NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
518245 | 2lfc | 17747 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 -16.589 9.298 -18.036 2 H2 MET 1 2H MET 1 -17.893 8.937 -19.040 3 H3 MET 1 3H MET 1 -17.170 7.720 -18.118 4 HA MET 1 HA MET 1 -17.856 8.753 -16.095 5 HB2 MET 1 2HB MET 1 -19.342 10.713 -16.111 6 HB3 MET 1 3HB MET 1 -17.808 11.083 -16.885 7 HG2 MET 1 2HG MET 1 -20.333 10.399 -18.403 8 HG3 MET 1 3HG MET 1 -19.810 12.039 -18.033 9 HE1 MET 1 3HE MET 1 -16.609 12.467 -20.216 10 HE2 MET 1 1HE MET 1 -16.672 12.062 -18.501 11 HE3 MET 1 2HE MET 1 -17.784 13.260 -19.167 12 H VAL 2 H VAL 2 -19.344 7.722 -19.041 13 HA VAL 2 HA VAL 2 -22.000 7.218 -18.008 14 HB VAL 2 HB VAL 2 -20.678 6.295 -20.607 15 HG11 VAL 2 1HG1 VAL 2 -22.944 5.936 -21.498 16 HG12 VAL 2 2HG1 VAL 2 -23.643 6.345 -19.930 17 HG13 VAL 2 3HG1 VAL 2 -22.647 4.898 -20.102 18 HG21 VAL 2 3HG2 VAL 2 -22.475 8.704 -20.109 19 HG22 VAL 2 1HG2 VAL 2 -21.840 8.196 -21.679 20 HG23 VAL 2 2HG2 VAL 2 -20.738 8.754 -20.420 21 H GLU 3 H GLU 3 -19.078 5.696 -17.564 22 HA GLU 3 HA GLU 3 -19.519 2.940 -17.599 23 HB2 GLU 3 2HB GLU 3 -17.789 4.523 -15.635 24 HB3 GLU 3 3HB GLU 3 -17.692 2.790 -15.913 25 HG2 GLU 3 2HG GLU 3 -15.887 3.627 -17.131 26 HG3 GLU 3 3HG GLU 3 -17.122 3.378 -18.360 27 HA PRO 4 HA PRO 4 -22.418 2.087 -14.285 28 HB2 PRO 4 2HB PRO 4 -21.066 -0.507 -13.733 29 HB3 PRO 4 3HB PRO 4 -22.663 -0.204 -14.442 30 HG2 PRO 4 2HG PRO 4 -20.617 -1.178 -15.896 31 HG3 PRO 4 3HG PRO 4 -21.850 -0.106 -16.600 32 HD2 PRO 4 2HD PRO 4 -19.059 0.592 -15.678 33 HD3 PRO 4 3HD PRO 4 -19.924 1.105 -17.140 34 H GLY 5 H GLY 5 -20.998 3.862 -13.117 35 HA2 GLY 5 2HA GLY 5 -20.220 4.719 -11.169 36 HA3 GLY 5 3HA GLY 5 -21.091 3.398 -10.414 37 H VAL 6 H VAL 6 -18.072 3.555 -12.379 38 HA VAL 6 HA VAL 6 -16.767 1.517 -10.902 39 HB VAL 6 HB VAL 6 -15.492 3.576 -12.760 40 HG11 VAL 6 1HG1 VAL 6 -13.796 2.477 -11.341 41 HG12 VAL 6 2HG1 VAL 6 -13.638 1.954 -13.018 42 HG13 VAL 6 3HG1 VAL 6 -14.394 0.889 -11.829 43 HG21 VAL 6 3HG2 VAL 6 -17.286 2.290 -13.878 44 HG22 VAL 6 1HG2 VAL 6 -16.517 0.776 -13.393 45 HG23 VAL 6 2HG2 VAL 6 -15.703 1.858 -14.529 46 H ALA 7 H ALA 7 -16.855 2.046 -8.732 47 HA ALA 7 HA ALA 7 -15.268 4.318 -7.711 48 HB1 ALA 7 3HB ALA 7 -17.596 4.147 -6.891 49 HB2 ALA 7 1HB ALA 7 -16.433 3.950 -5.580 50 HB3 ALA 7 2HB ALA 7 -17.254 2.540 -6.252 51 H LYS 8 H LYS 8 -13.281 3.386 -8.144 52 HA LYS 8 HA LYS 8 -12.127 1.707 -6.111 53 HB2 LYS 8 2HB LYS 8 -13.011 -0.089 -7.560 54 HB3 LYS 8 3HB LYS 8 -12.321 0.665 -8.992 55 HG2 LYS 8 2HG LYS 8 -10.040 0.197 -8.134 56 HG3 LYS 8 3HG LYS 8 -10.732 -0.570 -6.700 57 HD2 LYS 8 2HD LYS 8 -11.700 -2.353 -8.041 58 HD3 LYS 8 3HD LYS 8 -11.273 -1.529 -9.543 59 HE2 LYS 8 2HE LYS 8 -9.747 -3.403 -9.096 60 HE3 LYS 8 3HE LYS 8 -8.879 -1.870 -9.060 61 HZ1 LYS 8 3HZ LYS 8 -8.908 -1.940 -6.658 62 HZ2 LYS 8 1HZ LYS 8 -8.221 -3.355 -7.272 63 HZ3 LYS 8 2HZ LYS 8 -9.798 -3.380 -6.672 64 H LEU 9 H LEU 9 -9.848 2.073 -6.053 65 HA LEU 9 HA LEU 9 -8.776 4.251 -7.544 66 HB2 LEU 9 2HB LEU 9 -7.961 3.499 -5.244 67 HB3 LEU 9 3HB LEU 9 -7.178 2.140 -6.038 68 HG LEU 9 HG LEU 9 -5.852 3.834 -7.426 69 HD11 LEU 9 1HD1 LEU 9 -7.338 5.756 -7.165 70 HD12 LEU 9 2HD1 LEU 9 -5.711 6.141 -6.617 71 HD13 LEU 9 3HD1 LEU 9 -6.984 5.823 -5.436 72 HD21 LEU 9 3HD2 LEU 9 -4.840 2.695 -5.491 73 HD22 LEU 9 1HD2 LEU 9 -5.419 3.982 -4.429 74 HD23 LEU 9 2HD2 LEU 9 -4.221 4.335 -5.681 75 H THR 10 H THR 10 -8.080 4.199 -9.555 76 HA THR 10 HA THR 10 -8.172 1.800 -11.137 77 HB THR 10 HB THR 10 -7.567 3.628 -12.982 78 HG1 THR 10 HG1 THR 10 -8.692 5.439 -11.166 79 HG21 THR 10 3HG2 THR 10 -9.821 2.609 -12.757 80 HG22 THR 10 1HG2 THR 10 -9.924 4.337 -13.104 81 HG23 THR 10 2HG2 THR 10 -10.206 3.750 -11.464 82 H THR 11 H THR 11 -6.478 1.798 -13.043 83 HA THR 11 HA THR 11 -4.339 0.412 -11.932 84 HB THR 11 HB THR 11 -3.479 0.319 -14.347 85 HG1 THR 11 HG1 THR 11 -5.121 1.144 -15.877 86 HG21 THR 11 3HG2 THR 11 -5.027 -1.398 -13.454 87 HG22 THR 11 1HG2 THR 11 -5.355 -1.070 -15.155 88 HG23 THR 11 2HG2 THR 11 -6.410 -0.397 -13.908 89 H TYR 12 H TYR 12 -4.180 3.525 -13.742 90 HA TYR 12 HA TYR 12 -1.439 3.890 -13.754 91 HB2 TYR 12 2HB TYR 12 -1.901 6.320 -14.116 92 HB3 TYR 12 3HB TYR 12 -2.899 5.273 -15.115 93 HD1 TYR 12 HD2 TYR 12 -2.944 7.629 -12.239 94 HD2 TYR 12 HD1 TYR 12 -5.335 5.185 -14.807 95 HE1 TYR 12 HE2 TYR 12 -4.966 8.762 -11.436 96 HE2 TYR 12 HE1 TYR 12 -7.348 6.332 -13.996 97 HH TYR 12 HH TYR 12 -8.071 7.620 -12.003 98 H ALA 13 H ALA 13 -3.675 4.679 -11.156 99 HA ALA 13 HA ALA 13 -1.918 6.313 -9.610 100 HB1 ALA 13 3HB ALA 13 -4.462 4.860 -8.829 101 HB2 ALA 13 1HB ALA 13 -4.359 6.494 -9.479 102 HB3 ALA 13 2HB ALA 13 -3.679 6.130 -7.889 103 H SER 14 H SER 14 -2.767 2.870 -9.584 104 HA SER 14 HA SER 14 -1.235 2.233 -7.215 105 HB2 SER 14 2HB SER 14 -1.860 -0.130 -7.756 106 HB3 SER 14 3HB SER 14 -3.258 0.943 -7.724 107 HG SER 14 HG SER 14 -3.355 0.881 -9.921 108 H LYS 15 H LYS 15 -0.631 2.412 -10.631 109 HA LYS 15 HA LYS 15 1.771 0.841 -10.746 110 HB2 LYS 15 2HB LYS 15 0.738 3.044 -12.594 111 HB3 LYS 15 3HB LYS 15 2.133 2.033 -12.949 112 HG2 LYS 15 2HG LYS 15 -0.675 0.962 -12.554 113 HG3 LYS 15 3HG LYS 15 0.012 1.374 -14.123 114 HD2 LYS 15 2HD LYS 15 1.769 -0.336 -13.807 115 HD3 LYS 15 3HD LYS 15 1.098 -0.736 -12.225 116 HE2 LYS 15 2HE LYS 15 -0.974 -1.518 -13.261 117 HE3 LYS 15 3HE LYS 15 -0.397 -1.023 -14.855 118 HZ1 LYS 15 3HZ LYS 15 -0.137 -3.402 -14.465 119 HZ2 LYS 15 1HZ LYS 15 0.880 -3.096 -13.154 120 HZ3 LYS 15 2HZ LYS 15 1.354 -2.656 -14.712 121 H GLN 16 H GLN 16 1.133 4.360 -10.727 122 HA GLN 16 HA GLN 16 3.800 5.247 -10.452 123 HB2 GLN 16 2HB GLN 16 1.188 6.624 -9.699 124 HB3 GLN 16 3HB GLN 16 2.750 7.433 -9.748 125 HG2 GLN 16 2HG GLN 16 1.400 6.134 -12.134 126 HG3 GLN 16 3HG GLN 16 1.348 7.852 -11.758 127 HE21 GLN 16 1HE2 GLN 16 3.298 5.249 -12.976 128 HE22 GLN 16 2HE2 GLN 16 4.594 6.224 -13.568 129 H ALA 17 H ALA 17 1.526 4.025 -8.132 130 HA ALA 17 HA ALA 17 2.734 5.008 -5.755 131 HB1 ALA 17 3HB ALA 17 0.415 4.220 -5.807 132 HB2 ALA 17 1HB ALA 17 1.354 3.349 -4.595 133 HB3 ALA 17 2HB ALA 17 0.966 2.574 -6.136 134 H THR 18 H THR 18 2.904 1.783 -7.338 135 HA THR 18 HA THR 18 4.952 0.752 -5.624 136 HB THR 18 HB THR 18 5.135 -1.064 -7.390 137 HG1 THR 18 HG1 THR 18 2.881 0.028 -8.668 138 HG21 THR 18 3HG2 THR 18 3.501 -1.269 -5.534 139 HG22 THR 18 1HG2 THR 18 2.878 -1.982 -7.025 140 HG23 THR 18 2HG2 THR 18 2.302 -0.399 -6.497 141 H ASP 19 H ASP 19 4.950 2.675 -8.483 142 HA ASP 19 HA ASP 19 7.643 2.470 -9.347 143 HB2 ASP 19 2HB ASP 19 5.863 3.477 -10.731 144 HB3 ASP 19 3HB ASP 19 5.615 4.744 -9.541 145 H MET 20 H MET 20 5.958 4.475 -6.976 146 HA MET 20 HA MET 20 8.175 6.059 -6.140 147 HB2 MET 20 2HB MET 20 5.613 6.440 -5.747 148 HB3 MET 20 3HB MET 20 5.787 5.358 -4.377 149 HG2 MET 20 2HG MET 20 5.975 7.506 -3.444 150 HG3 MET 20 3HG MET 20 7.653 6.979 -3.592 151 HE1 MET 20 3HE MET 20 5.331 8.069 -6.563 152 HE2 MET 20 1HE MET 20 5.632 9.807 -6.634 153 HE3 MET 20 2HE MET 20 4.783 9.115 -5.252 154 H GLY 21 H GLY 21 6.741 2.995 -5.034 155 HA2 GLY 21 2HA GLY 21 8.480 1.358 -4.146 156 HA3 GLY 21 3HA GLY 21 8.878 2.624 -2.990 157 H ALA 22 H ALA 22 5.544 2.220 -3.898 158 HA ALA 22 HA ALA 22 4.772 1.407 -1.225 159 HB1 ALA 22 3HB ALA 22 2.467 1.688 -2.026 160 HB2 ALA 22 1HB ALA 22 3.052 1.883 -3.683 161 HB3 ALA 22 2HB ALA 22 3.451 3.088 -2.458 162 H ILE 23 H ILE 23 3.428 -0.460 -0.771 163 HA ILE 23 HA ILE 23 3.989 -2.811 -2.511 164 HB ILE 23 HB ILE 23 4.152 -4.194 -0.455 165 HG12 ILE 23 2HG1 ILE 23 3.836 -1.553 1.068 166 HG13 ILE 23 3HG1 ILE 23 2.656 -2.856 1.023 167 HG21 ILE 23 1HG2 ILE 23 6.052 -1.814 -0.364 168 HG22 ILE 23 2HG2 ILE 23 6.244 -3.253 -1.368 169 HG23 ILE 23 3HG2 ILE 23 6.335 -3.387 0.388 170 HD11 ILE 23 3HD1 ILE 23 4.251 -4.309 2.203 171 HD12 ILE 23 1HD1 ILE 23 3.834 -2.856 3.111 172 HD13 ILE 23 2HD1 ILE 23 5.389 -2.959 2.287 173 H TYR 24 H TYR 24 2.412 -4.524 -2.450 174 HA TYR 24 HA TYR 24 -0.288 -3.798 -1.467 175 HB2 TYR 24 2HB TYR 24 0.496 -6.075 -3.347 176 HB3 TYR 24 3HB TYR 24 -1.138 -5.597 -2.906 177 HD1 TYR 24 HD1 TYR 24 -2.023 -3.341 -3.717 178 HD2 TYR 24 HD2 TYR 24 1.610 -5.045 -5.193 179 HE1 TYR 24 HE1 TYR 24 -2.142 -1.898 -5.713 180 HE2 TYR 24 HE2 TYR 24 1.494 -3.602 -7.171 181 HH TYR 24 HH TYR 24 -0.477 -0.953 -7.408 182 H VAL 25 H VAL 25 -0.872 -4.727 0.412 183 HA VAL 25 HA VAL 25 0.283 -7.345 1.213 184 HB VAL 25 HB VAL 25 -0.167 -6.768 3.550 185 HG11 VAL 25 1HG1 VAL 25 1.408 -4.558 2.173 186 HG12 VAL 25 2HG1 VAL 25 2.025 -6.134 2.677 187 HG13 VAL 25 3HG1 VAL 25 1.500 -4.969 3.892 188 HG21 VAL 25 3HG2 VAL 25 -2.162 -5.366 3.312 189 HG22 VAL 25 1HG2 VAL 25 -1.208 -4.083 2.563 190 HG23 VAL 25 2HG2 VAL 25 -0.939 -4.515 4.256 191 H ASN 26 H ASN 26 -1.297 -8.656 2.616 192 HA ASN 26 HA ASN 26 -4.020 -8.582 1.474 193 HB2 ASN 26 2HB ASN 26 -4.328 -10.798 2.520 194 HB3 ASN 26 3HB ASN 26 -2.882 -10.781 1.522 195 HD21 ASN 26 1HD2 ASN 26 -3.661 -12.536 3.739 196 HD22 ASN 26 2HD2 ASN 26 -2.349 -12.451 4.863 197 H SER 27 H SER 27 -5.610 -9.523 3.454 198 HA SER 27 HA SER 27 -6.046 -7.202 5.081 199 HB2 SER 27 2HB SER 27 -7.929 -8.550 4.129 200 HB3 SER 27 3HB SER 27 -7.498 -9.878 5.205 201 HG SER 27 HG SER 27 -7.739 -7.641 6.651 202 H LYS 28 H LYS 28 -4.282 -10.160 5.578 203 HA LYS 28 HA LYS 28 -4.087 -9.886 8.446 204 HB2 LYS 28 2HB LYS 28 -2.156 -11.263 6.528 205 HB3 LYS 28 3HB LYS 28 -2.133 -11.399 8.286 206 HG2 LYS 28 2HG LYS 28 -4.361 -12.353 6.472 207 HG3 LYS 28 3HG LYS 28 -3.125 -13.374 7.210 208 HD2 LYS 28 2HD LYS 28 -3.981 -12.702 9.469 209 HD3 LYS 28 3HD LYS 28 -5.263 -11.777 8.679 210 HE2 LYS 28 2HE LYS 28 -6.132 -13.851 7.655 211 HE3 LYS 28 3HE LYS 28 -4.838 -14.778 8.424 212 HZ1 LYS 28 3HZ LYS 28 -6.780 -14.991 9.742 213 HZ2 LYS 28 1HZ LYS 28 -7.044 -13.321 9.763 214 HZ3 LYS 28 2HZ LYS 28 -5.727 -13.978 10.588 215 H GLY 29 H GLY 29 -1.769 -9.213 5.780 216 HA2 GLY 29 2HA GLY 29 -1.017 -6.734 5.983 217 HA3 GLY 29 3HA GLY 29 -0.340 -7.284 7.513 218 H ASP 30 H ASP 30 -0.033 -9.883 5.509 219 HA ASP 30 HA ASP 30 2.790 -9.454 5.039 220 HB2 ASP 30 2HB ASP 30 1.919 -11.700 5.671 221 HB3 ASP 30 3HB ASP 30 0.978 -11.772 4.191 222 H ARG 31 H ARG 31 3.804 -9.196 3.054 223 HA ARG 31 HA ARG 31 2.290 -7.759 1.099 224 HB2 ARG 31 2HB ARG 31 4.340 -7.147 0.058 225 HB3 ARG 31 3HB ARG 31 4.633 -7.116 1.782 226 HG2 ARG 31 2HG ARG 31 5.651 -9.144 -0.228 227 HG3 ARG 31 3HG ARG 31 6.592 -7.944 0.649 228 HD2 ARG 31 2HD ARG 31 5.266 -10.424 1.784 229 HD3 ARG 31 3HD ARG 31 6.995 -10.140 1.592 230 HE ARG 31 HE ARG 31 5.466 -8.379 3.385 231 HH11 ARG 31 1HH1 ARG 31 7.831 -10.968 3.060 232 HH12 ARG 31 2HH1 ARG 31 8.359 -10.841 4.709 233 HH21 ARG 31 1HH2 ARG 31 6.085 -8.350 5.570 234 HH22 ARG 31 2HH2 ARG 31 7.378 -9.363 6.126 235 H ILE 32 H ILE 32 1.054 -8.695 -0.339 236 HA ILE 32 HA ILE 32 1.316 -11.436 -1.172 237 HB ILE 32 HB ILE 32 -0.691 -11.035 -2.562 238 HG12 ILE 32 2HG1 ILE 32 -0.630 -8.124 -1.626 239 HG13 ILE 32 3HG1 ILE 32 -0.112 -8.637 -3.226 240 HG21 ILE 32 1HG2 ILE 32 -0.941 -9.855 0.227 241 HG22 ILE 32 2HG2 ILE 32 -0.982 -11.570 -0.188 242 HG23 ILE 32 3HG2 ILE 32 -2.268 -10.500 -0.746 243 HD11 ILE 32 3HD1 ILE 32 -2.381 -9.463 -3.679 244 HD12 ILE 32 1HD1 ILE 32 -2.335 -7.740 -3.304 245 HD13 ILE 32 2HD1 ILE 32 -2.889 -8.889 -2.087 246 H VAL 33 H VAL 33 1.947 -8.301 -2.628 247 HA VAL 33 HA VAL 33 3.930 -9.369 -4.366 248 HB VAL 33 HB VAL 33 1.922 -9.843 -5.763 249 HG11 VAL 33 1HG1 VAL 33 0.584 -8.063 -6.784 250 HG12 VAL 33 2HG1 VAL 33 1.450 -6.849 -5.838 251 HG13 VAL 33 3HG1 VAL 33 0.434 -8.040 -5.024 252 HG21 VAL 33 3HG2 VAL 33 2.743 -8.819 -7.866 253 HG22 VAL 33 1HG2 VAL 33 4.062 -9.451 -6.875 254 HG23 VAL 33 2HG2 VAL 33 3.753 -7.712 -6.930 255 H ASN 34 H ASN 34 5.391 -7.816 -4.888 256 HA ASN 34 HA ASN 34 5.302 -5.406 -3.261 257 HB2 ASN 34 2HB ASN 34 7.688 -5.207 -3.841 258 HB3 ASN 34 3HB ASN 34 7.317 -6.824 -3.260 259 HD21 ASN 34 1HD2 ASN 34 9.545 -5.880 -4.900 260 HD22 ASN 34 2HD2 ASN 34 9.514 -6.838 -6.341 261 H GLU 35 H GLU 35 5.143 -6.297 -6.619 262 HA GLU 35 HA GLU 35 5.305 -3.476 -7.506 263 HB2 GLU 35 2HB GLU 35 7.400 -4.714 -8.014 264 HB3 GLU 35 3HB GLU 35 6.485 -5.954 -8.858 265 HG2 GLU 35 2HG GLU 35 7.648 -4.359 -10.382 266 HG3 GLU 35 3HG GLU 35 5.902 -4.422 -10.630 267 H SER 36 H SER 36 3.922 -2.871 -9.098 268 HA SER 36 HA SER 36 1.640 -4.557 -9.752 269 HB2 SER 36 2HB SER 36 0.796 -2.472 -10.859 270 HB3 SER 36 3HB SER 36 1.273 -2.184 -9.186 271 HG SER 36 HG SER 36 3.381 -1.525 -10.184 272 H ASN 37 H ASN 37 3.468 -5.987 -10.746 273 HA ASN 37 HA ASN 37 4.639 -5.457 -13.257 274 HB2 ASN 37 2HB ASN 37 3.730 -8.185 -12.204 275 HB3 ASN 37 3HB ASN 37 4.942 -7.901 -13.452 276 HD21 ASN 37 1HD2 ASN 37 6.987 -7.055 -12.820 277 HD22 ASN 37 2HD2 ASN 37 7.543 -7.197 -11.189 278 H VAL 38 H VAL 38 1.776 -7.341 -12.444 279 HA VAL 38 HA VAL 38 0.196 -6.381 -14.625 280 HB VAL 38 HB VAL 38 1.516 -8.003 -15.902 281 HG11 VAL 38 1HG1 VAL 38 2.315 -9.462 -14.111 282 HG12 VAL 38 2HG1 VAL 38 1.587 -10.417 -15.404 283 HG13 VAL 38 3HG1 VAL 38 0.695 -10.140 -13.905 284 HG21 VAL 38 3HG2 VAL 38 -0.855 -7.802 -16.520 285 HG22 VAL 38 1HG2 VAL 38 -1.275 -9.111 -15.410 286 HG23 VAL 38 2HG2 VAL 38 -0.271 -9.438 -16.827 287 H TYR 39 H TYR 39 -1.996 -6.931 -14.340 288 HA TYR 39 HA TYR 39 -2.922 -7.156 -11.701 289 HB2 TYR 39 2HB TYR 39 -5.193 -7.210 -12.676 290 HB3 TYR 39 3HB TYR 39 -4.201 -6.012 -13.500 291 HD1 TYR 39 HD2 TYR 39 -3.164 -6.657 -15.798 292 HD2 TYR 39 HD1 TYR 39 -6.290 -8.952 -13.979 293 HE1 TYR 39 HE2 TYR 39 -3.667 -7.701 -17.961 294 HE2 TYR 39 HE1 TYR 39 -6.772 -9.992 -16.156 295 HH TYR 39 HH TYR 39 -4.693 -9.717 -18.829 296 H THR 40 H THR 40 -2.180 -9.662 -14.030 297 HA THR 40 HA THR 40 -3.860 -11.720 -12.994 298 HB THR 40 HB THR 40 -2.378 -13.285 -14.291 299 HG1 THR 40 HG1 THR 40 -0.606 -12.448 -15.385 300 HG21 THR 40 3HG2 THR 40 -2.828 -12.353 -16.546 301 HG22 THR 40 1HG2 THR 40 -3.148 -10.770 -15.833 302 HG23 THR 40 2HG2 THR 40 -4.222 -12.127 -15.485 303 H THR 41 H THR 41 -0.331 -11.078 -12.590 304 HA THR 41 HA THR 41 0.255 -13.019 -10.655 305 HB THR 41 HB THR 41 1.556 -10.265 -10.945 306 HG1 THR 41 HG1 THR 41 3.029 -11.626 -12.298 307 HG21 THR 41 3HG2 THR 41 2.307 -11.480 -8.897 308 HG22 THR 41 1HG2 THR 41 3.601 -11.368 -10.101 309 HG23 THR 41 2HG2 THR 41 2.721 -12.879 -9.891 310 H PHE 42 H PHE 42 -0.837 -9.697 -10.319 311 HA PHE 42 HA PHE 42 -0.820 -9.390 -7.530 312 HB2 PHE 42 2HB PHE 42 -0.944 -7.441 -8.922 313 HB3 PHE 42 3HB PHE 42 -2.342 -8.047 -9.795 314 HD1 PHE 42 HD1 PHE 42 -1.366 -7.078 -6.280 315 HD2 PHE 42 HD2 PHE 42 -4.416 -7.099 -9.280 316 HE1 PHE 42 HE1 PHE 42 -2.830 -5.763 -4.810 317 HE2 PHE 42 HE2 PHE 42 -5.872 -5.781 -7.799 318 HZ PHE 42 HZ PHE 42 -5.079 -5.112 -5.569 319 H ARG 43 H ARG 43 -3.345 -10.606 -9.737 320 HA ARG 43 HA ARG 43 -5.423 -10.669 -7.740 321 HB2 ARG 43 2HB ARG 43 -5.759 -10.324 -10.260 322 HB3 ARG 43 3HB ARG 43 -5.479 -12.048 -10.462 323 HG2 ARG 43 2HG ARG 43 -7.471 -12.515 -9.029 324 HG3 ARG 43 3HG ARG 43 -7.729 -10.775 -8.855 325 HD2 ARG 43 2HD ARG 43 -7.956 -10.627 -11.356 326 HD3 ARG 43 3HD ARG 43 -7.876 -12.385 -11.426 327 HE ARG 43 HE ARG 43 -10.010 -10.870 -10.043 328 HH11 ARG 43 1HH1 ARG 43 -9.084 -13.627 -12.029 329 HH12 ARG 43 2HH1 ARG 43 -10.712 -14.216 -12.164 330 HH21 ARG 43 1HH2 ARG 43 -12.130 -11.574 -10.349 331 HH22 ARG 43 2HH2 ARG 43 -12.438 -13.052 -11.212 332 H ASN 44 H ASN 44 -3.239 -13.073 -9.220 333 HA ASN 44 HA ASN 44 -4.293 -15.351 -7.843 334 HB2 ASN 44 2HB ASN 44 -1.599 -14.884 -9.201 335 HB3 ASN 44 3HB ASN 44 -1.954 -16.376 -8.345 336 HD21 ASN 44 1HD2 ASN 44 -2.368 -14.657 -11.269 337 HD22 ASN 44 2HD2 ASN 44 -3.371 -15.811 -12.068 338 H ALA 45 H ALA 45 -1.906 -12.889 -7.047 339 HA ALA 45 HA ALA 45 -0.798 -14.041 -4.708 340 HB1 ALA 45 3HB ALA 45 -1.146 -11.098 -5.398 341 HB2 ALA 45 1HB ALA 45 0.202 -12.120 -5.902 342 HB3 ALA 45 2HB ALA 45 -0.040 -11.762 -4.192 343 H ILE 46 H ILE 46 -3.642 -12.011 -5.252 344 HA ILE 46 HA ILE 46 -4.625 -11.810 -2.599 345 HB ILE 46 HB ILE 46 -6.021 -11.719 -5.316 346 HG12 ILE 46 2HG1 ILE 46 -5.252 -9.453 -3.417 347 HG13 ILE 46 3HG1 ILE 46 -4.388 -9.881 -4.890 348 HG21 ILE 46 1HG2 ILE 46 -7.242 -10.979 -2.642 349 HG22 ILE 46 2HG2 ILE 46 -7.696 -12.357 -3.645 350 HG23 ILE 46 3HG2 ILE 46 -7.987 -10.715 -4.222 351 HD11 ILE 46 3HD1 ILE 46 -5.774 -7.950 -5.255 352 HD12 ILE 46 1HD1 ILE 46 -7.207 -8.826 -4.718 353 HD13 ILE 46 2HD1 ILE 46 -6.384 -9.303 -6.206 354 H LEU 47 H LEU 47 -5.207 -14.146 -5.230 355 HA LEU 47 HA LEU 47 -7.187 -15.692 -3.838 356 HB2 LEU 47 2HB LEU 47 -5.674 -16.268 -6.412 357 HB3 LEU 47 3HB LEU 47 -7.004 -17.244 -5.810 358 HG LEU 47 HG LEU 47 -7.194 -14.345 -6.719 359 HD11 LEU 47 1HD1 LEU 47 -6.891 -15.886 -8.589 360 HD12 LEU 47 2HD1 LEU 47 -8.522 -15.222 -8.589 361 HD13 LEU 47 3HD1 LEU 47 -8.246 -16.874 -8.029 362 HD21 LEU 47 3HD2 LEU 47 -9.387 -16.173 -5.670 363 HD22 LEU 47 1HD2 LEU 47 -9.643 -14.597 -6.427 364 HD23 LEU 47 2HD2 LEU 47 -8.771 -14.707 -4.900 365 H LYS 48 H LYS 48 -3.770 -15.720 -3.742 366 HA LYS 48 HA LYS 48 -3.219 -18.494 -3.416 367 HB2 LYS 48 2HB LYS 48 -1.478 -16.747 -3.956 368 HB3 LYS 48 3HB LYS 48 -1.648 -16.110 -2.324 369 HG2 LYS 48 2HG LYS 48 -0.958 -18.471 -1.506 370 HG3 LYS 48 3HG LYS 48 -0.495 -18.783 -3.179 371 HD2 LYS 48 2HD LYS 48 1.466 -18.119 -1.884 372 HD3 LYS 48 3HD LYS 48 1.103 -16.875 -3.082 373 HE2 LYS 48 2HE LYS 48 0.200 -15.409 -1.414 374 HE3 LYS 48 3HE LYS 48 0.162 -16.692 -0.200 375 HZ1 LYS 48 3HZ LYS 48 2.534 -16.702 -0.121 376 HZ2 LYS 48 1HZ LYS 48 2.006 -15.114 0.084 377 HZ3 LYS 48 2HZ LYS 48 2.651 -15.605 -1.400 378 H GLN 49 H GLN 49 -4.091 -15.900 -1.196 379 HA GLN 49 HA GLN 49 -3.876 -17.658 1.164 380 HB2 GLN 49 2HB GLN 49 -4.174 -14.621 0.979 381 HB3 GLN 49 3HB GLN 49 -3.989 -15.545 2.473 382 HG2 GLN 49 2HG GLN 49 -1.757 -16.294 1.752 383 HG3 GLN 49 3HG GLN 49 -1.943 -15.406 0.240 384 HE21 GLN 49 1HE2 GLN 49 -1.338 -15.136 3.655 385 HE22 GLN 49 2HE2 GLN 49 -0.851 -13.479 3.634 386 H ALA 50 H ALA 50 -5.617 -17.145 2.855 387 HA ALA 50 HA ALA 50 -8.137 -17.933 1.717 388 HB1 ALA 50 3HB ALA 50 -7.390 -17.388 4.616 389 HB2 ALA 50 1HB ALA 50 -7.296 -18.950 3.803 390 HB3 ALA 50 2HB ALA 50 -8.866 -18.186 4.065 391 H ASP 51 H ASP 51 -6.942 -15.121 3.541 392 HA ASP 51 HA ASP 51 -9.420 -13.640 3.312 393 HB2 ASP 51 2HB ASP 51 -8.187 -11.838 4.516 394 HB3 ASP 51 3HB ASP 51 -8.127 -13.378 5.356 395 H LYS 52 H LYS 52 -9.789 -13.439 1.160 396 HA LYS 52 HA LYS 52 -7.737 -12.595 -0.706 397 HB2 LYS 52 2HB LYS 52 -10.599 -13.487 -1.111 398 HB3 LYS 52 3HB LYS 52 -9.502 -13.056 -2.424 399 HG2 LYS 52 2HG LYS 52 -7.992 -14.866 -1.833 400 HG3 LYS 52 3HG LYS 52 -8.974 -15.269 -0.417 401 HD2 LYS 52 2HD LYS 52 -10.855 -15.857 -1.889 402 HD3 LYS 52 3HD LYS 52 -9.901 -15.430 -3.306 403 HE2 LYS 52 2HE LYS 52 -8.339 -17.240 -2.861 404 HE3 LYS 52 3HE LYS 52 -9.158 -17.624 -1.346 405 HZ1 LYS 52 3HZ LYS 52 -10.392 -17.808 -4.039 406 HZ2 LYS 52 1HZ LYS 52 -11.112 -18.251 -2.576 407 HZ3 LYS 52 2HZ LYS 52 -9.785 -19.115 -3.158 408 H VAL 53 H VAL 53 -7.615 -10.451 0.366 409 HA VAL 53 HA VAL 53 -8.653 -8.626 -1.599 410 HB VAL 53 HB VAL 53 -10.456 -8.280 -0.017 411 HG11 VAL 53 1HG1 VAL 53 -10.152 -7.610 2.326 412 HG12 VAL 53 2HG1 VAL 53 -8.402 -7.807 2.170 413 HG13 VAL 53 3HG1 VAL 53 -9.466 -9.209 2.021 414 HG21 VAL 53 3HG2 VAL 53 -10.242 -5.882 0.519 415 HG22 VAL 53 1HG2 VAL 53 -9.596 -6.228 -1.087 416 HG23 VAL 53 2HG2 VAL 53 -8.496 -5.966 0.269 417 H ALA 54 H ALA 54 -7.307 -6.828 -1.846 418 HA ALA 54 HA ALA 54 -4.653 -7.047 -0.571 419 HB1 ALA 54 3HB ALA 54 -4.690 -7.307 -3.020 420 HB2 ALA 54 1HB ALA 54 -3.827 -5.839 -2.557 421 HB3 ALA 54 2HB ALA 54 -5.476 -5.738 -3.187 422 H TYR 55 H TYR 55 -3.556 -5.075 -0.112 423 HA TYR 55 HA TYR 55 -5.095 -2.607 0.230 424 HB2 TYR 55 2HB TYR 55 -3.673 -4.103 2.485 425 HB3 TYR 55 3HB TYR 55 -4.109 -2.403 2.587 426 HD1 TYR 55 HD2 TYR 55 -5.453 -5.859 2.577 427 HD2 TYR 55 HD1 TYR 55 -6.452 -1.712 2.885 428 HE1 TYR 55 HE2 TYR 55 -7.692 -6.452 3.392 429 HE2 TYR 55 HE1 TYR 55 -8.686 -2.320 3.703 430 HH TYR 55 HH TYR 55 -10.227 -4.221 3.560 431 H LEU 56 H LEU 56 -3.896 -1.490 -1.169 432 HA LEU 56 HA LEU 56 -1.055 -1.591 -1.451 433 HB2 LEU 56 2HB LEU 56 -2.494 -0.965 -3.326 434 HB3 LEU 56 3HB LEU 56 -3.164 0.384 -2.425 435 HG LEU 56 HG LEU 56 -0.968 1.553 -2.536 436 HD11 LEU 56 1HD1 LEU 56 -0.024 -0.777 -4.237 437 HD12 LEU 56 2HD1 LEU 56 0.572 -0.342 -2.635 438 HD13 LEU 56 3HD1 LEU 56 0.844 0.742 -3.996 439 HD21 LEU 56 3HD2 LEU 56 -1.043 2.107 -4.933 440 HD22 LEU 56 1HD2 LEU 56 -2.661 1.999 -4.243 441 HD23 LEU 56 2HD2 LEU 56 -2.037 0.682 -5.241 442 H VAL 57 H VAL 57 -0.019 -1.161 0.424 443 HA VAL 57 HA VAL 57 -0.619 1.162 2.089 444 HB VAL 57 HB VAL 57 1.580 -0.955 2.373 445 HG11 VAL 57 1HG1 VAL 57 1.854 -0.121 4.692 446 HG12 VAL 57 2HG1 VAL 57 0.675 1.154 4.378 447 HG13 VAL 57 3HG1 VAL 57 2.212 1.144 3.511 448 HG21 VAL 57 3HG2 VAL 57 0.158 -1.930 4.150 449 HG22 VAL 57 1HG2 VAL 57 -0.666 -1.936 2.587 450 HG23 VAL 57 2HG2 VAL 57 -1.094 -0.734 3.806 451 H MET 58 H MET 58 0.254 3.063 1.658 452 HA MET 58 HA MET 58 2.895 3.344 0.378 453 HB2 MET 58 2HB MET 58 2.073 5.055 -1.132 454 HB3 MET 58 3HB MET 58 1.028 3.660 -1.330 455 HG2 MET 58 2HG MET 58 -0.697 4.753 0.050 456 HG3 MET 58 3HG MET 58 0.360 6.144 0.273 457 HE1 MET 58 3HE MET 58 -1.689 5.015 -3.724 458 HE2 MET 58 1HE MET 58 -1.995 4.192 -2.195 459 HE3 MET 58 2HE MET 58 -0.447 3.985 -3.017 460 H ASP 59 H ASP 59 3.683 5.625 0.648 461 HA ASP 59 HA ASP 59 2.966 6.795 3.257 462 HB2 ASP 59 2HB ASP 59 5.022 8.199 2.856 463 HB3 ASP 59 3HB ASP 59 5.330 6.472 2.907 464 H GLU 60 H GLU 60 3.178 9.388 3.116 465 HA GLU 60 HA GLU 60 0.888 10.161 1.569 466 HB2 GLU 60 2HB GLU 60 1.204 10.980 3.877 467 HB3 GLU 60 3HB GLU 60 2.622 11.895 3.372 468 HG2 GLU 60 2HG GLU 60 1.318 13.409 2.074 469 HG3 GLU 60 3HG GLU 60 -0.089 12.350 2.100 470 H ARG 61 H ARG 61 4.363 10.530 1.127 471 HA ARG 61 HA ARG 61 4.269 12.678 -0.779 472 HB2 ARG 61 2HB ARG 61 6.411 10.515 -0.597 473 HB3 ARG 61 3HB ARG 61 6.576 12.106 -1.336 474 HG2 ARG 61 2HG ARG 61 6.254 11.495 1.613 475 HG3 ARG 61 3HG ARG 61 7.711 12.077 0.807 476 HD2 ARG 61 2HD ARG 61 6.547 14.192 0.259 477 HD3 ARG 61 3HD ARG 61 5.099 13.605 1.085 478 HE ARG 61 HE ARG 61 6.839 13.415 3.056 479 HH11 ARG 61 1HH1 ARG 61 6.401 16.067 0.778 480 HH12 ARG 61 2HH1 ARG 61 6.948 17.269 1.906 481 HH21 ARG 61 1HH2 ARG 61 7.548 14.971 4.498 482 HH22 ARG 61 2HH2 ARG 61 7.602 16.643 4.027 483 H THR 62 H THR 62 3.971 9.189 -0.965 484 HA THR 62 HA THR 62 3.804 8.864 -3.775 485 HB THR 62 HB THR 62 2.429 7.220 -1.600 486 HG1 THR 62 HG1 THR 62 4.790 7.456 -1.462 487 HG21 THR 62 3HG2 THR 62 2.501 5.372 -3.234 488 HG22 THR 62 1HG2 THR 62 3.193 6.457 -4.442 489 HG23 THR 62 2HG2 THR 62 1.547 6.721 -3.857 490 H TRP 63 H TRP 63 1.390 9.491 -1.253 491 HA TRP 63 HA TRP 63 -0.933 9.332 -2.826 492 HB2 TRP 63 2HB TRP 63 -1.032 9.168 -0.388 493 HB3 TRP 63 3HB TRP 63 -0.443 10.818 -0.210 494 HD1 TRP 63 HD1 TRP 63 -2.282 12.685 -0.083 495 HE1 TRP 63 HE1 TRP 63 -4.832 12.739 -0.387 496 HE3 TRP 63 HE3 TRP 63 -3.005 7.945 -1.919 497 HZ2 TRP 63 HZ2 TRP 63 -6.865 11.032 -1.286 498 HZ3 TRP 63 HZ3 TRP 63 -5.298 7.245 -2.484 499 HH2 TRP 63 HH2 TRP 63 -7.186 8.763 -2.173 500 H LYS 64 H LYS 64 1.266 12.057 -2.213 501 HA LYS 64 HA LYS 64 -0.318 14.182 -3.123 502 HB2 LYS 64 2HB LYS 64 2.700 13.863 -3.389 503 HB3 LYS 64 3HB LYS 64 1.822 15.382 -3.560 504 HG2 LYS 64 2HG LYS 64 2.158 13.724 -1.053 505 HG3 LYS 64 3HG LYS 64 2.804 15.334 -1.376 506 HD2 LYS 64 2HD LYS 64 0.368 16.131 -1.536 507 HD3 LYS 64 3HD LYS 64 -0.101 14.553 -0.906 508 HE2 LYS 64 2HE LYS 64 1.143 14.973 1.157 509 HE3 LYS 64 3HE LYS 64 1.736 16.507 0.507 510 HZ1 LYS 64 3HZ LYS 64 -0.135 16.840 1.993 511 HZ2 LYS 64 1HZ LYS 64 -1.106 15.847 1.035 512 HZ3 LYS 64 2HZ LYS 64 -0.537 17.315 0.427 513 H LYS 65 H LYS 65 1.383 11.717 -4.901 514 HA LYS 65 HA LYS 65 0.910 12.884 -7.520 515 HB2 LYS 65 2HB LYS 65 1.960 10.147 -6.681 516 HB3 LYS 65 3HB LYS 65 1.843 10.688 -8.353 517 HG2 LYS 65 2HG LYS 65 3.552 11.962 -6.192 518 HG3 LYS 65 3HG LYS 65 4.137 10.906 -7.476 519 HD2 LYS 65 2HD LYS 65 2.866 13.649 -7.872 520 HD3 LYS 65 3HD LYS 65 4.588 13.279 -7.979 521 HE2 LYS 65 2HE LYS 65 4.191 11.833 -9.914 522 HE3 LYS 65 3HE LYS 65 2.451 12.104 -9.787 523 HZ1 LYS 65 3HZ LYS 65 2.792 14.425 -10.273 524 HZ2 LYS 65 1HZ LYS 65 3.481 13.478 -11.491 525 HZ3 LYS 65 2HZ LYS 65 4.468 14.213 -10.335 526 H VAL 66 H VAL 66 -0.332 10.111 -5.629 527 HA VAL 66 HA VAL 66 -2.059 8.994 -7.529 528 HB VAL 66 HB VAL 66 -2.175 8.907 -4.474 529 HG11 VAL 66 1HG1 VAL 66 -3.581 6.871 -4.689 530 HG12 VAL 66 2HG1 VAL 66 -3.695 7.138 -6.429 531 HG13 VAL 66 3HG1 VAL 66 -4.399 8.306 -5.313 532 HG21 VAL 66 3HG2 VAL 66 -0.101 7.996 -5.438 533 HG22 VAL 66 1HG2 VAL 66 -1.031 6.931 -6.495 534 HG23 VAL 66 2HG2 VAL 66 -1.070 6.695 -4.744 535 H TYR 67 H TYR 67 -2.979 11.071 -4.775 536 HA TYR 67 HA TYR 67 -5.646 11.570 -5.263 537 HB2 TYR 67 2HB TYR 67 -4.496 12.238 -3.207 538 HB3 TYR 67 3HB TYR 67 -3.504 13.392 -4.079 539 HD1 TYR 67 HD1 TYR 67 -6.984 12.684 -2.953 540 HD2 TYR 67 HD2 TYR 67 -4.302 15.659 -4.436 541 HE1 TYR 67 HE1 TYR 67 -8.636 14.429 -2.436 542 HE2 TYR 67 HE2 TYR 67 -5.953 17.403 -3.917 543 HH TYR 67 HH TYR 67 -8.738 16.816 -2.014 544 H ASP 68 H ASP 68 -2.824 13.243 -6.598 545 HA ASP 68 HA ASP 68 -4.215 15.403 -7.830 546 HB2 ASP 68 2HB ASP 68 -1.805 15.543 -7.201 547 HB3 ASP 68 3HB ASP 68 -1.413 14.333 -8.418 548 H LEU 69 H LEU 69 -2.992 12.284 -8.962 549 HA LEU 69 HA LEU 69 -3.488 12.628 -11.742 550 HB2 LEU 69 2HB LEU 69 -3.085 10.145 -10.029 551 HB3 LEU 69 3HB LEU 69 -3.297 10.062 -11.771 552 HG LEU 69 HG LEU 69 -1.014 11.499 -10.357 553 HD11 LEU 69 1HD1 LEU 69 0.414 9.692 -11.193 554 HD12 LEU 69 2HD1 LEU 69 -0.994 8.861 -11.859 555 HD13 LEU 69 3HD1 LEU 69 -0.834 9.072 -10.113 556 HD21 LEU 69 3HD2 LEU 69 -1.570 12.592 -12.480 557 HD22 LEU 69 1HD2 LEU 69 -1.488 11.046 -13.329 558 HD23 LEU 69 2HD2 LEU 69 -0.034 11.743 -12.612 559 H LEU 70 H LEU 70 -5.419 11.393 -9.060 560 HA LEU 70 HA LEU 70 -7.576 10.311 -10.508 561 HB2 LEU 70 2HB LEU 70 -7.515 11.586 -7.741 562 HB3 LEU 70 3HB LEU 70 -8.901 10.717 -8.383 563 HG LEU 70 HG LEU 70 -6.156 9.504 -7.867 564 HD11 LEU 70 1HD1 LEU 70 -7.317 10.029 -5.780 565 HD12 LEU 70 2HD1 LEU 70 -7.212 8.288 -6.026 566 HD13 LEU 70 3HD1 LEU 70 -8.737 9.129 -6.322 567 HD21 LEU 70 3HD2 LEU 70 -7.209 7.333 -8.379 568 HD22 LEU 70 1HD2 LEU 70 -7.252 8.412 -9.771 569 HD23 LEU 70 2HD2 LEU 70 -8.711 8.150 -8.812 570 H ILE 71 H ILE 71 -7.287 13.560 -9.011 571 HA ILE 71 HA ILE 71 -9.661 14.638 -10.139 572 HB ILE 71 HB ILE 71 -7.222 16.131 -9.051 573 HG12 ILE 71 2HG1 ILE 71 -9.783 15.190 -7.664 574 HG13 ILE 71 3HG1 ILE 71 -8.157 14.578 -7.380 575 HG21 ILE 71 1HG2 ILE 71 -10.060 17.167 -9.449 576 HG22 ILE 71 2HG2 ILE 71 -8.651 17.637 -10.400 577 HG23 ILE 71 3HG2 ILE 71 -8.738 18.055 -8.689 578 HD11 ILE 71 3HD1 ILE 71 -8.837 16.022 -5.590 579 HD12 ILE 71 1HD1 ILE 71 -9.173 17.334 -6.720 580 HD13 ILE 71 2HD1 ILE 71 -7.515 16.774 -6.483 581 H LEU 72 H LEU 72 -6.383 14.416 -11.360 582 HA LEU 72 HA LEU 72 -6.475 16.175 -13.568 583 HB2 LEU 72 2HB LEU 72 -4.421 15.085 -12.649 584 HB3 LEU 72 3HB LEU 72 -4.972 13.535 -13.234 585 HG LEU 72 HG LEU 72 -3.091 14.718 -14.544 586 HD11 LEU 72 1HD1 LEU 72 -4.229 12.772 -15.491 587 HD12 LEU 72 2HD1 LEU 72 -3.819 13.939 -16.746 588 HD13 LEU 72 3HD1 LEU 72 -5.484 13.811 -16.171 589 HD21 LEU 72 3HD2 LEU 72 -5.376 16.421 -15.589 590 HD22 LEU 72 1HD2 LEU 72 -3.720 16.403 -16.206 591 HD23 LEU 72 2HD2 LEU 72 -4.044 16.979 -14.573 592 H HIS 73 H HIS 73 -7.294 12.727 -13.251 593 HA HIS 73 HA HIS 73 -8.295 12.382 -15.926 594 HB2 HIS 73 2HB HIS 73 -8.309 10.646 -13.430 595 HB3 HIS 73 3HB HIS 73 -9.213 10.162 -14.863 596 HD1 HIS 73 HD1 HIS 73 -7.935 8.605 -16.269 597 HD2 HIS 73 HD2 HIS 73 -5.410 11.259 -14.325 598 HE1 HIS 73 HE1 HIS 73 -5.621 7.985 -16.999 599 HE2 HIS 73 HE2 HIS 73 -4.110 9.447 -15.611 600 H ASP 74 H ASP 74 -9.578 13.734 -13.118 601 HA ASP 74 HA ASP 74 -11.433 14.935 -12.752 602 HB2 ASP 74 2HB ASP 74 -11.848 15.132 -15.225 603 HB3 ASP 74 3HB ASP 74 -12.784 13.645 -15.165 604 H PHE 75 H PHE 75 -10.761 12.905 -11.345 605 HA PHE 75 HA PHE 75 -13.272 11.621 -10.445 606 HB2 PHE 75 2HB PHE 75 -11.245 10.131 -11.001 607 HB3 PHE 75 3HB PHE 75 -10.399 10.893 -9.666 608 HD1 PHE 75 HD2 PHE 75 -13.616 9.078 -10.380 609 HD2 PHE 75 HD1 PHE 75 -10.455 9.789 -7.583 610 HE1 PHE 75 HE2 PHE 75 -14.528 7.346 -8.895 611 HE2 PHE 75 HE1 PHE 75 -11.370 8.045 -6.106 612 HZ PHE 75 HZ PHE 75 -13.412 6.824 -6.766 613 H THR 76 H THR 76 -14.114 13.227 -9.239 614 HA THR 76 HA THR 76 -12.726 15.508 -8.425 615 HB THR 76 HB THR 76 -15.177 15.332 -9.094 616 HG1 THR 76 HG1 THR 76 -14.998 17.281 -8.311 617 HG21 THR 76 3HG2 THR 76 -15.847 13.457 -7.657 618 HG22 THR 76 1HG2 THR 76 -16.854 14.875 -7.347 619 HG23 THR 76 2HG2 THR 76 -15.560 14.444 -6.224 620 HA PRO 77 HA PRO 77 -11.158 14.869 -4.228 621 HB2 PRO 77 2HB PRO 77 -12.114 17.188 -2.940 622 HB3 PRO 77 3HB PRO 77 -10.647 17.112 -3.936 623 HG2 PRO 77 2HG PRO 77 -13.416 17.963 -4.745 624 HG3 PRO 77 3HG PRO 77 -11.851 18.736 -5.097 625 HD2 PRO 77 2HD PRO 77 -12.978 17.271 -6.978 626 HD3 PRO 77 3HD PRO 77 -11.240 17.073 -6.682 627 H GLU 78 H GLU 78 -14.561 15.653 -4.648 628 HA GLU 78 HA GLU 78 -15.487 14.917 -2.075 629 HB2 GLU 78 2HB GLU 78 -16.985 14.975 -4.733 630 HB3 GLU 78 3HB GLU 78 -17.745 14.832 -3.150 631 HG2 GLU 78 2HG GLU 78 -16.795 17.060 -2.532 632 HG3 GLU 78 3HG GLU 78 -16.150 17.205 -4.167 633 H GLU 79 H GLU 79 -15.061 13.057 -5.094 634 HA GLU 79 HA GLU 79 -16.207 10.610 -4.238 635 HB2 GLU 79 2HB GLU 79 -14.029 11.201 -6.294 636 HB3 GLU 79 3HB GLU 79 -14.658 9.581 -6.024 637 HG2 GLU 79 2HG GLU 79 -16.368 11.934 -6.852 638 HG3 GLU 79 3HG GLU 79 -15.649 10.793 -7.982 639 H ILE 80 H ILE 80 -12.894 11.762 -4.278 640 HA ILE 80 HA ILE 80 -11.543 9.540 -3.292 641 HB ILE 80 HB ILE 80 -10.788 12.490 -3.046 642 HG12 ILE 80 2HG1 ILE 80 -10.120 10.529 -5.307 643 HG13 ILE 80 3HG1 ILE 80 -11.368 11.767 -5.399 644 HG21 ILE 80 1HG2 ILE 80 -9.021 10.015 -3.000 645 HG22 ILE 80 2HG2 ILE 80 -9.362 11.080 -1.635 646 HG23 ILE 80 3HG2 ILE 80 -8.445 11.681 -3.014 647 HD11 ILE 80 3HD1 ILE 80 -9.645 13.499 -5.132 648 HD12 ILE 80 1HD1 ILE 80 -9.387 12.481 -6.550 649 HD13 ILE 80 2HD1 ILE 80 -8.408 12.237 -5.104 650 H LYS 81 H LYS 81 -12.652 12.455 -1.512 651 HA LYS 81 HA LYS 81 -11.683 11.637 1.037 652 HB2 LYS 81 2HB LYS 81 -12.788 13.584 1.943 653 HB3 LYS 81 3HB LYS 81 -12.068 14.023 0.395 654 HG2 LYS 81 2HG LYS 81 -14.384 13.652 -0.635 655 HG3 LYS 81 3HG LYS 81 -15.003 13.558 1.015 656 HD2 LYS 81 2HD LYS 81 -13.539 15.934 -0.211 657 HD3 LYS 81 3HD LYS 81 -15.286 15.814 0.040 658 HE2 LYS 81 2HE LYS 81 -14.904 15.651 2.501 659 HE3 LYS 81 3HE LYS 81 -13.172 15.858 2.227 660 HZ1 LYS 81 3HZ LYS 81 -14.180 17.943 2.825 661 HZ2 LYS 81 1HZ LYS 81 -15.304 17.818 1.567 662 HZ3 LYS 81 2HZ LYS 81 -13.665 18.020 1.215 663 H SER 82 H SER 82 -14.559 10.869 -0.702 664 HA SER 82 HA SER 82 -16.270 10.249 1.510 665 HB2 SER 82 2HB SER 82 -17.108 10.857 -0.781 666 HB3 SER 82 3HB SER 82 -16.530 9.299 -1.375 667 HG SER 82 HG SER 82 -18.201 9.337 0.871 668 H PHE 83 H PHE 83 -13.856 8.479 -0.316 669 HA PHE 83 HA PHE 83 -14.562 5.878 0.725 670 HB2 PHE 83 2HB PHE 83 -12.000 6.814 -0.620 671 HB3 PHE 83 3HB PHE 83 -12.373 5.140 -0.221 672 HD1 PHE 83 HD2 PHE 83 -14.694 4.245 -1.214 673 HD2 PHE 83 HD1 PHE 83 -12.474 7.546 -2.788 674 HE1 PHE 83 HE2 PHE 83 -15.811 3.970 -3.392 675 HE2 PHE 83 HE1 PHE 83 -13.597 7.261 -4.951 676 HZ PHE 83 HZ PHE 83 -15.263 5.480 -5.260 677 H PHE 84 H PHE 84 -12.906 8.574 2.046 678 HA PHE 84 HA PHE 84 -11.401 7.087 4.041 679 HB2 PHE 84 2HB PHE 84 -12.040 10.056 3.776 680 HB3 PHE 84 3HB PHE 84 -11.108 9.388 5.110 681 HD1 PHE 84 HD1 PHE 84 -11.093 10.007 1.462 682 HD2 PHE 84 HD2 PHE 84 -8.793 8.746 4.825 683 HE1 PHE 84 HE1 PHE 84 -9.045 10.196 0.121 684 HE2 PHE 84 HE2 PHE 84 -6.746 8.929 3.480 685 HZ PHE 84 HZ PHE 84 -6.866 9.652 1.132 686 H GLU 85 H GLU 85 -14.656 7.931 3.637 687 HA GLU 85 HA GLU 85 -15.357 8.268 6.434 688 HB2 GLU 85 2HB GLU 85 -17.147 7.895 3.990 689 HB3 GLU 85 3HB GLU 85 -17.689 8.375 5.595 690 HG2 GLU 85 2HG GLU 85 -16.353 10.467 5.391 691 HG3 GLU 85 3HG GLU 85 -15.898 9.987 3.751 692 H ASN 86 H ASN 86 -15.757 6.629 7.805 693 HA ASN 86 HA ASN 86 -16.093 3.872 6.959 694 HB2 ASN 86 2HB ASN 86 -14.804 4.407 9.022 695 HB3 ASN 86 3HB ASN 86 -16.228 5.138 9.745 696 HD21 ASN 86 1HD2 ASN 86 -14.678 2.141 8.888 697 HD22 ASN 86 2HD2 ASN 86 -15.723 1.101 9.780 698 H LYS 87 H LYS 87 -18.015 4.083 5.703 699 HA LYS 87 HA LYS 87 -20.542 4.201 7.252 700 HB2 LYS 87 2HB LYS 87 -20.101 5.444 4.490 701 HB3 LYS 87 3HB LYS 87 -21.646 5.355 5.333 702 HG2 LYS 87 2HG LYS 87 -20.731 6.837 7.117 703 HG3 LYS 87 3HG LYS 87 -19.216 6.954 6.217 704 HD2 LYS 87 2HD LYS 87 -21.952 7.975 5.354 705 HD3 LYS 87 3HD LYS 87 -20.529 8.937 5.759 706 HE2 LYS 87 2HE LYS 87 -19.353 7.923 3.782 707 HE3 LYS 87 3HE LYS 87 -20.863 7.119 3.348 708 HZ1 LYS 87 3HZ LYS 87 -21.902 9.297 3.133 709 HZ2 LYS 87 1HZ LYS 87 -20.566 9.152 2.107 710 HZ3 LYS 87 2HZ LYS 87 -20.441 10.056 3.531 711 H GLY 88 H GLY 88 -21.710 2.423 6.938 712 HA2 GLY 88 2HA GLY 88 -22.658 0.568 5.950 713 HA3 GLY 88 3HA GLY 88 -21.758 0.899 4.475 714 H LYS 89 H LYS 89 -19.245 0.791 5.037 715 HA LYS 89 HA LYS 89 -18.510 -1.322 6.885 716 HB2 LYS 89 2HB LYS 89 -17.102 -2.454 5.072 717 HB3 LYS 89 3HB LYS 89 -18.835 -2.691 4.960 718 HG2 LYS 89 2HG LYS 89 -18.230 -2.348 2.730 719 HG3 LYS 89 3HG LYS 89 -18.799 -0.756 3.225 720 HD2 LYS 89 2HD LYS 89 -16.764 -0.542 1.885 721 HD3 LYS 89 3HD LYS 89 -16.451 -0.028 3.545 722 HE2 LYS 89 2HE LYS 89 -15.443 -2.279 3.996 723 HE3 LYS 89 3HE LYS 89 -15.665 -2.689 2.296 724 HZ1 LYS 89 3HZ LYS 89 -13.418 -1.891 2.864 725 HZ2 LYS 89 1HZ LYS 89 -14.061 -0.384 3.252 726 HZ3 LYS 89 2HZ LYS 89 -14.163 -0.961 1.668 727 H ARG 90 H ARG 90 -15.849 -1.489 6.375 728 HA ARG 90 HA ARG 90 -14.790 0.825 7.591 729 HB2 ARG 90 2HB ARG 90 -13.404 -1.502 6.189 730 HB3 ARG 90 3HB ARG 90 -12.559 -0.306 7.173 731 HG2 ARG 90 2HG ARG 90 -13.809 -0.979 9.152 732 HG3 ARG 90 3HG ARG 90 -14.785 -2.101 8.205 733 HD2 ARG 90 2HD ARG 90 -12.812 -3.486 7.768 734 HD3 ARG 90 3HD ARG 90 -11.781 -2.320 8.611 735 HE ARG 90 HE ARG 90 -13.558 -2.931 10.529 736 HH11 ARG 90 1HH1 ARG 90 -11.683 -5.048 8.423 737 HH12 ARG 90 2HH1 ARG 90 -11.616 -6.334 9.588 738 HH21 ARG 90 1HH2 ARG 90 -13.459 -4.618 12.033 739 HH22 ARG 90 2HH2 ARG 90 -12.623 -6.090 11.635 740 HA PRO 91 HA PRO 91 -13.720 3.622 4.211 741 HB2 PRO 91 2HB PRO 91 -10.963 3.934 5.368 742 HB3 PRO 91 3HB PRO 91 -12.190 5.168 5.028 743 HG2 PRO 91 2HG PRO 91 -11.673 4.436 7.535 744 HG3 PRO 91 3HG PRO 91 -13.336 4.793 7.012 745 HD2 PRO 91 2HD PRO 91 -12.030 2.111 7.432 746 HD3 PRO 91 3HD PRO 91 -13.667 2.648 7.866 747 H VAL 92 H VAL 92 -12.993 3.330 2.161 748 HA VAL 92 HA VAL 92 -11.346 1.050 1.433 749 HB VAL 92 HB VAL 92 -12.501 3.272 -0.333 750 HG11 VAL 92 1HG1 VAL 92 -10.593 2.173 -1.431 751 HG12 VAL 92 2HG1 VAL 92 -12.100 1.741 -2.238 752 HG13 VAL 92 3HG1 VAL 92 -11.319 0.586 -1.154 753 HG21 VAL 92 3HG2 VAL 92 -14.283 2.007 0.804 754 HG22 VAL 92 1HG2 VAL 92 -13.605 0.484 0.219 755 HG23 VAL 92 2HG2 VAL 92 -14.277 1.652 -0.924 756 H PHE 93 H PHE 93 -11.115 4.598 0.960 757 HA PHE 93 HA PHE 93 -8.190 4.499 0.769 758 HB2 PHE 93 2HB PHE 93 -10.158 6.836 0.626 759 HB3 PHE 93 3HB PHE 93 -8.411 7.012 0.513 760 HD1 PHE 93 HD1 PHE 93 -9.368 4.036 -1.258 761 HD2 PHE 93 HD2 PHE 93 -9.310 8.306 -1.581 762 HE1 PHE 93 HE1 PHE 93 -9.493 3.859 -3.707 763 HE2 PHE 93 HE2 PHE 93 -9.435 8.109 -4.032 764 HZ PHE 93 HZ PHE 93 -9.516 5.891 -5.095 765 H VAL 94 H VAL 94 -7.139 4.353 2.669 766 HA VAL 94 HA VAL 94 -8.284 5.573 5.133 767 HB VAL 94 HB VAL 94 -6.415 3.160 4.862 768 HG11 VAL 94 1HG1 VAL 94 -5.984 4.354 6.947 769 HG12 VAL 94 2HG1 VAL 94 -6.800 2.827 7.285 770 HG13 VAL 94 3HG1 VAL 94 -7.705 4.342 7.345 771 HG21 VAL 94 3HG2 VAL 94 -8.311 1.783 5.572 772 HG22 VAL 94 1HG2 VAL 94 -8.714 2.657 4.093 773 HG23 VAL 94 2HG2 VAL 94 -9.348 3.205 5.646 774 H LYS 95 H LYS 95 -6.867 6.750 6.489 775 HA LYS 95 HA LYS 95 -4.013 6.935 5.852 776 HB2 LYS 95 2HB LYS 95 -3.973 9.362 5.897 777 HB3 LYS 95 3HB LYS 95 -5.068 8.825 4.633 778 HG2 LYS 95 2HG LYS 95 -7.009 9.387 5.986 779 HG3 LYS 95 3HG LYS 95 -5.989 9.785 7.371 780 HD2 LYS 95 2HD LYS 95 -5.936 11.248 4.699 781 HD3 LYS 95 3HD LYS 95 -6.813 11.802 6.126 782 HE2 LYS 95 2HE LYS 95 -4.732 12.092 7.356 783 HE3 LYS 95 3HE LYS 95 -3.806 11.370 6.038 784 HZ1 LYS 95 3HZ LYS 95 -4.428 13.211 4.623 785 HZ2 LYS 95 1HZ LYS 95 -3.667 13.781 6.022 786 HZ3 LYS 95 2HZ LYS 95 -5.344 13.905 5.863 787 H GLY 96 H GLY 96 -2.780 7.966 7.556 788 HA2 GLY 96 2HA GLY 96 -3.294 9.124 9.867 789 HA3 GLY 96 3HA GLY 96 -3.835 7.488 10.259 790 H SER 97 H SER 97 -2.113 7.453 11.864 791 HA SER 97 HA SER 97 0.633 7.169 11.057 792 HB2 SER 97 2HB SER 97 -0.137 7.690 13.416 793 HB3 SER 97 3HB SER 97 -0.756 6.043 13.540 794 HG SER 97 HG SER 97 1.889 6.973 13.430 795 H LEU 98 H LEU 98 1.658 4.790 11.677 796 HA LEU 98 HA LEU 98 0.821 3.076 9.587 797 HB2 LEU 98 2HB LEU 98 3.142 3.059 10.406 798 HB3 LEU 98 3HB LEU 98 2.611 2.472 11.975 799 HG LEU 98 HG LEU 98 1.881 0.323 10.927 800 HD11 LEU 98 1HD1 LEU 98 1.345 1.109 8.678 801 HD12 LEU 98 2HD1 LEU 98 2.483 -0.234 8.617 802 HD13 LEU 98 3HD1 LEU 98 3.054 1.416 8.352 803 HD21 LEU 98 3HD2 LEU 98 4.099 -0.629 10.496 804 HD22 LEU 98 1HD2 LEU 98 4.132 0.450 11.893 805 HD23 LEU 98 2HD2 LEU 98 4.787 0.990 10.343 806 H GLU 99 H GLU 99 0.522 2.720 13.113 807 HA GLU 99 HA GLU 99 -1.045 0.336 13.068 808 HB2 GLU 99 2HB GLU 99 -0.675 2.364 15.323 809 HB3 GLU 99 3HB GLU 99 -1.353 0.743 15.495 810 HG2 GLU 99 2HG GLU 99 0.824 -0.201 14.679 811 HG3 GLU 99 3HG GLU 99 1.479 1.437 14.675 812 H SER 100 H SER 100 -1.821 3.798 13.337 813 HA SER 100 HA SER 100 -4.550 3.647 13.955 814 HB2 SER 100 2HB SER 100 -3.105 5.778 12.312 815 HB3 SER 100 3HB SER 100 -4.681 5.970 13.090 816 HG SER 100 HG SER 100 -3.183 6.786 14.495 817 H ALA 101 H ALA 101 -2.959 3.872 10.796 818 HA ALA 101 HA ALA 101 -5.297 3.826 9.188 819 HB1 ALA 101 3HB ALA 101 -2.424 3.171 8.436 820 HB2 ALA 101 1HB ALA 101 -3.169 4.769 8.385 821 HB3 ALA 101 2HB ALA 101 -3.735 3.493 7.298 822 H ALA 102 H ALA 102 -3.323 1.346 10.656 823 HA ALA 102 HA ALA 102 -4.215 -0.917 9.175 824 HB1 ALA 102 3HB ALA 102 -3.279 -2.216 11.038 825 HB2 ALA 102 1HB ALA 102 -3.159 -0.748 12.020 826 HB3 ALA 102 2HB ALA 102 -2.175 -0.923 10.568 827 H GLU 103 H GLU 103 -5.304 0.708 12.120 828 HA GLU 103 HA GLU 103 -7.295 -1.179 12.914 829 HB2 GLU 103 2HB GLU 103 -6.983 1.765 13.657 830 HB3 GLU 103 3HB GLU 103 -8.018 0.605 14.492 831 HG2 GLU 103 2HG GLU 103 -6.069 -0.710 15.147 832 HG3 GLU 103 3HG GLU 103 -5.016 0.368 14.251 833 H GLN 104 H GLN 104 -7.374 1.806 11.034 834 HA GLN 104 HA GLN 104 -10.227 1.978 10.799 835 HB2 GLN 104 2HB GLN 104 -8.008 3.324 9.212 836 HB3 GLN 104 3HB GLN 104 -9.714 3.755 9.100 837 HG2 GLN 104 2HG GLN 104 -9.743 4.501 11.395 838 HG3 GLN 104 3HG GLN 104 -8.110 3.893 11.663 839 HE21 GLN 104 1HE2 GLN 104 -6.366 5.059 10.883 840 HE22 GLN 104 2HE2 GLN 104 -6.499 6.683 10.321 841 H ALA 105 H ALA 105 -7.631 0.777 8.663 842 HA ALA 105 HA ALA 105 -9.361 -0.050 6.520 843 HB1 ALA 105 3HB ALA 105 -6.980 0.422 6.126 844 HB2 ALA 105 1HB ALA 105 -7.378 -1.227 5.643 845 HB3 ALA 105 2HB ALA 105 -6.521 -0.933 7.161 846 H GLY 106 H GLY 106 -8.332 -1.451 9.532 847 HA2 GLY 106 2HA GLY 106 -9.297 -3.199 10.699 848 HA3 GLY 106 3HA GLY 106 -10.179 -3.686 9.263 849 H ILE 107 H ILE 107 -6.804 -3.198 8.906 850 HA ILE 107 HA ILE 107 -6.271 -5.998 8.333 851 HB ILE 107 HB ILE 107 -4.210 -3.742 8.467 852 HG12 ILE 107 2HG1 ILE 107 -5.882 -4.443 6.011 853 HG13 ILE 107 3HG1 ILE 107 -6.125 -3.011 7.011 854 HG21 ILE 107 1HG2 ILE 107 -2.998 -5.063 6.786 855 HG22 ILE 107 2HG2 ILE 107 -4.291 -6.264 6.771 856 HG23 ILE 107 3HG2 ILE 107 -3.319 -6.032 8.225 857 HD11 ILE 107 3HD1 ILE 107 -4.875 -2.480 5.021 858 HD12 ILE 107 1HD1 ILE 107 -3.639 -3.665 5.434 859 HD13 ILE 107 2HD1 ILE 107 -3.873 -2.236 6.449 860 H VAL 108 H VAL 108 -4.691 -7.303 9.531 861 HA VAL 108 HA VAL 108 -4.624 -6.900 12.364 862 HB VAL 108 HB VAL 108 -2.904 -8.841 10.758 863 HG11 VAL 108 1HG1 VAL 108 -3.691 -8.849 13.700 864 HG12 VAL 108 2HG1 VAL 108 -2.081 -8.529 13.041 865 HG13 VAL 108 3HG1 VAL 108 -2.798 -10.132 12.878 866 HG21 VAL 108 3HG2 VAL 108 -5.271 -9.213 10.232 867 HG22 VAL 108 1HG2 VAL 108 -5.664 -9.311 11.952 868 HG23 VAL 108 2HG2 VAL 108 -4.642 -10.543 11.203 869 H VAL 109 H VAL 109 -3.423 -5.462 13.330 870 HA VAL 109 HA VAL 109 -1.627 -3.736 12.099 871 HB VAL 109 HB VAL 109 -1.895 -4.265 15.093 872 HG11 VAL 109 1HG1 VAL 109 -1.065 -1.937 15.397 873 HG12 VAL 109 2HG1 VAL 109 -0.781 -1.823 13.660 874 HG13 VAL 109 3HG1 VAL 109 0.137 -2.978 14.627 875 HG21 VAL 109 3HG2 VAL 109 -3.387 -2.240 13.383 876 HG22 VAL 109 1HG2 VAL 109 -3.552 -2.439 15.131 877 HG23 VAL 109 2HG2 VAL 109 -4.072 -3.724 14.038 878 H ASP 110 H ASP 110 -0.957 -6.408 14.352 879 HA ASP 110 HA ASP 110 1.798 -6.184 14.621 880 HB2 ASP 110 2HB ASP 110 0.505 -7.624 16.097 881 HB3 ASP 110 3HB ASP 110 0.009 -8.653 14.759 882 H GLU 111 H GLU 111 -0.047 -7.999 12.199 883 HA GLU 111 HA GLU 111 2.085 -9.325 10.944 884 HB2 GLU 111 2HB GLU 111 -0.620 -8.494 9.862 885 HB3 GLU 111 3HB GLU 111 0.471 -9.588 9.024 886 HG2 GLU 111 2HG GLU 111 -0.684 -10.139 11.771 887 HG3 GLU 111 3HG GLU 111 -1.440 -10.665 10.271 888 H LEU 112 H LEU 112 0.441 -6.205 10.080 889 HA LEU 112 HA LEU 112 2.245 -5.777 7.856 890 HB2 LEU 112 2HB LEU 112 1.170 -3.563 7.578 891 HB3 LEU 112 3HB LEU 112 0.054 -4.913 7.596 892 HG LEU 112 HG LEU 112 -0.449 -4.276 10.055 893 HD11 LEU 112 1HD1 LEU 112 1.406 -2.748 10.512 894 HD12 LEU 112 2HD1 LEU 112 -0.139 -1.926 10.701 895 HD13 LEU 112 3HD1 LEU 112 0.838 -1.644 9.258 896 HD21 LEU 112 3HD2 LEU 112 -2.155 -2.748 9.417 897 HD22 LEU 112 1HD2 LEU 112 -1.953 -3.895 8.106 898 HD23 LEU 112 2HD2 LEU 112 -1.291 -2.268 7.958 899 H VAL 113 H VAL 113 2.323 -4.863 11.199 900 HA VAL 113 HA VAL 113 4.271 -2.782 11.058 901 HB VAL 113 HB VAL 113 3.501 -4.620 13.385 902 HG11 VAL 113 1HG1 VAL 113 5.559 -2.365 13.459 903 HG12 VAL 113 2HG1 VAL 113 5.895 -4.082 13.687 904 HG13 VAL 113 3HG1 VAL 113 4.924 -3.211 14.874 905 HG21 VAL 113 3HG2 VAL 113 1.860 -2.874 12.767 906 HG22 VAL 113 1HG2 VAL 113 3.098 -1.632 12.944 907 HG23 VAL 113 2HG2 VAL 113 2.552 -2.543 14.356 908 H GLN 114 H GLN 114 4.384 -6.306 11.322 909 HA GLN 114 HA GLN 114 7.211 -6.595 11.451 910 HB2 GLN 114 2HB GLN 114 5.131 -8.493 10.288 911 HB3 GLN 114 3HB GLN 114 6.830 -8.908 10.523 912 HG2 GLN 114 2HG GLN 114 4.809 -8.256 12.677 913 HG3 GLN 114 3HG GLN 114 5.528 -9.827 12.344 914 HE21 GLN 114 1HE2 GLN 114 6.109 -6.633 13.644 915 HE22 GLN 114 2HE2 GLN 114 7.525 -7.029 14.544 916 H THR 115 H THR 115 4.940 -6.825 8.761 917 HA THR 115 HA THR 115 6.650 -7.108 6.652 918 HB THR 115 HB THR 115 3.899 -5.901 6.937 919 HG1 THR 115 HG1 THR 115 3.426 -7.937 6.740 920 HG21 THR 115 3HG2 THR 115 5.363 -6.289 4.319 921 HG22 THR 115 1HG2 THR 115 4.804 -4.760 5.004 922 HG23 THR 115 2HG2 THR 115 3.631 -5.979 4.499 923 H VAL 116 H VAL 116 5.753 -4.001 8.172 924 HA VAL 116 HA VAL 116 7.097 -2.384 6.183 925 HB VAL 116 HB VAL 116 5.835 -1.647 8.865 926 HG11 VAL 116 1HG1 VAL 116 6.084 0.739 8.235 927 HG12 VAL 116 2HG1 VAL 116 7.022 0.272 6.813 928 HG13 VAL 116 3HG1 VAL 116 7.660 -0.039 8.427 929 HG21 VAL 116 3HG2 VAL 116 4.937 -1.127 5.999 930 HG22 VAL 116 1HG2 VAL 116 4.087 -0.599 7.453 931 HG23 VAL 116 2HG2 VAL 116 4.245 -2.319 7.100 932 H LYS 117 H LYS 117 7.930 -3.608 9.465 933 HA LYS 117 HA LYS 117 10.426 -2.125 9.532 934 HB2 LYS 117 2HB LYS 117 10.916 -3.256 11.619 935 HB3 LYS 117 3HB LYS 117 9.217 -2.801 11.644 936 HG2 LYS 117 2HG LYS 117 8.586 -5.119 11.095 937 HG3 LYS 117 3HG LYS 117 10.282 -5.590 11.062 938 HD2 LYS 117 2HD LYS 117 8.780 -4.555 13.508 939 HD3 LYS 117 3HD LYS 117 9.148 -6.247 13.171 940 HE2 LYS 117 2HE LYS 117 11.599 -5.643 13.210 941 HE3 LYS 117 3HE LYS 117 11.131 -4.027 13.751 942 HZ1 LYS 117 3HZ LYS 117 10.047 -5.072 15.677 943 HZ2 LYS 117 1HZ LYS 117 11.705 -5.385 15.629 944 HZ3 LYS 117 2HZ LYS 117 10.605 -6.584 15.174 945 H ASN 118 H ASN 118 9.395 -5.221 8.301 946 HA ASN 118 HA ASN 118 11.981 -6.403 7.920 947 HB2 ASN 118 2HB ASN 118 9.474 -6.910 6.223 948 HB3 ASN 118 3HB ASN 118 10.914 -7.912 6.270 949 HD21 ASN 118 1HD2 ASN 118 10.682 -7.373 9.410 950 HD22 ASN 118 2HD2 ASN 118 9.523 -8.559 9.886 951 H TYR 119 H TYR 119 9.659 -4.609 5.945 952 HA TYR 119 HA TYR 119 11.062 -4.431 3.561 953 HB2 TYR 119 2HB TYR 119 8.639 -3.892 3.774 954 HB3 TYR 119 3HB TYR 119 9.042 -2.431 4.673 955 HD1 TYR 119 HD1 TYR 119 9.415 -4.080 1.337 956 HD2 TYR 119 HD2 TYR 119 9.552 -0.395 3.491 957 HE1 TYR 119 HE1 TYR 119 9.588 -2.854 -0.787 958 HE2 TYR 119 HE2 TYR 119 9.714 0.827 1.377 959 HH TYR 119 HH TYR 119 9.004 -0.420 -1.578 960 H GLN 120 H GLN 120 10.678 -1.797 5.927 961 HA GLN 120 HA GLN 120 12.574 -0.080 4.828 962 HB2 GLN 120 2HB GLN 120 11.543 -0.185 7.700 963 HB3 GLN 120 3HB GLN 120 12.435 1.163 6.996 964 HG2 GLN 120 2HG GLN 120 10.550 1.298 5.257 965 HG3 GLN 120 3HG GLN 120 9.648 0.207 6.292 966 HE21 GLN 120 1HE2 GLN 120 9.126 3.023 5.493 967 HE22 GLN 120 2HE2 GLN 120 8.948 3.901 6.964 968 H GLY 121 H GLY 121 13.003 -2.802 6.976 969 HA2 GLY 121 2HA GLY 121 15.627 -2.162 7.948 970 HA3 GLY 121 3HA GLY 121 14.831 -3.731 8.003 971 H TYR 122 H TYR 122 14.391 -4.189 5.239 972 HA TYR 122 HA TYR 122 17.101 -5.000 4.565 973 HB2 TYR 122 2HB TYR 122 16.142 -6.521 2.922 974 HB3 TYR 122 3HB TYR 122 15.448 -6.757 4.505 975 HD1 TYR 122 HD2 TYR 122 14.521 -4.548 1.551 976 HD2 TYR 122 HD1 TYR 122 13.288 -7.579 4.298 977 HE1 TYR 122 HE2 TYR 122 12.282 -4.575 0.543 978 HE2 TYR 122 HE1 TYR 122 11.061 -7.609 3.272 979 HH TYR 122 HH TYR 122 10.362 -5.860 0.380 980 H VAL 123 H VAL 123 14.914 -2.564 3.562 981 HA VAL 123 HA VAL 123 15.884 -1.978 0.970 982 HB VAL 123 HB VAL 123 14.689 -0.103 3.078 983 HG11 VAL 123 1HG1 VAL 123 15.270 0.525 0.152 984 HG12 VAL 123 2HG1 VAL 123 16.069 1.246 1.551 985 HG13 VAL 123 3HG1 VAL 123 14.359 1.560 1.260 986 HG21 VAL 123 3HG2 VAL 123 13.140 -1.835 2.214 987 HG22 VAL 123 1HG2 VAL 123 13.446 -1.298 0.567 988 HG23 VAL 123 2HG2 VAL 123 12.634 -0.226 1.708 989 H GLN 124 H GLN 124 16.768 -0.527 4.106 990 HA GLN 124 HA GLN 124 19.078 0.852 3.132 991 HB2 GLN 124 2HB GLN 124 19.479 1.365 5.552 992 HB3 GLN 124 3HB GLN 124 17.847 1.748 5.016 993 HG2 GLN 124 2HG GLN 124 17.072 -0.422 6.005 994 HG3 GLN 124 3HG GLN 124 18.694 -0.652 6.660 995 HE21 GLN 124 1HE2 GLN 124 16.169 -0.430 8.090 996 HE22 GLN 124 2HE2 GLN 124 16.324 0.918 9.160 997 H ASP 125 H ASP 125 18.562 -2.406 4.166 998 HA ASP 125 HA ASP 125 21.324 -3.113 4.686 999 HB2 ASP 125 2HB ASP 125 19.430 -4.421 5.611 1000 HB3 ASP 125 3HB ASP 125 18.869 -4.798 3.999 1001 H GLY 126 H GLY 126 19.244 -2.839 1.868 1002 HA2 GLY 126 2HA GLY 126 19.928 -2.645 -0.364 1003 HA3 GLY 126 3HA GLY 126 21.467 -3.389 0.031 1004 H HIS 127 H HIS 127 19.741 -5.596 1.461 1005 HA HIS 127 HA HIS 127 19.409 -7.240 -0.986 1006 HB2 HIS 127 2HB HIS 127 21.042 -8.080 0.732 1007 HB3 HIS 127 3HB HIS 127 19.746 -8.148 1.916 1008 HD1 HIS 127 HD1 HIS 127 21.200 -9.975 -0.979 1009 HD2 HIS 127 HD2 HIS 127 17.862 -10.299 1.494 1010 HE1 HIS 127 HE1 HIS 127 20.269 -12.268 -1.388 1011 HE2 HIS 127 HE2 HIS 127 18.255 -12.436 0.109 1012 H ASP 128 H ASP 128 17.333 -7.344 -1.637 1013 HA ASP 128 HA ASP 128 15.129 -6.674 0.057 1014 HB2 ASP 128 2HB ASP 128 13.809 -6.655 -1.844 1015 HB3 ASP 128 3HB ASP 128 15.393 -6.321 -2.527 1016 H HIS 129 H HIS 129 13.124 -8.070 -0.004 1017 HA HIS 129 HA HIS 129 13.516 -10.963 0.078 1018 HB2 HIS 129 2HB HIS 129 12.524 -9.390 2.504 1019 HB3 HIS 129 3HB HIS 129 12.224 -11.109 2.306 1020 HD1 HIS 129 HD1 HIS 129 14.076 -12.699 2.990 1021 HD2 HIS 129 HD2 HIS 129 15.309 -8.728 2.947 1022 HE1 HIS 129 HE1 HIS 129 16.380 -12.688 3.999 1023 HE2 HIS 129 HE2 HIS 129 17.017 -10.258 4.109 1024 H ASP 130 H ASP 130 12.034 -8.541 -1.262 1025 HA ASP 130 HA ASP 130 9.271 -9.575 -1.193 1026 HB2 ASP 130 2HB ASP 130 8.558 -7.330 -2.015 1027 HB3 ASP 130 3HB ASP 130 9.322 -7.258 -0.436 1028 H PHE 131 H PHE 131 10.217 -11.235 -2.573 1029 HA PHE 131 HA PHE 131 9.947 -12.370 -4.481 1030 HB2 PHE 131 2HB PHE 131 8.617 -9.858 -5.589 1031 HB3 PHE 131 3HB PHE 131 8.489 -11.480 -6.272 1032 HD1 PHE 131 HD1 PHE 131 7.285 -13.288 -4.972 1033 HD2 PHE 131 HD2 PHE 131 7.239 -9.198 -3.711 1034 HE1 PHE 131 HE1 PHE 131 5.386 -13.758 -3.472 1035 HE2 PHE 131 HE2 PHE 131 5.345 -9.679 -2.223 1036 HZ PHE 131 HZ PHE 131 4.421 -11.948 -2.102 1037 H GLY 132 H GLY 132 12.141 -9.944 -4.248 1038 HA2 GLY 132 2HA GLY 132 14.261 -10.125 -5.247 1039 HA3 GLY 132 3HA GLY 132 13.549 -10.857 -6.688 1040 H ARG 133 H ARG 133 12.899 -7.854 -4.874 1041 HA ARG 133 HA ARG 133 13.084 -6.217 -7.299 1042 HB2 ARG 133 2HB ARG 133 11.262 -5.774 -5.689 1043 HB3 ARG 133 3HB ARG 133 12.429 -5.493 -4.401 1044 HG2 ARG 133 2HG ARG 133 13.296 -3.522 -5.692 1045 HG3 ARG 133 3HG ARG 133 12.019 -3.779 -6.881 1046 HD2 ARG 133 2HD ARG 133 11.512 -3.225 -3.941 1047 HD3 ARG 133 3HD ARG 133 11.557 -1.973 -5.176 1048 HE ARG 133 HE ARG 133 9.449 -3.903 -4.674 1049 HH11 ARG 133 1HH1 ARG 133 10.712 -1.526 -6.964 1050 HH12 ARG 133 2HH1 ARG 133 9.186 -1.316 -7.763 1051 HH21 ARG 133 1HH2 ARG 133 7.443 -3.530 -5.728 1052 HH22 ARG 133 2HH2 ARG 133 7.366 -2.434 -7.072 1053 H ASP 134 H ASP 134 14.750 -4.734 -7.687 1054 HA ASP 134 HA ASP 134 17.301 -5.203 -6.459 1055 HB2 ASP 134 2HB ASP 134 16.910 -4.613 -8.909 1056 HB3 ASP 134 3HB ASP 134 16.564 -2.971 -8.407 1057 HA PRO 135 HA PRO 135 17.455 -2.283 -2.971 1058 HB2 PRO 135 2HB PRO 135 20.059 -1.234 -3.702 1059 HB3 PRO 135 3HB PRO 135 19.684 -2.480 -2.504 1060 HG2 PRO 135 2HG PRO 135 20.502 -2.806 -5.356 1061 HG3 PRO 135 3HG PRO 135 20.868 -3.829 -3.946 1062 HD2 PRO 135 2HD PRO 135 19.080 -4.660 -5.716 1063 HD3 PRO 135 3HD PRO 135 18.737 -4.858 -3.977 1064 H LYS 136 H LYS 136 18.298 -1.011 -6.211 1065 HA LYS 136 HA LYS 136 18.055 1.740 -5.407 1066 HB2 LYS 136 2HB LYS 136 18.410 2.301 -7.751 1067 HB3 LYS 136 3HB LYS 136 19.527 1.033 -7.265 1068 HG2 LYS 136 2HG LYS 136 17.919 -0.630 -8.330 1069 HG3 LYS 136 3HG LYS 136 17.045 0.753 -8.974 1070 HD2 LYS 136 2HD LYS 136 18.511 -0.120 -10.693 1071 HD3 LYS 136 3HD LYS 136 19.120 1.459 -10.188 1072 HE2 LYS 136 2HE LYS 136 20.843 0.355 -8.812 1073 HE3 LYS 136 3HE LYS 136 20.192 -1.225 -9.259 1074 HZ1 LYS 136 3HZ LYS 136 22.151 -0.610 -10.554 1075 HZ2 LYS 136 1HZ LYS 136 21.340 0.740 -11.159 1076 HZ3 LYS 136 2HZ LYS 136 20.795 -0.816 -11.539 1077 H TYR 137 H TYR 137 15.729 -0.625 -6.437 1078 HA TYR 137 HA TYR 137 13.613 1.373 -6.928 1079 HB2 TYR 137 2HB TYR 137 13.508 -1.681 -7.051 1080 HB3 TYR 137 3HB TYR 137 12.170 -0.606 -7.449 1081 HD1 TYR 137 HD1 TYR 137 15.532 -1.724 -8.506 1082 HD2 TYR 137 HD2 TYR 137 12.071 0.508 -9.626 1083 HE1 TYR 137 HE1 TYR 137 16.382 -1.581 -10.798 1084 HE2 TYR 137 HE2 TYR 137 12.917 0.649 -11.935 1085 HH TYR 137 HH TYR 137 15.621 -1.213 -13.025 1086 H LEU 138 H LEU 138 14.824 -0.691 -4.422 1087 HA LEU 138 HA LEU 138 12.598 -0.748 -2.659 1088 HB2 LEU 138 2HB LEU 138 15.598 -0.875 -2.186 1089 HB3 LEU 138 3HB LEU 138 14.450 -1.012 -0.872 1090 HG LEU 138 HG LEU 138 14.692 -2.958 -3.205 1091 HD11 LEU 138 1HD1 LEU 138 15.475 -3.350 -0.291 1092 HD12 LEU 138 2HD1 LEU 138 16.599 -3.083 -1.624 1093 HD13 LEU 138 3HD1 LEU 138 15.610 -4.536 -1.593 1094 HD21 LEU 138 3HD2 LEU 138 13.095 -4.365 -1.984 1095 HD22 LEU 138 1HD2 LEU 138 12.374 -2.807 -2.384 1096 HD23 LEU 138 2HD2 LEU 138 12.922 -3.126 -0.737 1097 H HIS 139 H HIS 139 11.725 0.857 -1.417 1098 HA HIS 139 HA HIS 139 13.183 3.330 -0.764 1099 HB2 HIS 139 2HB HIS 139 12.256 4.081 -2.816 1100 HB3 HIS 139 3HB HIS 139 10.792 3.130 -2.626 1101 HD1 HIS 139 HD1 HIS 139 8.814 4.227 -1.472 1102 HD2 HIS 139 HD2 HIS 139 12.224 6.591 -1.387 1103 HE1 HIS 139 HE1 HIS 139 8.054 6.471 -0.639 1104 HE2 HIS 139 HE2 HIS 139 10.100 7.924 -0.807 1105 H GLN 140 H GLN 140 12.866 3.465 1.438 1106 HA GLN 140 HA GLN 140 10.706 2.306 2.856 1107 HB2 GLN 140 2HB GLN 140 12.473 4.622 3.768 1108 HB3 GLN 140 3HB GLN 140 11.395 3.698 4.801 1109 HG2 GLN 140 2HG GLN 140 13.235 2.499 5.301 1110 HG3 GLN 140 3HG GLN 140 12.923 1.682 3.779 1111 HE21 GLN 140 1HE2 GLN 140 15.403 1.933 5.140 1112 HE22 GLN 140 2HE2 GLN 140 16.487 2.776 4.093 1113 H PHE 141 H PHE 141 8.814 3.164 3.665 1114 HA PHE 141 HA PHE 141 7.451 5.135 2.171 1115 HB2 PHE 141 2HB PHE 141 6.683 4.050 4.914 1116 HB3 PHE 141 3HB PHE 141 5.602 4.807 3.748 1117 HD1 PHE 141 HD1 PHE 141 5.253 3.617 1.493 1118 HD2 PHE 141 HD2 PHE 141 7.012 1.709 4.896 1119 HE1 PHE 141 HE1 PHE 141 4.744 1.411 0.534 1120 HE2 PHE 141 HE2 PHE 141 6.500 -0.482 3.933 1121 HZ PHE 141 HZ PHE 141 5.373 -0.637 1.744 1122 H GLU 142 H GLU 142 8.243 7.189 2.237 1123 HA GLU 142 HA GLU 142 9.077 8.400 4.778 1124 HB2 GLU 142 2HB GLU 142 9.992 10.237 3.353 1125 HB3 GLU 142 3HB GLU 142 10.683 8.658 2.998 1126 HG2 GLU 142 2HG GLU 142 9.241 8.477 0.995 1127 HG3 GLU 142 3HG GLU 142 8.556 10.063 1.355 1128 H GLY 143 H GLY 143 7.763 9.676 5.873 1129 HA2 GLY 143 2HA GLY 143 6.240 11.727 5.584 1130 HA3 GLY 143 3HA GLY 143 5.217 10.601 4.684 1131 H GLU 144 H GLU 144 4.872 12.054 7.307 1132 HA GLU 144 HA GLU 144 4.889 10.248 9.494 1133 HB2 GLU 144 2HB GLU 144 3.088 12.679 9.047 1134 HB3 GLU 144 3HB GLU 144 3.394 11.898 10.598 1135 HG2 GLU 144 2HG GLU 144 5.724 12.601 10.549 1136 HG3 GLU 144 3HG GLU 144 5.530 13.252 8.921 1137 H THR 145 H THR 145 2.723 10.666 6.827 1138 HA THR 145 HA THR 145 0.532 9.168 8.115 1139 HB THR 145 HB THR 145 0.417 10.921 5.617 1140 HG1 THR 145 HG1 THR 145 -0.512 11.580 8.229 1141 HG21 THR 145 3HG2 THR 145 -1.397 9.241 5.733 1142 HG22 THR 145 1HG2 THR 145 -2.017 10.872 5.990 1143 HG23 THR 145 2HG2 THR 145 -1.802 9.787 7.364 1144 H PHE 146 H PHE 146 0.404 7.080 7.559 1145 HA PHE 146 HA PHE 146 1.234 6.017 4.957 1146 HB2 PHE 146 2HB PHE 146 0.213 4.780 7.547 1147 HB3 PHE 146 3HB PHE 146 0.214 3.835 6.063 1148 HD1 PHE 146 HD2 PHE 146 2.464 5.677 8.439 1149 HD2 PHE 146 HD1 PHE 146 2.193 2.795 5.285 1150 HE1 PHE 146 HE2 PHE 146 4.815 5.024 8.814 1151 HE2 PHE 146 HE1 PHE 146 4.529 2.156 5.669 1152 HZ PHE 146 HZ PHE 146 5.847 3.257 7.423 1153 H TYR 147 H TYR 147 -0.185 6.065 3.279 1154 HA TYR 147 HA TYR 147 -3.090 6.028 3.773 1155 HB2 TYR 147 2HB TYR 147 -1.445 6.697 1.308 1156 HB3 TYR 147 3HB TYR 147 -3.169 6.365 1.191 1157 HD1 TYR 147 HD1 TYR 147 -0.669 8.672 2.738 1158 HD2 TYR 147 HD2 TYR 147 -4.778 8.033 1.768 1159 HE1 TYR 147 HE1 TYR 147 -1.180 11.002 3.316 1160 HE2 TYR 147 HE2 TYR 147 -5.278 10.365 2.344 1161 HH TYR 147 HH TYR 147 -2.794 12.682 2.916 1162 H ILE 148 H ILE 148 -3.972 4.096 3.912 1163 HA ILE 148 HA ILE 148 -2.890 1.812 2.367 1164 HB ILE 148 HB ILE 148 -4.709 1.829 4.825 1165 HG12 ILE 148 2HG1 ILE 148 -1.780 1.007 4.494 1166 HG13 ILE 148 3HG1 ILE 148 -2.371 2.392 5.402 1167 HG21 ILE 148 1HG2 ILE 148 -4.533 -0.613 4.797 1168 HG22 ILE 148 2HG2 ILE 148 -3.566 -0.553 3.325 1169 HG23 ILE 148 3HG2 ILE 148 -5.255 -0.039 3.295 1170 HD11 ILE 148 3HD1 ILE 148 -1.722 0.636 6.902 1171 HD12 ILE 148 1HD1 ILE 148 -2.778 -0.520 6.090 1172 HD13 ILE 148 2HD1 ILE 148 -3.471 0.837 6.982 1173 H ILE 149 H ILE 149 -3.922 1.647 0.467 1174 HA ILE 149 HA ILE 149 -6.758 2.385 0.201 1175 HB ILE 149 HB ILE 149 -4.799 1.681 -2.035 1176 HG12 ILE 149 2HG1 ILE 149 -3.949 3.696 -0.905 1177 HG13 ILE 149 3HG1 ILE 149 -4.619 4.141 -2.468 1178 HG21 ILE 149 1HG2 ILE 149 -6.495 2.781 -3.491 1179 HG22 ILE 149 2HG2 ILE 149 -7.546 2.993 -2.095 1180 HG23 ILE 149 3HG2 ILE 149 -7.142 1.369 -2.656 1181 HD11 ILE 149 3HD1 ILE 149 -5.174 5.774 -0.774 1182 HD12 ILE 149 1HD1 ILE 149 -5.952 4.535 0.211 1183 HD13 ILE 149 2HD1 ILE 149 -6.637 4.980 -1.355 1184 H GLU 150 H GLU 150 -8.070 0.723 0.596 1185 HA GLU 150 HA GLU 150 -7.542 -2.023 0.358 1186 HB2 GLU 150 2HB GLU 150 -9.343 -1.101 1.789 1187 HB3 GLU 150 3HB GLU 150 -10.214 -0.546 0.361 1188 HG2 GLU 150 2HG GLU 150 -10.419 -2.943 -0.374 1189 HG3 GLU 150 3HG GLU 150 -9.661 -3.431 1.142 1190 H GLN 151 H GLN 151 -6.940 -2.813 -1.549 1191 HA GLN 151 HA GLN 151 -8.408 -2.260 -4.029 1192 HB2 GLN 151 2HB GLN 151 -5.941 -3.978 -3.500 1193 HB3 GLN 151 3HB GLN 151 -6.663 -3.723 -5.083 1194 HG2 GLN 151 2HG GLN 151 -5.439 -1.556 -3.351 1195 HG3 GLN 151 3HG GLN 151 -4.640 -2.345 -4.713 1196 HE21 GLN 151 1HE2 GLN 151 -5.214 0.481 -4.356 1197 HE22 GLN 151 2HE2 GLN 151 -6.179 0.952 -5.708 1198 H ARG 152 H ARG 152 -10.365 -3.260 -3.653 1199 HA ARG 152 HA ARG 152 -10.612 -6.102 -3.164 1200 HB2 ARG 152 2HB ARG 152 -12.580 -3.979 -4.138 1201 HB3 ARG 152 3HB ARG 152 -13.031 -5.658 -3.865 1202 HG2 ARG 152 2HG ARG 152 -11.812 -3.988 -1.656 1203 HG3 ARG 152 3HG ARG 152 -13.540 -3.927 -2.005 1204 HD2 ARG 152 2HD ARG 152 -13.785 -6.281 -1.461 1205 HD3 ARG 152 3HD ARG 152 -12.029 -6.475 -1.331 1206 HE ARG 152 HE ARG 152 -13.020 -4.461 0.436 1207 HH11 ARG 152 1HH1 ARG 152 -12.749 -7.965 0.179 1208 HH12 ARG 152 2HH1 ARG 152 -12.734 -8.195 1.900 1209 HH21 ARG 152 1HH2 ARG 152 -12.801 -4.766 2.651 1210 HH22 ARG 152 2HH2 ARG 152 -12.762 -6.380 3.294 1211 H LEU 153 H LEU 153 -11.984 -7.331 -4.960 1212 HA LEU 153 HA LEU 153 -10.527 -7.440 -7.403 1213 HB2 LEU 153 2HB LEU 153 -13.210 -8.671 -6.663 1214 HB3 LEU 153 3HB LEU 153 -12.313 -9.056 -8.125 1215 HG LEU 153 HG LEU 153 -11.390 -9.622 -5.273 1216 HD11 LEU 153 1HD1 LEU 153 -12.291 -11.552 -7.434 1217 HD12 LEU 153 2HD1 LEU 153 -13.193 -11.120 -5.978 1218 HD13 LEU 153 3HD1 LEU 153 -11.666 -11.986 -5.840 1219 HD21 LEU 153 3HD2 LEU 153 -9.487 -10.826 -6.282 1220 HD22 LEU 153 1HD2 LEU 153 -9.454 -9.111 -6.693 1221 HD23 LEU 153 2HD2 LEU 153 -9.989 -10.294 -7.889 1222 H GLU 154 H GLU 154 -12.132 -7.583 -9.478 1223 HA GLU 154 HA GLU 154 -12.160 -4.876 -10.309 1224 HB2 GLU 154 2HB GLU 154 -13.499 -7.084 -11.940 1225 HB3 GLU 154 3HB GLU 154 -12.656 -5.659 -12.517 1226 HG2 GLU 154 2HG GLU 154 -11.233 -7.444 -13.075 1227 HG3 GLU 154 3HG GLU 154 -10.509 -6.755 -11.624 1228 H HIS 155 H HIS 155 -14.833 -7.229 -10.402 1229 HA HIS 155 HA HIS 155 -16.865 -5.159 -10.178 1230 HB2 HIS 155 2HB HIS 155 -18.486 -6.940 -10.455 1231 HB3 HIS 155 3HB HIS 155 -17.184 -7.245 -11.596 1232 HD1 HIS 155 HD1 HIS 155 -19.258 -8.954 -9.275 1233 HD2 HIS 155 HD2 HIS 155 -15.256 -9.288 -10.361 1234 HE1 HIS 155 HE1 HIS 155 -18.542 -11.240 -8.516 1235 HE2 HIS 155 HE2 HIS 155 -16.091 -11.362 -9.073 1236 H HIS 156 H HIS 156 -17.865 -4.569 -8.313 1237 HA HIS 156 HA HIS 156 -18.130 -6.097 -5.936 1238 HB2 HIS 156 2HB HIS 156 -16.654 -4.761 -4.411 1239 HB3 HIS 156 3HB HIS 156 -15.713 -5.646 -5.610 1240 HD1 HIS 156 HD1 HIS 156 -14.829 -4.143 -7.687 1241 HD2 HIS 156 HD2 HIS 156 -16.171 -2.043 -4.353 1242 HE1 HIS 156 HE1 HIS 156 -13.888 -1.831 -7.921 1243 HE2 HIS 156 HE2 HIS 156 -14.837 -0.545 -5.976 1244 H HIS 157 H HIS 157 -18.798 -4.432 -4.045 1245 HA HIS 157 HA HIS 157 -21.013 -2.936 -5.057 1246 HB2 HIS 157 2HB HIS 157 -21.093 -4.037 -2.829 1247 HB3 HIS 157 3HB HIS 157 -19.850 -2.941 -2.231 1248 HD1 HIS 157 HD1 HIS 157 -23.433 -2.888 -3.489 1249 HD2 HIS 157 HD2 HIS 157 -20.824 -0.534 -1.268 1250 HE1 HIS 157 HE1 HIS 157 -24.822 -1.002 -2.591 1251 HE2 HIS 157 HE2 HIS 157 -23.250 0.323 -1.142 1252 H HIS 158 H HIS 158 -21.312 -0.810 -5.279 1253 HA HIS 158 HA HIS 158 -19.271 1.173 -4.593 1254 HB2 HIS 158 2HB HIS 158 -19.472 2.153 -6.957 1255 HB3 HIS 158 3HB HIS 158 -18.556 0.661 -6.821 1256 HD1 HIS 158 HD1 HIS 158 -21.779 2.025 -8.237 1257 HD2 HIS 158 HD2 HIS 158 -19.608 -1.524 -8.210 1258 HE1 HIS 158 HE1 HIS 158 -22.802 0.585 -10.018 1259 HE2 HIS 158 HE2 HIS 158 -21.558 -1.593 -9.888 1260 H HIS 159 H HIS 159 -20.120 3.392 -4.801 1261 HA HIS 159 HA HIS 159 -22.819 3.612 -3.895 1262 HB2 HIS 159 2HB HIS 159 -22.461 6.034 -3.806 1263 HB3 HIS 159 3HB HIS 159 -21.048 5.215 -3.158 1264 HD1 HIS 159 HD1 HIS 159 -22.153 7.543 -5.804 1265 HD2 HIS 159 HD2 HIS 159 -18.701 5.420 -4.851 1266 HE1 HIS 159 HE1 HIS 159 -20.338 8.542 -7.209 1267 HE2 HIS 159 HE2 HIS 159 -18.275 7.215 -6.658 1268 H HIS 160 H HIS 160 -24.530 3.376 -5.133 1269 HA HIS 160 HA HIS 160 -26.019 3.295 -6.803 1270 HB2 HIS 160 2HB HIS 160 -24.405 5.622 -7.935 1271 HB3 HIS 160 3HB HIS 160 -25.884 5.029 -8.683 1272 HD1 HIS 160 HD1 HIS 160 -27.714 6.592 -8.143 1273 HD2 HIS 160 HD2 HIS 160 -25.143 6.088 -4.915 1274 HE1 HIS 160 HE1 HIS 160 -28.691 7.962 -6.279 1275 HE2 HIS 160 HE2 HIS 160 -27.218 7.490 -4.299 Start of MODEL 2 1 H1 MET 1 1H MET 1 -21.675 14.087 -17.831 2 H2 MET 1 2H MET 1 -23.350 13.971 -17.760 3 H3 MET 1 3H MET 1 -22.406 12.620 -17.412 4 HA MET 1 HA MET 1 -21.506 13.689 -15.481 5 HB2 MET 1 2HB MET 1 -22.341 15.868 -14.727 6 HB3 MET 1 3HB MET 1 -21.663 16.014 -16.341 7 HG2 MET 1 2HG MET 1 -23.968 15.963 -17.281 8 HG3 MET 1 3HG MET 1 -24.611 15.912 -15.639 9 HE1 MET 1 3HE MET 1 -23.340 19.429 -14.277 10 HE2 MET 1 1HE MET 1 -22.423 17.926 -14.207 11 HE3 MET 1 2HE MET 1 -24.148 17.924 -13.840 12 H VAL 2 H VAL 2 -24.357 12.511 -16.742 13 HA VAL 2 HA VAL 2 -25.731 12.311 -14.121 14 HB VAL 2 HB VAL 2 -27.725 11.530 -15.348 15 HG11 VAL 2 1HG1 VAL 2 -26.630 14.128 -16.480 16 HG12 VAL 2 2HG1 VAL 2 -27.469 13.930 -14.941 17 HG13 VAL 2 3HG1 VAL 2 -28.331 13.645 -16.453 18 HG21 VAL 2 3HG2 VAL 2 -27.843 11.567 -17.824 19 HG22 VAL 2 1HG2 VAL 2 -26.655 10.395 -17.252 20 HG23 VAL 2 2HG2 VAL 2 -26.120 11.941 -17.904 21 H GLU 3 H GLU 3 -23.334 10.730 -15.367 22 HA GLU 3 HA GLU 3 -24.165 8.051 -15.732 23 HB2 GLU 3 2HB GLU 3 -21.414 9.160 -15.014 24 HB3 GLU 3 3HB GLU 3 -21.721 7.477 -15.417 25 HG2 GLU 3 2HG GLU 3 -20.825 8.497 -17.370 26 HG3 GLU 3 3HG GLU 3 -22.542 8.237 -17.674 27 HA PRO 4 HA PRO 4 -24.880 6.424 -11.602 28 HB2 PRO 4 2HB PRO 4 -23.092 4.145 -12.514 29 HB3 PRO 4 3HB PRO 4 -24.689 4.088 -11.726 30 HG2 PRO 4 2HG PRO 4 -24.533 3.646 -14.319 31 HG3 PRO 4 3HG PRO 4 -25.837 4.679 -13.682 32 HD2 PRO 4 2HD PRO 4 -23.300 5.499 -15.090 33 HD3 PRO 4 3HD PRO 4 -24.944 6.166 -15.238 34 H GLY 5 H GLY 5 -23.848 6.012 -9.582 35 HA2 GLY 5 2HA GLY 5 -21.478 7.499 -9.091 36 HA3 GLY 5 3HA GLY 5 -22.321 6.480 -7.936 37 H VAL 6 H VAL 6 -19.989 6.484 -10.556 38 HA VAL 6 HA VAL 6 -18.797 3.941 -9.618 39 HB VAL 6 HB VAL 6 -17.976 3.585 -11.949 40 HG11 VAL 6 1HG1 VAL 6 -21.000 3.896 -11.791 41 HG12 VAL 6 2HG1 VAL 6 -20.066 2.495 -11.262 42 HG13 VAL 6 3HG1 VAL 6 -20.123 2.917 -12.975 43 HG21 VAL 6 3HG2 VAL 6 -18.879 4.920 -13.841 44 HG22 VAL 6 1HG2 VAL 6 -17.902 5.906 -12.751 45 HG23 VAL 6 2HG2 VAL 6 -19.661 6.013 -12.694 46 H ALA 7 H ALA 7 -16.561 3.883 -9.372 47 HA ALA 7 HA ALA 7 -15.279 6.391 -8.790 48 HB1 ALA 7 3HB ALA 7 -14.913 4.414 -7.374 49 HB2 ALA 7 1HB ALA 7 -13.384 5.003 -8.034 50 HB3 ALA 7 2HB ALA 7 -14.152 3.567 -8.721 51 H LYS 8 H LYS 8 -13.951 7.552 -10.056 52 HA LYS 8 HA LYS 8 -13.178 6.777 -12.711 53 HB2 LYS 8 2HB LYS 8 -13.635 9.152 -11.921 54 HB3 LYS 8 3HB LYS 8 -12.131 9.089 -11.020 55 HG2 LYS 8 2HG LYS 8 -11.720 10.294 -13.055 56 HG3 LYS 8 3HG LYS 8 -10.906 8.734 -13.181 57 HD2 LYS 8 2HD LYS 8 -11.990 9.279 -15.295 58 HD3 LYS 8 3HD LYS 8 -12.773 7.876 -14.568 59 HE2 LYS 8 2HE LYS 8 -14.483 9.324 -15.478 60 HE3 LYS 8 3HE LYS 8 -14.587 9.413 -13.721 61 HZ1 LYS 8 3HZ LYS 8 -13.403 11.415 -15.559 62 HZ2 LYS 8 1HZ LYS 8 -13.253 11.489 -13.882 63 HZ3 LYS 8 2HZ LYS 8 -14.777 11.594 -14.594 64 H LEU 9 H LEU 9 -11.910 6.236 -9.589 65 HA LEU 9 HA LEU 9 -9.175 5.929 -9.887 66 HB2 LEU 9 2HB LEU 9 -10.311 5.743 -7.721 67 HB3 LEU 9 3HB LEU 9 -11.154 4.298 -8.254 68 HG LEU 9 HG LEU 9 -8.930 3.100 -8.376 69 HD11 LEU 9 1HD1 LEU 9 -7.828 5.579 -7.036 70 HD12 LEU 9 2HD1 LEU 9 -7.446 5.001 -8.661 71 HD13 LEU 9 3HD1 LEU 9 -6.975 4.047 -7.258 72 HD21 LEU 9 3HD2 LEU 9 -9.671 4.208 -5.651 73 HD22 LEU 9 1HD2 LEU 9 -8.691 2.769 -5.953 74 HD23 LEU 9 2HD2 LEU 9 -10.383 2.799 -6.441 75 H THR 10 H THR 10 -7.966 4.617 -11.120 76 HA THR 10 HA THR 10 -8.927 1.963 -11.992 77 HB THR 10 HB THR 10 -7.379 3.700 -13.966 78 HG1 THR 10 HG1 THR 10 -9.863 4.290 -13.102 79 HG21 THR 10 3HG2 THR 10 -9.467 1.528 -14.421 80 HG22 THR 10 1HG2 THR 10 -7.717 1.296 -14.520 81 HG23 THR 10 2HG2 THR 10 -8.534 2.358 -15.667 82 H THR 11 H THR 11 -6.645 1.098 -13.333 83 HA THR 11 HA THR 11 -5.036 0.305 -11.158 84 HB THR 11 HB THR 11 -3.657 -0.842 -12.984 85 HG1 THR 11 HG1 THR 11 -4.777 -0.750 -15.098 86 HG21 THR 11 3HG2 THR 11 -6.673 -1.285 -13.092 87 HG22 THR 11 1HG2 THR 11 -5.568 -2.012 -11.920 88 HG23 THR 11 2HG2 THR 11 -5.440 -2.428 -13.629 89 H TYR 12 H TYR 12 -4.651 2.988 -13.367 90 HA TYR 12 HA TYR 12 -1.905 3.354 -13.478 91 HB2 TYR 12 2HB TYR 12 -2.332 5.706 -13.969 92 HB3 TYR 12 3HB TYR 12 -3.561 4.723 -14.751 93 HD1 TYR 12 HD1 TYR 12 -5.903 4.672 -13.779 94 HD2 TYR 12 HD2 TYR 12 -2.951 7.385 -12.327 95 HE1 TYR 12 HE1 TYR 12 -7.660 6.006 -12.703 96 HE2 TYR 12 HE2 TYR 12 -4.708 8.714 -11.252 97 HH TYR 12 HH TYR 12 -7.094 9.124 -11.429 98 H ALA 13 H ALA 13 -4.138 4.198 -10.887 99 HA ALA 13 HA ALA 13 -2.345 5.848 -9.389 100 HB1 ALA 13 3HB ALA 13 -4.775 6.155 -9.303 101 HB2 ALA 13 1HB ALA 13 -4.142 5.820 -7.691 102 HB3 ALA 13 2HB ALA 13 -4.974 4.552 -8.593 103 H SER 14 H SER 14 -3.160 2.420 -9.383 104 HA SER 14 HA SER 14 -1.930 1.891 -6.808 105 HB2 SER 14 2HB SER 14 -2.562 -0.505 -7.304 106 HB3 SER 14 3HB SER 14 -3.921 0.617 -7.351 107 HG SER 14 HG SER 14 -4.131 -0.592 -9.144 108 H LYS 15 H LYS 15 -1.075 1.591 -10.198 109 HA LYS 15 HA LYS 15 1.205 -0.151 -9.754 110 HB2 LYS 15 2HB LYS 15 0.273 1.315 -12.262 111 HB3 LYS 15 3HB LYS 15 1.561 0.111 -12.217 112 HG2 LYS 15 2HG LYS 15 -1.349 -0.396 -11.520 113 HG3 LYS 15 3HG LYS 15 -0.572 -0.815 -13.050 114 HD2 LYS 15 2HD LYS 15 0.918 -2.391 -11.894 115 HD3 LYS 15 3HD LYS 15 0.240 -1.921 -10.329 116 HE2 LYS 15 2HE LYS 15 -1.947 -2.811 -10.984 117 HE3 LYS 15 3HE LYS 15 -1.324 -3.221 -12.586 118 HZ1 LYS 15 3HZ LYS 15 -1.374 -5.141 -11.141 119 HZ2 LYS 15 1HZ LYS 15 -0.377 -4.371 -10.018 120 HZ3 LYS 15 2HZ LYS 15 0.218 -4.760 -11.552 121 H GLN 16 H GLN 16 0.725 3.276 -10.692 122 HA GLN 16 HA GLN 16 3.466 3.996 -10.778 123 HB2 GLN 16 2HB GLN 16 1.027 5.736 -10.218 124 HB3 GLN 16 3HB GLN 16 2.649 6.367 -10.491 125 HG2 GLN 16 2HG GLN 16 0.975 4.818 -12.490 126 HG3 GLN 16 3HG GLN 16 1.281 6.553 -12.510 127 HE21 GLN 16 1HE2 GLN 16 1.855 4.584 -14.585 128 HE22 GLN 16 2HE2 GLN 16 3.555 4.662 -14.873 129 H ALA 17 H ALA 17 1.121 3.791 -8.161 130 HA ALA 17 HA ALA 17 2.516 5.045 -6.088 131 HB1 ALA 17 3HB ALA 17 0.167 4.368 -5.897 132 HB2 ALA 17 1HB ALA 17 1.115 3.706 -4.565 133 HB3 ALA 17 2HB ALA 17 0.638 2.668 -5.914 134 H THR 18 H THR 18 2.454 1.570 -6.969 135 HA THR 18 HA THR 18 4.378 0.741 -5.054 136 HB THR 18 HB THR 18 4.454 -1.394 -6.426 137 HG1 THR 18 HG1 THR 18 3.749 -0.043 -8.421 138 HG21 THR 18 3HG2 THR 18 2.813 -1.089 -4.607 139 HG22 THR 18 1HG2 THR 18 2.169 -2.073 -5.920 140 HG23 THR 18 2HG2 THR 18 1.678 -0.388 -5.763 141 H ASP 19 H ASP 19 4.662 1.981 -8.290 142 HA ASP 19 HA ASP 19 7.322 1.238 -8.893 143 HB2 ASP 19 2HB ASP 19 5.749 2.056 -10.602 144 HB3 ASP 19 3HB ASP 19 5.661 3.627 -9.818 145 H MET 20 H MET 20 5.944 4.086 -7.254 146 HA MET 20 HA MET 20 8.508 5.411 -6.895 147 HB2 MET 20 2HB MET 20 5.728 6.116 -5.857 148 HB3 MET 20 3HB MET 20 7.151 7.137 -5.668 149 HG2 MET 20 2HG MET 20 7.310 7.431 -8.077 150 HG3 MET 20 3HG MET 20 5.974 6.309 -8.334 151 HE1 MET 20 3HE MET 20 3.440 6.836 -7.651 152 HE2 MET 20 1HE MET 20 2.952 8.307 -6.815 153 HE3 MET 20 2HE MET 20 3.956 7.120 -5.988 154 H GLY 21 H GLY 21 6.340 3.444 -4.929 155 HA2 GLY 21 2HA GLY 21 7.926 2.351 -3.118 156 HA3 GLY 21 3HA GLY 21 7.831 3.976 -2.450 157 H ALA 22 H ALA 22 5.798 1.298 -3.576 158 HA ALA 22 HA ALA 22 4.249 1.404 -1.113 159 HB1 ALA 22 3HB ALA 22 2.938 2.850 -2.643 160 HB2 ALA 22 1HB ALA 22 2.061 1.378 -2.217 161 HB3 ALA 22 2HB ALA 22 2.831 1.524 -3.801 162 H ILE 23 H ILE 23 2.794 -0.512 -0.960 163 HA ILE 23 HA ILE 23 3.857 -2.907 -2.333 164 HB ILE 23 HB ILE 23 3.943 -4.126 -0.144 165 HG12 ILE 23 2HG1 ILE 23 3.417 -1.379 1.107 166 HG13 ILE 23 3HG1 ILE 23 2.323 -2.754 1.141 167 HG21 ILE 23 1HG2 ILE 23 6.021 -3.154 -1.042 168 HG22 ILE 23 2HG2 ILE 23 6.030 -3.144 0.721 169 HG23 ILE 23 3HG2 ILE 23 5.710 -1.652 -0.168 170 HD11 ILE 23 3HD1 ILE 23 3.412 -2.452 3.272 171 HD12 ILE 23 1HD1 ILE 23 5.003 -2.591 2.523 172 HD13 ILE 23 2HD1 ILE 23 3.911 -3.979 2.549 173 H TYR 24 H TYR 24 2.350 -4.596 -2.543 174 HA TYR 24 HA TYR 24 -0.441 -4.047 -1.750 175 HB2 TYR 24 2HB TYR 24 0.694 -6.253 -3.533 176 HB3 TYR 24 3HB TYR 24 -1.009 -6.013 -3.178 177 HD1 TYR 24 HD1 TYR 24 -2.051 -3.709 -3.926 178 HD2 TYR 24 HD2 TYR 24 1.615 -5.276 -5.468 179 HE1 TYR 24 HE1 TYR 24 -2.311 -2.339 -5.959 180 HE2 TYR 24 HE2 TYR 24 1.359 -3.902 -7.477 181 HH TYR 24 HH TYR 24 -0.715 -1.366 -7.768 182 H VAL 25 H VAL 25 -0.967 -4.811 0.165 183 HA VAL 25 HA VAL 25 -0.019 -7.451 1.092 184 HB VAL 25 HB VAL 25 -0.538 -6.791 3.373 185 HG11 VAL 25 1HG1 VAL 25 1.127 -4.630 2.028 186 HG12 VAL 25 2HG1 VAL 25 1.698 -6.205 2.586 187 HG13 VAL 25 3HG1 VAL 25 1.139 -5.010 3.756 188 HG21 VAL 25 3HG2 VAL 25 -1.314 -4.523 4.005 189 HG22 VAL 25 1HG2 VAL 25 -2.503 -5.366 3.008 190 HG23 VAL 25 2HG2 VAL 25 -1.489 -4.108 2.297 191 H ASN 26 H ASN 26 -1.944 -8.267 2.740 192 HA ASN 26 HA ASN 26 -4.581 -7.841 1.418 193 HB2 ASN 26 2HB ASN 26 -5.172 -10.178 1.901 194 HB3 ASN 26 3HB ASN 26 -3.729 -10.119 0.896 195 HD21 ASN 26 1HD2 ASN 26 -1.700 -10.616 1.881 196 HD22 ASN 26 2HD2 ASN 26 -1.645 -11.605 3.295 197 H SER 27 H SER 27 -6.167 -9.172 3.325 198 HA SER 27 HA SER 27 -6.415 -7.096 5.260 199 HB2 SER 27 2HB SER 27 -8.370 -8.253 4.284 200 HB3 SER 27 3HB SER 27 -7.908 -9.735 5.113 201 HG SER 27 HG SER 27 -8.070 -7.639 6.843 202 H LYS 28 H LYS 28 -4.519 -9.950 5.372 203 HA LYS 28 HA LYS 28 -4.274 -9.889 8.292 204 HB2 LYS 28 2HB LYS 28 -2.695 -11.489 6.218 205 HB3 LYS 28 3HB LYS 28 -2.471 -11.601 7.960 206 HG2 LYS 28 2HG LYS 28 -4.941 -12.407 6.396 207 HG3 LYS 28 3HG LYS 28 -3.784 -13.478 7.198 208 HD2 LYS 28 2HD LYS 28 -4.432 -12.433 9.397 209 HD3 LYS 28 3HD LYS 28 -5.675 -11.507 8.547 210 HE2 LYS 28 2HE LYS 28 -6.689 -13.445 9.582 211 HE3 LYS 28 3HE LYS 28 -6.718 -13.672 7.830 212 HZ1 LYS 28 3HZ LYS 28 -4.907 -15.166 7.969 213 HZ2 LYS 28 1HZ LYS 28 -6.008 -15.649 9.148 214 HZ3 LYS 28 2HZ LYS 28 -4.613 -14.806 9.590 215 H GLY 29 H GLY 29 -2.304 -9.198 5.409 216 HA2 GLY 29 2HA GLY 29 -1.151 -6.997 5.414 217 HA3 GLY 29 3HA GLY 29 -0.552 -7.402 7.016 218 H ASP 30 H ASP 30 -0.698 -10.064 4.827 219 HA ASP 30 HA ASP 30 2.156 -10.280 4.584 220 HB2 ASP 30 2HB ASP 30 0.115 -11.745 2.831 221 HB3 ASP 30 3HB ASP 30 1.773 -12.227 3.173 222 H ARG 31 H ARG 31 3.318 -8.968 3.224 223 HA ARG 31 HA ARG 31 2.442 -7.667 0.901 224 HB2 ARG 31 2HB ARG 31 5.145 -8.682 1.808 225 HB3 ARG 31 3HB ARG 31 4.970 -8.015 0.189 226 HG2 ARG 31 2HG ARG 31 4.341 -5.858 1.044 227 HG3 ARG 31 3HG ARG 31 4.208 -6.482 2.693 228 HD2 ARG 31 2HD ARG 31 6.345 -5.156 2.082 229 HD3 ARG 31 3HD ARG 31 6.552 -6.692 2.931 230 HE ARG 31 HE ARG 31 7.081 -7.719 0.782 231 HH11 ARG 31 1HH1 ARG 31 7.433 -4.242 0.971 232 HH12 ARG 31 2HH1 ARG 31 8.557 -4.177 -0.350 233 HH21 ARG 31 1HH2 ARG 31 8.505 -7.615 -0.946 234 HH22 ARG 31 2HH2 ARG 31 9.166 -6.082 -1.433 235 H ILE 32 H ILE 32 1.158 -8.831 -0.413 236 HA ILE 32 HA ILE 32 1.640 -11.535 -1.219 237 HB ILE 32 HB ILE 32 -0.315 -11.315 -2.638 238 HG12 ILE 32 2HG1 ILE 32 -0.280 -8.308 -2.098 239 HG13 ILE 32 3HG1 ILE 32 0.154 -9.065 -3.625 240 HG21 ILE 32 1HG2 ILE 32 -2.019 -10.647 -0.994 241 HG22 ILE 32 2HG2 ILE 32 -0.788 -9.818 -0.038 242 HG23 ILE 32 3HG2 ILE 32 -0.727 -11.572 -0.227 243 HD11 ILE 32 3HD1 ILE 32 -2.141 -9.885 -3.872 244 HD12 ILE 32 1HD1 ILE 32 -2.072 -8.130 -3.723 245 HD13 ILE 32 2HD1 ILE 32 -2.582 -9.109 -2.347 246 H VAL 33 H VAL 33 2.302 -8.370 -2.519 247 HA VAL 33 HA VAL 33 4.593 -9.228 -3.932 248 HB VAL 33 HB VAL 33 2.993 -9.890 -5.689 249 HG11 VAL 33 1HG1 VAL 33 2.006 -7.023 -5.700 250 HG12 VAL 33 2HG1 VAL 33 1.109 -8.433 -5.140 251 HG13 VAL 33 3HG1 VAL 33 1.532 -8.281 -6.847 252 HG21 VAL 33 3HG2 VAL 33 4.525 -7.386 -6.494 253 HG22 VAL 33 1HG2 VAL 33 3.953 -8.653 -7.585 254 HG23 VAL 33 2HG2 VAL 33 5.191 -9.017 -6.384 255 H ASN 34 H ASN 34 5.991 -7.466 -4.153 256 HA ASN 34 HA ASN 34 5.349 -5.025 -2.772 257 HB2 ASN 34 2HB ASN 34 7.659 -6.152 -2.916 258 HB3 ASN 34 3HB ASN 34 7.785 -5.532 -4.551 259 HD21 ASN 34 1HD2 ASN 34 6.495 -2.870 -3.730 260 HD22 ASN 34 2HD2 ASN 34 7.748 -2.066 -2.876 261 H GLU 35 H GLU 35 6.457 -5.625 -6.087 262 HA GLU 35 HA GLU 35 4.632 -3.800 -7.349 263 HB2 GLU 35 2HB GLU 35 6.557 -2.336 -8.243 264 HB3 GLU 35 3HB GLU 35 6.072 -2.073 -6.581 265 HG2 GLU 35 2HG GLU 35 8.468 -1.954 -6.737 266 HG3 GLU 35 3HG GLU 35 8.012 -3.373 -5.795 267 H SER 36 H SER 36 5.649 -3.455 -9.768 268 HA SER 36 HA SER 36 5.813 -4.461 -11.788 269 HB2 SER 36 2HB SER 36 8.211 -4.417 -11.167 270 HB3 SER 36 3HB SER 36 8.054 -5.997 -10.398 271 HG SER 36 HG SER 36 7.568 -6.877 -12.440 272 H ASN 37 H ASN 37 3.686 -5.393 -11.394 273 HA ASN 37 HA ASN 37 3.633 -8.325 -11.392 274 HB2 ASN 37 2HB ASN 37 1.803 -8.346 -9.692 275 HB3 ASN 37 3HB ASN 37 3.318 -7.740 -9.035 276 HD21 ASN 37 1HD2 ASN 37 3.545 -5.420 -8.853 277 HD22 ASN 37 2HD2 ASN 37 2.165 -4.442 -8.534 278 H VAL 38 H VAL 38 2.396 -9.002 -12.961 279 HA VAL 38 HA VAL 38 0.489 -7.358 -14.396 280 HB VAL 38 HB VAL 38 1.922 -9.073 -15.511 281 HG11 VAL 38 1HG1 VAL 38 0.281 -11.140 -14.018 282 HG12 VAL 38 2HG1 VAL 38 1.980 -10.757 -13.736 283 HG13 VAL 38 3HG1 VAL 38 1.482 -11.478 -15.270 284 HG21 VAL 38 3HG2 VAL 38 0.225 -10.095 -16.977 285 HG22 VAL 38 1HG2 VAL 38 -0.163 -8.407 -16.633 286 HG23 VAL 38 2HG2 VAL 38 -1.038 -9.699 -15.808 287 H TYR 39 H TYR 39 -1.848 -8.160 -14.658 288 HA TYR 39 HA TYR 39 -3.271 -8.317 -12.286 289 HB2 TYR 39 2HB TYR 39 -5.246 -8.941 -13.628 290 HB3 TYR 39 3HB TYR 39 -4.314 -7.691 -14.447 291 HD1 TYR 39 HD1 TYR 39 -5.307 -11.273 -14.556 292 HD2 TYR 39 HD2 TYR 39 -3.193 -8.163 -16.587 293 HE1 TYR 39 HE1 TYR 39 -5.191 -12.670 -16.564 294 HE2 TYR 39 HE2 TYR 39 -3.068 -9.567 -18.601 295 HH TYR 39 HH TYR 39 -3.154 -11.949 -19.196 296 H THR 40 H THR 40 -1.900 -10.923 -14.200 297 HA THR 40 HA THR 40 -3.215 -13.133 -13.080 298 HB THR 40 HB THR 40 -0.349 -13.113 -14.139 299 HG1 THR 40 HG1 THR 40 -2.578 -13.549 -15.815 300 HG21 THR 40 3HG2 THR 40 -2.512 -15.249 -14.231 301 HG22 THR 40 1HG2 THR 40 -1.089 -15.274 -13.181 302 HG23 THR 40 2HG2 THR 40 -0.897 -15.386 -14.933 303 H THR 41 H THR 41 -0.095 -11.578 -12.227 304 HA THR 41 HA THR 41 0.639 -13.257 -10.083 305 HB THR 41 HB THR 41 1.371 -10.317 -10.493 306 HG1 THR 41 HG1 THR 41 3.385 -11.593 -11.256 307 HG21 THR 41 3HG2 THR 41 3.385 -10.821 -9.152 308 HG22 THR 41 1HG2 THR 41 2.809 -12.466 -8.877 309 HG23 THR 41 2HG2 THR 41 1.926 -11.094 -8.200 310 H PHE 42 H PHE 42 -1.027 -10.124 -10.151 311 HA PHE 42 HA PHE 42 -1.309 -9.702 -7.389 312 HB2 PHE 42 2HB PHE 42 -1.526 -7.907 -9.071 313 HB3 PHE 42 3HB PHE 42 -2.960 -8.670 -9.742 314 HD1 PHE 42 HD1 PHE 42 -1.672 -7.274 -6.497 315 HD2 PHE 42 HD2 PHE 42 -5.076 -7.865 -9.030 316 HE1 PHE 42 HE1 PHE 42 -3.059 -5.954 -4.959 317 HE2 PHE 42 HE2 PHE 42 -6.453 -6.538 -7.478 318 HZ PHE 42 HZ PHE 42 -5.443 -5.589 -5.443 319 H ARG 43 H ARG 43 -3.481 -11.207 -9.772 320 HA ARG 43 HA ARG 43 -5.729 -11.580 -8.085 321 HB2 ARG 43 2HB ARG 43 -5.882 -11.584 -10.573 322 HB3 ARG 43 3HB ARG 43 -4.961 -13.083 -10.632 323 HG2 ARG 43 2HG ARG 43 -6.790 -14.255 -9.444 324 HG3 ARG 43 3HG ARG 43 -7.711 -12.749 -9.375 325 HD2 ARG 43 2HD ARG 43 -8.538 -14.131 -11.204 326 HD3 ARG 43 3HD ARG 43 -7.759 -12.690 -11.861 327 HE ARG 43 HE ARG 43 -6.348 -15.282 -11.706 328 HH11 ARG 43 1HH1 ARG 43 -7.404 -12.521 -13.637 329 HH12 ARG 43 2HH1 ARG 43 -6.550 -13.043 -15.054 330 HH21 ARG 43 1HH2 ARG 43 -5.295 -15.965 -13.571 331 HH22 ARG 43 2HH2 ARG 43 -5.352 -14.999 -15.014 332 H ASN 44 H ASN 44 -3.282 -13.912 -9.293 333 HA ASN 44 HA ASN 44 -4.145 -16.171 -7.864 334 HB2 ASN 44 2HB ASN 44 -1.390 -15.492 -8.978 335 HB3 ASN 44 3HB ASN 44 -1.797 -17.071 -8.308 336 HD21 ASN 44 1HD2 ASN 44 -0.968 -16.363 -11.028 337 HD22 ASN 44 2HD2 ASN 44 -2.219 -16.935 -12.074 338 H ALA 45 H ALA 45 -1.984 -13.571 -6.941 339 HA ALA 45 HA ALA 45 -0.912 -14.662 -4.580 340 HB1 ALA 45 3HB ALA 45 -0.033 -12.643 -5.721 341 HB2 ALA 45 1HB ALA 45 -0.321 -12.376 -4.003 342 HB3 ALA 45 2HB ALA 45 -1.458 -11.742 -5.195 343 H ILE 46 H ILE 46 -3.812 -12.637 -5.136 344 HA ILE 46 HA ILE 46 -4.781 -12.599 -2.458 345 HB ILE 46 HB ILE 46 -6.301 -12.211 -5.087 346 HG12 ILE 46 2HG1 ILE 46 -5.175 -10.127 -3.152 347 HG13 ILE 46 3HG1 ILE 46 -4.493 -10.532 -4.722 348 HG21 ILE 46 1HG2 ILE 46 -8.061 -11.098 -3.744 349 HG22 ILE 46 2HG2 ILE 46 -7.205 -11.532 -2.265 350 HG23 ILE 46 3HG2 ILE 46 -7.875 -12.795 -3.298 351 HD11 ILE 46 3HD1 ILE 46 -6.535 -9.702 -5.813 352 HD12 ILE 46 1HD1 ILE 46 -5.735 -8.470 -4.839 353 HD13 ILE 46 2HD1 ILE 46 -7.188 -9.260 -4.232 354 H LEU 47 H LEU 47 -5.368 -14.785 -5.213 355 HA LEU 47 HA LEU 47 -7.501 -16.310 -4.161 356 HB2 LEU 47 2HB LEU 47 -5.325 -17.318 -6.051 357 HB3 LEU 47 3HB LEU 47 -6.907 -18.040 -5.807 358 HG LEU 47 HG LEU 47 -6.330 -15.390 -7.172 359 HD11 LEU 47 1HD1 LEU 47 -7.139 -16.482 -9.208 360 HD12 LEU 47 2HD1 LEU 47 -7.333 -18.000 -8.326 361 HD13 LEU 47 3HD1 LEU 47 -5.726 -17.304 -8.546 362 HD21 LEU 47 3HD2 LEU 47 -9.012 -16.708 -6.703 363 HD22 LEU 47 1HD2 LEU 47 -8.720 -15.285 -7.707 364 HD23 LEU 47 2HD2 LEU 47 -8.434 -15.209 -5.972 365 H LYS 48 H LYS 48 -4.027 -16.453 -3.735 366 HA LYS 48 HA LYS 48 -3.885 -19.005 -2.416 367 HB2 LYS 48 2HB LYS 48 -2.021 -17.954 -3.734 368 HB3 LYS 48 3HB LYS 48 -1.858 -16.725 -2.485 369 HG2 LYS 48 2HG LYS 48 -1.203 -18.472 -0.847 370 HG3 LYS 48 3HG LYS 48 -1.401 -19.709 -2.092 371 HD2 LYS 48 2HD LYS 48 0.964 -19.187 -1.872 372 HD3 LYS 48 3HD LYS 48 0.397 -18.606 -3.438 373 HE2 LYS 48 2HE LYS 48 1.839 -16.927 -2.487 374 HE3 LYS 48 3HE LYS 48 0.193 -16.300 -2.423 375 HZ1 LYS 48 3HZ LYS 48 1.694 -17.525 -0.168 376 HZ2 LYS 48 1HZ LYS 48 0.102 -16.970 -0.084 377 HZ3 LYS 48 2HZ LYS 48 1.361 -15.880 -0.361 378 H GLN 49 H GLN 49 -4.563 -15.744 -1.343 379 HA GLN 49 HA GLN 49 -3.653 -16.052 1.384 380 HB2 GLN 49 2HB GLN 49 -5.535 -13.929 0.251 381 HB3 GLN 49 3HB GLN 49 -4.691 -13.860 1.797 382 HG2 GLN 49 2HG GLN 49 -3.432 -13.784 -0.947 383 HG3 GLN 49 3HG GLN 49 -3.606 -12.432 0.165 384 HE21 GLN 49 1HE2 GLN 49 -1.219 -13.765 -1.072 385 HE22 GLN 49 2HE2 GLN 49 -0.170 -14.101 0.263 386 H ALA 50 H ALA 50 -5.046 -15.875 3.255 387 HA ALA 50 HA ALA 50 -7.303 -17.631 3.323 388 HB1 ALA 50 3HB ALA 50 -7.450 -16.975 5.696 389 HB2 ALA 50 1HB ALA 50 -6.312 -15.649 5.417 390 HB3 ALA 50 2HB ALA 50 -5.783 -17.324 5.244 391 H ASP 51 H ASP 51 -6.921 -14.278 2.710 392 HA ASP 51 HA ASP 51 -9.824 -13.728 2.936 393 HB2 ASP 51 2HB ASP 51 -8.009 -12.352 4.266 394 HB3 ASP 51 3HB ASP 51 -7.656 -11.597 2.717 395 H LYS 52 H LYS 52 -10.457 -11.921 1.201 396 HA LYS 52 HA LYS 52 -9.393 -12.804 -1.414 397 HB2 LYS 52 2HB LYS 52 -11.621 -13.889 -0.602 398 HB3 LYS 52 3HB LYS 52 -12.355 -12.322 -0.914 399 HG2 LYS 52 2HG LYS 52 -12.689 -13.888 -2.778 400 HG3 LYS 52 3HG LYS 52 -11.744 -12.483 -3.287 401 HD2 LYS 52 2HD LYS 52 -9.680 -13.772 -3.189 402 HD3 LYS 52 3HD LYS 52 -10.529 -15.162 -2.499 403 HE2 LYS 52 2HE LYS 52 -10.961 -14.011 -5.274 404 HE3 LYS 52 3HE LYS 52 -10.080 -15.491 -4.883 405 HZ1 LYS 52 3HZ LYS 52 -12.131 -16.411 -3.976 406 HZ2 LYS 52 1HZ LYS 52 -12.305 -15.992 -5.604 407 HZ3 LYS 52 2HZ LYS 52 -12.968 -15.006 -4.404 408 H VAL 53 H VAL 53 -9.105 -10.266 0.305 409 HA VAL 53 HA VAL 53 -9.200 -8.533 -2.066 410 HB VAL 53 HB VAL 53 -11.186 -7.851 -0.774 411 HG11 VAL 53 1HG1 VAL 53 -10.551 -8.513 1.477 412 HG12 VAL 53 2HG1 VAL 53 -11.019 -6.813 1.449 413 HG13 VAL 53 3HG1 VAL 53 -9.309 -7.257 1.534 414 HG21 VAL 53 3HG2 VAL 53 -10.755 -5.447 -0.579 415 HG22 VAL 53 1HG2 VAL 53 -9.970 -6.106 -2.016 416 HG23 VAL 53 2HG2 VAL 53 -9.012 -5.738 -0.579 417 H ALA 54 H ALA 54 -7.556 -7.050 -2.202 418 HA ALA 54 HA ALA 54 -5.290 -7.375 -0.334 419 HB1 ALA 54 3HB ALA 54 -5.336 -6.349 -3.197 420 HB2 ALA 54 1HB ALA 54 -4.823 -7.955 -2.675 421 HB3 ALA 54 2HB ALA 54 -3.896 -6.536 -2.187 422 H TYR 55 H TYR 55 -3.933 -5.324 -0.210 423 HA TYR 55 HA TYR 55 -5.446 -2.826 -0.118 424 HB2 TYR 55 2HB TYR 55 -4.304 -4.256 2.320 425 HB3 TYR 55 3HB TYR 55 -4.492 -2.509 2.304 426 HD1 TYR 55 HD1 TYR 55 -6.744 -1.481 2.283 427 HD2 TYR 55 HD2 TYR 55 -6.289 -5.727 2.525 428 HE1 TYR 55 HE1 TYR 55 -9.060 -1.682 3.048 429 HE2 TYR 55 HE2 TYR 55 -8.622 -5.923 3.289 430 HH TYR 55 HH TYR 55 -10.819 -3.251 3.166 431 H LEU 56 H LEU 56 -4.179 -1.389 -1.033 432 HA LEU 56 HA LEU 56 -1.338 -1.711 -1.378 433 HB2 LEU 56 2HB LEU 56 -2.815 -0.872 -3.178 434 HB3 LEU 56 3HB LEU 56 -3.261 0.506 -2.186 435 HG LEU 56 HG LEU 56 -0.906 1.332 -2.301 436 HD11 LEU 56 1HD1 LEU 56 0.261 -0.784 -2.577 437 HD12 LEU 56 2HD1 LEU 56 0.676 0.324 -3.879 438 HD13 LEU 56 3HD1 LEU 56 -0.452 -1.000 -4.178 439 HD21 LEU 56 3HD2 LEU 56 -2.206 0.823 -4.994 440 HD22 LEU 56 1HD2 LEU 56 -0.975 2.043 -4.655 441 HD23 LEU 56 2HD2 LEU 56 -2.559 2.159 -3.895 442 H VAL 57 H VAL 57 -0.237 -1.369 0.532 443 HA VAL 57 HA VAL 57 -0.783 0.976 2.202 444 HB VAL 57 HB VAL 57 1.339 -1.204 2.524 445 HG11 VAL 57 1HG1 VAL 57 1.644 -0.347 4.823 446 HG12 VAL 57 2HG1 VAL 57 0.505 0.962 4.495 447 HG13 VAL 57 3HG1 VAL 57 2.039 0.887 3.624 448 HG21 VAL 57 3HG2 VAL 57 -0.935 -2.106 2.752 449 HG22 VAL 57 1HG2 VAL 57 -1.327 -0.872 3.953 450 HG23 VAL 57 2HG2 VAL 57 -0.111 -2.103 4.311 451 H MET 58 H MET 58 0.134 2.839 1.754 452 HA MET 58 HA MET 58 2.823 3.041 0.547 453 HB2 MET 58 2HB MET 58 2.096 4.805 -0.951 454 HB3 MET 58 3HB MET 58 0.990 3.461 -1.185 455 HG2 MET 58 2HG MET 58 -0.709 4.591 0.158 456 HG3 MET 58 3HG MET 58 0.408 5.911 0.497 457 HE1 MET 58 3HE MET 58 -1.536 5.081 -3.602 458 HE2 MET 58 1HE MET 58 -1.949 4.230 -2.115 459 HE3 MET 58 2HE MET 58 -0.386 3.951 -2.888 460 H ASP 59 H ASP 59 3.562 5.415 0.799 461 HA ASP 59 HA ASP 59 2.774 6.539 3.427 462 HB2 ASP 59 2HB ASP 59 5.210 6.043 2.926 463 HB3 ASP 59 3HB ASP 59 5.153 7.222 1.622 464 H GLU 60 H GLU 60 2.734 9.046 3.410 465 HA GLU 60 HA GLU 60 0.766 9.910 1.550 466 HB2 GLU 60 2HB GLU 60 0.916 10.707 3.922 467 HB3 GLU 60 3HB GLU 60 2.350 11.634 3.495 468 HG2 GLU 60 2HG GLU 60 1.042 12.987 1.918 469 HG3 GLU 60 3HG GLU 60 -0.390 12.016 2.236 470 H ARG 61 H ARG 61 4.265 10.249 1.654 471 HA ARG 61 HA ARG 61 4.738 12.171 -0.320 472 HB2 ARG 61 2HB ARG 61 6.214 9.656 0.528 473 HB3 ARG 61 3HB ARG 61 6.804 10.578 -0.847 474 HG2 ARG 61 2HG ARG 61 6.463 11.657 1.970 475 HG3 ARG 61 3HG ARG 61 7.985 11.155 1.226 476 HD2 ARG 61 2HD ARG 61 7.588 12.896 -0.568 477 HD3 ARG 61 3HD ARG 61 6.206 13.462 0.379 478 HE ARG 61 HE ARG 61 8.444 13.438 2.053 479 HH11 ARG 61 1HH1 ARG 61 7.321 15.198 -0.808 480 HH12 ARG 61 2HH1 ARG 61 8.222 16.634 -0.413 481 HH21 ARG 61 1HH2 ARG 61 9.626 15.307 2.524 482 HH22 ARG 61 2HH2 ARG 61 9.528 16.691 1.478 483 H THR 62 H THR 62 4.262 8.674 -0.682 484 HA THR 62 HA THR 62 4.259 8.530 -3.501 485 HB THR 62 HB THR 62 2.877 6.699 -1.478 486 HG1 THR 62 HG1 THR 62 5.049 5.557 -1.976 487 HG21 THR 62 3HG2 THR 62 2.215 6.192 -3.805 488 HG22 THR 62 1HG2 THR 62 3.244 4.916 -3.146 489 HG23 THR 62 2HG2 THR 62 3.913 6.097 -4.274 490 H TRP 63 H TRP 63 1.743 9.101 -1.095 491 HA TRP 63 HA TRP 63 -0.511 8.909 -2.797 492 HB2 TRP 63 2HB TRP 63 -0.806 8.595 -0.417 493 HB3 TRP 63 3HB TRP 63 -0.165 10.195 -0.060 494 HD1 TRP 63 HD1 TRP 63 -1.883 12.183 -0.019 495 HE1 TRP 63 HE1 TRP 63 -4.405 12.391 -0.461 496 HE3 TRP 63 HE3 TRP 63 -2.799 7.527 -1.975 497 HZ2 TRP 63 HZ2 TRP 63 -6.490 10.832 -1.470 498 HZ3 TRP 63 HZ3 TRP 63 -5.102 6.978 -2.656 499 HH2 TRP 63 HH2 TRP 63 -6.914 8.601 -2.408 500 H LYS 64 H LYS 64 1.644 11.648 -2.037 501 HA LYS 64 HA LYS 64 0.033 13.797 -2.800 502 HB2 LYS 64 2HB LYS 64 3.024 13.479 -3.290 503 HB3 LYS 64 3HB LYS 64 2.146 15.002 -3.378 504 HG2 LYS 64 2HG LYS 64 2.665 13.318 -0.925 505 HG3 LYS 64 3HG LYS 64 3.315 14.915 -1.298 506 HD2 LYS 64 2HD LYS 64 0.904 15.772 -1.242 507 HD3 LYS 64 3HD LYS 64 0.444 14.197 -0.593 508 HE2 LYS 64 2HE LYS 64 2.012 14.565 1.310 509 HE3 LYS 64 3HE LYS 64 2.373 16.167 0.663 510 HZ1 LYS 64 3HZ LYS 64 -0.304 15.242 1.556 511 HZ2 LYS 64 1HZ LYS 64 0.067 16.783 0.980 512 HZ3 LYS 64 2HZ LYS 64 0.726 16.243 2.438 513 H LYS 65 H LYS 65 1.887 11.554 -4.731 514 HA LYS 65 HA LYS 65 1.424 12.783 -7.280 515 HB2 LYS 65 2HB LYS 65 2.318 9.953 -6.583 516 HB3 LYS 65 3HB LYS 65 2.459 10.716 -8.165 517 HG2 LYS 65 2HG LYS 65 3.871 11.658 -5.642 518 HG3 LYS 65 3HG LYS 65 4.606 10.661 -6.898 519 HD2 LYS 65 2HD LYS 65 3.548 13.492 -7.268 520 HD3 LYS 65 3HD LYS 65 5.247 13.032 -7.127 521 HE2 LYS 65 2HE LYS 65 5.056 11.699 -9.205 522 HE3 LYS 65 3HE LYS 65 3.360 12.167 -9.347 523 HZ1 LYS 65 3HZ LYS 65 5.711 13.974 -9.493 524 HZ2 LYS 65 1HZ LYS 65 4.104 14.496 -9.472 525 HZ3 LYS 65 2HZ LYS 65 4.664 13.553 -10.754 526 H VAL 66 H VAL 66 0.096 9.920 -5.578 527 HA VAL 66 HA VAL 66 -1.635 8.972 -7.577 528 HB VAL 66 HB VAL 66 -1.863 8.707 -4.537 529 HG11 VAL 66 1HG1 VAL 66 -3.279 7.071 -6.679 530 HG12 VAL 66 2HG1 VAL 66 -4.041 8.196 -5.554 531 HG13 VAL 66 3HG1 VAL 66 -3.291 6.720 -4.948 532 HG21 VAL 66 3HG2 VAL 66 -0.785 6.500 -4.862 533 HG22 VAL 66 1HG2 VAL 66 0.247 7.811 -5.439 534 HG23 VAL 66 2HG2 VAL 66 -0.644 6.817 -6.595 535 H TYR 67 H TYR 67 -2.404 11.028 -4.790 536 HA TYR 67 HA TYR 67 -5.046 11.675 -5.134 537 HB2 TYR 67 2HB TYR 67 -3.719 12.278 -3.148 538 HB3 TYR 67 3HB TYR 67 -2.746 13.390 -4.092 539 HD1 TYR 67 HD1 TYR 67 -6.084 12.857 -2.560 540 HD2 TYR 67 HD2 TYR 67 -3.537 15.671 -4.531 541 HE1 TYR 67 HE1 TYR 67 -7.606 14.681 -1.929 542 HE2 TYR 67 HE2 TYR 67 -5.063 17.493 -3.904 543 HH TYR 67 HH TYR 67 -7.419 17.796 -3.297 544 H ASP 68 H ASP 68 -2.194 13.308 -6.517 545 HA ASP 68 HA ASP 68 -3.545 15.339 -7.950 546 HB2 ASP 68 2HB ASP 68 -1.144 15.521 -7.484 547 HB3 ASP 68 3HB ASP 68 -0.810 14.073 -8.427 548 H LEU 69 H LEU 69 -2.463 12.084 -8.876 549 HA LEU 69 HA LEU 69 -3.126 12.178 -11.629 550 HB2 LEU 69 2HB LEU 69 -2.865 9.785 -9.756 551 HB3 LEU 69 3HB LEU 69 -2.991 9.662 -11.502 552 HG LEU 69 HG LEU 69 -0.689 10.910 -9.958 553 HD11 LEU 69 1HD1 LEU 69 -0.714 8.469 -9.807 554 HD12 LEU 69 2HD1 LEU 69 0.640 9.023 -10.787 555 HD13 LEU 69 3HD1 LEU 69 -0.788 8.337 -11.569 556 HD21 LEU 69 3HD2 LEU 69 -1.002 10.609 -12.956 557 HD22 LEU 69 1HD2 LEU 69 0.438 11.179 -12.114 558 HD23 LEU 69 2HD2 LEU 69 -1.046 12.123 -12.051 559 H LEU 70 H LEU 70 -5.009 11.427 -8.749 560 HA LEU 70 HA LEU 70 -7.265 10.239 -9.985 561 HB2 LEU 70 2HB LEU 70 -7.038 11.800 -7.375 562 HB3 LEU 70 3HB LEU 70 -8.485 10.936 -7.870 563 HG LEU 70 HG LEU 70 -5.784 9.665 -7.264 564 HD11 LEU 70 1HD1 LEU 70 -8.360 9.564 -5.664 565 HD12 LEU 70 2HD1 LEU 70 -6.899 10.456 -5.235 566 HD13 LEU 70 3HD1 LEU 70 -6.865 8.695 -5.293 567 HD21 LEU 70 3HD2 LEU 70 -6.928 8.423 -9.017 568 HD22 LEU 70 1HD2 LEU 70 -8.397 8.334 -8.039 569 HD23 LEU 70 2HD2 LEU 70 -6.927 7.503 -7.517 570 H ILE 71 H ILE 71 -6.687 13.594 -8.890 571 HA ILE 71 HA ILE 71 -9.107 14.673 -9.952 572 HB ILE 71 HB ILE 71 -6.551 16.151 -9.148 573 HG12 ILE 71 2HG1 ILE 71 -9.010 15.446 -7.463 574 HG13 ILE 71 3HG1 ILE 71 -7.420 14.705 -7.318 575 HG21 ILE 71 1HG2 ILE 71 -9.396 17.216 -9.387 576 HG22 ILE 71 2HG2 ILE 71 -8.060 17.582 -10.480 577 HG23 ILE 71 3HG2 ILE 71 -8.000 18.127 -8.804 578 HD11 ILE 71 3HD1 ILE 71 -7.803 16.291 -5.551 579 HD12 ILE 71 1HD1 ILE 71 -8.098 17.579 -6.718 580 HD13 ILE 71 2HD1 ILE 71 -6.493 16.849 -6.592 581 H LEU 72 H LEU 72 -5.886 14.216 -11.251 582 HA LEU 72 HA LEU 72 -6.061 15.842 -13.576 583 HB2 LEU 72 2HB LEU 72 -3.952 14.916 -12.544 584 HB3 LEU 72 3HB LEU 72 -4.392 13.325 -13.115 585 HG LEU 72 HG LEU 72 -2.591 14.567 -14.433 586 HD11 LEU 72 1HD1 LEU 72 -3.289 13.790 -16.627 587 HD12 LEU 72 2HD1 LEU 72 -4.959 13.637 -16.073 588 HD13 LEU 72 3HD1 LEU 72 -3.702 12.609 -15.383 589 HD21 LEU 72 3HD2 LEU 72 -3.254 16.275 -16.047 590 HD22 LEU 72 1HD2 LEU 72 -3.611 16.800 -14.403 591 HD23 LEU 72 2HD2 LEU 72 -4.916 16.234 -15.451 592 H HIS 73 H HIS 73 -6.738 12.407 -12.957 593 HA HIS 73 HA HIS 73 -7.808 11.858 -15.574 594 HB2 HIS 73 2HB HIS 73 -7.616 10.274 -13.005 595 HB3 HIS 73 3HB HIS 73 -8.649 9.696 -14.312 596 HD1 HIS 73 HD1 HIS 73 -7.472 8.007 -15.673 597 HD2 HIS 73 HD2 HIS 73 -4.833 10.900 -14.284 598 HE1 HIS 73 HE1 HIS 73 -5.233 7.379 -16.608 599 HE2 HIS 73 HE2 HIS 73 -3.652 9.109 -15.721 600 H ASP 74 H ASP 74 -9.022 13.348 -12.819 601 HA ASP 74 HA ASP 74 -10.835 14.686 -12.680 602 HB2 ASP 74 2HB ASP 74 -11.345 14.559 -15.105 603 HB3 ASP 74 3HB ASP 74 -12.165 13.023 -14.864 604 H PHE 75 H PHE 75 -10.412 13.450 -10.750 605 HA PHE 75 HA PHE 75 -12.899 12.195 -9.776 606 HB2 PHE 75 2HB PHE 75 -11.083 10.453 -10.213 607 HB3 PHE 75 3HB PHE 75 -10.074 11.276 -9.036 608 HD1 PHE 75 HD2 PHE 75 -13.477 9.699 -9.332 609 HD2 PHE 75 HD1 PHE 75 -10.099 10.469 -6.829 610 HE1 PHE 75 HE2 PHE 75 -14.436 8.264 -7.584 611 HE2 PHE 75 HE1 PHE 75 -11.065 9.032 -5.093 612 HZ PHE 75 HZ PHE 75 -13.230 7.926 -5.466 613 H THR 76 H THR 76 -13.582 13.987 -8.732 614 HA THR 76 HA THR 76 -12.002 16.145 -7.986 615 HB THR 76 HB THR 76 -14.501 16.173 -8.513 616 HG1 THR 76 HG1 THR 76 -14.888 17.842 -6.757 617 HG21 THR 76 3HG2 THR 76 -16.091 15.952 -6.661 618 HG22 THR 76 1HG2 THR 76 -14.777 15.480 -5.578 619 HG23 THR 76 2HG2 THR 76 -15.236 14.429 -6.921 620 HA PRO 77 HA PRO 77 -10.213 15.279 -3.952 621 HB2 PRO 77 2HB PRO 77 -10.600 17.740 -2.651 622 HB3 PRO 77 3HB PRO 77 -9.301 17.407 -3.817 623 HG2 PRO 77 2HG PRO 77 -11.976 18.698 -4.317 624 HG3 PRO 77 3HG PRO 77 -10.361 19.211 -4.857 625 HD2 PRO 77 2HD PRO 77 -11.924 17.936 -6.559 626 HD3 PRO 77 3HD PRO 77 -10.209 17.486 -6.474 627 H GLU 78 H GLU 78 -13.429 16.621 -4.134 628 HA GLU 78 HA GLU 78 -14.312 16.287 -1.473 629 HB2 GLU 78 2HB GLU 78 -15.976 16.237 -4.026 630 HB3 GLU 78 3HB GLU 78 -16.556 16.620 -2.406 631 HG2 GLU 78 2HG GLU 78 -15.280 18.690 -2.377 632 HG3 GLU 78 3HG GLU 78 -14.507 18.284 -3.912 633 H GLU 79 H GLU 79 -14.537 14.183 -4.350 634 HA GLU 79 HA GLU 79 -15.925 12.024 -3.154 635 HB2 GLU 79 2HB GLU 79 -14.123 12.202 -5.601 636 HB3 GLU 79 3HB GLU 79 -14.833 10.672 -5.097 637 HG2 GLU 79 2HG GLU 79 -16.414 13.160 -5.808 638 HG3 GLU 79 3HG GLU 79 -16.105 11.811 -6.902 639 H ILE 80 H ILE 80 -12.491 12.685 -3.649 640 HA ILE 80 HA ILE 80 -11.348 10.310 -2.765 641 HB ILE 80 HB ILE 80 -10.223 13.142 -2.475 642 HG12 ILE 80 2HG1 ILE 80 -9.878 11.156 -4.780 643 HG13 ILE 80 3HG1 ILE 80 -10.894 12.590 -4.820 644 HG21 ILE 80 1HG2 ILE 80 -7.994 12.072 -2.483 645 HG22 ILE 80 2HG2 ILE 80 -8.753 10.479 -2.514 646 HG23 ILE 80 3HG2 ILE 80 -8.967 11.530 -1.113 647 HD11 ILE 80 3HD1 ILE 80 -8.889 13.999 -4.582 648 HD12 ILE 80 1HD1 ILE 80 -8.839 12.971 -6.013 649 HD13 ILE 80 2HD1 ILE 80 -7.885 12.546 -4.595 650 H LYS 81 H LYS 81 -11.963 13.297 -0.908 651 HA LYS 81 HA LYS 81 -11.034 12.272 1.590 652 HB2 LYS 81 2HB LYS 81 -11.680 14.416 2.525 653 HB3 LYS 81 3HB LYS 81 -10.900 14.668 0.967 654 HG2 LYS 81 2HG LYS 81 -13.342 14.762 0.023 655 HG3 LYS 81 3HG LYS 81 -13.811 15.020 1.704 656 HD2 LYS 81 2HD LYS 81 -11.965 16.769 0.026 657 HD3 LYS 81 3HD LYS 81 -13.599 17.165 0.561 658 HE2 LYS 81 2HE LYS 81 -11.165 16.819 2.345 659 HE3 LYS 81 3HE LYS 81 -11.945 18.341 1.918 660 HZ1 LYS 81 3HZ LYS 81 -13.965 17.524 3.034 661 HZ2 LYS 81 1HZ LYS 81 -12.651 17.662 4.087 662 HZ3 LYS 81 2HZ LYS 81 -13.129 16.146 3.520 663 H SER 82 H SER 82 -14.066 12.125 -0.047 664 HA SER 82 HA SER 82 -15.798 11.696 2.191 665 HB2 SER 82 2HB SER 82 -16.629 12.417 -0.041 666 HB3 SER 82 3HB SER 82 -16.147 10.868 -0.727 667 HG SER 82 HG SER 82 -18.046 10.208 -0.145 668 H PHE 83 H PHE 83 -13.759 9.597 0.195 669 HA PHE 83 HA PHE 83 -14.834 7.119 1.264 670 HB2 PHE 83 2HB PHE 83 -12.442 7.683 -0.524 671 HB3 PHE 83 3HB PHE 83 -12.873 6.061 0.007 672 HD1 PHE 83 HD2 PHE 83 -15.440 5.412 -0.432 673 HD2 PHE 83 HD1 PHE 83 -13.259 8.360 -2.635 674 HE1 PHE 83 HE2 PHE 83 -17.016 5.188 -2.306 675 HE2 PHE 83 HE1 PHE 83 -14.845 8.128 -4.501 676 HZ PHE 83 HZ PHE 83 -16.723 6.548 -4.338 677 H PHE 84 H PHE 84 -12.862 9.381 2.680 678 HA PHE 84 HA PHE 84 -11.356 7.462 4.317 679 HB2 PHE 84 2HB PHE 84 -11.503 10.507 4.361 680 HB3 PHE 84 3HB PHE 84 -10.583 9.569 5.533 681 HD1 PHE 84 HD1 PHE 84 -10.779 10.557 1.971 682 HD2 PHE 84 HD2 PHE 84 -8.445 8.584 4.939 683 HE1 PHE 84 HE1 PHE 84 -8.851 10.571 0.451 684 HE2 PHE 84 HE2 PHE 84 -6.523 8.588 3.412 685 HZ PHE 84 HZ PHE 84 -6.717 9.582 1.170 686 H GLU 85 H GLU 85 -14.407 9.007 4.305 687 HA GLU 85 HA GLU 85 -14.837 9.267 7.114 688 HB2 GLU 85 2HB GLU 85 -16.854 9.131 4.827 689 HB3 GLU 85 3HB GLU 85 -17.232 9.596 6.484 690 HG2 GLU 85 2HG GLU 85 -15.430 11.090 4.551 691 HG3 GLU 85 3HG GLU 85 -17.042 11.574 5.079 692 H ASN 86 H ASN 86 -14.970 7.645 8.471 693 HA ASN 86 HA ASN 86 -15.766 4.931 7.624 694 HB2 ASN 86 2HB ASN 86 -13.515 5.337 8.723 695 HB3 ASN 86 3HB ASN 86 -14.349 5.846 10.182 696 HD21 ASN 86 1HD2 ASN 86 -12.459 3.661 9.797 697 HD22 ASN 86 2HD2 ASN 86 -13.265 2.214 10.285 698 H LYS 87 H LYS 87 -18.011 5.092 7.694 699 HA LYS 87 HA LYS 87 -19.319 5.693 10.297 700 HB2 LYS 87 2HB LYS 87 -20.259 6.508 7.511 701 HB3 LYS 87 3HB LYS 87 -21.240 6.664 8.966 702 HG2 LYS 87 2HG LYS 87 -19.723 8.315 9.890 703 HG3 LYS 87 3HG LYS 87 -18.571 8.064 8.574 704 HD2 LYS 87 2HD LYS 87 -21.397 9.153 8.222 705 HD3 LYS 87 3HD LYS 87 -19.937 10.146 8.303 706 HE2 LYS 87 2HE LYS 87 -19.070 9.092 6.267 707 HE3 LYS 87 3HE LYS 87 -20.460 8.005 6.204 708 HZ1 LYS 87 3HZ LYS 87 -20.671 9.894 4.693 709 HZ2 LYS 87 1HZ LYS 87 -20.607 10.965 5.996 710 HZ3 LYS 87 2HZ LYS 87 -21.901 9.887 5.848 711 H GLY 88 H GLY 88 -20.428 4.550 7.090 712 HA2 GLY 88 2HA GLY 88 -21.845 2.276 8.346 713 HA3 GLY 88 3HA GLY 88 -22.086 2.902 6.718 714 H LYS 89 H LYS 89 -19.449 3.070 5.907 715 HA LYS 89 HA LYS 89 -18.593 0.241 5.682 716 HB2 LYS 89 2HB LYS 89 -18.192 2.614 3.788 717 HB3 LYS 89 3HB LYS 89 -17.435 1.040 3.565 718 HG2 LYS 89 2HG LYS 89 -20.432 1.511 3.615 719 HG3 LYS 89 3HG LYS 89 -19.459 1.405 2.146 720 HD2 LYS 89 2HD LYS 89 -19.726 -0.819 4.214 721 HD3 LYS 89 3HD LYS 89 -20.651 -0.727 2.714 722 HE2 LYS 89 2HE LYS 89 -18.593 -0.919 1.394 723 HE3 LYS 89 3HE LYS 89 -17.615 -0.901 2.865 724 HZ1 LYS 89 3HZ LYS 89 -19.600 -2.995 2.144 725 HZ2 LYS 89 1HZ LYS 89 -18.648 -2.978 3.536 726 HZ3 LYS 89 2HZ LYS 89 -17.925 -3.150 2.021 727 H ARG 90 H ARG 90 -16.335 -0.185 5.714 728 HA ARG 90 HA ARG 90 -14.601 1.547 7.221 729 HB2 ARG 90 2HB ARG 90 -14.115 -1.015 5.632 730 HB3 ARG 90 3HB ARG 90 -12.830 -0.172 6.501 731 HG2 ARG 90 2HG ARG 90 -13.956 -0.536 8.627 732 HG3 ARG 90 3HG ARG 90 -15.347 -1.263 7.815 733 HD2 ARG 90 2HD ARG 90 -12.534 -2.407 7.648 734 HD3 ARG 90 3HD ARG 90 -13.706 -2.889 8.874 735 HE ARG 90 HE ARG 90 -15.136 -3.732 7.102 736 HH11 ARG 90 1HH1 ARG 90 -11.793 -3.123 6.183 737 HH12 ARG 90 2HH1 ARG 90 -11.824 -4.224 4.847 738 HH21 ARG 90 1HH2 ARG 90 -15.157 -5.214 5.377 739 HH22 ARG 90 2HH2 ARG 90 -13.743 -5.405 4.396 740 HA PRO 91 HA PRO 91 -13.433 4.270 3.972 741 HB2 PRO 91 2HB PRO 91 -10.587 4.241 4.907 742 HB3 PRO 91 3HB PRO 91 -11.739 5.587 4.842 743 HG2 PRO 91 2HG PRO 91 -11.029 4.496 7.178 744 HG3 PRO 91 3HG PRO 91 -12.690 5.071 6.894 745 HD2 PRO 91 2HD PRO 91 -11.635 2.248 6.832 746 HD3 PRO 91 3HD PRO 91 -13.150 2.875 7.522 747 H VAL 92 H VAL 92 -13.144 3.838 1.867 748 HA VAL 92 HA VAL 92 -11.668 1.616 0.825 749 HB VAL 92 HB VAL 92 -12.733 4.085 -0.640 750 HG11 VAL 92 1HG1 VAL 92 -11.037 2.917 -1.985 751 HG12 VAL 92 2HG1 VAL 92 -12.639 2.714 -2.695 752 HG13 VAL 92 3HG1 VAL 92 -11.902 1.389 -1.788 753 HG21 VAL 92 3HG2 VAL 92 -14.701 2.703 -1.209 754 HG22 VAL 92 1HG2 VAL 92 -14.534 2.882 0.539 755 HG23 VAL 92 2HG2 VAL 92 -14.061 1.370 -0.243 756 H PHE 93 H PHE 93 -11.086 5.075 1.176 757 HA PHE 93 HA PHE 93 -8.178 4.654 0.772 758 HB2 PHE 93 2HB PHE 93 -9.703 7.302 0.858 759 HB3 PHE 93 3HB PHE 93 -7.998 7.086 0.477 760 HD1 PHE 93 HD1 PHE 93 -8.347 4.692 -1.455 761 HD2 PHE 93 HD2 PHE 93 -10.367 8.447 -1.123 762 HE1 PHE 93 HE1 PHE 93 -8.891 4.618 -3.847 763 HE2 PHE 93 HE2 PHE 93 -10.911 8.359 -3.515 764 HZ PHE 93 HZ PHE 93 -10.177 6.447 -4.882 765 H VAL 94 H VAL 94 -7.165 4.382 2.695 766 HA VAL 94 HA VAL 94 -8.323 5.561 5.169 767 HB VAL 94 HB VAL 94 -6.335 3.230 5.044 768 HG11 VAL 94 1HG1 VAL 94 -8.190 4.164 7.262 769 HG12 VAL 94 2HG1 VAL 94 -6.441 4.397 7.196 770 HG13 VAL 94 3HG1 VAL 94 -7.108 2.770 7.337 771 HG21 VAL 94 3HG2 VAL 94 -9.356 2.961 5.272 772 HG22 VAL 94 1HG2 VAL 94 -8.176 1.651 5.362 773 HG23 VAL 94 2HG2 VAL 94 -8.396 2.540 3.853 774 H LYS 95 H LYS 95 -6.783 6.494 6.697 775 HA LYS 95 HA LYS 95 -4.002 6.838 5.898 776 HB2 LYS 95 2HB LYS 95 -3.996 9.257 5.968 777 HB3 LYS 95 3HB LYS 95 -5.189 8.736 4.785 778 HG2 LYS 95 2HG LYS 95 -7.010 9.207 6.343 779 HG3 LYS 95 3HG LYS 95 -5.858 9.634 7.613 780 HD2 LYS 95 2HD LYS 95 -6.185 11.101 4.965 781 HD3 LYS 95 3HD LYS 95 -6.839 11.636 6.515 782 HE2 LYS 95 2HE LYS 95 -4.567 11.892 7.413 783 HE3 LYS 95 3HE LYS 95 -3.880 11.270 5.911 784 HZ1 LYS 95 3HZ LYS 95 -4.791 13.170 4.740 785 HZ2 LYS 95 1HZ LYS 95 -3.792 13.683 6.005 786 HZ3 LYS 95 2HZ LYS 95 -5.471 13.764 6.168 787 H GLY 96 H GLY 96 -2.862 8.278 7.560 788 HA2 GLY 96 2HA GLY 96 -3.076 9.237 9.854 789 HA3 GLY 96 3HA GLY 96 -3.806 7.700 10.320 790 H SER 97 H SER 97 -2.172 7.162 11.813 791 HA SER 97 HA SER 97 0.570 6.776 10.954 792 HB2 SER 97 2HB SER 97 -0.007 7.166 13.342 793 HB3 SER 97 3HB SER 97 -0.922 5.661 13.372 794 HG SER 97 HG SER 97 1.062 5.180 14.178 795 H LEU 98 H LEU 98 1.498 4.448 11.192 796 HA LEU 98 HA LEU 98 0.441 2.788 9.184 797 HB2 LEU 98 2HB LEU 98 2.816 2.778 9.869 798 HB3 LEU 98 3HB LEU 98 2.379 2.128 11.440 799 HG LEU 98 HG LEU 98 1.644 0.010 10.381 800 HD11 LEU 98 1HD1 LEU 98 0.902 0.850 8.212 801 HD12 LEU 98 2HD1 LEU 98 2.056 -0.465 8.020 802 HD13 LEU 98 3HD1 LEU 98 2.571 1.202 7.754 803 HD21 LEU 98 3HD2 LEU 98 3.952 0.187 11.164 804 HD22 LEU 98 1HD2 LEU 98 4.463 0.809 9.591 805 HD23 LEU 98 2HD2 LEU 98 3.852 -0.841 9.737 806 H GLU 99 H GLU 99 0.301 2.529 12.717 807 HA GLU 99 HA GLU 99 -1.209 0.084 12.772 808 HB2 GLU 99 2HB GLU 99 -0.645 2.086 14.995 809 HB3 GLU 99 3HB GLU 99 -1.284 0.458 15.216 810 HG2 GLU 99 2HG GLU 99 0.819 -0.473 14.272 811 HG3 GLU 99 3HG GLU 99 1.457 1.164 14.117 812 H SER 100 H SER 100 -1.986 3.522 13.218 813 HA SER 100 HA SER 100 -4.673 3.307 14.015 814 HB2 SER 100 2HB SER 100 -3.315 5.503 12.385 815 HB3 SER 100 3HB SER 100 -4.830 5.677 13.261 816 HG SER 100 HG SER 100 -3.307 4.866 15.107 817 H ALA 101 H ALA 101 -3.226 3.636 10.783 818 HA ALA 101 HA ALA 101 -5.627 3.649 9.274 819 HB1 ALA 101 3HB ALA 101 -3.515 4.566 8.425 820 HB2 ALA 101 1HB ALA 101 -4.144 3.332 7.330 821 HB3 ALA 101 2HB ALA 101 -2.797 2.952 8.410 822 H ALA 102 H ALA 102 -3.535 1.106 10.493 823 HA ALA 102 HA ALA 102 -4.512 -1.113 9.062 824 HB1 ALA 102 3HB ALA 102 -3.556 -2.454 10.877 825 HB2 ALA 102 1HB ALA 102 -3.421 -1.015 11.896 826 HB3 ALA 102 2HB ALA 102 -2.456 -1.150 10.426 827 H GLU 103 H GLU 103 -5.505 0.351 12.141 828 HA GLU 103 HA GLU 103 -7.504 -1.543 12.839 829 HB2 GLU 103 2HB GLU 103 -7.218 1.354 13.748 830 HB3 GLU 103 3HB GLU 103 -8.188 0.113 14.542 831 HG2 GLU 103 2HG GLU 103 -6.092 -1.182 14.969 832 HG3 GLU 103 3HG GLU 103 -5.174 0.130 14.261 833 H GLN 104 H GLN 104 -7.625 1.559 11.133 834 HA GLN 104 HA GLN 104 -10.471 1.723 10.902 835 HB2 GLN 104 2HB GLN 104 -8.274 3.072 9.289 836 HB3 GLN 104 3HB GLN 104 -9.982 3.499 9.200 837 HG2 GLN 104 2HG GLN 104 -9.960 4.230 11.529 838 HG3 GLN 104 3HG GLN 104 -8.290 3.699 11.711 839 HE21 GLN 104 1HE2 GLN 104 -6.636 4.917 10.752 840 HE22 GLN 104 2HE2 GLN 104 -6.881 6.533 10.196 841 H ALA 105 H ALA 105 -7.935 0.326 8.865 842 HA ALA 105 HA ALA 105 -9.685 -0.275 6.628 843 HB1 ALA 105 3HB ALA 105 -7.309 0.226 6.264 844 HB2 ALA 105 1HB ALA 105 -7.702 -1.390 5.672 845 HB3 ALA 105 2HB ALA 105 -6.844 -1.191 7.206 846 H GLY 106 H GLY 106 -8.748 -1.845 9.580 847 HA2 GLY 106 2HA GLY 106 -9.635 -3.732 10.578 848 HA3 GLY 106 3HA GLY 106 -10.510 -4.110 9.106 849 H ILE 107 H ILE 107 -7.102 -3.494 9.002 850 HA ILE 107 HA ILE 107 -6.487 -6.281 8.288 851 HB ILE 107 HB ILE 107 -4.574 -3.896 8.246 852 HG12 ILE 107 2HG1 ILE 107 -6.266 -4.867 5.896 853 HG13 ILE 107 3HG1 ILE 107 -6.587 -3.402 6.822 854 HG21 ILE 107 1HG2 ILE 107 -4.505 -6.515 6.698 855 HG22 ILE 107 2HG2 ILE 107 -3.516 -6.130 8.106 856 HG23 ILE 107 3HG2 ILE 107 -3.306 -5.222 6.611 857 HD11 ILE 107 3HD1 ILE 107 -5.471 -2.857 4.773 858 HD12 ILE 107 1HD1 ILE 107 -4.141 -3.953 5.141 859 HD13 ILE 107 2HD1 ILE 107 -4.397 -2.506 6.124 860 H VAL 108 H VAL 108 -4.790 -7.453 9.400 861 HA VAL 108 HA VAL 108 -4.684 -7.062 12.216 862 HB VAL 108 HB VAL 108 -2.934 -8.892 10.515 863 HG11 VAL 108 1HG1 VAL 108 -2.605 -10.180 12.598 864 HG12 VAL 108 2HG1 VAL 108 -3.532 -8.978 13.497 865 HG13 VAL 108 3HG1 VAL 108 -1.992 -8.533 12.755 866 HG21 VAL 108 3HG2 VAL 108 -5.314 -9.386 10.150 867 HG22 VAL 108 1HG2 VAL 108 -5.585 -9.493 11.893 868 HG23 VAL 108 2HG2 VAL 108 -4.560 -10.679 11.083 869 H VAL 109 H VAL 109 -3.597 -5.525 13.165 870 HA VAL 109 HA VAL 109 -1.838 -3.705 12.059 871 HB VAL 109 HB VAL 109 -2.168 -4.466 14.993 872 HG11 VAL 109 1HG1 VAL 109 -0.096 -3.191 14.722 873 HG12 VAL 109 2HG1 VAL 109 -1.307 -2.218 15.557 874 HG13 VAL 109 3HG1 VAL 109 -0.963 -1.923 13.850 875 HG21 VAL 109 3HG2 VAL 109 -4.289 -3.777 13.939 876 HG22 VAL 109 1HG2 VAL 109 -3.551 -2.261 13.421 877 HG23 VAL 109 2HG2 VAL 109 -3.766 -2.597 15.141 878 H ASP 110 H ASP 110 -1.013 -6.355 14.317 879 HA ASP 110 HA ASP 110 1.722 -5.806 14.515 880 HB2 ASP 110 2HB ASP 110 0.436 -7.192 16.143 881 HB3 ASP 110 3HB ASP 110 0.326 -8.486 14.952 882 H GLU 111 H GLU 111 -0.021 -7.905 12.267 883 HA GLU 111 HA GLU 111 2.217 -9.196 11.099 884 HB2 GLU 111 2HB GLU 111 -0.611 -8.713 10.098 885 HB3 GLU 111 3HB GLU 111 0.568 -9.633 9.177 886 HG2 GLU 111 2HG GLU 111 -0.368 -10.350 11.967 887 HG3 GLU 111 3HG GLU 111 -1.039 -11.028 10.488 888 H LEU 112 H LEU 112 0.328 -6.282 10.024 889 HA LEU 112 HA LEU 112 2.022 -5.913 7.717 890 HB2 LEU 112 2HB LEU 112 0.827 -3.769 7.350 891 HB3 LEU 112 3HB LEU 112 -0.220 -5.163 7.511 892 HG LEU 112 HG LEU 112 -0.628 -4.383 9.947 893 HD11 LEU 112 1HD1 LEU 112 -0.427 -1.978 10.408 894 HD12 LEU 112 2HD1 LEU 112 0.472 -1.755 8.904 895 HD13 LEU 112 3HD1 LEU 112 1.149 -2.734 10.205 896 HD21 LEU 112 3HD2 LEU 112 -1.671 -2.610 7.733 897 HD22 LEU 112 1HD2 LEU 112 -2.430 -2.956 9.286 898 HD23 LEU 112 2HD2 LEU 112 -2.254 -4.230 8.100 899 H VAL 113 H VAL 113 2.119 -4.643 11.002 900 HA VAL 113 HA VAL 113 3.987 -2.562 10.603 901 HB VAL 113 HB VAL 113 3.504 -4.289 13.085 902 HG11 VAL 113 1HG1 VAL 113 5.800 -3.404 13.226 903 HG12 VAL 113 2HG1 VAL 113 4.762 -2.591 14.395 904 HG13 VAL 113 3HG1 VAL 113 5.217 -1.769 12.899 905 HG21 VAL 113 3HG2 VAL 113 2.316 -2.298 13.951 906 HG22 VAL 113 1HG2 VAL 113 1.607 -2.851 12.433 907 HG23 VAL 113 2HG2 VAL 113 2.655 -1.433 12.449 908 H GLN 114 H GLN 114 4.362 -6.042 11.197 909 HA GLN 114 HA GLN 114 7.170 -6.211 11.113 910 HB2 GLN 114 2HB GLN 114 5.003 -8.193 10.335 911 HB3 GLN 114 3HB GLN 114 6.710 -8.607 10.220 912 HG2 GLN 114 2HG GLN 114 5.293 -7.776 12.770 913 HG3 GLN 114 3HG GLN 114 5.630 -9.438 12.292 914 HE21 GLN 114 1HE2 GLN 114 7.017 -6.460 13.464 915 HE22 GLN 114 2HE2 GLN 114 8.556 -7.109 13.901 916 H THR 115 H THR 115 4.801 -6.600 8.425 917 HA THR 115 HA THR 115 6.742 -7.222 6.475 918 HB THR 115 HB THR 115 4.087 -7.555 6.514 919 HG1 THR 115 HG1 THR 115 5.593 -8.430 4.972 920 HG21 THR 115 3HG2 THR 115 2.901 -6.119 4.919 921 HG22 THR 115 1HG2 THR 115 4.335 -5.106 4.728 922 HG23 THR 115 2HG2 THR 115 3.491 -5.158 6.276 923 H VAL 116 H VAL 116 5.502 -4.122 7.551 924 HA VAL 116 HA VAL 116 6.534 -2.559 5.354 925 HB VAL 116 HB VAL 116 5.302 -1.811 8.039 926 HG11 VAL 116 1HG1 VAL 116 5.269 0.553 7.311 927 HG12 VAL 116 2HG1 VAL 116 6.238 0.131 5.897 928 HG13 VAL 116 3HG1 VAL 116 6.919 -0.043 7.515 929 HG21 VAL 116 3HG2 VAL 116 3.417 -0.999 6.652 930 HG22 VAL 116 1HG2 VAL 116 3.739 -2.711 6.364 931 HG23 VAL 116 2HG2 VAL 116 4.268 -1.504 5.190 932 H LYS 117 H LYS 117 7.524 -3.145 8.766 933 HA LYS 117 HA LYS 117 9.812 -1.412 8.606 934 HB2 LYS 117 2HB LYS 117 10.400 -2.154 10.812 935 HB3 LYS 117 3HB LYS 117 8.646 -2.006 10.765 936 HG2 LYS 117 2HG LYS 117 8.516 -4.501 10.423 937 HG3 LYS 117 3HG LYS 117 10.262 -4.577 10.674 938 HD2 LYS 117 2HD LYS 117 8.234 -3.537 12.697 939 HD3 LYS 117 3HD LYS 117 8.974 -5.139 12.725 940 HE2 LYS 117 2HE LYS 117 11.174 -4.170 13.110 941 HE3 LYS 117 3HE LYS 117 10.530 -2.538 12.921 942 HZ1 LYS 117 3HZ LYS 117 10.832 -3.216 15.256 943 HZ2 LYS 117 1HZ LYS 117 9.675 -4.428 15.039 944 HZ3 LYS 117 2HZ LYS 117 9.230 -2.808 14.894 945 H ASN 118 H ASN 118 9.220 -4.762 7.828 946 HA ASN 118 HA ASN 118 11.953 -5.627 7.677 947 HB2 ASN 118 2HB ASN 118 9.393 -6.809 6.495 948 HB3 ASN 118 3HB ASN 118 10.976 -7.558 6.285 949 HD21 ASN 118 1HD2 ASN 118 8.608 -8.634 7.631 950 HD22 ASN 118 2HD2 ASN 118 9.080 -8.958 9.263 951 H TYR 119 H TYR 119 9.547 -4.414 5.345 952 HA TYR 119 HA TYR 119 11.117 -4.372 3.036 953 HB2 TYR 119 2HB TYR 119 8.754 -3.839 2.853 954 HB3 TYR 119 3HB TYR 119 8.917 -2.463 3.937 955 HD1 TYR 119 HD1 TYR 119 10.369 -3.678 0.680 956 HD2 TYR 119 HD2 TYR 119 8.940 -0.320 2.892 957 HE1 TYR 119 HE1 TYR 119 10.716 -2.252 -1.283 958 HE2 TYR 119 HE2 TYR 119 9.283 1.115 0.924 959 HH TYR 119 HH TYR 119 9.895 -0.119 -2.198 960 H GLN 120 H GLN 120 10.572 -1.686 5.327 961 HA GLN 120 HA GLN 120 12.496 0.096 4.365 962 HB2 GLN 120 2HB GLN 120 11.311 -0.215 7.157 963 HB3 GLN 120 3HB GLN 120 12.321 1.148 6.677 964 HG2 GLN 120 2HG GLN 120 10.659 1.754 4.939 965 HG3 GLN 120 3HG GLN 120 9.638 0.415 5.459 966 HE21 GLN 120 1HE2 GLN 120 9.275 3.411 5.448 967 HE22 GLN 120 2HE2 GLN 120 8.766 3.795 7.043 968 H GLY 121 H GLY 121 12.818 -2.652 6.475 969 HA2 GLY 121 2HA GLY 121 15.275 -2.097 7.748 970 HA3 GLY 121 3HA GLY 121 14.555 -3.687 7.514 971 H TYR 122 H TYR 122 14.484 -3.933 4.782 972 HA TYR 122 HA TYR 122 17.312 -4.321 4.215 973 HB2 TYR 122 2HB TYR 122 16.627 -5.700 2.345 974 HB3 TYR 122 3HB TYR 122 15.881 -6.215 3.838 975 HD1 TYR 122 HD2 TYR 122 14.936 -3.861 1.004 976 HD2 TYR 122 HD1 TYR 122 13.783 -7.114 3.506 977 HE1 TYR 122 HE2 TYR 122 12.820 -4.051 -0.207 978 HE2 TYR 122 HE1 TYR 122 11.680 -7.308 2.282 979 HH TYR 122 HH TYR 122 10.255 -6.051 0.900 980 H VAL 123 H VAL 123 14.889 -2.034 3.333 981 HA VAL 123 HA VAL 123 15.950 -1.053 0.906 982 HB VAL 123 HB VAL 123 14.430 0.409 3.120 983 HG11 VAL 123 1HG1 VAL 123 14.089 2.270 1.471 984 HG12 VAL 123 2HG1 VAL 123 15.260 1.496 0.399 985 HG13 VAL 123 3HG1 VAL 123 15.772 2.100 1.977 986 HG21 VAL 123 3HG2 VAL 123 13.525 -0.474 0.352 987 HG22 VAL 123 1HG2 VAL 123 12.526 0.326 1.569 988 HG23 VAL 123 2HG2 VAL 123 13.144 -1.300 1.859 989 H GLN 124 H GLN 124 16.542 -0.002 4.275 990 HA GLN 124 HA GLN 124 18.615 1.848 3.634 991 HB2 GLN 124 2HB GLN 124 19.034 1.909 6.091 992 HB3 GLN 124 3HB GLN 124 17.331 2.105 5.686 993 HG2 GLN 124 2HG GLN 124 16.981 -0.321 6.207 994 HG3 GLN 124 3HG GLN 124 18.655 -0.407 6.747 995 HE21 GLN 124 1HE2 GLN 124 16.131 -0.855 8.209 996 HE22 GLN 124 2HE2 GLN 124 16.184 0.206 9.566 997 H ASP 125 H ASP 125 18.557 -1.594 4.098 998 HA ASP 125 HA ASP 125 21.417 -1.931 4.463 999 HB2 ASP 125 2HB ASP 125 19.726 -3.567 5.341 1000 HB3 ASP 125 3HB ASP 125 19.275 -3.975 3.695 1001 H GLY 126 H GLY 126 19.160 -1.728 1.798 1002 HA2 GLY 126 2HA GLY 126 19.484 -1.464 -0.451 1003 HA3 GLY 126 3HA GLY 126 21.216 -1.506 -0.191 1004 H HIS 127 H HIS 127 19.182 -4.152 0.886 1005 HA HIS 127 HA HIS 127 19.618 -5.762 -1.524 1006 HB2 HIS 127 2HB HIS 127 21.690 -6.153 -0.210 1007 HB3 HIS 127 3HB HIS 127 20.743 -6.578 1.210 1008 HD1 HIS 127 HD1 HIS 127 22.243 -8.010 -1.835 1009 HD2 HIS 127 HD2 HIS 127 19.362 -9.164 0.928 1010 HE1 HIS 127 HE1 HIS 127 21.982 -10.486 -2.126 1011 HE2 HIS 127 HE2 HIS 127 20.390 -11.180 -0.310 1012 H ASP 128 H ASP 128 17.592 -6.543 -1.892 1013 HA ASP 128 HA ASP 128 15.588 -6.468 0.137 1014 HB2 ASP 128 2HB ASP 128 14.008 -6.729 -1.523 1015 HB3 ASP 128 3HB ASP 128 15.339 -6.047 -2.447 1016 H HIS 129 H HIS 129 13.951 -8.432 0.184 1017 HA HIS 129 HA HIS 129 15.261 -11.003 0.629 1018 HB2 HIS 129 2HB HIS 129 14.244 -9.271 2.939 1019 HB3 HIS 129 3HB HIS 129 14.412 -11.015 3.090 1020 HD1 HIS 129 HD1 HIS 129 16.805 -11.968 3.241 1021 HD2 HIS 129 HD2 HIS 129 16.665 -7.838 3.048 1022 HE1 HIS 129 HE1 HIS 129 19.117 -11.191 3.813 1023 HE2 HIS 129 HE2 HIS 129 18.945 -8.684 3.848 1024 H ASP 130 H ASP 130 13.149 -9.981 -1.053 1025 HA ASP 130 HA ASP 130 10.802 -11.468 -0.037 1026 HB2 ASP 130 2HB ASP 130 10.979 -8.564 -0.778 1027 HB3 ASP 130 3HB ASP 130 9.568 -9.415 -1.382 1028 H PHE 131 H PHE 131 11.121 -9.555 -3.042 1029 HA PHE 131 HA PHE 131 10.418 -12.032 -4.545 1030 HB2 PHE 131 2HB PHE 131 9.376 -9.203 -5.075 1031 HB3 PHE 131 3HB PHE 131 8.903 -10.664 -5.934 1032 HD1 PHE 131 HD1 PHE 131 7.734 -12.533 -4.558 1033 HD2 PHE 131 HD2 PHE 131 8.141 -8.507 -3.155 1034 HE1 PHE 131 HE1 PHE 131 5.930 -12.908 -2.928 1035 HE2 PHE 131 HE2 PHE 131 6.334 -8.896 -1.528 1036 HZ PHE 131 HZ PHE 131 5.231 -11.097 -1.419 1037 H GLY 132 H GLY 132 12.824 -9.904 -4.076 1038 HA2 GLY 132 2HA GLY 132 14.753 -9.534 -5.265 1039 HA3 GLY 132 3HA GLY 132 14.026 -10.242 -6.708 1040 H ARG 133 H ARG 133 15.148 -7.424 -5.414 1041 HA ARG 133 HA ARG 133 14.103 -5.840 -7.559 1042 HB2 ARG 133 2HB ARG 133 12.213 -5.624 -5.988 1043 HB3 ARG 133 3HB ARG 133 13.289 -5.106 -4.697 1044 HG2 ARG 133 2HG ARG 133 11.963 -3.265 -5.803 1045 HG3 ARG 133 3HG ARG 133 13.706 -3.002 -5.765 1046 HD2 ARG 133 2HD ARG 133 12.666 -2.376 -7.938 1047 HD3 ARG 133 3HD ARG 133 13.913 -3.612 -8.098 1048 HE ARG 133 HE ARG 133 11.214 -4.589 -7.865 1049 HH11 ARG 133 1HH1 ARG 133 13.743 -3.664 -10.151 1050 HH12 ARG 133 2HH1 ARG 133 13.010 -4.549 -11.455 1051 HH21 ARG 133 1HH2 ARG 133 10.252 -5.620 -9.581 1052 HH22 ARG 133 2HH2 ARG 133 11.026 -5.655 -11.131 1053 H ASP 134 H ASP 134 15.465 -4.285 -8.084 1054 HA ASP 134 HA ASP 134 18.062 -4.015 -7.180 1055 HB2 ASP 134 2HB ASP 134 16.538 -1.748 -8.529 1056 HB3 ASP 134 3HB ASP 134 18.250 -2.138 -8.661 1057 HA PRO 135 HA PRO 135 17.697 -1.504 -3.379 1058 HB2 PRO 135 2HB PRO 135 20.247 -0.252 -3.686 1059 HB3 PRO 135 3HB PRO 135 19.893 -1.734 -2.782 1060 HG2 PRO 135 2HG PRO 135 20.989 -1.428 -5.535 1061 HG3 PRO 135 3HG PRO 135 21.326 -2.674 -4.313 1062 HD2 PRO 135 2HD PRO 135 19.761 -3.184 -6.447 1063 HD3 PRO 135 3HD PRO 135 19.433 -3.921 -4.864 1064 H LYS 136 H LYS 136 18.399 -0.136 -6.553 1065 HA LYS 136 HA LYS 136 18.185 2.622 -5.911 1066 HB2 LYS 136 2HB LYS 136 17.988 3.030 -8.308 1067 HB3 LYS 136 3HB LYS 136 19.184 1.763 -8.039 1068 HG2 LYS 136 2HG LYS 136 17.421 0.072 -8.605 1069 HG3 LYS 136 3HG LYS 136 16.328 1.399 -8.985 1070 HD2 LYS 136 2HD LYS 136 17.196 0.659 -11.068 1071 HD3 LYS 136 3HD LYS 136 18.042 2.166 -10.716 1072 HE2 LYS 136 2HE LYS 136 20.006 0.885 -9.946 1073 HE3 LYS 136 3HE LYS 136 19.135 -0.625 -10.247 1074 HZ1 LYS 136 3HZ LYS 136 20.640 -0.097 -12.058 1075 HZ2 LYS 136 1HZ LYS 136 19.861 1.382 -12.315 1076 HZ3 LYS 136 2HZ LYS 136 19.038 -0.067 -12.592 1077 H TYR 137 H TYR 137 15.731 0.174 -6.546 1078 HA TYR 137 HA TYR 137 13.545 2.154 -6.616 1079 HB2 TYR 137 2HB TYR 137 13.507 -0.861 -7.036 1080 HB3 TYR 137 3HB TYR 137 12.094 0.181 -7.143 1081 HD1 TYR 137 HD2 TYR 137 12.304 2.192 -8.842 1082 HD2 TYR 137 HD1 TYR 137 14.666 -1.359 -9.047 1083 HE1 TYR 137 HE2 TYR 137 12.757 2.628 -11.208 1084 HE2 TYR 137 HE1 TYR 137 15.130 -0.919 -11.419 1085 HH TYR 137 HH TYR 137 13.996 0.363 -13.313 1086 H LEU 138 H LEU 138 15.151 0.152 -4.366 1087 HA LEU 138 HA LEU 138 12.986 -0.216 -2.511 1088 HB2 LEU 138 2HB LEU 138 16.005 -0.278 -2.086 1089 HB3 LEU 138 3HB LEU 138 14.822 -0.736 -0.873 1090 HG LEU 138 HG LEU 138 15.413 -2.184 -3.482 1091 HD11 LEU 138 1HD1 LEU 138 16.106 -4.040 -2.011 1092 HD12 LEU 138 2HD1 LEU 138 15.811 -3.029 -0.590 1093 HD13 LEU 138 3HD1 LEU 138 17.072 -2.588 -1.746 1094 HD21 LEU 138 3HD2 LEU 138 13.732 -3.865 -2.777 1095 HD22 LEU 138 1HD2 LEU 138 13.015 -2.294 -3.127 1096 HD23 LEU 138 2HD2 LEU 138 13.240 -2.804 -1.453 1097 H HIS 139 H HIS 139 11.990 1.509 -1.643 1098 HA HIS 139 HA HIS 139 13.553 3.757 -0.537 1099 HB2 HIS 139 2HB HIS 139 12.790 4.483 -2.788 1100 HB3 HIS 139 3HB HIS 139 11.127 4.074 -2.381 1101 HD1 HIS 139 HD1 HIS 139 9.832 5.740 -0.901 1102 HD2 HIS 139 HD2 HIS 139 13.780 6.856 -1.571 1103 HE1 HIS 139 HE1 HIS 139 9.999 8.125 -0.129 1104 HE2 HIS 139 HE2 HIS 139 12.415 8.737 -0.460 1105 H GLN 140 H GLN 140 12.939 4.066 1.529 1106 HA GLN 140 HA GLN 140 10.891 2.582 2.791 1107 HB2 GLN 140 2HB GLN 140 12.261 5.070 3.914 1108 HB3 GLN 140 3HB GLN 140 11.408 3.837 4.833 1109 HG2 GLN 140 2HG GLN 140 13.131 2.175 4.119 1110 HG3 GLN 140 3HG GLN 140 14.011 3.479 3.326 1111 HE21 GLN 140 1HE2 GLN 140 14.916 1.739 5.438 1112 HE22 GLN 140 2HE2 GLN 140 15.349 2.744 6.770 1113 H PHE 141 H PHE 141 8.940 3.228 3.721 1114 HA PHE 141 HA PHE 141 7.456 5.420 2.635 1115 HB2 PHE 141 2HB PHE 141 6.865 3.787 5.142 1116 HB3 PHE 141 3HB PHE 141 5.715 4.742 4.216 1117 HD1 PHE 141 HD1 PHE 141 5.318 4.000 1.732 1118 HD2 PHE 141 HD2 PHE 141 7.071 1.479 4.708 1119 HE1 PHE 141 HE1 PHE 141 4.694 2.013 0.439 1120 HE2 PHE 141 HE2 PHE 141 6.446 -0.497 3.404 1121 HZ PHE 141 HZ PHE 141 5.259 -0.238 1.258 1122 H GLU 142 H GLU 142 8.105 7.482 3.141 1123 HA GLU 142 HA GLU 142 8.810 8.152 5.927 1124 HB2 GLU 142 2HB GLU 142 10.822 9.428 5.019 1125 HB3 GLU 142 3HB GLU 142 10.944 7.673 4.991 1126 HG2 GLU 142 2HG GLU 142 10.322 7.716 2.561 1127 HG3 GLU 142 3HG GLU 142 10.352 9.477 2.622 1128 H GLY 143 H GLY 143 6.967 9.300 6.182 1129 HA2 GLY 143 2HA GLY 143 7.034 12.069 5.501 1130 HA3 GLY 143 3HA GLY 143 5.811 11.232 4.548 1131 H GLU 144 H GLU 144 6.359 9.812 7.582 1132 HA GLU 144 HA GLU 144 5.371 9.709 9.580 1133 HB2 GLU 144 2HB GLU 144 4.644 12.634 9.118 1134 HB3 GLU 144 3HB GLU 144 4.544 11.797 10.665 1135 HG2 GLU 144 2HG GLU 144 7.050 12.451 9.088 1136 HG3 GLU 144 3HG GLU 144 6.553 13.130 10.638 1137 H THR 145 H THR 145 3.619 9.581 6.918 1138 HA THR 145 HA THR 145 1.126 8.994 8.320 1139 HB THR 145 HB THR 145 1.140 10.946 5.961 1140 HG1 THR 145 HG1 THR 145 1.109 11.307 8.719 1141 HG21 THR 145 3HG2 THR 145 -1.188 9.939 7.654 1142 HG22 THR 145 1HG2 THR 145 -0.862 9.465 5.982 1143 HG23 THR 145 2HG2 THR 145 -1.285 11.136 6.360 1144 H PHE 146 H PHE 146 0.490 7.083 7.625 1145 HA PHE 146 HA PHE 146 1.241 6.031 4.986 1146 HB2 PHE 146 2HB PHE 146 0.203 4.764 7.550 1147 HB3 PHE 146 3HB PHE 146 0.121 3.887 6.026 1148 HD1 PHE 146 HD2 PHE 146 2.510 5.499 8.416 1149 HD2 PHE 146 HD1 PHE 146 2.024 2.798 5.134 1150 HE1 PHE 146 HE2 PHE 146 4.837 4.734 8.688 1151 HE2 PHE 146 HE1 PHE 146 4.337 2.047 5.413 1152 HZ PHE 146 HZ PHE 146 5.751 3.005 7.177 1153 H TYR 147 H TYR 147 -0.258 5.330 3.507 1154 HA TYR 147 HA TYR 147 -3.137 5.799 3.998 1155 HB2 TYR 147 2HB TYR 147 -1.485 6.478 1.531 1156 HB3 TYR 147 3HB TYR 147 -3.214 6.184 1.400 1157 HD1 TYR 147 HD1 TYR 147 -0.783 8.304 3.341 1158 HD2 TYR 147 HD2 TYR 147 -4.674 8.014 1.615 1159 HE1 TYR 147 HE1 TYR 147 -1.212 10.650 3.894 1160 HE2 TYR 147 HE2 TYR 147 -5.090 10.368 2.172 1161 HH TYR 147 HH TYR 147 -2.585 12.473 3.296 1162 H ILE 148 H ILE 148 -4.345 4.033 3.718 1163 HA ILE 148 HA ILE 148 -3.212 1.689 2.284 1164 HB ILE 148 HB ILE 148 -5.124 1.712 4.674 1165 HG12 ILE 148 2HG1 ILE 148 -2.200 0.834 4.455 1166 HG13 ILE 148 3HG1 ILE 148 -2.809 2.215 5.359 1167 HG21 ILE 148 1HG2 ILE 148 -3.981 -0.662 3.161 1168 HG22 ILE 148 2HG2 ILE 148 -5.658 -0.117 3.115 1169 HG23 ILE 148 3HG2 ILE 148 -4.978 -0.743 4.615 1170 HD11 ILE 148 3HD1 ILE 148 -3.984 0.685 6.883 1171 HD12 ILE 148 1HD1 ILE 148 -2.246 0.399 6.842 1172 HD13 ILE 148 2HD1 ILE 148 -3.335 -0.694 5.989 1173 H ILE 149 H ILE 149 -4.198 1.444 0.393 1174 HA ILE 149 HA ILE 149 -6.940 2.450 -0.056 1175 HB ILE 149 HB ILE 149 -4.893 1.587 -2.164 1176 HG12 ILE 149 2HG1 ILE 149 -3.863 3.429 -0.951 1177 HG13 ILE 149 3HG1 ILE 149 -4.422 4.040 -2.501 1178 HG21 ILE 149 1HG2 ILE 149 -6.285 2.918 -3.719 1179 HG22 ILE 149 2HG2 ILE 149 -7.414 3.276 -2.410 1180 HG23 ILE 149 3HG2 ILE 149 -7.208 1.614 -2.969 1181 HD11 ILE 149 3HD1 ILE 149 -5.779 4.448 0.165 1182 HD12 ILE 149 1HD1 ILE 149 -6.351 5.068 -1.388 1183 HD13 ILE 149 2HD1 ILE 149 -4.819 5.629 -0.724 1184 H GLU 150 H GLU 150 -8.547 0.958 -0.234 1185 HA GLU 150 HA GLU 150 -8.066 -1.841 -0.027 1186 HB2 GLU 150 2HB GLU 150 -10.050 -0.708 0.966 1187 HB3 GLU 150 3HB GLU 150 -10.664 -0.365 -0.650 1188 HG2 GLU 150 2HG GLU 150 -10.896 -2.785 -1.086 1189 HG3 GLU 150 3HG GLU 150 -10.229 -3.147 0.505 1190 H GLN 151 H GLN 151 -7.207 -2.903 -1.689 1191 HA GLN 151 HA GLN 151 -7.964 -2.332 -4.480 1192 HB2 GLN 151 2HB GLN 151 -5.773 -4.135 -3.347 1193 HB3 GLN 151 3HB GLN 151 -6.036 -3.794 -5.054 1194 HG2 GLN 151 2HG GLN 151 -5.272 -1.729 -2.966 1195 HG3 GLN 151 3HG GLN 151 -4.148 -2.521 -4.069 1196 HE21 GLN 151 1HE2 GLN 151 -4.836 0.334 -3.750 1197 HE22 GLN 151 2HE2 GLN 151 -5.332 0.873 -5.311 1198 H ARG 152 H ARG 152 -9.907 -3.311 -4.770 1199 HA ARG 152 HA ARG 152 -10.547 -5.973 -3.845 1200 HB2 ARG 152 2HB ARG 152 -11.967 -3.965 -5.645 1201 HB3 ARG 152 3HB ARG 152 -12.626 -5.571 -5.338 1202 HG2 ARG 152 2HG ARG 152 -11.938 -3.658 -3.081 1203 HG3 ARG 152 3HG ARG 152 -13.513 -3.647 -3.883 1204 HD2 ARG 152 2HD ARG 152 -13.998 -5.873 -3.137 1205 HD3 ARG 152 3HD ARG 152 -12.330 -6.133 -2.613 1206 HE ARG 152 HE ARG 152 -13.549 -3.936 -1.254 1207 HH11 ARG 152 1HH1 ARG 152 -13.354 -7.449 -1.247 1208 HH12 ARG 152 2HH1 ARG 152 -13.729 -7.580 0.439 1209 HH21 ARG 152 1HH2 ARG 152 -13.960 -4.126 0.970 1210 HH22 ARG 152 2HH2 ARG 152 -14.070 -5.701 1.694 1211 H LEU 153 H LEU 153 -11.554 -7.492 -5.651 1212 HA LEU 153 HA LEU 153 -9.421 -8.476 -7.216 1213 HB2 LEU 153 2HB LEU 153 -12.397 -9.075 -7.354 1214 HB3 LEU 153 3HB LEU 153 -11.170 -10.007 -8.200 1215 HG LEU 153 HG LEU 153 -11.368 -9.751 -5.167 1216 HD11 LEU 153 1HD1 LEU 153 -13.262 -11.018 -6.060 1217 HD12 LEU 153 2HD1 LEU 153 -12.158 -12.069 -5.178 1218 HD13 LEU 153 3HD1 LEU 153 -12.159 -12.081 -6.943 1219 HD21 LEU 153 3HD2 LEU 153 -9.066 -10.116 -5.901 1220 HD22 LEU 153 1HD2 LEU 153 -9.567 -11.500 -6.879 1221 HD23 LEU 153 2HD2 LEU 153 -9.696 -11.562 -5.119 1222 H GLU 154 H GLU 154 -9.364 -8.745 -9.529 1223 HA GLU 154 HA GLU 154 -9.354 -6.305 -10.899 1224 HB2 GLU 154 2HB GLU 154 -8.807 -7.768 -12.920 1225 HB3 GLU 154 3HB GLU 154 -7.767 -7.966 -11.515 1226 HG2 GLU 154 2HG GLU 154 -8.816 -10.035 -10.911 1227 HG3 GLU 154 3HG GLU 154 -10.104 -9.793 -12.086 1228 H HIS 155 H HIS 155 -11.896 -8.727 -10.743 1229 HA HIS 155 HA HIS 155 -13.195 -7.844 -13.197 1230 HB2 HIS 155 2HB HIS 155 -13.964 -9.974 -11.167 1231 HB3 HIS 155 3HB HIS 155 -14.934 -9.590 -12.585 1232 HD1 HIS 155 HD1 HIS 155 -14.056 -10.380 -14.882 1233 HD2 HIS 155 HD2 HIS 155 -11.540 -11.335 -11.722 1234 HE1 HIS 155 HE1 HIS 155 -12.357 -11.964 -15.828 1235 HE2 HIS 155 HE2 HIS 155 -10.710 -12.291 -13.959 1236 H HIS 156 H HIS 156 -13.415 -5.650 -12.446 1237 HA HIS 156 HA HIS 156 -16.164 -5.250 -11.450 1238 HB2 HIS 156 2HB HIS 156 -13.700 -3.635 -10.658 1239 HB3 HIS 156 3HB HIS 156 -15.318 -2.950 -10.560 1240 HD1 HIS 156 HD1 HIS 156 -16.693 -3.517 -8.531 1241 HD2 HIS 156 HD2 HIS 156 -13.273 -5.837 -8.814 1242 HE1 HIS 156 HE1 HIS 156 -16.558 -4.778 -6.371 1243 HE2 HIS 156 HE2 HIS 156 -14.427 -6.107 -6.539 1244 H HIS 157 H HIS 157 -17.303 -3.752 -12.600 1245 HA HIS 157 HA HIS 157 -16.074 -2.609 -15.042 1246 HB2 HIS 157 2HB HIS 157 -17.281 -4.737 -15.561 1247 HB3 HIS 157 3HB HIS 157 -18.747 -4.087 -14.840 1248 HD1 HIS 157 HD1 HIS 157 -20.337 -3.336 -16.595 1249 HD2 HIS 157 HD2 HIS 157 -16.403 -2.852 -17.814 1250 HE1 HIS 157 HE1 HIS 157 -20.463 -2.406 -18.924 1251 HE2 HIS 157 HE2 HIS 157 -18.072 -2.048 -19.604 1252 H HIS 158 H HIS 158 -16.950 -0.636 -15.706 1253 HA HIS 158 HA HIS 158 -18.295 0.960 -13.738 1254 HB2 HIS 158 2HB HIS 158 -17.473 1.535 -16.614 1255 HB3 HIS 158 3HB HIS 158 -18.259 2.730 -15.583 1256 HD1 HIS 158 HD1 HIS 158 -14.965 1.267 -16.335 1257 HD2 HIS 158 HD2 HIS 158 -16.664 3.522 -13.293 1258 HE1 HIS 158 HE1 HIS 158 -13.043 2.108 -14.965 1259 HE2 HIS 158 HE2 HIS 158 -14.097 3.686 -13.311 1260 H HIS 159 H HIS 159 -20.358 0.697 -13.315 1261 HA HIS 159 HA HIS 159 -22.239 -0.582 -15.027 1262 HB2 HIS 159 2HB HIS 159 -22.569 0.860 -12.366 1263 HB3 HIS 159 3HB HIS 159 -23.916 0.094 -13.203 1264 HD1 HIS 159 HD1 HIS 159 -24.140 -1.417 -11.054 1265 HD2 HIS 159 HD2 HIS 159 -20.648 -1.990 -13.225 1266 HE1 HIS 159 HE1 HIS 159 -23.186 -3.585 -10.232 1267 HE2 HIS 159 HE2 HIS 159 -21.183 -3.992 -11.698 1268 H HIS 160 H HIS 160 -23.879 0.221 -16.214 1269 HA HIS 160 HA HIS 160 -24.833 2.923 -16.094 1270 HB2 HIS 160 2HB HIS 160 -22.815 3.271 -17.523 1271 HB3 HIS 160 3HB HIS 160 -23.377 2.031 -18.642 1272 HD1 HIS 160 HD1 HIS 160 -25.118 2.720 -20.371 1273 HD2 HIS 160 HD2 HIS 160 -24.361 5.703 -17.576 1274 HE1 HIS 160 HE1 HIS 160 -26.261 4.773 -21.251 1275 HE2 HIS 160 HE2 HIS 160 -25.930 6.511 -19.458 Start of MODEL 3 1 H1 MET 1 1H MET 1 -12.612 -3.741 4.158 2 H2 MET 1 2H MET 1 -11.532 -4.126 5.406 3 H3 MET 1 3H MET 1 -13.189 -4.401 5.608 4 HA MET 1 HA MET 1 -11.424 -5.746 3.654 5 HB2 MET 1 2HB MET 1 -11.039 -6.459 6.023 6 HB3 MET 1 3HB MET 1 -12.740 -6.877 6.163 7 HG2 MET 1 2HG MET 1 -12.449 -8.595 4.402 8 HG3 MET 1 3HG MET 1 -10.735 -8.183 4.307 9 HE1 MET 1 3HE MET 1 -11.562 -11.174 4.720 10 HE2 MET 1 1HE MET 1 -10.481 -11.644 6.029 11 HE3 MET 1 2HE MET 1 -9.892 -10.606 4.732 12 H VAL 2 H VAL 2 -14.653 -5.103 4.818 13 HA VAL 2 HA VAL 2 -15.869 -6.814 2.748 14 HB VAL 2 HB VAL 2 -17.349 -5.335 4.972 15 HG11 VAL 2 1HG1 VAL 2 -19.155 -6.949 4.543 16 HG12 VAL 2 2HG1 VAL 2 -18.193 -7.713 3.276 17 HG13 VAL 2 3HG1 VAL 2 -18.746 -6.048 3.082 18 HG21 VAL 2 3HG2 VAL 2 -15.733 -6.835 6.061 19 HG22 VAL 2 1HG2 VAL 2 -16.341 -8.203 5.123 20 HG23 VAL 2 2HG2 VAL 2 -17.384 -7.404 6.301 21 H GLU 3 H GLU 3 -15.389 -5.453 0.990 22 HA GLU 3 HA GLU 3 -16.304 -2.747 0.793 23 HB2 GLU 3 2HB GLU 3 -15.046 -4.726 -1.034 24 HB3 GLU 3 3HB GLU 3 -16.172 -3.657 -1.849 25 HG2 GLU 3 2HG GLU 3 -14.883 -1.705 -0.861 26 HG3 GLU 3 3HG GLU 3 -13.674 -2.880 -0.335 27 HA PRO 4 HA PRO 4 -20.560 -3.572 -0.822 28 HB2 PRO 4 2HB PRO 4 -20.957 -1.241 -2.193 29 HB3 PRO 4 3HB PRO 4 -21.026 -1.310 -0.422 30 HG2 PRO 4 2HG PRO 4 -18.746 -0.432 -2.171 31 HG3 PRO 4 3HG PRO 4 -19.410 0.353 -0.720 32 HD2 PRO 4 2HD PRO 4 -17.176 -1.180 -0.625 33 HD3 PRO 4 3HD PRO 4 -18.326 -1.108 0.734 34 H GLY 5 H GLY 5 -17.643 -3.042 -2.557 35 HA2 GLY 5 2HA GLY 5 -16.915 -4.305 -4.386 36 HA3 GLY 5 3HA GLY 5 -18.582 -4.622 -4.846 37 H VAL 6 H VAL 6 -16.541 -1.746 -4.315 38 HA VAL 6 HA VAL 6 -17.459 -0.652 -6.914 39 HB VAL 6 HB VAL 6 -17.005 1.632 -5.987 40 HG11 VAL 6 1HG1 VAL 6 -19.078 0.023 -4.444 41 HG12 VAL 6 2HG1 VAL 6 -19.291 0.759 -6.034 42 HG13 VAL 6 3HG1 VAL 6 -19.058 1.782 -4.617 43 HG21 VAL 6 3HG2 VAL 6 -15.424 1.072 -4.168 44 HG22 VAL 6 1HG2 VAL 6 -16.704 0.238 -3.283 45 HG23 VAL 6 2HG2 VAL 6 -16.793 1.984 -3.538 46 H ALA 7 H ALA 7 -14.701 -0.799 -4.646 47 HA ALA 7 HA ALA 7 -12.472 -0.475 -4.832 48 HB1 ALA 7 3HB ALA 7 -12.786 -2.757 -5.727 49 HB2 ALA 7 1HB ALA 7 -11.391 -1.960 -6.455 50 HB3 ALA 7 2HB ALA 7 -12.896 -2.107 -7.364 51 H LYS 8 H LYS 8 -13.900 1.789 -5.825 52 HA LYS 8 HA LYS 8 -12.980 2.522 -8.438 53 HB2 LYS 8 2HB LYS 8 -15.160 3.347 -7.585 54 HB3 LYS 8 3HB LYS 8 -14.325 4.293 -6.357 55 HG2 LYS 8 2HG LYS 8 -13.206 5.612 -8.123 56 HG3 LYS 8 3HG LYS 8 -14.032 4.667 -9.361 57 HD2 LYS 8 2HD LYS 8 -16.200 5.569 -8.642 58 HD3 LYS 8 3HD LYS 8 -15.426 6.431 -7.307 59 HE2 LYS 8 2HE LYS 8 -14.195 7.839 -8.866 60 HE3 LYS 8 3HE LYS 8 -14.803 6.917 -10.241 61 HZ1 LYS 8 3HZ LYS 8 -17.013 7.702 -9.782 62 HZ2 LYS 8 1HZ LYS 8 -15.963 9.020 -9.917 63 HZ3 LYS 8 2HZ LYS 8 -16.493 8.515 -8.394 64 H LEU 9 H LEU 9 -10.811 2.321 -8.285 65 HA LEU 9 HA LEU 9 -9.418 4.798 -7.669 66 HB2 LEU 9 2HB LEU 9 -8.913 3.369 -5.684 67 HB3 LEU 9 3HB LEU 9 -8.402 2.063 -6.742 68 HG LEU 9 HG LEU 9 -6.544 3.584 -7.589 69 HD11 LEU 9 1HD1 LEU 9 -7.377 5.353 -5.276 70 HD12 LEU 9 2HD1 LEU 9 -7.480 5.747 -6.994 71 HD13 LEU 9 3HD1 LEU 9 -5.905 5.531 -6.235 72 HD21 LEU 9 3HD2 LEU 9 -6.081 1.825 -5.961 73 HD22 LEU 9 1HD2 LEU 9 -6.489 2.913 -4.636 74 HD23 LEU 9 2HD2 LEU 9 -5.081 3.239 -5.646 75 H THR 10 H THR 10 -8.322 5.293 -9.493 76 HA THR 10 HA THR 10 -8.680 3.729 -11.830 77 HB THR 10 HB THR 10 -7.372 5.512 -12.965 78 HG1 THR 10 HG1 THR 10 -6.892 7.331 -11.307 79 HG21 THR 10 3HG2 THR 10 -9.358 6.634 -10.951 80 HG22 THR 10 1HG2 THR 10 -9.768 5.934 -12.520 81 HG23 THR 10 2HG2 THR 10 -8.827 7.422 -12.437 82 H THR 11 H THR 11 -7.140 2.717 -13.170 83 HA THR 11 HA THR 11 -5.389 0.990 -11.813 84 HB THR 11 HB THR 11 -4.718 0.304 -14.213 85 HG1 THR 11 HG1 THR 11 -6.747 1.435 -15.495 86 HG21 THR 11 3HG2 THR 11 -7.696 0.327 -13.558 87 HG22 THR 11 1HG2 THR 11 -6.533 -0.876 -12.994 88 HG23 THR 11 2HG2 THR 11 -6.904 -0.743 -14.714 89 H TYR 12 H TYR 12 -4.670 3.751 -14.005 90 HA TYR 12 HA TYR 12 -1.886 3.554 -14.016 91 HB2 TYR 12 2HB TYR 12 -1.830 5.960 -14.686 92 HB3 TYR 12 3HB TYR 12 -3.006 5.030 -15.603 93 HD1 TYR 12 HD2 TYR 12 -2.655 7.545 -12.865 94 HD2 TYR 12 HD1 TYR 12 -5.349 5.654 -15.589 95 HE1 TYR 12 HE2 TYR 12 -4.411 9.140 -12.252 96 HE2 TYR 12 HE1 TYR 12 -7.093 7.264 -14.969 97 HH TYR 12 HH TYR 12 -6.481 10.035 -13.043 98 H ALA 13 H ALA 13 -4.013 5.111 -11.634 99 HA ALA 13 HA ALA 13 -1.949 6.463 -10.173 100 HB1 ALA 13 3HB ALA 13 -3.720 6.959 -8.546 101 HB2 ALA 13 1HB ALA 13 -4.783 5.779 -9.324 102 HB3 ALA 13 2HB ALA 13 -4.294 7.233 -10.192 103 H SER 14 H SER 14 -3.577 3.348 -9.881 104 HA SER 14 HA SER 14 -2.598 2.565 -7.327 105 HB2 SER 14 2HB SER 14 -3.479 0.797 -9.658 106 HB3 SER 14 3HB SER 14 -3.334 0.289 -7.971 107 HG SER 14 HG SER 14 -5.077 2.308 -8.940 108 H LYS 15 H LYS 15 -1.371 2.155 -10.635 109 HA LYS 15 HA LYS 15 0.783 0.376 -9.812 110 HB2 LYS 15 2HB LYS 15 0.230 1.459 -12.601 111 HB3 LYS 15 3HB LYS 15 1.240 0.080 -12.179 112 HG2 LYS 15 2HG LYS 15 -1.768 0.290 -12.005 113 HG3 LYS 15 3HG LYS 15 -0.820 -0.814 -12.999 114 HD2 LYS 15 2HD LYS 15 -0.095 -2.040 -11.023 115 HD3 LYS 15 3HD LYS 15 -0.863 -0.865 -9.956 116 HE2 LYS 15 2HE LYS 15 -3.073 -1.533 -10.861 117 HE3 LYS 15 3HE LYS 15 -2.270 -2.748 -11.864 118 HZ1 LYS 15 3HZ LYS 15 -3.136 -3.725 -9.838 119 HZ2 LYS 15 1HZ LYS 15 -2.228 -2.656 -8.891 120 HZ3 LYS 15 2HZ LYS 15 -1.444 -3.811 -9.849 121 H GLN 16 H GLN 16 0.442 3.749 -10.786 122 HA GLN 16 HA GLN 16 3.199 4.404 -10.876 123 HB2 GLN 16 2HB GLN 16 0.743 6.090 -10.241 124 HB3 GLN 16 3HB GLN 16 2.364 6.772 -10.205 125 HG2 GLN 16 2HG GLN 16 1.052 5.510 -12.622 126 HG3 GLN 16 3HG GLN 16 1.182 7.237 -12.312 127 HE21 GLN 16 1HE2 GLN 16 3.964 7.070 -11.316 128 HE22 GLN 16 2HE2 GLN 16 4.940 6.768 -12.705 129 H ALA 17 H ALA 17 0.838 4.142 -8.253 130 HA ALA 17 HA ALA 17 2.331 5.163 -6.122 131 HB1 ALA 17 3HB ALA 17 -0.069 4.633 -5.982 132 HB2 ALA 17 1HB ALA 17 0.836 3.874 -4.672 133 HB3 ALA 17 2HB ALA 17 0.300 2.910 -6.052 134 H THR 18 H THR 18 2.054 1.767 -7.253 135 HA THR 18 HA THR 18 3.918 0.663 -5.429 136 HB THR 18 HB THR 18 3.963 -1.302 -7.041 137 HG1 THR 18 HG1 THR 18 3.589 -0.402 -9.015 138 HG21 THR 18 3HG2 THR 18 1.615 -1.934 -6.709 139 HG22 THR 18 1HG2 THR 18 1.198 -0.261 -6.328 140 HG23 THR 18 2HG2 THR 18 2.258 -1.175 -5.251 141 H ASP 19 H ASP 19 4.288 2.102 -8.592 142 HA ASP 19 HA ASP 19 7.003 1.406 -9.070 143 HB2 ASP 19 2HB ASP 19 5.337 2.225 -10.810 144 HB3 ASP 19 3HB ASP 19 5.525 3.846 -10.147 145 H MET 20 H MET 20 5.436 4.012 -7.331 146 HA MET 20 HA MET 20 7.944 5.376 -6.674 147 HB2 MET 20 2HB MET 20 5.043 5.992 -5.982 148 HB3 MET 20 3HB MET 20 6.402 6.970 -5.449 149 HG2 MET 20 2HG MET 20 6.942 7.524 -7.766 150 HG3 MET 20 3HG MET 20 5.636 6.488 -8.334 151 HE1 MET 20 3HE MET 20 3.029 7.049 -7.990 152 HE2 MET 20 1HE MET 20 2.460 8.406 -7.028 153 HE3 MET 20 2HE MET 20 3.299 7.069 -6.246 154 H GLY 21 H GLY 21 6.660 2.598 -5.538 155 HA2 GLY 21 2HA GLY 21 8.042 1.478 -3.932 156 HA3 GLY 21 3HA GLY 21 8.189 2.972 -3.025 157 H ALA 22 H ALA 22 4.971 2.521 -3.954 158 HA ALA 22 HA ALA 22 4.123 1.718 -1.322 159 HB1 ALA 22 3HB ALA 22 2.753 3.246 -2.692 160 HB2 ALA 22 1HB ALA 22 1.848 1.812 -2.213 161 HB3 ALA 22 2HB ALA 22 2.471 1.953 -3.860 162 H ILE 23 H ILE 23 2.946 -0.230 -0.810 163 HA ILE 23 HA ILE 23 3.799 -2.561 -2.444 164 HB ILE 23 HB ILE 23 4.089 -3.834 -0.322 165 HG12 ILE 23 2HG1 ILE 23 3.591 -1.152 1.070 166 HG13 ILE 23 3HG1 ILE 23 2.494 -2.524 1.098 167 HG21 ILE 23 1HG2 ILE 23 6.196 -2.753 0.419 168 HG22 ILE 23 2HG2 ILE 23 5.740 -1.278 -0.434 169 HG23 ILE 23 3HG2 ILE 23 6.055 -2.759 -1.342 170 HD11 ILE 23 3HD1 ILE 23 4.146 -3.819 2.350 171 HD12 ILE 23 1HD1 ILE 23 3.716 -2.320 3.173 172 HD13 ILE 23 2HD1 ILE 23 5.251 -2.442 2.315 173 H TYR 24 H TYR 24 2.422 -4.340 -2.547 174 HA TYR 24 HA TYR 24 -0.354 -3.957 -1.646 175 HB2 TYR 24 2HB TYR 24 0.896 -5.807 -3.710 176 HB3 TYR 24 3HB TYR 24 -0.726 -6.094 -3.087 177 HD1 TYR 24 HD1 TYR 24 -2.102 -3.613 -3.016 178 HD2 TYR 24 HD2 TYR 24 0.802 -4.879 -5.890 179 HE1 TYR 24 HE1 TYR 24 -3.096 -2.106 -4.686 180 HE2 TYR 24 HE2 TYR 24 -0.199 -3.363 -7.552 181 HH TYR 24 HH TYR 24 -2.458 -0.948 -6.759 182 H VAL 25 H VAL 25 -0.791 -4.743 0.258 183 HA VAL 25 HA VAL 25 0.159 -7.439 1.060 184 HB VAL 25 HB VAL 25 -0.273 -6.827 3.406 185 HG11 VAL 25 1HG1 VAL 25 1.545 -5.176 3.759 186 HG12 VAL 25 2HG1 VAL 25 1.511 -4.773 2.040 187 HG13 VAL 25 3HG1 VAL 25 1.983 -6.393 2.560 188 HG21 VAL 25 3HG2 VAL 25 -1.032 -4.048 2.404 189 HG22 VAL 25 1HG2 VAL 25 -0.845 -4.511 4.099 190 HG23 VAL 25 2HG2 VAL 25 -2.127 -5.229 3.125 191 H ASN 26 H ASN 26 -1.725 -8.304 2.729 192 HA ASN 26 HA ASN 26 -4.378 -7.771 1.483 193 HB2 ASN 26 2HB ASN 26 -5.000 -10.097 1.790 194 HB3 ASN 26 3HB ASN 26 -3.488 -10.046 0.888 195 HD21 ASN 26 1HD2 ASN 26 -1.512 -10.525 2.084 196 HD22 ASN 26 2HD2 ASN 26 -1.593 -11.609 3.415 197 H SER 27 H SER 27 -5.966 -9.139 3.369 198 HA SER 27 HA SER 27 -6.133 -7.096 5.358 199 HB2 SER 27 2HB SER 27 -8.128 -8.170 4.361 200 HB3 SER 27 3HB SER 27 -7.728 -9.677 5.178 201 HG SER 27 HG SER 27 -7.812 -7.544 6.890 202 H LYS 28 H LYS 28 -4.436 -10.087 5.377 203 HA LYS 28 HA LYS 28 -4.129 -10.175 8.260 204 HB2 LYS 28 2HB LYS 28 -2.447 -11.494 6.076 205 HB3 LYS 28 3HB LYS 28 -2.307 -11.807 7.805 206 HG2 LYS 28 2HG LYS 28 -4.728 -12.410 6.081 207 HG3 LYS 28 3HG LYS 28 -3.566 -13.587 6.701 208 HD2 LYS 28 2HD LYS 28 -4.237 -13.054 9.018 209 HD3 LYS 28 3HD LYS 28 -5.371 -11.836 8.421 210 HE2 LYS 28 2HE LYS 28 -6.546 -13.899 9.009 211 HE3 LYS 28 3HE LYS 28 -6.658 -13.607 7.271 212 HZ1 LYS 28 3HZ LYS 28 -6.178 -15.915 7.766 213 HZ2 LYS 28 1HZ LYS 28 -4.771 -15.483 8.597 214 HZ3 LYS 28 2HZ LYS 28 -4.885 -15.214 6.933 215 H GLY 29 H GLY 29 -2.083 -9.166 5.480 216 HA2 GLY 29 2HA GLY 29 -1.180 -6.866 5.630 217 HA3 GLY 29 3HA GLY 29 -0.718 -7.219 7.285 218 H ASP 30 H ASP 30 -0.159 -9.943 5.440 219 HA ASP 30 HA ASP 30 2.705 -9.488 5.314 220 HB2 ASP 30 2HB ASP 30 2.780 -11.827 4.399 221 HB3 ASP 30 3HB ASP 30 1.939 -11.712 5.938 222 H ARG 31 H ARG 31 3.967 -9.303 3.493 223 HA ARG 31 HA ARG 31 2.987 -8.081 1.164 224 HB2 ARG 31 2HB ARG 31 5.319 -7.775 1.749 225 HB3 ARG 31 3HB ARG 31 5.624 -9.512 1.715 226 HG2 ARG 31 2HG ARG 31 5.204 -9.516 -0.736 227 HG3 ARG 31 3HG ARG 31 4.965 -7.771 -0.683 228 HD2 ARG 31 2HD ARG 31 7.535 -9.153 0.136 229 HD3 ARG 31 3HD ARG 31 7.238 -8.512 -1.478 230 HE ARG 31 HE ARG 31 8.001 -7.057 0.856 231 HH11 ARG 31 1HH1 ARG 31 6.206 -6.712 -2.156 232 HH12 ARG 31 2HH1 ARG 31 6.440 -4.999 -2.231 233 HH21 ARG 31 1HH2 ARG 31 8.307 -4.832 0.728 234 HH22 ARG 31 2HH2 ARG 31 7.633 -3.930 -0.589 235 H ILE 32 H ILE 32 1.676 -9.013 -0.324 236 HA ILE 32 HA ILE 32 1.591 -11.900 -0.708 237 HB ILE 32 HB ILE 32 -0.286 -11.444 -2.291 238 HG12 ILE 32 2HG1 ILE 32 0.158 -8.502 -1.578 239 HG13 ILE 32 3HG1 ILE 32 0.464 -9.227 -3.151 240 HG21 ILE 32 1HG2 ILE 32 -1.898 -10.666 -0.590 241 HG22 ILE 32 2HG2 ILE 32 -0.568 -10.064 0.402 242 HG23 ILE 32 3HG2 ILE 32 -0.730 -11.796 0.101 243 HD11 ILE 32 3HD1 ILE 32 -1.938 -9.714 -3.367 244 HD12 ILE 32 1HD1 ILE 32 -1.592 -7.994 -3.185 245 HD13 ILE 32 2HD1 ILE 32 -2.219 -8.912 -1.818 246 H VAL 33 H VAL 33 2.975 -9.136 -2.328 247 HA VAL 33 HA VAL 33 4.372 -10.799 -4.253 248 HB VAL 33 HB VAL 33 2.169 -10.362 -5.373 249 HG11 VAL 33 1HG1 VAL 33 1.639 -8.171 -4.399 250 HG12 VAL 33 2HG1 VAL 33 1.547 -8.120 -6.159 251 HG13 VAL 33 3HG1 VAL 33 2.941 -7.424 -5.331 252 HG21 VAL 33 3HG2 VAL 33 3.059 -9.620 -7.556 253 HG22 VAL 33 1HG2 VAL 33 4.148 -10.761 -6.766 254 HG23 VAL 33 2HG2 VAL 33 4.528 -9.037 -6.766 255 H ASN 34 H ASN 34 6.126 -9.628 -5.303 256 HA ASN 34 HA ASN 34 7.573 -7.922 -3.594 257 HB2 ASN 34 2HB ASN 34 9.249 -7.792 -5.422 258 HB3 ASN 34 3HB ASN 34 8.691 -9.437 -5.169 259 HD21 ASN 34 1HD2 ASN 34 9.847 -7.900 -7.540 260 HD22 ASN 34 2HD2 ASN 34 8.786 -8.298 -8.842 261 H GLU 35 H GLU 35 5.745 -7.233 -6.494 262 HA GLU 35 HA GLU 35 5.185 -4.509 -5.806 263 HB2 GLU 35 2HB GLU 35 6.214 -3.480 -7.833 264 HB3 GLU 35 3HB GLU 35 7.446 -4.165 -6.777 265 HG2 GLU 35 2HG GLU 35 7.680 -6.115 -8.223 266 HG3 GLU 35 3HG GLU 35 6.347 -5.564 -9.236 267 H SER 36 H SER 36 4.053 -3.555 -8.021 268 HA SER 36 HA SER 36 2.109 -5.569 -8.833 269 HB2 SER 36 2HB SER 36 1.415 -3.206 -8.268 270 HB3 SER 36 3HB SER 36 2.256 -2.662 -9.718 271 HG SER 36 HG SER 36 0.890 -3.966 -10.943 272 H ASN 37 H ASN 37 3.478 -6.951 -10.014 273 HA ASN 37 HA ASN 37 5.019 -6.157 -12.274 274 HB2 ASN 37 2HB ASN 37 3.886 -8.908 -11.580 275 HB3 ASN 37 3HB ASN 37 5.081 -8.596 -12.836 276 HD21 ASN 37 1HD2 ASN 37 6.813 -9.675 -12.035 277 HD22 ASN 37 2HD2 ASN 37 7.561 -9.348 -10.513 278 H VAL 38 H VAL 38 1.914 -7.839 -12.015 279 HA VAL 38 HA VAL 38 0.745 -6.553 -14.311 280 HB VAL 38 HB VAL 38 2.172 -8.254 -15.436 281 HG11 VAL 38 1HG1 VAL 38 2.314 -9.920 -13.643 282 HG12 VAL 38 2HG1 VAL 38 1.810 -10.662 -15.160 283 HG13 VAL 38 3HG1 VAL 38 0.620 -10.357 -13.891 284 HG21 VAL 38 3HG2 VAL 38 0.051 -7.668 -16.525 285 HG22 VAL 38 1HG2 VAL 38 -0.780 -8.955 -15.645 286 HG23 VAL 38 2HG2 VAL 38 0.464 -9.355 -16.834 287 H TYR 39 H TYR 39 -1.539 -7.091 -14.501 288 HA TYR 39 HA TYR 39 -3.044 -7.419 -12.231 289 HB2 TYR 39 2HB TYR 39 -4.245 -6.613 -14.090 290 HB3 TYR 39 3HB TYR 39 -3.643 -7.868 -15.165 291 HD1 TYR 39 HD1 TYR 39 -5.991 -7.320 -12.270 292 HD2 TYR 39 HD2 TYR 39 -4.977 -9.783 -15.616 293 HE1 TYR 39 HE1 TYR 39 -8.035 -8.644 -11.933 294 HE2 TYR 39 HE2 TYR 39 -7.010 -11.100 -15.273 295 HH TYR 39 HH TYR 39 -9.530 -10.137 -13.266 296 H THR 40 H THR 40 -1.873 -9.984 -14.382 297 HA THR 40 HA THR 40 -3.480 -12.080 -13.456 298 HB THR 40 HB THR 40 -0.671 -12.519 -14.562 299 HG1 THR 40 HG1 THR 40 -1.683 -12.272 -16.654 300 HG21 THR 40 3HG2 THR 40 -1.748 -14.405 -15.725 301 HG22 THR 40 1HG2 THR 40 -3.309 -13.960 -15.030 302 HG23 THR 40 2HG2 THR 40 -2.003 -14.533 -13.982 303 H THR 41 H THR 41 -0.120 -11.217 -12.569 304 HA THR 41 HA THR 41 0.263 -13.191 -10.568 305 HB THR 41 HB THR 41 1.687 -10.492 -10.798 306 HG1 THR 41 HG1 THR 41 3.213 -11.752 -12.038 307 HG21 THR 41 3HG2 THR 41 3.601 -11.652 -9.750 308 HG22 THR 41 1HG2 THR 41 2.635 -13.120 -9.588 309 HG23 THR 41 2HG2 THR 41 2.198 -11.669 -8.681 310 H PHE 42 H PHE 42 -0.982 -9.891 -10.486 311 HA PHE 42 HA PHE 42 -0.951 -9.426 -7.693 312 HB2 PHE 42 2HB PHE 42 -1.106 -7.546 -9.208 313 HB3 PHE 42 3HB PHE 42 -2.555 -8.188 -9.970 314 HD1 PHE 42 HD1 PHE 42 -1.468 -7.315 -6.459 315 HD2 PHE 42 HD2 PHE 42 -4.489 -6.966 -9.469 316 HE1 PHE 42 HE1 PHE 42 -2.842 -5.959 -4.941 317 HE2 PHE 42 HE2 PHE 42 -5.853 -5.606 -7.937 318 HZ PHE 42 HZ PHE 42 -5.031 -5.102 -5.671 319 H ARG 43 H ARG 43 -3.588 -10.412 -9.881 320 HA ARG 43 HA ARG 43 -5.656 -10.739 -8.041 321 HB2 ARG 43 2HB ARG 43 -5.996 -10.736 -10.512 322 HB3 ARG 43 3HB ARG 43 -5.187 -12.296 -10.630 323 HG2 ARG 43 2HG ARG 43 -7.012 -13.256 -9.156 324 HG3 ARG 43 3HG ARG 43 -7.845 -11.705 -9.281 325 HD2 ARG 43 2HD ARG 43 -8.796 -13.245 -10.890 326 HD3 ARG 43 3HD ARG 43 -7.913 -11.989 -11.761 327 HE ARG 43 HE ARG 43 -6.483 -14.489 -11.217 328 HH11 ARG 43 1HH1 ARG 43 -8.297 -12.602 -13.570 329 HH12 ARG 43 2HH1 ARG 43 -7.716 -13.508 -14.931 330 HH21 ARG 43 1HH2 ARG 43 -5.743 -15.697 -13.005 331 HH22 ARG 43 2HH2 ARG 43 -6.256 -15.275 -14.610 332 H ASN 44 H ASN 44 -3.282 -13.070 -9.270 333 HA ASN 44 HA ASN 44 -4.208 -15.335 -7.838 334 HB2 ASN 44 2HB ASN 44 -1.537 -14.720 -9.172 335 HB3 ASN 44 3HB ASN 44 -1.902 -16.279 -8.433 336 HD21 ASN 44 1HD2 ASN 44 -1.316 -15.624 -11.222 337 HD22 ASN 44 2HD2 ASN 44 -2.656 -16.206 -12.142 338 H ALA 45 H ALA 45 -1.890 -12.798 -7.029 339 HA ALA 45 HA ALA 45 -0.704 -14.007 -4.753 340 HB1 ALA 45 3HB ALA 45 0.260 -12.052 -5.913 341 HB2 ALA 45 1HB ALA 45 0.050 -11.734 -4.191 342 HB3 ALA 45 2HB ALA 45 -1.085 -11.053 -5.359 343 H ILE 46 H ILE 46 -3.666 -12.215 -5.243 344 HA ILE 46 HA ILE 46 -4.439 -12.004 -2.458 345 HB ILE 46 HB ILE 46 -6.054 -11.557 -5.019 346 HG12 ILE 46 2HG1 ILE 46 -4.639 -9.479 -3.281 347 HG13 ILE 46 3HG1 ILE 46 -4.049 -10.053 -4.834 348 HG21 ILE 46 1HG2 ILE 46 -7.507 -11.916 -3.072 349 HG22 ILE 46 2HG2 ILE 46 -7.600 -10.244 -3.624 350 HG23 ILE 46 3HG2 ILE 46 -6.655 -10.647 -2.188 351 HD11 ILE 46 3HD1 ILE 46 -6.004 -9.114 -5.939 352 HD12 ILE 46 1HD1 ILE 46 -5.124 -7.893 -5.025 353 HD13 ILE 46 2HD1 ILE 46 -6.626 -8.554 -4.384 354 H LEU 47 H LEU 47 -5.123 -14.119 -5.224 355 HA LEU 47 HA LEU 47 -7.210 -15.691 -4.049 356 HB2 LEU 47 2HB LEU 47 -5.349 -16.248 -6.395 357 HB3 LEU 47 3HB LEU 47 -6.667 -17.316 -5.934 358 HG LEU 47 HG LEU 47 -7.005 -14.439 -6.865 359 HD11 LEU 47 1HD1 LEU 47 -6.264 -15.894 -8.687 360 HD12 LEU 47 2HD1 LEU 47 -7.939 -15.407 -8.921 361 HD13 LEU 47 3HD1 LEU 47 -7.568 -17.033 -8.338 362 HD21 LEU 47 3HD2 LEU 47 -9.086 -16.545 -6.207 363 HD22 LEU 47 1HD2 LEU 47 -9.412 -14.964 -6.922 364 HD23 LEU 47 2HD2 LEU 47 -8.755 -15.071 -5.287 365 H LYS 48 H LYS 48 -3.772 -15.776 -3.923 366 HA LYS 48 HA LYS 48 -3.303 -18.423 -3.010 367 HB2 LYS 48 2HB LYS 48 -1.599 -16.832 -3.952 368 HB3 LYS 48 3HB LYS 48 -1.739 -15.854 -2.497 369 HG2 LYS 48 2HG LYS 48 -0.944 -17.892 -1.186 370 HG3 LYS 48 3HG LYS 48 -0.607 -18.656 -2.743 371 HD2 LYS 48 2HD LYS 48 1.435 -17.642 -1.831 372 HD3 LYS 48 3HD LYS 48 0.954 -16.812 -3.312 373 HE2 LYS 48 2HE LYS 48 -0.071 -15.005 -1.943 374 HE3 LYS 48 3HE LYS 48 0.448 -15.836 -0.474 375 HZ1 LYS 48 3HZ LYS 48 2.741 -15.579 -1.200 376 HZ2 LYS 48 1HZ LYS 48 1.974 -14.084 -1.054 377 HZ3 LYS 48 2HZ LYS 48 2.236 -14.746 -2.583 378 H GLN 49 H GLN 49 -4.228 -15.424 -1.469 379 HA GLN 49 HA GLN 49 -4.306 -16.517 1.248 380 HB2 GLN 49 2HB GLN 49 -5.297 -13.840 0.157 381 HB3 GLN 49 3HB GLN 49 -5.120 -14.259 1.855 382 HG2 GLN 49 2HG GLN 49 -2.846 -14.002 -0.128 383 HG3 GLN 49 3HG GLN 49 -3.325 -12.773 1.045 384 HE21 GLN 49 1HE2 GLN 49 -2.983 -13.211 3.287 385 HE22 GLN 49 2HE2 GLN 49 -1.818 -14.370 3.807 386 H ALA 50 H ALA 50 -6.350 -16.650 2.427 387 HA ALA 50 HA ALA 50 -8.780 -17.177 0.938 388 HB1 ALA 50 3HB ALA 50 -8.345 -16.827 3.933 389 HB2 ALA 50 1HB ALA 50 -8.319 -18.356 3.055 390 HB3 ALA 50 2HB ALA 50 -9.818 -17.434 3.170 391 H ASP 51 H ASP 51 -7.197 -14.484 2.393 392 HA ASP 51 HA ASP 51 -9.373 -12.633 2.551 393 HB2 ASP 51 2HB ASP 51 -6.394 -11.987 2.303 394 HB3 ASP 51 3HB ASP 51 -7.643 -10.972 3.006 395 H LYS 52 H LYS 52 -10.441 -12.431 0.581 396 HA LYS 52 HA LYS 52 -9.011 -11.941 -1.919 397 HB2 LYS 52 2HB LYS 52 -11.843 -12.654 -1.201 398 HB3 LYS 52 3HB LYS 52 -11.609 -11.735 -2.685 399 HG2 LYS 52 2HG LYS 52 -11.695 -14.238 -3.004 400 HG3 LYS 52 3HG LYS 52 -10.255 -13.458 -3.660 401 HD2 LYS 52 2HD LYS 52 -8.925 -14.212 -1.758 402 HD3 LYS 52 3HD LYS 52 -10.353 -14.897 -0.975 403 HE2 LYS 52 2HE LYS 52 -9.084 -15.822 -3.571 404 HE3 LYS 52 3HE LYS 52 -9.009 -16.652 -2.019 405 HZ1 LYS 52 3HZ LYS 52 -11.444 -16.185 -3.647 406 HZ2 LYS 52 1HZ LYS 52 -11.430 -16.920 -2.125 407 HZ3 LYS 52 2HZ LYS 52 -10.648 -17.659 -3.429 408 H VAL 53 H VAL 53 -8.200 -10.101 -0.489 409 HA VAL 53 HA VAL 53 -9.247 -7.599 -1.425 410 HB VAL 53 HB VAL 53 -10.715 -7.836 0.492 411 HG11 VAL 53 1HG1 VAL 53 -9.951 -8.187 2.805 412 HG12 VAL 53 2HG1 VAL 53 -8.293 -8.392 2.238 413 HG13 VAL 53 3HG1 VAL 53 -9.537 -9.552 1.767 414 HG21 VAL 53 3HG2 VAL 53 -8.469 -5.907 1.186 415 HG22 VAL 53 1HG2 VAL 53 -10.104 -5.861 1.854 416 HG23 VAL 53 2HG2 VAL 53 -9.847 -5.578 0.133 417 H ALA 54 H ALA 54 -7.480 -6.442 -1.891 418 HA ALA 54 HA ALA 54 -4.936 -6.888 -0.450 419 HB1 ALA 54 3HB ALA 54 -4.789 -7.249 -2.872 420 HB2 ALA 54 1HB ALA 54 -3.848 -5.834 -2.404 421 HB3 ALA 54 2HB ALA 54 -5.424 -5.632 -3.181 422 H TYR 55 H TYR 55 -3.666 -4.978 -0.019 423 HA TYR 55 HA TYR 55 -5.147 -2.446 0.303 424 HB2 TYR 55 2HB TYR 55 -3.633 -3.973 2.462 425 HB3 TYR 55 3HB TYR 55 -3.985 -2.255 2.594 426 HD1 TYR 55 HD1 TYR 55 -6.383 -1.477 2.764 427 HD2 TYR 55 HD2 TYR 55 -5.366 -5.628 2.899 428 HE1 TYR 55 HE1 TYR 55 -8.565 -1.986 3.757 429 HE2 TYR 55 HE2 TYR 55 -7.555 -6.119 3.892 430 HH TYR 55 HH TYR 55 -10.063 -3.768 4.028 431 H LEU 56 H LEU 56 -4.068 -1.066 -0.857 432 HA LEU 56 HA LEU 56 -1.215 -1.278 -1.376 433 HB2 LEU 56 2HB LEU 56 -2.851 -0.715 -3.169 434 HB3 LEU 56 3HB LEU 56 -3.285 0.755 -2.311 435 HG LEU 56 HG LEU 56 -1.026 1.671 -2.682 436 HD11 LEU 56 1HD1 LEU 56 -0.412 -0.905 -4.153 437 HD12 LEU 56 2HD1 LEU 56 0.299 -0.368 -2.628 438 HD13 LEU 56 3HD1 LEU 56 0.614 0.531 -4.107 439 HD21 LEU 56 3HD2 LEU 56 -2.302 0.641 -5.239 440 HD22 LEU 56 1HD2 LEU 56 -1.142 1.968 -5.132 441 HD23 LEU 56 2HD2 LEU 56 -2.727 2.124 -4.380 442 H VAL 57 H VAL 57 0.011 -0.657 0.285 443 HA VAL 57 HA VAL 57 -0.720 1.633 1.994 444 HB VAL 57 HB VAL 57 1.532 -0.404 2.389 445 HG11 VAL 57 1HG1 VAL 57 1.582 0.400 4.730 446 HG12 VAL 57 2HG1 VAL 57 0.351 1.605 4.348 447 HG13 VAL 57 3HG1 VAL 57 1.942 1.700 3.591 448 HG21 VAL 57 3HG2 VAL 57 -1.250 -0.411 3.621 449 HG22 VAL 57 1HG2 VAL 57 0.066 -1.509 4.052 450 HG23 VAL 57 2HG2 VAL 57 -0.631 -1.558 2.432 451 H MET 58 H MET 58 0.185 3.563 1.533 452 HA MET 58 HA MET 58 2.979 3.727 0.582 453 HB2 MET 58 2HB MET 58 2.468 5.459 -1.011 454 HB3 MET 58 3HB MET 58 1.374 4.128 -1.345 455 HG2 MET 58 2HG MET 58 0.599 6.611 0.203 456 HG3 MET 58 3HG MET 58 0.348 6.401 -1.526 457 HE1 MET 58 3HE MET 58 -0.634 3.461 -1.891 458 HE2 MET 58 1HE MET 58 -1.483 4.844 -2.589 459 HE3 MET 58 2HE MET 58 -2.376 3.629 -1.674 460 H ASP 59 H ASP 59 3.904 5.932 0.979 461 HA ASP 59 HA ASP 59 3.039 7.184 3.482 462 HB2 ASP 59 2HB ASP 59 5.046 8.665 3.121 463 HB3 ASP 59 3HB ASP 59 5.454 6.957 3.120 464 H GLU 60 H GLU 60 3.173 9.752 3.328 465 HA GLU 60 HA GLU 60 0.820 10.481 1.922 466 HB2 GLU 60 2HB GLU 60 1.422 11.423 4.133 467 HB3 GLU 60 3HB GLU 60 2.754 12.312 3.399 468 HG2 GLU 60 2HG GLU 60 1.246 13.702 2.136 469 HG3 GLU 60 3HG GLU 60 -0.138 12.689 2.545 470 H ARG 61 H ARG 61 4.234 10.897 1.092 471 HA ARG 61 HA ARG 61 3.809 12.998 -0.856 472 HB2 ARG 61 2HB ARG 61 6.160 11.119 -0.391 473 HB3 ARG 61 3HB ARG 61 6.141 12.305 -1.690 474 HG2 ARG 61 2HG ARG 61 7.415 13.223 0.098 475 HG3 ARG 61 3HG ARG 61 5.894 14.111 0.042 476 HD2 ARG 61 2HD ARG 61 5.062 12.903 1.980 477 HD3 ARG 61 3HD ARG 61 6.464 11.830 1.970 478 HE ARG 61 HE ARG 61 6.292 14.459 3.093 479 HH11 ARG 61 1HH1 ARG 61 8.578 12.164 1.684 480 HH12 ARG 61 2HH1 ARG 61 9.948 12.882 2.472 481 HH21 ARG 61 1HH2 ARG 61 8.111 15.396 4.060 482 HH22 ARG 61 2HH2 ARG 61 9.682 14.706 3.813 483 H THR 62 H THR 62 4.339 9.484 -1.029 484 HA THR 62 HA THR 62 3.967 9.146 -3.804 485 HB THR 62 HB THR 62 3.476 7.184 -1.523 486 HG1 THR 62 HG1 THR 62 5.579 7.458 -1.407 487 HG21 THR 62 3HG2 THR 62 2.416 6.325 -3.591 488 HG22 THR 62 1HG2 THR 62 3.858 5.384 -3.193 489 HG23 THR 62 2HG2 THR 62 3.917 6.587 -4.480 490 H TRP 63 H TRP 63 1.707 9.365 -1.101 491 HA TRP 63 HA TRP 63 -0.675 8.710 -2.482 492 HB2 TRP 63 2HB TRP 63 -0.832 8.676 -0.106 493 HB3 TRP 63 3HB TRP 63 -0.161 10.299 0.057 494 HD1 TRP 63 HD1 TRP 63 -1.910 12.191 0.370 495 HE1 TRP 63 HE1 TRP 63 -4.441 12.436 0.035 496 HE3 TRP 63 HE3 TRP 63 -2.904 7.641 -1.770 497 HZ2 TRP 63 HZ2 TRP 63 -6.575 10.927 -0.996 498 HZ3 TRP 63 HZ3 TRP 63 -5.226 7.128 -2.412 499 HH2 TRP 63 HH2 TRP 63 -7.020 8.743 -2.031 500 H LYS 64 H LYS 64 0.901 11.910 -1.868 501 HA LYS 64 HA LYS 64 -1.036 13.576 -2.910 502 HB2 LYS 64 2HB LYS 64 1.986 13.885 -3.064 503 HB3 LYS 64 3HB LYS 64 0.855 15.170 -3.468 504 HG2 LYS 64 2HG LYS 64 1.288 13.906 -0.759 505 HG3 LYS 64 3HG LYS 64 1.698 15.545 -1.261 506 HD2 LYS 64 2HD LYS 64 -0.800 15.897 -1.667 507 HD3 LYS 64 3HD LYS 64 -1.066 14.365 -0.849 508 HE2 LYS 64 2HE LYS 64 -0.044 15.249 1.198 509 HE3 LYS 64 3HE LYS 64 0.322 16.768 0.371 510 HZ1 LYS 64 3HZ LYS 64 -2.042 17.158 0.086 511 HZ2 LYS 64 1HZ LYS 64 -1.684 16.939 1.724 512 HZ3 LYS 64 2HZ LYS 64 -2.407 15.691 0.847 513 H LYS 65 H LYS 65 1.392 11.690 -4.600 514 HA LYS 65 HA LYS 65 0.956 12.724 -7.207 515 HB2 LYS 65 2HB LYS 65 2.092 10.059 -6.283 516 HB3 LYS 65 3HB LYS 65 2.174 10.657 -7.934 517 HG2 LYS 65 2HG LYS 65 3.463 11.953 -5.515 518 HG3 LYS 65 3HG LYS 65 4.294 10.995 -6.738 519 HD2 LYS 65 2HD LYS 65 2.887 13.649 -7.218 520 HD3 LYS 65 3HD LYS 65 4.630 13.404 -7.104 521 HE2 LYS 65 2HE LYS 65 4.566 11.959 -9.101 522 HE3 LYS 65 3HE LYS 65 2.820 12.192 -9.215 523 HZ1 LYS 65 3HZ LYS 65 4.858 14.337 -9.440 524 HZ2 LYS 65 1HZ LYS 65 3.186 14.550 -9.553 525 HZ3 LYS 65 2HZ LYS 65 4.003 13.646 -10.723 526 H VAL 66 H VAL 66 -0.342 9.848 -5.499 527 HA VAL 66 HA VAL 66 -1.941 8.815 -7.587 528 HB VAL 66 HB VAL 66 -2.325 8.598 -4.554 529 HG11 VAL 66 1HG1 VAL 66 -4.437 8.037 -5.697 530 HG12 VAL 66 2HG1 VAL 66 -3.706 6.598 -4.989 531 HG13 VAL 66 3HG1 VAL 66 -3.590 6.879 -6.728 532 HG21 VAL 66 3HG2 VAL 66 -1.204 6.400 -4.789 533 HG22 VAL 66 1HG2 VAL 66 -0.162 7.720 -5.323 534 HG23 VAL 66 2HG2 VAL 66 -0.971 6.702 -6.513 535 H TYR 67 H TYR 67 -2.968 10.679 -4.743 536 HA TYR 67 HA TYR 67 -5.543 11.364 -5.256 537 HB2 TYR 67 2HB TYR 67 -4.291 11.850 -3.160 538 HB3 TYR 67 3HB TYR 67 -3.404 13.126 -3.978 539 HD1 TYR 67 HD1 TYR 67 -6.823 12.112 -2.869 540 HD2 TYR 67 HD2 TYR 67 -4.331 15.372 -4.076 541 HE1 TYR 67 HE1 TYR 67 -8.571 13.696 -2.207 542 HE2 TYR 67 HE2 TYR 67 -6.099 16.954 -3.405 543 HH TYR 67 HH TYR 67 -8.469 17.012 -3.034 544 H ASP 68 H ASP 68 -2.645 13.063 -6.422 545 HA ASP 68 HA ASP 68 -3.917 15.239 -7.704 546 HB2 ASP 68 2HB ASP 68 -1.499 15.282 -7.193 547 HB3 ASP 68 3HB ASP 68 -1.214 13.957 -8.318 548 H LEU 69 H LEU 69 -2.601 12.183 -9.024 549 HA LEU 69 HA LEU 69 -3.245 12.640 -11.722 550 HB2 LEU 69 2HB LEU 69 -2.803 10.026 -10.216 551 HB3 LEU 69 3HB LEU 69 -2.949 10.128 -11.963 552 HG LEU 69 HG LEU 69 -0.743 11.404 -10.302 553 HD11 LEU 69 1HD1 LEU 69 -0.506 8.978 -10.410 554 HD12 LEU 69 2HD1 LEU 69 0.749 9.765 -11.359 555 HD13 LEU 69 3HD1 LEU 69 -0.627 9.015 -12.173 556 HD21 LEU 69 3HD2 LEU 69 0.307 11.992 -12.455 557 HD22 LEU 69 1HD2 LEU 69 -1.250 12.792 -12.255 558 HD23 LEU 69 2HD2 LEU 69 -1.109 11.391 -13.320 559 H LEU 70 H LEU 70 -5.123 11.173 -9.121 560 HA LEU 70 HA LEU 70 -7.308 10.122 -10.514 561 HB2 LEU 70 2HB LEU 70 -7.245 11.490 -7.785 562 HB3 LEU 70 3HB LEU 70 -8.606 10.568 -8.388 563 HG LEU 70 HG LEU 70 -5.854 9.433 -7.770 564 HD11 LEU 70 1HD1 LEU 70 -6.954 8.277 -5.902 565 HD12 LEU 70 2HD1 LEU 70 -8.472 9.102 -6.274 566 HD13 LEU 70 3HD1 LEU 70 -7.070 10.029 -5.737 567 HD21 LEU 70 3HD2 LEU 70 -6.844 7.228 -8.183 568 HD22 LEU 70 1HD2 LEU 70 -6.891 8.230 -9.632 569 HD23 LEU 70 2HD2 LEU 70 -8.356 7.986 -8.682 570 H ILE 71 H ILE 71 -6.968 13.360 -9.043 571 HA ILE 71 HA ILE 71 -9.382 14.460 -10.093 572 HB ILE 71 HB ILE 71 -6.939 15.963 -9.023 573 HG12 ILE 71 2HG1 ILE 71 -9.391 14.999 -7.475 574 HG13 ILE 71 3HG1 ILE 71 -7.798 14.257 -7.395 575 HG21 ILE 71 1HG2 ILE 71 -9.841 16.864 -9.212 576 HG22 ILE 71 2HG2 ILE 71 -8.515 17.440 -10.223 577 HG23 ILE 71 3HG2 ILE 71 -8.520 17.791 -8.495 578 HD11 ILE 71 3HD1 ILE 71 -6.891 16.335 -6.459 579 HD12 ILE 71 1HD1 ILE 71 -8.182 15.648 -5.474 580 HD13 ILE 71 2HD1 ILE 71 -8.509 17.044 -6.498 581 H LEU 72 H LEU 72 -6.123 14.231 -11.255 582 HA LEU 72 HA LEU 72 -6.072 16.417 -13.065 583 HB2 LEU 72 2HB LEU 72 -4.078 15.241 -12.035 584 HB3 LEU 72 3HB LEU 72 -4.358 13.881 -13.100 585 HG LEU 72 HG LEU 72 -2.458 15.482 -13.728 586 HD11 LEU 72 1HD1 LEU 72 -3.329 13.869 -15.349 587 HD12 LEU 72 2HD1 LEU 72 -2.808 15.358 -16.128 588 HD13 LEU 72 3HD1 LEU 72 -4.531 15.042 -15.895 589 HD21 LEU 72 3HD2 LEU 72 -3.572 17.611 -13.227 590 HD22 LEU 72 1HD2 LEU 72 -4.719 17.346 -14.544 591 HD23 LEU 72 2HD2 LEU 72 -3.003 17.577 -14.894 592 H HIS 73 H HIS 73 -6.784 12.924 -13.473 593 HA HIS 73 HA HIS 73 -7.523 13.295 -16.287 594 HB2 HIS 73 2HB HIS 73 -7.659 10.853 -14.472 595 HB3 HIS 73 3HB HIS 73 -8.132 10.851 -16.169 596 HD1 HIS 73 HD1 HIS 73 -6.365 9.711 -17.464 597 HD2 HIS 73 HD2 HIS 73 -4.731 12.046 -14.434 598 HE1 HIS 73 HE1 HIS 73 -3.881 9.441 -17.660 599 HE2 HIS 73 HE2 HIS 73 -2.921 11.030 -15.979 600 H ASP 74 H ASP 74 -9.288 11.934 -13.445 601 HA ASP 74 HA ASP 74 -11.562 13.532 -13.530 602 HB2 ASP 74 2HB ASP 74 -13.270 12.107 -14.597 603 HB3 ASP 74 3HB ASP 74 -12.045 12.576 -15.759 604 H PHE 75 H PHE 75 -11.442 13.375 -11.345 605 HA PHE 75 HA PHE 75 -13.007 11.389 -10.074 606 HB2 PHE 75 2HB PHE 75 -10.606 10.283 -10.334 607 HB3 PHE 75 3HB PHE 75 -10.146 11.345 -9.019 608 HD1 PHE 75 HD1 PHE 75 -12.908 11.011 -7.487 609 HD2 PHE 75 HD2 PHE 75 -10.118 8.243 -9.181 610 HE1 PHE 75 HE1 PHE 75 -13.594 9.299 -5.857 611 HE2 PHE 75 HE2 PHE 75 -10.819 6.543 -7.550 612 HZ PHE 75 HZ PHE 75 -12.553 7.070 -5.889 613 H THR 76 H THR 76 -14.129 12.911 -9.026 614 HA THR 76 HA THR 76 -13.256 15.473 -8.404 615 HB THR 76 HB THR 76 -15.587 14.026 -7.078 616 HG1 THR 76 HG1 THR 76 -16.265 13.720 -9.051 617 HG21 THR 76 3HG2 THR 76 -15.227 16.913 -7.914 618 HG22 THR 76 1HG2 THR 76 -15.154 16.303 -6.261 619 HG23 THR 76 2HG2 THR 76 -16.668 16.226 -7.162 620 HA PRO 77 HA PRO 77 -10.965 14.768 -4.507 621 HB2 PRO 77 2HB PRO 77 -11.376 17.353 -3.442 622 HB3 PRO 77 3HB PRO 77 -10.049 16.884 -4.520 623 HG2 PRO 77 2HG PRO 77 -12.635 18.226 -5.210 624 HG3 PRO 77 3HG PRO 77 -10.999 18.526 -5.842 625 HD2 PRO 77 2HD PRO 77 -12.771 17.141 -7.290 626 HD3 PRO 77 3HD PRO 77 -11.058 16.667 -7.270 627 H GLU 78 H GLU 78 -14.156 16.298 -4.619 628 HA GLU 78 HA GLU 78 -15.072 15.879 -2.022 629 HB2 GLU 78 2HB GLU 78 -16.709 15.769 -4.596 630 HB3 GLU 78 3HB GLU 78 -17.370 15.975 -2.976 631 HG2 GLU 78 2HG GLU 78 -16.242 18.135 -2.746 632 HG3 GLU 78 3HG GLU 78 -15.477 17.928 -4.321 633 H GLU 79 H GLU 79 -15.183 13.685 -4.831 634 HA GLU 79 HA GLU 79 -16.556 11.548 -3.550 635 HB2 GLU 79 2HB GLU 79 -14.716 11.539 -5.980 636 HB3 GLU 79 3HB GLU 79 -15.662 10.147 -5.451 637 HG2 GLU 79 2HG GLU 79 -17.748 11.478 -5.789 638 HG3 GLU 79 3HG GLU 79 -16.763 12.803 -6.411 639 H ILE 80 H ILE 80 -13.098 12.227 -4.029 640 HA ILE 80 HA ILE 80 -12.014 9.799 -3.130 641 HB ILE 80 HB ILE 80 -10.747 12.578 -2.948 642 HG12 ILE 80 2HG1 ILE 80 -10.552 10.524 -5.212 643 HG13 ILE 80 3HG1 ILE 80 -11.521 11.988 -5.262 644 HG21 ILE 80 1HG2 ILE 80 -9.430 9.834 -2.951 645 HG22 ILE 80 2HG2 ILE 80 -9.536 10.933 -1.577 646 HG23 ILE 80 3HG2 ILE 80 -8.574 11.376 -2.985 647 HD11 ILE 80 3HD1 ILE 80 -9.487 13.341 -5.125 648 HD12 ILE 80 1HD1 ILE 80 -9.480 12.255 -6.516 649 HD13 ILE 80 2HD1 ILE 80 -8.516 11.866 -5.091 650 H LYS 81 H LYS 81 -12.613 12.834 -1.340 651 HA LYS 81 HA LYS 81 -11.779 11.833 1.213 652 HB2 LYS 81 2HB LYS 81 -12.615 13.970 2.106 653 HB3 LYS 81 3HB LYS 81 -11.623 14.215 0.676 654 HG2 LYS 81 2HG LYS 81 -13.922 14.258 -0.597 655 HG3 LYS 81 3HG LYS 81 -14.601 14.571 0.996 656 HD2 LYS 81 2HD LYS 81 -12.484 16.263 -0.395 657 HD3 LYS 81 3HD LYS 81 -14.200 16.653 -0.288 658 HE2 LYS 81 2HE LYS 81 -12.277 16.442 2.047 659 HE3 LYS 81 3HE LYS 81 -12.921 17.933 1.357 660 HZ1 LYS 81 3HZ LYS 81 -15.151 17.165 1.956 661 HZ2 LYS 81 1HZ LYS 81 -14.154 17.331 3.310 662 HZ3 LYS 81 2HZ LYS 81 -14.486 15.797 2.687 663 H SER 82 H SER 82 -14.776 11.678 -0.555 664 HA SER 82 HA SER 82 -16.458 10.967 1.671 665 HB2 SER 82 2HB SER 82 -16.831 10.621 -1.324 666 HB3 SER 82 3HB SER 82 -18.047 10.146 -0.134 667 HG SER 82 HG SER 82 -16.960 12.761 -0.290 668 H PHE 83 H PHE 83 -14.173 9.203 -0.327 669 HA PHE 83 HA PHE 83 -15.043 6.577 0.563 670 HB2 PHE 83 2HB PHE 83 -12.552 7.519 -0.901 671 HB3 PHE 83 3HB PHE 83 -12.753 5.850 -0.374 672 HD1 PHE 83 HD2 PHE 83 -14.771 4.532 -1.266 673 HD2 PHE 83 HD1 PHE 83 -13.494 8.232 -2.986 674 HE1 PHE 83 HE2 PHE 83 -15.993 3.998 -3.338 675 HE2 PHE 83 HE1 PHE 83 -14.719 7.689 -5.049 676 HZ PHE 83 HZ PHE 83 -15.970 5.578 -5.228 677 H PHE 84 H PHE 84 -13.125 9.103 1.914 678 HA PHE 84 HA PHE 84 -11.834 7.417 3.918 679 HB2 PHE 84 2HB PHE 84 -12.026 10.438 3.616 680 HB3 PHE 84 3HB PHE 84 -11.266 9.673 5.003 681 HD1 PHE 84 HD1 PHE 84 -10.946 10.296 1.362 682 HD2 PHE 84 HD2 PHE 84 -9.038 8.691 4.832 683 HE1 PHE 84 HE1 PHE 84 -8.795 10.273 0.169 684 HE2 PHE 84 HE2 PHE 84 -6.892 8.660 3.626 685 HZ PHE 84 HZ PHE 84 -6.767 9.454 1.301 686 H GLU 85 H GLU 85 -14.923 8.779 3.490 687 HA GLU 85 HA GLU 85 -15.674 9.055 6.256 688 HB2 GLU 85 2HB GLU 85 -17.431 8.755 3.784 689 HB3 GLU 85 3HB GLU 85 -17.980 9.274 5.370 690 HG2 GLU 85 2HG GLU 85 -16.003 10.773 3.642 691 HG3 GLU 85 3HG GLU 85 -17.720 11.133 3.742 692 H ASN 86 H ASN 86 -16.749 7.590 7.553 693 HA ASN 86 HA ASN 86 -16.549 4.781 6.923 694 HB2 ASN 86 2HB ASN 86 -17.874 6.057 9.356 695 HB3 ASN 86 3HB ASN 86 -17.374 4.378 9.187 696 HD21 ASN 86 1HD2 ASN 86 -15.220 3.839 9.501 697 HD22 ASN 86 2HD2 ASN 86 -14.056 4.957 10.114 698 H LYS 87 H LYS 87 -17.907 4.744 5.060 699 HA LYS 87 HA LYS 87 -20.832 4.765 5.576 700 HB2 LYS 87 2HB LYS 87 -19.422 5.785 3.061 701 HB3 LYS 87 3HB LYS 87 -21.166 5.652 3.273 702 HG2 LYS 87 2HG LYS 87 -21.063 7.332 5.106 703 HG3 LYS 87 3HG LYS 87 -19.321 7.462 4.853 704 HD2 LYS 87 2HD LYS 87 -20.425 9.329 3.757 705 HD3 LYS 87 3HD LYS 87 -19.735 8.268 2.525 706 HE2 LYS 87 2HE LYS 87 -21.980 9.037 1.886 707 HE3 LYS 87 3HE LYS 87 -21.966 7.289 2.126 708 HZ1 LYS 87 3HZ LYS 87 -22.939 9.301 4.078 709 HZ2 LYS 87 1HZ LYS 87 -22.931 7.630 4.322 710 HZ3 LYS 87 2HZ LYS 87 -23.910 8.310 3.120 711 H GLY 88 H GLY 88 -22.060 3.402 4.128 712 HA2 GLY 88 2HA GLY 88 -22.535 1.424 3.051 713 HA3 GLY 88 3HA GLY 88 -20.868 1.373 2.485 714 H LYS 89 H LYS 89 -19.266 0.538 3.872 715 HA LYS 89 HA LYS 89 -20.128 -1.031 6.225 716 HB2 LYS 89 2HB LYS 89 -18.327 -1.998 3.955 717 HB3 LYS 89 3HB LYS 89 -18.413 -2.802 5.514 718 HG2 LYS 89 2HG LYS 89 -20.742 -2.470 3.595 719 HG3 LYS 89 3HG LYS 89 -19.769 -3.931 3.769 720 HD2 LYS 89 2HD LYS 89 -21.482 -2.673 5.944 721 HD3 LYS 89 3HD LYS 89 -21.899 -4.110 5.013 722 HE2 LYS 89 2HE LYS 89 -19.996 -5.323 5.980 723 HE3 LYS 89 3HE LYS 89 -19.489 -3.874 6.852 724 HZ1 LYS 89 3HZ LYS 89 -20.708 -5.404 8.276 725 HZ2 LYS 89 1HZ LYS 89 -22.056 -5.314 7.259 726 HZ3 LYS 89 2HZ LYS 89 -21.546 -3.943 8.106 727 H ARG 90 H ARG 90 -17.427 0.366 4.378 728 HA ARG 90 HA ARG 90 -15.988 1.206 6.735 729 HB2 ARG 90 2HB ARG 90 -15.378 -1.168 6.689 730 HB3 ARG 90 3HB ARG 90 -14.949 -1.079 4.986 731 HG2 ARG 90 2HG ARG 90 -12.926 0.052 5.420 732 HG3 ARG 90 3HG ARG 90 -13.464 0.616 7.002 733 HD2 ARG 90 2HD ARG 90 -12.790 -2.263 6.301 734 HD3 ARG 90 3HD ARG 90 -11.759 -1.142 7.205 735 HE ARG 90 HE ARG 90 -14.247 -1.233 8.486 736 HH11 ARG 90 1HH1 ARG 90 -11.532 -3.386 7.955 737 HH12 ARG 90 2HH1 ARG 90 -11.830 -4.300 9.400 738 HH21 ARG 90 1HH2 ARG 90 -14.652 -2.458 10.338 739 HH22 ARG 90 2HH2 ARG 90 -13.597 -3.771 10.751 740 HA PRO 91 HA PRO 91 -14.408 4.234 3.702 741 HB2 PRO 91 2HB PRO 91 -11.921 4.227 5.397 742 HB3 PRO 91 3HB PRO 91 -12.948 5.587 4.904 743 HG2 PRO 91 2HG PRO 91 -12.976 4.649 7.413 744 HG3 PRO 91 3HG PRO 91 -14.437 5.285 6.629 745 HD2 PRO 91 2HD PRO 91 -13.663 2.441 7.150 746 HD3 PRO 91 3HD PRO 91 -15.269 3.198 7.166 747 H VAL 92 H VAL 92 -13.792 3.403 1.787 748 HA VAL 92 HA VAL 92 -12.006 1.228 1.376 749 HB VAL 92 HB VAL 92 -12.890 3.397 -0.596 750 HG11 VAL 92 1HG1 VAL 92 -10.890 2.240 -1.424 751 HG12 VAL 92 2HG1 VAL 92 -12.300 1.796 -2.384 752 HG13 VAL 92 3HG1 VAL 92 -11.666 0.674 -1.178 753 HG21 VAL 92 3HG2 VAL 92 -14.809 2.175 0.350 754 HG22 VAL 92 1HG2 VAL 92 -14.076 0.636 -0.107 755 HG23 VAL 92 2HG2 VAL 92 -14.594 1.774 -1.354 756 H PHE 93 H PHE 93 -11.649 4.750 1.207 757 HA PHE 93 HA PHE 93 -8.713 4.578 0.988 758 HB2 PHE 93 2HB PHE 93 -10.673 6.914 0.792 759 HB3 PHE 93 3HB PHE 93 -8.927 7.124 0.812 760 HD1 PHE 93 HD1 PHE 93 -10.674 4.387 -1.084 761 HD2 PHE 93 HD2 PHE 93 -8.736 8.187 -1.325 762 HE1 PHE 93 HE1 PHE 93 -10.628 4.210 -3.540 763 HE2 PHE 93 HE2 PHE 93 -8.692 7.997 -3.779 764 HZ PHE 93 HZ PHE 93 -9.635 6.015 -4.893 765 H VAL 94 H VAL 94 -7.621 4.462 2.902 766 HA VAL 94 HA VAL 94 -8.722 5.803 5.323 767 HB VAL 94 HB VAL 94 -7.143 3.172 5.208 768 HG11 VAL 94 1HG1 VAL 94 -8.293 4.601 7.635 769 HG12 VAL 94 2HG1 VAL 94 -6.581 4.442 7.237 770 HG13 VAL 94 3HG1 VAL 94 -7.527 3.010 7.638 771 HG21 VAL 94 3HG2 VAL 94 -9.474 2.863 4.480 772 HG22 VAL 94 1HG2 VAL 94 -10.062 3.647 5.950 773 HG23 VAL 94 2HG2 VAL 94 -9.211 2.100 6.048 774 H LYS 95 H LYS 95 -7.162 6.759 6.765 775 HA LYS 95 HA LYS 95 -4.340 6.869 5.962 776 HB2 LYS 95 2HB LYS 95 -4.234 9.302 6.068 777 HB3 LYS 95 3HB LYS 95 -5.400 8.808 4.850 778 HG2 LYS 95 2HG LYS 95 -7.262 9.377 6.301 779 HG3 LYS 95 3HG LYS 95 -6.171 9.734 7.642 780 HD2 LYS 95 2HD LYS 95 -6.219 11.242 4.995 781 HD3 LYS 95 3HD LYS 95 -7.003 11.792 6.475 782 HE2 LYS 95 2HE LYS 95 -4.869 12.041 7.595 783 HE3 LYS 95 3HE LYS 95 -4.018 11.262 6.257 784 HZ1 LYS 95 3HZ LYS 95 -3.821 13.697 6.254 785 HZ2 LYS 95 1HZ LYS 95 -5.490 13.834 6.038 786 HZ3 LYS 95 2HZ LYS 95 -4.537 13.105 4.841 787 H GLY 96 H GLY 96 -3.080 8.207 7.612 788 HA2 GLY 96 2HA GLY 96 -3.393 9.186 9.968 789 HA3 GLY 96 3HA GLY 96 -3.916 7.547 10.379 790 H SER 97 H SER 97 -2.107 7.233 11.808 791 HA SER 97 HA SER 97 0.574 7.036 10.736 792 HB2 SER 97 2HB SER 97 0.002 7.310 13.201 793 HB3 SER 97 3HB SER 97 -0.585 5.646 13.200 794 HG SER 97 HG SER 97 1.898 6.521 13.512 795 H LEU 98 H LEU 98 1.659 4.713 10.811 796 HA LEU 98 HA LEU 98 0.502 3.029 8.880 797 HB2 LEU 98 2HB LEU 98 2.911 3.010 9.352 798 HB3 LEU 98 3HB LEU 98 2.619 2.413 10.976 799 HG LEU 98 HG LEU 98 1.702 0.281 9.953 800 HD11 LEU 98 1HD1 LEU 98 2.802 1.398 7.358 801 HD12 LEU 98 2HD1 LEU 98 1.102 1.103 7.735 802 HD13 LEU 98 3HD1 LEU 98 2.222 -0.251 7.618 803 HD21 LEU 98 3HD2 LEU 98 3.975 0.390 10.853 804 HD22 LEU 98 1HD2 LEU 98 4.586 0.935 9.289 805 HD23 LEU 98 2HD2 LEU 98 3.895 -0.682 9.458 806 H GLU 99 H GLU 99 0.738 2.637 12.389 807 HA GLU 99 HA GLU 99 -0.726 0.214 12.617 808 HB2 GLU 99 2HB GLU 99 -0.110 2.362 14.692 809 HB3 GLU 99 3HB GLU 99 -0.715 0.746 15.056 810 HG2 GLU 99 2HG GLU 99 1.331 -0.270 14.181 811 HG3 GLU 99 3HG GLU 99 1.931 1.311 13.682 812 H SER 100 H SER 100 -1.648 3.632 12.993 813 HA SER 100 HA SER 100 -4.261 3.292 13.979 814 HB2 SER 100 2HB SER 100 -3.180 5.580 12.264 815 HB3 SER 100 3HB SER 100 -4.597 5.647 13.313 816 HG SER 100 HG SER 100 -3.323 5.519 15.078 817 H ALA 101 H ALA 101 -3.125 3.843 10.656 818 HA ALA 101 HA ALA 101 -5.645 3.701 9.364 819 HB1 ALA 101 3HB ALA 101 -2.865 3.282 8.205 820 HB2 ALA 101 1HB ALA 101 -3.694 4.829 8.378 821 HB3 ALA 101 2HB ALA 101 -4.337 3.606 7.281 822 H ALA 102 H ALA 102 -3.375 1.275 10.421 823 HA ALA 102 HA ALA 102 -4.243 -0.940 8.866 824 HB1 ALA 102 3HB ALA 102 -3.059 -2.285 10.544 825 HB2 ALA 102 1HB ALA 102 -2.956 -0.882 11.616 826 HB3 ALA 102 2HB ALA 102 -2.100 -0.881 10.075 827 H GLU 103 H GLU 103 -5.087 0.253 12.106 828 HA GLU 103 HA GLU 103 -6.959 -1.740 12.835 829 HB2 GLU 103 2HB GLU 103 -6.863 1.176 13.727 830 HB3 GLU 103 3HB GLU 103 -7.696 -0.134 14.565 831 HG2 GLU 103 2HG GLU 103 -5.544 -1.230 15.017 832 HG3 GLU 103 3HG GLU 103 -4.706 0.018 14.120 833 H GLN 104 H GLN 104 -7.393 1.439 11.320 834 HA GLN 104 HA GLN 104 -10.241 1.425 11.233 835 HB2 GLN 104 2HB GLN 104 -8.253 3.021 9.570 836 HB3 GLN 104 3HB GLN 104 -9.973 3.375 9.708 837 HG2 GLN 104 2HG GLN 104 -9.733 3.931 12.058 838 HG3 GLN 104 3HG GLN 104 -8.047 3.407 12.052 839 HE21 GLN 104 1HE2 GLN 104 -6.505 4.695 10.956 840 HE22 GLN 104 2HE2 GLN 104 -6.798 6.357 10.593 841 H ALA 105 H ALA 105 -7.766 0.322 8.950 842 HA ALA 105 HA ALA 105 -9.626 -0.304 6.808 843 HB1 ALA 105 3HB ALA 105 -7.306 0.345 6.310 844 HB2 ALA 105 1HB ALA 105 -7.653 -1.268 5.690 845 HB3 ALA 105 2HB ALA 105 -6.706 -1.074 7.169 846 H GLY 106 H GLY 106 -8.279 -1.910 9.590 847 HA2 GLY 106 2HA GLY 106 -9.053 -3.811 10.666 848 HA3 GLY 106 3HA GLY 106 -10.055 -4.189 9.278 849 H ILE 107 H ILE 107 -6.653 -3.530 9.026 850 HA ILE 107 HA ILE 107 -6.029 -6.266 8.179 851 HB ILE 107 HB ILE 107 -4.014 -3.993 8.440 852 HG12 ILE 107 2HG1 ILE 107 -5.753 -4.397 5.969 853 HG13 ILE 107 3HG1 ILE 107 -5.995 -3.111 7.146 854 HG21 ILE 107 1HG2 ILE 107 -2.888 -5.147 6.587 855 HG22 ILE 107 2HG2 ILE 107 -4.193 -6.330 6.508 856 HG23 ILE 107 3HG2 ILE 107 -3.162 -6.247 7.938 857 HD11 ILE 107 3HD1 ILE 107 -3.534 -3.505 5.447 858 HD12 ILE 107 1HD1 ILE 107 -3.779 -2.216 6.634 859 HD13 ILE 107 2HD1 ILE 107 -4.808 -2.313 5.206 860 H VAL 108 H VAL 108 -4.509 -7.604 9.397 861 HA VAL 108 HA VAL 108 -4.383 -7.164 12.211 862 HB VAL 108 HB VAL 108 -2.623 -9.077 10.615 863 HG11 VAL 108 1HG1 VAL 108 -3.373 -9.071 13.561 864 HG12 VAL 108 2HG1 VAL 108 -1.785 -8.706 12.883 865 HG13 VAL 108 3HG1 VAL 108 -2.446 -10.336 12.747 866 HG21 VAL 108 3HG2 VAL 108 -5.356 -9.606 11.842 867 HG22 VAL 108 1HG2 VAL 108 -4.302 -10.830 11.122 868 HG23 VAL 108 2HG2 VAL 108 -4.978 -9.546 10.119 869 H VAL 109 H VAL 109 -3.325 -5.539 13.022 870 HA VAL 109 HA VAL 109 -1.540 -3.850 11.757 871 HB VAL 109 HB VAL 109 -1.814 -4.215 14.772 872 HG11 VAL 109 1HG1 VAL 109 -1.129 -1.844 14.947 873 HG12 VAL 109 2HG1 VAL 109 -0.894 -1.783 13.199 874 HG13 VAL 109 3HG1 VAL 109 0.129 -2.824 14.190 875 HG21 VAL 109 3HG2 VAL 109 -4.027 -3.871 13.744 876 HG22 VAL 109 1HG2 VAL 109 -3.439 -2.412 12.943 877 HG23 VAL 109 2HG2 VAL 109 -3.556 -2.465 14.703 878 H ASP 110 H ASP 110 -0.874 -6.410 14.109 879 HA ASP 110 HA ASP 110 1.871 -6.017 14.490 880 HB2 ASP 110 2HB ASP 110 0.459 -7.413 15.986 881 HB3 ASP 110 3HB ASP 110 0.263 -8.614 14.717 882 H GLU 111 H GLU 111 0.133 -7.989 12.083 883 HA GLU 111 HA GLU 111 2.401 -9.281 10.987 884 HB2 GLU 111 2HB GLU 111 -0.332 -8.751 9.769 885 HB3 GLU 111 3HB GLU 111 0.903 -9.722 8.982 886 HG2 GLU 111 2HG GLU 111 -0.442 -10.330 11.620 887 HG3 GLU 111 3HG GLU 111 -0.732 -11.142 10.085 888 H LEU 112 H LEU 112 0.629 -6.299 9.924 889 HA LEU 112 HA LEU 112 2.479 -5.883 7.742 890 HB2 LEU 112 2HB LEU 112 1.358 -3.731 7.344 891 HB3 LEU 112 3HB LEU 112 0.270 -5.098 7.410 892 HG LEU 112 HG LEU 112 -0.285 -4.356 9.824 893 HD11 LEU 112 1HD1 LEU 112 1.511 -2.762 10.252 894 HD12 LEU 112 2HD1 LEU 112 -0.050 -1.956 10.338 895 HD13 LEU 112 3HD1 LEU 112 0.972 -1.746 8.912 896 HD21 LEU 112 3HD2 LEU 112 -1.112 -2.490 7.594 897 HD22 LEU 112 1HD2 LEU 112 -1.999 -2.874 9.067 898 HD23 LEU 112 2HD2 LEU 112 -1.762 -4.110 7.847 899 H VAL 113 H VAL 113 2.489 -4.906 11.045 900 HA VAL 113 HA VAL 113 4.389 -2.782 10.860 901 HB VAL 113 HB VAL 113 3.644 -4.604 13.205 902 HG11 VAL 113 1HG1 VAL 113 6.019 -4.059 13.534 903 HG12 VAL 113 2HG1 VAL 113 5.035 -3.156 14.686 904 HG13 VAL 113 3HG1 VAL 113 5.692 -2.346 13.262 905 HG21 VAL 113 3HG2 VAL 113 2.693 -2.531 14.166 906 HG22 VAL 113 1HG2 VAL 113 1.991 -2.874 12.584 907 HG23 VAL 113 2HG2 VAL 113 3.223 -1.623 12.746 908 H GLN 114 H GLN 114 4.593 -6.298 11.171 909 HA GLN 114 HA GLN 114 7.445 -6.523 11.318 910 HB2 GLN 114 2HB GLN 114 5.346 -8.495 10.304 911 HB3 GLN 114 3HB GLN 114 7.046 -8.895 10.524 912 HG2 GLN 114 2HG GLN 114 5.214 -7.987 12.758 913 HG3 GLN 114 3HG GLN 114 5.567 -9.667 12.385 914 HE21 GLN 114 1HE2 GLN 114 6.844 -6.699 13.711 915 HE22 GLN 114 2HE2 GLN 114 8.244 -7.400 14.443 916 H THR 115 H THR 115 5.094 -6.794 8.710 917 HA THR 115 HA THR 115 6.681 -7.267 6.517 918 HB THR 115 HB THR 115 4.032 -5.832 6.842 919 HG1 THR 115 HG1 THR 115 3.286 -7.793 6.884 920 HG21 THR 115 3HG2 THR 115 5.239 -6.808 4.239 921 HG22 THR 115 1HG2 THR 115 4.928 -5.128 4.682 922 HG23 THR 115 2HG2 THR 115 3.582 -6.244 4.471 923 H VAL 116 H VAL 116 5.838 -4.101 7.943 924 HA VAL 116 HA VAL 116 7.151 -2.615 5.811 925 HB VAL 116 HB VAL 116 5.679 -1.660 8.310 926 HG11 VAL 116 1HG1 VAL 116 6.858 0.065 6.086 927 HG12 VAL 116 2HG1 VAL 116 7.412 0.011 7.760 928 HG13 VAL 116 3HG1 VAL 116 5.807 0.639 7.385 929 HG21 VAL 116 3HG2 VAL 116 4.899 -1.545 5.368 930 HG22 VAL 116 1HG2 VAL 116 3.952 -0.903 6.713 931 HG23 VAL 116 2HG2 VAL 116 4.225 -2.640 6.576 932 H LYS 117 H LYS 117 7.835 -3.364 9.282 933 HA LYS 117 HA LYS 117 10.142 -1.646 9.391 934 HB2 LYS 117 2HB LYS 117 10.662 -2.616 11.538 935 HB3 LYS 117 3HB LYS 117 8.918 -2.417 11.453 936 HG2 LYS 117 2HG LYS 117 8.717 -4.850 10.906 937 HG3 LYS 117 3HG LYS 117 10.454 -5.017 11.138 938 HD2 LYS 117 2HD LYS 117 8.494 -4.093 13.279 939 HD3 LYS 117 3HD LYS 117 9.119 -5.733 13.127 940 HE2 LYS 117 2HE LYS 117 11.446 -4.790 13.441 941 HE3 LYS 117 3HE LYS 117 10.698 -3.229 13.793 942 HZ1 LYS 117 3HZ LYS 117 9.526 -4.254 15.649 943 HZ2 LYS 117 1HZ LYS 117 11.193 -4.452 15.820 944 HZ3 LYS 117 2HZ LYS 117 10.237 -5.746 15.314 945 H ASN 118 H ASN 118 9.605 -4.978 8.450 946 HA ASN 118 HA ASN 118 12.406 -5.667 8.151 947 HB2 ASN 118 2HB ASN 118 9.879 -7.110 7.215 948 HB3 ASN 118 3HB ASN 118 11.510 -7.747 7.003 949 HD21 ASN 118 1HD2 ASN 118 9.311 -8.928 8.472 950 HD22 ASN 118 2HD2 ASN 118 9.838 -9.095 10.106 951 H TYR 119 H TYR 119 9.735 -4.582 6.051 952 HA TYR 119 HA TYR 119 10.986 -4.570 3.557 953 HB2 TYR 119 2HB TYR 119 8.644 -3.930 3.712 954 HB3 TYR 119 3HB TYR 119 9.020 -2.572 4.761 955 HD1 TYR 119 HD1 TYR 119 9.728 -3.828 1.280 956 HD2 TYR 119 HD2 TYR 119 9.121 -0.407 3.770 957 HE1 TYR 119 HE1 TYR 119 9.797 -2.376 -0.695 958 HE2 TYR 119 HE2 TYR 119 9.196 1.046 1.781 959 HH TYR 119 HH TYR 119 9.848 1.095 -0.467 960 H GLN 120 H GLN 120 10.874 -1.963 5.944 961 HA GLN 120 HA GLN 120 12.739 -0.236 4.754 962 HB2 GLN 120 2HB GLN 120 11.798 -0.475 7.647 963 HB3 GLN 120 3HB GLN 120 12.763 0.864 7.030 964 HG2 GLN 120 2HG GLN 120 10.917 1.379 5.405 965 HG3 GLN 120 3HG GLN 120 9.946 0.129 6.177 966 HE21 GLN 120 1HE2 GLN 120 9.548 3.059 5.923 967 HE22 GLN 120 2HE2 GLN 120 9.313 3.637 7.524 968 H GLY 121 H GLY 121 13.093 -2.983 6.881 969 HA2 GLY 121 2HA GLY 121 15.753 -2.591 7.788 970 HA3 GLY 121 3HA GLY 121 14.875 -4.117 7.738 971 H TYR 122 H TYR 122 14.377 -4.399 5.015 972 HA TYR 122 HA TYR 122 17.021 -5.209 4.155 973 HB2 TYR 122 2HB TYR 122 15.978 -6.545 2.439 974 HB3 TYR 122 3HB TYR 122 15.267 -6.862 3.999 975 HD1 TYR 122 HD2 TYR 122 14.502 -4.627 1.022 976 HD2 TYR 122 HD1 TYR 122 13.012 -7.375 3.926 977 HE1 TYR 122 HE2 TYR 122 12.288 -4.574 -0.054 978 HE2 TYR 122 HE1 TYR 122 10.820 -7.327 2.839 979 HH TYR 122 HH TYR 122 10.289 -6.251 -0.189 980 H VAL 123 H VAL 123 14.881 -2.627 3.477 981 HA VAL 123 HA VAL 123 15.856 -1.750 0.982 982 HB VAL 123 HB VAL 123 14.715 -0.231 3.368 983 HG11 VAL 123 1HG1 VAL 123 14.594 1.794 1.916 984 HG12 VAL 123 2HG1 VAL 123 15.575 0.957 0.707 985 HG13 VAL 123 3HG1 VAL 123 16.253 1.327 2.295 986 HG21 VAL 123 3HG2 VAL 123 13.128 -1.617 2.048 987 HG22 VAL 123 1HG2 VAL 123 13.573 -0.731 0.592 988 HG23 VAL 123 2HG2 VAL 123 12.752 0.101 1.915 989 H GLN 124 H GLN 124 16.832 -0.753 4.271 990 HA GLN 124 HA GLN 124 19.157 0.699 3.400 991 HB2 GLN 124 2HB GLN 124 19.562 1.044 5.840 992 HB3 GLN 124 3HB GLN 124 17.921 1.461 5.356 993 HG2 GLN 124 2HG GLN 124 17.193 -0.801 6.166 994 HG3 GLN 124 3HG GLN 124 18.809 -1.029 6.830 995 HE21 GLN 124 1HE2 GLN 124 16.236 -0.965 8.186 996 HE22 GLN 124 2HE2 GLN 124 16.347 0.288 9.367 997 H ASP 125 H ASP 125 18.554 -2.589 4.198 998 HA ASP 125 HA ASP 125 21.193 -3.469 4.844 999 HB2 ASP 125 2HB ASP 125 19.120 -4.810 5.237 1000 HB3 ASP 125 3HB ASP 125 18.885 -4.964 3.505 1001 H GLY 126 H GLY 126 19.615 -2.534 1.893 1002 HA2 GLY 126 2HA GLY 126 20.418 -2.192 -0.229 1003 HA3 GLY 126 3HA GLY 126 22.004 -2.723 0.301 1004 H HIS 127 H HIS 127 19.255 -4.727 0.861 1005 HA HIS 127 HA HIS 127 19.385 -6.339 -1.504 1006 HB2 HIS 127 2HB HIS 127 21.496 -7.075 -0.358 1007 HB3 HIS 127 3HB HIS 127 20.569 -7.496 1.076 1008 HD1 HIS 127 HD1 HIS 127 21.320 -8.644 -2.404 1009 HD2 HIS 127 HD2 HIS 127 19.137 -9.941 0.896 1010 HE1 HIS 127 HE1 HIS 127 20.722 -11.028 -2.889 1011 HE2 HIS 127 HE2 HIS 127 19.533 -11.837 -0.829 1012 H ASP 128 H ASP 128 17.403 -7.312 -1.655 1013 HA ASP 128 HA ASP 128 15.485 -6.876 0.438 1014 HB2 ASP 128 2HB ASP 128 13.820 -7.694 -1.109 1015 HB3 ASP 128 3HB ASP 128 14.912 -6.628 -1.977 1016 H HIS 129 H HIS 129 14.432 -8.372 1.690 1017 HA HIS 129 HA HIS 129 15.604 -11.089 1.871 1018 HB2 HIS 129 2HB HIS 129 14.546 -9.249 4.048 1019 HB3 HIS 129 3HB HIS 129 14.808 -10.968 4.325 1020 HD1 HIS 129 HD1 HIS 129 16.911 -11.183 5.662 1021 HD2 HIS 129 HD2 HIS 129 17.246 -8.208 2.782 1022 HE1 HIS 129 HE1 HIS 129 19.246 -10.291 5.872 1023 HE2 HIS 129 HE2 HIS 129 19.479 -8.633 4.004 1024 H ASP 130 H ASP 130 12.570 -9.262 2.557 1025 HA ASP 130 HA ASP 130 10.959 -11.652 2.013 1026 HB2 ASP 130 2HB ASP 130 9.968 -8.837 2.652 1027 HB3 ASP 130 3HB ASP 130 9.013 -10.313 2.668 1028 H PHE 131 H PHE 131 11.847 -11.755 -0.100 1029 HA PHE 131 HA PHE 131 12.109 -11.194 -2.332 1030 HB2 PHE 131 2HB PHE 131 10.061 -12.075 -3.508 1031 HB3 PHE 131 3HB PHE 131 10.691 -13.109 -2.239 1032 HD1 PHE 131 HD1 PHE 131 9.481 -13.100 0.042 1033 HD2 PHE 131 HD2 PHE 131 7.752 -11.430 -3.499 1034 HE1 PHE 131 HE1 PHE 131 7.247 -13.238 1.062 1035 HE2 PHE 131 HE2 PHE 131 5.520 -11.569 -2.463 1036 HZ PHE 131 HZ PHE 131 5.274 -12.463 -0.183 1037 H GLY 132 H GLY 132 12.505 -8.895 -2.019 1038 HA2 GLY 132 2HA GLY 132 10.426 -7.116 -3.135 1039 HA3 GLY 132 3HA GLY 132 11.927 -6.617 -2.374 1040 H ARG 133 H ARG 133 13.505 -5.957 -3.708 1041 HA ARG 133 HA ARG 133 14.165 -7.081 -6.247 1042 HB2 ARG 133 2HB ARG 133 13.602 -5.038 -7.629 1043 HB3 ARG 133 3HB ARG 133 12.194 -5.927 -7.064 1044 HG2 ARG 133 2HG ARG 133 11.927 -4.238 -5.216 1045 HG3 ARG 133 3HG ARG 133 13.247 -3.308 -5.931 1046 HD2 ARG 133 2HD ARG 133 11.957 -2.990 -7.985 1047 HD3 ARG 133 3HD ARG 133 10.673 -4.037 -7.372 1048 HE ARG 133 HE ARG 133 11.121 -1.822 -5.627 1049 HH11 ARG 133 1HH1 ARG 133 9.628 -2.654 -8.698 1050 HH12 ARG 133 2HH1 ARG 133 8.459 -1.371 -8.613 1051 HH21 ARG 133 1HH2 ARG 133 9.560 -0.141 -5.530 1052 HH22 ARG 133 2HH2 ARG 133 8.422 0.045 -6.823 1053 H ASP 134 H ASP 134 15.571 -4.990 -7.419 1054 HA ASP 134 HA ASP 134 17.972 -4.880 -6.035 1055 HB2 ASP 134 2HB ASP 134 16.950 -2.920 -8.135 1056 HB3 ASP 134 3HB ASP 134 18.627 -3.031 -7.623 1057 HA PRO 135 HA PRO 135 17.610 -1.946 -2.711 1058 HB2 PRO 135 2HB PRO 135 20.161 -0.812 -2.700 1059 HB3 PRO 135 3HB PRO 135 19.775 -2.415 -2.053 1060 HG2 PRO 135 2HG PRO 135 20.881 -1.708 -4.752 1061 HG3 PRO 135 3HG PRO 135 21.406 -2.978 -3.618 1062 HD2 PRO 135 2HD PRO 135 19.872 -3.614 -5.699 1063 HD3 PRO 135 3HD PRO 135 19.577 -4.368 -4.116 1064 H LYS 136 H LYS 136 18.653 -0.725 -5.833 1065 HA LYS 136 HA LYS 136 18.515 2.055 -5.215 1066 HB2 LYS 136 2HB LYS 136 18.673 2.410 -7.648 1067 HB3 LYS 136 3HB LYS 136 19.838 1.212 -7.098 1068 HG2 LYS 136 2HG LYS 136 18.209 -0.582 -7.870 1069 HG3 LYS 136 3HG LYS 136 17.257 0.712 -8.601 1070 HD2 LYS 136 2HD LYS 136 18.621 -0.231 -10.339 1071 HD3 LYS 136 3HD LYS 136 19.311 1.348 -9.953 1072 HE2 LYS 136 2HE LYS 136 20.988 0.174 -8.486 1073 HE3 LYS 136 3HE LYS 136 20.324 -1.363 -9.055 1074 HZ1 LYS 136 3HZ LYS 136 22.281 -0.797 -10.300 1075 HZ2 LYS 136 1HZ LYS 136 21.645 0.711 -10.729 1076 HZ3 LYS 136 2HZ LYS 136 20.942 -0.709 -11.323 1077 H TYR 137 H TYR 137 16.122 -0.303 -6.118 1078 HA TYR 137 HA TYR 137 13.987 1.693 -6.481 1079 HB2 TYR 137 2HB TYR 137 13.863 -1.352 -6.635 1080 HB3 TYR 137 3HB TYR 137 12.583 -0.234 -7.105 1081 HD1 TYR 137 HD2 TYR 137 13.164 1.481 -9.001 1082 HD2 TYR 137 HD1 TYR 137 15.412 -2.077 -8.273 1083 HE1 TYR 137 HE2 TYR 137 14.102 1.603 -11.266 1084 HE2 TYR 137 HE1 TYR 137 16.375 -1.938 -10.530 1085 HH TYR 137 HH TYR 137 16.029 0.835 -12.498 1086 H LEU 138 H LEU 138 15.215 -0.630 -4.180 1087 HA LEU 138 HA LEU 138 13.050 -0.574 -2.326 1088 HB2 LEU 138 2HB LEU 138 16.007 -1.109 -1.840 1089 HB3 LEU 138 3HB LEU 138 14.735 -1.382 -0.665 1090 HG LEU 138 HG LEU 138 15.167 -2.914 -3.253 1091 HD11 LEU 138 1HD1 LEU 138 16.759 -3.489 -1.496 1092 HD12 LEU 138 2HD1 LEU 138 15.624 -4.814 -1.743 1093 HD13 LEU 138 3HD1 LEU 138 15.444 -3.749 -0.345 1094 HD21 LEU 138 3HD2 LEU 138 12.943 -3.267 -1.209 1095 HD22 LEU 138 1HD2 LEU 138 13.277 -4.343 -2.571 1096 HD23 LEU 138 2HD2 LEU 138 12.759 -2.686 -2.866 1097 H HIS 139 H HIS 139 12.386 1.267 -1.365 1098 HA HIS 139 HA HIS 139 14.335 2.896 0.081 1099 HB2 HIS 139 2HB HIS 139 13.322 5.027 -0.686 1100 HB3 HIS 139 3HB HIS 139 14.069 4.146 -2.014 1101 HD1 HIS 139 HD1 HIS 139 12.521 3.234 -3.859 1102 HD2 HIS 139 HD2 HIS 139 10.531 5.323 -0.872 1103 HE1 HIS 139 HE1 HIS 139 10.219 3.672 -4.759 1104 HE2 HIS 139 HE2 HIS 139 9.113 5.088 -3.000 1105 H GLN 140 H GLN 140 13.561 3.548 2.053 1106 HA GLN 140 HA GLN 140 11.160 2.415 3.079 1107 HB2 GLN 140 2HB GLN 140 12.801 4.688 4.286 1108 HB3 GLN 140 3HB GLN 140 11.619 3.704 5.121 1109 HG2 GLN 140 2HG GLN 140 13.351 2.430 5.807 1110 HG3 GLN 140 3HG GLN 140 13.382 1.783 4.178 1111 HE21 GLN 140 1HE2 GLN 140 15.555 1.975 6.043 1112 HE22 GLN 140 2HE2 GLN 140 16.777 2.934 5.290 1113 H PHE 141 H PHE 141 9.264 3.544 3.815 1114 HA PHE 141 HA PHE 141 8.151 5.361 1.963 1115 HB2 PHE 141 2HB PHE 141 7.190 4.547 4.742 1116 HB3 PHE 141 3HB PHE 141 6.229 5.473 3.604 1117 HD1 PHE 141 HD1 PHE 141 5.640 4.392 1.346 1118 HD2 PHE 141 HD2 PHE 141 7.160 2.157 4.666 1119 HE1 PHE 141 HE1 PHE 141 4.742 2.318 0.373 1120 HE2 PHE 141 HE2 PHE 141 6.259 0.091 3.682 1121 HZ PHE 141 HZ PHE 141 5.051 0.168 1.533 1122 H GLU 142 H GLU 142 9.414 7.213 1.826 1123 HA GLU 142 HA GLU 142 10.194 8.798 4.087 1124 HB2 GLU 142 2HB GLU 142 10.110 9.570 1.138 1125 HB3 GLU 142 3HB GLU 142 10.914 10.479 2.413 1126 HG2 GLU 142 2HG GLU 142 12.399 8.486 2.804 1127 HG3 GLU 142 3HG GLU 142 11.657 7.722 1.402 1128 H GLY 143 H GLY 143 8.492 9.449 5.289 1129 HA2 GLY 143 2HA GLY 143 6.962 11.639 4.959 1130 HA3 GLY 143 3HA GLY 143 5.995 10.403 4.144 1131 H GLU 144 H GLU 144 5.492 11.921 6.649 1132 HA GLU 144 HA GLU 144 5.863 10.137 8.883 1133 HB2 GLU 144 2HB GLU 144 4.191 12.678 8.604 1134 HB3 GLU 144 3HB GLU 144 4.512 11.845 10.123 1135 HG2 GLU 144 2HG GLU 144 6.931 12.288 9.860 1136 HG3 GLU 144 3HG GLU 144 6.615 13.106 8.336 1137 H THR 145 H THR 145 2.970 11.346 7.173 1138 HA THR 145 HA THR 145 1.163 9.495 8.443 1139 HB THR 145 HB THR 145 0.725 11.493 6.168 1140 HG1 THR 145 HG1 THR 145 0.601 11.625 8.980 1141 HG21 THR 145 3HG2 THR 145 -1.053 9.769 6.122 1142 HG22 THR 145 1HG2 THR 145 -1.694 11.310 6.693 1143 HG23 THR 145 2HG2 THR 145 -1.353 10.016 7.843 1144 H PHE 146 H PHE 146 0.608 7.529 7.730 1145 HA PHE 146 HA PHE 146 1.247 6.588 5.014 1146 HB2 PHE 146 2HB PHE 146 0.363 5.167 7.558 1147 HB3 PHE 146 3HB PHE 146 0.343 4.356 5.998 1148 HD1 PHE 146 HD2 PHE 146 2.608 5.991 8.490 1149 HD2 PHE 146 HD1 PHE 146 2.331 3.434 5.066 1150 HE1 PHE 146 HE2 PHE 146 4.958 5.314 8.788 1151 HE2 PHE 146 HE1 PHE 146 4.675 2.776 5.374 1152 HZ PHE 146 HZ PHE 146 5.991 3.704 7.230 1153 H TYR 147 H TYR 147 -0.294 5.799 3.643 1154 HA TYR 147 HA TYR 147 -3.170 6.131 4.255 1155 HB2 TYR 147 2HB TYR 147 -1.687 6.760 1.652 1156 HB3 TYR 147 3HB TYR 147 -3.439 6.584 1.743 1157 HD1 TYR 147 HD1 TYR 147 -0.599 8.589 3.154 1158 HD2 TYR 147 HD2 TYR 147 -4.785 8.470 2.297 1159 HE1 TYR 147 HE1 TYR 147 -0.797 10.949 3.789 1160 HE2 TYR 147 HE2 TYR 147 -4.976 10.838 2.933 1161 HH TYR 147 HH TYR 147 -2.214 12.836 3.478 1162 H ILE 148 H ILE 148 -4.340 4.339 3.872 1163 HA ILE 148 HA ILE 148 -3.140 2.060 2.403 1164 HB ILE 148 HB ILE 148 -4.812 1.923 4.966 1165 HG12 ILE 148 2HG1 ILE 148 -1.865 1.260 4.488 1166 HG13 ILE 148 3HG1 ILE 148 -2.487 2.581 5.464 1167 HG21 ILE 148 1HG2 ILE 148 -3.635 -0.346 3.324 1168 HG22 ILE 148 2HG2 ILE 148 -5.347 0.082 3.418 1169 HG23 ILE 148 3HG2 ILE 148 -4.507 -0.509 4.847 1170 HD11 ILE 148 3HD1 ILE 148 -2.728 -0.364 6.083 1171 HD12 ILE 148 1HD1 ILE 148 -3.416 0.943 7.054 1172 HD13 ILE 148 2HD1 ILE 148 -1.668 0.806 6.867 1173 H ILE 149 H ILE 149 -4.333 1.726 0.623 1174 HA ILE 149 HA ILE 149 -7.196 2.480 0.586 1175 HB ILE 149 HB ILE 149 -5.422 1.955 -1.844 1176 HG12 ILE 149 2HG1 ILE 149 -4.455 3.876 -0.667 1177 HG13 ILE 149 3HG1 ILE 149 -5.266 4.436 -2.121 1178 HG21 ILE 149 1HG2 ILE 149 -7.217 3.216 -3.054 1179 HG22 ILE 149 2HG2 ILE 149 -8.158 3.265 -1.565 1180 HG23 ILE 149 3HG2 ILE 149 -7.793 1.716 -2.329 1181 HD11 ILE 149 3HD1 ILE 149 -6.317 4.652 0.700 1182 HD12 ILE 149 1HD1 ILE 149 -7.164 5.196 -0.751 1183 HD13 ILE 149 2HD1 ILE 149 -5.642 5.952 -0.279 1184 H GLU 150 H GLU 150 -8.560 0.847 0.745 1185 HA GLU 150 HA GLU 150 -7.975 -1.916 0.420 1186 HB2 GLU 150 2HB GLU 150 -9.689 -0.994 1.998 1187 HB3 GLU 150 3HB GLU 150 -10.679 -0.500 0.629 1188 HG2 GLU 150 2HG GLU 150 -11.143 -2.771 0.026 1189 HG3 GLU 150 3HG GLU 150 -9.906 -3.397 1.114 1190 H GLN 151 H GLN 151 -8.058 -3.111 -1.377 1191 HA GLN 151 HA GLN 151 -9.634 -2.326 -3.750 1192 HB2 GLN 151 2HB GLN 151 -6.719 -3.268 -3.767 1193 HB3 GLN 151 3HB GLN 151 -7.717 -3.067 -5.204 1194 HG2 GLN 151 2HG GLN 151 -7.814 -0.656 -4.845 1195 HG3 GLN 151 3HG GLN 151 -6.927 -0.824 -3.326 1196 HE21 GLN 151 1HE2 GLN 151 -5.249 0.527 -4.054 1197 HE22 GLN 151 2HE2 GLN 151 -4.117 0.029 -5.257 1198 H ARG 152 H ARG 152 -11.148 -3.973 -3.438 1199 HA ARG 152 HA ARG 152 -10.252 -6.745 -3.084 1200 HB2 ARG 152 2HB ARG 152 -13.079 -5.643 -3.430 1201 HB3 ARG 152 3HB ARG 152 -12.669 -7.311 -3.054 1202 HG2 ARG 152 2HG ARG 152 -11.366 -5.926 -1.031 1203 HG3 ARG 152 3HG ARG 152 -12.813 -4.958 -1.271 1204 HD2 ARG 152 2HD ARG 152 -12.770 -7.938 -0.698 1205 HD3 ARG 152 3HD ARG 152 -13.072 -6.670 0.488 1206 HE ARG 152 HE ARG 152 -14.915 -6.483 -1.666 1207 HH11 ARG 152 1HH1 ARG 152 -14.243 -8.386 1.211 1208 HH12 ARG 152 2HH1 ARG 152 -15.893 -8.860 1.446 1209 HH21 ARG 152 1HH2 ARG 152 -17.119 -7.024 -1.286 1210 HH22 ARG 152 2HH2 ARG 152 -17.531 -8.080 0.026 1211 H LEU 153 H LEU 153 -10.999 -8.430 -4.566 1212 HA LEU 153 HA LEU 153 -10.123 -8.000 -7.196 1213 HB2 LEU 153 2HB LEU 153 -11.682 -10.298 -5.958 1214 HB3 LEU 153 3HB LEU 153 -11.079 -10.344 -7.608 1215 HG LEU 153 HG LEU 153 -9.330 -10.088 -5.127 1216 HD11 LEU 153 1HD1 LEU 153 -9.782 -12.481 -6.940 1217 HD12 LEU 153 2HD1 LEU 153 -10.360 -12.306 -5.280 1218 HD13 LEU 153 3HD1 LEU 153 -8.630 -12.391 -5.603 1219 HD21 LEU 153 3HD2 LEU 153 -8.308 -8.978 -7.050 1220 HD22 LEU 153 1HD2 LEU 153 -8.561 -10.412 -8.050 1221 HD23 LEU 153 2HD2 LEU 153 -7.445 -10.467 -6.683 1222 H GLU 154 H GLU 154 -11.281 -8.376 -9.204 1223 HA GLU 154 HA GLU 154 -13.536 -6.710 -9.513 1224 HB2 GLU 154 2HB GLU 154 -13.529 -7.466 -11.885 1225 HB3 GLU 154 3HB GLU 154 -11.934 -6.977 -11.326 1226 HG2 GLU 154 2HG GLU 154 -11.303 -9.328 -11.032 1227 HG3 GLU 154 3HG GLU 154 -12.895 -9.836 -11.573 1228 H HIS 155 H HIS 155 -15.558 -7.347 -10.556 1229 HA HIS 155 HA HIS 155 -16.712 -9.676 -9.140 1230 HB2 HIS 155 2HB HIS 155 -17.990 -6.928 -9.601 1231 HB3 HIS 155 3HB HIS 155 -18.692 -8.270 -8.698 1232 HD1 HIS 155 HD1 HIS 155 -18.077 -8.440 -6.229 1233 HD2 HIS 155 HD2 HIS 155 -15.650 -5.761 -8.290 1234 HE1 HIS 155 HE1 HIS 155 -16.650 -7.329 -4.484 1235 HE2 HIS 155 HE2 HIS 155 -15.065 -5.876 -5.782 1236 H HIS 156 H HIS 156 -16.781 -11.057 -10.847 1237 HA HIS 156 HA HIS 156 -17.739 -10.238 -13.476 1238 HB2 HIS 156 2HB HIS 156 -15.805 -11.798 -13.228 1239 HB3 HIS 156 3HB HIS 156 -16.855 -12.984 -12.467 1240 HD1 HIS 156 HD1 HIS 156 -16.000 -11.493 -15.816 1241 HD2 HIS 156 HD2 HIS 156 -18.468 -14.449 -14.243 1242 HE1 HIS 156 HE1 HIS 156 -16.813 -12.826 -17.788 1243 HE2 HIS 156 HE2 HIS 156 -18.426 -14.490 -16.824 1244 H HIS 157 H HIS 157 -19.868 -9.780 -13.315 1245 HA HIS 157 HA HIS 157 -21.755 -11.901 -12.468 1246 HB2 HIS 157 2HB HIS 157 -23.284 -10.113 -11.653 1247 HB3 HIS 157 3HB HIS 157 -21.765 -10.129 -10.772 1248 HD1 HIS 157 HD1 HIS 157 -20.067 -8.159 -11.348 1249 HD2 HIS 157 HD2 HIS 157 -23.917 -7.679 -12.837 1250 HE1 HIS 157 HE1 HIS 157 -20.236 -5.738 -12.009 1251 HE2 HIS 157 HE2 HIS 157 -22.516 -5.525 -13.044 1252 H HIS 158 H HIS 158 -23.139 -12.503 -14.023 1253 HA HIS 158 HA HIS 158 -23.319 -11.059 -16.538 1254 HB2 HIS 158 2HB HIS 158 -23.271 -13.533 -16.535 1255 HB3 HIS 158 3HB HIS 158 -24.748 -13.590 -15.582 1256 HD1 HIS 158 HD1 HIS 158 -26.494 -14.483 -17.104 1257 HD2 HIS 158 HD2 HIS 158 -24.083 -11.714 -19.046 1258 HE1 HIS 158 HE1 HIS 158 -27.486 -14.214 -19.392 1259 HE2 HIS 158 HE2 HIS 158 -26.155 -12.372 -20.449 1260 H HIS 159 H HIS 159 -24.057 -9.137 -15.417 1261 HA HIS 159 HA HIS 159 -26.859 -8.617 -15.614 1262 HB2 HIS 159 2HB HIS 159 -25.613 -8.816 -12.837 1263 HB3 HIS 159 3HB HIS 159 -26.909 -7.655 -13.132 1264 HD1 HIS 159 HD1 HIS 159 -26.334 -11.143 -12.240 1265 HD2 HIS 159 HD2 HIS 159 -29.382 -8.953 -14.014 1266 HE1 HIS 159 HE1 HIS 159 -28.372 -12.606 -12.120 1267 HE2 HIS 159 HE2 HIS 159 -30.219 -11.209 -13.094 1268 H HIS 160 H HIS 160 -27.253 -6.265 -14.864 1269 HA HIS 160 HA HIS 160 -24.873 -4.578 -15.432 1270 HB2 HIS 160 2HB HIS 160 -27.805 -3.999 -16.075 1271 HB3 HIS 160 3HB HIS 160 -26.463 -2.897 -16.365 1272 HD1 HIS 160 HD1 HIS 160 -28.538 -4.824 -18.289 1273 HD2 HIS 160 HD2 HIS 160 -24.393 -4.680 -18.006 1274 HE1 HIS 160 HE1 HIS 160 -27.683 -5.767 -20.453 1275 HE2 HIS 160 HE2 HIS 160 -25.188 -5.521 -20.319 Start of MODEL 4 1 H1 MET 1 1H MET 1 -24.057 20.055 -10.114 2 H2 MET 1 2H MET 1 -22.944 18.920 -10.685 3 H3 MET 1 3H MET 1 -22.622 19.774 -9.267 4 HA MET 1 HA MET 1 -23.289 17.529 -8.789 5 HB2 MET 1 2HB MET 1 -25.394 19.579 -7.975 6 HB3 MET 1 3HB MET 1 -25.096 18.045 -7.159 7 HG2 MET 1 2HG MET 1 -23.189 20.386 -7.346 8 HG3 MET 1 3HG MET 1 -24.065 19.836 -5.911 9 HE1 MET 1 3HE MET 1 -20.311 18.926 -5.143 10 HE2 MET 1 1HE MET 1 -21.727 19.812 -4.583 11 HE3 MET 1 2HE MET 1 -20.885 20.327 -6.046 12 H VAL 2 H VAL 2 -24.919 18.873 -11.385 13 HA VAL 2 HA VAL 2 -27.272 17.209 -11.429 14 HB VAL 2 HB VAL 2 -27.605 18.001 -13.737 15 HG11 VAL 2 1HG1 VAL 2 -28.324 19.482 -11.915 16 HG12 VAL 2 2HG1 VAL 2 -27.803 20.419 -13.314 17 HG13 VAL 2 3HG1 VAL 2 -26.745 20.272 -11.908 18 HG21 VAL 2 3HG2 VAL 2 -25.290 17.948 -14.549 19 HG22 VAL 2 1HG2 VAL 2 -24.865 19.304 -13.504 20 HG23 VAL 2 2HG2 VAL 2 -25.998 19.537 -14.839 21 H GLU 3 H GLU 3 -24.061 16.479 -11.850 22 HA GLU 3 HA GLU 3 -23.941 14.776 -14.095 23 HB2 GLU 3 2HB GLU 3 -22.202 14.708 -11.575 24 HB3 GLU 3 3HB GLU 3 -21.810 13.970 -13.123 25 HG2 GLU 3 2HG GLU 3 -20.501 15.917 -13.080 26 HG3 GLU 3 3HG GLU 3 -21.864 16.358 -14.100 27 HA PRO 4 HA PRO 4 -25.821 11.062 -12.304 28 HB2 PRO 4 2HB PRO 4 -25.168 9.209 -14.154 29 HB3 PRO 4 3HB PRO 4 -26.183 10.599 -14.593 30 HG2 PRO 4 2HG PRO 4 -23.258 10.174 -15.107 31 HG3 PRO 4 3HG PRO 4 -24.500 10.848 -16.185 32 HD2 PRO 4 2HD PRO 4 -22.733 12.378 -14.656 33 HD3 PRO 4 3HD PRO 4 -24.272 12.971 -15.309 34 H GLY 5 H GLY 5 -22.948 11.824 -11.482 35 HA2 GLY 5 2HA GLY 5 -21.760 10.614 -9.731 36 HA3 GLY 5 3HA GLY 5 -21.888 9.160 -10.714 37 H VAL 6 H VAL 6 -21.002 9.398 -12.956 38 HA VAL 6 HA VAL 6 -19.409 9.701 -14.488 39 HB VAL 6 HB VAL 6 -18.656 12.234 -12.981 40 HG11 VAL 6 1HG1 VAL 6 -16.717 11.497 -14.285 41 HG12 VAL 6 2HG1 VAL 6 -17.435 12.923 -15.033 42 HG13 VAL 6 3HG1 VAL 6 -17.720 11.327 -15.727 43 HG21 VAL 6 3HG2 VAL 6 -19.855 13.416 -14.798 44 HG22 VAL 6 1HG2 VAL 6 -20.926 12.320 -13.921 45 HG23 VAL 6 2HG2 VAL 6 -20.306 11.864 -15.509 46 H ALA 7 H ALA 7 -17.907 10.573 -11.356 47 HA ALA 7 HA ALA 7 -15.330 9.663 -11.854 48 HB1 ALA 7 3HB ALA 7 -15.914 11.167 -10.016 49 HB2 ALA 7 1HB ALA 7 -15.016 9.772 -9.417 50 HB3 ALA 7 2HB ALA 7 -16.765 9.860 -9.191 51 H LYS 8 H LYS 8 -14.547 7.683 -12.201 52 HA LYS 8 HA LYS 8 -15.402 5.412 -10.525 53 HB2 LYS 8 2HB LYS 8 -15.443 3.826 -12.375 54 HB3 LYS 8 3HB LYS 8 -16.598 5.103 -12.692 55 HG2 LYS 8 2HG LYS 8 -13.840 5.043 -13.957 56 HG3 LYS 8 3HG LYS 8 -15.243 4.261 -14.686 57 HD2 LYS 8 2HD LYS 8 -16.385 6.370 -14.948 58 HD3 LYS 8 3HD LYS 8 -15.178 7.219 -13.980 59 HE2 LYS 8 2HE LYS 8 -13.488 6.767 -15.741 60 HE3 LYS 8 3HE LYS 8 -14.730 5.974 -16.715 61 HZ1 LYS 8 3HZ LYS 8 -14.254 8.351 -17.272 62 HZ2 LYS 8 1HZ LYS 8 -14.947 8.786 -15.792 63 HZ3 LYS 8 2HZ LYS 8 -15.877 8.008 -16.973 64 H LEU 9 H LEU 9 -13.711 4.144 -9.837 65 HA LEU 9 HA LEU 9 -11.053 5.284 -10.173 66 HB2 LEU 9 2HB LEU 9 -12.252 4.390 -7.988 67 HB3 LEU 9 3HB LEU 9 -11.649 2.825 -8.488 68 HG LEU 9 HG LEU 9 -9.884 5.257 -7.918 69 HD11 LEU 9 1HD1 LEU 9 -10.456 2.868 -6.137 70 HD12 LEU 9 2HD1 LEU 9 -11.020 4.522 -5.887 71 HD13 LEU 9 3HD1 LEU 9 -9.299 4.163 -5.805 72 HD21 LEU 9 3HD2 LEU 9 -9.068 2.357 -8.306 73 HD22 LEU 9 1HD2 LEU 9 -7.997 3.696 -7.879 74 HD23 LEU 9 2HD2 LEU 9 -8.792 3.671 -9.450 75 H THR 10 H THR 10 -9.668 4.602 -11.689 76 HA THR 10 HA THR 10 -9.710 1.796 -12.639 77 HB THR 10 HB THR 10 -8.608 4.306 -13.986 78 HG1 THR 10 HG1 THR 10 -10.939 3.967 -13.948 79 HG21 THR 10 3HG2 THR 10 -7.239 2.349 -14.644 80 HG22 THR 10 1HG2 THR 10 -8.240 2.902 -15.988 81 HG23 THR 10 2HG2 THR 10 -8.704 1.463 -15.078 82 H THR 11 H THR 11 -7.656 0.756 -12.888 83 HA THR 11 HA THR 11 -6.203 0.759 -10.519 84 HB THR 11 HB THR 11 -4.711 -0.906 -11.754 85 HG1 THR 11 HG1 THR 11 -5.433 -1.463 -13.869 86 HG21 THR 11 3HG2 THR 11 -7.721 -1.355 -11.981 87 HG22 THR 11 1HG2 THR 11 -6.735 -1.682 -10.553 88 HG23 THR 11 2HG2 THR 11 -6.487 -2.616 -12.029 89 H TYR 12 H TYR 12 -5.577 2.793 -13.271 90 HA TYR 12 HA TYR 12 -2.861 2.838 -13.589 91 HB2 TYR 12 2HB TYR 12 -3.050 5.046 -14.560 92 HB3 TYR 12 3HB TYR 12 -4.489 4.128 -14.984 93 HD1 TYR 12 HD1 TYR 12 -6.647 4.589 -13.602 94 HD2 TYR 12 HD2 TYR 12 -3.264 7.195 -13.525 95 HE1 TYR 12 HE1 TYR 12 -8.060 6.396 -12.732 96 HE2 TYR 12 HE2 TYR 12 -4.676 8.999 -12.662 97 HH TYR 12 HH TYR 12 -7.784 8.502 -11.450 98 H ALA 13 H ALA 13 -4.674 4.612 -11.093 99 HA ALA 13 HA ALA 13 -2.513 6.204 -10.149 100 HB1 ALA 13 3HB ALA 13 -5.131 5.481 -8.791 101 HB2 ALA 13 1HB ALA 13 -4.875 6.845 -9.879 102 HB3 ALA 13 2HB ALA 13 -4.053 6.797 -8.315 103 H SER 14 H SER 14 -3.811 3.044 -9.225 104 HA SER 14 HA SER 14 -2.237 2.809 -6.810 105 HB2 SER 14 2HB SER 14 -3.205 0.507 -6.662 106 HB3 SER 14 3HB SER 14 -4.440 1.747 -6.860 107 HG SER 14 HG SER 14 -5.070 0.430 -8.379 108 H LYS 15 H LYS 15 -1.775 2.032 -10.173 109 HA LYS 15 HA LYS 15 0.460 0.210 -9.726 110 HB2 LYS 15 2HB LYS 15 -0.428 1.542 -12.328 111 HB3 LYS 15 3HB LYS 15 0.691 0.189 -12.179 112 HG2 LYS 15 2HG LYS 15 -2.275 0.181 -11.563 113 HG3 LYS 15 3HG LYS 15 -1.462 -0.655 -12.887 114 HD2 LYS 15 2HD LYS 15 -0.356 -2.166 -11.327 115 HD3 LYS 15 3HD LYS 15 -0.967 -1.254 -9.943 116 HE2 LYS 15 2HE LYS 15 -3.281 -1.874 -10.582 117 HE3 LYS 15 3HE LYS 15 -2.642 -2.832 -11.923 118 HZ1 LYS 15 3HZ LYS 15 -3.134 -4.203 -10.007 119 HZ2 LYS 15 1HZ LYS 15 -2.080 -3.293 -9.042 120 HZ3 LYS 15 2HZ LYS 15 -1.478 -4.215 -10.325 121 H GLN 16 H GLN 16 0.033 3.604 -10.756 122 HA GLN 16 HA GLN 16 2.715 4.367 -11.038 123 HB2 GLN 16 2HB GLN 16 0.335 5.988 -10.023 124 HB3 GLN 16 3HB GLN 16 1.893 6.692 -10.435 125 HG2 GLN 16 2HG GLN 16 0.029 5.265 -12.352 126 HG3 GLN 16 3HG GLN 16 0.252 7.008 -12.229 127 HE21 GLN 16 1HE2 GLN 16 0.632 5.270 -14.531 128 HE22 GLN 16 2HE2 GLN 16 2.274 5.462 -15.027 129 H ALA 17 H ALA 17 0.671 3.941 -8.229 130 HA ALA 17 HA ALA 17 2.201 5.101 -6.219 131 HB1 ALA 17 3HB ALA 17 0.336 2.719 -6.036 132 HB2 ALA 17 1HB ALA 17 -0.130 4.417 -5.937 133 HB3 ALA 17 2HB ALA 17 0.887 3.709 -4.680 134 H THR 18 H THR 18 2.228 1.706 -7.398 135 HA THR 18 HA THR 18 4.188 0.814 -5.518 136 HB THR 18 HB THR 18 4.280 -1.262 -6.977 137 HG1 THR 18 HG1 THR 18 3.780 -0.680 -9.000 138 HG21 THR 18 3HG2 THR 18 2.616 -1.072 -5.139 139 HG22 THR 18 1HG2 THR 18 1.989 -2.003 -6.501 140 HG23 THR 18 2HG2 THR 18 1.473 -0.332 -6.265 141 H ASP 19 H ASP 19 4.356 2.069 -8.824 142 HA ASP 19 HA ASP 19 7.072 1.550 -9.374 143 HB2 ASP 19 2HB ASP 19 5.304 3.860 -10.267 144 HB3 ASP 19 3HB ASP 19 6.921 3.588 -10.908 145 H MET 20 H MET 20 5.556 4.344 -7.768 146 HA MET 20 HA MET 20 8.028 5.785 -7.392 147 HB2 MET 20 2HB MET 20 5.236 6.242 -6.267 148 HB3 MET 20 3HB MET 20 6.588 7.340 -6.017 149 HG2 MET 20 2HG MET 20 6.718 7.771 -8.422 150 HG3 MET 20 3HG MET 20 5.410 6.625 -8.715 151 HE1 MET 20 3HE MET 20 2.855 7.048 -7.947 152 HE2 MET 20 1HE MET 20 2.368 8.441 -6.990 153 HE3 MET 20 2HE MET 20 3.414 7.210 -6.280 154 H GLY 21 H GLY 21 6.041 3.640 -5.396 155 HA2 GLY 21 2HA GLY 21 7.716 2.462 -3.770 156 HA3 GLY 21 3HA GLY 21 7.764 4.056 -3.031 157 H ALA 22 H ALA 22 5.640 1.381 -3.911 158 HA ALA 22 HA ALA 22 4.306 1.521 -1.348 159 HB1 ALA 22 3HB ALA 22 2.898 3.043 -2.702 160 HB2 ALA 22 1HB ALA 22 2.017 1.583 -2.243 161 HB3 ALA 22 2HB ALA 22 2.643 1.761 -3.885 162 H ILE 23 H ILE 23 3.187 -0.439 -0.836 163 HA ILE 23 HA ILE 23 3.907 -2.784 -2.528 164 HB ILE 23 HB ILE 23 4.210 -4.106 -0.414 165 HG12 ILE 23 2HG1 ILE 23 3.941 -1.412 1.014 166 HG13 ILE 23 3HG1 ILE 23 2.769 -2.717 1.081 167 HG21 ILE 23 1HG2 ILE 23 6.200 -3.157 -1.504 168 HG22 ILE 23 2HG2 ILE 23 6.409 -3.193 0.247 169 HG23 ILE 23 3HG2 ILE 23 6.027 -1.673 -0.564 170 HD11 ILE 23 3HD1 ILE 23 5.566 -2.771 2.212 171 HD12 ILE 23 1HD1 ILE 23 4.425 -4.122 2.237 172 HD13 ILE 23 2HD1 ILE 23 4.050 -2.635 3.104 173 H TYR 24 H TYR 24 2.389 -4.485 -2.630 174 HA TYR 24 HA TYR 24 -0.320 -3.908 -1.610 175 HB2 TYR 24 2HB TYR 24 0.648 -5.985 -3.621 176 HB3 TYR 24 3HB TYR 24 -1.005 -5.893 -3.034 177 HD1 TYR 24 HD1 TYR 24 -2.127 -3.426 -3.336 178 HD2 TYR 24 HD2 TYR 24 1.072 -4.995 -5.709 179 HE1 TYR 24 HE1 TYR 24 -2.777 -1.954 -5.204 180 HE2 TYR 24 HE2 TYR 24 0.428 -3.513 -7.554 181 HH TYR 24 HH TYR 24 -1.602 -0.923 -7.269 182 H VAL 25 H VAL 25 -0.871 -4.779 0.242 183 HA VAL 25 HA VAL 25 0.376 -7.284 1.208 184 HB VAL 25 HB VAL 25 -0.109 -6.530 3.496 185 HG11 VAL 25 1HG1 VAL 25 1.516 -4.668 3.672 186 HG12 VAL 25 2HG1 VAL 25 1.440 -4.437 1.922 187 HG13 VAL 25 3HG1 VAL 25 2.075 -5.944 2.591 188 HG21 VAL 25 3HG2 VAL 25 -0.909 -4.244 3.995 189 HG22 VAL 25 1HG2 VAL 25 -2.119 -5.187 3.119 190 HG23 VAL 25 2HG2 VAL 25 -1.173 -3.961 2.272 191 H ASN 26 H ASN 26 -1.078 -8.600 2.658 192 HA ASN 26 HA ASN 26 -3.800 -8.750 1.524 193 HB2 ASN 26 2HB ASN 26 -3.904 -11.022 2.510 194 HB3 ASN 26 3HB ASN 26 -2.561 -10.837 1.399 195 HD21 ASN 26 1HD2 ASN 26 -1.677 -12.731 2.342 196 HD22 ASN 26 2HD2 ASN 26 -0.863 -12.675 3.865 197 H SER 27 H SER 27 -5.143 -10.084 3.542 198 HA SER 27 HA SER 27 -6.094 -7.888 5.063 199 HB2 SER 27 2HB SER 27 -7.572 -9.667 4.192 200 HB3 SER 27 3HB SER 27 -6.803 -10.839 5.261 201 HG SER 27 HG SER 27 -7.993 -8.497 6.297 202 H LYS 28 H LYS 28 -3.599 -10.174 5.725 203 HA LYS 28 HA LYS 28 -3.656 -9.692 8.624 204 HB2 LYS 28 2HB LYS 28 -1.610 -11.276 6.999 205 HB3 LYS 28 3HB LYS 28 -1.746 -11.234 8.755 206 HG2 LYS 28 2HG LYS 28 -3.748 -12.430 6.821 207 HG3 LYS 28 3HG LYS 28 -2.658 -13.314 7.892 208 HD2 LYS 28 2HD LYS 28 -3.824 -12.421 9.861 209 HD3 LYS 28 3HD LYS 28 -4.876 -11.448 8.827 210 HE2 LYS 28 2HE LYS 28 -5.790 -13.526 7.833 211 HE3 LYS 28 3HE LYS 28 -4.762 -14.483 8.906 212 HZ1 LYS 28 3HZ LYS 28 -7.006 -14.271 9.770 213 HZ2 LYS 28 1HZ LYS 28 -6.878 -12.586 9.780 214 HZ3 LYS 28 2HZ LYS 28 -5.906 -13.517 10.803 215 H GLY 29 H GLY 29 -1.554 -9.140 5.819 216 HA2 GLY 29 2HA GLY 29 -0.797 -6.672 5.827 217 HA3 GLY 29 3HA GLY 29 0.055 -7.158 7.287 218 H ASP 30 H ASP 30 0.082 -9.830 5.317 219 HA ASP 30 HA ASP 30 2.858 -9.679 4.751 220 HB2 ASP 30 2HB ASP 30 0.781 -11.555 3.510 221 HB3 ASP 30 3HB ASP 30 2.523 -11.796 3.491 222 H ARG 31 H ARG 31 3.796 -8.488 3.146 223 HA ARG 31 HA ARG 31 2.499 -7.435 0.883 224 HB2 ARG 31 2HB ARG 31 4.748 -6.921 -0.061 225 HB3 ARG 31 3HB ARG 31 4.529 -6.344 1.577 226 HG2 ARG 31 2HG ARG 31 6.085 -8.874 0.917 227 HG3 ARG 31 3HG ARG 31 6.824 -7.278 1.017 228 HD2 ARG 31 2HD ARG 31 6.052 -7.106 3.378 229 HD3 ARG 31 3HD ARG 31 5.398 -8.739 3.262 230 HE ARG 31 HE ARG 31 8.183 -8.639 2.607 231 HH11 ARG 31 1HH1 ARG 31 5.893 -8.855 5.295 232 HH12 ARG 31 2HH1 ARG 31 7.045 -9.573 6.373 233 HH21 ARG 31 1HH2 ARG 31 9.707 -9.490 4.079 234 HH22 ARG 31 2HH2 ARG 31 9.213 -9.935 5.686 235 H ILE 32 H ILE 32 1.342 -8.883 -0.200 236 HA ILE 32 HA ILE 32 2.096 -11.560 -0.809 237 HB ILE 32 HB ILE 32 0.002 -11.543 -2.268 238 HG12 ILE 32 2HG1 ILE 32 -0.216 -8.659 -1.258 239 HG13 ILE 32 3HG1 ILE 32 0.045 -9.151 -2.925 240 HG21 ILE 32 1HG2 ILE 32 -1.552 -11.425 -0.371 241 HG22 ILE 32 2HG2 ILE 32 -0.337 -10.585 0.594 242 HG23 ILE 32 3HG2 ILE 32 -0.059 -12.251 0.082 243 HD11 ILE 32 3HD1 ILE 32 -2.223 -8.479 -2.611 244 HD12 ILE 32 1HD1 ILE 32 -2.439 -9.626 -1.290 245 HD13 ILE 32 2HD1 ILE 32 -2.171 -10.209 -2.937 246 H VAL 33 H VAL 33 2.689 -8.597 -2.484 247 HA VAL 33 HA VAL 33 4.209 -10.042 -4.481 248 HB VAL 33 HB VAL 33 2.003 -9.871 -5.586 249 HG11 VAL 33 1HG1 VAL 33 1.015 -7.729 -6.254 250 HG12 VAL 33 2HG1 VAL 33 2.271 -6.858 -5.370 251 HG13 VAL 33 3HG1 VAL 33 1.115 -7.866 -4.496 252 HG21 VAL 33 3HG2 VAL 33 4.095 -8.085 -6.878 253 HG22 VAL 33 1HG2 VAL 33 2.748 -8.863 -7.714 254 HG23 VAL 33 2HG2 VAL 33 4.017 -9.845 -6.981 255 H ASN 34 H ASN 34 5.961 -8.936 -5.187 256 HA ASN 34 HA ASN 34 7.006 -6.824 -3.614 257 HB2 ASN 34 2HB ASN 34 8.975 -6.956 -5.110 258 HB3 ASN 34 3HB ASN 34 8.463 -8.539 -4.546 259 HD21 ASN 34 1HD2 ASN 34 10.035 -7.716 -6.915 260 HD22 ASN 34 2HD2 ASN 34 9.236 -8.433 -8.264 261 H GLU 35 H GLU 35 5.670 -6.970 -6.833 262 HA GLU 35 HA GLU 35 5.208 -4.139 -7.140 263 HB2 GLU 35 2HB GLU 35 7.551 -4.093 -7.770 264 HB3 GLU 35 3HB GLU 35 7.407 -5.553 -8.732 265 HG2 GLU 35 2HG GLU 35 7.677 -3.540 -10.131 266 HG3 GLU 35 3HG GLU 35 6.147 -4.352 -10.444 267 H SER 36 H SER 36 3.661 -3.788 -8.764 268 HA SER 36 HA SER 36 2.274 -6.125 -9.813 269 HB2 SER 36 2HB SER 36 1.061 -4.109 -8.907 270 HB3 SER 36 3HB SER 36 1.676 -3.163 -10.265 271 HG SER 36 HG SER 36 0.552 -4.543 -11.664 272 H ASN 37 H ASN 37 4.352 -6.680 -10.930 273 HA ASN 37 HA ASN 37 5.348 -5.304 -13.190 274 HB2 ASN 37 2HB ASN 37 6.648 -7.006 -11.929 275 HB3 ASN 37 3HB ASN 37 5.540 -8.266 -12.452 276 HD21 ASN 37 1HD2 ASN 37 5.647 -8.986 -14.615 277 HD22 ASN 37 2HD2 ASN 37 7.007 -8.657 -15.625 278 H VAL 38 H VAL 38 3.054 -7.968 -12.811 279 HA VAL 38 HA VAL 38 1.677 -7.166 -15.275 280 HB VAL 38 HB VAL 38 3.124 -9.089 -15.924 281 HG11 VAL 38 1HG1 VAL 38 2.735 -11.352 -15.030 282 HG12 VAL 38 2HG1 VAL 38 1.601 -10.692 -13.848 283 HG13 VAL 38 3HG1 VAL 38 3.306 -10.241 -13.784 284 HG21 VAL 38 3HG2 VAL 38 0.161 -9.791 -15.919 285 HG22 VAL 38 1HG2 VAL 38 1.385 -10.507 -16.976 286 HG23 VAL 38 2HG2 VAL 38 0.995 -8.792 -17.112 287 H TYR 39 H TYR 39 -0.573 -7.708 -15.252 288 HA TYR 39 HA TYR 39 -1.927 -7.435 -12.837 289 HB2 TYR 39 2HB TYR 39 -3.982 -7.888 -14.133 290 HB3 TYR 39 3HB TYR 39 -2.898 -6.817 -15.009 291 HD1 TYR 39 HD1 TYR 39 -4.291 -10.273 -14.928 292 HD2 TYR 39 HD2 TYR 39 -1.925 -7.497 -17.167 293 HE1 TYR 39 HE1 TYR 39 -4.396 -11.756 -16.877 294 HE2 TYR 39 HE2 TYR 39 -2.033 -8.993 -19.118 295 HH TYR 39 HH TYR 39 -2.409 -11.374 -19.606 296 H THR 40 H THR 40 -0.840 -10.332 -14.468 297 HA THR 40 HA THR 40 -2.586 -12.216 -13.316 298 HB THR 40 HB THR 40 0.246 -12.741 -14.342 299 HG1 THR 40 HG1 THR 40 -1.184 -13.243 -16.316 300 HG21 THR 40 3HG2 THR 40 -2.227 -14.516 -14.280 301 HG22 THR 40 1HG2 THR 40 -0.816 -14.690 -13.230 302 HG23 THR 40 2HG2 THR 40 -0.661 -14.948 -14.968 303 H THR 41 H THR 41 0.769 -11.249 -12.427 304 HA THR 41 HA THR 41 1.108 -13.014 -10.259 305 HB THR 41 HB THR 41 2.431 -10.280 -10.588 306 HG1 THR 41 HG1 THR 41 3.227 -12.820 -11.618 307 HG21 THR 41 3HG2 THR 41 3.434 -12.799 -9.201 308 HG22 THR 41 1HG2 THR 41 2.850 -11.350 -8.376 309 HG23 THR 41 2HG2 THR 41 4.315 -11.280 -9.357 310 H PHE 42 H PHE 42 -0.174 -9.722 -10.441 311 HA PHE 42 HA PHE 42 -0.573 -9.267 -7.669 312 HB2 PHE 42 2HB PHE 42 -0.478 -7.409 -9.253 313 HB3 PHE 42 3HB PHE 42 -1.861 -8.033 -10.141 314 HD1 PHE 42 HD1 PHE 42 -1.243 -7.365 -6.475 315 HD2 PHE 42 HD2 PHE 42 -3.663 -6.547 -9.904 316 HE1 PHE 42 HE1 PHE 42 -2.717 -5.948 -5.116 317 HE2 PHE 42 HE2 PHE 42 -5.125 -5.124 -8.534 318 HZ PHE 42 HZ PHE 42 -4.654 -4.825 -6.134 319 H ARG 43 H ARG 43 -2.664 -10.582 -10.243 320 HA ARG 43 HA ARG 43 -5.081 -10.582 -8.774 321 HB2 ARG 43 2HB ARG 43 -5.162 -10.623 -11.198 322 HB3 ARG 43 3HB ARG 43 -4.274 -12.141 -11.263 323 HG2 ARG 43 2HG ARG 43 -6.162 -13.344 -10.283 324 HG3 ARG 43 3HG ARG 43 -7.043 -11.835 -10.036 325 HD2 ARG 43 2HD ARG 43 -6.229 -12.914 -12.750 326 HD3 ARG 43 3HD ARG 43 -7.809 -13.162 -12.017 327 HE ARG 43 HE ARG 43 -6.731 -10.647 -13.084 328 HH11 ARG 43 1HH1 ARG 43 -9.431 -12.324 -11.571 329 HH12 ARG 43 2HH1 ARG 43 -10.581 -11.083 -11.954 330 HH21 ARG 43 1HH2 ARG 43 -8.241 -9.040 -13.607 331 HH22 ARG 43 2HH2 ARG 43 -9.899 -9.203 -13.120 332 H ASN 44 H ASN 44 -2.746 -13.213 -9.471 333 HA ASN 44 HA ASN 44 -4.142 -15.203 -7.981 334 HB2 ASN 44 2HB ASN 44 -1.235 -15.095 -8.890 335 HB3 ASN 44 3HB ASN 44 -1.967 -16.496 -8.122 336 HD21 ASN 44 1HD2 ASN 44 -1.475 -14.877 -11.078 337 HD22 ASN 44 2HD2 ASN 44 -2.500 -15.856 -12.067 338 H ALA 45 H ALA 45 -1.690 -12.821 -7.124 339 HA ALA 45 HA ALA 45 -1.080 -13.688 -4.514 340 HB1 ALA 45 3HB ALA 45 0.191 -11.950 -5.707 341 HB2 ALA 45 1HB ALA 45 -0.341 -11.378 -4.127 342 HB3 ALA 45 2HB ALA 45 -1.182 -10.848 -5.584 343 H ILE 46 H ILE 46 -3.777 -11.767 -5.789 344 HA ILE 46 HA ILE 46 -5.077 -11.278 -3.270 345 HB ILE 46 HB ILE 46 -6.148 -11.141 -6.130 346 HG12 ILE 46 2HG1 ILE 46 -5.187 -8.929 -4.257 347 HG13 ILE 46 3HG1 ILE 46 -4.366 -9.487 -5.709 348 HG21 ILE 46 1HG2 ILE 46 -8.041 -9.841 -5.225 349 HG22 ILE 46 2HG2 ILE 46 -7.454 -10.121 -3.585 350 HG23 ILE 46 3HG2 ILE 46 -8.009 -11.479 -4.566 351 HD11 ILE 46 3HD1 ILE 46 -6.238 -8.670 -7.072 352 HD12 ILE 46 1HD1 ILE 46 -5.490 -7.397 -6.113 353 HD13 ILE 46 2HD1 ILE 46 -7.033 -8.078 -5.610 354 H LEU 47 H LEU 47 -5.306 -13.757 -5.799 355 HA LEU 47 HA LEU 47 -7.673 -15.048 -4.910 356 HB2 LEU 47 2HB LEU 47 -5.387 -16.077 -6.636 357 HB3 LEU 47 3HB LEU 47 -6.872 -16.974 -6.361 358 HG LEU 47 HG LEU 47 -6.696 -14.268 -7.755 359 HD11 LEU 47 1HD1 LEU 47 -7.271 -15.458 -9.817 360 HD12 LEU 47 2HD1 LEU 47 -7.221 -17.001 -8.958 361 HD13 LEU 47 3HD1 LEU 47 -5.749 -16.046 -9.146 362 HD21 LEU 47 3HD2 LEU 47 -8.803 -14.497 -6.568 363 HD22 LEU 47 1HD2 LEU 47 -9.090 -16.070 -7.317 364 HD23 LEU 47 2HD2 LEU 47 -9.065 -14.607 -8.303 365 H LYS 48 H LYS 48 -4.384 -15.199 -3.863 366 HA LYS 48 HA LYS 48 -4.328 -17.554 -2.341 367 HB2 LYS 48 2HB LYS 48 -2.361 -16.160 -2.816 368 HB3 LYS 48 3HB LYS 48 -3.004 -14.852 -1.832 369 HG2 LYS 48 2HG LYS 48 -2.733 -16.177 0.198 370 HG3 LYS 48 3HG LYS 48 -2.247 -17.591 -0.738 371 HD2 LYS 48 2HD LYS 48 -0.708 -14.972 -0.511 372 HD3 LYS 48 3HD LYS 48 -0.288 -16.498 0.270 373 HE2 LYS 48 2HE LYS 48 -0.281 -15.923 -2.715 374 HE3 LYS 48 3HE LYS 48 1.121 -16.207 -1.683 375 HZ1 LYS 48 3HZ LYS 48 -1.005 -18.212 -2.230 376 HZ2 LYS 48 1HZ LYS 48 0.406 -18.470 -1.337 377 HZ3 LYS 48 2HZ LYS 48 0.498 -18.163 -2.994 378 H GLN 49 H GLN 49 -5.726 -14.392 -1.613 379 HA GLN 49 HA GLN 49 -6.392 -14.969 1.139 380 HB2 GLN 49 2HB GLN 49 -7.209 -12.718 -0.744 381 HB3 GLN 49 3HB GLN 49 -7.845 -12.852 0.891 382 HG2 GLN 49 2HG GLN 49 -6.085 -11.256 0.941 383 HG3 GLN 49 3HG GLN 49 -5.494 -12.702 1.755 384 HE21 GLN 49 1HE2 GLN 49 -5.210 -10.673 -1.061 385 HE22 GLN 49 2HE2 GLN 49 -3.724 -11.340 -1.640 386 H ALA 50 H ALA 50 -8.430 -15.338 2.005 387 HA ALA 50 HA ALA 50 -10.351 -16.855 0.569 388 HB1 ALA 50 3HB ALA 50 -10.590 -15.452 3.264 389 HB2 ALA 50 1HB ALA 50 -10.017 -17.098 2.995 390 HB3 ALA 50 2HB ALA 50 -11.695 -16.684 2.646 391 H ASP 51 H ASP 51 -10.802 -13.680 2.184 392 HA ASP 51 HA ASP 51 -12.798 -12.788 0.295 393 HB2 ASP 51 2HB ASP 51 -12.773 -11.979 2.680 394 HB3 ASP 51 3HB ASP 51 -11.268 -11.122 2.357 395 H LYS 52 H LYS 52 -12.378 -11.946 -1.639 396 HA LYS 52 HA LYS 52 -9.674 -11.871 -2.572 397 HB2 LYS 52 2HB LYS 52 -12.284 -11.298 -4.024 398 HB3 LYS 52 3HB LYS 52 -10.710 -11.417 -4.804 399 HG2 LYS 52 2HG LYS 52 -12.123 -13.650 -3.304 400 HG3 LYS 52 3HG LYS 52 -11.975 -13.506 -5.058 401 HD2 LYS 52 2HD LYS 52 -9.534 -13.758 -4.903 402 HD3 LYS 52 3HD LYS 52 -9.626 -13.812 -3.140 403 HE2 LYS 52 2HE LYS 52 -10.873 -15.857 -5.013 404 HE3 LYS 52 3HE LYS 52 -9.349 -16.058 -4.152 405 HZ1 LYS 52 3HZ LYS 52 -11.106 -17.161 -2.980 406 HZ2 LYS 52 1HZ LYS 52 -12.026 -15.743 -2.909 407 HZ3 LYS 52 2HZ LYS 52 -10.569 -15.848 -2.059 408 H VAL 53 H VAL 53 -8.728 -10.187 -1.421 409 HA VAL 53 HA VAL 53 -8.965 -7.565 -2.671 410 HB VAL 53 HB VAL 53 -10.552 -7.504 -0.728 411 HG11 VAL 53 1HG1 VAL 53 -9.417 -9.051 0.798 412 HG12 VAL 53 2HG1 VAL 53 -9.753 -7.510 1.587 413 HG13 VAL 53 3HG1 VAL 53 -8.114 -7.883 1.044 414 HG21 VAL 53 3HG2 VAL 53 -8.164 -5.651 -0.419 415 HG22 VAL 53 1HG2 VAL 53 -9.785 -5.367 0.228 416 HG23 VAL 53 2HG2 VAL 53 -9.527 -5.425 -1.517 417 H ALA 54 H ALA 54 -7.126 -6.310 -2.445 418 HA ALA 54 HA ALA 54 -4.877 -7.173 -0.753 419 HB1 ALA 54 3HB ALA 54 -4.647 -6.237 -3.649 420 HB2 ALA 54 1HB ALA 54 -4.294 -7.856 -3.039 421 HB3 ALA 54 2HB ALA 54 -3.292 -6.495 -2.541 422 H TYR 55 H TYR 55 -4.275 -5.498 0.496 423 HA TYR 55 HA TYR 55 -5.262 -2.793 0.015 424 HB2 TYR 55 2HB TYR 55 -3.642 -4.017 2.297 425 HB3 TYR 55 3HB TYR 55 -4.215 -2.353 2.261 426 HD1 TYR 55 HD2 TYR 55 -5.277 -5.904 2.630 427 HD2 TYR 55 HD1 TYR 55 -6.573 -1.823 2.693 428 HE1 TYR 55 HE2 TYR 55 -7.401 -6.588 3.680 429 HE2 TYR 55 HE1 TYR 55 -8.680 -2.511 3.741 430 HH TYR 55 HH TYR 55 -10.066 -4.375 4.029 431 H LEU 56 H LEU 56 -3.740 -0.957 0.073 432 HA LEU 56 HA LEU 56 -1.044 -1.568 -1.027 433 HB2 LEU 56 2HB LEU 56 -2.657 -0.822 -2.765 434 HB3 LEU 56 3HB LEU 56 -2.974 0.641 -1.854 435 HG LEU 56 HG LEU 56 -0.664 1.428 -2.280 436 HD11 LEU 56 1HD1 LEU 56 0.527 -0.694 -2.370 437 HD12 LEU 56 2HD1 LEU 56 0.821 0.238 -3.834 438 HD13 LEU 56 3HD1 LEU 56 -0.297 -1.125 -3.869 439 HD21 LEU 56 3HD2 LEU 56 -0.899 1.827 -4.697 440 HD22 LEU 56 1HD2 LEU 56 -2.434 2.031 -3.855 441 HD23 LEU 56 2HD2 LEU 56 -2.130 0.566 -4.794 442 H VAL 57 H VAL 57 0.216 -1.139 0.729 443 HA VAL 57 HA VAL 57 -0.267 1.176 2.451 444 HB VAL 57 HB VAL 57 1.948 -0.933 2.599 445 HG11 VAL 57 1HG1 VAL 57 1.133 1.134 4.681 446 HG12 VAL 57 2HG1 VAL 57 2.619 1.157 3.729 447 HG13 VAL 57 3HG1 VAL 57 2.343 -0.132 4.900 448 HG21 VAL 57 3HG2 VAL 57 -0.267 -1.943 2.923 449 HG22 VAL 57 1HG2 VAL 57 -0.649 -0.756 4.173 450 HG23 VAL 57 2HG2 VAL 57 0.637 -1.939 4.439 451 H MET 58 H MET 58 0.754 3.051 2.232 452 HA MET 58 HA MET 58 3.294 3.390 0.813 453 HB2 MET 58 2HB MET 58 2.394 5.092 -0.707 454 HB3 MET 58 3HB MET 58 1.469 3.616 -0.925 455 HG2 MET 58 2HG MET 58 -0.362 4.543 0.423 456 HG3 MET 58 3HG MET 58 0.577 6.008 0.703 457 HE1 MET 58 3HE MET 58 -1.324 4.810 -3.328 458 HE2 MET 58 1HE MET 58 -1.592 3.953 -1.810 459 HE3 MET 58 2HE MET 58 -0.027 3.849 -2.623 460 H ASP 59 H ASP 59 4.004 5.776 1.076 461 HA ASP 59 HA ASP 59 2.877 7.035 3.513 462 HB2 ASP 59 2HB ASP 59 5.402 6.860 3.241 463 HB3 ASP 59 3HB ASP 59 5.293 7.943 1.856 464 H GLU 60 H GLU 60 2.572 9.464 3.291 465 HA GLU 60 HA GLU 60 0.589 10.058 1.399 466 HB2 GLU 60 2HB GLU 60 0.709 10.982 3.688 467 HB3 GLU 60 3HB GLU 60 2.136 11.911 3.251 468 HG2 GLU 60 2HG GLU 60 0.811 13.238 1.658 469 HG3 GLU 60 3HG GLU 60 -0.610 12.252 1.997 470 H ARG 61 H ARG 61 4.061 10.480 1.280 471 HA ARG 61 HA ARG 61 4.411 12.413 -0.705 472 HB2 ARG 61 2HB ARG 61 5.937 9.805 -0.264 473 HB3 ARG 61 3HB ARG 61 6.493 11.105 -1.309 474 HG2 ARG 61 2HG ARG 61 6.122 11.263 1.698 475 HG3 ARG 61 3HG ARG 61 7.654 11.138 0.833 476 HD2 ARG 61 2HD ARG 61 5.721 13.476 0.805 477 HD3 ARG 61 3HD ARG 61 7.346 13.427 1.498 478 HE ARG 61 HE ARG 61 7.535 12.805 -1.234 479 HH11 ARG 61 1HH1 ARG 61 6.793 15.599 0.775 480 HH12 ARG 61 2HH1 ARG 61 7.344 16.740 -0.410 481 HH21 ARG 61 1HH2 ARG 61 8.213 14.302 -2.783 482 HH22 ARG 61 2HH2 ARG 61 8.150 16.004 -2.431 483 H THR 62 H THR 62 3.850 8.935 -1.038 484 HA THR 62 HA THR 62 3.687 8.779 -3.856 485 HB THR 62 HB THR 62 2.453 6.966 -1.727 486 HG1 THR 62 HG1 THR 62 4.521 5.779 -2.255 487 HG21 THR 62 3HG2 THR 62 3.269 6.317 -4.581 488 HG22 THR 62 1HG2 THR 62 1.608 6.441 -3.993 489 HG23 THR 62 2HG2 THR 62 2.666 5.164 -3.389 490 H TRP 63 H TRP 63 1.327 9.383 -1.298 491 HA TRP 63 HA TRP 63 -1.039 9.199 -2.848 492 HB2 TRP 63 2HB TRP 63 -1.167 8.913 -0.459 493 HB3 TRP 63 3HB TRP 63 -0.469 10.501 -0.161 494 HD1 TRP 63 HD1 TRP 63 -2.145 12.494 0.080 495 HE1 TRP 63 HE1 TRP 63 -4.697 12.743 -0.149 496 HE3 TRP 63 HE3 TRP 63 -3.265 7.914 -1.930 497 HZ2 TRP 63 HZ2 TRP 63 -6.881 11.231 -1.059 498 HZ3 TRP 63 HZ3 TRP 63 -5.615 7.402 -2.462 499 HH2 TRP 63 HH2 TRP 63 -7.380 9.033 -2.033 500 H LYS 64 H LYS 64 1.176 11.925 -2.242 501 HA LYS 64 HA LYS 64 -0.415 14.095 -2.999 502 HB2 LYS 64 2HB LYS 64 2.524 13.724 -3.716 503 HB3 LYS 64 3HB LYS 64 1.665 15.255 -3.639 504 HG2 LYS 64 2HG LYS 64 2.343 13.448 -1.314 505 HG3 LYS 64 3HG LYS 64 3.096 14.983 -1.714 506 HD2 LYS 64 2HD LYS 64 0.821 16.073 -1.375 507 HD3 LYS 64 3HD LYS 64 0.260 14.529 -0.730 508 HE2 LYS 64 2HE LYS 64 2.019 14.647 1.027 509 HE3 LYS 64 3HE LYS 64 2.539 16.202 0.375 510 HZ1 LYS 64 3HZ LYS 64 1.089 16.465 2.297 511 HZ2 LYS 64 1HZ LYS 64 -0.146 15.631 1.507 512 HZ3 LYS 64 2HZ LYS 64 0.374 17.123 0.916 513 H LYS 65 H LYS 65 1.083 11.607 -4.896 514 HA LYS 65 HA LYS 65 0.505 12.797 -7.483 515 HB2 LYS 65 2HB LYS 65 1.675 10.090 -6.717 516 HB3 LYS 65 3HB LYS 65 1.583 10.728 -8.353 517 HG2 LYS 65 2HG LYS 65 3.202 11.907 -6.073 518 HG3 LYS 65 3HG LYS 65 3.843 10.971 -7.422 519 HD2 LYS 65 2HD LYS 65 2.536 13.713 -7.573 520 HD3 LYS 65 3HD LYS 65 4.245 13.339 -7.808 521 HE2 LYS 65 2HE LYS 65 3.632 11.966 -9.808 522 HE3 LYS 65 3HE LYS 65 1.952 12.459 -9.593 523 HZ1 LYS 65 3HZ LYS 65 4.248 14.231 -10.214 524 HZ2 LYS 65 1HZ LYS 65 2.693 14.784 -9.835 525 HZ3 LYS 65 2HZ LYS 65 2.944 13.854 -11.222 526 H VAL 66 H VAL 66 -0.596 9.969 -5.542 527 HA VAL 66 HA VAL 66 -2.363 8.875 -7.447 528 HB VAL 66 HB VAL 66 -2.469 8.688 -4.398 529 HG11 VAL 66 1HG1 VAL 66 -4.673 8.084 -5.323 530 HG12 VAL 66 2HG1 VAL 66 -3.855 6.656 -4.690 531 HG13 VAL 66 3HG1 VAL 66 -3.914 6.938 -6.432 532 HG21 VAL 66 3HG2 VAL 66 -1.338 6.503 -4.710 533 HG22 VAL 66 1HG2 VAL 66 -0.370 7.828 -5.360 534 HG23 VAL 66 2HG2 VAL 66 -1.277 6.782 -6.454 535 H TYR 67 H TYR 67 -3.172 10.916 -4.616 536 HA TYR 67 HA TYR 67 -5.815 11.540 -5.023 537 HB2 TYR 67 2HB TYR 67 -4.496 12.202 -3.044 538 HB3 TYR 67 3HB TYR 67 -3.575 13.346 -4.002 539 HD1 TYR 67 HD1 TYR 67 -7.026 12.603 -2.795 540 HD2 TYR 67 HD2 TYR 67 -4.352 15.638 -4.164 541 HE1 TYR 67 HE1 TYR 67 -8.674 14.318 -2.191 542 HE2 TYR 67 HE2 TYR 67 -6.009 17.364 -3.563 543 HH TYR 67 HH TYR 67 -8.703 16.754 -1.629 544 H ASP 68 H ASP 68 -2.974 13.132 -6.438 545 HA ASP 68 HA ASP 68 -4.282 15.278 -7.715 546 HB2 ASP 68 2HB ASP 68 -1.831 15.253 -7.310 547 HB3 ASP 68 3HB ASP 68 -1.641 13.954 -8.481 548 H LEU 69 H LEU 69 -3.043 12.218 -9.058 549 HA LEU 69 HA LEU 69 -3.803 12.609 -11.716 550 HB2 LEU 69 2HB LEU 69 -3.310 9.999 -10.213 551 HB3 LEU 69 3HB LEU 69 -3.449 10.123 -11.956 552 HG LEU 69 HG LEU 69 -1.246 11.386 -10.266 553 HD11 LEU 69 1HD1 LEU 69 -1.111 9.002 -12.151 554 HD12 LEU 69 2HD1 LEU 69 -1.007 8.950 -10.390 555 HD13 LEU 69 3HD1 LEU 69 0.257 9.748 -11.321 556 HD21 LEU 69 3HD2 LEU 69 -1.599 11.382 -13.280 557 HD22 LEU 69 1HD2 LEU 69 -0.181 11.973 -12.409 558 HD23 LEU 69 2HD2 LEU 69 -1.733 12.779 -12.209 559 H LEU 70 H LEU 70 -5.560 11.205 -8.983 560 HA LEU 70 HA LEU 70 -7.742 10.088 -10.350 561 HB2 LEU 70 2HB LEU 70 -7.586 11.300 -7.567 562 HB3 LEU 70 3HB LEU 70 -9.016 10.490 -8.170 563 HG LEU 70 HG LEU 70 -6.297 9.164 -7.810 564 HD11 LEU 70 1HD1 LEU 70 -7.325 9.709 -5.652 565 HD12 LEU 70 2HD1 LEU 70 -7.295 7.969 -5.922 566 HD13 LEU 70 3HD1 LEU 70 -8.804 8.866 -6.123 567 HD21 LEU 70 3HD2 LEU 70 -7.541 8.146 -9.652 568 HD22 LEU 70 1HD2 LEU 70 -8.960 7.941 -8.619 569 HD23 LEU 70 2HD2 LEU 70 -7.474 7.049 -8.277 570 H ILE 71 H ILE 71 -7.522 13.357 -8.838 571 HA ILE 71 HA ILE 71 -10.001 14.319 -9.829 572 HB ILE 71 HB ILE 71 -7.571 16.010 -9.065 573 HG12 ILE 71 2HG1 ILE 71 -9.828 15.020 -7.249 574 HG13 ILE 71 3HG1 ILE 71 -8.179 14.403 -7.243 575 HG21 ILE 71 1HG2 ILE 71 -9.251 17.765 -8.545 576 HG22 ILE 71 2HG2 ILE 71 -10.534 16.697 -9.125 577 HG23 ILE 71 3HG2 ILE 71 -9.307 17.288 -10.246 578 HD11 ILE 71 3HD1 ILE 71 -8.539 15.926 -5.409 579 HD12 ILE 71 1HD1 ILE 71 -9.024 17.206 -6.520 580 HD13 ILE 71 2HD1 ILE 71 -7.362 16.601 -6.536 581 H LEU 72 H LEU 72 -6.705 14.639 -11.003 582 HA LEU 72 HA LEU 72 -6.979 16.486 -13.062 583 HB2 LEU 72 2HB LEU 72 -4.855 15.761 -12.011 584 HB3 LEU 72 3HB LEU 72 -5.010 14.176 -12.722 585 HG LEU 72 HG LEU 72 -3.276 15.781 -13.732 586 HD11 LEU 72 1HD1 LEU 72 -5.234 14.538 -15.673 587 HD12 LEU 72 2HD1 LEU 72 -3.892 13.723 -14.866 588 HD13 LEU 72 3HD1 LEU 72 -3.568 15.016 -16.016 589 HD21 LEU 72 3HD2 LEU 72 -4.644 17.814 -13.782 590 HD22 LEU 72 1HD2 LEU 72 -5.705 17.093 -14.996 591 HD23 LEU 72 2HD2 LEU 72 -4.013 17.424 -15.379 592 H HIS 73 H HIS 73 -7.418 12.965 -13.042 593 HA HIS 73 HA HIS 73 -7.903 12.797 -15.890 594 HB2 HIS 73 2HB HIS 73 -7.978 10.803 -13.620 595 HB3 HIS 73 3HB HIS 73 -8.695 10.381 -15.172 596 HD1 HIS 73 HD1 HIS 73 -7.108 8.986 -16.450 597 HD2 HIS 73 HD2 HIS 73 -5.138 11.947 -14.302 598 HE1 HIS 73 HE1 HIS 73 -4.681 8.765 -17.057 599 HE2 HIS 73 HE2 HIS 73 -3.576 10.712 -15.927 600 H ASP 74 H ASP 74 -10.020 12.399 -12.969 601 HA ASP 74 HA ASP 74 -12.443 12.989 -14.368 602 HB2 ASP 74 2HB ASP 74 -11.885 10.955 -15.613 603 HB3 ASP 74 3HB ASP 74 -11.620 10.060 -14.130 604 H PHE 75 H PHE 75 -10.895 11.267 -11.698 605 HA PHE 75 HA PHE 75 -13.321 10.654 -10.308 606 HB2 PHE 75 2HB PHE 75 -11.015 9.396 -10.295 607 HB3 PHE 75 3HB PHE 75 -10.571 10.537 -9.043 608 HD1 PHE 75 HD1 PHE 75 -11.797 10.502 -6.841 609 HD2 PHE 75 HD2 PHE 75 -12.526 7.577 -9.865 610 HE1 PHE 75 HE1 PHE 75 -12.817 9.014 -5.166 611 HE2 PHE 75 HE2 PHE 75 -13.564 6.109 -8.191 612 HZ PHE 75 HZ PHE 75 -13.706 6.819 -5.841 613 H THR 76 H THR 76 -14.446 12.184 -9.340 614 HA THR 76 HA THR 76 -13.786 14.765 -8.740 615 HB THR 76 HB THR 76 -15.921 13.000 -7.473 616 HG1 THR 76 HG1 THR 76 -16.363 14.684 -9.697 617 HG21 THR 76 3HG2 THR 76 -15.864 16.000 -7.851 618 HG22 THR 76 1HG2 THR 76 -15.696 15.144 -6.320 619 HG23 THR 76 2HG2 THR 76 -17.214 15.061 -7.211 620 HA PRO 77 HA PRO 77 -11.321 14.521 -4.864 621 HB2 PRO 77 2HB PRO 77 -12.008 17.066 -3.892 622 HB3 PRO 77 3HB PRO 77 -10.733 16.747 -5.084 623 HG2 PRO 77 2HG PRO 77 -13.580 17.583 -5.577 624 HG3 PRO 77 3HG PRO 77 -12.081 18.211 -6.306 625 HD2 PRO 77 2HD PRO 77 -13.573 16.497 -7.670 626 HD3 PRO 77 3HD PRO 77 -11.802 16.308 -7.683 627 H GLU 78 H GLU 78 -14.690 15.466 -4.939 628 HA GLU 78 HA GLU 78 -15.307 15.147 -2.186 629 HB2 GLU 78 2HB GLU 78 -17.134 15.115 -4.624 630 HB3 GLU 78 3HB GLU 78 -17.671 15.286 -2.951 631 HG2 GLU 78 2HG GLU 78 -16.454 17.405 -2.743 632 HG3 GLU 78 3HG GLU 78 -15.815 17.223 -4.372 633 H GLU 79 H GLU 79 -15.358 12.953 -4.956 634 HA GLU 79 HA GLU 79 -16.538 10.739 -3.580 635 HB2 GLU 79 2HB GLU 79 -14.813 10.801 -6.090 636 HB3 GLU 79 3HB GLU 79 -15.671 9.383 -5.503 637 HG2 GLU 79 2HG GLU 79 -16.973 11.967 -6.392 638 HG3 GLU 79 3HG GLU 79 -16.847 10.502 -7.360 639 H ILE 80 H ILE 80 -13.204 11.812 -4.158 640 HA ILE 80 HA ILE 80 -11.748 9.646 -3.115 641 HB ILE 80 HB ILE 80 -11.069 12.628 -3.074 642 HG12 ILE 80 2HG1 ILE 80 -10.219 10.459 -5.046 643 HG13 ILE 80 3HG1 ILE 80 -11.399 11.726 -5.358 644 HG21 ILE 80 1HG2 ILE 80 -9.194 10.282 -2.605 645 HG22 ILE 80 2HG2 ILE 80 -9.696 11.473 -1.405 646 HG23 ILE 80 3HG2 ILE 80 -8.703 11.966 -2.771 647 HD11 ILE 80 3HD1 ILE 80 -8.443 12.111 -4.890 648 HD12 ILE 80 1HD1 ILE 80 -9.617 13.413 -5.116 649 HD13 ILE 80 2HD1 ILE 80 -9.316 12.259 -6.414 650 H LYS 81 H LYS 81 -12.797 12.661 -1.544 651 HA LYS 81 HA LYS 81 -11.793 11.961 1.017 652 HB2 LYS 81 2HB LYS 81 -12.675 14.067 1.794 653 HB3 LYS 81 3HB LYS 81 -11.949 14.298 0.210 654 HG2 LYS 81 2HG LYS 81 -14.420 13.994 -0.661 655 HG3 LYS 81 3HG LYS 81 -14.853 14.401 0.999 656 HD2 LYS 81 2HD LYS 81 -13.190 16.122 -0.893 657 HD3 LYS 81 3HD LYS 81 -14.880 16.388 -0.465 658 HE2 LYS 81 2HE LYS 81 -14.234 16.813 1.878 659 HE3 LYS 81 3HE LYS 81 -12.541 16.531 1.466 660 HZ1 LYS 81 3HZ LYS 81 -13.045 18.891 1.514 661 HZ2 LYS 81 1HZ LYS 81 -14.256 18.692 0.353 662 HZ3 LYS 81 2HZ LYS 81 -12.643 18.417 -0.057 663 H SER 82 H SER 82 -14.788 11.343 -0.613 664 HA SER 82 HA SER 82 -16.585 10.889 1.493 665 HB2 SER 82 2HB SER 82 -17.283 10.932 -0.865 666 HB3 SER 82 3HB SER 82 -16.366 9.465 -1.197 667 HG SER 82 HG SER 82 -18.486 8.893 -0.902 668 H PHE 83 H PHE 83 -13.921 8.915 0.346 669 HA PHE 83 HA PHE 83 -14.684 6.520 1.783 670 HB2 PHE 83 2HB PHE 83 -12.037 7.268 0.477 671 HB3 PHE 83 3HB PHE 83 -12.459 5.665 1.074 672 HD1 PHE 83 HD2 PHE 83 -15.020 4.987 0.103 673 HD2 PHE 83 HD1 PHE 83 -12.064 7.360 -1.875 674 HE1 PHE 83 HE2 PHE 83 -16.008 4.418 -2.080 675 HE2 PHE 83 HE1 PHE 83 -13.056 6.785 -4.046 676 HZ PHE 83 HZ PHE 83 -15.030 5.317 -4.155 677 H PHE 84 H PHE 84 -12.638 9.337 2.416 678 HA PHE 84 HA PHE 84 -11.542 8.340 4.902 679 HB2 PHE 84 2HB PHE 84 -11.698 11.189 3.815 680 HB3 PHE 84 3HB PHE 84 -10.812 10.722 5.260 681 HD1 PHE 84 HD2 PHE 84 -8.972 8.839 4.917 682 HD2 PHE 84 HD1 PHE 84 -10.523 11.261 1.761 683 HE1 PHE 84 HE2 PHE 84 -6.980 8.365 3.553 684 HE2 PHE 84 HE1 PHE 84 -8.539 10.781 0.406 685 HZ PHE 84 HZ PHE 84 -6.766 9.331 1.301 686 H GLU 85 H GLU 85 -14.382 10.185 3.929 687 HA GLU 85 HA GLU 85 -15.412 10.730 6.548 688 HB2 GLU 85 2HB GLU 85 -17.006 10.410 3.958 689 HB3 GLU 85 3HB GLU 85 -17.531 11.234 5.418 690 HG2 GLU 85 2HG GLU 85 -15.328 12.130 3.557 691 HG3 GLU 85 3HG GLU 85 -16.938 12.815 3.659 692 H ASN 86 H ASN 86 -15.428 8.076 4.343 693 HA ASN 86 HA ASN 86 -16.232 6.018 4.225 694 HB2 ASN 86 2HB ASN 86 -14.814 5.691 6.219 695 HB3 ASN 86 3HB ASN 86 -16.166 6.112 7.266 696 HD21 ASN 86 1HD2 ASN 86 -16.095 4.085 8.304 697 HD22 ASN 86 2HD2 ASN 86 -16.621 2.630 7.540 698 H LYS 87 H LYS 87 -18.109 7.334 3.394 699 HA LYS 87 HA LYS 87 -20.618 6.766 4.809 700 HB2 LYS 87 2HB LYS 87 -20.090 8.104 2.116 701 HB3 LYS 87 3HB LYS 87 -21.676 7.944 2.874 702 HG2 LYS 87 2HG LYS 87 -20.910 9.327 4.788 703 HG3 LYS 87 3HG LYS 87 -19.322 9.488 4.038 704 HD2 LYS 87 2HD LYS 87 -21.935 10.517 2.859 705 HD3 LYS 87 3HD LYS 87 -20.737 11.501 3.699 706 HE2 LYS 87 2HE LYS 87 -19.069 10.877 1.930 707 HE3 LYS 87 3HE LYS 87 -20.364 10.041 1.064 708 HZ1 LYS 87 3HZ LYS 87 -21.571 12.186 1.009 709 HZ2 LYS 87 1HZ LYS 87 -20.109 12.226 0.167 710 HZ3 LYS 87 2HZ LYS 87 -20.226 12.940 1.692 711 H GLY 88 H GLY 88 -18.486 4.975 3.095 712 HA2 GLY 88 2HA GLY 88 -20.329 3.257 1.638 713 HA3 GLY 88 3HA GLY 88 -18.603 3.012 1.873 714 H LYS 89 H LYS 89 -17.920 1.656 3.477 715 HA LYS 89 HA LYS 89 -19.698 0.876 5.677 716 HB2 LYS 89 2HB LYS 89 -18.490 -1.115 3.696 717 HB3 LYS 89 3HB LYS 89 -19.031 -1.592 5.299 718 HG2 LYS 89 2HG LYS 89 -20.770 -0.437 3.106 719 HG3 LYS 89 3HG LYS 89 -20.704 -2.129 3.598 720 HD2 LYS 89 2HD LYS 89 -21.670 0.199 5.298 721 HD3 LYS 89 3HD LYS 89 -22.685 -1.019 4.532 722 HE2 LYS 89 2HE LYS 89 -21.655 -2.767 5.960 723 HE3 LYS 89 3HE LYS 89 -20.653 -1.534 6.735 724 HZ1 LYS 89 3HZ LYS 89 -22.558 -1.972 8.100 725 HZ2 LYS 89 1HZ LYS 89 -23.618 -1.709 6.805 726 HZ3 LYS 89 2HZ LYS 89 -22.728 -0.424 7.443 727 H ARG 90 H ARG 90 -16.628 -0.098 4.199 728 HA ARG 90 HA ARG 90 -15.129 0.640 6.647 729 HB2 ARG 90 2HB ARG 90 -15.200 -1.852 6.188 730 HB3 ARG 90 3HB ARG 90 -14.479 -1.556 4.611 731 HG2 ARG 90 2HG ARG 90 -12.422 -0.720 5.685 732 HG3 ARG 90 3HG ARG 90 -13.146 -0.957 7.277 733 HD2 ARG 90 2HD ARG 90 -11.596 -2.796 6.688 734 HD3 ARG 90 3HD ARG 90 -13.252 -3.384 6.894 735 HE ARG 90 HE ARG 90 -12.310 -2.717 4.196 736 HH11 ARG 90 1HH1 ARG 90 -13.174 -5.274 6.472 737 HH12 ARG 90 2HH1 ARG 90 -13.296 -6.475 5.228 738 HH21 ARG 90 1HH2 ARG 90 -12.502 -4.283 2.616 739 HH22 ARG 90 2HH2 ARG 90 -12.914 -5.912 3.042 740 HA PRO 91 HA PRO 91 -13.563 3.770 3.854 741 HB2 PRO 91 2HB PRO 91 -11.067 4.282 5.030 742 HB3 PRO 91 3HB PRO 91 -12.611 4.945 5.601 743 HG2 PRO 91 2HG PRO 91 -11.082 2.593 6.646 744 HG3 PRO 91 3HG PRO 91 -11.962 3.852 7.540 745 HD2 PRO 91 2HD PRO 91 -13.016 1.396 7.164 746 HD3 PRO 91 3HD PRO 91 -14.039 2.851 7.176 747 H VAL 92 H VAL 92 -12.892 3.362 1.841 748 HA VAL 92 HA VAL 92 -11.120 1.231 1.092 749 HB VAL 92 HB VAL 92 -12.101 3.581 -0.610 750 HG11 VAL 92 1HG1 VAL 92 -10.983 0.889 -1.488 751 HG12 VAL 92 2HG1 VAL 92 -10.158 2.444 -1.612 752 HG13 VAL 92 3HG1 VAL 92 -11.615 2.147 -2.558 753 HG21 VAL 92 3HG2 VAL 92 -13.884 2.070 -1.418 754 HG22 VAL 92 1HG2 VAL 92 -14.009 2.343 0.321 755 HG23 VAL 92 2HG2 VAL 92 -13.351 0.823 -0.288 756 H PHE 93 H PHE 93 -10.931 4.772 0.937 757 HA PHE 93 HA PHE 93 -8.010 4.774 0.876 758 HB2 PHE 93 2HB PHE 93 -10.011 7.079 0.870 759 HB3 PHE 93 3HB PHE 93 -8.270 7.253 0.717 760 HD1 PHE 93 HD1 PHE 93 -8.890 4.424 -1.224 761 HD2 PHE 93 HD2 PHE 93 -9.626 8.639 -1.233 762 HE1 PHE 93 HE1 PHE 93 -9.098 4.389 -3.666 763 HE2 PHE 93 HE2 PHE 93 -9.833 8.583 -3.685 764 HZ PHE 93 HZ PHE 93 -9.571 6.465 -4.902 765 H VAL 94 H VAL 94 -7.126 4.365 2.820 766 HA VAL 94 HA VAL 94 -8.247 5.586 5.285 767 HB VAL 94 HB VAL 94 -6.354 3.183 5.114 768 HG11 VAL 94 1HG1 VAL 94 -8.055 4.222 7.408 769 HG12 VAL 94 2HG1 VAL 94 -6.299 4.349 7.269 770 HG13 VAL 94 3HG1 VAL 94 -7.056 2.767 7.442 771 HG21 VAL 94 3HG2 VAL 94 -8.283 1.723 5.550 772 HG22 VAL 94 1HG2 VAL 94 -8.475 2.581 4.020 773 HG23 VAL 94 2HG2 VAL 94 -9.373 3.106 5.446 774 H LYS 95 H LYS 95 -6.687 6.469 6.810 775 HA LYS 95 HA LYS 95 -3.901 6.754 6.039 776 HB2 LYS 95 2HB LYS 95 -3.886 9.208 6.131 777 HB3 LYS 95 3HB LYS 95 -4.935 8.633 4.842 778 HG2 LYS 95 2HG LYS 95 -6.921 9.094 6.190 779 HG3 LYS 95 3HG LYS 95 -5.916 9.592 7.555 780 HD2 LYS 95 2HD LYS 95 -5.978 10.968 4.837 781 HD3 LYS 95 3HD LYS 95 -6.835 11.524 6.275 782 HE2 LYS 95 2HE LYS 95 -4.707 11.888 7.443 783 HE3 LYS 95 3HE LYS 95 -3.815 11.245 6.060 784 HZ1 LYS 95 3HZ LYS 95 -4.559 13.077 4.724 785 HZ2 LYS 95 1HZ LYS 95 -3.849 13.683 6.138 786 HZ3 LYS 95 2HZ LYS 95 -5.532 13.667 5.977 787 H GLY 96 H GLY 96 -2.750 8.188 7.684 788 HA2 GLY 96 2HA GLY 96 -3.056 9.122 10.035 789 HA3 GLY 96 3HA GLY 96 -3.609 7.492 10.435 790 H SER 97 H SER 97 -1.787 7.353 11.938 791 HA SER 97 HA SER 97 0.899 7.076 10.929 792 HB2 SER 97 2HB SER 97 0.222 7.514 13.364 793 HB3 SER 97 3HB SER 97 -0.273 5.824 13.457 794 HG SER 97 HG SER 97 2.239 6.934 13.496 795 H LEU 98 H LEU 98 1.985 4.713 11.293 796 HA LEU 98 HA LEU 98 0.894 2.976 9.345 797 HB2 LEU 98 2HB LEU 98 3.302 2.994 9.924 798 HB3 LEU 98 3HB LEU 98 2.933 2.363 11.521 799 HG LEU 98 HG LEU 98 2.113 0.235 10.484 800 HD11 LEU 98 1HD1 LEU 98 3.067 1.400 7.855 801 HD12 LEU 98 2HD1 LEU 98 1.392 1.076 8.307 802 HD13 LEU 98 3HD1 LEU 98 2.526 -0.259 8.125 803 HD21 LEU 98 3HD2 LEU 98 4.299 -0.668 9.837 804 HD22 LEU 98 1HD2 LEU 98 4.421 0.358 11.266 805 HD23 LEU 98 2HD2 LEU 98 4.947 0.968 9.694 806 H GLU 99 H GLU 99 0.770 2.933 12.871 807 HA GLU 99 HA GLU 99 -0.727 0.529 13.183 808 HB2 GLU 99 2HB GLU 99 -0.353 2.892 15.076 809 HB3 GLU 99 3HB GLU 99 -1.021 1.327 15.537 810 HG2 GLU 99 2HG GLU 99 1.089 0.212 15.104 811 HG3 GLU 99 3HG GLU 99 1.772 1.674 14.396 812 H SER 100 H SER 100 -1.646 3.991 13.205 813 HA SER 100 HA SER 100 -4.351 3.761 13.873 814 HB2 SER 100 2HB SER 100 -3.090 5.856 12.049 815 HB3 SER 100 3HB SER 100 -4.580 6.039 12.965 816 HG SER 100 HG SER 100 -2.773 5.393 14.725 817 H ALA 101 H ALA 101 -2.835 3.924 10.658 818 HA ALA 101 HA ALA 101 -5.204 3.880 9.120 819 HB1 ALA 101 3HB ALA 101 -3.087 4.782 8.286 820 HB2 ALA 101 1HB ALA 101 -3.691 3.523 7.209 821 HB3 ALA 101 2HB ALA 101 -2.361 3.171 8.320 822 H ALA 102 H ALA 102 -3.166 1.379 10.456 823 HA ALA 102 HA ALA 102 -4.114 -0.856 8.990 824 HB1 ALA 102 3HB ALA 102 -3.070 -2.169 10.777 825 HB2 ALA 102 1HB ALA 102 -2.928 -0.717 11.780 826 HB3 ALA 102 2HB ALA 102 -2.020 -0.846 10.275 827 H GLU 103 H GLU 103 -5.009 0.556 12.109 828 HA GLU 103 HA GLU 103 -6.949 -1.313 12.938 829 HB2 GLU 103 2HB GLU 103 -6.759 1.659 13.619 830 HB3 GLU 103 3HB GLU 103 -7.653 0.446 14.538 831 HG2 GLU 103 2HG GLU 103 -5.574 -0.698 15.130 832 HG3 GLU 103 3HG GLU 103 -4.655 0.384 14.107 833 H GLN 104 H GLN 104 -7.273 1.766 11.219 834 HA GLN 104 HA GLN 104 -10.122 1.767 11.031 835 HB2 GLN 104 2HB GLN 104 -8.015 3.305 9.467 836 HB3 GLN 104 3HB GLN 104 -9.741 3.649 9.408 837 HG2 GLN 104 2HG GLN 104 -9.750 4.321 11.739 838 HG3 GLN 104 3HG GLN 104 -8.076 3.797 11.941 839 HE21 GLN 104 1HE2 GLN 104 -6.416 5.050 11.035 840 HE22 GLN 104 2HE2 GLN 104 -6.656 6.684 10.541 841 H ALA 105 H ALA 105 -7.559 0.460 8.985 842 HA ALA 105 HA ALA 105 -9.333 -0.170 6.751 843 HB1 ALA 105 3HB ALA 105 -6.988 0.435 6.322 844 HB2 ALA 105 1HB ALA 105 -7.338 -1.192 5.737 845 HB3 ALA 105 2HB ALA 105 -6.438 -0.967 7.243 846 H GLY 106 H GLY 106 -8.413 -1.625 9.725 847 HA2 GLY 106 2HA GLY 106 -9.386 -3.452 10.760 848 HA3 GLY 106 3HA GLY 106 -10.173 -3.889 9.255 849 H ILE 107 H ILE 107 -6.811 -3.348 9.010 850 HA ILE 107 HA ILE 107 -6.241 -6.172 8.489 851 HB ILE 107 HB ILE 107 -4.173 -3.929 8.400 852 HG12 ILE 107 2HG1 ILE 107 -6.035 -4.560 6.069 853 HG13 ILE 107 3HG1 ILE 107 -6.209 -3.152 7.115 854 HG21 ILE 107 1HG2 ILE 107 -4.492 -6.436 6.707 855 HG22 ILE 107 2HG2 ILE 107 -3.390 -6.253 8.073 856 HG23 ILE 107 3HG2 ILE 107 -3.156 -5.284 6.619 857 HD11 ILE 107 3HD1 ILE 107 -5.084 -2.548 5.081 858 HD12 ILE 107 1HD1 ILE 107 -3.842 -3.771 5.349 859 HD13 ILE 107 2HD1 ILE 107 -3.973 -2.385 6.438 860 H VAL 108 H VAL 108 -4.531 -7.330 9.632 861 HA VAL 108 HA VAL 108 -4.346 -6.848 12.431 862 HB VAL 108 HB VAL 108 -2.595 -8.682 10.725 863 HG11 VAL 108 1HG1 VAL 108 -3.170 -8.776 13.711 864 HG12 VAL 108 2HG1 VAL 108 -1.642 -8.299 12.965 865 HG13 VAL 108 3HG1 VAL 108 -2.221 -9.957 12.805 866 HG21 VAL 108 3HG2 VAL 108 -4.202 -10.479 11.303 867 HG22 VAL 108 1HG2 VAL 108 -4.978 -9.186 10.385 868 HG23 VAL 108 2HG2 VAL 108 -5.225 -9.300 12.128 869 H VAL 109 H VAL 109 -3.386 -5.038 13.123 870 HA VAL 109 HA VAL 109 -1.556 -3.370 11.973 871 HB VAL 109 HB VAL 109 -1.881 -3.909 14.957 872 HG11 VAL 109 1HG1 VAL 109 -0.662 -1.460 13.626 873 HG12 VAL 109 2HG1 VAL 109 0.208 -2.668 14.574 874 HG13 VAL 109 3HG1 VAL 109 -0.987 -1.634 15.354 875 HG21 VAL 109 3HG2 VAL 109 -3.460 -2.039 14.992 876 HG22 VAL 109 1HG2 VAL 109 -3.993 -3.264 13.839 877 HG23 VAL 109 2HG2 VAL 109 -3.229 -1.784 13.262 878 H ASP 110 H ASP 110 -0.830 -6.000 14.266 879 HA ASP 110 HA ASP 110 1.900 -5.559 14.620 880 HB2 ASP 110 2HB ASP 110 0.395 -7.090 16.003 881 HB3 ASP 110 3HB ASP 110 0.524 -8.292 14.725 882 H GLU 111 H GLU 111 0.209 -7.565 12.238 883 HA GLU 111 HA GLU 111 2.531 -8.833 11.189 884 HB2 GLU 111 2HB GLU 111 -0.345 -8.664 10.262 885 HB3 GLU 111 3HB GLU 111 0.874 -9.485 9.297 886 HG2 GLU 111 2HG GLU 111 0.172 -10.205 12.158 887 HG3 GLU 111 3HG GLU 111 -0.451 -11.018 10.725 888 H LEU 112 H LEU 112 0.601 -5.998 10.038 889 HA LEU 112 HA LEU 112 2.354 -5.666 7.746 890 HB2 LEU 112 2HB LEU 112 1.164 -3.536 7.307 891 HB3 LEU 112 3HB LEU 112 0.127 -4.941 7.419 892 HG LEU 112 HG LEU 112 -0.366 -4.159 9.857 893 HD11 LEU 112 1HD1 LEU 112 1.353 -2.451 10.111 894 HD12 LEU 112 2HD1 LEU 112 -0.249 -1.737 10.263 895 HD13 LEU 112 3HD1 LEU 112 0.674 -1.525 8.771 896 HD21 LEU 112 3HD2 LEU 112 -2.215 -2.841 9.136 897 HD22 LEU 112 1HD2 LEU 112 -1.954 -4.114 7.956 898 HD23 LEU 112 2HD2 LEU 112 -1.439 -2.465 7.596 899 H VAL 113 H VAL 113 2.382 -4.537 11.027 900 HA VAL 113 HA VAL 113 4.359 -2.504 10.719 901 HB VAL 113 HB VAL 113 3.497 -4.145 13.145 902 HG11 VAL 113 1HG1 VAL 113 4.915 -2.700 14.582 903 HG12 VAL 113 2HG1 VAL 113 5.630 -1.970 13.143 904 HG13 VAL 113 3HG1 VAL 113 5.893 -3.681 13.487 905 HG21 VAL 113 3HG2 VAL 113 2.601 -1.985 13.950 906 HG22 VAL 113 1HG2 VAL 113 1.934 -2.393 12.369 907 HG23 VAL 113 2HG2 VAL 113 3.209 -1.182 12.500 908 H GLN 114 H GLN 114 4.475 -6.014 11.274 909 HA GLN 114 HA GLN 114 7.295 -6.313 11.405 910 HB2 GLN 114 2HB GLN 114 5.180 -8.250 10.365 911 HB3 GLN 114 3HB GLN 114 6.867 -8.679 10.633 912 HG2 GLN 114 2HG GLN 114 4.847 -7.895 12.746 913 HG3 GLN 114 3HG GLN 114 5.535 -9.493 12.476 914 HE21 GLN 114 1HE2 GLN 114 6.081 -6.316 13.768 915 HE22 GLN 114 2HE2 GLN 114 7.545 -6.680 14.608 916 H THR 115 H THR 115 5.000 -6.626 8.739 917 HA THR 115 HA THR 115 6.665 -7.117 6.619 918 HB THR 115 HB THR 115 3.914 -5.995 6.974 919 HG1 THR 115 HG1 THR 115 3.558 -8.020 6.624 920 HG21 THR 115 3HG2 THR 115 3.534 -5.801 4.543 921 HG22 THR 115 1HG2 THR 115 5.267 -5.973 4.265 922 HG23 THR 115 2HG2 THR 115 4.649 -4.574 5.145 923 H VAL 116 H VAL 116 5.779 -3.912 7.952 924 HA VAL 116 HA VAL 116 7.179 -2.498 5.835 925 HB VAL 116 HB VAL 116 5.665 -1.499 8.289 926 HG11 VAL 116 1HG1 VAL 116 5.917 0.810 7.433 927 HG12 VAL 116 2HG1 VAL 116 6.994 0.233 6.159 928 HG13 VAL 116 3HG1 VAL 116 7.487 0.116 7.849 929 HG21 VAL 116 3HG2 VAL 116 5.035 -1.302 5.313 930 HG22 VAL 116 1HG2 VAL 116 4.037 -0.663 6.623 931 HG23 VAL 116 2HG2 VAL 116 4.270 -2.404 6.459 932 H LYS 117 H LYS 117 7.853 -3.300 9.284 933 HA LYS 117 HA LYS 117 10.174 -1.573 9.394 934 HB2 LYS 117 2HB LYS 117 10.612 -2.412 11.590 935 HB3 LYS 117 3HB LYS 117 8.868 -2.254 11.454 936 HG2 LYS 117 2HG LYS 117 8.665 -4.692 11.113 937 HG3 LYS 117 3HG LYS 117 10.416 -4.864 11.233 938 HD2 LYS 117 2HD LYS 117 8.600 -3.830 13.454 939 HD3 LYS 117 3HD LYS 117 9.244 -5.468 13.350 940 HE2 LYS 117 2HE LYS 117 11.538 -4.609 13.567 941 HE3 LYS 117 3HE LYS 117 10.935 -2.950 13.593 942 HZ1 LYS 117 3HZ LYS 117 9.739 -3.471 15.638 943 HZ2 LYS 117 1HZ LYS 117 11.398 -3.726 15.821 944 HZ3 LYS 117 2HZ LYS 117 10.360 -5.043 15.624 945 H ASN 118 H ASN 118 9.583 -4.911 8.564 946 HA ASN 118 HA ASN 118 12.365 -5.692 8.413 947 HB2 ASN 118 2HB ASN 118 9.865 -7.127 7.385 948 HB3 ASN 118 3HB ASN 118 11.491 -7.814 7.403 949 HD21 ASN 118 1HD2 ASN 118 9.071 -8.785 8.771 950 HD22 ASN 118 2HD2 ASN 118 9.433 -8.811 10.460 951 H TYR 119 H TYR 119 9.809 -4.632 6.174 952 HA TYR 119 HA TYR 119 11.217 -4.790 3.750 953 HB2 TYR 119 2HB TYR 119 8.854 -4.249 3.702 954 HB3 TYR 119 3HB TYR 119 9.098 -2.816 4.688 955 HD1 TYR 119 HD1 TYR 119 10.245 -4.197 1.353 956 HD2 TYR 119 HD2 TYR 119 9.030 -0.745 3.570 957 HE1 TYR 119 HE1 TYR 119 10.381 -2.831 -0.690 958 HE2 TYR 119 HE2 TYR 119 9.171 0.613 1.530 959 HH TYR 119 HH TYR 119 10.062 0.648 -0.627 960 H GLN 120 H GLN 120 10.811 -1.938 5.842 961 HA GLN 120 HA GLN 120 12.666 -0.246 4.656 962 HB2 GLN 120 2HB GLN 120 11.600 -0.331 7.512 963 HB3 GLN 120 3HB GLN 120 12.595 0.984 6.898 964 HG2 GLN 120 2HG GLN 120 10.856 1.450 5.166 965 HG3 GLN 120 3HG GLN 120 9.846 0.190 5.869 966 HE21 GLN 120 1HE2 GLN 120 9.491 3.161 5.563 967 HE22 GLN 120 2HE2 GLN 120 9.075 3.723 7.135 968 H GLY 121 H GLY 121 13.104 -2.813 6.988 969 HA2 GLY 121 2HA GLY 121 15.708 -2.132 7.935 970 HA3 GLY 121 3HA GLY 121 14.928 -3.713 8.033 971 H TYR 122 H TYR 122 14.510 -4.359 5.388 972 HA TYR 122 HA TYR 122 17.212 -5.060 4.636 973 HB2 TYR 122 2HB TYR 122 16.282 -6.633 3.070 974 HB3 TYR 122 3HB TYR 122 15.562 -6.828 4.643 975 HD1 TYR 122 HD2 TYR 122 14.579 -4.689 1.654 976 HD2 TYR 122 HD1 TYR 122 13.492 -7.820 4.349 977 HE1 TYR 122 HE2 TYR 122 12.414 -4.919 0.526 978 HE2 TYR 122 HE1 TYR 122 11.332 -8.063 3.206 979 HH TYR 122 HH TYR 122 9.842 -6.788 1.795 980 H VAL 123 H VAL 123 15.023 -2.582 3.722 981 HA VAL 123 HA VAL 123 15.983 -1.910 1.143 982 HB VAL 123 HB VAL 123 14.953 -0.101 3.390 983 HG11 VAL 123 1HG1 VAL 123 15.542 0.685 0.506 984 HG12 VAL 123 2HG1 VAL 123 16.382 1.268 1.948 985 HG13 VAL 123 3HG1 VAL 123 14.692 1.694 1.684 986 HG21 VAL 123 3HG2 VAL 123 13.542 -0.943 0.834 987 HG22 VAL 123 1HG2 VAL 123 12.865 0.022 2.143 988 HG23 VAL 123 2HG2 VAL 123 13.273 -1.670 2.411 989 H GLN 124 H GLN 124 16.985 -0.749 4.378 990 HA GLN 124 HA GLN 124 19.205 0.771 3.401 991 HB2 GLN 124 2HB GLN 124 19.746 1.100 5.839 992 HB3 GLN 124 3HB GLN 124 18.111 1.559 5.380 993 HG2 GLN 124 2HG GLN 124 17.197 -0.444 6.358 994 HG3 GLN 124 3HG GLN 124 18.813 -1.086 6.667 995 HE21 GLN 124 1HE2 GLN 124 18.363 -1.326 8.865 996 HE22 GLN 124 2HE2 GLN 124 18.283 0.019 9.949 997 H ASP 125 H ASP 125 18.888 -2.555 4.498 998 HA ASP 125 HA ASP 125 21.729 -3.079 4.630 999 HB2 ASP 125 2HB ASP 125 19.297 -4.882 4.343 1000 HB3 ASP 125 3HB ASP 125 20.929 -5.540 4.277 1001 H GLY 126 H GLY 126 19.368 -2.844 2.094 1002 HA2 GLY 126 2HA GLY 126 19.574 -2.787 -0.179 1003 HA3 GLY 126 3HA GLY 126 21.315 -2.929 -0.001 1004 H HIS 127 H HIS 127 18.728 -5.147 1.047 1005 HA HIS 127 HA HIS 127 19.052 -7.028 -1.085 1006 HB2 HIS 127 2HB HIS 127 21.158 -7.578 0.071 1007 HB3 HIS 127 3HB HIS 127 20.324 -7.739 1.610 1008 HD1 HIS 127 HD1 HIS 127 20.900 -9.521 -1.642 1009 HD2 HIS 127 HD2 HIS 127 18.974 -10.222 1.985 1010 HE1 HIS 127 HE1 HIS 127 20.421 -11.977 -1.592 1011 HE2 HIS 127 HE2 HIS 127 19.117 -12.340 0.524 1012 H ASP 128 H ASP 128 17.023 -7.869 -1.280 1013 HA ASP 128 HA ASP 128 15.058 -7.581 0.802 1014 HB2 ASP 128 2HB ASP 128 13.449 -8.413 -0.763 1015 HB3 ASP 128 3HB ASP 128 14.571 -7.438 -1.702 1016 H HIS 129 H HIS 129 13.572 -9.511 1.366 1017 HA HIS 129 HA HIS 129 15.182 -11.929 2.020 1018 HB2 HIS 129 2HB HIS 129 13.603 -10.128 3.854 1019 HB3 HIS 129 3HB HIS 129 13.693 -11.838 4.247 1020 HD1 HIS 129 HD1 HIS 129 15.599 -12.453 5.686 1021 HD2 HIS 129 HD2 HIS 129 16.325 -8.916 3.631 1022 HE1 HIS 129 HE1 HIS 129 17.763 -11.578 6.594 1023 HE2 HIS 129 HE2 HIS 129 18.079 -9.350 5.477 1024 H ASP 130 H ASP 130 12.624 -10.950 0.251 1025 HA ASP 130 HA ASP 130 11.396 -13.502 0.072 1026 HB2 ASP 130 2HB ASP 130 9.103 -12.910 0.872 1027 HB3 ASP 130 3HB ASP 130 10.291 -12.929 2.166 1028 H PHE 131 H PHE 131 11.817 -13.240 -2.091 1029 HA PHE 131 HA PHE 131 11.593 -12.650 -4.248 1030 HB2 PHE 131 2HB PHE 131 9.223 -12.666 -5.099 1031 HB3 PHE 131 3HB PHE 131 9.633 -14.016 -4.062 1032 HD1 PHE 131 HD2 PHE 131 7.741 -10.803 -4.216 1033 HD2 PHE 131 HD1 PHE 131 8.361 -14.456 -2.067 1034 HE1 PHE 131 HE2 PHE 131 5.745 -10.348 -2.856 1035 HE2 PHE 131 HE1 PHE 131 6.360 -13.993 -0.716 1036 HZ PHE 131 HZ PHE 131 5.056 -11.940 -1.106 1037 H GLY 132 H GLY 132 12.043 -10.270 -2.558 1038 HA2 GLY 132 2HA GLY 132 10.375 -8.117 -3.388 1039 HA3 GLY 132 3HA GLY 132 11.886 -7.994 -2.503 1040 H ARG 133 H ARG 133 13.499 -6.958 -3.586 1041 HA ARG 133 HA ARG 133 14.099 -7.266 -6.328 1042 HB2 ARG 133 2HB ARG 133 13.389 -5.008 -7.174 1043 HB3 ARG 133 3HB ARG 133 12.055 -6.087 -6.807 1044 HG2 ARG 133 2HG ARG 133 11.925 -4.816 -4.526 1045 HG3 ARG 133 3HG ARG 133 12.921 -3.597 -5.327 1046 HD2 ARG 133 2HD ARG 133 11.143 -3.594 -7.197 1047 HD3 ARG 133 3HD ARG 133 10.129 -4.519 -6.085 1048 HE ARG 133 HE ARG 133 11.013 -2.199 -4.754 1049 HH11 ARG 133 1HH1 ARG 133 8.870 -3.060 -7.405 1050 HH12 ARG 133 2HH1 ARG 133 7.858 -1.666 -7.222 1051 HH21 ARG 133 1HH2 ARG 133 9.730 -0.295 -4.594 1052 HH22 ARG 133 2HH2 ARG 133 8.348 -0.099 -5.630 1053 H ASP 134 H ASP 134 15.412 -5.117 -7.055 1054 HA ASP 134 HA ASP 134 17.742 -5.197 -5.474 1055 HB2 ASP 134 2HB ASP 134 17.630 -4.847 -7.984 1056 HB3 ASP 134 3HB ASP 134 17.085 -3.201 -7.695 1057 HA PRO 135 HA PRO 135 17.453 -1.892 -2.308 1058 HB2 PRO 135 2HB PRO 135 19.999 -0.808 -3.256 1059 HB3 PRO 135 3HB PRO 135 19.675 -1.741 -1.794 1060 HG2 PRO 135 2HG PRO 135 20.605 -2.678 -4.462 1061 HG3 PRO 135 3HG PRO 135 20.915 -3.369 -2.847 1062 HD2 PRO 135 2HD PRO 135 19.259 -4.614 -4.490 1063 HD3 PRO 135 3HD PRO 135 18.802 -4.445 -2.772 1064 H LYS 136 H LYS 136 18.281 -0.986 -5.692 1065 HA LYS 136 HA LYS 136 17.840 1.826 -5.318 1066 HB2 LYS 136 2HB LYS 136 18.138 2.064 -7.690 1067 HB3 LYS 136 3HB LYS 136 19.256 0.814 -7.147 1068 HG2 LYS 136 2HG LYS 136 17.670 -0.923 -7.978 1069 HG3 LYS 136 3HG LYS 136 16.609 0.362 -8.563 1070 HD2 LYS 136 2HD LYS 136 17.897 -0.464 -10.431 1071 HD3 LYS 136 3HD LYS 136 18.478 1.159 -10.049 1072 HE2 LYS 136 2HE LYS 136 20.370 0.104 -8.767 1073 HE3 LYS 136 3HE LYS 136 19.794 -1.476 -9.317 1074 HZ1 LYS 136 3HZ LYS 136 20.181 -0.803 -11.588 1075 HZ2 LYS 136 1HZ LYS 136 21.602 -0.615 -10.690 1076 HZ3 LYS 136 2HZ LYS 136 20.670 0.738 -11.098 1077 H TYR 137 H TYR 137 15.731 -0.837 -5.987 1078 HA TYR 137 HA TYR 137 13.416 0.888 -6.582 1079 HB2 TYR 137 2HB TYR 137 13.565 -2.157 -6.490 1080 HB3 TYR 137 3HB TYR 137 12.249 -1.190 -7.138 1081 HD1 TYR 137 HD2 TYR 137 13.081 0.542 -9.069 1082 HD2 TYR 137 HD1 TYR 137 15.008 -3.135 -8.073 1083 HE1 TYR 137 HE2 TYR 137 14.111 0.486 -11.290 1084 HE2 TYR 137 HE1 TYR 137 16.052 -3.191 -10.303 1085 HH TYR 137 HH TYR 137 15.597 -2.251 -12.588 1086 H LEU 138 H LEU 138 14.856 -0.995 -4.029 1087 HA LEU 138 HA LEU 138 12.590 -1.040 -2.230 1088 HB2 LEU 138 2HB LEU 138 15.571 -1.373 -1.670 1089 HB3 LEU 138 3HB LEU 138 14.295 -1.702 -0.522 1090 HG LEU 138 HG LEU 138 14.778 -3.265 -3.081 1091 HD11 LEU 138 1HD1 LEU 138 15.420 -3.996 -0.198 1092 HD12 LEU 138 2HD1 LEU 138 16.582 -3.623 -1.479 1093 HD13 LEU 138 3HD1 LEU 138 15.578 -5.069 -1.595 1094 HD21 LEU 138 3HD2 LEU 138 12.796 -3.775 -0.836 1095 HD22 LEU 138 1HD2 LEU 138 13.132 -4.873 -2.180 1096 HD23 LEU 138 2HD2 LEU 138 12.415 -3.295 -2.491 1097 H HIS 139 H HIS 139 11.863 0.791 -1.161 1098 HA HIS 139 HA HIS 139 13.802 2.746 -0.128 1099 HB2 HIS 139 2HB HIS 139 13.095 3.593 -2.380 1100 HB3 HIS 139 3HB HIS 139 11.420 3.598 -1.843 1101 HD1 HIS 139 HD1 HIS 139 10.678 5.871 -1.174 1102 HD2 HIS 139 HD2 HIS 139 14.743 5.343 -0.484 1103 HE1 HIS 139 HE1 HIS 139 11.499 8.064 -0.286 1104 HE2 HIS 139 HE2 HIS 139 13.909 7.652 0.300 1105 H GLN 140 H GLN 140 13.254 3.401 1.888 1106 HA GLN 140 HA GLN 140 11.035 2.320 3.277 1107 HB2 GLN 140 2HB GLN 140 12.754 4.701 4.101 1108 HB3 GLN 140 3HB GLN 140 11.700 3.778 5.154 1109 HG2 GLN 140 2HG GLN 140 13.573 2.639 5.716 1110 HG3 GLN 140 3HG GLN 140 13.324 1.780 4.212 1111 HE21 GLN 140 1HE2 GLN 140 15.768 2.181 5.641 1112 HE22 GLN 140 2HE2 GLN 140 16.850 3.004 4.576 1113 H PHE 141 H PHE 141 9.015 3.178 3.804 1114 HA PHE 141 HA PHE 141 7.940 5.356 2.306 1115 HB2 PHE 141 2HB PHE 141 6.722 4.124 4.815 1116 HB3 PHE 141 3HB PHE 141 5.878 5.019 3.558 1117 HD1 PHE 141 HD1 PHE 141 5.963 3.947 1.138 1118 HD2 PHE 141 HD2 PHE 141 6.695 1.780 4.754 1119 HE1 PHE 141 HE1 PHE 141 5.405 1.839 0.004 1120 HE2 PHE 141 HE2 PHE 141 6.138 -0.311 3.617 1121 HZ PHE 141 HZ PHE 141 5.494 -0.293 1.233 1122 H GLU 142 H GLU 142 9.189 7.163 2.736 1123 HA GLU 142 HA GLU 142 9.265 8.215 5.500 1124 HB2 GLU 142 2HB GLU 142 11.195 9.609 4.690 1125 HB3 GLU 142 3HB GLU 142 11.505 7.876 4.641 1126 HG2 GLU 142 2HG GLU 142 11.147 7.830 2.231 1127 HG3 GLU 142 3HG GLU 142 10.690 9.530 2.234 1128 H GLY 143 H GLY 143 8.372 10.117 5.924 1129 HA2 GLY 143 2HA GLY 143 7.994 12.373 4.450 1130 HA3 GLY 143 3HA GLY 143 6.602 11.375 4.022 1131 H GLU 144 H GLU 144 4.904 11.182 5.484 1132 HA GLU 144 HA GLU 144 5.120 12.492 8.113 1133 HB2 GLU 144 2HB GLU 144 3.368 13.549 5.849 1134 HB3 GLU 144 3HB GLU 144 3.071 13.953 7.537 1135 HG2 GLU 144 2HG GLU 144 5.259 15.043 7.695 1136 HG3 GLU 144 3HG GLU 144 5.640 14.554 6.050 1137 H THR 145 H THR 145 3.112 10.627 5.834 1138 HA THR 145 HA THR 145 1.429 9.632 8.030 1139 HB THR 145 HB THR 145 0.285 11.227 5.674 1140 HG1 THR 145 HG1 THR 145 0.812 11.796 8.356 1141 HG21 THR 145 3HG2 THR 145 -1.934 10.885 6.706 1142 HG22 THR 145 1HG2 THR 145 -1.221 9.821 7.921 1143 HG23 THR 145 2HG2 THR 145 -1.229 9.342 6.221 1144 H PHE 146 H PHE 146 0.818 7.550 7.668 1145 HA PHE 146 HA PHE 146 1.448 6.234 5.141 1146 HB2 PHE 146 2HB PHE 146 0.673 5.288 7.918 1147 HB3 PHE 146 3HB PHE 146 0.432 4.193 6.566 1148 HD1 PHE 146 HD2 PHE 146 3.015 5.975 8.575 1149 HD2 PHE 146 HD1 PHE 146 2.293 3.130 5.455 1150 HE1 PHE 146 HE2 PHE 146 5.366 5.233 8.687 1151 HE2 PHE 146 HE1 PHE 146 4.630 2.402 5.582 1152 HZ PHE 146 HZ PHE 146 6.173 3.442 7.181 1153 H TYR 147 H TYR 147 0.003 5.660 3.636 1154 HA TYR 147 HA TYR 147 -2.905 5.828 4.193 1155 HB2 TYR 147 2HB TYR 147 -1.324 6.501 1.683 1156 HB3 TYR 147 3HB TYR 147 -3.030 6.081 1.579 1157 HD1 TYR 147 HD1 TYR 147 -0.736 8.452 3.397 1158 HD2 TYR 147 HD2 TYR 147 -4.616 7.806 1.733 1159 HE1 TYR 147 HE1 TYR 147 -1.329 10.789 3.855 1160 HE2 TYR 147 HE2 TYR 147 -5.196 10.145 2.192 1161 HH TYR 147 HH TYR 147 -2.907 12.492 3.001 1162 H ILE 148 H ILE 148 -4.127 4.097 3.732 1163 HA ILE 148 HA ILE 148 -2.928 1.764 2.355 1164 HB ILE 148 HB ILE 148 -4.782 1.721 4.788 1165 HG12 ILE 148 2HG1 ILE 148 -1.871 0.826 4.475 1166 HG13 ILE 148 3HG1 ILE 148 -2.434 2.206 5.407 1167 HG21 ILE 148 1HG2 ILE 148 -5.357 -0.076 3.194 1168 HG22 ILE 148 2HG2 ILE 148 -4.651 -0.729 4.669 1169 HG23 ILE 148 3HG2 ILE 148 -3.678 -0.625 3.202 1170 HD11 ILE 148 3HD1 ILE 148 -2.941 -0.705 6.026 1171 HD12 ILE 148 1HD1 ILE 148 -3.601 0.658 6.936 1172 HD13 ILE 148 2HD1 ILE 148 -1.860 0.400 6.874 1173 H ILE 149 H ILE 149 -3.902 1.706 0.432 1174 HA ILE 149 HA ILE 149 -6.718 2.521 0.093 1175 HB ILE 149 HB ILE 149 -4.666 1.881 -2.082 1176 HG12 ILE 149 2HG1 ILE 149 -3.777 3.768 -0.808 1177 HG13 ILE 149 3HG1 ILE 149 -4.371 4.356 -2.351 1178 HG21 ILE 149 1HG2 ILE 149 -6.990 1.757 -2.858 1179 HG22 ILE 149 2HG2 ILE 149 -6.180 3.151 -3.569 1180 HG23 ILE 149 3HG2 ILE 149 -7.312 3.379 -2.235 1181 HD11 ILE 149 3HD1 ILE 149 -6.396 5.206 -1.225 1182 HD12 ILE 149 1HD1 ILE 149 -4.907 5.900 -0.583 1183 HD13 ILE 149 2HD1 ILE 149 -5.749 4.643 0.320 1184 H GLU 150 H GLU 150 -8.282 1.030 -0.487 1185 HA GLU 150 HA GLU 150 -7.536 -1.813 -0.305 1186 HB2 GLU 150 2HB GLU 150 -9.220 -0.893 1.269 1187 HB3 GLU 150 3HB GLU 150 -10.252 -0.433 -0.077 1188 HG2 GLU 150 2HG GLU 150 -10.697 -2.732 -0.624 1189 HG3 GLU 150 3HG GLU 150 -9.471 -3.305 0.501 1190 H GLN 151 H GLN 151 -7.038 -2.666 -2.259 1191 HA GLN 151 HA GLN 151 -8.663 -2.109 -4.667 1192 HB2 GLN 151 2HB GLN 151 -6.031 -3.650 -4.387 1193 HB3 GLN 151 3HB GLN 151 -6.907 -3.441 -5.895 1194 HG2 GLN 151 2HG GLN 151 -5.087 -1.921 -5.924 1195 HG3 GLN 151 3HG GLN 151 -6.536 -0.957 -5.676 1196 HE21 GLN 151 1HE2 GLN 151 -4.926 -2.824 -3.153 1197 HE22 GLN 151 2HE2 GLN 151 -4.389 -1.459 -2.253 1198 H ARG 152 H ARG 152 -10.476 -3.391 -4.591 1199 HA ARG 152 HA ARG 152 -10.316 -6.239 -3.887 1200 HB2 ARG 152 2HB ARG 152 -12.680 -4.729 -5.114 1201 HB3 ARG 152 3HB ARG 152 -12.715 -6.332 -4.399 1202 HG2 ARG 152 2HG ARG 152 -13.691 -5.029 -2.741 1203 HG3 ARG 152 3HG ARG 152 -12.019 -5.122 -2.189 1204 HD2 ARG 152 2HD ARG 152 -11.564 -2.881 -3.043 1205 HD3 ARG 152 3HD ARG 152 -13.176 -2.791 -3.770 1206 HE ARG 152 HE ARG 152 -12.727 -3.003 -0.861 1207 HH11 ARG 152 1HH1 ARG 152 -14.382 -1.424 -3.537 1208 HH12 ARG 152 2HH1 ARG 152 -15.353 -0.434 -2.500 1209 HH21 ARG 152 1HH2 ARG 152 -13.982 -1.724 0.480 1210 HH22 ARG 152 2HH2 ARG 152 -15.124 -0.606 -0.202 1211 H LEU 153 H LEU 153 -11.104 -7.894 -5.550 1212 HA LEU 153 HA LEU 153 -10.110 -7.487 -8.215 1213 HB2 LEU 153 2HB LEU 153 -11.816 -9.666 -6.980 1214 HB3 LEU 153 3HB LEU 153 -11.487 -9.648 -8.705 1215 HG LEU 153 HG LEU 153 -9.406 -9.900 -6.495 1216 HD11 LEU 153 1HD1 LEU 153 -9.054 -12.165 -7.343 1217 HD12 LEU 153 2HD1 LEU 153 -10.332 -11.943 -8.542 1218 HD13 LEU 153 3HD1 LEU 153 -10.722 -11.945 -6.819 1219 HD21 LEU 153 3HD2 LEU 153 -7.755 -10.232 -8.292 1220 HD22 LEU 153 1HD2 LEU 153 -8.476 -8.626 -8.369 1221 HD23 LEU 153 2HD2 LEU 153 -8.986 -9.876 -9.507 1222 H GLU 154 H GLU 154 -11.648 -8.010 -10.123 1223 HA GLU 154 HA GLU 154 -13.298 -5.743 -10.443 1224 HB2 GLU 154 2HB GLU 154 -13.004 -8.210 -12.200 1225 HB3 GLU 154 3HB GLU 154 -13.842 -6.735 -12.684 1226 HG2 GLU 154 2HG GLU 154 -11.710 -5.463 -12.411 1227 HG3 GLU 154 3HG GLU 154 -10.886 -6.966 -12.000 1228 H HIS 155 H HIS 155 -15.318 -5.414 -10.038 1229 HA HIS 155 HA HIS 155 -17.502 -5.550 -9.587 1230 HB2 HIS 155 2HB HIS 155 -17.299 -8.378 -10.685 1231 HB3 HIS 155 3HB HIS 155 -18.815 -7.636 -10.193 1232 HD1 HIS 155 HD1 HIS 155 -19.999 -7.329 -12.369 1233 HD2 HIS 155 HD2 HIS 155 -16.089 -5.941 -12.552 1234 HE1 HIS 155 HE1 HIS 155 -19.751 -6.298 -14.642 1235 HE2 HIS 155 HE2 HIS 155 -17.328 -5.678 -14.799 1236 H HIS 156 H HIS 156 -15.214 -6.886 -7.753 1237 HA HIS 156 HA HIS 156 -16.952 -8.151 -5.768 1238 HB2 HIS 156 2HB HIS 156 -14.666 -9.051 -6.043 1239 HB3 HIS 156 3HB HIS 156 -13.973 -7.485 -5.634 1240 HD1 HIS 156 HD1 HIS 156 -12.864 -7.892 -3.420 1241 HD2 HIS 156 HD2 HIS 156 -16.671 -9.547 -3.526 1242 HE1 HIS 156 HE1 HIS 156 -13.319 -8.679 -1.086 1243 HE2 HIS 156 HE2 HIS 156 -15.541 -9.834 -1.226 1244 H HIS 157 H HIS 157 -18.241 -6.137 -5.949 1245 HA HIS 157 HA HIS 157 -17.310 -3.861 -4.322 1246 HB2 HIS 157 2HB HIS 157 -18.254 -3.504 -6.660 1247 HB3 HIS 157 3HB HIS 157 -19.796 -4.114 -6.080 1248 HD1 HIS 157 HD1 HIS 157 -17.901 -1.048 -6.494 1249 HD2 HIS 157 HD2 HIS 157 -20.979 -2.326 -4.024 1250 HE1 HIS 157 HE1 HIS 157 -18.961 1.042 -5.598 1251 HE2 HIS 157 HE2 HIS 157 -20.903 0.227 -4.240 1252 H HIS 158 H HIS 158 -17.457 -5.597 -2.609 1253 HA HIS 158 HA HIS 158 -20.027 -6.501 -1.695 1254 HB2 HIS 158 2HB HIS 158 -18.805 -7.640 0.065 1255 HB3 HIS 158 3HB HIS 158 -17.884 -7.811 -1.425 1256 HD1 HIS 158 HD1 HIS 158 -17.464 -6.985 2.038 1257 HD2 HIS 158 HD2 HIS 158 -15.646 -5.747 -1.491 1258 HE1 HIS 158 HE1 HIS 158 -15.333 -5.861 2.734 1259 HE2 HIS 158 HE2 HIS 158 -14.250 -5.136 0.588 1260 H HIS 159 H HIS 159 -21.285 -5.655 -0.089 1261 HA HIS 159 HA HIS 159 -20.368 -3.908 1.968 1262 HB2 HIS 159 2HB HIS 159 -21.536 -1.846 1.411 1263 HB3 HIS 159 3HB HIS 159 -20.526 -2.259 0.028 1264 HD1 HIS 159 HD1 HIS 159 -24.032 -1.651 1.043 1265 HD2 HIS 159 HD2 HIS 159 -22.030 -3.196 -2.261 1266 HE1 HIS 159 HE1 HIS 159 -25.712 -1.666 -0.819 1267 HE2 HIS 159 HE2 HIS 159 -24.522 -2.741 -2.758 1268 H HIS 160 H HIS 160 -22.129 -3.305 3.440 1269 HA HIS 160 HA HIS 160 -24.665 -4.796 3.036 1270 HB2 HIS 160 2HB HIS 160 -23.220 -5.771 4.881 1271 HB3 HIS 160 3HB HIS 160 -23.324 -4.230 5.725 1272 HD1 HIS 160 HD1 HIS 160 -25.537 -7.094 4.591 1273 HD2 HIS 160 HD2 HIS 160 -25.601 -3.938 7.292 1274 HE1 HIS 160 HE1 HIS 160 -27.618 -7.412 5.958 1275 HE2 HIS 160 HE2 HIS 160 -27.689 -5.432 7.498 Start of MODEL 5 1 H1 MET 1 1H MET 1 -23.535 7.943 5.587 2 H2 MET 1 2H MET 1 -24.564 9.038 4.817 3 H3 MET 1 3H MET 1 -23.017 9.525 5.284 4 HA MET 1 HA MET 1 -22.013 8.046 3.724 5 HB2 MET 1 2HB MET 1 -23.404 6.733 2.144 6 HB3 MET 1 3HB MET 1 -23.735 6.261 3.801 7 HG2 MET 1 2HG MET 1 -25.813 7.595 3.774 8 HG3 MET 1 3HG MET 1 -25.487 8.069 2.108 9 HE1 MET 1 3HE MET 1 -25.623 6.391 0.030 10 HE2 MET 1 1HE MET 1 -25.947 4.665 0.184 11 HE3 MET 1 2HE MET 1 -24.421 5.330 0.765 12 H VAL 2 H VAL 2 -21.439 8.928 1.763 13 HA VAL 2 HA VAL 2 -23.215 10.950 0.501 14 HB VAL 2 HB VAL 2 -20.145 10.972 0.414 15 HG11 VAL 2 1HG1 VAL 2 -21.175 11.950 -1.580 16 HG12 VAL 2 2HG1 VAL 2 -20.409 13.211 -0.615 17 HG13 VAL 2 3HG1 VAL 2 -22.162 13.018 -0.580 18 HG21 VAL 2 3HG2 VAL 2 -21.955 12.790 2.057 19 HG22 VAL 2 1HG2 VAL 2 -20.205 12.964 1.879 20 HG23 VAL 2 2HG2 VAL 2 -20.874 11.551 2.694 21 H GLU 3 H GLU 3 -24.151 9.457 -0.815 22 HA GLU 3 HA GLU 3 -24.575 8.050 -2.510 23 HB2 GLU 3 2HB GLU 3 -21.807 8.933 -3.403 24 HB3 GLU 3 3HB GLU 3 -22.714 7.727 -4.307 25 HG2 GLU 3 2HG GLU 3 -22.993 9.887 -5.349 26 HG3 GLU 3 3HG GLU 3 -24.526 9.350 -4.670 27 HA PRO 4 HA PRO 4 -22.951 3.846 -1.552 28 HB2 PRO 4 2HB PRO 4 -23.018 3.444 -4.558 29 HB3 PRO 4 3HB PRO 4 -23.655 2.408 -3.259 30 HG2 PRO 4 2HG PRO 4 -25.318 3.878 -4.696 31 HG3 PRO 4 3HG PRO 4 -25.554 3.718 -2.939 32 HD2 PRO 4 2HD PRO 4 -24.419 6.042 -4.487 33 HD3 PRO 4 3HD PRO 4 -25.488 6.046 -3.066 34 H GLY 5 H GLY 5 -21.038 2.466 -2.120 35 HA2 GLY 5 2HA GLY 5 -18.665 4.068 -2.400 36 HA3 GLY 5 3HA GLY 5 -18.734 2.334 -2.161 37 H VAL 6 H VAL 6 -19.275 4.825 -4.635 38 HA VAL 6 HA VAL 6 -18.447 2.937 -6.758 39 HB VAL 6 HB VAL 6 -19.795 4.431 -8.329 40 HG11 VAL 6 1HG1 VAL 6 -21.982 3.435 -7.750 41 HG12 VAL 6 2HG1 VAL 6 -21.384 3.018 -6.144 42 HG13 VAL 6 3HG1 VAL 6 -20.682 2.255 -7.573 43 HG21 VAL 6 3HG2 VAL 6 -21.567 5.885 -7.372 44 HG22 VAL 6 1HG2 VAL 6 -19.963 6.464 -6.913 45 HG23 VAL 6 2HG2 VAL 6 -20.951 5.583 -5.746 46 H ALA 7 H ALA 7 -16.273 3.619 -5.901 47 HA ALA 7 HA ALA 7 -15.250 6.235 -6.542 48 HB1 ALA 7 3HB ALA 7 -14.258 4.876 -4.742 49 HB2 ALA 7 1HB ALA 7 -13.057 5.284 -5.967 50 HB3 ALA 7 2HB ALA 7 -13.751 3.661 -5.917 51 H LYS 8 H LYS 8 -14.005 6.848 -8.279 52 HA LYS 8 HA LYS 8 -14.158 5.330 -10.763 53 HB2 LYS 8 2HB LYS 8 -12.944 8.080 -10.207 54 HB3 LYS 8 3HB LYS 8 -13.240 7.392 -11.799 55 HG2 LYS 8 2HG LYS 8 -15.422 8.006 -9.787 56 HG3 LYS 8 3HG LYS 8 -14.931 9.105 -11.077 57 HD2 LYS 8 2HD LYS 8 -15.615 7.447 -12.771 58 HD3 LYS 8 3HD LYS 8 -16.048 6.299 -11.497 59 HE2 LYS 8 2HE LYS 8 -18.032 7.445 -12.418 60 HE3 LYS 8 3HE LYS 8 -17.813 7.806 -10.709 61 HZ1 LYS 8 3HZ LYS 8 -18.393 9.781 -11.923 62 HZ2 LYS 8 1HZ LYS 8 -17.089 9.579 -12.983 63 HZ3 LYS 8 2HZ LYS 8 -16.811 9.926 -11.355 64 H LEU 9 H LEU 9 -12.220 5.011 -8.240 65 HA LEU 9 HA LEU 9 -9.576 5.097 -9.081 66 HB2 LEU 9 2HB LEU 9 -10.261 4.809 -6.733 67 HB3 LEU 9 3HB LEU 9 -10.936 3.233 -7.106 68 HG LEU 9 HG LEU 9 -8.598 2.441 -7.686 69 HD11 LEU 9 1HD1 LEU 9 -7.524 4.565 -8.170 70 HD12 LEU 9 2HD1 LEU 9 -6.667 3.728 -6.881 71 HD13 LEU 9 3HD1 LEU 9 -7.725 5.088 -6.494 72 HD21 LEU 9 3HD2 LEU 9 -7.874 2.172 -5.350 73 HD22 LEU 9 1HD2 LEU 9 -9.603 1.885 -5.541 74 HD23 LEU 9 2HD2 LEU 9 -9.033 3.404 -4.848 75 H THR 10 H THR 10 -8.793 4.125 -10.838 76 HA THR 10 HA THR 10 -9.308 1.246 -11.330 77 HB THR 10 HB THR 10 -8.597 3.355 -13.427 78 HG1 THR 10 HG1 THR 10 -10.694 3.746 -12.678 79 HG21 THR 10 3HG2 THR 10 -7.937 1.045 -14.063 80 HG22 THR 10 1HG2 THR 10 -9.243 1.652 -15.080 81 HG23 THR 10 2HG2 THR 10 -9.595 0.501 -13.791 82 H THR 11 H THR 11 -7.301 0.238 -12.435 83 HA THR 11 HA THR 11 -5.323 0.226 -10.501 84 HB THR 11 HB THR 11 -4.960 -0.910 -13.299 85 HG1 THR 11 HG1 THR 11 -6.434 -2.127 -11.180 86 HG21 THR 11 3HG2 THR 11 -3.854 -2.776 -12.103 87 HG22 THR 11 1HG2 THR 11 -4.126 -1.962 -10.561 88 HG23 THR 11 2HG2 THR 11 -3.048 -1.246 -11.761 89 H TYR 12 H TYR 12 -5.422 2.275 -13.340 90 HA TYR 12 HA TYR 12 -2.751 2.744 -13.947 91 HB2 TYR 12 2HB TYR 12 -3.444 4.858 -14.947 92 HB3 TYR 12 3HB TYR 12 -4.723 3.683 -15.218 93 HD1 TYR 12 HD1 TYR 12 -6.874 3.860 -13.887 94 HD2 TYR 12 HD2 TYR 12 -3.870 6.887 -13.642 95 HE1 TYR 12 HE1 TYR 12 -8.496 5.399 -12.858 96 HE2 TYR 12 HE2 TYR 12 -5.500 8.415 -12.620 97 HH TYR 12 HH TYR 12 -8.539 7.403 -11.466 98 H ALA 13 H ALA 13 -4.705 4.185 -11.366 99 HA ALA 13 HA ALA 13 -2.808 6.120 -10.456 100 HB1 ALA 13 3HB ALA 13 -5.260 6.301 -10.101 101 HB2 ALA 13 1HB ALA 13 -4.372 6.410 -8.581 102 HB3 ALA 13 2HB ALA 13 -5.198 4.911 -9.014 103 H SER 14 H SER 14 -3.597 2.823 -9.632 104 HA SER 14 HA SER 14 -2.009 2.582 -7.270 105 HB2 SER 14 2HB SER 14 -3.186 0.411 -9.054 106 HB3 SER 14 3HB SER 14 -2.685 0.234 -7.371 107 HG SER 14 HG SER 14 -4.883 0.546 -7.390 108 H LYS 15 H LYS 15 -1.412 2.146 -10.696 109 HA LYS 15 HA LYS 15 0.946 0.570 -10.621 110 HB2 LYS 15 2HB LYS 15 -0.040 2.594 -12.687 111 HB3 LYS 15 3HB LYS 15 1.402 1.615 -12.922 112 HG2 LYS 15 2HG LYS 15 -1.413 0.554 -12.587 113 HG3 LYS 15 3HG LYS 15 -0.536 0.686 -14.110 114 HD2 LYS 15 2HD LYS 15 1.159 -0.919 -13.270 115 HD3 LYS 15 3HD LYS 15 0.282 -1.034 -11.743 116 HE2 LYS 15 2HE LYS 15 -1.706 -1.894 -13.044 117 HE3 LYS 15 3HE LYS 15 -0.665 -1.959 -14.470 118 HZ1 LYS 15 3HZ LYS 15 -0.218 -3.414 -11.919 119 HZ2 LYS 15 1HZ LYS 15 0.815 -3.459 -13.256 120 HZ3 LYS 15 2HZ LYS 15 -0.747 -4.097 -13.370 121 H GLN 16 H GLN 16 0.424 4.092 -10.728 122 HA GLN 16 HA GLN 16 3.181 4.797 -10.754 123 HB2 GLN 16 2HB GLN 16 0.764 6.494 -10.005 124 HB3 GLN 16 3HB GLN 16 2.387 7.115 -10.276 125 HG2 GLN 16 2HG GLN 16 0.529 5.873 -12.314 126 HG3 GLN 16 3HG GLN 16 1.102 7.538 -12.246 127 HE21 GLN 16 1HE2 GLN 16 3.310 7.955 -12.787 128 HE22 GLN 16 2HE2 GLN 16 4.199 6.864 -13.789 129 H ALA 17 H ALA 17 0.837 4.277 -8.189 130 HA ALA 17 HA ALA 17 2.257 5.318 -5.996 131 HB1 ALA 17 3HB ALA 17 -0.113 4.668 -5.886 132 HB2 ALA 17 1HB ALA 17 0.825 3.884 -4.613 133 HB3 ALA 17 2HB ALA 17 0.340 2.972 -6.045 134 H THR 18 H THR 18 2.138 1.969 -7.263 135 HA THR 18 HA THR 18 4.117 0.891 -5.533 136 HB THR 18 HB THR 18 4.174 -0.992 -7.304 137 HG1 THR 18 HG1 THR 18 3.478 0.314 -9.074 138 HG21 THR 18 3HG2 THR 18 1.456 -0.209 -6.181 139 HG22 THR 18 1HG2 THR 18 2.701 -1.120 -5.320 140 HG23 THR 18 2HG2 THR 18 1.924 -1.817 -6.742 141 H ASP 19 H ASP 19 4.323 2.637 -8.544 142 HA ASP 19 HA ASP 19 7.004 2.054 -9.263 143 HB2 ASP 19 2HB ASP 19 5.395 3.131 -10.801 144 HB3 ASP 19 3HB ASP 19 5.359 4.572 -9.795 145 H MET 20 H MET 20 5.584 4.492 -7.079 146 HA MET 20 HA MET 20 8.087 5.734 -6.382 147 HB2 MET 20 2HB MET 20 5.261 6.065 -5.551 148 HB3 MET 20 3HB MET 20 6.381 6.297 -4.217 149 HG2 MET 20 2HG MET 20 6.021 8.436 -5.117 150 HG3 MET 20 3HG MET 20 7.606 7.964 -5.717 151 HE1 MET 20 3HE MET 20 3.885 7.125 -6.904 152 HE2 MET 20 1HE MET 20 3.749 8.309 -8.207 153 HE3 MET 20 2HE MET 20 3.940 8.855 -6.543 154 H GLY 21 H GLY 21 6.659 2.760 -5.463 155 HA2 GLY 21 2HA GLY 21 8.139 1.136 -4.413 156 HA3 GLY 21 3HA GLY 21 8.684 2.397 -3.315 157 H ALA 22 H ALA 22 5.293 2.331 -4.011 158 HA ALA 22 HA ALA 22 4.567 1.560 -1.344 159 HB1 ALA 22 3HB ALA 22 2.243 1.796 -2.109 160 HB2 ALA 22 1HB ALA 22 2.797 1.928 -3.783 161 HB3 ALA 22 2HB ALA 22 3.213 3.181 -2.614 162 H ILE 23 H ILE 23 3.773 -0.387 -0.619 163 HA ILE 23 HA ILE 23 4.247 -2.718 -2.377 164 HB ILE 23 HB ILE 23 4.400 -4.057 -0.294 165 HG12 ILE 23 2HG1 ILE 23 4.010 -1.412 1.203 166 HG13 ILE 23 3HG1 ILE 23 2.803 -2.682 1.086 167 HG21 ILE 23 1HG2 ILE 23 6.467 -3.046 -1.181 168 HG22 ILE 23 2HG2 ILE 23 6.526 -3.123 0.579 169 HG23 ILE 23 3HG2 ILE 23 6.185 -1.589 -0.222 170 HD11 ILE 23 3HD1 ILE 23 5.465 -2.880 2.481 171 HD12 ILE 23 1HD1 ILE 23 4.285 -4.186 2.328 172 HD13 ILE 23 2HD1 ILE 23 3.874 -2.729 3.229 173 H TYR 24 H TYR 24 2.741 -4.400 -2.508 174 HA TYR 24 HA TYR 24 -0.026 -3.829 -1.662 175 HB2 TYR 24 2HB TYR 24 1.191 -5.733 -3.686 176 HB3 TYR 24 3HB TYR 24 -0.419 -6.030 -3.056 177 HD1 TYR 24 HD1 TYR 24 -1.940 -3.722 -3.083 178 HD2 TYR 24 HD2 TYR 24 1.194 -4.743 -5.807 179 HE1 TYR 24 HE1 TYR 24 -2.978 -2.326 -4.816 180 HE2 TYR 24 HE2 TYR 24 0.149 -3.341 -7.522 181 HH TYR 24 HH TYR 24 -2.468 -1.216 -6.852 182 H VAL 25 H VAL 25 -0.583 -4.632 0.239 183 HA VAL 25 HA VAL 25 0.259 -7.366 1.030 184 HB VAL 25 HB VAL 25 -0.376 -6.828 3.338 185 HG11 VAL 25 1HG1 VAL 25 1.945 -6.402 2.720 186 HG12 VAL 25 2HG1 VAL 25 1.418 -5.218 3.914 187 HG13 VAL 25 3HG1 VAL 25 1.546 -4.756 2.215 188 HG21 VAL 25 3HG2 VAL 25 -0.991 -4.537 4.062 189 HG22 VAL 25 1HG2 VAL 25 -2.184 -5.217 2.954 190 HG23 VAL 25 2HG2 VAL 25 -1.029 -4.016 2.376 191 H ASN 26 H ASN 26 -1.759 -8.230 2.560 192 HA ASN 26 HA ASN 26 -4.307 -7.643 1.131 193 HB2 ASN 26 2HB ASN 26 -4.990 -9.934 1.302 194 HB3 ASN 26 3HB ASN 26 -3.358 -9.959 0.648 195 HD21 ASN 26 1HD2 ASN 26 -1.598 -10.465 2.208 196 HD22 ASN 26 2HD2 ASN 26 -1.950 -11.565 3.498 197 H SER 27 H SER 27 -6.113 -8.844 2.843 198 HA SER 27 HA SER 27 -6.288 -6.926 4.944 199 HB2 SER 27 2HB SER 27 -8.277 -7.841 3.799 200 HB3 SER 27 3HB SER 27 -7.967 -9.423 4.503 201 HG SER 27 HG SER 27 -8.052 -7.595 6.462 202 H LYS 28 H LYS 28 -4.587 -9.849 4.865 203 HA LYS 28 HA LYS 28 -4.473 -10.118 7.777 204 HB2 LYS 28 2HB LYS 28 -3.027 -11.644 5.572 205 HB3 LYS 28 3HB LYS 28 -2.885 -11.991 7.291 206 HG2 LYS 28 2HG LYS 28 -5.415 -12.206 5.642 207 HG3 LYS 28 3HG LYS 28 -4.416 -13.550 6.194 208 HD2 LYS 28 2HD LYS 28 -4.925 -12.910 8.559 209 HD3 LYS 28 3HD LYS 28 -5.981 -11.629 7.959 210 HE2 LYS 28 2HE LYS 28 -7.392 -13.342 6.845 211 HE3 LYS 28 3HE LYS 28 -6.358 -14.608 7.509 212 HZ1 LYS 28 3HZ LYS 28 -8.342 -14.298 8.834 213 HZ2 LYS 28 1HZ LYS 28 -7.953 -12.674 9.099 214 HZ3 LYS 28 2HZ LYS 28 -6.971 -13.897 9.734 215 H GLY 29 H GLY 29 -2.496 -8.960 5.055 216 HA2 GLY 29 2HA GLY 29 -1.089 -7.020 5.396 217 HA3 GLY 29 3HA GLY 29 -0.665 -7.631 6.988 218 H ASP 30 H ASP 30 -0.711 -10.207 4.842 219 HA ASP 30 HA ASP 30 2.145 -10.412 4.594 220 HB2 ASP 30 2HB ASP 30 0.043 -11.966 3.003 221 HB3 ASP 30 3HB ASP 30 1.728 -12.413 3.226 222 H ARG 31 H ARG 31 3.345 -9.317 3.090 223 HA ARG 31 HA ARG 31 2.335 -7.839 0.931 224 HB2 ARG 31 2HB ARG 31 4.699 -7.751 0.096 225 HB3 ARG 31 3HB ARG 31 4.537 -7.310 1.790 226 HG2 ARG 31 2HG ARG 31 5.383 -9.522 2.472 227 HG3 ARG 31 3HG ARG 31 5.499 -10.008 0.781 228 HD2 ARG 31 2HD ARG 31 7.204 -8.267 0.384 229 HD3 ARG 31 3HD ARG 31 7.071 -7.744 2.067 230 HE ARG 31 HE ARG 31 8.251 -10.264 1.088 231 HH11 ARG 31 1HH1 ARG 31 7.666 -8.117 3.823 232 HH12 ARG 31 2HH1 ARG 31 8.795 -8.935 4.850 233 HH21 ARG 31 1HH2 ARG 31 9.677 -11.352 2.472 234 HH22 ARG 31 2HH2 ARG 31 9.930 -10.764 4.087 235 H ILE 32 H ILE 32 1.159 -8.681 -0.637 236 HA ILE 32 HA ILE 32 1.335 -11.422 -1.503 237 HB ILE 32 HB ILE 32 -0.539 -10.932 -2.960 238 HG12 ILE 32 2HG1 ILE 32 -0.140 -7.964 -2.357 239 HG13 ILE 32 3HG1 ILE 32 0.277 -8.747 -3.873 240 HG21 ILE 32 1HG2 ILE 32 -2.195 -10.057 -1.371 241 HG22 ILE 32 2HG2 ILE 32 -0.905 -9.377 -0.376 242 HG23 ILE 32 3HG2 ILE 32 -1.056 -11.126 -0.549 243 HD11 ILE 32 3HD1 ILE 32 -1.795 -7.534 -4.059 244 HD12 ILE 32 1HD1 ILE 32 -2.498 -8.472 -2.743 245 HD13 ILE 32 2HD1 ILE 32 -2.071 -9.263 -4.262 246 H VAL 33 H VAL 33 2.378 -8.308 -2.689 247 HA VAL 33 HA VAL 33 4.401 -9.376 -4.379 248 HB VAL 33 HB VAL 33 2.393 -9.648 -5.885 249 HG11 VAL 33 1HG1 VAL 33 1.273 -7.714 -6.893 250 HG12 VAL 33 2HG1 VAL 33 2.193 -6.622 -5.857 251 HG13 VAL 33 3HG1 VAL 33 1.039 -7.748 -5.145 252 HG21 VAL 33 3HG2 VAL 33 4.471 -7.666 -6.860 253 HG22 VAL 33 1HG2 VAL 33 3.394 -8.601 -7.901 254 HG23 VAL 33 2HG2 VAL 33 4.584 -9.427 -6.898 255 H ASN 34 H ASN 34 5.999 -7.769 -4.684 256 HA ASN 34 HA ASN 34 5.720 -5.463 -2.902 257 HB2 ASN 34 2HB ASN 34 8.135 -5.183 -3.130 258 HB3 ASN 34 3HB ASN 34 7.761 -6.871 -2.799 259 HD21 ASN 34 1HD2 ASN 34 8.257 -8.418 -4.360 260 HD22 ASN 34 2HD2 ASN 34 9.182 -8.066 -5.773 261 H GLU 35 H GLU 35 4.935 -5.885 -6.037 262 HA GLU 35 HA GLU 35 5.225 -3.107 -6.861 263 HB2 GLU 35 2HB GLU 35 7.420 -4.127 -7.467 264 HB3 GLU 35 3HB GLU 35 6.598 -5.408 -8.346 265 HG2 GLU 35 2HG GLU 35 5.719 -3.719 -9.946 266 HG3 GLU 35 3HG GLU 35 6.598 -2.461 -9.078 267 H SER 36 H SER 36 3.761 -2.635 -8.628 268 HA SER 36 HA SER 36 1.690 -4.646 -9.128 269 HB2 SER 36 2HB SER 36 1.245 -2.130 -8.644 270 HB3 SER 36 3HB SER 36 1.768 -1.830 -10.299 271 HG SER 36 HG SER 36 -0.615 -2.682 -9.404 272 H ASN 37 H ASN 37 3.717 -5.793 -10.102 273 HA ASN 37 HA ASN 37 4.944 -5.045 -12.493 274 HB2 ASN 37 2HB ASN 37 5.859 -6.738 -10.939 275 HB3 ASN 37 3HB ASN 37 4.551 -7.841 -11.345 276 HD21 ASN 37 1HD2 ASN 37 7.445 -6.262 -12.560 277 HD22 ASN 37 2HD2 ASN 37 7.733 -7.374 -13.854 278 H VAL 38 H VAL 38 2.343 -7.402 -11.960 279 HA VAL 38 HA VAL 38 0.943 -6.588 -14.332 280 HB VAL 38 HB VAL 38 2.553 -8.136 -15.366 281 HG11 VAL 38 1HG1 VAL 38 1.509 -10.306 -13.524 282 HG12 VAL 38 2HG1 VAL 38 3.106 -9.557 -13.460 283 HG13 VAL 38 3HG1 VAL 38 2.647 -10.529 -14.858 284 HG21 VAL 38 3HG2 VAL 38 0.979 -9.618 -16.549 285 HG22 VAL 38 1HG2 VAL 38 0.306 -8.002 -16.335 286 HG23 VAL 38 2HG2 VAL 38 -0.241 -9.328 -15.305 287 H TYR 39 H TYR 39 -1.242 -7.205 -14.251 288 HA TYR 39 HA TYR 39 -2.319 -7.403 -11.648 289 HB2 TYR 39 2HB TYR 39 -4.515 -7.325 -12.693 290 HB3 TYR 39 3HB TYR 39 -3.448 -6.234 -13.567 291 HD1 TYR 39 HD2 TYR 39 -2.524 -6.963 -15.845 292 HD2 TYR 39 HD1 TYR 39 -5.598 -9.160 -13.837 293 HE1 TYR 39 HE2 TYR 39 -3.086 -8.105 -17.942 294 HE2 TYR 39 HE1 TYR 39 -6.147 -10.299 -15.943 295 HH TYR 39 HH TYR 39 -5.889 -10.040 -18.310 296 H THR 40 H THR 40 -1.506 -9.839 -13.987 297 HA THR 40 HA THR 40 -3.216 -11.925 -13.125 298 HB THR 40 HB THR 40 -1.558 -13.412 -14.346 299 HG1 THR 40 HG1 THR 40 0.265 -12.552 -15.134 300 HG21 THR 40 3HG2 THR 40 -1.979 -12.466 -16.593 301 HG22 THR 40 1HG2 THR 40 -2.437 -10.925 -15.864 302 HG23 THR 40 2HG2 THR 40 -3.428 -12.359 -15.592 303 H THR 41 H THR 41 0.297 -11.408 -12.509 304 HA THR 41 HA THR 41 0.675 -13.355 -10.535 305 HB THR 41 HB THR 41 2.123 -10.682 -10.849 306 HG1 THR 41 HG1 THR 41 3.044 -13.172 -11.820 307 HG21 THR 41 3HG2 THR 41 2.668 -11.723 -8.665 308 HG22 THR 41 1HG2 THR 41 4.049 -11.802 -9.759 309 HG23 THR 41 2HG2 THR 41 3.066 -13.238 -9.480 310 H PHE 42 H PHE 42 -0.244 -9.968 -10.266 311 HA PHE 42 HA PHE 42 -0.385 -9.585 -7.509 312 HB2 PHE 42 2HB PHE 42 -0.475 -7.661 -8.902 313 HB3 PHE 42 3HB PHE 42 -1.739 -8.328 -9.917 314 HD1 PHE 42 HD1 PHE 42 -1.177 -7.126 -6.394 315 HD2 PHE 42 HD2 PHE 42 -3.924 -7.522 -9.650 316 HE1 PHE 42 HE1 PHE 42 -2.842 -5.796 -5.168 317 HE2 PHE 42 HE2 PHE 42 -5.583 -6.193 -8.408 318 HZ PHE 42 HZ PHE 42 -5.042 -5.326 -6.166 319 H ARG 43 H ARG 43 -2.802 -10.909 -9.764 320 HA ARG 43 HA ARG 43 -4.970 -10.835 -7.858 321 HB2 ARG 43 2HB ARG 43 -5.302 -10.464 -10.275 322 HB3 ARG 43 3HB ARG 43 -4.821 -12.121 -10.617 323 HG2 ARG 43 2HG ARG 43 -6.822 -13.012 -9.737 324 HG3 ARG 43 3HG ARG 43 -7.173 -11.561 -8.789 325 HD2 ARG 43 2HD ARG 43 -7.286 -11.779 -11.821 326 HD3 ARG 43 3HD ARG 43 -8.675 -11.713 -10.728 327 HE ARG 43 HE ARG 43 -7.314 -9.474 -10.090 328 HH11 ARG 43 1HH1 ARG 43 -8.448 -10.663 -13.207 329 HH12 ARG 43 2HH1 ARG 43 -8.619 -9.068 -13.874 330 HH21 ARG 43 1HH2 ARG 43 -7.532 -7.420 -10.969 331 HH22 ARG 43 2HH2 ARG 43 -8.104 -7.218 -12.597 332 H ASN 44 H ASN 44 -2.985 -13.409 -9.363 333 HA ASN 44 HA ASN 44 -4.163 -15.570 -7.924 334 HB2 ASN 44 2HB ASN 44 -1.476 -15.315 -9.338 335 HB3 ASN 44 3HB ASN 44 -1.956 -16.791 -8.516 336 HD21 ASN 44 1HD2 ASN 44 -2.356 -14.884 -11.359 337 HD22 ASN 44 2HD2 ASN 44 -3.449 -15.936 -12.176 338 H ALA 45 H ALA 45 -1.703 -13.223 -7.118 339 HA ALA 45 HA ALA 45 -0.690 -14.467 -4.772 340 HB1 ALA 45 3HB ALA 45 0.187 -12.253 -4.203 341 HB2 ALA 45 1HB ALA 45 -0.822 -11.512 -5.450 342 HB3 ALA 45 2HB ALA 45 0.472 -12.621 -5.903 343 H ILE 46 H ILE 46 -3.440 -12.251 -5.341 344 HA ILE 46 HA ILE 46 -4.306 -12.021 -2.629 345 HB ILE 46 HB ILE 46 -5.964 -11.771 -5.192 346 HG12 ILE 46 2HG1 ILE 46 -4.608 -9.588 -3.542 347 HG13 ILE 46 3HG1 ILE 46 -4.039 -10.185 -5.094 348 HG21 ILE 46 1HG2 ILE 46 -6.606 -10.775 -2.389 349 HG22 ILE 46 2HG2 ILE 46 -7.416 -12.098 -3.230 350 HG23 ILE 46 3HG2 ILE 46 -7.562 -10.452 -3.838 351 HD11 ILE 46 3HD1 ILE 46 -6.059 -9.348 -6.167 352 HD12 ILE 46 1HD1 ILE 46 -5.177 -8.071 -5.331 353 HD13 ILE 46 2HD1 ILE 46 -6.639 -8.744 -4.612 354 H LEU 47 H LEU 47 -5.148 -14.242 -5.274 355 HA LEU 47 HA LEU 47 -7.110 -15.783 -3.918 356 HB2 LEU 47 2HB LEU 47 -5.331 -16.585 -6.255 357 HB3 LEU 47 3HB LEU 47 -6.777 -17.440 -5.744 358 HG LEU 47 HG LEU 47 -6.697 -14.631 -6.914 359 HD11 LEU 47 1HD1 LEU 47 -6.250 -16.345 -8.597 360 HD12 LEU 47 2HD1 LEU 47 -7.827 -15.607 -8.859 361 HD13 LEU 47 3HD1 LEU 47 -7.719 -17.213 -8.133 362 HD21 LEU 47 3HD2 LEU 47 -9.156 -14.728 -6.923 363 HD22 LEU 47 1HD2 LEU 47 -8.506 -14.791 -5.287 364 HD23 LEU 47 2HD2 LEU 47 -9.104 -16.263 -6.055 365 H LYS 48 H LYS 48 -3.637 -15.840 -3.894 366 HA LYS 48 HA LYS 48 -3.201 -18.428 -2.766 367 HB2 LYS 48 2HB LYS 48 -1.461 -17.090 -3.926 368 HB3 LYS 48 3HB LYS 48 -1.514 -15.885 -2.647 369 HG2 LYS 48 2HG LYS 48 -0.737 -17.688 -1.038 370 HG3 LYS 48 3HG LYS 48 -0.512 -18.750 -2.430 371 HD2 LYS 48 2HD LYS 48 0.915 -16.113 -1.914 372 HD3 LYS 48 3HD LYS 48 1.625 -17.722 -1.806 373 HE2 LYS 48 2HE LYS 48 0.604 -16.381 -4.333 374 HE3 LYS 48 3HE LYS 48 2.291 -16.619 -3.893 375 HZ1 LYS 48 3HZ LYS 48 0.318 -18.759 -4.508 376 HZ2 LYS 48 1HZ LYS 48 1.903 -19.031 -3.984 377 HZ3 LYS 48 2HZ LYS 48 1.623 -18.281 -5.469 378 H GLN 49 H GLN 49 -3.901 -15.231 -1.445 379 HA GLN 49 HA GLN 49 -3.245 -15.907 1.305 380 HB2 GLN 49 2HB GLN 49 -4.625 -13.399 0.259 381 HB3 GLN 49 3HB GLN 49 -3.841 -13.598 1.819 382 HG2 GLN 49 2HG GLN 49 -2.427 -13.632 -0.851 383 HG3 GLN 49 3HG GLN 49 -2.536 -12.239 0.214 384 HE21 GLN 49 1HE2 GLN 49 -0.264 -12.125 0.258 385 HE22 GLN 49 2HE2 GLN 49 0.701 -13.221 1.166 386 H ALA 50 H ALA 50 -5.006 -15.026 2.945 387 HA ALA 50 HA ALA 50 -7.133 -16.905 2.929 388 HB1 ALA 50 3HB ALA 50 -7.773 -15.883 5.079 389 HB2 ALA 50 1HB ALA 50 -6.667 -14.534 4.781 390 HB3 ALA 50 2HB ALA 50 -6.036 -16.166 5.001 391 H ASP 51 H ASP 51 -7.126 -13.344 2.773 392 HA ASP 51 HA ASP 51 -9.994 -13.246 2.162 393 HB2 ASP 51 2HB ASP 51 -8.011 -10.984 2.645 394 HB3 ASP 51 3HB ASP 51 -9.761 -10.818 2.533 395 H LYS 52 H LYS 52 -10.739 -11.751 0.485 396 HA LYS 52 HA LYS 52 -9.181 -12.072 -2.016 397 HB2 LYS 52 2HB LYS 52 -12.200 -11.937 -1.576 398 HB3 LYS 52 3HB LYS 52 -11.426 -12.014 -3.159 399 HG2 LYS 52 2HG LYS 52 -11.191 -14.123 -0.991 400 HG3 LYS 52 3HG LYS 52 -12.217 -14.242 -2.425 401 HD2 LYS 52 2HD LYS 52 -10.318 -14.391 -3.892 402 HD3 LYS 52 3HD LYS 52 -9.204 -13.860 -2.633 403 HE2 LYS 52 2HE LYS 52 -9.029 -16.292 -3.132 404 HE3 LYS 52 3HE LYS 52 -9.454 -15.969 -1.449 405 HZ1 LYS 52 3HZ LYS 52 -11.405 -16.685 -3.568 406 HZ2 LYS 52 1HZ LYS 52 -11.723 -16.512 -1.919 407 HZ3 LYS 52 2HZ LYS 52 -10.747 -17.780 -2.464 408 H VAL 53 H VAL 53 -8.822 -9.910 -0.151 409 HA VAL 53 HA VAL 53 -9.147 -7.706 -2.056 410 HB VAL 53 HB VAL 53 -10.958 -7.315 -0.480 411 HG11 VAL 53 1HG1 VAL 53 -10.206 -8.642 1.425 412 HG12 VAL 53 2HG1 VAL 53 -10.655 -7.014 1.930 413 HG13 VAL 53 3HG1 VAL 53 -8.950 -7.455 1.789 414 HG21 VAL 53 3HG2 VAL 53 -10.380 -5.073 0.376 415 HG22 VAL 53 1HG2 VAL 53 -9.779 -5.319 -1.266 416 HG23 VAL 53 2HG2 VAL 53 -8.666 -5.404 0.103 417 H ALA 54 H ALA 54 -7.348 -6.539 -2.269 418 HA ALA 54 HA ALA 54 -5.002 -7.054 -0.555 419 HB1 ALA 54 3HB ALA 54 -5.192 -5.875 -3.358 420 HB2 ALA 54 1HB ALA 54 -4.686 -7.514 -2.950 421 HB3 ALA 54 2HB ALA 54 -3.698 -6.141 -2.453 422 H TYR 55 H TYR 55 -3.602 -5.083 -0.240 423 HA TYR 55 HA TYR 55 -5.074 -2.544 -0.022 424 HB2 TYR 55 2HB TYR 55 -3.820 -4.044 2.323 425 HB3 TYR 55 3HB TYR 55 -4.154 -2.314 2.371 426 HD1 TYR 55 HD1 TYR 55 -6.479 -1.472 2.370 427 HD2 TYR 55 HD2 TYR 55 -5.684 -5.672 2.414 428 HE1 TYR 55 HE1 TYR 55 -8.824 -1.917 2.948 429 HE2 TYR 55 HE2 TYR 55 -8.027 -6.099 2.997 430 HH TYR 55 HH TYR 55 -10.440 -3.710 2.747 431 H LEU 56 H LEU 56 -3.883 -1.140 -1.003 432 HA LEU 56 HA LEU 56 -1.031 -1.481 -1.419 433 HB2 LEU 56 2HB LEU 56 -2.586 -0.800 -3.237 434 HB3 LEU 56 3HB LEU 56 -2.983 0.666 -2.355 435 HG LEU 56 HG LEU 56 -0.729 1.548 -2.693 436 HD11 LEU 56 1HD1 LEU 56 0.575 -0.507 -2.514 437 HD12 LEU 56 2HD1 LEU 56 0.976 0.348 -4.000 438 HD13 LEU 56 3HD1 LEU 56 -0.064 -1.079 -4.057 439 HD21 LEU 56 3HD2 LEU 56 -2.347 1.941 -4.483 440 HD22 LEU 56 1HD2 LEU 56 -1.890 0.425 -5.266 441 HD23 LEU 56 2HD2 LEU 56 -0.732 1.751 -5.158 442 H VAL 57 H VAL 57 0.126 -1.015 0.337 443 HA VAL 57 HA VAL 57 -0.503 1.201 2.131 444 HB VAL 57 HB VAL 57 1.762 -0.858 2.231 445 HG11 VAL 57 1HG1 VAL 57 2.093 -0.164 4.575 446 HG12 VAL 57 2HG1 VAL 57 0.869 1.093 4.388 447 HG13 VAL 57 3HG1 VAL 57 2.370 1.179 3.466 448 HG21 VAL 57 3HG2 VAL 57 -0.437 -1.921 2.458 449 HG22 VAL 57 1HG2 VAL 57 -0.870 -0.805 3.756 450 HG23 VAL 57 2HG2 VAL 57 0.430 -1.977 3.991 451 H MET 58 H MET 58 0.225 3.161 1.660 452 HA MET 58 HA MET 58 2.911 3.588 0.500 453 HB2 MET 58 2HB MET 58 2.072 5.315 -0.993 454 HB3 MET 58 3HB MET 58 1.116 3.871 -1.276 455 HG2 MET 58 2HG MET 58 -0.689 4.847 0.145 456 HG3 MET 58 3HG MET 58 0.269 6.318 0.289 457 HE1 MET 58 3HE MET 58 -1.719 4.821 -3.597 458 HE2 MET 58 1HE MET 58 -1.913 4.057 -2.020 459 HE3 MET 58 2HE MET 58 -0.371 3.945 -2.873 460 H ASP 59 H ASP 59 3.400 6.063 0.744 461 HA ASP 59 HA ASP 59 2.576 7.059 3.420 462 HB2 ASP 59 2HB ASP 59 4.636 8.447 3.289 463 HB3 ASP 59 3HB ASP 59 5.026 6.741 3.102 464 H GLU 60 H GLU 60 2.919 9.708 3.233 465 HA GLU 60 HA GLU 60 0.565 10.511 1.833 466 HB2 GLU 60 2HB GLU 60 1.112 11.500 4.005 467 HB3 GLU 60 3HB GLU 60 2.590 12.213 3.356 468 HG2 GLU 60 2HG GLU 60 1.354 13.744 1.985 469 HG3 GLU 60 3HG GLU 60 -0.155 12.882 2.259 470 H ARG 61 H ARG 61 4.045 11.074 1.209 471 HA ARG 61 HA ARG 61 3.714 13.065 -0.800 472 HB2 ARG 61 2HB ARG 61 6.052 11.145 -0.439 473 HB3 ARG 61 3HB ARG 61 6.070 12.613 -1.408 474 HG2 ARG 61 2HG ARG 61 5.599 13.905 0.737 475 HG3 ARG 61 3HG ARG 61 5.893 12.400 1.613 476 HD2 ARG 61 2HD ARG 61 7.933 13.721 1.613 477 HD3 ARG 61 3HD ARG 61 8.180 12.304 0.583 478 HE ARG 61 HE ARG 61 7.286 14.695 -0.794 479 HH11 ARG 61 1HH1 ARG 61 10.120 12.838 0.155 480 HH12 ARG 61 2HH1 ARG 61 11.139 13.567 -1.046 481 HH21 ARG 61 1HH2 ARG 61 8.618 15.661 -2.340 482 HH22 ARG 61 2HH2 ARG 61 10.280 15.172 -2.461 483 H THR 62 H THR 62 4.096 9.536 -0.965 484 HA THR 62 HA THR 62 3.895 9.210 -3.768 485 HB THR 62 HB THR 62 3.184 7.328 -1.475 486 HG1 THR 62 HG1 THR 62 5.333 7.615 -1.463 487 HG21 THR 62 3HG2 THR 62 3.462 6.652 -4.436 488 HG22 THR 62 1HG2 THR 62 1.984 6.534 -3.473 489 HG23 THR 62 2HG2 THR 62 3.349 5.474 -3.128 490 H TRP 63 H TRP 63 1.423 9.324 -1.212 491 HA TRP 63 HA TRP 63 -0.833 8.681 -2.748 492 HB2 TRP 63 2HB TRP 63 -1.096 8.589 -0.380 493 HB3 TRP 63 3HB TRP 63 -0.534 10.246 -0.160 494 HD1 TRP 63 HD1 TRP 63 -2.418 11.938 0.243 495 HE1 TRP 63 HE1 TRP 63 -4.929 12.084 -0.241 496 HE3 TRP 63 HE3 TRP 63 -3.019 7.567 -2.362 497 HZ2 TRP 63 HZ2 TRP 63 -6.895 10.582 -1.543 498 HZ3 TRP 63 HZ3 TRP 63 -5.265 7.004 -3.205 499 HH2 TRP 63 HH2 TRP 63 -7.165 8.487 -2.803 500 H LYS 64 H LYS 64 0.789 11.828 -2.235 501 HA LYS 64 HA LYS 64 -1.124 13.563 -3.241 502 HB2 LYS 64 2HB LYS 64 1.900 13.728 -3.572 503 HB3 LYS 64 3HB LYS 64 0.793 15.063 -3.870 504 HG2 LYS 64 2HG LYS 64 1.392 13.735 -1.222 505 HG3 LYS 64 3HG LYS 64 1.797 15.379 -1.723 506 HD2 LYS 64 2HD LYS 64 -0.712 15.810 -1.922 507 HD3 LYS 64 3HD LYS 64 -0.963 14.248 -1.146 508 HE2 LYS 64 2HE LYS 64 0.298 15.043 0.830 509 HE3 LYS 64 3HE LYS 64 0.518 16.605 0.038 510 HZ1 LYS 64 3HZ LYS 64 -1.324 16.617 1.627 511 HZ2 LYS 64 1HZ LYS 64 -2.112 15.409 0.741 512 HZ3 LYS 64 2HZ LYS 64 -1.865 16.937 0.055 513 H LYS 65 H LYS 65 1.056 11.441 -5.000 514 HA LYS 65 HA LYS 65 0.597 12.623 -7.592 515 HB2 LYS 65 2HB LYS 65 1.894 9.957 -6.887 516 HB3 LYS 65 3HB LYS 65 1.990 10.775 -8.443 517 HG2 LYS 65 2HG LYS 65 3.187 11.685 -5.818 518 HG3 LYS 65 3HG LYS 65 4.061 11.138 -7.246 519 HD2 LYS 65 2HD LYS 65 2.390 13.672 -7.047 520 HD3 LYS 65 3HD LYS 65 4.149 13.595 -6.993 521 HE2 LYS 65 2HE LYS 65 4.274 12.878 -9.284 522 HE3 LYS 65 3HE LYS 65 2.525 12.623 -9.361 523 HZ1 LYS 65 3HZ LYS 65 3.166 14.692 -10.417 524 HZ2 LYS 65 1HZ LYS 65 3.859 15.252 -8.981 525 HZ3 LYS 65 2HZ LYS 65 2.189 14.989 -9.072 526 H VAL 66 H VAL 66 -0.543 9.733 -5.861 527 HA VAL 66 HA VAL 66 -2.236 8.640 -7.854 528 HB VAL 66 HB VAL 66 -2.644 8.583 -4.819 529 HG11 VAL 66 1HG1 VAL 66 -4.644 7.823 -6.047 530 HG12 VAL 66 2HG1 VAL 66 -3.887 6.493 -5.175 531 HG13 VAL 66 3HG1 VAL 66 -3.670 6.636 -6.920 532 HG21 VAL 66 3HG2 VAL 66 -1.054 6.650 -6.549 533 HG22 VAL 66 1HG2 VAL 66 -1.382 6.459 -4.824 534 HG23 VAL 66 2HG2 VAL 66 -0.389 7.802 -5.389 535 H TYR 67 H TYR 67 -2.671 11.095 -5.412 536 HA TYR 67 HA TYR 67 -5.434 11.625 -5.618 537 HB2 TYR 67 2HB TYR 67 -4.092 12.258 -3.659 538 HB3 TYR 67 3HB TYR 67 -3.081 13.311 -4.633 539 HD1 TYR 67 HD1 TYR 67 -6.450 12.935 -3.100 540 HD2 TYR 67 HD2 TYR 67 -3.779 15.579 -5.133 541 HE1 TYR 67 HE1 TYR 67 -7.890 14.842 -2.525 542 HE2 TYR 67 HE2 TYR 67 -5.221 17.485 -4.556 543 HH TYR 67 HH TYR 67 -7.511 17.944 -3.941 544 H ASP 68 H ASP 68 -2.570 13.007 -7.243 545 HA ASP 68 HA ASP 68 -3.801 15.028 -8.762 546 HB2 ASP 68 2HB ASP 68 -1.422 13.262 -9.530 547 HB3 ASP 68 3HB ASP 68 -1.907 14.699 -10.421 548 H LEU 69 H LEU 69 -3.089 11.636 -9.554 549 HA LEU 69 HA LEU 69 -4.022 11.594 -12.196 550 HB2 LEU 69 2HB LEU 69 -3.805 9.308 -10.202 551 HB3 LEU 69 3HB LEU 69 -3.991 9.112 -11.941 552 HG LEU 69 HG LEU 69 -1.608 10.452 -10.615 553 HD11 LEU 69 1HD1 LEU 69 -0.374 8.419 -11.120 554 HD12 LEU 69 2HD1 LEU 69 -1.829 7.664 -11.774 555 HD13 LEU 69 3HD1 LEU 69 -1.734 8.068 -10.057 556 HD21 LEU 69 3HD2 LEU 69 -0.544 10.286 -12.828 557 HD22 LEU 69 1HD2 LEU 69 -1.994 11.286 -12.888 558 HD23 LEU 69 2HD2 LEU 69 -2.037 9.635 -13.509 559 H LEU 70 H LEU 70 -5.706 10.836 -9.162 560 HA LEU 70 HA LEU 70 -8.086 9.741 -10.190 561 HB2 LEU 70 2HB LEU 70 -7.624 11.330 -7.630 562 HB3 LEU 70 3HB LEU 70 -9.117 10.480 -7.989 563 HG LEU 70 HG LEU 70 -6.396 9.161 -7.632 564 HD11 LEU 70 1HD1 LEU 70 -7.264 10.038 -5.519 565 HD12 LEU 70 2HD1 LEU 70 -7.284 8.277 -5.530 566 HD13 LEU 70 3HD1 LEU 70 -8.786 9.175 -5.766 567 HD21 LEU 70 3HD2 LEU 70 -7.774 7.901 -9.212 568 HD22 LEU 70 1HD2 LEU 70 -9.115 7.880 -8.062 569 HD23 LEU 70 2HD2 LEU 70 -7.615 7.025 -7.694 570 H ILE 71 H ILE 71 -7.401 13.098 -9.186 571 HA ILE 71 HA ILE 71 -9.907 14.181 -10.026 572 HB ILE 71 HB ILE 71 -7.296 15.674 -9.461 573 HG12 ILE 71 2HG1 ILE 71 -9.559 14.913 -7.554 574 HG13 ILE 71 3HG1 ILE 71 -7.935 14.238 -7.550 575 HG21 ILE 71 1HG2 ILE 71 -10.163 16.690 -9.385 576 HG22 ILE 71 2HG2 ILE 71 -8.976 17.070 -10.633 577 HG23 ILE 71 3HG2 ILE 71 -8.723 17.626 -8.979 578 HD11 ILE 71 3HD1 ILE 71 -8.166 15.816 -5.772 579 HD12 ILE 71 1HD1 ILE 71 -8.699 17.071 -6.892 580 HD13 ILE 71 2HD1 ILE 71 -7.046 16.457 -6.973 581 H LEU 72 H LEU 72 -6.795 13.770 -11.550 582 HA LEU 72 HA LEU 72 -7.033 15.599 -13.697 583 HB2 LEU 72 2HB LEU 72 -4.902 14.606 -12.816 584 HB3 LEU 72 3HB LEU 72 -5.335 13.059 -13.508 585 HG LEU 72 HG LEU 72 -3.582 14.475 -14.753 586 HD11 LEU 72 1HD1 LEU 72 -4.313 13.817 -16.988 587 HD12 LEU 72 2HD1 LEU 72 -5.953 13.542 -16.395 588 HD13 LEU 72 3HD1 LEU 72 -4.624 12.535 -15.816 589 HD21 LEU 72 3HD2 LEU 72 -6.006 16.098 -15.617 590 HD22 LEU 72 1HD2 LEU 72 -4.367 16.248 -16.256 591 HD23 LEU 72 2HD2 LEU 72 -4.696 16.663 -14.577 592 H HIS 73 H HIS 73 -7.718 12.105 -13.412 593 HA HIS 73 HA HIS 73 -8.607 11.856 -16.144 594 HB2 HIS 73 2HB HIS 73 -8.666 9.968 -13.760 595 HB3 HIS 73 3HB HIS 73 -9.438 9.551 -15.290 596 HD1 HIS 73 HD1 HIS 73 -7.966 7.936 -16.421 597 HD2 HIS 73 HD2 HIS 73 -5.763 10.967 -14.612 598 HE1 HIS 73 HE1 HIS 73 -5.578 7.503 -17.044 599 HE2 HIS 73 HE2 HIS 73 -4.255 9.293 -15.878 600 H ASP 74 H ASP 74 -10.289 11.478 -13.009 601 HA ASP 74 HA ASP 74 -12.468 13.118 -13.319 602 HB2 ASP 74 2HB ASP 74 -13.109 11.807 -15.348 603 HB3 ASP 74 3HB ASP 74 -13.113 10.323 -14.411 604 H PHE 75 H PHE 75 -11.975 13.182 -11.070 605 HA PHE 75 HA PHE 75 -13.698 11.693 -9.420 606 HB2 PHE 75 2HB PHE 75 -11.739 9.987 -9.854 607 HB3 PHE 75 3HB PHE 75 -10.784 11.012 -8.797 608 HD1 PHE 75 HD2 PHE 75 -14.365 9.900 -8.529 609 HD2 PHE 75 HD1 PHE 75 -10.444 9.729 -6.849 610 HE1 PHE 75 HE2 PHE 75 -15.225 8.608 -6.628 611 HE2 PHE 75 HE1 PHE 75 -11.315 8.432 -4.968 612 HZ PHE 75 HZ PHE 75 -13.698 7.872 -4.845 613 H THR 76 H THR 76 -14.277 13.665 -8.614 614 HA THR 76 HA THR 76 -12.540 15.860 -8.267 615 HB THR 76 HB THR 76 -15.101 15.850 -8.774 616 HG1 THR 76 HG1 THR 76 -14.484 17.863 -8.609 617 HG21 THR 76 3HG2 THR 76 -15.858 14.585 -6.787 618 HG22 THR 76 1HG2 THR 76 -16.606 16.183 -6.863 619 HG23 THR 76 2HG2 THR 76 -15.278 15.882 -5.739 620 HA PRO 77 HA PRO 77 -10.677 15.393 -4.215 621 HB2 PRO 77 2HB PRO 77 -11.093 17.951 -3.096 622 HB3 PRO 77 3HB PRO 77 -9.770 17.497 -4.183 623 HG2 PRO 77 2HG PRO 77 -12.373 18.824 -4.866 624 HG3 PRO 77 3HG PRO 77 -10.732 19.179 -5.457 625 HD2 PRO 77 2HD PRO 77 -12.411 17.814 -6.994 626 HD3 PRO 77 3HD PRO 77 -10.708 17.308 -6.896 627 H GLU 78 H GLU 78 -13.949 16.691 -4.275 628 HA GLU 78 HA GLU 78 -14.608 16.348 -1.548 629 HB2 GLU 78 2HB GLU 78 -16.376 16.437 -4.020 630 HB3 GLU 78 3HB GLU 78 -17.005 16.428 -2.373 631 HG2 GLU 78 2HG GLU 78 -15.878 18.543 -1.888 632 HG3 GLU 78 3HG GLU 78 -15.143 18.545 -3.492 633 H GLU 79 H GLU 79 -14.886 14.148 -4.320 634 HA GLU 79 HA GLU 79 -16.282 12.045 -2.992 635 HB2 GLU 79 2HB GLU 79 -14.455 11.955 -5.441 636 HB3 GLU 79 3HB GLU 79 -15.469 10.619 -4.897 637 HG2 GLU 79 2HG GLU 79 -17.492 11.925 -5.310 638 HG3 GLU 79 3HG GLU 79 -16.517 13.325 -5.759 639 H ILE 80 H ILE 80 -12.859 12.544 -3.765 640 HA ILE 80 HA ILE 80 -11.667 10.285 -2.735 641 HB ILE 80 HB ILE 80 -10.530 13.123 -2.690 642 HG12 ILE 80 2HG1 ILE 80 -10.429 11.002 -4.888 643 HG13 ILE 80 3HG1 ILE 80 -11.340 12.505 -4.942 644 HG21 ILE 80 1HG2 ILE 80 -8.303 12.056 -2.769 645 HG22 ILE 80 2HG2 ILE 80 -9.056 10.463 -2.691 646 HG23 ILE 80 3HG2 ILE 80 -9.189 11.565 -1.322 647 HD11 ILE 80 3HD1 ILE 80 -9.223 13.757 -4.884 648 HD12 ILE 80 1HD1 ILE 80 -9.364 12.689 -6.282 649 HD13 ILE 80 2HD1 ILE 80 -8.345 12.226 -4.921 650 H LYS 81 H LYS 81 -12.134 13.396 -1.018 651 HA LYS 81 HA LYS 81 -11.102 12.536 1.480 652 HB2 LYS 81 2HB LYS 81 -11.978 14.646 2.384 653 HB3 LYS 81 3HB LYS 81 -11.157 14.897 0.849 654 HG2 LYS 81 2HG LYS 81 -13.488 14.818 -0.230 655 HG3 LYS 81 3HG LYS 81 -14.127 14.977 1.403 656 HD2 LYS 81 2HD LYS 81 -12.234 16.944 0.054 657 HD3 LYS 81 3HD LYS 81 -13.984 17.148 0.190 658 HE2 LYS 81 2HE LYS 81 -12.076 16.975 2.550 659 HE3 LYS 81 3HE LYS 81 -12.767 18.460 1.902 660 HZ1 LYS 81 3HZ LYS 81 -14.321 16.213 3.066 661 HZ2 LYS 81 1HZ LYS 81 -14.960 17.660 2.475 662 HZ3 LYS 81 2HZ LYS 81 -13.969 17.673 3.841 663 H SER 82 H SER 82 -14.308 12.293 0.076 664 HA SER 82 HA SER 82 -15.760 11.808 2.490 665 HB2 SER 82 2HB SER 82 -16.866 12.558 0.416 666 HB3 SER 82 3HB SER 82 -16.413 11.063 -0.398 667 HG SER 82 HG SER 82 -18.341 10.505 0.271 668 H PHE 83 H PHE 83 -13.906 9.719 0.314 669 HA PHE 83 HA PHE 83 -14.799 7.252 1.572 670 HB2 PHE 83 2HB PHE 83 -12.577 7.833 -0.419 671 HB3 PHE 83 3HB PHE 83 -12.836 6.227 0.260 672 HD1 PHE 83 HD2 PHE 83 -15.110 5.102 -0.091 673 HD2 PHE 83 HD1 PHE 83 -13.904 8.560 -2.298 674 HE1 PHE 83 HE2 PHE 83 -16.827 4.623 -1.789 675 HE2 PHE 83 HE1 PHE 83 -15.632 8.075 -3.985 676 HZ PHE 83 HZ PHE 83 -17.095 6.110 -3.734 677 H PHE 84 H PHE 84 -12.478 9.660 2.380 678 HA PHE 84 HA PHE 84 -11.148 8.015 4.398 679 HB2 PHE 84 2HB PHE 84 -11.162 11.036 3.927 680 HB3 PHE 84 3HB PHE 84 -10.273 10.262 5.233 681 HD1 PHE 84 HD2 PHE 84 -8.305 8.822 4.733 682 HD2 PHE 84 HD1 PHE 84 -10.303 10.993 1.648 683 HE1 PHE 84 HE2 PHE 84 -6.353 8.546 3.265 684 HE2 PHE 84 HE1 PHE 84 -8.346 10.719 0.186 685 HZ PHE 84 HZ PHE 84 -6.369 9.496 0.996 686 H GLU 85 H GLU 85 -13.680 10.435 4.175 687 HA GLU 85 HA GLU 85 -14.355 10.340 7.041 688 HB2 GLU 85 2HB GLU 85 -15.446 12.143 4.822 689 HB3 GLU 85 3HB GLU 85 -15.661 12.357 6.558 690 HG2 GLU 85 2HG GLU 85 -13.249 12.797 6.819 691 HG3 GLU 85 3HG GLU 85 -13.023 12.535 5.087 692 H ASN 86 H ASN 86 -14.907 7.986 5.718 693 HA ASN 86 HA ASN 86 -17.460 7.878 4.450 694 HB2 ASN 86 2HB ASN 86 -15.477 6.288 4.093 695 HB3 ASN 86 3HB ASN 86 -15.916 5.522 5.614 696 HD21 ASN 86 1HD2 ASN 86 -15.818 4.268 3.069 697 HD22 ASN 86 2HD2 ASN 86 -17.408 3.732 2.674 698 H LYS 87 H LYS 87 -18.951 8.771 5.868 699 HA LYS 87 HA LYS 87 -19.370 7.676 8.547 700 HB2 LYS 87 2HB LYS 87 -20.840 9.874 7.030 701 HB3 LYS 87 3HB LYS 87 -21.146 9.432 8.707 702 HG2 LYS 87 2HG LYS 87 -18.818 10.084 9.291 703 HG3 LYS 87 3HG LYS 87 -18.543 10.566 7.618 704 HD2 LYS 87 2HD LYS 87 -20.646 11.803 9.445 705 HD3 LYS 87 3HD LYS 87 -19.050 12.493 9.143 706 HE2 LYS 87 2HE LYS 87 -19.580 12.788 6.781 707 HE3 LYS 87 3HE LYS 87 -21.135 11.983 6.994 708 HZ1 LYS 87 3HZ LYS 87 -21.884 13.770 8.369 709 HZ2 LYS 87 1HZ LYS 87 -21.276 14.440 6.944 710 HZ3 LYS 87 2HZ LYS 87 -20.363 14.500 8.364 711 H GLY 88 H GLY 88 -19.798 5.537 7.707 712 HA2 GLY 88 2HA GLY 88 -22.410 4.703 7.891 713 HA3 GLY 88 3HA GLY 88 -22.148 4.931 6.159 714 H LYS 89 H LYS 89 -19.642 4.167 5.744 715 HA LYS 89 HA LYS 89 -19.572 1.285 6.492 716 HB2 LYS 89 2HB LYS 89 -18.821 2.588 3.828 717 HB3 LYS 89 3HB LYS 89 -18.646 0.880 4.205 718 HG2 LYS 89 2HG LYS 89 -21.265 2.392 4.040 719 HG3 LYS 89 3HG LYS 89 -20.622 1.327 2.794 720 HD2 LYS 89 2HD LYS 89 -21.399 0.469 5.609 721 HD3 LYS 89 3HD LYS 89 -22.388 0.232 4.168 722 HE2 LYS 89 2HE LYS 89 -20.687 -1.244 3.203 723 HE3 LYS 89 3HE LYS 89 -19.615 -0.946 4.574 724 HZ1 LYS 89 3HZ LYS 89 -21.283 -1.976 6.021 725 HZ2 LYS 89 1HZ LYS 89 -20.741 -3.050 4.831 726 HZ3 LYS 89 2HZ LYS 89 -22.256 -2.308 4.680 727 H ARG 90 H ARG 90 -17.254 0.442 5.706 728 HA ARG 90 HA ARG 90 -15.253 1.730 7.304 729 HB2 ARG 90 2HB ARG 90 -15.300 -0.689 7.141 730 HB3 ARG 90 3HB ARG 90 -15.173 -0.637 5.386 731 HG2 ARG 90 2HG ARG 90 -12.875 0.004 5.468 732 HG3 ARG 90 3HG ARG 90 -12.970 0.415 7.182 733 HD2 ARG 90 2HD ARG 90 -13.222 -2.381 6.027 734 HD3 ARG 90 3HD ARG 90 -11.787 -1.721 6.818 735 HE ARG 90 HE ARG 90 -13.717 -1.385 8.694 736 HH11 ARG 90 1HH1 ARG 90 -12.734 -4.240 6.884 737 HH12 ARG 90 2HH1 ARG 90 -13.185 -5.340 8.143 738 HH21 ARG 90 1HH2 ARG 90 -14.295 -2.845 10.336 739 HH22 ARG 90 2HH2 ARG 90 -14.068 -4.548 10.095 740 HA PRO 91 HA PRO 91 -13.702 4.643 4.181 741 HB2 PRO 91 2HB PRO 91 -11.094 4.236 5.652 742 HB3 PRO 91 3HB PRO 91 -11.920 5.748 5.216 743 HG2 PRO 91 2HG PRO 91 -11.971 4.877 7.725 744 HG3 PRO 91 3HG PRO 91 -13.417 5.606 6.995 745 HD2 PRO 91 2HD PRO 91 -12.825 2.703 7.507 746 HD3 PRO 91 3HD PRO 91 -14.359 3.588 7.664 747 H VAL 92 H VAL 92 -13.240 4.049 2.153 748 HA VAL 92 HA VAL 92 -11.756 1.691 1.413 749 HB VAL 92 HB VAL 92 -12.689 4.035 -0.324 750 HG11 VAL 92 1HG1 VAL 92 -11.777 1.263 -1.192 751 HG12 VAL 92 2HG1 VAL 92 -10.890 2.768 -1.431 752 HG13 VAL 92 3HG1 VAL 92 -12.428 2.517 -2.253 753 HG21 VAL 92 3HG2 VAL 92 -14.573 2.920 0.795 754 HG22 VAL 92 1HG2 VAL 92 -14.036 1.353 0.184 755 HG23 VAL 92 2HG2 VAL 92 -14.601 2.595 -0.938 756 H PHE 93 H PHE 93 -11.211 5.189 1.285 757 HA PHE 93 HA PHE 93 -8.303 4.827 1.007 758 HB2 PHE 93 2HB PHE 93 -9.981 7.374 1.046 759 HB3 PHE 93 3HB PHE 93 -8.245 7.296 0.767 760 HD1 PHE 93 HD1 PHE 93 -8.503 4.718 -1.083 761 HD2 PHE 93 HD2 PHE 93 -10.394 8.558 -1.037 762 HE1 PHE 93 HE1 PHE 93 -8.874 4.573 -3.505 763 HE2 PHE 93 HE2 PHE 93 -10.760 8.393 -3.457 764 HZ PHE 93 HZ PHE 93 -10.005 6.404 -4.699 765 H VAL 94 H VAL 94 -7.255 4.545 2.875 766 HA VAL 94 HA VAL 94 -8.321 5.705 5.392 767 HB VAL 94 HB VAL 94 -6.553 3.227 5.050 768 HG11 VAL 94 1HG1 VAL 94 -6.208 4.342 7.196 769 HG12 VAL 94 2HG1 VAL 94 -7.051 2.813 7.426 770 HG13 VAL 94 3HG1 VAL 94 -7.947 4.330 7.511 771 HG21 VAL 94 3HG2 VAL 94 -8.528 1.882 5.630 772 HG22 VAL 94 1HG2 VAL 94 -8.819 2.811 4.158 773 HG23 VAL 94 2HG2 VAL 94 -9.529 3.336 5.687 774 H LYS 95 H LYS 95 -6.822 6.670 6.835 775 HA LYS 95 HA LYS 95 -3.985 6.808 6.167 776 HB2 LYS 95 2HB LYS 95 -3.896 9.269 6.329 777 HB3 LYS 95 3HB LYS 95 -4.890 8.750 4.974 778 HG2 LYS 95 2HG LYS 95 -6.931 9.234 6.228 779 HG3 LYS 95 3HG LYS 95 -5.989 9.680 7.652 780 HD2 LYS 95 2HD LYS 95 -5.876 11.122 4.965 781 HD3 LYS 95 3HD LYS 95 -6.799 11.668 6.367 782 HE2 LYS 95 2HE LYS 95 -4.730 11.922 7.661 783 HE3 LYS 95 3HE LYS 95 -3.788 11.302 6.303 784 HZ1 LYS 95 3HZ LYS 95 -3.724 13.716 6.441 785 HZ2 LYS 95 1HZ LYS 95 -5.401 13.793 6.268 786 HZ3 LYS 95 2HZ LYS 95 -4.445 13.208 5.000 787 H GLY 96 H GLY 96 -2.798 8.077 7.905 788 HA2 GLY 96 2HA GLY 96 -3.117 8.924 10.292 789 HA3 GLY 96 3HA GLY 96 -3.827 7.335 10.592 790 H SER 97 H SER 97 -2.112 6.914 12.153 791 HA SER 97 HA SER 97 0.617 6.560 11.290 792 HB2 SER 97 2HB SER 97 0.023 6.789 13.693 793 HB3 SER 97 3HB SER 97 -0.895 5.285 13.629 794 HG SER 97 HG SER 97 1.053 4.685 14.398 795 H LEU 98 H LEU 98 1.617 4.252 11.266 796 HA LEU 98 HA LEU 98 0.469 2.668 9.241 797 HB2 LEU 98 2HB LEU 98 2.883 2.679 9.754 798 HB3 LEU 98 3HB LEU 98 2.575 1.935 11.314 799 HG LEU 98 HG LEU 98 1.773 -0.135 10.136 800 HD11 LEU 98 1HD1 LEU 98 1.035 0.854 8.018 801 HD12 LEU 98 2HD1 LEU 98 2.185 -0.449 7.745 802 HD13 LEU 98 3HD1 LEU 98 2.707 1.229 7.590 803 HD21 LEU 98 3HD2 LEU 98 3.985 -0.932 9.436 804 HD22 LEU 98 1HD2 LEU 98 4.084 0.004 10.925 805 HD23 LEU 98 2HD2 LEU 98 4.587 0.728 9.394 806 H GLU 99 H GLU 99 0.346 2.425 12.759 807 HA GLU 99 HA GLU 99 -1.064 -0.085 12.872 808 HB2 GLU 99 2HB GLU 99 -0.824 2.005 15.085 809 HB3 GLU 99 3HB GLU 99 -1.283 0.318 15.267 810 HG2 GLU 99 2HG GLU 99 0.925 0.323 16.015 811 HG3 GLU 99 3HG GLU 99 1.100 -0.218 14.346 812 H SER 100 H SER 100 -1.974 3.354 13.268 813 HA SER 100 HA SER 100 -4.675 3.066 13.966 814 HB2 SER 100 2HB SER 100 -3.388 5.351 12.394 815 HB3 SER 100 3HB SER 100 -4.896 5.446 13.299 816 HG SER 100 HG SER 100 -3.689 5.029 15.198 817 H ALA 101 H ALA 101 -3.167 3.553 10.807 818 HA ALA 101 HA ALA 101 -5.517 3.598 9.230 819 HB1 ALA 101 3HB ALA 101 -3.399 4.609 8.505 820 HB2 ALA 101 1HB ALA 101 -3.974 3.441 7.313 821 HB3 ALA 101 2HB ALA 101 -2.650 3.014 8.404 822 H ALA 102 H ALA 102 -3.472 1.022 10.421 823 HA ALA 102 HA ALA 102 -4.360 -1.105 8.767 824 HB1 ALA 102 3HB ALA 102 -3.403 -2.550 10.500 825 HB2 ALA 102 1HB ALA 102 -3.294 -1.174 11.607 826 HB3 ALA 102 2HB ALA 102 -2.326 -1.204 10.132 827 H GLU 103 H GLU 103 -5.364 0.064 11.968 828 HA GLU 103 HA GLU 103 -7.346 -1.864 12.551 829 HB2 GLU 103 2HB GLU 103 -7.175 1.028 13.526 830 HB3 GLU 103 3HB GLU 103 -8.115 -0.258 14.282 831 HG2 GLU 103 2HG GLU 103 -6.012 -1.490 14.754 832 HG3 GLU 103 3HG GLU 103 -5.105 -0.181 14.022 833 H GLN 104 H GLN 104 -7.568 1.321 11.020 834 HA GLN 104 HA GLN 104 -10.404 1.380 10.676 835 HB2 GLN 104 2HB GLN 104 -8.208 2.869 9.191 836 HB3 GLN 104 3HB GLN 104 -9.924 3.250 9.082 837 HG2 GLN 104 2HG GLN 104 -9.990 3.918 11.400 838 HG3 GLN 104 3HG GLN 104 -8.335 3.355 11.655 839 HE21 GLN 104 1HE2 GLN 104 -6.623 4.572 10.845 840 HE22 GLN 104 2HE2 GLN 104 -6.812 6.199 10.313 841 H ALA 105 H ALA 105 -7.738 0.240 8.607 842 HA ALA 105 HA ALA 105 -9.441 -0.349 6.325 843 HB1 ALA 105 3HB ALA 105 -6.549 -1.112 6.865 844 HB2 ALA 105 1HB ALA 105 -7.106 0.309 5.981 845 HB3 ALA 105 2HB ALA 105 -7.398 -1.302 5.326 846 H GLY 106 H GLY 106 -8.665 -1.944 9.258 847 HA2 GLY 106 2HA GLY 106 -9.490 -3.901 10.133 848 HA3 GLY 106 3HA GLY 106 -10.337 -4.195 8.622 849 H ILE 107 H ILE 107 -6.891 -3.683 8.970 850 HA ILE 107 HA ILE 107 -6.285 -6.410 7.996 851 HB ILE 107 HB ILE 107 -4.338 -4.070 8.215 852 HG12 ILE 107 2HG1 ILE 107 -5.947 -4.771 5.714 853 HG13 ILE 107 3HG1 ILE 107 -6.293 -3.403 6.768 854 HG21 ILE 107 1HG2 ILE 107 -4.288 -6.556 6.457 855 HG22 ILE 107 2HG2 ILE 107 -3.340 -6.315 7.925 856 HG23 ILE 107 3HG2 ILE 107 -3.052 -5.299 6.514 857 HD11 ILE 107 3HD1 ILE 107 -5.072 -2.680 4.834 858 HD12 ILE 107 1HD1 ILE 107 -3.772 -3.821 5.168 859 HD13 ILE 107 2HD1 ILE 107 -4.072 -2.472 6.271 860 H VAL 108 H VAL 108 -4.628 -7.666 9.126 861 HA VAL 108 HA VAL 108 -4.477 -7.346 11.955 862 HB VAL 108 HB VAL 108 -2.650 -9.052 10.216 863 HG11 VAL 108 1HG1 VAL 108 -2.329 -10.424 12.245 864 HG12 VAL 108 2HG1 VAL 108 -3.325 -9.295 13.165 865 HG13 VAL 108 3HG1 VAL 108 -1.785 -8.761 12.489 866 HG21 VAL 108 3HG2 VAL 108 -4.992 -9.614 9.745 867 HG22 VAL 108 1HG2 VAL 108 -5.310 -9.817 11.471 868 HG23 VAL 108 2HG2 VAL 108 -4.215 -10.922 10.637 869 H VAL 109 H VAL 109 -3.547 -5.634 12.753 870 HA VAL 109 HA VAL 109 -1.683 -3.895 11.702 871 HB VAL 109 HB VAL 109 -2.131 -4.490 14.657 872 HG11 VAL 109 1HG1 VAL 109 -1.421 -2.160 15.070 873 HG12 VAL 109 2HG1 VAL 109 -1.070 -1.966 13.352 874 HG13 VAL 109 3HG1 VAL 109 -0.138 -3.109 14.318 875 HG21 VAL 109 3HG2 VAL 109 -3.856 -2.746 14.656 876 HG22 VAL 109 1HG2 VAL 109 -4.270 -4.016 13.502 877 HG23 VAL 109 2HG2 VAL 109 -3.616 -2.482 12.929 878 H ASP 110 H ASP 110 -1.190 -6.631 13.861 879 HA ASP 110 HA ASP 110 1.476 -6.487 14.522 880 HB2 ASP 110 2HB ASP 110 -0.226 -8.110 15.439 881 HB3 ASP 110 3HB ASP 110 -0.114 -9.045 13.955 882 H GLU 111 H GLU 111 0.029 -8.116 11.692 883 HA GLU 111 HA GLU 111 2.458 -9.188 10.681 884 HB2 GLU 111 2HB GLU 111 -0.251 -8.796 9.368 885 HB3 GLU 111 3HB GLU 111 1.089 -9.626 8.592 886 HG2 GLU 111 2HG GLU 111 -0.263 -10.484 11.157 887 HG3 GLU 111 3HG GLU 111 -0.524 -11.199 9.567 888 H LEU 112 H LEU 112 0.515 -6.286 9.704 889 HA LEU 112 HA LEU 112 2.304 -5.730 7.535 890 HB2 LEU 112 2HB LEU 112 1.106 -3.564 7.258 891 HB3 LEU 112 3HB LEU 112 0.111 -4.999 7.186 892 HG LEU 112 HG LEU 112 -0.588 -4.488 9.609 893 HD11 LEU 112 1HD1 LEU 112 1.135 -2.871 10.233 894 HD12 LEU 112 2HD1 LEU 112 -0.466 -2.154 10.362 895 HD13 LEU 112 3HD1 LEU 112 0.572 -1.754 8.988 896 HD21 LEU 112 3HD2 LEU 112 -1.977 -4.116 7.573 897 HD22 LEU 112 1HD2 LEU 112 -1.411 -2.447 7.531 898 HD23 LEU 112 2HD2 LEU 112 -2.347 -3.041 8.907 899 H VAL 113 H VAL 113 2.184 -4.559 10.863 900 HA VAL 113 HA VAL 113 4.125 -2.525 10.626 901 HB VAL 113 HB VAL 113 3.419 -4.247 13.056 902 HG11 VAL 113 1HG1 VAL 113 5.725 -3.437 13.355 903 HG12 VAL 113 2HG1 VAL 113 4.637 -2.591 14.452 904 HG13 VAL 113 3HG1 VAL 113 5.218 -1.785 12.991 905 HG21 VAL 113 3HG2 VAL 113 2.242 -2.217 13.849 906 HG22 VAL 113 1HG2 VAL 113 1.618 -2.739 12.284 907 HG23 VAL 113 2HG2 VAL 113 2.711 -1.360 12.379 908 H GLN 114 H GLN 114 4.380 -6.028 11.126 909 HA GLN 114 HA GLN 114 7.191 -6.183 11.413 910 HB2 GLN 114 2HB GLN 114 5.154 -8.212 10.444 911 HB3 GLN 114 3HB GLN 114 6.864 -8.599 10.559 912 HG2 GLN 114 2HG GLN 114 5.104 -7.736 12.867 913 HG3 GLN 114 3HG GLN 114 5.596 -9.389 12.512 914 HE21 GLN 114 1HE2 GLN 114 6.577 -6.336 13.828 915 HE22 GLN 114 2HE2 GLN 114 8.102 -6.857 14.445 916 H THR 115 H THR 115 5.157 -6.574 8.438 917 HA THR 115 HA THR 115 7.420 -7.153 6.803 918 HB THR 115 HB THR 115 5.140 -7.964 6.204 919 HG1 THR 115 HG1 THR 115 6.385 -6.351 4.190 920 HG21 THR 115 3HG2 THR 115 3.829 -5.933 6.689 921 HG22 THR 115 1HG2 THR 115 3.548 -6.496 5.042 922 HG23 THR 115 2HG2 THR 115 4.595 -5.104 5.337 923 H VAL 116 H VAL 116 5.918 -4.113 7.725 924 HA VAL 116 HA VAL 116 7.248 -2.561 5.646 925 HB VAL 116 HB VAL 116 5.532 -1.695 8.021 926 HG11 VAL 116 1HG1 VAL 116 5.492 0.581 7.045 927 HG12 VAL 116 2HG1 VAL 116 6.690 0.091 5.844 928 HG13 VAL 116 3HG1 VAL 116 7.116 0.119 7.556 929 HG21 VAL 116 3HG2 VAL 116 3.842 -1.139 6.305 930 HG22 VAL 116 1HG2 VAL 116 4.290 -2.845 6.231 931 HG23 VAL 116 2HG2 VAL 116 4.927 -1.714 5.036 932 H LYS 117 H LYS 117 7.761 -3.225 9.134 933 HA LYS 117 HA LYS 117 9.910 -1.301 9.384 934 HB2 LYS 117 2HB LYS 117 10.237 -2.090 11.631 935 HB3 LYS 117 3HB LYS 117 8.502 -2.064 11.349 936 HG2 LYS 117 2HG LYS 117 8.553 -4.528 10.977 937 HG3 LYS 117 3HG LYS 117 10.273 -4.533 11.349 938 HD2 LYS 117 2HD LYS 117 8.055 -3.704 13.266 939 HD3 LYS 117 3HD LYS 117 8.895 -5.252 13.282 940 HE2 LYS 117 2HE LYS 117 11.013 -4.124 13.820 941 HE3 LYS 117 3HE LYS 117 10.208 -2.555 13.750 942 HZ1 LYS 117 3HZ LYS 117 9.650 -4.730 15.699 943 HZ2 LYS 117 1HZ LYS 117 8.784 -3.279 15.602 944 HZ3 LYS 117 2HZ LYS 117 10.424 -3.262 16.024 945 H ASN 118 H ASN 118 9.690 -4.797 8.834 946 HA ASN 118 HA ASN 118 12.494 -5.320 8.776 947 HB2 ASN 118 2HB ASN 118 10.173 -6.883 7.533 948 HB3 ASN 118 3HB ASN 118 11.843 -7.449 7.551 949 HD21 ASN 118 1HD2 ASN 118 9.420 -8.604 8.776 950 HD22 ASN 118 2HD2 ASN 118 9.779 -8.785 10.454 951 H TYR 119 H TYR 119 10.062 -4.453 6.331 952 HA TYR 119 HA TYR 119 11.522 -4.440 4.001 953 HB2 TYR 119 2HB TYR 119 9.132 -3.891 4.050 954 HB3 TYR 119 3HB TYR 119 9.468 -2.394 4.900 955 HD1 TYR 119 HD1 TYR 119 10.830 -3.987 1.751 956 HD2 TYR 119 HD2 TYR 119 9.003 -0.564 3.536 957 HE1 TYR 119 HE1 TYR 119 10.867 -2.824 -0.419 958 HE2 TYR 119 HE2 TYR 119 9.046 0.598 1.379 959 HH TYR 119 HH TYR 119 9.885 0.554 -0.741 960 H GLN 120 H GLN 120 11.140 -1.645 6.194 961 HA GLN 120 HA GLN 120 13.123 -0.066 4.960 962 HB2 GLN 120 2HB GLN 120 11.796 0.131 7.693 963 HB3 GLN 120 3HB GLN 120 12.932 1.337 7.087 964 HG2 GLN 120 2HG GLN 120 11.374 1.549 5.041 965 HG3 GLN 120 3HG GLN 120 10.211 0.624 5.982 966 HE21 GLN 120 1HE2 GLN 120 8.948 2.593 5.563 967 HE22 GLN 120 2HE2 GLN 120 9.088 3.930 6.646 968 H GLY 121 H GLY 121 13.374 -2.623 7.280 969 HA2 GLY 121 2HA GLY 121 15.959 -2.030 8.356 970 HA3 GLY 121 3HA GLY 121 15.152 -3.598 8.354 971 H TYR 122 H TYR 122 14.851 -4.120 5.643 972 HA TYR 122 HA TYR 122 17.618 -4.735 4.973 973 HB2 TYR 122 2HB TYR 122 16.719 -6.283 3.254 974 HB3 TYR 122 3HB TYR 122 16.268 -6.652 4.898 975 HD1 TYR 122 HD2 TYR 122 14.800 -4.786 1.938 976 HD2 TYR 122 HD1 TYR 122 14.118 -7.475 5.192 977 HE1 TYR 122 HE2 TYR 122 12.481 -5.125 1.200 978 HE2 TYR 122 HE1 TYR 122 11.809 -7.810 4.435 979 HH TYR 122 HH TYR 122 10.661 -6.633 1.414 980 H VAL 123 H VAL 123 15.289 -2.440 3.939 981 HA VAL 123 HA VAL 123 16.227 -1.754 1.387 982 HB VAL 123 HB VAL 123 15.127 0.070 3.586 983 HG11 VAL 123 1HG1 VAL 123 15.805 0.842 0.715 984 HG12 VAL 123 2HG1 VAL 123 16.552 1.475 2.182 985 HG13 VAL 123 3HG1 VAL 123 14.866 1.841 1.829 986 HG21 VAL 123 3HG2 VAL 123 13.083 0.150 2.218 987 HG22 VAL 123 1HG2 VAL 123 13.497 -1.522 2.591 988 HG23 VAL 123 2HG2 VAL 123 13.838 -0.872 0.992 989 H GLN 124 H GLN 124 17.243 -0.480 4.553 990 HA GLN 124 HA GLN 124 19.445 1.035 3.542 991 HB2 GLN 124 2HB GLN 124 20.007 1.382 5.959 992 HB3 GLN 124 3HB GLN 124 18.338 1.769 5.555 993 HG2 GLN 124 2HG GLN 124 17.639 -0.441 6.442 994 HG3 GLN 124 3HG GLN 124 19.305 -0.746 6.925 995 HE21 GLN 124 1HE2 GLN 124 16.866 -0.583 8.544 996 HE22 GLN 124 2HE2 GLN 124 17.174 0.621 9.733 997 H ASP 125 H ASP 125 19.080 -2.279 4.502 998 HA ASP 125 HA ASP 125 21.854 -2.898 4.937 999 HB2 ASP 125 2HB ASP 125 19.993 -4.308 5.809 1000 HB3 ASP 125 3HB ASP 125 19.534 -4.738 4.171 1001 H GLY 126 H GLY 126 19.797 -2.565 2.129 1002 HA2 GLY 126 2HA GLY 126 20.401 -2.328 -0.101 1003 HA3 GLY 126 3HA GLY 126 22.051 -2.766 0.310 1004 H HIS 127 H HIS 127 19.706 -4.966 1.468 1005 HA HIS 127 HA HIS 127 19.777 -6.679 -0.929 1006 HB2 HIS 127 2HB HIS 127 21.639 -7.466 0.542 1007 HB3 HIS 127 3HB HIS 127 20.516 -7.632 1.886 1008 HD1 HIS 127 HD1 HIS 127 21.834 -9.393 -1.070 1009 HD2 HIS 127 HD2 HIS 127 18.663 -9.872 1.586 1010 HE1 HIS 127 HE1 HIS 127 21.063 -11.763 -1.356 1011 HE2 HIS 127 HE2 HIS 127 19.215 -12.054 0.319 1012 H ASP 128 H ASP 128 17.710 -7.044 -1.395 1013 HA ASP 128 HA ASP 128 15.630 -6.493 0.492 1014 HB2 ASP 128 2HB ASP 128 14.175 -6.419 -1.290 1015 HB3 ASP 128 3HB ASP 128 15.682 -6.137 -2.148 1016 H HIS 129 H HIS 129 13.765 -7.957 0.702 1017 HA HIS 129 HA HIS 129 14.264 -10.825 0.622 1018 HB2 HIS 129 2HB HIS 129 13.554 -9.357 3.207 1019 HB3 HIS 129 3HB HIS 129 13.357 -11.086 3.005 1020 HD1 HIS 129 HD1 HIS 129 15.366 -12.530 3.500 1021 HD2 HIS 129 HD2 HIS 129 16.343 -8.500 3.244 1022 HE1 HIS 129 HE1 HIS 129 17.756 -12.358 4.260 1023 HE2 HIS 129 HE2 HIS 129 18.234 -9.900 4.282 1024 H ASP 130 H ASP 130 12.569 -8.481 -0.517 1025 HA ASP 130 HA ASP 130 9.841 -8.844 0.174 1026 HB2 ASP 130 2HB ASP 130 11.037 -7.853 -2.466 1027 HB3 ASP 130 3HB ASP 130 9.357 -7.678 -1.986 1028 H PHE 131 H PHE 131 11.294 -9.579 -2.966 1029 HA PHE 131 HA PHE 131 10.450 -12.350 -3.067 1030 HB2 PHE 131 2HB PHE 131 9.189 -10.225 -4.874 1031 HB3 PHE 131 3HB PHE 131 9.203 -11.936 -5.298 1032 HD1 PHE 131 HD1 PHE 131 7.981 -13.582 -3.807 1033 HD2 PHE 131 HD2 PHE 131 7.531 -9.348 -3.358 1034 HE1 PHE 131 HE1 PHE 131 5.910 -13.931 -2.518 1035 HE2 PHE 131 HE2 PHE 131 5.465 -9.714 -2.069 1036 HZ PHE 131 HZ PHE 131 4.656 -11.999 -1.656 1037 H GLY 132 H GLY 132 12.841 -10.421 -3.233 1038 HA2 GLY 132 2HA GLY 132 14.899 -10.588 -4.222 1039 HA3 GLY 132 3HA GLY 132 14.264 -11.747 -5.391 1040 H ARG 133 H ARG 133 13.406 -8.373 -4.591 1041 HA ARG 133 HA ARG 133 13.482 -7.496 -7.368 1042 HB2 ARG 133 2HB ARG 133 12.916 -5.244 -6.460 1043 HB3 ARG 133 3HB ARG 133 11.806 -6.474 -5.863 1044 HG2 ARG 133 2HG ARG 133 12.674 -6.404 -3.685 1045 HG3 ARG 133 3HG ARG 133 14.208 -5.706 -4.214 1046 HD2 ARG 133 2HD ARG 133 12.897 -4.074 -2.983 1047 HD3 ARG 133 3HD ARG 133 13.095 -3.569 -4.658 1048 HE ARG 133 HE ARG 133 10.679 -4.742 -4.724 1049 HH11 ARG 133 1HH1 ARG 133 12.016 -2.368 -2.507 1050 HH12 ARG 133 2HH1 ARG 133 10.487 -1.623 -2.179 1051 HH21 ARG 133 1HH2 ARG 133 8.667 -3.696 -4.322 1052 HH22 ARG 133 2HH2 ARG 133 8.598 -2.374 -3.201 1053 H ASP 134 H ASP 134 14.704 -5.150 -7.527 1054 HA ASP 134 HA ASP 134 17.551 -5.662 -7.014 1055 HB2 ASP 134 2HB ASP 134 16.617 -4.830 -9.265 1056 HB3 ASP 134 3HB ASP 134 16.318 -3.288 -8.484 1057 HA PRO 135 HA PRO 135 17.707 -3.122 -3.293 1058 HB2 PRO 135 2HB PRO 135 20.253 -1.957 -3.595 1059 HB3 PRO 135 3HB PRO 135 19.928 -3.558 -2.907 1060 HG2 PRO 135 2HG PRO 135 20.742 -2.848 -5.701 1061 HG3 PRO 135 3HG PRO 135 21.287 -4.189 -4.672 1062 HD2 PRO 135 2HD PRO 135 19.518 -4.633 -6.617 1063 HD3 PRO 135 3HD PRO 135 19.346 -5.452 -5.047 1064 H LYS 136 H LYS 136 18.035 -1.583 -6.443 1065 HA LYS 136 HA LYS 136 17.967 1.129 -5.434 1066 HB2 LYS 136 2HB LYS 136 17.788 1.858 -7.728 1067 HB3 LYS 136 3HB LYS 136 18.924 0.516 -7.687 1068 HG2 LYS 136 2HG LYS 136 17.170 -0.992 -8.539 1069 HG3 LYS 136 3HG LYS 136 16.023 0.347 -8.544 1070 HD2 LYS 136 2HD LYS 136 16.812 -0.018 -10.803 1071 HD3 LYS 136 3HD LYS 136 17.449 1.523 -10.232 1072 HE2 LYS 136 2HE LYS 136 19.630 0.483 -9.817 1073 HE3 LYS 136 3HE LYS 136 18.992 -1.092 -10.293 1074 HZ1 LYS 136 3HZ LYS 136 20.220 -0.084 -12.096 1075 HZ2 LYS 136 1HZ LYS 136 19.230 1.288 -12.057 1076 HZ3 LYS 136 2HZ LYS 136 18.585 -0.206 -12.513 1077 H TYR 137 H TYR 137 15.549 -1.273 -6.072 1078 HA TYR 137 HA TYR 137 13.305 0.601 -6.160 1079 HB2 TYR 137 2HB TYR 137 13.440 -2.444 -6.203 1080 HB3 TYR 137 3HB TYR 137 11.914 -1.551 -6.208 1081 HD1 TYR 137 HD1 TYR 137 14.938 -2.355 -8.160 1082 HD2 TYR 137 HD2 TYR 137 11.211 -0.280 -8.197 1083 HE1 TYR 137 HE1 TYR 137 15.179 -1.969 -10.567 1084 HE2 TYR 137 HE2 TYR 137 11.448 0.092 -10.614 1085 HH TYR 137 HH TYR 137 13.916 -1.418 -12.507 1086 H LEU 138 H LEU 138 15.125 -0.969 -3.782 1087 HA LEU 138 HA LEU 138 13.251 -1.033 -1.646 1088 HB2 LEU 138 2HB LEU 138 16.282 -0.839 -1.736 1089 HB3 LEU 138 3HB LEU 138 15.389 -0.961 -0.233 1090 HG LEU 138 HG LEU 138 15.399 -3.067 -2.431 1091 HD11 LEU 138 1HD1 LEU 138 17.569 -2.935 -1.282 1092 HD12 LEU 138 2HD1 LEU 138 16.732 -4.436 -0.905 1093 HD13 LEU 138 3HD1 LEU 138 16.767 -3.130 0.281 1094 HD21 LEU 138 3HD2 LEU 138 13.272 -3.029 -1.210 1095 HD22 LEU 138 1HD2 LEU 138 14.132 -3.156 0.329 1096 HD23 LEU 138 2HD2 LEU 138 14.188 -4.484 -0.836 1097 H HIS 139 H HIS 139 12.073 0.830 -1.504 1098 HA HIS 139 HA HIS 139 13.464 3.342 -0.729 1099 HB2 HIS 139 2HB HIS 139 10.991 2.948 -2.475 1100 HB3 HIS 139 3HB HIS 139 11.269 4.464 -1.626 1101 HD1 HIS 139 HD1 HIS 139 12.117 6.125 -3.254 1102 HD2 HIS 139 HD2 HIS 139 13.711 2.352 -3.966 1103 HE1 HIS 139 HE1 HIS 139 13.666 6.403 -5.211 1104 HE2 HIS 139 HE2 HIS 139 14.729 4.144 -5.519 1105 H GLN 140 H GLN 140 13.105 3.764 1.376 1106 HA GLN 140 HA GLN 140 11.111 2.459 2.972 1107 HB2 GLN 140 2HB GLN 140 12.772 4.919 3.681 1108 HB3 GLN 140 3HB GLN 140 11.919 3.878 4.810 1109 HG2 GLN 140 2HG GLN 140 13.386 2.010 4.248 1110 HG3 GLN 140 3HG GLN 140 14.218 3.002 3.067 1111 HE21 GLN 140 1HE2 GLN 140 15.366 1.611 5.320 1112 HE22 GLN 140 2HE2 GLN 140 16.133 2.810 6.294 1113 H PHE 141 H PHE 141 9.157 3.254 3.734 1114 HA PHE 141 HA PHE 141 7.820 5.356 2.356 1115 HB2 PHE 141 2HB PHE 141 7.035 3.933 4.937 1116 HB3 PHE 141 3HB PHE 141 5.973 4.963 3.983 1117 HD1 PHE 141 HD1 PHE 141 5.570 4.261 1.512 1118 HD2 PHE 141 HD2 PHE 141 7.059 1.598 4.512 1119 HE1 PHE 141 HE1 PHE 141 4.838 2.336 0.186 1120 HE2 PHE 141 HE2 PHE 141 6.322 -0.322 3.170 1121 HZ PHE 141 HZ PHE 141 5.215 0.043 0.996 1122 H GLU 142 H GLU 142 8.886 7.279 2.600 1123 HA GLU 142 HA GLU 142 9.770 8.224 5.198 1124 HB2 GLU 142 2HB GLU 142 10.573 10.238 3.904 1125 HB3 GLU 142 3HB GLU 142 11.279 8.704 3.416 1126 HG2 GLU 142 2HG GLU 142 9.821 8.630 1.444 1127 HG3 GLU 142 3HG GLU 142 9.043 10.133 1.941 1128 H GLY 143 H GLY 143 8.047 8.622 6.452 1129 HA2 GLY 143 2HA GLY 143 6.901 11.047 6.707 1130 HA3 GLY 143 3HA GLY 143 5.779 10.237 5.617 1131 H GLU 144 H GLU 144 5.360 11.177 8.363 1132 HA GLU 144 HA GLU 144 5.216 8.895 10.114 1133 HB2 GLU 144 2HB GLU 144 3.872 11.632 10.342 1134 HB3 GLU 144 3HB GLU 144 3.986 10.435 11.630 1135 HG2 GLU 144 2HG GLU 144 6.438 10.642 11.640 1136 HG3 GLU 144 3HG GLU 144 6.354 11.797 10.315 1137 H THR 145 H THR 145 2.973 10.568 7.943 1138 HA THR 145 HA THR 145 0.692 8.927 8.755 1139 HB THR 145 HB THR 145 0.804 11.114 6.624 1140 HG1 THR 145 HG1 THR 145 0.595 11.169 9.399 1141 HG21 THR 145 3HG2 THR 145 -1.571 9.858 8.068 1142 HG22 THR 145 1HG2 THR 145 -1.144 9.584 6.377 1143 HG23 THR 145 2HG2 THR 145 -1.650 11.187 6.911 1144 H PHE 146 H PHE 146 0.547 6.961 7.908 1145 HA PHE 146 HA PHE 146 1.295 6.289 5.155 1146 HB2 PHE 146 2HB PHE 146 0.305 4.719 7.560 1147 HB3 PHE 146 3HB PHE 146 0.219 4.001 5.957 1148 HD1 PHE 146 HD2 PHE 146 2.621 5.437 8.453 1149 HD2 PHE 146 HD1 PHE 146 2.112 3.004 4.973 1150 HE1 PHE 146 HE2 PHE 146 4.957 4.667 8.630 1151 HE2 PHE 146 HE1 PHE 146 4.436 2.251 5.161 1152 HZ PHE 146 HZ PHE 146 5.863 3.074 6.984 1153 H TYR 147 H TYR 147 -0.165 5.782 3.560 1154 HA TYR 147 HA TYR 147 -3.068 6.082 4.087 1155 HB2 TYR 147 2HB TYR 147 -1.440 6.833 1.617 1156 HB3 TYR 147 3HB TYR 147 -3.191 6.656 1.576 1157 HD1 TYR 147 HD1 TYR 147 -0.481 8.557 3.366 1158 HD2 TYR 147 HD2 TYR 147 -4.546 8.525 2.068 1159 HE1 TYR 147 HE1 TYR 147 -0.738 10.889 4.090 1160 HE2 TYR 147 HE2 TYR 147 -4.791 10.857 2.790 1161 HH TYR 147 HH TYR 147 -2.123 12.815 3.642 1162 H ILE 148 H ILE 148 -4.004 4.152 4.065 1163 HA ILE 148 HA ILE 148 -2.937 1.963 2.377 1164 HB ILE 148 HB ILE 148 -4.761 1.832 4.829 1165 HG12 ILE 148 2HG1 ILE 148 -1.847 0.986 4.424 1166 HG13 ILE 148 3HG1 ILE 148 -2.416 2.310 5.430 1167 HG21 ILE 148 1HG2 ILE 148 -4.598 -0.624 4.631 1168 HG22 ILE 148 2HG2 ILE 148 -3.679 -0.452 3.135 1169 HG23 ILE 148 3HG2 ILE 148 -5.361 0.076 3.205 1170 HD11 ILE 148 3HD1 ILE 148 -3.517 0.681 6.914 1171 HD12 ILE 148 1HD1 ILE 148 -1.776 0.435 6.789 1172 HD13 ILE 148 2HD1 ILE 148 -2.877 -0.631 5.918 1173 H ILE 149 H ILE 149 -3.984 1.641 0.539 1174 HA ILE 149 HA ILE 149 -6.716 2.699 0.133 1175 HB ILE 149 HB ILE 149 -4.604 1.931 -1.942 1176 HG12 ILE 149 2HG1 ILE 149 -3.759 3.843 -0.711 1177 HG13 ILE 149 3HG1 ILE 149 -4.327 4.423 -2.267 1178 HG21 ILE 149 1HG2 ILE 149 -6.874 1.780 -2.848 1179 HG22 ILE 149 2HG2 ILE 149 -6.022 3.150 -3.556 1180 HG23 ILE 149 3HG2 ILE 149 -7.232 3.422 -2.301 1181 HD11 ILE 149 3HD1 ILE 149 -4.917 5.974 -0.517 1182 HD12 ILE 149 1HD1 ILE 149 -5.753 4.704 0.379 1183 HD13 ILE 149 2HD1 ILE 149 -6.384 5.251 -1.176 1184 H GLU 150 H GLU 150 -8.338 1.268 -0.038 1185 HA GLU 150 HA GLU 150 -7.917 -1.565 0.065 1186 HB2 GLU 150 2HB GLU 150 -9.777 -0.389 1.247 1187 HB3 GLU 150 3HB GLU 150 -10.503 0.008 -0.307 1188 HG2 GLU 150 2HG GLU 150 -10.880 -2.368 -0.773 1189 HG3 GLU 150 3HG GLU 150 -10.059 -2.816 0.722 1190 H GLN 151 H GLN 151 -7.681 -2.889 -1.567 1191 HA GLN 151 HA GLN 151 -8.520 -2.168 -4.330 1192 HB2 GLN 151 2HB GLN 151 -6.255 -4.031 -3.456 1193 HB3 GLN 151 3HB GLN 151 -6.658 -3.606 -5.112 1194 HG2 GLN 151 2HG GLN 151 -5.692 -1.615 -3.043 1195 HG3 GLN 151 3HG GLN 151 -4.640 -2.445 -4.183 1196 HE21 GLN 151 1HE2 GLN 151 -7.154 -0.027 -3.852 1197 HE22 GLN 151 2HE2 GLN 151 -6.930 0.684 -5.409 1198 H ARG 152 H ARG 152 -10.489 -3.176 -4.440 1199 HA ARG 152 HA ARG 152 -10.917 -5.890 -3.425 1200 HB2 ARG 152 2HB ARG 152 -12.762 -3.831 -4.720 1201 HB3 ARG 152 3HB ARG 152 -13.295 -5.432 -4.225 1202 HG2 ARG 152 2HG ARG 152 -12.028 -3.518 -2.245 1203 HG3 ARG 152 3HG ARG 152 -13.748 -3.451 -2.627 1204 HD2 ARG 152 2HD ARG 152 -14.040 -5.741 -1.844 1205 HD3 ARG 152 3HD ARG 152 -12.303 -5.898 -1.578 1206 HE ARG 152 HE ARG 152 -13.405 -3.735 -0.091 1207 HH11 ARG 152 1HH1 ARG 152 -13.108 -7.239 -0.070 1208 HH12 ARG 152 2HH1 ARG 152 -13.236 -7.363 1.655 1209 HH21 ARG 152 1HH2 ARG 152 -13.506 -3.904 2.199 1210 HH22 ARG 152 2HH2 ARG 152 -13.464 -5.482 2.932 1211 H LEU 153 H LEU 153 -11.436 -7.679 -4.770 1212 HA LEU 153 HA LEU 153 -10.332 -7.771 -7.394 1213 HB2 LEU 153 2HB LEU 153 -12.126 -9.713 -5.888 1214 HB3 LEU 153 3HB LEU 153 -11.553 -10.044 -7.515 1215 HG LEU 153 HG LEU 153 -9.762 -9.645 -5.084 1216 HD11 LEU 153 1HD1 LEU 153 -11.023 -11.758 -4.988 1217 HD12 LEU 153 2HD1 LEU 153 -9.301 -12.034 -5.226 1218 HD13 LEU 153 3HD1 LEU 153 -10.415 -12.200 -6.586 1219 HD21 LEU 153 3HD2 LEU 153 -9.034 -10.418 -7.932 1220 HD22 LEU 153 1HD2 LEU 153 -7.928 -10.378 -6.555 1221 HD23 LEU 153 2HD2 LEU 153 -8.661 -8.887 -7.136 1222 H GLU 154 H GLU 154 -11.343 -7.876 -9.413 1223 HA GLU 154 HA GLU 154 -13.574 -6.105 -9.721 1224 HB2 GLU 154 2HB GLU 154 -12.145 -7.782 -11.811 1225 HB3 GLU 154 3HB GLU 154 -13.235 -6.444 -12.146 1226 HG2 GLU 154 2HG GLU 154 -11.627 -4.894 -11.076 1227 HG3 GLU 154 3HG GLU 154 -10.535 -6.249 -10.783 1228 H HIS 155 H HIS 155 -15.335 -6.618 -11.238 1229 HA HIS 155 HA HIS 155 -16.274 -9.305 -11.581 1230 HB2 HIS 155 2HB HIS 155 -18.441 -9.005 -10.315 1231 HB3 HIS 155 3HB HIS 155 -17.023 -9.165 -9.293 1232 HD1 HIS 155 HD1 HIS 155 -20.008 -7.489 -9.141 1233 HD2 HIS 155 HD2 HIS 155 -16.086 -6.159 -8.786 1234 HE1 HIS 155 HE1 HIS 155 -20.133 -5.356 -7.823 1235 HE2 HIS 155 HE2 HIS 155 -17.791 -4.462 -7.856 1236 H HIS 156 H HIS 156 -16.747 -5.827 -11.874 1237 HA HIS 156 HA HIS 156 -17.812 -6.292 -14.573 1238 HB2 HIS 156 2HB HIS 156 -19.154 -4.492 -12.512 1239 HB3 HIS 156 3HB HIS 156 -19.419 -4.294 -14.241 1240 HD1 HIS 156 HD1 HIS 156 -20.641 -6.310 -15.471 1241 HD2 HIS 156 HD2 HIS 156 -20.630 -6.517 -11.317 1242 HE1 HIS 156 HE1 HIS 156 -22.379 -8.020 -14.874 1243 HE2 HIS 156 HE2 HIS 156 -22.423 -8.057 -12.360 1244 H HIS 157 H HIS 157 -16.116 -5.560 -15.704 1245 HA HIS 157 HA HIS 157 -15.769 -2.709 -15.928 1246 HB2 HIS 157 2HB HIS 157 -13.483 -4.438 -14.937 1247 HB3 HIS 157 3HB HIS 157 -13.118 -3.109 -16.029 1248 HD1 HIS 157 HD1 HIS 157 -12.614 -3.602 -12.753 1249 HD2 HIS 157 HD2 HIS 157 -14.897 -0.717 -14.692 1250 HE1 HIS 157 HE1 HIS 157 -12.810 -1.693 -11.125 1251 HE2 HIS 157 HE2 HIS 157 -14.064 0.086 -12.383 1252 H HIS 158 H HIS 158 -16.479 -2.737 -18.010 1253 HA HIS 158 HA HIS 158 -15.419 -4.559 -20.013 1254 HB2 HIS 158 2HB HIS 158 -17.357 -2.219 -20.168 1255 HB3 HIS 158 3HB HIS 158 -16.769 -3.031 -21.612 1256 HD1 HIS 158 HD1 HIS 158 -17.379 -5.671 -21.752 1257 HD2 HIS 158 HD2 HIS 158 -19.605 -3.373 -19.097 1258 HE1 HIS 158 HE1 HIS 158 -19.443 -7.014 -21.259 1259 HE2 HIS 158 HE2 HIS 158 -20.697 -5.679 -19.545 1260 H HIS 159 H HIS 159 -14.720 -1.381 -18.802 1261 HA HIS 159 HA HIS 159 -12.300 -1.076 -20.270 1262 HB2 HIS 159 2HB HIS 159 -12.905 0.918 -21.626 1263 HB3 HIS 159 3HB HIS 159 -13.860 -0.478 -22.108 1264 HD1 HIS 159 HD1 HIS 159 -14.175 2.994 -21.035 1265 HD2 HIS 159 HD2 HIS 159 -16.627 -0.363 -21.109 1266 HE1 HIS 159 HE1 HIS 159 -16.521 3.861 -20.798 1267 HE2 HIS 159 HE2 HIS 159 -17.938 1.797 -20.583 1268 H HIS 160 H HIS 160 -11.982 1.724 -20.110 1269 HA HIS 160 HA HIS 160 -12.731 2.613 -17.417 1270 HB2 HIS 160 2HB HIS 160 -10.297 3.177 -16.884 1271 HB3 HIS 160 3HB HIS 160 -10.678 1.459 -16.897 1272 HD1 HIS 160 HD1 HIS 160 -9.083 4.055 -19.181 1273 HD2 HIS 160 HD2 HIS 160 -9.026 -0.034 -18.479 1274 HE1 HIS 160 HE1 HIS 160 -7.285 3.137 -20.680 1275 HE2 HIS 160 HE2 HIS 160 -7.381 0.649 -20.339 Start of MODEL 6 1 H1 MET 1 1H MET 1 -28.339 4.400 1.347 2 H2 MET 1 2H MET 1 -29.542 5.412 0.738 3 H3 MET 1 3H MET 1 -28.774 4.309 -0.282 4 HA MET 1 HA MET 1 -30.468 3.610 2.031 5 HB2 MET 1 2HB MET 1 -31.069 3.321 -0.953 6 HB3 MET 1 3HB MET 1 -32.126 2.819 0.362 7 HG2 MET 1 2HG MET 1 -32.969 4.852 -0.587 8 HG3 MET 1 3HG MET 1 -32.346 5.220 1.024 9 HE1 MET 1 3HE MET 1 -33.033 7.393 -1.199 10 HE2 MET 1 1HE MET 1 -31.634 8.466 -1.178 11 HE3 MET 1 2HE MET 1 -32.342 7.912 0.340 12 H VAL 2 H VAL 2 -29.595 2.179 -1.103 13 HA VAL 2 HA VAL 2 -28.096 -0.033 -0.041 14 HB VAL 2 HB VAL 2 -29.710 -1.757 -1.207 15 HG11 VAL 2 1HG1 VAL 2 -30.960 -2.195 0.877 16 HG12 VAL 2 2HG1 VAL 2 -30.489 -0.612 1.502 17 HG13 VAL 2 3HG1 VAL 2 -29.260 -1.841 1.195 18 HG21 VAL 2 3HG2 VAL 2 -31.249 -0.138 -2.229 19 HG22 VAL 2 1HG2 VAL 2 -31.725 0.459 -0.638 20 HG23 VAL 2 2HG2 VAL 2 -32.127 -1.193 -1.122 21 H GLU 3 H GLU 3 -26.799 1.372 -1.440 22 HA GLU 3 HA GLU 3 -27.219 1.232 -4.335 23 HB2 GLU 3 2HB GLU 3 -25.036 2.552 -2.646 24 HB3 GLU 3 3HB GLU 3 -25.080 2.603 -4.402 25 HG2 GLU 3 2HG GLU 3 -25.908 4.688 -3.503 26 HG3 GLU 3 3HG GLU 3 -27.205 3.830 -4.327 27 HA PRO 4 HA PRO 4 -24.384 -2.203 -5.280 28 HB2 PRO 4 2HB PRO 4 -23.059 -0.189 -7.125 29 HB3 PRO 4 3HB PRO 4 -23.557 -1.866 -7.453 30 HG2 PRO 4 2HG PRO 4 -25.035 0.124 -8.356 31 HG3 PRO 4 3HG PRO 4 -25.824 -1.305 -7.641 32 HD2 PRO 4 2HD PRO 4 -25.411 1.425 -6.441 33 HD3 PRO 4 3HD PRO 4 -26.800 0.323 -6.291 34 H GLY 5 H GLY 5 -22.103 -2.829 -5.097 35 HA2 GLY 5 2HA GLY 5 -20.669 -1.484 -3.002 36 HA3 GLY 5 3HA GLY 5 -20.121 -2.884 -3.913 37 H VAL 6 H VAL 6 -20.607 0.613 -4.241 38 HA VAL 6 HA VAL 6 -18.738 0.844 -6.455 39 HB VAL 6 HB VAL 6 -19.479 3.270 -6.486 40 HG11 VAL 6 1HG1 VAL 6 -20.572 1.604 -7.928 41 HG12 VAL 6 2HG1 VAL 6 -21.740 2.811 -7.392 42 HG13 VAL 6 3HG1 VAL 6 -21.721 1.209 -6.646 43 HG21 VAL 6 3HG2 VAL 6 -21.490 3.940 -5.176 44 HG22 VAL 6 1HG2 VAL 6 -20.127 3.563 -4.120 45 HG23 VAL 6 2HG2 VAL 6 -21.439 2.401 -4.312 46 H ALA 7 H ALA 7 -16.924 0.143 -5.221 47 HA ALA 7 HA ALA 7 -15.504 2.232 -3.751 48 HB1 ALA 7 3HB ALA 7 -15.079 0.727 -1.810 49 HB2 ALA 7 1HB ALA 7 -16.212 -0.443 -2.489 50 HB3 ALA 7 2HB ALA 7 -16.786 1.146 -1.976 51 H LYS 8 H LYS 8 -14.372 2.009 -5.793 52 HA LYS 8 HA LYS 8 -12.217 -0.021 -5.695 53 HB2 LYS 8 2HB LYS 8 -13.671 0.948 -8.209 54 HB3 LYS 8 3HB LYS 8 -12.228 -0.061 -8.212 55 HG2 LYS 8 2HG LYS 8 -13.504 -1.876 -7.106 56 HG3 LYS 8 3HG LYS 8 -14.950 -0.861 -7.119 57 HD2 LYS 8 2HD LYS 8 -13.441 -1.823 -9.589 58 HD3 LYS 8 3HD LYS 8 -14.948 -2.508 -8.984 59 HE2 LYS 8 2HE LYS 8 -16.112 -0.387 -9.420 60 HE3 LYS 8 3HE LYS 8 -14.602 0.353 -9.956 61 HZ1 LYS 8 3HZ LYS 8 -15.958 -1.946 -11.276 62 HZ2 LYS 8 1HZ LYS 8 -14.519 -1.226 -11.790 63 HZ3 LYS 8 2HZ LYS 8 -15.960 -0.350 -11.832 64 H LEU 9 H LEU 9 -10.431 0.771 -7.299 65 HA LEU 9 HA LEU 9 -10.280 3.694 -7.662 66 HB2 LEU 9 2HB LEU 9 -8.910 3.086 -5.617 67 HB3 LEU 9 3HB LEU 9 -7.970 1.983 -6.607 68 HG LEU 9 HG LEU 9 -7.244 3.979 -8.001 69 HD11 LEU 9 1HD1 LEU 9 -8.546 5.574 -5.783 70 HD12 LEU 9 2HD1 LEU 9 -9.041 5.518 -7.477 71 HD13 LEU 9 3HD1 LEU 9 -7.488 6.222 -7.038 72 HD21 LEU 9 3HD2 LEU 9 -5.759 3.004 -6.322 73 HD22 LEU 9 1HD2 LEU 9 -6.467 4.022 -5.064 74 HD23 LEU 9 2HD2 LEU 9 -5.554 4.751 -6.389 75 H THR 10 H THR 10 -9.429 4.216 -9.630 76 HA THR 10 HA THR 10 -9.288 2.423 -11.763 77 HB THR 10 HB THR 10 -8.029 4.373 -12.932 78 HG1 THR 10 HG1 THR 10 -7.515 5.149 -10.556 79 HG21 THR 10 3HG2 THR 10 -10.710 5.010 -11.639 80 HG22 THR 10 1HG2 THR 10 -10.477 4.115 -13.144 81 HG23 THR 10 2HG2 THR 10 -10.019 5.816 -13.049 82 H THR 11 H THR 11 -7.615 1.416 -12.840 83 HA THR 11 HA THR 11 -5.637 0.303 -11.193 84 HB THR 11 HB THR 11 -5.674 0.149 -14.234 85 HG1 THR 11 HG1 THR 11 -7.451 -0.842 -12.336 86 HG21 THR 11 3HG2 THR 11 -3.690 -0.895 -13.201 87 HG22 THR 11 1HG2 THR 11 -4.759 -2.130 -13.870 88 HG23 THR 11 2HG2 THR 11 -4.729 -1.837 -12.130 89 H TYR 12 H TYR 12 -5.401 2.922 -13.631 90 HA TYR 12 HA TYR 12 -2.607 3.039 -13.874 91 HB2 TYR 12 2HB TYR 12 -2.843 5.280 -14.809 92 HB3 TYR 12 3HB TYR 12 -4.153 4.281 -15.403 93 HD1 TYR 12 HD2 TYR 12 -3.344 7.023 -12.972 94 HD2 TYR 12 HD1 TYR 12 -6.454 4.981 -15.080 95 HE1 TYR 12 HE2 TYR 12 -4.955 8.724 -12.243 96 HE2 TYR 12 HE1 TYR 12 -8.057 6.700 -14.353 97 HH TYR 12 HH TYR 12 -8.258 8.355 -12.442 98 H ALA 13 H ALA 13 -4.733 4.426 -11.424 99 HA ALA 13 HA ALA 13 -2.818 6.214 -10.247 100 HB1 ALA 13 3HB ALA 13 -4.551 6.549 -8.524 101 HB2 ALA 13 1HB ALA 13 -5.454 5.166 -9.155 102 HB3 ALA 13 2HB ALA 13 -5.250 6.612 -10.143 103 H SER 14 H SER 14 -4.053 2.988 -9.479 104 HA SER 14 HA SER 14 -2.611 2.666 -7.026 105 HB2 SER 14 2HB SER 14 -3.364 0.248 -7.245 106 HB3 SER 14 3HB SER 14 -4.669 1.432 -7.309 107 HG SER 14 HG SER 14 -5.174 0.410 -9.069 108 H LYS 15 H LYS 15 -1.917 1.999 -10.397 109 HA LYS 15 HA LYS 15 0.378 0.316 -9.891 110 HB2 LYS 15 2HB LYS 15 -0.680 1.561 -12.467 111 HB3 LYS 15 3HB LYS 15 0.767 0.555 -12.410 112 HG2 LYS 15 2HG LYS 15 -2.054 -0.300 -11.676 113 HG3 LYS 15 3HG LYS 15 -1.150 -0.775 -13.115 114 HD2 LYS 15 2HD LYS 15 0.473 -2.010 -11.753 115 HD3 LYS 15 3HD LYS 15 -0.290 -1.441 -10.264 116 HE2 LYS 15 2HE LYS 15 -2.330 -2.684 -10.810 117 HE3 LYS 15 3HE LYS 15 -1.619 -3.223 -12.333 118 HZ1 LYS 15 3HZ LYS 15 -1.466 -4.912 -10.600 119 HZ2 LYS 15 1HZ LYS 15 -0.560 -3.865 -9.628 120 HZ3 LYS 15 2HZ LYS 15 0.073 -4.417 -11.101 121 H GLN 16 H GLN 16 -0.115 3.762 -10.657 122 HA GLN 16 HA GLN 16 2.673 4.348 -10.952 123 HB2 GLN 16 2HB GLN 16 0.408 6.264 -10.267 124 HB3 GLN 16 3HB GLN 16 2.052 6.744 -10.668 125 HG2 GLN 16 2HG GLN 16 -0.068 5.594 -12.472 126 HG3 GLN 16 3HG GLN 16 0.827 7.100 -12.634 127 HE21 GLN 16 1HE2 GLN 16 2.979 7.014 -13.414 128 HE22 GLN 16 2HE2 GLN 16 3.564 5.663 -14.320 129 H ALA 17 H ALA 17 0.492 4.152 -8.213 130 HA ALA 17 HA ALA 17 2.080 5.353 -6.219 131 HB1 ALA 17 3HB ALA 17 -0.270 4.713 -5.846 132 HB2 ALA 17 1HB ALA 17 0.775 3.993 -4.618 133 HB3 ALA 17 2HB ALA 17 0.166 3.006 -5.950 134 H THR 18 H THR 18 1.866 1.902 -7.222 135 HA THR 18 HA THR 18 4.087 1.023 -5.634 136 HB THR 18 HB THR 18 3.832 -1.068 -7.310 137 HG1 THR 18 HG1 THR 18 2.452 0.028 -8.773 138 HG21 THR 18 3HG2 THR 18 2.065 -1.982 -5.902 139 HG22 THR 18 1HG2 THR 18 1.646 -0.370 -5.327 140 HG23 THR 18 2HG2 THR 18 3.203 -1.081 -4.903 141 H ASP 19 H ASP 19 3.827 2.351 -8.817 142 HA ASP 19 HA ASP 19 6.304 1.444 -9.908 143 HB2 ASP 19 2HB ASP 19 4.480 2.273 -11.341 144 HB3 ASP 19 3HB ASP 19 4.588 3.869 -10.610 145 H MET 20 H MET 20 5.296 4.358 -8.143 146 HA MET 20 HA MET 20 7.922 5.613 -8.293 147 HB2 MET 20 2HB MET 20 5.361 6.478 -6.879 148 HB3 MET 20 3HB MET 20 6.840 7.434 -6.923 149 HG2 MET 20 2HG MET 20 6.665 7.552 -9.389 150 HG3 MET 20 3HG MET 20 5.155 6.644 -9.308 151 HE1 MET 20 3HE MET 20 2.905 7.603 -8.152 152 HE2 MET 20 1HE MET 20 2.827 9.191 -7.390 153 HE3 MET 20 2HE MET 20 3.783 7.908 -6.652 154 H GLY 21 H GLY 21 5.886 4.035 -5.844 155 HA2 GLY 21 2HA GLY 21 7.774 2.768 -4.389 156 HA3 GLY 21 3HA GLY 21 7.813 4.384 -3.704 157 H ALA 22 H ALA 22 5.797 1.552 -4.258 158 HA ALA 22 HA ALA 22 4.649 1.796 -1.618 159 HB1 ALA 22 3HB ALA 22 2.757 1.762 -4.004 160 HB2 ALA 22 1HB ALA 22 3.051 3.151 -2.955 161 HB3 ALA 22 2HB ALA 22 2.296 1.698 -2.300 162 H ILE 23 H ILE 23 3.219 -0.130 -1.148 163 HA ILE 23 HA ILE 23 3.993 -2.556 -2.681 164 HB ILE 23 HB ILE 23 4.058 -3.834 -0.526 165 HG12 ILE 23 2HG1 ILE 23 3.837 -1.095 0.829 166 HG13 ILE 23 3HG1 ILE 23 2.580 -2.324 0.817 167 HG21 ILE 23 1HG2 ILE 23 6.029 -1.515 -0.565 168 HG22 ILE 23 2HG2 ILE 23 6.185 -3.024 -1.468 169 HG23 ILE 23 3HG2 ILE 23 6.249 -3.043 0.296 170 HD11 ILE 23 3HD1 ILE 23 4.050 -3.805 2.129 171 HD12 ILE 23 1HD1 ILE 23 3.693 -2.282 2.941 172 HD13 ILE 23 2HD1 ILE 23 5.264 -2.523 2.179 173 H TYR 24 H TYR 24 2.412 -4.159 -2.834 174 HA TYR 24 HA TYR 24 -0.335 -3.538 -1.924 175 HB2 TYR 24 2HB TYR 24 0.723 -5.668 -3.845 176 HB3 TYR 24 3HB TYR 24 -0.955 -5.542 -3.352 177 HD1 TYR 24 HD1 TYR 24 -2.015 -3.070 -3.805 178 HD2 TYR 24 HD2 TYR 24 1.241 -4.804 -5.972 179 HE1 TYR 24 HE1 TYR 24 -2.566 -1.685 -5.766 180 HE2 TYR 24 HE2 TYR 24 0.699 -3.406 -7.921 181 HH TYR 24 HH TYR 24 -1.303 -0.777 -7.832 182 H VAL 25 H VAL 25 -0.905 -4.439 -0.003 183 HA VAL 25 HA VAL 25 0.258 -7.049 0.816 184 HB VAL 25 HB VAL 25 -0.138 -6.517 3.141 185 HG11 VAL 25 1HG1 VAL 25 1.298 -4.192 1.815 186 HG12 VAL 25 2HG1 VAL 25 1.993 -5.754 2.251 187 HG13 VAL 25 3HG1 VAL 25 1.442 -4.658 3.516 188 HG21 VAL 25 3HG2 VAL 25 -2.212 -5.207 2.983 189 HG22 VAL 25 1HG2 VAL 25 -1.320 -3.839 2.312 190 HG23 VAL 25 2HG2 VAL 25 -1.016 -4.367 3.970 191 H ASN 26 H ASN 26 -1.408 -8.166 2.463 192 HA ASN 26 HA ASN 26 -4.118 -8.094 1.223 193 HB2 ASN 26 2HB ASN 26 -4.349 -10.478 1.813 194 HB3 ASN 26 3HB ASN 26 -2.967 -10.226 0.760 195 HD21 ASN 26 1HD2 ASN 26 -0.871 -10.577 1.599 196 HD22 ASN 26 2HD2 ASN 26 -0.625 -11.466 3.056 197 H SER 27 H SER 27 -5.475 -9.606 3.071 198 HA SER 27 HA SER 27 -6.336 -7.696 4.925 199 HB2 SER 27 2HB SER 27 -7.748 -9.583 5.791 200 HB3 SER 27 3HB SER 27 -7.783 -9.443 4.033 201 HG SER 27 HG SER 27 -7.356 -11.606 5.197 202 H LYS 28 H LYS 28 -3.766 -9.993 5.218 203 HA LYS 28 HA LYS 28 -3.696 -9.882 8.147 204 HB2 LYS 28 2HB LYS 28 -1.743 -11.312 6.291 205 HB3 LYS 28 3HB LYS 28 -1.944 -11.558 8.027 206 HG2 LYS 28 2HG LYS 28 -3.966 -12.231 5.872 207 HG3 LYS 28 3HG LYS 28 -2.961 -13.385 6.751 208 HD2 LYS 28 2HD LYS 28 -4.137 -12.928 8.822 209 HD3 LYS 28 3HD LYS 28 -5.005 -11.572 8.095 210 HE2 LYS 28 2HE LYS 28 -6.169 -13.143 6.576 211 HE3 LYS 28 3HE LYS 28 -5.321 -14.498 7.333 212 HZ1 LYS 28 3HZ LYS 28 -6.367 -13.927 9.438 213 HZ2 LYS 28 1HZ LYS 28 -7.537 -14.210 8.256 214 HZ3 LYS 28 2HZ LYS 28 -7.175 -12.627 8.719 215 H GLY 29 H GLY 29 -2.098 -8.535 5.343 216 HA2 GLY 29 2HA GLY 29 -1.017 -6.390 5.508 217 HA3 GLY 29 3HA GLY 29 -0.412 -6.828 7.098 218 H ASP 30 H ASP 30 -0.100 -9.508 5.232 219 HA ASP 30 HA ASP 30 2.721 -9.266 4.761 220 HB2 ASP 30 2HB ASP 30 1.677 -11.458 5.303 221 HB3 ASP 30 3HB ASP 30 0.703 -11.387 3.845 222 H ARG 31 H ARG 31 3.695 -8.443 2.945 223 HA ARG 31 HA ARG 31 2.229 -7.326 0.796 224 HB2 ARG 31 2HB ARG 31 4.733 -7.403 -0.307 225 HB3 ARG 31 3HB ARG 31 4.179 -6.171 0.803 226 HG2 ARG 31 2HG ARG 31 6.283 -6.678 1.631 227 HG3 ARG 31 3HG ARG 31 5.243 -7.648 2.667 228 HD2 ARG 31 2HD ARG 31 6.705 -8.743 0.239 229 HD3 ARG 31 3HD ARG 31 7.360 -8.769 1.874 230 HE ARG 31 HE ARG 31 4.778 -10.005 1.688 231 HH11 ARG 31 1HH1 ARG 31 8.231 -10.631 1.243 232 HH12 ARG 31 2HH1 ARG 31 8.051 -12.345 1.450 233 HH21 ARG 31 1HH2 ARG 31 4.573 -12.251 1.860 234 HH22 ARG 31 2HH2 ARG 31 5.988 -13.258 1.797 235 H ILE 32 H ILE 32 1.100 -8.416 -0.639 236 HA ILE 32 HA ILE 32 1.543 -11.180 -1.298 237 HB ILE 32 HB ILE 32 -0.321 -10.898 -2.948 238 HG12 ILE 32 2HG1 ILE 32 -0.501 -8.010 -1.967 239 HG13 ILE 32 3HG1 ILE 32 0.162 -8.476 -3.528 240 HG21 ILE 32 1HG2 ILE 32 -0.804 -11.517 -0.631 241 HG22 ILE 32 2HG2 ILE 32 -2.097 -10.521 -1.296 242 HG23 ILE 32 3HG2 ILE 32 -0.925 -9.812 -0.182 243 HD11 ILE 32 3HD1 ILE 32 -2.030 -9.420 -4.145 244 HD12 ILE 32 1HD1 ILE 32 -2.086 -7.695 -3.782 245 HD13 ILE 32 2HD1 ILE 32 -2.676 -8.860 -2.599 246 H VAL 33 H VAL 33 2.249 -8.123 -2.855 247 HA VAL 33 HA VAL 33 4.242 -9.410 -4.516 248 HB VAL 33 HB VAL 33 2.326 -9.437 -6.030 249 HG11 VAL 33 1HG1 VAL 33 0.974 -7.646 -5.073 250 HG12 VAL 33 2HG1 VAL 33 1.177 -7.424 -6.811 251 HG13 VAL 33 3HG1 VAL 33 2.107 -6.434 -5.680 252 HG21 VAL 33 3HG2 VAL 33 3.293 -8.215 -7.951 253 HG22 VAL 33 1HG2 VAL 33 4.527 -9.075 -7.028 254 HG23 VAL 33 2HG2 VAL 33 4.356 -7.326 -6.857 255 H ASN 34 H ASN 34 5.938 -8.118 -4.952 256 HA ASN 34 HA ASN 34 6.630 -6.189 -3.016 257 HB2 ASN 34 2HB ASN 34 8.784 -6.029 -4.320 258 HB3 ASN 34 3HB ASN 34 8.316 -7.673 -3.911 259 HD21 ASN 34 1HD2 ASN 34 10.075 -6.663 -6.018 260 HD22 ASN 34 2HD2 ASN 34 9.470 -7.298 -7.499 261 H GLU 35 H GLU 35 5.489 -5.839 -6.310 262 HA GLU 35 HA GLU 35 5.071 -3.004 -6.110 263 HB2 GLU 35 2HB GLU 35 6.635 -2.350 -7.981 264 HB3 GLU 35 3HB GLU 35 7.465 -2.880 -6.520 265 HG2 GLU 35 2HG GLU 35 7.735 -5.155 -7.612 266 HG3 GLU 35 3HG GLU 35 7.112 -4.442 -9.095 267 H SER 36 H SER 36 4.969 -2.418 -8.896 268 HA SER 36 HA SER 36 2.381 -3.205 -9.538 269 HB2 SER 36 2HB SER 36 4.498 -2.203 -11.502 270 HB3 SER 36 3HB SER 36 2.748 -2.088 -11.692 271 HG SER 36 HG SER 36 3.668 -0.127 -10.951 272 H ASN 37 H ASN 37 5.295 -4.106 -11.384 273 HA ASN 37 HA ASN 37 5.875 -5.786 -12.737 274 HB2 ASN 37 2HB ASN 37 4.323 -7.420 -10.698 275 HB3 ASN 37 3HB ASN 37 5.311 -8.142 -11.960 276 HD21 ASN 37 1HD2 ASN 37 5.599 -8.387 -9.093 277 HD22 ASN 37 2HD2 ASN 37 7.170 -7.793 -8.700 278 H VAL 38 H VAL 38 2.759 -7.331 -12.029 279 HA VAL 38 HA VAL 38 1.570 -6.711 -14.582 280 HB VAL 38 HB VAL 38 3.253 -8.439 -15.244 281 HG11 VAL 38 1HG1 VAL 38 3.396 -9.739 -13.180 282 HG12 VAL 38 2HG1 VAL 38 3.055 -10.784 -14.559 283 HG13 VAL 38 3HG1 VAL 38 1.761 -10.365 -13.431 284 HG21 VAL 38 3HG2 VAL 38 1.751 -9.897 -16.537 285 HG22 VAL 38 1HG2 VAL 38 1.191 -8.223 -16.552 286 HG23 VAL 38 2HG2 VAL 38 0.386 -9.414 -15.524 287 H TYR 39 H TYR 39 -0.631 -7.620 -14.732 288 HA TYR 39 HA TYR 39 -2.099 -7.496 -12.346 289 HB2 TYR 39 2HB TYR 39 -4.051 -8.090 -13.654 290 HB3 TYR 39 3HB TYR 39 -3.033 -7.037 -14.621 291 HD1 TYR 39 HD2 TYR 39 -1.826 -7.953 -16.631 292 HD2 TYR 39 HD1 TYR 39 -4.467 -10.441 -14.356 293 HE1 TYR 39 HE2 TYR 39 -1.914 -9.569 -18.480 294 HE2 TYR 39 HE1 TYR 39 -4.560 -12.036 -16.218 295 HH TYR 39 HH TYR 39 -4.199 -12.007 -18.714 296 H THR 40 H THR 40 -0.598 -10.195 -13.928 297 HA THR 40 HA THR 40 -2.178 -12.292 -12.897 298 HB THR 40 HB THR 40 0.734 -12.486 -13.815 299 HG1 THR 40 HG1 THR 40 -0.041 -12.586 -15.863 300 HG21 THR 40 3HG2 THR 40 -1.522 -14.535 -13.768 301 HG22 THR 40 1HG2 THR 40 -0.093 -14.545 -12.729 302 HG23 THR 40 2HG2 THR 40 0.081 -14.802 -14.467 303 H THR 41 H THR 41 1.075 -11.124 -11.856 304 HA THR 41 HA THR 41 1.293 -12.844 -9.604 305 HB THR 41 HB THR 41 3.281 -11.822 -10.636 306 HG1 THR 41 HG1 THR 41 2.800 -11.435 -7.873 307 HG21 THR 41 3HG2 THR 41 2.418 -9.586 -11.156 308 HG22 THR 41 1HG2 THR 41 3.894 -9.480 -10.194 309 HG23 THR 41 2HG2 THR 41 2.325 -9.205 -9.434 310 H PHE 42 H PHE 42 -0.336 -9.830 -10.051 311 HA PHE 42 HA PHE 42 -0.650 -9.141 -7.266 312 HB2 PHE 42 2HB PHE 42 -0.693 -7.374 -8.957 313 HB3 PHE 42 3HB PHE 42 -2.007 -8.161 -9.821 314 HD1 PHE 42 HD1 PHE 42 -1.280 -6.854 -6.367 315 HD2 PHE 42 HD2 PHE 42 -4.140 -7.214 -9.525 316 HE1 PHE 42 HE1 PHE 42 -2.878 -5.504 -5.087 317 HE2 PHE 42 HE2 PHE 42 -5.735 -5.853 -8.234 318 HZ PHE 42 HZ PHE 42 -5.103 -4.995 -6.010 319 H ARG 43 H ARG 43 -2.950 -10.207 -9.792 320 HA ARG 43 HA ARG 43 -5.213 -10.483 -8.158 321 HB2 ARG 43 2HB ARG 43 -5.317 -10.209 -10.649 322 HB3 ARG 43 3HB ARG 43 -4.644 -11.822 -10.846 323 HG2 ARG 43 2HG ARG 43 -6.719 -12.664 -9.553 324 HG3 ARG 43 3HG ARG 43 -7.388 -11.051 -9.809 325 HD2 ARG 43 2HD ARG 43 -6.500 -12.972 -11.993 326 HD3 ARG 43 3HD ARG 43 -8.169 -12.668 -11.510 327 HE ARG 43 HE ARG 43 -7.116 -10.203 -12.201 328 HH11 ARG 43 1HH1 ARG 43 -7.653 -13.261 -13.859 329 HH12 ARG 43 2HH1 ARG 43 -7.875 -12.524 -15.416 330 HH21 ARG 43 1HH2 ARG 43 -7.409 -9.222 -14.243 331 HH22 ARG 43 2HH2 ARG 43 -7.735 -10.209 -15.639 332 H ASN 44 H ASN 44 -2.912 -12.910 -9.391 333 HA ASN 44 HA ASN 44 -4.261 -15.217 -8.403 334 HB2 ASN 44 2HB ASN 44 -1.377 -14.847 -9.321 335 HB3 ASN 44 3HB ASN 44 -2.091 -16.411 -8.934 336 HD21 ASN 44 1HD2 ASN 44 -1.530 -17.006 -11.123 337 HD22 ASN 44 2HD2 ASN 44 -2.544 -16.534 -12.437 338 H ALA 45 H ALA 45 -1.873 -13.064 -7.004 339 HA ALA 45 HA ALA 45 -1.211 -14.684 -4.734 340 HB1 ALA 45 3HB ALA 45 -0.233 -12.625 -3.812 341 HB2 ALA 45 1HB ALA 45 -1.012 -11.676 -5.085 342 HB3 ALA 45 2HB ALA 45 0.239 -12.848 -5.499 343 H ILE 46 H ILE 46 -3.732 -12.319 -5.455 344 HA ILE 46 HA ILE 46 -4.909 -12.163 -2.833 345 HB ILE 46 HB ILE 46 -6.179 -11.584 -5.563 346 HG12 ILE 46 2HG1 ILE 46 -4.839 -9.602 -3.660 347 HG13 ILE 46 3HG1 ILE 46 -4.107 -10.228 -5.132 348 HG21 ILE 46 1HG2 ILE 46 -7.862 -11.851 -3.799 349 HG22 ILE 46 2HG2 ILE 46 -7.775 -10.169 -4.320 350 HG23 ILE 46 3HG2 ILE 46 -7.030 -10.659 -2.796 351 HD11 ILE 46 3HD1 ILE 46 -4.998 -8.016 -5.482 352 HD12 ILE 46 1HD1 ILE 46 -6.602 -8.546 -4.978 353 HD13 ILE 46 2HD1 ILE 46 -5.880 -9.190 -6.457 354 H LEU 47 H LEU 47 -5.376 -14.106 -5.742 355 HA LEU 47 HA LEU 47 -7.674 -15.574 -4.898 356 HB2 LEU 47 2HB LEU 47 -5.631 -16.128 -7.082 357 HB3 LEU 47 3HB LEU 47 -7.074 -17.102 -6.837 358 HG LEU 47 HG LEU 47 -7.075 -14.144 -7.573 359 HD11 LEU 47 1HD1 LEU 47 -6.245 -15.520 -9.423 360 HD12 LEU 47 2HD1 LEU 47 -7.833 -14.855 -9.793 361 HD13 LEU 47 3HD1 LEU 47 -7.676 -16.551 -9.325 362 HD21 LEU 47 3HD2 LEU 47 -9.393 -16.096 -7.348 363 HD22 LEU 47 1HD2 LEU 47 -9.491 -14.427 -7.920 364 HD23 LEU 47 2HD2 LEU 47 -9.041 -14.757 -6.250 365 H LYS 48 H LYS 48 -4.232 -15.970 -4.488 366 HA LYS 48 HA LYS 48 -4.284 -18.657 -3.456 367 HB2 LYS 48 2HB LYS 48 -2.220 -17.776 -4.412 368 HB3 LYS 48 3HB LYS 48 -2.203 -16.431 -3.277 369 HG2 LYS 48 2HG LYS 48 -1.793 -17.991 -1.410 370 HG3 LYS 48 3HG LYS 48 -1.853 -19.361 -2.521 371 HD2 LYS 48 2HD LYS 48 0.177 -17.095 -2.656 372 HD3 LYS 48 3HD LYS 48 0.477 -18.668 -1.915 373 HE2 LYS 48 2HE LYS 48 -0.208 -18.212 -4.841 374 HE3 LYS 48 3HE LYS 48 1.410 -18.511 -4.205 375 HZ1 LYS 48 3HZ LYS 48 0.637 -20.678 -3.413 376 HZ2 LYS 48 1HZ LYS 48 0.458 -20.526 -5.085 377 HZ3 LYS 48 2HZ LYS 48 -0.889 -20.389 -4.080 378 H GLN 49 H GLN 49 -4.356 -15.389 -2.078 379 HA GLN 49 HA GLN 49 -4.435 -16.197 0.679 380 HB2 GLN 49 2HB GLN 49 -3.650 -13.955 0.189 381 HB3 GLN 49 3HB GLN 49 -5.100 -13.569 -0.725 382 HG2 GLN 49 2HG GLN 49 -5.121 -12.398 1.398 383 HG3 GLN 49 3HG GLN 49 -6.426 -13.575 1.364 384 HE21 GLN 49 1HE2 GLN 49 -5.326 -12.300 3.653 385 HE22 GLN 49 2HE2 GLN 49 -4.675 -13.531 4.671 386 H ALA 50 H ALA 50 -6.197 -16.405 2.014 387 HA ALA 50 HA ALA 50 -8.574 -17.516 1.052 388 HB1 ALA 50 3HB ALA 50 -8.054 -16.264 3.773 389 HB2 ALA 50 1HB ALA 50 -7.700 -17.932 3.319 390 HB3 ALA 50 2HB ALA 50 -9.374 -17.373 3.388 391 H ASP 51 H ASP 51 -7.972 -14.244 2.356 392 HA ASP 51 HA ASP 51 -10.619 -13.262 1.663 393 HB2 ASP 51 2HB ASP 51 -8.153 -11.789 2.699 394 HB3 ASP 51 3HB ASP 51 -9.750 -11.066 2.493 395 H LYS 52 H LYS 52 -11.180 -12.180 -0.123 396 HA LYS 52 HA LYS 52 -9.246 -11.934 -2.323 397 HB2 LYS 52 2HB LYS 52 -12.294 -11.882 -2.339 398 HB3 LYS 52 3HB LYS 52 -11.276 -11.794 -3.779 399 HG2 LYS 52 2HG LYS 52 -11.398 -14.112 -1.820 400 HG3 LYS 52 3HG LYS 52 -12.146 -14.080 -3.421 401 HD2 LYS 52 2HD LYS 52 -9.933 -13.963 -4.483 402 HD3 LYS 52 3HD LYS 52 -9.147 -13.852 -2.905 403 HE2 LYS 52 2HE LYS 52 -10.743 -16.242 -3.893 404 HE3 LYS 52 3HE LYS 52 -8.988 -16.121 -3.882 405 HZ1 LYS 52 3HZ LYS 52 -9.733 -17.343 -1.991 406 HZ2 LYS 52 1HZ LYS 52 -10.756 -16.087 -1.506 407 HZ3 LYS 52 2HZ LYS 52 -9.082 -15.875 -1.469 408 H VAL 53 H VAL 53 -8.373 -10.150 -1.015 409 HA VAL 53 HA VAL 53 -9.154 -7.596 -2.100 410 HB VAL 53 HB VAL 53 -10.670 -7.664 -0.174 411 HG11 VAL 53 1HG1 VAL 53 -9.527 -9.281 1.260 412 HG12 VAL 53 2HG1 VAL 53 -9.904 -7.813 2.161 413 HG13 VAL 53 3HG1 VAL 53 -8.250 -8.110 1.614 414 HG21 VAL 53 3HG2 VAL 53 -8.364 -5.743 0.324 415 HG22 VAL 53 1HG2 VAL 53 -10.003 -5.577 0.968 416 HG23 VAL 53 2HG2 VAL 53 -9.725 -5.487 -0.772 417 H ALA 54 H ALA 54 -7.426 -6.182 -2.137 418 HA ALA 54 HA ALA 54 -4.914 -6.862 -0.737 419 HB1 ALA 54 3HB ALA 54 -3.657 -6.112 -2.720 420 HB2 ALA 54 1HB ALA 54 -5.170 -5.856 -3.599 421 HB3 ALA 54 2HB ALA 54 -4.694 -7.482 -3.109 422 H TYR 55 H TYR 55 -4.182 -5.211 0.423 423 HA TYR 55 HA TYR 55 -5.409 -2.540 0.188 424 HB2 TYR 55 2HB TYR 55 -3.811 -3.790 2.476 425 HB3 TYR 55 3HB TYR 55 -4.586 -2.213 2.500 426 HD1 TYR 55 HD2 TYR 55 -5.256 -5.873 2.362 427 HD2 TYR 55 HD1 TYR 55 -6.942 -2.004 3.046 428 HE1 TYR 55 HE2 TYR 55 -7.300 -6.909 3.219 429 HE2 TYR 55 HE1 TYR 55 -8.991 -3.060 3.904 430 HH TYR 55 HH TYR 55 -10.165 -5.271 3.626 431 H LEU 56 H LEU 56 -4.244 -1.316 -1.146 432 HA LEU 56 HA LEU 56 -1.397 -1.484 -1.512 433 HB2 LEU 56 2HB LEU 56 -2.826 -0.846 -3.373 434 HB3 LEU 56 3HB LEU 56 -3.517 0.486 -2.461 435 HG LEU 56 HG LEU 56 -1.322 1.654 -2.519 436 HD11 LEU 56 1HD1 LEU 56 -0.388 -0.604 -4.294 437 HD12 LEU 56 2HD1 LEU 56 0.204 -0.218 -2.676 438 HD13 LEU 56 3HD1 LEU 56 0.475 0.909 -4.002 439 HD21 LEU 56 3HD2 LEU 56 -1.400 2.308 -4.882 440 HD22 LEU 56 1HD2 LEU 56 -3.017 2.171 -4.195 441 HD23 LEU 56 2HD2 LEU 56 -2.394 0.898 -5.249 442 H VAL 57 H VAL 57 -0.141 -0.896 0.168 443 HA VAL 57 HA VAL 57 -0.794 1.445 1.842 444 HB VAL 57 HB VAL 57 1.372 -0.684 2.274 445 HG11 VAL 57 1HG1 VAL 57 0.375 1.482 4.176 446 HG12 VAL 57 2HG1 VAL 57 1.949 1.438 3.378 447 HG13 VAL 57 3HG1 VAL 57 1.538 0.213 4.577 448 HG21 VAL 57 3HG2 VAL 57 -0.870 -1.671 2.411 449 HG22 VAL 57 1HG2 VAL 57 -1.371 -0.441 3.574 450 HG23 VAL 57 2HG2 VAL 57 -0.126 -1.617 4.009 451 H MET 58 H MET 58 0.170 3.350 1.396 452 HA MET 58 HA MET 58 3.013 3.446 0.631 453 HB2 MET 58 2HB MET 58 2.723 5.025 -1.129 454 HB3 MET 58 3HB MET 58 1.487 3.818 -1.440 455 HG2 MET 58 2HG MET 58 1.028 6.526 -0.173 456 HG3 MET 58 3HG MET 58 0.688 6.103 -1.844 457 HE1 MET 58 3HE MET 58 -0.597 3.297 -1.720 458 HE2 MET 58 1HE MET 58 -1.355 4.617 -2.612 459 HE3 MET 58 2HE MET 58 -2.307 3.648 -1.489 460 H ASP 59 H ASP 59 3.665 5.910 0.821 461 HA ASP 59 HA ASP 59 2.707 6.993 3.393 462 HB2 ASP 59 2HB ASP 59 4.726 8.491 3.170 463 HB3 ASP 59 3HB ASP 59 5.119 6.778 3.187 464 H GLU 60 H GLU 60 2.631 9.500 3.424 465 HA GLU 60 HA GLU 60 0.512 10.289 1.728 466 HB2 GLU 60 2HB GLU 60 0.819 11.140 4.076 467 HB3 GLU 60 3HB GLU 60 2.154 12.145 3.516 468 HG2 GLU 60 2HG GLU 60 0.668 13.403 2.063 469 HG3 GLU 60 3HG GLU 60 -0.676 12.324 2.417 470 H ARG 61 H ARG 61 3.980 10.790 1.479 471 HA ARG 61 HA ARG 61 3.905 13.020 -0.313 472 HB2 ARG 61 2HB ARG 61 5.948 11.599 1.084 473 HB3 ARG 61 3HB ARG 61 6.343 11.377 -0.609 474 HG2 ARG 61 2HG ARG 61 7.531 13.310 0.185 475 HG3 ARG 61 3HG ARG 61 6.262 13.868 -0.911 476 HD2 ARG 61 2HD ARG 61 4.839 14.414 1.065 477 HD3 ARG 61 3HD ARG 61 6.161 13.927 2.132 478 HE ARG 61 HE ARG 61 6.477 16.121 0.174 479 HH11 ARG 61 1HH1 ARG 61 6.577 15.022 3.529 480 HH12 ARG 61 2HH1 ARG 61 7.271 16.507 4.101 481 HH21 ARG 61 1HH2 ARG 61 7.351 18.040 0.939 482 HH22 ARG 61 2HH2 ARG 61 7.708 18.220 2.630 483 H THR 62 H THR 62 4.062 9.501 -0.765 484 HA THR 62 HA THR 62 4.103 9.562 -3.640 485 HB THR 62 HB THR 62 3.285 7.296 -1.757 486 HG1 THR 62 HG1 THR 62 5.356 7.410 -1.299 487 HG21 THR 62 3HG2 THR 62 4.189 7.145 -4.673 488 HG22 THR 62 1HG2 THR 62 2.541 6.859 -4.100 489 HG23 THR 62 2HG2 THR 62 3.842 5.768 -3.623 490 H TRP 63 H TRP 63 1.580 9.448 -1.144 491 HA TRP 63 HA TRP 63 -0.626 8.891 -2.835 492 HB2 TRP 63 2HB TRP 63 -0.970 8.534 -0.487 493 HB3 TRP 63 3HB TRP 63 -0.482 10.178 -0.081 494 HD1 TRP 63 HD1 TRP 63 -2.392 11.942 0.125 495 HE1 TRP 63 HE1 TRP 63 -4.907 11.991 -0.402 496 HE3 TRP 63 HE3 TRP 63 -2.867 7.428 -2.295 497 HZ2 TRP 63 HZ2 TRP 63 -6.830 10.392 -1.657 498 HZ3 TRP 63 HZ3 TRP 63 -5.096 6.780 -3.132 499 HH2 TRP 63 HH2 TRP 63 -7.034 8.235 -2.818 500 H LYS 64 H LYS 64 0.957 11.958 -1.947 501 HA LYS 64 HA LYS 64 -0.853 13.874 -2.725 502 HB2 LYS 64 2HB LYS 64 2.142 13.855 -3.307 503 HB3 LYS 64 3HB LYS 64 1.121 15.282 -3.436 504 HG2 LYS 64 2HG LYS 64 1.856 13.764 -0.931 505 HG3 LYS 64 3HG LYS 64 2.336 15.398 -1.389 506 HD2 LYS 64 2HD LYS 64 -0.132 16.028 -1.303 507 HD3 LYS 64 3HD LYS 64 -0.434 14.441 -0.594 508 HE2 LYS 64 2HE LYS 64 1.088 15.005 1.281 509 HE3 LYS 64 3HE LYS 64 1.349 16.600 0.567 510 HZ1 LYS 64 3HZ LYS 64 -0.981 17.110 0.871 511 HZ2 LYS 64 1HZ LYS 64 -0.322 16.621 2.352 512 HZ3 LYS 64 2HZ LYS 64 -1.289 15.563 1.461 513 H LYS 65 H LYS 65 1.304 11.966 -4.715 514 HA LYS 65 HA LYS 65 0.771 13.286 -7.190 515 HB2 LYS 65 2HB LYS 65 2.046 10.556 -6.760 516 HB3 LYS 65 3HB LYS 65 2.239 11.607 -8.161 517 HG2 LYS 65 2HG LYS 65 3.297 12.061 -5.356 518 HG3 LYS 65 3HG LYS 65 4.241 11.700 -6.803 519 HD2 LYS 65 2HD LYS 65 2.677 14.255 -6.244 520 HD3 LYS 65 3HD LYS 65 4.431 14.063 -6.225 521 HE2 LYS 65 2HE LYS 65 4.367 13.491 -8.640 522 HE3 LYS 65 3HE LYS 65 2.627 13.786 -8.642 523 HZ1 LYS 65 3HZ LYS 65 3.792 15.730 -9.424 524 HZ2 LYS 65 1HZ LYS 65 4.720 15.801 -8.018 525 HZ3 LYS 65 2HZ LYS 65 3.057 16.079 -7.941 526 H VAL 66 H VAL 66 -0.257 10.202 -5.723 527 HA VAL 66 HA VAL 66 -1.821 9.172 -7.827 528 HB VAL 66 HB VAL 66 -2.281 8.831 -4.814 529 HG11 VAL 66 1HG1 VAL 66 -3.428 6.715 -5.379 530 HG12 VAL 66 2HG1 VAL 66 -3.249 7.062 -7.102 531 HG13 VAL 66 3HG1 VAL 66 -4.255 8.104 -6.091 532 HG21 VAL 66 3HG2 VAL 66 0.008 8.201 -5.461 533 HG22 VAL 66 1HG2 VAL 66 -0.616 7.118 -6.709 534 HG23 VAL 66 2HG2 VAL 66 -0.921 6.773 -5.002 535 H TYR 67 H TYR 67 -2.601 11.385 -5.211 536 HA TYR 67 HA TYR 67 -5.388 11.680 -5.630 537 HB2 TYR 67 2HB TYR 67 -4.287 12.196 -3.475 538 HB3 TYR 67 3HB TYR 67 -3.371 13.497 -4.225 539 HD1 TYR 67 HD1 TYR 67 -6.864 12.422 -3.374 540 HD2 TYR 67 HD2 TYR 67 -4.292 15.713 -4.289 541 HE1 TYR 67 HE1 TYR 67 -8.665 13.994 -2.806 542 HE2 TYR 67 HE2 TYR 67 -6.098 17.277 -3.711 543 HH TYR 67 HH TYR 67 -8.516 17.318 -3.546 544 H ASP 68 H ASP 68 -2.540 13.422 -6.832 545 HA ASP 68 HA ASP 68 -3.865 15.464 -8.286 546 HB2 ASP 68 2HB ASP 68 -1.137 14.157 -8.658 547 HB3 ASP 68 3HB ASP 68 -1.701 15.402 -9.763 548 H LEU 69 H LEU 69 -2.805 12.198 -9.201 549 HA LEU 69 HA LEU 69 -3.326 12.279 -11.967 550 HB2 LEU 69 2HB LEU 69 -3.318 9.879 -10.080 551 HB3 LEU 69 3HB LEU 69 -3.286 9.769 -11.838 552 HG LEU 69 HG LEU 69 -1.116 11.031 -10.129 553 HD11 LEU 69 1HD1 LEU 69 -1.232 8.618 -9.812 554 HD12 LEU 69 2HD1 LEU 69 0.228 9.076 -10.685 555 HD13 LEU 69 3HD1 LEU 69 -1.133 8.365 -11.559 556 HD21 LEU 69 3HD2 LEU 69 -1.243 12.094 -12.328 557 HD22 LEU 69 1HD2 LEU 69 -1.159 10.516 -13.118 558 HD23 LEU 69 2HD2 LEU 69 0.216 11.119 -12.188 559 H LEU 70 H LEU 70 -5.341 11.316 -9.240 560 HA LEU 70 HA LEU 70 -7.563 10.268 -10.592 561 HB2 LEU 70 2HB LEU 70 -7.442 11.729 -7.913 562 HB3 LEU 70 3HB LEU 70 -8.834 10.821 -8.482 563 HG LEU 70 HG LEU 70 -6.099 9.681 -7.818 564 HD11 LEU 70 1HD1 LEU 70 -8.762 9.314 -6.421 565 HD12 LEU 70 2HD1 LEU 70 -7.390 10.260 -5.835 566 HD13 LEU 70 3HD1 LEU 70 -7.246 8.512 -5.997 567 HD21 LEU 70 3HD2 LEU 70 -8.537 8.217 -8.874 568 HD22 LEU 70 1HD2 LEU 70 -7.049 7.465 -8.301 569 HD23 LEU 70 2HD2 LEU 70 -7.021 8.483 -9.736 570 H ILE 71 H ILE 71 -7.061 13.566 -9.340 571 HA ILE 71 HA ILE 71 -9.443 14.676 -10.486 572 HB ILE 71 HB ILE 71 -6.978 16.083 -9.330 573 HG12 ILE 71 2HG1 ILE 71 -9.603 15.265 -7.976 574 HG13 ILE 71 3HG1 ILE 71 -8.029 14.527 -7.704 575 HG21 ILE 71 1HG2 ILE 71 -8.428 18.048 -8.992 576 HG22 ILE 71 2HG2 ILE 71 -9.770 17.210 -9.773 577 HG23 ILE 71 3HG2 ILE 71 -8.332 17.626 -10.706 578 HD11 ILE 71 3HD1 ILE 71 -8.618 15.986 -5.884 579 HD12 ILE 71 1HD1 ILE 71 -8.815 17.348 -6.988 580 HD13 ILE 71 2HD1 ILE 71 -7.221 16.629 -6.743 581 H LEU 72 H LEU 72 -6.211 14.195 -11.628 582 HA LEU 72 HA LEU 72 -6.044 16.187 -13.674 583 HB2 LEU 72 2HB LEU 72 -4.116 14.982 -12.531 584 HB3 LEU 72 3HB LEU 72 -4.519 13.546 -13.442 585 HG LEU 72 HG LEU 72 -2.520 14.895 -14.262 586 HD11 LEU 72 1HD1 LEU 72 -3.582 13.226 -15.708 587 HD12 LEU 72 2HD1 LEU 72 -2.941 14.582 -16.635 588 HD13 LEU 72 3HD1 LEU 72 -4.680 14.456 -16.347 589 HD21 LEU 72 3HD2 LEU 72 -4.619 16.877 -15.215 590 HD22 LEU 72 1HD2 LEU 72 -2.889 16.926 -15.573 591 HD23 LEU 72 2HD2 LEU 72 -3.452 17.148 -13.920 592 H HIS 73 H HIS 73 -6.917 12.724 -13.641 593 HA HIS 73 HA HIS 73 -7.499 12.667 -16.493 594 HB2 HIS 73 2HB HIS 73 -7.837 10.571 -14.302 595 HB3 HIS 73 3HB HIS 73 -8.334 10.302 -15.970 596 HD1 HIS 73 HD1 HIS 73 -6.684 8.750 -16.942 597 HD2 HIS 73 HD2 HIS 73 -4.839 11.627 -14.583 598 HE1 HIS 73 HE1 HIS 73 -4.227 8.307 -17.143 599 HE2 HIS 73 HE2 HIS 73 -3.137 10.164 -15.857 600 H ASP 74 H ASP 74 -9.446 11.950 -13.570 601 HA ASP 74 HA ASP 74 -11.512 13.756 -13.830 602 HB2 ASP 74 2HB ASP 74 -12.127 12.691 -15.990 603 HB3 ASP 74 3HB ASP 74 -12.217 11.114 -15.219 604 H PHE 75 H PHE 75 -11.581 13.718 -11.599 605 HA PHE 75 HA PHE 75 -13.255 11.819 -10.316 606 HB2 PHE 75 2HB PHE 75 -10.918 10.618 -10.413 607 HB3 PHE 75 3HB PHE 75 -10.419 11.751 -9.173 608 HD1 PHE 75 HD1 PHE 75 -13.612 11.335 -8.076 609 HD2 PHE 75 HD2 PHE 75 -10.128 8.950 -8.690 610 HE1 PHE 75 HE1 PHE 75 -14.385 9.737 -6.377 611 HE2 PHE 75 HE2 PHE 75 -10.910 7.361 -6.989 612 HZ PHE 75 HZ PHE 75 -13.043 7.749 -5.830 613 H THR 76 H THR 76 -14.325 13.065 -8.922 614 HA THR 76 HA THR 76 -13.580 15.719 -8.308 615 HB THR 76 HB THR 76 -15.868 14.024 -7.207 616 HG1 THR 76 HG1 THR 76 -16.990 14.580 -8.989 617 HG21 THR 76 3HG2 THR 76 -15.498 16.116 -5.934 618 HG22 THR 76 1HG2 THR 76 -17.020 16.157 -6.826 619 HG23 THR 76 2HG2 THR 76 -15.619 17.043 -7.430 620 HA PRO 77 HA PRO 77 -11.154 14.934 -4.492 621 HB2 PRO 77 2HB PRO 77 -11.770 17.473 -3.355 622 HB3 PRO 77 3HB PRO 77 -10.373 17.087 -4.375 623 HG2 PRO 77 2HG PRO 77 -12.983 18.329 -5.152 624 HG3 PRO 77 3HG PRO 77 -11.340 18.676 -5.740 625 HD2 PRO 77 2HD PRO 77 -13.020 17.262 -7.243 626 HD3 PRO 77 3HD PRO 77 -11.300 16.804 -7.156 627 H GLU 78 H GLU 78 -14.454 16.193 -4.419 628 HA GLU 78 HA GLU 78 -15.145 15.684 -1.745 629 HB2 GLU 78 2HB GLU 78 -16.914 15.688 -4.227 630 HB3 GLU 78 3HB GLU 78 -17.512 15.761 -2.568 631 HG2 GLU 78 2HG GLU 78 -16.332 17.918 -2.248 632 HG3 GLU 78 3HG GLU 78 -15.755 17.835 -3.913 633 H GLU 79 H GLU 79 -15.273 13.592 -4.592 634 HA GLU 79 HA GLU 79 -16.604 11.416 -3.211 635 HB2 GLU 79 2HB GLU 79 -15.306 11.396 -5.969 636 HB3 GLU 79 3HB GLU 79 -16.436 10.203 -5.328 637 HG2 GLU 79 2HG GLU 79 -17.017 13.089 -6.040 638 HG3 GLU 79 3HG GLU 79 -17.597 11.647 -6.870 639 H ILE 80 H ILE 80 -13.316 12.365 -3.857 640 HA ILE 80 HA ILE 80 -12.049 9.843 -3.307 641 HB ILE 80 HB ILE 80 -10.906 12.684 -3.127 642 HG12 ILE 80 2HG1 ILE 80 -10.723 10.694 -5.451 643 HG13 ILE 80 3HG1 ILE 80 -11.799 12.084 -5.401 644 HG21 ILE 80 1HG2 ILE 80 -9.520 11.081 -1.870 645 HG22 ILE 80 2HG2 ILE 80 -8.676 11.637 -3.313 646 HG23 ILE 80 3HG2 ILE 80 -9.412 10.034 -3.289 647 HD11 ILE 80 3HD1 ILE 80 -9.872 12.552 -6.768 648 HD12 ILE 80 1HD1 ILE 80 -8.784 12.180 -5.427 649 HD13 ILE 80 2HD1 ILE 80 -9.856 13.581 -5.335 650 H LYS 81 H LYS 81 -12.681 12.792 -1.400 651 HA LYS 81 HA LYS 81 -11.409 11.893 0.985 652 HB2 LYS 81 2HB LYS 81 -12.205 13.937 1.991 653 HB3 LYS 81 3HB LYS 81 -11.636 14.271 0.357 654 HG2 LYS 81 2HG LYS 81 -14.115 14.071 -0.354 655 HG3 LYS 81 3HG LYS 81 -14.487 14.183 1.369 656 HD2 LYS 81 2HD LYS 81 -12.988 16.255 -0.290 657 HD3 LYS 81 3HD LYS 81 -14.668 16.371 0.252 658 HE2 LYS 81 2HE LYS 81 -13.868 16.347 2.622 659 HE3 LYS 81 3HE LYS 81 -12.204 16.360 2.029 660 HZ1 LYS 81 3HZ LYS 81 -12.896 18.584 2.576 661 HZ2 LYS 81 1HZ LYS 81 -14.254 18.464 1.579 662 HZ3 LYS 81 2HZ LYS 81 -12.704 18.475 0.903 663 H SER 82 H SER 82 -14.667 11.587 -0.242 664 HA SER 82 HA SER 82 -16.037 11.003 2.175 665 HB2 SER 82 2HB SER 82 -17.802 10.057 0.681 666 HB3 SER 82 3HB SER 82 -17.230 11.624 0.114 667 HG SER 82 HG SER 82 -15.686 10.068 -1.134 668 H PHE 83 H PHE 83 -13.962 9.077 0.152 669 HA PHE 83 HA PHE 83 -14.707 6.514 1.275 670 HB2 PHE 83 2HB PHE 83 -12.360 7.362 -0.466 671 HB3 PHE 83 3HB PHE 83 -12.604 5.706 0.077 672 HD1 PHE 83 HD2 PHE 83 -15.547 5.399 -0.274 673 HD2 PHE 83 HD1 PHE 83 -12.648 7.217 -2.843 674 HE1 PHE 83 HE2 PHE 83 -16.967 4.926 -2.223 675 HE2 PHE 83 HE1 PHE 83 -14.084 6.731 -4.790 676 HZ PHE 83 HZ PHE 83 -16.245 5.591 -4.478 677 H PHE 84 H PHE 84 -12.858 9.107 2.455 678 HA PHE 84 HA PHE 84 -11.234 7.470 4.279 679 HB2 PHE 84 2HB PHE 84 -11.541 10.493 3.976 680 HB3 PHE 84 3HB PHE 84 -10.544 9.741 5.216 681 HD1 PHE 84 HD1 PHE 84 -10.846 10.396 1.599 682 HD2 PHE 84 HD2 PHE 84 -8.398 8.730 4.662 683 HE1 PHE 84 HE1 PHE 84 -8.942 10.362 0.040 684 HE2 PHE 84 HE2 PHE 84 -6.500 8.681 3.109 685 HZ PHE 84 HZ PHE 84 -6.762 9.498 0.800 686 H GLU 85 H GLU 85 -14.208 9.225 4.204 687 HA GLU 85 HA GLU 85 -14.481 9.564 7.067 688 HB2 GLU 85 2HB GLU 85 -16.474 10.043 4.812 689 HB3 GLU 85 3HB GLU 85 -16.641 10.610 6.469 690 HG2 GLU 85 2HG GLU 85 -14.690 12.086 6.169 691 HG3 GLU 85 3HG GLU 85 -14.489 11.499 4.516 692 H ASN 86 H ASN 86 -14.771 7.691 8.176 693 HA ASN 86 HA ASN 86 -16.433 5.483 7.337 694 HB2 ASN 86 2HB ASN 86 -14.512 5.028 8.774 695 HB3 ASN 86 3HB ASN 86 -15.098 6.140 10.002 696 HD21 ASN 86 1HD2 ASN 86 -15.620 3.005 8.499 697 HD22 ASN 86 2HD2 ASN 86 -16.544 2.325 9.789 698 H LYS 87 H LYS 87 -18.476 6.194 6.969 699 HA LYS 87 HA LYS 87 -20.016 7.553 9.127 700 HB2 LYS 87 2HB LYS 87 -20.238 7.889 6.099 701 HB3 LYS 87 3HB LYS 87 -21.312 8.646 7.271 702 HG2 LYS 87 2HG LYS 87 -19.479 9.992 8.154 703 HG3 LYS 87 3HG LYS 87 -18.323 9.165 7.107 704 HD2 LYS 87 2HD LYS 87 -20.628 10.923 6.153 705 HD3 LYS 87 3HD LYS 87 -18.929 11.399 6.222 706 HE2 LYS 87 2HE LYS 87 -18.394 9.565 4.606 707 HE3 LYS 87 3HE LYS 87 -20.122 9.219 4.475 708 HZ1 LYS 87 3HZ LYS 87 -20.426 11.535 3.695 709 HZ2 LYS 87 1HZ LYS 87 -19.449 10.620 2.665 710 HZ3 LYS 87 2HZ LYS 87 -18.752 11.744 3.713 711 H GLY 88 H GLY 88 -19.758 4.638 8.534 712 HA2 GLY 88 2HA GLY 88 -22.098 3.535 9.131 713 HA3 GLY 88 3HA GLY 88 -22.352 3.834 7.410 714 H LYS 89 H LYS 89 -19.826 3.356 6.425 715 HA LYS 89 HA LYS 89 -19.310 0.490 6.993 716 HB2 LYS 89 2HB LYS 89 -19.336 1.886 4.277 717 HB3 LYS 89 3HB LYS 89 -18.759 0.248 4.532 718 HG2 LYS 89 2HG LYS 89 -21.594 1.040 5.216 719 HG3 LYS 89 3HG LYS 89 -21.130 0.606 3.575 720 HD2 LYS 89 2HD LYS 89 -22.041 -1.375 4.538 721 HD3 LYS 89 3HD LYS 89 -20.297 -1.618 4.500 722 HE2 LYS 89 2HE LYS 89 -20.133 -1.183 6.870 723 HE3 LYS 89 3HE LYS 89 -21.826 -0.707 6.955 724 HZ1 LYS 89 3HZ LYS 89 -21.475 -2.959 7.783 725 HZ2 LYS 89 1HZ LYS 89 -20.844 -3.439 6.292 726 HZ3 LYS 89 2HZ LYS 89 -22.458 -2.974 6.412 727 H ARG 90 H ARG 90 -17.179 -0.185 6.031 728 HA ARG 90 HA ARG 90 -15.028 1.059 7.268 729 HB2 ARG 90 2HB ARG 90 -15.049 -1.322 6.605 730 HB3 ARG 90 3HB ARG 90 -15.047 -0.876 4.903 731 HG2 ARG 90 2HG ARG 90 -12.794 0.158 5.227 732 HG3 ARG 90 3HG ARG 90 -12.803 -0.414 6.899 733 HD2 ARG 90 2HD ARG 90 -12.964 -2.170 4.427 734 HD3 ARG 90 3HD ARG 90 -11.521 -1.900 5.409 735 HE ARG 90 HE ARG 90 -13.784 -2.933 6.885 736 HH11 ARG 90 1HH1 ARG 90 -11.001 -3.823 4.954 737 HH12 ARG 90 2HH1 ARG 90 -10.877 -5.411 5.640 738 HH21 ARG 90 1HH2 ARG 90 -13.582 -4.990 7.828 739 HH22 ARG 90 2HH2 ARG 90 -12.343 -6.071 7.270 740 HA PRO 91 HA PRO 91 -13.974 4.295 4.217 741 HB2 PRO 91 2HB PRO 91 -11.412 4.826 5.166 742 HB3 PRO 91 3HB PRO 91 -12.889 5.509 5.873 743 HG2 PRO 91 2HG PRO 91 -11.260 3.178 6.811 744 HG3 PRO 91 3HG PRO 91 -12.042 4.468 7.756 745 HD2 PRO 91 2HD PRO 91 -13.137 2.000 7.521 746 HD3 PRO 91 3HD PRO 91 -14.131 3.464 7.665 747 H VAL 92 H VAL 92 -13.368 3.816 2.196 748 HA VAL 92 HA VAL 92 -11.936 1.440 1.452 749 HB VAL 92 HB VAL 92 -12.680 3.832 -0.309 750 HG11 VAL 92 1HG1 VAL 92 -11.049 2.338 -1.383 751 HG12 VAL 92 2HG1 VAL 92 -12.613 2.238 -2.192 752 HG13 VAL 92 3HG1 VAL 92 -12.101 0.948 -1.099 753 HG21 VAL 92 3HG2 VAL 92 -14.664 2.979 0.878 754 HG22 VAL 92 1HG2 VAL 92 -14.341 1.348 0.282 755 HG23 VAL 92 2HG2 VAL 92 -14.765 2.639 -0.849 756 H PHE 93 H PHE 93 -11.267 4.913 1.266 757 HA PHE 93 HA PHE 93 -8.365 4.470 1.004 758 HB2 PHE 93 2HB PHE 93 -9.973 7.070 0.955 759 HB3 PHE 93 3HB PHE 93 -8.244 6.927 0.666 760 HD1 PHE 93 HD1 PHE 93 -9.241 4.171 -1.087 761 HD2 PHE 93 HD2 PHE 93 -9.749 8.420 -1.219 762 HE1 PHE 93 HE1 PHE 93 -9.671 4.054 -3.508 763 HE2 PHE 93 HE2 PHE 93 -10.179 8.287 -3.634 764 HZ PHE 93 HZ PHE 93 -10.143 6.112 -4.781 765 H VAL 94 H VAL 94 -7.322 4.276 2.903 766 HA VAL 94 HA VAL 94 -8.427 5.524 5.365 767 HB VAL 94 HB VAL 94 -6.590 3.073 5.167 768 HG11 VAL 94 1HG1 VAL 94 -7.184 2.703 7.534 769 HG12 VAL 94 2HG1 VAL 94 -8.125 4.198 7.540 770 HG13 VAL 94 3HG1 VAL 94 -6.377 4.254 7.301 771 HG21 VAL 94 3HG2 VAL 94 -8.553 1.687 5.705 772 HG22 VAL 94 1HG2 VAL 94 -8.788 2.547 4.182 773 HG23 VAL 94 2HG2 VAL 94 -9.598 3.109 5.647 774 H LYS 95 H LYS 95 -6.886 6.477 6.821 775 HA LYS 95 HA LYS 95 -4.093 6.754 6.036 776 HB2 LYS 95 2HB LYS 95 -4.098 9.196 6.137 777 HB3 LYS 95 3HB LYS 95 -5.191 8.640 4.878 778 HG2 LYS 95 2HG LYS 95 -7.133 9.115 6.270 779 HG3 LYS 95 3HG LYS 95 -6.100 9.554 7.637 780 HD2 LYS 95 2HD LYS 95 -6.183 11.010 4.957 781 HD3 LYS 95 3HD LYS 95 -7.000 11.547 6.427 782 HE2 LYS 95 2HE LYS 95 -4.865 11.866 7.553 783 HE3 LYS 95 3HE LYS 95 -3.993 11.178 6.181 784 HZ1 LYS 95 3HZ LYS 95 -3.916 13.601 6.198 785 HZ2 LYS 95 1HZ LYS 95 -5.600 13.677 6.101 786 HZ3 LYS 95 2HZ LYS 95 -4.705 13.026 4.820 787 H GLY 96 H GLY 96 -2.928 8.120 7.718 788 HA2 GLY 96 2HA GLY 96 -3.281 9.057 10.070 789 HA3 GLY 96 3HA GLY 96 -3.829 7.424 10.455 790 H SER 97 H SER 97 -2.098 7.107 11.934 791 HA SER 97 HA SER 97 0.639 6.941 10.964 792 HB2 SER 97 2HB SER 97 -0.065 7.452 13.379 793 HB3 SER 97 3HB SER 97 -0.508 5.752 13.531 794 HG SER 97 HG SER 97 2.059 6.778 12.862 795 H LEU 98 H LEU 98 1.742 4.627 11.419 796 HA LEU 98 HA LEU 98 0.832 2.911 9.397 797 HB2 LEU 98 2HB LEU 98 3.184 2.983 10.160 798 HB3 LEU 98 3HB LEU 98 2.715 2.301 11.710 799 HG LEU 98 HG LEU 98 2.019 0.186 10.525 800 HD11 LEU 98 1HD1 LEU 98 2.747 -0.231 8.223 801 HD12 LEU 98 2HD1 LEU 98 3.276 1.446 8.068 802 HD13 LEU 98 3HD1 LEU 98 1.565 1.075 8.299 803 HD21 LEU 98 3HD2 LEU 98 4.282 -0.681 10.168 804 HD22 LEU 98 1HD2 LEU 98 4.213 0.332 11.610 805 HD23 LEU 98 2HD2 LEU 98 4.928 0.963 10.123 806 H GLU 99 H GLU 99 0.582 2.555 12.926 807 HA GLU 99 HA GLU 99 -0.880 0.081 12.811 808 HB2 GLU 99 2HB GLU 99 -0.313 1.915 15.186 809 HB3 GLU 99 3HB GLU 99 -0.996 0.288 15.281 810 HG2 GLU 99 2HG GLU 99 1.114 -0.568 14.186 811 HG3 GLU 99 3HG GLU 99 1.773 1.059 14.332 812 H SER 100 H SER 100 -1.695 3.474 13.245 813 HA SER 100 HA SER 100 -4.336 3.185 14.253 814 HB2 SER 100 2HB SER 100 -3.045 5.490 12.723 815 HB3 SER 100 3HB SER 100 -4.534 5.601 13.658 816 HG SER 100 HG SER 100 -2.553 4.521 15.153 817 H ALA 101 H ALA 101 -3.089 3.879 10.994 818 HA ALA 101 HA ALA 101 -5.519 3.817 9.558 819 HB1 ALA 101 3HB ALA 101 -3.452 4.838 8.683 820 HB2 ALA 101 1HB ALA 101 -4.079 3.629 7.558 821 HB3 ALA 101 2HB ALA 101 -2.692 3.246 8.587 822 H ALA 102 H ALA 102 -3.322 1.313 10.658 823 HA ALA 102 HA ALA 102 -4.219 -0.850 9.060 824 HB1 ALA 102 3HB ALA 102 -2.093 -0.856 10.316 825 HB2 ALA 102 1HB ALA 102 -3.085 -2.261 10.709 826 HB3 ALA 102 2HB ALA 102 -2.991 -0.903 11.835 827 H GLU 103 H GLU 103 -5.132 0.317 12.294 828 HA GLU 103 HA GLU 103 -7.035 -1.676 12.930 829 HB2 GLU 103 2HB GLU 103 -6.914 1.199 13.975 830 HB3 GLU 103 3HB GLU 103 -7.836 -0.121 14.695 831 HG2 GLU 103 2HG GLU 103 -5.662 -1.336 15.067 832 HG3 GLU 103 3HG GLU 103 -4.824 0.094 14.500 833 H GLN 104 H GLN 104 -7.354 1.502 11.395 834 HA GLN 104 HA GLN 104 -10.204 1.529 11.183 835 HB2 GLN 104 2HB GLN 104 -8.113 3.080 9.602 836 HB3 GLN 104 3HB GLN 104 -9.839 3.439 9.620 837 HG2 GLN 104 2HG GLN 104 -9.738 4.023 11.981 838 HG3 GLN 104 3HG GLN 104 -8.042 3.540 12.061 839 HE21 GLN 104 1HE2 GLN 104 -6.467 4.886 11.138 840 HE22 GLN 104 2HE2 GLN 104 -6.798 6.511 10.647 841 H ALA 105 H ALA 105 -7.624 0.467 8.993 842 HA ALA 105 HA ALA 105 -9.324 -0.154 6.748 843 HB1 ALA 105 3HB ALA 105 -7.310 -1.247 5.818 844 HB2 ALA 105 1HB ALA 105 -6.490 -1.071 7.375 845 HB3 ALA 105 2HB ALA 105 -6.936 0.359 6.442 846 H GLY 106 H GLY 106 -8.441 -1.758 9.697 847 HA2 GLY 106 2HA GLY 106 -9.410 -3.614 10.678 848 HA3 GLY 106 3HA GLY 106 -10.332 -3.902 9.206 849 H ILE 107 H ILE 107 -6.862 -3.534 9.265 850 HA ILE 107 HA ILE 107 -6.424 -6.280 8.290 851 HB ILE 107 HB ILE 107 -4.356 -4.031 8.578 852 HG12 ILE 107 2HG1 ILE 107 -6.015 -4.666 6.087 853 HG13 ILE 107 3HG1 ILE 107 -6.229 -3.253 7.117 854 HG21 ILE 107 1HG2 ILE 107 -4.343 -6.486 6.777 855 HG22 ILE 107 2HG2 ILE 107 -3.420 -6.304 8.269 856 HG23 ILE 107 3HG2 ILE 107 -3.072 -5.264 6.891 857 HD11 ILE 107 3HD1 ILE 107 -5.013 -2.681 5.126 858 HD12 ILE 107 1HD1 ILE 107 -3.783 -3.896 5.469 859 HD13 ILE 107 2HD1 ILE 107 -3.967 -2.493 6.531 860 H VAL 108 H VAL 108 -4.678 -7.607 9.319 861 HA VAL 108 HA VAL 108 -4.507 -7.429 12.173 862 HB VAL 108 HB VAL 108 -2.704 -9.086 10.351 863 HG11 VAL 108 1HG1 VAL 108 -2.419 -10.512 12.357 864 HG12 VAL 108 2HG1 VAL 108 -3.419 -9.397 13.292 865 HG13 VAL 108 3HG1 VAL 108 -1.866 -8.860 12.643 866 HG21 VAL 108 3HG2 VAL 108 -5.052 -9.621 9.849 867 HG22 VAL 108 1HG2 VAL 108 -5.386 -9.877 11.565 868 HG23 VAL 108 2HG2 VAL 108 -4.291 -10.962 10.703 869 H VAL 109 H VAL 109 -3.574 -5.736 12.987 870 HA VAL 109 HA VAL 109 -1.924 -3.898 11.736 871 HB VAL 109 HB VAL 109 -2.270 -4.321 14.740 872 HG11 VAL 109 1HG1 VAL 109 -1.683 -1.929 14.985 873 HG12 VAL 109 2HG1 VAL 109 -1.353 -1.834 13.253 874 HG13 VAL 109 3HG1 VAL 109 -0.354 -2.858 14.286 875 HG21 VAL 109 3HG2 VAL 109 -4.080 -2.648 14.608 876 HG22 VAL 109 1HG2 VAL 109 -4.434 -4.047 13.588 877 HG23 VAL 109 2HG2 VAL 109 -3.865 -2.544 12.860 878 H ASP 110 H ASP 110 -1.049 -6.325 14.179 879 HA ASP 110 HA ASP 110 1.635 -5.578 14.566 880 HB2 ASP 110 2HB ASP 110 0.288 -6.989 16.161 881 HB3 ASP 110 3HB ASP 110 0.391 -8.336 15.038 882 H GLU 111 H GLU 111 0.153 -7.805 12.270 883 HA GLU 111 HA GLU 111 2.572 -8.983 11.325 884 HB2 GLU 111 2HB GLU 111 -0.178 -8.824 10.060 885 HB3 GLU 111 3HB GLU 111 1.159 -9.732 9.362 886 HG2 GLU 111 2HG GLU 111 -0.123 -10.243 12.060 887 HG3 GLU 111 3HG GLU 111 -0.397 -11.172 10.591 888 H LEU 112 H LEU 112 0.554 -6.229 10.076 889 HA LEU 112 HA LEU 112 2.411 -5.777 7.912 890 HB2 LEU 112 2HB LEU 112 1.241 -3.665 7.445 891 HB3 LEU 112 3HB LEU 112 0.186 -5.055 7.536 892 HG LEU 112 HG LEU 112 -0.439 -4.248 9.909 893 HD11 LEU 112 1HD1 LEU 112 1.348 -2.617 10.294 894 HD12 LEU 112 2HD1 LEU 112 -0.237 -1.857 10.390 895 HD13 LEU 112 3HD1 LEU 112 0.764 -1.630 8.952 896 HD21 LEU 112 3HD2 LEU 112 -1.902 -4.098 7.908 897 HD22 LEU 112 1HD2 LEU 112 -1.266 -2.486 7.581 898 HD23 LEU 112 2HD2 LEU 112 -2.175 -2.804 9.061 899 H VAL 113 H VAL 113 2.282 -4.613 11.208 900 HA VAL 113 HA VAL 113 4.267 -2.605 11.032 901 HB VAL 113 HB VAL 113 3.556 -4.428 13.388 902 HG11 VAL 113 1HG1 VAL 113 5.868 -3.607 13.705 903 HG12 VAL 113 2HG1 VAL 113 4.771 -2.849 14.860 904 HG13 VAL 113 3HG1 VAL 113 5.329 -1.943 13.450 905 HG21 VAL 113 3HG2 VAL 113 1.744 -2.923 12.665 906 HG22 VAL 113 1HG2 VAL 113 2.815 -1.530 12.817 907 HG23 VAL 113 2HG2 VAL 113 2.350 -2.451 14.252 908 H GLN 114 H GLN 114 4.424 -6.115 11.450 909 HA GLN 114 HA GLN 114 7.211 -6.431 11.750 910 HB2 GLN 114 2HB GLN 114 5.081 -8.290 10.618 911 HB3 GLN 114 3HB GLN 114 6.763 -8.784 10.772 912 HG2 GLN 114 2HG GLN 114 5.099 -7.827 13.116 913 HG3 GLN 114 3HG GLN 114 5.219 -9.516 12.639 914 HE21 GLN 114 1HE2 GLN 114 6.952 -6.796 14.005 915 HE22 GLN 114 2HE2 GLN 114 8.291 -7.705 14.613 916 H THR 115 H THR 115 5.180 -6.554 8.757 917 HA THR 115 HA THR 115 7.365 -7.171 7.063 918 HB THR 115 HB THR 115 4.973 -7.634 6.422 919 HG1 THR 115 HG1 THR 115 6.390 -7.851 4.768 920 HG21 THR 115 3HG2 THR 115 3.939 -5.457 6.940 921 HG22 THR 115 1HG2 THR 115 3.689 -5.878 5.246 922 HG23 THR 115 2HG2 THR 115 4.908 -4.679 5.688 923 H VAL 116 H VAL 116 5.959 -4.046 8.009 924 HA VAL 116 HA VAL 116 7.421 -2.504 6.065 925 HB VAL 116 HB VAL 116 5.821 -1.641 8.524 926 HG11 VAL 116 1HG1 VAL 116 7.047 0.185 6.404 927 HG12 VAL 116 2HG1 VAL 116 7.511 0.097 8.104 928 HG13 VAL 116 3HG1 VAL 116 5.910 0.686 7.661 929 HG21 VAL 116 3HG2 VAL 116 4.479 -2.629 6.709 930 HG22 VAL 116 1HG2 VAL 116 5.157 -1.480 5.551 931 HG23 VAL 116 2HG2 VAL 116 4.132 -0.907 6.872 932 H LYS 117 H LYS 117 7.950 -3.304 9.523 933 HA LYS 117 HA LYS 117 10.203 -1.521 9.795 934 HB2 LYS 117 2HB LYS 117 10.498 -2.407 12.007 935 HB3 LYS 117 3HB LYS 117 8.769 -2.243 11.728 936 HG2 LYS 117 2HG LYS 117 8.687 -4.720 11.244 937 HG3 LYS 117 3HG LYS 117 10.381 -4.819 11.734 938 HD2 LYS 117 2HD LYS 117 8.054 -3.916 13.488 939 HD3 LYS 117 3HD LYS 117 8.882 -5.470 13.585 940 HE2 LYS 117 2HE LYS 117 10.954 -4.351 14.274 941 HE3 LYS 117 3HE LYS 117 10.184 -2.771 14.104 942 HZ1 LYS 117 3HZ LYS 117 9.375 -4.891 16.031 943 HZ2 LYS 117 1HZ LYS 117 8.633 -3.385 15.865 944 HZ3 LYS 117 2HZ LYS 117 10.228 -3.481 16.412 945 H ASN 118 H ASN 118 9.796 -4.949 9.025 946 HA ASN 118 HA ASN 118 12.552 -5.692 8.925 947 HB2 ASN 118 2HB ASN 118 10.106 -6.886 7.517 948 HB3 ASN 118 3HB ASN 118 11.722 -7.583 7.388 949 HD21 ASN 118 1HD2 ASN 118 9.236 -8.704 8.532 950 HD22 ASN 118 2HD2 ASN 118 9.621 -9.140 10.156 951 H TYR 119 H TYR 119 10.219 -4.509 6.563 952 HA TYR 119 HA TYR 119 11.657 -4.593 4.200 953 HB2 TYR 119 2HB TYR 119 9.228 -4.049 4.331 954 HB3 TYR 119 3HB TYR 119 9.610 -2.496 5.055 955 HD1 TYR 119 HD1 TYR 119 10.557 -4.439 1.952 956 HD2 TYR 119 HD2 TYR 119 9.422 -0.666 3.613 957 HE1 TYR 119 HE1 TYR 119 10.548 -3.444 -0.295 958 HE2 TYR 119 HE2 TYR 119 9.421 0.323 1.369 959 HH TYR 119 HH TYR 119 10.256 -0.033 -0.815 960 H GLN 120 H GLN 120 11.272 -1.806 6.386 961 HA GLN 120 HA GLN 120 13.060 -0.078 5.105 962 HB2 GLN 120 2HB GLN 120 12.147 -0.100 8.017 963 HB3 GLN 120 3HB GLN 120 12.994 1.240 7.245 964 HG2 GLN 120 2HG GLN 120 11.080 1.395 5.597 965 HG3 GLN 120 3HG GLN 120 10.228 0.196 6.566 966 HE21 GLN 120 1HE2 GLN 120 9.555 3.009 5.942 967 HE22 GLN 120 2HE2 GLN 120 9.349 3.796 7.461 968 H GLY 121 H GLY 121 13.595 -2.516 7.592 969 HA2 GLY 121 2HA GLY 121 16.235 -1.888 8.367 970 HA3 GLY 121 3HA GLY 121 15.473 -3.472 8.475 971 H TYR 122 H TYR 122 15.060 -4.212 5.849 972 HA TYR 122 HA TYR 122 17.804 -4.835 5.112 973 HB2 TYR 122 2HB TYR 122 16.943 -6.564 3.648 974 HB3 TYR 122 3HB TYR 122 16.215 -6.686 5.234 975 HD1 TYR 122 HD2 TYR 122 15.428 -5.314 1.777 976 HD2 TYR 122 HD1 TYR 122 13.903 -7.103 5.349 977 HE1 TYR 122 HE2 TYR 122 13.226 -5.593 0.711 978 HE2 TYR 122 HE1 TYR 122 11.721 -7.395 4.270 979 HH TYR 122 HH TYR 122 10.463 -6.166 2.259 980 H VAL 123 H VAL 123 15.412 -2.646 4.022 981 HA VAL 123 HA VAL 123 16.197 -2.228 1.336 982 HB VAL 123 HB VAL 123 14.768 -0.454 3.366 983 HG11 VAL 123 1HG1 VAL 123 15.533 0.384 0.539 984 HG12 VAL 123 2HG1 VAL 123 16.066 1.140 2.042 985 HG13 VAL 123 3HG1 VAL 123 14.372 1.235 1.564 986 HG21 VAL 123 3HG2 VAL 123 13.865 -1.628 0.704 987 HG22 VAL 123 1HG2 VAL 123 12.852 -0.722 1.833 988 HG23 VAL 123 2HG2 VAL 123 13.497 -2.300 2.291 989 H GLN 124 H GLN 124 17.139 -0.487 4.319 990 HA GLN 124 HA GLN 124 19.173 1.081 2.997 991 HB2 GLN 124 2HB GLN 124 19.703 1.908 5.302 992 HB3 GLN 124 3HB GLN 124 18.005 2.060 4.874 993 HG2 GLN 124 2HG GLN 124 17.632 -0.124 6.148 994 HG3 GLN 124 3HG GLN 124 19.269 0.078 6.770 995 HE21 GLN 124 1HE2 GLN 124 16.727 0.056 8.225 996 HE22 GLN 124 2HE2 GLN 124 16.625 1.569 9.050 997 H ASP 125 H ASP 125 19.082 -2.031 4.467 998 HA ASP 125 HA ASP 125 21.914 -2.380 4.885 999 HB2 ASP 125 2HB ASP 125 20.271 -3.739 6.112 1000 HB3 ASP 125 3HB ASP 125 19.612 -4.374 4.614 1001 H GLY 126 H GLY 126 19.701 -2.658 2.163 1002 HA2 GLY 126 2HA GLY 126 20.368 -2.536 -0.085 1003 HA3 GLY 126 3HA GLY 126 21.942 -3.190 0.331 1004 H HIS 127 H HIS 127 20.555 -5.384 1.958 1005 HA HIS 127 HA HIS 127 20.374 -7.258 -0.247 1006 HB2 HIS 127 2HB HIS 127 21.556 -7.876 1.858 1007 HB3 HIS 127 3HB HIS 127 20.039 -7.763 2.745 1008 HD1 HIS 127 HD1 HIS 127 21.765 -9.851 0.115 1009 HD2 HIS 127 HD2 HIS 127 18.407 -10.047 2.556 1010 HE1 HIS 127 HE1 HIS 127 20.921 -12.206 -0.084 1011 HE2 HIS 127 HE2 HIS 127 18.901 -12.307 1.409 1012 H ASP 128 H ASP 128 18.533 -7.449 -1.332 1013 HA ASP 128 HA ASP 128 15.961 -6.655 -0.394 1014 HB2 ASP 128 2HB ASP 128 15.139 -7.485 -2.551 1015 HB3 ASP 128 3HB ASP 128 16.622 -6.578 -2.789 1016 H HIS 129 H HIS 129 14.138 -7.971 -0.005 1017 HA HIS 129 HA HIS 129 14.548 -10.880 0.281 1018 HB2 HIS 129 2HB HIS 129 13.056 -9.042 2.194 1019 HB3 HIS 129 3HB HIS 129 12.765 -10.772 2.140 1020 HD1 HIS 129 HD1 HIS 129 13.836 -11.786 4.125 1021 HD2 HIS 129 HD2 HIS 129 16.209 -8.768 2.528 1022 HE1 HIS 129 HE1 HIS 129 15.891 -11.700 5.571 1023 HE2 HIS 129 HE2 HIS 129 17.249 -9.802 4.650 1024 H ASP 130 H ASP 130 11.856 -8.565 0.526 1025 HA ASP 130 HA ASP 130 9.642 -8.918 -0.107 1026 HB2 ASP 130 2HB ASP 130 11.095 -8.179 -2.685 1027 HB3 ASP 130 3HB ASP 130 9.385 -7.917 -2.378 1028 H PHE 131 H PHE 131 10.826 -9.893 -3.231 1029 HA PHE 131 HA PHE 131 10.228 -12.718 -2.899 1030 HB2 PHE 131 2HB PHE 131 8.977 -11.016 -5.103 1031 HB3 PHE 131 3HB PHE 131 8.925 -12.778 -5.041 1032 HD1 PHE 131 HD1 PHE 131 7.826 -13.863 -2.950 1033 HD2 PHE 131 HD2 PHE 131 7.263 -9.754 -4.015 1034 HE1 PHE 131 HE1 PHE 131 5.839 -13.754 -1.497 1035 HE2 PHE 131 HE2 PHE 131 5.277 -9.669 -2.568 1036 HZ PHE 131 HZ PHE 131 4.569 -11.659 -1.312 1037 H GLY 132 H GLY 132 12.504 -10.627 -3.419 1038 HA2 GLY 132 2HA GLY 132 14.605 -11.011 -4.333 1039 HA3 GLY 132 3HA GLY 132 13.929 -12.208 -5.450 1040 H ARG 133 H ARG 133 14.944 -8.974 -5.074 1041 HA ARG 133 HA ARG 133 14.503 -8.399 -7.878 1042 HB2 ARG 133 2HB ARG 133 13.451 -6.173 -7.460 1043 HB3 ARG 133 3HB ARG 133 12.409 -7.520 -7.034 1044 HG2 ARG 133 2HG ARG 133 12.730 -7.127 -4.664 1045 HG3 ARG 133 3HG ARG 133 14.007 -5.942 -4.970 1046 HD2 ARG 133 2HD ARG 133 12.439 -4.383 -5.919 1047 HD3 ARG 133 3HD ARG 133 11.163 -5.595 -5.971 1048 HE ARG 133 HE ARG 133 12.002 -5.109 -3.283 1049 HH11 ARG 133 1HH1 ARG 133 10.065 -3.706 -5.900 1050 HH12 ARG 133 2HH1 ARG 133 9.028 -2.834 -4.813 1051 HH21 ARG 133 1HH2 ARG 133 10.555 -4.016 -1.886 1052 HH22 ARG 133 2HH2 ARG 133 9.310 -3.009 -2.552 1053 H ASP 134 H ASP 134 15.304 -5.909 -8.169 1054 HA ASP 134 HA ASP 134 18.048 -5.823 -7.315 1055 HB2 ASP 134 2HB ASP 134 16.353 -3.767 -8.795 1056 HB3 ASP 134 3HB ASP 134 18.095 -3.652 -8.561 1057 HA PRO 135 HA PRO 135 17.572 -3.312 -3.550 1058 HB2 PRO 135 2HB PRO 135 20.095 -2.121 -3.526 1059 HB3 PRO 135 3HB PRO 135 19.771 -3.775 -2.969 1060 HG2 PRO 135 2HG PRO 135 20.841 -2.848 -5.618 1061 HG3 PRO 135 3HG PRO 135 21.356 -4.220 -4.608 1062 HD2 PRO 135 2HD PRO 135 19.785 -4.592 -6.766 1063 HD3 PRO 135 3HD PRO 135 19.591 -5.576 -5.300 1064 H LYS 136 H LYS 136 18.077 -2.008 -6.697 1065 HA LYS 136 HA LYS 136 18.034 0.776 -6.056 1066 HB2 LYS 136 2HB LYS 136 17.699 1.162 -8.438 1067 HB3 LYS 136 3HB LYS 136 18.902 -0.104 -8.218 1068 HG2 LYS 136 2HG LYS 136 17.096 -1.784 -8.693 1069 HG3 LYS 136 3HG LYS 136 16.008 -0.442 -9.037 1070 HD2 LYS 136 2HD LYS 136 16.840 -1.274 -11.141 1071 HD3 LYS 136 3HD LYS 136 17.580 0.303 -10.859 1072 HE2 LYS 136 2HE LYS 136 19.649 -0.834 -10.082 1073 HE3 LYS 136 3HE LYS 136 18.895 -2.400 -10.400 1074 HZ1 LYS 136 3HZ LYS 136 18.691 -1.706 -12.761 1075 HZ2 LYS 136 1HZ LYS 136 20.292 -1.816 -12.233 1076 HZ3 LYS 136 2HZ LYS 136 19.564 -0.305 -12.404 1077 H TYR 137 H TYR 137 15.533 -1.643 -6.344 1078 HA TYR 137 HA TYR 137 13.341 0.297 -6.478 1079 HB2 TYR 137 2HB TYR 137 13.333 -2.750 -6.298 1080 HB3 TYR 137 3HB TYR 137 11.874 -1.764 -6.407 1081 HD1 TYR 137 HD2 TYR 137 11.459 -0.378 -8.481 1082 HD2 TYR 137 HD1 TYR 137 14.639 -3.222 -8.282 1083 HE1 TYR 137 HE2 TYR 137 11.684 -0.300 -10.927 1084 HE2 TYR 137 HE1 TYR 137 14.878 -3.127 -10.722 1085 HH TYR 137 HH TYR 137 13.642 -2.546 -12.681 1086 H LEU 138 H LEU 138 15.160 -1.332 -4.081 1087 HA LEU 138 HA LEU 138 13.304 -1.330 -1.917 1088 HB2 LEU 138 2HB LEU 138 16.350 -1.238 -1.891 1089 HB3 LEU 138 3HB LEU 138 15.351 -1.516 -0.475 1090 HG LEU 138 HG LEU 138 15.725 -3.371 -2.849 1091 HD11 LEU 138 1HD1 LEU 138 16.456 -3.729 0.082 1092 HD12 LEU 138 2HD1 LEU 138 17.577 -3.331 -1.224 1093 HD13 LEU 138 3HD1 LEU 138 16.744 -4.878 -1.228 1094 HD21 LEU 138 3HD2 LEU 138 14.233 -4.961 -1.700 1095 HD22 LEU 138 1HD2 LEU 138 13.386 -3.491 -2.178 1096 HD23 LEU 138 2HD2 LEU 138 13.845 -3.734 -0.490 1097 H HIS 139 H HIS 139 12.320 0.590 -1.422 1098 HA HIS 139 HA HIS 139 14.010 2.757 -0.337 1099 HB2 HIS 139 2HB HIS 139 11.549 3.283 -2.068 1100 HB3 HIS 139 3HB HIS 139 12.530 4.500 -1.261 1101 HD1 HIS 139 HD1 HIS 139 11.968 3.242 -4.471 1102 HD2 HIS 139 HD2 HIS 139 15.421 4.209 -2.369 1103 HE1 HIS 139 HE1 HIS 139 13.739 3.588 -6.208 1104 HE2 HIS 139 HE2 HIS 139 15.837 4.035 -4.916 1105 H GLN 140 H GLN 140 13.168 3.619 1.552 1106 HA GLN 140 HA GLN 140 10.924 2.260 2.807 1107 HB2 GLN 140 2HB GLN 140 12.546 4.596 3.933 1108 HB3 GLN 140 3HB GLN 140 11.467 3.530 4.816 1109 HG2 GLN 140 2HG GLN 140 13.422 2.534 5.417 1110 HG3 GLN 140 3HG GLN 140 13.172 1.663 3.913 1111 HE21 GLN 140 1HE2 GLN 140 15.645 2.143 5.328 1112 HE22 GLN 140 2HE2 GLN 140 16.685 2.993 4.237 1113 H PHE 141 H PHE 141 9.136 3.469 3.784 1114 HA PHE 141 HA PHE 141 7.997 5.475 2.030 1115 HB2 PHE 141 2HB PHE 141 6.896 4.358 4.658 1116 HB3 PHE 141 3HB PHE 141 5.992 5.247 3.437 1117 HD1 PHE 141 HD1 PHE 141 5.605 4.173 1.160 1118 HD2 PHE 141 HD2 PHE 141 7.166 1.993 4.494 1119 HE1 PHE 141 HE1 PHE 141 4.997 2.052 0.075 1120 HE2 PHE 141 HE2 PHE 141 6.550 -0.117 3.403 1121 HZ PHE 141 HZ PHE 141 5.472 -0.093 1.184 1122 H GLU 142 H GLU 142 7.460 7.603 2.625 1123 HA GLU 142 HA GLU 142 8.994 8.954 4.634 1124 HB2 GLU 142 2HB GLU 142 6.593 9.935 3.025 1125 HB3 GLU 142 3HB GLU 142 7.697 10.954 3.949 1126 HG2 GLU 142 2HG GLU 142 8.405 9.291 1.514 1127 HG3 GLU 142 3HG GLU 142 8.190 11.039 1.550 1128 H GLY 143 H GLY 143 8.564 8.294 6.655 1129 HA2 GLY 143 2HA GLY 143 6.022 7.491 7.686 1130 HA3 GLY 143 3HA GLY 143 7.506 7.724 8.597 1131 H GLU 144 H GLU 144 4.862 9.461 7.072 1132 HA GLU 144 HA GLU 144 4.833 11.485 9.246 1133 HB2 GLU 144 2HB GLU 144 4.077 11.958 6.309 1134 HB3 GLU 144 3HB GLU 144 4.045 13.157 7.597 1135 HG2 GLU 144 2HG GLU 144 6.490 13.102 7.755 1136 HG3 GLU 144 3HG GLU 144 6.553 11.806 6.563 1137 H THR 145 H THR 145 2.982 10.079 6.566 1138 HA THR 145 HA THR 145 0.783 9.268 8.293 1139 HB THR 145 HB THR 145 0.248 10.949 5.786 1140 HG1 THR 145 HG1 THR 145 0.806 12.525 7.120 1141 HG21 THR 145 3HG2 THR 145 -1.549 9.346 6.384 1142 HG22 THR 145 1HG2 THR 145 -2.059 11.022 6.585 1143 HG23 THR 145 2HG2 THR 145 -1.636 10.056 8.000 1144 H PHE 146 H PHE 146 0.499 7.153 7.758 1145 HA PHE 146 HA PHE 146 1.159 6.108 5.105 1146 HB2 PHE 146 2HB PHE 146 0.462 4.825 7.768 1147 HB3 PHE 146 3HB PHE 146 0.338 3.883 6.288 1148 HD1 PHE 146 HD2 PHE 146 2.724 5.660 8.525 1149 HD2 PHE 146 HD1 PHE 146 2.292 3.093 5.130 1150 HE1 PHE 146 HE2 PHE 146 5.129 5.126 8.610 1151 HE2 PHE 146 HE1 PHE 146 4.687 2.572 5.222 1152 HZ PHE 146 HZ PHE 146 6.113 3.577 6.951 1153 H TYR 147 H TYR 147 -0.290 5.689 3.581 1154 HA TYR 147 HA TYR 147 -3.184 5.790 4.162 1155 HB2 TYR 147 2HB TYR 147 -1.608 6.417 1.630 1156 HB3 TYR 147 3HB TYR 147 -3.348 6.148 1.600 1157 HD1 TYR 147 HD1 TYR 147 -0.805 8.239 3.438 1158 HD2 TYR 147 HD2 TYR 147 -4.732 8.033 1.782 1159 HE1 TYR 147 HE1 TYR 147 -1.181 10.591 4.015 1160 HE2 TYR 147 HE2 TYR 147 -5.099 10.390 2.360 1161 HH TYR 147 HH TYR 147 -2.555 12.448 3.429 1162 H ILE 148 H ILE 148 -4.409 4.067 3.776 1163 HA ILE 148 HA ILE 148 -3.269 1.663 2.466 1164 HB ILE 148 HB ILE 148 -5.128 1.781 4.900 1165 HG12 ILE 148 2HG1 ILE 148 -2.226 0.837 4.637 1166 HG13 ILE 148 3HG1 ILE 148 -2.787 2.255 5.515 1167 HG21 ILE 148 1HG2 ILE 148 -5.026 -0.682 4.907 1168 HG22 ILE 148 2HG2 ILE 148 -4.080 -0.658 3.418 1169 HG23 ILE 148 3HG2 ILE 148 -5.747 -0.077 3.416 1170 HD11 ILE 148 3HD1 ILE 148 -3.322 -0.626 6.228 1171 HD12 ILE 148 1HD1 ILE 148 -3.980 0.772 7.085 1172 HD13 ILE 148 2HD1 ILE 148 -2.241 0.498 7.049 1173 H ILE 149 H ILE 149 -4.276 1.504 0.562 1174 HA ILE 149 HA ILE 149 -7.052 2.425 0.190 1175 HB ILE 149 HB ILE 149 -4.973 1.692 -1.934 1176 HG12 ILE 149 2HG1 ILE 149 -4.129 3.631 -0.730 1177 HG13 ILE 149 3HG1 ILE 149 -4.725 4.174 -2.290 1178 HG21 ILE 149 1HG2 ILE 149 -7.643 3.129 -2.213 1179 HG22 ILE 149 2HG2 ILE 149 -7.268 1.492 -2.759 1180 HG23 ILE 149 3HG2 ILE 149 -6.471 2.875 -3.508 1181 HD11 ILE 149 3HD1 ILE 149 -6.116 4.500 0.373 1182 HD12 ILE 149 1HD1 ILE 149 -6.769 5.014 -1.186 1183 HD13 ILE 149 2HD1 ILE 149 -5.298 5.754 -0.558 1184 H GLU 150 H GLU 150 -8.353 0.753 0.747 1185 HA GLU 150 HA GLU 150 -7.860 -2.000 0.288 1186 HB2 GLU 150 2HB GLU 150 -9.389 -1.254 2.061 1187 HB3 GLU 150 3HB GLU 150 -10.472 -0.527 0.874 1188 HG2 GLU 150 2HG GLU 150 -11.013 -2.712 -0.045 1189 HG3 GLU 150 3HG GLU 150 -9.839 -3.494 1.004 1190 H GLN 151 H GLN 151 -7.937 -3.050 -1.562 1191 HA GLN 151 HA GLN 151 -9.709 -2.199 -3.788 1192 HB2 GLN 151 2HB GLN 151 -6.888 -3.386 -3.966 1193 HB3 GLN 151 3HB GLN 151 -7.948 -3.128 -5.349 1194 HG2 GLN 151 2HG GLN 151 -6.910 -0.926 -3.541 1195 HG3 GLN 151 3HG GLN 151 -6.184 -1.387 -5.079 1196 HE21 GLN 151 1HE2 GLN 151 -8.949 0.136 -3.562 1197 HE22 GLN 151 2HE2 GLN 151 -9.562 0.888 -4.989 1198 H ARG 152 H ARG 152 -11.375 -3.677 -3.479 1199 HA ARG 152 HA ARG 152 -10.786 -6.523 -3.142 1200 HB2 ARG 152 2HB ARG 152 -13.493 -5.174 -3.610 1201 HB3 ARG 152 3HB ARG 152 -13.249 -6.881 -3.267 1202 HG2 ARG 152 2HG ARG 152 -13.801 -6.159 -1.151 1203 HG3 ARG 152 3HG ARG 152 -12.052 -5.939 -1.077 1204 HD2 ARG 152 2HD ARG 152 -13.090 -3.975 -0.159 1205 HD3 ARG 152 3HD ARG 152 -12.403 -3.523 -1.722 1206 HE ARG 152 HE ARG 152 -14.789 -3.927 -2.577 1207 HH11 ARG 152 1HH1 ARG 152 -14.100 -2.596 0.628 1208 HH12 ARG 152 2HH1 ARG 152 -15.610 -1.751 0.717 1209 HH21 ARG 152 1HH2 ARG 152 -16.778 -2.855 -2.405 1210 HH22 ARG 152 2HH2 ARG 152 -17.128 -1.901 -1.006 1211 H LEU 153 H LEU 153 -11.613 -8.122 -4.698 1212 HA LEU 153 HA LEU 153 -10.549 -7.653 -7.260 1213 HB2 LEU 153 2HB LEU 153 -12.207 -9.939 -6.160 1214 HB3 LEU 153 3HB LEU 153 -11.610 -9.943 -7.815 1215 HG LEU 153 HG LEU 153 -9.873 -9.857 -5.312 1216 HD11 LEU 153 1HD1 LEU 153 -9.194 -12.122 -5.919 1217 HD12 LEU 153 2HD1 LEU 153 -10.326 -12.123 -7.275 1218 HD13 LEU 153 3HD1 LEU 153 -10.929 -12.037 -5.617 1219 HD21 LEU 153 3HD2 LEU 153 -7.964 -10.169 -6.848 1220 HD22 LEU 153 1HD2 LEU 153 -8.789 -8.638 -7.130 1221 HD23 LEU 153 2HD2 LEU 153 -9.043 -9.991 -8.236 1222 H GLU 154 H GLU 154 -11.402 -7.542 -9.239 1223 HA GLU 154 HA GLU 154 -13.540 -5.856 -9.763 1224 HB2 GLU 154 2HB GLU 154 -13.219 -7.220 -12.214 1225 HB3 GLU 154 3HB GLU 154 -12.375 -5.772 -11.714 1226 HG2 GLU 154 2HG GLU 154 -10.862 -7.440 -12.657 1227 HG3 GLU 154 3HG GLU 154 -10.471 -7.087 -10.974 1228 H HIS 155 H HIS 155 -13.485 -9.417 -10.032 1229 HA HIS 155 HA HIS 155 -16.274 -9.624 -10.730 1230 HB2 HIS 155 2HB HIS 155 -15.968 -12.067 -10.479 1231 HB3 HIS 155 3HB HIS 155 -14.694 -11.364 -11.461 1232 HD1 HIS 155 HD1 HIS 155 -15.278 -13.363 -8.421 1233 HD2 HIS 155 HD2 HIS 155 -12.129 -11.249 -10.123 1234 HE1 HIS 155 HE1 HIS 155 -13.216 -14.173 -7.237 1235 HE2 HIS 155 HE2 HIS 155 -11.311 -13.010 -8.403 1236 H HIS 156 H HIS 156 -17.463 -8.584 -9.255 1237 HA HIS 156 HA HIS 156 -17.261 -8.966 -6.389 1238 HB2 HIS 156 2HB HIS 156 -19.275 -7.444 -8.095 1239 HB3 HIS 156 3HB HIS 156 -19.230 -7.405 -6.336 1240 HD1 HIS 156 HD1 HIS 156 -18.267 -5.349 -9.000 1241 HD2 HIS 156 HD2 HIS 156 -16.305 -6.632 -5.568 1242 HE1 HIS 156 HE1 HIS 156 -16.372 -3.732 -8.664 1243 HE2 HIS 156 HE2 HIS 156 -15.053 -4.713 -6.756 1244 H HIS 157 H HIS 157 -19.334 -9.455 -5.119 1245 HA HIS 157 HA HIS 157 -20.522 -11.187 -4.261 1246 HB2 HIS 157 2HB HIS 157 -21.486 -11.602 -7.137 1247 HB3 HIS 157 3HB HIS 157 -22.247 -12.273 -5.700 1248 HD1 HIS 157 HD1 HIS 157 -23.740 -10.448 -7.737 1249 HD2 HIS 157 HD2 HIS 157 -22.065 -9.112 -4.175 1250 HE1 HIS 157 HE1 HIS 157 -24.984 -8.344 -7.162 1251 HE2 HIS 157 HE2 HIS 157 -24.110 -7.705 -4.889 1252 H HIS 158 H HIS 158 -17.942 -11.732 -4.513 1253 HA HIS 158 HA HIS 158 -17.168 -13.709 -6.365 1254 HB2 HIS 158 2HB HIS 158 -15.013 -13.764 -5.309 1255 HB3 HIS 158 3HB HIS 158 -15.568 -12.104 -5.236 1256 HD1 HIS 158 HD1 HIS 158 -14.187 -14.760 -3.181 1257 HD2 HIS 158 HD2 HIS 158 -16.504 -11.372 -2.516 1258 HE1 HIS 158 HE1 HIS 158 -14.055 -14.315 -0.710 1259 HE2 HIS 158 HE2 HIS 158 -15.604 -12.379 -0.320 1260 H HIS 159 H HIS 159 -17.730 -15.725 -6.435 1261 HA HIS 159 HA HIS 159 -18.012 -17.392 -4.014 1262 HB2 HIS 159 2HB HIS 159 -18.896 -19.115 -5.793 1263 HB3 HIS 159 3HB HIS 159 -19.938 -17.784 -5.307 1264 HD1 HIS 159 HD1 HIS 159 -20.361 -15.895 -7.037 1265 HD2 HIS 159 HD2 HIS 159 -18.092 -19.064 -8.493 1266 HE1 HIS 159 HE1 HIS 159 -20.371 -15.646 -9.531 1267 HE2 HIS 159 HE2 HIS 159 -19.185 -17.689 -10.388 1268 H HIS 160 H HIS 160 -15.615 -16.366 -5.902 1269 HA HIS 160 HA HIS 160 -13.941 -18.655 -5.071 1270 HB2 HIS 160 2HB HIS 160 -13.512 -16.773 -7.451 1271 HB3 HIS 160 3HB HIS 160 -12.285 -17.880 -6.843 1272 HD1 HIS 160 HD1 HIS 160 -12.553 -20.362 -7.393 1273 HD2 HIS 160 HD2 HIS 160 -15.612 -18.003 -8.918 1274 HE1 HIS 160 HE1 HIS 160 -13.812 -21.842 -8.975 1275 HE2 HIS 160 HE2 HIS 160 -15.751 -20.445 -9.750 Start of MODEL 7 1 H1 MET 1 1H MET 1 -22.412 8.116 -2.303 2 H2 MET 1 2H MET 1 -23.706 8.327 -3.362 3 H3 MET 1 3H MET 1 -22.814 6.903 -3.404 4 HA MET 1 HA MET 1 -23.529 6.371 -1.175 5 HB2 MET 1 2HB MET 1 -25.273 8.845 -1.519 6 HB3 MET 1 3HB MET 1 -25.458 7.679 -0.209 7 HG2 MET 1 2HG MET 1 -24.228 9.631 0.571 8 HG3 MET 1 3HG MET 1 -23.174 8.215 0.575 9 HE1 MET 1 3HE MET 1 -20.486 10.817 -0.371 10 HE2 MET 1 1HE MET 1 -20.909 9.431 0.634 11 HE3 MET 1 2HE MET 1 -21.750 10.968 0.847 12 H VAL 2 H VAL 2 -24.625 6.774 -4.326 13 HA VAL 2 HA VAL 2 -26.482 4.493 -3.957 14 HB VAL 2 HB VAL 2 -26.950 6.597 -6.125 15 HG11 VAL 2 1HG1 VAL 2 -29.178 5.535 -6.340 16 HG12 VAL 2 2HG1 VAL 2 -28.758 4.375 -5.077 17 HG13 VAL 2 3HG1 VAL 2 -27.881 4.368 -6.611 18 HG21 VAL 2 3HG2 VAL 2 -27.308 7.727 -3.969 19 HG22 VAL 2 1HG2 VAL 2 -28.411 6.444 -3.459 20 HG23 VAL 2 2HG2 VAL 2 -28.841 7.494 -4.812 21 H GLU 3 H GLU 3 -24.102 3.792 -4.244 22 HA GLU 3 HA GLU 3 -23.539 3.180 -7.096 23 HB2 GLU 3 2HB GLU 3 -21.670 3.126 -4.670 24 HB3 GLU 3 3HB GLU 3 -21.228 2.536 -6.263 25 HG2 GLU 3 2HG GLU 3 -20.240 4.661 -6.124 26 HG3 GLU 3 3HG GLU 3 -21.669 4.904 -7.124 27 HA PRO 4 HA PRO 4 -24.248 -1.193 -5.973 28 HB2 PRO 4 2HB PRO 4 -22.528 -2.567 -7.599 29 HB3 PRO 4 3HB PRO 4 -23.970 -1.743 -8.232 30 HG2 PRO 4 2HG PRO 4 -21.112 -0.834 -8.278 31 HG3 PRO 4 3HG PRO 4 -22.351 -0.722 -9.550 32 HD2 PRO 4 2HD PRO 4 -21.675 1.389 -7.906 33 HD3 PRO 4 3HD PRO 4 -23.270 1.220 -8.668 34 H GLY 5 H GLY 5 -22.700 -3.296 -5.507 35 HA2 GLY 5 2HA GLY 5 -21.158 -2.544 -3.162 36 HA3 GLY 5 3HA GLY 5 -21.558 -4.174 -3.690 37 H VAL 6 H VAL 6 -19.635 -1.402 -4.872 38 HA VAL 6 HA VAL 6 -17.368 -3.211 -5.471 39 HB VAL 6 HB VAL 6 -16.803 -1.781 -7.440 40 HG11 VAL 6 1HG1 VAL 6 -18.564 -2.618 -8.964 41 HG12 VAL 6 2HG1 VAL 6 -19.587 -2.993 -7.574 42 HG13 VAL 6 3HG1 VAL 6 -18.061 -3.851 -7.805 43 HG21 VAL 6 3HG2 VAL 6 -19.491 -0.422 -6.952 44 HG22 VAL 6 1HG2 VAL 6 -18.468 -0.185 -8.375 45 HG23 VAL 6 2HG2 VAL 6 -17.903 0.329 -6.785 46 H ALA 7 H ALA 7 -15.338 -2.436 -4.956 47 HA ALA 7 HA ALA 7 -14.844 0.267 -4.072 48 HB1 ALA 7 3HB ALA 7 -14.218 -0.335 -1.744 49 HB2 ALA 7 1HB ALA 7 -14.815 -1.974 -2.020 50 HB3 ALA 7 2HB ALA 7 -15.932 -0.612 -2.057 51 H LYS 8 H LYS 8 -12.990 0.593 -5.093 52 HA LYS 8 HA LYS 8 -10.576 -0.846 -4.553 53 HB2 LYS 8 2HB LYS 8 -10.066 -1.670 -6.799 54 HB3 LYS 8 3HB LYS 8 -11.573 -2.394 -6.266 55 HG2 LYS 8 2HG LYS 8 -11.433 -0.011 -8.157 56 HG3 LYS 8 3HG LYS 8 -11.485 -1.685 -8.705 57 HD2 LYS 8 2HD LYS 8 -13.644 -0.336 -7.029 58 HD3 LYS 8 3HD LYS 8 -13.709 -0.549 -8.782 59 HE2 LYS 8 2HE LYS 8 -13.580 -2.812 -6.747 60 HE3 LYS 8 3HE LYS 8 -15.033 -2.270 -7.587 61 HZ1 LYS 8 3HZ LYS 8 -13.983 -2.871 -9.690 62 HZ2 LYS 8 1HZ LYS 8 -14.103 -4.200 -8.656 63 HZ3 LYS 8 2HZ LYS 8 -12.618 -3.432 -8.866 64 H LEU 9 H LEU 9 -8.821 0.054 -6.222 65 HA LEU 9 HA LEU 9 -9.279 2.957 -6.620 66 HB2 LEU 9 2HB LEU 9 -7.507 2.358 -4.959 67 HB3 LEU 9 3HB LEU 9 -6.645 1.472 -6.202 68 HG LEU 9 HG LEU 9 -6.226 3.588 -7.442 69 HD11 LEU 9 1HD1 LEU 9 -8.226 4.847 -6.840 70 HD12 LEU 9 2HD1 LEU 9 -6.779 5.772 -6.452 71 HD13 LEU 9 3HD1 LEU 9 -7.680 4.966 -5.164 72 HD21 LEU 9 3HD2 LEU 9 -4.585 2.853 -5.770 73 HD22 LEU 9 1HD2 LEU 9 -5.426 3.782 -4.523 74 HD23 LEU 9 2HD2 LEU 9 -4.649 4.611 -5.877 75 H THR 10 H THR 10 -8.584 3.868 -8.583 76 HA THR 10 HA THR 10 -8.717 2.392 -10.966 77 HB THR 10 HB THR 10 -7.778 4.467 -12.043 78 HG1 THR 10 HG1 THR 10 -6.849 4.877 -9.543 79 HG21 THR 10 3HG2 THR 10 -10.205 4.341 -11.555 80 HG22 THR 10 1HG2 THR 10 -9.598 5.993 -11.403 81 HG23 THR 10 2HG2 THR 10 -9.916 5.035 -9.955 82 H THR 11 H THR 11 -7.192 1.356 -12.170 83 HA THR 11 HA THR 11 -4.875 0.392 -10.927 84 HB THR 11 HB THR 11 -4.312 -0.608 -13.190 85 HG1 THR 11 HG1 THR 11 -6.064 -0.340 -14.781 86 HG21 THR 11 3HG2 THR 11 -6.260 -2.129 -13.258 87 HG22 THR 11 1HG2 THR 11 -7.193 -1.003 -12.267 88 HG23 THR 11 2HG2 THR 11 -5.777 -1.814 -11.590 89 H TYR 12 H TYR 12 -5.280 3.126 -13.200 90 HA TYR 12 HA TYR 12 -2.602 3.406 -14.003 91 HB2 TYR 12 2HB TYR 12 -3.156 5.720 -14.677 92 HB3 TYR 12 3HB TYR 12 -4.363 4.569 -15.211 93 HD1 TYR 12 HD2 TYR 12 -3.746 7.098 -12.465 94 HD2 TYR 12 HD1 TYR 12 -6.649 5.086 -14.862 95 HE1 TYR 12 HE2 TYR 12 -5.495 8.548 -11.563 96 HE2 TYR 12 HE1 TYR 12 -8.398 6.558 -13.970 97 HH TYR 12 HH TYR 12 -8.785 7.972 -11.935 98 H ALA 13 H ALA 13 -4.242 4.641 -11.148 99 HA ALA 13 HA ALA 13 -2.054 6.241 -10.184 100 HB1 ALA 13 3HB ALA 13 -4.410 6.769 -9.664 101 HB2 ALA 13 1HB ALA 13 -3.462 6.534 -8.194 102 HB3 ALA 13 2HB ALA 13 -4.551 5.261 -8.758 103 H SER 14 H SER 14 -3.284 2.989 -9.700 104 HA SER 14 HA SER 14 -1.769 2.296 -7.404 105 HB2 SER 14 2HB SER 14 -3.156 0.540 -9.468 106 HB3 SER 14 3HB SER 14 -2.553 -0.006 -7.901 107 HG SER 14 HG SER 14 -4.765 1.583 -8.507 108 H LYS 15 H LYS 15 -1.119 2.111 -10.879 109 HA LYS 15 HA LYS 15 1.077 0.290 -10.812 110 HB2 LYS 15 2HB LYS 15 0.470 2.461 -12.872 111 HB3 LYS 15 3HB LYS 15 1.624 1.150 -13.089 112 HG2 LYS 15 2HG LYS 15 -1.383 0.909 -12.865 113 HG3 LYS 15 3HG LYS 15 -0.408 0.664 -14.310 114 HD2 LYS 15 2HD LYS 15 0.615 -1.335 -13.308 115 HD3 LYS 15 3HD LYS 15 -0.259 -1.057 -11.799 116 HE2 LYS 15 2HE LYS 15 -2.399 -1.427 -12.961 117 HE3 LYS 15 3HE LYS 15 -1.539 -1.677 -14.482 118 HZ1 LYS 15 3HZ LYS 15 -1.329 -3.366 -12.051 119 HZ2 LYS 15 1HZ LYS 15 -0.429 -3.588 -13.465 120 HZ3 LYS 15 2HZ LYS 15 -2.110 -3.777 -13.491 121 H GLN 16 H GLN 16 0.814 3.807 -10.826 122 HA GLN 16 HA GLN 16 3.648 4.304 -10.775 123 HB2 GLN 16 2HB GLN 16 1.347 6.230 -10.250 124 HB3 GLN 16 3HB GLN 16 3.010 6.669 -10.635 125 HG2 GLN 16 2HG GLN 16 1.105 5.200 -12.486 126 HG3 GLN 16 3HG GLN 16 1.492 6.917 -12.573 127 HE21 GLN 16 1HE2 GLN 16 1.857 4.782 -14.572 128 HE22 GLN 16 2HE2 GLN 16 3.538 4.795 -14.978 129 H ALA 17 H ALA 17 1.120 3.922 -8.404 130 HA ALA 17 HA ALA 17 2.383 5.051 -6.135 131 HB1 ALA 17 3HB ALA 17 -0.022 4.503 -6.173 132 HB2 ALA 17 1HB ALA 17 0.786 3.716 -4.815 133 HB3 ALA 17 2HB ALA 17 0.361 2.781 -6.254 134 H THR 18 H THR 18 2.193 1.683 -7.336 135 HA THR 18 HA THR 18 3.865 0.579 -5.317 136 HB THR 18 HB THR 18 3.952 -1.422 -6.920 137 HG1 THR 18 HG1 THR 18 3.618 -0.381 -8.882 138 HG21 THR 18 3HG2 THR 18 1.607 -2.040 -6.564 139 HG22 THR 18 1HG2 THR 18 1.200 -0.359 -6.208 140 HG23 THR 18 2HG2 THR 18 2.264 -1.259 -5.123 141 H ASP 19 H ASP 19 4.468 1.749 -8.601 142 HA ASP 19 HA ASP 19 7.176 1.048 -8.907 143 HB2 ASP 19 2HB ASP 19 5.775 1.883 -10.775 144 HB3 ASP 19 3HB ASP 19 5.664 3.464 -10.014 145 H MET 20 H MET 20 5.610 3.702 -7.229 146 HA MET 20 HA MET 20 7.904 5.321 -6.728 147 HB2 MET 20 2HB MET 20 5.377 5.946 -6.617 148 HB3 MET 20 3HB MET 20 5.399 5.266 -5.001 149 HG2 MET 20 2HG MET 20 5.701 7.562 -4.636 150 HG3 MET 20 3HG MET 20 7.351 6.937 -4.566 151 HE1 MET 20 3HE MET 20 5.139 7.407 -7.805 152 HE2 MET 20 1HE MET 20 5.574 9.053 -8.271 153 HE3 MET 20 2HE MET 20 4.670 8.767 -6.782 154 H GLY 21 H GLY 21 6.307 2.664 -4.998 155 HA2 GLY 21 2HA GLY 21 8.282 1.521 -3.617 156 HA3 GLY 21 3HA GLY 21 8.000 2.937 -2.613 157 H ALA 22 H ALA 22 5.010 2.329 -3.780 158 HA ALA 22 HA ALA 22 4.058 1.324 -1.294 159 HB1 ALA 22 3HB ALA 22 2.524 1.616 -3.896 160 HB2 ALA 22 1HB ALA 22 2.727 2.876 -2.676 161 HB3 ALA 22 2HB ALA 22 1.825 1.410 -2.286 162 H ILE 23 H ILE 23 2.720 -0.556 -0.986 163 HA ILE 23 HA ILE 23 3.499 -2.935 -2.585 164 HB ILE 23 HB ILE 23 3.701 -4.221 -0.428 165 HG12 ILE 23 2HG1 ILE 23 3.527 -1.463 0.896 166 HG13 ILE 23 3HG1 ILE 23 2.301 -2.719 0.994 167 HG21 ILE 23 1HG2 ILE 23 5.938 -3.388 0.229 168 HG22 ILE 23 2HG2 ILE 23 5.637 -1.882 -0.641 169 HG23 ILE 23 3HG2 ILE 23 5.750 -3.404 -1.528 170 HD11 ILE 23 3HD1 ILE 23 3.866 -4.139 2.224 171 HD12 ILE 23 1HD1 ILE 23 3.569 -2.598 3.025 172 HD13 ILE 23 2HD1 ILE 23 5.080 -2.855 2.153 173 H TYR 24 H TYR 24 1.967 -4.638 -2.559 174 HA TYR 24 HA TYR 24 -0.718 -4.024 -1.493 175 HB2 TYR 24 2HB TYR 24 0.259 -6.064 -3.531 176 HB3 TYR 24 3HB TYR 24 -1.351 -6.144 -2.825 177 HD1 TYR 24 HD1 TYR 24 -2.902 -4.103 -3.121 178 HD2 TYR 24 HD2 TYR 24 0.632 -4.708 -5.456 179 HE1 TYR 24 HE1 TYR 24 -3.796 -2.618 -4.865 180 HE2 TYR 24 HE2 TYR 24 -0.255 -3.222 -7.182 181 HH TYR 24 HH TYR 24 -3.025 -1.267 -6.716 182 H VAL 25 H VAL 25 -1.157 -4.845 0.436 183 HA VAL 25 HA VAL 25 -0.054 -7.478 1.259 184 HB VAL 25 HB VAL 25 -0.474 -6.826 3.593 185 HG11 VAL 25 1HG1 VAL 25 1.145 -4.697 2.141 186 HG12 VAL 25 2HG1 VAL 25 1.726 -6.277 2.679 187 HG13 VAL 25 3HG1 VAL 25 1.245 -5.066 3.868 188 HG21 VAL 25 3HG2 VAL 25 -1.181 -4.550 4.251 189 HG22 VAL 25 1HG2 VAL 25 -2.434 -5.364 3.310 190 HG23 VAL 25 2HG2 VAL 25 -1.427 -4.128 2.553 191 H ASN 26 H ASN 26 -1.701 -8.581 2.841 192 HA ASN 26 HA ASN 26 -4.438 -8.449 1.676 193 HB2 ASN 26 2HB ASN 26 -4.727 -10.756 2.496 194 HB3 ASN 26 3HB ASN 26 -3.295 -10.654 1.484 195 HD21 ASN 26 1HD2 ASN 26 -3.897 -12.686 3.384 196 HD22 ASN 26 2HD2 ASN 26 -2.648 -12.658 4.577 197 H SER 27 H SER 27 -5.937 -9.579 3.638 198 HA SER 27 HA SER 27 -6.315 -7.497 5.535 199 HB2 SER 27 2HB SER 27 -8.188 -8.806 4.594 200 HB3 SER 27 3HB SER 27 -7.593 -10.255 5.391 201 HG SER 27 HG SER 27 -8.377 -7.886 6.736 202 H LYS 28 H LYS 28 -4.130 -10.069 5.593 203 HA LYS 28 HA LYS 28 -3.869 -10.134 8.512 204 HB2 LYS 28 2HB LYS 28 -2.180 -11.536 6.392 205 HB3 LYS 28 3HB LYS 28 -2.113 -11.813 8.135 206 HG2 LYS 28 2HG LYS 28 -4.448 -12.431 6.296 207 HG3 LYS 28 3HG LYS 28 -3.342 -13.605 7.022 208 HD2 LYS 28 2HD LYS 28 -4.164 -13.023 9.273 209 HD3 LYS 28 3HD LYS 28 -5.223 -11.781 8.592 210 HE2 LYS 28 2HE LYS 28 -6.479 -13.831 9.131 211 HE3 LYS 28 3HE LYS 28 -6.497 -13.520 7.394 212 HZ1 LYS 28 3HZ LYS 28 -6.088 -15.847 7.932 213 HZ2 LYS 28 1HZ LYS 28 -4.683 -15.430 8.765 214 HZ3 LYS 28 2HZ LYS 28 -4.788 -15.173 7.097 215 H GLY 29 H GLY 29 -2.288 -8.825 5.636 216 HA2 GLY 29 2HA GLY 29 -1.016 -6.778 5.796 217 HA3 GLY 29 3HA GLY 29 -0.400 -7.291 7.358 218 H ASP 30 H ASP 30 -0.383 -9.995 5.541 219 HA ASP 30 HA ASP 30 2.402 -10.027 4.896 220 HB2 ASP 30 2HB ASP 30 1.378 -12.145 5.425 221 HB3 ASP 30 3HB ASP 30 0.052 -11.868 4.305 222 H ARG 31 H ARG 31 3.249 -8.945 3.206 223 HA ARG 31 HA ARG 31 1.914 -7.830 1.042 224 HB2 ARG 31 2HB ARG 31 4.064 -7.512 -0.068 225 HB3 ARG 31 3HB ARG 31 4.175 -7.092 1.630 226 HG2 ARG 31 2HG ARG 31 5.135 -9.792 0.653 227 HG3 ARG 31 3HG ARG 31 6.143 -8.361 0.466 228 HD2 ARG 31 2HD ARG 31 6.904 -9.327 2.455 229 HD3 ARG 31 3HD ARG 31 5.844 -8.036 3.006 230 HE ARG 31 HE ARG 31 4.393 -10.465 2.875 231 HH11 ARG 31 1HH1 ARG 31 6.979 -8.975 4.769 232 HH12 ARG 31 2HH1 ARG 31 6.605 -9.869 6.207 233 HH21 ARG 31 1HH2 ARG 31 3.917 -11.609 4.806 234 HH22 ARG 31 2HH2 ARG 31 4.873 -11.355 6.224 235 H ILE 32 H ILE 32 0.781 -8.791 -0.471 236 HA ILE 32 HA ILE 32 0.968 -11.615 -1.033 237 HB ILE 32 HB ILE 32 -1.045 -11.325 -2.377 238 HG12 ILE 32 2HG1 ILE 32 -0.718 -8.297 -2.019 239 HG13 ILE 32 3HG1 ILE 32 -0.435 -9.171 -3.518 240 HG21 ILE 32 1HG2 ILE 32 -1.210 -9.629 0.145 241 HG22 ILE 32 2HG2 ILE 32 -1.322 -11.390 0.072 242 HG23 ILE 32 3HG2 ILE 32 -2.572 -10.397 -0.678 243 HD11 ILE 32 3HD1 ILE 32 -2.562 -8.052 -3.571 244 HD12 ILE 32 1HD1 ILE 32 -3.083 -8.885 -2.108 245 HD13 ILE 32 2HD1 ILE 32 -2.801 -9.798 -3.594 246 H VAL 33 H VAL 33 1.826 -8.630 -2.618 247 HA VAL 33 HA VAL 33 3.559 -9.970 -4.502 248 HB VAL 33 HB VAL 33 1.345 -9.951 -5.711 249 HG11 VAL 33 1HG1 VAL 33 0.361 -7.856 -6.551 250 HG12 VAL 33 2HG1 VAL 33 1.552 -6.920 -5.641 251 HG13 VAL 33 3HG1 VAL 33 0.360 -7.897 -4.784 252 HG21 VAL 33 3HG2 VAL 33 3.415 -9.958 -7.008 253 HG22 VAL 33 1HG2 VAL 33 3.477 -8.193 -6.970 254 HG23 VAL 33 2HG2 VAL 33 2.179 -9.014 -7.844 255 H ASN 34 H ASN 34 5.162 -8.556 -5.274 256 HA ASN 34 HA ASN 34 6.011 -6.462 -3.631 257 HB2 ASN 34 2HB ASN 34 7.553 -7.727 -5.084 258 HB3 ASN 34 3HB ASN 34 6.761 -7.102 -6.524 259 HD21 ASN 34 1HD2 ASN 34 7.696 -5.239 -3.620 260 HD22 ASN 34 2HD2 ASN 34 8.840 -4.242 -4.442 261 H GLU 35 H GLU 35 4.686 -6.312 -6.937 262 HA GLU 35 HA GLU 35 3.607 -3.623 -6.514 263 HB2 GLU 35 2HB GLU 35 5.682 -4.333 -8.655 264 HB3 GLU 35 3HB GLU 35 4.696 -2.868 -8.702 265 HG2 GLU 35 2HG GLU 35 5.663 -2.146 -6.546 266 HG3 GLU 35 3HG GLU 35 6.643 -3.606 -6.495 267 H SER 36 H SER 36 2.520 -2.894 -8.628 268 HA SER 36 HA SER 36 0.692 -4.986 -9.535 269 HB2 SER 36 2HB SER 36 -0.518 -2.982 -10.530 270 HB3 SER 36 3HB SER 36 -0.311 -2.908 -8.779 271 HG SER 36 HG SER 36 0.966 -1.241 -8.992 272 H ASN 37 H ASN 37 3.172 -5.527 -10.456 273 HA ASN 37 HA ASN 37 4.152 -4.465 -12.816 274 HB2 ASN 37 2HB ASN 37 5.389 -6.109 -11.481 275 HB3 ASN 37 3HB ASN 37 4.200 -7.358 -11.843 276 HD21 ASN 37 1HD2 ASN 37 5.584 -8.766 -12.846 277 HD22 ASN 37 2HD2 ASN 37 6.403 -8.436 -14.332 278 H VAL 38 H VAL 38 1.831 -7.138 -12.426 279 HA VAL 38 HA VAL 38 0.471 -6.494 -14.886 280 HB VAL 38 HB VAL 38 2.258 -7.872 -15.820 281 HG11 VAL 38 1HG1 VAL 38 2.659 -10.220 -15.177 282 HG12 VAL 38 2HG1 VAL 38 1.483 -10.065 -13.867 283 HG13 VAL 38 3HG1 VAL 38 2.969 -9.111 -13.836 284 HG21 VAL 38 3HG2 VAL 38 -0.331 -9.466 -15.739 285 HG22 VAL 38 1HG2 VAL 38 0.951 -9.637 -16.943 286 HG23 VAL 38 2HG2 VAL 38 0.035 -8.132 -16.837 287 H TYR 39 H TYR 39 -1.619 -7.406 -14.964 288 HA TYR 39 HA TYR 39 -2.889 -7.707 -12.471 289 HB2 TYR 39 2HB TYR 39 -4.957 -8.063 -13.743 290 HB3 TYR 39 3HB TYR 39 -4.025 -6.752 -14.445 291 HD1 TYR 39 HD1 TYR 39 -5.255 -10.210 -14.982 292 HD2 TYR 39 HD2 TYR 39 -3.038 -6.985 -16.710 293 HE1 TYR 39 HE1 TYR 39 -5.397 -11.292 -17.180 294 HE2 TYR 39 HE2 TYR 39 -3.181 -8.069 -18.909 295 HH TYR 39 HH TYR 39 -5.263 -10.745 -19.510 296 H THR 40 H THR 40 -1.475 -10.089 -14.575 297 HA THR 40 HA THR 40 -2.971 -12.374 -13.865 298 HB THR 40 HB THR 40 -0.969 -13.674 -14.673 299 HG1 THR 40 HG1 THR 40 0.755 -12.281 -15.583 300 HG21 THR 40 3HG2 THR 40 -1.000 -12.851 -17.002 301 HG22 THR 40 1HG2 THR 40 -1.725 -11.330 -16.470 302 HG23 THR 40 2HG2 THR 40 -2.627 -12.842 -16.320 303 H THR 41 H THR 41 0.273 -11.344 -12.661 304 HA THR 41 HA THR 41 0.348 -13.258 -10.565 305 HB THR 41 HB THR 41 2.411 -12.299 -11.539 306 HG1 THR 41 HG1 THR 41 1.882 -12.490 -8.847 307 HG21 THR 41 3HG2 THR 41 1.694 -9.932 -11.787 308 HG22 THR 41 1HG2 THR 41 3.220 -10.070 -10.909 309 HG23 THR 41 2HG2 THR 41 1.722 -9.746 -10.033 310 H PHE 42 H PHE 42 -0.941 -10.002 -10.772 311 HA PHE 42 HA PHE 42 -1.059 -9.415 -7.984 312 HB2 PHE 42 2HB PHE 42 -1.130 -7.555 -9.498 313 HB3 PHE 42 3HB PHE 42 -2.456 -8.251 -10.422 314 HD1 PHE 42 HD1 PHE 42 -1.729 -7.099 -6.897 315 HD2 PHE 42 HD2 PHE 42 -4.604 -7.373 -10.064 316 HE1 PHE 42 HE1 PHE 42 -3.359 -5.847 -5.547 317 HE2 PHE 42 HE2 PHE 42 -6.214 -6.115 -8.705 318 HZ PHE 42 HZ PHE 42 -5.597 -5.352 -6.446 319 H ARG 43 H ARG 43 -3.587 -10.457 -10.304 320 HA ARG 43 HA ARG 43 -5.693 -10.678 -8.431 321 HB2 ARG 43 2HB ARG 43 -5.946 -10.497 -10.953 322 HB3 ARG 43 3HB ARG 43 -5.443 -12.181 -11.078 323 HG2 ARG 43 2HG ARG 43 -7.424 -12.816 -9.655 324 HG3 ARG 43 3HG ARG 43 -7.941 -11.126 -9.697 325 HD2 ARG 43 2HD ARG 43 -7.965 -11.315 -12.237 326 HD3 ARG 43 3HD ARG 43 -7.701 -13.047 -12.039 327 HE ARG 43 HE ARG 43 -10.092 -11.592 -11.051 328 HH11 ARG 43 1HH1 ARG 43 -8.696 -14.481 -12.500 329 HH12 ARG 43 2HH1 ARG 43 -10.223 -15.292 -12.634 330 HH21 ARG 43 1HH2 ARG 43 -12.075 -12.635 -11.275 331 HH22 ARG 43 2HH2 ARG 43 -12.140 -14.238 -11.935 332 H ASN 44 H ASN 44 -3.423 -13.038 -9.814 333 HA ASN 44 HA ASN 44 -4.349 -15.345 -8.485 334 HB2 ASN 44 2HB ASN 44 -1.593 -14.697 -9.600 335 HB3 ASN 44 3HB ASN 44 -2.010 -16.273 -8.931 336 HD21 ASN 44 1HD2 ASN 44 -1.143 -15.713 -11.586 337 HD22 ASN 44 2HD2 ASN 44 -2.409 -16.192 -12.657 338 H ALA 45 H ALA 45 -2.192 -12.751 -7.428 339 HA ALA 45 HA ALA 45 -1.106 -14.023 -5.133 340 HB1 ALA 45 3HB ALA 45 -0.133 -11.976 -6.094 341 HB2 ALA 45 1HB ALA 45 -0.505 -11.758 -4.383 342 HB3 ALA 45 2HB ALA 45 -1.560 -11.055 -5.613 343 H ILE 46 H ILE 46 -4.022 -12.009 -5.592 344 HA ILE 46 HA ILE 46 -4.900 -12.020 -2.872 345 HB ILE 46 HB ILE 46 -6.676 -11.704 -5.343 346 HG12 ILE 46 2HG1 ILE 46 -5.149 -9.501 -3.864 347 HG13 ILE 46 3HG1 ILE 46 -4.719 -10.134 -5.450 348 HG21 ILE 46 1HG2 ILE 46 -7.015 -10.665 -2.496 349 HG22 ILE 46 2HG2 ILE 46 -7.914 -11.999 -3.223 350 HG23 ILE 46 3HG2 ILE 46 -8.122 -10.360 -3.840 351 HD11 ILE 46 3HD1 ILE 46 -5.872 -8.018 -5.632 352 HD12 ILE 46 1HD1 ILE 46 -7.263 -8.663 -4.761 353 HD13 ILE 46 2HD1 ILE 46 -6.837 -9.306 -6.352 354 H LEU 47 H LEU 47 -5.558 -14.051 -5.692 355 HA LEU 47 HA LEU 47 -7.505 -15.759 -4.475 356 HB2 LEU 47 2HB LEU 47 -5.869 -16.094 -7.017 357 HB3 LEU 47 3HB LEU 47 -7.192 -17.154 -6.545 358 HG LEU 47 HG LEU 47 -7.443 -14.190 -7.224 359 HD11 LEU 47 1HD1 LEU 47 -8.379 -16.614 -8.784 360 HD12 LEU 47 2HD1 LEU 47 -7.031 -15.555 -9.207 361 HD13 LEU 47 3HD1 LEU 47 -8.676 -14.923 -9.206 362 HD21 LEU 47 3HD2 LEU 47 -9.618 -16.170 -6.463 363 HD22 LEU 47 1HD2 LEU 47 -9.880 -14.524 -7.049 364 HD23 LEU 47 2HD2 LEU 47 -9.072 -14.789 -5.507 365 H LYS 48 H LYS 48 -4.080 -15.655 -4.429 366 HA LYS 48 HA LYS 48 -3.540 -18.405 -3.720 367 HB2 LYS 48 2HB LYS 48 -1.906 -16.809 -4.805 368 HB3 LYS 48 3HB LYS 48 -1.842 -15.905 -3.299 369 HG2 LYS 48 2HG LYS 48 -0.927 -17.966 -2.180 370 HG3 LYS 48 3HG LYS 48 -0.892 -18.755 -3.762 371 HD2 LYS 48 2HD LYS 48 0.673 -16.285 -2.913 372 HD3 LYS 48 3HD LYS 48 1.332 -17.887 -3.247 373 HE2 LYS 48 2HE LYS 48 0.684 -17.651 -5.629 374 HE3 LYS 48 3HE LYS 48 0.014 -16.052 -5.288 375 HZ1 LYS 48 3HZ LYS 48 2.189 -15.807 -6.191 376 HZ2 LYS 48 1HZ LYS 48 2.860 -16.867 -5.058 377 HZ3 LYS 48 2HZ LYS 48 2.252 -15.371 -4.564 378 H GLN 49 H GLN 49 -4.215 -15.383 -2.064 379 HA GLN 49 HA GLN 49 -3.712 -16.374 0.611 380 HB2 GLN 49 2HB GLN 49 -5.199 -13.847 -0.248 381 HB3 GLN 49 3HB GLN 49 -4.577 -14.198 1.364 382 HG2 GLN 49 2HG GLN 49 -2.934 -13.712 -1.136 383 HG3 GLN 49 3HG GLN 49 -3.162 -12.591 0.195 384 HE21 GLN 49 1HE2 GLN 49 -2.089 -12.968 2.146 385 HE22 GLN 49 2HE2 GLN 49 -0.746 -14.034 2.259 386 H ALA 50 H ALA 50 -5.301 -16.803 2.159 387 HA ALA 50 HA ALA 50 -7.889 -17.758 1.414 388 HB1 ALA 50 3HB ALA 50 -6.700 -18.597 3.407 389 HB2 ALA 50 1HB ALA 50 -8.275 -17.932 3.850 390 HB3 ALA 50 2HB ALA 50 -6.803 -17.003 4.155 391 H ASP 51 H ASP 51 -6.563 -14.706 2.403 392 HA ASP 51 HA ASP 51 -9.053 -13.303 2.812 393 HB2 ASP 51 2HB ASP 51 -6.298 -12.067 2.336 394 HB3 ASP 51 3HB ASP 51 -7.679 -11.340 3.163 395 H LYS 52 H LYS 52 -10.312 -12.779 1.120 396 HA LYS 52 HA LYS 52 -9.189 -12.414 -1.582 397 HB2 LYS 52 2HB LYS 52 -12.054 -12.847 -0.622 398 HB3 LYS 52 3HB LYS 52 -11.592 -12.612 -2.309 399 HG2 LYS 52 2HG LYS 52 -10.726 -14.904 -0.515 400 HG3 LYS 52 3HG LYS 52 -11.895 -14.992 -1.838 401 HD2 LYS 52 2HD LYS 52 -10.099 -14.420 -3.462 402 HD3 LYS 52 3HD LYS 52 -8.930 -14.315 -2.141 403 HE2 LYS 52 2HE LYS 52 -8.730 -16.454 -3.314 404 HE3 LYS 52 3HE LYS 52 -9.266 -16.704 -1.655 405 HZ1 LYS 52 3HZ LYS 52 -11.015 -16.711 -4.055 406 HZ2 LYS 52 1HZ LYS 52 -11.523 -16.965 -2.463 407 HZ3 LYS 52 2HZ LYS 52 -10.491 -18.074 -3.206 408 H VAL 53 H VAL 53 -8.585 -10.465 0.203 409 HA VAL 53 HA VAL 53 -9.578 -8.131 -1.172 410 HB VAL 53 HB VAL 53 -11.165 -8.227 0.708 411 HG11 VAL 53 1HG1 VAL 53 -10.471 -8.112 3.072 412 HG12 VAL 53 2HG1 VAL 53 -8.778 -8.239 2.590 413 HG13 VAL 53 3HG1 VAL 53 -9.880 -9.587 2.301 414 HG21 VAL 53 3HG2 VAL 53 -10.777 -5.996 1.724 415 HG22 VAL 53 1HG2 VAL 53 -10.452 -5.990 -0.014 416 HG23 VAL 53 2HG2 VAL 53 -9.112 -6.021 1.135 417 H ALA 54 H ALA 54 -7.873 -6.918 -1.613 418 HA ALA 54 HA ALA 54 -5.293 -7.283 -0.225 419 HB1 ALA 54 3HB ALA 54 -5.285 -7.718 -2.656 420 HB2 ALA 54 1HB ALA 54 -4.298 -6.305 -2.267 421 HB3 ALA 54 2HB ALA 54 -5.910 -6.096 -2.960 422 H TYR 55 H TYR 55 -3.992 -5.242 -0.036 423 HA TYR 55 HA TYR 55 -5.539 -2.771 0.319 424 HB2 TYR 55 2HB TYR 55 -3.898 -4.113 2.524 425 HB3 TYR 55 3HB TYR 55 -4.464 -2.452 2.597 426 HD1 TYR 55 HD2 TYR 55 -5.508 -5.999 2.825 427 HD2 TYR 55 HD1 TYR 55 -6.840 -1.939 3.021 428 HE1 TYR 55 HE2 TYR 55 -7.610 -6.734 3.856 429 HE2 TYR 55 HE1 TYR 55 -8.937 -2.682 4.060 430 HH TYR 55 HH TYR 55 -10.316 -4.716 4.183 431 H LEU 56 H LEU 56 -4.442 -1.435 -0.983 432 HA LEU 56 HA LEU 56 -1.586 -1.637 -1.436 433 HB2 LEU 56 2HB LEU 56 -3.164 -1.033 -3.259 434 HB3 LEU 56 3HB LEU 56 -3.628 0.421 -2.392 435 HG LEU 56 HG LEU 56 -1.339 1.343 -2.681 436 HD11 LEU 56 1HD1 LEU 56 -0.733 -1.187 -4.232 437 HD12 LEU 56 2HD1 LEU 56 -0.032 -0.707 -2.684 438 HD13 LEU 56 3HD1 LEU 56 0.309 0.238 -4.130 439 HD21 LEU 56 3HD2 LEU 56 -2.559 0.414 -5.297 440 HD22 LEU 56 1HD2 LEU 56 -1.425 1.756 -5.094 441 HD23 LEU 56 2HD2 LEU 56 -3.033 1.847 -4.378 442 H VAL 57 H VAL 57 -0.407 -1.078 0.300 443 HA VAL 57 HA VAL 57 -1.072 1.259 1.955 444 HB VAL 57 HB VAL 57 1.095 -0.857 2.384 445 HG11 VAL 57 1HG1 VAL 57 1.609 1.257 3.559 446 HG12 VAL 57 2HG1 VAL 57 1.186 -0.008 4.717 447 HG13 VAL 57 3HG1 VAL 57 0.009 1.243 4.308 448 HG21 VAL 57 3HG2 VAL 57 -0.430 -1.842 4.076 449 HG22 VAL 57 1HG2 VAL 57 -1.140 -1.888 2.457 450 HG23 VAL 57 2HG2 VAL 57 -1.678 -0.677 3.624 451 H MET 58 H MET 58 -0.055 3.147 1.656 452 HA MET 58 HA MET 58 2.742 3.248 0.767 453 HB2 MET 58 2HB MET 58 2.357 4.973 -0.871 454 HB3 MET 58 3HB MET 58 1.224 3.684 -1.240 455 HG2 MET 58 2HG MET 58 0.477 6.202 0.271 456 HG3 MET 58 3HG MET 58 0.287 6.000 -1.467 457 HE1 MET 58 3HE MET 58 -0.770 3.104 -1.879 458 HE2 MET 58 1HE MET 58 -1.545 4.517 -2.602 459 HE3 MET 58 2HE MET 58 -2.512 3.327 -1.730 460 H ASP 59 H ASP 59 3.558 5.572 1.081 461 HA ASP 59 HA ASP 59 2.569 6.778 3.590 462 HB2 ASP 59 2HB ASP 59 4.664 8.160 3.402 463 HB3 ASP 59 3HB ASP 59 4.975 6.429 3.456 464 H GLU 60 H GLU 60 2.744 9.368 3.463 465 HA GLU 60 HA GLU 60 0.632 10.075 1.656 466 HB2 GLU 60 2HB GLU 60 0.718 10.999 3.954 467 HB3 GLU 60 3HB GLU 60 2.148 11.933 3.523 468 HG2 GLU 60 2HG GLU 60 0.875 13.243 1.913 469 HG3 GLU 60 3HG GLU 60 -0.542 12.224 2.131 470 H ARG 61 H ARG 61 4.122 10.562 1.624 471 HA ARG 61 HA ARG 61 4.213 12.651 -0.331 472 HB2 ARG 61 2HB ARG 61 6.130 12.082 1.126 473 HB3 ARG 61 3HB ARG 61 6.274 10.513 0.342 474 HG2 ARG 61 2HG ARG 61 6.794 11.707 -1.819 475 HG3 ARG 61 3HG ARG 61 6.788 13.229 -0.922 476 HD2 ARG 61 2HD ARG 61 8.613 12.344 0.522 477 HD3 ARG 61 3HD ARG 61 8.644 10.871 -0.450 478 HE ARG 61 HE ARG 61 9.024 12.855 -2.277 479 HH11 ARG 61 1HH1 ARG 61 10.667 11.976 0.716 480 HH12 ARG 61 2HH1 ARG 61 12.202 12.583 0.185 481 HH21 ARG 61 1HH2 ARG 61 11.034 13.657 -2.938 482 HH22 ARG 61 2HH2 ARG 61 12.404 13.534 -1.887 483 H THR 62 H THR 62 4.279 9.103 -0.566 484 HA THR 62 HA THR 62 4.317 8.893 -3.403 485 HB THR 62 HB THR 62 3.326 6.972 -1.249 486 HG1 THR 62 HG1 THR 62 5.504 7.168 -1.086 487 HG21 THR 62 3HG2 THR 62 3.458 5.179 -2.962 488 HG22 THR 62 1HG2 THR 62 3.791 6.389 -4.204 489 HG23 THR 62 2HG2 THR 62 2.227 6.372 -3.385 490 H TRP 63 H TRP 63 1.738 9.102 -0.972 491 HA TRP 63 HA TRP 63 -0.483 8.703 -2.640 492 HB2 TRP 63 2HB TRP 63 -0.820 8.511 -0.264 493 HB3 TRP 63 3HB TRP 63 -0.215 10.137 0.027 494 HD1 TRP 63 HD1 TRP 63 -1.981 12.087 0.023 495 HE1 TRP 63 HE1 TRP 63 -4.504 12.233 -0.469 496 HE3 TRP 63 HE3 TRP 63 -2.737 7.380 -1.860 497 HZ2 TRP 63 HZ2 TRP 63 -6.534 10.596 -1.513 498 HZ3 TRP 63 HZ3 TRP 63 -5.003 6.758 -2.589 499 HH2 TRP 63 HH2 TRP 63 -6.860 8.335 -2.419 500 H LYS 64 H LYS 64 1.420 11.652 -1.987 501 HA LYS 64 HA LYS 64 -0.254 13.645 -2.925 502 HB2 LYS 64 2HB LYS 64 2.733 13.414 -3.498 503 HB3 LYS 64 3HB LYS 64 1.782 14.894 -3.606 504 HG2 LYS 64 2HG LYS 64 2.413 13.331 -1.099 505 HG3 LYS 64 3HG LYS 64 3.122 14.866 -1.591 506 HD2 LYS 64 2HD LYS 64 0.766 15.853 -1.456 507 HD3 LYS 64 3HD LYS 64 0.258 14.338 -0.707 508 HE2 LYS 64 2HE LYS 64 1.867 14.683 1.119 509 HE3 LYS 64 3HE LYS 64 2.435 16.168 0.353 510 HZ1 LYS 64 3HZ LYS 64 -0.311 15.709 1.374 511 HZ2 LYS 64 1HZ LYS 64 0.272 17.142 0.696 512 HZ3 LYS 64 2HZ LYS 64 0.893 16.589 2.165 513 H LYS 65 H LYS 65 1.847 11.451 -4.727 514 HA LYS 65 HA LYS 65 1.283 12.593 -7.296 515 HB2 LYS 65 2HB LYS 65 2.689 9.968 -6.667 516 HB3 LYS 65 3HB LYS 65 2.751 10.854 -8.190 517 HG2 LYS 65 2HG LYS 65 3.984 11.636 -5.529 518 HG3 LYS 65 3HG LYS 65 4.819 11.263 -7.036 519 HD2 LYS 65 2HD LYS 65 3.075 13.709 -6.510 520 HD3 LYS 65 3HD LYS 65 4.836 13.684 -6.561 521 HE2 LYS 65 2HE LYS 65 4.842 13.224 -8.929 522 HE3 LYS 65 3HE LYS 65 3.098 12.942 -8.941 523 HZ1 LYS 65 3HZ LYS 65 2.739 15.246 -8.375 524 HZ2 LYS 65 1HZ LYS 65 3.668 15.136 -9.783 525 HZ3 LYS 65 2HZ LYS 65 4.405 15.533 -8.315 526 H VAL 66 H VAL 66 0.199 9.710 -5.521 527 HA VAL 66 HA VAL 66 -1.401 8.478 -7.481 528 HB VAL 66 HB VAL 66 -1.905 8.666 -4.462 529 HG11 VAL 66 1HG1 VAL 66 -3.003 6.610 -6.424 530 HG12 VAL 66 2HG1 VAL 66 -3.935 7.912 -5.679 531 HG13 VAL 66 3HG1 VAL 66 -3.260 6.626 -4.676 532 HG21 VAL 66 3HG2 VAL 66 -0.413 6.542 -6.051 533 HG22 VAL 66 1HG2 VAL 66 -0.757 6.472 -4.318 534 HG23 VAL 66 2HG2 VAL 66 0.309 7.725 -4.957 535 H TYR 67 H TYR 67 -2.084 11.038 -5.189 536 HA TYR 67 HA TYR 67 -4.846 11.410 -5.700 537 HB2 TYR 67 2HB TYR 67 -3.714 11.889 -3.530 538 HB3 TYR 67 3HB TYR 67 -2.810 13.186 -4.286 539 HD1 TYR 67 HD1 TYR 67 -6.237 12.140 -3.226 540 HD2 TYR 67 HD2 TYR 67 -3.761 15.377 -4.466 541 HE1 TYR 67 HE1 TYR 67 -7.969 13.743 -2.530 542 HE2 TYR 67 HE2 TYR 67 -5.477 16.968 -3.798 543 HH TYR 67 HH TYR 67 -7.796 17.092 -3.351 544 H ASP 68 H ASP 68 -1.855 12.914 -6.909 545 HA ASP 68 HA ASP 68 -2.927 15.018 -8.445 546 HB2 ASP 68 2HB ASP 68 -0.441 13.306 -8.835 547 HB3 ASP 68 3HB ASP 68 -0.867 14.545 -10.004 548 H LEU 69 H LEU 69 -2.153 11.657 -9.312 549 HA LEU 69 HA LEU 69 -2.869 11.748 -12.038 550 HB2 LEU 69 2HB LEU 69 -2.755 9.363 -10.148 551 HB3 LEU 69 3HB LEU 69 -2.830 9.250 -11.905 552 HG LEU 69 HG LEU 69 -0.550 10.555 -10.373 553 HD11 LEU 69 1HD1 LEU 69 0.750 8.561 -10.883 554 HD12 LEU 69 2HD1 LEU 69 -0.667 7.802 -11.613 555 HD13 LEU 69 3HD1 LEU 69 -0.651 8.174 -9.886 556 HD21 LEU 69 3HD2 LEU 69 -0.793 9.837 -13.316 557 HD22 LEU 69 1HD2 LEU 69 0.653 10.469 -12.520 558 HD23 LEU 69 2HD2 LEU 69 -0.794 11.466 -12.632 559 H LEU 70 H LEU 70 -4.704 10.855 -9.147 560 HA LEU 70 HA LEU 70 -6.980 9.762 -10.322 561 HB2 LEU 70 2HB LEU 70 -6.682 11.333 -7.732 562 HB3 LEU 70 3HB LEU 70 -8.163 10.506 -8.189 563 HG LEU 70 HG LEU 70 -5.481 9.172 -7.640 564 HD11 LEU 70 1HD1 LEU 70 -8.037 9.121 -6.014 565 HD12 LEU 70 2HD1 LEU 70 -6.540 9.955 -5.588 566 HD13 LEU 70 3HD1 LEU 70 -6.568 8.196 -5.674 567 HD21 LEU 70 3HD2 LEU 70 -6.647 7.038 -7.896 568 HD22 LEU 70 1HD2 LEU 70 -6.697 7.969 -9.391 569 HD23 LEU 70 2HD2 LEU 70 -8.127 7.882 -8.358 570 H ILE 71 H ILE 71 -6.504 13.131 -9.201 571 HA ILE 71 HA ILE 71 -8.945 14.134 -10.262 572 HB ILE 71 HB ILE 71 -6.441 15.717 -9.506 573 HG12 ILE 71 2HG1 ILE 71 -8.795 14.925 -7.711 574 HG13 ILE 71 3HG1 ILE 71 -7.204 14.170 -7.672 575 HG21 ILE 71 1HG2 ILE 71 -9.357 16.601 -9.603 576 HG22 ILE 71 2HG2 ILE 71 -8.097 17.072 -10.746 577 HG23 ILE 71 3HG2 ILE 71 -7.996 17.591 -9.062 578 HD11 ILE 71 3HD1 ILE 71 -7.801 17.051 -7.016 579 HD12 ILE 71 1HD1 ILE 71 -6.210 16.283 -6.974 580 HD13 ILE 71 2HD1 ILE 71 -7.477 15.754 -5.867 581 H LEU 72 H LEU 72 -5.724 13.817 -11.559 582 HA LEU 72 HA LEU 72 -5.835 15.604 -13.746 583 HB2 LEU 72 2HB LEU 72 -3.770 14.606 -12.675 584 HB3 LEU 72 3HB LEU 72 -4.154 13.081 -13.432 585 HG LEU 72 HG LEU 72 -2.297 14.410 -14.524 586 HD11 LEU 72 1HD1 LEU 72 -2.886 13.943 -16.815 587 HD12 LEU 72 2HD1 LEU 72 -4.595 13.821 -16.390 588 HD13 LEU 72 3HD1 LEU 72 -3.443 12.639 -15.762 589 HD21 LEU 72 3HD2 LEU 72 -2.844 16.322 -15.953 590 HD22 LEU 72 1HD2 LEU 72 -3.219 16.659 -14.263 591 HD23 LEU 72 2HD2 LEU 72 -4.521 16.280 -15.397 592 H HIS 73 H HIS 73 -6.314 12.057 -13.562 593 HA HIS 73 HA HIS 73 -6.946 11.913 -16.405 594 HB2 HIS 73 2HB HIS 73 -6.706 9.731 -14.293 595 HB3 HIS 73 3HB HIS 73 -7.071 9.424 -15.989 596 HD1 HIS 73 HD1 HIS 73 -5.120 10.246 -17.719 597 HD2 HIS 73 HD2 HIS 73 -3.995 9.824 -13.748 598 HE1 HIS 73 HE1 HIS 73 -2.620 10.104 -17.738 599 HE2 HIS 73 HE2 HIS 73 -1.992 9.633 -15.349 600 H ASP 74 H ASP 74 -8.648 10.785 -13.388 601 HA ASP 74 HA ASP 74 -11.116 11.996 -14.184 602 HB2 ASP 74 2HB ASP 74 -11.097 10.053 -15.767 603 HB3 ASP 74 3HB ASP 74 -11.014 8.943 -14.401 604 H PHE 75 H PHE 75 -10.725 12.807 -12.076 605 HA PHE 75 HA PHE 75 -12.585 11.771 -10.216 606 HB2 PHE 75 2HB PHE 75 -9.712 11.195 -9.600 607 HB3 PHE 75 3HB PHE 75 -10.567 11.971 -8.288 608 HD1 PHE 75 HD1 PHE 75 -13.006 10.824 -7.817 609 HD2 PHE 75 HD2 PHE 75 -9.605 8.854 -9.522 610 HE1 PHE 75 HE1 PHE 75 -13.853 8.655 -7.028 611 HE2 PHE 75 HE2 PHE 75 -10.466 6.693 -8.735 612 HZ PHE 75 HZ PHE 75 -12.590 6.587 -7.486 613 H THR 76 H THR 76 -12.301 13.228 -8.061 614 HA THR 76 HA THR 76 -11.081 15.830 -8.488 615 HB THR 76 HB THR 76 -13.442 15.950 -9.546 616 HG1 THR 76 HG1 THR 76 -13.849 17.912 -7.892 617 HG21 THR 76 3HG2 THR 76 -14.343 15.843 -6.640 618 HG22 THR 76 1HG2 THR 76 -14.679 14.619 -7.869 619 HG23 THR 76 2HG2 THR 76 -15.362 16.236 -8.025 620 HA PRO 77 HA PRO 77 -10.071 15.521 -4.162 621 HB2 PRO 77 2HB PRO 77 -11.051 18.043 -3.174 622 HB3 PRO 77 3HB PRO 77 -9.421 17.690 -3.779 623 HG2 PRO 77 2HG PRO 77 -11.748 18.890 -5.211 624 HG3 PRO 77 3HG PRO 77 -10.015 19.258 -5.356 625 HD2 PRO 77 2HD PRO 77 -11.208 17.830 -7.254 626 HD3 PRO 77 3HD PRO 77 -9.588 17.364 -6.700 627 H GLU 78 H GLU 78 -13.355 16.833 -4.650 628 HA GLU 78 HA GLU 78 -14.366 16.265 -2.084 629 HB2 GLU 78 2HB GLU 78 -15.813 16.714 -4.720 630 HB3 GLU 78 3HB GLU 78 -16.641 16.577 -3.167 631 HG2 GLU 78 2HG GLU 78 -15.379 18.537 -2.329 632 HG3 GLU 78 3HG GLU 78 -14.582 18.688 -3.893 633 H GLU 79 H GLU 79 -14.132 14.207 -4.937 634 HA GLU 79 HA GLU 79 -15.899 12.151 -3.949 635 HB2 GLU 79 2HB GLU 79 -13.818 12.066 -6.171 636 HB3 GLU 79 3HB GLU 79 -14.981 10.782 -5.834 637 HG2 GLU 79 2HG GLU 79 -15.632 13.603 -6.716 638 HG3 GLU 79 3HG GLU 79 -15.698 12.158 -7.720 639 H ILE 80 H ILE 80 -12.414 12.612 -4.144 640 HA ILE 80 HA ILE 80 -11.604 10.043 -3.305 641 HB ILE 80 HB ILE 80 -10.090 12.690 -3.146 642 HG12 ILE 80 2HG1 ILE 80 -10.038 10.602 -5.389 643 HG13 ILE 80 3HG1 ILE 80 -10.989 12.083 -5.450 644 HG21 ILE 80 1HG2 ILE 80 -8.037 11.305 -3.200 645 HG22 ILE 80 2HG2 ILE 80 -9.020 9.840 -3.152 646 HG23 ILE 80 3HG2 ILE 80 -9.017 10.947 -1.776 647 HD11 ILE 80 3HD1 ILE 80 -8.947 12.296 -6.718 648 HD12 ILE 80 1HD1 ILE 80 -7.983 11.920 -5.290 649 HD13 ILE 80 2HD1 ILE 80 -8.940 13.406 -5.347 650 H LYS 81 H LYS 81 -12.094 13.099 -1.550 651 HA LYS 81 HA LYS 81 -11.264 12.121 1.007 652 HB2 LYS 81 2HB LYS 81 -11.934 14.253 1.884 653 HB3 LYS 81 3HB LYS 81 -11.162 14.516 0.325 654 HG2 LYS 81 2HG LYS 81 -13.571 14.589 -0.641 655 HG3 LYS 81 3HG LYS 81 -14.096 14.767 1.038 656 HD2 LYS 81 2HD LYS 81 -12.262 16.630 -0.525 657 HD3 LYS 81 3HD LYS 81 -13.909 16.970 0.003 658 HE2 LYS 81 2HE LYS 81 -13.166 16.913 2.358 659 HE3 LYS 81 3HE LYS 81 -11.520 16.550 1.836 660 HZ1 LYS 81 3HZ LYS 81 -11.743 18.879 2.310 661 HZ2 LYS 81 1HZ LYS 81 -13.042 19.027 1.238 662 HZ3 LYS 81 2HZ LYS 81 -11.501 18.678 0.652 663 H SER 82 H SER 82 -14.257 12.025 -0.752 664 HA SER 82 HA SER 82 -16.101 11.719 1.391 665 HB2 SER 82 2HB SER 82 -16.779 12.362 -0.910 666 HB3 SER 82 3HB SER 82 -16.301 10.776 -1.505 667 HG SER 82 HG SER 82 -18.536 10.915 -1.129 668 H PHE 83 H PHE 83 -13.920 9.493 -0.230 669 HA PHE 83 HA PHE 83 -15.101 7.049 0.715 670 HB2 PHE 83 2HB PHE 83 -12.297 7.602 -0.321 671 HB3 PHE 83 3HB PHE 83 -12.946 5.996 -0.009 672 HD1 PHE 83 HD2 PHE 83 -15.374 5.626 -1.240 673 HD2 PHE 83 HD1 PHE 83 -12.260 8.245 -2.573 674 HE1 PHE 83 HE2 PHE 83 -16.243 5.504 -3.539 675 HE2 PHE 83 HE1 PHE 83 -13.134 8.112 -4.866 676 HZ PHE 83 HZ PHE 83 -15.123 6.743 -5.354 677 H PHE 84 H PHE 84 -12.789 9.343 2.041 678 HA PHE 84 HA PHE 84 -11.892 7.682 4.227 679 HB2 PHE 84 2HB PHE 84 -11.752 10.713 3.871 680 HB3 PHE 84 3HB PHE 84 -10.985 9.829 5.184 681 HD1 PHE 84 HD1 PHE 84 -10.874 10.515 1.552 682 HD2 PHE 84 HD2 PHE 84 -8.906 8.597 4.819 683 HE1 PHE 84 HE1 PHE 84 -8.854 10.269 0.180 684 HE2 PHE 84 HE2 PHE 84 -6.892 8.338 3.436 685 HZ PHE 84 HZ PHE 84 -6.859 9.178 1.119 686 H GLU 85 H GLU 85 -14.577 9.824 3.618 687 HA GLU 85 HA GLU 85 -15.344 10.214 6.358 688 HB2 GLU 85 2HB GLU 85 -16.865 10.704 3.769 689 HB3 GLU 85 3HB GLU 85 -17.428 11.189 5.369 690 HG2 GLU 85 2HG GLU 85 -14.934 12.201 3.954 691 HG3 GLU 85 3HG GLU 85 -16.442 13.087 4.185 692 H ASN 86 H ASN 86 -15.788 8.418 7.457 693 HA ASN 86 HA ASN 86 -17.806 6.503 6.422 694 HB2 ASN 86 2HB ASN 86 -16.734 4.785 7.857 695 HB3 ASN 86 3HB ASN 86 -15.597 5.439 6.685 696 HD21 ASN 86 1HD2 ASN 86 -13.973 6.903 7.439 697 HD22 ASN 86 2HD2 ASN 86 -13.473 6.885 9.090 698 H LYS 87 H LYS 87 -19.459 5.921 7.781 699 HA LYS 87 HA LYS 87 -19.918 7.584 10.192 700 HB2 LYS 87 2HB LYS 87 -21.934 6.220 8.352 701 HB3 LYS 87 3HB LYS 87 -22.332 7.216 9.751 702 HG2 LYS 87 2HG LYS 87 -21.280 9.166 8.638 703 HG3 LYS 87 3HG LYS 87 -20.940 8.155 7.225 704 HD2 LYS 87 2HD LYS 87 -23.350 7.812 6.860 705 HD3 LYS 87 3HD LYS 87 -23.726 8.733 8.324 706 HE2 LYS 87 2HE LYS 87 -22.398 9.809 5.817 707 HE3 LYS 87 3HE LYS 87 -24.054 10.124 6.340 708 HZ1 LYS 87 3HZ LYS 87 -21.558 10.987 7.696 709 HZ2 LYS 87 1HZ LYS 87 -23.101 11.159 8.365 710 HZ3 LYS 87 2HZ LYS 87 -22.703 11.969 6.940 711 H GLY 88 H GLY 88 -20.054 4.339 8.832 712 HA2 GLY 88 2HA GLY 88 -19.736 3.108 11.457 713 HA3 GLY 88 3HA GLY 88 -21.248 2.725 10.626 714 H LYS 89 H LYS 89 -20.464 2.557 8.005 715 HA LYS 89 HA LYS 89 -19.089 0.041 7.858 716 HB2 LYS 89 2HB LYS 89 -19.920 1.963 5.629 717 HB3 LYS 89 3HB LYS 89 -19.310 0.331 5.373 718 HG2 LYS 89 2HG LYS 89 -21.903 1.071 6.773 719 HG3 LYS 89 3HG LYS 89 -21.747 0.416 5.141 720 HD2 LYS 89 2HD LYS 89 -21.039 -1.016 7.736 721 HD3 LYS 89 3HD LYS 89 -22.443 -1.332 6.713 722 HE2 LYS 89 2HE LYS 89 -19.530 -1.797 5.969 723 HE3 LYS 89 3HE LYS 89 -20.728 -3.036 6.334 724 HZ1 LYS 89 3HZ LYS 89 -20.806 -1.173 4.022 725 HZ2 LYS 89 1HZ LYS 89 -21.976 -2.341 4.375 726 HZ3 LYS 89 2HZ LYS 89 -20.407 -2.813 3.967 727 H ARG 90 H ARG 90 -17.059 -0.381 7.096 728 HA ARG 90 HA ARG 90 -14.997 1.322 7.882 729 HB2 ARG 90 2HB ARG 90 -14.860 -1.135 7.866 730 HB3 ARG 90 3HB ARG 90 -14.916 -1.154 6.106 731 HG2 ARG 90 2HG ARG 90 -12.728 -0.180 5.937 732 HG3 ARG 90 3HG ARG 90 -12.704 0.214 7.659 733 HD2 ARG 90 2HD ARG 90 -11.300 -1.711 7.238 734 HD3 ARG 90 3HD ARG 90 -12.695 -2.197 8.205 735 HE ARG 90 HE ARG 90 -12.648 -2.606 5.269 736 HH11 ARG 90 1HH1 ARG 90 -12.868 -3.983 8.511 737 HH12 ARG 90 2HH1 ARG 90 -13.300 -5.558 7.933 738 HH21 ARG 90 1HH2 ARG 90 -13.162 -4.671 4.539 739 HH22 ARG 90 2HH2 ARG 90 -13.465 -5.950 5.671 740 HA PRO 91 HA PRO 91 -14.505 3.877 4.186 741 HB2 PRO 91 2HB PRO 91 -12.048 5.006 4.727 742 HB3 PRO 91 3HB PRO 91 -13.538 5.497 5.562 743 HG2 PRO 91 2HG PRO 91 -11.377 3.639 6.511 744 HG3 PRO 91 3HG PRO 91 -12.242 4.909 7.405 745 HD2 PRO 91 2HD PRO 91 -12.895 2.266 7.624 746 HD3 PRO 91 3HD PRO 91 -14.098 3.562 7.803 747 H VAL 92 H VAL 92 -13.776 3.439 2.180 748 HA VAL 92 HA VAL 92 -12.094 1.208 1.577 749 HB VAL 92 HB VAL 92 -12.979 3.456 -0.306 750 HG11 VAL 92 1HG1 VAL 92 -11.128 2.137 -1.261 751 HG12 VAL 92 2HG1 VAL 92 -12.627 1.798 -2.129 752 HG13 VAL 92 3HG1 VAL 92 -12.010 0.637 -0.951 753 HG21 VAL 92 3HG2 VAL 92 -14.855 1.981 -0.950 754 HG22 VAL 92 1HG2 VAL 92 -14.933 2.403 0.764 755 HG23 VAL 92 2HG2 VAL 92 -14.359 0.807 0.272 756 H PHE 93 H PHE 93 -11.703 4.720 1.454 757 HA PHE 93 HA PHE 93 -8.781 4.491 1.129 758 HB2 PHE 93 2HB PHE 93 -10.710 6.843 0.946 759 HB3 PHE 93 3HB PHE 93 -8.966 7.053 0.988 760 HD1 PHE 93 HD1 PHE 93 -10.613 4.277 -0.904 761 HD2 PHE 93 HD2 PHE 93 -8.804 8.147 -1.143 762 HE1 PHE 93 HE1 PHE 93 -10.522 4.082 -3.342 763 HE2 PHE 93 HE2 PHE 93 -8.716 7.935 -3.590 764 HZ PHE 93 HZ PHE 93 -9.562 5.904 -4.691 765 H VAL 94 H VAL 94 -7.727 4.245 2.982 766 HA VAL 94 HA VAL 94 -8.720 5.468 5.501 767 HB VAL 94 HB VAL 94 -6.861 3.053 5.205 768 HG11 VAL 94 1HG1 VAL 94 -8.352 4.114 7.629 769 HG12 VAL 94 2HG1 VAL 94 -6.612 4.221 7.348 770 HG13 VAL 94 3HG1 VAL 94 -7.372 2.645 7.589 771 HG21 VAL 94 3HG2 VAL 94 -9.852 3.023 5.761 772 HG22 VAL 94 1HG2 VAL 94 -8.785 1.616 5.801 773 HG23 VAL 94 2HG2 VAL 94 -9.068 2.469 4.281 774 H LYS 95 H LYS 95 -7.106 6.437 6.903 775 HA LYS 95 HA LYS 95 -4.326 6.575 6.075 776 HB2 LYS 95 2HB LYS 95 -4.174 8.999 5.970 777 HB3 LYS 95 3HB LYS 95 -5.355 8.441 4.790 778 HG2 LYS 95 2HG LYS 95 -7.205 9.173 6.175 779 HG3 LYS 95 3HG LYS 95 -6.119 9.545 7.519 780 HD2 LYS 95 2HD LYS 95 -6.132 10.955 4.818 781 HD3 LYS 95 3HD LYS 95 -6.834 11.591 6.309 782 HE2 LYS 95 2HE LYS 95 -4.609 11.650 7.358 783 HE3 LYS 95 3HE LYS 95 -3.889 10.932 5.917 784 HZ1 LYS 95 3HZ LYS 95 -3.564 13.307 5.981 785 HZ2 LYS 95 1HZ LYS 95 -5.233 13.569 6.042 786 HZ3 LYS 95 2HZ LYS 95 -4.535 12.878 4.667 787 H GLY 96 H GLY 96 -3.098 8.069 7.638 788 HA2 GLY 96 2HA GLY 96 -3.495 9.154 9.952 789 HA3 GLY 96 3HA GLY 96 -3.928 7.507 10.418 790 H SER 97 H SER 97 -2.160 7.097 11.782 791 HA SER 97 HA SER 97 0.539 7.048 10.669 792 HB2 SER 97 2HB SER 97 0.180 7.422 13.110 793 HB3 SER 97 3HB SER 97 -0.563 5.829 13.241 794 HG SER 97 HG SER 97 1.740 6.035 13.800 795 H LEU 98 H LEU 98 1.665 4.703 11.011 796 HA LEU 98 HA LEU 98 0.609 2.927 9.090 797 HB2 LEU 98 2HB LEU 98 3.008 2.998 9.688 798 HB3 LEU 98 3HB LEU 98 2.636 2.390 11.295 799 HG LEU 98 HG LEU 98 1.845 0.234 10.279 800 HD11 LEU 98 1HD1 LEU 98 1.172 1.024 8.072 801 HD12 LEU 98 2HD1 LEU 98 2.335 -0.291 7.932 802 HD13 LEU 98 3HD1 LEU 98 2.854 1.374 7.659 803 HD21 LEU 98 3HD2 LEU 98 4.689 0.981 9.544 804 HD22 LEU 98 1HD2 LEU 98 4.052 -0.660 9.701 805 HD23 LEU 98 2HD2 LEU 98 4.133 0.391 11.114 806 H GLU 99 H GLU 99 0.672 2.735 12.642 807 HA GLU 99 HA GLU 99 -0.742 0.276 12.871 808 HB2 GLU 99 2HB GLU 99 -0.271 2.468 14.927 809 HB3 GLU 99 3HB GLU 99 -0.880 0.852 15.296 810 HG2 GLU 99 2HG GLU 99 1.240 -0.128 14.454 811 HG3 GLU 99 3HG GLU 99 1.849 1.497 14.119 812 H SER 100 H SER 100 -1.679 3.683 13.197 813 HA SER 100 HA SER 100 -4.302 3.390 14.131 814 HB2 SER 100 2HB SER 100 -3.168 5.621 12.365 815 HB3 SER 100 3HB SER 100 -4.584 5.733 13.418 816 HG SER 100 HG SER 100 -3.186 5.317 15.186 817 H ALA 101 H ALA 101 -3.120 3.870 10.803 818 HA ALA 101 HA ALA 101 -5.604 3.727 9.473 819 HB1 ALA 101 3HB ALA 101 -3.599 4.753 8.472 820 HB2 ALA 101 1HB ALA 101 -4.275 3.510 7.415 821 HB3 ALA 101 2HB ALA 101 -2.827 3.169 8.368 822 H ALA 102 H ALA 102 -3.399 1.263 10.598 823 HA ALA 102 HA ALA 102 -4.356 -0.941 9.064 824 HB1 ALA 102 3HB ALA 102 -2.149 -0.925 10.160 825 HB2 ALA 102 1HB ALA 102 -3.116 -2.300 10.701 826 HB3 ALA 102 2HB ALA 102 -2.928 -0.890 11.744 827 H GLU 103 H GLU 103 -5.120 0.360 12.275 828 HA GLU 103 HA GLU 103 -6.949 -1.646 13.120 829 HB2 GLU 103 2HB GLU 103 -6.762 1.268 14.007 830 HB3 GLU 103 3HB GLU 103 -7.583 -0.028 14.882 831 HG2 GLU 103 2HG GLU 103 -5.458 -1.174 15.243 832 HG3 GLU 103 3HG GLU 103 -4.618 0.027 14.276 833 H GLN 104 H GLN 104 -7.348 1.458 11.490 834 HA GLN 104 HA GLN 104 -10.198 1.480 11.373 835 HB2 GLN 104 2HB GLN 104 -8.147 2.942 9.663 836 HB3 GLN 104 3HB GLN 104 -9.870 3.316 9.709 837 HG2 GLN 104 2HG GLN 104 -9.713 4.032 12.011 838 HG3 GLN 104 3HG GLN 104 -8.039 3.489 12.122 839 HE21 GLN 104 1HE2 GLN 104 -6.433 4.695 11.062 840 HE22 GLN 104 2HE2 GLN 104 -6.686 6.319 10.547 841 H ALA 105 H ALA 105 -7.670 0.241 9.212 842 HA ALA 105 HA ALA 105 -9.535 -0.512 7.099 843 HB1 ALA 105 3HB ALA 105 -7.277 0.250 6.507 844 HB2 ALA 105 1HB ALA 105 -7.554 -1.402 5.949 845 HB3 ALA 105 2HB ALA 105 -6.568 -1.108 7.387 846 H GLY 106 H GLY 106 -8.452 -1.904 10.026 847 HA2 GLY 106 2HA GLY 106 -9.205 -3.803 11.089 848 HA3 GLY 106 3HA GLY 106 -10.174 -4.174 9.670 849 H ILE 107 H ILE 107 -6.742 -3.665 9.463 850 HA ILE 107 HA ILE 107 -6.263 -6.438 8.611 851 HB ILE 107 HB ILE 107 -4.211 -4.174 8.650 852 HG12 ILE 107 2HG1 ILE 107 -6.084 -4.745 6.307 853 HG13 ILE 107 3HG1 ILE 107 -6.257 -3.375 7.403 854 HG21 ILE 107 1HG2 ILE 107 -3.354 -6.454 8.218 855 HG22 ILE 107 2HG2 ILE 107 -3.159 -5.416 6.804 856 HG23 ILE 107 3HG2 ILE 107 -4.457 -6.612 6.848 857 HD11 ILE 107 3HD1 ILE 107 -5.174 -2.698 5.353 858 HD12 ILE 107 1HD1 ILE 107 -3.908 -3.905 5.576 859 HD13 ILE 107 2HD1 ILE 107 -4.050 -2.549 6.701 860 H VAL 108 H VAL 108 -4.485 -7.688 9.625 861 HA VAL 108 HA VAL 108 -4.131 -7.302 12.446 862 HB VAL 108 HB VAL 108 -2.531 -9.117 10.590 863 HG11 VAL 108 1HG1 VAL 108 -1.354 -8.742 12.723 864 HG12 VAL 108 2HG1 VAL 108 -1.950 -10.398 12.621 865 HG13 VAL 108 3HG1 VAL 108 -2.801 -9.216 13.624 866 HG21 VAL 108 3HG2 VAL 108 -4.042 -10.922 11.325 867 HG22 VAL 108 1HG2 VAL 108 -4.923 -9.643 10.483 868 HG23 VAL 108 2HG2 VAL 108 -4.998 -9.755 12.246 869 H VAL 109 H VAL 109 -3.098 -5.595 13.127 870 HA VAL 109 HA VAL 109 -1.362 -3.911 11.752 871 HB VAL 109 HB VAL 109 -1.515 -4.211 14.795 872 HG11 VAL 109 1HG1 VAL 109 0.383 -2.817 14.077 873 HG12 VAL 109 2HG1 VAL 109 -0.845 -1.820 14.856 874 HG13 VAL 109 3HG1 VAL 109 -0.694 -1.814 13.098 875 HG21 VAL 109 3HG2 VAL 109 -3.295 -2.504 14.767 876 HG22 VAL 109 1HG2 VAL 109 -3.776 -3.928 13.838 877 HG23 VAL 109 2HG2 VAL 109 -3.248 -2.468 13.003 878 H ASP 110 H ASP 110 -0.676 -6.531 14.033 879 HA ASP 110 HA ASP 110 2.042 -6.123 14.505 880 HB2 ASP 110 2HB ASP 110 0.570 -7.632 15.847 881 HB3 ASP 110 3HB ASP 110 0.503 -8.766 14.502 882 H GLU 111 H GLU 111 0.446 -8.075 11.972 883 HA GLU 111 HA GLU 111 2.881 -9.193 10.955 884 HB2 GLU 111 2HB GLU 111 0.114 -9.159 9.690 885 HB3 GLU 111 3HB GLU 111 1.485 -10.106 9.115 886 HG2 GLU 111 2HG GLU 111 1.516 -11.283 11.335 887 HG3 GLU 111 3HG GLU 111 0.039 -10.421 11.759 888 H LEU 112 H LEU 112 0.753 -6.469 9.896 889 HA LEU 112 HA LEU 112 2.389 -5.958 7.568 890 HB2 LEU 112 2HB LEU 112 1.130 -3.877 7.276 891 HB3 LEU 112 3HB LEU 112 0.103 -5.277 7.489 892 HG LEU 112 HG LEU 112 -0.120 -4.443 9.979 893 HD11 LEU 112 1HD1 LEU 112 1.595 -2.696 9.947 894 HD12 LEU 112 2HD1 LEU 112 0.010 -2.008 10.287 895 HD13 LEU 112 3HD1 LEU 112 0.721 -1.834 8.679 896 HD21 LEU 112 3HD2 LEU 112 -2.046 -3.106 9.387 897 HD22 LEU 112 1HD2 LEU 112 -1.932 -4.512 8.346 898 HD23 LEU 112 2HD2 LEU 112 -1.462 -2.926 7.735 899 H VAL 113 H VAL 113 2.598 -4.977 10.885 900 HA VAL 113 HA VAL 113 4.465 -2.843 10.527 901 HB VAL 113 HB VAL 113 3.758 -4.510 12.983 902 HG11 VAL 113 1HG1 VAL 113 6.162 -3.987 13.224 903 HG12 VAL 113 2HG1 VAL 113 5.216 -3.024 14.362 904 HG13 VAL 113 3HG1 VAL 113 5.838 -2.285 12.884 905 HG21 VAL 113 3HG2 VAL 113 2.131 -2.778 12.290 906 HG22 VAL 113 1HG2 VAL 113 3.398 -1.553 12.349 907 HG23 VAL 113 2HG2 VAL 113 2.869 -2.350 13.835 908 H GLN 114 H GLN 114 4.747 -6.372 10.923 909 HA GLN 114 HA GLN 114 7.590 -6.540 10.967 910 HB2 GLN 114 2HB GLN 114 5.547 -8.542 9.894 911 HB3 GLN 114 3HB GLN 114 7.262 -8.891 10.111 912 HG2 GLN 114 2HG GLN 114 5.259 -8.270 12.303 913 HG3 GLN 114 3HG GLN 114 5.968 -9.841 11.936 914 HE21 GLN 114 1HE2 GLN 114 6.479 -6.755 13.438 915 HE22 GLN 114 2HE2 GLN 114 7.996 -7.132 14.177 916 H THR 115 H THR 115 5.207 -6.773 8.405 917 HA THR 115 HA THR 115 6.731 -7.145 6.154 918 HB THR 115 HB THR 115 4.070 -5.775 6.642 919 HG1 THR 115 HG1 THR 115 3.413 -7.772 6.691 920 HG21 THR 115 3HG2 THR 115 3.539 -6.087 4.279 921 HG22 THR 115 1HG2 THR 115 5.195 -6.613 3.960 922 HG23 THR 115 2HG2 THR 115 4.875 -4.955 4.485 923 H VAL 116 H VAL 116 5.839 -4.045 7.689 924 HA VAL 116 HA VAL 116 7.147 -2.448 5.644 925 HB VAL 116 HB VAL 116 5.696 -1.636 8.209 926 HG11 VAL 116 1HG1 VAL 116 6.782 0.191 6.018 927 HG12 VAL 116 2HG1 VAL 116 7.391 0.090 7.672 928 HG13 VAL 116 3HG1 VAL 116 5.763 0.704 7.370 929 HG21 VAL 116 3HG2 VAL 116 3.912 -0.863 6.672 930 HG22 VAL 116 1HG2 VAL 116 4.234 -2.584 6.446 931 HG23 VAL 116 2HG2 VAL 116 4.856 -1.410 5.285 932 H LYS 117 H LYS 117 7.857 -3.384 9.045 933 HA LYS 117 HA LYS 117 10.023 -1.530 9.353 934 HB2 LYS 117 2HB LYS 117 10.485 -2.519 11.474 935 HB3 LYS 117 3HB LYS 117 8.735 -2.554 11.293 936 HG2 LYS 117 2HG LYS 117 8.853 -4.962 10.689 937 HG3 LYS 117 3HG LYS 117 10.606 -4.925 10.889 938 HD2 LYS 117 2HD LYS 117 8.564 -4.385 13.086 939 HD3 LYS 117 3HD LYS 117 9.442 -5.899 12.856 940 HE2 LYS 117 2HE LYS 117 11.576 -4.739 13.286 941 HE3 LYS 117 3HE LYS 117 10.718 -3.209 13.479 942 HZ1 LYS 117 3HZ LYS 117 10.367 -5.604 15.193 943 HZ2 LYS 117 1HZ LYS 117 9.570 -4.128 15.386 944 HZ3 LYS 117 2HZ LYS 117 11.244 -4.225 15.602 945 H ASN 118 H ASN 118 9.757 -4.865 8.315 946 HA ASN 118 HA ASN 118 12.589 -5.380 8.215 947 HB2 ASN 118 2HB ASN 118 10.247 -6.964 7.063 948 HB3 ASN 118 3HB ASN 118 11.922 -7.518 7.070 949 HD21 ASN 118 1HD2 ASN 118 9.594 -8.715 8.332 950 HD22 ASN 118 2HD2 ASN 118 9.953 -8.836 10.016 951 H TYR 119 H TYR 119 10.012 -4.482 5.907 952 HA TYR 119 HA TYR 119 11.482 -4.387 3.538 953 HB2 TYR 119 2HB TYR 119 9.076 -4.007 3.467 954 HB3 TYR 119 3HB TYR 119 9.217 -2.579 4.486 955 HD1 TYR 119 HD1 TYR 119 10.510 -3.859 1.183 956 HD2 TYR 119 HD2 TYR 119 9.131 -0.471 3.395 957 HE1 TYR 119 HE1 TYR 119 10.702 -2.478 -0.830 958 HE2 TYR 119 HE2 TYR 119 9.326 0.916 1.374 959 HH TYR 119 HH TYR 119 10.354 0.970 -0.750 960 H GLN 120 H GLN 120 10.839 -1.644 5.727 961 HA GLN 120 HA GLN 120 12.648 0.188 4.672 962 HB2 GLN 120 2HB GLN 120 11.563 -0.031 7.513 963 HB3 GLN 120 3HB GLN 120 12.429 1.370 6.888 964 HG2 GLN 120 2HG GLN 120 10.635 1.637 5.154 965 HG3 GLN 120 3HG GLN 120 9.738 0.334 5.933 966 HE21 GLN 120 1HE2 GLN 120 9.102 3.212 5.541 967 HE22 GLN 120 2HE2 GLN 120 8.747 3.827 7.107 968 H GLY 121 H GLY 121 13.095 -2.402 6.974 969 HA2 GLY 121 2HA GLY 121 15.566 -1.621 8.122 970 HA3 GLY 121 3HA GLY 121 14.857 -3.224 8.150 971 H TYR 122 H TYR 122 14.731 -3.724 5.354 972 HA TYR 122 HA TYR 122 17.549 -4.293 4.873 973 HB2 TYR 122 2HB TYR 122 16.824 -5.836 3.163 974 HB3 TYR 122 3HB TYR 122 15.978 -6.134 4.657 975 HD1 TYR 122 HD2 TYR 122 15.193 -3.922 1.645 976 HD2 TYR 122 HD1 TYR 122 13.915 -7.116 4.177 977 HE1 TYR 122 HE2 TYR 122 13.136 -4.144 0.338 978 HE2 TYR 122 HE1 TYR 122 11.866 -7.345 2.849 979 HH TYR 122 HH TYR 122 10.478 -6.003 1.351 980 H VAL 123 H VAL 123 15.266 -1.983 3.806 981 HA VAL 123 HA VAL 123 16.162 -1.356 1.213 982 HB VAL 123 HB VAL 123 14.757 0.289 3.357 983 HG11 VAL 123 1HG1 VAL 123 14.430 2.111 1.675 984 HG12 VAL 123 2HG1 VAL 123 15.582 1.300 0.612 985 HG13 VAL 123 3HG1 VAL 123 16.113 1.932 2.171 986 HG21 VAL 123 3HG2 VAL 123 12.839 0.199 1.814 987 HG22 VAL 123 1HG2 VAL 123 13.432 -1.430 2.137 988 HG23 VAL 123 2HG2 VAL 123 13.819 -0.641 0.610 989 H GLN 124 H GLN 124 17.089 0.079 4.346 990 HA GLN 124 HA GLN 124 19.000 1.912 3.391 991 HB2 GLN 124 2HB GLN 124 19.829 1.919 5.797 992 HB3 GLN 124 3HB GLN 124 18.110 2.242 5.594 993 HG2 GLN 124 2HG GLN 124 17.501 0.077 6.326 994 HG3 GLN 124 3HG GLN 124 19.162 -0.519 6.239 995 HE21 GLN 124 1HE2 GLN 124 19.227 -1.191 8.343 996 HE22 GLN 124 2HE2 GLN 124 19.222 -0.115 9.697 997 H ASP 125 H ASP 125 19.238 -1.500 4.055 998 HA ASP 125 HA ASP 125 22.134 -1.624 3.913 999 HB2 ASP 125 2HB ASP 125 19.948 -3.736 4.118 1000 HB3 ASP 125 3HB ASP 125 21.645 -4.168 3.936 1001 H GLY 126 H GLY 126 19.474 -1.774 1.693 1002 HA2 GLY 126 2HA GLY 126 19.398 -1.884 -0.600 1003 HA3 GLY 126 3HA GLY 126 21.153 -1.861 -0.628 1004 H HIS 127 H HIS 127 18.920 -4.197 0.875 1005 HA HIS 127 HA HIS 127 19.518 -6.262 -1.104 1006 HB2 HIS 127 2HB HIS 127 21.390 -6.461 0.535 1007 HB3 HIS 127 3HB HIS 127 20.234 -6.603 1.851 1008 HD1 HIS 127 HD1 HIS 127 21.797 -8.529 -0.936 1009 HD2 HIS 127 HD2 HIS 127 19.006 -9.167 2.075 1010 HE1 HIS 127 HE1 HIS 127 21.470 -11.014 -0.830 1011 HE2 HIS 127 HE2 HIS 127 19.856 -11.377 1.064 1012 H ASP 128 H ASP 128 17.363 -6.625 -1.615 1013 HA ASP 128 HA ASP 128 15.252 -6.439 0.272 1014 HB2 ASP 128 2HB ASP 128 13.758 -7.026 -1.492 1015 HB3 ASP 128 3HB ASP 128 15.023 -6.048 -2.223 1016 H HIS 129 H HIS 129 13.779 -8.117 0.900 1017 HA HIS 129 HA HIS 129 14.875 -10.858 1.124 1018 HB2 HIS 129 2HB HIS 129 13.735 -9.123 3.361 1019 HB3 HIS 129 3HB HIS 129 13.709 -10.874 3.469 1020 HD1 HIS 129 HD1 HIS 129 15.583 -11.814 4.706 1021 HD2 HIS 129 HD2 HIS 129 16.616 -8.217 2.900 1022 HE1 HIS 129 HE1 HIS 129 17.945 -11.355 5.418 1023 HE2 HIS 129 HE2 HIS 129 18.443 -9.062 4.504 1024 H ASP 130 H ASP 130 11.994 -8.858 1.737 1025 HA ASP 130 HA ASP 130 10.159 -11.062 1.235 1026 HB2 ASP 130 2HB ASP 130 9.692 -8.138 1.965 1027 HB3 ASP 130 3HB ASP 130 8.419 -9.343 1.835 1028 H PHE 131 H PHE 131 11.419 -10.884 -1.008 1029 HA PHE 131 HA PHE 131 11.619 -10.253 -3.162 1030 HB2 PHE 131 2HB PHE 131 9.469 -10.751 -4.470 1031 HB3 PHE 131 3HB PHE 131 10.117 -12.029 -3.468 1032 HD1 PHE 131 HD2 PHE 131 7.339 -9.574 -3.786 1033 HD2 PHE 131 HD1 PHE 131 8.850 -12.926 -1.589 1034 HE1 PHE 131 HE2 PHE 131 5.147 -9.868 -2.719 1035 HE2 PHE 131 HE1 PHE 131 6.647 -13.212 -0.535 1036 HZ PHE 131 HZ PHE 131 4.798 -11.687 -1.095 1037 H GLY 132 H GLY 132 12.103 -8.055 -2.313 1038 HA2 GLY 132 2HA GLY 132 10.151 -5.951 -2.794 1039 HA3 GLY 132 3HA GLY 132 11.813 -5.751 -2.233 1040 H ARG 133 H ARG 133 11.913 -3.976 -3.754 1041 HA ARG 133 HA ARG 133 12.199 -4.732 -6.603 1042 HB2 ARG 133 2HB ARG 133 12.332 -2.260 -7.051 1043 HB3 ARG 133 3HB ARG 133 10.797 -2.782 -6.382 1044 HG2 ARG 133 2HG ARG 133 12.923 -1.596 -4.578 1045 HG3 ARG 133 3HG ARG 133 11.882 -0.553 -5.549 1046 HD2 ARG 133 2HD ARG 133 10.956 -2.550 -3.447 1047 HD3 ARG 133 3HD ARG 133 10.994 -0.792 -3.275 1048 HE ARG 133 HE ARG 133 9.445 -1.481 -5.532 1049 HH11 ARG 133 1HH1 ARG 133 9.207 -1.571 -2.023 1050 HH12 ARG 133 2HH1 ARG 133 7.478 -1.477 -2.028 1051 HH21 ARG 133 1HH2 ARG 133 7.211 -1.297 -5.502 1052 HH22 ARG 133 2HH2 ARG 133 6.346 -1.324 -3.998 1053 H ASP 134 H ASP 134 14.109 -3.188 -7.581 1054 HA ASP 134 HA ASP 134 16.524 -4.392 -6.878 1055 HB2 ASP 134 2HB ASP 134 16.014 -3.171 -9.087 1056 HB3 ASP 134 3HB ASP 134 16.265 -1.674 -8.234 1057 HA PRO 135 HA PRO 135 18.135 -2.424 -3.093 1058 HB2 PRO 135 2HB PRO 135 20.711 -1.886 -4.405 1059 HB3 PRO 135 3HB PRO 135 20.315 -3.098 -3.178 1060 HG2 PRO 135 2HG PRO 135 20.433 -3.388 -6.118 1061 HG3 PRO 135 3HG PRO 135 20.622 -4.623 -4.855 1062 HD2 PRO 135 2HD PRO 135 18.425 -4.563 -6.382 1063 HD3 PRO 135 3HD PRO 135 18.292 -4.957 -4.648 1064 H LYS 136 H LYS 136 18.925 -0.720 -6.166 1065 HA LYS 136 HA LYS 136 19.340 1.809 -4.864 1066 HB2 LYS 136 2HB LYS 136 19.761 2.695 -7.064 1067 HB3 LYS 136 3HB LYS 136 20.475 1.085 -6.995 1068 HG2 LYS 136 2HG LYS 136 18.380 0.233 -8.147 1069 HG3 LYS 136 3HG LYS 136 17.914 1.912 -8.387 1070 HD2 LYS 136 2HD LYS 136 18.903 1.123 -10.404 1071 HD3 LYS 136 3HD LYS 136 20.062 2.248 -9.670 1072 HE2 LYS 136 2HE LYS 136 21.559 0.543 -10.106 1073 HE3 LYS 136 3HE LYS 136 20.903 -0.133 -8.634 1074 HZ1 LYS 136 3HZ LYS 136 19.386 -1.452 -9.880 1075 HZ2 LYS 136 1HZ LYS 136 20.958 -1.743 -10.415 1076 HZ3 LYS 136 2HZ LYS 136 19.918 -0.781 -11.331 1077 H TYR 137 H TYR 137 16.531 0.231 -6.302 1078 HA TYR 137 HA TYR 137 14.882 2.665 -6.244 1079 HB2 TYR 137 2HB TYR 137 14.181 -0.202 -7.038 1080 HB3 TYR 137 3HB TYR 137 13.049 1.145 -7.092 1081 HD1 TYR 137 HD1 TYR 137 16.131 -0.217 -8.580 1082 HD2 TYR 137 HD2 TYR 137 13.103 2.738 -8.966 1083 HE1 TYR 137 HE1 TYR 137 16.969 0.280 -10.803 1084 HE2 TYR 137 HE2 TYR 137 13.919 3.254 -11.233 1085 HH TYR 137 HH TYR 137 16.176 1.280 -12.881 1086 H LEU 138 H LEU 138 15.687 0.069 -4.133 1087 HA LEU 138 HA LEU 138 13.419 -0.048 -2.471 1088 HB2 LEU 138 2HB LEU 138 16.374 -0.411 -1.868 1089 HB3 LEU 138 3HB LEU 138 15.149 -0.616 -0.632 1090 HG LEU 138 HG LEU 138 15.421 -2.314 -3.150 1091 HD11 LEU 138 1HD1 LEU 138 17.207 -2.760 -1.532 1092 HD12 LEU 138 2HD1 LEU 138 16.085 -4.115 -1.620 1093 HD13 LEU 138 3HD1 LEU 138 16.014 -3.003 -0.250 1094 HD21 LEU 138 3HD2 LEU 138 13.070 -2.120 -2.485 1095 HD22 LEU 138 1HD2 LEU 138 13.473 -2.598 -0.834 1096 HD23 LEU 138 2HD2 LEU 138 13.673 -3.741 -2.166 1097 H HIS 139 H HIS 139 12.460 1.713 -1.621 1098 HA HIS 139 HA HIS 139 14.080 3.647 -0.068 1099 HB2 HIS 139 2HB HIS 139 11.802 4.372 -1.977 1100 HB3 HIS 139 3HB HIS 139 12.477 5.482 -0.786 1101 HD1 HIS 139 HD1 HIS 139 13.083 4.057 -4.138 1102 HD2 HIS 139 HD2 HIS 139 15.169 6.327 -1.356 1103 HE1 HIS 139 HE1 HIS 139 15.064 4.978 -5.369 1104 HE2 HIS 139 HE2 HIS 139 16.243 6.435 -3.699 1105 H GLN 140 H GLN 140 13.251 4.076 1.920 1106 HA GLN 140 HA GLN 140 11.156 2.482 2.996 1107 HB2 GLN 140 2HB GLN 140 12.449 4.971 4.224 1108 HB3 GLN 140 3HB GLN 140 11.439 3.813 5.074 1109 HG2 GLN 140 2HG GLN 140 13.462 3.000 5.727 1110 HG3 GLN 140 3HG GLN 140 13.307 2.096 4.229 1111 HE21 GLN 140 1HE2 GLN 140 15.691 2.558 5.563 1112 HE22 GLN 140 2HE2 GLN 140 16.722 3.513 4.562 1113 H PHE 141 H PHE 141 9.045 3.062 3.616 1114 HA PHE 141 HA PHE 141 7.664 5.175 2.318 1115 HB2 PHE 141 2HB PHE 141 6.901 3.703 4.887 1116 HB3 PHE 141 3HB PHE 141 5.818 4.706 3.929 1117 HD1 PHE 141 HD1 PHE 141 5.553 3.952 1.387 1118 HD2 PHE 141 HD2 PHE 141 6.833 1.392 4.570 1119 HE1 PHE 141 HE1 PHE 141 4.815 1.991 0.122 1120 HE2 PHE 141 HE2 PHE 141 6.097 -0.562 3.294 1121 HZ PHE 141 HZ PHE 141 5.089 -0.271 1.058 1122 H GLU 142 H GLU 142 7.373 7.285 2.948 1123 HA GLU 142 HA GLU 142 8.969 8.496 4.965 1124 HB2 GLU 142 2HB GLU 142 6.501 9.633 3.565 1125 HB3 GLU 142 3HB GLU 142 7.730 10.566 4.417 1126 HG2 GLU 142 2HG GLU 142 8.279 8.907 1.933 1127 HG3 GLU 142 3HG GLU 142 7.868 10.616 1.905 1128 H GLY 143 H GLY 143 8.620 8.024 7.045 1129 HA2 GLY 143 2HA GLY 143 6.074 7.263 8.168 1130 HA3 GLY 143 3HA GLY 143 7.599 7.457 9.027 1131 H GLU 144 H GLU 144 5.256 9.481 7.286 1132 HA GLU 144 HA GLU 144 5.139 11.316 9.575 1133 HB2 GLU 144 2HB GLU 144 4.599 13.122 7.724 1134 HB3 GLU 144 3HB GLU 144 6.256 12.736 8.148 1135 HG2 GLU 144 2HG GLU 144 6.251 12.892 5.816 1136 HG3 GLU 144 3HG GLU 144 6.285 11.163 6.139 1137 H THR 145 H THR 145 3.441 10.093 6.682 1138 HA THR 145 HA THR 145 1.091 9.547 8.328 1139 HB THR 145 HB THR 145 0.793 11.166 5.749 1140 HG1 THR 145 HG1 THR 145 1.536 12.544 7.339 1141 HG21 THR 145 3HG2 THR 145 -1.296 10.339 7.802 1142 HG22 THR 145 1HG2 THR 145 -1.121 9.644 6.185 1143 HG23 THR 145 2HG2 THR 145 -1.589 11.336 6.376 1144 H PHE 146 H PHE 146 0.243 7.588 7.678 1145 HA PHE 146 HA PHE 146 1.054 6.408 5.089 1146 HB2 PHE 146 2HB PHE 146 0.284 5.184 7.753 1147 HB3 PHE 146 3HB PHE 146 0.005 4.255 6.285 1148 HD1 PHE 146 HD2 PHE 146 2.658 5.853 8.369 1149 HD2 PHE 146 HD1 PHE 146 1.792 3.194 5.124 1150 HE1 PHE 146 HE2 PHE 146 4.983 5.043 8.396 1151 HE2 PHE 146 HE1 PHE 146 4.107 2.395 5.162 1152 HZ PHE 146 HZ PHE 146 5.707 3.307 6.788 1153 H TYR 147 H TYR 147 -0.472 5.485 3.754 1154 HA TYR 147 HA TYR 147 -3.351 5.869 4.294 1155 HB2 TYR 147 2HB TYR 147 -1.811 6.381 1.703 1156 HB3 TYR 147 3HB TYR 147 -3.549 6.108 1.707 1157 HD1 TYR 147 HD1 TYR 147 -0.963 8.354 3.280 1158 HD2 TYR 147 HD2 TYR 147 -4.976 7.970 1.875 1159 HE1 TYR 147 HE1 TYR 147 -1.335 10.746 3.665 1160 HE2 TYR 147 HE2 TYR 147 -5.339 10.367 2.260 1161 HH TYR 147 HH TYR 147 -2.743 12.527 3.009 1162 H ILE 148 H ILE 148 -4.612 4.111 3.793 1163 HA ILE 148 HA ILE 148 -3.398 1.756 2.473 1164 HB ILE 148 HB ILE 148 -5.176 1.706 4.967 1165 HG12 ILE 148 2HG1 ILE 148 -2.250 0.904 4.588 1166 HG13 ILE 148 3HG1 ILE 148 -2.844 2.259 5.540 1167 HG21 ILE 148 1HG2 ILE 148 -4.973 -0.753 4.877 1168 HG22 ILE 148 2HG2 ILE 148 -4.063 -0.630 3.370 1169 HG23 ILE 148 3HG2 ILE 148 -5.755 -0.128 3.424 1170 HD11 ILE 148 3HD1 ILE 148 -3.915 0.670 7.087 1171 HD12 ILE 148 1HD1 ILE 148 -2.168 0.455 6.977 1172 HD13 ILE 148 2HD1 ILE 148 -3.245 -0.670 6.151 1173 H ILE 149 H ILE 149 -4.497 1.544 0.625 1174 HA ILE 149 HA ILE 149 -7.318 2.373 0.427 1175 HB ILE 149 HB ILE 149 -5.433 1.654 -1.866 1176 HG12 ILE 149 2HG1 ILE 149 -4.483 3.601 -0.680 1177 HG13 ILE 149 3HG1 ILE 149 -5.131 4.105 -2.234 1178 HG21 ILE 149 1HG2 ILE 149 -8.093 3.136 -1.841 1179 HG22 ILE 149 2HG2 ILE 149 -7.805 1.510 -2.465 1180 HG23 ILE 149 3HG2 ILE 149 -7.072 2.901 -3.264 1181 HD11 ILE 149 3HD1 ILE 149 -5.607 5.722 -0.507 1182 HD12 ILE 149 1HD1 ILE 149 -6.450 4.508 0.453 1183 HD13 ILE 149 2HD1 ILE 149 -7.107 5.019 -1.107 1184 H GLU 150 H GLU 150 -8.646 0.759 0.900 1185 HA GLU 150 HA GLU 150 -8.143 -2.010 0.747 1186 HB2 GLU 150 2HB GLU 150 -9.709 -1.027 2.365 1187 HB3 GLU 150 3HB GLU 150 -10.754 -0.475 1.058 1188 HG2 GLU 150 2HG GLU 150 -11.354 -2.745 0.480 1189 HG3 GLU 150 3HG GLU 150 -10.143 -3.396 1.590 1190 H GLN 151 H GLN 151 -8.178 -3.270 -0.955 1191 HA GLN 151 HA GLN 151 -9.649 -2.638 -3.450 1192 HB2 GLN 151 2HB GLN 151 -7.163 -4.404 -3.125 1193 HB3 GLN 151 3HB GLN 151 -7.908 -3.920 -4.646 1194 HG2 GLN 151 2HG GLN 151 -6.496 -2.062 -2.695 1195 HG3 GLN 151 3HG GLN 151 -5.801 -2.716 -4.177 1196 HE21 GLN 151 1HE2 GLN 151 -8.060 -0.424 -2.838 1197 HE22 GLN 151 2HE2 GLN 151 -8.323 0.468 -4.289 1198 H ARG 152 H ARG 152 -11.486 -3.967 -3.498 1199 HA ARG 152 HA ARG 152 -11.302 -6.742 -2.495 1200 HB2 ARG 152 2HB ARG 152 -13.700 -5.212 -3.607 1201 HB3 ARG 152 3HB ARG 152 -13.746 -6.905 -3.151 1202 HG2 ARG 152 2HG ARG 152 -14.707 -5.789 -1.320 1203 HG3 ARG 152 3HG ARG 152 -13.060 -6.142 -0.794 1204 HD2 ARG 152 2HD ARG 152 -12.383 -3.843 -1.243 1205 HD3 ARG 152 3HD ARG 152 -13.961 -3.477 -1.937 1206 HE ARG 152 HE ARG 152 -13.227 -3.466 0.811 1207 HH11 ARG 152 1HH1 ARG 152 -16.019 -4.040 -1.246 1208 HH12 ARG 152 2HH1 ARG 152 -17.151 -3.620 -0.007 1209 HH21 ARG 152 1HH2 ARG 152 -14.693 -2.806 2.360 1210 HH22 ARG 152 2HH2 ARG 152 -16.398 -2.913 2.052 1211 H LEU 153 H LEU 153 -12.414 -8.417 -4.013 1212 HA LEU 153 HA LEU 153 -11.104 -8.480 -6.568 1213 HB2 LEU 153 2HB LEU 153 -13.133 -10.305 -5.233 1214 HB3 LEU 153 3HB LEU 153 -12.554 -10.603 -6.866 1215 HG LEU 153 HG LEU 153 -10.800 -10.542 -4.371 1216 HD11 LEU 153 1HD1 LEU 153 -10.577 -12.957 -4.679 1217 HD12 LEU 153 2HD1 LEU 153 -11.708 -12.909 -6.035 1218 HD13 LEU 153 3HD1 LEU 153 -12.259 -12.507 -4.405 1219 HD21 LEU 153 3HD2 LEU 153 -9.550 -9.789 -6.340 1220 HD22 LEU 153 1HD2 LEU 153 -10.074 -11.212 -7.250 1221 HD23 LEU 153 2HD2 LEU 153 -9.012 -11.393 -5.852 1222 H GLU 154 H GLU 154 -12.634 -9.320 -8.456 1223 HA GLU 154 HA GLU 154 -14.137 -7.058 -9.339 1224 HB2 GLU 154 2HB GLU 154 -13.868 -9.830 -10.565 1225 HB3 GLU 154 3HB GLU 154 -14.459 -8.393 -11.396 1226 HG2 GLU 154 2HG GLU 154 -12.257 -7.339 -11.217 1227 HG3 GLU 154 3HG GLU 154 -11.653 -8.706 -10.277 1228 H HIS 155 H HIS 155 -16.320 -7.714 -10.608 1229 HA HIS 155 HA HIS 155 -18.349 -8.246 -8.698 1230 HB2 HIS 155 2HB HIS 155 -18.520 -8.343 -11.744 1231 HB3 HIS 155 3HB HIS 155 -19.908 -8.360 -10.661 1232 HD1 HIS 155 HD1 HIS 155 -20.969 -6.125 -10.489 1233 HD2 HIS 155 HD2 HIS 155 -16.908 -5.818 -11.239 1234 HE1 HIS 155 HE1 HIS 155 -20.526 -3.682 -10.784 1235 HE2 HIS 155 HE2 HIS 155 -18.095 -3.547 -11.416 1236 H HIS 156 H HIS 156 -18.771 -10.146 -7.813 1237 HA HIS 156 HA HIS 156 -17.718 -12.645 -8.591 1238 HB2 HIS 156 2HB HIS 156 -20.116 -12.129 -6.773 1239 HB3 HIS 156 3HB HIS 156 -19.129 -13.587 -6.809 1240 HD1 HIS 156 HD1 HIS 156 -19.572 -10.781 -4.767 1241 HD2 HIS 156 HD2 HIS 156 -16.188 -12.661 -6.275 1242 HE1 HIS 156 HE1 HIS 156 -17.684 -10.070 -3.278 1243 HE2 HIS 156 HE2 HIS 156 -15.633 -11.126 -4.280 1244 H HIS 157 H HIS 157 -20.822 -11.097 -9.185 1245 HA HIS 157 HA HIS 157 -21.260 -12.875 -11.507 1246 HB2 HIS 157 2HB HIS 157 -23.375 -11.760 -9.609 1247 HB3 HIS 157 3HB HIS 157 -23.756 -12.468 -11.175 1248 HD1 HIS 157 HD1 HIS 157 -24.444 -13.467 -8.086 1249 HD2 HIS 157 HD2 HIS 157 -21.949 -15.215 -10.915 1250 HE1 HIS 157 HE1 HIS 157 -24.308 -15.898 -7.464 1251 HE2 HIS 157 HE2 HIS 157 -22.620 -16.861 -9.054 1252 H HIS 158 H HIS 158 -21.548 -11.738 -13.416 1253 HA HIS 158 HA HIS 158 -21.213 -8.854 -13.346 1254 HB2 HIS 158 2HB HIS 158 -21.105 -8.961 -15.820 1255 HB3 HIS 158 3HB HIS 158 -19.978 -10.062 -15.052 1256 HD1 HIS 158 HD1 HIS 158 -22.774 -9.918 -17.440 1257 HD2 HIS 158 HD2 HIS 158 -20.654 -12.850 -15.399 1258 HE1 HIS 158 HE1 HIS 158 -23.275 -12.068 -18.631 1259 HE2 HIS 158 HE2 HIS 158 -22.091 -13.835 -17.296 1260 H HIS 159 H HIS 159 -23.065 -8.253 -12.262 1261 HA HIS 159 HA HIS 159 -25.352 -7.576 -13.872 1262 HB2 HIS 159 2HB HIS 159 -25.555 -9.742 -11.767 1263 HB3 HIS 159 3HB HIS 159 -26.887 -8.606 -11.874 1264 HD1 HIS 159 HD1 HIS 159 -25.655 -11.702 -13.318 1265 HD2 HIS 159 HD2 HIS 159 -28.133 -8.610 -14.562 1266 HE1 HIS 159 HE1 HIS 159 -26.973 -12.626 -15.244 1267 HE2 HIS 159 HE2 HIS 159 -28.579 -10.797 -15.858 1268 H HIS 160 H HIS 160 -25.130 -5.452 -13.431 1269 HA HIS 160 HA HIS 160 -25.164 -3.446 -12.429 1270 HB2 HIS 160 2HB HIS 160 -27.329 -4.171 -11.505 1271 HB3 HIS 160 3HB HIS 160 -26.518 -4.941 -10.145 1272 HD1 HIS 160 HD1 HIS 160 -26.732 -1.431 -11.619 1273 HD2 HIS 160 HD2 HIS 160 -26.455 -3.325 -7.935 1274 HE1 HIS 160 HE1 HIS 160 -26.811 0.401 -9.912 1275 HE2 HIS 160 HE2 HIS 160 -26.770 -0.778 -7.690 Start of MODEL 8 1 H1 MET 1 1H MET 1 -8.787 -9.676 -26.749 2 H2 MET 1 2H MET 1 -8.435 -8.260 -27.603 3 H3 MET 1 3H MET 1 -10.018 -8.578 -27.116 4 HA MET 1 HA MET 1 -9.480 -8.347 -24.847 5 HB2 MET 1 2HB MET 1 -7.180 -9.293 -24.970 6 HB3 MET 1 3HB MET 1 -6.618 -7.843 -25.787 7 HG2 MET 1 2HG MET 1 -7.083 -6.516 -23.768 8 HG3 MET 1 3HG MET 1 -7.686 -7.960 -22.954 9 HE1 MET 1 3HE MET 1 -4.261 -7.257 -21.115 10 HE2 MET 1 1HE MET 1 -5.995 -7.488 -20.897 11 HE3 MET 1 2HE MET 1 -5.391 -6.049 -21.722 12 H VAL 2 H VAL 2 -11.015 -6.747 -25.492 13 HA VAL 2 HA VAL 2 -9.856 -4.011 -25.448 14 HB VAL 2 HB VAL 2 -12.543 -4.806 -26.703 15 HG11 VAL 2 1HG1 VAL 2 -12.715 -2.422 -27.383 16 HG12 VAL 2 2HG1 VAL 2 -11.233 -2.059 -26.498 17 HG13 VAL 2 3HG1 VAL 2 -12.672 -2.593 -25.626 18 HG21 VAL 2 3HG2 VAL 2 -11.563 -4.083 -28.860 19 HG22 VAL 2 1HG2 VAL 2 -10.670 -5.439 -28.167 20 HG23 VAL 2 2HG2 VAL 2 -10.011 -3.806 -28.064 21 H GLU 3 H GLU 3 -10.352 -2.954 -23.635 22 HA GLU 3 HA GLU 3 -12.151 -4.103 -21.646 23 HB2 GLU 3 2HB GLU 3 -11.119 -2.524 -20.119 24 HB3 GLU 3 3HB GLU 3 -9.845 -3.258 -21.087 25 HG2 GLU 3 2HG GLU 3 -9.953 -1.220 -22.575 26 HG3 GLU 3 3HG GLU 3 -11.016 -0.485 -21.390 27 HA PRO 4 HA PRO 4 -15.333 -0.955 -22.455 28 HB2 PRO 4 2HB PRO 4 -16.746 -0.964 -20.139 29 HB3 PRO 4 3HB PRO 4 -16.715 -2.377 -21.212 30 HG2 PRO 4 2HG PRO 4 -15.304 -1.959 -18.625 31 HG3 PRO 4 3HG PRO 4 -15.947 -3.454 -19.331 32 HD2 PRO 4 2HD PRO 4 -13.228 -2.604 -19.395 33 HD3 PRO 4 3HD PRO 4 -13.939 -3.938 -20.328 34 H GLY 5 H GLY 5 -16.464 0.952 -20.825 35 HA2 GLY 5 2HA GLY 5 -14.315 2.904 -20.578 36 HA3 GLY 5 3HA GLY 5 -16.036 3.200 -20.407 37 H VAL 6 H VAL 6 -13.646 1.165 -18.715 38 HA VAL 6 HA VAL 6 -14.827 1.529 -16.140 39 HB VAL 6 HB VAL 6 -12.715 0.361 -15.300 40 HG11 VAL 6 1HG1 VAL 6 -14.263 -1.019 -17.521 41 HG12 VAL 6 2HG1 VAL 6 -14.768 -0.877 -15.835 42 HG13 VAL 6 3HG1 VAL 6 -13.339 -1.825 -16.249 43 HG21 VAL 6 3HG2 VAL 6 -11.123 1.054 -17.051 44 HG22 VAL 6 1HG2 VAL 6 -12.051 0.181 -18.273 45 HG23 VAL 6 2HG2 VAL 6 -11.227 -0.705 -16.987 46 H ALA 7 H ALA 7 -14.396 2.975 -14.589 47 HA ALA 7 HA ALA 7 -12.132 4.821 -14.679 48 HB1 ALA 7 3HB ALA 7 -13.568 6.832 -14.820 49 HB2 ALA 7 1HB ALA 7 -14.996 5.813 -15.030 50 HB3 ALA 7 2HB ALA 7 -13.736 5.839 -16.265 51 H LYS 8 H LYS 8 -12.818 6.671 -12.884 52 HA LYS 8 HA LYS 8 -12.876 7.159 -10.694 53 HB2 LYS 8 2HB LYS 8 -15.177 5.176 -10.747 54 HB3 LYS 8 3HB LYS 8 -14.773 6.121 -9.316 55 HG2 LYS 8 2HG LYS 8 -15.178 8.213 -10.570 56 HG3 LYS 8 3HG LYS 8 -15.565 7.274 -12.016 57 HD2 LYS 8 2HD LYS 8 -17.528 6.296 -10.889 58 HD3 LYS 8 3HD LYS 8 -17.129 7.156 -9.396 59 HE2 LYS 8 2HE LYS 8 -17.517 9.315 -10.502 60 HE3 LYS 8 3HE LYS 8 -17.808 8.501 -12.041 61 HZ1 LYS 8 3HZ LYS 8 -19.472 8.212 -9.598 62 HZ2 LYS 8 1HZ LYS 8 -19.747 7.448 -11.080 63 HZ3 LYS 8 2HZ LYS 8 -19.865 9.127 -10.963 64 H LEU 9 H LEU 9 -10.879 6.535 -10.064 65 HA LEU 9 HA LEU 9 -9.155 5.420 -9.157 66 HB2 LEU 9 2HB LEU 9 -10.580 5.477 -7.134 67 HB3 LEU 9 3HB LEU 9 -11.333 3.966 -7.616 68 HG LEU 9 HG LEU 9 -9.030 2.860 -7.390 69 HD11 LEU 9 1HD1 LEU 9 -8.290 5.460 -6.018 70 HD12 LEU 9 2HD1 LEU 9 -7.616 4.848 -7.531 71 HD13 LEU 9 3HD1 LEU 9 -7.327 3.980 -6.024 72 HD21 LEU 9 3HD2 LEU 9 -10.244 4.045 -4.878 73 HD22 LEU 9 1HD2 LEU 9 -9.175 2.642 -4.950 74 HD23 LEU 9 2HD2 LEU 9 -10.772 2.572 -5.694 75 H THR 10 H THR 10 -8.866 4.591 -11.339 76 HA THR 10 HA THR 10 -9.271 1.686 -11.710 77 HB THR 10 HB THR 10 -8.079 3.569 -13.790 78 HG1 THR 10 HG1 THR 10 -10.744 3.430 -12.893 79 HG21 THR 10 3HG2 THR 10 -9.174 2.059 -15.403 80 HG22 THR 10 1HG2 THR 10 -9.841 1.099 -14.080 81 HG23 THR 10 2HG2 THR 10 -8.095 1.150 -14.343 82 H THR 11 H THR 11 -7.019 0.965 -13.179 83 HA THR 11 HA THR 11 -5.248 0.251 -11.165 84 HB THR 11 HB THR 11 -3.774 -0.596 -13.009 85 HG1 THR 11 HG1 THR 11 -3.919 0.296 -14.912 86 HG21 THR 11 3HG2 THR 11 -5.712 -1.989 -12.324 87 HG22 THR 11 1HG2 THR 11 -5.406 -2.144 -14.056 88 HG23 THR 11 2HG2 THR 11 -6.739 -1.141 -13.483 89 H TYR 12 H TYR 12 -4.996 2.974 -13.441 90 HA TYR 12 HA TYR 12 -2.340 3.632 -13.417 91 HB2 TYR 12 2HB TYR 12 -2.980 5.899 -14.039 92 HB3 TYR 12 3HB TYR 12 -4.120 4.776 -14.768 93 HD1 TYR 12 HD1 TYR 12 -6.447 4.544 -13.745 94 HD2 TYR 12 HD2 TYR 12 -3.743 7.608 -12.517 95 HE1 TYR 12 HE1 TYR 12 -8.306 5.782 -12.728 96 HE2 TYR 12 HE2 TYR 12 -5.605 8.841 -11.506 97 HH TYR 12 HH TYR 12 -8.063 9.004 -11.749 98 H ALA 13 H ALA 13 -4.715 4.399 -10.924 99 HA ALA 13 HA ALA 13 -3.129 6.222 -9.420 100 HB1 ALA 13 3HB ALA 13 -5.587 4.627 -8.613 101 HB2 ALA 13 1HB ALA 13 -5.587 6.215 -9.378 102 HB3 ALA 13 2HB ALA 13 -4.934 6.022 -7.747 103 H SER 14 H SER 14 -3.814 2.754 -9.176 104 HA SER 14 HA SER 14 -2.484 2.424 -6.646 105 HB2 SER 14 2HB SER 14 -3.061 0.012 -6.945 106 HB3 SER 14 3HB SER 14 -4.448 1.078 -7.149 107 HG SER 14 HG SER 14 -3.096 0.517 -9.491 108 H LYS 15 H LYS 15 -1.549 2.007 -10.024 109 HA LYS 15 HA LYS 15 0.622 0.168 -9.390 110 HB2 LYS 15 2HB LYS 15 -0.021 1.426 -12.101 111 HB3 LYS 15 3HB LYS 15 1.043 0.057 -11.801 112 HG2 LYS 15 2HG LYS 15 -1.962 0.152 -11.564 113 HG3 LYS 15 3HG LYS 15 -0.993 -0.847 -12.643 114 HD2 LYS 15 2HD LYS 15 -0.193 -2.173 -10.739 115 HD3 LYS 15 3HD LYS 15 -1.042 -1.114 -9.613 116 HE2 LYS 15 2HE LYS 15 -3.204 -1.816 -10.643 117 HE3 LYS 15 3HE LYS 15 -2.314 -2.953 -11.663 118 HZ1 LYS 15 3HZ LYS 15 -3.255 -3.982 -9.656 119 HZ2 LYS 15 1HZ LYS 15 -2.293 -2.981 -8.692 120 HZ3 LYS 15 2HZ LYS 15 -1.571 -4.119 -9.710 121 H GLN 16 H GLN 16 0.286 3.529 -10.523 122 HA GLN 16 HA GLN 16 3.076 4.091 -10.584 123 HB2 GLN 16 2HB GLN 16 0.763 6.040 -10.255 124 HB3 GLN 16 3HB GLN 16 2.422 6.479 -10.647 125 HG2 GLN 16 2HG GLN 16 0.501 4.901 -12.374 126 HG3 GLN 16 3HG GLN 16 1.077 6.542 -12.654 127 HE21 GLN 16 1HE2 GLN 16 3.206 6.830 -13.440 128 HE22 GLN 16 2HE2 GLN 16 4.112 5.538 -14.143 129 H ALA 17 H ALA 17 0.595 4.290 -8.060 130 HA ALA 17 HA ALA 17 1.938 5.487 -5.952 131 HB1 ALA 17 3HB ALA 17 0.191 3.008 -5.782 132 HB2 ALA 17 1HB ALA 17 -0.403 4.672 -5.838 133 HB3 ALA 17 2HB ALA 17 0.550 4.122 -4.457 134 H THR 18 H THR 18 2.026 2.100 -6.970 135 HA THR 18 HA THR 18 3.834 1.165 -4.991 136 HB THR 18 HB THR 18 3.262 -0.137 -7.681 137 HG1 THR 18 HG1 THR 18 1.526 0.469 -5.637 138 HG21 THR 18 3HG2 THR 18 4.927 -1.283 -6.228 139 HG22 THR 18 1HG2 THR 18 3.451 -2.235 -6.425 140 HG23 THR 18 2HG2 THR 18 3.724 -1.330 -4.937 141 H ASP 19 H ASP 19 4.208 2.548 -8.195 142 HA ASP 19 HA ASP 19 6.902 1.968 -8.746 143 HB2 ASP 19 2HB ASP 19 5.355 2.842 -10.455 144 HB3 ASP 19 3HB ASP 19 5.208 4.363 -9.590 145 H MET 20 H MET 20 5.483 4.878 -7.150 146 HA MET 20 HA MET 20 8.073 6.038 -6.624 147 HB2 MET 20 2HB MET 20 5.279 6.868 -5.782 148 HB3 MET 20 3HB MET 20 6.709 7.706 -5.193 149 HG2 MET 20 2HG MET 20 6.088 9.032 -6.985 150 HG3 MET 20 3HG MET 20 7.289 7.981 -7.729 151 HE1 MET 20 3HE MET 20 3.551 8.977 -7.458 152 HE2 MET 20 1HE MET 20 3.491 7.362 -6.756 153 HE3 MET 20 2HE MET 20 2.727 7.679 -8.314 154 H GLY 21 H GLY 21 5.836 4.048 -4.736 155 HA2 GLY 21 2HA GLY 21 7.485 2.850 -3.033 156 HA3 GLY 21 3HA GLY 21 7.411 4.436 -2.278 157 H ALA 22 H ALA 22 5.364 1.774 -3.439 158 HA ALA 22 HA ALA 22 3.899 1.824 -0.901 159 HB1 ALA 22 3HB ALA 22 1.708 1.645 -1.993 160 HB2 ALA 22 1HB ALA 22 2.461 1.807 -3.583 161 HB3 ALA 22 2HB ALA 22 2.493 3.157 -2.449 162 H ILE 23 H ILE 23 2.958 -0.227 -0.390 163 HA ILE 23 HA ILE 23 3.991 -2.517 -1.979 164 HB ILE 23 HB ILE 23 4.106 -3.830 0.146 165 HG12 ILE 23 2HG1 ILE 23 3.514 -1.174 1.543 166 HG13 ILE 23 3HG1 ILE 23 2.413 -2.539 1.461 167 HG21 ILE 23 1HG2 ILE 23 5.777 -1.292 0.208 168 HG22 ILE 23 2HG2 ILE 23 6.154 -2.765 -0.689 169 HG23 ILE 23 3HG2 ILE 23 6.148 -2.785 1.075 170 HD11 ILE 23 3HD1 ILE 23 5.059 -2.459 2.902 171 HD12 ILE 23 1HD1 ILE 23 3.997 -3.867 2.795 172 HD13 ILE 23 2HD1 ILE 23 3.450 -2.410 3.621 173 H TYR 24 H TYR 24 2.658 -4.298 -2.222 174 HA TYR 24 HA TYR 24 -0.199 -3.943 -1.638 175 HB2 TYR 24 2HB TYR 24 1.294 -5.896 -3.446 176 HB3 TYR 24 3HB TYR 24 -0.432 -6.004 -3.126 177 HD1 TYR 24 HD1 TYR 24 -1.832 -3.816 -3.631 178 HD2 TYR 24 HD2 TYR 24 1.988 -4.672 -5.360 179 HE1 TYR 24 HE1 TYR 24 -2.332 -2.292 -5.494 180 HE2 TYR 24 HE2 TYR 24 1.481 -3.139 -7.215 181 HH TYR 24 HH TYR 24 -0.749 -0.872 -7.181 182 H VAL 25 H VAL 25 -0.863 -4.767 0.230 183 HA VAL 25 HA VAL 25 0.092 -7.443 1.087 184 HB VAL 25 HB VAL 25 -0.424 -6.889 3.404 185 HG11 VAL 25 1HG1 VAL 25 1.844 -6.378 2.677 186 HG12 VAL 25 2HG1 VAL 25 1.328 -5.204 3.888 187 HG13 VAL 25 3HG1 VAL 25 1.362 -4.752 2.180 188 HG21 VAL 25 3HG2 VAL 25 -1.097 -4.631 4.162 189 HG22 VAL 25 1HG2 VAL 25 -2.315 -5.343 3.102 190 HG23 VAL 25 2HG2 VAL 25 -1.229 -4.100 2.484 191 H ASN 26 H ASN 26 -1.686 -8.613 2.403 192 HA ASN 26 HA ASN 26 -4.324 -8.252 1.102 193 HB2 ASN 26 2HB ASN 26 -4.896 -10.475 1.973 194 HB3 ASN 26 3HB ASN 26 -3.370 -10.555 1.105 195 HD21 ASN 26 1HD2 ASN 26 -4.417 -12.389 3.123 196 HD22 ASN 26 2HD2 ASN 26 -3.235 -12.415 4.389 197 H SER 27 H SER 27 -6.035 -9.204 2.953 198 HA SER 27 HA SER 27 -6.539 -7.042 4.696 199 HB2 SER 27 2HB SER 27 -8.404 -8.544 5.527 200 HB3 SER 27 3HB SER 27 -8.359 -8.339 3.772 201 HG SER 27 HG SER 27 -8.380 -10.446 3.798 202 H LYS 28 H LYS 28 -4.440 -9.694 5.141 203 HA LYS 28 HA LYS 28 -4.536 -9.570 8.078 204 HB2 LYS 28 2HB LYS 28 -2.738 -11.248 6.272 205 HB3 LYS 28 3HB LYS 28 -2.881 -11.393 8.020 206 HG2 LYS 28 2HG LYS 28 -5.118 -11.944 6.049 207 HG3 LYS 28 3HG LYS 28 -4.091 -13.174 6.791 208 HD2 LYS 28 2HD LYS 28 -4.923 -12.558 9.019 209 HD3 LYS 28 3HD LYS 28 -5.910 -11.273 8.318 210 HE2 LYS 28 2HE LYS 28 -7.236 -12.952 7.093 211 HE3 LYS 28 3HE LYS 28 -6.234 -14.244 7.764 212 HZ1 LYS 28 3HZ LYS 28 -6.985 -13.627 9.977 213 HZ2 LYS 28 1HZ LYS 28 -8.302 -13.990 8.983 214 HZ3 LYS 28 2HZ LYS 28 -7.934 -12.382 9.339 215 H GLY 29 H GLY 29 -2.234 -9.040 5.394 216 HA2 GLY 29 2HA GLY 29 -0.991 -6.835 5.636 217 HA3 GLY 29 3HA GLY 29 -0.464 -7.472 7.188 218 H ASP 30 H ASP 30 -0.662 -10.085 5.182 219 HA ASP 30 HA ASP 30 2.140 -10.468 4.891 220 HB2 ASP 30 2HB ASP 30 -0.034 -11.881 3.262 221 HB3 ASP 30 3HB ASP 30 1.576 -12.480 3.635 222 H ARG 31 H ARG 31 3.520 -9.848 3.237 223 HA ARG 31 HA ARG 31 2.719 -8.324 0.991 224 HB2 ARG 31 2HB ARG 31 5.048 -8.205 1.703 225 HB3 ARG 31 3HB ARG 31 5.276 -9.930 1.430 226 HG2 ARG 31 2HG ARG 31 4.915 -9.580 -1.005 227 HG3 ARG 31 3HG ARG 31 4.727 -7.851 -0.723 228 HD2 ARG 31 2HD ARG 31 7.238 -9.436 -0.102 229 HD3 ARG 31 3HD ARG 31 6.988 -8.502 -1.574 230 HE ARG 31 HE ARG 31 7.751 -7.527 1.005 231 HH11 ARG 31 1HH1 ARG 31 6.071 -6.545 -1.943 232 HH12 ARG 31 2HH1 ARG 31 6.374 -4.858 -1.691 233 HH21 ARG 31 1HH2 ARG 31 8.108 -5.333 1.328 234 HH22 ARG 31 2HH2 ARG 31 7.533 -4.172 0.175 235 H ILE 32 H ILE 32 1.132 -9.213 -0.180 236 HA ILE 32 HA ILE 32 0.942 -11.902 -1.092 237 HB ILE 32 HB ILE 32 -0.801 -10.999 -2.679 238 HG12 ILE 32 2HG1 ILE 32 -0.109 -8.288 -1.446 239 HG13 ILE 32 3HG1 ILE 32 0.252 -8.765 -3.098 240 HG21 ILE 32 1HG2 ILE 32 -1.407 -11.675 -0.397 241 HG22 ILE 32 2HG2 ILE 32 -2.406 -10.326 -0.939 242 HG23 ILE 32 3HG2 ILE 32 -1.077 -10.042 0.188 243 HD11 ILE 32 3HD1 ILE 32 -1.649 -7.321 -3.032 244 HD12 ILE 32 1HD1 ILE 32 -2.478 -8.391 -1.903 245 HD13 ILE 32 2HD1 ILE 32 -2.145 -8.930 -3.552 246 H VAL 33 H VAL 33 2.210 -8.932 -2.511 247 HA VAL 33 HA VAL 33 3.902 -10.334 -4.363 248 HB VAL 33 HB VAL 33 1.676 -10.201 -5.578 249 HG11 VAL 33 1HG1 VAL 33 2.133 -7.201 -5.625 250 HG12 VAL 33 2HG1 VAL 33 0.868 -8.042 -4.728 251 HG13 VAL 33 3HG1 VAL 33 0.866 -8.079 -6.491 252 HG21 VAL 33 3HG2 VAL 33 3.744 -10.458 -6.844 253 HG22 VAL 33 1HG2 VAL 33 3.975 -8.708 -6.882 254 HG23 VAL 33 2HG2 VAL 33 2.611 -9.440 -7.734 255 H ASN 34 H ASN 34 5.486 -8.908 -5.257 256 HA ASN 34 HA ASN 34 6.297 -6.729 -3.642 257 HB2 ASN 34 2HB ASN 34 8.060 -6.388 -5.390 258 HB3 ASN 34 3HB ASN 34 7.972 -8.028 -4.778 259 HD21 ASN 34 1HD2 ASN 34 8.985 -6.827 -7.352 260 HD22 ASN 34 2HD2 ASN 34 8.244 -7.794 -8.580 261 H GLU 35 H GLU 35 4.936 -6.884 -6.907 262 HA GLU 35 HA GLU 35 4.186 -4.048 -6.994 263 HB2 GLU 35 2HB GLU 35 6.142 -5.365 -8.962 264 HB3 GLU 35 3HB GLU 35 5.439 -3.766 -9.176 265 HG2 GLU 35 2HG GLU 35 6.687 -2.868 -7.314 266 HG3 GLU 35 3HG GLU 35 7.200 -4.476 -6.807 267 H SER 36 H SER 36 3.592 -3.999 -9.758 268 HA SER 36 HA SER 36 1.999 -6.444 -10.308 269 HB2 SER 36 2HB SER 36 1.193 -3.572 -10.958 270 HB3 SER 36 3HB SER 36 0.300 -5.023 -11.414 271 HG SER 36 HG SER 36 0.934 -4.509 -8.717 272 H ASN 37 H ASN 37 3.766 -7.258 -11.472 273 HA ASN 37 HA ASN 37 4.876 -6.031 -13.798 274 HB2 ASN 37 2HB ASN 37 4.682 -9.008 -13.115 275 HB3 ASN 37 3HB ASN 37 5.729 -8.295 -14.338 276 HD21 ASN 37 1HD2 ASN 37 7.628 -9.029 -13.405 277 HD22 ASN 37 2HD2 ASN 37 8.244 -8.451 -11.898 278 H VAL 38 H VAL 38 2.190 -8.220 -13.196 279 HA VAL 38 HA VAL 38 0.675 -7.079 -15.389 280 HB VAL 38 HB VAL 38 1.783 -9.042 -16.467 281 HG11 VAL 38 1HG1 VAL 38 2.080 -10.491 -14.519 282 HG12 VAL 38 2HG1 VAL 38 1.240 -11.351 -15.808 283 HG13 VAL 38 3HG1 VAL 38 0.337 -10.751 -14.415 284 HG21 VAL 38 3HG2 VAL 38 -0.431 -8.351 -17.284 285 HG22 VAL 38 1HG2 VAL 38 -1.215 -9.430 -16.125 286 HG23 VAL 38 2HG2 VAL 38 -0.228 -10.099 -17.431 287 H TYR 39 H TYR 39 -1.660 -7.472 -15.087 288 HA TYR 39 HA TYR 39 -2.564 -7.376 -12.441 289 HB2 TYR 39 2HB TYR 39 -4.861 -7.572 -13.366 290 HB3 TYR 39 3HB TYR 39 -3.884 -6.436 -14.286 291 HD1 TYR 39 HD1 TYR 39 -5.570 -9.750 -14.387 292 HD2 TYR 39 HD2 TYR 39 -3.268 -6.912 -16.622 293 HE1 TYR 39 HE1 TYR 39 -6.126 -10.928 -16.472 294 HE2 TYR 39 HE2 TYR 39 -3.826 -8.101 -18.697 295 HH TYR 39 HH TYR 39 -6.232 -10.500 -18.888 296 H THR 40 H THR 40 -2.002 -10.118 -14.517 297 HA THR 40 HA THR 40 -3.614 -12.028 -13.193 298 HB THR 40 HB THR 40 -1.103 -12.643 -14.825 299 HG1 THR 40 HG1 THR 40 -2.397 -12.456 -16.654 300 HG21 THR 40 3HG2 THR 40 -3.719 -14.165 -14.481 301 HG22 THR 40 1HG2 THR 40 -2.178 -14.591 -13.727 302 HG23 THR 40 2HG2 THR 40 -2.352 -14.668 -15.482 303 H THR 41 H THR 41 -0.187 -11.059 -12.807 304 HA THR 41 HA THR 41 0.569 -13.007 -10.891 305 HB THR 41 HB THR 41 1.711 -10.199 -11.302 306 HG1 THR 41 HG1 THR 41 3.255 -12.080 -12.333 307 HG21 THR 41 3HG2 THR 41 2.482 -11.198 -9.150 308 HG22 THR 41 1HG2 THR 41 3.795 -11.097 -10.324 309 HG23 THR 41 2HG2 THR 41 3.007 -12.643 -10.017 310 H PHE 42 H PHE 42 -0.789 -9.742 -10.588 311 HA PHE 42 HA PHE 42 -0.873 -9.542 -7.767 312 HB2 PHE 42 2HB PHE 42 -1.165 -7.560 -9.196 313 HB3 PHE 42 3HB PHE 42 -2.628 -8.234 -9.903 314 HD1 PHE 42 HD1 PHE 42 -1.174 -6.877 -6.737 315 HD2 PHE 42 HD2 PHE 42 -4.760 -7.930 -8.819 316 HE1 PHE 42 HE1 PHE 42 -2.530 -5.797 -4.987 317 HE2 PHE 42 HE2 PHE 42 -6.100 -6.842 -7.071 318 HZ PHE 42 HZ PHE 42 -4.985 -5.774 -5.157 319 H ARG 43 H ARG 43 -3.129 -10.890 -10.144 320 HA ARG 43 HA ARG 43 -5.331 -11.411 -8.463 321 HB2 ARG 43 2HB ARG 43 -5.453 -11.396 -10.945 322 HB3 ARG 43 3HB ARG 43 -4.460 -12.846 -11.015 323 HG2 ARG 43 2HG ARG 43 -6.267 -14.102 -9.840 324 HG3 ARG 43 3HG ARG 43 -7.260 -12.642 -9.848 325 HD2 ARG 43 2HD ARG 43 -6.216 -14.062 -12.321 326 HD3 ARG 43 3HD ARG 43 -7.853 -14.218 -11.681 327 HE ARG 43 HE ARG 43 -7.732 -11.585 -12.069 328 HH11 ARG 43 1HH1 ARG 43 -6.693 -14.169 -14.238 329 HH12 ARG 43 2HH1 ARG 43 -7.018 -13.240 -15.669 330 HH21 ARG 43 1HH2 ARG 43 -8.199 -10.422 -13.963 331 HH22 ARG 43 2HH2 ARG 43 -7.865 -11.136 -15.512 332 H ASN 44 H ASN 44 -2.640 -13.545 -9.531 333 HA ASN 44 HA ASN 44 -3.341 -15.793 -7.945 334 HB2 ASN 44 2HB ASN 44 -0.679 -14.999 -9.205 335 HB3 ASN 44 3HB ASN 44 -0.898 -16.504 -8.327 336 HD21 ASN 44 1HD2 ASN 44 -1.351 -14.907 -11.316 337 HD22 ASN 44 2HD2 ASN 44 -2.133 -16.200 -12.149 338 H ALA 45 H ALA 45 -1.555 -12.887 -7.232 339 HA ALA 45 HA ALA 45 -0.264 -13.669 -4.840 340 HB1 ALA 45 3HB ALA 45 -0.057 -11.261 -4.436 341 HB2 ALA 45 1HB ALA 45 -1.266 -10.932 -5.683 342 HB3 ALA 45 2HB ALA 45 0.288 -11.640 -6.120 343 H ILE 46 H ILE 46 -3.524 -12.448 -5.506 344 HA ILE 46 HA ILE 46 -4.336 -12.344 -2.729 345 HB ILE 46 HB ILE 46 -6.110 -12.315 -5.219 346 HG12 ILE 46 2HG1 ILE 46 -4.362 -10.484 -5.244 347 HG13 ILE 46 3HG1 ILE 46 -6.014 -9.889 -5.198 348 HG21 ILE 46 1HG2 ILE 46 -6.642 -11.323 -2.389 349 HG22 ILE 46 2HG2 ILE 46 -7.356 -12.744 -3.148 350 HG23 ILE 46 3HG2 ILE 46 -7.734 -11.138 -3.763 351 HD11 ILE 46 3HD1 ILE 46 -5.800 -9.378 -2.844 352 HD12 ILE 46 1HD1 ILE 46 -4.510 -8.622 -3.772 353 HD13 ILE 46 2HD1 ILE 46 -4.171 -10.064 -2.819 354 H LEU 47 H LEU 47 -4.563 -14.624 -5.427 355 HA LEU 47 HA LEU 47 -6.259 -16.574 -4.235 356 HB2 LEU 47 2HB LEU 47 -4.122 -16.981 -6.369 357 HB3 LEU 47 3HB LEU 47 -5.401 -18.118 -5.980 358 HG LEU 47 HG LEU 47 -5.775 -15.377 -7.258 359 HD11 LEU 47 1HD1 LEU 47 -4.826 -17.001 -8.817 360 HD12 LEU 47 2HD1 LEU 47 -6.486 -16.609 -9.261 361 HD13 LEU 47 3HD1 LEU 47 -6.128 -18.140 -8.457 362 HD21 LEU 47 3HD2 LEU 47 -7.686 -15.846 -5.826 363 HD22 LEU 47 1HD2 LEU 47 -7.887 -17.435 -6.570 364 HD23 LEU 47 2HD2 LEU 47 -8.149 -15.971 -7.520 365 H LYS 48 H LYS 48 -2.869 -15.866 -3.939 366 HA LYS 48 HA LYS 48 -1.819 -18.192 -2.742 367 HB2 LYS 48 2HB LYS 48 -0.445 -16.292 -3.557 368 HB3 LYS 48 3HB LYS 48 -1.112 -15.251 -2.309 369 HG2 LYS 48 2HG LYS 48 -0.032 -16.768 -0.588 370 HG3 LYS 48 3HG LYS 48 0.766 -17.611 -1.918 371 HD2 LYS 48 2HD LYS 48 1.094 -14.670 -1.189 372 HD3 LYS 48 3HD LYS 48 2.277 -15.947 -0.916 373 HE2 LYS 48 2HE LYS 48 1.343 -14.903 -3.616 374 HE3 LYS 48 3HE LYS 48 2.922 -14.641 -2.874 375 HZ1 LYS 48 3HZ LYS 48 3.280 -17.070 -2.975 376 HZ2 LYS 48 1HZ LYS 48 3.095 -16.375 -4.504 377 HZ3 LYS 48 2HZ LYS 48 1.823 -17.244 -3.812 378 H GLN 49 H GLN 49 -3.609 -15.465 -1.473 379 HA GLN 49 HA GLN 49 -3.495 -16.436 1.304 380 HB2 GLN 49 2HB GLN 49 -4.517 -13.795 0.162 381 HB3 GLN 49 3HB GLN 49 -4.360 -14.188 1.872 382 HG2 GLN 49 2HG GLN 49 -2.109 -13.844 -0.128 383 HG3 GLN 49 3HG GLN 49 -2.507 -12.772 1.214 384 HE21 GLN 49 1HE2 GLN 49 -2.046 -13.500 3.354 385 HE22 GLN 49 2HE2 GLN 49 -0.884 -14.738 3.660 386 H ALA 50 H ALA 50 -5.574 -16.205 2.531 387 HA ALA 50 HA ALA 50 -7.577 -17.839 1.281 388 HB1 ALA 50 3HB ALA 50 -6.861 -18.218 3.614 389 HB2 ALA 50 1HB ALA 50 -8.596 -17.905 3.524 390 HB3 ALA 50 2HB ALA 50 -7.498 -16.640 4.080 391 H ASP 51 H ASP 51 -7.782 -14.664 2.984 392 HA ASP 51 HA ASP 51 -10.420 -14.149 1.892 393 HB2 ASP 51 2HB ASP 51 -9.807 -13.476 4.218 394 HB3 ASP 51 3HB ASP 51 -8.659 -12.309 3.566 395 H LYS 52 H LYS 52 -10.965 -12.700 0.329 396 HA LYS 52 HA LYS 52 -8.818 -12.303 -1.619 397 HB2 LYS 52 2HB LYS 52 -11.812 -12.680 -1.987 398 HB3 LYS 52 3HB LYS 52 -10.687 -12.395 -3.309 399 HG2 LYS 52 2HG LYS 52 -10.412 -14.750 -1.411 400 HG3 LYS 52 3HG LYS 52 -11.355 -14.827 -2.898 401 HD2 LYS 52 2HD LYS 52 -9.358 -14.351 -4.236 402 HD3 LYS 52 3HD LYS 52 -8.389 -14.151 -2.775 403 HE2 LYS 52 2HE LYS 52 -9.774 -16.744 -3.535 404 HE3 LYS 52 3HE LYS 52 -8.101 -16.366 -3.940 405 HZ1 LYS 52 3HZ LYS 52 -8.161 -17.677 -1.970 406 HZ2 LYS 52 1HZ LYS 52 -9.247 -16.625 -1.220 407 HZ3 LYS 52 2HZ LYS 52 -7.667 -16.120 -1.544 408 H VAL 53 H VAL 53 -8.359 -10.272 -0.287 409 HA VAL 53 HA VAL 53 -9.072 -8.088 -2.029 410 HB VAL 53 HB VAL 53 -10.916 -7.780 -0.468 411 HG11 VAL 53 1HG1 VAL 53 -8.916 -7.707 1.810 412 HG12 VAL 53 2HG1 VAL 53 -10.074 -8.996 1.471 413 HG13 VAL 53 3HG1 VAL 53 -10.653 -7.396 1.932 414 HG21 VAL 53 3HG2 VAL 53 -8.784 -5.685 0.095 415 HG22 VAL 53 1HG2 VAL 53 -10.523 -5.479 0.329 416 HG23 VAL 53 2HG2 VAL 53 -9.872 -5.714 -1.292 417 H ALA 54 H ALA 54 -7.496 -6.494 -2.056 418 HA ALA 54 HA ALA 54 -5.061 -6.908 -0.428 419 HB1 ALA 54 3HB ALA 54 -4.709 -7.060 -2.848 420 HB2 ALA 54 1HB ALA 54 -3.896 -5.640 -2.199 421 HB3 ALA 54 2HB ALA 54 -5.419 -5.467 -3.083 422 H TYR 55 H TYR 55 -3.942 -4.986 0.222 423 HA TYR 55 HA TYR 55 -5.424 -2.453 0.340 424 HB2 TYR 55 2HB TYR 55 -4.181 -3.932 2.711 425 HB3 TYR 55 3HB TYR 55 -4.575 -2.218 2.751 426 HD1 TYR 55 HD2 TYR 55 -6.011 -5.638 2.748 427 HD2 TYR 55 HD1 TYR 55 -6.933 -1.460 2.848 428 HE1 TYR 55 HE2 TYR 55 -8.309 -6.149 3.459 429 HE2 TYR 55 HE1 TYR 55 -9.223 -1.991 3.562 430 HH TYR 55 HH TYR 55 -10.794 -3.841 3.464 431 H LEU 56 H LEU 56 -4.154 -1.100 -0.703 432 HA LEU 56 HA LEU 56 -1.300 -1.518 -1.021 433 HB2 LEU 56 2HB LEU 56 -2.744 -0.830 -2.917 434 HB3 LEU 56 3HB LEU 56 -3.149 0.658 -2.076 435 HG LEU 56 HG LEU 56 -0.772 1.404 -2.253 436 HD11 LEU 56 1HD1 LEU 56 0.810 0.189 -3.710 437 HD12 LEU 56 2HD1 LEU 56 -0.341 -1.141 -3.845 438 HD13 LEU 56 3HD1 LEU 56 0.373 -0.747 -2.283 439 HD21 LEU 56 3HD2 LEU 56 -0.754 1.800 -4.694 440 HD22 LEU 56 1HD2 LEU 56 -2.338 2.104 -3.976 441 HD23 LEU 56 2HD2 LEU 56 -2.049 0.618 -4.886 442 H VAL 57 H VAL 57 -0.196 -1.040 0.805 443 HA VAL 57 HA VAL 57 -0.832 1.308 2.443 444 HB VAL 57 HB VAL 57 1.315 -0.833 2.869 445 HG11 VAL 57 1HG1 VAL 57 0.267 1.277 4.800 446 HG12 VAL 57 2HG1 VAL 57 1.863 1.264 4.047 447 HG13 VAL 57 3HG1 VAL 57 1.424 0.002 5.198 448 HG21 VAL 57 3HG2 VAL 57 -0.225 -1.804 4.550 449 HG22 VAL 57 1HG2 VAL 57 -0.938 -1.819 2.934 450 HG23 VAL 57 2HG2 VAL 57 -1.453 -0.611 4.112 451 H MET 58 H MET 58 0.150 3.187 2.105 452 HA MET 58 HA MET 58 2.851 3.410 0.929 453 HB2 MET 58 2HB MET 58 2.111 5.194 -0.562 454 HB3 MET 58 3HB MET 58 1.071 3.807 -0.840 455 HG2 MET 58 2HG MET 58 -0.676 4.865 0.571 456 HG3 MET 58 3HG MET 58 0.366 6.275 0.765 457 HE1 MET 58 3HE MET 58 -0.358 4.009 -2.439 458 HE2 MET 58 1HE MET 58 -1.620 4.981 -3.194 459 HE3 MET 58 2HE MET 58 -1.918 4.209 -1.637 460 H ASP 59 H ASP 59 3.611 5.785 1.249 461 HA ASP 59 HA ASP 59 2.611 6.938 3.791 462 HB2 ASP 59 2HB ASP 59 5.104 6.508 3.489 463 HB3 ASP 59 3HB ASP 59 5.116 7.701 2.198 464 H GLU 60 H GLU 60 2.538 9.440 3.723 465 HA GLU 60 HA GLU 60 0.532 10.179 1.874 466 HB2 GLU 60 2HB GLU 60 0.651 11.028 4.203 467 HB3 GLU 60 3HB GLU 60 2.068 11.990 3.793 468 HG2 GLU 60 2HG GLU 60 0.762 13.346 2.264 469 HG3 GLU 60 3HG GLU 60 -0.646 12.311 2.466 470 H ARG 61 H ARG 61 4.007 10.558 1.799 471 HA ARG 61 HA ARG 61 4.307 12.638 -0.090 472 HB2 ARG 61 2HB ARG 61 6.046 10.142 0.121 473 HB3 ARG 61 3HB ARG 61 6.516 11.684 -0.582 474 HG2 ARG 61 2HG ARG 61 5.955 11.120 2.334 475 HG3 ARG 61 3HG ARG 61 7.528 11.415 1.601 476 HD2 ARG 61 2HD ARG 61 6.766 13.742 1.037 477 HD3 ARG 61 3HD ARG 61 5.262 13.412 1.914 478 HE ARG 61 HE ARG 61 7.454 12.823 3.581 479 HH11 ARG 61 1HH1 ARG 61 5.820 15.636 2.230 480 HH12 ARG 61 2HH1 ARG 61 6.319 16.679 3.524 481 HH21 ARG 61 1HH2 ARG 61 8.139 14.220 5.209 482 HH22 ARG 61 2HH2 ARG 61 7.628 15.878 5.209 483 H THR 62 H THR 62 3.907 9.151 -0.508 484 HA THR 62 HA THR 62 3.874 9.067 -3.339 485 HB THR 62 HB THR 62 2.638 7.124 -1.330 486 HG1 THR 62 HG1 THR 62 4.748 6.047 -1.751 487 HG21 THR 62 3HG2 THR 62 1.892 6.656 -3.634 488 HG22 THR 62 1HG2 THR 62 3.012 5.412 -3.070 489 HG23 THR 62 2HG2 THR 62 3.570 6.662 -4.184 490 H TRP 63 H TRP 63 1.353 9.395 -0.854 491 HA TRP 63 HA TRP 63 -0.938 9.212 -2.465 492 HB2 TRP 63 2HB TRP 63 -1.186 9.019 -0.081 493 HB3 TRP 63 3HB TRP 63 -0.472 10.606 0.199 494 HD1 TRP 63 HD1 TRP 63 -2.133 12.614 0.356 495 HE1 TRP 63 HE1 TRP 63 -4.659 12.923 0.011 496 HE3 TRP 63 HE3 TRP 63 -3.261 8.030 -1.666 497 HZ2 TRP 63 HZ2 TRP 63 -6.829 11.442 -0.969 498 HZ3 TRP 63 HZ3 TRP 63 -5.602 7.565 -2.282 499 HH2 TRP 63 HH2 TRP 63 -7.348 9.240 -1.939 500 H LYS 64 H LYS 64 1.193 11.998 -1.823 501 HA LYS 64 HA LYS 64 -0.409 14.096 -2.748 502 HB2 LYS 64 2HB LYS 64 2.583 13.797 -3.252 503 HB3 LYS 64 3HB LYS 64 1.677 15.304 -3.288 504 HG2 LYS 64 2HG LYS 64 2.300 13.594 -0.883 505 HG3 LYS 64 3HG LYS 64 2.926 15.200 -1.251 506 HD2 LYS 64 2HD LYS 64 0.544 16.076 -1.047 507 HD3 LYS 64 3HD LYS 64 0.071 14.474 -0.472 508 HE2 LYS 64 2HE LYS 64 1.720 14.708 1.395 509 HE3 LYS 64 3HE LYS 64 2.070 16.342 0.825 510 HZ1 LYS 64 3HZ LYS 64 0.473 16.304 2.673 511 HZ2 LYS 64 1HZ LYS 64 -0.597 15.398 1.735 512 HZ3 LYS 64 2HZ LYS 64 -0.204 16.976 1.278 513 H LYS 65 H LYS 65 1.482 11.720 -4.490 514 HA LYS 65 HA LYS 65 1.107 12.837 -7.117 515 HB2 LYS 65 2HB LYS 65 2.139 10.084 -6.336 516 HB3 LYS 65 3HB LYS 65 2.375 10.893 -7.880 517 HG2 LYS 65 2HG LYS 65 3.545 11.751 -5.215 518 HG3 LYS 65 3HG LYS 65 4.418 10.937 -6.509 519 HD2 LYS 65 2HD LYS 65 3.192 13.715 -6.679 520 HD3 LYS 65 3HD LYS 65 4.900 13.357 -6.438 521 HE2 LYS 65 2HE LYS 65 5.067 12.364 -8.649 522 HE3 LYS 65 3HE LYS 65 3.323 12.508 -8.891 523 HZ1 LYS 65 3HZ LYS 65 3.541 14.909 -8.816 524 HZ2 LYS 65 1HZ LYS 65 4.537 14.269 -10.022 525 HZ3 LYS 65 2HZ LYS 65 5.205 14.786 -8.559 526 H VAL 66 H VAL 66 -0.308 10.152 -5.232 527 HA VAL 66 HA VAL 66 -1.797 8.934 -7.335 528 HB VAL 66 HB VAL 66 -2.325 8.823 -4.320 529 HG11 VAL 66 1HG1 VAL 66 -4.295 8.061 -5.596 530 HG12 VAL 66 2HG1 VAL 66 -3.522 6.703 -4.779 531 HG13 VAL 66 3HG1 VAL 66 -3.288 6.936 -6.514 532 HG21 VAL 66 3HG2 VAL 66 -1.042 6.708 -4.353 533 HG22 VAL 66 1HG2 VAL 66 -0.049 8.070 -4.874 534 HG23 VAL 66 2HG2 VAL 66 -0.691 6.941 -6.067 535 H TYR 67 H TYR 67 -2.839 11.036 -4.648 536 HA TYR 67 HA TYR 67 -5.453 11.608 -5.285 537 HB2 TYR 67 2HB TYR 67 -4.349 12.299 -3.197 538 HB3 TYR 67 3HB TYR 67 -3.323 13.428 -4.065 539 HD1 TYR 67 HD2 TYR 67 -4.308 15.593 -4.931 540 HD2 TYR 67 HD1 TYR 67 -6.626 12.891 -2.570 541 HE1 TYR 67 HE2 TYR 67 -5.931 17.379 -4.477 542 HE2 TYR 67 HE1 TYR 67 -8.247 14.686 -2.115 543 HH TYR 67 HH TYR 67 -8.390 17.121 -2.113 544 H ASP 68 H ASP 68 -2.514 13.126 -6.537 545 HA ASP 68 HA ASP 68 -3.680 15.162 -8.104 546 HB2 ASP 68 2HB ASP 68 -1.304 15.222 -7.505 547 HB3 ASP 68 3HB ASP 68 -1.000 13.735 -8.397 548 H LEU 69 H LEU 69 -2.497 11.905 -8.985 549 HA LEU 69 HA LEU 69 -3.056 11.894 -11.718 550 HB2 LEU 69 2HB LEU 69 -2.973 9.620 -9.692 551 HB3 LEU 69 3HB LEU 69 -3.168 9.336 -11.415 552 HG LEU 69 HG LEU 69 -0.758 10.780 -10.248 553 HD11 LEU 69 1HD1 LEU 69 -0.984 7.838 -10.982 554 HD12 LEU 69 2HD1 LEU 69 -0.808 8.499 -9.353 555 HD13 LEU 69 3HD1 LEU 69 0.496 8.686 -10.521 556 HD21 LEU 69 3HD2 LEU 69 0.262 10.322 -12.433 557 HD22 LEU 69 1HD2 LEU 69 -1.213 11.271 -12.611 558 HD23 LEU 69 2HD2 LEU 69 -1.226 9.546 -12.983 559 H LEU 70 H LEU 70 -5.097 11.101 -8.960 560 HA LEU 70 HA LEU 70 -7.329 10.013 -10.234 561 HB2 LEU 70 2HB LEU 70 -7.115 11.631 -7.661 562 HB3 LEU 70 3HB LEU 70 -8.579 10.803 -8.160 563 HG LEU 70 HG LEU 70 -5.931 9.409 -7.574 564 HD11 LEU 70 1HD1 LEU 70 -6.978 8.585 -5.516 565 HD12 LEU 70 2HD1 LEU 70 -8.425 9.539 -5.850 566 HD13 LEU 70 3HD1 LEU 70 -6.890 10.347 -5.521 567 HD21 LEU 70 3HD2 LEU 70 -8.673 8.239 -8.149 568 HD22 LEU 70 1HD2 LEU 70 -7.243 7.321 -7.667 569 HD23 LEU 70 2HD2 LEU 70 -7.263 8.172 -9.209 570 H ILE 71 H ILE 71 -6.799 13.410 -9.215 571 HA ILE 71 HA ILE 71 -9.152 14.412 -10.524 572 HB ILE 71 HB ILE 71 -6.785 16.015 -9.434 573 HG12 ILE 71 2HG1 ILE 71 -9.320 15.077 -7.996 574 HG13 ILE 71 3HG1 ILE 71 -7.683 14.519 -7.675 575 HG21 ILE 71 1HG2 ILE 71 -8.281 17.361 -10.883 576 HG22 ILE 71 2HG2 ILE 71 -8.397 17.881 -9.203 577 HG23 ILE 71 3HG2 ILE 71 -9.670 16.882 -9.904 578 HD11 ILE 71 3HD1 ILE 71 -7.083 16.773 -6.914 579 HD12 ILE 71 1HD1 ILE 71 -8.399 16.060 -5.979 580 HD13 ILE 71 2HD1 ILE 71 -8.749 17.292 -7.190 581 H LEU 72 H LEU 72 -5.905 13.824 -11.565 582 HA LEU 72 HA LEU 72 -5.770 15.714 -13.722 583 HB2 LEU 72 2HB LEU 72 -3.802 14.720 -12.502 584 HB3 LEU 72 3HB LEU 72 -4.120 13.185 -13.277 585 HG LEU 72 HG LEU 72 -2.205 14.674 -14.205 586 HD11 LEU 72 1HD1 LEU 72 -4.220 13.612 -16.200 587 HD12 LEU 72 2HD1 LEU 72 -2.964 12.675 -15.388 588 HD13 LEU 72 3HD1 LEU 72 -2.516 13.956 -16.513 589 HD21 LEU 72 3HD2 LEU 72 -2.784 16.400 -15.848 590 HD22 LEU 72 1HD2 LEU 72 -3.440 16.820 -14.266 591 HD23 LEU 72 2HD2 LEU 72 -4.504 16.179 -15.521 592 H HIS 73 H HIS 73 -6.594 12.265 -13.454 593 HA HIS 73 HA HIS 73 -7.091 11.922 -16.292 594 HB2 HIS 73 2HB HIS 73 -7.518 10.142 -13.857 595 HB3 HIS 73 3HB HIS 73 -8.112 9.674 -15.446 596 HD1 HIS 73 HD1 HIS 73 -6.595 7.927 -16.292 597 HD2 HIS 73 HD2 HIS 73 -4.497 10.961 -14.377 598 HE1 HIS 73 HE1 HIS 73 -4.170 7.353 -16.568 599 HE2 HIS 73 HE2 HIS 73 -2.942 9.303 -15.592 600 H ASP 74 H ASP 74 -9.145 11.626 -13.410 601 HA ASP 74 HA ASP 74 -11.152 13.367 -13.740 602 HB2 ASP 74 2HB ASP 74 -11.743 12.419 -15.978 603 HB3 ASP 74 3HB ASP 74 -11.966 10.831 -15.260 604 H PHE 75 H PHE 75 -11.210 13.212 -11.572 605 HA PHE 75 HA PHE 75 -12.952 11.476 -10.238 606 HB2 PHE 75 2HB PHE 75 -10.922 9.890 -10.595 607 HB3 PHE 75 3HB PHE 75 -10.044 10.907 -9.471 608 HD1 PHE 75 HD2 PHE 75 -13.321 9.055 -9.649 609 HD2 PHE 75 HD1 PHE 75 -9.955 10.124 -7.255 610 HE1 PHE 75 HE2 PHE 75 -14.145 7.620 -7.826 611 HE2 PHE 75 HE1 PHE 75 -10.776 8.686 -5.448 612 HZ PHE 75 HZ PHE 75 -12.864 7.432 -5.734 613 H THR 76 H THR 76 -13.615 13.522 -9.676 614 HA THR 76 HA THR 76 -12.209 15.728 -8.815 615 HB THR 76 HB THR 76 -14.602 15.705 -9.537 616 HG1 THR 76 HG1 THR 76 -14.948 17.506 -8.494 617 HG21 THR 76 3HG2 THR 76 -16.385 15.117 -7.942 618 HG22 THR 76 1HG2 THR 76 -15.160 14.580 -6.789 619 HG23 THR 76 2HG2 THR 76 -15.370 13.720 -8.318 620 HA PRO 77 HA PRO 77 -10.817 15.142 -4.528 621 HB2 PRO 77 2HB PRO 77 -11.672 17.545 -3.360 622 HB3 PRO 77 3HB PRO 77 -10.212 17.389 -4.361 623 HG2 PRO 77 2HG PRO 77 -12.984 18.235 -5.232 624 HG3 PRO 77 3HG PRO 77 -11.416 19.025 -5.552 625 HD2 PRO 77 2HD PRO 77 -12.442 17.528 -7.439 626 HD3 PRO 77 3HD PRO 77 -10.724 17.305 -7.056 627 H GLU 78 H GLU 78 -14.095 16.078 -5.220 628 HA GLU 78 HA GLU 78 -15.345 15.697 -2.738 629 HB2 GLU 78 2HB GLU 78 -16.374 15.598 -5.596 630 HB3 GLU 78 3HB GLU 78 -17.427 15.623 -4.188 631 HG2 GLU 78 2HG GLU 78 -15.352 17.773 -4.651 632 HG3 GLU 78 3HG GLU 78 -16.946 17.870 -5.382 633 H GLU 79 H GLU 79 -14.773 13.436 -5.439 634 HA GLU 79 HA GLU 79 -16.156 11.228 -4.275 635 HB2 GLU 79 2HB GLU 79 -13.979 11.341 -6.407 636 HB3 GLU 79 3HB GLU 79 -14.757 9.847 -5.905 637 HG2 GLU 79 2HG GLU 79 -16.111 12.216 -7.206 638 HG3 GLU 79 3HG GLU 79 -15.745 10.671 -7.966 639 H ILE 80 H ILE 80 -12.776 12.238 -4.374 640 HA ILE 80 HA ILE 80 -11.510 10.061 -3.198 641 HB ILE 80 HB ILE 80 -10.698 13.002 -3.021 642 HG12 ILE 80 2HG1 ILE 80 -9.942 10.930 -5.143 643 HG13 ILE 80 3HG1 ILE 80 -11.112 12.221 -5.375 644 HG21 ILE 80 1HG2 ILE 80 -9.427 11.600 -1.448 645 HG22 ILE 80 2HG2 ILE 80 -8.386 12.152 -2.759 646 HG23 ILE 80 3HG2 ILE 80 -8.993 10.495 -2.756 647 HD11 ILE 80 3HD1 ILE 80 -8.158 12.548 -4.897 648 HD12 ILE 80 1HD1 ILE 80 -9.317 13.873 -5.045 649 HD13 ILE 80 2HD1 ILE 80 -9.028 12.795 -6.411 650 H LYS 81 H LYS 81 -12.486 13.115 -1.651 651 HA LYS 81 HA LYS 81 -11.812 12.423 0.998 652 HB2 LYS 81 2HB LYS 81 -12.951 14.483 1.638 653 HB3 LYS 81 3HB LYS 81 -12.026 14.753 0.165 654 HG2 LYS 81 2HG LYS 81 -14.252 14.318 -1.088 655 HG3 LYS 81 3HG LYS 81 -15.028 14.538 0.478 656 HD2 LYS 81 2HD LYS 81 -13.274 16.587 -0.932 657 HD3 LYS 81 3HD LYS 81 -15.035 16.604 -0.897 658 HE2 LYS 81 2HE LYS 81 -13.219 16.892 1.513 659 HE3 LYS 81 3HE LYS 81 -14.085 18.197 0.706 660 HZ1 LYS 81 3HZ LYS 81 -15.326 15.893 2.109 661 HZ2 LYS 81 1HZ LYS 81 -16.170 17.110 1.307 662 HZ3 LYS 81 2HZ LYS 81 -15.253 17.484 2.674 663 H SER 82 H SER 82 -14.658 11.732 -0.912 664 HA SER 82 HA SER 82 -16.449 11.181 1.278 665 HB2 SER 82 2HB SER 82 -17.248 11.885 -0.969 666 HB3 SER 82 3HB SER 82 -16.645 10.380 -1.664 667 HG SER 82 HG SER 82 -18.322 10.036 0.496 668 H PHE 83 H PHE 83 -14.063 9.291 -0.521 669 HA PHE 83 HA PHE 83 -14.930 6.741 0.574 670 HB2 PHE 83 2HB PHE 83 -12.416 7.542 -0.932 671 HB3 PHE 83 3HB PHE 83 -12.651 5.920 -0.282 672 HD1 PHE 83 HD2 PHE 83 -14.674 4.563 -1.074 673 HD2 PHE 83 HD1 PHE 83 -13.398 8.132 -3.048 674 HE1 PHE 83 HE2 PHE 83 -15.937 3.910 -3.083 675 HE2 PHE 83 HE1 PHE 83 -14.676 7.475 -5.044 676 HZ PHE 83 HZ PHE 83 -15.943 5.369 -5.065 677 H PHE 84 H PHE 84 -13.048 9.367 1.771 678 HA PHE 84 HA PHE 84 -12.029 7.900 4.078 679 HB2 PHE 84 2HB PHE 84 -12.352 10.904 3.580 680 HB3 PHE 84 3HB PHE 84 -11.621 10.218 5.026 681 HD1 PHE 84 HD1 PHE 84 -11.179 10.702 1.376 682 HD2 PHE 84 HD2 PHE 84 -9.336 9.409 5.008 683 HE1 PHE 84 HE1 PHE 84 -8.984 10.711 0.266 684 HE2 PHE 84 HE2 PHE 84 -7.146 9.417 3.890 685 HZ PHE 84 HZ PHE 84 -6.971 10.069 1.523 686 H GLU 85 H GLU 85 -14.673 10.100 3.302 687 HA GLU 85 HA GLU 85 -15.961 9.941 5.909 688 HB2 GLU 85 2HB GLU 85 -16.736 11.378 3.329 689 HB3 GLU 85 3HB GLU 85 -17.547 11.585 4.877 690 HG2 GLU 85 2HG GLU 85 -15.606 12.636 5.838 691 HG3 GLU 85 3HG GLU 85 -14.627 12.215 4.433 692 H ASN 86 H ASN 86 -16.067 7.444 5.301 693 HA ASN 86 HA ASN 86 -18.518 6.808 3.772 694 HB2 ASN 86 2HB ASN 86 -16.248 5.564 3.438 695 HB3 ASN 86 3HB ASN 86 -16.597 4.760 4.965 696 HD21 ASN 86 1HD2 ASN 86 -16.283 3.373 2.565 697 HD22 ASN 86 2HD2 ASN 86 -17.791 2.668 2.118 698 H LYS 87 H LYS 87 -20.381 6.447 4.857 699 HA LYS 87 HA LYS 87 -20.341 6.089 7.800 700 HB2 LYS 87 2HB LYS 87 -22.345 7.502 5.985 701 HB3 LYS 87 3HB LYS 87 -22.716 7.073 7.648 702 HG2 LYS 87 2HG LYS 87 -22.111 9.355 7.710 703 HG3 LYS 87 3HG LYS 87 -20.714 8.487 8.344 704 HD2 LYS 87 2HD LYS 87 -19.927 10.238 6.875 705 HD3 LYS 87 3HD LYS 87 -19.639 8.687 6.088 706 HE2 LYS 87 2HE LYS 87 -20.479 10.270 4.444 707 HE3 LYS 87 3HE LYS 87 -21.709 9.041 4.726 708 HZ1 LYS 87 3HZ LYS 87 -22.601 11.324 4.619 709 HZ2 LYS 87 1HZ LYS 87 -21.699 11.739 5.988 710 HZ3 LYS 87 2HZ LYS 87 -22.928 10.582 6.101 711 H GLY 88 H GLY 88 -20.828 4.075 8.395 712 HA2 GLY 88 2HA GLY 88 -22.206 2.206 8.672 713 HA3 GLY 88 3HA GLY 88 -23.098 2.637 7.223 714 H LYS 89 H LYS 89 -19.707 2.678 6.810 715 HA LYS 89 HA LYS 89 -19.281 -0.107 6.167 716 HB2 LYS 89 2HB LYS 89 -20.566 0.834 4.147 717 HB3 LYS 89 3HB LYS 89 -19.224 1.927 3.884 718 HG2 LYS 89 2HG LYS 89 -18.645 0.301 2.379 719 HG3 LYS 89 3HG LYS 89 -17.826 -0.363 3.788 720 HD2 LYS 89 2HD LYS 89 -20.607 -1.190 2.860 721 HD3 LYS 89 3HD LYS 89 -19.130 -2.046 2.447 722 HE2 LYS 89 2HE LYS 89 -18.757 -2.679 4.740 723 HE3 LYS 89 3HE LYS 89 -20.053 -1.623 5.302 724 HZ1 LYS 89 3HZ LYS 89 -20.427 -4.006 3.565 725 HZ2 LYS 89 1HZ LYS 89 -21.653 -3.018 4.179 726 HZ3 LYS 89 2HZ LYS 89 -20.720 -3.957 5.230 727 H ARG 90 H ARG 90 -17.002 -0.494 5.646 728 HA ARG 90 HA ARG 90 -15.100 1.081 6.976 729 HB2 ARG 90 2HB ARG 90 -14.708 -1.286 6.498 730 HB3 ARG 90 3HB ARG 90 -14.733 -0.990 4.763 731 HG2 ARG 90 2HG ARG 90 -12.674 0.434 5.044 732 HG3 ARG 90 3HG ARG 90 -12.624 -0.043 6.741 733 HD2 ARG 90 2HD ARG 90 -12.432 -1.923 4.365 734 HD3 ARG 90 3HD ARG 90 -11.075 -1.375 5.349 735 HE ARG 90 HE ARG 90 -12.133 -2.544 7.249 736 HH11 ARG 90 1HH1 ARG 90 -13.019 -3.563 4.004 737 HH12 ARG 90 2HH1 ARG 90 -13.478 -5.165 4.505 738 HH21 ARG 90 1HH2 ARG 90 -12.704 -4.640 7.891 739 HH22 ARG 90 2HH2 ARG 90 -13.294 -5.772 6.718 740 HA PRO 91 HA PRO 91 -14.274 4.309 3.825 741 HB2 PRO 91 2HB PRO 91 -11.755 4.667 5.429 742 HB3 PRO 91 3HB PRO 91 -12.981 5.869 4.968 743 HG2 PRO 91 2HG PRO 91 -12.816 5.000 7.487 744 HG3 PRO 91 3HG PRO 91 -14.398 5.319 6.739 745 HD2 PRO 91 2HD PRO 91 -13.024 2.672 7.189 746 HD3 PRO 91 3HD PRO 91 -14.738 3.109 7.409 747 H VAL 92 H VAL 92 -13.455 3.772 1.875 748 HA VAL 92 HA VAL 92 -11.634 1.625 1.420 749 HB VAL 92 HB VAL 92 -12.577 3.834 -0.472 750 HG11 VAL 92 1HG1 VAL 92 -11.859 2.378 -2.334 751 HG12 VAL 92 2HG1 VAL 92 -11.182 1.223 -1.184 752 HG13 VAL 92 3HG1 VAL 92 -10.488 2.839 -1.323 753 HG21 VAL 92 3HG2 VAL 92 -14.166 2.146 -1.330 754 HG22 VAL 92 1HG2 VAL 92 -14.424 2.450 0.390 755 HG23 VAL 92 2HG2 VAL 92 -13.591 0.984 -0.132 756 H PHE 93 H PHE 93 -11.325 5.170 1.361 757 HA PHE 93 HA PHE 93 -8.384 4.989 1.311 758 HB2 PHE 93 2HB PHE 93 -10.209 7.424 1.158 759 HB3 PHE 93 3HB PHE 93 -8.453 7.465 1.055 760 HD1 PHE 93 HD1 PHE 93 -8.815 4.684 -0.807 761 HD2 PHE 93 HD2 PHE 93 -10.047 8.782 -0.980 762 HE1 PHE 93 HE1 PHE 93 -8.956 4.550 -3.257 763 HE2 PHE 93 HE2 PHE 93 -10.188 8.623 -3.432 764 HZ PHE 93 HZ PHE 93 -9.646 6.513 -4.572 765 H VAL 94 H VAL 94 -7.616 4.552 3.304 766 HA VAL 94 HA VAL 94 -8.616 6.053 5.668 767 HB VAL 94 HB VAL 94 -7.053 3.413 5.592 768 HG11 VAL 94 1HG1 VAL 94 -8.261 4.874 7.971 769 HG12 VAL 94 2HG1 VAL 94 -6.539 4.711 7.617 770 HG13 VAL 94 3HG1 VAL 94 -7.494 3.284 8.019 771 HG21 VAL 94 3HG2 VAL 94 -9.132 2.341 6.394 772 HG22 VAL 94 1HG2 VAL 94 -9.366 3.093 4.812 773 HG23 VAL 94 2HG2 VAL 94 -9.984 3.883 6.264 774 H LYS 95 H LYS 95 -7.008 7.014 7.066 775 HA LYS 95 HA LYS 95 -4.186 6.911 6.286 776 HB2 LYS 95 2HB LYS 95 -3.906 9.348 6.335 777 HB3 LYS 95 3HB LYS 95 -5.042 8.881 5.077 778 HG2 LYS 95 2HG LYS 95 -6.929 9.628 6.400 779 HG3 LYS 95 3HG LYS 95 -5.897 9.936 7.798 780 HD2 LYS 95 2HD LYS 95 -5.675 11.393 5.129 781 HD3 LYS 95 3HD LYS 95 -6.520 12.019 6.544 782 HE2 LYS 95 2HE LYS 95 -4.455 12.139 7.807 783 HE3 LYS 95 3HE LYS 95 -3.573 11.293 6.536 784 HZ1 LYS 95 3HZ LYS 95 -4.871 13.925 6.132 785 HZ2 LYS 95 1HZ LYS 95 -3.772 13.150 5.112 786 HZ3 LYS 95 2HZ LYS 95 -3.257 13.753 6.603 787 H GLY 96 H GLY 96 -2.832 8.139 7.904 788 HA2 GLY 96 2HA GLY 96 -3.136 9.126 10.295 789 HA3 GLY 96 3HA GLY 96 -3.702 7.490 10.653 790 H SER 97 H SER 97 -1.892 7.160 12.096 791 HA SER 97 HA SER 97 0.778 6.849 11.020 792 HB2 SER 97 2HB SER 97 0.346 7.208 13.447 793 HB3 SER 97 3HB SER 97 -0.519 5.675 13.529 794 HG SER 97 HG SER 97 1.363 4.857 13.947 795 H LEU 98 H LEU 98 1.767 4.462 11.184 796 HA LEU 98 HA LEU 98 0.546 2.880 9.186 797 HB2 LEU 98 2HB LEU 98 2.953 2.803 9.594 798 HB3 LEU 98 3HB LEU 98 2.693 2.183 11.216 799 HG LEU 98 HG LEU 98 1.720 0.077 10.194 800 HD11 LEU 98 1HD1 LEU 98 2.139 -0.425 7.836 801 HD12 LEU 98 2HD1 LEU 98 2.741 1.213 7.577 802 HD13 LEU 98 3HD1 LEU 98 1.051 0.952 8.013 803 HD21 LEU 98 3HD2 LEU 98 3.877 -0.912 9.585 804 HD22 LEU 98 1HD2 LEU 98 4.027 0.125 11.005 805 HD23 LEU 98 2HD2 LEU 98 4.590 0.697 9.431 806 H GLU 99 H GLU 99 0.848 2.263 12.705 807 HA GLU 99 HA GLU 99 -0.747 -0.081 12.782 808 HB2 GLU 99 2HB GLU 99 -0.162 1.877 15.047 809 HB3 GLU 99 3HB GLU 99 -0.848 0.273 15.250 810 HG2 GLU 99 2HG GLU 99 1.406 0.032 15.857 811 HG3 GLU 99 3HG GLU 99 1.323 -0.634 14.230 812 H SER 100 H SER 100 -1.486 3.350 13.316 813 HA SER 100 HA SER 100 -4.092 3.123 14.341 814 HB2 SER 100 2HB SER 100 -2.810 5.425 12.807 815 HB3 SER 100 3HB SER 100 -4.275 5.546 13.786 816 HG SER 100 HG SER 100 -3.060 5.708 15.480 817 H ALA 101 H ALA 101 -2.995 3.743 11.018 818 HA ALA 101 HA ALA 101 -5.548 3.934 9.810 819 HB1 ALA 101 3HB ALA 101 -3.510 4.853 8.790 820 HB2 ALA 101 1HB ALA 101 -4.329 3.751 7.681 821 HB3 ALA 101 2HB ALA 101 -2.882 3.222 8.548 822 H ALA 102 H ALA 102 -3.501 1.238 10.668 823 HA ALA 102 HA ALA 102 -4.725 -0.784 9.072 824 HB1 ALA 102 3HB ALA 102 -2.471 -1.005 9.987 825 HB2 ALA 102 1HB ALA 102 -3.495 -2.334 10.530 826 HB3 ALA 102 2HB ALA 102 -3.114 -1.006 11.631 827 H GLU 103 H GLU 103 -5.190 0.366 12.422 828 HA GLU 103 HA GLU 103 -7.178 -1.485 13.243 829 HB2 GLU 103 2HB GLU 103 -6.846 1.411 14.161 830 HB3 GLU 103 3HB GLU 103 -7.719 0.142 15.019 831 HG2 GLU 103 2HG GLU 103 -5.613 -1.095 15.349 832 HG3 GLU 103 3HG GLU 103 -4.741 0.158 14.474 833 H GLN 104 H GLN 104 -7.394 1.718 11.748 834 HA GLN 104 HA GLN 104 -10.226 1.966 11.695 835 HB2 GLN 104 2HB GLN 104 -8.077 3.316 10.017 836 HB3 GLN 104 3HB GLN 104 -9.766 3.813 10.042 837 HG2 GLN 104 2HG GLN 104 -9.611 4.485 12.354 838 HG3 GLN 104 3HG GLN 104 -7.988 3.801 12.495 839 HE21 GLN 104 1HE2 GLN 104 -6.248 4.910 11.577 840 HE22 GLN 104 2HE2 GLN 104 -6.353 6.548 11.043 841 H ALA 105 H ALA 105 -7.940 0.445 9.497 842 HA ALA 105 HA ALA 105 -10.008 -0.109 7.474 843 HB1 ALA 105 3HB ALA 105 -7.786 0.586 6.693 844 HB2 ALA 105 1HB ALA 105 -8.156 -1.049 6.145 845 HB3 ALA 105 2HB ALA 105 -7.046 -0.798 7.497 846 H GLY 106 H GLY 106 -8.773 -1.545 10.307 847 HA2 GLY 106 2HA GLY 106 -9.456 -3.448 11.397 848 HA3 GLY 106 3HA GLY 106 -10.483 -3.842 10.031 849 H ILE 107 H ILE 107 -7.172 -3.296 9.321 850 HA ILE 107 HA ILE 107 -6.673 -6.059 8.548 851 HB ILE 107 HB ILE 107 -4.630 -3.788 8.558 852 HG12 ILE 107 2HG1 ILE 107 -6.579 -4.342 6.278 853 HG13 ILE 107 3HG1 ILE 107 -6.742 -3.003 7.412 854 HG21 ILE 107 1HG2 ILE 107 -3.791 -6.073 8.051 855 HG22 ILE 107 2HG2 ILE 107 -3.625 -4.989 6.672 856 HG23 ILE 107 3HG2 ILE 107 -4.923 -6.180 6.699 857 HD11 ILE 107 3HD1 ILE 107 -5.750 -2.259 5.363 858 HD12 ILE 107 1HD1 ILE 107 -4.460 -3.450 5.500 859 HD13 ILE 107 2HD1 ILE 107 -4.575 -2.129 6.669 860 H VAL 108 H VAL 108 -4.861 -7.325 9.455 861 HA VAL 108 HA VAL 108 -4.567 -7.081 12.294 862 HB VAL 108 HB VAL 108 -3.050 -8.934 10.397 863 HG11 VAL 108 1HG1 VAL 108 -2.713 -10.358 12.396 864 HG12 VAL 108 2HG1 VAL 108 -3.500 -9.137 13.400 865 HG13 VAL 108 3HG1 VAL 108 -1.969 -8.768 12.600 866 HG21 VAL 108 3HG2 VAL 108 -5.473 -9.244 10.144 867 HG22 VAL 108 1HG2 VAL 108 -5.656 -9.419 11.892 868 HG23 VAL 108 2HG2 VAL 108 -4.768 -10.635 10.968 869 H VAL 109 H VAL 109 -3.521 -5.346 12.940 870 HA VAL 109 HA VAL 109 -1.500 -3.802 11.946 871 HB VAL 109 HB VAL 109 -2.172 -4.466 14.854 872 HG11 VAL 109 1HG1 VAL 109 -0.415 -2.184 13.883 873 HG12 VAL 109 2HG1 VAL 109 0.111 -3.567 14.841 874 HG13 VAL 109 3HG1 VAL 109 -1.003 -2.390 15.536 875 HG21 VAL 109 3HG2 VAL 109 -4.000 -3.405 13.568 876 HG22 VAL 109 1HG2 VAL 109 -2.938 -2.053 13.173 877 HG23 VAL 109 2HG2 VAL 109 -3.416 -2.341 14.848 878 H ASP 110 H ASP 110 -1.183 -6.551 14.118 879 HA ASP 110 HA ASP 110 1.504 -6.584 14.717 880 HB2 ASP 110 2HB ASP 110 -0.190 -7.946 15.867 881 HB3 ASP 110 3HB ASP 110 -0.448 -8.913 14.422 882 H GLU 111 H GLU 111 -0.111 -7.964 11.883 883 HA GLU 111 HA GLU 111 2.204 -9.318 10.853 884 HB2 GLU 111 2HB GLU 111 -0.465 -8.645 9.545 885 HB3 GLU 111 3HB GLU 111 0.777 -9.647 8.804 886 HG2 GLU 111 2HG GLU 111 -0.720 -10.261 11.356 887 HG3 GLU 111 3HG GLU 111 -0.996 -11.013 9.790 888 H LEU 112 H LEU 112 0.400 -6.357 9.789 889 HA LEU 112 HA LEU 112 2.199 -5.897 7.605 890 HB2 LEU 112 2HB LEU 112 1.001 -3.728 7.309 891 HB3 LEU 112 3HB LEU 112 -0.017 -5.151 7.342 892 HG LEU 112 HG LEU 112 -0.476 -4.534 9.846 893 HD11 LEU 112 1HD1 LEU 112 0.451 -1.804 8.893 894 HD12 LEU 112 2HD1 LEU 112 1.223 -2.789 10.137 895 HD13 LEU 112 3HD1 LEU 112 -0.395 -2.148 10.405 896 HD21 LEU 112 3HD2 LEU 112 -2.111 -4.426 7.999 897 HD22 LEU 112 1HD2 LEU 112 -1.622 -2.763 7.675 898 HD23 LEU 112 2HD2 LEU 112 -2.370 -3.189 9.219 899 H VAL 113 H VAL 113 2.339 -4.902 10.888 900 HA VAL 113 HA VAL 113 4.131 -2.695 10.625 901 HB VAL 113 HB VAL 113 3.418 -4.466 13.004 902 HG11 VAL 113 1HG1 VAL 113 5.313 -2.077 13.093 903 HG12 VAL 113 2HG1 VAL 113 5.765 -3.758 13.379 904 HG13 VAL 113 3HG1 VAL 113 4.674 -2.938 14.495 905 HG21 VAL 113 3HG2 VAL 113 2.305 -2.411 13.817 906 HG22 VAL 113 1HG2 VAL 113 1.706 -2.876 12.224 907 HG23 VAL 113 2HG2 VAL 113 2.852 -1.543 12.382 908 H GLN 114 H GLN 114 4.544 -6.182 11.022 909 HA GLN 114 HA GLN 114 7.414 -6.177 11.151 910 HB2 GLN 114 2HB GLN 114 5.442 -8.339 10.301 911 HB3 GLN 114 3HB GLN 114 7.176 -8.605 10.452 912 HG2 GLN 114 2HG GLN 114 5.298 -7.847 12.701 913 HG3 GLN 114 3HG GLN 114 5.994 -9.441 12.415 914 HE21 GLN 114 1HE2 GLN 114 6.551 -6.270 13.675 915 HE22 GLN 114 2HE2 GLN 114 8.112 -6.576 14.343 916 H THR 115 H THR 115 5.020 -6.591 8.626 917 HA THR 115 HA THR 115 6.611 -7.165 6.435 918 HB THR 115 HB THR 115 3.917 -5.785 6.692 919 HG1 THR 115 HG1 THR 115 3.123 -7.817 6.631 920 HG21 THR 115 3HG2 THR 115 4.790 -5.343 4.446 921 HG22 THR 115 1HG2 THR 115 3.448 -6.482 4.396 922 HG23 THR 115 2HG2 THR 115 5.103 -7.067 4.211 923 H VAL 116 H VAL 116 5.691 -3.985 7.766 924 HA VAL 116 HA VAL 116 6.904 -2.483 5.586 925 HB VAL 116 HB VAL 116 5.495 -1.604 8.144 926 HG11 VAL 116 1HG1 VAL 116 6.603 0.206 5.964 927 HG12 VAL 116 2HG1 VAL 116 7.159 0.128 7.636 928 HG13 VAL 116 3HG1 VAL 116 5.538 0.722 7.274 929 HG21 VAL 116 3HG2 VAL 116 4.028 -2.572 6.420 930 HG22 VAL 116 1HG2 VAL 116 4.654 -1.432 5.225 931 HG23 VAL 116 2HG2 VAL 116 3.717 -0.846 6.599 932 H LYS 117 H LYS 117 7.722 -3.254 9.002 933 HA LYS 117 HA LYS 117 9.958 -1.450 9.085 934 HB2 LYS 117 2HB LYS 117 10.514 -2.361 11.230 935 HB3 LYS 117 3HB LYS 117 8.762 -2.264 11.151 936 HG2 LYS 117 2HG LYS 117 8.611 -4.679 10.766 937 HG3 LYS 117 3HG LYS 117 10.368 -4.815 10.751 938 HD2 LYS 117 2HD LYS 117 8.678 -3.948 13.134 939 HD3 LYS 117 3HD LYS 117 9.401 -5.541 12.913 940 HE2 LYS 117 2HE LYS 117 11.657 -4.508 12.964 941 HE3 LYS 117 3HE LYS 117 10.914 -2.928 13.224 942 HZ1 LYS 117 3HZ LYS 117 9.936 -3.852 15.293 943 HZ2 LYS 117 1HZ LYS 117 11.625 -3.793 15.313 944 HZ3 LYS 117 2HZ LYS 117 10.834 -5.263 15.060 945 H ASN 118 H ASN 118 9.571 -4.869 8.324 946 HA ASN 118 HA ASN 118 12.391 -5.420 8.033 947 HB2 ASN 118 2HB ASN 118 9.969 -7.077 7.159 948 HB3 ASN 118 3HB ASN 118 11.644 -7.633 7.109 949 HD21 ASN 118 1HD2 ASN 118 9.337 -8.696 8.607 950 HD22 ASN 118 2HD2 ASN 118 9.809 -8.694 10.269 951 H TYR 119 H TYR 119 9.705 -4.470 5.924 952 HA TYR 119 HA TYR 119 10.949 -4.610 3.419 953 HB2 TYR 119 2HB TYR 119 8.583 -3.992 3.597 954 HB3 TYR 119 3HB TYR 119 8.990 -2.526 4.476 955 HD1 TYR 119 HD1 TYR 119 10.112 -4.068 1.208 956 HD2 TYR 119 HD2 TYR 119 8.573 -0.605 3.185 957 HE1 TYR 119 HE1 TYR 119 10.119 -2.848 -0.922 958 HE2 TYR 119 HE2 TYR 119 8.583 0.612 1.048 959 HH TYR 119 HH TYR 119 9.557 0.543 -1.128 960 H GLN 120 H GLN 120 10.767 -1.773 5.608 961 HA GLN 120 HA GLN 120 12.712 -0.216 4.315 962 HB2 GLN 120 2HB GLN 120 11.801 -0.133 7.229 963 HB3 GLN 120 3HB GLN 120 12.785 1.104 6.450 964 HG2 GLN 120 2HG GLN 120 10.884 1.445 4.800 965 HG3 GLN 120 3HG GLN 120 9.908 0.381 5.811 966 HE21 GLN 120 1HE2 GLN 120 9.515 3.227 5.162 967 HE22 GLN 120 2HE2 GLN 120 9.445 4.052 6.672 968 H GLY 121 H GLY 121 13.010 -2.869 6.551 969 HA2 GLY 121 2HA GLY 121 15.640 -2.422 7.532 970 HA3 GLY 121 3HA GLY 121 14.776 -3.956 7.513 971 H TYR 122 H TYR 122 14.380 -4.360 4.769 972 HA TYR 122 HA TYR 122 17.108 -5.042 4.010 973 HB2 TYR 122 2HB TYR 122 16.136 -6.445 2.240 974 HB3 TYR 122 3HB TYR 122 15.570 -6.852 3.839 975 HD1 TYR 122 HD2 TYR 122 14.368 -4.630 0.998 976 HD2 TYR 122 HD1 TYR 122 13.393 -7.648 3.867 977 HE1 TYR 122 HE2 TYR 122 12.096 -4.801 0.068 978 HE2 TYR 122 HE1 TYR 122 11.137 -7.829 2.917 979 HH TYR 122 HH TYR 122 10.296 -6.674 -0.029 980 H VAL 123 H VAL 123 14.812 -2.621 3.181 981 HA VAL 123 HA VAL 123 15.913 -1.789 0.695 982 HB VAL 123 HB VAL 123 14.402 -0.173 2.809 983 HG11 VAL 123 1HG1 VAL 123 14.115 1.589 1.060 984 HG12 VAL 123 2HG1 VAL 123 15.240 0.717 0.017 985 HG13 VAL 123 3HG1 VAL 123 15.800 1.396 1.547 986 HG21 VAL 123 3HG2 VAL 123 12.494 -0.315 1.258 987 HG22 VAL 123 1HG2 VAL 123 13.069 -1.934 1.657 988 HG23 VAL 123 2HG2 VAL 123 13.475 -1.218 0.102 989 H GLN 124 H GLN 124 16.575 -0.724 4.072 990 HA GLN 124 HA GLN 124 18.460 1.278 3.332 991 HB2 GLN 124 2HB GLN 124 19.008 1.435 5.730 992 HB3 GLN 124 3HB GLN 124 17.267 1.395 5.477 993 HG2 GLN 124 2HG GLN 124 17.136 -0.900 6.190 994 HG3 GLN 124 3HG GLN 124 18.893 -1.043 6.220 995 HE21 GLN 124 1HE2 GLN 124 18.857 -1.746 8.343 996 HE22 GLN 124 2HE2 GLN 124 18.552 -0.674 9.665 997 H ASP 125 H ASP 125 18.820 -2.102 4.324 998 HA ASP 125 HA ASP 125 21.706 -2.088 4.360 999 HB2 ASP 125 2HB ASP 125 19.596 -4.268 4.562 1000 HB3 ASP 125 3HB ASP 125 21.303 -4.675 4.434 1001 H GLY 126 H GLY 126 19.311 -2.337 1.923 1002 HA2 GLY 126 2HA GLY 126 19.523 -2.283 -0.355 1003 HA3 GLY 126 3HA GLY 126 21.267 -2.189 -0.146 1004 H HIS 127 H HIS 127 19.183 -4.748 1.045 1005 HA HIS 127 HA HIS 127 19.727 -6.521 -1.202 1006 HB2 HIS 127 2HB HIS 127 21.689 -7.005 0.202 1007 HB3 HIS 127 3HB HIS 127 20.679 -7.173 1.633 1008 HD1 HIS 127 HD1 HIS 127 21.670 -8.989 -1.501 1009 HD2 HIS 127 HD2 HIS 127 19.361 -9.668 1.890 1010 HE1 HIS 127 HE1 HIS 127 21.183 -11.445 -1.497 1011 HE2 HIS 127 HE2 HIS 127 19.963 -11.857 0.662 1012 H ASP 128 H ASP 128 17.660 -6.904 -1.660 1013 HA ASP 128 HA ASP 128 15.494 -6.957 0.150 1014 HB2 ASP 128 2HB ASP 128 15.006 -6.451 -2.130 1015 HB3 ASP 128 3HB ASP 128 15.857 -7.873 -2.721 1016 H HIS 129 H HIS 129 14.271 -8.642 0.967 1017 HA HIS 129 HA HIS 129 15.538 -11.328 1.172 1018 HB2 HIS 129 2HB HIS 129 13.955 -9.708 3.209 1019 HB3 HIS 129 3HB HIS 129 14.157 -11.445 3.386 1020 HD1 HIS 129 HD1 HIS 129 15.720 -11.703 5.264 1021 HD2 HIS 129 HD2 HIS 129 16.996 -8.734 2.651 1022 HE1 HIS 129 HE1 HIS 129 17.927 -10.927 6.160 1023 HE2 HIS 129 HE2 HIS 129 18.543 -8.983 4.698 1024 H ASP 130 H ASP 130 12.620 -9.521 0.406 1025 HA ASP 130 HA ASP 130 11.028 -12.031 0.274 1026 HB2 ASP 130 2HB ASP 130 10.094 -9.338 1.364 1027 HB3 ASP 130 3HB ASP 130 9.052 -10.737 1.116 1028 H PHE 131 H PHE 131 12.099 -11.493 -1.957 1029 HA PHE 131 HA PHE 131 11.880 -11.072 -4.149 1030 HB2 PHE 131 2HB PHE 131 9.762 -11.873 -5.182 1031 HB3 PHE 131 3HB PHE 131 10.404 -12.970 -3.978 1032 HD1 PHE 131 HD2 PHE 131 7.687 -10.529 -4.691 1033 HD2 PHE 131 HD1 PHE 131 9.085 -13.583 -2.035 1034 HE1 PHE 131 HE2 PHE 131 5.477 -10.635 -3.630 1035 HE2 PHE 131 HE1 PHE 131 6.855 -13.678 -0.991 1036 HZ PHE 131 HZ PHE 131 5.052 -12.202 -1.786 1037 H GLY 132 H GLY 132 11.514 -8.643 -2.563 1038 HA2 GLY 132 2HA GLY 132 9.588 -6.889 -3.675 1039 HA3 GLY 132 3HA GLY 132 11.084 -6.421 -2.874 1040 H ARG 133 H ARG 133 12.962 -6.034 -4.121 1041 HA ARG 133 HA ARG 133 13.295 -6.583 -6.851 1042 HB2 ARG 133 2HB ARG 133 13.080 -4.294 -7.844 1043 HB3 ARG 133 3HB ARG 133 11.549 -4.966 -7.302 1044 HG2 ARG 133 2HG ARG 133 11.850 -3.556 -5.173 1045 HG3 ARG 133 3HG ARG 133 13.145 -2.725 -6.043 1046 HD2 ARG 133 2HD ARG 133 11.490 -2.210 -7.875 1047 HD3 ARG 133 3HD ARG 133 10.226 -2.913 -6.860 1048 HE ARG 133 HE ARG 133 11.656 -0.833 -5.514 1049 HH11 ARG 133 1HH1 ARG 133 9.051 -1.369 -7.849 1050 HH12 ARG 133 2HH1 ARG 133 8.311 0.168 -7.523 1051 HH21 ARG 133 1HH2 ARG 133 10.736 1.219 -5.236 1052 HH22 ARG 133 2HH2 ARG 133 9.262 1.619 -6.056 1053 H ASP 134 H ASP 134 15.044 -4.764 -7.717 1054 HA ASP 134 HA ASP 134 17.372 -5.412 -6.280 1055 HB2 ASP 134 2HB ASP 134 17.215 -4.910 -8.776 1056 HB3 ASP 134 3HB ASP 134 17.079 -3.208 -8.374 1057 HA PRO 135 HA PRO 135 17.985 -2.400 -2.904 1058 HB2 PRO 135 2HB PRO 135 20.621 -1.740 -4.024 1059 HB3 PRO 135 3HB PRO 135 20.231 -2.689 -2.587 1060 HG2 PRO 135 2HG PRO 135 20.758 -3.622 -5.355 1061 HG3 PRO 135 3HG PRO 135 21.010 -4.469 -3.807 1062 HD2 PRO 135 2HD PRO 135 19.030 -5.230 -5.381 1063 HD3 PRO 135 3HD PRO 135 18.726 -5.084 -3.632 1064 H LYS 136 H LYS 136 18.998 -1.313 -6.187 1065 HA LYS 136 HA LYS 136 19.047 1.453 -5.519 1066 HB2 LYS 136 2HB LYS 136 19.355 1.883 -7.894 1067 HB3 LYS 136 3HB LYS 136 20.301 0.473 -7.427 1068 HG2 LYS 136 2HG LYS 136 18.465 -0.975 -8.378 1069 HG3 LYS 136 3HG LYS 136 17.695 0.498 -8.972 1070 HD2 LYS 136 2HD LYS 136 18.939 -0.512 -10.786 1071 HD3 LYS 136 3HD LYS 136 19.754 0.986 -10.325 1072 HE2 LYS 136 2HE LYS 136 21.409 -0.340 -9.038 1073 HE3 LYS 136 3HE LYS 136 20.574 -1.823 -9.515 1074 HZ1 LYS 136 3HZ LYS 136 21.089 -1.293 -11.835 1075 HZ2 LYS 136 1HZ LYS 136 22.492 -1.446 -10.906 1076 HZ3 LYS 136 2HZ LYS 136 21.934 0.084 -11.347 1077 H TYR 137 H TYR 137 16.486 -0.637 -6.739 1078 HA TYR 137 HA TYR 137 14.611 1.569 -7.174 1079 HB2 TYR 137 2HB TYR 137 14.149 -1.442 -7.381 1080 HB3 TYR 137 3HB TYR 137 13.057 -0.179 -7.947 1081 HD1 TYR 137 HD2 TYR 137 14.180 1.543 -9.682 1082 HD2 TYR 137 HD1 TYR 137 15.570 -2.436 -8.979 1083 HE1 TYR 137 HE2 TYR 137 15.311 1.549 -11.863 1084 HE2 TYR 137 HE1 TYR 137 16.715 -2.426 -11.158 1085 HH TYR 137 HH TYR 137 16.508 -1.238 -13.347 1086 H LEU 138 H LEU 138 15.416 -0.764 -4.700 1087 HA LEU 138 HA LEU 138 13.072 -0.782 -3.144 1088 HB2 LEU 138 2HB LEU 138 15.997 -1.043 -2.351 1089 HB3 LEU 138 3HB LEU 138 14.701 -1.200 -1.184 1090 HG LEU 138 HG LEU 138 15.141 -3.035 -3.573 1091 HD11 LEU 138 1HD1 LEU 138 15.619 -3.547 -0.613 1092 HD12 LEU 138 2HD1 LEU 138 16.860 -3.350 -1.853 1093 HD13 LEU 138 3HD1 LEU 138 15.776 -4.735 -1.912 1094 HD21 LEU 138 3HD2 LEU 138 12.756 -2.872 -3.051 1095 HD22 LEU 138 1HD2 LEU 138 13.075 -3.217 -1.348 1096 HD23 LEU 138 2HD2 LEU 138 13.373 -4.452 -2.576 1097 H HIS 139 H HIS 139 12.126 0.736 -1.892 1098 HA HIS 139 HA HIS 139 13.564 3.159 -1.057 1099 HB2 HIS 139 2HB HIS 139 12.626 3.689 -3.290 1100 HB3 HIS 139 3HB HIS 139 11.023 3.192 -2.757 1101 HD1 HIS 139 HD1 HIS 139 9.601 5.160 -2.252 1102 HD2 HIS 139 HD2 HIS 139 13.594 5.916 -1.400 1103 HE1 HIS 139 HE1 HIS 139 9.672 7.512 -1.392 1104 HE2 HIS 139 HE2 HIS 139 12.124 8.007 -1.152 1105 H GLN 140 H GLN 140 13.054 3.576 0.988 1106 HA GLN 140 HA GLN 140 10.975 2.268 2.449 1107 HB2 GLN 140 2HB GLN 140 12.624 4.709 3.258 1108 HB3 GLN 140 3HB GLN 140 11.676 3.696 4.343 1109 HG2 GLN 140 2HG GLN 140 13.184 1.784 3.804 1110 HG3 GLN 140 3HG GLN 140 14.163 2.877 2.825 1111 HE21 GLN 140 1HE2 GLN 140 14.974 1.358 5.165 1112 HE22 GLN 140 2HE2 GLN 140 15.530 2.509 6.319 1113 H PHE 141 H PHE 141 9.138 3.215 3.443 1114 HA PHE 141 HA PHE 141 7.814 5.451 2.263 1115 HB2 PHE 141 2HB PHE 141 7.293 4.189 4.990 1116 HB3 PHE 141 3HB PHE 141 6.173 5.184 4.065 1117 HD1 PHE 141 HD1 PHE 141 5.568 4.268 1.657 1118 HD2 PHE 141 HD2 PHE 141 7.097 1.861 4.842 1119 HE1 PHE 141 HE1 PHE 141 4.630 2.258 0.607 1120 HE2 PHE 141 HE2 PHE 141 6.152 -0.135 3.787 1121 HZ PHE 141 HZ PHE 141 4.920 0.054 1.661 1122 H GLU 142 H GLU 142 9.303 7.165 2.336 1123 HA GLU 142 HA GLU 142 10.417 8.057 4.871 1124 HB2 GLU 142 2HB GLU 142 11.460 9.888 3.452 1125 HB3 GLU 142 3HB GLU 142 11.949 8.244 3.078 1126 HG2 GLU 142 2HG GLU 142 10.571 8.211 1.090 1127 HG3 GLU 142 3HG GLU 142 9.860 9.769 1.507 1128 H GLY 143 H GLY 143 8.821 8.809 6.140 1129 HA2 GLY 143 2HA GLY 143 7.976 11.447 5.966 1130 HA3 GLY 143 3HA GLY 143 6.678 10.476 5.269 1131 H GLU 144 H GLU 144 5.113 10.376 6.749 1132 HA GLU 144 HA GLU 144 5.667 9.641 9.535 1133 HB2 GLU 144 2HB GLU 144 4.203 12.229 8.803 1134 HB3 GLU 144 3HB GLU 144 4.429 11.601 10.430 1135 HG2 GLU 144 2HG GLU 144 6.849 11.970 10.273 1136 HG3 GLU 144 3HG GLU 144 6.682 12.513 8.607 1137 H THR 145 H THR 145 3.168 10.833 7.287 1138 HA THR 145 HA THR 145 1.067 9.319 8.658 1139 HB THR 145 HB THR 145 0.862 11.408 6.428 1140 HG1 THR 145 HG1 THR 145 0.917 11.541 9.233 1141 HG21 THR 145 3HG2 THR 145 -1.304 10.214 8.206 1142 HG22 THR 145 1HG2 THR 145 -1.116 9.912 6.477 1143 HG23 THR 145 2HG2 THR 145 -1.530 11.529 7.052 1144 H PHE 146 H PHE 146 0.646 7.323 7.947 1145 HA PHE 146 HA PHE 146 1.202 6.437 5.210 1146 HB2 PHE 146 2HB PHE 146 0.356 5.017 7.772 1147 HB3 PHE 146 3HB PHE 146 0.309 4.193 6.216 1148 HD1 PHE 146 HD2 PHE 146 2.658 6.065 8.482 1149 HD2 PHE 146 HD1 PHE 146 2.233 3.138 5.386 1150 HE1 PHE 146 HE2 PHE 146 5.042 5.483 8.689 1151 HE2 PHE 146 HE1 PHE 146 4.608 2.572 5.600 1152 HZ PHE 146 HZ PHE 146 6.016 3.729 7.241 1153 H TYR 147 H TYR 147 -0.319 5.824 3.741 1154 HA TYR 147 HA TYR 147 -3.205 6.037 4.412 1155 HB2 TYR 147 2HB TYR 147 -1.726 6.643 1.821 1156 HB3 TYR 147 3HB TYR 147 -3.449 6.278 1.821 1157 HD1 TYR 147 HD1 TYR 147 -1.006 8.576 3.540 1158 HD2 TYR 147 HD2 TYR 147 -4.945 8.073 1.967 1159 HE1 TYR 147 HE1 TYR 147 -1.499 10.937 3.992 1160 HE2 TYR 147 HE2 TYR 147 -5.422 10.437 2.414 1161 HH TYR 147 HH TYR 147 -2.992 12.691 3.195 1162 H ILE 148 H ILE 148 -4.436 4.299 4.043 1163 HA ILE 148 HA ILE 148 -3.294 1.938 2.662 1164 HB ILE 148 HB ILE 148 -5.208 2.005 5.046 1165 HG12 ILE 148 2HG1 ILE 148 -2.332 0.997 4.770 1166 HG13 ILE 148 3HG1 ILE 148 -2.863 2.375 5.724 1167 HG21 ILE 148 1HG2 ILE 148 -4.194 -0.410 3.505 1168 HG22 ILE 148 2HG2 ILE 148 -5.842 0.221 3.451 1169 HG23 ILE 148 3HG2 ILE 148 -5.203 -0.450 4.949 1170 HD11 ILE 148 3HD1 ILE 148 -4.108 0.813 7.194 1171 HD12 ILE 148 1HD1 ILE 148 -2.367 0.533 7.165 1172 HD13 ILE 148 2HD1 ILE 148 -3.442 -0.534 6.265 1173 H ILE 149 H ILE 149 -4.223 1.727 0.766 1174 HA ILE 149 HA ILE 149 -6.929 2.769 0.209 1175 HB ILE 149 HB ILE 149 -4.772 1.860 -1.764 1176 HG12 ILE 149 2HG1 ILE 149 -3.877 3.773 -0.534 1177 HG13 ILE 149 3HG1 ILE 149 -4.307 4.289 -2.156 1178 HG21 ILE 149 1HG2 ILE 149 -7.023 1.812 -2.732 1179 HG22 ILE 149 2HG2 ILE 149 -6.081 3.118 -3.448 1180 HG23 ILE 149 3HG2 ILE 149 -7.304 3.485 -2.231 1181 HD11 ILE 149 3HD1 ILE 149 -6.356 5.328 -1.266 1182 HD12 ILE 149 1HD1 ILE 149 -4.892 5.978 -0.529 1183 HD13 ILE 149 2HD1 ILE 149 -5.888 4.828 0.361 1184 H GLU 150 H GLU 150 -8.456 1.215 0.454 1185 HA GLU 150 HA GLU 150 -7.988 -1.589 0.351 1186 HB2 GLU 150 2HB GLU 150 -9.793 -0.633 1.728 1187 HB3 GLU 150 3HB GLU 150 -10.601 -0.011 0.294 1188 HG2 GLU 150 2HG GLU 150 -11.032 -2.311 -0.474 1189 HG3 GLU 150 3HG GLU 150 -10.190 -2.955 0.931 1190 H GLN 151 H GLN 151 -7.364 -2.461 -1.511 1191 HA GLN 151 HA GLN 151 -8.805 -1.904 -4.043 1192 HB2 GLN 151 2HB GLN 151 -6.037 -3.097 -3.535 1193 HB3 GLN 151 3HB GLN 151 -6.773 -2.959 -5.126 1194 HG2 GLN 151 2HG GLN 151 -6.035 -0.636 -3.315 1195 HG3 GLN 151 3HG GLN 151 -5.110 -1.183 -4.712 1196 HE21 GLN 151 1HE2 GLN 151 -5.984 -0.840 -6.813 1197 HE22 GLN 151 2HE2 GLN 151 -7.199 0.353 -7.094 1198 H ARG 152 H ARG 152 -10.532 -3.312 -3.925 1199 HA ARG 152 HA ARG 152 -10.342 -6.047 -3.060 1200 HB2 ARG 152 2HB ARG 152 -12.476 -4.452 -3.317 1201 HB3 ARG 152 3HB ARG 152 -12.500 -5.053 -4.967 1202 HG2 ARG 152 2HG ARG 152 -13.986 -6.513 -3.904 1203 HG3 ARG 152 3HG ARG 152 -12.483 -7.436 -3.827 1204 HD2 ARG 152 2HD ARG 152 -13.630 -7.552 -1.693 1205 HD3 ARG 152 3HD ARG 152 -12.143 -6.619 -1.502 1206 HE ARG 152 HE ARG 152 -14.616 -5.130 -2.000 1207 HH11 ARG 152 1HH1 ARG 152 -12.292 -6.191 0.431 1208 HH12 ARG 152 2HH1 ARG 152 -12.798 -5.001 1.590 1209 HH21 ARG 152 1HH2 ARG 152 -15.227 -3.576 -0.465 1210 HH22 ARG 152 2HH2 ARG 152 -14.448 -3.530 1.084 1211 H LEU 153 H LEU 153 -10.804 -7.922 -4.657 1212 HA LEU 153 HA LEU 153 -9.212 -7.879 -7.020 1213 HB2 LEU 153 2HB LEU 153 -11.220 -9.821 -5.862 1214 HB3 LEU 153 3HB LEU 153 -10.754 -10.022 -7.540 1215 HG LEU 153 HG LEU 153 -8.884 -10.156 -5.140 1216 HD11 LEU 153 1HD1 LEU 153 -10.307 -12.139 -5.378 1217 HD12 LEU 153 2HD1 LEU 153 -8.640 -12.526 -5.788 1218 HD13 LEU 153 3HD1 LEU 153 -9.832 -12.309 -7.071 1219 HD21 LEU 153 3HD2 LEU 153 -8.236 -10.442 -8.105 1220 HD22 LEU 153 1HD2 LEU 153 -7.123 -10.773 -6.775 1221 HD23 LEU 153 2HD2 LEU 153 -7.708 -9.135 -7.042 1222 H GLU 154 H GLU 154 -10.125 -8.427 -9.178 1223 HA GLU 154 HA GLU 154 -12.012 -6.656 -10.284 1224 HB2 GLU 154 2HB GLU 154 -11.136 -9.405 -11.270 1225 HB3 GLU 154 3HB GLU 154 -11.898 -8.160 -12.263 1226 HG2 GLU 154 2HG GLU 154 -9.980 -6.778 -12.213 1227 HG3 GLU 154 3HG GLU 154 -9.290 -7.611 -10.829 1228 H HIS 155 H HIS 155 -12.321 -9.883 -8.923 1229 HA HIS 155 HA HIS 155 -15.095 -10.273 -9.039 1230 HB2 HIS 155 2HB HIS 155 -13.088 -10.966 -6.834 1231 HB3 HIS 155 3HB HIS 155 -14.744 -11.561 -6.866 1232 HD1 HIS 155 HD1 HIS 155 -15.097 -13.726 -8.019 1233 HD2 HIS 155 HD2 HIS 155 -11.519 -11.935 -9.165 1234 HE1 HIS 155 HE1 HIS 155 -13.892 -15.448 -9.392 1235 HE2 HIS 155 HE2 HIS 155 -11.759 -14.328 -10.126 1236 H HIS 156 H HIS 156 -16.435 -8.528 -8.628 1237 HA HIS 156 HA HIS 156 -15.754 -6.420 -6.781 1238 HB2 HIS 156 2HB HIS 156 -16.934 -5.948 -8.911 1239 HB3 HIS 156 3HB HIS 156 -18.315 -6.896 -8.369 1240 HD1 HIS 156 HD1 HIS 156 -16.410 -3.758 -7.359 1241 HD2 HIS 156 HD2 HIS 156 -20.217 -5.403 -7.071 1242 HE1 HIS 156 HE1 HIS 156 -17.837 -1.980 -6.320 1243 HE2 HIS 156 HE2 HIS 156 -20.167 -2.927 -6.336 1244 H HIS 157 H HIS 157 -15.643 -7.399 -4.775 1245 HA HIS 157 HA HIS 157 -18.057 -8.572 -3.555 1246 HB2 HIS 157 2HB HIS 157 -15.168 -8.392 -2.614 1247 HB3 HIS 157 3HB HIS 157 -16.472 -8.981 -1.592 1248 HD1 HIS 157 HD1 HIS 157 -15.367 -11.302 -1.422 1249 HD2 HIS 157 HD2 HIS 157 -16.378 -10.220 -5.302 1250 HE1 HIS 157 HE1 HIS 157 -15.090 -13.381 -2.802 1251 HE2 HIS 157 HE2 HIS 157 -15.943 -12.747 -5.079 1252 H HIS 158 H HIS 158 -19.368 -6.748 -3.369 1253 HA HIS 158 HA HIS 158 -18.498 -4.653 -1.442 1254 HB2 HIS 158 2HB HIS 158 -18.893 -3.829 -3.802 1255 HB3 HIS 158 3HB HIS 158 -20.565 -4.364 -3.685 1256 HD1 HIS 158 HD1 HIS 158 -18.260 -2.065 -1.666 1257 HD2 HIS 158 HD2 HIS 158 -22.199 -2.284 -2.995 1258 HE1 HIS 158 HE1 HIS 158 -19.395 -0.009 -0.770 1259 HE2 HIS 158 HE2 HIS 158 -21.790 -0.223 -1.491 1260 H HIS 159 H HIS 159 -19.414 -7.122 -0.619 1261 HA HIS 159 HA HIS 159 -21.554 -6.462 1.144 1262 HB2 HIS 159 2HB HIS 159 -23.256 -8.090 0.416 1263 HB3 HIS 159 3HB HIS 159 -22.926 -6.975 -0.907 1264 HD1 HIS 159 HD1 HIS 159 -23.441 -10.447 -0.342 1265 HD2 HIS 159 HD2 HIS 159 -20.841 -8.296 -2.777 1266 HE1 HIS 159 HE1 HIS 159 -22.682 -12.050 -2.110 1267 HE2 HIS 159 HE2 HIS 159 -21.034 -10.770 -3.495 1268 H HIS 160 H HIS 160 -19.609 -8.917 -0.395 1269 HA HIS 160 HA HIS 160 -18.621 -10.138 1.960 1270 HB2 HIS 160 2HB HIS 160 -20.896 -11.175 1.992 1271 HB3 HIS 160 3HB HIS 160 -20.688 -11.726 0.335 1272 HD1 HIS 160 HD1 HIS 160 -19.009 -13.737 -0.034 1273 HD2 HIS 160 HD2 HIS 160 -19.741 -12.800 3.948 1274 HE1 HIS 160 HE1 HIS 160 -18.204 -15.715 1.287 1275 HE2 HIS 160 HE2 HIS 160 -18.433 -15.002 3.681 Start of MODEL 9 1 H1 MET 1 1H MET 1 -30.833 8.020 1.338 2 H2 MET 1 2H MET 1 -29.537 9.020 0.927 3 H3 MET 1 3H MET 1 -30.447 9.345 2.306 4 HA MET 1 HA MET 1 -28.327 8.364 2.861 5 HB2 MET 1 2HB MET 1 -29.217 6.582 4.351 6 HB3 MET 1 3HB MET 1 -30.226 8.017 4.372 7 HG2 MET 1 2HG MET 1 -31.842 6.890 2.859 8 HG3 MET 1 3HG MET 1 -30.833 5.445 2.882 9 HE1 MET 1 3HE MET 1 -33.223 7.789 4.987 10 HE2 MET 1 1HE MET 1 -31.712 7.908 5.892 11 HE3 MET 1 2HE MET 1 -33.095 7.066 6.589 12 H VAL 2 H VAL 2 -29.247 7.404 -0.044 13 HA VAL 2 HA VAL 2 -27.532 4.981 -0.022 14 HB VAL 2 HB VAL 2 -28.517 4.380 -2.247 15 HG11 VAL 2 1HG1 VAL 2 -30.660 3.500 -1.370 16 HG12 VAL 2 2HG1 VAL 2 -30.539 4.580 0.022 17 HG13 VAL 2 3HG1 VAL 2 -29.345 3.301 -0.210 18 HG21 VAL 2 3HG2 VAL 2 -29.326 6.565 -3.009 19 HG22 VAL 2 1HG2 VAL 2 -30.520 6.611 -1.711 20 HG23 VAL 2 2HG2 VAL 2 -30.655 5.405 -2.997 21 H GLU 3 H GLU 3 -25.564 5.565 -0.411 22 HA GLU 3 HA GLU 3 -24.761 7.881 -1.930 23 HB2 GLU 3 2HB GLU 3 -23.216 5.644 -0.538 24 HB3 GLU 3 3HB GLU 3 -22.408 6.920 -1.444 25 HG2 GLU 3 2HG GLU 3 -22.396 7.377 0.972 26 HG3 GLU 3 3HG GLU 3 -23.275 8.613 0.072 27 HA PRO 4 HA PRO 4 -24.156 6.124 -6.062 28 HB2 PRO 4 2HB PRO 4 -21.312 7.158 -5.856 29 HB3 PRO 4 3HB PRO 4 -22.507 7.389 -7.154 30 HG2 PRO 4 2HG PRO 4 -21.986 9.366 -5.466 31 HG3 PRO 4 3HG PRO 4 -23.659 9.057 -5.994 32 HD2 PRO 4 2HD PRO 4 -22.349 8.387 -3.369 33 HD3 PRO 4 3HD PRO 4 -24.010 8.932 -3.694 34 H GLY 5 H GLY 5 -23.285 4.261 -6.996 35 HA2 GLY 5 2HA GLY 5 -22.509 2.130 -5.380 36 HA3 GLY 5 3HA GLY 5 -22.363 2.177 -7.130 37 H VAL 6 H VAL 6 -20.738 2.628 -4.105 38 HA VAL 6 HA VAL 6 -18.248 3.656 -4.976 39 HB VAL 6 HB VAL 6 -17.375 2.940 -2.747 40 HG11 VAL 6 1HG1 VAL 6 -18.871 4.322 -1.345 41 HG12 VAL 6 2HG1 VAL 6 -20.116 4.258 -2.596 42 HG13 VAL 6 3HG1 VAL 6 -18.584 5.072 -2.917 43 HG21 VAL 6 3HG2 VAL 6 -18.547 0.779 -2.524 44 HG22 VAL 6 1HG2 VAL 6 -20.092 1.616 -2.347 45 HG23 VAL 6 2HG2 VAL 6 -18.843 1.795 -1.111 46 H ALA 7 H ALA 7 -16.156 2.464 -4.868 47 HA ALA 7 HA ALA 7 -16.244 -0.346 -5.679 48 HB1 ALA 7 3HB ALA 7 -16.828 0.878 -7.753 49 HB2 ALA 7 1HB ALA 7 -15.247 0.105 -7.893 50 HB3 ALA 7 2HB ALA 7 -15.356 1.844 -7.608 51 H LYS 8 H LYS 8 -13.869 -0.794 -6.655 52 HA LYS 8 HA LYS 8 -11.926 -0.350 -4.593 53 HB2 LYS 8 2HB LYS 8 -10.478 -1.732 -5.950 54 HB3 LYS 8 3HB LYS 8 -12.099 -2.393 -6.105 55 HG2 LYS 8 2HG LYS 8 -12.278 -1.017 -8.293 56 HG3 LYS 8 3HG LYS 8 -10.536 -0.794 -8.145 57 HD2 LYS 8 2HD LYS 8 -10.902 -2.648 -9.638 58 HD3 LYS 8 3HD LYS 8 -10.286 -3.315 -8.125 59 HE2 LYS 8 2HE LYS 8 -12.488 -4.077 -7.483 60 HE3 LYS 8 3HE LYS 8 -13.242 -3.198 -8.816 61 HZ1 LYS 8 3HZ LYS 8 -12.085 -4.658 -10.371 62 HZ2 LYS 8 1HZ LYS 8 -13.071 -5.537 -9.321 63 HZ3 LYS 8 2HZ LYS 8 -11.404 -5.509 -9.083 64 H LEU 9 H LEU 9 -9.706 0.613 -5.117 65 HA LEU 9 HA LEU 9 -9.834 3.163 -6.391 66 HB2 LEU 9 2HB LEU 9 -8.207 2.658 -4.598 67 HB3 LEU 9 3HB LEU 9 -7.403 1.497 -5.637 68 HG LEU 9 HG LEU 9 -6.719 3.341 -7.169 69 HD11 LEU 9 1HD1 LEU 9 -8.013 5.205 -5.159 70 HD12 LEU 9 2HD1 LEU 9 -8.556 4.899 -6.811 71 HD13 LEU 9 3HD1 LEU 9 -7.010 5.691 -6.529 72 HD21 LEU 9 3HD2 LEU 9 -5.911 3.843 -4.285 73 HD22 LEU 9 1HD2 LEU 9 -5.028 4.373 -5.722 74 HD23 LEU 9 2HD2 LEU 9 -5.188 2.652 -5.372 75 H THR 10 H THR 10 -9.565 3.676 -8.484 76 HA THR 10 HA THR 10 -9.685 1.806 -10.551 77 HB THR 10 HB THR 10 -8.713 4.679 -10.873 78 HG1 THR 10 HG1 THR 10 -11.344 4.579 -11.178 79 HG21 THR 10 3HG2 THR 10 -10.425 2.925 -12.681 80 HG22 THR 10 1HG2 THR 10 -8.722 3.315 -12.944 81 HG23 THR 10 2HG2 THR 10 -9.941 4.590 -13.012 82 H THR 11 H THR 11 -8.138 0.885 -11.877 83 HA THR 11 HA THR 11 -5.961 -0.068 -10.504 84 HB THR 11 HB THR 11 -5.271 -1.160 -12.684 85 HG1 THR 11 HG1 THR 11 -5.849 0.011 -14.362 86 HG21 THR 11 3HG2 THR 11 -6.975 -2.234 -11.247 87 HG22 THR 11 1HG2 THR 11 -7.333 -2.498 -12.954 88 HG23 THR 11 2HG2 THR 11 -8.249 -1.299 -12.035 89 H TYR 12 H TYR 12 -5.871 2.553 -12.929 90 HA TYR 12 HA TYR 12 -3.134 2.536 -13.510 91 HB2 TYR 12 2HB TYR 12 -3.404 4.764 -14.427 92 HB3 TYR 12 3HB TYR 12 -4.845 3.836 -14.801 93 HD1 TYR 12 HD1 TYR 12 -7.024 4.441 -13.783 94 HD2 TYR 12 HD2 TYR 12 -3.515 6.704 -12.865 95 HE1 TYR 12 HE1 TYR 12 -8.411 6.226 -12.826 96 HE2 TYR 12 HE2 TYR 12 -4.912 8.484 -11.907 97 HH TYR 12 HH TYR 12 -8.223 8.086 -11.257 98 H ALA 13 H ALA 13 -4.864 3.940 -10.827 99 HA ALA 13 HA ALA 13 -2.828 5.697 -9.865 100 HB1 ALA 13 3HB ALA 13 -5.215 6.082 -9.456 101 HB2 ALA 13 1HB ALA 13 -4.345 5.951 -7.929 102 HB3 ALA 13 2HB ALA 13 -5.310 4.595 -8.510 103 H SER 14 H SER 14 -3.879 2.403 -9.107 104 HA SER 14 HA SER 14 -2.170 2.067 -6.820 105 HB2 SER 14 2HB SER 14 -2.960 -0.292 -6.882 106 HB3 SER 14 3HB SER 14 -4.296 0.855 -6.970 107 HG SER 14 HG SER 14 -4.049 -1.087 -8.518 108 H LYS 15 H LYS 15 -1.870 1.495 -10.273 109 HA LYS 15 HA LYS 15 0.433 -0.160 -10.281 110 HB2 LYS 15 2HB LYS 15 -0.379 1.926 -12.364 111 HB3 LYS 15 3HB LYS 15 0.807 0.648 -12.610 112 HG2 LYS 15 2HG LYS 15 -2.162 0.305 -12.172 113 HG3 LYS 15 3HG LYS 15 -1.280 0.050 -13.677 114 HD2 LYS 15 2HD LYS 15 -0.100 -1.863 -12.704 115 HD3 LYS 15 3HD LYS 15 -0.849 -1.567 -11.130 116 HE2 LYS 15 2HE LYS 15 -3.070 -2.043 -12.111 117 HE3 LYS 15 3HE LYS 15 -2.306 -2.365 -13.672 118 HZ1 LYS 15 3HZ LYS 15 -2.718 -4.412 -12.500 119 HZ2 LYS 15 1HZ LYS 15 -1.843 -3.875 -11.158 120 HZ3 LYS 15 2HZ LYS 15 -1.048 -4.164 -12.620 121 H GLN 16 H GLN 16 0.033 3.360 -10.449 122 HA GLN 16 HA GLN 16 2.810 3.992 -10.623 123 HB2 GLN 16 2HB GLN 16 0.392 5.712 -9.932 124 HB3 GLN 16 3HB GLN 16 2.010 6.349 -10.205 125 HG2 GLN 16 2HG GLN 16 0.398 4.807 -12.259 126 HG3 GLN 16 3HG GLN 16 0.516 6.564 -12.185 127 HE21 GLN 16 1HE2 GLN 16 1.291 4.798 -14.371 128 HE22 GLN 16 2HE2 GLN 16 2.975 5.065 -14.641 129 H ALA 17 H ALA 17 0.595 3.538 -7.949 130 HA ALA 17 HA ALA 17 2.155 4.747 -5.902 131 HB1 ALA 17 3HB ALA 17 0.079 2.546 -5.671 132 HB2 ALA 17 1HB ALA 17 -0.241 4.281 -5.634 133 HB3 ALA 17 2HB ALA 17 0.701 3.533 -4.343 134 H THR 18 H THR 18 1.776 1.333 -6.918 135 HA THR 18 HA THR 18 3.723 0.252 -5.157 136 HB THR 18 HB THR 18 3.648 -1.760 -6.709 137 HG1 THR 18 HG1 THR 18 1.458 -0.743 -8.078 138 HG21 THR 18 3HG2 THR 18 0.946 -0.679 -5.848 139 HG22 THR 18 1HG2 THR 18 2.076 -1.567 -4.820 140 HG23 THR 18 2HG2 THR 18 1.328 -2.365 -6.205 141 H ASP 19 H ASP 19 3.885 1.523 -8.421 142 HA ASP 19 HA ASP 19 6.523 0.831 -9.119 143 HB2 ASP 19 2HB ASP 19 4.871 1.676 -10.761 144 HB3 ASP 19 3HB ASP 19 4.878 3.255 -9.984 145 H MET 20 H MET 20 5.167 3.582 -7.389 146 HA MET 20 HA MET 20 7.496 5.165 -7.119 147 HB2 MET 20 2HB MET 20 4.994 5.791 -6.697 148 HB3 MET 20 3HB MET 20 5.216 5.112 -5.095 149 HG2 MET 20 2HG MET 20 5.526 7.459 -4.873 150 HG3 MET 20 3HG MET 20 7.146 6.760 -4.810 151 HE1 MET 20 3HE MET 20 5.025 7.053 -8.120 152 HE2 MET 20 1HE MET 20 5.401 8.705 -8.618 153 HE3 MET 20 2HE MET 20 4.470 8.415 -7.148 154 H GLY 21 H GLY 21 6.194 2.449 -5.312 155 HA2 GLY 21 2HA GLY 21 7.865 1.027 -4.156 156 HA3 GLY 21 3HA GLY 21 8.482 2.491 -3.402 157 H ALA 22 H ALA 22 5.267 1.062 -3.936 158 HA ALA 22 HA ALA 22 4.681 1.230 -1.035 159 HB1 ALA 22 3HB ALA 22 2.312 1.587 -1.599 160 HB2 ALA 22 1HB ALA 22 2.698 1.555 -3.324 161 HB3 ALA 22 2HB ALA 22 3.311 2.857 -2.304 162 H ILE 23 H ILE 23 3.729 -0.556 -0.119 163 HA ILE 23 HA ILE 23 4.099 -3.080 -1.540 164 HB ILE 23 HB ILE 23 3.670 -4.154 0.687 165 HG12 ILE 23 2HG1 ILE 23 3.354 -1.278 1.680 166 HG13 ILE 23 3HG1 ILE 23 2.104 -2.513 1.652 167 HG21 ILE 23 1HG2 ILE 23 5.739 -3.410 1.793 168 HG22 ILE 23 2HG2 ILE 23 5.768 -1.961 0.786 169 HG23 ILE 23 3HG2 ILE 23 5.965 -3.552 0.048 170 HD11 ILE 23 3HD1 ILE 23 2.925 -2.183 3.883 171 HD12 ILE 23 1HD1 ILE 23 4.578 -2.527 3.375 172 HD13 ILE 23 2HD1 ILE 23 3.352 -3.797 3.323 173 H TYR 24 H TYR 24 2.517 -4.481 -2.079 174 HA TYR 24 HA TYR 24 -0.293 -3.787 -1.562 175 HB2 TYR 24 2HB TYR 24 1.070 -5.102 -3.807 176 HB3 TYR 24 3HB TYR 24 -0.166 -6.176 -3.169 177 HD1 TYR 24 HD1 TYR 24 -2.384 -4.536 -2.415 178 HD2 TYR 24 HD2 TYR 24 0.254 -4.019 -5.730 179 HE1 TYR 24 HE1 TYR 24 -4.122 -3.277 -3.597 180 HE2 TYR 24 HE2 TYR 24 -1.486 -2.758 -6.910 181 HH TYR 24 HH TYR 24 -4.213 -1.564 -5.431 182 H VAL 25 H VAL 25 -1.213 -4.681 0.099 183 HA VAL 25 HA VAL 25 -0.243 -7.242 1.216 184 HB VAL 25 HB VAL 25 -0.898 -6.454 3.445 185 HG11 VAL 25 1HG1 VAL 25 0.956 -4.462 2.080 186 HG12 VAL 25 2HG1 VAL 25 1.413 -6.027 2.758 187 HG13 VAL 25 3HG1 VAL 25 0.848 -4.740 3.823 188 HG21 VAL 25 3HG2 VAL 25 -2.765 -4.972 2.861 189 HG22 VAL 25 1HG2 VAL 25 -1.651 -3.806 2.141 190 HG23 VAL 25 2HG2 VAL 25 -1.608 -4.116 3.879 191 H ASN 26 H ASN 26 -1.882 -8.508 2.296 192 HA ASN 26 HA ASN 26 -4.562 -8.309 1.084 193 HB2 ASN 26 2HB ASN 26 -4.884 -10.591 1.978 194 HB3 ASN 26 3HB ASN 26 -3.425 -10.497 1.005 195 HD21 ASN 26 1HD2 ASN 26 -4.129 -12.459 2.985 196 HD22 ASN 26 2HD2 ASN 26 -2.869 -12.428 4.167 197 H SER 27 H SER 27 -6.184 -9.386 2.958 198 HA SER 27 HA SER 27 -6.730 -7.244 4.749 199 HB2 SER 27 2HB SER 27 -8.504 -8.718 3.729 200 HB3 SER 27 3HB SER 27 -7.979 -10.027 4.787 201 HG SER 27 HG SER 27 -8.417 -8.454 6.547 202 H LYS 28 H LYS 28 -4.643 -9.936 5.047 203 HA LYS 28 HA LYS 28 -4.529 -9.893 7.954 204 HB2 LYS 28 2HB LYS 28 -2.606 -11.165 5.951 205 HB3 LYS 28 3HB LYS 28 -2.605 -11.435 7.693 206 HG2 LYS 28 2HG LYS 28 -4.806 -12.216 5.755 207 HG3 LYS 28 3HG LYS 28 -3.658 -13.310 6.531 208 HD2 LYS 28 2HD LYS 28 -4.623 -12.872 8.719 209 HD3 LYS 28 3HD LYS 28 -5.658 -11.601 8.061 210 HE2 LYS 28 2HE LYS 28 -6.876 -13.272 6.727 211 HE3 LYS 28 3HE LYS 28 -5.836 -14.552 7.364 212 HZ1 LYS 28 3HZ LYS 28 -7.567 -12.807 9.035 213 HZ2 LYS 28 1HZ LYS 28 -6.668 -14.136 9.562 214 HZ3 LYS 28 2HZ LYS 28 -7.988 -14.361 8.529 215 H GLY 29 H GLY 29 -2.566 -8.704 5.221 216 HA2 GLY 29 2HA GLY 29 -1.583 -6.472 5.397 217 HA3 GLY 29 3HA GLY 29 -1.182 -6.815 7.073 218 H ASP 30 H ASP 30 -0.739 -9.464 5.039 219 HA ASP 30 HA ASP 30 2.153 -9.340 5.096 220 HB2 ASP 30 2HB ASP 30 1.006 -11.489 5.448 221 HB3 ASP 30 3HB ASP 30 0.170 -11.350 3.907 222 H ARG 31 H ARG 31 3.454 -8.668 3.397 223 HA ARG 31 HA ARG 31 2.370 -7.410 1.103 224 HB2 ARG 31 2HB ARG 31 4.611 -6.974 0.348 225 HB3 ARG 31 3HB ARG 31 4.538 -6.713 2.071 226 HG2 ARG 31 2HG ARG 31 5.906 -8.990 0.616 227 HG3 ARG 31 3HG ARG 31 6.673 -7.662 1.480 228 HD2 ARG 31 2HD ARG 31 6.910 -9.398 3.018 229 HD3 ARG 31 3HD ARG 31 5.401 -8.676 3.576 230 HE ARG 31 HE ARG 31 4.232 -10.541 2.834 231 HH11 ARG 31 1HH1 ARG 31 7.599 -10.842 1.847 232 HH12 ARG 31 2HH1 ARG 31 7.439 -12.514 1.405 233 HH21 ARG 31 1HH2 ARG 31 4.031 -12.704 2.218 234 HH22 ARG 31 2HH2 ARG 31 5.415 -13.569 1.616 235 H ILE 32 H ILE 32 1.100 -8.681 -0.068 236 HA ILE 32 HA ILE 32 1.427 -11.419 -0.616 237 HB ILE 32 HB ILE 32 -0.455 -11.174 -2.207 238 HG12 ILE 32 2HG1 ILE 32 -0.175 -8.154 -1.811 239 HG13 ILE 32 3HG1 ILE 32 0.268 -9.016 -3.274 240 HG21 ILE 32 1HG2 ILE 32 -2.128 -10.247 -0.657 241 HG22 ILE 32 2HG2 ILE 32 -0.846 -9.485 0.289 242 HG23 ILE 32 3HG2 ILE 32 -0.951 -11.245 0.199 243 HD11 ILE 32 3HD1 ILE 32 -1.847 -7.879 -3.518 244 HD12 ILE 32 1HD1 ILE 32 -2.518 -8.770 -2.151 245 HD13 ILE 32 2HD1 ILE 32 -2.066 -9.624 -3.629 246 H VAL 33 H VAL 33 2.435 -8.585 -2.424 247 HA VAL 33 HA VAL 33 4.120 -10.163 -4.181 248 HB VAL 33 HB VAL 33 1.926 -10.061 -5.389 249 HG11 VAL 33 1HG1 VAL 33 1.083 -7.907 -4.592 250 HG12 VAL 33 2HG1 VAL 33 1.097 -7.955 -6.355 251 HG13 VAL 33 3HG1 VAL 33 2.345 -7.055 -5.489 252 HG21 VAL 33 3HG2 VAL 33 2.820 -9.351 -7.571 253 HG22 VAL 33 1HG2 VAL 33 4.002 -10.297 -6.664 254 HG23 VAL 33 2HG2 VAL 33 4.166 -8.541 -6.765 255 H ASN 34 H ASN 34 5.813 -8.940 -5.105 256 HA ASN 34 HA ASN 34 6.932 -6.773 -3.851 257 HB2 ASN 34 2HB ASN 34 8.227 -8.065 -5.429 258 HB3 ASN 34 3HB ASN 34 7.138 -7.658 -6.753 259 HD21 ASN 34 1HD2 ASN 34 8.594 -5.486 -4.313 260 HD22 ASN 34 2HD2 ASN 34 9.452 -4.522 -5.453 261 H GLU 35 H GLU 35 4.855 -6.745 -6.728 262 HA GLU 35 HA GLU 35 4.049 -3.977 -6.478 263 HB2 GLU 35 2HB GLU 35 6.350 -3.793 -7.463 264 HB3 GLU 35 3HB GLU 35 5.888 -4.872 -8.771 265 HG2 GLU 35 2HG GLU 35 4.221 -3.192 -9.530 266 HG3 GLU 35 3HG GLU 35 4.754 -2.104 -8.253 267 H SER 36 H SER 36 2.340 -3.474 -8.011 268 HA SER 36 HA SER 36 0.912 -5.753 -9.154 269 HB2 SER 36 2HB SER 36 -0.815 -3.970 -9.714 270 HB3 SER 36 3HB SER 36 -0.429 -4.081 -7.998 271 HG SER 36 HG SER 36 0.814 -2.227 -9.751 272 H ASN 37 H ASN 37 3.387 -5.407 -10.366 273 HA ASN 37 HA ASN 37 3.675 -3.803 -12.601 274 HB2 ASN 37 2HB ASN 37 5.449 -5.211 -11.519 275 HB3 ASN 37 3HB ASN 37 4.726 -6.649 -12.225 276 HD21 ASN 37 1HD2 ASN 37 7.402 -5.309 -12.520 277 HD22 ASN 37 2HD2 ASN 37 7.632 -5.158 -14.225 278 H VAL 38 H VAL 38 2.346 -7.081 -12.406 279 HA VAL 38 HA VAL 38 0.627 -6.520 -14.731 280 HB VAL 38 HB VAL 38 2.484 -8.032 -15.448 281 HG11 VAL 38 1HG1 VAL 38 2.627 -10.350 -14.644 282 HG12 VAL 38 2HG1 VAL 38 1.386 -10.014 -13.432 283 HG13 VAL 38 3HG1 VAL 38 2.945 -9.189 -13.353 284 HG21 VAL 38 3HG2 VAL 38 -0.259 -9.347 -15.461 285 HG22 VAL 38 1HG2 VAL 38 1.076 -9.741 -16.553 286 HG23 VAL 38 2HG2 VAL 38 0.331 -8.143 -16.609 287 H TYR 39 H TYR 39 -1.466 -7.333 -14.546 288 HA TYR 39 HA TYR 39 -2.648 -7.579 -12.021 289 HB2 TYR 39 2HB TYR 39 -4.714 -8.185 -13.204 290 HB3 TYR 39 3HB TYR 39 -3.882 -6.904 -14.074 291 HD1 TYR 39 HD2 TYR 39 -2.859 -7.346 -16.307 292 HD2 TYR 39 HD1 TYR 39 -4.912 -10.466 -14.211 293 HE1 TYR 39 HE2 TYR 39 -2.940 -8.693 -18.366 294 HE2 TYR 39 HE1 TYR 39 -4.993 -11.792 -16.268 295 HH TYR 39 HH TYR 39 -3.143 -11.122 -18.979 296 H THR 40 H THR 40 -1.168 -9.965 -14.032 297 HA THR 40 HA THR 40 -2.469 -12.308 -13.221 298 HB THR 40 HB THR 40 0.422 -12.112 -14.191 299 HG1 THR 40 HG1 THR 40 -1.731 -12.394 -15.983 300 HG21 THR 40 3HG2 THR 40 -0.334 -14.382 -13.518 301 HG22 THR 40 1HG2 THR 40 -0.083 -14.279 -15.265 302 HG23 THR 40 2HG2 THR 40 -1.720 -14.232 -14.605 303 H THR 41 H THR 41 0.667 -10.908 -12.147 304 HA THR 41 HA THR 41 1.146 -12.862 -10.119 305 HB THR 41 HB THR 41 2.997 -11.573 -11.198 306 HG1 THR 41 HG1 THR 41 2.693 -12.014 -8.505 307 HG21 THR 41 3HG2 THR 41 2.099 -9.235 -9.466 308 HG22 THR 41 1HG2 THR 41 1.977 -9.305 -11.229 309 HG23 THR 41 2HG2 THR 41 3.560 -9.300 -10.453 310 H PHE 42 H PHE 42 -0.506 -9.795 -10.215 311 HA PHE 42 HA PHE 42 -0.831 -9.272 -7.457 312 HB2 PHE 42 2HB PHE 42 -1.264 -7.540 -9.119 313 HB3 PHE 42 3HB PHE 42 -2.480 -8.525 -9.913 314 HD1 PHE 42 HD1 PHE 42 -1.771 -6.816 -6.650 315 HD2 PHE 42 HD2 PHE 42 -4.769 -8.183 -9.384 316 HE1 PHE 42 HE1 PHE 42 -3.511 -5.710 -5.320 317 HE2 PHE 42 HE2 PHE 42 -6.503 -7.064 -8.038 318 HZ PHE 42 HZ PHE 42 -5.872 -5.826 -6.002 319 H ARG 43 H ARG 43 -2.805 -11.060 -9.828 320 HA ARG 43 HA ARG 43 -5.000 -11.585 -8.093 321 HB2 ARG 43 2HB ARG 43 -5.287 -11.567 -10.547 322 HB3 ARG 43 3HB ARG 43 -4.208 -12.953 -10.705 323 HG2 ARG 43 2HG ARG 43 -5.833 -14.325 -9.383 324 HG3 ARG 43 3HG ARG 43 -6.926 -12.940 -9.333 325 HD2 ARG 43 2HD ARG 43 -5.971 -14.347 -11.840 326 HD3 ARG 43 3HD ARG 43 -7.548 -14.576 -11.081 327 HE ARG 43 HE ARG 43 -7.752 -12.023 -11.520 328 HH11 ARG 43 1HH1 ARG 43 -6.190 -14.323 -13.674 329 HH12 ARG 43 2HH1 ARG 43 -6.541 -13.410 -15.109 330 HH21 ARG 43 1HH2 ARG 43 -8.252 -10.851 -13.426 331 HH22 ARG 43 2HH2 ARG 43 -7.712 -11.444 -14.965 332 H ASN 44 H ASN 44 -2.291 -13.583 -9.267 333 HA ASN 44 HA ASN 44 -2.977 -16.003 -8.000 334 HB2 ASN 44 2HB ASN 44 -0.230 -14.964 -8.848 335 HB3 ASN 44 3HB ASN 44 -0.567 -16.636 -8.399 336 HD21 ASN 44 1HD2 ASN 44 0.386 -15.495 -10.938 337 HD22 ASN 44 2HD2 ASN 44 -0.732 -16.015 -12.143 338 H ALA 45 H ALA 45 -1.094 -13.237 -6.905 339 HA ALA 45 HA ALA 45 -0.068 -14.226 -4.487 340 HB1 ALA 45 3HB ALA 45 -0.882 -11.385 -5.179 341 HB2 ALA 45 1HB ALA 45 0.678 -12.129 -5.534 342 HB3 ALA 45 2HB ALA 45 0.191 -11.864 -3.859 343 H ILE 46 H ILE 46 -3.152 -12.609 -5.217 344 HA ILE 46 HA ILE 46 -4.164 -12.495 -2.539 345 HB ILE 46 HB ILE 46 -5.527 -12.183 -5.251 346 HG12 ILE 46 2HG1 ILE 46 -4.644 -10.121 -3.184 347 HG13 ILE 46 3HG1 ILE 46 -3.832 -10.458 -4.707 348 HG21 ILE 46 1HG2 ILE 46 -7.460 -11.192 -4.081 349 HG22 ILE 46 2HG2 ILE 46 -6.726 -11.581 -2.525 350 HG23 ILE 46 3HG2 ILE 46 -7.228 -12.879 -3.610 351 HD11 ILE 46 3HD1 ILE 46 -5.763 -9.646 -5.929 352 HD12 ILE 46 1HD1 ILE 46 -5.136 -8.435 -4.819 353 HD13 ILE 46 2HD1 ILE 46 -6.603 -9.321 -4.409 354 H LEU 47 H LEU 47 -4.589 -14.757 -5.247 355 HA LEU 47 HA LEU 47 -6.613 -16.384 -4.072 356 HB2 LEU 47 2HB LEU 47 -4.599 -17.034 -6.261 357 HB3 LEU 47 3HB LEU 47 -5.959 -18.064 -5.828 358 HG LEU 47 HG LEU 47 -6.154 -15.255 -6.990 359 HD11 LEU 47 1HD1 LEU 47 -5.422 -16.884 -8.640 360 HD12 LEU 47 2HD1 LEU 47 -7.068 -16.361 -8.981 361 HD13 LEU 47 3HD1 LEU 47 -6.781 -17.942 -8.247 362 HD21 LEU 47 3HD2 LEU 47 -8.392 -17.169 -6.233 363 HD22 LEU 47 1HD2 LEU 47 -8.590 -15.653 -7.119 364 HD23 LEU 47 2HD2 LEU 47 -8.015 -15.631 -5.454 365 H LYS 48 H LYS 48 -3.170 -16.265 -3.837 366 HA LYS 48 HA LYS 48 -2.710 -18.781 -2.545 367 HB2 LYS 48 2HB LYS 48 -1.050 -17.427 -3.880 368 HB3 LYS 48 3HB LYS 48 -0.999 -16.261 -2.566 369 HG2 LYS 48 2HG LYS 48 0.009 -17.919 -1.076 370 HG3 LYS 48 3HG LYS 48 -0.188 -19.178 -2.302 371 HD2 LYS 48 2HD LYS 48 2.136 -18.369 -2.267 372 HD3 LYS 48 3HD LYS 48 1.365 -17.985 -3.806 373 HE2 LYS 48 2HE LYS 48 2.681 -16.081 -3.087 374 HE3 LYS 48 3HE LYS 48 0.975 -15.646 -2.967 375 HZ1 LYS 48 3HZ LYS 48 2.215 -14.923 -1.025 376 HZ2 LYS 48 1HZ LYS 48 2.721 -16.502 -0.724 377 HZ3 LYS 48 2HZ LYS 48 1.092 -16.103 -0.583 378 H GLN 49 H GLN 49 -3.927 -15.733 -1.451 379 HA GLN 49 HA GLN 49 -3.222 -16.105 1.374 380 HB2 GLN 49 2HB GLN 49 -5.065 -13.985 0.167 381 HB3 GLN 49 3HB GLN 49 -4.327 -13.964 1.767 382 HG2 GLN 49 2HG GLN 49 -2.915 -13.687 -0.886 383 HG3 GLN 49 3HG GLN 49 -3.182 -12.415 0.300 384 HE21 GLN 49 1HE2 GLN 49 -0.696 -13.436 -0.884 385 HE22 GLN 49 2HE2 GLN 49 0.307 -13.883 0.450 386 H ALA 50 H ALA 50 -4.881 -16.177 3.017 387 HA ALA 50 HA ALA 50 -6.957 -18.067 2.652 388 HB1 ALA 50 3HB ALA 50 -5.845 -17.715 4.832 389 HB2 ALA 50 1HB ALA 50 -7.591 -17.510 4.988 390 HB3 ALA 50 2HB ALA 50 -6.533 -16.096 4.944 391 H ASP 51 H ASP 51 -6.947 -14.544 2.955 392 HA ASP 51 HA ASP 51 -9.800 -14.261 2.342 393 HB2 ASP 51 2HB ASP 51 -9.433 -11.864 2.750 394 HB3 ASP 51 3HB ASP 51 -8.755 -12.802 4.074 395 H LYS 52 H LYS 52 -10.190 -12.337 0.705 396 HA LYS 52 HA LYS 52 -8.617 -12.764 -1.749 397 HB2 LYS 52 2HB LYS 52 -11.640 -13.156 -1.535 398 HB3 LYS 52 3HB LYS 52 -10.756 -13.081 -3.053 399 HG2 LYS 52 2HG LYS 52 -10.346 -15.181 -0.903 400 HG3 LYS 52 3HG LYS 52 -11.288 -15.407 -2.381 401 HD2 LYS 52 2HD LYS 52 -9.303 -15.187 -3.764 402 HD3 LYS 52 3HD LYS 52 -8.325 -14.684 -2.380 403 HE2 LYS 52 2HE LYS 52 -7.848 -17.010 -2.953 404 HE3 LYS 52 3HE LYS 52 -8.623 -16.933 -1.376 405 HZ1 LYS 52 3HZ LYS 52 -9.981 -17.614 -3.928 406 HZ2 LYS 52 1HZ LYS 52 -10.704 -17.572 -2.403 407 HZ3 LYS 52 2HZ LYS 52 -9.513 -18.716 -2.738 408 H VAL 53 H VAL 53 -8.303 -10.511 -0.299 409 HA VAL 53 HA VAL 53 -9.113 -8.501 -2.234 410 HB VAL 53 HB VAL 53 -11.007 -8.402 -0.634 411 HG11 VAL 53 1HG1 VAL 53 -8.984 -7.700 1.517 412 HG12 VAL 53 2HG1 VAL 53 -9.901 -9.204 1.398 413 HG13 VAL 53 3HG1 VAL 53 -10.743 -7.681 1.690 414 HG21 VAL 53 3HG2 VAL 53 -10.974 -5.979 -0.165 415 HG22 VAL 53 1HG2 VAL 53 -10.355 -6.338 -1.779 416 HG23 VAL 53 2HG2 VAL 53 -9.235 -5.936 -0.474 417 H ALA 54 H ALA 54 -7.619 -6.771 -2.321 418 HA ALA 54 HA ALA 54 -5.225 -7.060 -0.586 419 HB1 ALA 54 3HB ALA 54 -3.848 -6.391 -2.507 420 HB2 ALA 54 1HB ALA 54 -5.291 -6.313 -3.528 421 HB3 ALA 54 2HB ALA 54 -4.766 -7.856 -2.854 422 H TYR 55 H TYR 55 -5.122 -5.372 0.727 423 HA TYR 55 HA TYR 55 -5.932 -2.682 -0.007 424 HB2 TYR 55 2HB TYR 55 -4.421 -3.759 2.419 425 HB3 TYR 55 3HB TYR 55 -4.967 -2.096 2.239 426 HD1 TYR 55 HD2 TYR 55 -6.059 -5.586 2.846 427 HD2 TYR 55 HD1 TYR 55 -7.322 -1.509 2.580 428 HE1 TYR 55 HE2 TYR 55 -8.176 -6.167 3.948 429 HE2 TYR 55 HE1 TYR 55 -9.432 -2.096 3.694 430 HH TYR 55 HH TYR 55 -9.891 -4.893 5.391 431 H LEU 56 H LEU 56 -4.378 -0.923 -0.010 432 HA LEU 56 HA LEU 56 -1.648 -1.669 -0.882 433 HB2 LEU 56 2HB LEU 56 -3.070 -1.007 -2.799 434 HB3 LEU 56 3HB LEU 56 -3.447 0.515 -2.010 435 HG LEU 56 HG LEU 56 -1.100 1.244 -2.231 436 HD11 LEU 56 1HD1 LEU 56 0.543 -0.038 -3.505 437 HD12 LEU 56 2HD1 LEU 56 -0.585 -1.392 -3.628 438 HD13 LEU 56 3HD1 LEU 56 0.043 -0.903 -2.053 439 HD21 LEU 56 3HD2 LEU 56 -2.304 0.248 -4.828 440 HD22 LEU 56 1HD2 LEU 56 -1.049 1.480 -4.684 441 HD23 LEU 56 2HD2 LEU 56 -2.653 1.782 -4.024 442 H VAL 57 H VAL 57 -0.355 -1.028 0.667 443 HA VAL 57 HA VAL 57 -0.988 1.315 2.335 444 HB VAL 57 HB VAL 57 1.175 -0.805 2.769 445 HG11 VAL 57 1HG1 VAL 57 1.300 0.096 5.071 446 HG12 VAL 57 2HG1 VAL 57 0.111 1.332 4.653 447 HG13 VAL 57 3HG1 VAL 57 1.693 1.332 3.872 448 HG21 VAL 57 3HG2 VAL 57 -0.315 -1.773 4.489 449 HG22 VAL 57 1HG2 VAL 57 -1.052 -1.834 2.885 450 HG23 VAL 57 2HG2 VAL 57 -1.575 -0.616 4.048 451 H MET 58 H MET 58 -0.245 3.123 1.388 452 HA MET 58 HA MET 58 2.587 3.242 0.503 453 HB2 MET 58 2HB MET 58 2.033 5.020 -1.022 454 HB3 MET 58 3HB MET 58 0.888 3.724 -1.325 455 HG2 MET 58 2HG MET 58 0.239 6.161 0.350 456 HG3 MET 58 3HG MET 58 -0.059 6.060 -1.381 457 HE1 MET 58 3HE MET 58 -2.819 3.323 -1.611 458 HE2 MET 58 1HE MET 58 -1.087 3.154 -1.876 459 HE3 MET 58 2HE MET 58 -1.937 4.574 -2.487 460 H ASP 59 H ASP 59 3.464 5.527 0.794 461 HA ASP 59 HA ASP 59 2.738 6.649 3.428 462 HB2 ASP 59 2HB ASP 59 4.912 7.833 3.259 463 HB3 ASP 59 3HB ASP 59 5.112 6.094 3.104 464 H GLU 60 H GLU 60 3.365 9.165 3.336 465 HA GLU 60 HA GLU 60 1.178 10.419 2.112 466 HB2 GLU 60 2HB GLU 60 2.266 11.268 4.175 467 HB3 GLU 60 3HB GLU 60 3.693 11.710 3.241 468 HG2 GLU 60 2HG GLU 60 2.477 13.737 3.511 469 HG3 GLU 60 3HG GLU 60 2.176 13.234 1.863 470 H ARG 61 H ARG 61 4.626 10.342 1.163 471 HA ARG 61 HA ARG 61 4.429 12.379 -0.844 472 HB2 ARG 61 2HB ARG 61 6.550 10.283 -0.250 473 HB3 ARG 61 3HB ARG 61 6.677 11.333 -1.657 474 HG2 ARG 61 2HG ARG 61 8.024 12.221 0.150 475 HG3 ARG 61 3HG ARG 61 6.684 13.318 -0.182 476 HD2 ARG 61 2HD ARG 61 5.484 12.500 1.790 477 HD3 ARG 61 3HD ARG 61 6.747 11.302 2.098 478 HE ARG 61 HE ARG 61 8.231 13.436 2.245 479 HH11 ARG 61 1HH1 ARG 61 4.959 13.098 3.519 480 HH12 ARG 61 2HH1 ARG 61 5.204 14.253 4.787 481 HH21 ARG 61 1HH2 ARG 61 8.545 14.936 3.887 482 HH22 ARG 61 2HH2 ARG 61 7.259 15.307 4.999 483 H THR 62 H THR 62 4.429 8.829 -0.945 484 HA THR 62 HA THR 62 4.038 8.510 -3.723 485 HB THR 62 HB THR 62 3.196 6.693 -1.427 486 HG1 THR 62 HG1 THR 62 5.389 6.873 -1.433 487 HG21 THR 62 3HG2 THR 62 3.189 4.855 -3.095 488 HG22 THR 62 1HG2 THR 62 3.479 6.024 -4.385 489 HG23 THR 62 2HG2 THR 62 1.962 6.063 -3.485 490 H TRP 63 H TRP 63 1.781 9.044 -1.050 491 HA TRP 63 HA TRP 63 -0.642 8.707 -2.465 492 HB2 TRP 63 2HB TRP 63 -0.782 8.670 -0.073 493 HB3 TRP 63 3HB TRP 63 0.021 10.230 0.084 494 HD1 TRP 63 HD1 TRP 63 -1.541 12.316 0.257 495 HE1 TRP 63 HE1 TRP 63 -4.056 12.738 0.012 496 HE3 TRP 63 HE3 TRP 63 -2.971 7.739 -1.569 497 HZ2 TRP 63 HZ2 TRP 63 -6.348 11.337 -0.840 498 HZ3 TRP 63 HZ3 TRP 63 -5.350 7.372 -2.083 499 HH2 TRP 63 HH2 TRP 63 -7.003 9.138 -1.724 500 H LYS 64 H LYS 64 1.469 11.573 -1.977 501 HA LYS 64 HA LYS 64 -0.258 13.580 -2.893 502 HB2 LYS 64 2HB LYS 64 2.768 13.465 -3.305 503 HB3 LYS 64 3HB LYS 64 1.779 14.906 -3.495 504 HG2 LYS 64 2HG LYS 64 2.497 13.445 -0.951 505 HG3 LYS 64 3HG LYS 64 2.875 15.108 -1.400 506 HD2 LYS 64 2HD LYS 64 0.226 15.393 -1.386 507 HD3 LYS 64 3HD LYS 64 0.282 13.931 -0.393 508 HE2 LYS 64 2HE LYS 64 1.834 15.128 1.168 509 HE3 LYS 64 3HE LYS 64 1.582 16.599 0.224 510 HZ1 LYS 64 3HZ LYS 64 -0.517 15.048 1.643 511 HZ2 LYS 64 1HZ LYS 64 -0.801 16.424 0.705 512 HZ3 LYS 64 2HZ LYS 64 0.109 16.543 2.124 513 H LYS 65 H LYS 65 1.728 11.285 -4.599 514 HA LYS 65 HA LYS 65 1.470 12.352 -7.238 515 HB2 LYS 65 2HB LYS 65 2.226 9.512 -6.424 516 HB3 LYS 65 3HB LYS 65 2.626 10.320 -7.935 517 HG2 LYS 65 2HG LYS 65 3.690 11.011 -5.185 518 HG3 LYS 65 3HG LYS 65 4.578 10.201 -6.469 519 HD2 LYS 65 2HD LYS 65 3.551 13.062 -6.544 520 HD3 LYS 65 3HD LYS 65 5.219 12.566 -6.261 521 HE2 LYS 65 2HE LYS 65 5.314 11.586 -8.532 522 HE3 LYS 65 3HE LYS 65 3.644 12.097 -8.815 523 HZ1 LYS 65 3HZ LYS 65 4.375 14.406 -8.446 524 HZ2 LYS 65 1HZ LYS 65 5.143 13.688 -9.766 525 HZ3 LYS 65 2HZ LYS 65 5.971 13.873 -8.308 526 H VAL 66 H VAL 66 -0.020 9.588 -5.518 527 HA VAL 66 HA VAL 66 -1.662 8.597 -7.586 528 HB VAL 66 HB VAL 66 -1.997 8.402 -4.546 529 HG11 VAL 66 1HG1 VAL 66 -3.376 6.742 -6.690 530 HG12 VAL 66 2HG1 VAL 66 -4.158 7.907 -5.622 531 HG13 VAL 66 3HG1 VAL 66 -3.452 6.435 -4.953 532 HG21 VAL 66 3HG2 VAL 66 -0.768 6.458 -6.542 533 HG22 VAL 66 1HG2 VAL 66 -0.946 6.172 -4.806 534 HG23 VAL 66 2HG2 VAL 66 0.116 7.456 -5.387 535 H TYR 67 H TYR 67 -2.557 10.587 -4.793 536 HA TYR 67 HA TYR 67 -5.150 11.309 -5.267 537 HB2 TYR 67 2HB TYR 67 -3.854 11.785 -3.205 538 HB3 TYR 67 3HB TYR 67 -2.915 12.997 -4.057 539 HD1 TYR 67 HD1 TYR 67 -6.544 12.227 -3.351 540 HD2 TYR 67 HD2 TYR 67 -3.512 15.230 -3.627 541 HE1 TYR 67 HE1 TYR 67 -8.146 13.918 -2.580 542 HE2 TYR 67 HE2 TYR 67 -5.126 16.918 -2.860 543 HH TYR 67 HH TYR 67 -7.520 17.262 -2.742 544 H ASP 68 H ASP 68 -2.211 12.851 -6.534 545 HA ASP 68 HA ASP 68 -3.393 15.048 -7.864 546 HB2 ASP 68 2HB ASP 68 -0.993 15.026 -7.386 547 HB3 ASP 68 3HB ASP 68 -0.760 13.599 -8.386 548 H LEU 69 H LEU 69 -2.476 11.796 -9.019 549 HA LEU 69 HA LEU 69 -3.145 12.129 -11.755 550 HB2 LEU 69 2HB LEU 69 -3.050 9.596 -10.057 551 HB3 LEU 69 3HB LEU 69 -3.154 9.611 -11.813 552 HG LEU 69 HG LEU 69 -0.831 10.705 -10.187 553 HD11 LEU 69 1HD1 LEU 69 0.436 8.789 -11.026 554 HD12 LEU 69 2HD1 LEU 69 -1.008 8.159 -11.823 555 HD13 LEU 69 3HD1 LEU 69 -0.946 8.273 -10.061 556 HD21 LEU 69 3HD2 LEU 69 -1.126 10.447 -13.198 557 HD22 LEU 69 1HD2 LEU 69 0.334 10.945 -12.335 558 HD23 LEU 69 2HD2 LEU 69 -1.110 11.950 -12.271 559 H LEU 70 H LEU 70 -5.000 11.005 -8.959 560 HA LEU 70 HA LEU 70 -7.312 10.079 -10.242 561 HB2 LEU 70 2HB LEU 70 -6.992 11.357 -7.496 562 HB3 LEU 70 3HB LEU 70 -8.452 10.537 -8.032 563 HG LEU 70 HG LEU 70 -5.725 9.231 -7.659 564 HD11 LEU 70 1HD1 LEU 70 -6.734 9.815 -5.520 565 HD12 LEU 70 2HD1 LEU 70 -6.736 8.069 -5.749 566 HD13 LEU 70 3HD1 LEU 70 -8.229 8.988 -5.966 567 HD21 LEU 70 3HD2 LEU 70 -6.939 8.146 -9.472 568 HD22 LEU 70 1HD2 LEU 70 -8.367 7.963 -8.450 569 HD23 LEU 70 2HD2 LEU 70 -6.883 7.095 -8.062 570 H ILE 71 H ILE 71 -6.597 13.284 -8.855 571 HA ILE 71 HA ILE 71 -9.021 14.541 -9.663 572 HB ILE 71 HB ILE 71 -6.363 15.838 -8.883 573 HG12 ILE 71 2HG1 ILE 71 -8.781 15.202 -7.125 574 HG13 ILE 71 3HG1 ILE 71 -7.294 14.261 -7.156 575 HG21 ILE 71 1HG2 ILE 71 -7.723 17.834 -8.300 576 HG22 ILE 71 2HG2 ILE 71 -9.164 17.027 -8.925 577 HG23 ILE 71 3HG2 ILE 71 -7.846 17.445 -10.022 578 HD11 ILE 71 3HD1 ILE 71 -6.049 16.196 -6.352 579 HD12 ILE 71 1HD1 ILE 71 -7.349 15.731 -5.256 580 HD13 ILE 71 2HD1 ILE 71 -7.545 17.136 -6.301 581 H LEU 72 H LEU 72 -5.867 14.190 -11.172 582 HA LEU 72 HA LEU 72 -6.123 16.133 -13.228 583 HB2 LEU 72 2HB LEU 72 -3.971 15.149 -12.446 584 HB3 LEU 72 3HB LEU 72 -4.418 13.599 -13.118 585 HG LEU 72 HG LEU 72 -2.695 15.020 -14.410 586 HD11 LEU 72 1HD1 LEU 72 -3.422 14.309 -16.614 587 HD12 LEU 72 2HD1 LEU 72 -5.066 14.047 -16.023 588 HD13 LEU 72 3HD1 LEU 72 -3.742 13.048 -15.418 589 HD21 LEU 72 3HD2 LEU 72 -3.521 16.760 -15.926 590 HD22 LEU 72 1HD2 LEU 72 -3.830 17.195 -14.245 591 HD23 LEU 72 2HD2 LEU 72 -5.148 16.603 -15.259 592 H HIS 73 H HIS 73 -6.999 12.712 -12.978 593 HA HIS 73 HA HIS 73 -7.722 12.383 -15.743 594 HB2 HIS 73 2HB HIS 73 -7.985 10.660 -13.266 595 HB3 HIS 73 3HB HIS 73 -8.882 10.223 -14.717 596 HD1 HIS 73 HD1 HIS 73 -7.667 8.327 -15.715 597 HD2 HIS 73 HD2 HIS 73 -5.055 11.277 -14.408 598 HE1 HIS 73 HE1 HIS 73 -5.385 7.567 -16.424 599 HE2 HIS 73 HE2 HIS 73 -3.859 9.449 -15.776 600 H ASP 74 H ASP 74 -9.720 12.406 -12.736 601 HA ASP 74 HA ASP 74 -11.795 14.043 -13.690 602 HB2 ASP 74 2HB ASP 74 -13.617 12.365 -14.147 603 HB3 ASP 74 3HB ASP 74 -12.320 12.311 -15.335 604 H PHE 75 H PHE 75 -10.530 11.849 -11.393 605 HA PHE 75 HA PHE 75 -12.882 11.566 -9.746 606 HB2 PHE 75 2HB PHE 75 -11.038 9.826 -10.020 607 HB3 PHE 75 3HB PHE 75 -10.007 10.848 -9.031 608 HD1 PHE 75 HD1 PHE 75 -13.438 10.930 -7.846 609 HD2 PHE 75 HD2 PHE 75 -9.847 8.594 -7.769 610 HE1 PHE 75 HE1 PHE 75 -14.248 9.723 -5.860 611 HE2 PHE 75 HE2 PHE 75 -10.668 7.409 -5.782 612 HZ PHE 75 HZ PHE 75 -12.863 7.968 -4.830 613 H THR 76 H THR 76 -13.555 13.453 -8.997 614 HA THR 76 HA THR 76 -12.242 15.756 -8.316 615 HB THR 76 HB THR 76 -14.882 14.643 -7.265 616 HG1 THR 76 HG1 THR 76 -15.462 16.255 -9.174 617 HG21 THR 76 3HG2 THR 76 -14.224 16.642 -6.016 618 HG22 THR 76 1HG2 THR 76 -15.613 16.973 -7.056 619 HG23 THR 76 2HG2 THR 76 -14.005 17.529 -7.526 620 HA PRO 77 HA PRO 77 -10.211 14.957 -4.278 621 HB2 PRO 77 2HB PRO 77 -10.405 17.566 -3.254 622 HB3 PRO 77 3HB PRO 77 -9.143 17.003 -4.367 623 HG2 PRO 77 2HG PRO 77 -11.685 18.468 -5.011 624 HG3 PRO 77 3HG PRO 77 -10.037 18.742 -5.626 625 HD2 PRO 77 2HD PRO 77 -11.786 17.438 -7.137 626 HD3 PRO 77 3HD PRO 77 -10.108 16.854 -7.043 627 H GLU 78 H GLU 78 -13.266 16.664 -4.476 628 HA GLU 78 HA GLU 78 -14.082 16.478 -1.781 629 HB2 GLU 78 2HB GLU 78 -15.785 16.712 -4.299 630 HB3 GLU 78 3HB GLU 78 -16.327 17.056 -2.657 631 HG2 GLU 78 2HG GLU 78 -14.765 18.932 -2.489 632 HG3 GLU 78 3HG GLU 78 -14.109 18.556 -4.084 633 H GLU 79 H GLU 79 -14.402 14.260 -4.514 634 HA GLU 79 HA GLU 79 -16.170 12.458 -3.093 635 HB2 GLU 79 2HB GLU 79 -14.693 11.963 -5.715 636 HB3 GLU 79 3HB GLU 79 -16.055 11.048 -5.078 637 HG2 GLU 79 2HG GLU 79 -16.049 13.848 -6.203 638 HG3 GLU 79 3HG GLU 79 -16.945 12.445 -6.776 639 H ILE 80 H ILE 80 -12.725 12.612 -3.925 640 HA ILE 80 HA ILE 80 -11.851 10.092 -3.054 641 HB ILE 80 HB ILE 80 -10.358 12.763 -2.954 642 HG12 ILE 80 2HG1 ILE 80 -10.279 10.597 -5.112 643 HG13 ILE 80 3HG1 ILE 80 -11.193 12.092 -5.236 644 HG21 ILE 80 1HG2 ILE 80 -9.257 11.090 -1.514 645 HG22 ILE 80 2HG2 ILE 80 -8.271 11.432 -2.936 646 HG23 ILE 80 3HG2 ILE 80 -9.214 9.943 -2.855 647 HD11 ILE 80 3HD1 ILE 80 -9.149 12.261 -6.484 648 HD12 ILE 80 1HD1 ILE 80 -8.196 11.847 -5.058 649 HD13 ILE 80 2HD1 ILE 80 -9.094 13.366 -5.111 650 H LYS 81 H LYS 81 -12.126 13.165 -1.270 651 HA LYS 81 HA LYS 81 -11.185 12.163 1.222 652 HB2 LYS 81 2HB LYS 81 -11.732 14.326 2.131 653 HB3 LYS 81 3HB LYS 81 -11.008 14.537 0.544 654 HG2 LYS 81 2HG LYS 81 -13.441 14.719 -0.328 655 HG3 LYS 81 3HG LYS 81 -13.895 14.935 1.361 656 HD2 LYS 81 2HD LYS 81 -11.832 16.681 -0.047 657 HD3 LYS 81 3HD LYS 81 -13.556 17.059 -0.028 658 HE2 LYS 81 2HE LYS 81 -12.381 18.346 1.694 659 HE3 LYS 81 3HE LYS 81 -13.529 17.234 2.429 660 HZ1 LYS 81 3HZ LYS 81 -11.373 17.366 3.581 661 HZ2 LYS 81 1HZ LYS 81 -10.614 16.735 2.210 662 HZ3 LYS 81 2HZ LYS 81 -11.735 15.801 3.061 663 H SER 82 H SER 82 -14.301 12.115 -0.291 664 HA SER 82 HA SER 82 -15.959 11.820 2.001 665 HB2 SER 82 2HB SER 82 -16.839 12.436 -0.251 666 HB3 SER 82 3HB SER 82 -16.456 10.815 -0.837 667 HG SER 82 HG SER 82 -17.901 10.577 1.390 668 H PHE 83 H PHE 83 -13.974 9.562 0.155 669 HA PHE 83 HA PHE 83 -15.049 7.153 1.315 670 HB2 PHE 83 2HB PHE 83 -12.491 7.696 -0.227 671 HB3 PHE 83 3HB PHE 83 -12.887 6.103 0.409 672 HD1 PHE 83 HD1 PHE 83 -13.739 8.629 -2.140 673 HD2 PHE 83 HD2 PHE 83 -14.679 4.760 -0.586 674 HE1 PHE 83 HE1 PHE 83 -15.039 8.126 -4.166 675 HE2 PHE 83 HE2 PHE 83 -15.973 4.264 -2.618 676 HZ PHE 83 HZ PHE 83 -16.161 5.947 -4.407 677 H PHE 84 H PHE 84 -12.738 9.514 2.398 678 HA PHE 84 HA PHE 84 -11.553 7.877 4.466 679 HB2 PHE 84 2HB PHE 84 -11.643 10.909 4.090 680 HB3 PHE 84 3HB PHE 84 -10.815 10.129 5.432 681 HD1 PHE 84 HD1 PHE 84 -10.794 10.540 1.737 682 HD2 PHE 84 HD2 PHE 84 -8.622 9.150 5.142 683 HE1 PHE 84 HE1 PHE 84 -8.764 10.357 0.363 684 HE2 PHE 84 HE2 PHE 84 -6.595 8.960 3.758 685 HZ PHE 84 HZ PHE 84 -6.661 9.564 1.375 686 H GLU 85 H GLU 85 -14.395 9.855 4.119 687 HA GLU 85 HA GLU 85 -15.061 9.798 6.990 688 HB2 GLU 85 2HB GLU 85 -16.522 11.126 4.670 689 HB3 GLU 85 3HB GLU 85 -16.774 11.415 6.388 690 HG2 GLU 85 2HG GLU 85 -14.630 12.500 6.605 691 HG3 GLU 85 3HG GLU 85 -14.176 12.039 4.960 692 H ASN 86 H ASN 86 -15.336 7.563 4.710 693 HA ASN 86 HA ASN 86 -18.104 7.001 4.429 694 HB2 ASN 86 2HB ASN 86 -16.272 6.170 2.911 695 HB3 ASN 86 3HB ASN 86 -15.763 5.057 4.171 696 HD21 ASN 86 1HD2 ASN 86 -16.721 4.541 1.439 697 HD22 ASN 86 2HD2 ASN 86 -18.060 3.464 1.594 698 H LYS 87 H LYS 87 -19.213 6.893 6.310 699 HA LYS 87 HA LYS 87 -18.306 5.163 8.532 700 HB2 LYS 87 2HB LYS 87 -20.343 7.423 8.439 701 HB3 LYS 87 3HB LYS 87 -20.053 6.426 9.863 702 HG2 LYS 87 2HG LYS 87 -17.756 7.229 10.021 703 HG3 LYS 87 3HG LYS 87 -17.933 8.125 8.513 704 HD2 LYS 87 2HD LYS 87 -18.089 9.693 10.339 705 HD3 LYS 87 3HD LYS 87 -19.686 9.548 9.612 706 HE2 LYS 87 2HE LYS 87 -18.853 8.058 12.127 707 HE3 LYS 87 3HE LYS 87 -19.630 9.637 12.145 708 HZ1 LYS 87 3HZ LYS 87 -20.791 7.086 11.156 709 HZ2 LYS 87 1HZ LYS 87 -21.511 8.598 10.915 710 HZ3 LYS 87 2HZ LYS 87 -21.290 8.005 12.478 711 H GLY 88 H GLY 88 -20.569 5.280 5.970 712 HA2 GLY 88 2HA GLY 88 -22.707 3.751 7.114 713 HA3 GLY 88 3HA GLY 88 -22.412 4.032 5.407 714 H LYS 89 H LYS 89 -19.936 2.922 5.045 715 HA LYS 89 HA LYS 89 -20.284 0.053 5.695 716 HB2 LYS 89 2HB LYS 89 -18.697 1.423 3.469 717 HB3 LYS 89 3HB LYS 89 -18.629 -0.298 3.791 718 HG2 LYS 89 2HG LYS 89 -21.292 0.981 3.169 719 HG3 LYS 89 3HG LYS 89 -20.157 0.650 1.866 720 HD2 LYS 89 2HD LYS 89 -21.703 -1.195 1.992 721 HD3 LYS 89 3HD LYS 89 -20.132 -1.763 2.549 722 HE2 LYS 89 2HE LYS 89 -21.956 -2.657 3.931 723 HE3 LYS 89 3HE LYS 89 -20.901 -1.614 4.885 724 HZ1 LYS 89 3HZ LYS 89 -23.237 -1.215 5.351 725 HZ2 LYS 89 1HZ LYS 89 -23.522 -0.829 3.731 726 HZ3 LYS 89 2HZ LYS 89 -22.525 0.160 4.669 727 H ARG 90 H ARG 90 -17.464 2.002 4.856 728 HA ARG 90 HA ARG 90 -16.103 2.167 7.258 729 HB2 ARG 90 2HB ARG 90 -16.164 -0.415 7.041 730 HB3 ARG 90 3HB ARG 90 -15.114 -0.249 5.638 731 HG2 ARG 90 2HG ARG 90 -13.366 0.749 7.016 732 HG3 ARG 90 3HG ARG 90 -14.424 0.738 8.427 733 HD2 ARG 90 2HD ARG 90 -14.489 -1.817 8.172 734 HD3 ARG 90 3HD ARG 90 -13.168 -1.633 7.017 735 HE ARG 90 HE ARG 90 -11.776 -0.821 8.752 736 HH11 ARG 90 1HH1 ARG 90 -14.883 -1.934 9.952 737 HH12 ARG 90 2HH1 ARG 90 -14.334 -2.082 11.596 738 HH21 ARG 90 1HH2 ARG 90 -11.075 -0.985 10.895 739 HH22 ARG 90 2HH2 ARG 90 -12.171 -1.541 12.118 740 HA PRO 91 HA PRO 91 -13.835 4.785 4.377 741 HB2 PRO 91 2HB PRO 91 -11.440 4.279 6.131 742 HB3 PRO 91 3HB PRO 91 -12.117 5.821 5.564 743 HG2 PRO 91 2HG PRO 91 -12.494 5.041 8.078 744 HG3 PRO 91 3HG PRO 91 -13.811 5.821 7.175 745 HD2 PRO 91 2HD PRO 91 -13.430 2.907 7.814 746 HD3 PRO 91 3HD PRO 91 -14.924 3.872 7.784 747 H VAL 92 H VAL 92 -13.595 3.751 2.491 748 HA VAL 92 HA VAL 92 -11.938 1.494 1.936 749 HB VAL 92 HB VAL 92 -12.967 3.636 -0.002 750 HG11 VAL 92 1HG1 VAL 92 -11.988 0.818 -0.613 751 HG12 VAL 92 2HG1 VAL 92 -11.134 2.314 -0.991 752 HG13 VAL 92 3HG1 VAL 92 -12.666 1.955 -1.785 753 HG21 VAL 92 3HG2 VAL 92 -14.821 2.586 1.232 754 HG22 VAL 92 1HG2 VAL 92 -14.248 0.983 0.765 755 HG23 VAL 92 2HG2 VAL 92 -14.850 2.101 -0.464 756 H PHE 93 H PHE 93 -11.558 4.980 1.729 757 HA PHE 93 HA PHE 93 -8.652 4.815 1.272 758 HB2 PHE 93 2HB PHE 93 -10.642 7.126 1.144 759 HB3 PHE 93 3HB PHE 93 -8.903 7.363 1.073 760 HD1 PHE 93 HD1 PHE 93 -11.040 4.777 -0.671 761 HD2 PHE 93 HD2 PHE 93 -8.495 8.187 -1.078 762 HE1 PHE 93 HE1 PHE 93 -11.116 4.542 -3.116 763 HE2 PHE 93 HE2 PHE 93 -8.577 7.945 -3.525 764 HZ PHE 93 HZ PHE 93 -9.876 6.121 -4.545 765 H VAL 94 H VAL 94 -7.519 4.669 3.133 766 HA VAL 94 HA VAL 94 -8.486 6.007 5.614 767 HB VAL 94 HB VAL 94 -6.807 3.445 5.426 768 HG11 VAL 94 1HG1 VAL 94 -7.260 3.217 7.843 769 HG12 VAL 94 2HG1 VAL 94 -8.102 4.768 7.836 770 HG13 VAL 94 3HG1 VAL 94 -6.373 4.701 7.484 771 HG21 VAL 94 3HG2 VAL 94 -9.751 3.695 6.134 772 HG22 VAL 94 1HG2 VAL 94 -8.794 2.211 6.154 773 HG23 VAL 94 2HG2 VAL 94 -9.107 3.038 4.626 774 H LYS 95 H LYS 95 -6.812 6.870 7.010 775 HA LYS 95 HA LYS 95 -4.029 6.812 6.183 776 HB2 LYS 95 2HB LYS 95 -3.731 9.237 6.178 777 HB3 LYS 95 3HB LYS 95 -4.890 8.753 4.948 778 HG2 LYS 95 2HG LYS 95 -6.752 9.555 6.256 779 HG3 LYS 95 3HG LYS 95 -5.720 9.851 7.658 780 HD2 LYS 95 2HD LYS 95 -5.455 11.288 4.981 781 HD3 LYS 95 3HD LYS 95 -6.282 11.943 6.395 782 HE2 LYS 95 2HE LYS 95 -4.199 11.936 7.672 783 HE3 LYS 95 3HE LYS 95 -3.353 11.142 6.340 784 HZ1 LYS 95 3HZ LYS 95 -2.914 13.501 6.385 785 HZ2 LYS 95 1HZ LYS 95 -4.556 13.854 6.242 786 HZ3 LYS 95 2HZ LYS 95 -3.741 13.090 4.975 787 H GLY 96 H GLY 96 -2.662 8.107 7.751 788 HA2 GLY 96 2HA GLY 96 -2.853 9.242 10.040 789 HA3 GLY 96 3HA GLY 96 -3.561 7.708 10.549 790 H SER 97 H SER 97 -1.840 7.304 12.022 791 HA SER 97 HA SER 97 0.867 6.873 11.159 792 HB2 SER 97 2HB SER 97 0.238 7.279 13.551 793 HB3 SER 97 3HB SER 97 -0.621 5.741 13.585 794 HG SER 97 HG SER 97 1.468 5.544 14.460 795 H LEU 98 H LEU 98 1.781 4.482 11.507 796 HA LEU 98 HA LEU 98 0.731 2.871 9.437 797 HB2 LEU 98 2HB LEU 98 3.096 2.776 10.107 798 HB3 LEU 98 3HB LEU 98 2.645 2.162 11.689 799 HG LEU 98 HG LEU 98 1.818 0.056 10.651 800 HD11 LEU 98 1HD1 LEU 98 2.251 -0.455 8.298 801 HD12 LEU 98 2HD1 LEU 98 2.826 1.191 8.028 802 HD13 LEU 98 3HD1 LEU 98 1.141 0.903 8.467 803 HD21 LEU 98 3HD2 LEU 98 4.127 0.152 11.463 804 HD22 LEU 98 1HD2 LEU 98 4.679 0.716 9.882 805 HD23 LEU 98 2HD2 LEU 98 3.992 -0.901 10.057 806 H GLU 99 H GLU 99 0.591 2.508 12.990 807 HA GLU 99 HA GLU 99 -1.059 0.174 12.948 808 HB2 GLU 99 2HB GLU 99 -0.690 2.093 15.293 809 HB3 GLU 99 3HB GLU 99 -1.303 0.449 15.362 810 HG2 GLU 99 2HG GLU 99 0.880 0.178 16.112 811 HG3 GLU 99 3HG GLU 99 1.030 -0.228 14.405 812 H SER 100 H SER 100 -1.696 3.662 13.377 813 HA SER 100 HA SER 100 -4.401 3.614 14.072 814 HB2 SER 100 2HB SER 100 -2.933 5.720 12.417 815 HB3 SER 100 3HB SER 100 -4.497 5.956 13.189 816 HG SER 100 HG SER 100 -2.943 5.087 15.081 817 H ALA 101 H ALA 101 -2.967 3.934 10.822 818 HA ALA 101 HA ALA 101 -5.352 3.999 9.327 819 HB1 ALA 101 3HB ALA 101 -3.206 4.801 8.439 820 HB2 ALA 101 1HB ALA 101 -3.907 3.590 7.366 821 HB3 ALA 101 2HB ALA 101 -2.569 3.154 8.436 822 H ALA 102 H ALA 102 -3.469 1.356 10.632 823 HA ALA 102 HA ALA 102 -4.524 -0.778 9.062 824 HB1 ALA 102 3HB ALA 102 -3.498 -2.222 10.753 825 HB2 ALA 102 1HB ALA 102 -3.266 -0.833 11.828 826 HB3 ALA 102 2HB ALA 102 -2.396 -0.925 10.297 827 H GLU 103 H GLU 103 -5.289 0.536 12.281 828 HA GLU 103 HA GLU 103 -7.296 -1.271 13.093 829 HB2 GLU 103 2HB GLU 103 -6.995 1.676 13.851 830 HB3 GLU 103 3HB GLU 103 -7.918 0.473 14.748 831 HG2 GLU 103 2HG GLU 103 -5.883 -0.744 15.306 832 HG3 GLU 103 3HG GLU 103 -4.928 0.331 14.300 833 H GLN 104 H GLN 104 -7.488 1.853 11.442 834 HA GLN 104 HA GLN 104 -10.336 2.001 11.287 835 HB2 GLN 104 2HB GLN 104 -8.190 3.510 9.748 836 HB3 GLN 104 3HB GLN 104 -9.899 3.939 9.764 837 HG2 GLN 104 2HG GLN 104 -9.813 4.489 12.114 838 HG3 GLN 104 3HG GLN 104 -8.168 3.861 12.253 839 HE21 GLN 104 1HE2 GLN 104 -6.459 5.063 11.354 840 HE22 GLN 104 2HE2 GLN 104 -6.620 6.731 10.949 841 H ALA 105 H ALA 105 -7.852 0.727 9.121 842 HA ALA 105 HA ALA 105 -9.681 0.256 6.906 843 HB1 ALA 105 3HB ALA 105 -7.317 0.751 6.462 844 HB2 ALA 105 1HB ALA 105 -7.756 -0.835 5.824 845 HB3 ALA 105 2HB ALA 105 -6.829 -0.709 7.324 846 H GLY 106 H GLY 106 -8.768 -1.396 9.795 847 HA2 GLY 106 2HA GLY 106 -9.592 -3.327 10.742 848 HA3 GLY 106 3HA GLY 106 -10.637 -3.539 9.343 849 H ILE 107 H ILE 107 -7.127 -3.300 9.515 850 HA ILE 107 HA ILE 107 -6.773 -6.022 8.384 851 HB ILE 107 HB ILE 107 -4.669 -3.803 8.414 852 HG12 ILE 107 2HG1 ILE 107 -6.614 -4.346 6.125 853 HG13 ILE 107 3HG1 ILE 107 -6.666 -2.941 7.188 854 HG21 ILE 107 1HG2 ILE 107 -3.646 -5.072 6.576 855 HG22 ILE 107 2HG2 ILE 107 -4.969 -6.240 6.618 856 HG23 ILE 107 3HG2 ILE 107 -3.867 -6.105 7.989 857 HD11 ILE 107 3HD1 ILE 107 -5.632 -2.403 5.080 858 HD12 ILE 107 1HD1 ILE 107 -4.412 -3.653 5.316 859 HD13 ILE 107 2HD1 ILE 107 -4.465 -2.249 6.391 860 H VAL 108 H VAL 108 -4.947 -7.291 9.321 861 HA VAL 108 HA VAL 108 -4.691 -6.994 12.156 862 HB VAL 108 HB VAL 108 -3.017 -8.805 10.375 863 HG11 VAL 108 1HG1 VAL 108 -3.616 -8.942 13.355 864 HG12 VAL 108 2HG1 VAL 108 -2.071 -8.510 12.615 865 HG13 VAL 108 3HG1 VAL 108 -2.708 -10.145 12.433 866 HG21 VAL 108 3HG2 VAL 108 -5.405 -9.256 9.991 867 HG22 VAL 108 1HG2 VAL 108 -5.668 -9.436 11.729 868 HG23 VAL 108 2HG2 VAL 108 -4.651 -10.592 10.862 869 H VAL 109 H VAL 109 -3.650 -5.367 12.927 870 HA VAL 109 HA VAL 109 -1.787 -3.662 11.825 871 HB VAL 109 HB VAL 109 -2.114 -4.326 14.794 872 HG11 VAL 109 1HG1 VAL 109 -0.073 -3.015 14.394 873 HG12 VAL 109 2HG1 VAL 109 -1.277 -2.052 15.250 874 HG13 VAL 109 3HG1 VAL 109 -1.007 -1.795 13.524 875 HG21 VAL 109 3HG2 VAL 109 -3.759 -2.491 14.901 876 HG22 VAL 109 1HG2 VAL 109 -4.278 -3.735 13.761 877 HG23 VAL 109 2HG2 VAL 109 -3.591 -2.223 13.165 878 H ASP 110 H ASP 110 -1.252 -6.438 13.931 879 HA ASP 110 HA ASP 110 1.466 -6.381 14.402 880 HB2 ASP 110 2HB ASP 110 -0.023 -7.913 15.586 881 HB3 ASP 110 3HB ASP 110 -0.434 -8.759 14.098 882 H GLU 111 H GLU 111 -0.281 -7.905 11.683 883 HA GLU 111 HA GLU 111 1.968 -9.135 10.491 884 HB2 GLU 111 2HB GLU 111 -0.686 -8.373 9.221 885 HB3 GLU 111 3HB GLU 111 0.536 -9.366 8.438 886 HG2 GLU 111 2HG GLU 111 -1.035 -10.055 10.933 887 HG3 GLU 111 3HG GLU 111 -1.223 -10.768 9.332 888 H LEU 112 H LEU 112 0.221 -6.099 9.604 889 HA LEU 112 HA LEU 112 2.044 -5.533 7.462 890 HB2 LEU 112 2HB LEU 112 0.893 -3.307 7.317 891 HB3 LEU 112 3HB LEU 112 -0.136 -4.719 7.186 892 HG LEU 112 HG LEU 112 -0.641 -4.327 9.732 893 HD11 LEU 112 1HD1 LEU 112 -0.586 -1.994 10.482 894 HD12 LEU 112 2HD1 LEU 112 0.298 -1.531 9.026 895 HD13 LEU 112 3HD1 LEU 112 1.038 -2.620 10.201 896 HD21 LEU 112 3HD2 LEU 112 -2.537 -2.935 9.182 897 HD22 LEU 112 1HD2 LEU 112 -2.268 -4.101 7.895 898 HD23 LEU 112 2HD2 LEU 112 -1.784 -2.418 7.674 899 H VAL 113 H VAL 113 2.172 -4.773 10.825 900 HA VAL 113 HA VAL 113 4.098 -2.663 10.695 901 HB VAL 113 HB VAL 113 3.333 -4.542 12.978 902 HG11 VAL 113 1HG1 VAL 113 5.724 -4.044 13.308 903 HG12 VAL 113 2HG1 VAL 113 4.758 -3.180 14.506 904 HG13 VAL 113 3HG1 VAL 113 5.415 -2.316 13.114 905 HG21 VAL 113 3HG2 VAL 113 2.409 -2.466 13.984 906 HG22 VAL 113 1HG2 VAL 113 1.703 -2.784 12.399 907 HG23 VAL 113 2HG2 VAL 113 2.946 -1.547 12.576 908 H GLN 114 H GLN 114 4.326 -6.209 10.954 909 HA GLN 114 HA GLN 114 7.192 -6.354 11.063 910 HB2 GLN 114 2HB GLN 114 5.180 -8.422 10.071 911 HB3 GLN 114 3HB GLN 114 6.890 -8.743 10.359 912 HG2 GLN 114 2HG GLN 114 4.870 -7.935 12.465 913 HG3 GLN 114 3HG GLN 114 5.502 -9.558 12.208 914 HE21 GLN 114 1HE2 GLN 114 6.225 -6.366 13.404 915 HE22 GLN 114 2HE2 GLN 114 7.657 -6.797 14.262 916 H THR 115 H THR 115 4.813 -6.607 8.517 917 HA THR 115 HA THR 115 6.356 -7.120 6.292 918 HB THR 115 HB THR 115 3.695 -5.727 6.701 919 HG1 THR 115 HG1 THR 115 2.943 -7.705 6.627 920 HG21 THR 115 3HG2 THR 115 4.852 -6.629 4.054 921 HG22 THR 115 1HG2 THR 115 4.523 -4.965 4.538 922 HG23 THR 115 2HG2 THR 115 3.190 -6.102 4.335 923 H VAL 116 H VAL 116 5.500 -3.955 7.727 924 HA VAL 116 HA VAL 116 6.796 -2.412 5.641 925 HB VAL 116 HB VAL 116 5.459 -1.573 8.254 926 HG11 VAL 116 1HG1 VAL 116 5.718 0.794 7.544 927 HG12 VAL 116 2HG1 VAL 116 6.735 0.275 6.197 928 HG13 VAL 116 3HG1 VAL 116 7.282 0.033 7.856 929 HG21 VAL 116 3HG2 VAL 116 3.944 -2.305 6.454 930 HG22 VAL 116 1HG2 VAL 116 4.671 -1.138 5.347 931 HG23 VAL 116 2HG2 VAL 116 3.764 -0.576 6.753 932 H LYS 117 H LYS 117 7.635 -3.421 8.968 933 HA LYS 117 HA LYS 117 9.901 -1.652 9.142 934 HB2 LYS 117 2HB LYS 117 10.383 -2.632 11.253 935 HB3 LYS 117 3HB LYS 117 8.632 -2.562 11.132 936 HG2 LYS 117 2HG LYS 117 8.625 -4.994 10.536 937 HG3 LYS 117 3HG LYS 117 10.365 -5.035 10.795 938 HD2 LYS 117 2HD LYS 117 8.315 -4.312 12.931 939 HD3 LYS 117 3HD LYS 117 9.021 -5.911 12.720 940 HE2 LYS 117 2HE LYS 117 10.203 -4.870 14.511 941 HE3 LYS 117 3HE LYS 117 11.295 -4.861 13.129 942 HZ1 LYS 117 3HZ LYS 117 10.947 -2.569 12.814 943 HZ2 LYS 117 1HZ LYS 117 11.177 -2.771 14.471 944 HZ3 LYS 117 2HZ LYS 117 9.619 -2.524 13.864 945 H ASN 118 H ASN 118 9.411 -4.948 8.103 946 HA ASN 118 HA ASN 118 12.238 -5.544 7.755 947 HB2 ASN 118 2HB ASN 118 9.755 -7.111 6.898 948 HB3 ASN 118 3HB ASN 118 11.417 -7.692 6.762 949 HD21 ASN 118 1HD2 ASN 118 9.018 -8.568 8.361 950 HD22 ASN 118 2HD2 ASN 118 9.596 -8.715 9.978 951 H TYR 119 H TYR 119 9.539 -4.337 5.860 952 HA TYR 119 HA TYR 119 10.675 -4.421 3.288 953 HB2 TYR 119 2HB TYR 119 8.312 -3.774 3.675 954 HB3 TYR 119 3HB TYR 119 8.834 -2.309 4.490 955 HD1 TYR 119 HD1 TYR 119 9.075 -4.049 1.170 956 HD2 TYR 119 HD2 TYR 119 8.994 -0.310 3.234 957 HE1 TYR 119 HE1 TYR 119 8.962 -2.865 -0.977 958 HE2 TYR 119 HE2 TYR 119 8.884 0.867 1.089 959 HH TYR 119 HH TYR 119 9.263 0.583 -1.205 960 H GLN 120 H GLN 120 10.579 -1.656 5.542 961 HA GLN 120 HA GLN 120 12.615 -0.120 4.379 962 HB2 GLN 120 2HB GLN 120 11.651 -0.161 7.280 963 HB3 GLN 120 3HB GLN 120 12.643 1.106 6.560 964 HG2 GLN 120 2HG GLN 120 10.775 1.534 4.921 965 HG3 GLN 120 3HG GLN 120 9.789 0.389 5.822 966 HE21 GLN 120 1HE2 GLN 120 9.412 3.269 5.327 967 HE22 GLN 120 2HE2 GLN 120 9.274 4.007 6.878 968 H GLY 121 H GLY 121 12.709 -2.814 6.585 969 HA2 GLY 121 2HA GLY 121 15.273 -2.705 7.645 970 HA3 GLY 121 3HA GLY 121 14.361 -4.174 7.323 971 H TYR 122 H TYR 122 14.262 -4.578 4.703 972 HA TYR 122 HA TYR 122 16.977 -5.256 4.112 973 HB2 TYR 122 2HB TYR 122 16.192 -6.438 2.184 974 HB3 TYR 122 3HB TYR 122 15.023 -6.709 3.465 975 HD1 TYR 122 HD2 TYR 122 15.613 -4.913 0.268 976 HD2 TYR 122 HD1 TYR 122 12.695 -6.030 3.160 977 HE1 TYR 122 HE2 TYR 122 13.845 -4.150 -1.209 978 HE2 TYR 122 HE1 TYR 122 10.925 -5.254 1.643 979 HH TYR 122 HH TYR 122 11.479 -4.490 -1.589 980 H VAL 123 H VAL 123 14.855 -2.636 3.154 981 HA VAL 123 HA VAL 123 16.320 -1.671 0.934 982 HB VAL 123 HB VAL 123 14.627 -0.054 2.897 983 HG11 VAL 123 1HG1 VAL 123 15.684 0.735 0.145 984 HG12 VAL 123 2HG1 VAL 123 16.170 1.436 1.691 985 HG13 VAL 123 3HG1 VAL 123 14.527 1.675 1.094 986 HG21 VAL 123 3HG2 VAL 123 13.896 -1.182 0.161 987 HG22 VAL 123 1HG2 VAL 123 12.842 -0.208 1.193 988 HG23 VAL 123 2HG2 VAL 123 13.347 -1.818 1.708 989 H GLN 124 H GLN 124 16.659 -0.938 4.441 990 HA GLN 124 HA GLN 124 18.926 0.823 3.982 991 HB2 GLN 124 2HB GLN 124 19.076 1.029 6.422 992 HB3 GLN 124 3HB GLN 124 17.430 1.302 5.869 993 HG2 GLN 124 2HG GLN 124 16.718 -0.846 6.653 994 HG3 GLN 124 3HG GLN 124 18.381 -1.342 6.992 995 HE21 GLN 124 1HE2 GLN 124 17.939 -1.772 9.161 996 HE22 GLN 124 2HE2 GLN 124 17.643 -0.524 10.320 997 H ASP 125 H ASP 125 18.507 -2.591 4.484 998 HA ASP 125 HA ASP 125 21.270 -3.191 5.068 999 HB2 ASP 125 2HB ASP 125 18.996 -4.841 3.912 1000 HB3 ASP 125 3HB ASP 125 20.616 -5.511 4.083 1001 H GLY 126 H GLY 126 19.456 -2.368 2.209 1002 HA2 GLY 126 2HA GLY 126 20.171 -1.779 0.105 1003 HA3 GLY 126 3HA GLY 126 21.827 -2.064 0.616 1004 H HIS 127 H HIS 127 19.033 -4.289 0.529 1005 HA HIS 127 HA HIS 127 19.749 -5.543 -1.935 1006 HB2 HIS 127 2HB HIS 127 21.506 -6.498 -0.312 1007 HB3 HIS 127 3HB HIS 127 20.188 -7.309 0.527 1008 HD1 HIS 127 HD1 HIS 127 22.371 -7.537 -2.445 1009 HD2 HIS 127 HD2 HIS 127 18.936 -9.407 -1.037 1010 HE1 HIS 127 HE1 HIS 127 22.115 -9.604 -3.832 1011 HE2 HIS 127 HE2 HIS 127 20.080 -10.762 -2.909 1012 H ASP 128 H ASP 128 18.072 -6.906 -2.680 1013 HA ASP 128 HA ASP 128 15.502 -6.421 -1.556 1014 HB2 ASP 128 2HB ASP 128 14.602 -7.699 -3.428 1015 HB3 ASP 128 3HB ASP 128 15.887 -6.650 -4.006 1016 H HIS 129 H HIS 129 14.169 -7.674 -0.396 1017 HA HIS 129 HA HIS 129 14.687 -10.534 0.083 1018 HB2 HIS 129 2HB HIS 129 14.571 -8.410 2.243 1019 HB3 HIS 129 3HB HIS 129 14.054 -10.047 2.606 1020 HD1 HIS 129 HD1 HIS 129 15.837 -11.640 3.304 1021 HD2 HIS 129 HD2 HIS 129 17.429 -8.269 1.470 1022 HE1 HIS 129 HE1 HIS 129 18.320 -11.833 3.570 1023 HE2 HIS 129 HE2 HIS 129 19.239 -9.721 2.581 1024 H ASP 130 H ASP 130 12.861 -8.954 -1.485 1025 HA ASP 130 HA ASP 130 10.213 -9.589 -0.319 1026 HB2 ASP 130 2HB ASP 130 9.365 -7.449 -1.119 1027 HB3 ASP 130 3HB ASP 130 10.781 -7.141 -0.124 1028 H PHE 131 H PHE 131 11.989 -10.917 -2.350 1029 HA PHE 131 HA PHE 131 12.178 -11.569 -4.501 1030 HB2 PHE 131 2HB PHE 131 9.952 -12.427 -5.523 1031 HB3 PHE 131 3HB PHE 131 10.503 -13.165 -4.042 1032 HD1 PHE 131 HD1 PHE 131 9.322 -12.526 -1.843 1033 HD2 PHE 131 HD2 PHE 131 7.796 -11.431 -5.692 1034 HE1 PHE 131 HE1 PHE 131 7.105 -12.131 -0.855 1035 HE2 PHE 131 HE2 PHE 131 5.592 -11.020 -4.689 1036 HZ PHE 131 HZ PHE 131 5.245 -11.351 -2.271 1037 H GLY 132 H GLY 132 12.306 -8.814 -4.296 1038 HA2 GLY 132 2HA GLY 132 10.609 -7.701 -6.439 1039 HA3 GLY 132 3HA GLY 132 11.303 -6.805 -5.106 1040 H ARG 133 H ARG 133 13.364 -5.917 -5.336 1041 HA ARG 133 HA ARG 133 14.752 -6.230 -7.884 1042 HB2 ARG 133 2HB ARG 133 14.361 -3.981 -8.697 1043 HB3 ARG 133 3HB ARG 133 12.803 -4.746 -8.431 1044 HG2 ARG 133 2HG ARG 133 14.065 -2.824 -6.449 1045 HG3 ARG 133 3HG ARG 133 12.986 -2.315 -7.742 1046 HD2 ARG 133 2HD ARG 133 12.225 -4.272 -5.555 1047 HD3 ARG 133 3HD ARG 133 11.870 -2.545 -5.514 1048 HE ARG 133 HE ARG 133 10.609 -4.581 -7.171 1049 HH11 ARG 133 1HH1 ARG 133 10.927 -1.115 -6.548 1050 HH12 ARG 133 2HH1 ARG 133 9.453 -0.726 -7.379 1051 HH21 ARG 133 1HH2 ARG 133 8.680 -4.043 -8.155 1052 HH22 ARG 133 2HH2 ARG 133 8.190 -2.380 -8.281 1053 H ASP 134 H ASP 134 16.438 -4.476 -8.119 1054 HA ASP 134 HA ASP 134 18.318 -4.781 -6.078 1055 HB2 ASP 134 2HB ASP 134 18.783 -4.395 -8.556 1056 HB3 ASP 134 3HB ASP 134 18.374 -2.704 -8.323 1057 HA PRO 135 HA PRO 135 17.913 -1.502 -2.904 1058 HB2 PRO 135 2HB PRO 135 20.685 -0.702 -3.412 1059 HB3 PRO 135 3HB PRO 135 20.015 -1.593 -2.041 1060 HG2 PRO 135 2HG PRO 135 21.256 -2.637 -4.530 1061 HG3 PRO 135 3HG PRO 135 21.180 -3.370 -2.909 1062 HD2 PRO 135 2HD PRO 135 19.692 -4.370 -4.852 1063 HD3 PRO 135 3HD PRO 135 18.970 -4.158 -3.233 1064 H LYS 136 H LYS 136 19.313 -0.588 -6.056 1065 HA LYS 136 HA LYS 136 19.037 2.247 -5.555 1066 HB2 LYS 136 2HB LYS 136 19.976 2.575 -7.753 1067 HB3 LYS 136 3HB LYS 136 20.854 1.274 -6.954 1068 HG2 LYS 136 2HG LYS 136 19.432 -0.367 -8.274 1069 HG3 LYS 136 3HG LYS 136 18.797 1.014 -9.170 1070 HD2 LYS 136 2HD LYS 136 20.589 -0.019 -10.463 1071 HD3 LYS 136 3HD LYS 136 21.137 1.567 -9.907 1072 HE2 LYS 136 2HE LYS 136 22.382 0.474 -8.068 1073 HE3 LYS 136 3HE LYS 136 21.806 -1.100 -8.632 1074 HZ1 LYS 136 3HZ LYS 136 23.036 -0.805 -10.665 1075 HZ2 LYS 136 1HZ LYS 136 24.076 -0.604 -9.348 1076 HZ3 LYS 136 2HZ LYS 136 23.525 0.743 -10.206 1077 H TYR 137 H TYR 137 16.718 0.009 -6.221 1078 HA TYR 137 HA TYR 137 14.889 1.994 -7.483 1079 HB2 TYR 137 2HB TYR 137 14.636 -1.042 -7.671 1080 HB3 TYR 137 3HB TYR 137 13.668 0.156 -8.517 1081 HD1 TYR 137 HD2 TYR 137 14.887 1.660 -10.255 1082 HD2 TYR 137 HD1 TYR 137 16.567 -1.951 -8.702 1083 HE1 TYR 137 HE2 TYR 137 16.429 1.549 -12.163 1084 HE2 TYR 137 HE1 TYR 137 18.124 -2.054 -10.605 1085 HH TYR 137 HH TYR 137 18.224 -1.211 -12.936 1086 H LEU 138 H LEU 138 15.667 0.789 -4.593 1087 HA LEU 138 HA LEU 138 13.017 0.017 -3.617 1088 HB2 LEU 138 2HB LEU 138 15.714 0.194 -2.219 1089 HB3 LEU 138 3HB LEU 138 14.234 -0.340 -1.441 1090 HG LEU 138 HG LEU 138 15.654 -1.755 -3.732 1091 HD11 LEU 138 1HD1 LEU 138 15.344 -2.583 -0.827 1092 HD12 LEU 138 2HD1 LEU 138 16.821 -1.986 -1.582 1093 HD13 LEU 138 3HD1 LEU 138 16.128 -3.518 -2.105 1094 HD21 LEU 138 3HD2 LEU 138 13.995 -3.545 -3.453 1095 HD22 LEU 138 1HD2 LEU 138 13.239 -2.033 -3.950 1096 HD23 LEU 138 2HD2 LEU 138 13.120 -2.566 -2.271 1097 H HIS 139 H HIS 139 11.956 1.104 -1.908 1098 HA HIS 139 HA HIS 139 12.660 3.898 -1.332 1099 HB2 HIS 139 2HB HIS 139 11.406 4.125 -3.409 1100 HB3 HIS 139 3HB HIS 139 10.160 3.019 -2.856 1101 HD1 HIS 139 HD1 HIS 139 8.188 4.020 -1.683 1102 HD2 HIS 139 HD2 HIS 139 11.329 6.725 -2.047 1103 HE1 HIS 139 HE1 HIS 139 7.253 6.241 -1.002 1104 HE2 HIS 139 HE2 HIS 139 9.184 7.837 -1.134 1105 H GLN 140 H GLN 140 12.601 3.768 0.869 1106 HA GLN 140 HA GLN 140 10.668 2.300 2.403 1107 HB2 GLN 140 2HB GLN 140 12.416 4.650 3.287 1108 HB3 GLN 140 3HB GLN 140 11.548 3.552 4.352 1109 HG2 GLN 140 2HG GLN 140 12.956 1.687 3.609 1110 HG3 GLN 140 3HG GLN 140 13.810 2.763 2.506 1111 HE21 GLN 140 1HE2 GLN 140 14.858 1.159 4.755 1112 HE22 GLN 140 2HE2 GLN 140 15.656 2.287 5.788 1113 H PHE 141 H PHE 141 8.886 3.108 3.538 1114 HA PHE 141 HA PHE 141 7.390 5.257 2.421 1115 HB2 PHE 141 2HB PHE 141 6.989 3.788 5.059 1116 HB3 PHE 141 3HB PHE 141 5.788 4.791 4.249 1117 HD1 PHE 141 HD1 PHE 141 5.229 4.070 1.763 1118 HD2 PHE 141 HD2 PHE 141 6.895 1.475 4.725 1119 HE1 PHE 141 HE1 PHE 141 4.388 2.117 0.541 1120 HE2 PHE 141 HE2 PHE 141 6.052 -0.467 3.497 1121 HZ PHE 141 HZ PHE 141 4.804 -0.150 1.396 1122 H GLU 142 H GLU 142 7.684 7.375 2.811 1123 HA GLU 142 HA GLU 142 8.991 8.253 5.330 1124 HB2 GLU 142 2HB GLU 142 9.907 10.169 4.018 1125 HB3 GLU 142 3HB GLU 142 10.496 8.610 3.453 1126 HG2 GLU 142 2HG GLU 142 9.028 8.662 1.534 1127 HG3 GLU 142 3HG GLU 142 8.199 10.094 2.141 1128 H GLY 143 H GLY 143 8.369 10.296 6.176 1129 HA2 GLY 143 2HA GLY 143 6.997 12.218 6.342 1130 HA3 GLY 143 3HA GLY 143 5.827 11.487 5.255 1131 H GLU 144 H GLU 144 6.436 8.967 7.099 1132 HA GLU 144 HA GLU 144 5.660 7.908 8.920 1133 HB2 GLU 144 2HB GLU 144 5.054 10.680 10.018 1134 HB3 GLU 144 3HB GLU 144 4.903 9.192 10.951 1135 HG2 GLU 144 2HG GLU 144 7.273 8.792 10.871 1136 HG3 GLU 144 3HG GLU 144 7.511 10.053 9.667 1137 H THR 145 H THR 145 3.519 10.104 7.274 1138 HA THR 145 HA THR 145 1.097 8.957 8.380 1139 HB THR 145 HB THR 145 1.402 10.914 6.060 1140 HG1 THR 145 HG1 THR 145 1.713 11.213 8.767 1141 HG21 THR 145 3HG2 THR 145 -0.825 9.814 6.151 1142 HG22 THR 145 1HG2 THR 145 -0.940 11.514 6.603 1143 HG23 THR 145 2HG2 THR 145 -0.992 10.268 7.851 1144 H PHE 146 H PHE 146 0.680 6.935 7.762 1145 HA PHE 146 HA PHE 146 1.169 5.933 5.064 1146 HB2 PHE 146 2HB PHE 146 0.223 4.652 7.656 1147 HB3 PHE 146 3HB PHE 146 0.170 3.781 6.125 1148 HD1 PHE 146 HD2 PHE 146 2.497 5.449 8.539 1149 HD2 PHE 146 HD1 PHE 146 2.099 2.783 5.227 1150 HE1 PHE 146 HE2 PHE 146 4.840 4.747 8.807 1151 HE2 PHE 146 HE1 PHE 146 4.424 2.090 5.503 1152 HZ PHE 146 HZ PHE 146 5.804 3.061 7.283 1153 H TYR 147 H TYR 147 -0.381 5.625 3.590 1154 HA TYR 147 HA TYR 147 -3.230 5.972 4.293 1155 HB2 TYR 147 2HB TYR 147 -1.725 6.447 1.676 1156 HB3 TYR 147 3HB TYR 147 -3.480 6.360 1.755 1157 HD1 TYR 147 HD1 TYR 147 -0.562 8.255 3.187 1158 HD2 TYR 147 HD2 TYR 147 -4.717 8.308 2.189 1159 HE1 TYR 147 HE1 TYR 147 -0.667 10.644 3.737 1160 HE2 TYR 147 HE2 TYR 147 -4.820 10.692 2.742 1161 HH TYR 147 HH TYR 147 -2.042 12.596 3.234 1162 H ILE 148 H ILE 148 -4.570 4.293 3.891 1163 HA ILE 148 HA ILE 148 -3.549 1.902 2.472 1164 HB ILE 148 HB ILE 148 -5.278 1.912 4.996 1165 HG12 ILE 148 2HG1 ILE 148 -2.399 0.987 4.542 1166 HG13 ILE 148 3HG1 ILE 148 -2.920 2.333 5.546 1167 HG21 ILE 148 1HG2 ILE 148 -4.304 -0.452 3.344 1168 HG22 ILE 148 2HG2 ILE 148 -5.964 0.144 3.406 1169 HG23 ILE 148 3HG2 ILE 148 -5.222 -0.541 4.848 1170 HD11 ILE 148 3HD1 ILE 148 -4.032 0.741 7.059 1171 HD12 ILE 148 1HD1 ILE 148 -2.298 0.463 6.915 1172 HD13 ILE 148 2HD1 ILE 148 -3.430 -0.593 6.071 1173 H ILE 149 H ILE 149 -4.657 1.855 0.628 1174 HA ILE 149 HA ILE 149 -7.532 2.578 0.584 1175 HB ILE 149 HB ILE 149 -5.801 2.175 -1.899 1176 HG12 ILE 149 2HG1 ILE 149 -4.657 3.936 -0.611 1177 HG13 ILE 149 3HG1 ILE 149 -5.435 4.637 -2.021 1178 HG21 ILE 149 1HG2 ILE 149 -8.226 2.146 -2.242 1179 HG22 ILE 149 2HG2 ILE 149 -7.528 3.590 -2.975 1180 HG23 ILE 149 3HG2 ILE 149 -8.390 3.713 -1.440 1181 HD11 ILE 149 3HD1 ILE 149 -5.664 6.072 -0.101 1182 HD12 ILE 149 1HD1 ILE 149 -6.428 4.779 0.821 1183 HD13 ILE 149 2HD1 ILE 149 -7.246 5.465 -0.585 1184 H GLU 150 H GLU 150 -9.037 1.044 -0.176 1185 HA GLU 150 HA GLU 150 -8.129 -1.756 -0.154 1186 HB2 GLU 150 2HB GLU 150 -10.019 -1.058 1.320 1187 HB3 GLU 150 3HB GLU 150 -10.952 -0.602 -0.103 1188 HG2 GLU 150 2HG GLU 150 -10.866 -2.981 -0.880 1189 HG3 GLU 150 3HG GLU 150 -10.025 -3.405 0.612 1190 H GLN 151 H GLN 151 -7.712 -2.733 -2.054 1191 HA GLN 151 HA GLN 151 -9.374 -2.144 -4.444 1192 HB2 GLN 151 2HB GLN 151 -6.514 -3.231 -4.411 1193 HB3 GLN 151 3HB GLN 151 -7.502 -3.010 -5.850 1194 HG2 GLN 151 2HG GLN 151 -5.968 -1.208 -5.801 1195 HG3 GLN 151 3HG GLN 151 -7.530 -0.535 -5.336 1196 HE21 GLN 151 1HE2 GLN 151 -5.581 -2.418 -3.078 1197 HE22 GLN 151 2HE2 GLN 151 -5.157 -1.083 -2.070 1198 H ARG 152 H ARG 152 -10.242 -3.832 -5.483 1199 HA ARG 152 HA ARG 152 -10.020 -6.553 -4.341 1200 HB2 ARG 152 2HB ARG 152 -12.147 -5.338 -6.184 1201 HB3 ARG 152 3HB ARG 152 -12.130 -6.998 -5.620 1202 HG2 ARG 152 2HG ARG 152 -13.728 -5.905 -4.255 1203 HG3 ARG 152 3HG ARG 152 -12.297 -6.076 -3.238 1204 HD2 ARG 152 2HD ARG 152 -11.705 -3.725 -3.659 1205 HD3 ARG 152 3HD ARG 152 -13.095 -3.541 -4.725 1206 HE ARG 152 HE ARG 152 -13.094 -3.716 -1.800 1207 HH11 ARG 152 1HH1 ARG 152 -15.004 -3.391 -4.735 1208 HH12 ARG 152 2HH1 ARG 152 -16.412 -2.836 -3.891 1209 HH21 ARG 152 1HH2 ARG 152 -14.905 -2.962 -0.724 1210 HH22 ARG 152 2HH2 ARG 152 -16.355 -2.591 -1.609 1211 H LEU 153 H LEU 153 -10.324 -8.270 -6.286 1212 HA LEU 153 HA LEU 153 -8.098 -8.221 -7.967 1213 HB2 LEU 153 2HB LEU 153 -10.718 -9.738 -8.269 1214 HB3 LEU 153 3HB LEU 153 -9.383 -9.960 -9.391 1215 HG LEU 153 HG LEU 153 -9.311 -10.589 -6.408 1216 HD11 LEU 153 1HD1 LEU 153 -9.169 -12.937 -7.107 1217 HD12 LEU 153 2HD1 LEU 153 -9.346 -12.467 -8.799 1218 HD13 LEU 153 3HD1 LEU 153 -10.670 -12.201 -7.662 1219 HD21 LEU 153 3HD2 LEU 153 -7.133 -9.816 -7.227 1220 HD22 LEU 153 1HD2 LEU 153 -7.181 -11.011 -8.527 1221 HD23 LEU 153 2HD2 LEU 153 -7.098 -11.534 -6.841 1222 H GLU 154 H GLU 154 -7.622 -7.055 -9.690 1223 HA GLU 154 HA GLU 154 -8.939 -4.850 -10.586 1224 HB2 GLU 154 2HB GLU 154 -7.027 -6.589 -12.186 1225 HB3 GLU 154 3HB GLU 154 -7.424 -4.915 -12.572 1226 HG2 GLU 154 2HG GLU 154 -6.412 -4.163 -10.467 1227 HG3 GLU 154 3HG GLU 154 -6.085 -5.837 -10.012 1228 H HIS 155 H HIS 155 -9.198 -8.083 -11.946 1229 HA HIS 155 HA HIS 155 -11.874 -7.622 -12.824 1230 HB2 HIS 155 2HB HIS 155 -11.444 -8.305 -15.251 1231 HB3 HIS 155 3HB HIS 155 -10.925 -6.680 -14.817 1232 HD1 HIS 155 HD1 HIS 155 -9.688 -9.828 -16.257 1233 HD2 HIS 155 HD2 HIS 155 -8.045 -6.422 -14.537 1234 HE1 HIS 155 HE1 HIS 155 -7.257 -9.847 -16.889 1235 HE2 HIS 155 HE2 HIS 155 -6.362 -7.668 -16.021 1236 H HIS 156 H HIS 156 -12.992 -9.484 -12.878 1237 HA HIS 156 HA HIS 156 -11.600 -12.061 -12.432 1238 HB2 HIS 156 2HB HIS 156 -14.546 -11.323 -12.026 1239 HB3 HIS 156 3HB HIS 156 -13.820 -12.885 -11.658 1240 HD1 HIS 156 HD1 HIS 156 -13.410 -13.163 -9.252 1241 HD2 HIS 156 HD2 HIS 156 -13.165 -9.167 -10.356 1242 HE1 HIS 156 HE1 HIS 156 -13.066 -11.901 -7.115 1243 HE2 HIS 156 HE2 HIS 156 -13.075 -9.480 -7.796 1244 H HIS 157 H HIS 157 -12.870 -13.946 -13.429 1245 HA HIS 157 HA HIS 157 -14.538 -13.520 -15.727 1246 HB2 HIS 157 2HB HIS 157 -13.092 -14.527 -17.446 1247 HB3 HIS 157 3HB HIS 157 -12.250 -13.143 -16.750 1248 HD1 HIS 157 HD1 HIS 157 -11.949 -16.774 -17.303 1249 HD2 HIS 157 HD2 HIS 157 -10.086 -13.901 -14.947 1250 HE1 HIS 157 HE1 HIS 157 -9.831 -17.838 -16.483 1251 HE2 HIS 157 HE2 HIS 157 -8.650 -16.020 -15.221 1252 H HIS 158 H HIS 158 -15.333 -15.552 -16.574 1253 HA HIS 158 HA HIS 158 -16.165 -17.627 -16.512 1254 HB2 HIS 158 2HB HIS 158 -13.780 -18.332 -16.694 1255 HB3 HIS 158 3HB HIS 158 -13.664 -18.383 -14.937 1256 HD1 HIS 158 HD1 HIS 158 -15.225 -20.234 -13.753 1257 HD2 HIS 158 HD2 HIS 158 -14.722 -20.636 -17.861 1258 HE1 HIS 158 HE1 HIS 158 -15.983 -22.563 -14.300 1259 HE2 HIS 158 HE2 HIS 158 -15.704 -22.766 -16.791 1260 H HIS 159 H HIS 159 -17.974 -17.105 -15.282 1261 HA HIS 159 HA HIS 159 -18.291 -18.802 -13.017 1262 HB2 HIS 159 2HB HIS 159 -18.967 -17.219 -11.305 1263 HB3 HIS 159 3HB HIS 159 -17.372 -16.734 -11.871 1264 HD1 HIS 159 HD1 HIS 159 -20.720 -15.445 -11.269 1265 HD2 HIS 159 HD2 HIS 159 -17.523 -14.417 -13.725 1266 HE1 HIS 159 HE1 HIS 159 -21.134 -13.068 -11.957 1267 HE2 HIS 159 HE2 HIS 159 -19.232 -12.494 -13.500 1268 H HIS 160 H HIS 160 -20.562 -18.929 -12.338 1269 HA HIS 160 HA HIS 160 -22.325 -18.769 -14.616 1270 HB2 HIS 160 2HB HIS 160 -22.350 -20.726 -13.104 1271 HB3 HIS 160 3HB HIS 160 -22.847 -19.708 -11.756 1272 HD1 HIS 160 HD1 HIS 160 -24.150 -20.994 -15.085 1273 HD2 HIS 160 HD2 HIS 160 -25.582 -19.369 -11.540 1274 HE1 HIS 160 HE1 HIS 160 -26.644 -21.223 -15.193 1275 HE2 HIS 160 HE2 HIS 160 -27.491 -20.160 -13.085 Start of MODEL 10 1 H1 MET 1 1H MET 1 -29.300 0.313 3.635 2 H2 MET 1 2H MET 1 -30.682 1.145 4.129 3 H3 MET 1 3H MET 1 -29.174 1.525 4.800 4 HA MET 1 HA MET 1 -30.018 1.929 1.998 5 HB2 MET 1 2HB MET 1 -29.442 3.902 4.249 6 HB3 MET 1 3HB MET 1 -29.658 4.379 2.567 7 HG2 MET 1 2HG MET 1 -31.698 4.781 3.814 8 HG3 MET 1 3HG MET 1 -31.975 3.496 2.638 9 HE1 MET 1 3HE MET 1 -33.945 4.107 5.141 10 HE2 MET 1 1HE MET 1 -34.297 2.456 5.649 11 HE3 MET 1 2HE MET 1 -34.236 2.854 3.932 12 H VAL 2 H VAL 2 -28.301 1.195 0.820 13 HA VAL 2 HA VAL 2 -25.650 2.345 1.204 14 HB VAL 2 HB VAL 2 -25.671 0.375 2.741 15 HG11 VAL 2 1HG1 VAL 2 -25.772 -1.930 1.901 16 HG12 VAL 2 2HG1 VAL 2 -26.095 -1.340 0.269 17 HG13 VAL 2 3HG1 VAL 2 -27.270 -1.063 1.556 18 HG21 VAL 2 3HG2 VAL 2 -23.528 1.058 1.777 19 HG22 VAL 2 1HG2 VAL 2 -23.793 0.018 0.375 20 HG23 VAL 2 2HG2 VAL 2 -23.573 -0.694 1.978 21 H GLU 3 H GLU 3 -24.299 2.110 -0.627 22 HA GLU 3 HA GLU 3 -25.546 1.843 -3.177 23 HB2 GLU 3 2HB GLU 3 -22.644 2.176 -2.311 24 HB3 GLU 3 3HB GLU 3 -23.099 2.028 -4.004 25 HG2 GLU 3 2HG GLU 3 -22.799 4.373 -3.442 26 HG3 GLU 3 3HG GLU 3 -24.490 4.055 -3.824 27 HA PRO 4 HA PRO 4 -25.055 -2.518 -4.025 28 HB2 PRO 4 2HB PRO 4 -24.648 -2.627 -6.724 29 HB3 PRO 4 3HB PRO 4 -26.185 -2.066 -6.025 30 HG2 PRO 4 2HG PRO 4 -23.869 -0.425 -7.031 31 HG3 PRO 4 3HG PRO 4 -25.605 -0.242 -7.379 32 HD2 PRO 4 2HD PRO 4 -24.371 1.283 -5.512 33 HD3 PRO 4 3HD PRO 4 -26.057 0.758 -5.316 34 H GLY 5 H GLY 5 -22.410 -1.049 -3.367 35 HA2 GLY 5 2HA GLY 5 -20.274 -1.784 -2.999 36 HA3 GLY 5 3HA GLY 5 -20.681 -3.295 -3.799 37 H VAL 6 H VAL 6 -20.565 0.116 -4.827 38 HA VAL 6 HA VAL 6 -19.130 -0.532 -7.283 39 HB VAL 6 HB VAL 6 -19.403 1.874 -7.827 40 HG11 VAL 6 1HG1 VAL 6 -21.970 0.607 -6.789 41 HG12 VAL 6 2HG1 VAL 6 -21.240 0.328 -8.371 42 HG13 VAL 6 3HG1 VAL 6 -21.875 1.924 -7.966 43 HG21 VAL 6 3HG2 VAL 6 -20.661 3.400 -6.310 44 HG22 VAL 6 1HG2 VAL 6 -19.146 2.858 -5.581 45 HG23 VAL 6 2HG2 VAL 6 -20.675 2.144 -5.067 46 H ALA 7 H ALA 7 -17.919 -0.651 -4.426 47 HA ALA 7 HA ALA 7 -15.878 1.394 -4.349 48 HB1 ALA 7 3HB ALA 7 -16.958 0.673 -2.285 49 HB2 ALA 7 1HB ALA 7 -15.236 0.292 -2.224 50 HB3 ALA 7 2HB ALA 7 -16.414 -0.984 -2.542 51 H LYS 8 H LYS 8 -14.363 1.130 -5.920 52 HA LYS 8 HA LYS 8 -12.356 -0.905 -5.593 53 HB2 LYS 8 2HB LYS 8 -13.949 -2.097 -7.111 54 HB3 LYS 8 3HB LYS 8 -13.887 -0.755 -8.244 55 HG2 LYS 8 2HG LYS 8 -12.506 -2.535 -9.092 56 HG3 LYS 8 3HG LYS 8 -11.450 -1.210 -8.593 57 HD2 LYS 8 2HD LYS 8 -10.909 -2.409 -6.505 58 HD3 LYS 8 3HD LYS 8 -12.014 -3.715 -6.952 59 HE2 LYS 8 2HE LYS 8 -9.685 -4.338 -7.417 60 HE3 LYS 8 3HE LYS 8 -10.609 -4.240 -8.912 61 HZ1 LYS 8 3HZ LYS 8 -8.421 -3.231 -9.113 62 HZ2 LYS 8 1HZ LYS 8 -8.785 -2.124 -7.891 63 HZ3 LYS 8 2HZ LYS 8 -9.635 -2.085 -9.347 64 H LEU 9 H LEU 9 -10.403 0.045 -6.037 65 HA LEU 9 HA LEU 9 -10.378 2.708 -7.268 66 HB2 LEU 9 2HB LEU 9 -9.322 2.224 -5.003 67 HB3 LEU 9 3HB LEU 9 -8.121 1.256 -5.823 68 HG LEU 9 HG LEU 9 -7.556 3.730 -5.102 69 HD11 LEU 9 1HD1 LEU 9 -5.988 2.373 -6.368 70 HD12 LEU 9 2HD1 LEU 9 -5.967 4.053 -6.904 71 HD13 LEU 9 3HD1 LEU 9 -6.787 2.827 -7.876 72 HD21 LEU 9 3HD2 LEU 9 -8.941 4.342 -7.733 73 HD22 LEU 9 1HD2 LEU 9 -8.016 5.472 -6.741 74 HD23 LEU 9 2HD2 LEU 9 -9.525 4.799 -6.131 75 H THR 10 H THR 10 -8.760 3.203 -8.845 76 HA THR 10 HA THR 10 -8.875 1.446 -11.072 77 HB THR 10 HB THR 10 -7.719 3.365 -12.215 78 HG1 THR 10 HG1 THR 10 -7.699 5.278 -10.534 79 HG21 THR 10 3HG2 THR 10 -9.522 5.036 -11.863 80 HG22 THR 10 1HG2 THR 10 -10.043 4.173 -10.410 81 HG23 THR 10 2HG2 THR 10 -10.187 3.409 -11.996 82 H THR 11 H THR 11 -6.977 1.057 -12.491 83 HA THR 11 HA THR 11 -4.889 -0.296 -11.020 84 HB THR 11 HB THR 11 -4.126 -0.998 -13.363 85 HG1 THR 11 HG1 THR 11 -4.994 -0.017 -15.002 86 HG21 THR 11 3HG2 THR 11 -7.037 -1.574 -12.658 87 HG22 THR 11 1HG2 THR 11 -5.634 -2.435 -12.015 88 HG23 THR 11 2HG2 THR 11 -6.023 -2.538 -13.733 89 H TYR 12 H TYR 12 -5.053 2.537 -13.236 90 HA TYR 12 HA TYR 12 -2.316 2.872 -13.701 91 HB2 TYR 12 2HB TYR 12 -2.820 5.148 -14.464 92 HB3 TYR 12 3HB TYR 12 -4.038 4.027 -15.043 93 HD1 TYR 12 HD2 TYR 12 -3.401 6.754 -12.556 94 HD2 TYR 12 HD1 TYR 12 -6.382 4.362 -14.478 95 HE1 TYR 12 HE2 TYR 12 -5.153 8.194 -11.622 96 HE2 TYR 12 HE1 TYR 12 -8.130 5.819 -13.549 97 HH TYR 12 HH TYR 12 -7.451 8.815 -12.031 98 H ALA 13 H ALA 13 -4.252 4.045 -11.018 99 HA ALA 13 HA ALA 13 -2.318 5.825 -9.890 100 HB1 ALA 13 3HB ALA 13 -4.775 4.540 -8.662 101 HB2 ALA 13 1HB ALA 13 -4.741 6.068 -9.538 102 HB3 ALA 13 2HB ALA 13 -3.894 5.918 -7.999 103 H SER 14 H SER 14 -3.304 2.495 -9.326 104 HA SER 14 HA SER 14 -1.662 1.993 -7.051 105 HB2 SER 14 2HB SER 14 -3.065 0.092 -8.972 106 HB3 SER 14 3HB SER 14 -2.372 -0.356 -7.412 107 HG SER 14 HG SER 14 -4.663 1.134 -7.983 108 H LYS 15 H LYS 15 -1.215 1.798 -10.507 109 HA LYS 15 HA LYS 15 1.064 0.172 -10.728 110 HB2 LYS 15 2HB LYS 15 -0.023 2.478 -12.385 111 HB3 LYS 15 3HB LYS 15 1.471 1.680 -12.844 112 HG2 LYS 15 2HG LYS 15 -1.178 0.225 -12.550 113 HG3 LYS 15 3HG LYS 15 -0.590 0.913 -14.069 114 HD2 LYS 15 2HD LYS 15 1.479 -0.514 -13.824 115 HD3 LYS 15 3HD LYS 15 0.720 -1.288 -12.430 116 HE2 LYS 15 2HE LYS 15 -1.064 -2.156 -13.849 117 HE3 LYS 15 3HE LYS 15 -0.426 -1.281 -15.245 118 HZ1 LYS 15 3HZ LYS 15 0.297 -3.527 -15.379 119 HZ2 LYS 15 1HZ LYS 15 0.872 -3.519 -13.792 120 HZ3 LYS 15 2HZ LYS 15 1.649 -2.598 -14.971 121 H GLN 16 H GLN 16 0.796 3.728 -10.596 122 HA GLN 16 HA GLN 16 3.594 4.192 -10.665 123 HB2 GLN 16 2HB GLN 16 1.328 6.067 -9.874 124 HB3 GLN 16 3HB GLN 16 2.984 6.565 -10.210 125 HG2 GLN 16 2HG GLN 16 1.032 5.334 -12.180 126 HG3 GLN 16 3HG GLN 16 1.579 7.009 -12.146 127 HE21 GLN 16 1HE2 GLN 16 3.746 7.468 -12.781 128 HE22 GLN 16 2HE2 GLN 16 4.647 6.364 -13.760 129 H ALA 17 H ALA 17 1.235 4.024 -8.036 130 HA ALA 17 HA ALA 17 2.671 5.011 -5.882 131 HB1 ALA 17 3HB ALA 17 0.730 2.672 -5.853 132 HB2 ALA 17 1HB ALA 17 0.284 4.378 -5.795 133 HB3 ALA 17 2HB ALA 17 1.192 3.660 -4.463 134 H THR 18 H THR 18 2.560 1.662 -7.115 135 HA THR 18 HA THR 18 4.379 0.606 -5.191 136 HB THR 18 HB THR 18 4.396 -1.435 -6.679 137 HG1 THR 18 HG1 THR 18 2.377 -0.198 -8.224 138 HG21 THR 18 3HG2 THR 18 2.031 -2.019 -6.330 139 HG22 THR 18 1HG2 THR 18 1.644 -0.318 -6.048 140 HG23 THR 18 2HG2 THR 18 2.688 -1.186 -4.919 141 H ASP 19 H ASP 19 4.741 1.852 -8.497 142 HA ASP 19 HA ASP 19 7.385 1.150 -9.050 143 HB2 ASP 19 2HB ASP 19 5.643 3.460 -9.955 144 HB3 ASP 19 3HB ASP 19 7.338 3.424 -10.434 145 H MET 20 H MET 20 6.227 4.076 -7.281 146 HA MET 20 HA MET 20 8.889 5.063 -6.799 147 HB2 MET 20 2HB MET 20 6.191 5.863 -5.671 148 HB3 MET 20 3HB MET 20 7.671 6.526 -4.994 149 HG2 MET 20 2HG MET 20 7.119 8.173 -6.512 150 HG3 MET 20 3HG MET 20 8.183 7.178 -7.498 151 HE1 MET 20 3HE MET 20 3.588 7.371 -7.867 152 HE2 MET 20 1HE MET 20 4.558 8.455 -6.872 153 HE3 MET 20 2HE MET 20 4.370 6.762 -6.409 154 H GLY 21 H GLY 21 6.592 3.111 -4.892 155 HA2 GLY 21 2HA GLY 21 8.142 1.417 -3.588 156 HA3 GLY 21 3HA GLY 21 8.536 2.872 -2.680 157 H ALA 22 H ALA 22 5.797 0.875 -3.733 158 HA ALA 22 HA ALA 22 4.613 1.072 -1.045 159 HB1 ALA 22 3HB ALA 22 3.383 2.699 -2.451 160 HB2 ALA 22 1HB ALA 22 2.354 1.343 -1.985 161 HB3 ALA 22 2HB ALA 22 3.023 1.427 -3.619 162 H ILE 23 H ILE 23 3.354 -0.781 -0.496 163 HA ILE 23 HA ILE 23 3.898 -3.170 -2.180 164 HB ILE 23 HB ILE 23 4.214 -4.452 0.011 165 HG12 ILE 23 2HG1 ILE 23 5.219 -2.715 1.877 166 HG13 ILE 23 3HG1 ILE 23 4.004 -1.658 1.172 167 HG21 ILE 23 1HG2 ILE 23 6.280 -2.334 -0.681 168 HG22 ILE 23 2HG2 ILE 23 6.099 -3.917 -1.442 169 HG23 ILE 23 3HG2 ILE 23 6.593 -3.804 0.248 170 HD11 ILE 23 3HD1 ILE 23 3.209 -2.772 3.160 171 HD12 ILE 23 1HD1 ILE 23 3.491 -4.346 2.421 172 HD13 ILE 23 2HD1 ILE 23 2.272 -3.260 1.749 173 H TYR 24 H TYR 24 2.411 -4.891 -2.041 174 HA TYR 24 HA TYR 24 -0.294 -4.153 -1.121 175 HB2 TYR 24 2HB TYR 24 0.668 -6.343 -3.013 176 HB3 TYR 24 3HB TYR 24 -1.003 -6.177 -2.480 177 HD1 TYR 24 HD1 TYR 24 -2.084 -3.782 -2.884 178 HD2 TYR 24 HD2 TYR 24 1.262 -5.327 -5.052 179 HE1 TYR 24 HE1 TYR 24 -2.581 -2.257 -4.748 180 HE2 TYR 24 HE2 TYR 24 0.770 -3.802 -6.899 181 HH TYR 24 HH TYR 24 -1.242 -1.190 -6.639 182 H VAL 25 H VAL 25 -1.016 -4.997 0.695 183 HA VAL 25 HA VAL 25 -0.107 -7.673 1.580 184 HB VAL 25 HB VAL 25 -0.709 -7.010 3.892 185 HG11 VAL 25 1HG1 VAL 25 1.339 -5.159 2.629 186 HG12 VAL 25 2HG1 VAL 25 1.625 -6.797 3.224 187 HG13 VAL 25 3HG1 VAL 25 1.203 -5.511 4.355 188 HG21 VAL 25 3HG2 VAL 25 -1.133 -4.641 4.497 189 HG22 VAL 25 1HG2 VAL 25 -2.399 -5.286 3.448 190 HG23 VAL 25 2HG2 VAL 25 -1.167 -4.212 2.782 191 H ASN 26 H ASN 26 -1.743 -9.050 2.417 192 HA ASN 26 HA ASN 26 -4.493 -8.550 1.545 193 HB2 ASN 26 2HB ASN 26 -4.955 -10.805 2.475 194 HB3 ASN 26 3HB ASN 26 -3.578 -10.843 1.385 195 HD21 ASN 26 1HD2 ASN 26 -4.187 -12.816 3.312 196 HD22 ASN 26 2HD2 ASN 26 -2.879 -12.862 4.439 197 H SER 27 H SER 27 -6.143 -9.344 3.499 198 HA SER 27 HA SER 27 -6.076 -7.200 5.388 199 HB2 SER 27 2HB SER 27 -8.191 -8.099 4.407 200 HB3 SER 27 3HB SER 27 -7.973 -9.574 5.342 201 HG SER 27 HG SER 27 -7.892 -7.165 6.735 202 H LYS 28 H LYS 28 -4.428 -10.167 5.485 203 HA LYS 28 HA LYS 28 -4.130 -10.229 8.372 204 HB2 LYS 28 2HB LYS 28 -2.385 -11.446 6.182 205 HB3 LYS 28 3HB LYS 28 -2.126 -11.682 7.909 206 HG2 LYS 28 2HG LYS 28 -4.555 -12.590 6.340 207 HG3 LYS 28 3HG LYS 28 -3.220 -13.614 6.874 208 HD2 LYS 28 2HD LYS 28 -3.798 -13.048 9.254 209 HD3 LYS 28 3HD LYS 28 -5.196 -12.138 8.665 210 HE2 LYS 28 2HE LYS 28 -6.062 -14.242 7.622 211 HE3 LYS 28 3HE LYS 28 -4.709 -15.124 8.338 212 HZ1 LYS 28 3HZ LYS 28 -6.704 -15.306 9.680 213 HZ2 LYS 28 1HZ LYS 28 -6.789 -13.626 9.833 214 HZ3 LYS 28 2HZ LYS 28 -5.503 -14.471 10.527 215 H GLY 29 H GLY 29 -2.252 -8.980 5.594 216 HA2 GLY 29 2HA GLY 29 -0.975 -6.928 5.800 217 HA3 GLY 29 3HA GLY 29 -0.644 -7.310 7.483 218 H ASP 30 H ASP 30 -0.532 -9.852 5.162 219 HA ASP 30 HA ASP 30 2.399 -9.978 5.233 220 HB2 ASP 30 2HB ASP 30 1.096 -12.061 5.684 221 HB3 ASP 30 3HB ASP 30 0.341 -11.938 4.099 222 H ARG 31 H ARG 31 3.546 -9.219 3.545 223 HA ARG 31 HA ARG 31 2.516 -8.002 1.262 224 HB2 ARG 31 2HB ARG 31 4.778 -7.832 0.429 225 HB3 ARG 31 3HB ARG 31 4.813 -7.583 2.162 226 HG2 ARG 31 2HG ARG 31 5.709 -10.082 0.683 227 HG3 ARG 31 3HG ARG 31 6.762 -8.874 1.416 228 HD2 ARG 31 2HD ARG 31 5.977 -9.512 3.651 229 HD3 ARG 31 3HD ARG 31 4.819 -10.650 2.955 230 HE ARG 31 HE ARG 31 7.752 -10.922 2.974 231 HH11 ARG 31 1HH1 ARG 31 4.597 -12.448 2.560 232 HH12 ARG 31 2HH1 ARG 31 5.269 -14.047 2.507 233 HH21 ARG 31 1HH2 ARG 31 8.590 -12.991 2.895 234 HH22 ARG 31 2HH2 ARG 31 7.535 -14.351 2.699 235 H ILE 32 H ILE 32 1.206 -9.027 -0.111 236 HA ILE 32 HA ILE 32 1.398 -11.863 -0.671 237 HB ILE 32 HB ILE 32 -0.675 -11.561 -1.988 238 HG12 ILE 32 2HG1 ILE 32 -0.441 -8.573 -1.345 239 HG13 ILE 32 3HG1 ILE 32 -0.168 -9.283 -2.932 240 HG21 ILE 32 1HG2 ILE 32 -0.770 -10.139 0.700 241 HG22 ILE 32 2HG2 ILE 32 -0.838 -11.886 0.444 242 HG23 ILE 32 3HG2 ILE 32 -2.150 -10.860 -0.137 243 HD11 ILE 32 3HD1 ILE 32 -2.342 -8.257 -2.817 244 HD12 ILE 32 1HD1 ILE 32 -2.785 -9.255 -1.431 245 HD13 ILE 32 2HD1 ILE 32 -2.511 -10.001 -3.010 246 H VAL 33 H VAL 33 2.224 -8.898 -2.314 247 HA VAL 33 HA VAL 33 3.769 -10.316 -4.299 248 HB VAL 33 HB VAL 33 1.524 -10.286 -5.375 249 HG11 VAL 33 1HG1 VAL 33 0.585 -8.260 -4.368 250 HG12 VAL 33 2HG1 VAL 33 0.464 -8.200 -6.127 251 HG13 VAL 33 3HG1 VAL 33 1.705 -7.258 -5.294 252 HG21 VAL 33 3HG2 VAL 33 3.534 -8.493 -6.781 253 HG22 VAL 33 1HG2 VAL 33 2.193 -9.345 -7.555 254 HG23 VAL 33 2HG2 VAL 33 3.507 -10.260 -6.811 255 H ASN 34 H ASN 34 5.322 -8.986 -5.304 256 HA ASN 34 HA ASN 34 6.497 -6.954 -3.806 257 HB2 ASN 34 2HB ASN 34 7.769 -8.296 -5.397 258 HB3 ASN 34 3HB ASN 34 6.804 -7.709 -6.742 259 HD21 ASN 34 1HD2 ASN 34 8.186 -5.684 -4.154 260 HD22 ASN 34 2HD2 ASN 34 9.274 -4.835 -5.186 261 H GLU 35 H GLU 35 4.657 -6.685 -6.841 262 HA GLU 35 HA GLU 35 3.663 -4.042 -6.296 263 HB2 GLU 35 2HB GLU 35 4.833 -2.922 -8.188 264 HB3 GLU 35 3HB GLU 35 5.970 -3.474 -6.958 265 HG2 GLU 35 2HG GLU 35 6.491 -5.458 -8.362 266 HG3 GLU 35 3HG GLU 35 5.401 -4.843 -9.605 267 H SER 36 H SER 36 2.638 -3.152 -8.397 268 HA SER 36 HA SER 36 1.012 -5.243 -9.634 269 HB2 SER 36 2HB SER 36 -0.321 -3.212 -10.433 270 HB3 SER 36 3HB SER 36 -0.205 -3.379 -8.682 271 HG SER 36 HG SER 36 1.545 -1.746 -10.211 272 H ASN 37 H ASN 37 3.627 -5.398 -10.584 273 HA ASN 37 HA ASN 37 4.286 -3.989 -12.914 274 HB2 ASN 37 2HB ASN 37 5.819 -5.648 -11.838 275 HB3 ASN 37 3HB ASN 37 4.788 -6.966 -12.402 276 HD21 ASN 37 1HD2 ASN 37 6.158 -7.959 -13.833 277 HD22 ASN 37 2HD2 ASN 37 6.872 -7.193 -15.208 278 H VAL 38 H VAL 38 2.478 -7.041 -12.632 279 HA VAL 38 HA VAL 38 0.748 -6.180 -14.863 280 HB VAL 38 HB VAL 38 2.176 -8.118 -15.584 281 HG11 VAL 38 1HG1 VAL 38 1.828 -10.369 -14.649 282 HG12 VAL 38 2HG1 VAL 38 0.759 -9.700 -13.411 283 HG13 VAL 38 3HG1 VAL 38 2.469 -9.258 -13.433 284 HG21 VAL 38 3HG2 VAL 38 -0.784 -8.780 -15.366 285 HG22 VAL 38 1HG2 VAL 38 0.353 -9.509 -16.510 286 HG23 VAL 38 2HG2 VAL 38 -0.028 -7.789 -16.618 287 H TYR 39 H TYR 39 -1.480 -6.646 -14.539 288 HA TYR 39 HA TYR 39 -2.457 -6.467 -11.899 289 HB2 TYR 39 2HB TYR 39 -4.686 -6.635 -12.880 290 HB3 TYR 39 3HB TYR 39 -3.681 -5.618 -13.900 291 HD1 TYR 39 HD2 TYR 39 -2.853 -6.507 -16.124 292 HD2 TYR 39 HD1 TYR 39 -5.634 -8.732 -13.749 293 HE1 TYR 39 HE2 TYR 39 -3.426 -7.891 -18.075 294 HE2 TYR 39 HE1 TYR 39 -6.200 -10.101 -15.702 295 HH TYR 39 HH TYR 39 -6.123 -9.864 -18.205 296 H THR 40 H THR 40 -1.706 -9.186 -13.918 297 HA THR 40 HA THR 40 -3.513 -11.100 -12.926 298 HB THR 40 HB THR 40 -0.822 -11.705 -14.241 299 HG1 THR 40 HG1 THR 40 -2.073 -11.491 -16.225 300 HG21 THR 40 3HG2 THR 40 -2.118 -13.678 -13.468 301 HG22 THR 40 1HG2 THR 40 -2.060 -13.603 -15.233 302 HG23 THR 40 2HG2 THR 40 -3.523 -13.107 -14.376 303 H THR 41 H THR 41 -0.069 -10.446 -12.111 304 HA THR 41 HA THR 41 0.237 -12.592 -10.275 305 HB THR 41 HB THR 41 2.207 -11.480 -11.295 306 HG1 THR 41 HG1 THR 41 1.937 -11.788 -8.525 307 HG21 THR 41 3HG2 THR 41 1.594 -9.124 -9.472 308 HG22 THR 41 1HG2 THR 41 1.483 -9.119 -11.235 309 HG23 THR 41 2HG2 THR 41 3.050 -9.319 -10.449 310 H PHE 42 H PHE 42 -0.966 -9.326 -9.981 311 HA PHE 42 HA PHE 42 -1.048 -9.184 -7.125 312 HB2 PHE 42 2HB PHE 42 -0.935 -7.106 -8.320 313 HB3 PHE 42 3HB PHE 42 -2.275 -7.542 -9.373 314 HD1 PHE 42 HD1 PHE 42 -1.642 -7.177 -5.675 315 HD2 PHE 42 HD2 PHE 42 -4.286 -6.412 -8.959 316 HE1 PHE 42 HE1 PHE 42 -3.212 -6.049 -4.167 317 HE2 PHE 42 HE2 PHE 42 -5.842 -5.276 -7.428 318 HZ PHE 42 HZ PHE 42 -5.301 -5.107 -5.036 319 H ARG 43 H ARG 43 -3.383 -10.002 -9.669 320 HA ARG 43 HA ARG 43 -5.713 -10.075 -8.038 321 HB2 ARG 43 2HB ARG 43 -5.737 -9.741 -10.525 322 HB3 ARG 43 3HB ARG 43 -5.205 -11.408 -10.744 323 HG2 ARG 43 2HG ARG 43 -7.318 -12.191 -9.657 324 HG3 ARG 43 3HG ARG 43 -7.841 -10.509 -9.517 325 HD2 ARG 43 2HD ARG 43 -7.711 -10.307 -12.007 326 HD3 ARG 43 3HD ARG 43 -7.291 -12.020 -12.097 327 HE ARG 43 HE ARG 43 -9.900 -10.851 -11.500 328 HH11 ARG 43 1HH1 ARG 43 -8.013 -13.812 -11.707 329 HH12 ARG 43 2HH1 ARG 43 -9.414 -14.828 -11.776 330 HH21 ARG 43 1HH2 ARG 43 -11.704 -12.189 -11.608 331 HH22 ARG 43 2HH2 ARG 43 -11.508 -13.913 -11.721 332 H ASN 44 H ASN 44 -3.592 -12.584 -9.396 333 HA ASN 44 HA ASN 44 -4.871 -14.828 -8.237 334 HB2 ASN 44 2HB ASN 44 -2.010 -14.518 -9.253 335 HB3 ASN 44 3HB ASN 44 -2.753 -16.060 -8.823 336 HD21 ASN 44 1HD2 ASN 44 -1.693 -15.170 -11.382 337 HD22 ASN 44 2HD2 ASN 44 -2.983 -15.309 -12.519 338 H ALA 45 H ALA 45 -2.427 -12.609 -7.043 339 HA ALA 45 HA ALA 45 -1.568 -14.026 -4.765 340 HB1 ALA 45 3HB ALA 45 -0.426 -12.016 -5.609 341 HB2 ALA 45 1HB ALA 45 -0.837 -11.848 -3.902 342 HB3 ALA 45 2HB ALA 45 -1.802 -11.020 -5.129 343 H ILE 46 H ILE 46 -4.325 -11.792 -5.244 344 HA ILE 46 HA ILE 46 -5.388 -11.898 -2.601 345 HB ILE 46 HB ILE 46 -6.928 -11.402 -5.199 346 HG12 ILE 46 2HG1 ILE 46 -5.569 -9.347 -3.388 347 HG13 ILE 46 3HG1 ILE 46 -4.989 -9.839 -4.977 348 HG21 ILE 46 1HG2 ILE 46 -8.535 -10.164 -3.773 349 HG22 ILE 46 2HG2 ILE 46 -7.599 -10.599 -2.341 350 HG23 ILE 46 3HG2 ILE 46 -8.408 -11.856 -3.280 351 HD11 ILE 46 3HD1 ILE 46 -7.015 -8.923 -6.001 352 HD12 ILE 46 1HD1 ILE 46 -6.130 -7.707 -5.081 353 HD13 ILE 46 2HD1 ILE 46 -7.594 -8.422 -4.409 354 H LEU 47 H LEU 47 -5.956 -13.784 -5.545 355 HA LEU 47 HA LEU 47 -8.102 -15.402 -4.636 356 HB2 LEU 47 2HB LEU 47 -6.073 -15.944 -6.835 357 HB3 LEU 47 3HB LEU 47 -7.572 -16.832 -6.611 358 HG LEU 47 HG LEU 47 -7.359 -13.884 -7.350 359 HD11 LEU 47 1HD1 LEU 47 -8.210 -14.550 -9.547 360 HD12 LEU 47 2HD1 LEU 47 -8.165 -16.249 -9.063 361 HD13 LEU 47 3HD1 LEU 47 -6.666 -15.323 -9.190 362 HD21 LEU 47 3HD2 LEU 47 -9.372 -14.289 -6.023 363 HD22 LEU 47 1HD2 LEU 47 -9.837 -15.618 -7.094 364 HD23 LEU 47 2HD2 LEU 47 -9.788 -13.961 -7.705 365 H LYS 48 H LYS 48 -4.670 -15.580 -4.188 366 HA LYS 48 HA LYS 48 -4.547 -18.361 -3.395 367 HB2 LYS 48 2HB LYS 48 -2.660 -17.156 -4.497 368 HB3 LYS 48 3HB LYS 48 -2.510 -16.112 -3.088 369 HG2 LYS 48 2HG LYS 48 -1.833 -18.004 -1.702 370 HG3 LYS 48 3HG LYS 48 -2.120 -19.129 -3.033 371 HD2 LYS 48 2HD LYS 48 -0.040 -16.906 -3.031 372 HD3 LYS 48 3HD LYS 48 0.296 -18.611 -2.726 373 HE2 LYS 48 2HE LYS 48 -0.520 -19.151 -5.023 374 HE3 LYS 48 3HE LYS 48 -0.776 -17.428 -5.316 375 HZ1 LYS 48 3HZ LYS 48 1.324 -18.198 -6.225 376 HZ2 LYS 48 1HZ LYS 48 1.835 -18.698 -4.693 377 HZ3 LYS 48 2HZ LYS 48 1.582 -17.058 -5.006 378 H GLN 49 H GLN 49 -5.070 -15.272 -1.840 379 HA GLN 49 HA GLN 49 -4.489 -16.212 0.863 380 HB2 GLN 49 2HB GLN 49 -5.651 -13.560 -0.111 381 HB3 GLN 49 3HB GLN 49 -5.187 -13.916 1.551 382 HG2 GLN 49 2HG GLN 49 -3.329 -13.803 -0.835 383 HG3 GLN 49 3HG GLN 49 -3.475 -12.583 0.427 384 HE21 GLN 49 1HE2 GLN 49 -1.142 -14.159 -0.457 385 HE22 GLN 49 2HE2 GLN 49 -0.560 -14.960 0.959 386 H ALA 50 H ALA 50 -6.013 -16.305 2.543 387 HA ALA 50 HA ALA 50 -8.658 -17.251 1.928 388 HB1 ALA 50 3HB ALA 50 -7.372 -18.128 3.850 389 HB2 ALA 50 1HB ALA 50 -8.908 -17.438 4.379 390 HB3 ALA 50 2HB ALA 50 -7.406 -16.539 4.617 391 H ASP 51 H ASP 51 -7.245 -14.271 3.186 392 HA ASP 51 HA ASP 51 -9.725 -12.800 3.393 393 HB2 ASP 51 2HB ASP 51 -6.821 -11.853 3.326 394 HB3 ASP 51 3HB ASP 51 -8.205 -10.817 3.667 395 H LYS 52 H LYS 52 -10.823 -12.129 1.634 396 HA LYS 52 HA LYS 52 -9.565 -12.447 -0.992 397 HB2 LYS 52 2HB LYS 52 -11.873 -13.507 -0.049 398 HB3 LYS 52 3HB LYS 52 -12.542 -12.022 -0.709 399 HG2 LYS 52 2HG LYS 52 -12.681 -13.931 -2.275 400 HG3 LYS 52 3HG LYS 52 -11.724 -12.595 -2.930 401 HD2 LYS 52 2HD LYS 52 -9.647 -13.759 -2.478 402 HD3 LYS 52 3HD LYS 52 -10.481 -15.013 -1.551 403 HE2 LYS 52 2HE LYS 52 -10.801 -14.509 -4.526 404 HE3 LYS 52 3HE LYS 52 -9.816 -15.780 -3.803 405 HZ1 LYS 52 3HZ LYS 52 -11.930 -16.644 -4.514 406 HZ2 LYS 52 1HZ LYS 52 -12.763 -15.514 -3.576 407 HZ3 LYS 52 2HZ LYS 52 -11.837 -16.713 -2.831 408 H VAL 53 H VAL 53 -8.833 -10.158 0.358 409 HA VAL 53 HA VAL 53 -9.394 -8.140 -1.600 410 HB VAL 53 HB VAL 53 -11.266 -7.622 -0.184 411 HG11 VAL 53 1HG1 VAL 53 -9.434 -7.597 2.237 412 HG12 VAL 53 2HG1 VAL 53 -10.654 -8.817 1.855 413 HG13 VAL 53 3HG1 VAL 53 -11.150 -7.165 2.221 414 HG21 VAL 53 3HG2 VAL 53 -10.052 -5.664 -1.004 415 HG22 VAL 53 1HG2 VAL 53 -9.044 -5.649 0.447 416 HG23 VAL 53 2HG2 VAL 53 -10.776 -5.327 0.569 417 H ALA 54 H ALA 54 -7.654 -6.842 -1.850 418 HA ALA 54 HA ALA 54 -5.332 -7.174 -0.047 419 HB1 ALA 54 3HB ALA 54 -4.960 -7.921 -2.352 420 HB2 ALA 54 1HB ALA 54 -3.956 -6.520 -1.972 421 HB3 ALA 54 2HB ALA 54 -5.412 -6.328 -2.958 422 H TYR 55 H TYR 55 -3.871 -5.212 -0.068 423 HA TYR 55 HA TYR 55 -5.278 -2.655 0.125 424 HB2 TYR 55 2HB TYR 55 -4.087 -4.145 2.515 425 HB3 TYR 55 3HB TYR 55 -4.410 -2.415 2.537 426 HD1 TYR 55 HD1 TYR 55 -6.771 -1.570 2.351 427 HD2 TYR 55 HD2 TYR 55 -5.929 -5.745 2.791 428 HE1 TYR 55 HE1 TYR 55 -9.113 -1.984 2.957 429 HE2 TYR 55 HE2 TYR 55 -8.279 -6.151 3.398 430 HH TYR 55 HH TYR 55 -10.711 -3.801 2.910 431 H LEU 56 H LEU 56 -3.989 -1.369 -0.953 432 HA LEU 56 HA LEU 56 -1.146 -1.703 -1.231 433 HB2 LEU 56 2HB LEU 56 -2.569 -0.926 -3.088 434 HB3 LEU 56 3HB LEU 56 -3.052 0.487 -2.162 435 HG LEU 56 HG LEU 56 -0.753 1.392 -2.288 436 HD11 LEU 56 1HD1 LEU 56 0.981 0.302 -3.655 437 HD12 LEU 56 2HD1 LEU 56 -0.063 -1.104 -3.866 438 HD13 LEU 56 3HD1 LEU 56 0.533 -0.680 -2.260 439 HD21 LEU 56 3HD2 LEU 56 -1.844 0.542 -4.987 440 HD22 LEU 56 1HD2 LEU 56 -0.667 1.830 -4.715 441 HD23 LEU 56 2HD2 LEU 56 -2.299 1.983 -4.074 442 H VAL 57 H VAL 57 -0.026 -1.295 0.614 443 HA VAL 57 HA VAL 57 -0.570 1.024 2.306 444 HB VAL 57 HB VAL 57 1.694 -1.021 2.540 445 HG11 VAL 57 1HG1 VAL 57 2.210 1.081 3.723 446 HG12 VAL 57 2HG1 VAL 57 1.911 -0.219 4.879 447 HG13 VAL 57 3HG1 VAL 57 0.667 0.996 4.580 448 HG21 VAL 57 3HG2 VAL 57 -0.990 -0.988 3.961 449 HG22 VAL 57 1HG2 VAL 57 0.340 -2.102 4.301 450 HG23 VAL 57 2HG2 VAL 57 -0.469 -2.146 2.732 451 H MET 58 H MET 58 0.160 2.921 1.607 452 HA MET 58 HA MET 58 3.003 3.200 0.871 453 HB2 MET 58 2HB MET 58 2.475 4.920 -0.808 454 HB3 MET 58 3HB MET 58 1.689 3.409 -1.236 455 HG2 MET 58 2HG MET 58 -0.441 4.258 -0.402 456 HG3 MET 58 3HG MET 58 0.335 5.784 0.037 457 HE1 MET 58 3HE MET 58 -1.766 4.128 -2.490 458 HE2 MET 58 1HE MET 58 -1.889 5.499 -3.592 459 HE3 MET 58 2HE MET 58 -2.217 5.723 -1.876 460 H ASP 59 H ASP 59 3.510 5.662 0.985 461 HA ASP 59 HA ASP 59 2.491 6.713 3.554 462 HB2 ASP 59 2HB ASP 59 4.539 8.129 3.482 463 HB3 ASP 59 3HB ASP 59 4.902 6.411 3.418 464 H GLU 60 H GLU 60 2.784 9.302 3.485 465 HA GLU 60 HA GLU 60 0.583 10.179 1.890 466 HB2 GLU 60 2HB GLU 60 0.940 10.981 4.213 467 HB3 GLU 60 3HB GLU 60 2.391 11.836 3.693 468 HG2 GLU 60 2HG GLU 60 1.096 13.325 2.290 469 HG3 GLU 60 3HG GLU 60 -0.369 12.385 2.551 470 H ARG 61 H ARG 61 4.083 10.520 1.613 471 HA ARG 61 HA ARG 61 4.042 12.746 -0.221 472 HB2 ARG 61 2HB ARG 61 6.253 10.723 0.334 473 HB3 ARG 61 3HB ARG 61 6.453 12.255 -0.517 474 HG2 ARG 61 2HG ARG 61 5.634 11.941 2.393 475 HG3 ARG 61 3HG ARG 61 7.247 12.365 1.818 476 HD2 ARG 61 2HD ARG 61 4.722 14.009 1.479 477 HD3 ARG 61 3HD ARG 61 6.068 14.358 2.568 478 HE ARG 61 HE ARG 61 7.412 14.395 0.347 479 HH11 ARG 61 1HH1 ARG 61 4.159 15.654 0.777 480 HH12 ARG 61 2HH1 ARG 61 4.327 16.844 -0.474 481 HH21 ARG 61 1HH2 ARG 61 7.611 15.944 -1.307 482 HH22 ARG 61 2HH2 ARG 61 6.286 17.009 -1.657 483 H THR 62 H THR 62 4.265 9.209 -0.551 484 HA THR 62 HA THR 62 4.334 9.095 -3.399 485 HB THR 62 HB THR 62 3.372 7.006 -1.393 486 HG1 THR 62 HG1 THR 62 5.425 6.670 -1.060 487 HG21 THR 62 3HG2 THR 62 4.245 6.619 -4.286 488 HG22 THR 62 1HG2 THR 62 2.592 6.445 -3.686 489 HG23 THR 62 2HG2 THR 62 3.849 5.328 -3.149 490 H TRP 63 H TRP 63 1.743 9.212 -0.991 491 HA TRP 63 HA TRP 63 -0.482 8.863 -2.689 492 HB2 TRP 63 2HB TRP 63 -0.793 8.644 -0.310 493 HB3 TRP 63 3HB TRP 63 -0.190 10.266 -0.006 494 HD1 TRP 63 HD1 TRP 63 -1.993 12.113 0.242 495 HE1 TRP 63 HE1 TRP 63 -4.528 12.259 -0.135 496 HE3 TRP 63 HE3 TRP 63 -2.742 7.623 -2.109 497 HZ2 TRP 63 HZ2 TRP 63 -6.575 10.702 -1.274 498 HZ3 TRP 63 HZ3 TRP 63 -5.024 7.033 -2.819 499 HH2 TRP 63 HH2 TRP 63 -6.905 8.542 -2.412 500 H LYS 64 H LYS 64 1.443 11.785 -1.897 501 HA LYS 64 HA LYS 64 -0.240 13.734 -3.005 502 HB2 LYS 64 2HB LYS 64 2.806 13.703 -2.942 503 HB3 LYS 64 3HB LYS 64 1.828 15.121 -3.314 504 HG2 LYS 64 2HG LYS 64 2.059 13.670 -0.672 505 HG3 LYS 64 3HG LYS 64 2.552 15.323 -1.052 506 HD2 LYS 64 2HD LYS 64 0.065 15.809 -1.494 507 HD3 LYS 64 3HD LYS 64 -0.280 14.231 -0.790 508 HE2 LYS 64 2HE LYS 64 0.764 14.940 1.325 509 HE3 LYS 64 3HE LYS 64 1.147 16.508 0.611 510 HZ1 LYS 64 3HZ LYS 64 -1.184 16.982 0.403 511 HZ2 LYS 64 1HZ LYS 64 -0.857 16.546 2.003 512 HZ3 LYS 64 2HZ LYS 64 -1.601 15.443 0.963 513 H LYS 65 H LYS 65 1.745 11.347 -4.558 514 HA LYS 65 HA LYS 65 1.550 12.497 -7.215 515 HB2 LYS 65 2HB LYS 65 2.495 9.727 -6.361 516 HB3 LYS 65 3HB LYS 65 2.706 10.442 -7.956 517 HG2 LYS 65 2HG LYS 65 4.010 11.335 -5.362 518 HG3 LYS 65 3HG LYS 65 4.801 10.565 -6.738 519 HD2 LYS 65 2HD LYS 65 3.518 13.325 -6.746 520 HD3 LYS 65 3HD LYS 65 5.246 12.995 -6.654 521 HE2 LYS 65 2HE LYS 65 5.298 12.134 -8.892 522 HE3 LYS 65 3HE LYS 65 3.533 12.089 -8.988 523 HZ1 LYS 65 3HZ LYS 65 3.518 14.506 -8.829 524 HZ2 LYS 65 1HZ LYS 65 4.390 13.975 -10.171 525 HZ3 LYS 65 2HZ LYS 65 5.207 14.533 -8.802 526 H VAL 66 H VAL 66 0.180 9.710 -5.459 527 HA VAL 66 HA VAL 66 -1.329 8.600 -7.578 528 HB VAL 66 HB VAL 66 -1.648 8.317 -4.552 529 HG11 VAL 66 1HG1 VAL 66 -2.866 6.213 -4.996 530 HG12 VAL 66 2HG1 VAL 66 -2.803 6.533 -6.729 531 HG13 VAL 66 3HG1 VAL 66 -3.730 7.599 -5.671 532 HG21 VAL 66 3HG2 VAL 66 0.568 7.644 -5.369 533 HG22 VAL 66 1HG2 VAL 66 -0.172 6.584 -6.571 534 HG23 VAL 66 2HG2 VAL 66 -0.346 6.225 -4.851 535 H TYR 67 H TYR 67 -2.474 10.396 -4.716 536 HA TYR 67 HA TYR 67 -5.073 10.991 -5.232 537 HB2 TYR 67 2HB TYR 67 -3.902 11.626 -3.176 538 HB3 TYR 67 3HB TYR 67 -2.917 12.784 -4.043 539 HD1 TYR 67 HD1 TYR 67 -6.523 12.067 -3.240 540 HD2 TYR 67 HD2 TYR 67 -3.552 15.053 -3.988 541 HE1 TYR 67 HE1 TYR 67 -8.131 13.821 -2.625 542 HE2 TYR 67 HE2 TYR 67 -5.161 16.802 -3.378 543 HH TYR 67 HH TYR 67 -7.581 17.106 -3.250 544 H ASP 68 H ASP 68 -2.233 12.735 -6.473 545 HA ASP 68 HA ASP 68 -3.582 14.788 -7.859 546 HB2 ASP 68 2HB ASP 68 -1.205 14.995 -7.331 547 HB3 ASP 68 3HB ASP 68 -0.817 13.591 -8.315 548 H LEU 69 H LEU 69 -2.376 11.591 -8.917 549 HA LEU 69 HA LEU 69 -3.006 11.866 -11.671 550 HB2 LEU 69 2HB LEU 69 -2.603 9.374 -9.978 551 HB3 LEU 69 3HB LEU 69 -2.729 9.357 -11.728 552 HG LEU 69 HG LEU 69 -0.553 10.839 -10.201 553 HD11 LEU 69 1HD1 LEU 69 -0.309 8.441 -9.856 554 HD12 LEU 69 2HD1 LEU 69 0.965 9.053 -10.906 555 HD13 LEU 69 3HD1 LEU 69 -0.390 8.154 -11.598 556 HD21 LEU 69 3HD2 LEU 69 -1.013 11.841 -12.374 557 HD22 LEU 69 1HD2 LEU 69 -0.868 10.268 -13.168 558 HD23 LEU 69 2HD2 LEU 69 0.540 11.014 -12.405 559 H LEU 70 H LEU 70 -4.861 10.706 -8.906 560 HA LEU 70 HA LEU 70 -7.070 9.594 -10.258 561 HB2 LEU 70 2HB LEU 70 -6.974 11.025 -7.568 562 HB3 LEU 70 3HB LEU 70 -8.336 10.075 -8.141 563 HG LEU 70 HG LEU 70 -5.558 8.988 -7.526 564 HD11 LEU 70 1HD1 LEU 70 -6.616 7.849 -5.635 565 HD12 LEU 70 2HD1 LEU 70 -8.157 8.629 -6.008 566 HD13 LEU 70 3HD1 LEU 70 -6.772 9.599 -5.498 567 HD21 LEU 70 3HD2 LEU 70 -6.526 6.757 -7.894 568 HD22 LEU 70 1HD2 LEU 70 -6.582 7.732 -9.360 569 HD23 LEU 70 2HD2 LEU 70 -8.046 7.488 -8.407 570 H ILE 71 H ILE 71 -6.543 12.877 -8.968 571 HA ILE 71 HA ILE 71 -8.937 14.048 -9.962 572 HB ILE 71 HB ILE 71 -6.341 15.439 -9.146 573 HG12 ILE 71 2HG1 ILE 71 -8.799 14.767 -7.451 574 HG13 ILE 71 3HG1 ILE 71 -7.241 13.952 -7.356 575 HG21 ILE 71 1HG2 ILE 71 -7.751 17.429 -8.709 576 HG22 ILE 71 2HG2 ILE 71 -9.167 16.563 -9.309 577 HG23 ILE 71 3HG2 ILE 71 -7.840 16.947 -10.407 578 HD11 ILE 71 3HD1 ILE 71 -6.201 16.027 -6.606 579 HD12 ILE 71 1HD1 ILE 71 -7.518 15.519 -5.549 580 HD13 ILE 71 2HD1 ILE 71 -7.768 16.841 -6.687 581 H LEU 72 H LEU 72 -5.750 13.638 -11.276 582 HA LEU 72 HA LEU 72 -5.841 15.498 -13.424 583 HB2 LEU 72 2HB LEU 72 -3.753 14.660 -12.403 584 HB3 LEU 72 3HB LEU 72 -4.119 13.030 -12.906 585 HG LEU 72 HG LEU 72 -2.277 14.264 -14.183 586 HD11 LEU 72 1HD1 LEU 72 -2.798 13.303 -16.349 587 HD12 LEU 72 2HD1 LEU 72 -4.494 13.117 -15.893 588 HD13 LEU 72 3HD1 LEU 72 -3.247 12.196 -15.052 589 HD21 LEU 72 3HD2 LEU 72 -4.602 15.741 -15.456 590 HD22 LEU 72 1HD2 LEU 72 -2.915 15.797 -15.981 591 HD23 LEU 72 2HD2 LEU 72 -3.368 16.446 -14.406 592 H HIS 73 H HIS 73 -6.651 12.052 -13.049 593 HA HIS 73 HA HIS 73 -6.982 11.631 -15.917 594 HB2 HIS 73 2HB HIS 73 -6.160 9.976 -13.899 595 HB3 HIS 73 3HB HIS 73 -7.850 9.518 -13.956 596 HD1 HIS 73 HD1 HIS 73 -8.662 8.387 -16.203 597 HD2 HIS 73 HD2 HIS 73 -4.582 9.030 -15.909 598 HE1 HIS 73 HE1 HIS 73 -7.642 6.941 -17.963 599 HE2 HIS 73 HE2 HIS 73 -5.170 7.374 -17.795 600 H ASP 74 H ASP 74 -9.169 11.014 -13.091 601 HA ASP 74 HA ASP 74 -11.419 12.396 -13.935 602 HB2 ASP 74 2HB ASP 74 -12.915 10.677 -14.901 603 HB3 ASP 74 3HB ASP 74 -11.509 10.920 -15.918 604 H PHE 75 H PHE 75 -10.747 12.465 -11.518 605 HA PHE 75 HA PHE 75 -12.757 10.995 -10.019 606 HB2 PHE 75 2HB PHE 75 -10.592 9.509 -10.219 607 HB3 PHE 75 3HB PHE 75 -9.887 10.624 -9.061 608 HD1 PHE 75 HD1 PHE 75 -13.194 10.504 -7.986 609 HD2 PHE 75 HD2 PHE 75 -9.751 7.958 -8.269 610 HE1 PHE 75 HE1 PHE 75 -14.074 9.073 -6.193 611 HE2 PHE 75 HE2 PHE 75 -10.659 6.560 -6.471 612 HZ PHE 75 HZ PHE 75 -12.817 7.110 -5.436 613 H THR 76 H THR 76 -13.629 12.814 -9.186 614 HA THR 76 HA THR 76 -12.338 15.241 -8.694 615 HB THR 76 HB THR 76 -15.023 14.158 -7.740 616 HG1 THR 76 HG1 THR 76 -15.554 14.436 -9.741 617 HG21 THR 76 3HG2 THR 76 -14.128 17.051 -7.913 618 HG22 THR 76 1HG2 THR 76 -14.403 16.140 -6.425 619 HG23 THR 76 2HG2 THR 76 -15.747 16.483 -7.507 620 HA PRO 77 HA PRO 77 -10.348 14.624 -4.644 621 HB2 PRO 77 2HB PRO 77 -10.753 17.241 -3.649 622 HB3 PRO 77 3HB PRO 77 -9.399 16.728 -4.676 623 HG2 PRO 77 2HG PRO 77 -11.972 18.048 -5.484 624 HG3 PRO 77 3HG PRO 77 -10.312 18.374 -6.038 625 HD2 PRO 77 2HD PRO 77 -11.937 16.962 -7.589 626 HD3 PRO 77 3HD PRO 77 -10.245 16.437 -7.401 627 H GLU 78 H GLU 78 -13.543 16.089 -4.874 628 HA GLU 78 HA GLU 78 -14.380 15.742 -2.204 629 HB2 GLU 78 2HB GLU 78 -16.029 15.918 -4.756 630 HB3 GLU 78 3HB GLU 78 -16.682 16.047 -3.121 631 HG2 GLU 78 2HG GLU 78 -15.313 18.054 -2.718 632 HG3 GLU 78 3HG GLU 78 -14.630 17.921 -4.337 633 H GLU 79 H GLU 79 -14.799 13.695 -5.095 634 HA GLU 79 HA GLU 79 -16.244 11.599 -3.858 635 HB2 GLU 79 2HB GLU 79 -14.410 11.460 -6.281 636 HB3 GLU 79 3HB GLU 79 -15.593 10.238 -5.813 637 HG2 GLU 79 2HG GLU 79 -17.413 11.843 -6.221 638 HG3 GLU 79 3HG GLU 79 -16.232 13.072 -6.684 639 H ILE 80 H ILE 80 -12.804 12.291 -4.086 640 HA ILE 80 HA ILE 80 -11.837 9.752 -3.170 641 HB ILE 80 HB ILE 80 -10.473 12.494 -3.130 642 HG12 ILE 80 2HG1 ILE 80 -10.256 10.268 -5.219 643 HG13 ILE 80 3HG1 ILE 80 -11.210 11.733 -5.416 644 HG21 ILE 80 1HG2 ILE 80 -9.217 9.730 -2.907 645 HG22 ILE 80 2HG2 ILE 80 -9.351 10.907 -1.600 646 HG23 ILE 80 3HG2 ILE 80 -8.335 11.256 -2.999 647 HD11 ILE 80 3HD1 ILE 80 -9.135 11.919 -6.611 648 HD12 ILE 80 1HD1 ILE 80 -8.210 11.587 -5.144 649 HD13 ILE 80 2HD1 ILE 80 -9.157 13.072 -5.277 650 H LYS 81 H LYS 81 -12.345 12.917 -1.575 651 HA LYS 81 HA LYS 81 -11.419 12.078 0.990 652 HB2 LYS 81 2HB LYS 81 -12.007 14.276 1.774 653 HB3 LYS 81 3HB LYS 81 -11.298 14.420 0.170 654 HG2 LYS 81 2HG LYS 81 -13.757 14.468 -0.684 655 HG3 LYS 81 3HG LYS 81 -14.184 14.805 0.994 656 HD2 LYS 81 2HD LYS 81 -12.283 16.463 -0.720 657 HD3 LYS 81 3HD LYS 81 -13.972 16.863 -0.395 658 HE2 LYS 81 2HE LYS 81 -11.863 16.614 1.784 659 HE3 LYS 81 3HE LYS 81 -12.314 18.134 1.014 660 HZ1 LYS 81 3HZ LYS 81 -14.170 16.373 2.520 661 HZ2 LYS 81 1HZ LYS 81 -14.554 17.861 1.818 662 HZ3 LYS 81 2HZ LYS 81 -13.465 17.791 3.106 663 H SER 82 H SER 82 -14.468 11.777 -0.587 664 HA SER 82 HA SER 82 -16.209 11.757 1.666 665 HB2 SER 82 2HB SER 82 -17.902 10.887 0.125 666 HB3 SER 82 3HB SER 82 -16.965 12.143 -0.692 667 HG SER 82 HG SER 82 -15.658 10.201 -1.425 668 H PHE 83 H PHE 83 -14.106 9.305 0.294 669 HA PHE 83 HA PHE 83 -15.362 7.065 1.615 670 HB2 PHE 83 2HB PHE 83 -12.632 7.337 0.299 671 HB3 PHE 83 3HB PHE 83 -13.232 5.830 0.990 672 HD1 PHE 83 HD2 PHE 83 -15.662 5.100 0.121 673 HD2 PHE 83 HD1 PHE 83 -13.004 7.678 -2.024 674 HE1 PHE 83 HE2 PHE 83 -16.816 4.550 -1.986 675 HE2 PHE 83 HE1 PHE 83 -14.166 7.122 -4.119 676 HZ PHE 83 HZ PHE 83 -16.068 5.560 -4.106 677 H PHE 84 H PHE 84 -13.004 9.465 2.522 678 HA PHE 84 HA PHE 84 -12.046 8.105 4.886 679 HB2 PHE 84 2HB PHE 84 -11.904 11.055 4.130 680 HB3 PHE 84 3HB PHE 84 -11.065 10.324 5.490 681 HD1 PHE 84 HD1 PHE 84 -11.158 10.600 1.811 682 HD2 PHE 84 HD2 PHE 84 -9.007 9.026 5.139 683 HE1 PHE 84 HE1 PHE 84 -9.209 10.238 0.363 684 HE2 PHE 84 HE2 PHE 84 -7.059 8.642 3.679 685 HZ PHE 84 HZ PHE 84 -7.154 9.253 1.297 686 H GLU 85 H GLU 85 -14.971 9.625 4.106 687 HA GLU 85 HA GLU 85 -15.611 10.662 6.764 688 HB2 GLU 85 2HB GLU 85 -17.424 10.398 4.315 689 HB3 GLU 85 3HB GLU 85 -17.713 11.388 5.741 690 HG2 GLU 85 2HG GLU 85 -15.579 11.813 3.638 691 HG3 GLU 85 3HG GLU 85 -17.034 12.777 3.870 692 H ASN 86 H ASN 86 -15.024 7.884 6.713 693 HA ASN 86 HA ASN 86 -17.226 6.161 6.424 694 HB2 ASN 86 2HB ASN 86 -15.828 4.498 7.646 695 HB3 ASN 86 3HB ASN 86 -14.943 5.301 6.359 696 HD21 ASN 86 1HD2 ASN 86 -14.032 3.921 8.856 697 HD22 ASN 86 2HD2 ASN 86 -13.011 5.053 9.636 698 H LYS 87 H LYS 87 -15.800 7.596 9.393 699 HA LYS 87 HA LYS 87 -16.484 7.813 11.541 700 HB2 LYS 87 2HB LYS 87 -19.117 8.402 10.123 701 HB3 LYS 87 3HB LYS 87 -18.774 8.824 11.799 702 HG2 LYS 87 2HG LYS 87 -16.897 10.280 11.009 703 HG3 LYS 87 3HG LYS 87 -17.345 9.910 9.345 704 HD2 LYS 87 2HD LYS 87 -18.256 12.071 9.878 705 HD3 LYS 87 3HD LYS 87 -19.608 10.946 9.800 706 HE2 LYS 87 2HE LYS 87 -18.289 11.811 12.396 707 HE3 LYS 87 3HE LYS 87 -19.688 12.620 11.699 708 HZ1 LYS 87 3HZ LYS 87 -19.549 9.834 12.715 709 HZ2 LYS 87 1HZ LYS 87 -20.865 10.444 11.847 710 HZ3 LYS 87 2HZ LYS 87 -20.449 11.114 13.336 711 H GLY 88 H GLY 88 -16.615 5.065 10.585 712 HA2 GLY 88 2HA GLY 88 -17.277 3.268 12.201 713 HA3 GLY 88 3HA GLY 88 -18.906 3.931 12.107 714 H LYS 89 H LYS 89 -16.360 3.074 9.776 715 HA LYS 89 HA LYS 89 -17.765 0.903 8.566 716 HB2 LYS 89 2HB LYS 89 -19.020 2.910 7.597 717 HB3 LYS 89 3HB LYS 89 -17.516 3.437 6.856 718 HG2 LYS 89 2HG LYS 89 -18.906 2.301 5.201 719 HG3 LYS 89 3HG LYS 89 -17.456 1.342 5.516 720 HD2 LYS 89 2HD LYS 89 -19.394 -0.145 5.394 721 HD3 LYS 89 3HD LYS 89 -18.784 -0.119 7.051 722 HE2 LYS 89 2HE LYS 89 -20.571 1.552 7.620 723 HE3 LYS 89 3HE LYS 89 -21.212 1.373 5.987 724 HZ1 LYS 89 3HZ LYS 89 -22.428 0.006 7.500 725 HZ2 LYS 89 1HZ LYS 89 -21.018 -0.750 8.051 726 HZ3 LYS 89 2HZ LYS 89 -21.544 -0.990 6.464 727 H ARG 90 H ARG 90 -16.380 -0.124 6.887 728 HA ARG 90 HA ARG 90 -13.566 0.425 7.127 729 HB2 ARG 90 2HB ARG 90 -14.423 -1.869 6.750 730 HB3 ARG 90 3HB ARG 90 -15.007 -1.397 5.156 731 HG2 ARG 90 2HG ARG 90 -12.746 -1.046 4.360 732 HG3 ARG 90 3HG ARG 90 -12.084 -1.265 5.984 733 HD2 ARG 90 2HD ARG 90 -13.461 -3.389 4.306 734 HD3 ARG 90 3HD ARG 90 -11.729 -3.263 4.636 735 HE ARG 90 HE ARG 90 -13.549 -3.518 6.919 736 HH11 ARG 90 1HH1 ARG 90 -11.167 -5.100 4.866 737 HH12 ARG 90 2HH1 ARG 90 -10.925 -6.409 5.976 738 HH21 ARG 90 1HH2 ARG 90 -13.223 -5.224 8.346 739 HH22 ARG 90 2HH2 ARG 90 -12.090 -6.480 7.949 740 HA PRO 91 HA PRO 91 -13.867 3.558 3.814 741 HB2 PRO 91 2HB PRO 91 -11.078 4.295 4.341 742 HB3 PRO 91 3HB PRO 91 -12.547 5.200 4.747 743 HG2 PRO 91 2HG PRO 91 -10.890 4.056 6.620 744 HG3 PRO 91 3HG PRO 91 -12.610 4.409 6.891 745 HD2 PRO 91 2HD PRO 91 -11.312 1.781 6.200 746 HD3 PRO 91 3HD PRO 91 -12.647 2.123 7.327 747 H VAL 92 H VAL 92 -13.280 3.506 1.671 748 HA VAL 92 HA VAL 92 -11.624 1.395 0.613 749 HB VAL 92 HB VAL 92 -12.751 3.854 -0.819 750 HG11 VAL 92 1HG1 VAL 92 -11.684 1.255 -2.004 751 HG12 VAL 92 2HG1 VAL 92 -10.909 2.838 -2.106 752 HG13 VAL 92 3HG1 VAL 92 -12.453 2.561 -2.915 753 HG21 VAL 92 3HG2 VAL 92 -13.915 1.051 -0.595 754 HG22 VAL 92 1HG2 VAL 92 -14.580 2.373 -1.562 755 HG23 VAL 92 2HG2 VAL 92 -14.538 2.503 0.198 756 H PHE 93 H PHE 93 -11.281 4.829 1.280 757 HA PHE 93 HA PHE 93 -8.359 4.648 0.824 758 HB2 PHE 93 2HB PHE 93 -10.128 7.130 0.826 759 HB3 PHE 93 3HB PHE 93 -8.384 7.110 0.580 760 HD1 PHE 93 HD1 PHE 93 -8.235 4.699 -1.282 761 HD2 PHE 93 HD2 PHE 93 -10.812 8.105 -1.228 762 HE1 PHE 93 HE1 PHE 93 -8.552 4.503 -3.694 763 HE2 PHE 93 HE2 PHE 93 -11.125 7.891 -3.655 764 HZ PHE 93 HZ PHE 93 -9.998 6.089 -4.883 765 H VAL 94 H VAL 94 -7.382 4.349 2.699 766 HA VAL 94 HA VAL 94 -8.510 5.448 5.212 767 HB VAL 94 HB VAL 94 -6.537 3.122 4.984 768 HG11 VAL 94 1HG1 VAL 94 -8.394 3.989 7.223 769 HG12 VAL 94 2HG1 VAL 94 -6.642 4.209 7.176 770 HG13 VAL 94 3HG1 VAL 94 -7.325 2.584 7.258 771 HG21 VAL 94 3HG2 VAL 94 -8.568 2.464 3.751 772 HG22 VAL 94 1HG2 VAL 94 -9.567 2.887 5.143 773 HG23 VAL 94 2HG2 VAL 94 -8.421 1.551 5.254 774 H LYS 95 H LYS 95 -7.014 6.426 6.701 775 HA LYS 95 HA LYS 95 -4.221 6.782 5.930 776 HB2 LYS 95 2HB LYS 95 -4.259 9.206 6.023 777 HB3 LYS 95 3HB LYS 95 -5.404 8.658 4.804 778 HG2 LYS 95 2HG LYS 95 -7.289 9.168 6.194 779 HG3 LYS 95 3HG LYS 95 -6.270 9.421 7.614 780 HD2 LYS 95 2HD LYS 95 -6.218 11.151 5.108 781 HD3 LYS 95 3HD LYS 95 -7.080 11.556 6.596 782 HE2 LYS 95 2HE LYS 95 -4.987 11.677 7.838 783 HE3 LYS 95 3HE LYS 95 -4.079 11.096 6.439 784 HZ1 LYS 95 3HZ LYS 95 -5.595 13.643 6.523 785 HZ2 LYS 95 1HZ LYS 95 -4.623 13.087 5.258 786 HZ3 LYS 95 2HZ LYS 95 -3.929 13.500 6.739 787 H GLY 96 H GLY 96 -3.121 8.245 7.598 788 HA2 GLY 96 2HA GLY 96 -3.364 9.205 9.883 789 HA3 GLY 96 3HA GLY 96 -4.085 7.662 10.342 790 H SER 97 H SER 97 -2.418 7.316 11.906 791 HA SER 97 HA SER 97 0.347 7.020 11.154 792 HB2 SER 97 2HB SER 97 -0.475 7.424 13.515 793 HB3 SER 97 3HB SER 97 -1.124 5.785 13.532 794 HG SER 97 HG SER 97 1.192 6.419 14.303 795 H LEU 98 H LEU 98 1.456 4.742 11.338 796 HA LEU 98 HA LEU 98 0.510 3.059 9.300 797 HB2 LEU 98 2HB LEU 98 2.868 3.099 9.975 798 HB3 LEU 98 3HB LEU 98 2.462 2.440 11.550 799 HG LEU 98 HG LEU 98 1.796 0.286 10.486 800 HD11 LEU 98 1HD1 LEU 98 2.284 -0.181 8.128 801 HD12 LEU 98 2HD1 LEU 98 2.730 1.508 7.874 802 HD13 LEU 98 3HD1 LEU 98 1.069 1.087 8.294 803 HD21 LEU 98 3HD2 LEU 98 4.033 -0.495 9.875 804 HD22 LEU 98 1HD2 LEU 98 4.084 0.542 11.301 805 HD23 LEU 98 2HD2 LEU 98 4.593 1.175 9.731 806 H GLU 99 H GLU 99 0.354 2.626 12.821 807 HA GLU 99 HA GLU 99 -1.081 0.157 12.770 808 HB2 GLU 99 2HB GLU 99 -0.737 2.155 15.042 809 HB3 GLU 99 3HB GLU 99 -1.292 0.487 15.208 810 HG2 GLU 99 2HG GLU 99 0.898 -0.320 14.371 811 HG3 GLU 99 3HG GLU 99 1.446 1.349 14.223 812 H SER 100 H SER 100 -2.029 3.558 13.134 813 HA SER 100 HA SER 100 -4.703 3.199 13.940 814 HB2 SER 100 2HB SER 100 -3.401 5.502 12.424 815 HB3 SER 100 3HB SER 100 -4.979 5.577 13.210 816 HG SER 100 HG SER 100 -4.046 5.430 15.156 817 H ALA 101 H ALA 101 -3.331 3.785 10.732 818 HA ALA 101 HA ALA 101 -5.693 3.699 9.215 819 HB1 ALA 101 3HB ALA 101 -2.835 3.127 8.347 820 HB2 ALA 101 1HB ALA 101 -3.604 4.715 8.401 821 HB3 ALA 101 2HB ALA 101 -4.190 3.488 7.272 822 H ALA 102 H ALA 102 -3.553 1.202 10.419 823 HA ALA 102 HA ALA 102 -4.415 -0.995 8.857 824 HB1 ALA 102 3HB ALA 102 -2.344 -1.009 10.157 825 HB2 ALA 102 1HB ALA 102 -3.387 -2.342 10.651 826 HB3 ALA 102 2HB ALA 102 -3.262 -0.901 11.662 827 H GLU 103 H GLU 103 -5.409 0.243 12.047 828 HA GLU 103 HA GLU 103 -7.299 -1.728 12.727 829 HB2 GLU 103 2HB GLU 103 -7.271 1.204 13.581 830 HB3 GLU 103 3HB GLU 103 -8.132 -0.105 14.396 831 HG2 GLU 103 2HG GLU 103 -5.971 -1.205 14.895 832 HG3 GLU 103 3HG GLU 103 -5.127 0.113 14.099 833 H GLN 104 H GLN 104 -7.684 1.401 11.104 834 HA GLN 104 HA GLN 104 -10.512 1.345 10.805 835 HB2 GLN 104 2HB GLN 104 -8.408 2.860 9.214 836 HB3 GLN 104 3HB GLN 104 -10.138 3.193 9.162 837 HG2 GLN 104 2HG GLN 104 -10.144 3.937 11.447 838 HG3 GLN 104 3HG GLN 104 -8.485 3.388 11.696 839 HE21 GLN 104 1HE2 GLN 104 -6.781 4.611 10.803 840 HE22 GLN 104 2HE2 GLN 104 -6.999 6.230 10.249 841 H ALA 105 H ALA 105 -7.859 0.274 8.692 842 HA ALA 105 HA ALA 105 -9.533 -0.412 6.441 843 HB1 ALA 105 3HB ALA 105 -7.180 0.243 6.143 844 HB2 ALA 105 1HB ALA 105 -7.476 -1.368 5.485 845 HB3 ALA 105 2HB ALA 105 -6.655 -1.184 7.040 846 H GLY 106 H GLY 106 -8.592 -2.004 9.371 847 HA2 GLY 106 2HA GLY 106 -9.449 -3.939 10.308 848 HA3 GLY 106 3HA GLY 106 -10.272 -4.297 8.795 849 H ILE 107 H ILE 107 -6.834 -3.685 9.280 850 HA ILE 107 HA ILE 107 -6.149 -6.406 8.325 851 HB ILE 107 HB ILE 107 -4.256 -4.011 8.344 852 HG12 ILE 107 2HG1 ILE 107 -5.995 -4.795 5.961 853 HG13 ILE 107 3HG1 ILE 107 -6.317 -3.410 7.004 854 HG21 ILE 107 1HG2 ILE 107 -3.236 -6.236 8.032 855 HG22 ILE 107 2HG2 ILE 107 -3.076 -5.259 6.572 856 HG23 ILE 107 3HG2 ILE 107 -4.292 -6.537 6.648 857 HD11 ILE 107 3HD1 ILE 107 -5.207 -2.716 4.980 858 HD12 ILE 107 1HD1 ILE 107 -3.861 -3.810 5.294 859 HD13 ILE 107 2HD1 ILE 107 -4.155 -2.437 6.367 860 H VAL 108 H VAL 108 -4.465 -7.557 9.475 861 HA VAL 108 HA VAL 108 -4.360 -7.134 12.312 862 HB VAL 108 HB VAL 108 -2.624 -8.994 10.627 863 HG11 VAL 108 1HG1 VAL 108 -2.353 -10.339 12.675 864 HG12 VAL 108 2HG1 VAL 108 -3.255 -9.128 13.592 865 HG13 VAL 108 3HG1 VAL 108 -1.697 -8.711 12.869 866 HG21 VAL 108 3HG2 VAL 108 -4.254 -10.766 11.088 867 HG22 VAL 108 1HG2 VAL 108 -5.004 -9.428 10.212 868 HG23 VAL 108 2HG2 VAL 108 -5.285 -9.613 11.947 869 H VAL 109 H VAL 109 -3.307 -5.423 13.073 870 HA VAL 109 HA VAL 109 -1.335 -3.841 11.971 871 HB VAL 109 HB VAL 109 -1.871 -4.348 14.944 872 HG11 VAL 109 1HG1 VAL 109 -0.384 -2.010 13.678 873 HG12 VAL 109 2HG1 VAL 109 0.329 -3.272 14.685 874 HG13 VAL 109 3HG1 VAL 109 -0.830 -2.141 15.383 875 HG21 VAL 109 3HG2 VAL 109 -3.855 -3.546 13.695 876 HG22 VAL 109 1HG2 VAL 109 -2.938 -2.148 13.133 877 HG23 VAL 109 2HG2 VAL 109 -3.294 -2.337 14.852 878 H ASP 110 H ASP 110 -0.988 -6.668 14.029 879 HA ASP 110 HA ASP 110 1.707 -6.620 14.699 880 HB2 ASP 110 2HB ASP 110 -0.089 -8.127 15.655 881 HB3 ASP 110 3HB ASP 110 -0.021 -9.096 14.190 882 H GLU 111 H GLU 111 0.133 -8.149 11.884 883 HA GLU 111 HA GLU 111 2.524 -9.330 10.869 884 HB2 GLU 111 2HB GLU 111 -0.146 -8.846 9.495 885 HB3 GLU 111 3HB GLU 111 1.166 -9.809 8.818 886 HG2 GLU 111 2HG GLU 111 -0.435 -10.412 11.320 887 HG3 GLU 111 3HG GLU 111 -0.527 -11.257 9.774 888 H LEU 112 H LEU 112 0.628 -6.416 9.921 889 HA LEU 112 HA LEU 112 2.266 -5.916 7.635 890 HB2 LEU 112 2HB LEU 112 1.049 -3.791 7.406 891 HB3 LEU 112 3HB LEU 112 0.004 -5.184 7.600 892 HG LEU 112 HG LEU 112 0.022 -4.373 10.181 893 HD11 LEU 112 1HD1 LEU 112 -0.062 -1.934 10.391 894 HD12 LEU 112 2HD1 LEU 112 0.430 -1.756 8.704 895 HD13 LEU 112 3HD1 LEU 112 1.535 -2.474 9.876 896 HD21 LEU 112 3HD2 LEU 112 -1.729 -3.090 8.083 897 HD22 LEU 112 1HD2 LEU 112 -2.085 -3.303 9.797 898 HD23 LEU 112 2HD2 LEU 112 -1.942 -4.707 8.759 899 H VAL 113 H VAL 113 2.368 -4.637 10.950 900 HA VAL 113 HA VAL 113 4.284 -2.602 10.479 901 HB VAL 113 HB VAL 113 3.666 -4.148 13.040 902 HG11 VAL 113 1HG1 VAL 113 5.993 -3.346 13.186 903 HG12 VAL 113 2HG1 VAL 113 4.959 -2.410 14.263 904 HG13 VAL 113 3HG1 VAL 113 5.482 -1.720 12.725 905 HG21 VAL 113 3HG2 VAL 113 2.539 -2.034 13.722 906 HG22 VAL 113 1HG2 VAL 113 1.842 -2.696 12.240 907 HG23 VAL 113 2HG2 VAL 113 2.946 -1.324 12.157 908 H GLN 114 H GLN 114 4.610 -6.067 11.259 909 HA GLN 114 HA GLN 114 7.403 -6.238 11.402 910 HB2 GLN 114 2HB GLN 114 5.341 -8.275 10.497 911 HB3 GLN 114 3HB GLN 114 7.053 -8.664 10.597 912 HG2 GLN 114 2HG GLN 114 5.331 -7.756 12.921 913 HG3 GLN 114 3HG GLN 114 5.775 -9.425 12.574 914 HE21 GLN 114 1HE2 GLN 114 6.928 -6.340 13.696 915 HE22 GLN 114 2HE2 GLN 114 8.406 -6.909 14.380 916 H THR 115 H THR 115 5.281 -6.781 8.516 917 HA THR 115 HA THR 115 7.476 -7.234 6.779 918 HB THR 115 HB THR 115 5.152 -8.080 6.321 919 HG1 THR 115 HG1 THR 115 6.962 -7.155 4.570 920 HG21 THR 115 3HG2 THR 115 4.603 -5.243 5.388 921 HG22 THR 115 1HG2 THR 115 3.853 -6.038 6.769 922 HG23 THR 115 2HG2 THR 115 3.546 -6.636 5.138 923 H VAL 116 H VAL 116 5.960 -4.263 7.819 924 HA VAL 116 HA VAL 116 7.062 -2.594 5.734 925 HB VAL 116 HB VAL 116 5.651 -1.955 8.362 926 HG11 VAL 116 1HG1 VAL 116 7.292 -0.148 8.062 927 HG12 VAL 116 2HG1 VAL 116 5.665 0.454 7.733 928 HG13 VAL 116 3HG1 VAL 116 6.757 0.091 6.395 929 HG21 VAL 116 3HG2 VAL 116 3.879 -1.065 6.876 930 HG22 VAL 116 1HG2 VAL 116 4.229 -2.757 6.506 931 HG23 VAL 116 2HG2 VAL 116 4.851 -1.478 5.461 932 H LYS 117 H LYS 117 7.956 -3.297 9.155 933 HA LYS 117 HA LYS 117 10.181 -1.466 9.139 934 HB2 LYS 117 2HB LYS 117 10.708 -2.293 11.363 935 HB3 LYS 117 3HB LYS 117 8.968 -2.063 11.229 936 HG2 LYS 117 2HG LYS 117 8.784 -4.567 10.791 937 HG3 LYS 117 3HG LYS 117 10.484 -4.693 11.243 938 HD2 LYS 117 2HD LYS 117 8.299 -3.569 13.040 939 HD3 LYS 117 3HD LYS 117 8.878 -5.233 13.096 940 HE2 LYS 117 2HE LYS 117 10.651 -2.815 13.572 941 HE3 LYS 117 3HE LYS 117 9.861 -3.730 14.853 942 HZ1 LYS 117 3HZ LYS 117 11.075 -5.708 14.078 943 HZ2 LYS 117 1HZ LYS 117 12.104 -4.470 14.598 944 HZ3 LYS 117 2HZ LYS 117 11.888 -4.749 12.952 945 H ASN 118 H ASN 118 9.772 -4.880 8.427 946 HA ASN 118 HA ASN 118 12.544 -5.585 8.250 947 HB2 ASN 118 2HB ASN 118 10.081 -6.882 6.984 948 HB3 ASN 118 3HB ASN 118 11.704 -7.569 6.917 949 HD21 ASN 118 1HD2 ASN 118 9.187 -8.556 8.149 950 HD22 ASN 118 2HD2 ASN 118 9.580 -8.888 9.799 951 H TYR 119 H TYR 119 10.037 -4.606 5.903 952 HA TYR 119 HA TYR 119 11.497 -4.534 3.544 953 HB2 TYR 119 2HB TYR 119 9.083 -4.166 3.532 954 HB3 TYR 119 3HB TYR 119 9.253 -2.703 4.489 955 HD1 TYR 119 HD1 TYR 119 10.473 -4.090 1.183 956 HD2 TYR 119 HD2 TYR 119 9.057 -0.668 3.333 957 HE1 TYR 119 HE1 TYR 119 10.505 -2.769 -0.890 958 HE2 TYR 119 HE2 TYR 119 9.096 0.646 1.262 959 HH TYR 119 HH TYR 119 9.966 0.675 -0.900 960 H GLN 120 H GLN 120 10.916 -1.824 5.786 961 HA GLN 120 HA GLN 120 12.567 0.050 4.569 962 HB2 GLN 120 2HB GLN 120 11.629 -0.136 7.466 963 HB3 GLN 120 3HB GLN 120 12.467 1.264 6.797 964 HG2 GLN 120 2HG GLN 120 10.602 1.468 5.101 965 HG3 GLN 120 3HG GLN 120 9.737 0.213 5.985 966 HE21 GLN 120 1HE2 GLN 120 9.046 3.035 5.487 967 HE22 GLN 120 2HE2 GLN 120 8.801 3.757 7.025 968 H GLY 121 H GLY 121 13.360 -2.540 6.755 969 HA2 GLY 121 2HA GLY 121 15.911 -1.619 7.632 970 HA3 GLY 121 3HA GLY 121 15.294 -3.259 7.726 971 H TYR 122 H TYR 122 14.951 -4.102 5.183 972 HA TYR 122 HA TYR 122 17.698 -4.479 4.422 973 HB2 TYR 122 2HB TYR 122 16.881 -6.080 2.761 974 HB3 TYR 122 3HB TYR 122 16.283 -6.399 4.369 975 HD1 TYR 122 HD2 TYR 122 15.047 -4.456 1.331 976 HD2 TYR 122 HD1 TYR 122 14.150 -7.293 4.399 977 HE1 TYR 122 HE2 TYR 122 12.808 -4.790 0.375 978 HE2 TYR 122 HE1 TYR 122 11.927 -7.626 3.435 979 HH TYR 122 HH TYR 122 10.340 -6.514 2.020 980 H VAL 123 H VAL 123 15.216 -2.356 3.344 981 HA VAL 123 HA VAL 123 16.159 -1.677 0.775 982 HB VAL 123 HB VAL 123 14.710 0.030 2.858 983 HG11 VAL 123 1HG1 VAL 123 15.273 0.734 -0.049 984 HG12 VAL 123 2HG1 VAL 123 15.938 1.549 1.367 985 HG13 VAL 123 3HG1 VAL 123 14.209 1.641 1.031 986 HG21 VAL 123 3HG2 VAL 123 13.391 -1.858 1.974 987 HG22 VAL 123 1HG2 VAL 123 13.681 -1.315 0.330 988 HG23 VAL 123 2HG2 VAL 123 12.719 -0.326 1.427 989 H GLN 124 H GLN 124 16.963 -0.315 3.997 990 HA GLN 124 HA GLN 124 18.982 1.452 2.913 991 HB2 GLN 124 2HB GLN 124 19.386 2.113 5.262 992 HB3 GLN 124 3HB GLN 124 17.689 2.211 4.814 993 HG2 GLN 124 2HG GLN 124 17.272 0.066 5.979 994 HG3 GLN 124 3HG GLN 124 18.970 0.010 6.460 995 HE21 GLN 124 1HE2 GLN 124 18.474 0.061 8.662 996 HE22 GLN 124 2HE2 GLN 124 17.842 1.459 9.451 997 H ASP 125 H ASP 125 18.973 -1.802 4.138 998 HA ASP 125 HA ASP 125 21.829 -2.041 4.479 999 HB2 ASP 125 2HB ASP 125 19.582 -4.040 4.124 1000 HB3 ASP 125 3HB ASP 125 21.256 -4.585 4.117 1001 H GLY 126 H GLY 126 19.672 -2.046 1.742 1002 HA2 GLY 126 2HA GLY 126 20.225 -1.732 -0.471 1003 HA3 GLY 126 3HA GLY 126 21.919 -1.966 -0.086 1004 H HIS 127 H HIS 127 19.207 -4.153 0.555 1005 HA HIS 127 HA HIS 127 19.654 -5.907 -1.683 1006 HB2 HIS 127 2HB HIS 127 21.602 -6.575 -0.313 1007 HB3 HIS 127 3HB HIS 127 20.587 -6.784 1.101 1008 HD1 HIS 127 HD1 HIS 127 21.723 -8.489 -2.008 1009 HD2 HIS 127 HD2 HIS 127 19.101 -9.233 1.133 1010 HE1 HIS 127 HE1 HIS 127 21.228 -10.946 -2.103 1011 HE2 HIS 127 HE2 HIS 127 19.624 -11.367 -0.211 1012 H ASP 128 H ASP 128 17.515 -6.402 -2.107 1013 HA ASP 128 HA ASP 128 15.478 -6.338 -0.091 1014 HB2 ASP 128 2HB ASP 128 13.905 -6.984 -1.821 1015 HB3 ASP 128 3HB ASP 128 15.005 -5.785 -2.490 1016 H HIS 129 H HIS 129 14.165 -8.102 0.650 1017 HA HIS 129 HA HIS 129 15.502 -10.756 0.593 1018 HB2 HIS 129 2HB HIS 129 13.860 -9.451 2.801 1019 HB3 HIS 129 3HB HIS 129 14.242 -11.169 2.790 1020 HD1 HIS 129 HD1 HIS 129 15.527 -10.826 5.036 1021 HD2 HIS 129 HD2 HIS 129 17.151 -8.754 1.825 1022 HE1 HIS 129 HE1 HIS 129 17.793 -10.067 5.791 1023 HE2 HIS 129 HE2 HIS 129 18.772 -8.877 3.811 1024 H ASP 130 H ASP 130 12.266 -9.268 1.016 1025 HA ASP 130 HA ASP 130 10.955 -11.732 0.164 1026 HB2 ASP 130 2HB ASP 130 9.645 -9.077 0.886 1027 HB3 ASP 130 3HB ASP 130 8.874 -10.664 0.823 1028 H PHE 131 H PHE 131 11.893 -11.646 -2.009 1029 HA PHE 131 HA PHE 131 11.834 -11.295 -4.259 1030 HB2 PHE 131 2HB PHE 131 9.470 -11.670 -5.199 1031 HB3 PHE 131 3HB PHE 131 10.090 -12.885 -4.099 1032 HD1 PHE 131 HD2 PHE 131 7.639 -10.112 -4.448 1033 HD2 PHE 131 HD1 PHE 131 9.006 -13.322 -1.971 1034 HE1 PHE 131 HE2 PHE 131 5.639 -9.895 -3.037 1035 HE2 PHE 131 HE1 PHE 131 6.998 -13.092 -0.574 1036 HZ PHE 131 HZ PHE 131 5.321 -11.370 -1.095 1037 H GLY 132 H GLY 132 12.314 -8.854 -3.192 1038 HA2 GLY 132 2HA GLY 132 10.410 -6.841 -4.016 1039 HA3 GLY 132 3HA GLY 132 11.966 -6.573 -3.241 1040 H ARG 133 H ARG 133 13.499 -5.681 -4.474 1041 HA ARG 133 HA ARG 133 13.996 -6.215 -7.219 1042 HB2 ARG 133 2HB ARG 133 13.353 -4.023 -8.199 1043 HB3 ARG 133 3HB ARG 133 11.949 -4.897 -7.596 1044 HG2 ARG 133 2HG ARG 133 12.077 -3.451 -5.500 1045 HG3 ARG 133 3HG ARG 133 13.301 -2.489 -6.336 1046 HD2 ARG 133 2HD ARG 133 11.636 -2.073 -8.170 1047 HD3 ARG 133 3HD ARG 133 10.423 -2.927 -7.206 1048 HE ARG 133 HE ARG 133 11.743 -0.655 -5.933 1049 HH11 ARG 133 1HH1 ARG 133 8.892 -1.804 -7.640 1050 HH12 ARG 133 2HH1 ARG 133 7.914 -0.467 -7.140 1051 HH21 ARG 133 1HH2 ARG 133 10.463 1.134 -5.337 1052 HH22 ARG 133 2HH2 ARG 133 8.802 1.197 -5.837 1053 H ASP 134 H ASP 134 15.416 -4.076 -8.045 1054 HA ASP 134 HA ASP 134 17.825 -4.210 -6.676 1055 HB2 ASP 134 2HB ASP 134 16.861 -1.971 -8.498 1056 HB3 ASP 134 3HB ASP 134 18.534 -2.203 -8.007 1057 HA PRO 135 HA PRO 135 17.472 -1.548 -3.051 1058 HB2 PRO 135 2HB PRO 135 20.131 -0.625 -2.979 1059 HB3 PRO 135 3HB PRO 135 19.567 -2.170 -2.325 1060 HG2 PRO 135 2HG PRO 135 20.844 -1.615 -4.985 1061 HG3 PRO 135 3HG PRO 135 21.156 -2.945 -3.840 1062 HD2 PRO 135 2HD PRO 135 19.649 -3.379 -5.991 1063 HD3 PRO 135 3HD PRO 135 19.180 -4.092 -4.429 1064 H LYS 136 H LYS 136 18.789 -0.294 -6.043 1065 HA LYS 136 HA LYS 136 18.708 2.480 -5.410 1066 HB2 LYS 136 2HB LYS 136 19.161 2.846 -7.746 1067 HB3 LYS 136 3HB LYS 136 20.051 1.406 -7.267 1068 HG2 LYS 136 2HG LYS 136 18.095 0.050 -8.239 1069 HG3 LYS 136 3HG LYS 136 17.520 1.569 -8.925 1070 HD2 LYS 136 2HD LYS 136 18.733 0.541 -10.680 1071 HD3 LYS 136 3HD LYS 136 19.837 1.765 -10.049 1072 HE2 LYS 136 2HE LYS 136 21.048 0.031 -8.783 1073 HE3 LYS 136 3HE LYS 136 19.895 -1.189 -9.342 1074 HZ1 LYS 136 3HZ LYS 136 20.631 -0.811 -11.604 1075 HZ2 LYS 136 1HZ LYS 136 21.941 -1.228 -10.622 1076 HZ3 LYS 136 2HZ LYS 136 21.715 0.376 -11.090 1077 H TYR 137 H TYR 137 16.280 0.192 -6.444 1078 HA TYR 137 HA TYR 137 14.267 2.294 -6.970 1079 HB2 TYR 137 2HB TYR 137 14.159 -0.721 -7.462 1080 HB3 TYR 137 3HB TYR 137 12.883 0.422 -7.874 1081 HD1 TYR 137 HD2 TYR 137 14.047 2.620 -9.218 1082 HD2 TYR 137 HD1 TYR 137 15.293 -1.468 -9.382 1083 HE1 TYR 137 HE2 TYR 137 15.073 3.017 -11.412 1084 HE2 TYR 137 HE1 TYR 137 16.328 -1.068 -11.574 1085 HH TYR 137 HH TYR 137 16.140 0.496 -13.444 1086 H LEU 138 H LEU 138 15.255 0.009 -4.575 1087 HA LEU 138 HA LEU 138 12.817 -0.205 -3.103 1088 HB2 LEU 138 2HB LEU 138 15.726 -0.459 -2.244 1089 HB3 LEU 138 3HB LEU 138 14.381 -0.760 -1.168 1090 HG LEU 138 HG LEU 138 15.071 -2.384 -3.647 1091 HD11 LEU 138 1HD1 LEU 138 15.272 -3.136 -0.707 1092 HD12 LEU 138 2HD1 LEU 138 16.630 -2.713 -1.755 1093 HD13 LEU 138 3HD1 LEU 138 15.681 -4.157 -2.092 1094 HD21 LEU 138 3HD2 LEU 138 13.295 -3.942 -2.931 1095 HD22 LEU 138 1HD2 LEU 138 12.641 -2.353 -3.331 1096 HD23 LEU 138 2HD2 LEU 138 12.826 -2.829 -1.640 1097 H HIS 139 H HIS 139 11.937 1.212 -1.633 1098 HA HIS 139 HA HIS 139 13.396 3.598 -0.718 1099 HB2 HIS 139 2HB HIS 139 12.471 4.379 -2.832 1100 HB3 HIS 139 3HB HIS 139 10.904 3.662 -2.487 1101 HD1 HIS 139 HD1 HIS 139 9.209 5.244 -1.640 1102 HD2 HIS 139 HD2 HIS 139 13.060 6.619 -0.919 1103 HE1 HIS 139 HE1 HIS 139 8.936 7.532 -0.658 1104 HE2 HIS 139 HE2 HIS 139 11.268 8.252 -0.055 1105 H GLN 140 H GLN 140 12.826 4.021 1.392 1106 HA GLN 140 HA GLN 140 10.697 2.505 2.649 1107 HB2 GLN 140 2HB GLN 140 12.389 4.715 3.909 1108 HB3 GLN 140 3HB GLN 140 11.326 3.602 4.753 1109 HG2 GLN 140 2HG GLN 140 13.302 2.547 5.162 1110 HG3 GLN 140 3HG GLN 140 12.911 1.773 3.635 1111 HE21 GLN 140 1HE2 GLN 140 15.479 2.102 4.888 1112 HE22 GLN 140 2HE2 GLN 140 16.459 3.003 3.781 1113 H PHE 141 H PHE 141 8.965 3.455 3.813 1114 HA PHE 141 HA PHE 141 7.470 5.383 2.420 1115 HB2 PHE 141 2HB PHE 141 7.042 4.318 5.245 1116 HB3 PHE 141 3HB PHE 141 5.827 5.109 4.240 1117 HD1 PHE 141 HD1 PHE 141 5.165 3.963 2.021 1118 HD2 PHE 141 HD2 PHE 141 7.354 1.962 5.113 1119 HE1 PHE 141 HE1 PHE 141 4.516 1.781 1.087 1120 HE2 PHE 141 HE2 PHE 141 6.695 -0.203 4.175 1121 HZ PHE 141 HZ PHE 141 5.282 -0.301 2.157 1122 H GLU 142 H GLU 142 7.587 7.492 2.484 1123 HA GLU 142 HA GLU 142 9.244 8.988 4.308 1124 HB2 GLU 142 2HB GLU 142 7.447 9.805 1.995 1125 HB3 GLU 142 3HB GLU 142 8.458 10.937 2.885 1126 HG2 GLU 142 2HG GLU 142 9.453 8.578 1.266 1127 HG3 GLU 142 3HG GLU 142 9.454 10.262 0.738 1128 H GLY 143 H GLY 143 8.532 10.820 5.539 1129 HA2 GLY 143 2HA GLY 143 7.186 12.026 6.943 1130 HA3 GLY 143 3HA GLY 143 5.827 11.565 5.926 1131 H GLU 144 H GLU 144 4.485 11.307 7.747 1132 HA GLU 144 HA GLU 144 5.053 9.008 9.538 1133 HB2 GLU 144 2HB GLU 144 3.394 11.498 10.122 1134 HB3 GLU 144 3HB GLU 144 3.677 10.165 11.240 1135 HG2 GLU 144 2HG GLU 144 6.070 10.709 11.326 1136 HG3 GLU 144 3HG GLU 144 5.838 11.989 10.136 1137 H THR 145 H THR 145 2.649 10.669 7.543 1138 HA THR 145 HA THR 145 0.457 8.980 8.416 1139 HB THR 145 HB THR 145 0.489 11.085 6.210 1140 HG1 THR 145 HG1 THR 145 0.532 12.471 7.788 1141 HG21 THR 145 3HG2 THR 145 -1.464 9.584 6.071 1142 HG22 THR 145 1HG2 THR 145 -1.951 11.189 6.628 1143 HG23 THR 145 2HG2 THR 145 -1.811 9.859 7.781 1144 H PHE 146 H PHE 146 0.255 6.994 7.629 1145 HA PHE 146 HA PHE 146 1.057 6.235 4.916 1146 HB2 PHE 146 2HB PHE 146 -0.006 4.673 7.307 1147 HB3 PHE 146 3HB PHE 146 0.199 3.933 5.723 1148 HD1 PHE 146 HD2 PHE 146 2.121 5.773 8.387 1149 HD2 PHE 146 HD1 PHE 146 2.260 2.985 5.141 1150 HE1 PHE 146 HE2 PHE 146 4.465 5.248 8.927 1151 HE2 PHE 146 HE1 PHE 146 4.588 2.467 5.695 1152 HZ PHE 146 HZ PHE 146 5.700 3.586 7.576 1153 H TYR 147 H TYR 147 -0.373 5.968 3.275 1154 HA TYR 147 HA TYR 147 -3.282 6.024 3.824 1155 HB2 TYR 147 2HB TYR 147 -1.686 6.857 1.365 1156 HB3 TYR 147 3HB TYR 147 -3.418 6.543 1.281 1157 HD1 TYR 147 HD1 TYR 147 -0.897 8.668 3.091 1158 HD2 TYR 147 HD2 TYR 147 -4.965 8.268 1.839 1159 HE1 TYR 147 HE1 TYR 147 -1.360 10.956 3.845 1160 HE2 TYR 147 HE2 TYR 147 -5.420 10.565 2.592 1161 HH TYR 147 HH TYR 147 -2.903 12.750 3.466 1162 H ILE 148 H ILE 148 -4.118 4.091 3.897 1163 HA ILE 148 HA ILE 148 -3.033 1.848 2.313 1164 HB ILE 148 HB ILE 148 -4.913 1.843 4.727 1165 HG12 ILE 148 2HG1 ILE 148 -1.986 1.001 4.440 1166 HG13 ILE 148 3HG1 ILE 148 -2.589 2.382 5.350 1167 HG21 ILE 148 1HG2 ILE 148 -4.741 -0.619 4.682 1168 HG22 ILE 148 2HG2 ILE 148 -3.778 -0.535 3.207 1169 HG23 ILE 148 3HG2 ILE 148 -5.463 -0.013 3.189 1170 HD11 ILE 148 3HD1 ILE 148 -3.726 0.831 6.896 1171 HD12 ILE 148 1HD1 ILE 148 -1.980 0.602 6.842 1172 HD13 ILE 148 2HD1 ILE 148 -3.039 -0.531 6.005 1173 H ILE 149 H ILE 149 -4.057 1.444 0.472 1174 HA ILE 149 HA ILE 149 -6.784 2.483 -0.015 1175 HB ILE 149 HB ILE 149 -4.681 1.606 -2.055 1176 HG12 ILE 149 2HG1 ILE 149 -3.786 3.538 -0.882 1177 HG13 ILE 149 3HG1 ILE 149 -4.333 4.072 -2.465 1178 HG21 ILE 149 1HG2 ILE 149 -6.086 2.804 -3.705 1179 HG22 ILE 149 2HG2 ILE 149 -7.274 3.147 -2.446 1180 HG23 ILE 149 3HG2 ILE 149 -6.966 1.480 -2.936 1181 HD11 ILE 149 3HD1 ILE 149 -6.353 5.012 -1.426 1182 HD12 ILE 149 1HD1 ILE 149 -4.869 5.694 -0.765 1183 HD13 ILE 149 2HD1 ILE 149 -5.768 4.491 0.157 1184 H GLU 150 H GLU 150 -8.378 1.009 -0.062 1185 HA GLU 150 HA GLU 150 -7.943 -1.812 -0.058 1186 HB2 GLU 150 2HB GLU 150 -9.852 -0.827 1.161 1187 HB3 GLU 150 3HB GLU 150 -10.543 -0.239 -0.351 1188 HG2 GLU 150 2HG GLU 150 -10.789 -2.583 -1.140 1189 HG3 GLU 150 3HG GLU 150 -10.114 -3.160 0.379 1190 H GLN 151 H GLN 151 -7.508 -2.948 -1.820 1191 HA GLN 151 HA GLN 151 -9.028 -2.476 -4.319 1192 HB2 GLN 151 2HB GLN 151 -6.344 -3.844 -3.870 1193 HB3 GLN 151 3HB GLN 151 -7.244 -3.963 -5.376 1194 HG2 GLN 151 2HG GLN 151 -6.260 -1.347 -4.187 1195 HG3 GLN 151 3HG GLN 151 -5.388 -2.281 -5.403 1196 HE21 GLN 151 1HE2 GLN 151 -5.464 -0.642 -6.932 1197 HE22 GLN 151 2HE2 GLN 151 -6.915 -0.164 -7.745 1198 H ARG 152 H ARG 152 -10.831 -3.568 -3.846 1199 HA ARG 152 HA ARG 152 -10.934 -6.253 -2.775 1200 HB2 ARG 152 2HB ARG 152 -12.724 -4.358 -2.594 1201 HB3 ARG 152 3HB ARG 152 -13.141 -4.738 -4.257 1202 HG2 ARG 152 2HG ARG 152 -14.732 -5.884 -2.930 1203 HG3 ARG 152 3HG ARG 152 -13.594 -7.132 -3.444 1204 HD2 ARG 152 2HD ARG 152 -14.176 -7.435 -1.109 1205 HD3 ARG 152 3HD ARG 152 -12.478 -6.990 -1.244 1206 HE ARG 152 HE ARG 152 -13.336 -4.623 -0.703 1207 HH11 ARG 152 1HH1 ARG 152 -14.787 -7.551 0.628 1208 HH12 ARG 152 2HH1 ARG 152 -15.362 -6.757 2.058 1209 HH21 ARG 152 1HH2 ARG 152 -14.080 -3.601 1.172 1210 HH22 ARG 152 2HH2 ARG 152 -14.957 -4.512 2.362 1211 H LEU 153 H LEU 153 -12.117 -8.015 -4.234 1212 HA LEU 153 HA LEU 153 -10.959 -8.221 -6.848 1213 HB2 LEU 153 2HB LEU 153 -13.196 -9.774 -5.505 1214 HB3 LEU 153 3HB LEU 153 -12.686 -10.107 -7.154 1215 HG LEU 153 HG LEU 153 -11.017 -10.450 -4.629 1216 HD11 LEU 153 1HD1 LEU 153 -11.015 -12.821 -5.257 1217 HD12 LEU 153 2HD1 LEU 153 -12.043 -12.469 -6.648 1218 HD13 LEU 153 3HD1 LEU 153 -12.654 -12.223 -5.009 1219 HD21 LEU 153 3HD2 LEU 153 -9.215 -11.303 -6.105 1220 HD22 LEU 153 1HD2 LEU 153 -9.551 -9.598 -6.397 1221 HD23 LEU 153 2HD2 LEU 153 -10.148 -10.819 -7.524 1222 H GLU 154 H GLU 154 -12.418 -8.612 -8.797 1223 HA GLU 154 HA GLU 154 -13.738 -6.185 -9.455 1224 HB2 GLU 154 2HB GLU 154 -14.204 -7.298 -11.637 1225 HB3 GLU 154 3HB GLU 154 -12.517 -7.429 -11.150 1226 HG2 GLU 154 2HG GLU 154 -13.033 -9.748 -10.283 1227 HG3 GLU 154 3HG GLU 154 -14.629 -9.598 -11.020 1228 H HIS 155 H HIS 155 -15.938 -5.892 -10.044 1229 HA HIS 155 HA HIS 155 -17.783 -7.391 -8.284 1230 HB2 HIS 155 2HB HIS 155 -17.941 -4.500 -9.273 1231 HB3 HIS 155 3HB HIS 155 -19.052 -5.262 -8.135 1232 HD1 HIS 155 HD1 HIS 155 -18.474 -4.921 -5.710 1233 HD2 HIS 155 HD2 HIS 155 -15.160 -4.381 -8.149 1234 HE1 HIS 155 HE1 HIS 155 -16.652 -4.145 -4.193 1235 HE2 HIS 155 HE2 HIS 155 -14.763 -3.545 -5.733 1236 H HIS 156 H HIS 156 -19.786 -7.999 -9.054 1237 HA HIS 156 HA HIS 156 -19.888 -8.678 -11.863 1238 HB2 HIS 156 2HB HIS 156 -21.761 -9.318 -9.538 1239 HB3 HIS 156 3HB HIS 156 -22.032 -9.891 -11.182 1240 HD1 HIS 156 HD1 HIS 156 -21.717 -12.355 -10.722 1241 HD2 HIS 156 HD2 HIS 156 -18.495 -10.071 -9.419 1242 HE1 HIS 156 HE1 HIS 156 -19.923 -13.994 -10.100 1243 HE2 HIS 156 HE2 HIS 156 -18.023 -12.590 -9.240 1244 H HIS 157 H HIS 157 -21.988 -8.491 -13.072 1245 HA HIS 157 HA HIS 157 -22.828 -5.781 -13.328 1246 HB2 HIS 157 2HB HIS 157 -23.918 -8.338 -14.578 1247 HB3 HIS 157 3HB HIS 157 -24.554 -6.741 -14.957 1248 HD1 HIS 157 HD1 HIS 157 -23.252 -5.310 -16.580 1249 HD2 HIS 157 HD2 HIS 157 -21.249 -8.802 -15.568 1250 HE1 HIS 157 HE1 HIS 157 -21.324 -5.466 -18.176 1251 HE2 HIS 157 HE2 HIS 157 -20.222 -7.661 -17.636 1252 H HIS 158 H HIS 158 -23.711 -5.015 -11.535 1253 HA HIS 158 HA HIS 158 -25.779 -6.364 -9.990 1254 HB2 HIS 158 2HB HIS 158 -25.535 -4.243 -8.530 1255 HB3 HIS 158 3HB HIS 158 -24.126 -5.287 -8.646 1256 HD1 HIS 158 HD1 HIS 158 -22.037 -4.359 -9.792 1257 HD2 HIS 158 HD2 HIS 158 -25.213 -1.677 -9.773 1258 HE1 HIS 158 HE1 HIS 158 -21.072 -2.161 -10.521 1259 HE2 HIS 158 HE2 HIS 158 -23.043 -0.618 -10.679 1260 H HIS 159 H HIS 159 -26.915 -6.068 -12.359 1261 HA HIS 159 HA HIS 159 -29.277 -4.602 -11.845 1262 HB2 HIS 159 2HB HIS 159 -27.812 -2.669 -12.495 1263 HB3 HIS 159 3HB HIS 159 -27.524 -3.414 -14.059 1264 HD1 HIS 159 HD1 HIS 159 -29.362 -3.165 -15.830 1265 HD2 HIS 159 HD2 HIS 159 -30.412 -1.556 -12.144 1266 HE1 HIS 159 HE1 HIS 159 -31.440 -1.822 -16.244 1267 HE2 HIS 159 HE2 HIS 159 -31.943 -0.720 -14.045 1268 H HIS 160 H HIS 160 -30.818 -5.797 -12.791 1269 HA HIS 160 HA HIS 160 -30.719 -6.429 -15.599 1270 HB2 HIS 160 2HB HIS 160 -31.267 -8.845 -15.390 1271 HB3 HIS 160 3HB HIS 160 -29.661 -8.483 -14.787 1272 HD1 HIS 160 HD1 HIS 160 -29.135 -9.138 -12.413 1273 HD2 HIS 160 HD2 HIS 160 -33.176 -9.559 -13.291 1274 HE1 HIS 160 HE1 HIS 160 -30.123 -10.401 -10.486 1275 HE2 HIS 160 HE2 HIS 160 -32.571 -10.593 -11.010 Start of MODEL 11 1 H1 MET 1 1H MET 1 -26.118 4.919 -12.454 2 H2 MET 1 2H MET 1 -26.068 4.129 -10.969 3 H3 MET 1 3H MET 1 -25.940 5.811 -11.034 4 HA MET 1 HA MET 1 -28.105 5.155 -10.293 5 HB2 MET 1 2HB MET 1 -28.111 6.338 -13.101 6 HB3 MET 1 3HB MET 1 -29.483 6.386 -11.999 7 HG2 MET 1 2HG MET 1 -28.369 8.524 -11.976 8 HG3 MET 1 3HG MET 1 -28.116 7.737 -10.416 9 HE1 MET 1 3HE MET 1 -24.806 9.829 -11.161 10 HE2 MET 1 1HE MET 1 -26.138 9.622 -10.024 11 HE3 MET 1 2HE MET 1 -26.448 10.249 -11.646 12 H VAL 2 H VAL 2 -27.925 4.269 -13.793 13 HA VAL 2 HA VAL 2 -29.506 1.813 -13.230 14 HB VAL 2 HB VAL 2 -30.669 2.072 -15.394 15 HG11 VAL 2 1HG1 VAL 2 -31.012 4.513 -13.614 16 HG12 VAL 2 2HG1 VAL 2 -31.756 2.931 -13.368 17 HG13 VAL 2 3HG1 VAL 2 -32.197 3.901 -14.773 18 HG21 VAL 2 3HG2 VAL 2 -30.561 4.185 -16.695 19 HG22 VAL 2 1HG2 VAL 2 -28.996 3.368 -16.652 20 HG23 VAL 2 2HG2 VAL 2 -29.281 4.776 -15.630 21 H GLU 3 H GLU 3 -26.898 3.297 -15.009 22 HA GLU 3 HA GLU 3 -26.105 1.186 -16.692 23 HB2 GLU 3 2HB GLU 3 -23.942 2.299 -16.816 24 HB3 GLU 3 3HB GLU 3 -25.211 3.510 -16.868 25 HG2 GLU 3 2HG GLU 3 -24.046 2.915 -14.179 26 HG3 GLU 3 3HG GLU 3 -22.989 3.714 -15.331 27 HA PRO 4 HA PRO 4 -24.390 -1.943 -13.978 28 HB2 PRO 4 2HB PRO 4 -21.975 -2.696 -15.100 29 HB3 PRO 4 3HB PRO 4 -23.540 -3.096 -15.838 30 HG2 PRO 4 2HG PRO 4 -21.683 -0.824 -16.501 31 HG3 PRO 4 3HG PRO 4 -22.500 -1.959 -17.605 32 HD2 PRO 4 2HD PRO 4 -23.490 0.510 -17.182 33 HD3 PRO 4 3HD PRO 4 -24.581 -0.874 -17.391 34 H GLY 5 H GLY 5 -22.245 -2.642 -12.779 35 HA2 GLY 5 2HA GLY 5 -21.588 -0.508 -10.980 36 HA3 GLY 5 3HA GLY 5 -20.995 -2.161 -10.921 37 H VAL 6 H VAL 6 -20.588 0.906 -12.651 38 HA VAL 6 HA VAL 6 -17.938 0.250 -13.642 39 HB VAL 6 HB VAL 6 -17.958 2.540 -14.620 40 HG11 VAL 6 1HG1 VAL 6 -19.833 2.214 -16.208 41 HG12 VAL 6 2HG1 VAL 6 -20.545 1.011 -15.129 42 HG13 VAL 6 3HG1 VAL 6 -18.987 0.699 -15.893 43 HG21 VAL 6 3HG2 VAL 6 -19.175 3.733 -12.836 44 HG22 VAL 6 1HG2 VAL 6 -20.660 2.873 -13.250 45 HG23 VAL 6 2HG2 VAL 6 -19.947 4.012 -14.398 46 H ALA 7 H ALA 7 -16.138 1.899 -13.235 47 HA ALA 7 HA ALA 7 -16.044 2.802 -10.427 48 HB1 ALA 7 3HB ALA 7 -13.887 1.670 -10.071 49 HB2 ALA 7 1HB ALA 7 -13.975 0.966 -11.688 50 HB3 ALA 7 2HB ALA 7 -15.150 0.497 -10.457 51 H LYS 8 H LYS 8 -15.558 4.898 -10.555 52 HA LYS 8 HA LYS 8 -14.006 6.176 -12.590 53 HB2 LYS 8 2HB LYS 8 -14.739 7.109 -9.779 54 HB3 LYS 8 3HB LYS 8 -13.984 8.132 -10.998 55 HG2 LYS 8 2HG LYS 8 -15.968 7.921 -12.429 56 HG3 LYS 8 3HG LYS 8 -16.727 6.857 -11.235 57 HD2 LYS 8 2HD LYS 8 -16.717 8.684 -9.575 58 HD3 LYS 8 3HD LYS 8 -15.886 9.741 -10.719 59 HE2 LYS 8 2HE LYS 8 -18.681 8.607 -11.065 60 HE3 LYS 8 3HE LYS 8 -18.282 10.263 -10.601 61 HZ1 LYS 8 3HZ LYS 8 -17.657 8.949 -13.187 62 HZ2 LYS 8 1HZ LYS 8 -17.104 10.483 -12.738 63 HZ3 LYS 8 2HZ LYS 8 -18.756 10.204 -12.920 64 H LEU 9 H LEU 9 -13.349 5.086 -9.260 65 HA LEU 9 HA LEU 9 -10.509 5.467 -9.361 66 HB2 LEU 9 2HB LEU 9 -11.677 5.292 -7.192 67 HB3 LEU 9 3HB LEU 9 -12.192 3.660 -7.579 68 HG LEU 9 HG LEU 9 -9.754 2.949 -7.587 69 HD11 LEU 9 1HD1 LEU 9 -8.064 4.394 -6.561 70 HD12 LEU 9 2HD1 LEU 9 -9.223 5.723 -6.497 71 HD13 LEU 9 3HD1 LEU 9 -8.698 5.081 -8.055 72 HD21 LEU 9 3HD2 LEU 9 -10.782 4.109 -4.980 73 HD22 LEU 9 1HD2 LEU 9 -9.507 2.897 -5.143 74 HD23 LEU 9 2HD2 LEU 9 -11.151 2.515 -5.644 75 H THR 10 H THR 10 -10.067 4.618 -11.404 76 HA THR 10 HA THR 10 -10.187 1.739 -11.837 77 HB THR 10 HB THR 10 -9.014 3.956 -13.576 78 HG1 THR 10 HG1 THR 10 -11.550 3.347 -13.071 79 HG21 THR 10 3HG2 THR 10 -9.671 1.075 -14.302 80 HG22 THR 10 1HG2 THR 10 -8.041 1.754 -14.154 81 HG23 THR 10 2HG2 THR 10 -9.125 2.319 -15.424 82 H THR 11 H THR 11 -8.190 0.598 -12.336 83 HA THR 11 HA THR 11 -6.566 0.502 -10.117 84 HB THR 11 HB THR 11 -5.227 -1.176 -11.437 85 HG1 THR 11 HG1 THR 11 -6.666 -1.506 -13.572 86 HG21 THR 11 3HG2 THR 11 -7.071 -2.796 -11.724 87 HG22 THR 11 1HG2 THR 11 -8.246 -1.480 -11.640 88 HG23 THR 11 2HG2 THR 11 -7.266 -1.881 -10.228 89 H TYR 12 H TYR 12 -6.039 2.518 -12.922 90 HA TYR 12 HA TYR 12 -3.316 2.656 -13.258 91 HB2 TYR 12 2HB TYR 12 -3.605 4.880 -14.207 92 HB3 TYR 12 3HB TYR 12 -4.978 3.887 -14.665 93 HD1 TYR 12 HD1 TYR 12 -7.241 4.408 -13.802 94 HD2 TYR 12 HD2 TYR 12 -3.909 6.814 -12.659 95 HE1 TYR 12 HE1 TYR 12 -8.774 6.115 -12.919 96 HE2 TYR 12 HE2 TYR 12 -5.435 8.514 -11.777 97 HH TYR 12 HH TYR 12 -7.676 9.251 -11.971 98 H ALA 13 H ALA 13 -5.218 4.134 -10.701 99 HA ALA 13 HA ALA 13 -3.362 5.955 -9.629 100 HB1 ALA 13 3HB ALA 13 -5.777 6.039 -9.162 101 HB2 ALA 13 1HB ALA 13 -4.856 5.967 -7.658 102 HB3 ALA 13 2HB ALA 13 -5.672 4.523 -8.267 103 H SER 14 H SER 14 -4.059 2.552 -8.879 104 HA SER 14 HA SER 14 -2.181 2.422 -6.672 105 HB2 SER 14 2HB SER 14 -2.928 0.058 -6.488 106 HB3 SER 14 3HB SER 14 -4.295 1.172 -6.521 107 HG SER 14 HG SER 14 -4.891 -0.280 -7.973 108 H LYS 15 H LYS 15 -2.207 1.637 -10.091 109 HA LYS 15 HA LYS 15 0.060 -0.116 -10.111 110 HB2 LYS 15 2HB LYS 15 -0.997 1.621 -12.392 111 HB3 LYS 15 3HB LYS 15 0.100 0.253 -12.560 112 HG2 LYS 15 2HG LYS 15 -2.807 0.179 -11.720 113 HG3 LYS 15 3HG LYS 15 -2.115 -0.450 -13.213 114 HD2 LYS 15 2HD LYS 15 -0.900 -2.173 -11.945 115 HD3 LYS 15 3HD LYS 15 -1.494 -1.504 -10.424 116 HE2 LYS 15 2HE LYS 15 -3.797 -2.083 -11.074 117 HE3 LYS 15 3HE LYS 15 -3.211 -2.755 -12.595 118 HZ1 LYS 15 3HZ LYS 15 -3.603 -4.476 -10.940 119 HZ2 LYS 15 1HZ LYS 15 -2.505 -3.745 -9.882 120 HZ3 LYS 15 2HZ LYS 15 -1.963 -4.399 -11.342 121 H GLN 16 H GLN 16 -0.387 3.331 -10.841 122 HA GLN 16 HA GLN 16 2.342 4.019 -11.152 123 HB2 GLN 16 2HB GLN 16 -0.060 5.750 -10.420 124 HB3 GLN 16 3HB GLN 16 1.527 6.385 -10.846 125 HG2 GLN 16 2HG GLN 16 -0.225 4.718 -12.676 126 HG3 GLN 16 3HG GLN 16 -0.073 6.472 -12.734 127 HE21 GLN 16 1HE2 GLN 16 0.568 4.390 -14.762 128 HE22 GLN 16 2HE2 GLN 16 2.220 4.665 -15.189 129 H ALA 17 H ALA 17 0.326 3.578 -8.347 130 HA ALA 17 HA ALA 17 1.898 4.996 -6.444 131 HB1 ALA 17 3HB ALA 17 -0.468 4.445 -6.053 132 HB2 ALA 17 1HB ALA 17 0.563 3.826 -4.760 133 HB3 ALA 17 2HB ALA 17 -0.061 2.729 -5.995 134 H THR 18 H THR 18 1.638 1.477 -7.214 135 HA THR 18 HA THR 18 3.749 0.664 -5.488 136 HB THR 18 HB THR 18 3.760 -1.479 -6.844 137 HG1 THR 18 HG1 THR 18 2.221 0.096 -8.535 138 HG21 THR 18 3HG2 THR 18 1.527 -2.205 -6.171 139 HG22 THR 18 1HG2 THR 18 1.011 -0.525 -5.989 140 HG23 THR 18 2HG2 THR 18 2.241 -1.196 -4.917 141 H ASP 19 H ASP 19 3.631 1.715 -8.811 142 HA ASP 19 HA ASP 19 6.321 1.150 -9.582 143 HB2 ASP 19 2HB ASP 19 4.359 1.477 -11.146 144 HB3 ASP 19 3HB ASP 19 4.353 3.188 -10.735 145 H MET 20 H MET 20 4.816 3.673 -7.735 146 HA MET 20 HA MET 20 6.980 5.608 -7.910 147 HB2 MET 20 2HB MET 20 4.507 6.127 -7.455 148 HB3 MET 20 3HB MET 20 4.736 5.470 -5.848 149 HG2 MET 20 2HG MET 20 4.957 7.786 -5.532 150 HG3 MET 20 3HG MET 20 6.633 7.241 -5.628 151 HE1 MET 20 3HE MET 20 4.278 7.405 -8.795 152 HE2 MET 20 1HE MET 20 4.388 9.122 -9.185 153 HE3 MET 20 2HE MET 20 3.621 8.606 -7.678 154 H GLY 21 H GLY 21 5.849 3.088 -5.733 155 HA2 GLY 21 2HA GLY 21 7.729 2.124 -4.258 156 HA3 GLY 21 3HA GLY 21 7.823 3.773 -3.636 157 H ALA 22 H ALA 22 5.647 1.035 -4.100 158 HA ALA 22 HA ALA 22 4.510 1.277 -1.470 159 HB1 ALA 22 3HB ALA 22 3.072 2.893 -2.686 160 HB2 ALA 22 1HB ALA 22 2.153 1.477 -2.171 161 HB3 ALA 22 2HB ALA 22 2.649 1.644 -3.858 162 H ILE 23 H ILE 23 3.319 -0.629 -0.894 163 HA ILE 23 HA ILE 23 3.829 -2.969 -2.664 164 HB ILE 23 HB ILE 23 4.142 -4.345 -0.604 165 HG12 ILE 23 2HG1 ILE 23 4.083 -1.707 0.950 166 HG13 ILE 23 3HG1 ILE 23 2.781 -2.887 0.947 167 HG21 ILE 23 1HG2 ILE 23 6.391 -3.539 0.018 168 HG22 ILE 23 2HG2 ILE 23 6.047 -1.977 -0.726 169 HG23 ILE 23 3HG2 ILE 23 6.134 -3.430 -1.726 170 HD11 ILE 23 3HD1 ILE 23 4.069 -3.065 2.962 171 HD12 ILE 23 1HD1 ILE 23 5.558 -3.314 2.049 172 HD13 ILE 23 2HD1 ILE 23 4.271 -4.526 1.999 173 H TYR 24 H TYR 24 2.279 -4.656 -2.623 174 HA TYR 24 HA TYR 24 -0.383 -4.006 -1.519 175 HB2 TYR 24 2HB TYR 24 0.497 -6.133 -3.519 176 HB3 TYR 24 3HB TYR 24 -1.132 -6.016 -2.874 177 HD1 TYR 24 HD1 TYR 24 -2.215 -3.519 -3.186 178 HD2 TYR 24 HD2 TYR 24 0.816 -5.258 -5.646 179 HE1 TYR 24 HE1 TYR 24 -2.927 -2.107 -5.079 180 HE2 TYR 24 HE2 TYR 24 0.121 -3.854 -7.507 181 HH TYR 24 HH TYR 24 -1.869 -1.210 -7.227 182 H VAL 25 H VAL 25 -1.001 -4.977 0.286 183 HA VAL 25 HA VAL 25 0.025 -7.658 1.011 184 HB VAL 25 HB VAL 25 -0.254 -7.147 3.384 185 HG11 VAL 25 1HG1 VAL 25 1.443 -5.033 2.005 186 HG12 VAL 25 2HG1 VAL 25 1.938 -6.672 2.439 187 HG13 VAL 25 3HG1 VAL 25 1.572 -5.499 3.704 188 HG21 VAL 25 3HG2 VAL 25 -0.808 -4.890 4.236 189 HG22 VAL 25 1HG2 VAL 25 -2.137 -5.571 3.294 190 HG23 VAL 25 2HG2 VAL 25 -1.098 -4.332 2.585 191 H ASN 26 H ASN 26 -1.640 -8.876 2.383 192 HA ASN 26 HA ASN 26 -4.375 -8.377 1.342 193 HB2 ASN 26 2HB ASN 26 -4.869 -10.703 1.876 194 HB3 ASN 26 3HB ASN 26 -3.381 -10.640 0.944 195 HD21 ASN 26 1HD2 ASN 26 -1.447 -11.228 1.942 196 HD22 ASN 26 2HD2 ASN 26 -1.412 -12.060 3.453 197 H SER 27 H SER 27 -5.812 -9.761 3.322 198 HA SER 27 HA SER 27 -6.443 -7.631 5.024 199 HB2 SER 27 2HB SER 27 -8.131 -9.200 4.254 200 HB3 SER 27 3HB SER 27 -7.326 -10.532 5.078 201 HG SER 27 HG SER 27 -8.567 -10.047 6.685 202 H LYS 28 H LYS 28 -4.095 -10.116 5.474 203 HA LYS 28 HA LYS 28 -4.018 -9.768 8.390 204 HB2 LYS 28 2HB LYS 28 -2.064 -11.439 6.755 205 HB3 LYS 28 3HB LYS 28 -2.461 -11.592 8.464 206 HG2 LYS 28 2HG LYS 28 -4.225 -12.323 6.110 207 HG3 LYS 28 3HG LYS 28 -3.424 -13.441 7.216 208 HD2 LYS 28 2HD LYS 28 -4.853 -12.658 9.069 209 HD3 LYS 28 3HD LYS 28 -5.614 -11.470 8.000 210 HE2 LYS 28 2HE LYS 28 -6.443 -13.335 6.573 211 HE3 LYS 28 3HE LYS 28 -5.749 -14.491 7.713 212 HZ1 LYS 28 3HZ LYS 28 -7.198 -13.587 9.427 213 HZ2 LYS 28 1HZ LYS 28 -8.092 -14.167 8.114 214 HZ3 LYS 28 2HZ LYS 28 -7.862 -12.507 8.315 215 H GLY 29 H GLY 29 -1.631 -9.688 5.747 216 HA2 GLY 29 2HA GLY 29 -0.652 -7.267 5.540 217 HA3 GLY 29 3HA GLY 29 -0.056 -7.631 7.159 218 H ASP 30 H ASP 30 -0.374 -9.965 4.539 219 HA ASP 30 HA ASP 30 2.519 -10.474 4.562 220 HB2 ASP 30 2HB ASP 30 0.339 -11.962 3.024 221 HB3 ASP 30 3HB ASP 30 1.994 -12.502 3.293 222 H ARG 31 H ARG 31 3.802 -9.994 2.849 223 HA ARG 31 HA ARG 31 2.907 -8.162 0.842 224 HB2 ARG 31 2HB ARG 31 5.257 -8.389 -0.073 225 HB3 ARG 31 3HB ARG 31 5.177 -7.873 1.599 226 HG2 ARG 31 2HG ARG 31 5.490 -10.810 1.277 227 HG3 ARG 31 3HG ARG 31 6.832 -9.878 0.623 228 HD2 ARG 31 2HD ARG 31 7.215 -10.599 2.967 229 HD3 ARG 31 3HD ARG 31 7.225 -8.846 2.791 230 HE ARG 31 HE ARG 31 4.883 -8.908 3.646 231 HH11 ARG 31 1HH1 ARG 31 7.122 -11.470 4.578 232 HH12 ARG 31 2HH1 ARG 31 6.273 -11.828 6.049 233 HH21 ARG 31 1HH2 ARG 31 3.788 -9.398 5.572 234 HH22 ARG 31 2HH2 ARG 31 4.395 -10.654 6.601 235 H ILE 32 H ILE 32 1.325 -9.126 -0.376 236 HA ILE 32 HA ILE 32 1.526 -11.768 -1.469 237 HB ILE 32 HB ILE 32 -0.512 -11.219 -2.751 238 HG12 ILE 32 2HG1 ILE 32 -0.282 -8.399 -1.604 239 HG13 ILE 32 3HG1 ILE 32 0.004 -8.831 -3.286 240 HG21 ILE 32 1HG2 ILE 32 -0.738 -11.985 -0.437 241 HG22 ILE 32 2HG2 ILE 32 -2.032 -10.861 -0.848 242 HG23 ILE 32 3HG2 ILE 32 -0.676 -10.316 0.143 243 HD11 ILE 32 3HD1 ILE 32 -2.174 -7.836 -3.015 244 HD12 ILE 32 1HD1 ILE 32 -2.627 -9.056 -1.824 245 HD13 ILE 32 2HD1 ILE 32 -2.338 -9.521 -3.504 246 H VAL 33 H VAL 33 2.251 -8.536 -2.614 247 HA VAL 33 HA VAL 33 4.265 -9.514 -4.355 248 HB VAL 33 HB VAL 33 2.270 -9.786 -5.858 249 HG11 VAL 33 1HG1 VAL 33 2.013 -6.766 -5.743 250 HG12 VAL 33 2HG1 VAL 33 0.886 -7.931 -5.048 251 HG13 VAL 33 3HG1 VAL 33 1.098 -7.851 -6.798 252 HG21 VAL 33 3HG2 VAL 33 3.265 -8.704 -7.845 253 HG22 VAL 33 1HG2 VAL 33 4.488 -9.473 -6.832 254 HG23 VAL 33 2HG2 VAL 33 4.292 -7.719 -6.800 255 H ASN 34 H ASN 34 5.797 -7.917 -4.764 256 HA ASN 34 HA ASN 34 5.924 -5.752 -2.925 257 HB2 ASN 34 2HB ASN 34 8.113 -5.247 -3.924 258 HB3 ASN 34 3HB ASN 34 7.941 -6.969 -3.614 259 HD21 ASN 34 1HD2 ASN 34 9.609 -5.367 -5.569 260 HD22 ASN 34 2HD2 ASN 34 9.332 -6.140 -7.085 261 H GLU 35 H GLU 35 5.178 -6.011 -6.305 262 HA GLU 35 HA GLU 35 4.331 -3.252 -6.629 263 HB2 GLU 35 2HB GLU 35 6.741 -3.055 -7.071 264 HB3 GLU 35 3HB GLU 35 6.711 -4.457 -8.135 265 HG2 GLU 35 2HG GLU 35 5.168 -3.112 -9.670 266 HG3 GLU 35 3HG GLU 35 5.516 -1.710 -8.657 267 H SER 36 H SER 36 2.926 -3.051 -8.432 268 HA SER 36 HA SER 36 1.813 -5.501 -9.483 269 HB2 SER 36 2HB SER 36 0.411 -3.475 -8.956 270 HB3 SER 36 3HB SER 36 1.166 -2.648 -10.317 271 HG SER 36 HG SER 36 0.302 -4.178 -11.696 272 H ASN 37 H ASN 37 3.845 -6.220 -10.395 273 HA ASN 37 HA ASN 37 5.023 -5.016 -12.704 274 HB2 ASN 37 2HB ASN 37 6.229 -6.641 -11.226 275 HB3 ASN 37 3HB ASN 37 5.135 -7.916 -11.747 276 HD21 ASN 37 1HD2 ASN 37 7.796 -5.848 -12.694 277 HD22 ASN 37 2HD2 ASN 37 8.230 -6.732 -14.115 278 H VAL 38 H VAL 38 2.913 -7.836 -12.240 279 HA VAL 38 HA VAL 38 1.434 -7.245 -14.686 280 HB VAL 38 HB VAL 38 3.163 -8.829 -15.463 281 HG11 VAL 38 1HG1 VAL 38 2.136 -10.784 -13.383 282 HG12 VAL 38 2HG1 VAL 38 3.697 -9.959 -13.362 283 HG13 VAL 38 3HG1 VAL 38 3.339 -11.133 -14.630 284 HG21 VAL 38 3HG2 VAL 38 0.412 -10.126 -15.344 285 HG22 VAL 38 1HG2 VAL 38 1.695 -10.536 -16.490 286 HG23 VAL 38 2HG2 VAL 38 0.956 -8.935 -16.527 287 H TYR 39 H TYR 39 -0.712 -7.947 -14.573 288 HA TYR 39 HA TYR 39 -1.846 -7.944 -11.998 289 HB2 TYR 39 2HB TYR 39 -4.015 -8.103 -13.076 290 HB3 TYR 39 3HB TYR 39 -2.995 -7.030 -14.021 291 HD1 TYR 39 HD2 TYR 39 -1.989 -7.898 -16.215 292 HD2 TYR 39 HD1 TYR 39 -4.994 -10.083 -14.089 293 HE1 TYR 39 HE2 TYR 39 -2.461 -9.213 -18.227 294 HE2 TYR 39 HE1 TYR 39 -5.458 -11.401 -16.112 295 HH TYR 39 HH TYR 39 -3.418 -11.359 -18.850 296 H THR 40 H THR 40 -0.886 -10.615 -14.051 297 HA THR 40 HA THR 40 -2.582 -12.637 -13.034 298 HB THR 40 HB THR 40 -0.773 -14.220 -13.944 299 HG1 THR 40 HG1 THR 40 1.112 -13.390 -14.398 300 HG21 THR 40 3HG2 THR 40 -1.736 -12.029 -15.828 301 HG22 THR 40 1HG2 THR 40 -2.630 -13.492 -15.402 302 HG23 THR 40 2HG2 THR 40 -1.127 -13.612 -16.322 303 H THR 41 H THR 41 0.762 -11.741 -12.180 304 HA THR 41 HA THR 41 1.192 -13.510 -10.043 305 HB THR 41 HB THR 41 2.379 -10.748 -10.557 306 HG1 THR 41 HG1 THR 41 4.049 -12.043 -11.555 307 HG21 THR 41 3HG2 THR 41 4.318 -11.501 -9.233 308 HG22 THR 41 1HG2 THR 41 3.512 -13.030 -8.874 309 HG23 THR 41 2HG2 THR 41 2.864 -11.515 -8.237 310 H PHE 42 H PHE 42 -0.040 -10.195 -10.116 311 HA PHE 42 HA PHE 42 -0.384 -9.702 -7.370 312 HB2 PHE 42 2HB PHE 42 -0.391 -7.860 -8.921 313 HB3 PHE 42 3HB PHE 42 -1.676 -8.576 -9.881 314 HD1 PHE 42 HD1 PHE 42 -1.260 -7.600 -6.250 315 HD2 PHE 42 HD2 PHE 42 -3.662 -7.348 -9.789 316 HE1 PHE 42 HE1 PHE 42 -2.899 -6.214 -5.055 317 HE2 PHE 42 HE2 PHE 42 -5.293 -5.965 -8.576 318 HZ PHE 42 HZ PHE 42 -4.913 -5.395 -6.209 319 H ARG 43 H ARG 43 -2.517 -11.202 -9.769 320 HA ARG 43 HA ARG 43 -4.914 -11.037 -8.197 321 HB2 ARG 43 2HB ARG 43 -4.868 -10.984 -10.712 322 HB3 ARG 43 3HB ARG 43 -4.384 -12.679 -10.710 323 HG2 ARG 43 2HG ARG 43 -6.521 -13.280 -9.604 324 HG3 ARG 43 3HG ARG 43 -6.997 -11.579 -9.619 325 HD2 ARG 43 2HD ARG 43 -6.718 -11.676 -12.175 326 HD3 ARG 43 3HD ARG 43 -6.607 -13.427 -11.987 327 HE ARG 43 HE ARG 43 -8.853 -13.524 -11.456 328 HH11 ARG 43 1HH1 ARG 43 -7.843 -10.171 -11.790 329 HH12 ARG 43 2HH1 ARG 43 -9.463 -9.566 -11.859 330 HH21 ARG 43 1HH2 ARG 43 -10.968 -12.706 -11.565 331 HH22 ARG 43 2HH2 ARG 43 -11.228 -10.998 -11.731 332 H ASN 44 H ASN 44 -2.727 -13.696 -9.200 333 HA ASN 44 HA ASN 44 -4.236 -15.785 -7.982 334 HB2 ASN 44 2HB ASN 44 -1.379 -15.691 -9.032 335 HB3 ASN 44 3HB ASN 44 -2.066 -17.146 -8.316 336 HD21 ASN 44 1HD2 ASN 44 -3.904 -14.890 -10.359 337 HD22 ASN 44 2HD2 ASN 44 -4.103 -15.987 -11.668 338 H ALA 45 H ALA 45 -1.843 -13.591 -6.780 339 HA ALA 45 HA ALA 45 -1.187 -14.934 -4.356 340 HB1 ALA 45 3HB ALA 45 0.192 -13.136 -5.335 341 HB2 ALA 45 1HB ALA 45 -0.269 -12.769 -3.673 342 HB3 ALA 45 2HB ALA 45 -1.095 -11.973 -5.015 343 H ILE 46 H ILE 46 -3.689 -12.577 -5.270 344 HA ILE 46 HA ILE 46 -4.954 -12.342 -2.711 345 HB ILE 46 HB ILE 46 -6.115 -11.809 -5.489 346 HG12 ILE 46 2HG1 ILE 46 -4.813 -9.849 -3.542 347 HG13 ILE 46 3HG1 ILE 46 -4.086 -10.444 -5.029 348 HG21 ILE 46 1HG2 ILE 46 -7.895 -12.045 -3.797 349 HG22 ILE 46 2HG2 ILE 46 -7.783 -10.379 -4.364 350 HG23 ILE 46 3HG2 ILE 46 -7.114 -10.820 -2.792 351 HD11 ILE 46 3HD1 ILE 46 -4.953 -8.216 -5.324 352 HD12 ILE 46 1HD1 ILE 46 -6.564 -8.735 -4.833 353 HD13 ILE 46 2HD1 ILE 46 -5.852 -9.351 -6.326 354 H LEU 47 H LEU 47 -5.343 -14.473 -5.508 355 HA LEU 47 HA LEU 47 -7.772 -15.754 -4.729 356 HB2 LEU 47 2HB LEU 47 -5.607 -16.647 -6.671 357 HB3 LEU 47 3HB LEU 47 -7.161 -17.450 -6.493 358 HG LEU 47 HG LEU 47 -6.757 -14.593 -7.467 359 HD11 LEU 47 1HD1 LEU 47 -7.437 -15.414 -9.673 360 HD12 LEU 47 2HD1 LEU 47 -7.508 -17.065 -9.048 361 HD13 LEU 47 3HD1 LEU 47 -5.967 -16.206 -9.109 362 HD21 LEU 47 3HD2 LEU 47 -8.880 -14.796 -6.284 363 HD22 LEU 47 1HD2 LEU 47 -9.322 -16.207 -7.253 364 HD23 LEU 47 2HD2 LEU 47 -9.162 -14.621 -8.013 365 H LYS 48 H LYS 48 -4.378 -16.310 -4.089 366 HA LYS 48 HA LYS 48 -4.533 -18.897 -2.910 367 HB2 LYS 48 2HB LYS 48 -2.396 -18.000 -3.671 368 HB3 LYS 48 3HB LYS 48 -2.525 -16.629 -2.573 369 HG2 LYS 48 2HG LYS 48 -2.270 -18.122 -0.630 370 HG3 LYS 48 3HG LYS 48 -2.234 -19.531 -1.693 371 HD2 LYS 48 2HD LYS 48 -0.179 -17.287 -1.687 372 HD3 LYS 48 3HD LYS 48 0.027 -18.857 -0.907 373 HE2 LYS 48 2HE LYS 48 -0.296 -18.362 -3.886 374 HE3 LYS 48 3HE LYS 48 1.181 -18.841 -3.052 375 HZ1 LYS 48 3HZ LYS 48 0.098 -20.913 -2.422 376 HZ2 LYS 48 1HZ LYS 48 0.137 -20.725 -4.099 377 HZ3 LYS 48 2HZ LYS 48 -1.296 -20.452 -3.256 378 H GLN 49 H GLN 49 -4.879 -15.605 -1.675 379 HA GLN 49 HA GLN 49 -5.229 -16.418 1.090 380 HB2 GLN 49 2HB GLN 49 -4.214 -14.191 0.432 381 HB3 GLN 49 3HB GLN 49 -5.785 -13.699 -0.198 382 HG2 GLN 49 2HG GLN 49 -5.403 -12.752 2.040 383 HG3 GLN 49 3HG GLN 49 -6.762 -13.878 2.065 384 HE21 GLN 49 1HE2 GLN 49 -6.584 -14.295 4.288 385 HE22 GLN 49 2HE2 GLN 49 -5.274 -15.190 4.968 386 H ALA 50 H ALA 50 -7.178 -16.544 2.195 387 HA ALA 50 HA ALA 50 -9.589 -17.182 0.861 388 HB1 ALA 50 3HB ALA 50 -10.597 -17.204 3.119 389 HB2 ALA 50 1HB ALA 50 -9.170 -16.391 3.771 390 HB3 ALA 50 2HB ALA 50 -9.035 -18.025 3.120 391 H ASP 51 H ASP 51 -8.382 -14.245 2.355 392 HA ASP 51 HA ASP 51 -10.764 -12.658 1.943 393 HB2 ASP 51 2HB ASP 51 -7.943 -11.732 2.650 394 HB3 ASP 51 3HB ASP 51 -9.431 -10.815 2.857 395 H LYS 52 H LYS 52 -11.294 -12.034 -0.078 396 HA LYS 52 HA LYS 52 -9.307 -11.725 -2.194 397 HB2 LYS 52 2HB LYS 52 -12.342 -11.486 -2.279 398 HB3 LYS 52 3HB LYS 52 -11.288 -11.433 -3.691 399 HG2 LYS 52 2HG LYS 52 -11.664 -13.796 -1.816 400 HG3 LYS 52 3HG LYS 52 -12.316 -13.652 -3.453 401 HD2 LYS 52 2HD LYS 52 -10.031 -13.641 -4.383 402 HD3 LYS 52 3HD LYS 52 -9.349 -13.686 -2.754 403 HE2 LYS 52 2HE LYS 52 -11.053 -15.872 -3.996 404 HE3 LYS 52 3HE LYS 52 -9.297 -15.898 -3.840 405 HZ1 LYS 52 3HZ LYS 52 -10.313 -17.151 -2.079 406 HZ2 LYS 52 1HZ LYS 52 -11.238 -15.824 -1.595 407 HZ3 LYS 52 2HZ LYS 52 -9.559 -15.788 -1.432 408 H VAL 53 H VAL 53 -8.331 -9.982 -0.940 409 HA VAL 53 HA VAL 53 -9.104 -7.372 -1.884 410 HB VAL 53 HB VAL 53 -10.516 -7.486 0.121 411 HG11 VAL 53 1HG1 VAL 53 -9.337 -9.200 1.410 412 HG12 VAL 53 2HG1 VAL 53 -9.627 -7.769 2.401 413 HG13 VAL 53 3HG1 VAL 53 -8.016 -8.075 1.746 414 HG21 VAL 53 3HG2 VAL 53 -8.140 -5.650 0.599 415 HG22 VAL 53 1HG2 VAL 53 -9.751 -5.464 1.301 416 HG23 VAL 53 2HG2 VAL 53 -9.522 -5.308 -0.441 417 H ALA 54 H ALA 54 -7.337 -6.028 -2.006 418 HA ALA 54 HA ALA 54 -4.794 -6.829 -0.717 419 HB1 ALA 54 3HB ALA 54 -4.690 -7.368 -3.112 420 HB2 ALA 54 1HB ALA 54 -3.591 -6.043 -2.721 421 HB3 ALA 54 2HB ALA 54 -5.130 -5.711 -3.526 422 H TYR 55 H TYR 55 -4.376 -5.323 0.746 423 HA TYR 55 HA TYR 55 -5.261 -2.559 0.492 424 HB2 TYR 55 2HB TYR 55 -3.797 -4.000 2.748 425 HB3 TYR 55 3HB TYR 55 -4.416 -2.355 2.818 426 HD1 TYR 55 HD1 TYR 55 -6.917 -1.944 2.773 427 HD2 TYR 55 HD2 TYR 55 -5.286 -5.889 3.077 428 HE1 TYR 55 HE1 TYR 55 -9.092 -2.795 3.559 429 HE2 TYR 55 HE2 TYR 55 -7.451 -6.717 3.851 430 HH TYR 55 HH TYR 55 -9.457 -5.916 4.902 431 H LEU 56 H LEU 56 -4.004 -1.090 -0.334 432 HA LEU 56 HA LEU 56 -1.236 -1.588 -1.057 433 HB2 LEU 56 2HB LEU 56 -2.857 -0.625 -2.670 434 HB3 LEU 56 3HB LEU 56 -3.132 0.739 -1.600 435 HG LEU 56 HG LEU 56 -0.768 1.468 -1.939 436 HD11 LEU 56 1HD1 LEU 56 0.600 0.451 -3.707 437 HD12 LEU 56 2HD1 LEU 56 -0.602 -0.825 -3.911 438 HD13 LEU 56 3HD1 LEU 56 0.283 -0.675 -2.390 439 HD21 LEU 56 3HD2 LEU 56 -1.048 2.270 -4.235 440 HD22 LEU 56 1HD2 LEU 56 -2.543 2.413 -3.317 441 HD23 LEU 56 2HD2 LEU 56 -2.352 1.115 -4.498 442 H VAL 57 H VAL 57 0.166 -1.282 0.574 443 HA VAL 57 HA VAL 57 -0.165 0.817 2.580 444 HB VAL 57 HB VAL 57 2.015 -1.308 2.312 445 HG11 VAL 57 1HG1 VAL 57 2.842 0.659 3.537 446 HG12 VAL 57 2HG1 VAL 57 2.639 -0.706 4.633 447 HG13 VAL 57 3HG1 VAL 57 1.448 0.594 4.621 448 HG21 VAL 57 3HG2 VAL 57 -0.173 -2.336 2.774 449 HG22 VAL 57 1HG2 VAL 57 -0.405 -1.263 4.159 450 HG23 VAL 57 2HG2 VAL 57 0.881 -2.472 4.182 451 H MET 58 H MET 58 0.867 2.698 2.481 452 HA MET 58 HA MET 58 3.146 3.284 0.787 453 HB2 MET 58 2HB MET 58 1.870 4.832 -0.713 454 HB3 MET 58 3HB MET 58 1.300 3.177 -0.880 455 HG2 MET 58 2HG MET 58 -0.487 3.908 0.913 456 HG3 MET 58 3HG MET 58 -0.089 5.529 0.371 457 HE1 MET 58 3HE MET 58 -1.247 5.448 -3.341 458 HE2 MET 58 1HE MET 58 0.390 5.194 -2.744 459 HE3 MET 58 2HE MET 58 -0.630 6.440 -2.022 460 H ASP 59 H ASP 59 3.777 5.564 1.045 461 HA ASP 59 HA ASP 59 2.662 6.889 3.446 462 HB2 ASP 59 2HB ASP 59 5.184 6.550 3.254 463 HB3 ASP 59 3HB ASP 59 5.179 7.625 1.860 464 H GLU 60 H GLU 60 2.519 9.352 3.198 465 HA GLU 60 HA GLU 60 0.640 10.033 1.216 466 HB2 GLU 60 2HB GLU 60 0.772 11.033 3.513 467 HB3 GLU 60 3HB GLU 60 2.202 11.931 3.019 468 HG2 GLU 60 2HG GLU 60 0.919 13.226 1.421 469 HG3 GLU 60 3HG GLU 60 -0.497 12.212 1.656 470 H ARG 61 H ARG 61 4.095 10.250 1.336 471 HA ARG 61 HA ARG 61 4.898 11.972 -0.636 472 HB2 ARG 61 2HB ARG 61 6.432 10.583 0.703 473 HB3 ARG 61 3HB ARG 61 5.842 9.121 -0.073 474 HG2 ARG 61 2HG ARG 61 8.019 9.677 -0.968 475 HG3 ARG 61 3HG ARG 61 6.809 9.911 -2.231 476 HD2 ARG 61 2HD ARG 61 6.889 12.302 -1.971 477 HD3 ARG 61 3HD ARG 61 7.868 12.171 -0.505 478 HE ARG 61 HE ARG 61 9.405 10.960 -2.368 479 HH11 ARG 61 1HH1 ARG 61 7.866 14.114 -2.307 480 HH12 ARG 61 2HH1 ARG 61 9.080 14.862 -3.291 481 HH21 ARG 61 1HH2 ARG 61 11.032 11.966 -3.632 482 HH22 ARG 61 2HH2 ARG 61 10.874 13.645 -4.045 483 H THR 62 H THR 62 3.925 8.589 -1.124 484 HA THR 62 HA THR 62 3.897 8.581 -3.953 485 HB THR 62 HB THR 62 2.510 6.726 -1.955 486 HG1 THR 62 HG1 THR 62 4.561 5.472 -2.605 487 HG21 THR 62 3HG2 THR 62 1.660 6.386 -4.242 488 HG22 THR 62 1HG2 THR 62 2.660 5.019 -3.737 489 HG23 THR 62 2HG2 THR 62 3.311 6.229 -4.841 490 H TRP 63 H TRP 63 1.407 9.037 -1.464 491 HA TRP 63 HA TRP 63 -0.890 9.049 -3.038 492 HB2 TRP 63 2HB TRP 63 -1.079 8.854 -0.651 493 HB3 TRP 63 3HB TRP 63 -0.285 10.401 -0.392 494 HD1 TRP 63 HD1 TRP 63 -1.830 12.511 -0.228 495 HE1 TRP 63 HE1 TRP 63 -4.358 12.912 -0.486 496 HE3 TRP 63 HE3 TRP 63 -3.211 7.963 -2.169 497 HZ2 TRP 63 HZ2 TRP 63 -6.613 11.519 -1.390 498 HZ3 TRP 63 HZ3 TRP 63 -5.585 7.594 -2.715 499 HH2 TRP 63 HH2 TRP 63 -7.255 9.338 -2.334 500 H LYS 64 H LYS 64 1.414 11.727 -2.482 501 HA LYS 64 HA LYS 64 -0.078 13.954 -3.219 502 HB2 LYS 64 2HB LYS 64 2.810 13.449 -4.056 503 HB3 LYS 64 3HB LYS 64 2.030 15.020 -3.909 504 HG2 LYS 64 2HG LYS 64 2.652 13.116 -1.651 505 HG3 LYS 64 3HG LYS 64 3.535 14.581 -2.049 506 HD2 LYS 64 2HD LYS 64 1.409 15.884 -1.596 507 HD3 LYS 64 3HD LYS 64 0.690 14.383 -1.008 508 HE2 LYS 64 2HE LYS 64 2.462 14.212 0.704 509 HE3 LYS 64 3HE LYS 64 3.173 15.714 0.111 510 HZ1 LYS 64 3HZ LYS 64 1.816 16.066 2.076 511 HZ2 LYS 64 1HZ LYS 64 0.465 15.429 1.288 512 HZ3 LYS 64 2HZ LYS 64 1.157 16.871 0.748 513 H LYS 65 H LYS 65 1.508 11.571 -5.268 514 HA LYS 65 HA LYS 65 0.801 12.797 -7.771 515 HB2 LYS 65 2HB LYS 65 1.942 10.062 -7.088 516 HB3 LYS 65 3HB LYS 65 1.743 10.665 -8.730 517 HG2 LYS 65 2HG LYS 65 3.479 11.982 -6.610 518 HG3 LYS 65 3HG LYS 65 4.077 10.887 -7.854 519 HD2 LYS 65 2HD LYS 65 2.733 13.567 -8.358 520 HD3 LYS 65 3HD LYS 65 4.465 13.251 -8.452 521 HE2 LYS 65 2HE LYS 65 4.091 11.672 -10.318 522 HE3 LYS 65 3HE LYS 65 2.352 11.963 -10.224 523 HZ1 LYS 65 3HZ LYS 65 4.444 13.939 -10.954 524 HZ2 LYS 65 1HZ LYS 65 2.814 14.313 -10.721 525 HZ3 LYS 65 2HZ LYS 65 3.266 13.275 -11.972 526 H VAL 66 H VAL 66 -0.346 9.992 -5.869 527 HA VAL 66 HA VAL 66 -2.149 8.903 -7.727 528 HB VAL 66 HB VAL 66 -2.232 8.772 -4.676 529 HG11 VAL 66 1HG1 VAL 66 -3.693 7.001 -6.676 530 HG12 VAL 66 2HG1 VAL 66 -4.442 8.161 -5.578 531 HG13 VAL 66 3HG1 VAL 66 -3.628 6.736 -4.931 532 HG21 VAL 66 3HG2 VAL 66 -0.137 7.907 -5.632 533 HG22 VAL 66 1HG2 VAL 66 -1.044 6.848 -6.714 534 HG23 VAL 66 2HG2 VAL 66 -1.095 6.582 -4.968 535 H TYR 67 H TYR 67 -2.906 11.006 -4.938 536 HA TYR 67 HA TYR 67 -5.543 11.624 -5.228 537 HB2 TYR 67 2HB TYR 67 -4.191 12.416 -3.345 538 HB3 TYR 67 3HB TYR 67 -3.236 13.442 -4.400 539 HD1 TYR 67 HD1 TYR 67 -6.661 12.999 -2.971 540 HD2 TYR 67 HD2 TYR 67 -3.935 15.714 -4.830 541 HE1 TYR 67 HE1 TYR 67 -8.188 14.860 -2.493 542 HE2 TYR 67 HE2 TYR 67 -5.465 17.576 -4.356 543 HH TYR 67 HH TYR 67 -8.192 17.244 -2.273 544 H ASP 68 H ASP 68 -2.806 13.177 -6.879 545 HA ASP 68 HA ASP 68 -4.258 15.189 -8.242 546 HB2 ASP 68 2HB ASP 68 -1.818 15.380 -7.865 547 HB3 ASP 68 3HB ASP 68 -1.530 13.987 -8.906 548 H LEU 69 H LEU 69 -3.101 11.954 -9.216 549 HA LEU 69 HA LEU 69 -3.865 12.042 -11.944 550 HB2 LEU 69 2HB LEU 69 -3.434 9.652 -10.099 551 HB3 LEU 69 3HB LEU 69 -3.613 9.527 -11.843 552 HG LEU 69 HG LEU 69 -1.338 10.944 -10.400 553 HD11 LEU 69 1HD1 LEU 69 -1.211 8.521 -10.138 554 HD12 LEU 69 2HD1 LEU 69 0.080 9.110 -11.180 555 HD13 LEU 69 3HD1 LEU 69 -1.322 8.300 -11.887 556 HD21 LEU 69 3HD2 LEU 69 -1.819 12.039 -12.527 557 HD22 LEU 69 1HD2 LEU 69 -1.737 10.491 -13.377 558 HD23 LEU 69 2HD2 LEU 69 -0.294 11.166 -12.613 559 H LEU 70 H LEU 70 -5.593 11.152 -9.013 560 HA LEU 70 HA LEU 70 -7.850 9.884 -10.116 561 HB2 LEU 70 2HB LEU 70 -7.548 11.529 -7.571 562 HB3 LEU 70 3HB LEU 70 -9.004 10.632 -7.967 563 HG LEU 70 HG LEU 70 -6.260 9.444 -7.432 564 HD11 LEU 70 1HD1 LEU 70 -8.802 9.284 -5.789 565 HD12 LEU 70 2HD1 LEU 70 -7.358 10.223 -5.401 566 HD13 LEU 70 3HD1 LEU 70 -7.275 8.465 -5.434 567 HD21 LEU 70 3HD2 LEU 70 -7.376 8.139 -9.156 568 HD22 LEU 70 1HD2 LEU 70 -8.837 8.016 -8.170 569 HD23 LEU 70 2HD2 LEU 70 -7.341 7.238 -7.645 570 H ILE 71 H ILE 71 -7.396 13.276 -9.118 571 HA ILE 71 HA ILE 71 -9.874 14.250 -10.127 572 HB ILE 71 HB ILE 71 -7.346 15.839 -9.465 573 HG12 ILE 71 2HG1 ILE 71 -9.665 15.039 -7.634 574 HG13 ILE 71 3HG1 ILE 71 -8.026 14.404 -7.555 575 HG21 ILE 71 1HG2 ILE 71 -8.997 17.165 -10.736 576 HG22 ILE 71 2HG2 ILE 71 -8.865 17.748 -9.077 577 HG23 ILE 71 3HG2 ILE 71 -10.246 16.758 -9.555 578 HD11 ILE 71 3HD1 ILE 71 -8.410 16.013 -5.810 579 HD12 ILE 71 1HD1 ILE 71 -8.867 17.241 -6.990 580 HD13 ILE 71 2HD1 ILE 71 -7.209 16.632 -6.945 581 H LEU 72 H LEU 72 -6.687 13.858 -11.499 582 HA LEU 72 HA LEU 72 -6.851 15.624 -13.705 583 HB2 LEU 72 2HB LEU 72 -4.745 14.669 -12.680 584 HB3 LEU 72 3HB LEU 72 -5.124 13.126 -13.401 585 HG LEU 72 HG LEU 72 -3.325 14.551 -14.550 586 HD11 LEU 72 1HD1 LEU 72 -3.924 13.908 -16.811 587 HD12 LEU 72 2HD1 LEU 72 -5.598 13.632 -16.319 588 HD13 LEU 72 3HD1 LEU 72 -4.307 12.620 -15.667 589 HD21 LEU 72 3HD2 LEU 72 -5.708 16.176 -15.510 590 HD22 LEU 72 1HD2 LEU 72 -4.037 16.339 -16.066 591 HD23 LEU 72 2HD2 LEU 72 -4.450 16.729 -14.399 592 H HIS 73 H HIS 73 -7.567 12.136 -13.337 593 HA HIS 73 HA HIS 73 -8.428 11.848 -16.104 594 HB2 HIS 73 2HB HIS 73 -8.471 9.966 -13.718 595 HB3 HIS 73 3HB HIS 73 -9.218 9.537 -15.249 596 HD1 HIS 73 HD1 HIS 73 -7.770 8.085 -16.582 597 HD2 HIS 73 HD2 HIS 73 -5.528 10.760 -14.332 598 HE1 HIS 73 HE1 HIS 73 -5.376 7.511 -17.045 599 HE2 HIS 73 HE2 HIS 73 -4.044 9.205 -15.746 600 H ASP 74 H ASP 74 -10.129 11.335 -12.991 601 HA ASP 74 HA ASP 74 -12.208 13.102 -13.156 602 HB2 ASP 74 2HB ASP 74 -12.987 12.040 -15.258 603 HB3 ASP 74 3HB ASP 74 -13.029 10.466 -14.474 604 H PHE 75 H PHE 75 -11.848 13.037 -10.959 605 HA PHE 75 HA PHE 75 -13.529 11.378 -9.395 606 HB2 PHE 75 2HB PHE 75 -11.335 9.928 -9.874 607 HB3 PHE 75 3HB PHE 75 -10.611 10.956 -8.655 608 HD1 PHE 75 HD1 PHE 75 -11.625 10.934 -6.294 609 HD2 PHE 75 HD2 PHE 75 -12.698 8.094 -9.279 610 HE1 PHE 75 HE1 PHE 75 -12.488 9.426 -4.555 611 HE2 PHE 75 HE2 PHE 75 -13.570 6.593 -7.548 612 HZ PHE 75 HZ PHE 75 -13.463 7.252 -5.181 613 H THR 76 H THR 76 -14.282 13.318 -8.633 614 HA THR 76 HA THR 76 -12.705 15.617 -8.185 615 HB THR 76 HB THR 76 -15.221 15.543 -8.742 616 HG1 THR 76 HG1 THR 76 -14.374 17.519 -8.223 617 HG21 THR 76 3HG2 THR 76 -16.813 15.516 -6.856 618 HG22 THR 76 1HG2 THR 76 -15.487 15.166 -5.742 619 HG23 THR 76 2HG2 THR 76 -15.949 13.978 -6.963 620 HA PRO 77 HA PRO 77 -11.046 15.112 -4.010 621 HB2 PRO 77 2HB PRO 77 -11.545 17.681 -2.953 622 HB3 PRO 77 3HB PRO 77 -10.151 17.240 -3.959 623 HG2 PRO 77 2HG PRO 77 -12.743 18.502 -4.789 624 HG3 PRO 77 3HG PRO 77 -11.084 18.908 -5.282 625 HD2 PRO 77 2HD PRO 77 -12.618 17.495 -6.926 626 HD3 PRO 77 3HD PRO 77 -10.912 17.038 -6.726 627 H GLU 78 H GLU 78 -14.338 16.417 -4.363 628 HA GLU 78 HA GLU 78 -15.254 16.229 -1.720 629 HB2 GLU 78 2HB GLU 78 -16.847 15.805 -4.283 630 HB3 GLU 78 3HB GLU 78 -17.555 16.070 -2.690 631 HG2 GLU 78 2HG GLU 78 -16.433 18.303 -2.607 632 HG3 GLU 78 3HG GLU 78 -15.863 18.037 -4.260 633 H GLU 79 H GLU 79 -15.065 13.731 -4.240 634 HA GLU 79 HA GLU 79 -16.300 11.636 -2.743 635 HB2 GLU 79 2HB GLU 79 -14.341 11.483 -5.079 636 HB3 GLU 79 3HB GLU 79 -15.222 10.107 -4.420 637 HG2 GLU 79 2HG GLU 79 -16.426 12.526 -5.779 638 HG3 GLU 79 3HG GLU 79 -16.286 10.902 -6.451 639 H ILE 80 H ILE 80 -12.934 12.470 -3.462 640 HA ILE 80 HA ILE 80 -11.575 10.376 -2.267 641 HB ILE 80 HB ILE 80 -10.642 13.274 -2.532 642 HG12 ILE 80 2HG1 ILE 80 -10.266 10.942 -4.471 643 HG13 ILE 80 3HG1 ILE 80 -11.411 12.258 -4.686 644 HG21 ILE 80 1HG2 ILE 80 -8.340 12.362 -2.509 645 HG22 ILE 80 2HG2 ILE 80 -8.979 10.747 -2.204 646 HG23 ILE 80 3HG2 ILE 80 -9.188 12.020 -1.000 647 HD11 ILE 80 3HD1 ILE 80 -9.482 12.579 -6.077 648 HD12 ILE 80 1HD1 ILE 80 -8.403 12.492 -4.685 649 HD13 ILE 80 2HD1 ILE 80 -9.536 13.839 -4.847 650 H LYS 81 H LYS 81 -12.171 13.598 -0.867 651 HA LYS 81 HA LYS 81 -11.084 13.157 1.669 652 HB2 LYS 81 2HB LYS 81 -12.160 15.253 2.328 653 HB3 LYS 81 3HB LYS 81 -11.449 15.409 0.724 654 HG2 LYS 81 2HG LYS 81 -13.803 14.900 -0.193 655 HG3 LYS 81 3HG LYS 81 -14.380 15.165 1.452 656 HD2 LYS 81 2HD LYS 81 -12.847 17.199 -0.221 657 HD3 LYS 81 3HD LYS 81 -14.599 17.173 -0.000 658 HE2 LYS 81 2HE LYS 81 -14.211 17.411 2.482 659 HE3 LYS 81 3HE LYS 81 -12.502 17.675 2.131 660 HZ1 LYS 81 3HZ LYS 81 -14.761 19.335 1.159 661 HZ2 LYS 81 1HZ LYS 81 -13.134 19.586 0.784 662 HZ3 LYS 81 2HZ LYS 81 -13.668 19.754 2.380 663 H SER 82 H SER 82 -14.291 12.502 0.375 664 HA SER 82 HA SER 82 -15.643 12.178 2.878 665 HB2 SER 82 2HB SER 82 -16.860 12.785 0.791 666 HB3 SER 82 3HB SER 82 -16.485 11.206 0.105 667 HG SER 82 HG SER 82 -17.592 10.703 2.428 668 H PHE 83 H PHE 83 -13.638 10.049 0.953 669 HA PHE 83 HA PHE 83 -14.536 7.618 2.236 670 HB2 PHE 83 2HB PHE 83 -12.010 8.241 0.647 671 HB3 PHE 83 3HB PHE 83 -12.351 6.649 1.324 672 HD1 PHE 83 HD2 PHE 83 -14.748 5.664 0.718 673 HD2 PHE 83 HD1 PHE 83 -12.716 8.648 -1.572 674 HE1 PHE 83 HE2 PHE 83 -16.111 5.095 -1.249 675 HE2 PHE 83 HE1 PHE 83 -14.083 8.076 -3.525 676 HZ PHE 83 HZ PHE 83 -15.778 6.300 -3.372 677 H PHE 84 H PHE 84 -12.150 10.106 2.972 678 HA PHE 84 HA PHE 84 -11.076 8.735 5.301 679 HB2 PHE 84 2HB PHE 84 -10.946 11.708 4.601 680 HB3 PHE 84 3HB PHE 84 -9.948 10.870 5.786 681 HD1 PHE 84 HD2 PHE 84 -8.456 8.905 4.872 682 HD2 PHE 84 HD1 PHE 84 -10.123 11.959 2.400 683 HE1 PHE 84 HE2 PHE 84 -6.796 8.422 3.125 684 HE2 PHE 84 HE1 PHE 84 -8.466 11.470 0.659 685 HZ PHE 84 HZ PHE 84 -6.802 9.700 1.022 686 H GLU 85 H GLU 85 -13.540 11.138 4.608 687 HA GLU 85 HA GLU 85 -14.488 11.319 7.388 688 HB2 GLU 85 2HB GLU 85 -15.401 12.819 4.880 689 HB3 GLU 85 3HB GLU 85 -15.849 13.206 6.540 690 HG2 GLU 85 2HG GLU 85 -13.504 13.807 7.042 691 HG3 GLU 85 3HG GLU 85 -13.042 13.373 5.397 692 H ASN 86 H ASN 86 -14.794 8.819 6.446 693 HA ASN 86 HA ASN 86 -16.981 8.351 4.682 694 HB2 ASN 86 2HB ASN 86 -16.548 5.930 5.142 695 HB3 ASN 86 3HB ASN 86 -15.103 6.816 4.678 696 HD21 ASN 86 1HD2 ASN 86 -13.489 7.211 6.255 697 HD22 ASN 86 2HD2 ASN 86 -13.417 6.293 7.716 698 H LYS 87 H LYS 87 -19.011 8.546 5.186 699 HA LYS 87 HA LYS 87 -20.088 7.726 7.824 700 HB2 LYS 87 2HB LYS 87 -21.445 9.332 5.612 701 HB3 LYS 87 3HB LYS 87 -22.056 9.052 7.240 702 HG2 LYS 87 2HG LYS 87 -20.189 10.392 8.168 703 HG3 LYS 87 3HG LYS 87 -19.586 10.676 6.536 704 HD2 LYS 87 2HD LYS 87 -22.289 11.589 7.597 705 HD3 LYS 87 3HD LYS 87 -20.858 12.603 7.449 706 HE2 LYS 87 2HE LYS 87 -22.177 13.142 5.564 707 HE3 LYS 87 3HE LYS 87 -20.932 12.073 4.925 708 HZ1 LYS 87 3HZ LYS 87 -22.501 10.277 4.875 709 HZ2 LYS 87 1HZ LYS 87 -23.192 11.606 4.098 710 HZ3 LYS 87 2HZ LYS 87 -23.678 11.201 5.663 711 H GLY 88 H GLY 88 -19.819 6.882 4.511 712 HA2 GLY 88 2HA GLY 88 -22.138 5.144 4.320 713 HA3 GLY 88 3HA GLY 88 -20.868 5.368 3.126 714 H LYS 89 H LYS 89 -21.037 4.232 6.487 715 HA LYS 89 HA LYS 89 -20.466 2.380 7.585 716 HB2 LYS 89 2HB LYS 89 -20.397 1.068 4.863 717 HB3 LYS 89 3HB LYS 89 -20.327 0.197 6.396 718 HG2 LYS 89 2HG LYS 89 -22.573 1.022 6.986 719 HG3 LYS 89 3HG LYS 89 -22.649 1.942 5.478 720 HD2 LYS 89 2HD LYS 89 -22.395 -1.081 5.674 721 HD3 LYS 89 3HD LYS 89 -23.898 -0.214 5.360 722 HE2 LYS 89 2HE LYS 89 -22.958 0.672 3.254 723 HE3 LYS 89 3HE LYS 89 -21.436 -0.165 3.573 724 HZ1 LYS 89 3HZ LYS 89 -24.079 -1.436 3.090 725 HZ2 LYS 89 1HZ LYS 89 -22.666 -2.267 3.507 726 HZ3 LYS 89 2HZ LYS 89 -22.749 -1.431 2.046 727 H ARG 90 H ARG 90 -18.461 1.847 4.677 728 HA ARG 90 HA ARG 90 -16.076 1.632 6.416 729 HB2 ARG 90 2HB ARG 90 -16.778 -0.584 5.753 730 HB3 ARG 90 3HB ARG 90 -16.977 -0.093 4.075 731 HG2 ARG 90 2HG ARG 90 -14.560 0.124 3.803 732 HG3 ARG 90 3HG ARG 90 -14.305 -0.210 5.518 733 HD2 ARG 90 2HD ARG 90 -15.056 -2.476 5.271 734 HD3 ARG 90 3HD ARG 90 -15.621 -2.175 3.624 735 HE ARG 90 HE ARG 90 -13.197 -1.740 3.102 736 HH11 ARG 90 1HH1 ARG 90 -14.105 -3.958 5.680 737 HH12 ARG 90 2HH1 ARG 90 -12.664 -4.911 5.520 738 HH21 ARG 90 1HH2 ARG 90 -11.417 -3.049 2.809 739 HH22 ARG 90 2HH2 ARG 90 -11.134 -4.385 3.877 740 HA PRO 91 HA PRO 91 -14.172 4.494 3.420 741 HB2 PRO 91 2HB PRO 91 -11.604 4.437 4.375 742 HB3 PRO 91 3HB PRO 91 -12.917 5.266 5.234 743 HG2 PRO 91 2HG PRO 91 -11.714 2.578 5.794 744 HG3 PRO 91 3HG PRO 91 -12.204 3.858 6.928 745 HD2 PRO 91 2HD PRO 91 -13.750 1.644 6.372 746 HD3 PRO 91 3HD PRO 91 -14.411 3.194 6.936 747 H VAL 92 H VAL 92 -12.962 4.353 1.533 748 HA VAL 92 HA VAL 92 -11.640 1.809 0.818 749 HB VAL 92 HB VAL 92 -12.324 4.191 -0.976 750 HG11 VAL 92 1HG1 VAL 92 -11.727 2.707 -2.870 751 HG12 VAL 92 2HG1 VAL 92 -11.240 1.450 -1.732 752 HG13 VAL 92 3HG1 VAL 92 -10.349 2.971 -1.798 753 HG21 VAL 92 3HG2 VAL 92 -14.096 2.752 -1.938 754 HG22 VAL 92 1HG2 VAL 92 -14.365 3.032 -0.216 755 HG23 VAL 92 2HG2 VAL 92 -13.713 1.487 -0.769 756 H PHE 93 H PHE 93 -11.132 5.326 0.923 757 HA PHE 93 HA PHE 93 -8.204 5.014 0.890 758 HB2 PHE 93 2HB PHE 93 -9.868 7.571 0.849 759 HB3 PHE 93 3HB PHE 93 -8.127 7.465 0.624 760 HD1 PHE 93 HD1 PHE 93 -8.244 5.000 -1.315 761 HD2 PHE 93 HD2 PHE 93 -10.332 8.736 -1.195 762 HE1 PHE 93 HE1 PHE 93 -8.547 4.920 -3.750 763 HE2 PHE 93 HE2 PHE 93 -10.634 8.638 -3.631 764 HZ PHE 93 HZ PHE 93 -9.743 6.734 -4.911 765 H VAL 94 H VAL 94 -7.210 4.878 2.818 766 HA VAL 94 HA VAL 94 -8.341 6.241 5.203 767 HB VAL 94 HB VAL 94 -6.660 3.684 5.288 768 HG11 VAL 94 1HG1 VAL 94 -7.440 3.532 7.623 769 HG12 VAL 94 2HG1 VAL 94 -8.351 5.031 7.423 770 HG13 VAL 94 3HG1 VAL 94 -6.588 5.051 7.331 771 HG21 VAL 94 3HG2 VAL 94 -8.787 3.148 4.153 772 HG22 VAL 94 1HG2 VAL 94 -9.691 3.855 5.493 773 HG23 VAL 94 2HG2 VAL 94 -8.721 2.402 5.752 774 H LYS 95 H LYS 95 -6.785 7.220 6.617 775 HA LYS 95 HA LYS 95 -3.946 7.193 5.903 776 HB2 LYS 95 2HB LYS 95 -3.715 9.606 5.805 777 HB3 LYS 95 3HB LYS 95 -4.916 9.104 4.624 778 HG2 LYS 95 2HG LYS 95 -6.728 9.861 6.109 779 HG3 LYS 95 3HG LYS 95 -5.549 10.328 7.337 780 HD2 LYS 95 2HD LYS 95 -5.720 11.524 4.537 781 HD3 LYS 95 3HD LYS 95 -6.380 12.273 5.992 782 HE2 LYS 95 2HE LYS 95 -4.169 12.591 6.920 783 HE3 LYS 95 3HE LYS 95 -3.438 11.592 5.663 784 HZ1 LYS 95 3HZ LYS 95 -4.121 13.265 4.029 785 HZ2 LYS 95 1HZ LYS 95 -3.062 13.892 5.186 786 HZ3 LYS 95 2HZ LYS 95 -4.713 14.244 5.268 787 H GLY 96 H GLY 96 -2.700 8.598 7.500 788 HA2 GLY 96 2HA GLY 96 -2.940 9.682 9.782 789 HA3 GLY 96 3HA GLY 96 -3.645 8.139 10.267 790 H SER 97 H SER 97 -2.107 7.252 11.575 791 HA SER 97 HA SER 97 0.672 6.994 10.687 792 HB2 SER 97 2HB SER 97 0.090 7.357 13.119 793 HB3 SER 97 3HB SER 97 -0.720 5.791 13.128 794 HG SER 97 HG SER 97 1.868 6.338 13.468 795 H LEU 98 H LEU 98 1.561 4.615 10.863 796 HA LEU 98 HA LEU 98 0.397 2.997 8.875 797 HB2 LEU 98 2HB LEU 98 2.791 2.875 9.444 798 HB3 LEU 98 3HB LEU 98 2.401 2.294 11.053 799 HG LEU 98 HG LEU 98 1.454 0.196 10.033 800 HD11 LEU 98 1HD1 LEU 98 2.585 1.249 7.430 801 HD12 LEU 98 2HD1 LEU 98 0.876 1.047 7.825 802 HD13 LEU 98 3HD1 LEU 98 1.921 -0.365 7.704 803 HD21 LEU 98 3HD2 LEU 98 3.730 0.201 10.928 804 HD22 LEU 98 1HD2 LEU 98 4.367 0.723 9.364 805 HD23 LEU 98 2HD2 LEU 98 3.605 -0.861 9.529 806 H GLU 99 H GLU 99 0.478 2.594 12.423 807 HA GLU 99 HA GLU 99 -1.147 0.267 12.546 808 HB2 GLU 99 2HB GLU 99 -0.468 2.321 14.690 809 HB3 GLU 99 3HB GLU 99 -1.281 0.784 15.010 810 HG2 GLU 99 2HG GLU 99 0.689 -0.443 14.175 811 HG3 GLU 99 3HG GLU 99 1.503 1.084 13.834 812 H SER 100 H SER 100 -1.868 3.741 12.888 813 HA SER 100 HA SER 100 -4.530 3.603 13.774 814 HB2 SER 100 2HB SER 100 -3.258 5.722 11.959 815 HB3 SER 100 3HB SER 100 -4.734 5.929 12.910 816 HG SER 100 HG SER 100 -3.248 5.316 14.735 817 H ALA 101 H ALA 101 -3.242 3.896 10.465 818 HA ALA 101 HA ALA 101 -5.695 3.858 9.068 819 HB1 ALA 101 3HB ALA 101 -2.909 3.156 8.069 820 HB2 ALA 101 1HB ALA 101 -3.623 4.769 8.099 821 HB3 ALA 101 2HB ALA 101 -4.308 3.522 7.054 822 H ALA 102 H ALA 102 -3.609 1.346 10.279 823 HA ALA 102 HA ALA 102 -4.585 -0.902 8.859 824 HB1 ALA 102 3HB ALA 102 -3.299 -0.727 11.604 825 HB2 ALA 102 1HB ALA 102 -2.448 -0.910 10.070 826 HB3 ALA 102 2HB ALA 102 -3.500 -2.200 10.657 827 H GLU 103 H GLU 103 -5.391 0.490 12.037 828 HA GLU 103 HA GLU 103 -7.291 -1.447 12.870 829 HB2 GLU 103 2HB GLU 103 -7.065 1.472 13.753 830 HB3 GLU 103 3HB GLU 103 -7.893 0.184 14.629 831 HG2 GLU 103 2HG GLU 103 -5.742 -0.978 14.956 832 HG3 GLU 103 3HG GLU 103 -4.921 0.283 14.068 833 H GLN 104 H GLN 104 -7.585 1.642 11.191 834 HA GLN 104 HA GLN 104 -10.421 1.835 11.139 835 HB2 GLN 104 2HB GLN 104 -8.297 3.110 9.371 836 HB3 GLN 104 3HB GLN 104 -9.998 3.565 9.345 837 HG2 GLN 104 2HG GLN 104 -9.866 4.356 11.650 838 HG3 GLN 104 3HG GLN 104 -8.193 3.808 11.774 839 HE21 GLN 104 1HE2 GLN 104 -6.571 4.986 10.707 840 HE22 GLN 104 2HE2 GLN 104 -6.826 6.579 10.093 841 H ALA 105 H ALA 105 -8.064 0.367 8.923 842 HA ALA 105 HA ALA 105 -10.097 -0.303 6.916 843 HB1 ALA 105 3HB ALA 105 -7.868 0.440 6.167 844 HB2 ALA 105 1HB ALA 105 -8.217 -1.198 5.609 845 HB3 ALA 105 2HB ALA 105 -7.122 -0.942 6.973 846 H GLY 106 H GLY 106 -8.809 -1.721 9.767 847 HA2 GLY 106 2HA GLY 106 -9.617 -3.586 10.879 848 HA3 GLY 106 3HA GLY 106 -10.509 -4.061 9.447 849 H ILE 107 H ILE 107 -7.109 -3.426 9.191 850 HA ILE 107 HA ILE 107 -6.556 -6.176 8.352 851 HB ILE 107 HB ILE 107 -4.480 -3.952 8.446 852 HG12 ILE 107 2HG1 ILE 107 -6.419 -4.262 6.115 853 HG13 ILE 107 3HG1 ILE 107 -6.575 -3.022 7.357 854 HG21 ILE 107 1HG2 ILE 107 -3.538 -5.091 6.473 855 HG22 ILE 107 2HG2 ILE 107 -4.865 -6.254 6.495 856 HG23 ILE 107 3HG2 ILE 107 -3.710 -6.210 7.829 857 HD11 ILE 107 3HD1 ILE 107 -4.234 -3.342 5.481 858 HD12 ILE 107 1HD1 ILE 107 -4.401 -2.108 6.734 859 HD13 ILE 107 2HD1 ILE 107 -5.518 -2.140 5.373 860 H VAL 108 H VAL 108 -4.863 -7.491 9.349 861 HA VAL 108 HA VAL 108 -4.632 -7.252 12.188 862 HB VAL 108 HB VAL 108 -2.981 -9.025 10.327 863 HG11 VAL 108 1HG1 VAL 108 -1.907 -8.783 12.529 864 HG12 VAL 108 2HG1 VAL 108 -2.542 -10.415 12.332 865 HG13 VAL 108 3HG1 VAL 108 -3.406 -9.250 13.338 866 HG21 VAL 108 3HG2 VAL 108 -4.590 -10.818 10.873 867 HG22 VAL 108 1HG2 VAL 108 -5.390 -9.461 10.076 868 HG23 VAL 108 2HG2 VAL 108 -5.553 -9.681 11.820 869 H VAL 109 H VAL 109 -3.605 -5.586 12.991 870 HA VAL 109 HA VAL 109 -1.730 -3.907 11.857 871 HB VAL 109 HB VAL 109 -2.185 -4.428 14.836 872 HG11 VAL 109 1HG1 VAL 109 -0.913 -1.997 13.508 873 HG12 VAL 109 2HG1 VAL 109 -0.084 -3.193 14.506 874 HG13 VAL 109 3HG1 VAL 109 -1.303 -2.141 15.225 875 HG21 VAL 109 3HG2 VAL 109 -4.264 -3.827 13.660 876 HG22 VAL 109 1HG2 VAL 109 -3.498 -2.379 13.007 877 HG23 VAL 109 2HG2 VAL 109 -3.770 -2.525 14.745 878 H ASP 110 H ASP 110 -1.214 -6.772 13.861 879 HA ASP 110 HA ASP 110 1.529 -6.387 14.437 880 HB2 ASP 110 2HB ASP 110 -0.047 -7.840 15.751 881 HB3 ASP 110 3HB ASP 110 -0.040 -9.010 14.435 882 H GLU 111 H GLU 111 -0.114 -8.152 11.830 883 HA GLU 111 HA GLU 111 2.253 -9.360 10.750 884 HB2 GLU 111 2HB GLU 111 -0.533 -9.000 9.587 885 HB3 GLU 111 3HB GLU 111 0.752 -9.867 8.756 886 HG2 GLU 111 2HG GLU 111 -0.415 -10.634 11.447 887 HG3 GLU 111 3HG GLU 111 -0.847 -11.368 9.905 888 H LEU 112 H LEU 112 0.342 -6.420 9.908 889 HA LEU 112 HA LEU 112 1.965 -5.901 7.586 890 HB2 LEU 112 2HB LEU 112 0.765 -3.755 7.399 891 HB3 LEU 112 3HB LEU 112 -0.281 -5.154 7.516 892 HG LEU 112 HG LEU 112 -0.417 -4.489 10.082 893 HD11 LEU 112 1HD1 LEU 112 1.221 -2.671 10.076 894 HD12 LEU 112 2HD1 LEU 112 -0.379 -2.086 10.523 895 HD13 LEU 112 3HD1 LEU 112 0.251 -1.777 8.902 896 HD21 LEU 112 3HD2 LEU 112 -2.425 -3.283 9.654 897 HD22 LEU 112 1HD2 LEU 112 -2.267 -4.583 8.487 898 HD23 LEU 112 2HD2 LEU 112 -1.928 -2.918 8.002 899 H VAL 113 H VAL 113 2.114 -4.790 10.955 900 HA VAL 113 HA VAL 113 4.118 -2.835 10.685 901 HB VAL 113 HB VAL 113 3.516 -4.732 13.006 902 HG11 VAL 113 1HG1 VAL 113 5.929 -4.216 13.166 903 HG12 VAL 113 2HG1 VAL 113 5.043 -3.379 14.443 904 HG13 VAL 113 3HG1 VAL 113 5.587 -2.490 13.018 905 HG21 VAL 113 3HG2 VAL 113 3.089 -1.731 12.673 906 HG22 VAL 113 1HG2 VAL 113 2.640 -2.678 14.098 907 HG23 VAL 113 2HG2 VAL 113 1.840 -2.969 12.554 908 H GLN 114 H GLN 114 4.303 -6.374 10.809 909 HA GLN 114 HA GLN 114 7.106 -6.658 10.746 910 HB2 GLN 114 2HB GLN 114 4.933 -8.511 9.708 911 HB3 GLN 114 3HB GLN 114 6.635 -8.956 9.788 912 HG2 GLN 114 2HG GLN 114 4.873 -8.241 12.151 913 HG3 GLN 114 3HG GLN 114 5.377 -9.863 11.689 914 HE21 GLN 114 1HE2 GLN 114 6.429 -6.829 13.081 915 HE22 GLN 114 2HE2 GLN 114 7.914 -7.419 13.733 916 H THR 115 H THR 115 4.769 -6.851 7.970 917 HA THR 115 HA THR 115 6.759 -7.233 6.019 918 HB THR 115 HB THR 115 4.364 -7.752 5.628 919 HG1 THR 115 HG1 THR 115 5.862 -6.231 3.785 920 HG21 THR 115 3HG2 THR 115 3.393 -5.647 6.557 921 HG22 THR 115 1HG2 THR 115 2.761 -6.088 4.971 922 HG23 THR 115 2HG2 THR 115 3.955 -4.795 5.121 923 H VAL 116 H VAL 116 5.529 -4.232 7.388 924 HA VAL 116 HA VAL 116 6.707 -2.511 5.395 925 HB VAL 116 HB VAL 116 5.512 -1.832 8.118 926 HG11 VAL 116 1HG1 VAL 116 7.118 -0.072 7.472 927 HG12 VAL 116 2HG1 VAL 116 5.466 0.536 7.348 928 HG13 VAL 116 3HG1 VAL 116 6.348 0.077 5.889 929 HG21 VAL 116 3HG2 VAL 116 4.347 -1.548 5.321 930 HG22 VAL 116 1HG2 VAL 116 3.554 -1.065 6.823 931 HG23 VAL 116 2HG2 VAL 116 3.888 -2.767 6.509 932 H LYS 117 H LYS 117 7.591 -3.547 8.736 933 HA LYS 117 HA LYS 117 9.944 -1.864 8.790 934 HB2 LYS 117 2HB LYS 117 10.494 -2.832 10.902 935 HB3 LYS 117 3HB LYS 117 8.748 -2.617 10.887 936 HG2 LYS 117 2HG LYS 117 8.396 -4.994 10.535 937 HG3 LYS 117 3HG LYS 117 10.123 -5.271 10.312 938 HD2 LYS 117 2HD LYS 117 8.822 -4.320 12.898 939 HD3 LYS 117 3HD LYS 117 9.333 -5.977 12.562 940 HE2 LYS 117 2HE LYS 117 11.671 -5.226 12.346 941 HE3 LYS 117 3HE LYS 117 11.173 -3.559 12.642 942 HZ1 LYS 117 3HZ LYS 117 10.969 -5.822 14.545 943 HZ2 LYS 117 1HZ LYS 117 10.373 -4.269 14.828 944 HZ3 LYS 117 2HZ LYS 117 12.033 -4.513 14.640 945 H ASN 118 H ASN 118 9.241 -5.056 7.630 946 HA ASN 118 HA ASN 118 11.980 -5.991 7.467 947 HB2 ASN 118 2HB ASN 118 9.416 -7.114 6.229 948 HB3 ASN 118 3HB ASN 118 10.993 -7.895 6.126 949 HD21 ASN 118 1HD2 ASN 118 8.541 -8.919 7.327 950 HD22 ASN 118 2HD2 ASN 118 8.895 -9.232 8.990 951 H TYR 119 H TYR 119 9.549 -4.557 5.330 952 HA TYR 119 HA TYR 119 11.001 -4.419 2.929 953 HB2 TYR 119 2HB TYR 119 8.613 -3.867 2.978 954 HB3 TYR 119 3HB TYR 119 8.893 -2.544 4.101 955 HD1 TYR 119 HD1 TYR 119 9.430 -3.649 0.579 956 HD2 TYR 119 HD2 TYR 119 9.446 -0.328 3.273 957 HE1 TYR 119 HE1 TYR 119 9.588 -2.109 -1.325 958 HE2 TYR 119 HE2 TYR 119 9.607 1.213 1.367 959 HH TYR 119 HH TYR 119 10.264 1.232 -0.959 960 H GLN 120 H GLN 120 10.559 -1.915 5.416 961 HA GLN 120 HA GLN 120 12.499 -0.100 4.516 962 HB2 GLN 120 2HB GLN 120 11.244 -0.463 7.273 963 HB3 GLN 120 3HB GLN 120 12.254 0.911 6.828 964 HG2 GLN 120 2HG GLN 120 10.598 1.480 5.026 965 HG3 GLN 120 3HG GLN 120 9.564 0.180 5.619 966 HE21 GLN 120 1HE2 GLN 120 9.146 3.116 5.475 967 HE22 GLN 120 2HE2 GLN 120 8.741 3.609 7.072 968 H GLY 121 H GLY 121 12.736 -2.948 6.465 969 HA2 GLY 121 2HA GLY 121 15.246 -2.457 7.734 970 HA3 GLY 121 3HA GLY 121 14.423 -4.002 7.569 971 H TYR 122 H TYR 122 14.205 -4.301 4.832 972 HA TYR 122 HA TYR 122 16.900 -5.095 4.238 973 HB2 TYR 122 2HB TYR 122 16.050 -6.273 2.326 974 HB3 TYR 122 3HB TYR 122 15.052 -6.607 3.714 975 HD1 TYR 122 HD2 TYR 122 14.803 -3.879 1.058 976 HD2 TYR 122 HD1 TYR 122 12.973 -7.268 2.905 977 HE1 TYR 122 HE2 TYR 122 12.869 -3.649 -0.424 978 HE2 TYR 122 HE1 TYR 122 11.045 -7.047 1.397 979 HH TYR 122 HH TYR 122 9.954 -5.331 0.025 980 H VAL 123 H VAL 123 14.979 -2.361 3.435 981 HA VAL 123 HA VAL 123 16.378 -1.420 1.149 982 HB VAL 123 HB VAL 123 14.773 0.085 3.261 983 HG11 VAL 123 1HG1 VAL 123 14.772 2.022 1.695 984 HG12 VAL 123 2HG1 VAL 123 15.931 1.178 0.666 985 HG13 VAL 123 3HG1 VAL 123 16.389 1.659 2.302 986 HG21 VAL 123 3HG2 VAL 123 13.024 0.203 1.521 987 HG22 VAL 123 1HG2 VAL 123 13.470 -1.476 1.833 988 HG23 VAL 123 2HG2 VAL 123 14.069 -0.662 0.391 989 H GLN 124 H GLN 124 16.687 -0.478 4.610 990 HA GLN 124 HA GLN 124 19.086 1.047 4.207 991 HB2 GLN 124 2HB GLN 124 19.171 1.185 6.706 992 HB3 GLN 124 3HB GLN 124 17.613 1.657 6.035 993 HG2 GLN 124 2HG GLN 124 16.732 -0.599 6.565 994 HG3 GLN 124 3HG GLN 124 18.258 -0.995 7.358 995 HE21 GLN 124 1HE2 GLN 124 15.571 -0.923 8.487 996 HE22 GLN 124 2HE2 GLN 124 15.625 0.210 9.790 997 H ASP 125 H ASP 125 18.458 -2.307 4.654 998 HA ASP 125 HA ASP 125 21.084 -3.111 5.532 999 HB2 ASP 125 2HB ASP 125 19.044 -4.521 5.862 1000 HB3 ASP 125 3HB ASP 125 18.885 -4.701 4.120 1001 H GLY 126 H GLY 126 19.612 -2.247 2.514 1002 HA2 GLY 126 2HA GLY 126 20.479 -1.909 0.427 1003 HA3 GLY 126 3HA GLY 126 22.074 -2.295 1.052 1004 H HIS 127 H HIS 127 19.417 -4.508 1.413 1005 HA HIS 127 HA HIS 127 19.945 -6.077 -0.960 1006 HB2 HIS 127 2HB HIS 127 21.791 -6.859 0.513 1007 HB3 HIS 127 3HB HIS 127 20.650 -7.179 1.811 1008 HD1 HIS 127 HD1 HIS 127 22.030 -8.608 -1.325 1009 HD2 HIS 127 HD2 HIS 127 19.044 -9.553 1.419 1010 HE1 HIS 127 HE1 HIS 127 21.433 -11.000 -1.773 1011 HE2 HIS 127 HE2 HIS 127 19.513 -11.484 -0.219 1012 H ASP 128 H ASP 128 17.906 -6.541 -1.561 1013 HA ASP 128 HA ASP 128 15.682 -6.426 0.207 1014 HB2 ASP 128 2HB ASP 128 14.286 -6.742 -1.668 1015 HB3 ASP 128 3HB ASP 128 15.673 -5.894 -2.336 1016 H HIS 129 H HIS 129 14.292 -8.131 0.799 1017 HA HIS 129 HA HIS 129 15.554 -10.807 1.006 1018 HB2 HIS 129 2HB HIS 129 13.606 -9.347 2.824 1019 HB3 HIS 129 3HB HIS 129 13.947 -11.062 2.997 1020 HD1 HIS 129 HD1 HIS 129 14.897 -10.696 5.351 1021 HD2 HIS 129 HD2 HIS 129 16.946 -8.584 2.429 1022 HE1 HIS 129 HE1 HIS 129 16.966 -9.842 6.462 1023 HE2 HIS 129 HE2 HIS 129 18.159 -8.513 4.698 1024 H ASP 130 H ASP 130 12.343 -9.249 0.898 1025 HA ASP 130 HA ASP 130 11.209 -11.625 -0.426 1026 HB2 ASP 130 2HB ASP 130 9.881 -9.321 1.054 1027 HB3 ASP 130 3HB ASP 130 8.981 -10.587 0.222 1028 H PHE 131 H PHE 131 12.077 -11.159 -2.457 1029 HA PHE 131 HA PHE 131 12.082 -10.415 -4.586 1030 HB2 PHE 131 2HB PHE 131 9.658 -10.322 -5.577 1031 HB3 PHE 131 3HB PHE 131 10.244 -11.823 -4.888 1032 HD1 PHE 131 HD2 PHE 131 8.041 -8.893 -4.230 1033 HD2 PHE 131 HD1 PHE 131 9.063 -12.888 -3.095 1034 HE1 PHE 131 HE2 PHE 131 6.059 -8.994 -2.780 1035 HE2 PHE 131 HE1 PHE 131 7.073 -12.976 -1.657 1036 HZ PHE 131 HZ PHE 131 5.586 -11.028 -1.487 1037 H GLY 132 H GLY 132 12.547 -8.177 -2.927 1038 HA2 GLY 132 2HA GLY 132 10.957 -5.919 -3.724 1039 HA3 GLY 132 3HA GLY 132 12.493 -5.880 -2.864 1040 H ARG 133 H ARG 133 14.285 -5.263 -3.946 1041 HA ARG 133 HA ARG 133 14.856 -5.757 -6.655 1042 HB2 ARG 133 2HB ARG 133 14.810 -3.464 -7.615 1043 HB3 ARG 133 3HB ARG 133 13.203 -4.051 -7.236 1044 HG2 ARG 133 2HG ARG 133 14.662 -2.233 -5.316 1045 HG3 ARG 133 3HG ARG 133 13.828 -1.578 -6.722 1046 HD2 ARG 133 2HD ARG 133 12.588 -3.149 -4.441 1047 HD3 ARG 133 3HD ARG 133 12.369 -1.434 -4.792 1048 HE ARG 133 HE ARG 133 11.297 -3.688 -6.392 1049 HH11 ARG 133 1HH1 ARG 133 11.243 -0.253 -5.588 1050 HH12 ARG 133 2HH1 ARG 133 9.807 0.066 -6.505 1051 HH21 ARG 133 1HH2 ARG 133 9.407 -3.244 -7.591 1052 HH22 ARG 133 2HH2 ARG 133 8.765 -1.633 -7.642 1053 H ASP 134 H ASP 134 16.674 -3.968 -7.358 1054 HA ASP 134 HA ASP 134 18.965 -4.521 -5.878 1055 HB2 ASP 134 2HB ASP 134 18.790 -3.835 -8.339 1056 HB3 ASP 134 3HB ASP 134 18.572 -2.179 -7.804 1057 HA PRO 135 HA PRO 135 19.175 -1.693 -2.322 1058 HB2 PRO 135 2HB PRO 135 21.912 -0.888 -2.829 1059 HB3 PRO 135 3HB PRO 135 21.330 -2.129 -1.710 1060 HG2 PRO 135 2HG PRO 135 22.333 -2.439 -4.496 1061 HG3 PRO 135 3HG PRO 135 22.484 -3.542 -3.107 1062 HD2 PRO 135 2HD PRO 135 20.773 -4.114 -5.056 1063 HD3 PRO 135 3HD PRO 135 20.286 -4.373 -3.362 1064 H LYS 136 H LYS 136 20.278 -0.482 -5.492 1065 HA LYS 136 HA LYS 136 20.337 2.280 -4.693 1066 HB2 LYS 136 2HB LYS 136 20.800 2.812 -7.003 1067 HB3 LYS 136 3HB LYS 136 21.714 1.371 -6.581 1068 HG2 LYS 136 2HG LYS 136 19.920 0.003 -7.723 1069 HG3 LYS 136 3HG LYS 136 19.194 1.518 -8.265 1070 HD2 LYS 136 2HD LYS 136 20.533 0.654 -10.077 1071 HD3 LYS 136 3HD LYS 136 21.380 2.064 -9.428 1072 HE2 LYS 136 2HE LYS 136 22.861 0.517 -8.137 1073 HE3 LYS 136 3HE LYS 136 22.007 -0.850 -8.864 1074 HZ1 LYS 136 3HZ LYS 136 24.041 -0.439 -10.032 1075 HZ2 LYS 136 1HZ LYS 136 23.627 1.175 -10.312 1076 HZ3 LYS 136 2HZ LYS 136 22.744 -0.064 -11.046 1077 H TYR 137 H TYR 137 17.877 0.166 -6.011 1078 HA TYR 137 HA TYR 137 15.980 2.373 -6.495 1079 HB2 TYR 137 2HB TYR 137 15.714 -0.612 -7.077 1080 HB3 TYR 137 3HB TYR 137 14.546 0.622 -7.531 1081 HD1 TYR 137 HD2 TYR 137 15.710 2.679 -8.917 1082 HD2 TYR 137 HD1 TYR 137 17.114 -1.359 -8.804 1083 HE1 TYR 137 HE2 TYR 137 16.873 3.016 -11.052 1084 HE2 TYR 137 HE1 TYR 137 18.284 -1.013 -10.934 1085 HH TYR 137 HH TYR 137 18.105 0.453 -12.903 1086 H LEU 138 H LEU 138 16.879 0.477 -3.916 1087 HA LEU 138 HA LEU 138 14.283 0.074 -2.702 1088 HB2 LEU 138 2HB LEU 138 17.120 -0.177 -1.634 1089 HB3 LEU 138 3HB LEU 138 15.706 -0.481 -0.642 1090 HG LEU 138 HG LEU 138 16.530 -2.075 -3.103 1091 HD11 LEU 138 1HD1 LEU 138 16.569 -2.889 -0.178 1092 HD12 LEU 138 2HD1 LEU 138 17.977 -2.516 -1.175 1093 HD13 LEU 138 3HD1 LEU 138 16.980 -3.916 -1.558 1094 HD21 LEU 138 3HD2 LEU 138 14.686 -3.602 -2.557 1095 HD22 LEU 138 1HD2 LEU 138 14.095 -1.984 -2.931 1096 HD23 LEU 138 2HD2 LEU 138 14.167 -2.527 -1.253 1097 H HIS 139 H HIS 139 13.177 1.551 -1.538 1098 HA HIS 139 HA HIS 139 14.547 3.629 0.010 1099 HB2 HIS 139 2HB HIS 139 14.043 4.757 -2.156 1100 HB3 HIS 139 3HB HIS 139 12.345 4.314 -2.004 1101 HD1 HIS 139 HD1 HIS 139 11.119 6.428 -1.486 1102 HD2 HIS 139 HD2 HIS 139 14.693 6.186 0.621 1103 HE1 HIS 139 HE1 HIS 139 11.165 8.437 0.013 1104 HE2 HIS 139 HE2 HIS 139 13.408 8.351 1.145 1105 H GLN 140 H GLN 140 13.533 3.973 1.957 1106 HA GLN 140 HA GLN 140 11.294 2.354 2.746 1107 HB2 GLN 140 2HB GLN 140 12.589 4.670 4.271 1108 HB3 GLN 140 3HB GLN 140 11.444 3.521 4.937 1109 HG2 GLN 140 2HG GLN 140 13.332 2.535 5.710 1110 HG3 GLN 140 3HG GLN 140 13.293 1.762 4.135 1111 HE21 GLN 140 1HE2 GLN 140 15.522 2.027 5.784 1112 HE22 GLN 140 2HE2 GLN 140 16.708 2.967 4.957 1113 H PHE 141 H PHE 141 9.202 3.056 3.388 1114 HA PHE 141 HA PHE 141 8.091 5.481 2.346 1115 HB2 PHE 141 2HB PHE 141 6.956 3.834 4.646 1116 HB3 PHE 141 3HB PHE 141 6.074 4.912 3.574 1117 HD1 PHE 141 HD1 PHE 141 6.273 4.165 0.962 1118 HD2 PHE 141 HD2 PHE 141 6.646 1.553 4.335 1119 HE1 PHE 141 HE1 PHE 141 5.591 2.254 -0.420 1120 HE2 PHE 141 HE2 PHE 141 5.974 -0.345 2.941 1121 HZ PHE 141 HZ PHE 141 5.444 -0.003 0.555 1122 H GLU 142 H GLU 142 9.215 7.299 3.149 1123 HA GLU 142 HA GLU 142 10.150 7.553 5.836 1124 HB2 GLU 142 2HB GLU 142 9.675 9.744 3.775 1125 HB3 GLU 142 3HB GLU 142 10.622 9.913 5.250 1126 HG2 GLU 142 2HG GLU 142 12.234 8.232 4.396 1127 HG3 GLU 142 3HG GLU 142 11.292 8.087 2.912 1128 H GLY 143 H GLY 143 8.666 7.407 7.399 1129 HA2 GLY 143 2HA GLY 143 5.914 7.681 7.029 1130 HA3 GLY 143 3HA GLY 143 6.719 7.461 8.566 1131 H GLU 144 H GLU 144 5.673 9.873 6.226 1132 HA GLU 144 HA GLU 144 5.484 11.965 8.287 1133 HB2 GLU 144 2HB GLU 144 4.715 12.018 5.314 1134 HB3 GLU 144 3HB GLU 144 4.638 13.395 6.416 1135 HG2 GLU 144 2HG GLU 144 7.131 13.191 6.743 1136 HG3 GLU 144 3HG GLU 144 7.142 11.940 5.500 1137 H THR 145 H THR 145 3.387 10.278 5.940 1138 HA THR 145 HA THR 145 1.296 9.858 7.939 1139 HB THR 145 HB THR 145 0.650 11.324 5.328 1140 HG1 THR 145 HG1 THR 145 1.607 12.734 6.860 1141 HG21 THR 145 3HG2 THR 145 -1.631 11.524 6.256 1142 HG22 THR 145 1HG2 THR 145 -1.161 10.560 7.652 1143 HG23 THR 145 2HG2 THR 145 -1.184 9.831 6.041 1144 H PHE 146 H PHE 146 0.796 7.715 7.669 1145 HA PHE 146 HA PHE 146 1.367 6.355 5.143 1146 HB2 PHE 146 2HB PHE 146 0.863 5.464 7.973 1147 HB3 PHE 146 3HB PHE 146 0.366 4.345 6.713 1148 HD1 PHE 146 HD2 PHE 146 3.281 6.012 8.296 1149 HD2 PHE 146 HD1 PHE 146 1.990 3.188 5.345 1150 HE1 PHE 146 HE2 PHE 146 5.577 5.146 8.099 1151 HE2 PHE 146 HE1 PHE 146 4.278 2.330 5.163 1152 HZ PHE 146 HZ PHE 146 6.076 3.305 6.530 1153 H TYR 147 H TYR 147 -0.078 5.900 3.695 1154 HA TYR 147 HA TYR 147 -2.978 5.996 4.246 1155 HB2 TYR 147 2HB TYR 147 -1.350 6.398 1.701 1156 HB3 TYR 147 3HB TYR 147 -3.067 6.021 1.626 1157 HD1 TYR 147 HD1 TYR 147 -0.764 8.459 3.339 1158 HD2 TYR 147 HD2 TYR 147 -4.540 7.803 1.471 1159 HE1 TYR 147 HE1 TYR 147 -1.297 10.840 3.560 1160 HE2 TYR 147 HE2 TYR 147 -5.063 10.181 1.690 1161 HH TYR 147 HH TYR 147 -2.718 12.508 2.511 1162 H ILE 148 H ILE 148 -4.274 4.335 3.508 1163 HA ILE 148 HA ILE 148 -3.058 1.923 2.344 1164 HB ILE 148 HB ILE 148 -4.977 1.972 4.721 1165 HG12 ILE 148 2HG1 ILE 148 -2.175 0.788 4.402 1166 HG13 ILE 148 3HG1 ILE 148 -2.588 2.224 5.328 1167 HG21 ILE 148 1HG2 ILE 148 -5.081 -0.490 4.570 1168 HG22 ILE 148 2HG2 ILE 148 -4.127 -0.442 3.086 1169 HG23 ILE 148 3HG2 ILE 148 -5.742 0.268 3.120 1170 HD11 ILE 148 3HD1 ILE 148 -2.208 0.407 6.817 1171 HD12 ILE 148 1HD1 ILE 148 -3.358 -0.617 5.957 1172 HD13 ILE 148 2HD1 ILE 148 -3.926 0.797 6.845 1173 H ILE 149 H ILE 149 -3.902 1.887 0.385 1174 HA ILE 149 HA ILE 149 -6.650 2.813 -0.147 1175 HB ILE 149 HB ILE 149 -4.502 2.002 -2.166 1176 HG12 ILE 149 2HG1 ILE 149 -3.657 3.915 -0.904 1177 HG13 ILE 149 3HG1 ILE 149 -4.119 4.457 -2.511 1178 HG21 ILE 149 1HG2 ILE 149 -5.883 3.232 -3.815 1179 HG22 ILE 149 2HG2 ILE 149 -7.088 3.552 -2.566 1180 HG23 ILE 149 3HG2 ILE 149 -6.778 1.894 -3.086 1181 HD11 ILE 149 3HD1 ILE 149 -5.675 4.869 0.041 1182 HD12 ILE 149 1HD1 ILE 149 -6.194 5.392 -1.566 1183 HD13 ILE 149 2HD1 ILE 149 -4.738 6.073 -0.842 1184 H GLU 150 H GLU 150 -8.181 1.299 -0.062 1185 HA GLU 150 HA GLU 150 -7.752 -1.520 -0.183 1186 HB2 GLU 150 2HB GLU 150 -9.652 -0.551 1.074 1187 HB3 GLU 150 3HB GLU 150 -10.327 0.093 -0.423 1188 HG2 GLU 150 2HG GLU 150 -10.404 -2.374 -1.235 1189 HG3 GLU 150 3HG GLU 150 -10.131 -2.808 0.449 1190 H GLN 151 H GLN 151 -7.153 -2.468 -2.041 1191 HA GLN 151 HA GLN 151 -8.614 -1.898 -4.562 1192 HB2 GLN 151 2HB GLN 151 -5.757 -2.917 -4.192 1193 HB3 GLN 151 3HB GLN 151 -6.584 -2.831 -5.745 1194 HG2 GLN 151 2HG GLN 151 -5.935 -0.452 -3.974 1195 HG3 GLN 151 3HG GLN 151 -5.020 -0.953 -5.394 1196 HE21 GLN 151 1HE2 GLN 151 -7.956 0.589 -4.281 1197 HE22 GLN 151 2HE2 GLN 151 -8.471 1.171 -5.822 1198 H ARG 152 H ARG 152 -10.212 -3.377 -4.411 1199 HA ARG 152 HA ARG 152 -9.605 -6.212 -3.879 1200 HB2 ARG 152 2HB ARG 152 -12.257 -4.735 -4.167 1201 HB3 ARG 152 3HB ARG 152 -12.117 -6.479 -3.933 1202 HG2 ARG 152 2HG ARG 152 -10.873 -6.028 -1.805 1203 HG3 ARG 152 3HG ARG 152 -11.223 -4.313 -2.009 1204 HD2 ARG 152 2HD ARG 152 -13.365 -6.451 -1.813 1205 HD3 ARG 152 3HD ARG 152 -12.720 -5.573 -0.425 1206 HE ARG 152 HE ARG 152 -13.708 -3.865 -2.530 1207 HH11 ARG 152 1HH1 ARG 152 -14.609 -5.631 0.389 1208 HH12 ARG 152 2HH1 ARG 152 -15.998 -4.640 0.702 1209 HH21 ARG 152 1HH2 ARG 152 -15.516 -2.555 -2.082 1210 HH22 ARG 152 2HH2 ARG 152 -16.507 -2.901 -0.702 1211 H LEU 153 H LEU 153 -10.799 -7.787 -5.357 1212 HA LEU 153 HA LEU 153 -10.035 -7.482 -8.077 1213 HB2 LEU 153 2HB LEU 153 -11.949 -9.476 -6.796 1214 HB3 LEU 153 3HB LEU 153 -11.321 -9.612 -8.431 1215 HG LEU 153 HG LEU 153 -9.658 -9.762 -5.879 1216 HD11 LEU 153 1HD1 LEU 153 -10.436 -11.980 -7.799 1217 HD12 LEU 153 2HD1 LEU 153 -11.057 -11.745 -6.162 1218 HD13 LEU 153 3HD1 LEU 153 -9.356 -12.133 -6.408 1219 HD21 LEU 153 3HD2 LEU 153 -8.777 -10.122 -8.767 1220 HD22 LEU 153 1HD2 LEU 153 -7.777 -10.394 -7.335 1221 HD23 LEU 153 2HD2 LEU 153 -8.360 -8.773 -7.705 1222 H GLU 154 H GLU 154 -11.819 -7.961 -9.863 1223 HA GLU 154 HA GLU 154 -13.318 -5.565 -10.096 1224 HB2 GLU 154 2HB GLU 154 -13.748 -8.067 -11.793 1225 HB3 GLU 154 3HB GLU 154 -14.209 -6.421 -12.204 1226 HG2 GLU 154 2HG GLU 154 -12.310 -6.816 -13.506 1227 HG3 GLU 154 3HG GLU 154 -11.688 -5.880 -12.147 1228 H HIS 155 H HIS 155 -15.721 -5.796 -10.941 1229 HA HIS 155 HA HIS 155 -17.145 -6.407 -8.487 1230 HB2 HIS 155 2HB HIS 155 -18.085 -5.037 -11.051 1231 HB3 HIS 155 3HB HIS 155 -18.986 -5.105 -9.537 1232 HD1 HIS 155 HD1 HIS 155 -18.829 -2.389 -9.968 1233 HD2 HIS 155 HD2 HIS 155 -15.313 -4.269 -8.798 1234 HE1 HIS 155 HE1 HIS 155 -17.312 -0.558 -9.168 1235 HE2 HIS 155 HE2 HIS 155 -15.187 -1.714 -8.508 1236 H HIS 156 H HIS 156 -16.883 -8.702 -8.669 1237 HA HIS 156 HA HIS 156 -18.476 -10.177 -10.666 1238 HB2 HIS 156 2HB HIS 156 -16.470 -11.121 -8.549 1239 HB3 HIS 156 3HB HIS 156 -17.379 -12.219 -9.583 1240 HD1 HIS 156 HD1 HIS 156 -16.587 -12.487 -12.013 1241 HD2 HIS 156 HD2 HIS 156 -14.340 -9.746 -9.852 1242 HE1 HIS 156 HE1 HIS 156 -14.570 -12.006 -13.425 1243 HE2 HIS 156 HE2 HIS 156 -13.381 -10.155 -12.212 1244 H HIS 157 H HIS 157 -19.676 -8.531 -8.557 1245 HA HIS 157 HA HIS 157 -20.595 -9.821 -6.288 1246 HB2 HIS 157 2HB HIS 157 -22.399 -8.107 -6.238 1247 HB3 HIS 157 3HB HIS 157 -20.831 -7.400 -6.617 1248 HD1 HIS 157 HD1 HIS 157 -24.256 -7.882 -7.996 1249 HD2 HIS 157 HD2 HIS 157 -20.569 -6.519 -9.348 1250 HE1 HIS 157 HE1 HIS 157 -24.714 -6.720 -10.172 1251 HE2 HIS 157 HE2 HIS 157 -22.492 -5.786 -10.890 1252 H HIS 158 H HIS 158 -21.881 -10.032 -9.593 1253 HA HIS 158 HA HIS 158 -24.343 -11.321 -8.873 1254 HB2 HIS 158 2HB HIS 158 -24.205 -10.055 -10.988 1255 HB3 HIS 158 3HB HIS 158 -22.970 -11.158 -11.592 1256 HD1 HIS 158 HD1 HIS 158 -26.637 -11.178 -10.590 1257 HD2 HIS 158 HD2 HIS 158 -23.982 -13.379 -12.894 1258 HE1 HIS 158 HE1 HIS 158 -28.026 -12.895 -11.769 1259 HE2 HIS 158 HE2 HIS 158 -26.424 -14.050 -13.320 1260 H HIS 159 H HIS 159 -23.604 -12.940 -7.519 1261 HA HIS 159 HA HIS 159 -23.102 -15.474 -8.947 1262 HB2 HIS 159 2HB HIS 159 -21.877 -14.586 -6.300 1263 HB3 HIS 159 3HB HIS 159 -22.037 -16.293 -6.706 1264 HD1 HIS 159 HD1 HIS 159 -19.613 -13.710 -6.863 1265 HD2 HIS 159 HD2 HIS 159 -20.749 -16.760 -9.437 1266 HE1 HIS 159 HE1 HIS 159 -17.637 -14.104 -8.357 1267 HE2 HIS 159 HE2 HIS 159 -18.292 -16.072 -9.776 1268 H HIS 160 H HIS 160 -24.985 -13.587 -6.826 1269 HA HIS 160 HA HIS 160 -26.948 -15.765 -6.529 1270 HB2 HIS 160 2HB HIS 160 -25.911 -13.999 -4.270 1271 HB3 HIS 160 3HB HIS 160 -27.464 -14.816 -4.173 1272 HD1 HIS 160 HD1 HIS 160 -27.451 -17.366 -3.889 1273 HD2 HIS 160 HD2 HIS 160 -23.664 -15.669 -3.918 1274 HE1 HIS 160 HE1 HIS 160 -25.905 -19.160 -3.083 1275 HE2 HIS 160 HE2 HIS 160 -23.655 -18.048 -2.927 Start of MODEL 12 1 H1 MET 1 1H MET 1 -6.430 -3.474 -24.560 2 H2 MET 1 2H MET 1 -6.355 -4.173 -23.024 3 H3 MET 1 3H MET 1 -4.948 -3.588 -23.759 4 HA MET 1 HA MET 1 -7.272 -1.948 -22.977 5 HB2 MET 1 2HB MET 1 -4.548 -2.228 -21.630 6 HB3 MET 1 3HB MET 1 -5.749 -1.013 -21.200 7 HG2 MET 1 2HG MET 1 -6.104 -4.013 -20.945 8 HG3 MET 1 3HG MET 1 -5.763 -2.893 -19.624 9 HE1 MET 1 3HE MET 1 -8.266 -4.974 -19.631 10 HE2 MET 1 1HE MET 1 -9.535 -3.933 -18.984 11 HE3 MET 1 2HE MET 1 -7.915 -3.881 -18.291 12 H VAL 2 H VAL 2 -7.238 -1.044 -25.094 13 HA VAL 2 HA VAL 2 -5.006 0.483 -26.084 14 HB VAL 2 HB VAL 2 -7.973 0.868 -26.770 15 HG11 VAL 2 1HG1 VAL 2 -6.558 2.765 -27.475 16 HG12 VAL 2 2HG1 VAL 2 -7.154 1.873 -28.876 17 HG13 VAL 2 3HG1 VAL 2 -5.484 1.660 -28.342 18 HG21 VAL 2 3HG2 VAL 2 -7.285 -1.472 -27.187 19 HG22 VAL 2 1HG2 VAL 2 -5.959 -0.901 -28.203 20 HG23 VAL 2 2HG2 VAL 2 -7.632 -0.616 -28.692 21 H GLU 3 H GLU 3 -8.001 1.186 -24.330 22 HA GLU 3 HA GLU 3 -7.517 3.987 -23.917 23 HB2 GLU 3 2HB GLU 3 -9.516 2.053 -22.648 24 HB3 GLU 3 3HB GLU 3 -9.505 3.791 -22.345 25 HG2 GLU 3 2HG GLU 3 -9.972 4.263 -24.684 26 HG3 GLU 3 3HG GLU 3 -9.833 2.554 -25.087 27 HA PRO 4 HA PRO 4 -5.004 3.651 -20.184 28 HB2 PRO 4 2HB PRO 4 -5.140 6.203 -19.291 29 HB3 PRO 4 3HB PRO 4 -4.338 5.817 -20.829 30 HG2 PRO 4 2HG PRO 4 -7.111 6.884 -20.377 31 HG3 PRO 4 3HG PRO 4 -5.879 7.422 -21.542 32 HD2 PRO 4 2HD PRO 4 -7.929 5.734 -22.231 33 HD3 PRO 4 3HD PRO 4 -6.345 5.713 -23.034 34 H GLY 5 H GLY 5 -5.210 4.576 -17.754 35 HA2 GLY 5 2HA GLY 5 -7.513 3.334 -16.567 36 HA3 GLY 5 3HA GLY 5 -6.219 4.164 -15.724 37 H VAL 6 H VAL 6 -9.191 4.712 -17.583 38 HA VAL 6 HA VAL 6 -9.743 7.199 -16.040 39 HB VAL 6 HB VAL 6 -10.791 8.163 -18.126 40 HG11 VAL 6 1HG1 VAL 6 -8.691 8.855 -19.222 41 HG12 VAL 6 2HG1 VAL 6 -7.819 7.563 -18.390 42 HG13 VAL 6 3HG1 VAL 6 -8.541 8.881 -17.462 43 HG21 VAL 6 3HG2 VAL 6 -10.247 7.194 -20.347 44 HG22 VAL 6 1HG2 VAL 6 -11.200 6.075 -19.370 45 HG23 VAL 6 2HG2 VAL 6 -9.464 5.819 -19.561 46 H ALA 7 H ALA 7 -10.616 4.225 -16.097 47 HA ALA 7 HA ALA 7 -13.421 4.328 -16.939 48 HB1 ALA 7 3HB ALA 7 -11.984 2.493 -17.737 49 HB2 ALA 7 1HB ALA 7 -13.299 1.871 -16.742 50 HB3 ALA 7 2HB ALA 7 -11.669 1.995 -16.074 51 H LYS 8 H LYS 8 -12.700 5.756 -14.525 52 HA LYS 8 HA LYS 8 -13.321 6.188 -12.424 53 HB2 LYS 8 2HB LYS 8 -15.464 4.049 -12.797 54 HB3 LYS 8 3HB LYS 8 -15.409 5.210 -11.475 55 HG2 LYS 8 2HG LYS 8 -15.837 5.827 -14.414 56 HG3 LYS 8 3HG LYS 8 -17.028 5.949 -13.122 57 HD2 LYS 8 2HD LYS 8 -14.522 7.651 -13.393 58 HD3 LYS 8 3HD LYS 8 -16.158 8.167 -13.788 59 HE2 LYS 8 2HE LYS 8 -16.827 8.086 -11.469 60 HE3 LYS 8 3HE LYS 8 -15.315 7.297 -11.005 61 HZ1 LYS 8 3HZ LYS 8 -15.489 10.032 -12.155 62 HZ2 LYS 8 1HZ LYS 8 -14.105 9.277 -11.545 63 HZ3 LYS 8 2HZ LYS 8 -15.373 9.701 -10.503 64 H LEU 9 H LEU 9 -11.377 5.590 -11.651 65 HA LEU 9 HA LEU 9 -9.805 4.600 -10.435 66 HB2 LEU 9 2HB LEU 9 -11.633 4.487 -8.705 67 HB3 LEU 9 3HB LEU 9 -11.977 2.848 -9.236 68 HG LEU 9 HG LEU 9 -9.709 2.123 -8.544 69 HD11 LEU 9 1HD1 LEU 9 -9.301 4.967 -7.567 70 HD12 LEU 9 2HD1 LEU 9 -8.462 4.193 -8.913 71 HD13 LEU 9 3HD1 LEU 9 -8.218 3.604 -7.272 72 HD21 LEU 9 3HD2 LEU 9 -11.200 3.572 -6.337 73 HD22 LEU 9 1HD2 LEU 9 -10.015 2.280 -6.115 74 HD23 LEU 9 2HD2 LEU 9 -11.539 1.944 -6.933 75 H THR 10 H THR 10 -8.368 3.447 -11.520 76 HA THR 10 HA THR 10 -8.826 0.682 -12.373 77 HB THR 10 HB THR 10 -7.629 2.620 -14.413 78 HG1 THR 10 HG1 THR 10 -10.346 2.399 -13.746 79 HG21 THR 10 3HG2 THR 10 -7.440 0.179 -14.853 80 HG22 THR 10 1HG2 THR 10 -8.447 0.987 -16.057 81 HG23 THR 10 2HG2 THR 10 -9.200 0.033 -14.780 82 H THR 11 H THR 11 -6.281 0.452 -13.769 83 HA THR 11 HA THR 11 -4.518 0.064 -11.620 84 HB THR 11 HB THR 11 -2.804 -0.326 -13.538 85 HG1 THR 11 HG1 THR 11 -3.463 0.533 -15.364 86 HG21 THR 11 3HG2 THR 11 -3.875 -2.425 -14.271 87 HG22 THR 11 1HG2 THR 11 -5.424 -1.879 -13.619 88 HG23 THR 11 2HG2 THR 11 -4.072 -2.205 -12.532 89 H TYR 12 H TYR 12 -5.025 2.973 -13.458 90 HA TYR 12 HA TYR 12 -2.495 4.115 -13.615 91 HB2 TYR 12 2HB TYR 12 -3.586 6.238 -13.968 92 HB3 TYR 12 3HB TYR 12 -4.587 4.998 -14.702 93 HD1 TYR 12 HD1 TYR 12 -6.662 4.188 -13.343 94 HD2 TYR 12 HD2 TYR 12 -4.557 7.786 -12.422 95 HE1 TYR 12 HE1 TYR 12 -8.615 5.026 -12.128 96 HE2 TYR 12 HE2 TYR 12 -6.519 8.613 -11.199 97 HH TYR 12 HH TYR 12 -9.185 8.062 -11.406 98 H ALA 13 H ALA 13 -4.687 4.037 -10.865 99 HA ALA 13 HA ALA 13 -3.273 5.981 -9.268 100 HB1 ALA 13 3HB ALA 13 -5.456 4.013 -8.488 101 HB2 ALA 13 1HB ALA 13 -5.708 5.662 -9.062 102 HB3 ALA 13 2HB ALA 13 -4.903 5.381 -7.517 103 H SER 14 H SER 14 -3.313 2.455 -9.552 104 HA SER 14 HA SER 14 -1.853 1.985 -7.085 105 HB2 SER 14 2HB SER 14 -2.044 -0.432 -7.739 106 HB3 SER 14 3HB SER 14 -3.596 0.400 -7.706 107 HG SER 14 HG SER 14 -2.724 -1.002 -9.644 108 H LYS 15 H LYS 15 -1.175 1.966 -10.529 109 HA LYS 15 HA LYS 15 1.327 0.659 -10.523 110 HB2 LYS 15 2HB LYS 15 -0.003 2.567 -12.494 111 HB3 LYS 15 3HB LYS 15 1.585 1.878 -12.811 112 HG2 LYS 15 2HG LYS 15 -0.934 0.239 -12.363 113 HG3 LYS 15 3HG LYS 15 -0.278 0.673 -13.947 114 HD2 LYS 15 2HD LYS 15 1.816 -0.534 -13.415 115 HD3 LYS 15 3HD LYS 15 1.171 -0.955 -11.829 116 HE2 LYS 15 2HE LYS 15 -0.590 -2.306 -12.886 117 HE3 LYS 15 3HE LYS 15 0.013 -1.858 -14.487 118 HZ1 LYS 15 3HZ LYS 15 2.099 -2.945 -14.001 119 HZ2 LYS 15 1HZ LYS 15 0.827 -4.034 -13.761 120 HZ3 LYS 15 2HZ LYS 15 1.591 -3.318 -12.432 121 H GLN 16 H GLN 16 0.520 4.130 -10.728 122 HA GLN 16 HA GLN 16 3.227 4.988 -10.796 123 HB2 GLN 16 2HB GLN 16 0.802 6.679 -10.068 124 HB3 GLN 16 3HB GLN 16 2.351 7.247 -10.687 125 HG2 GLN 16 2HG GLN 16 0.216 5.705 -12.174 126 HG3 GLN 16 3HG GLN 16 0.757 7.350 -12.472 127 HE21 GLN 16 1HE2 GLN 16 3.637 6.627 -12.323 128 HE22 GLN 16 2HE2 GLN 16 3.967 5.750 -13.772 129 H ALA 17 H ALA 17 0.900 4.475 -8.229 130 HA ALA 17 HA ALA 17 2.156 5.730 -6.070 131 HB1 ALA 17 3HB ALA 17 0.850 4.211 -4.649 132 HB2 ALA 17 1HB ALA 17 0.495 3.191 -6.049 133 HB3 ALA 17 2HB ALA 17 -0.131 4.839 -5.974 134 H THR 18 H THR 18 2.602 2.427 -7.380 135 HA THR 18 HA THR 18 4.477 1.615 -5.353 136 HB THR 18 HB THR 18 4.796 -0.424 -6.766 137 HG1 THR 18 HG1 THR 18 2.886 0.755 -8.522 138 HG21 THR 18 3HG2 THR 18 2.910 -0.342 -5.162 139 HG22 THR 18 1HG2 THR 18 2.488 -1.272 -6.601 140 HG23 THR 18 2HG2 THR 18 1.883 0.373 -6.407 141 H ASP 19 H ASP 19 4.751 3.016 -8.585 142 HA ASP 19 HA ASP 19 7.528 2.689 -9.011 143 HB2 ASP 19 2HB ASP 19 5.714 4.990 -9.870 144 HB3 ASP 19 3HB ASP 19 7.363 4.776 -10.451 145 H MET 20 H MET 20 5.711 5.154 -7.247 146 HA MET 20 HA MET 20 8.064 6.715 -6.548 147 HB2 MET 20 2HB MET 20 5.120 6.995 -5.820 148 HB3 MET 20 3HB MET 20 6.368 8.121 -5.289 149 HG2 MET 20 2HG MET 20 6.880 8.686 -7.621 150 HG3 MET 20 3HG MET 20 5.661 7.537 -8.177 151 HE1 MET 20 3HE MET 20 3.067 7.978 -6.375 152 HE2 MET 20 1HE MET 20 3.111 7.928 -8.143 153 HE3 MET 20 2HE MET 20 2.308 9.259 -7.324 154 H GLY 21 H GLY 21 6.071 4.259 -5.020 155 HA2 GLY 21 2HA GLY 21 7.555 3.055 -3.295 156 HA3 GLY 21 3HA GLY 21 7.465 4.582 -2.427 157 H ALA 22 H ALA 22 5.684 1.770 -3.521 158 HA ALA 22 HA ALA 22 3.948 1.862 -1.217 159 HB1 ALA 22 3HB ALA 22 2.681 1.915 -3.983 160 HB2 ALA 22 1HB ALA 22 2.664 3.248 -2.824 161 HB3 ALA 22 2HB ALA 22 1.828 1.743 -2.446 162 H ILE 23 H ILE 23 3.059 -0.178 -0.717 163 HA ILE 23 HA ILE 23 3.981 -2.487 -2.356 164 HB ILE 23 HB ILE 23 4.263 -3.792 -0.236 165 HG12 ILE 23 2HG1 ILE 23 3.769 -1.122 1.181 166 HG13 ILE 23 3HG1 ILE 23 2.688 -2.506 1.207 167 HG21 ILE 23 1HG2 ILE 23 6.248 -2.743 -1.234 168 HG22 ILE 23 2HG2 ILE 23 6.380 -2.767 0.525 169 HG23 ILE 23 3HG2 ILE 23 5.956 -1.268 -0.306 170 HD11 ILE 23 3HD1 ILE 23 3.892 -2.327 3.278 171 HD12 ILE 23 1HD1 ILE 23 5.441 -2.374 2.436 172 HD13 ILE 23 2HD1 ILE 23 4.387 -3.792 2.433 173 H TYR 24 H TYR 24 2.624 -4.355 -2.349 174 HA TYR 24 HA TYR 24 -0.210 -3.885 -1.622 175 HB2 TYR 24 2HB TYR 24 1.038 -6.044 -3.391 176 HB3 TYR 24 3HB TYR 24 -0.681 -5.835 -3.095 177 HD1 TYR 24 HD1 TYR 24 -1.813 -3.703 -3.923 178 HD2 TYR 24 HD2 TYR 24 2.106 -4.841 -5.178 179 HE1 TYR 24 HE1 TYR 24 -2.041 -2.278 -5.910 180 HE2 TYR 24 HE2 TYR 24 1.896 -3.407 -7.165 181 HH TYR 24 HH TYR 24 0.220 -2.387 -8.531 182 H VAL 25 H VAL 25 -0.838 -4.765 0.288 183 HA VAL 25 HA VAL 25 0.487 -7.229 1.281 184 HB VAL 25 HB VAL 25 0.041 -6.505 3.581 185 HG11 VAL 25 1HG1 VAL 25 1.675 -4.653 3.757 186 HG12 VAL 25 2HG1 VAL 25 1.548 -4.373 2.017 187 HG13 VAL 25 3HG1 VAL 25 2.208 -5.894 2.620 188 HG21 VAL 25 3HG2 VAL 25 -1.061 -3.925 2.409 189 HG22 VAL 25 1HG2 VAL 25 -0.752 -4.223 4.126 190 HG23 VAL 25 2HG2 VAL 25 -1.980 -5.159 3.272 191 H ASN 26 H ASN 26 -0.860 -8.620 2.668 192 HA ASN 26 HA ASN 26 -3.591 -8.925 1.608 193 HB2 ASN 26 2HB ASN 26 -3.570 -11.149 2.708 194 HB3 ASN 26 3HB ASN 26 -2.210 -10.946 1.630 195 HD21 ASN 26 1HD2 ASN 26 -2.412 -12.895 3.657 196 HD22 ASN 26 2HD2 ASN 26 -1.135 -12.599 4.783 197 H SER 27 H SER 27 -5.102 -9.983 3.474 198 HA SER 27 HA SER 27 -5.845 -7.867 5.193 199 HB2 SER 27 2HB SER 27 -7.439 -9.549 4.245 200 HB3 SER 27 3HB SER 27 -6.776 -10.759 5.345 201 HG SER 27 HG SER 27 -7.536 -8.421 6.583 202 H LYS 28 H LYS 28 -3.512 -10.339 5.638 203 HA LYS 28 HA LYS 28 -3.352 -10.048 8.518 204 HB2 LYS 28 2HB LYS 28 -1.304 -11.229 6.584 205 HB3 LYS 28 3HB LYS 28 -1.299 -11.393 8.338 206 HG2 LYS 28 2HG LYS 28 -3.372 -12.540 6.442 207 HG3 LYS 28 3HG LYS 28 -2.110 -13.445 7.282 208 HD2 LYS 28 2HD LYS 28 -3.137 -12.870 9.462 209 HD3 LYS 28 3HD LYS 28 -4.389 -11.935 8.634 210 HE2 LYS 28 2HE LYS 28 -5.145 -14.020 7.493 211 HE3 LYS 28 3HE LYS 28 -3.937 -14.933 8.405 212 HZ1 LYS 28 3HZ LYS 28 -6.127 -15.040 9.431 213 HZ2 LYS 28 1HZ LYS 28 -6.161 -13.359 9.592 214 HZ3 LYS 28 2HZ LYS 28 -5.024 -14.265 10.454 215 H GLY 29 H GLY 29 -1.154 -9.137 5.801 216 HA2 GLY 29 2HA GLY 29 -0.839 -6.592 5.744 217 HA3 GLY 29 3HA GLY 29 -0.221 -6.792 7.377 218 H ASP 30 H ASP 30 0.471 -9.176 4.936 219 HA ASP 30 HA ASP 30 3.293 -8.289 4.794 220 HB2 ASP 30 2HB ASP 30 2.497 -10.613 5.856 221 HB3 ASP 30 3HB ASP 30 2.386 -11.126 4.188 222 H ARG 31 H ARG 31 4.351 -8.577 2.691 223 HA ARG 31 HA ARG 31 2.724 -7.658 0.550 224 HB2 ARG 31 2HB ARG 31 5.606 -8.651 0.386 225 HB3 ARG 31 3HB ARG 31 4.750 -7.807 -0.896 226 HG2 ARG 31 2HG ARG 31 5.938 -6.040 -0.007 227 HG3 ARG 31 3HG ARG 31 4.466 -5.917 0.957 228 HD2 ARG 31 2HD ARG 31 6.308 -5.686 2.463 229 HD3 ARG 31 3HD ARG 31 5.636 -7.296 2.738 230 HE ARG 31 HE ARG 31 8.030 -6.844 1.037 231 HH11 ARG 31 1HH1 ARG 31 6.529 -8.615 3.712 232 HH12 ARG 31 2HH1 ARG 31 7.890 -9.671 3.911 233 HH21 ARG 31 1HH2 ARG 31 9.782 -8.219 1.341 234 HH22 ARG 31 2HH2 ARG 31 9.727 -9.453 2.576 235 H ILE 32 H ILE 32 1.322 -8.922 -0.532 236 HA ILE 32 HA ILE 32 1.684 -11.758 -1.023 237 HB ILE 32 HB ILE 32 -0.369 -11.557 -2.461 238 HG12 ILE 32 2HG1 ILE 32 -0.303 -8.593 -1.670 239 HG13 ILE 32 3HG1 ILE 32 -0.024 -9.217 -3.291 240 HG21 ILE 32 1HG2 ILE 32 -1.915 -11.033 -0.599 241 HG22 ILE 32 2HG2 ILE 32 -0.577 -10.315 0.305 242 HG23 ILE 32 3HG2 ILE 32 -0.563 -12.039 -0.072 243 HD11 ILE 32 3HD1 ILE 32 -2.247 -8.307 -3.093 244 HD12 ILE 32 1HD1 ILE 32 -2.610 -9.385 -1.745 245 HD13 ILE 32 2HD1 ILE 32 -2.333 -10.048 -3.358 246 H VAL 33 H VAL 33 2.296 -8.796 -2.728 247 HA VAL 33 HA VAL 33 4.156 -10.206 -4.465 248 HB VAL 33 HB VAL 33 2.110 -9.927 -5.861 249 HG11 VAL 33 1HG1 VAL 33 1.304 -7.722 -6.570 250 HG12 VAL 33 2HG1 VAL 33 2.449 -6.938 -5.479 251 HG13 VAL 33 3HG1 VAL 33 1.146 -7.933 -4.824 252 HG21 VAL 33 3HG2 VAL 33 4.286 -9.953 -6.968 253 HG22 VAL 33 1HG2 VAL 33 4.449 -8.206 -6.765 254 HG23 VAL 33 2HG2 VAL 33 3.195 -8.862 -7.822 255 H ASN 34 H ASN 34 6.013 -9.019 -4.761 256 HA ASN 34 HA ASN 34 6.635 -7.192 -2.662 257 HB2 ASN 34 2HB ASN 34 8.930 -7.221 -3.632 258 HB3 ASN 34 3HB ASN 34 8.269 -8.830 -3.388 259 HD21 ASN 34 1HD2 ASN 34 7.744 -10.097 -5.222 260 HD22 ASN 34 2HD2 ASN 34 8.349 -9.722 -6.796 261 H GLU 35 H GLU 35 5.745 -6.738 -5.964 262 HA GLU 35 HA GLU 35 5.993 -3.854 -5.923 263 HB2 GLU 35 2HB GLU 35 8.342 -4.792 -6.316 264 HB3 GLU 35 3HB GLU 35 7.750 -5.497 -7.812 265 HG2 GLU 35 2HG GLU 35 7.311 -3.250 -8.709 266 HG3 GLU 35 3HG GLU 35 7.848 -2.527 -7.188 267 H SER 36 H SER 36 5.362 -3.008 -8.173 268 HA SER 36 HA SER 36 3.141 -4.479 -9.267 269 HB2 SER 36 2HB SER 36 3.038 -2.025 -9.047 270 HB3 SER 36 3HB SER 36 4.425 -1.847 -10.123 271 HG SER 36 HG SER 36 3.053 -1.853 -11.670 272 H ASN 37 H ASN 37 4.373 -6.365 -9.872 273 HA ASN 37 HA ASN 37 6.284 -6.319 -12.038 274 HB2 ASN 37 2HB ASN 37 6.367 -8.095 -10.304 275 HB3 ASN 37 3HB ASN 37 4.755 -8.638 -10.754 276 HD21 ASN 37 1HD2 ASN 37 7.487 -7.750 -12.880 277 HD22 ASN 37 2HD2 ASN 37 7.638 -9.309 -13.605 278 H VAL 38 H VAL 38 3.085 -7.847 -11.707 279 HA VAL 38 HA VAL 38 2.043 -6.777 -14.157 280 HB VAL 38 HB VAL 38 3.420 -8.610 -15.088 281 HG11 VAL 38 1HG1 VAL 38 2.987 -10.985 -14.619 282 HG12 VAL 38 2HG1 VAL 38 1.818 -10.537 -13.373 283 HG13 VAL 38 3HG1 VAL 38 3.524 -10.123 -13.175 284 HG21 VAL 38 3HG2 VAL 38 1.335 -8.037 -16.245 285 HG22 VAL 38 1HG2 VAL 38 0.449 -9.228 -15.287 286 HG23 VAL 38 2HG2 VAL 38 1.692 -9.755 -16.427 287 H TYR 39 H TYR 39 -0.250 -7.093 -14.285 288 HA TYR 39 HA TYR 39 -1.543 -7.249 -11.742 289 HB2 TYR 39 2HB TYR 39 -3.602 -6.714 -12.945 290 HB3 TYR 39 3HB TYR 39 -2.293 -5.725 -13.574 291 HD1 TYR 39 HD1 TYR 39 -4.558 -8.570 -14.339 292 HD2 TYR 39 HD2 TYR 39 -1.551 -5.966 -15.920 293 HE1 TYR 39 HE1 TYR 39 -5.080 -9.323 -16.607 294 HE2 TYR 39 HE2 TYR 39 -2.084 -6.738 -18.191 295 HH TYR 39 HH TYR 39 -4.858 -8.630 -18.883 296 H THR 40 H THR 40 -0.792 -9.650 -14.095 297 HA THR 40 HA THR 40 -2.994 -11.417 -13.727 298 HB THR 40 HB THR 40 -1.551 -13.115 -14.864 299 HG1 THR 40 HG1 THR 40 0.559 -12.672 -15.320 300 HG21 THR 40 3HG2 THR 40 -2.777 -11.487 -16.281 301 HG22 THR 40 1HG2 THR 40 -1.225 -11.922 -17.008 302 HG23 THR 40 2HG2 THR 40 -1.411 -10.373 -16.182 303 H THR 41 H THR 41 0.394 -11.603 -12.576 304 HA THR 41 HA THR 41 0.128 -13.690 -10.738 305 HB THR 41 HB THR 41 2.048 -11.314 -10.658 306 HG1 THR 41 HG1 THR 41 3.386 -12.713 -11.887 307 HG21 THR 41 3HG2 THR 41 3.614 -12.845 -9.510 308 HG22 THR 41 1HG2 THR 41 2.372 -14.098 -9.470 309 HG23 THR 41 2HG2 THR 41 2.152 -12.607 -8.553 310 H PHE 42 H PHE 42 -0.367 -10.209 -10.374 311 HA PHE 42 HA PHE 42 -0.767 -10.083 -7.577 312 HB2 PHE 42 2HB PHE 42 -0.252 -8.076 -8.874 313 HB3 PHE 42 3HB PHE 42 -1.713 -8.268 -9.835 314 HD1 PHE 42 HD1 PHE 42 -0.987 -8.228 -6.132 315 HD2 PHE 42 HD2 PHE 42 -3.253 -6.561 -9.361 316 HE1 PHE 42 HE1 PHE 42 -2.183 -6.778 -4.554 317 HE2 PHE 42 HE2 PHE 42 -4.444 -5.112 -7.768 318 HZ PHE 42 HZ PHE 42 -3.910 -5.221 -5.365 319 H ARG 43 H ARG 43 -3.002 -10.620 -10.299 320 HA ARG 43 HA ARG 43 -5.454 -10.436 -8.875 321 HB2 ARG 43 2HB ARG 43 -5.220 -10.281 -11.390 322 HB3 ARG 43 3HB ARG 43 -4.907 -12.012 -11.438 323 HG2 ARG 43 2HG ARG 43 -7.191 -12.380 -10.428 324 HG3 ARG 43 3HG ARG 43 -7.480 -10.643 -10.571 325 HD2 ARG 43 2HD ARG 43 -7.034 -12.631 -12.819 326 HD3 ARG 43 3HD ARG 43 -8.501 -11.716 -12.471 327 HE ARG 43 HE ARG 43 -5.968 -10.518 -13.429 328 HH11 ARG 43 1HH1 ARG 43 -9.487 -10.584 -13.496 329 HH12 ARG 43 2HH1 ARG 43 -9.596 -9.269 -14.625 330 HH21 ARG 43 1HH2 ARG 43 -6.140 -8.831 -14.879 331 HH22 ARG 43 2HH2 ARG 43 -7.692 -8.275 -15.407 332 H ASN 44 H ASN 44 -3.468 -13.210 -9.920 333 HA ASN 44 HA ASN 44 -4.994 -15.248 -8.683 334 HB2 ASN 44 2HB ASN 44 -2.070 -15.190 -9.539 335 HB3 ASN 44 3HB ASN 44 -2.842 -16.628 -8.885 336 HD21 ASN 44 1HD2 ASN 44 -2.311 -14.771 -11.680 337 HD22 ASN 44 2HD2 ASN 44 -3.321 -15.666 -12.750 338 H ALA 45 H ALA 45 -2.504 -13.096 -7.431 339 HA ALA 45 HA ALA 45 -1.941 -14.489 -5.015 340 HB1 ALA 45 3HB ALA 45 -0.962 -12.376 -4.242 341 HB2 ALA 45 1HB ALA 45 -1.713 -11.517 -5.596 342 HB3 ALA 45 2HB ALA 45 -0.471 -12.733 -5.897 343 H ILE 46 H ILE 46 -4.486 -12.248 -5.945 344 HA ILE 46 HA ILE 46 -5.610 -11.948 -3.267 345 HB ILE 46 HB ILE 46 -6.801 -11.108 -5.960 346 HG12 ILE 46 2HG1 ILE 46 -5.146 -9.405 -4.036 347 HG13 ILE 46 3HG1 ILE 46 -4.581 -10.028 -5.581 348 HG21 ILE 46 1HG2 ILE 46 -8.176 -9.523 -4.655 349 HG22 ILE 46 2HG2 ILE 46 -7.474 -10.137 -3.157 350 HG23 ILE 46 3HG2 ILE 46 -8.480 -11.188 -4.154 351 HD11 ILE 46 3HD1 ILE 46 -6.804 -8.025 -5.176 352 HD12 ILE 46 1HD1 ILE 46 -6.295 -8.687 -6.734 353 HD13 ILE 46 2HD1 ILE 46 -5.181 -7.709 -5.783 354 H LEU 47 H LEU 47 -6.048 -13.999 -6.078 355 HA LEU 47 HA LEU 47 -8.587 -15.151 -5.211 356 HB2 LEU 47 2HB LEU 47 -6.703 -15.872 -7.491 357 HB3 LEU 47 3HB LEU 47 -8.253 -16.653 -7.213 358 HG LEU 47 HG LEU 47 -7.851 -13.715 -7.919 359 HD11 LEU 47 1HD1 LEU 47 -8.901 -14.270 -10.060 360 HD12 LEU 47 2HD1 LEU 47 -8.984 -15.973 -9.599 361 HD13 LEU 47 3HD1 LEU 47 -7.417 -15.190 -9.820 362 HD21 LEU 47 3HD2 LEU 47 -10.439 -15.243 -7.501 363 HD22 LEU 47 1HD2 LEU 47 -10.304 -13.591 -8.109 364 HD23 LEU 47 2HD2 LEU 47 -9.796 -13.967 -6.465 365 H LYS 48 H LYS 48 -5.257 -15.750 -4.630 366 HA LYS 48 HA LYS 48 -5.661 -18.559 -3.757 367 HB2 LYS 48 2HB LYS 48 -3.772 -17.959 -5.315 368 HB3 LYS 48 3HB LYS 48 -3.094 -16.929 -4.060 369 HG2 LYS 48 2HG LYS 48 -2.800 -18.937 -2.607 370 HG3 LYS 48 3HG LYS 48 -3.420 -19.952 -3.912 371 HD2 LYS 48 2HD LYS 48 -0.894 -18.250 -4.007 372 HD3 LYS 48 3HD LYS 48 -0.956 -20.003 -3.848 373 HE2 LYS 48 2HE LYS 48 -1.932 -18.435 -6.267 374 HE3 LYS 48 3HE LYS 48 -0.393 -19.284 -6.154 375 HZ1 LYS 48 3HZ LYS 48 -3.054 -20.584 -5.940 376 HZ2 LYS 48 1HZ LYS 48 -1.553 -21.361 -5.934 377 HZ3 LYS 48 2HZ LYS 48 -2.089 -20.564 -7.327 378 H GLN 49 H GLN 49 -4.744 -15.357 -2.639 379 HA GLN 49 HA GLN 49 -5.005 -16.109 0.196 380 HB2 GLN 49 2HB GLN 49 -2.548 -16.300 -0.578 381 HB3 GLN 49 3HB GLN 49 -2.584 -14.571 -0.900 382 HG2 GLN 49 2HG GLN 49 -2.944 -14.103 1.471 383 HG3 GLN 49 3HG GLN 49 -3.053 -15.822 1.826 384 HE21 GLN 49 1HE2 GLN 49 -0.887 -13.202 0.988 385 HE22 GLN 49 2HE2 GLN 49 0.575 -14.012 1.415 386 H ALA 50 H ALA 50 -4.663 -13.737 1.425 387 HA ALA 50 HA ALA 50 -4.877 -11.501 1.603 388 HB1 ALA 50 3HB ALA 50 -5.279 -9.980 -0.265 389 HB2 ALA 50 1HB ALA 50 -5.668 -11.345 -1.322 390 HB3 ALA 50 2HB ALA 50 -4.034 -11.158 -0.684 391 H ASP 51 H ASP 51 -7.319 -13.668 0.894 392 HA ASP 51 HA ASP 51 -9.484 -13.862 1.534 393 HB2 ASP 51 2HB ASP 51 -8.886 -11.389 3.245 394 HB3 ASP 51 3HB ASP 51 -10.316 -12.402 3.406 395 H LYS 52 H LYS 52 -8.885 -12.567 -0.855 396 HA LYS 52 HA LYS 52 -9.766 -11.493 -2.613 397 HB2 LYS 52 2HB LYS 52 -12.295 -11.392 -0.929 398 HB3 LYS 52 3HB LYS 52 -12.230 -10.895 -2.613 399 HG2 LYS 52 2HG LYS 52 -11.649 -13.687 -1.579 400 HG3 LYS 52 3HG LYS 52 -13.146 -13.163 -2.357 401 HD2 LYS 52 2HD LYS 52 -11.799 -12.602 -4.420 402 HD3 LYS 52 3HD LYS 52 -10.381 -13.302 -3.628 403 HE2 LYS 52 2HE LYS 52 -11.422 -14.903 -5.176 404 HE3 LYS 52 3HE LYS 52 -11.523 -15.490 -3.515 405 HZ1 LYS 52 3HZ LYS 52 -13.710 -14.160 -5.032 406 HZ2 LYS 52 1HZ LYS 52 -13.811 -14.685 -3.429 407 HZ3 LYS 52 2HZ LYS 52 -13.608 -15.810 -4.671 408 H VAL 53 H VAL 53 -8.643 -9.927 -0.141 409 HA VAL 53 HA VAL 53 -9.188 -7.288 -1.322 410 HB VAL 53 HB VAL 53 -10.649 -7.392 0.633 411 HG11 VAL 53 1HG1 VAL 53 -8.204 -7.939 2.345 412 HG12 VAL 53 2HG1 VAL 53 -9.502 -9.079 1.988 413 HG13 VAL 53 3HG1 VAL 53 -9.840 -7.631 2.940 414 HG21 VAL 53 3HG2 VAL 53 -8.281 -5.546 1.138 415 HG22 VAL 53 1HG2 VAL 53 -9.908 -5.346 1.802 416 HG23 VAL 53 2HG2 VAL 53 -9.641 -5.222 0.062 417 H ALA 54 H ALA 54 -7.337 -6.489 -1.977 418 HA ALA 54 HA ALA 54 -4.803 -6.951 -0.521 419 HB1 ALA 54 3HB ALA 54 -4.769 -7.535 -2.914 420 HB2 ALA 54 1HB ALA 54 -3.715 -6.154 -2.602 421 HB3 ALA 54 2HB ALA 54 -5.302 -5.909 -3.342 422 H TYR 55 H TYR 55 -3.652 -5.178 0.217 423 HA TYR 55 HA TYR 55 -5.053 -2.565 0.286 424 HB2 TYR 55 2HB TYR 55 -3.317 -3.843 2.441 425 HB3 TYR 55 3HB TYR 55 -4.074 -2.264 2.539 426 HD1 TYR 55 HD1 TYR 55 -6.537 -2.067 2.902 427 HD2 TYR 55 HD2 TYR 55 -4.608 -5.885 2.807 428 HE1 TYR 55 HE1 TYR 55 -8.482 -3.086 4.017 429 HE2 TYR 55 HE2 TYR 55 -6.552 -6.887 3.904 430 HH TYR 55 HH TYR 55 -8.385 -6.066 5.477 431 H LEU 56 H LEU 56 -3.945 -1.181 -0.959 432 HA LEU 56 HA LEU 56 -1.057 -1.410 -1.343 433 HB2 LEU 56 2HB LEU 56 -2.575 -0.860 -3.234 434 HB3 LEU 56 3HB LEU 56 -3.058 0.620 -2.421 435 HG LEU 56 HG LEU 56 -0.702 1.457 -2.603 436 HD11 LEU 56 1HD1 LEU 56 -0.202 -1.047 -4.221 437 HD12 LEU 56 2HD1 LEU 56 0.511 -0.642 -2.660 438 HD13 LEU 56 3HD1 LEU 56 0.898 0.325 -4.079 439 HD21 LEU 56 3HD2 LEU 56 -0.761 1.936 -5.013 440 HD22 LEU 56 1HD2 LEU 56 -2.355 2.108 -4.277 441 HD23 LEU 56 2HD2 LEU 56 -1.976 0.676 -5.239 442 H VAL 57 H VAL 57 0.124 -0.723 0.324 443 HA VAL 57 HA VAL 57 -0.697 1.580 1.975 444 HB VAL 57 HB VAL 57 1.495 -0.485 2.540 445 HG11 VAL 57 1HG1 VAL 57 1.378 0.329 4.872 446 HG12 VAL 57 2HG1 VAL 57 0.187 1.542 4.398 447 HG13 VAL 57 3HG1 VAL 57 1.832 1.625 3.762 448 HG21 VAL 57 3HG2 VAL 57 -0.098 -1.567 4.094 449 HG22 VAL 57 1HG2 VAL 57 -0.689 -1.606 2.430 450 HG23 VAL 57 2HG2 VAL 57 -1.366 -0.450 3.578 451 H MET 58 H MET 58 0.303 3.497 1.653 452 HA MET 58 HA MET 58 3.142 3.626 0.849 453 HB2 MET 58 2HB MET 58 2.753 5.369 -0.780 454 HB3 MET 58 3HB MET 58 1.693 4.031 -1.189 455 HG2 MET 58 2HG MET 58 0.781 6.498 0.315 456 HG3 MET 58 3HG MET 58 0.665 6.309 -1.431 457 HE1 MET 58 3HE MET 58 -1.890 3.388 -1.771 458 HE2 MET 58 1HE MET 58 -0.131 3.308 -1.798 459 HE3 MET 58 2HE MET 58 -0.970 4.618 -2.635 460 H ASP 59 H ASP 59 3.911 6.019 1.118 461 HA ASP 59 HA ASP 59 2.827 7.214 3.584 462 HB2 ASP 59 2HB ASP 59 5.295 6.975 3.379 463 HB3 ASP 59 3HB ASP 59 5.292 7.978 1.933 464 H GLU 60 H GLU 60 2.505 9.624 3.568 465 HA GLU 60 HA GLU 60 0.451 10.312 1.787 466 HB2 GLU 60 2HB GLU 60 0.656 11.150 4.124 467 HB3 GLU 60 3HB GLU 60 2.004 12.173 3.638 468 HG2 GLU 60 2HG GLU 60 0.562 13.482 2.187 469 HG3 GLU 60 3HG GLU 60 -0.778 12.371 2.440 470 H ARG 61 H ARG 61 3.881 11.058 1.712 471 HA ARG 61 HA ARG 61 4.054 13.066 -0.197 472 HB2 ARG 61 2HB ARG 61 6.310 12.231 -0.686 473 HB3 ARG 61 3HB ARG 61 5.999 12.138 1.044 474 HG2 ARG 61 2HG ARG 61 5.670 9.735 0.930 475 HG3 ARG 61 3HG ARG 61 5.750 9.757 -0.832 476 HD2 ARG 61 2HD ARG 61 8.113 10.533 -0.674 477 HD3 ARG 61 3HD ARG 61 8.011 10.390 1.081 478 HE ARG 61 HE ARG 61 8.228 8.125 0.902 479 HH11 ARG 61 1HH1 ARG 61 7.470 9.365 -2.305 480 HH12 ARG 61 2HH1 ARG 61 7.781 7.854 -3.096 481 HH21 ARG 61 1HH2 ARG 61 8.683 6.148 -0.159 482 HH22 ARG 61 2HH2 ARG 61 8.467 6.033 -1.880 483 H THR 62 H THR 62 3.627 9.594 -0.685 484 HA THR 62 HA THR 62 3.747 9.639 -3.550 485 HB THR 62 HB THR 62 2.745 7.485 -1.622 486 HG1 THR 62 HG1 THR 62 4.923 6.618 -2.143 487 HG21 THR 62 3HG2 THR 62 3.233 5.893 -3.444 488 HG22 THR 62 1HG2 THR 62 3.623 7.238 -4.518 489 HG23 THR 62 2HG2 THR 62 1.976 7.039 -3.914 490 H TRP 63 H TRP 63 1.211 9.619 -1.055 491 HA TRP 63 HA TRP 63 -1.035 9.198 -2.675 492 HB2 TRP 63 2HB TRP 63 -1.307 8.963 -0.299 493 HB3 TRP 63 3HB TRP 63 -0.771 10.613 0.005 494 HD1 TRP 63 HD1 TRP 63 -2.634 12.455 0.096 495 HE1 TRP 63 HE1 TRP 63 -5.157 12.518 -0.364 496 HE3 TRP 63 HE3 TRP 63 -3.235 7.772 -1.919 497 HZ2 TRP 63 HZ2 TRP 63 -7.133 10.840 -1.435 498 HZ3 TRP 63 HZ3 TRP 63 -5.489 7.089 -2.639 499 HH2 TRP 63 HH2 TRP 63 -7.398 8.594 -2.401 500 H LYS 64 H LYS 64 0.757 12.196 -1.994 501 HA LYS 64 HA LYS 64 -1.067 14.132 -2.765 502 HB2 LYS 64 2HB LYS 64 1.890 14.147 -3.491 503 HB3 LYS 64 3HB LYS 64 0.839 15.559 -3.417 504 HG2 LYS 64 2HG LYS 64 1.760 13.844 -1.109 505 HG3 LYS 64 3HG LYS 64 2.241 15.504 -1.474 506 HD2 LYS 64 2HD LYS 64 -0.189 16.180 -1.130 507 HD3 LYS 64 3HD LYS 64 -0.493 14.536 -0.555 508 HE2 LYS 64 2HE LYS 64 1.281 14.904 1.190 509 HE3 LYS 64 3HE LYS 64 1.376 16.582 0.657 510 HZ1 LYS 64 3HZ LYS 64 -1.082 15.281 1.679 511 HZ2 LYS 64 1HZ LYS 64 -0.900 16.912 1.297 512 HZ3 LYS 64 2HZ LYS 64 -0.065 16.251 2.614 513 H LYS 65 H LYS 65 0.995 12.110 -4.786 514 HA LYS 65 HA LYS 65 0.091 13.240 -7.285 515 HB2 LYS 65 2HB LYS 65 1.926 10.908 -6.628 516 HB3 LYS 65 3HB LYS 65 1.525 11.371 -8.276 517 HG2 LYS 65 2HG LYS 65 2.990 13.069 -6.236 518 HG3 LYS 65 3HG LYS 65 3.695 12.281 -7.647 519 HD2 LYS 65 2HD LYS 65 1.688 14.565 -7.651 520 HD3 LYS 65 3HD LYS 65 3.386 14.649 -8.116 521 HE2 LYS 65 2HE LYS 65 2.933 13.119 -10.023 522 HE3 LYS 65 3HE LYS 65 1.232 13.065 -9.559 523 HZ1 LYS 65 3HZ LYS 65 1.633 14.653 -11.354 524 HZ2 LYS 65 1HZ LYS 65 2.675 15.541 -10.361 525 HZ3 LYS 65 2HZ LYS 65 1.034 15.421 -9.973 526 H VAL 66 H VAL 66 -0.682 10.330 -5.374 527 HA VAL 66 HA VAL 66 -2.152 8.955 -7.386 528 HB VAL 66 HB VAL 66 -2.513 8.808 -4.345 529 HG11 VAL 66 1HG1 VAL 66 -3.425 6.852 -6.499 530 HG12 VAL 66 2HG1 VAL 66 -4.471 7.883 -5.518 531 HG13 VAL 66 3HG1 VAL 66 -3.543 6.593 -4.755 532 HG21 VAL 66 3HG2 VAL 66 -1.052 6.812 -4.450 533 HG22 VAL 66 1HG2 VAL 66 -0.209 8.251 -5.024 534 HG23 VAL 66 2HG2 VAL 66 -0.815 7.064 -6.180 535 H TYR 67 H TYR 67 -3.335 10.894 -4.628 536 HA TYR 67 HA TYR 67 -5.954 11.401 -5.180 537 HB2 TYR 67 2HB TYR 67 -4.712 12.160 -3.168 538 HB3 TYR 67 3HB TYR 67 -3.857 13.355 -4.127 539 HD1 TYR 67 HD1 TYR 67 -7.298 12.382 -3.032 540 HD2 TYR 67 HD2 TYR 67 -4.754 15.585 -4.268 541 HE1 TYR 67 HE1 TYR 67 -9.065 13.994 -2.478 542 HE2 TYR 67 HE2 TYR 67 -6.531 17.201 -3.715 543 HH TYR 67 HH TYR 67 -9.279 16.415 -1.905 544 H ASP 68 H ASP 68 -3.156 13.146 -6.463 545 HA ASP 68 HA ASP 68 -4.427 15.126 -7.985 546 HB2 ASP 68 2HB ASP 68 -2.063 15.279 -7.404 547 HB3 ASP 68 3HB ASP 68 -1.697 13.805 -8.283 548 H LEU 69 H LEU 69 -3.289 11.875 -8.897 549 HA LEU 69 HA LEU 69 -3.952 11.969 -11.664 550 HB2 LEU 69 2HB LEU 69 -3.527 9.634 -9.755 551 HB3 LEU 69 3HB LEU 69 -3.799 9.419 -11.480 552 HG LEU 69 HG LEU 69 -1.457 10.980 -10.329 553 HD11 LEU 69 1HD1 LEU 69 -1.508 8.117 -11.336 554 HD12 LEU 69 2HD1 LEU 69 -1.307 8.633 -9.659 555 HD13 LEU 69 3HD1 LEU 69 -0.073 9.029 -10.851 556 HD21 LEU 69 3HD2 LEU 69 -2.002 9.995 -13.150 557 HD22 LEU 69 1HD2 LEU 69 -0.521 10.783 -12.597 558 HD23 LEU 69 2HD2 LEU 69 -2.041 11.671 -12.595 559 H LEU 70 H LEU 70 -5.695 10.848 -8.782 560 HA LEU 70 HA LEU 70 -7.857 9.533 -9.965 561 HB2 LEU 70 2HB LEU 70 -7.769 11.152 -7.388 562 HB3 LEU 70 3HB LEU 70 -9.098 10.096 -7.836 563 HG LEU 70 HG LEU 70 -6.249 9.172 -7.293 564 HD11 LEU 70 1HD1 LEU 70 -7.124 8.212 -5.213 565 HD12 LEU 70 2HD1 LEU 70 -8.709 8.917 -5.540 566 HD13 LEU 70 3HD1 LEU 70 -7.319 9.963 -5.244 567 HD21 LEU 70 3HD2 LEU 70 -7.167 6.896 -7.343 568 HD22 LEU 70 1HD2 LEU 70 -7.365 7.710 -8.894 569 HD23 LEU 70 2HD2 LEU 70 -8.745 7.535 -7.809 570 H ILE 71 H ILE 71 -7.633 12.925 -8.867 571 HA ILE 71 HA ILE 71 -10.121 13.824 -9.838 572 HB ILE 71 HB ILE 71 -7.600 15.495 -9.362 573 HG12 ILE 71 2HG1 ILE 71 -9.882 14.835 -7.434 574 HG13 ILE 71 3HG1 ILE 71 -8.261 14.155 -7.358 575 HG21 ILE 71 1HG2 ILE 71 -10.521 16.340 -9.463 576 HG22 ILE 71 2HG2 ILE 71 -9.289 16.726 -10.666 577 HG23 ILE 71 3HG2 ILE 71 -9.169 17.394 -9.036 578 HD11 ILE 71 3HD1 ILE 71 -7.354 16.378 -6.900 579 HD12 ILE 71 1HD1 ILE 71 -8.556 15.882 -5.710 580 HD13 ILE 71 2HD1 ILE 71 -8.988 17.050 -6.957 581 H LEU 72 H LEU 72 -6.911 13.780 -11.297 582 HA LEU 72 HA LEU 72 -7.440 15.441 -13.532 583 HB2 LEU 72 2HB LEU 72 -5.200 14.967 -12.515 584 HB3 LEU 72 3HB LEU 72 -5.265 13.334 -13.131 585 HG LEU 72 HG LEU 72 -3.771 15.026 -14.369 586 HD11 LEU 72 1HD1 LEU 72 -4.300 12.857 -15.342 587 HD12 LEU 72 2HD1 LEU 72 -4.168 14.108 -16.577 588 HD13 LEU 72 3HD1 LEU 72 -5.759 13.523 -16.081 589 HD21 LEU 72 3HD2 LEU 72 -5.336 16.925 -14.391 590 HD22 LEU 72 1HD2 LEU 72 -6.409 16.046 -15.483 591 HD23 LEU 72 2HD2 LEU 72 -4.792 16.519 -16.016 592 H HIS 73 H HIS 73 -7.651 11.926 -13.054 593 HA HIS 73 HA HIS 73 -7.999 11.403 -15.897 594 HB2 HIS 73 2HB HIS 73 -7.868 9.588 -13.472 595 HB3 HIS 73 3HB HIS 73 -8.333 8.974 -15.055 596 HD1 HIS 73 HD1 HIS 73 -6.419 7.926 -16.200 597 HD2 HIS 73 HD2 HIS 73 -5.167 11.060 -13.789 598 HE1 HIS 73 HE1 HIS 73 -3.915 7.922 -16.330 599 HE2 HIS 73 HE2 HIS 73 -3.186 9.765 -14.800 600 H ASP 74 H ASP 74 -10.071 11.188 -12.932 601 HA ASP 74 HA ASP 74 -12.457 11.397 -14.571 602 HB2 ASP 74 2HB ASP 74 -13.434 9.188 -13.932 603 HB3 ASP 74 3HB ASP 74 -12.010 9.040 -14.947 604 H PHE 75 H PHE 75 -11.213 10.720 -11.287 605 HA PHE 75 HA PHE 75 -13.663 11.170 -9.908 606 HB2 PHE 75 2HB PHE 75 -10.772 11.039 -9.006 607 HB3 PHE 75 3HB PHE 75 -12.014 11.530 -7.872 608 HD1 PHE 75 HD1 PHE 75 -13.956 9.942 -7.433 609 HD2 PHE 75 HD2 PHE 75 -10.356 8.737 -9.399 610 HE1 PHE 75 HE1 PHE 75 -14.412 7.614 -6.848 611 HE2 PHE 75 HE2 PHE 75 -10.825 6.409 -8.818 612 HZ PHE 75 HZ PHE 75 -12.851 5.828 -7.535 613 H THR 76 H THR 76 -13.611 12.784 -8.016 614 HA THR 76 HA THR 76 -12.589 15.447 -8.689 615 HB THR 76 HB THR 76 -15.053 15.198 -9.442 616 HG1 THR 76 HG1 THR 76 -15.654 17.209 -8.561 617 HG21 THR 76 3HG2 THR 76 -15.871 13.815 -7.568 618 HG22 THR 76 1HG2 THR 76 -16.797 15.315 -7.713 619 HG23 THR 76 2HG2 THR 76 -15.572 15.153 -6.453 620 HA PRO 77 HA PRO 77 -11.020 15.504 -4.513 621 HB2 PRO 77 2HB PRO 77 -12.101 17.964 -3.523 622 HB3 PRO 77 3HB PRO 77 -10.563 17.752 -4.380 623 HG2 PRO 77 2HG PRO 77 -13.232 18.552 -5.493 624 HG3 PRO 77 3HG PRO 77 -11.611 19.172 -5.888 625 HD2 PRO 77 2HD PRO 77 -12.786 17.493 -7.558 626 HD3 PRO 77 3HD PRO 77 -11.063 17.259 -7.177 627 H GLU 78 H GLU 78 -14.460 16.365 -4.753 628 HA GLU 78 HA GLU 78 -15.161 16.123 -2.037 629 HB2 GLU 78 2HB GLU 78 -16.902 15.908 -4.530 630 HB3 GLU 78 3HB GLU 78 -17.533 16.012 -2.887 631 HG2 GLU 78 2HG GLU 78 -16.345 18.224 -2.646 632 HG3 GLU 78 3HG GLU 78 -15.949 18.129 -4.367 633 H GLU 79 H GLU 79 -15.353 13.736 -4.688 634 HA GLU 79 HA GLU 79 -16.765 11.793 -3.110 635 HB2 GLU 79 2HB GLU 79 -15.298 11.382 -5.751 636 HB3 GLU 79 3HB GLU 79 -16.432 10.251 -5.020 637 HG2 GLU 79 2HG GLU 79 -17.045 12.990 -6.155 638 HG3 GLU 79 3HG GLU 79 -17.570 11.433 -6.778 639 H ILE 80 H ILE 80 -13.394 12.351 -3.922 640 HA ILE 80 HA ILE 80 -12.269 9.905 -3.031 641 HB ILE 80 HB ILE 80 -10.972 12.668 -3.162 642 HG12 ILE 80 2HG1 ILE 80 -10.976 10.471 -5.289 643 HG13 ILE 80 3HG1 ILE 80 -11.985 11.911 -5.340 644 HG21 ILE 80 1HG2 ILE 80 -9.667 9.918 -3.112 645 HG22 ILE 80 2HG2 ILE 80 -9.634 11.106 -1.810 646 HG23 ILE 80 3HG2 ILE 80 -8.819 11.447 -3.335 647 HD11 ILE 80 3HD1 ILE 80 -9.985 13.309 -5.456 648 HD12 ILE 80 1HD1 ILE 80 -10.071 12.145 -6.777 649 HD13 ILE 80 2HD1 ILE 80 -8.974 11.859 -5.427 650 H LYS 81 H LYS 81 -12.662 13.090 -1.438 651 HA LYS 81 HA LYS 81 -11.604 12.260 1.087 652 HB2 LYS 81 2HB LYS 81 -12.331 14.430 1.941 653 HB3 LYS 81 3HB LYS 81 -11.518 14.604 0.393 654 HG2 LYS 81 2HG LYS 81 -13.875 14.675 -0.649 655 HG3 LYS 81 3HG LYS 81 -14.466 14.910 0.996 656 HD2 LYS 81 2HD LYS 81 -12.456 16.712 -0.427 657 HD3 LYS 81 3HD LYS 81 -14.173 17.062 -0.234 658 HE2 LYS 81 2HE LYS 81 -13.913 17.187 2.188 659 HE3 LYS 81 3HE LYS 81 -12.216 16.716 2.062 660 HZ1 LYS 81 3HZ LYS 81 -13.427 19.213 0.998 661 HZ2 LYS 81 1HZ LYS 81 -11.810 18.762 0.808 662 HZ3 LYS 81 2HZ LYS 81 -12.418 19.089 2.348 663 H SER 82 H SER 82 -14.770 12.132 -0.376 664 HA SER 82 HA SER 82 -16.350 11.667 1.938 665 HB2 SER 82 2HB SER 82 -17.315 12.285 -0.260 666 HB3 SER 82 3HB SER 82 -16.814 10.734 -0.928 667 HG SER 82 HG SER 82 -18.641 10.002 -0.218 668 H PHE 83 H PHE 83 -14.191 9.608 0.100 669 HA PHE 83 HA PHE 83 -15.122 7.101 1.172 670 HB2 PHE 83 2HB PHE 83 -12.526 7.814 -0.241 671 HB3 PHE 83 3HB PHE 83 -12.972 6.173 0.225 672 HD1 PHE 83 HD2 PHE 83 -15.781 5.930 -0.501 673 HD2 PHE 83 HD1 PHE 83 -12.642 7.941 -2.595 674 HE1 PHE 83 HE2 PHE 83 -16.993 5.632 -2.624 675 HE2 PHE 83 HE1 PHE 83 -13.857 7.636 -4.709 676 HZ PHE 83 HZ PHE 83 -16.033 6.484 -4.727 677 H PHE 84 H PHE 84 -12.881 9.553 2.325 678 HA PHE 84 HA PHE 84 -11.516 7.871 4.245 679 HB2 PHE 84 2HB PHE 84 -11.760 10.905 4.011 680 HB3 PHE 84 3HB PHE 84 -10.832 10.118 5.284 681 HD1 PHE 84 HD1 PHE 84 -11.004 10.732 1.639 682 HD2 PHE 84 HD2 PHE 84 -8.657 9.157 4.840 683 HE1 PHE 84 HE1 PHE 84 -9.039 10.678 0.165 684 HE2 PHE 84 HE2 PHE 84 -6.700 9.099 3.363 685 HZ PHE 84 HZ PHE 84 -6.884 9.860 1.031 686 H GLU 85 H GLU 85 -14.270 10.039 4.280 687 HA GLU 85 HA GLU 85 -14.847 9.580 7.122 688 HB2 GLU 85 2HB GLU 85 -16.556 11.372 6.788 689 HB3 GLU 85 3HB GLU 85 -14.932 11.902 6.352 690 HG2 GLU 85 2HG GLU 85 -15.481 11.473 3.953 691 HG3 GLU 85 3HG GLU 85 -17.121 11.056 4.432 692 H ASN 86 H ASN 86 -15.333 7.723 4.565 693 HA ASN 86 HA ASN 86 -18.123 7.144 4.515 694 HB2 ASN 86 2HB ASN 86 -16.515 6.460 2.718 695 HB3 ASN 86 3HB ASN 86 -15.767 5.326 3.825 696 HD21 ASN 86 1HD2 ASN 86 -16.205 3.685 2.320 697 HD22 ASN 86 2HD2 ASN 86 -17.778 3.009 2.137 698 H LYS 87 H LYS 87 -19.050 6.767 6.462 699 HA LYS 87 HA LYS 87 -17.812 5.098 8.525 700 HB2 LYS 87 2HB LYS 87 -20.478 6.594 8.587 701 HB3 LYS 87 3HB LYS 87 -19.672 5.854 9.968 702 HG2 LYS 87 2HG LYS 87 -17.741 7.480 9.570 703 HG3 LYS 87 3HG LYS 87 -18.770 8.275 8.382 704 HD2 LYS 87 2HD LYS 87 -19.074 9.584 10.318 705 HD3 LYS 87 3HD LYS 87 -20.493 8.538 10.315 706 HE2 LYS 87 2HE LYS 87 -17.987 8.096 11.980 707 HE3 LYS 87 3HE LYS 87 -19.491 8.798 12.565 708 HZ1 LYS 87 3HZ LYS 87 -19.343 6.491 13.175 709 HZ2 LYS 87 1HZ LYS 87 -19.136 6.024 11.565 710 HZ3 LYS 87 2HZ LYS 87 -20.602 6.695 12.073 711 H GLY 88 H GLY 88 -20.497 5.035 6.260 712 HA2 GLY 88 2HA GLY 88 -22.022 2.912 7.348 713 HA3 GLY 88 3HA GLY 88 -22.109 3.522 5.704 714 H LYS 89 H LYS 89 -19.743 2.993 4.593 715 HA LYS 89 HA LYS 89 -19.358 0.052 4.832 716 HB2 LYS 89 2HB LYS 89 -18.626 1.815 2.448 717 HB3 LYS 89 3HB LYS 89 -18.577 0.061 2.513 718 HG2 LYS 89 2HG LYS 89 -21.044 1.815 2.534 719 HG3 LYS 89 3HG LYS 89 -20.497 0.788 1.211 720 HD2 LYS 89 2HD LYS 89 -21.437 -0.192 3.936 721 HD3 LYS 89 3HD LYS 89 -22.406 -0.197 2.464 722 HE2 LYS 89 2HE LYS 89 -20.896 -1.808 1.425 723 HE3 LYS 89 3HE LYS 89 -19.810 -1.734 2.816 724 HZ1 LYS 89 3HZ LYS 89 -22.597 -2.768 2.806 725 HZ2 LYS 89 1HZ LYS 89 -21.642 -2.600 4.189 726 HZ3 LYS 89 2HZ LYS 89 -21.185 -3.682 2.973 727 H ARG 90 H ARG 90 -16.945 -0.416 3.865 728 HA ARG 90 HA ARG 90 -15.087 0.620 5.754 729 HB2 ARG 90 2HB ARG 90 -14.900 -1.651 4.578 730 HB3 ARG 90 3HB ARG 90 -14.390 -0.793 3.132 731 HG2 ARG 90 2HG ARG 90 -12.557 0.211 4.825 732 HG3 ARG 90 3HG ARG 90 -12.906 -1.274 5.706 733 HD2 ARG 90 2HD ARG 90 -11.758 -0.959 2.928 734 HD3 ARG 90 3HD ARG 90 -11.034 -1.752 4.326 735 HE ARG 90 HE ARG 90 -13.309 -2.800 2.747 736 HH11 ARG 90 1HH1 ARG 90 -10.520 -3.404 4.783 737 HH12 ARG 90 2HH1 ARG 90 -10.619 -5.127 4.627 738 HH21 ARG 90 1HH2 ARG 90 -13.407 -5.052 2.514 739 HH22 ARG 90 2HH2 ARG 90 -12.257 -6.055 3.342 740 HA PRO 91 HA PRO 91 -13.849 4.402 3.500 741 HB2 PRO 91 2HB PRO 91 -11.335 3.964 5.117 742 HB3 PRO 91 3HB PRO 91 -12.298 5.447 4.911 743 HG2 PRO 91 2HG PRO 91 -12.435 4.076 7.183 744 HG3 PRO 91 3HG PRO 91 -13.907 4.790 6.478 745 HD2 PRO 91 2HD PRO 91 -12.993 1.919 6.441 746 HD3 PRO 91 3HD PRO 91 -14.633 2.581 6.638 747 H VAL 92 H VAL 92 -13.404 3.944 1.415 748 HA VAL 92 HA VAL 92 -11.773 1.864 0.417 749 HB VAL 92 HB VAL 92 -12.604 4.428 -1.030 750 HG11 VAL 92 1HG1 VAL 92 -11.729 1.757 -2.202 751 HG12 VAL 92 2HG1 VAL 92 -10.806 3.262 -2.234 752 HG13 VAL 92 3HG1 VAL 92 -12.321 3.143 -3.127 753 HG21 VAL 92 3HG2 VAL 92 -14.056 1.756 -0.917 754 HG22 VAL 92 1HG2 VAL 92 -14.532 3.148 -1.895 755 HG23 VAL 92 2HG2 VAL 92 -14.569 3.252 -0.134 756 H PHE 93 H PHE 93 -11.189 5.288 1.000 757 HA PHE 93 HA PHE 93 -8.272 4.859 0.758 758 HB2 PHE 93 2HB PHE 93 -9.820 7.486 0.643 759 HB3 PHE 93 3HB PHE 93 -8.080 7.295 0.438 760 HD1 PHE 93 HD1 PHE 93 -7.895 4.971 -1.393 761 HD2 PHE 93 HD2 PHE 93 -10.602 8.277 -1.453 762 HE1 PHE 93 HE1 PHE 93 -8.182 4.692 -3.818 763 HE2 PHE 93 HE2 PHE 93 -10.884 7.988 -3.881 764 HZ PHE 93 HZ PHE 93 -9.678 6.199 -5.066 765 H VAL 94 H VAL 94 -7.398 4.523 2.672 766 HA VAL 94 HA VAL 94 -8.505 5.726 5.150 767 HB VAL 94 HB VAL 94 -6.734 3.242 4.792 768 HG11 VAL 94 1HG1 VAL 94 -6.285 4.330 6.938 769 HG12 VAL 94 2HG1 VAL 94 -7.142 2.809 7.190 770 HG13 VAL 94 3HG1 VAL 94 -8.010 4.341 7.319 771 HG21 VAL 94 3HG2 VAL 94 -9.045 2.854 3.997 772 HG22 VAL 94 1HG2 VAL 94 -9.670 3.366 5.565 773 HG23 VAL 94 2HG2 VAL 94 -8.686 1.906 5.441 774 H LYS 95 H LYS 95 -6.962 6.685 6.637 775 HA LYS 95 HA LYS 95 -4.140 6.808 5.896 776 HB2 LYS 95 2HB LYS 95 -3.967 9.214 5.955 777 HB3 LYS 95 3HB LYS 95 -5.174 8.774 4.757 778 HG2 LYS 95 2HG LYS 95 -6.986 9.457 6.202 779 HG3 LYS 95 3HG LYS 95 -5.891 9.690 7.569 780 HD2 LYS 95 2HD LYS 95 -5.874 11.311 4.987 781 HD3 LYS 95 3HD LYS 95 -6.515 11.855 6.539 782 HE2 LYS 95 2HE LYS 95 -4.289 11.786 7.539 783 HE3 LYS 95 3HE LYS 95 -3.615 11.069 6.075 784 HZ1 LYS 95 3HZ LYS 95 -3.104 13.393 6.144 785 HZ2 LYS 95 1HZ LYS 95 -4.736 13.807 6.334 786 HZ3 LYS 95 2HZ LYS 95 -4.200 13.117 4.888 787 H GLY 96 H GLY 96 -2.859 7.926 7.581 788 HA2 GLY 96 2HA GLY 96 -3.261 9.007 9.900 789 HA3 GLY 96 3HA GLY 96 -3.867 7.397 10.301 790 H SER 97 H SER 97 -2.138 7.310 11.881 791 HA SER 97 HA SER 97 0.595 6.977 10.997 792 HB2 SER 97 2HB SER 97 -0.124 7.645 13.344 793 HB3 SER 97 3HB SER 97 -0.709 5.999 13.581 794 HG SER 97 HG SER 97 1.503 6.564 14.319 795 H LEU 98 H LEU 98 1.687 4.725 11.320 796 HA LEU 98 HA LEU 98 0.793 3.031 9.335 797 HB2 LEU 98 2HB LEU 98 3.116 3.065 10.148 798 HB3 LEU 98 3HB LEU 98 2.616 2.357 11.674 799 HG LEU 98 HG LEU 98 1.993 0.243 10.492 800 HD11 LEU 98 1HD1 LEU 98 2.653 -0.139 8.155 801 HD12 LEU 98 2HD1 LEU 98 3.101 1.561 7.996 802 HD13 LEU 98 3HD1 LEU 98 1.420 1.112 8.290 803 HD21 LEU 98 3HD2 LEU 98 4.263 -0.545 10.002 804 HD22 LEU 98 1HD2 LEU 98 4.226 0.436 11.467 805 HD23 LEU 98 2HD2 LEU 98 4.847 1.121 9.963 806 H GLU 99 H GLU 99 0.325 2.652 12.825 807 HA GLU 99 HA GLU 99 -1.042 0.104 12.623 808 HB2 GLU 99 2HB GLU 99 -0.769 1.933 15.047 809 HB3 GLU 99 3HB GLU 99 -1.188 0.219 15.052 810 HG2 GLU 99 2HG GLU 99 1.036 -0.341 14.158 811 HG3 GLU 99 3HG GLU 99 1.466 1.365 14.129 812 H SER 100 H SER 100 -1.918 3.481 13.256 813 HA SER 100 HA SER 100 -4.607 3.233 13.946 814 HB2 SER 100 2HB SER 100 -3.236 5.472 12.376 815 HB3 SER 100 3HB SER 100 -4.768 5.625 13.236 816 HG SER 100 HG SER 100 -3.393 4.855 15.122 817 H ALA 101 H ALA 101 -3.150 3.720 10.749 818 HA ALA 101 HA ALA 101 -5.506 3.754 9.199 819 HB1 ALA 101 3HB ALA 101 -3.393 4.736 8.439 820 HB2 ALA 101 1HB ALA 101 -3.972 3.543 7.277 821 HB3 ALA 101 2HB ALA 101 -2.646 3.137 8.375 822 H ALA 102 H ALA 102 -3.419 1.169 10.349 823 HA ALA 102 HA ALA 102 -4.303 -0.959 8.705 824 HB1 ALA 102 3HB ALA 102 -2.247 -1.037 10.046 825 HB2 ALA 102 1HB ALA 102 -3.298 -2.400 10.426 826 HB3 ALA 102 2HB ALA 102 -3.197 -1.026 11.533 827 H GLU 103 H GLU 103 -5.302 0.197 11.889 828 HA GLU 103 HA GLU 103 -7.263 -1.746 12.511 829 HB2 GLU 103 2HB GLU 103 -7.045 1.147 13.452 830 HB3 GLU 103 3HB GLU 103 -7.983 -0.118 14.244 831 HG2 GLU 103 2HG GLU 103 -5.942 -1.344 14.772 832 HG3 GLU 103 3HG GLU 103 -4.981 -0.185 13.884 833 H GLN 104 H GLN 104 -7.457 1.427 10.974 834 HA GLN 104 HA GLN 104 -10.299 1.532 10.659 835 HB2 GLN 104 2HB GLN 104 -8.079 3.045 9.228 836 HB3 GLN 104 3HB GLN 104 -9.792 3.440 9.112 837 HG2 GLN 104 2HG GLN 104 -9.863 4.031 11.473 838 HG3 GLN 104 3HG GLN 104 -8.192 3.513 11.689 839 HE21 GLN 104 1HE2 GLN 104 -6.524 4.815 10.874 840 HE22 GLN 104 2HE2 GLN 104 -6.775 6.444 10.365 841 H ALA 105 H ALA 105 -7.695 0.182 8.700 842 HA ALA 105 HA ALA 105 -9.327 -0.125 6.300 843 HB1 ALA 105 3HB ALA 105 -7.315 -1.138 5.318 844 HB2 ALA 105 1HB ALA 105 -6.517 -1.111 6.897 845 HB3 ALA 105 2HB ALA 105 -6.941 0.401 6.093 846 H GLY 106 H GLY 106 -8.383 -2.077 9.064 847 HA2 GLY 106 2HA GLY 106 -9.386 -4.074 9.769 848 HA3 GLY 106 3HA GLY 106 -10.088 -4.303 8.174 849 H ILE 107 H ILE 107 -6.778 -3.832 9.367 850 HA ILE 107 HA ILE 107 -5.893 -6.396 8.159 851 HB ILE 107 HB ILE 107 -3.903 -4.120 8.446 852 HG12 ILE 107 2HG1 ILE 107 -5.775 -4.277 6.041 853 HG13 ILE 107 3HG1 ILE 107 -5.814 -3.019 7.274 854 HG21 ILE 107 1HG2 ILE 107 -4.238 -6.293 6.340 855 HG22 ILE 107 2HG2 ILE 107 -3.162 -6.365 7.737 856 HG23 ILE 107 3HG2 ILE 107 -2.877 -5.173 6.472 857 HD11 ILE 107 3HD1 ILE 107 -4.678 -2.273 5.270 858 HD12 ILE 107 1HD1 ILE 107 -3.508 -3.582 5.410 859 HD13 ILE 107 2HD1 ILE 107 -3.566 -2.309 6.636 860 H VAL 108 H VAL 108 -4.043 -7.394 9.342 861 HA VAL 108 HA VAL 108 -4.215 -7.001 12.211 862 HB VAL 108 HB VAL 108 -2.333 -8.849 10.683 863 HG11 VAL 108 1HG1 VAL 108 -1.579 -8.452 12.977 864 HG12 VAL 108 2HG1 VAL 108 -2.182 -10.102 12.821 865 HG13 VAL 108 3HG1 VAL 108 -3.177 -8.872 13.607 866 HG21 VAL 108 3HG2 VAL 108 -5.077 -9.480 11.831 867 HG22 VAL 108 1HG2 VAL 108 -3.965 -10.653 11.115 868 HG23 VAL 108 2HG2 VAL 108 -4.663 -9.375 10.118 869 H VAL 109 H VAL 109 -3.250 -5.320 13.040 870 HA VAL 109 HA VAL 109 -1.260 -3.676 12.099 871 HB VAL 109 HB VAL 109 -2.000 -4.307 14.993 872 HG11 VAL 109 1HG1 VAL 109 -0.451 -1.913 13.960 873 HG12 VAL 109 2HG1 VAL 109 0.191 -3.210 14.969 874 HG13 VAL 109 3HG1 VAL 109 -1.037 -2.120 15.612 875 HG21 VAL 109 3HG2 VAL 109 -3.892 -3.478 13.631 876 HG22 VAL 109 1HG2 VAL 109 -2.956 -2.046 13.199 877 HG23 VAL 109 2HG2 VAL 109 -3.439 -2.315 14.877 878 H ASP 110 H ASP 110 -0.920 -6.438 14.292 879 HA ASP 110 HA ASP 110 1.752 -6.272 15.010 880 HB2 ASP 110 2HB ASP 110 0.020 -7.764 16.062 881 HB3 ASP 110 3HB ASP 110 0.110 -8.825 14.659 882 H GLU 111 H GLU 111 0.294 -7.825 12.176 883 HA GLU 111 HA GLU 111 2.666 -9.057 11.191 884 HB2 GLU 111 2HB GLU 111 0.140 -8.285 9.672 885 HB3 GLU 111 3HB GLU 111 1.403 -9.350 9.068 886 HG2 GLU 111 2HG GLU 111 -0.323 -9.906 11.489 887 HG3 GLU 111 3HG GLU 111 -0.613 -10.549 9.878 888 H LEU 112 H LEU 112 0.890 -6.078 10.127 889 HA LEU 112 HA LEU 112 2.819 -5.552 8.067 890 HB2 LEU 112 2HB LEU 112 1.563 -3.413 7.685 891 HB3 LEU 112 3HB LEU 112 0.634 -4.895 7.585 892 HG LEU 112 HG LEU 112 -0.077 -4.357 10.059 893 HD11 LEU 112 1HD1 LEU 112 1.444 -2.497 10.500 894 HD12 LEU 112 2HD1 LEU 112 -0.233 -1.971 10.614 895 HD13 LEU 112 3HD1 LEU 112 0.724 -1.562 9.186 896 HD21 LEU 112 3HD2 LEU 112 -1.184 -2.672 7.807 897 HD22 LEU 112 1HD2 LEU 112 -2.010 -3.188 9.278 898 HD23 LEU 112 2HD2 LEU 112 -1.549 -4.379 8.072 899 H VAL 113 H VAL 113 2.689 -4.506 11.347 900 HA VAL 113 HA VAL 113 4.462 -2.275 11.111 901 HB VAL 113 HB VAL 113 3.726 -4.000 13.523 902 HG11 VAL 113 1HG1 VAL 113 4.798 -2.282 14.964 903 HG12 VAL 113 2HG1 VAL 113 5.436 -1.480 13.527 904 HG13 VAL 113 3HG1 VAL 113 5.983 -3.104 13.944 905 HG21 VAL 113 3HG2 VAL 113 2.958 -1.163 12.736 906 HG22 VAL 113 1HG2 VAL 113 2.436 -1.997 14.206 907 HG23 VAL 113 2HG2 VAL 113 1.921 -2.586 12.623 908 H GLN 114 H GLN 114 4.890 -5.740 11.678 909 HA GLN 114 HA GLN 114 7.750 -5.742 11.933 910 HB2 GLN 114 2HB GLN 114 5.824 -7.936 11.044 911 HB3 GLN 114 3HB GLN 114 7.547 -8.194 11.318 912 HG2 GLN 114 2HG GLN 114 5.540 -7.335 13.415 913 HG3 GLN 114 3HG GLN 114 6.210 -8.952 13.226 914 HE21 GLN 114 1HE2 GLN 114 6.846 -5.692 14.286 915 HE22 GLN 114 2HE2 GLN 114 8.318 -6.035 15.119 916 H THR 115 H THR 115 5.479 -6.296 9.317 917 HA THR 115 HA THR 115 7.092 -6.915 7.199 918 HB THR 115 HB THR 115 4.473 -5.395 7.339 919 HG1 THR 115 HG1 THR 115 3.587 -7.336 7.259 920 HG21 THR 115 3HG2 THR 115 5.484 -4.880 5.174 921 HG22 THR 115 1HG2 THR 115 4.093 -5.950 4.987 922 HG23 THR 115 2HG2 THR 115 5.731 -6.598 4.864 923 H VAL 116 H VAL 116 6.120 -3.628 8.285 924 HA VAL 116 HA VAL 116 7.480 -2.313 6.097 925 HB VAL 116 HB VAL 116 5.969 -1.241 8.527 926 HG11 VAL 116 1HG1 VAL 116 7.692 0.435 7.966 927 HG12 VAL 116 2HG1 VAL 116 6.092 1.024 7.517 928 HG13 VAL 116 3HG1 VAL 116 7.188 0.419 6.273 929 HG21 VAL 116 3HG2 VAL 116 4.272 -0.575 6.853 930 HG22 VAL 116 1HG2 VAL 116 4.578 -2.312 6.791 931 HG23 VAL 116 2HG2 VAL 116 5.265 -1.250 5.559 932 H LYS 117 H LYS 117 8.166 -2.776 9.603 933 HA LYS 117 HA LYS 117 10.427 -0.987 9.578 934 HB2 LYS 117 2HB LYS 117 10.864 -1.658 11.841 935 HB3 LYS 117 3HB LYS 117 9.122 -1.508 11.655 936 HG2 LYS 117 2HG LYS 117 9.018 -4.026 11.408 937 HG3 LYS 117 3HG LYS 117 10.731 -4.082 11.823 938 HD2 LYS 117 2HD LYS 117 8.476 -3.043 13.593 939 HD3 LYS 117 3HD LYS 117 9.355 -4.556 13.803 940 HE2 LYS 117 2HE LYS 117 11.418 -3.331 14.295 941 HE3 LYS 117 3HE LYS 117 10.611 -1.792 13.981 942 HZ1 LYS 117 3HZ LYS 117 10.674 -2.118 16.319 943 HZ2 LYS 117 1HZ LYS 117 10.049 -3.687 16.197 944 HZ3 LYS 117 2HZ LYS 117 9.073 -2.360 15.834 945 H ASN 118 H ASN 118 10.031 -4.494 9.219 946 HA ASN 118 HA ASN 118 12.832 -5.112 9.050 947 HB2 ASN 118 2HB ASN 118 10.407 -6.704 8.082 948 HB3 ASN 118 3HB ASN 118 12.064 -7.308 8.033 949 HD21 ASN 118 1HD2 ASN 118 9.717 -8.326 9.474 950 HD22 ASN 118 2HD2 ASN 118 10.171 -8.393 11.137 951 H TYR 119 H TYR 119 10.248 -4.410 6.718 952 HA TYR 119 HA TYR 119 11.510 -4.760 4.285 953 HB2 TYR 119 2HB TYR 119 9.123 -4.156 4.470 954 HB3 TYR 119 3HB TYR 119 9.554 -2.556 5.049 955 HD1 TYR 119 HD1 TYR 119 10.677 -4.623 2.099 956 HD2 TYR 119 HD2 TYR 119 8.929 -0.963 3.444 957 HE1 TYR 119 HE1 TYR 119 10.581 -3.818 -0.216 958 HE2 TYR 119 HE2 TYR 119 8.838 -0.156 1.130 959 HH TYR 119 HH TYR 119 9.815 -0.544 -1.004 960 H GLN 120 H GLN 120 11.249 -1.677 6.053 961 HA GLN 120 HA GLN 120 13.091 -0.196 4.589 962 HB2 GLN 120 2HB GLN 120 12.232 0.085 7.499 963 HB3 GLN 120 3HB GLN 120 13.182 1.291 6.632 964 HG2 GLN 120 2HG GLN 120 11.278 1.491 4.979 965 HG3 GLN 120 3HG GLN 120 10.330 0.440 6.031 966 HE21 GLN 120 1HE2 GLN 120 9.978 3.293 5.224 967 HE22 GLN 120 2HE2 GLN 120 9.831 4.165 6.699 968 H GLY 121 H GLY 121 13.573 -2.326 7.369 969 HA2 GLY 121 2HA GLY 121 16.189 -1.732 8.115 970 HA3 GLY 121 3HA GLY 121 15.406 -3.292 8.298 971 H TYR 122 H TYR 122 15.083 -4.175 5.689 972 HA TYR 122 HA TYR 122 17.852 -4.699 4.956 973 HB2 TYR 122 2HB TYR 122 17.048 -6.493 3.525 974 HB3 TYR 122 3HB TYR 122 16.418 -6.634 5.151 975 HD1 TYR 122 HD2 TYR 122 15.403 -5.403 1.727 976 HD2 TYR 122 HD1 TYR 122 14.135 -7.081 5.444 977 HE1 TYR 122 HE2 TYR 122 13.151 -5.725 0.818 978 HE2 TYR 122 HE1 TYR 122 11.887 -7.412 4.519 979 HH TYR 122 HH TYR 122 10.497 -6.363 2.703 980 H VAL 123 H VAL 123 15.292 -2.680 3.770 981 HA VAL 123 HA VAL 123 16.161 -2.205 1.124 982 HB VAL 123 HB VAL 123 14.839 -0.271 3.097 983 HG11 VAL 123 1HG1 VAL 123 15.420 0.211 0.142 984 HG12 VAL 123 2HG1 VAL 123 16.095 1.102 1.508 985 HG13 VAL 123 3HG1 VAL 123 14.376 1.228 1.142 986 HG21 VAL 123 3HG2 VAL 123 13.638 -1.624 0.651 987 HG22 VAL 123 1HG2 VAL 123 12.788 -0.618 1.822 988 HG23 VAL 123 2HG2 VAL 123 13.430 -2.187 2.301 989 H GLN 124 H GLN 124 16.973 -0.455 4.130 990 HA GLN 124 HA GLN 124 19.043 1.144 2.968 991 HB2 GLN 124 2HB GLN 124 19.443 1.928 5.260 992 HB3 GLN 124 3HB GLN 124 17.717 1.888 4.916 993 HG2 GLN 124 2HG GLN 124 17.592 -0.310 6.129 994 HG3 GLN 124 3HG GLN 124 19.286 -0.107 6.567 995 HE21 GLN 124 1HE2 GLN 124 18.809 -0.094 8.766 996 HE22 GLN 124 2HE2 GLN 124 18.015 1.221 9.549 997 H ASP 125 H ASP 125 18.955 -2.032 4.369 998 HA ASP 125 HA ASP 125 21.752 -2.362 4.927 999 HB2 ASP 125 2HB ASP 125 19.869 -3.747 5.898 1000 HB3 ASP 125 3HB ASP 125 19.652 -4.489 4.325 1001 H GLY 126 H GLY 126 19.766 -2.561 2.069 1002 HA2 GLY 126 2HA GLY 126 20.319 -2.717 -0.158 1003 HA3 GLY 126 3HA GLY 126 22.017 -2.831 0.290 1004 H HIS 127 H HIS 127 19.383 -4.949 1.376 1005 HA HIS 127 HA HIS 127 20.175 -7.100 -0.474 1006 HB2 HIS 127 2HB HIS 127 21.568 -7.383 1.620 1007 HB3 HIS 127 3HB HIS 127 20.088 -7.521 2.560 1008 HD1 HIS 127 HD1 HIS 127 22.420 -9.454 0.459 1009 HD2 HIS 127 HD2 HIS 127 18.619 -9.976 2.051 1010 HE1 HIS 127 HE1 HIS 127 21.924 -11.900 0.239 1011 HE2 HIS 127 HE2 HIS 127 19.555 -12.147 1.022 1012 H ASP 128 H ASP 128 18.368 -8.097 -1.228 1013 HA ASP 128 HA ASP 128 15.761 -7.188 -0.367 1014 HB2 ASP 128 2HB ASP 128 14.899 -8.357 -2.290 1015 HB3 ASP 128 3HB ASP 128 16.400 -7.571 -2.775 1016 H HIS 129 H HIS 129 13.991 -8.578 0.222 1017 HA HIS 129 HA HIS 129 14.529 -11.315 1.108 1018 HB2 HIS 129 2HB HIS 129 13.839 -9.071 3.026 1019 HB3 HIS 129 3HB HIS 129 13.271 -10.693 3.373 1020 HD1 HIS 129 HD1 HIS 129 14.990 -12.402 4.177 1021 HD2 HIS 129 HD2 HIS 129 16.652 -8.685 3.351 1022 HE1 HIS 129 HE1 HIS 129 17.295 -12.462 5.154 1023 HE2 HIS 129 HE2 HIS 129 18.212 -10.153 4.796 1024 H ASP 130 H ASP 130 12.642 -9.281 -0.564 1025 HA ASP 130 HA ASP 130 10.002 -9.851 0.310 1026 HB2 ASP 130 2HB ASP 130 10.947 -8.867 -2.412 1027 HB3 ASP 130 3HB ASP 130 9.303 -8.789 -1.797 1028 H PHE 131 H PHE 131 11.133 -10.572 -2.972 1029 HA PHE 131 HA PHE 131 10.500 -13.423 -2.814 1030 HB2 PHE 131 2HB PHE 131 9.116 -11.500 -4.750 1031 HB3 PHE 131 3HB PHE 131 9.084 -13.252 -4.919 1032 HD1 PHE 131 HD1 PHE 131 8.198 -14.573 -2.791 1033 HD2 PHE 131 HD2 PHE 131 7.316 -10.466 -3.604 1034 HE1 PHE 131 HE1 PHE 131 6.224 -14.700 -1.325 1035 HE2 PHE 131 HE2 PHE 131 5.347 -10.603 -2.135 1036 HZ PHE 131 HZ PHE 131 4.800 -12.719 -0.999 1037 H GLY 132 H GLY 132 12.768 -11.332 -3.328 1038 HA2 GLY 132 2HA GLY 132 14.784 -11.710 -4.460 1039 HA3 GLY 132 3HA GLY 132 13.953 -12.686 -5.662 1040 H ARG 133 H ARG 133 15.139 -9.583 -4.868 1041 HA ARG 133 HA ARG 133 14.934 -8.693 -7.578 1042 HB2 ARG 133 2HB ARG 133 13.738 -6.553 -7.159 1043 HB3 ARG 133 3HB ARG 133 12.703 -7.951 -6.903 1044 HG2 ARG 133 2HG ARG 133 12.946 -7.701 -4.459 1045 HG3 ARG 133 3HG ARG 133 14.011 -6.310 -4.701 1046 HD2 ARG 133 2HD ARG 133 12.205 -5.034 -5.718 1047 HD3 ARG 133 3HD ARG 133 11.139 -6.443 -5.700 1048 HE ARG 133 HE ARG 133 11.844 -6.001 -3.058 1049 HH11 ARG 133 1HH1 ARG 133 10.182 -4.122 -5.556 1050 HH12 ARG 133 2HH1 ARG 133 9.210 -3.267 -4.407 1051 HH21 ARG 133 1HH2 ARG 133 10.499 -4.912 -1.600 1052 HH22 ARG 133 2HH2 ARG 133 9.389 -3.711 -2.174 1053 H ASP 134 H ASP 134 15.753 -6.153 -7.505 1054 HA ASP 134 HA ASP 134 18.377 -6.384 -6.192 1055 HB2 ASP 134 2HB ASP 134 18.082 -5.979 -8.704 1056 HB3 ASP 134 3HB ASP 134 17.478 -4.377 -8.318 1057 HA PRO 135 HA PRO 135 17.563 -3.305 -2.957 1058 HB2 PRO 135 2HB PRO 135 20.019 -1.908 -3.003 1059 HB3 PRO 135 3HB PRO 135 19.693 -3.403 -2.105 1060 HG2 PRO 135 2HG PRO 135 20.939 -3.080 -4.823 1061 HG3 PRO 135 3HG PRO 135 21.434 -4.131 -3.470 1062 HD2 PRO 135 2HD PRO 135 20.103 -5.195 -5.490 1063 HD3 PRO 135 3HD PRO 135 19.651 -5.644 -3.828 1064 H LYS 136 H LYS 136 18.535 -2.146 -6.163 1065 HA LYS 136 HA LYS 136 17.991 0.616 -5.742 1066 HB2 LYS 136 2HB LYS 136 17.902 0.842 -8.182 1067 HB3 LYS 136 3HB LYS 136 19.241 -0.201 -7.720 1068 HG2 LYS 136 2HG LYS 136 17.828 -2.180 -8.317 1069 HG3 LYS 136 3HG LYS 136 16.570 -1.067 -8.860 1070 HD2 LYS 136 2HD LYS 136 17.825 -1.847 -10.794 1071 HD3 LYS 136 3HD LYS 136 18.162 -0.132 -10.556 1072 HE2 LYS 136 2HE LYS 136 20.309 -0.720 -9.470 1073 HE3 LYS 136 3HE LYS 136 19.951 -2.434 -9.707 1074 HZ1 LYS 136 3HZ LYS 136 21.464 -1.566 -11.391 1075 HZ2 LYS 136 1HZ LYS 136 20.299 -0.444 -11.886 1076 HZ3 LYS 136 2HZ LYS 136 20.019 -2.095 -12.081 1077 H TYR 137 H TYR 137 15.897 -2.099 -6.331 1078 HA TYR 137 HA TYR 137 13.494 -0.543 -6.878 1079 HB2 TYR 137 2HB TYR 137 13.928 -3.522 -6.391 1080 HB3 TYR 137 3HB TYR 137 12.404 -2.793 -6.893 1081 HD1 TYR 137 HD2 TYR 137 12.357 -1.503 -9.124 1082 HD2 TYR 137 HD1 TYR 137 15.539 -4.137 -8.037 1083 HE1 TYR 137 HE2 TYR 137 13.047 -1.648 -11.471 1084 HE2 TYR 137 HE1 TYR 137 16.239 -4.266 -10.386 1085 HH TYR 137 HH TYR 137 15.266 -3.970 -12.613 1086 H LEU 138 H LEU 138 15.076 -1.986 -4.147 1087 HA LEU 138 HA LEU 138 12.930 -1.985 -2.282 1088 HB2 LEU 138 2HB LEU 138 15.946 -1.752 -1.876 1089 HB3 LEU 138 3HB LEU 138 14.798 -2.008 -0.580 1090 HG LEU 138 HG LEU 138 15.451 -3.958 -2.817 1091 HD11 LEU 138 1HD1 LEU 138 15.975 -4.157 0.173 1092 HD12 LEU 138 2HD1 LEU 138 17.181 -3.812 -1.071 1093 HD13 LEU 138 3HD1 LEU 138 16.367 -5.371 -1.050 1094 HD21 LEU 138 3HD2 LEU 138 13.438 -4.268 -0.574 1095 HD22 LEU 138 1HD2 LEU 138 13.935 -5.535 -1.700 1096 HD23 LEU 138 2HD2 LEU 138 13.080 -4.116 -2.297 1097 H HIS 139 H HIS 139 11.811 -0.145 -1.801 1098 HA HIS 139 HA HIS 139 13.277 2.409 -1.316 1099 HB2 HIS 139 2HB HIS 139 10.566 2.042 -2.699 1100 HB3 HIS 139 3HB HIS 139 11.190 3.597 -2.158 1101 HD1 HIS 139 HD1 HIS 139 11.374 1.175 -4.938 1102 HD2 HIS 139 HD2 HIS 139 13.481 4.526 -3.665 1103 HE1 HIS 139 HE1 HIS 139 12.735 1.909 -6.914 1104 HE2 HIS 139 HE2 HIS 139 14.043 3.891 -6.099 1105 H GLN 140 H GLN 140 12.921 3.228 0.686 1106 HA GLN 140 HA GLN 140 10.986 2.072 2.513 1107 HB2 GLN 140 2HB GLN 140 12.778 4.524 2.900 1108 HB3 GLN 140 3HB GLN 140 11.856 3.719 4.161 1109 HG2 GLN 140 2HG GLN 140 13.223 1.691 3.883 1110 HG3 GLN 140 3HG GLN 140 14.142 2.486 2.608 1111 HE21 GLN 140 1HE2 GLN 140 15.089 1.378 5.131 1112 HE22 GLN 140 2HE2 GLN 140 15.890 2.659 5.955 1113 H PHE 141 H PHE 141 9.254 3.182 3.489 1114 HA PHE 141 HA PHE 141 8.072 5.491 2.159 1115 HB2 PHE 141 2HB PHE 141 7.195 4.167 4.769 1116 HB3 PHE 141 3HB PHE 141 6.227 5.199 3.718 1117 HD1 PHE 141 HD1 PHE 141 5.768 4.322 1.312 1118 HD2 PHE 141 HD2 PHE 141 7.092 1.822 4.523 1119 HE1 PHE 141 HE1 PHE 141 4.945 2.340 0.130 1120 HE2 PHE 141 HE2 PHE 141 6.257 -0.153 3.330 1121 HZ PHE 141 HZ PHE 141 5.186 0.106 1.124 1122 H GLU 142 H GLU 142 7.754 7.531 3.259 1123 HA GLU 142 HA GLU 142 9.903 8.183 5.157 1124 HB2 GLU 142 2HB GLU 142 8.063 9.935 3.483 1125 HB3 GLU 142 3HB GLU 142 9.173 10.580 4.695 1126 HG2 GLU 142 2HG GLU 142 11.073 9.487 3.493 1127 HG3 GLU 142 3HG GLU 142 9.941 8.957 2.250 1128 H GLY 143 H GLY 143 9.358 9.704 6.956 1129 HA2 GLY 143 2HA GLY 143 7.235 8.468 8.549 1130 HA3 GLY 143 3HA GLY 143 8.535 9.496 9.130 1131 H GLU 144 H GLU 144 5.695 9.781 6.914 1132 HA GLU 144 HA GLU 144 4.917 12.240 8.396 1133 HB2 GLU 144 2HB GLU 144 4.334 11.585 5.473 1134 HB3 GLU 144 3HB GLU 144 3.739 12.996 6.344 1135 HG2 GLU 144 2HG GLU 144 6.182 13.649 6.713 1136 HG3 GLU 144 3HG GLU 144 6.605 12.364 5.592 1137 H THR 145 H THR 145 3.151 10.086 6.137 1138 HA THR 145 HA THR 145 1.265 9.234 8.193 1139 HB THR 145 HB THR 145 0.395 11.024 5.873 1140 HG1 THR 145 HG1 THR 145 1.120 12.212 7.642 1141 HG21 THR 145 3HG2 THR 145 -1.379 9.624 7.911 1142 HG22 THR 145 1HG2 THR 145 -1.268 9.212 6.196 1143 HG23 THR 145 2HG2 THR 145 -1.907 10.777 6.686 1144 H PHE 146 H PHE 146 0.665 7.175 7.738 1145 HA PHE 146 HA PHE 146 1.199 6.015 5.111 1146 HB2 PHE 146 2HB PHE 146 0.491 4.847 7.825 1147 HB3 PHE 146 3HB PHE 146 0.331 3.865 6.373 1148 HD1 PHE 146 HD2 PHE 146 2.748 5.518 8.636 1149 HD2 PHE 146 HD1 PHE 146 2.285 3.138 5.111 1150 HE1 PHE 146 HE2 PHE 146 5.139 4.933 8.699 1151 HE2 PHE 146 HE1 PHE 146 4.665 2.567 5.186 1152 HZ PHE 146 HZ PHE 146 6.100 3.460 6.969 1153 H TYR 147 H TYR 147 -0.263 5.957 3.592 1154 HA TYR 147 HA TYR 147 -3.157 5.899 4.167 1155 HB2 TYR 147 2HB TYR 147 -1.550 6.546 1.661 1156 HB3 TYR 147 3HB TYR 147 -3.273 6.193 1.575 1157 HD1 TYR 147 HD1 TYR 147 -0.901 8.436 3.455 1158 HD2 TYR 147 HD2 TYR 147 -4.754 7.995 1.680 1159 HE1 TYR 147 HE1 TYR 147 -1.402 10.790 3.934 1160 HE2 TYR 147 HE2 TYR 147 -5.241 10.348 2.152 1161 HH TYR 147 HH TYR 147 -2.844 12.573 3.123 1162 H ILE 148 H ILE 148 -4.452 4.260 3.364 1163 HA ILE 148 HA ILE 148 -3.176 1.860 2.209 1164 HB ILE 148 HB ILE 148 -5.066 1.870 4.622 1165 HG12 ILE 148 2HG1 ILE 148 -2.126 1.055 4.373 1166 HG13 ILE 148 3HG1 ILE 148 -2.755 2.421 5.280 1167 HG21 ILE 148 1HG2 ILE 148 -3.899 -0.500 3.121 1168 HG22 ILE 148 2HG2 ILE 148 -5.588 0.014 3.091 1169 HG23 ILE 148 3HG2 ILE 148 -4.876 -0.584 4.587 1170 HD11 ILE 148 3HD1 ILE 148 -3.107 -0.496 5.924 1171 HD12 ILE 148 1HD1 ILE 148 -3.893 0.823 6.796 1172 HD13 ILE 148 2HD1 ILE 148 -2.137 0.692 6.788 1173 H ILE 149 H ILE 149 -4.261 1.238 0.446 1174 HA ILE 149 HA ILE 149 -6.901 2.432 -0.142 1175 HB ILE 149 HB ILE 149 -4.967 1.148 -2.132 1176 HG12 ILE 149 2HG1 ILE 149 -3.760 3.018 -1.148 1177 HG13 ILE 149 3HG1 ILE 149 -4.265 3.470 -2.767 1178 HG21 ILE 149 1HG2 ILE 149 -7.317 3.031 -2.584 1179 HG22 ILE 149 2HG2 ILE 149 -7.277 1.303 -2.945 1180 HG23 ILE 149 3HG2 ILE 149 -6.236 2.414 -3.836 1181 HD11 ILE 149 3HD1 ILE 149 -6.078 4.823 -1.805 1182 HD12 ILE 149 1HD1 ILE 149 -4.487 5.319 -1.231 1183 HD13 ILE 149 2HD1 ILE 149 -5.542 4.372 -0.186 1184 H GLU 150 H GLU 150 -8.630 1.123 -0.160 1185 HA GLU 150 HA GLU 150 -8.572 -1.728 0.034 1186 HB2 GLU 150 2HB GLU 150 -10.414 -0.398 0.999 1187 HB3 GLU 150 3HB GLU 150 -10.852 0.207 -0.595 1188 HG2 GLU 150 2HG GLU 150 -11.301 -2.284 -1.202 1189 HG3 GLU 150 3HG GLU 150 -11.214 -2.585 0.528 1190 H GLN 151 H GLN 151 -7.832 -2.883 -1.668 1191 HA GLN 151 HA GLN 151 -8.886 -2.354 -4.399 1192 HB2 GLN 151 2HB GLN 151 -6.274 -3.743 -3.601 1193 HB3 GLN 151 3HB GLN 151 -6.856 -3.531 -5.250 1194 HG2 GLN 151 2HG GLN 151 -6.593 -1.126 -5.099 1195 HG3 GLN 151 3HG GLN 151 -6.192 -1.233 -3.385 1196 HE21 GLN 151 1HE2 GLN 151 -4.636 -0.133 -5.626 1197 HE22 GLN 151 2HE2 GLN 151 -3.126 -0.968 -5.584 1198 H ARG 152 H ARG 152 -10.617 -3.662 -4.547 1199 HA ARG 152 HA ARG 152 -10.445 -6.478 -3.631 1200 HB2 ARG 152 2HB ARG 152 -12.689 -4.468 -3.330 1201 HB3 ARG 152 3HB ARG 152 -13.038 -6.196 -3.369 1202 HG2 ARG 152 2HG ARG 152 -11.708 -6.616 -1.434 1203 HG3 ARG 152 3HG ARG 152 -11.028 -4.988 -1.455 1204 HD2 ARG 152 2HD ARG 152 -12.715 -5.297 0.296 1205 HD3 ARG 152 3HD ARG 152 -13.155 -4.040 -0.857 1206 HE ARG 152 HE ARG 152 -14.299 -6.631 -1.435 1207 HH11 ARG 152 1HH1 ARG 152 -14.760 -3.632 0.378 1208 HH12 ARG 152 2HH1 ARG 152 -16.482 -3.832 0.493 1209 HH21 ARG 152 1HH2 ARG 152 -16.571 -6.845 -1.319 1210 HH22 ARG 152 2HH2 ARG 152 -17.503 -5.653 -0.469 1211 H LEU 153 H LEU 153 -10.786 -7.957 -5.126 1212 HA LEU 153 HA LEU 153 -11.532 -7.369 -7.835 1213 HB2 LEU 153 2HB LEU 153 -11.195 -10.025 -6.395 1214 HB3 LEU 153 3HB LEU 153 -11.475 -9.868 -8.120 1215 HG LEU 153 HG LEU 153 -9.002 -8.963 -6.595 1216 HD11 LEU 153 1HD1 LEU 153 -9.334 -11.112 -8.714 1217 HD12 LEU 153 2HD1 LEU 153 -9.109 -11.380 -6.984 1218 HD13 LEU 153 3HD1 LEU 153 -7.822 -10.640 -7.931 1219 HD21 LEU 153 3HD2 LEU 153 -9.449 -7.318 -8.342 1220 HD22 LEU 153 1HD2 LEU 153 -9.597 -8.597 -9.554 1221 HD23 LEU 153 2HD2 LEU 153 -8.046 -8.294 -8.766 1222 H GLU 154 H GLU 154 -13.258 -9.055 -8.798 1223 HA GLU 154 HA GLU 154 -15.405 -9.384 -9.314 1224 HB2 GLU 154 2HB GLU 154 -16.711 -10.769 -7.778 1225 HB3 GLU 154 3HB GLU 154 -15.024 -11.259 -7.760 1226 HG2 GLU 154 2HG GLU 154 -14.759 -9.944 -5.608 1227 HG3 GLU 154 3HG GLU 154 -16.498 -9.699 -5.624 1228 H HIS 155 H HIS 155 -14.737 -6.692 -8.026 1229 HA HIS 155 HA HIS 155 -17.447 -5.586 -8.027 1230 HB2 HIS 155 2HB HIS 155 -15.462 -5.246 -5.717 1231 HB3 HIS 155 3HB HIS 155 -16.765 -4.097 -6.002 1232 HD1 HIS 155 HD1 HIS 155 -19.078 -4.728 -5.217 1233 HD2 HIS 155 HD2 HIS 155 -16.348 -7.821 -4.758 1234 HE1 HIS 155 HE1 HIS 155 -20.239 -6.447 -3.807 1235 HE2 HIS 155 HE2 HIS 155 -18.569 -8.307 -3.540 1236 H HIS 156 H HIS 156 -15.753 -5.517 -10.091 1237 HA HIS 156 HA HIS 156 -13.755 -3.516 -10.091 1238 HB2 HIS 156 2HB HIS 156 -13.785 -3.737 -12.590 1239 HB3 HIS 156 3HB HIS 156 -13.629 -5.273 -11.752 1240 HD1 HIS 156 HD1 HIS 156 -15.570 -6.967 -12.003 1241 HD2 HIS 156 HD2 HIS 156 -16.177 -3.433 -14.107 1242 HE1 HIS 156 HE1 HIS 156 -17.499 -7.417 -13.541 1243 HE2 HIS 156 HE2 HIS 156 -17.872 -5.261 -14.771 1244 H HIS 157 H HIS 157 -13.911 -1.399 -10.102 1245 HA HIS 157 HA HIS 157 -14.548 0.750 -10.334 1246 HB2 HIS 157 2HB HIS 157 -16.289 -0.164 -12.664 1247 HB3 HIS 157 3HB HIS 157 -15.611 1.439 -12.412 1248 HD1 HIS 157 HD1 HIS 157 -12.803 1.401 -12.465 1249 HD2 HIS 157 HD2 HIS 157 -14.828 -1.675 -14.389 1250 HE1 HIS 157 HE1 HIS 157 -11.152 0.402 -14.075 1251 HE2 HIS 157 HE2 HIS 157 -12.470 -1.319 -15.350 1252 H HIS 158 H HIS 158 -16.114 -0.835 -8.470 1253 HA HIS 158 HA HIS 158 -18.894 -0.392 -8.750 1254 HB2 HIS 158 2HB HIS 158 -19.127 -1.204 -6.454 1255 HB3 HIS 158 3HB HIS 158 -17.945 -2.193 -7.304 1256 HD1 HIS 158 HD1 HIS 158 -15.348 -1.665 -6.624 1257 HD2 HIS 158 HD2 HIS 158 -18.257 -0.169 -4.063 1258 HE1 HIS 158 HE1 HIS 158 -14.135 -1.053 -4.510 1259 HE2 HIS 158 HE2 HIS 158 -15.941 -0.293 -2.944 1260 H HIS 159 H HIS 159 -19.643 1.611 -9.000 1261 HA HIS 159 HA HIS 159 -18.882 3.764 -7.105 1262 HB2 HIS 159 2HB HIS 159 -19.486 5.388 -8.935 1263 HB3 HIS 159 3HB HIS 159 -18.101 4.380 -9.310 1264 HD1 HIS 159 HD1 HIS 159 -21.759 4.757 -10.225 1265 HD2 HIS 159 HD2 HIS 159 -18.307 2.955 -11.672 1266 HE1 HIS 159 HE1 HIS 159 -22.338 3.929 -12.524 1267 HE2 HIS 159 HE2 HIS 159 -20.184 3.027 -13.445 1268 H HIS 160 H HIS 160 -20.698 2.037 -6.215 1269 HA HIS 160 HA HIS 160 -23.074 3.697 -5.880 1270 HB2 HIS 160 2HB HIS 160 -24.672 1.816 -6.357 1271 HB3 HIS 160 3HB HIS 160 -23.785 2.318 -7.792 1272 HD1 HIS 160 HD1 HIS 160 -21.988 0.650 -8.725 1273 HD2 HIS 160 HD2 HIS 160 -24.227 -0.849 -5.557 1274 HE1 HIS 160 HE1 HIS 160 -21.538 -1.820 -8.685 1275 HE2 HIS 160 HE2 HIS 160 -23.015 -2.713 -6.862 Start of MODEL 13 1 H1 MET 1 1H MET 1 -31.883 9.710 -4.561 2 H2 MET 1 2H MET 1 -32.371 11.257 -4.093 3 H3 MET 1 3H MET 1 -31.427 10.318 -3.054 4 HA MET 1 HA MET 1 -30.569 11.324 -5.691 5 HB2 MET 1 2HB MET 1 -29.885 12.270 -2.877 6 HB3 MET 1 3HB MET 1 -29.000 12.775 -4.309 7 HG2 MET 1 2HG MET 1 -31.052 13.814 -5.203 8 HG3 MET 1 3HG MET 1 -31.930 13.307 -3.759 9 HE1 MET 1 3HE MET 1 -28.183 14.638 -3.831 10 HE2 MET 1 1HE MET 1 -28.451 16.370 -3.630 11 HE3 MET 1 2HE MET 1 -28.964 15.568 -5.113 12 H VAL 2 H VAL 2 -29.854 9.258 -6.281 13 HA VAL 2 HA VAL 2 -27.357 8.364 -4.938 14 HB VAL 2 HB VAL 2 -27.785 6.054 -5.719 15 HG11 VAL 2 1HG1 VAL 2 -30.093 7.124 -4.051 16 HG12 VAL 2 2HG1 VAL 2 -28.506 6.633 -3.455 17 HG13 VAL 2 3HG1 VAL 2 -29.591 5.430 -4.153 18 HG21 VAL 2 3HG2 VAL 2 -29.982 5.357 -6.637 19 HG22 VAL 2 1HG2 VAL 2 -29.163 6.502 -7.702 20 HG23 VAL 2 2HG2 VAL 2 -30.498 7.047 -6.687 21 H GLU 3 H GLU 3 -25.644 7.907 -6.310 22 HA GLU 3 HA GLU 3 -25.909 8.681 -9.165 23 HB2 GLU 3 2HB GLU 3 -23.483 8.868 -7.304 24 HB3 GLU 3 3HB GLU 3 -23.472 9.264 -9.024 25 HG2 GLU 3 2HG GLU 3 -25.096 11.058 -8.660 26 HG3 GLU 3 3HG GLU 3 -25.182 10.648 -6.953 27 HA PRO 4 HA PRO 4 -24.719 4.503 -10.260 28 HB2 PRO 4 2HB PRO 4 -23.437 4.874 -12.665 29 HB3 PRO 4 3HB PRO 4 -25.185 5.111 -12.471 30 HG2 PRO 4 2HG PRO 4 -23.003 7.170 -12.487 31 HG3 PRO 4 3HG PRO 4 -24.572 7.191 -13.328 32 HD2 PRO 4 2HD PRO 4 -24.188 8.536 -10.996 33 HD3 PRO 4 3HD PRO 4 -25.754 7.802 -11.400 34 H GLY 5 H GLY 5 -22.421 3.653 -11.684 35 HA2 GLY 5 2HA GLY 5 -20.366 3.620 -9.669 36 HA3 GLY 5 3HA GLY 5 -20.301 2.881 -11.264 37 H VAL 6 H VAL 6 -20.395 6.116 -9.824 38 HA VAL 6 HA VAL 6 -18.781 7.368 -11.874 39 HB VAL 6 HB VAL 6 -19.048 9.432 -10.469 40 HG11 VAL 6 1HG1 VAL 6 -21.656 7.941 -10.983 41 HG12 VAL 6 2HG1 VAL 6 -20.756 8.900 -12.159 42 HG13 VAL 6 3HG1 VAL 6 -21.492 9.688 -10.764 43 HG21 VAL 6 3HG2 VAL 6 -20.609 7.620 -8.585 44 HG22 VAL 6 1HG2 VAL 6 -20.515 9.382 -8.468 45 HG23 VAL 6 2HG2 VAL 6 -19.066 8.403 -8.240 46 H ALA 7 H ALA 7 -18.155 5.562 -9.089 47 HA ALA 7 HA ALA 7 -15.641 6.620 -8.306 48 HB1 ALA 7 3HB ALA 7 -15.328 4.450 -7.153 49 HB2 ALA 7 1HB ALA 7 -16.753 3.808 -7.976 50 HB3 ALA 7 2HB ALA 7 -16.921 5.134 -6.824 51 H LYS 8 H LYS 8 -14.620 7.072 -10.296 52 HA LYS 8 HA LYS 8 -13.887 4.871 -12.100 53 HB2 LYS 8 2HB LYS 8 -14.788 7.077 -12.949 54 HB3 LYS 8 3HB LYS 8 -13.332 7.863 -12.350 55 HG2 LYS 8 2HG LYS 8 -11.964 6.521 -13.929 56 HG3 LYS 8 3HG LYS 8 -13.428 5.729 -14.525 57 HD2 LYS 8 2HD LYS 8 -14.282 7.850 -15.386 58 HD3 LYS 8 3HD LYS 8 -12.940 8.730 -14.654 59 HE2 LYS 8 2HE LYS 8 -12.521 8.522 -17.018 60 HE3 LYS 8 3HE LYS 8 -11.373 7.493 -16.167 61 HZ1 LYS 8 3HZ LYS 8 -13.849 6.595 -17.537 62 HZ2 LYS 8 1HZ LYS 8 -12.801 5.594 -16.676 63 HZ3 LYS 8 2HZ LYS 8 -12.267 6.370 -18.079 64 H LEU 9 H LEU 9 -12.801 4.697 -9.521 65 HA LEU 9 HA LEU 9 -10.036 5.427 -9.473 66 HB2 LEU 9 2HB LEU 9 -11.276 4.898 -7.393 67 HB3 LEU 9 3HB LEU 9 -11.558 3.259 -7.962 68 HG LEU 9 HG LEU 9 -9.066 2.855 -7.891 69 HD11 LEU 9 1HD1 LEU 9 -8.247 5.123 -8.097 70 HD12 LEU 9 2HD1 LEU 9 -7.621 4.371 -6.633 71 HD13 LEU 9 3HD1 LEU 9 -8.931 5.551 -6.526 72 HD21 LEU 9 3HD2 LEU 9 -10.329 3.640 -5.250 73 HD22 LEU 9 1HD2 LEU 9 -8.914 2.602 -5.456 74 HD23 LEU 9 2HD2 LEU 9 -10.482 2.082 -6.067 75 H THR 10 H THR 10 -9.286 4.850 -11.515 76 HA THR 10 HA THR 10 -9.461 2.092 -12.472 77 HB THR 10 HB THR 10 -8.126 4.472 -13.816 78 HG1 THR 10 HG1 THR 10 -10.367 4.853 -13.339 79 HG21 THR 10 3HG2 THR 10 -7.541 2.261 -14.807 80 HG22 THR 10 1HG2 THR 10 -8.496 3.249 -15.915 81 HG23 THR 10 2HG2 THR 10 -9.261 1.926 -15.034 82 H THR 11 H THR 11 -7.467 1.016 -13.235 83 HA THR 11 HA THR 11 -5.845 0.456 -11.068 84 HB THR 11 HB THR 11 -4.525 -0.938 -12.749 85 HG1 THR 11 HG1 THR 11 -4.950 -0.770 -14.838 86 HG21 THR 11 3HG2 THR 11 -6.488 -1.886 -11.578 87 HG22 THR 11 1HG2 THR 11 -6.388 -2.494 -13.233 88 HG23 THR 11 2HG2 THR 11 -7.554 -1.233 -12.825 89 H TYR 12 H TYR 12 -5.224 2.907 -13.508 90 HA TYR 12 HA TYR 12 -2.453 3.010 -13.586 91 HB2 TYR 12 2HB TYR 12 -2.637 5.331 -14.333 92 HB3 TYR 12 3HB TYR 12 -3.918 4.376 -15.059 93 HD1 TYR 12 HD2 TYR 12 -3.191 7.020 -12.540 94 HD2 TYR 12 HD1 TYR 12 -6.264 4.889 -14.595 95 HE1 TYR 12 HE2 TYR 12 -4.847 8.637 -11.739 96 HE2 TYR 12 HE1 TYR 12 -7.918 6.519 -13.793 97 HH TYR 12 HH TYR 12 -7.024 9.462 -12.255 98 H ALA 13 H ALA 13 -4.633 4.356 -11.160 99 HA ALA 13 HA ALA 13 -2.794 5.967 -9.727 100 HB1 ALA 13 3HB ALA 13 -5.245 6.229 -9.598 101 HB2 ALA 13 1HB ALA 13 -4.547 6.023 -7.992 102 HB3 ALA 13 2HB ALA 13 -5.376 4.673 -8.774 103 H SER 14 H SER 14 -3.650 2.602 -9.590 104 HA SER 14 HA SER 14 -2.393 2.002 -7.079 105 HB2 SER 14 2HB SER 14 -3.380 0.118 -9.261 106 HB3 SER 14 3HB SER 14 -3.030 -0.309 -7.585 107 HG SER 14 HG SER 14 -4.776 1.769 -7.727 108 H LYS 15 H LYS 15 -1.567 1.726 -10.522 109 HA LYS 15 HA LYS 15 0.805 0.149 -10.196 110 HB2 LYS 15 2HB LYS 15 0.199 1.996 -12.550 111 HB3 LYS 15 3HB LYS 15 1.243 0.581 -12.547 112 HG2 LYS 15 2HG LYS 15 -1.769 0.632 -12.355 113 HG3 LYS 15 3HG LYS 15 -0.808 0.087 -13.724 114 HD2 LYS 15 2HD LYS 15 0.048 -1.804 -12.350 115 HD3 LYS 15 3HD LYS 15 -0.937 -1.248 -10.990 116 HE2 LYS 15 2HE LYS 15 -2.983 -1.652 -12.261 117 HE3 LYS 15 3HE LYS 15 -2.047 -2.099 -13.688 118 HZ1 LYS 15 3HZ LYS 15 -1.149 -3.979 -12.422 119 HZ2 LYS 15 1HZ LYS 15 -2.832 -4.054 -12.556 120 HZ3 LYS 15 2HZ LYS 15 -2.121 -3.562 -11.107 121 H GLN 16 H GLN 16 0.078 3.567 -10.458 122 HA GLN 16 HA GLN 16 2.778 4.484 -10.592 123 HB2 GLN 16 2HB GLN 16 0.138 5.930 -10.192 124 HB3 GLN 16 3HB GLN 16 1.686 6.772 -10.236 125 HG2 GLN 16 2HG GLN 16 0.571 5.055 -12.476 126 HG3 GLN 16 3HG GLN 16 0.531 6.815 -12.427 127 HE21 GLN 16 1HE2 GLN 16 1.801 4.981 -14.372 128 HE22 GLN 16 2HE2 GLN 16 3.471 5.418 -14.414 129 H ALA 17 H ALA 17 0.576 3.816 -7.938 130 HA ALA 17 HA ALA 17 2.034 5.146 -5.888 131 HB1 ALA 17 3HB ALA 17 0.859 3.635 -4.334 132 HB2 ALA 17 1HB ALA 17 0.336 2.636 -5.698 133 HB3 ALA 17 2HB ALA 17 -0.248 4.292 -5.541 134 H THR 18 H THR 18 2.122 1.792 -7.097 135 HA THR 18 HA THR 18 4.429 1.016 -5.617 136 HB THR 18 HB THR 18 4.357 -0.952 -7.411 137 HG1 THR 18 HG1 THR 18 2.924 -0.060 -8.875 138 HG21 THR 18 3HG2 THR 18 2.103 -0.568 -5.408 139 HG22 THR 18 1HG2 THR 18 3.711 -1.187 -5.021 140 HG23 THR 18 2HG2 THR 18 2.648 -2.101 -6.090 141 H ASP 19 H ASP 19 4.064 2.799 -8.525 142 HA ASP 19 HA ASP 19 6.507 2.294 -9.825 143 HB2 ASP 19 2HB ASP 19 4.618 3.597 -10.822 144 HB3 ASP 19 3HB ASP 19 4.962 4.924 -9.717 145 H MET 20 H MET 20 5.683 4.568 -7.192 146 HA MET 20 HA MET 20 8.446 5.456 -6.892 147 HB2 MET 20 2HB MET 20 5.863 6.187 -5.491 148 HB3 MET 20 3HB MET 20 7.404 6.632 -4.769 149 HG2 MET 20 2HG MET 20 6.742 8.536 -5.969 150 HG3 MET 20 3HG MET 20 7.946 7.772 -7.000 151 HE1 MET 20 3HE MET 20 3.435 8.062 -7.803 152 HE2 MET 20 1HE MET 20 4.321 8.914 -6.540 153 HE3 MET 20 2HE MET 20 4.026 7.180 -6.398 154 H GLY 21 H GLY 21 6.996 2.639 -6.033 155 HA2 GLY 21 2HA GLY 21 8.132 0.900 -4.932 156 HA3 GLY 21 3HA GLY 21 9.074 2.076 -4.029 157 H ALA 22 H ALA 22 5.614 1.364 -4.449 158 HA ALA 22 HA ALA 22 5.177 1.345 -1.537 159 HB1 ALA 22 3HB ALA 22 3.132 1.366 -3.785 160 HB2 ALA 22 1HB ALA 22 3.646 2.772 -2.848 161 HB3 ALA 22 2HB ALA 22 2.776 1.456 -2.055 162 H ILE 23 H ILE 23 3.444 -0.365 -0.870 163 HA ILE 23 HA ILE 23 4.210 -2.989 -2.052 164 HB ILE 23 HB ILE 23 4.042 -3.972 0.236 165 HG12 ILE 23 2HG1 ILE 23 3.740 -1.085 1.204 166 HG13 ILE 23 3HG1 ILE 23 2.494 -2.323 1.269 167 HG21 ILE 23 1HG2 ILE 23 6.257 -3.298 -0.605 168 HG22 ILE 23 2HG2 ILE 23 6.164 -3.098 1.145 169 HG23 ILE 23 3HG2 ILE 23 6.044 -1.688 0.090 170 HD11 ILE 23 3HD1 ILE 23 3.473 -1.978 3.446 171 HD12 ILE 23 1HD1 ILE 23 5.086 -2.328 2.820 172 HD13 ILE 23 2HD1 ILE 23 3.858 -3.597 2.867 173 H TYR 24 H TYR 24 2.575 -4.427 -2.479 174 HA TYR 24 HA TYR 24 -0.193 -3.825 -1.632 175 HB2 TYR 24 2HB TYR 24 0.919 -5.942 -3.536 176 HB3 TYR 24 3HB TYR 24 -0.775 -5.832 -3.079 177 HD1 TYR 24 HD1 TYR 24 -1.971 -3.546 -3.625 178 HD2 TYR 24 HD2 TYR 24 1.629 -4.860 -5.512 179 HE1 TYR 24 HE1 TYR 24 -2.453 -2.101 -5.555 180 HE2 TYR 24 HE2 TYR 24 1.156 -3.404 -7.433 181 HH TYR 24 HH TYR 24 -0.896 -0.948 -7.456 182 H VAL 25 H VAL 25 -0.792 -4.703 0.258 183 HA VAL 25 HA VAL 25 0.400 -7.259 1.162 184 HB VAL 25 HB VAL 25 -0.088 -6.635 3.458 185 HG11 VAL 25 1HG1 VAL 25 1.477 -4.743 3.785 186 HG12 VAL 25 2HG1 VAL 25 1.388 -4.373 2.060 187 HG13 VAL 25 3HG1 VAL 25 2.075 -5.907 2.601 188 HG21 VAL 25 3HG2 VAL 25 -2.157 -5.349 3.172 189 HG22 VAL 25 1HG2 VAL 25 -1.258 -4.017 2.443 190 HG23 VAL 25 2HG2 VAL 25 -0.996 -4.440 4.137 191 H ASN 26 H ASN 26 -1.158 -8.551 2.567 192 HA ASN 26 HA ASN 26 -3.828 -8.673 1.302 193 HB2 ASN 26 2HB ASN 26 -4.002 -10.909 2.309 194 HB3 ASN 26 3HB ASN 26 -2.499 -10.778 1.409 195 HD21 ASN 26 1HD2 ASN 26 -3.332 -12.541 3.621 196 HD22 ASN 26 2HD2 ASN 26 -2.087 -12.378 4.812 197 H SER 27 H SER 27 -5.399 -9.750 3.175 198 HA SER 27 HA SER 27 -6.170 -7.598 4.843 199 HB2 SER 27 2HB SER 27 -7.764 -9.269 3.909 200 HB3 SER 27 3HB SER 27 -7.091 -10.498 4.974 201 HG SER 27 HG SER 27 -7.685 -8.533 6.560 202 H LYS 28 H LYS 28 -3.854 -10.101 5.376 203 HA LYS 28 HA LYS 28 -3.861 -9.805 8.279 204 HB2 LYS 28 2HB LYS 28 -1.899 -11.265 6.449 205 HB3 LYS 28 3HB LYS 28 -1.847 -11.289 8.210 206 HG2 LYS 28 2HG LYS 28 -4.039 -12.436 6.449 207 HG3 LYS 28 3HG LYS 28 -2.865 -13.336 7.415 208 HD2 LYS 28 2HD LYS 28 -3.848 -12.242 9.481 209 HD3 LYS 28 3HD LYS 28 -5.109 -11.560 8.449 210 HE2 LYS 28 2HE LYS 28 -5.896 -13.573 9.591 211 HE3 LYS 28 3HE LYS 28 -5.838 -13.839 7.847 212 HZ1 LYS 28 3HZ LYS 28 -3.826 -15.069 8.089 213 HZ2 LYS 28 1HZ LYS 28 -4.945 -15.695 9.190 214 HZ3 LYS 28 2HZ LYS 28 -3.703 -14.686 9.728 215 H GLY 29 H GLY 29 -2.000 -8.683 5.492 216 HA2 GLY 29 2HA GLY 29 -0.930 -6.552 5.425 217 HA3 GLY 29 3HA GLY 29 -0.674 -6.628 7.166 218 H ASP 30 H ASP 30 0.046 -8.559 4.271 219 HA ASP 30 HA ASP 30 2.925 -8.368 4.755 220 HB2 ASP 30 2HB ASP 30 2.307 -10.484 5.885 221 HB3 ASP 30 3HB ASP 30 1.486 -11.045 4.434 222 H ARG 31 H ARG 31 4.139 -8.635 2.842 223 HA ARG 31 HA ARG 31 2.849 -7.509 0.586 224 HB2 ARG 31 2HB ARG 31 5.689 -8.525 0.980 225 HB3 ARG 31 3HB ARG 31 5.143 -7.850 -0.550 226 HG2 ARG 31 2HG ARG 31 6.279 -6.110 0.591 227 HG3 ARG 31 3HG ARG 31 4.561 -5.726 0.682 228 HD2 ARG 31 2HD ARG 31 5.657 -5.260 2.817 229 HD3 ARG 31 3HD ARG 31 4.508 -6.586 3.000 230 HE ARG 31 HE ARG 31 6.239 -7.924 3.650 231 HH11 ARG 31 1HH1 ARG 31 7.659 -5.279 1.796 232 HH12 ARG 31 2HH1 ARG 31 9.284 -5.789 2.093 233 HH21 ARG 31 1HH2 ARG 31 8.412 -8.572 3.997 234 HH22 ARG 31 2HH2 ARG 31 9.709 -7.634 3.326 235 H ILE 32 H ILE 32 1.401 -8.746 -0.481 236 HA ILE 32 HA ILE 32 1.886 -11.497 -1.238 237 HB ILE 32 HB ILE 32 -0.231 -11.339 -2.508 238 HG12 ILE 32 2HG1 ILE 32 -0.350 -8.414 -1.602 239 HG13 ILE 32 3HG1 ILE 32 -0.025 -8.943 -3.247 240 HG21 ILE 32 1HG2 ILE 32 -0.416 -10.214 0.312 241 HG22 ILE 32 2HG2 ILE 32 -0.289 -11.919 -0.125 242 HG23 ILE 32 3HG2 ILE 32 -1.727 -11.002 -0.571 243 HD11 ILE 32 3HD1 ILE 32 -2.306 -8.223 -3.041 244 HD12 ILE 32 1HD1 ILE 32 -2.592 -9.358 -1.720 245 HD13 ILE 32 2HD1 ILE 32 -2.262 -9.958 -3.348 246 H VAL 33 H VAL 33 2.447 -8.369 -2.624 247 HA VAL 33 HA VAL 33 4.235 -9.479 -4.554 248 HB VAL 33 HB VAL 33 2.176 -9.722 -5.878 249 HG11 VAL 33 1HG1 VAL 33 0.790 -7.821 -6.564 250 HG12 VAL 33 2HG1 VAL 33 1.743 -6.746 -5.537 251 HG13 VAL 33 3HG1 VAL 33 0.779 -8.035 -4.811 252 HG21 VAL 33 3HG2 VAL 33 4.229 -9.168 -7.104 253 HG22 VAL 33 1HG2 VAL 33 3.875 -7.445 -6.962 254 HG23 VAL 33 2HG2 VAL 33 2.815 -8.491 -7.912 255 H ASN 34 H ASN 34 5.728 -7.952 -5.284 256 HA ASN 34 HA ASN 34 6.057 -5.630 -3.596 257 HB2 ASN 34 2HB ASN 34 8.308 -5.439 -4.713 258 HB3 ASN 34 3HB ASN 34 8.019 -6.987 -3.934 259 HD21 ASN 34 1HD2 ASN 34 9.791 -6.052 -6.206 260 HD22 ASN 34 2HD2 ASN 34 9.525 -7.222 -7.450 261 H GLU 35 H GLU 35 7.277 -5.048 -6.820 262 HA GLU 35 HA GLU 35 5.611 -2.784 -7.313 263 HB2 GLU 35 2HB GLU 35 7.703 -4.272 -8.930 264 HB3 GLU 35 3HB GLU 35 6.740 -3.011 -9.689 265 HG2 GLU 35 2HG GLU 35 8.953 -2.217 -8.947 266 HG3 GLU 35 3HG GLU 35 7.620 -1.339 -8.203 267 H SER 36 H SER 36 4.243 -2.505 -9.126 268 HA SER 36 HA SER 36 2.515 -4.756 -9.791 269 HB2 SER 36 2HB SER 36 1.190 -2.942 -10.976 270 HB3 SER 36 3HB SER 36 1.436 -2.631 -9.258 271 HG SER 36 HG SER 36 3.026 -1.543 -11.346 272 H ASN 37 H ASN 37 4.557 -5.717 -10.785 273 HA ASN 37 HA ASN 37 5.665 -4.826 -13.220 274 HB2 ASN 37 2HB ASN 37 5.482 -7.613 -11.987 275 HB3 ASN 37 3HB ASN 37 6.377 -7.286 -13.464 276 HD21 ASN 37 1HD2 ASN 37 6.258 -6.688 -10.004 277 HD22 ASN 37 2HD2 ASN 37 7.895 -6.155 -9.855 278 H VAL 38 H VAL 38 2.976 -7.002 -12.537 279 HA VAL 38 HA VAL 38 1.608 -6.104 -14.914 280 HB VAL 38 HB VAL 38 2.874 -8.050 -15.815 281 HG11 VAL 38 1HG1 VAL 38 2.413 -10.350 -15.088 282 HG12 VAL 38 2HG1 VAL 38 1.386 -9.742 -13.785 283 HG13 VAL 38 3HG1 VAL 38 3.115 -9.384 -13.787 284 HG21 VAL 38 3HG2 VAL 38 -0.125 -8.545 -15.657 285 HG22 VAL 38 1HG2 VAL 38 0.970 -9.240 -16.858 286 HG23 VAL 38 2HG2 VAL 38 0.705 -7.499 -16.811 287 H TYR 39 H TYR 39 -0.670 -6.374 -14.725 288 HA TYR 39 HA TYR 39 -1.820 -6.434 -12.157 289 HB2 TYR 39 2HB TYR 39 -4.018 -6.561 -13.323 290 HB3 TYR 39 3HB TYR 39 -2.960 -5.346 -14.025 291 HD1 TYR 39 HD1 TYR 39 -4.598 -8.634 -14.634 292 HD2 TYR 39 HD2 TYR 39 -2.092 -5.600 -16.315 293 HE1 TYR 39 HE1 TYR 39 -4.914 -9.600 -16.871 294 HE2 TYR 39 HE2 TYR 39 -2.410 -6.577 -18.544 295 HH TYR 39 HH TYR 39 -3.018 -8.672 -19.557 296 H THR 40 H THR 40 -1.076 -8.983 -14.381 297 HA THR 40 HA THR 40 -2.820 -10.988 -13.543 298 HB THR 40 HB THR 40 -0.028 -11.436 -14.707 299 HG1 THR 40 HG1 THR 40 -1.048 -11.197 -16.742 300 HG21 THR 40 3HG2 THR 40 -2.609 -13.029 -14.964 301 HG22 THR 40 1HG2 THR 40 -1.203 -13.493 -14.001 302 HG23 THR 40 2HG2 THR 40 -1.077 -13.411 -15.759 303 H THR 41 H THR 41 0.593 -10.328 -12.508 304 HA THR 41 HA THR 41 0.792 -12.540 -10.735 305 HB THR 41 HB THR 41 2.822 -11.386 -11.599 306 HG1 THR 41 HG1 THR 41 2.569 -11.480 -8.750 307 HG21 THR 41 3HG2 THR 41 3.640 -9.301 -10.523 308 HG22 THR 41 1HG2 THR 41 2.097 -9.140 -9.680 309 HG23 THR 41 2HG2 THR 41 2.158 -9.029 -11.440 310 H PHE 42 H PHE 42 -0.380 -9.258 -10.309 311 HA PHE 42 HA PHE 42 -0.581 -9.239 -7.469 312 HB2 PHE 42 2HB PHE 42 -0.586 -7.130 -8.655 313 HB3 PHE 42 3HB PHE 42 -1.949 -7.617 -9.653 314 HD1 PHE 42 HD1 PHE 42 -1.286 -7.442 -5.932 315 HD2 PHE 42 HD2 PHE 42 -3.882 -6.390 -9.167 316 HE1 PHE 42 HE1 PHE 42 -2.819 -6.345 -4.356 317 HE2 PHE 42 HE2 PHE 42 -5.408 -5.294 -7.578 318 HZ PHE 42 HZ PHE 42 -4.879 -5.273 -5.174 319 H ARG 43 H ARG 43 -2.938 -9.910 -10.065 320 HA ARG 43 HA ARG 43 -5.185 -10.399 -8.432 321 HB2 ARG 43 2HB ARG 43 -5.304 -9.872 -10.872 322 HB3 ARG 43 3HB ARG 43 -4.590 -11.440 -11.240 323 HG2 ARG 43 2HG ARG 43 -6.562 -12.562 -10.232 324 HG3 ARG 43 3HG ARG 43 -7.278 -10.983 -9.898 325 HD2 ARG 43 2HD ARG 43 -7.201 -10.516 -12.382 326 HD3 ARG 43 3HD ARG 43 -6.664 -12.180 -12.613 327 HE ARG 43 HE ARG 43 -8.813 -12.899 -11.641 328 HH11 ARG 43 1HH1 ARG 43 -8.602 -9.642 -12.970 329 HH12 ARG 43 2HH1 ARG 43 -10.307 -9.513 -13.272 330 HH21 ARG 43 1HH2 ARG 43 -11.048 -12.723 -12.026 331 HH22 ARG 43 2HH2 ARG 43 -11.694 -11.277 -12.732 332 H ASN 44 H ASN 44 -2.789 -12.576 -9.906 333 HA ASN 44 HA ASN 44 -3.840 -15.052 -9.099 334 HB2 ASN 44 2HB ASN 44 -0.904 -14.341 -9.589 335 HB3 ASN 44 3HB ASN 44 -1.532 -15.982 -9.457 336 HD21 ASN 44 1HD2 ASN 44 -0.077 -15.019 -11.638 337 HD22 ASN 44 2HD2 ASN 44 -1.101 -15.022 -13.035 338 H ALA 45 H ALA 45 -1.546 -12.836 -7.532 339 HA ALA 45 HA ALA 45 -0.793 -14.419 -5.331 340 HB1 ALA 45 3HB ALA 45 0.398 -12.373 -6.005 341 HB2 ALA 45 1HB ALA 45 -0.054 -12.312 -4.302 342 HB3 ALA 45 2HB ALA 45 -0.971 -11.383 -5.493 343 H ILE 46 H ILE 46 -3.563 -12.220 -5.767 344 HA ILE 46 HA ILE 46 -4.610 -12.315 -3.117 345 HB ILE 46 HB ILE 46 -6.024 -11.767 -5.773 346 HG12 ILE 46 2HG1 ILE 46 -4.926 -9.819 -3.688 347 HG13 ILE 46 3HG1 ILE 46 -4.201 -10.155 -5.255 348 HG21 ILE 46 1HG2 ILE 46 -7.825 -10.705 -4.443 349 HG22 ILE 46 2HG2 ILE 46 -7.029 -11.217 -2.955 350 HG23 ILE 46 3HG2 ILE 46 -7.673 -12.425 -4.068 351 HD11 ILE 46 3HD1 ILE 46 -5.398 -8.068 -5.293 352 HD12 ILE 46 1HD1 ILE 46 -6.885 -8.868 -4.786 353 HD13 ILE 46 2HD1 ILE 46 -6.178 -9.231 -6.363 354 H LEU 47 H LEU 47 -5.286 -14.183 -6.072 355 HA LEU 47 HA LEU 47 -7.341 -15.848 -4.981 356 HB2 LEU 47 2HB LEU 47 -5.585 -16.336 -7.417 357 HB3 LEU 47 3HB LEU 47 -7.094 -17.163 -7.059 358 HG LEU 47 HG LEU 47 -6.814 -14.200 -7.718 359 HD11 LEU 47 1HD1 LEU 47 -7.928 -16.454 -9.408 360 HD12 LEU 47 2HD1 LEU 47 -6.410 -15.589 -9.671 361 HD13 LEU 47 3HD1 LEU 47 -7.943 -14.736 -9.821 362 HD21 LEU 47 3HD2 LEU 47 -9.333 -15.816 -7.198 363 HD22 LEU 47 1HD2 LEU 47 -9.277 -14.149 -7.778 364 HD23 LEU 47 2HD2 LEU 47 -8.670 -14.540 -6.171 365 H LYS 48 H LYS 48 -3.910 -15.978 -5.052 366 HA LYS 48 HA LYS 48 -3.462 -18.766 -4.462 367 HB2 LYS 48 2HB LYS 48 -1.865 -17.411 -5.739 368 HB3 LYS 48 3HB LYS 48 -1.731 -16.251 -4.428 369 HG2 LYS 48 2HG LYS 48 -0.681 -18.105 -3.051 370 HG3 LYS 48 3HG LYS 48 -0.635 -19.068 -4.537 371 HD2 LYS 48 2HD LYS 48 0.694 -17.260 -5.644 372 HD3 LYS 48 3HD LYS 48 0.667 -16.340 -4.135 373 HE2 LYS 48 2HE LYS 48 1.951 -19.044 -4.547 374 HE3 LYS 48 3HE LYS 48 2.786 -17.497 -4.415 375 HZ1 LYS 48 3HZ LYS 48 2.868 -18.653 -2.323 376 HZ2 LYS 48 1HZ LYS 48 1.184 -18.808 -2.288 377 HZ3 LYS 48 2HZ LYS 48 1.891 -17.287 -2.158 378 H GLN 49 H GLN 49 -3.625 -15.731 -2.726 379 HA GLN 49 HA GLN 49 -2.746 -16.603 -0.161 380 HB2 GLN 49 2HB GLN 49 -2.620 -14.249 -0.851 381 HB3 GLN 49 3HB GLN 49 -4.363 -14.174 -1.075 382 HG2 GLN 49 2HG GLN 49 -3.651 -13.018 0.973 383 HG3 GLN 49 3HG GLN 49 -4.718 -14.374 1.329 384 HE21 GLN 49 1HE2 GLN 49 -4.038 -14.597 3.420 385 HE22 GLN 49 2HE2 GLN 49 -2.469 -15.167 3.868 386 H ALA 50 H ALA 50 -4.027 -16.905 1.733 387 HA ALA 50 HA ALA 50 -6.286 -18.510 1.673 388 HB1 ALA 50 3HB ALA 50 -6.521 -17.990 4.090 389 HB2 ALA 50 1HB ALA 50 -5.393 -16.641 3.911 390 HB3 ALA 50 2HB ALA 50 -4.839 -18.298 3.662 391 H ASP 51 H ASP 51 -6.193 -15.044 2.572 392 HA ASP 51 HA ASP 51 -9.050 -14.685 2.204 393 HB2 ASP 51 2HB ASP 51 -8.625 -12.326 2.877 394 HB3 ASP 51 3HB ASP 51 -7.948 -13.474 4.025 395 H LYS 52 H LYS 52 -9.597 -12.511 0.950 396 HA LYS 52 HA LYS 52 -8.557 -12.762 -1.802 397 HB2 LYS 52 2HB LYS 52 -11.473 -12.852 -0.907 398 HB3 LYS 52 3HB LYS 52 -10.994 -12.593 -2.583 399 HG2 LYS 52 2HG LYS 52 -10.255 -15.032 -0.941 400 HG3 LYS 52 3HG LYS 52 -11.604 -14.964 -2.080 401 HD2 LYS 52 2HD LYS 52 -10.185 -14.869 -3.967 402 HD3 LYS 52 3HD LYS 52 -8.814 -14.255 -3.040 403 HE2 LYS 52 2HE LYS 52 -9.915 -17.077 -2.810 404 HE3 LYS 52 3HE LYS 52 -8.508 -16.610 -3.774 405 HZ1 LYS 52 3HZ LYS 52 -7.804 -17.442 -1.658 406 HZ2 LYS 52 1HZ LYS 52 -8.789 -16.350 -0.833 407 HZ3 LYS 52 2HZ LYS 52 -7.464 -15.787 -1.720 408 H VAL 53 H VAL 53 -8.406 -10.637 0.462 409 HA VAL 53 HA VAL 53 -8.994 -8.388 -1.359 410 HB VAL 53 HB VAL 53 -10.811 -8.350 0.267 411 HG11 VAL 53 1HG1 VAL 53 -9.784 -9.553 2.123 412 HG12 VAL 53 2HG1 VAL 53 -10.502 -8.037 2.664 413 HG13 VAL 53 3HG1 VAL 53 -8.749 -8.168 2.479 414 HG21 VAL 53 3HG2 VAL 53 -8.846 -6.089 0.799 415 HG22 VAL 53 1HG2 VAL 53 -10.590 -6.037 1.085 416 HG23 VAL 53 2HG2 VAL 53 -9.968 -6.197 -0.559 417 H ALA 54 H ALA 54 -7.392 -7.056 -1.609 418 HA ALA 54 HA ALA 54 -4.925 -7.313 -0.022 419 HB1 ALA 54 3HB ALA 54 -5.362 -6.248 -2.841 420 HB2 ALA 54 1HB ALA 54 -4.714 -7.834 -2.420 421 HB3 ALA 54 2HB ALA 54 -3.801 -6.379 -2.019 422 H TYR 55 H TYR 55 -3.666 -5.201 0.005 423 HA TYR 55 HA TYR 55 -5.229 -2.747 0.224 424 HB2 TYR 55 2HB TYR 55 -3.725 -3.993 2.579 425 HB3 TYR 55 3HB TYR 55 -4.263 -2.319 2.539 426 HD1 TYR 55 HD1 TYR 55 -6.716 -1.785 2.569 427 HD2 TYR 55 HD2 TYR 55 -5.312 -5.792 3.090 428 HE1 TYR 55 HE1 TYR 55 -8.897 -2.431 3.493 429 HE2 TYR 55 HE2 TYR 55 -7.501 -6.431 4.016 430 HH TYR 55 HH TYR 55 -10.249 -4.379 3.839 431 H LEU 56 H LEU 56 -4.068 -1.443 -1.021 432 HA LEU 56 HA LEU 56 -1.204 -1.699 -1.397 433 HB2 LEU 56 2HB LEU 56 -2.610 -1.198 -3.312 434 HB3 LEU 56 3HB LEU 56 -3.287 0.212 -2.517 435 HG LEU 56 HG LEU 56 -1.138 1.390 -2.693 436 HD11 LEU 56 1HD1 LEU 56 0.768 0.489 -3.954 437 HD12 LEU 56 2HD1 LEU 56 -0.042 -1.076 -4.061 438 HD13 LEU 56 3HD1 LEU 56 0.445 -0.439 -2.490 439 HD21 LEU 56 3HD2 LEU 56 -2.739 1.599 -4.512 440 HD22 LEU 56 1HD2 LEU 56 -2.040 0.196 -5.323 441 HD23 LEU 56 2HD2 LEU 56 -1.095 1.672 -5.131 442 H VAL 57 H VAL 57 -0.036 -1.037 0.288 443 HA VAL 57 HA VAL 57 -0.729 1.369 1.833 444 HB VAL 57 HB VAL 57 1.377 -0.773 2.416 445 HG11 VAL 57 1HG1 VAL 57 0.304 1.432 4.215 446 HG12 VAL 57 2HG1 VAL 57 1.914 1.365 3.495 447 HG13 VAL 57 3HG1 VAL 57 1.438 0.167 4.699 448 HG21 VAL 57 3HG2 VAL 57 -1.421 -0.496 3.575 449 HG22 VAL 57 1HG2 VAL 57 -0.203 -1.667 4.094 450 HG23 VAL 57 2HG2 VAL 57 -0.873 -1.753 2.463 451 H MET 58 H MET 58 0.360 3.236 1.484 452 HA MET 58 HA MET 58 3.177 3.204 0.642 453 HB2 MET 58 2HB MET 58 2.907 4.805 -1.117 454 HB3 MET 58 3HB MET 58 1.681 3.584 -1.412 455 HG2 MET 58 2HG MET 58 1.161 6.266 -0.110 456 HG3 MET 58 3HG MET 58 0.899 5.905 -1.811 457 HE1 MET 58 3HE MET 58 -2.042 3.357 -1.673 458 HE2 MET 58 1HE MET 58 -0.317 3.041 -1.829 459 HE3 MET 58 2HE MET 58 -1.055 4.373 -2.724 460 H ASP 59 H ASP 59 4.054 5.511 0.807 461 HA ASP 59 HA ASP 59 3.264 6.847 3.295 462 HB2 ASP 59 2HB ASP 59 5.316 8.244 2.841 463 HB3 ASP 59 3HB ASP 59 5.670 6.519 2.889 464 H GLU 60 H GLU 60 3.133 9.285 3.218 465 HA GLU 60 HA GLU 60 0.976 10.001 1.521 466 HB2 GLU 60 2HB GLU 60 1.187 10.844 3.850 467 HB3 GLU 60 3HB GLU 60 2.564 11.830 3.368 468 HG2 GLU 60 2HG GLU 60 1.162 13.152 1.878 469 HG3 GLU 60 3HG GLU 60 -0.220 12.107 2.179 470 H ARG 61 H ARG 61 4.460 10.584 1.230 471 HA ARG 61 HA ARG 61 4.431 12.792 -0.564 472 HB2 ARG 61 2HB ARG 61 6.460 10.522 -0.734 473 HB3 ARG 61 3HB ARG 61 6.699 12.208 -1.165 474 HG2 ARG 61 2HG ARG 61 6.364 11.144 1.653 475 HG3 ARG 61 3HG ARG 61 7.897 11.538 0.883 476 HD2 ARG 61 2HD ARG 61 6.985 13.929 0.633 477 HD3 ARG 61 3HD ARG 61 5.695 13.434 1.737 478 HE ARG 61 HE ARG 61 8.588 13.435 2.374 479 HH11 ARG 61 1HH1 ARG 61 5.259 13.662 3.531 480 HH12 ARG 61 2HH1 ARG 61 5.741 13.978 5.170 481 HH21 ARG 61 1HH2 ARG 61 9.187 13.813 4.485 482 HH22 ARG 61 2HH2 ARG 61 7.964 14.061 5.698 483 H THR 62 H THR 62 4.460 9.297 -1.060 484 HA THR 62 HA THR 62 4.252 9.203 -3.875 485 HB THR 62 HB THR 62 3.525 7.166 -1.720 486 HG1 THR 62 HG1 THR 62 5.649 7.226 -1.609 487 HG21 THR 62 3HG2 THR 62 2.384 6.541 -3.836 488 HG22 THR 62 1HG2 THR 62 3.696 5.420 -3.448 489 HG23 THR 62 2HG2 THR 62 3.922 6.651 -4.690 490 H TRP 63 H TRP 63 1.806 9.296 -1.283 491 HA TRP 63 HA TRP 63 -0.487 8.835 -2.866 492 HB2 TRP 63 2HB TRP 63 -0.771 8.599 -0.506 493 HB3 TRP 63 3HB TRP 63 -0.141 10.211 -0.178 494 HD1 TRP 63 HD1 TRP 63 -1.881 12.167 -0.071 495 HE1 TRP 63 HE1 TRP 63 -4.418 12.366 -0.393 496 HE3 TRP 63 HE3 TRP 63 -2.834 7.525 -2.026 497 HZ2 TRP 63 HZ2 TRP 63 -6.541 10.793 -1.346 498 HZ3 TRP 63 HZ3 TRP 63 -5.154 6.961 -2.624 499 HH2 TRP 63 HH2 TRP 63 -6.972 8.561 -2.290 500 H LYS 64 H LYS 64 1.292 11.860 -2.141 501 HA LYS 64 HA LYS 64 -0.538 13.750 -3.031 502 HB2 LYS 64 2HB LYS 64 2.490 13.803 -3.345 503 HB3 LYS 64 3HB LYS 64 1.443 15.206 -3.537 504 HG2 LYS 64 2HG LYS 64 1.958 13.639 -1.004 505 HG3 LYS 64 3HG LYS 64 2.480 15.285 -1.372 506 HD2 LYS 64 2HD LYS 64 -0.013 15.891 -1.520 507 HD3 LYS 64 3HD LYS 64 -0.350 14.299 -0.842 508 HE2 LYS 64 2HE LYS 64 0.936 14.863 1.175 509 HE3 LYS 64 3HE LYS 64 1.349 16.432 0.480 510 HZ1 LYS 64 3HZ LYS 64 -1.031 16.979 0.468 511 HZ2 LYS 64 1HZ LYS 64 -0.457 16.670 2.029 512 HZ3 LYS 64 2HZ LYS 64 -1.369 15.507 1.220 513 H LYS 65 H LYS 65 1.470 11.568 -4.879 514 HA LYS 65 HA LYS 65 0.916 12.748 -7.456 515 HB2 LYS 65 2HB LYS 65 2.076 10.014 -6.777 516 HB3 LYS 65 3HB LYS 65 2.081 10.764 -8.370 517 HG2 LYS 65 2HG LYS 65 3.543 11.774 -5.915 518 HG3 LYS 65 3HG LYS 65 4.271 10.939 -7.285 519 HD2 LYS 65 2HD LYS 65 2.951 13.677 -7.344 520 HD3 LYS 65 3HD LYS 65 4.680 13.341 -7.418 521 HE2 LYS 65 2HE LYS 65 4.276 12.078 -9.553 522 HE3 LYS 65 3HE LYS 65 2.600 12.631 -9.505 523 HZ1 LYS 65 3HZ LYS 65 5.032 14.317 -9.729 524 HZ2 LYS 65 1HZ LYS 65 3.483 14.934 -9.470 525 HZ3 LYS 65 2HZ LYS 65 3.827 14.092 -10.892 526 H VAL 66 H VAL 66 -0.223 9.889 -5.632 527 HA VAL 66 HA VAL 66 -1.873 8.755 -7.618 528 HB VAL 66 HB VAL 66 -2.174 8.563 -4.574 529 HG11 VAL 66 1HG1 VAL 66 -3.318 6.733 -6.727 530 HG12 VAL 66 2HG1 VAL 66 -4.241 7.834 -5.700 531 HG13 VAL 66 3HG1 VAL 66 -3.407 6.456 -4.984 532 HG21 VAL 66 3HG2 VAL 66 -0.879 6.457 -4.773 533 HG22 VAL 66 1HG2 VAL 66 0.054 7.846 -5.334 534 HG23 VAL 66 2HG2 VAL 66 -0.674 6.743 -6.504 535 H TYR 67 H TYR 67 -2.816 10.735 -4.816 536 HA TYR 67 HA TYR 67 -5.455 11.294 -5.272 537 HB2 TYR 67 2HB TYR 67 -4.231 11.948 -3.230 538 HB3 TYR 67 3HB TYR 67 -3.296 13.128 -4.133 539 HD1 TYR 67 HD1 TYR 67 -6.745 12.316 -2.974 540 HD2 TYR 67 HD2 TYR 67 -4.148 15.384 -4.428 541 HE1 TYR 67 HE1 TYR 67 -8.454 14.002 -2.468 542 HE2 TYR 67 HE2 TYR 67 -5.868 17.077 -3.921 543 HH TYR 67 HH TYR 67 -8.583 16.431 -2.008 544 H ASP 68 H ASP 68 -2.624 13.015 -6.543 545 HA ASP 68 HA ASP 68 -3.905 15.115 -7.903 546 HB2 ASP 68 2HB ASP 68 -1.479 15.170 -7.446 547 HB3 ASP 68 3HB ASP 68 -1.214 13.784 -8.493 548 H LEU 69 H LEU 69 -2.801 11.925 -9.029 549 HA LEU 69 HA LEU 69 -3.438 12.236 -11.767 550 HB2 LEU 69 2HB LEU 69 -2.950 9.761 -10.068 551 HB3 LEU 69 3HB LEU 69 -3.170 9.692 -11.810 552 HG LEU 69 HG LEU 69 -0.920 11.189 -10.406 553 HD11 LEU 69 1HD1 LEU 69 0.558 9.408 -11.235 554 HD12 LEU 69 2HD1 LEU 69 -0.838 8.524 -11.857 555 HD13 LEU 69 3HD1 LEU 69 -0.657 8.785 -10.121 556 HD21 LEU 69 3HD2 LEU 69 -1.375 10.679 -13.364 557 HD22 LEU 69 1HD2 LEU 69 0.055 11.430 -12.652 558 HD23 LEU 69 2HD2 LEU 69 -1.509 12.233 -12.534 559 H LEU 70 H LEU 70 -5.274 11.054 -9.013 560 HA LEU 70 HA LEU 70 -7.464 9.862 -10.296 561 HB2 LEU 70 2HB LEU 70 -7.321 11.384 -7.661 562 HB3 LEU 70 3HB LEU 70 -8.746 10.496 -8.180 563 HG LEU 70 HG LEU 70 -6.015 9.286 -7.599 564 HD11 LEU 70 1HD1 LEU 70 -8.595 9.079 -6.016 565 HD12 LEU 70 2HD1 LEU 70 -7.159 10.001 -5.559 566 HD13 LEU 70 3HD1 LEU 70 -7.079 8.244 -5.657 567 HD21 LEU 70 3HD2 LEU 70 -7.106 7.104 -7.922 568 HD22 LEU 70 1HD2 LEU 70 -7.116 8.068 -9.397 569 HD23 LEU 70 2HD2 LEU 70 -8.589 7.915 -8.435 570 H ILE 71 H ILE 71 -7.128 13.191 -9.086 571 HA ILE 71 HA ILE 71 -9.506 14.228 -10.253 572 HB ILE 71 HB ILE 71 -7.023 15.765 -9.341 573 HG12 ILE 71 2HG1 ILE 71 -9.508 14.981 -7.740 574 HG13 ILE 71 3HG1 ILE 71 -7.904 14.284 -7.546 575 HG21 ILE 71 1HG2 ILE 71 -8.534 17.151 -10.718 576 HG22 ILE 71 2HG2 ILE 71 -8.542 17.694 -9.040 577 HG23 ILE 71 3HG2 ILE 71 -9.890 16.739 -9.664 578 HD11 ILE 71 3HD1 ILE 71 -7.061 16.463 -6.818 579 HD12 ILE 71 1HD1 ILE 71 -8.361 15.855 -5.794 580 HD13 ILE 71 2HD1 ILE 71 -8.692 17.129 -6.967 581 H LEU 72 H LEU 72 -6.216 13.897 -11.361 582 HA LEU 72 HA LEU 72 -6.161 15.772 -13.459 583 HB2 LEU 72 2HB LEU 72 -4.184 14.716 -12.345 584 HB3 LEU 72 3HB LEU 72 -4.554 13.197 -13.125 585 HG LEU 72 HG LEU 72 -2.619 14.589 -14.082 586 HD11 LEU 72 1HD1 LEU 72 -3.551 12.690 -15.304 587 HD12 LEU 72 2HD1 LEU 72 -3.020 13.970 -16.388 588 HD13 LEU 72 3HD1 LEU 72 -4.742 13.749 -16.067 589 HD21 LEU 72 3HD2 LEU 72 -3.689 16.799 -14.017 590 HD22 LEU 72 1HD2 LEU 72 -4.865 16.289 -15.233 591 HD23 LEU 72 2HD2 LEU 72 -3.151 16.407 -15.647 592 H HIS 73 H HIS 73 -7.013 12.281 -13.430 593 HA HIS 73 HA HIS 73 -7.700 12.328 -16.269 594 HB2 HIS 73 2HB HIS 73 -7.737 10.154 -14.156 595 HB3 HIS 73 3HB HIS 73 -8.500 9.904 -15.721 596 HD1 HIS 73 HD1 HIS 73 -7.021 9.403 -17.685 597 HD2 HIS 73 HD2 HIS 73 -4.858 10.454 -14.294 598 HE1 HIS 73 HE1 HIS 73 -4.629 8.904 -18.235 599 HE2 HIS 73 HE2 HIS 73 -3.340 9.540 -16.172 600 H ASP 74 H ASP 74 -9.613 11.375 -13.359 601 HA ASP 74 HA ASP 74 -11.853 13.009 -13.703 602 HB2 ASP 74 2HB ASP 74 -12.064 10.396 -15.247 603 HB3 ASP 74 3HB ASP 74 -13.501 11.007 -14.446 604 H PHE 75 H PHE 75 -11.383 12.944 -11.430 605 HA PHE 75 HA PHE 75 -13.175 11.298 -9.981 606 HB2 PHE 75 2HB PHE 75 -11.060 9.767 -10.386 607 HB3 PHE 75 3HB PHE 75 -10.289 10.764 -9.162 608 HD1 PHE 75 HD2 PHE 75 -13.685 9.171 -9.518 609 HD2 PHE 75 HD1 PHE 75 -10.179 9.623 -7.116 610 HE1 PHE 75 HE2 PHE 75 -14.656 7.712 -7.805 611 HE2 PHE 75 HE1 PHE 75 -11.157 8.147 -5.423 612 HZ PHE 75 HZ PHE 75 -13.395 7.190 -5.763 613 H THR 76 H THR 76 -13.941 13.154 -9.138 614 HA THR 76 HA THR 76 -12.358 15.456 -8.615 615 HB THR 76 HB THR 76 -14.859 15.260 -9.419 616 HG1 THR 76 HG1 THR 76 -14.288 17.295 -9.284 617 HG21 THR 76 3HG2 THR 76 -15.763 14.021 -7.480 618 HG22 THR 76 1HG2 THR 76 -16.567 15.583 -7.663 619 HG23 THR 76 2HG2 THR 76 -15.339 15.361 -6.416 620 HA PRO 77 HA PRO 77 -11.032 14.990 -4.366 621 HB2 PRO 77 2HB PRO 77 -11.747 17.495 -3.235 622 HB3 PRO 77 3HB PRO 77 -10.254 17.134 -4.124 623 HG2 PRO 77 2HG PRO 77 -12.774 18.392 -5.134 624 HG3 PRO 77 3HG PRO 77 -11.080 18.799 -5.494 625 HD2 PRO 77 2HD PRO 77 -12.519 17.420 -7.268 626 HD3 PRO 77 3HD PRO 77 -10.817 16.987 -6.978 627 H GLU 78 H GLU 78 -14.322 16.357 -4.684 628 HA GLU 78 HA GLU 78 -15.269 15.700 -2.119 629 HB2 GLU 78 2HB GLU 78 -16.774 16.110 -4.732 630 HB3 GLU 78 3HB GLU 78 -17.600 15.780 -3.214 631 HG2 GLU 78 2HG GLU 78 -16.588 17.829 -2.228 632 HG3 GLU 78 3HG GLU 78 -15.810 18.174 -3.772 633 H GLU 79 H GLU 79 -15.043 13.712 -5.043 634 HA GLU 79 HA GLU 79 -16.477 11.469 -4.023 635 HB2 GLU 79 2HB GLU 79 -14.421 11.724 -6.264 636 HB3 GLU 79 3HB GLU 79 -15.173 10.192 -5.848 637 HG2 GLU 79 2HG GLU 79 -16.637 12.669 -6.789 638 HG3 GLU 79 3HG GLU 79 -16.285 11.242 -7.765 639 H ILE 80 H ILE 80 -13.007 12.155 -4.307 640 HA ILE 80 HA ILE 80 -11.919 9.847 -3.241 641 HB ILE 80 HB ILE 80 -10.781 12.671 -2.942 642 HG12 ILE 80 2HG1 ILE 80 -10.421 10.696 -5.256 643 HG13 ILE 80 3HG1 ILE 80 -11.437 12.129 -5.303 644 HG21 ILE 80 1HG2 ILE 80 -9.344 9.981 -2.988 645 HG22 ILE 80 2HG2 ILE 80 -9.588 10.996 -1.566 646 HG23 ILE 80 3HG2 ILE 80 -8.566 11.563 -2.886 647 HD11 ILE 80 3HD1 ILE 80 -9.374 12.526 -6.459 648 HD12 ILE 80 1HD1 ILE 80 -8.439 12.083 -5.029 649 HD13 ILE 80 2HD1 ILE 80 -9.447 13.533 -5.013 650 H LYS 81 H LYS 81 -12.906 12.804 -1.507 651 HA LYS 81 HA LYS 81 -11.940 11.930 1.043 652 HB2 LYS 81 2HB LYS 81 -12.843 14.007 1.924 653 HB3 LYS 81 3HB LYS 81 -11.979 14.303 0.420 654 HG2 LYS 81 2HG LYS 81 -14.299 14.244 -0.716 655 HG3 LYS 81 3HG LYS 81 -14.963 14.379 0.914 656 HD2 LYS 81 2HD LYS 81 -13.082 16.360 -0.440 657 HD3 LYS 81 3HD LYS 81 -14.807 16.590 -0.155 658 HE2 LYS 81 2HE LYS 81 -12.692 16.323 2.014 659 HE3 LYS 81 3HE LYS 81 -13.434 17.829 1.481 660 HZ1 LYS 81 3HZ LYS 81 -14.821 15.561 2.799 661 HZ2 LYS 81 1HZ LYS 81 -15.589 16.937 2.199 662 HZ3 LYS 81 2HZ LYS 81 -14.492 17.071 3.472 663 H SER 82 H SER 82 -14.933 11.426 -0.651 664 HA SER 82 HA SER 82 -16.652 10.893 1.562 665 HB2 SER 82 2HB SER 82 -16.765 9.829 -1.289 666 HB3 SER 82 3HB SER 82 -18.068 9.687 -0.113 667 HG SER 82 HG SER 82 -17.400 11.776 -1.687 668 H PHE 83 H PHE 83 -14.229 8.954 -0.091 669 HA PHE 83 HA PHE 83 -15.078 6.422 1.027 670 HB2 PHE 83 2HB PHE 83 -12.529 7.198 -0.441 671 HB3 PHE 83 3HB PHE 83 -12.916 5.553 0.067 672 HD1 PHE 83 HD2 PHE 83 -14.900 4.371 -0.940 673 HD2 PHE 83 HD1 PHE 83 -13.534 8.137 -2.430 674 HE1 PHE 83 HE2 PHE 83 -16.177 4.016 -3.015 675 HE2 PHE 83 HE1 PHE 83 -14.818 7.779 -4.494 676 HZ PHE 83 HZ PHE 83 -16.140 5.724 -4.790 677 H PHE 84 H PHE 84 -13.209 9.038 2.220 678 HA PHE 84 HA PHE 84 -11.863 7.530 4.306 679 HB2 PHE 84 2HB PHE 84 -12.352 10.526 3.984 680 HB3 PHE 84 3HB PHE 84 -11.431 9.820 5.306 681 HD1 PHE 84 HD1 PHE 84 -11.463 10.316 1.619 682 HD2 PHE 84 HD2 PHE 84 -9.116 9.212 5.009 683 HE1 PHE 84 HE1 PHE 84 -9.428 10.460 0.249 684 HE2 PHE 84 HE2 PHE 84 -7.080 9.346 3.629 685 HZ PHE 84 HZ PHE 84 -7.230 9.971 1.253 686 H GLU 85 H GLU 85 -14.996 8.888 3.796 687 HA GLU 85 HA GLU 85 -15.824 8.820 6.597 688 HB2 GLU 85 2HB GLU 85 -17.429 9.373 4.059 689 HB3 GLU 85 3HB GLU 85 -18.028 9.556 5.704 690 HG2 GLU 85 2HG GLU 85 -15.781 11.152 4.444 691 HG3 GLU 85 3HG GLU 85 -17.427 11.718 4.717 692 H ASN 86 H ASN 86 -15.634 6.671 7.171 693 HA ASN 86 HA ASN 86 -16.812 4.551 5.563 694 HB2 ASN 86 2HB ASN 86 -15.854 3.044 7.322 695 HB3 ASN 86 3HB ASN 86 -14.673 4.072 6.527 696 HD21 ASN 86 1HD2 ASN 86 -16.193 3.267 9.535 697 HD22 ASN 86 2HD2 ASN 86 -15.231 4.293 10.539 698 H LYS 87 H LYS 87 -18.994 4.687 5.625 699 HA LYS 87 HA LYS 87 -20.325 4.127 8.233 700 HB2 LYS 87 2HB LYS 87 -21.481 5.580 5.813 701 HB3 LYS 87 3HB LYS 87 -22.378 5.151 7.267 702 HG2 LYS 87 2HG LYS 87 -20.944 6.649 8.614 703 HG3 LYS 87 3HG LYS 87 -20.024 7.067 7.163 704 HD2 LYS 87 2HD LYS 87 -21.693 8.816 7.697 705 HD3 LYS 87 3HD LYS 87 -22.037 8.059 6.140 706 HE2 LYS 87 2HE LYS 87 -23.726 6.594 7.322 707 HE3 LYS 87 3HE LYS 87 -23.448 7.548 8.781 708 HZ1 LYS 87 3HZ LYS 87 -25.378 8.339 7.596 709 HZ2 LYS 87 1HZ LYS 87 -24.468 8.585 6.191 710 HZ3 LYS 87 2HZ LYS 87 -24.168 9.516 7.563 711 H GLY 88 H GLY 88 -20.139 3.441 4.774 712 HA2 GLY 88 2HA GLY 88 -22.271 1.550 4.603 713 HA3 GLY 88 3HA GLY 88 -21.010 1.823 3.414 714 H LYS 89 H LYS 89 -18.888 0.811 3.803 715 HA LYS 89 HA LYS 89 -19.057 -1.687 5.405 716 HB2 LYS 89 2HB LYS 89 -17.380 -1.215 2.888 717 HB3 LYS 89 3HB LYS 89 -17.458 -2.714 3.804 718 HG2 LYS 89 2HG LYS 89 -19.722 -1.455 2.229 719 HG3 LYS 89 3HG LYS 89 -18.785 -2.868 1.746 720 HD2 LYS 89 2HD LYS 89 -20.637 -2.690 4.157 721 HD3 LYS 89 3HD LYS 89 -21.003 -3.493 2.631 722 HE2 LYS 89 2HE LYS 89 -19.167 -5.101 3.036 723 HE3 LYS 89 3HE LYS 89 -18.799 -4.294 4.564 724 HZ1 LYS 89 3HZ LYS 89 -20.164 -6.291 4.877 725 HZ2 LYS 89 1HZ LYS 89 -21.384 -5.618 3.916 726 HZ3 LYS 89 2HZ LYS 89 -20.978 -4.901 5.386 727 H ARG 90 H ARG 90 -16.273 -0.084 3.902 728 HA ARG 90 HA ARG 90 -15.090 0.659 6.484 729 HB2 ARG 90 2HB ARG 90 -13.870 -1.318 4.492 730 HB3 ARG 90 3HB ARG 90 -12.896 -0.454 5.677 731 HG2 ARG 90 2HG ARG 90 -14.273 -1.485 7.494 732 HG3 ARG 90 3HG ARG 90 -15.114 -2.434 6.266 733 HD2 ARG 90 2HD ARG 90 -12.148 -2.536 6.897 734 HD3 ARG 90 3HD ARG 90 -13.360 -3.755 7.315 735 HE ARG 90 HE ARG 90 -12.856 -3.068 4.497 736 HH11 ARG 90 1HH1 ARG 90 -12.769 -5.462 7.071 737 HH12 ARG 90 2HH1 ARG 90 -12.466 -6.780 5.987 738 HH21 ARG 90 1HH2 ARG 90 -12.443 -4.740 3.096 739 HH22 ARG 90 2HH2 ARG 90 -12.277 -6.366 3.697 740 HA PRO 91 HA PRO 91 -13.455 3.951 3.905 741 HB2 PRO 91 2HB PRO 91 -10.973 4.530 4.958 742 HB3 PRO 91 3HB PRO 91 -12.498 4.985 5.741 743 HG2 PRO 91 2HG PRO 91 -10.615 2.803 6.444 744 HG3 PRO 91 3HG PRO 91 -11.685 3.750 7.494 745 HD2 PRO 91 2HD PRO 91 -12.186 1.139 6.585 746 HD3 PRO 91 3HD PRO 91 -13.391 2.235 7.286 747 H VAL 92 H VAL 92 -13.044 3.459 1.856 748 HA VAL 92 HA VAL 92 -11.254 1.440 0.935 749 HB VAL 92 HB VAL 92 -12.566 3.706 -0.642 750 HG11 VAL 92 1HG1 VAL 92 -12.181 2.317 -2.657 751 HG12 VAL 92 2HG1 VAL 92 -11.294 1.142 -1.681 752 HG13 VAL 92 3HG1 VAL 92 -10.663 2.777 -1.884 753 HG21 VAL 92 3HG2 VAL 92 -14.288 2.037 -1.264 754 HG22 VAL 92 1HG2 VAL 92 -14.234 2.287 0.483 755 HG23 VAL 92 2HG2 VAL 92 -13.514 0.838 -0.224 756 H PHE 93 H PHE 93 -11.038 4.936 1.310 757 HA PHE 93 HA PHE 93 -8.110 4.809 0.850 758 HB2 PHE 93 2HB PHE 93 -9.911 7.273 0.836 759 HB3 PHE 93 3HB PHE 93 -8.182 7.249 0.505 760 HD1 PHE 93 HD1 PHE 93 -8.217 4.735 -1.325 761 HD2 PHE 93 HD2 PHE 93 -10.616 8.270 -1.215 762 HE1 PHE 93 HE1 PHE 93 -8.663 4.513 -3.729 763 HE2 PHE 93 HE2 PHE 93 -11.061 8.036 -3.617 764 HZ PHE 93 HZ PHE 93 -10.088 6.160 -4.879 765 H VAL 94 H VAL 94 -7.116 4.550 2.751 766 HA VAL 94 HA VAL 94 -8.194 5.812 5.218 767 HB VAL 94 HB VAL 94 -6.197 3.490 5.169 768 HG11 VAL 94 1HG1 VAL 94 -6.980 3.111 7.467 769 HG12 VAL 94 2HG1 VAL 94 -8.108 4.461 7.323 770 HG13 VAL 94 3HG1 VAL 94 -6.368 4.756 7.271 771 HG21 VAL 94 3HG2 VAL 94 -9.219 3.219 5.322 772 HG22 VAL 94 1HG2 VAL 94 -8.054 1.915 5.576 773 HG23 VAL 94 2HG2 VAL 94 -8.191 2.683 3.990 774 H LYS 95 H LYS 95 -6.591 6.757 6.672 775 HA LYS 95 HA LYS 95 -3.850 7.128 5.786 776 HB2 LYS 95 2HB LYS 95 -3.917 9.564 5.762 777 HB3 LYS 95 3HB LYS 95 -5.053 8.917 4.584 778 HG2 LYS 95 2HG LYS 95 -6.934 9.405 6.057 779 HG3 LYS 95 3HG LYS 95 -5.841 9.970 7.324 780 HD2 LYS 95 2HD LYS 95 -6.075 11.237 4.560 781 HD3 LYS 95 3HD LYS 95 -6.898 11.832 6.002 782 HE2 LYS 95 2HE LYS 95 -4.777 12.351 7.068 783 HE3 LYS 95 3HE LYS 95 -3.882 11.581 5.752 784 HZ1 LYS 95 3HZ LYS 95 -3.960 14.030 5.610 785 HZ2 LYS 95 1HZ LYS 95 -5.631 13.958 5.400 786 HZ3 LYS 95 2HZ LYS 95 -4.599 13.268 4.247 787 H GLY 96 H GLY 96 -2.764 8.772 7.348 788 HA2 GLY 96 2HA GLY 96 -2.768 9.678 9.632 789 HA3 GLY 96 3HA GLY 96 -3.565 8.191 10.159 790 H SER 97 H SER 97 -1.784 7.819 11.632 791 HA SER 97 HA SER 97 0.874 7.260 10.668 792 HB2 SER 97 2HB SER 97 0.316 7.880 13.043 793 HB3 SER 97 3HB SER 97 -0.465 6.314 13.242 794 HG SER 97 HG SER 97 2.269 6.798 12.623 795 H LEU 98 H LEU 98 1.828 4.956 10.945 796 HA LEU 98 HA LEU 98 0.729 3.216 9.075 797 HB2 LEU 98 2HB LEU 98 3.093 3.118 9.684 798 HB3 LEU 98 3HB LEU 98 2.695 2.691 11.338 799 HG LEU 98 HG LEU 98 1.855 0.470 10.560 800 HD11 LEU 98 1HD1 LEU 98 2.840 1.306 7.818 801 HD12 LEU 98 2HD1 LEU 98 1.161 1.039 8.294 802 HD13 LEU 98 3HD1 LEU 98 2.293 -0.311 8.276 803 HD21 LEU 98 3HD2 LEU 98 4.709 1.079 9.719 804 HD22 LEU 98 1HD2 LEU 98 4.049 -0.524 10.062 805 HD23 LEU 98 2HD2 LEU 98 4.163 0.674 11.349 806 H GLU 99 H GLU 99 0.757 2.845 12.622 807 HA GLU 99 HA GLU 99 -0.854 0.506 12.737 808 HB2 GLU 99 2HB GLU 99 -0.219 2.526 14.940 809 HB3 GLU 99 3HB GLU 99 -0.862 0.898 15.189 810 HG2 GLU 99 2HG GLU 99 1.177 -0.085 14.242 811 HG3 GLU 99 3HG GLU 99 1.812 1.517 13.890 812 H SER 100 H SER 100 -1.565 3.945 12.966 813 HA SER 100 HA SER 100 -4.207 3.887 13.942 814 HB2 SER 100 2HB SER 100 -2.876 5.923 12.085 815 HB3 SER 100 3HB SER 100 -4.341 6.202 13.013 816 HG SER 100 HG SER 100 -2.492 5.325 14.697 817 H ALA 101 H ALA 101 -2.944 4.011 10.625 818 HA ALA 101 HA ALA 101 -5.415 3.989 9.242 819 HB1 ALA 101 3HB ALA 101 -3.339 4.849 8.242 820 HB2 ALA 101 1HB ALA 101 -4.037 3.580 7.237 821 HB3 ALA 101 2HB ALA 101 -2.642 3.226 8.262 822 H ALA 102 H ALA 102 -3.360 1.512 10.557 823 HA ALA 102 HA ALA 102 -4.389 -0.737 9.145 824 HB1 ALA 102 3HB ALA 102 -3.202 -2.052 10.844 825 HB2 ALA 102 1HB ALA 102 -2.969 -0.597 11.824 826 HB3 ALA 102 2HB ALA 102 -2.191 -0.736 10.248 827 H GLU 103 H GLU 103 -5.169 0.828 12.233 828 HA GLU 103 HA GLU 103 -7.109 -1.043 13.169 829 HB2 GLU 103 2HB GLU 103 -6.862 1.930 13.821 830 HB3 GLU 103 3HB GLU 103 -7.750 0.734 14.766 831 HG2 GLU 103 2HG GLU 103 -5.690 -0.412 15.344 832 HG3 GLU 103 3HG GLU 103 -4.762 0.650 14.299 833 H GLN 104 H GLN 104 -7.356 1.991 11.369 834 HA GLN 104 HA GLN 104 -10.179 2.176 11.225 835 HB2 GLN 104 2HB GLN 104 -8.009 3.365 9.461 836 HB3 GLN 104 3HB GLN 104 -9.710 3.824 9.372 837 HG2 GLN 104 2HG GLN 104 -9.641 4.701 11.643 838 HG3 GLN 104 3HG GLN 104 -7.992 4.118 11.856 839 HE21 GLN 104 1HE2 GLN 104 -6.292 5.226 10.865 840 HE22 GLN 104 2HE2 GLN 104 -6.475 6.810 10.209 841 H ALA 105 H ALA 105 -7.803 0.716 9.008 842 HA ALA 105 HA ALA 105 -9.811 -0.193 7.114 843 HB1 ALA 105 3HB ALA 105 -7.932 -1.319 5.996 844 HB2 ALA 105 1HB ALA 105 -6.875 -0.946 7.367 845 HB3 ALA 105 2HB ALA 105 -7.526 0.356 6.370 846 H GLY 106 H GLY 106 -8.434 -1.362 10.075 847 HA2 GLY 106 2HA GLY 106 -9.089 -3.103 11.428 848 HA3 GLY 106 3HA GLY 106 -10.263 -3.582 10.213 849 H ILE 107 H ILE 107 -6.907 -3.213 9.416 850 HA ILE 107 HA ILE 107 -6.571 -6.009 8.689 851 HB ILE 107 HB ILE 107 -4.413 -3.833 8.682 852 HG12 ILE 107 2HG1 ILE 107 -6.331 -4.410 6.377 853 HG13 ILE 107 3HG1 ILE 107 -6.462 -3.020 7.453 854 HG21 ILE 107 1HG2 ILE 107 -4.742 -6.304 6.932 855 HG22 ILE 107 2HG2 ILE 107 -3.619 -6.143 8.284 856 HG23 ILE 107 3HG2 ILE 107 -3.417 -5.139 6.849 857 HD11 ILE 107 3HD1 ILE 107 -4.157 -3.609 5.594 858 HD12 ILE 107 1HD1 ILE 107 -4.269 -2.227 6.694 859 HD13 ILE 107 2HD1 ILE 107 -5.422 -2.402 5.372 860 H VAL 108 H VAL 108 -4.710 -7.312 9.588 861 HA VAL 108 HA VAL 108 -4.486 -7.190 12.430 862 HB VAL 108 HB VAL 108 -2.718 -8.767 10.509 863 HG11 VAL 108 1HG1 VAL 108 -3.287 -9.229 13.458 864 HG12 VAL 108 2HG1 VAL 108 -1.775 -8.626 12.770 865 HG13 VAL 108 3HG1 VAL 108 -2.311 -10.269 12.415 866 HG21 VAL 108 3HG2 VAL 108 -5.338 -9.615 11.794 867 HG22 VAL 108 1HG2 VAL 108 -4.260 -10.671 10.875 868 HG23 VAL 108 2HG2 VAL 108 -5.058 -9.313 10.078 869 H VAL 109 H VAL 109 -3.607 -5.393 13.205 870 HA VAL 109 HA VAL 109 -1.690 -3.716 12.106 871 HB VAL 109 HB VAL 109 -2.313 -4.068 15.086 872 HG11 VAL 109 1HG1 VAL 109 -0.220 -2.797 14.760 873 HG12 VAL 109 2HG1 VAL 109 -1.498 -1.757 15.388 874 HG13 VAL 109 3HG1 VAL 109 -1.055 -1.675 13.681 875 HG21 VAL 109 3HG2 VAL 109 -3.559 -2.138 13.090 876 HG22 VAL 109 1HG2 VAL 109 -3.916 -2.213 14.818 877 HG23 VAL 109 2HG2 VAL 109 -4.345 -3.565 13.766 878 H ASP 110 H ASP 110 -1.306 -6.419 14.343 879 HA ASP 110 HA ASP 110 1.381 -6.044 15.051 880 HB2 ASP 110 2HB ASP 110 -0.262 -7.534 16.256 881 HB3 ASP 110 3HB ASP 110 -0.108 -8.712 14.957 882 H GLU 111 H GLU 111 -0.055 -7.947 12.384 883 HA GLU 111 HA GLU 111 2.379 -9.108 11.486 884 HB2 GLU 111 2HB GLU 111 -0.247 -8.647 10.016 885 HB3 GLU 111 3HB GLU 111 1.119 -9.485 9.292 886 HG2 GLU 111 2HG GLU 111 -0.440 -10.366 11.728 887 HG3 GLU 111 3HG GLU 111 -0.528 -11.070 10.118 888 H LEU 112 H LEU 112 0.564 -6.185 10.382 889 HA LEU 112 HA LEU 112 2.421 -5.740 8.246 890 HB2 LEU 112 2HB LEU 112 1.194 -3.636 7.806 891 HB3 LEU 112 3HB LEU 112 0.199 -5.073 7.864 892 HG LEU 112 HG LEU 112 -0.359 -4.330 10.319 893 HD11 LEU 112 1HD1 LEU 112 1.281 -2.526 10.554 894 HD12 LEU 112 2HD1 LEU 112 -0.361 -1.916 10.733 895 HD13 LEU 112 3HD1 LEU 112 0.523 -1.637 9.231 896 HD21 LEU 112 3HD2 LEU 112 -1.961 -4.419 8.465 897 HD22 LEU 112 1HD2 LEU 112 -1.499 -2.786 7.977 898 HD23 LEU 112 2HD2 LEU 112 -2.270 -3.063 9.541 899 H VAL 113 H VAL 113 2.249 -4.412 11.526 900 HA VAL 113 HA VAL 113 4.092 -2.303 11.252 901 HB VAL 113 HB VAL 113 3.543 -4.087 13.679 902 HG11 VAL 113 1HG1 VAL 113 5.823 -3.196 13.930 903 HG12 VAL 113 2HG1 VAL 113 4.740 -2.387 15.064 904 HG13 VAL 113 3HG1 VAL 113 5.253 -1.561 13.589 905 HG21 VAL 113 3HG2 VAL 113 2.300 -2.121 14.524 906 HG22 VAL 113 1HG2 VAL 113 1.666 -2.656 12.967 907 HG23 VAL 113 2HG2 VAL 113 2.701 -1.231 13.053 908 H GLN 114 H GLN 114 4.564 -5.750 11.955 909 HA GLN 114 HA GLN 114 7.384 -5.773 12.095 910 HB2 GLN 114 2HB GLN 114 5.538 -8.017 11.201 911 HB3 GLN 114 3HB GLN 114 7.216 -8.214 11.672 912 HG2 GLN 114 2HG GLN 114 5.044 -7.196 13.522 913 HG3 GLN 114 3HG GLN 114 5.547 -8.878 13.423 914 HE21 GLN 114 1HE2 GLN 114 6.438 -5.676 14.492 915 HE22 GLN 114 2HE2 GLN 114 7.781 -6.163 15.464 916 H THR 115 H THR 115 5.158 -6.453 9.341 917 HA THR 115 HA THR 115 7.213 -7.226 7.560 918 HB THR 115 HB THR 115 4.605 -7.699 7.433 919 HG1 THR 115 HG1 THR 115 5.514 -8.763 5.849 920 HG21 THR 115 3HG2 THR 115 4.775 -5.296 5.561 921 HG22 THR 115 1HG2 THR 115 3.900 -5.327 7.094 922 HG23 THR 115 2HG2 THR 115 3.390 -6.372 5.766 923 H VAL 116 H VAL 116 5.912 -4.048 8.312 924 HA VAL 116 HA VAL 116 7.102 -2.705 6.023 925 HB VAL 116 HB VAL 116 5.681 -1.600 8.494 926 HG11 VAL 116 1HG1 VAL 116 6.696 -0.020 6.092 927 HG12 VAL 116 2HG1 VAL 116 7.309 0.087 7.743 928 HG13 VAL 116 3HG1 VAL 116 5.667 0.618 7.379 929 HG21 VAL 116 3HG2 VAL 116 4.211 -2.793 6.912 930 HG22 VAL 116 1HG2 VAL 116 4.773 -1.767 5.589 931 HG23 VAL 116 2HG2 VAL 116 3.849 -1.067 6.922 932 H LYS 117 H LYS 117 7.839 -2.968 9.536 933 HA LYS 117 HA LYS 117 10.118 -1.208 9.361 934 HB2 LYS 117 2HB LYS 117 10.552 -1.718 11.669 935 HB3 LYS 117 3HB LYS 117 8.811 -1.556 11.482 936 HG2 LYS 117 2HG LYS 117 8.612 -4.044 11.459 937 HG3 LYS 117 3HG LYS 117 10.350 -4.166 11.732 938 HD2 LYS 117 2HD LYS 117 8.319 -2.914 13.631 939 HD3 LYS 117 3HD LYS 117 9.124 -4.469 13.839 940 HE2 LYS 117 2HE LYS 117 11.322 -3.269 13.938 941 HE3 LYS 117 3HE LYS 117 10.444 -1.735 13.858 942 HZ1 LYS 117 3HZ LYS 117 10.949 -2.266 16.136 943 HZ2 LYS 117 1HZ LYS 117 10.221 -3.782 16.003 944 HZ3 LYS 117 2HZ LYS 117 9.282 -2.379 15.910 945 H ASN 118 H ASN 118 9.604 -4.650 8.996 946 HA ASN 118 HA ASN 118 12.360 -5.472 9.000 947 HB2 ASN 118 2HB ASN 118 9.844 -6.849 7.934 948 HB3 ASN 118 3HB ASN 118 11.450 -7.553 7.775 949 HD21 ASN 118 1HD2 ASN 118 10.217 -5.808 10.621 950 HD22 ASN 118 2HD2 ASN 118 10.208 -7.183 11.662 951 H TYR 119 H TYR 119 9.911 -4.665 6.563 952 HA TYR 119 HA TYR 119 11.250 -4.923 4.186 953 HB2 TYR 119 2HB TYR 119 8.901 -4.297 4.232 954 HB3 TYR 119 3HB TYR 119 9.270 -2.780 5.033 955 HD1 TYR 119 HD1 TYR 119 10.561 -4.445 1.873 956 HD2 TYR 119 HD2 TYR 119 8.749 -0.995 3.634 957 HE1 TYR 119 HE1 TYR 119 10.527 -3.331 -0.323 958 HE2 TYR 119 HE2 TYR 119 8.727 0.106 1.452 959 HH TYR 119 HH TYR 119 9.651 0.032 -0.667 960 H GLN 120 H GLN 120 11.074 -1.927 6.118 961 HA GLN 120 HA GLN 120 12.988 -0.431 4.742 962 HB2 GLN 120 2HB GLN 120 12.134 -0.271 7.668 963 HB3 GLN 120 3HB GLN 120 13.081 0.964 6.840 964 HG2 GLN 120 2HG GLN 120 11.197 1.324 5.259 965 HG3 GLN 120 3HG GLN 120 10.249 0.127 6.142 966 HE21 GLN 120 1HE2 GLN 120 9.861 3.044 5.682 967 HE22 GLN 120 2HE2 GLN 120 9.660 3.732 7.245 968 H GLY 121 H GLY 121 13.363 -2.754 7.370 969 HA2 GLY 121 2HA GLY 121 15.962 -2.245 8.224 970 HA3 GLY 121 3HA GLY 121 15.174 -3.819 8.262 971 H TYR 122 H TYR 122 14.884 -4.481 5.625 972 HA TYR 122 HA TYR 122 17.652 -4.971 4.854 973 HB2 TYR 122 2HB TYR 122 16.805 -6.655 3.321 974 HB3 TYR 122 3HB TYR 122 16.196 -6.899 4.943 975 HD1 TYR 122 HD2 TYR 122 15.174 -5.449 1.616 976 HD2 TYR 122 HD1 TYR 122 13.900 -7.305 5.243 977 HE1 TYR 122 HE2 TYR 122 12.909 -5.662 0.711 978 HE2 TYR 122 HE1 TYR 122 11.636 -7.524 4.323 979 HH TYR 122 HH TYR 122 10.951 -7.043 1.043 980 H VAL 123 H VAL 123 15.123 -2.854 3.856 981 HA VAL 123 HA VAL 123 15.835 -2.300 1.185 982 HB VAL 123 HB VAL 123 14.548 -0.518 3.315 983 HG11 VAL 123 1HG1 VAL 123 15.157 0.279 0.437 984 HG12 VAL 123 2HG1 VAL 123 15.784 1.045 1.899 985 HG13 VAL 123 3HG1 VAL 123 14.068 1.166 1.512 986 HG21 VAL 123 3HG2 VAL 123 12.524 -0.751 1.943 987 HG22 VAL 123 1HG2 VAL 123 13.174 -2.344 2.327 988 HG23 VAL 123 2HG2 VAL 123 13.427 -1.658 0.728 989 H GLN 124 H GLN 124 16.886 -0.725 4.199 990 HA GLN 124 HA GLN 124 18.825 0.990 3.012 991 HB2 GLN 124 2HB GLN 124 19.566 1.416 5.345 992 HB3 GLN 124 3HB GLN 124 17.817 1.520 5.182 993 HG2 GLN 124 2HG GLN 124 17.662 -0.831 6.088 994 HG3 GLN 124 3HG GLN 124 19.396 -0.767 6.398 995 HE21 GLN 124 1HE2 GLN 124 17.212 -1.096 8.318 996 HE22 GLN 124 2HE2 GLN 124 17.371 0.207 9.442 997 H ASP 125 H ASP 125 18.880 -2.314 4.069 998 HA ASP 125 HA ASP 125 21.737 -2.714 4.144 999 HB2 ASP 125 2HB ASP 125 20.257 -4.109 5.505 1000 HB3 ASP 125 3HB ASP 125 19.356 -4.626 4.094 1001 H GLY 126 H GLY 126 19.238 -2.803 1.679 1002 HA2 GLY 126 2HA GLY 126 19.649 -2.624 -0.626 1003 HA3 GLY 126 3HA GLY 126 21.244 -3.324 -0.412 1004 H HIS 127 H HIS 127 20.029 -5.573 1.244 1005 HA HIS 127 HA HIS 127 19.501 -7.353 -1.011 1006 HB2 HIS 127 2HB HIS 127 21.093 -8.034 0.760 1007 HB3 HIS 127 3HB HIS 127 19.831 -7.904 1.975 1008 HD1 HIS 127 HD1 HIS 127 21.095 -10.087 -0.763 1009 HD2 HIS 127 HD2 HIS 127 18.062 -10.137 2.075 1010 HE1 HIS 127 HE1 HIS 127 20.213 -12.431 -0.757 1011 HE2 HIS 127 HE2 HIS 127 18.290 -12.388 0.850 1012 H ASP 128 H ASP 128 17.446 -7.876 -1.643 1013 HA ASP 128 HA ASP 128 15.133 -6.972 -0.189 1014 HB2 ASP 128 2HB ASP 128 13.833 -7.680 -2.033 1015 HB3 ASP 128 3HB ASP 128 15.351 -7.138 -2.740 1016 H HIS 129 H HIS 129 13.229 -8.599 -0.075 1017 HA HIS 129 HA HIS 129 13.839 -11.332 0.657 1018 HB2 HIS 129 2HB HIS 129 13.031 -9.329 2.799 1019 HB3 HIS 129 3HB HIS 129 12.534 -11.007 2.946 1020 HD1 HIS 129 HD1 HIS 129 14.348 -12.738 3.504 1021 HD2 HIS 129 HD2 HIS 129 15.792 -8.858 3.275 1022 HE1 HIS 129 HE1 HIS 129 16.657 -12.822 4.452 1023 HE2 HIS 129 HE2 HIS 129 17.399 -10.429 4.530 1024 H ASP 130 H ASP 130 12.263 -9.599 -1.216 1025 HA ASP 130 HA ASP 130 9.767 -11.053 -1.089 1026 HB2 ASP 130 2HB ASP 130 8.319 -9.047 -1.286 1027 HB3 ASP 130 3HB ASP 130 9.163 -9.104 0.252 1028 H PHE 131 H PHE 131 10.363 -12.071 -2.918 1029 HA PHE 131 HA PHE 131 10.002 -12.564 -5.074 1030 HB2 PHE 131 2HB PHE 131 8.876 -9.736 -5.306 1031 HB3 PHE 131 3HB PHE 131 8.672 -11.013 -6.505 1032 HD1 PHE 131 HD1 PHE 131 7.373 -13.100 -5.887 1033 HD2 PHE 131 HD2 PHE 131 7.440 -9.646 -3.361 1034 HE1 PHE 131 HE1 PHE 131 5.410 -13.944 -4.665 1035 HE2 PHE 131 HE2 PHE 131 5.476 -10.497 -2.146 1036 HZ PHE 131 HZ PHE 131 4.463 -12.643 -2.800 1037 H GLY 132 H GLY 132 12.521 -10.941 -4.141 1038 HA2 GLY 132 2HA GLY 132 14.564 -10.645 -5.186 1039 HA3 GLY 132 3HA GLY 132 13.838 -11.108 -6.730 1040 H ARG 133 H ARG 133 12.925 -8.616 -4.462 1041 HA ARG 133 HA ARG 133 12.470 -6.610 -6.407 1042 HB2 ARG 133 2HB ARG 133 11.380 -6.924 -4.101 1043 HB3 ARG 133 3HB ARG 133 12.822 -6.195 -3.407 1044 HG2 ARG 133 2HG ARG 133 12.346 -4.081 -4.522 1045 HG3 ARG 133 3HG ARG 133 11.001 -4.809 -5.413 1046 HD2 ARG 133 2HD ARG 133 9.989 -5.359 -3.100 1047 HD3 ARG 133 3HD ARG 133 11.184 -4.247 -2.443 1048 HE ARG 133 HE ARG 133 9.971 -2.745 -4.335 1049 HH11 ARG 133 1HH1 ARG 133 8.667 -4.721 -1.720 1050 HH12 ARG 133 2HH1 ARG 133 7.256 -3.734 -1.526 1051 HH21 ARG 133 1HH2 ARG 133 8.113 -1.507 -4.104 1052 HH22 ARG 133 2HH2 ARG 133 6.943 -1.902 -2.889 1053 H ASP 134 H ASP 134 13.774 -4.997 -7.161 1054 HA ASP 134 HA ASP 134 16.605 -5.197 -6.815 1055 HB2 ASP 134 2HB ASP 134 15.031 -2.942 -8.138 1056 HB3 ASP 134 3HB ASP 134 16.742 -3.293 -8.361 1057 HA PRO 135 HA PRO 135 17.150 -2.340 -3.278 1058 HB2 PRO 135 2HB PRO 135 19.721 -1.406 -4.006 1059 HB3 PRO 135 3HB PRO 135 19.377 -2.853 -3.042 1060 HG2 PRO 135 2HG PRO 135 19.981 -2.650 -5.964 1061 HG3 PRO 135 3HG PRO 135 20.493 -3.878 -4.785 1062 HD2 PRO 135 2HD PRO 135 18.517 -4.385 -6.530 1063 HD3 PRO 135 3HD PRO 135 18.451 -5.016 -4.869 1064 H LYS 136 H LYS 136 17.097 -1.351 -6.619 1065 HA LYS 136 HA LYS 136 17.045 1.496 -6.080 1066 HB2 LYS 136 2HB LYS 136 16.499 1.783 -8.436 1067 HB3 LYS 136 3HB LYS 136 17.777 0.584 -8.293 1068 HG2 LYS 136 2HG LYS 136 16.102 -1.212 -8.614 1069 HG3 LYS 136 3HG LYS 136 14.840 0.005 -8.771 1070 HD2 LYS 136 2HD LYS 136 15.364 -0.629 -10.993 1071 HD3 LYS 136 3HD LYS 136 16.168 0.923 -10.771 1072 HE2 LYS 136 2HE LYS 136 18.305 -0.278 -10.366 1073 HE3 LYS 136 3HE LYS 136 17.466 -1.813 -10.629 1074 HZ1 LYS 136 3HZ LYS 136 17.743 0.359 -12.644 1075 HZ2 LYS 136 1HZ LYS 136 16.970 -1.127 -12.887 1076 HZ3 LYS 136 2HZ LYS 136 18.634 -1.073 -12.614 1077 H TYR 137 H TYR 137 14.665 -1.085 -6.367 1078 HA TYR 137 HA TYR 137 12.367 0.733 -6.192 1079 HB2 TYR 137 2HB TYR 137 12.551 -2.282 -6.576 1080 HB3 TYR 137 3HB TYR 137 11.030 -1.400 -6.454 1081 HD1 TYR 137 HD2 TYR 137 10.998 0.805 -8.088 1082 HD2 TYR 137 HD1 TYR 137 13.209 -2.783 -8.785 1083 HE1 TYR 137 HE2 TYR 137 11.093 1.326 -10.487 1084 HE2 TYR 137 HE1 TYR 137 13.315 -2.261 -11.184 1085 HH TYR 137 HH TYR 137 12.082 -0.938 -12.840 1086 H LEU 138 H LEU 138 14.309 -1.190 -4.132 1087 HA LEU 138 HA LEU 138 12.558 -1.475 -1.926 1088 HB2 LEU 138 2HB LEU 138 15.590 -1.272 -2.128 1089 HB3 LEU 138 3HB LEU 138 14.776 -1.474 -0.587 1090 HG LEU 138 HG LEU 138 14.726 -3.466 -2.894 1091 HD11 LEU 138 1HD1 LEU 138 16.042 -4.918 -1.424 1092 HD12 LEU 138 2HD1 LEU 138 16.095 -3.658 -0.188 1093 HD13 LEU 138 3HD1 LEU 138 16.893 -3.408 -1.742 1094 HD21 LEU 138 3HD2 LEU 138 12.607 -3.479 -1.660 1095 HD22 LEU 138 1HD2 LEU 138 13.470 -3.710 -0.140 1096 HD23 LEU 138 2HD2 LEU 138 13.514 -4.962 -1.386 1097 H HIS 139 H HIS 139 11.421 0.274 -1.325 1098 HA HIS 139 HA HIS 139 12.794 2.878 -0.881 1099 HB2 HIS 139 2HB HIS 139 11.448 3.087 -2.884 1100 HB3 HIS 139 3HB HIS 139 10.074 2.294 -2.125 1101 HD1 HIS 139 HD1 HIS 139 8.307 3.853 -1.375 1102 HD2 HIS 139 HD2 HIS 139 12.017 5.726 -1.476 1103 HE1 HIS 139 HE1 HIS 139 7.886 6.240 -0.753 1104 HE2 HIS 139 HE2 HIS 139 10.089 7.381 -1.037 1105 H GLN 140 H GLN 140 12.822 3.283 1.272 1106 HA GLN 140 HA GLN 140 10.943 2.186 3.148 1107 HB2 GLN 140 2HB GLN 140 12.795 4.570 3.623 1108 HB3 GLN 140 3HB GLN 140 12.000 3.594 4.847 1109 HG2 GLN 140 2HG GLN 140 13.369 1.637 4.117 1110 HG3 GLN 140 3HG GLN 140 14.221 2.696 2.997 1111 HE21 GLN 140 1HE2 GLN 140 15.301 1.159 5.221 1112 HE22 GLN 140 2HE2 GLN 140 16.067 2.295 6.272 1113 H PHE 141 H PHE 141 9.004 3.013 3.742 1114 HA PHE 141 HA PHE 141 7.998 5.518 2.709 1115 HB2 PHE 141 2HB PHE 141 6.735 3.846 4.917 1116 HB3 PHE 141 3HB PHE 141 5.935 4.962 3.818 1117 HD1 PHE 141 HD1 PHE 141 6.053 4.304 1.260 1118 HD2 PHE 141 HD2 PHE 141 6.625 1.563 4.485 1119 HE1 PHE 141 HE1 PHE 141 5.462 2.439 -0.211 1120 HE2 PHE 141 HE2 PHE 141 6.036 -0.294 3.016 1121 HZ PHE 141 HZ PHE 141 5.455 0.129 0.652 1122 H GLU 142 H GLU 142 8.107 7.476 3.760 1123 HA GLU 142 HA GLU 142 9.545 7.782 6.210 1124 HB2 GLU 142 2HB GLU 142 7.790 9.740 4.663 1125 HB3 GLU 142 3HB GLU 142 8.744 10.186 6.082 1126 HG2 GLU 142 2HG GLU 142 10.812 9.447 4.872 1127 HG3 GLU 142 3HG GLU 142 9.821 9.114 3.454 1128 H GLY 143 H GLY 143 8.833 7.584 8.223 1129 HA2 GLY 143 2HA GLY 143 6.234 6.390 8.671 1130 HA3 GLY 143 3HA GLY 143 7.561 6.515 9.809 1131 H GLU 144 H GLU 144 5.398 8.729 8.080 1132 HA GLU 144 HA GLU 144 4.815 10.202 10.589 1133 HB2 GLU 144 2HB GLU 144 4.901 11.416 7.779 1134 HB3 GLU 144 3HB GLU 144 4.700 12.272 9.307 1135 HG2 GLU 144 2HG GLU 144 7.008 11.620 9.962 1136 HG3 GLU 144 3HG GLU 144 7.205 10.817 8.403 1137 H THR 145 H THR 145 3.653 9.825 7.233 1138 HA THR 145 HA THR 145 0.948 9.178 8.202 1139 HB THR 145 HB THR 145 1.491 11.139 5.919 1140 HG1 THR 145 HG1 THR 145 1.473 11.544 8.572 1141 HG21 THR 145 3HG2 THR 145 -1.111 10.354 7.300 1142 HG22 THR 145 1HG2 THR 145 -0.619 9.834 5.684 1143 HG23 THR 145 2HG2 THR 145 -0.933 11.540 6.006 1144 H PHE 146 H PHE 146 0.810 7.125 7.587 1145 HA PHE 146 HA PHE 146 1.455 6.210 4.880 1146 HB2 PHE 146 2HB PHE 146 0.496 4.828 7.414 1147 HB3 PHE 146 3HB PHE 146 0.407 4.009 5.861 1148 HD1 PHE 146 HD2 PHE 146 2.880 5.751 8.110 1149 HD2 PHE 146 HD1 PHE 146 2.223 2.771 5.117 1150 HE1 PHE 146 HE2 PHE 146 5.199 4.959 8.371 1151 HE2 PHE 146 HE1 PHE 146 4.525 1.992 5.384 1152 HZ PHE 146 HZ PHE 146 6.020 3.071 6.999 1153 H TYR 147 H TYR 147 -0.102 5.497 3.426 1154 HA TYR 147 HA TYR 147 -2.969 5.877 4.044 1155 HB2 TYR 147 2HB TYR 147 -1.439 6.441 1.474 1156 HB3 TYR 147 3HB TYR 147 -3.169 6.125 1.444 1157 HD1 TYR 147 HD1 TYR 147 -0.656 8.387 3.099 1158 HD2 TYR 147 HD2 TYR 147 -4.659 7.933 1.677 1159 HE1 TYR 147 HE1 TYR 147 -1.093 10.754 3.562 1160 HE2 TYR 147 HE2 TYR 147 -5.091 10.308 2.140 1161 HH TYR 147 HH TYR 147 -2.542 12.516 2.936 1162 H ILE 148 H ILE 148 -4.296 4.207 3.568 1163 HA ILE 148 HA ILE 148 -3.151 1.747 2.360 1164 HB ILE 148 HB ILE 148 -5.027 1.924 4.771 1165 HG12 ILE 148 2HG1 ILE 148 -2.154 0.918 4.510 1166 HG13 ILE 148 3HG1 ILE 148 -2.691 2.335 5.401 1167 HG21 ILE 148 1HG2 ILE 148 -5.010 -0.538 4.809 1168 HG22 ILE 148 2HG2 ILE 148 -4.050 -0.567 3.330 1169 HG23 ILE 148 3HG2 ILE 148 -5.699 0.063 3.301 1170 HD11 ILE 148 3HD1 ILE 148 -2.164 0.556 6.918 1171 HD12 ILE 148 1HD1 ILE 148 -3.272 -0.543 6.097 1172 HD13 ILE 148 2HD1 ILE 148 -3.898 0.861 6.965 1173 H ILE 149 H ILE 149 -4.130 1.453 0.494 1174 HA ILE 149 HA ILE 149 -6.877 2.382 -0.002 1175 HB ILE 149 HB ILE 149 -4.869 1.284 -2.040 1176 HG12 ILE 149 2HG1 ILE 149 -3.843 3.262 -1.082 1177 HG13 ILE 149 3HG1 ILE 149 -4.450 3.689 -2.674 1178 HG21 ILE 149 1HG2 ILE 149 -6.310 2.404 -3.716 1179 HG22 ILE 149 2HG2 ILE 149 -7.427 2.892 -2.439 1180 HG23 ILE 149 3HG2 ILE 149 -7.195 1.179 -2.803 1181 HD11 ILE 149 3HD1 ILE 149 -4.827 5.461 -1.078 1182 HD12 ILE 149 1HD1 ILE 149 -5.739 4.372 -0.035 1183 HD13 ILE 149 2HD1 ILE 149 -6.366 4.804 -1.627 1184 H GLU 150 H GLU 150 -8.371 0.876 0.434 1185 HA GLU 150 HA GLU 150 -7.998 -1.916 0.581 1186 HB2 GLU 150 2HB GLU 150 -9.840 -0.769 1.745 1187 HB3 GLU 150 3HB GLU 150 -10.553 -0.281 0.212 1188 HG2 GLU 150 2HG GLU 150 -11.020 -2.647 -0.324 1189 HG3 GLU 150 3HG GLU 150 -10.279 -3.149 1.190 1190 H GLN 151 H GLN 151 -7.310 -3.001 -1.134 1191 HA GLN 151 HA GLN 151 -8.418 -2.569 -3.838 1192 HB2 GLN 151 2HB GLN 151 -6.028 -4.244 -2.924 1193 HB3 GLN 151 3HB GLN 151 -6.514 -3.988 -4.596 1194 HG2 GLN 151 2HG GLN 151 -5.614 -1.769 -2.733 1195 HG3 GLN 151 3HG GLN 151 -4.542 -2.628 -3.833 1196 HE21 GLN 151 1HE2 GLN 151 -4.010 -0.766 -4.955 1197 HE22 GLN 151 2HE2 GLN 151 -5.107 0.033 -6.018 1198 H ARG 152 H ARG 152 -10.332 -3.627 -3.828 1199 HA ARG 152 HA ARG 152 -10.455 -6.462 -2.958 1200 HB2 ARG 152 2HB ARG 152 -11.998 -4.919 -1.786 1201 HB3 ARG 152 3HB ARG 152 -12.703 -4.427 -3.323 1202 HG2 ARG 152 2HG ARG 152 -13.761 -6.515 -3.647 1203 HG3 ARG 152 3HG ARG 152 -12.722 -7.329 -2.471 1204 HD2 ARG 152 2HD ARG 152 -15.042 -6.982 -1.685 1205 HD3 ARG 152 3HD ARG 152 -13.831 -6.262 -0.636 1206 HE ARG 152 HE ARG 152 -15.520 -4.727 -2.539 1207 HH11 ARG 152 1HH1 ARG 152 -13.861 -4.985 0.550 1208 HH12 ARG 152 2HH1 ARG 152 -14.362 -3.417 1.100 1209 HH21 ARG 152 1HH2 ARG 152 -16.185 -2.662 -1.804 1210 HH22 ARG 152 2HH2 ARG 152 -15.686 -2.102 -0.242 1211 H LEU 153 H LEU 153 -11.507 -7.952 -4.390 1212 HA LEU 153 HA LEU 153 -10.752 -7.792 -7.081 1213 HB2 LEU 153 2HB LEU 153 -12.766 -9.611 -5.709 1214 HB3 LEU 153 3HB LEU 153 -12.209 -9.857 -7.359 1215 HG LEU 153 HG LEU 153 -10.420 -9.918 -4.891 1216 HD11 LEU 153 1HD1 LEU 153 -10.265 -12.336 -5.217 1217 HD12 LEU 153 2HD1 LEU 153 -11.406 -12.250 -6.562 1218 HD13 LEU 153 3HD1 LEU 153 -11.935 -11.846 -4.927 1219 HD21 LEU 153 3HD2 LEU 153 -9.754 -10.532 -7.791 1220 HD22 LEU 153 1HD2 LEU 153 -8.681 -10.792 -6.411 1221 HD23 LEU 153 2HD2 LEU 153 -9.179 -9.159 -6.841 1222 H GLU 154 H GLU 154 -12.222 -8.039 -8.979 1223 HA GLU 154 HA GLU 154 -13.664 -5.563 -9.184 1224 HB2 GLU 154 2HB GLU 154 -13.307 -7.753 -11.265 1225 HB3 GLU 154 3HB GLU 154 -13.760 -6.080 -11.577 1226 HG2 GLU 154 2HG GLU 154 -11.539 -5.324 -10.820 1227 HG3 GLU 154 3HG GLU 154 -11.091 -6.991 -10.451 1228 H HIS 155 H HIS 155 -15.729 -5.531 -10.534 1229 HA HIS 155 HA HIS 155 -17.949 -5.850 -10.811 1230 HB2 HIS 155 2HB HIS 155 -17.331 -8.780 -10.218 1231 HB3 HIS 155 3HB HIS 155 -18.884 -8.192 -10.803 1232 HD1 HIS 155 HD1 HIS 155 -18.873 -9.368 -13.054 1233 HD2 HIS 155 HD2 HIS 155 -15.435 -7.118 -12.425 1234 HE1 HIS 155 HE1 HIS 155 -17.651 -9.363 -15.250 1235 HE2 HIS 155 HE2 HIS 155 -15.672 -7.859 -14.878 1236 H HIS 156 H HIS 156 -16.738 -5.259 -8.190 1237 HA HIS 156 HA HIS 156 -19.033 -5.846 -6.406 1238 HB2 HIS 156 2HB HIS 156 -16.086 -5.629 -5.639 1239 HB3 HIS 156 3HB HIS 156 -17.414 -5.783 -4.492 1240 HD1 HIS 156 HD1 HIS 156 -14.894 -7.800 -5.649 1241 HD2 HIS 156 HD2 HIS 156 -19.008 -8.331 -5.520 1242 HE1 HIS 156 HE1 HIS 156 -15.247 -10.274 -5.775 1243 HE2 HIS 156 HE2 HIS 156 -17.737 -10.571 -5.536 1244 H HIS 157 H HIS 157 -19.593 -4.136 -4.969 1245 HA HIS 157 HA HIS 157 -20.248 -2.027 -4.493 1246 HB2 HIS 157 2HB HIS 157 -17.863 -1.690 -3.824 1247 HB3 HIS 157 3HB HIS 157 -17.452 -1.237 -5.473 1248 HD1 HIS 157 HD1 HIS 157 -19.659 0.036 -2.630 1249 HD2 HIS 157 HD2 HIS 157 -17.537 1.472 -5.901 1250 HE1 HIS 157 HE1 HIS 157 -19.895 2.534 -2.547 1251 HE2 HIS 157 HE2 HIS 157 -18.809 3.339 -4.663 1252 H HIS 158 H HIS 158 -20.485 -3.245 -7.316 1253 HA HIS 158 HA HIS 158 -20.489 -0.999 -9.137 1254 HB2 HIS 158 2HB HIS 158 -21.305 -2.522 -10.822 1255 HB3 HIS 158 3HB HIS 158 -20.039 -3.337 -9.921 1256 HD1 HIS 158 HD1 HIS 158 -20.684 -5.510 -8.714 1257 HD2 HIS 158 HD2 HIS 158 -23.924 -3.625 -10.499 1258 HE1 HIS 158 HE1 HIS 158 -22.535 -7.203 -8.711 1259 HE2 HIS 158 HE2 HIS 158 -24.514 -5.994 -9.673 1260 H HIS 159 H HIS 159 -22.200 0.300 -9.663 1261 HA HIS 159 HA HIS 159 -24.893 -0.238 -8.655 1262 HB2 HIS 159 2HB HIS 159 -23.717 0.855 -6.741 1263 HB3 HIS 159 3HB HIS 159 -23.292 2.217 -7.773 1264 HD1 HIS 159 HD1 HIS 159 -25.012 4.053 -8.013 1265 HD2 HIS 159 HD2 HIS 159 -26.573 0.681 -6.166 1266 HE1 HIS 159 HE1 HIS 159 -27.288 4.725 -7.214 1267 HE2 HIS 159 HE2 HIS 159 -28.286 2.611 -6.288 1268 H HIS 160 H HIS 160 -26.473 0.906 -9.716 1269 HA HIS 160 HA HIS 160 -25.702 2.922 -11.745 1270 HB2 HIS 160 2HB HIS 160 -27.727 0.652 -12.022 1271 HB3 HIS 160 3HB HIS 160 -27.630 2.013 -13.134 1272 HD1 HIS 160 HD1 HIS 160 -26.141 -1.269 -12.418 1273 HD2 HIS 160 HD2 HIS 160 -25.189 2.065 -14.697 1274 HE1 HIS 160 HE1 HIS 160 -24.304 -2.013 -13.955 1275 HE2 HIS 160 HE2 HIS 160 -23.947 -0.047 -15.487 Start of MODEL 14 1 H1 MET 1 1H MET 1 -14.263 20.019 -9.482 2 H2 MET 1 2H MET 1 -15.310 20.979 -8.568 3 H3 MET 1 3H MET 1 -13.647 21.177 -8.415 4 HA MET 1 HA MET 1 -14.594 22.954 -9.728 5 HB2 MET 1 2HB MET 1 -12.968 20.988 -11.419 6 HB3 MET 1 3HB MET 1 -13.127 22.714 -11.736 7 HG2 MET 1 2HG MET 1 -11.975 23.212 -9.625 8 HG3 MET 1 3HG MET 1 -11.830 21.484 -9.293 9 HE1 MET 1 3HE MET 1 -8.122 22.485 -10.150 10 HE2 MET 1 1HE MET 1 -9.185 21.741 -8.956 11 HE3 MET 1 2HE MET 1 -9.292 23.474 -9.278 12 H VAL 2 H VAL 2 -15.242 23.303 -12.261 13 HA VAL 2 HA VAL 2 -17.816 22.126 -12.664 14 HB VAL 2 HB VAL 2 -16.124 23.760 -14.628 15 HG11 VAL 2 1HG1 VAL 2 -19.086 23.041 -14.770 16 HG12 VAL 2 2HG1 VAL 2 -17.815 22.449 -15.843 17 HG13 VAL 2 3HG1 VAL 2 -18.251 24.156 -15.856 18 HG21 VAL 2 3HG2 VAL 2 -17.569 25.666 -13.958 19 HG22 VAL 2 1HG2 VAL 2 -16.672 25.020 -12.583 20 HG23 VAL 2 2HG2 VAL 2 -18.384 24.638 -12.775 21 H GLU 3 H GLU 3 -17.781 19.994 -12.874 22 HA GLU 3 HA GLU 3 -16.344 18.680 -15.084 23 HB2 GLU 3 2HB GLU 3 -16.348 17.831 -12.145 24 HB3 GLU 3 3HB GLU 3 -15.814 16.781 -13.456 25 HG2 GLU 3 2HG GLU 3 -13.933 18.142 -13.931 26 HG3 GLU 3 3HG GLU 3 -14.553 19.488 -12.985 27 HA PRO 4 HA PRO 4 -20.373 16.572 -15.395 28 HB2 PRO 4 2HB PRO 4 -19.614 14.331 -16.820 29 HB3 PRO 4 3HB PRO 4 -19.819 15.930 -17.558 30 HG2 PRO 4 2HG PRO 4 -17.305 14.543 -16.732 31 HG3 PRO 4 3HG PRO 4 -17.631 15.534 -18.169 32 HD2 PRO 4 2HD PRO 4 -16.296 16.477 -15.973 33 HD3 PRO 4 3HD PRO 4 -17.246 17.520 -17.049 34 H GLY 5 H GLY 5 -21.100 14.059 -15.125 35 HA2 GLY 5 2HA GLY 5 -20.454 13.353 -12.390 36 HA3 GLY 5 3HA GLY 5 -21.626 12.570 -13.432 37 H VAL 6 H VAL 6 -18.105 13.061 -13.575 38 HA VAL 6 HA VAL 6 -17.681 10.240 -14.293 39 HB VAL 6 HB VAL 6 -15.478 11.053 -15.236 40 HG11 VAL 6 1HG1 VAL 6 -17.948 12.350 -16.470 41 HG12 VAL 6 2HG1 VAL 6 -17.391 10.696 -16.742 42 HG13 VAL 6 3HG1 VAL 6 -16.414 12.056 -17.297 43 HG21 VAL 6 3HG2 VAL 6 -15.142 13.480 -15.666 44 HG22 VAL 6 1HG2 VAL 6 -15.184 13.133 -13.936 45 HG23 VAL 6 2HG2 VAL 6 -16.588 13.855 -14.727 46 H ALA 7 H ALA 7 -16.448 8.986 -12.988 47 HA ALA 7 HA ALA 7 -14.605 9.936 -11.029 48 HB1 ALA 7 3HB ALA 7 -16.673 10.577 -9.855 49 HB2 ALA 7 1HB ALA 7 -15.832 9.284 -8.997 50 HB3 ALA 7 2HB ALA 7 -17.266 8.919 -9.962 51 H LYS 8 H LYS 8 -13.229 8.404 -11.876 52 HA LYS 8 HA LYS 8 -13.866 5.570 -11.291 53 HB2 LYS 8 2HB LYS 8 -12.466 6.631 -13.785 54 HB3 LYS 8 3HB LYS 8 -12.574 4.925 -13.351 55 HG2 LYS 8 2HG LYS 8 -15.055 5.051 -13.524 56 HG3 LYS 8 3HG LYS 8 -14.919 6.753 -13.971 57 HD2 LYS 8 2HD LYS 8 -15.257 5.376 -15.967 58 HD3 LYS 8 3HD LYS 8 -13.663 6.133 -16.006 59 HE2 LYS 8 2HE LYS 8 -12.653 4.011 -15.224 60 HE3 LYS 8 3HE LYS 8 -14.253 3.261 -15.218 61 HZ1 LYS 8 3HZ LYS 8 -12.873 4.375 -17.599 62 HZ2 LYS 8 1HZ LYS 8 -14.393 3.634 -17.595 63 HZ3 LYS 8 2HZ LYS 8 -13.015 2.735 -17.217 64 H LEU 9 H LEU 9 -12.352 4.456 -10.305 65 HA LEU 9 HA LEU 9 -9.643 5.542 -9.865 66 HB2 LEU 9 2HB LEU 9 -10.891 5.258 -7.766 67 HB3 LEU 9 3HB LEU 9 -11.342 3.621 -8.209 68 HG LEU 9 HG LEU 9 -8.888 2.992 -8.086 69 HD11 LEU 9 1HD1 LEU 9 -8.556 5.740 -6.844 70 HD12 LEU 9 2HD1 LEU 9 -7.857 5.182 -8.367 71 HD13 LEU 9 3HD1 LEU 9 -7.342 4.457 -6.848 72 HD21 LEU 9 3HD2 LEU 9 -8.827 2.858 -5.621 73 HD22 LEU 9 1HD2 LEU 9 -10.415 2.435 -6.259 74 HD23 LEU 9 2HD2 LEU 9 -10.154 4.017 -5.521 75 H THR 10 H THR 10 -8.634 4.708 -11.672 76 HA THR 10 HA THR 10 -8.799 1.796 -12.199 77 HB THR 10 HB THR 10 -7.688 3.989 -14.022 78 HG1 THR 10 HG1 THR 10 -9.701 3.950 -15.015 79 HG21 THR 10 3HG2 THR 10 -6.894 1.697 -14.610 80 HG22 THR 10 1HG2 THR 10 -7.988 2.339 -15.839 81 HG23 THR 10 2HG2 THR 10 -8.568 1.144 -14.679 82 H THR 11 H THR 11 -6.664 0.826 -12.934 83 HA THR 11 HA THR 11 -4.943 0.678 -10.787 84 HB THR 11 HB THR 11 -3.498 -0.731 -12.308 85 HG1 THR 11 HG1 THR 11 -4.588 -1.103 -14.448 86 HG21 THR 11 3HG2 THR 11 -6.483 -1.328 -12.455 87 HG22 THR 11 1HG2 THR 11 -5.414 -1.755 -11.112 88 HG23 THR 11 2HG2 THR 11 -5.178 -2.490 -12.696 89 H TYR 12 H TYR 12 -4.713 3.019 -13.370 90 HA TYR 12 HA TYR 12 -1.980 3.531 -13.549 91 HB2 TYR 12 2HB TYR 12 -2.520 5.746 -14.380 92 HB3 TYR 12 3HB TYR 12 -3.741 4.633 -14.968 93 HD1 TYR 12 HD2 TYR 12 -3.113 7.507 -12.693 94 HD2 TYR 12 HD1 TYR 12 -6.102 4.848 -14.200 95 HE1 TYR 12 HE2 TYR 12 -4.863 8.970 -11.797 96 HE2 TYR 12 HE1 TYR 12 -7.850 6.323 -13.300 97 HH TYR 12 HH TYR 12 -8.173 8.043 -11.666 98 H ALA 13 H ALA 13 -4.253 4.590 -11.068 99 HA ALA 13 HA ALA 13 -2.572 6.390 -9.641 100 HB1 ALA 13 3HB ALA 13 -4.958 4.771 -8.670 101 HB2 ALA 13 1HB ALA 13 -5.024 6.371 -9.419 102 HB3 ALA 13 2HB ALA 13 -4.252 6.168 -7.850 103 H SER 14 H SER 14 -3.331 2.966 -9.255 104 HA SER 14 HA SER 14 -1.738 2.432 -6.960 105 HB2 SER 14 2HB SER 14 -2.806 0.515 -9.076 106 HB3 SER 14 3HB SER 14 -2.230 0.071 -7.467 107 HG SER 14 HG SER 14 -4.338 0.256 -7.133 108 H LYS 15 H LYS 15 -1.085 2.428 -10.393 109 HA LYS 15 HA LYS 15 1.265 0.820 -10.416 110 HB2 LYS 15 2HB LYS 15 -0.104 2.630 -12.414 111 HB3 LYS 15 3HB LYS 15 1.546 2.122 -12.752 112 HG2 LYS 15 2HG LYS 15 -0.746 0.199 -12.234 113 HG3 LYS 15 3HG LYS 15 -0.204 0.710 -13.837 114 HD2 LYS 15 2HD LYS 15 2.060 -0.221 -13.343 115 HD3 LYS 15 3HD LYS 15 1.470 -0.780 -11.775 116 HE2 LYS 15 2HE LYS 15 -0.124 -2.276 -12.877 117 HE3 LYS 15 3HE LYS 15 0.364 -1.664 -14.461 118 HZ1 LYS 15 3HZ LYS 15 2.533 -2.585 -14.160 119 HZ2 LYS 15 1HZ LYS 15 1.398 -3.802 -13.874 120 HZ3 LYS 15 2HZ LYS 15 2.192 -3.056 -12.576 121 H GLN 16 H GLN 16 0.723 4.331 -10.405 122 HA GLN 16 HA GLN 16 3.541 4.968 -10.531 123 HB2 GLN 16 2HB GLN 16 1.156 6.753 -9.907 124 HB3 GLN 16 3HB GLN 16 2.788 7.319 -10.253 125 HG2 GLN 16 2HG GLN 16 0.885 5.920 -12.150 126 HG3 GLN 16 3HG GLN 16 1.445 7.589 -12.234 127 HE21 GLN 16 1HE2 GLN 16 3.631 7.974 -12.896 128 HE22 GLN 16 2HE2 GLN 16 4.526 6.797 -13.787 129 H ALA 17 H ALA 17 1.285 4.285 -8.009 130 HA ALA 17 HA ALA 17 2.825 5.346 -5.829 131 HB1 ALA 17 3HB ALA 17 0.429 4.896 -5.594 132 HB2 ALA 17 1HB ALA 17 1.353 3.979 -4.404 133 HB3 ALA 17 2HB ALA 17 0.706 3.173 -5.838 134 H THR 18 H THR 18 2.437 2.082 -7.242 135 HA THR 18 HA THR 18 4.382 0.781 -5.607 136 HB THR 18 HB THR 18 4.230 -1.066 -7.339 137 HG1 THR 18 HG1 THR 18 3.745 0.304 -9.163 138 HG21 THR 18 3HG2 THR 18 2.658 -1.024 -5.435 139 HG22 THR 18 1HG2 THR 18 1.885 -1.643 -6.896 140 HG23 THR 18 2HG2 THR 18 1.560 0.005 -6.360 141 H ASP 19 H ASP 19 4.550 2.526 -8.631 142 HA ASP 19 HA ASP 19 7.171 1.806 -9.461 143 HB2 ASP 19 2HB ASP 19 5.520 2.909 -10.959 144 HB3 ASP 19 3HB ASP 19 5.592 4.371 -9.982 145 H MET 20 H MET 20 5.863 4.311 -7.329 146 HA MET 20 HA MET 20 8.268 5.681 -6.713 147 HB2 MET 20 2HB MET 20 5.792 6.317 -6.162 148 HB3 MET 20 3HB MET 20 5.962 5.280 -4.759 149 HG2 MET 20 2HG MET 20 6.379 7.454 -3.970 150 HG3 MET 20 3HG MET 20 7.984 6.741 -4.132 151 HE1 MET 20 3HE MET 20 5.293 9.048 -5.848 152 HE2 MET 20 1HE MET 20 5.726 7.923 -7.138 153 HE3 MET 20 2HE MET 20 6.174 9.625 -7.263 154 H GLY 21 H GLY 21 6.649 2.852 -5.334 155 HA2 GLY 21 2HA GLY 21 8.416 1.103 -4.696 156 HA3 GLY 21 3HA GLY 21 8.909 2.296 -3.507 157 H ALA 22 H ALA 22 5.534 2.271 -4.055 158 HA ALA 22 HA ALA 22 4.927 1.409 -1.416 159 HB1 ALA 22 3HB ALA 22 3.029 1.777 -3.751 160 HB2 ALA 22 1HB ALA 22 3.528 3.031 -2.613 161 HB3 ALA 22 2HB ALA 22 2.579 1.657 -2.046 162 H ILE 23 H ILE 23 3.903 -0.444 -0.685 163 HA ILE 23 HA ILE 23 4.391 -2.880 -2.309 164 HB ILE 23 HB ILE 23 4.575 -4.076 -0.122 165 HG12 ILE 23 2HG1 ILE 23 4.361 -1.309 1.177 166 HG13 ILE 23 3HG1 ILE 23 3.072 -2.503 1.192 167 HG21 ILE 23 1HG2 ILE 23 6.631 -3.223 -1.174 168 HG22 ILE 23 2HG2 ILE 23 6.768 -3.147 0.581 169 HG23 ILE 23 3HG2 ILE 23 6.445 -1.677 -0.340 170 HD11 ILE 23 3HD1 ILE 23 4.233 -2.438 3.298 171 HD12 ILE 23 1HD1 ILE 23 5.769 -2.777 2.505 172 HD13 ILE 23 2HD1 ILE 23 4.491 -3.998 2.518 173 H TYR 24 H TYR 24 2.856 -4.553 -2.309 174 HA TYR 24 HA TYR 24 0.154 -3.908 -1.313 175 HB2 TYR 24 2HB TYR 24 1.145 -5.972 -3.290 176 HB3 TYR 24 3HB TYR 24 -0.465 -6.064 -2.593 177 HD1 TYR 24 HD1 TYR 24 -1.915 -3.839 -2.795 178 HD2 TYR 24 HD2 TYR 24 1.373 -4.806 -5.345 179 HE1 TYR 24 HE1 TYR 24 -2.812 -2.360 -4.533 180 HE2 TYR 24 HE2 TYR 24 0.457 -3.326 -7.068 181 HH TYR 24 HH TYR 24 -1.686 -2.396 -7.739 182 H VAL 25 H VAL 25 -0.478 -4.726 0.523 183 HA VAL 25 HA VAL 25 0.462 -7.384 1.429 184 HB VAL 25 HB VAL 25 -0.196 -6.739 3.728 185 HG11 VAL 25 1HG1 VAL 25 2.138 -6.373 3.074 186 HG12 VAL 25 2HG1 VAL 25 1.627 -5.135 4.219 187 HG13 VAL 25 3HG1 VAL 25 1.752 -4.747 2.500 188 HG21 VAL 25 3HG2 VAL 25 -1.983 -5.116 3.225 189 HG22 VAL 25 1HG2 VAL 25 -0.792 -3.968 2.605 190 HG23 VAL 25 2HG2 VAL 25 -0.795 -4.407 4.316 191 H ASN 26 H ASN 26 -1.529 -8.250 3.000 192 HA ASN 26 HA ASN 26 -4.069 -7.862 1.495 193 HB2 ASN 26 2HB ASN 26 -4.614 -10.215 1.701 194 HB3 ASN 26 3HB ASN 26 -3.017 -10.089 0.971 195 HD21 ASN 26 1HD2 ASN 26 -1.168 -10.545 2.306 196 HD22 ASN 26 2HD2 ASN 26 -1.337 -11.624 3.646 197 H SER 27 H SER 27 -5.751 -9.355 3.192 198 HA SER 27 HA SER 27 -6.404 -7.451 5.159 199 HB2 SER 27 2HB SER 27 -8.058 -8.944 4.113 200 HB3 SER 27 3HB SER 27 -7.353 -10.327 4.941 201 HG SER 27 HG SER 27 -7.953 -9.341 6.925 202 H LYS 28 H LYS 28 -4.290 -10.217 5.437 203 HA LYS 28 HA LYS 28 -4.142 -10.018 8.349 204 HB2 LYS 28 2HB LYS 28 -2.263 -11.581 6.543 205 HB3 LYS 28 3HB LYS 28 -2.519 -11.795 8.271 206 HG2 LYS 28 2HG LYS 28 -4.459 -12.461 6.046 207 HG3 LYS 28 3HG LYS 28 -3.563 -13.601 7.051 208 HD2 LYS 28 2HD LYS 28 -4.833 -12.756 9.050 209 HD3 LYS 28 3HD LYS 28 -5.773 -11.718 7.971 210 HE2 LYS 28 2HE LYS 28 -6.508 -13.772 6.734 211 HE3 LYS 28 3HE LYS 28 -5.690 -14.749 7.952 212 HZ1 LYS 28 3HZ LYS 28 -8.002 -12.939 8.351 213 HZ2 LYS 28 1HZ LYS 28 -7.150 -13.669 9.622 214 HZ3 LYS 28 2HZ LYS 28 -7.976 -14.624 8.498 215 H GLY 29 H GLY 29 -2.446 -8.950 5.494 216 HA2 GLY 29 2HA GLY 29 -1.093 -7.019 5.390 217 HA3 GLY 29 3HA GLY 29 -0.706 -7.195 7.098 218 H ASP 30 H ASP 30 -0.592 -9.973 4.974 219 HA ASP 30 HA ASP 30 2.267 -10.300 5.317 220 HB2 ASP 30 2HB ASP 30 0.490 -11.855 3.384 221 HB3 ASP 30 3HB ASP 30 2.071 -12.332 4.000 222 H ARG 31 H ARG 31 3.806 -9.697 3.913 223 HA ARG 31 HA ARG 31 3.508 -8.072 1.673 224 HB2 ARG 31 2HB ARG 31 5.879 -8.792 1.068 225 HB3 ARG 31 3HB ARG 31 5.687 -8.160 2.693 226 HG2 ARG 31 2HG ARG 31 5.548 -11.144 2.326 227 HG3 ARG 31 3HG ARG 31 7.121 -10.373 2.194 228 HD2 ARG 31 2HD ARG 31 6.959 -9.512 4.456 229 HD3 ARG 31 3HD ARG 31 5.283 -10.050 4.579 230 HE ARG 31 HE ARG 31 6.011 -12.299 4.687 231 HH11 ARG 31 1HH1 ARG 31 8.720 -10.073 4.787 232 HH12 ARG 31 2HH1 ARG 31 9.800 -11.243 5.458 233 HH21 ARG 31 1HH2 ARG 31 7.430 -13.800 5.584 234 HH22 ARG 31 2HH2 ARG 31 9.071 -13.353 5.912 235 H ILE 32 H ILE 32 2.094 -8.714 0.091 236 HA ILE 32 HA ILE 32 2.597 -11.255 -1.343 237 HB ILE 32 HB ILE 32 0.522 -10.927 -2.540 238 HG12 ILE 32 2HG1 ILE 32 0.213 -8.201 -1.195 239 HG13 ILE 32 3HG1 ILE 32 0.646 -8.448 -2.881 240 HG21 ILE 32 1HG2 ILE 32 0.099 -10.261 0.401 241 HG22 ILE 32 2HG2 ILE 32 0.295 -11.872 -0.292 242 HG23 ILE 32 3HG2 ILE 32 -1.135 -10.916 -0.685 243 HD11 ILE 32 3HD1 ILE 32 -1.532 -9.487 -3.289 244 HD12 ILE 32 1HD1 ILE 32 -1.682 -7.850 -2.650 245 HD13 ILE 32 2HD1 ILE 32 -1.964 -9.233 -1.594 246 H VAL 33 H VAL 33 1.943 -10.372 -3.963 247 HA VAL 33 HA VAL 33 4.408 -9.644 -4.979 248 HB VAL 33 HB VAL 33 2.590 -10.685 -6.317 249 HG11 VAL 33 1HG1 VAL 33 0.767 -9.328 -7.302 250 HG12 VAL 33 2HG1 VAL 33 1.284 -7.934 -6.345 251 HG13 VAL 33 3HG1 VAL 33 0.663 -9.375 -5.539 252 HG21 VAL 33 3HG2 VAL 33 4.510 -9.697 -7.488 253 HG22 VAL 33 1HG2 VAL 33 3.701 -8.128 -7.553 254 HG23 VAL 33 2HG2 VAL 33 3.050 -9.500 -8.454 255 H ASN 34 H ASN 34 5.499 -7.727 -5.277 256 HA ASN 34 HA ASN 34 4.923 -5.538 -3.673 257 HB2 ASN 34 2HB ASN 34 7.197 -6.236 -4.683 258 HB3 ASN 34 3HB ASN 34 6.732 -5.339 -6.115 259 HD21 ASN 34 1HD2 ASN 34 5.488 -3.068 -4.610 260 HD22 ASN 34 2HD2 ASN 34 6.791 -2.221 -3.875 261 H GLU 35 H GLU 35 4.535 -5.784 -7.229 262 HA GLU 35 HA GLU 35 2.562 -3.574 -7.089 263 HB2 GLU 35 2HB GLU 35 3.161 -2.838 -9.307 264 HB3 GLU 35 3HB GLU 35 4.602 -2.848 -8.301 265 HG2 GLU 35 2HG GLU 35 5.510 -4.745 -9.418 266 HG3 GLU 35 3HG GLU 35 3.968 -5.135 -10.188 267 H SER 36 H SER 36 0.848 -3.656 -8.635 268 HA SER 36 HA SER 36 -0.119 -6.302 -9.330 269 HB2 SER 36 2HB SER 36 -2.066 -4.946 -10.281 270 HB3 SER 36 3HB SER 36 -1.763 -4.694 -8.562 271 HG SER 36 HG SER 36 -1.142 -3.000 -10.733 272 H ASN 37 H ASN 37 1.909 -6.645 -10.573 273 HA ASN 37 HA ASN 37 2.831 -5.250 -12.774 274 HB2 ASN 37 2HB ASN 37 4.097 -7.049 -11.616 275 HB3 ASN 37 3HB ASN 37 2.977 -8.254 -12.241 276 HD21 ASN 37 1HD2 ASN 37 4.602 -9.398 -13.278 277 HD22 ASN 37 2HD2 ASN 37 5.408 -8.817 -14.692 278 H VAL 38 H VAL 38 0.965 -8.252 -12.885 279 HA VAL 38 HA VAL 38 -0.743 -7.160 -15.028 280 HB VAL 38 HB VAL 38 0.764 -8.810 -16.080 281 HG11 VAL 38 1HG1 VAL 38 0.808 -11.189 -15.437 282 HG12 VAL 38 2HG1 VAL 38 -0.220 -10.837 -14.046 283 HG13 VAL 38 3HG1 VAL 38 1.402 -10.147 -14.142 284 HG21 VAL 38 3HG2 VAL 38 -1.535 -8.713 -16.942 285 HG22 VAL 38 1HG2 VAL 38 -2.047 -9.950 -15.793 286 HG23 VAL 38 2HG2 VAL 38 -0.900 -10.353 -17.075 287 H TYR 39 H TYR 39 -2.947 -7.862 -14.862 288 HA TYR 39 HA TYR 39 -4.085 -7.947 -12.336 289 HB2 TYR 39 2HB TYR 39 -6.205 -8.548 -13.418 290 HB3 TYR 39 3HB TYR 39 -5.346 -7.403 -14.437 291 HD1 TYR 39 HD2 TYR 39 -4.276 -8.208 -16.600 292 HD2 TYR 39 HD1 TYR 39 -6.683 -10.837 -14.224 293 HE1 TYR 39 HE2 TYR 39 -4.450 -9.773 -18.478 294 HE2 TYR 39 HE1 TYR 39 -6.849 -12.387 -16.119 295 HH TYR 39 HH TYR 39 -4.846 -12.261 -18.765 296 H THR 40 H THR 40 -2.968 -10.592 -14.335 297 HA THR 40 HA THR 40 -4.226 -12.775 -13.107 298 HB THR 40 HB THR 40 -1.510 -12.872 -14.491 299 HG1 THR 40 HG1 THR 40 -3.783 -13.214 -16.033 300 HG21 THR 40 3HG2 THR 40 -2.326 -15.074 -15.296 301 HG22 THR 40 1HG2 THR 40 -3.829 -14.847 -14.397 302 HG23 THR 40 2HG2 THR 40 -2.299 -15.022 -13.533 303 H THR 41 H THR 41 -0.884 -11.545 -12.675 304 HA THR 41 HA THR 41 -0.070 -13.382 -10.688 305 HB THR 41 HB THR 41 1.036 -10.568 -11.160 306 HG1 THR 41 HG1 THR 41 1.708 -13.076 -12.336 307 HG21 THR 41 3HG2 THR 41 1.869 -11.565 -9.042 308 HG22 THR 41 1HG2 THR 41 3.153 -11.463 -10.245 309 HG23 THR 41 2HG2 THR 41 2.375 -13.012 -9.920 310 H PHE 42 H PHE 42 -1.467 -10.148 -10.475 311 HA PHE 42 HA PHE 42 -1.142 -9.748 -7.682 312 HB2 PHE 42 2HB PHE 42 -1.410 -7.877 -9.241 313 HB3 PHE 42 3HB PHE 42 -3.021 -8.439 -9.686 314 HD1 PHE 42 HD1 PHE 42 -1.184 -7.691 -6.477 315 HD2 PHE 42 HD2 PHE 42 -4.744 -7.125 -8.779 316 HE1 PHE 42 HE1 PHE 42 -2.127 -6.312 -4.688 317 HE2 PHE 42 HE2 PHE 42 -5.680 -5.735 -6.980 318 HZ PHE 42 HZ PHE 42 -4.370 -5.331 -4.930 319 H ARG 43 H ARG 43 -3.966 -10.639 -9.627 320 HA ARG 43 HA ARG 43 -5.875 -10.971 -7.611 321 HB2 ARG 43 2HB ARG 43 -6.481 -10.786 -9.952 322 HB3 ARG 43 3HB ARG 43 -5.599 -12.251 -10.352 323 HG2 ARG 43 2HG ARG 43 -7.264 -13.604 -9.130 324 HG3 ARG 43 3HG ARG 43 -8.152 -12.135 -8.693 325 HD2 ARG 43 2HD ARG 43 -8.576 -11.644 -11.043 326 HD3 ARG 43 3HD ARG 43 -7.579 -13.006 -11.550 327 HE ARG 43 HE ARG 43 -9.511 -14.213 -10.102 328 HH11 ARG 43 1HH1 ARG 43 -9.676 -11.833 -12.691 329 HH12 ARG 43 2HH1 ARG 43 -11.192 -12.415 -13.304 330 HH21 ARG 43 1HH2 ARG 43 -11.452 -15.053 -10.991 331 HH22 ARG 43 2HH2 ARG 43 -12.201 -14.250 -12.338 332 H ASN 44 H ASN 44 -3.727 -13.381 -9.142 333 HA ASN 44 HA ASN 44 -4.689 -15.604 -7.615 334 HB2 ASN 44 2HB ASN 44 -2.177 -15.299 -9.306 335 HB3 ASN 44 3HB ASN 44 -2.687 -16.818 -8.573 336 HD21 ASN 44 1HD2 ASN 44 -2.344 -16.189 -11.409 337 HD22 ASN 44 2HD2 ASN 44 -3.871 -16.480 -12.158 338 H ALA 45 H ALA 45 -2.183 -13.208 -7.054 339 HA ALA 45 HA ALA 45 -0.863 -14.486 -4.881 340 HB1 ALA 45 3HB ALA 45 0.070 -12.488 -5.986 341 HB2 ALA 45 1HB ALA 45 -0.097 -12.228 -4.246 342 HB3 ALA 45 2HB ALA 45 -1.260 -11.511 -5.367 343 H ILE 46 H ILE 46 -3.660 -12.301 -5.071 344 HA ILE 46 HA ILE 46 -4.319 -12.182 -2.306 345 HB ILE 46 HB ILE 46 -6.162 -11.838 -4.722 346 HG12 ILE 46 2HG1 ILE 46 -4.659 -9.680 -3.161 347 HG13 ILE 46 3HG1 ILE 46 -4.212 -10.264 -4.761 348 HG21 ILE 46 1HG2 ILE 46 -7.625 -10.531 -3.215 349 HG22 ILE 46 2HG2 ILE 46 -6.556 -10.887 -1.857 350 HG23 ILE 46 3HG2 ILE 46 -7.441 -12.190 -2.652 351 HD11 ILE 46 3HD1 ILE 46 -6.345 -9.428 -5.650 352 HD12 ILE 46 1HD1 ILE 46 -5.374 -8.156 -4.910 353 HD13 ILE 46 2HD1 ILE 46 -6.758 -8.817 -4.045 354 H LEU 47 H LEU 47 -5.282 -14.364 -4.931 355 HA LEU 47 HA LEU 47 -7.202 -15.878 -3.433 356 HB2 LEU 47 2HB LEU 47 -5.759 -16.633 -5.999 357 HB3 LEU 47 3HB LEU 47 -7.162 -17.458 -5.332 358 HG LEU 47 HG LEU 47 -7.083 -14.640 -6.474 359 HD11 LEU 47 1HD1 LEU 47 -8.641 -15.493 -8.159 360 HD12 LEU 47 2HD1 LEU 47 -8.537 -17.107 -7.451 361 HD13 LEU 47 3HD1 LEU 47 -7.110 -16.370 -8.187 362 HD21 LEU 47 3HD2 LEU 47 -8.575 -14.596 -4.559 363 HD22 LEU 47 1HD2 LEU 47 -9.422 -16.031 -5.140 364 HD23 LEU 47 2HD2 LEU 47 -9.517 -14.517 -6.043 365 H LYS 48 H LYS 48 -3.778 -15.994 -3.782 366 HA LYS 48 HA LYS 48 -3.428 -18.610 -2.572 367 HB2 LYS 48 2HB LYS 48 -1.874 -17.478 -4.294 368 HB3 LYS 48 3HB LYS 48 -1.322 -16.448 -2.980 369 HG2 LYS 48 2HG LYS 48 -0.417 -18.353 -1.789 370 HG3 LYS 48 3HG LYS 48 -1.130 -19.478 -2.946 371 HD2 LYS 48 2HD LYS 48 1.290 -19.196 -3.370 372 HD3 LYS 48 3HD LYS 48 0.338 -18.613 -4.734 373 HE2 LYS 48 2HE LYS 48 2.200 -17.092 -4.260 374 HE3 LYS 48 3HE LYS 48 0.660 -16.284 -3.959 375 HZ1 LYS 48 3HZ LYS 48 2.243 -15.818 -2.214 376 HZ2 LYS 48 1HZ LYS 48 2.443 -17.468 -1.901 377 HZ3 LYS 48 2HZ LYS 48 0.961 -16.725 -1.588 378 H GLN 49 H GLN 49 -4.262 -15.553 -1.407 379 HA GLN 49 HA GLN 49 -3.153 -15.984 1.294 380 HB2 GLN 49 2HB GLN 49 -4.516 -13.546 0.070 381 HB3 GLN 49 3HB GLN 49 -3.951 -13.635 1.737 382 HG2 GLN 49 2HG GLN 49 -2.245 -13.762 -0.758 383 HG3 GLN 49 3HG GLN 49 -2.370 -12.411 0.362 384 HE21 GLN 49 1HE2 GLN 49 -1.061 -15.612 -0.126 385 HE22 GLN 49 2HE2 GLN 49 0.033 -15.585 1.208 386 H ALA 50 H ALA 50 -4.647 -15.371 3.091 387 HA ALA 50 HA ALA 50 -6.731 -17.251 3.258 388 HB1 ALA 50 3HB ALA 50 -5.392 -16.539 5.190 389 HB2 ALA 50 1HB ALA 50 -7.113 -16.322 5.509 390 HB3 ALA 50 2HB ALA 50 -6.106 -14.928 5.111 391 H ASP 51 H ASP 51 -7.175 -13.719 3.812 392 HA ASP 51 HA ASP 51 -9.927 -13.856 2.840 393 HB2 ASP 51 2HB ASP 51 -8.297 -11.542 3.953 394 HB3 ASP 51 3HB ASP 51 -9.981 -11.407 3.457 395 H LYS 52 H LYS 52 -10.711 -12.608 1.110 396 HA LYS 52 HA LYS 52 -8.764 -12.388 -1.082 397 HB2 LYS 52 2HB LYS 52 -11.801 -12.623 -1.207 398 HB3 LYS 52 3HB LYS 52 -10.707 -12.632 -2.586 399 HG2 LYS 52 2HG LYS 52 -10.896 -14.729 -0.405 400 HG3 LYS 52 3HG LYS 52 -11.369 -14.911 -2.098 401 HD2 LYS 52 2HD LYS 52 -9.008 -14.684 -2.798 402 HD3 LYS 52 3HD LYS 52 -8.516 -14.422 -1.124 403 HE2 LYS 52 2HE LYS 52 -9.831 -16.966 -2.130 404 HE3 LYS 52 3HE LYS 52 -8.091 -16.743 -1.965 405 HZ1 LYS 52 3HZ LYS 52 -8.352 -16.444 0.382 406 HZ2 LYS 52 1HZ LYS 52 -9.084 -17.897 -0.083 407 HZ3 LYS 52 2HZ LYS 52 -10.038 -16.540 0.261 408 H VAL 53 H VAL 53 -8.194 -10.389 0.195 409 HA VAL 53 HA VAL 53 -8.893 -8.195 -1.518 410 HB VAL 53 HB VAL 53 -10.666 -7.823 0.110 411 HG11 VAL 53 1HG1 VAL 53 -10.284 -7.466 2.513 412 HG12 VAL 53 2HG1 VAL 53 -8.577 -7.871 2.313 413 HG13 VAL 53 3HG1 VAL 53 -9.813 -9.095 2.020 414 HG21 VAL 53 3HG2 VAL 53 -10.128 -5.539 0.895 415 HG22 VAL 53 1HG2 VAL 53 -9.550 -5.808 -0.751 416 HG23 VAL 53 2HG2 VAL 53 -8.411 -5.832 0.598 417 H ALA 54 H ALA 54 -7.131 -6.941 -1.833 418 HA ALA 54 HA ALA 54 -4.755 -7.241 -0.109 419 HB1 ALA 54 3HB ALA 54 -4.411 -7.841 -2.474 420 HB2 ALA 54 1HB ALA 54 -3.485 -6.398 -2.056 421 HB3 ALA 54 2HB ALA 54 -4.984 -6.250 -2.977 422 H TYR 55 H TYR 55 -3.396 -5.149 -0.121 423 HA TYR 55 HA TYR 55 -4.930 -2.666 0.068 424 HB2 TYR 55 2HB TYR 55 -3.520 -3.934 2.467 425 HB3 TYR 55 3HB TYR 55 -4.069 -2.263 2.421 426 HD1 TYR 55 HD1 TYR 55 -6.541 -1.765 2.369 427 HD2 TYR 55 HD2 TYR 55 -5.100 -5.753 2.887 428 HE1 TYR 55 HE1 TYR 55 -8.743 -2.460 3.186 429 HE2 TYR 55 HE2 TYR 55 -7.307 -6.437 3.701 430 HH TYR 55 HH TYR 55 -10.069 -4.524 3.358 431 H LEU 56 H LEU 56 -3.704 -1.247 -0.991 432 HA LEU 56 HA LEU 56 -0.817 -1.543 -1.266 433 HB2 LEU 56 2HB LEU 56 -2.279 -0.902 -3.190 434 HB3 LEU 56 3HB LEU 56 -2.715 0.580 -2.358 435 HG LEU 56 HG LEU 56 -0.388 1.383 -2.521 436 HD11 LEU 56 1HD1 LEU 56 1.305 0.191 -3.834 437 HD12 LEU 56 2HD1 LEU 56 0.219 -1.191 -3.996 438 HD13 LEU 56 3HD1 LEU 56 0.825 -0.723 -2.406 439 HD21 LEU 56 3HD2 LEU 56 -1.931 1.952 -4.339 440 HD22 LEU 56 1HD2 LEU 56 -1.498 0.471 -5.199 441 HD23 LEU 56 2HD2 LEU 56 -0.298 1.742 -4.961 442 H VAL 57 H VAL 57 0.478 -0.754 0.269 443 HA VAL 57 HA VAL 57 -0.414 1.487 1.991 444 HB VAL 57 HB VAL 57 1.765 -0.600 2.530 445 HG11 VAL 57 1HG1 VAL 57 2.199 1.497 3.724 446 HG12 VAL 57 2HG1 VAL 57 1.728 0.238 4.861 447 HG13 VAL 57 3HG1 VAL 57 0.568 1.487 4.398 448 HG21 VAL 57 3HG2 VAL 57 0.181 -1.615 4.143 449 HG22 VAL 57 1HG2 VAL 57 -0.444 -1.667 2.493 450 HG23 VAL 57 2HG2 VAL 57 -1.072 -0.477 3.636 451 H MET 58 H MET 58 0.552 3.408 1.656 452 HA MET 58 HA MET 58 3.411 3.563 0.955 453 HB2 MET 58 2HB MET 58 3.128 5.163 -0.801 454 HB3 MET 58 3HB MET 58 2.021 3.855 -1.173 455 HG2 MET 58 2HG MET 58 1.226 6.495 0.085 456 HG3 MET 58 3HG MET 58 1.071 6.097 -1.622 457 HE1 MET 58 3HE MET 58 -1.637 3.279 -1.537 458 HE2 MET 58 1HE MET 58 0.117 3.113 -1.570 459 HE3 MET 58 2HE MET 58 -0.675 4.328 -2.576 460 H ASP 59 H ASP 59 4.205 5.844 1.233 461 HA ASP 59 HA ASP 59 3.213 7.133 3.658 462 HB2 ASP 59 2HB ASP 59 5.204 8.653 3.287 463 HB3 ASP 59 3HB ASP 59 5.635 6.949 3.372 464 H GLU 60 H GLU 60 3.037 9.636 3.573 465 HA GLU 60 HA GLU 60 0.898 10.305 1.828 466 HB2 GLU 60 2HB GLU 60 1.103 11.236 4.135 467 HB3 GLU 60 3HB GLU 60 2.473 12.218 3.609 468 HG2 GLU 60 2HG GLU 60 1.060 13.437 2.045 469 HG3 GLU 60 3HG GLU 60 -0.310 12.393 2.403 470 H ARG 61 H ARG 61 4.356 10.858 1.549 471 HA ARG 61 HA ARG 61 4.268 13.012 -0.332 472 HB2 ARG 61 2HB ARG 61 6.470 10.956 0.085 473 HB3 ARG 61 3HB ARG 61 6.639 12.468 -0.802 474 HG2 ARG 61 2HG ARG 61 6.065 12.202 2.169 475 HG3 ARG 61 3HG ARG 61 7.614 12.640 1.442 476 HD2 ARG 61 2HD ARG 61 6.577 14.684 0.497 477 HD3 ARG 61 3HD ARG 61 5.041 14.248 1.253 478 HE ARG 61 HE ARG 61 6.816 14.295 3.325 479 HH11 ARG 61 1HH1 ARG 61 5.883 16.668 0.894 480 HH12 ARG 61 2HH1 ARG 61 6.192 18.027 1.926 481 HH21 ARG 61 1HH2 ARG 61 7.221 16.072 4.655 482 HH22 ARG 61 2HH2 ARG 61 6.955 17.684 4.072 483 H THR 62 H THR 62 4.220 9.516 -0.650 484 HA THR 62 HA THR 62 4.238 9.395 -3.511 485 HB THR 62 HB THR 62 3.159 7.376 -1.486 486 HG1 THR 62 HG1 THR 62 5.389 7.886 -1.188 487 HG21 THR 62 3HG2 THR 62 2.365 6.865 -3.759 488 HG22 THR 62 1HG2 THR 62 3.579 5.691 -3.258 489 HG23 THR 62 2HG2 THR 62 4.013 6.981 -4.381 490 H TRP 63 H TRP 63 1.743 9.716 -1.028 491 HA TRP 63 HA TRP 63 -0.541 9.338 -2.691 492 HB2 TRP 63 2HB TRP 63 -0.769 9.069 -0.287 493 HB3 TRP 63 3HB TRP 63 -0.235 10.720 0.001 494 HD1 TRP 63 HD1 TRP 63 -2.107 12.524 0.188 495 HE1 TRP 63 HE1 TRP 63 -4.655 12.540 -0.178 496 HE3 TRP 63 HE3 TRP 63 -2.681 7.919 -2.007 497 HZ2 TRP 63 HZ2 TRP 63 -6.634 10.855 -1.257 498 HZ3 TRP 63 HZ3 TRP 63 -4.941 7.218 -2.693 499 HH2 TRP 63 HH2 TRP 63 -6.878 8.658 -2.324 500 H LYS 64 H LYS 64 1.436 12.191 -1.965 501 HA LYS 64 HA LYS 64 -0.228 14.246 -2.895 502 HB2 LYS 64 2HB LYS 64 2.787 14.074 -3.297 503 HB3 LYS 64 3HB LYS 64 1.813 15.541 -3.339 504 HG2 LYS 64 2HG LYS 64 2.394 13.810 -0.931 505 HG3 LYS 64 3HG LYS 64 3.002 15.427 -1.259 506 HD2 LYS 64 2HD LYS 64 0.573 16.224 -1.189 507 HD3 LYS 64 3HD LYS 64 0.159 14.626 -0.570 508 HE2 LYS 64 2HE LYS 64 1.704 14.984 1.340 509 HE3 LYS 64 3HE LYS 64 2.072 16.595 0.718 510 HZ1 LYS 64 3HZ LYS 64 -0.649 15.705 1.500 511 HZ2 LYS 64 1HZ LYS 64 -0.168 17.267 1.081 512 HZ3 LYS 64 2HZ LYS 64 0.395 16.568 2.517 513 H LYS 65 H LYS 65 1.567 11.836 -4.605 514 HA LYS 65 HA LYS 65 1.301 12.979 -7.248 515 HB2 LYS 65 2HB LYS 65 2.074 10.108 -6.577 516 HB3 LYS 65 3HB LYS 65 2.514 11.044 -8.002 517 HG2 LYS 65 2HG LYS 65 3.531 11.460 -5.174 518 HG3 LYS 65 3HG LYS 65 4.434 10.780 -6.521 519 HD2 LYS 65 2HD LYS 65 3.405 13.637 -6.372 520 HD3 LYS 65 3HD LYS 65 5.058 13.135 -6.023 521 HE2 LYS 65 2HE LYS 65 5.337 12.372 -8.333 522 HE3 LYS 65 3HE LYS 65 3.664 12.806 -8.697 523 HZ1 LYS 65 3HZ LYS 65 5.103 14.536 -9.456 524 HZ2 LYS 65 1HZ LYS 65 5.852 14.659 -7.944 525 HZ3 LYS 65 2HZ LYS 65 4.239 15.121 -8.126 526 H VAL 66 H VAL 66 -0.006 10.140 -5.515 527 HA VAL 66 HA VAL 66 -1.667 9.122 -7.534 528 HB VAL 66 HB VAL 66 -1.963 8.841 -4.506 529 HG11 VAL 66 1HG1 VAL 66 -3.176 7.104 -6.695 530 HG12 VAL 66 2HG1 VAL 66 -4.058 8.185 -5.614 531 HG13 VAL 66 3HG1 VAL 66 -3.241 6.768 -4.960 532 HG21 VAL 66 3HG2 VAL 66 -0.729 6.715 -4.772 533 HG22 VAL 66 1HG2 VAL 66 0.239 8.088 -5.313 534 HG23 VAL 66 2HG2 VAL 66 -0.533 7.032 -6.498 535 H TYR 67 H TYR 67 -2.598 11.087 -4.719 536 HA TYR 67 HA TYR 67 -5.296 11.537 -5.151 537 HB2 TYR 67 2HB TYR 67 -3.958 12.169 -3.108 538 HB3 TYR 67 3HB TYR 67 -3.284 13.525 -4.001 539 HD1 TYR 67 HD1 TYR 67 -6.601 12.119 -2.909 540 HD2 TYR 67 HD2 TYR 67 -4.380 15.655 -3.797 541 HE1 TYR 67 HE1 TYR 67 -8.456 13.489 -2.092 542 HE2 TYR 67 HE2 TYR 67 -6.253 17.022 -2.988 543 HH TYR 67 HH TYR 67 -8.610 16.868 -2.570 544 H ASP 68 H ASP 68 -2.516 13.304 -6.449 545 HA ASP 68 HA ASP 68 -3.897 15.393 -7.769 546 HB2 ASP 68 2HB ASP 68 -1.508 15.594 -7.360 547 HB3 ASP 68 3HB ASP 68 -1.166 14.137 -8.290 548 H LEU 69 H LEU 69 -2.681 12.260 -8.942 549 HA LEU 69 HA LEU 69 -3.365 12.538 -11.662 550 HB2 LEU 69 2HB LEU 69 -3.100 9.969 -10.057 551 HB3 LEU 69 3HB LEU 69 -3.036 10.097 -11.811 552 HG LEU 69 HG LEU 69 -0.986 11.182 -9.847 553 HD11 LEU 69 1HD1 LEU 69 -0.764 8.927 -11.853 554 HD12 LEU 69 2HD1 LEU 69 -0.844 8.766 -10.097 555 HD13 LEU 69 3HD1 LEU 69 0.547 9.545 -10.843 556 HD21 LEU 69 3HD2 LEU 69 -1.168 12.744 -11.711 557 HD22 LEU 69 1HD2 LEU 69 -0.991 11.423 -12.867 558 HD23 LEU 69 2HD2 LEU 69 0.352 11.859 -11.809 559 H LEU 70 H LEU 70 -5.190 11.333 -8.914 560 HA LEU 70 HA LEU 70 -7.408 10.198 -10.229 561 HB2 LEU 70 2HB LEU 70 -7.226 11.548 -7.503 562 HB3 LEU 70 3HB LEU 70 -8.609 10.608 -8.051 563 HG LEU 70 HG LEU 70 -5.801 9.530 -7.589 564 HD11 LEU 70 1HD1 LEU 70 -8.348 9.030 -6.016 565 HD12 LEU 70 2HD1 LEU 70 -6.980 10.013 -5.488 566 HD13 LEU 70 3HD1 LEU 70 -6.776 8.278 -5.720 567 HD21 LEU 70 3HD2 LEU 70 -8.295 8.049 -8.500 568 HD22 LEU 70 1HD2 LEU 70 -6.754 7.301 -8.063 569 HD23 LEU 70 2HD2 LEU 70 -6.849 8.356 -9.468 570 H ILE 71 H ILE 71 -7.044 13.441 -8.806 571 HA ILE 71 HA ILE 71 -9.513 14.509 -9.764 572 HB ILE 71 HB ILE 71 -7.021 16.059 -8.893 573 HG12 ILE 71 2HG1 ILE 71 -9.340 15.068 -7.163 574 HG13 ILE 71 3HG1 ILE 71 -7.716 14.389 -7.168 575 HG21 ILE 71 1HG2 ILE 71 -8.602 17.879 -8.297 576 HG22 ILE 71 2HG2 ILE 71 -9.950 16.916 -8.907 577 HG23 ILE 71 3HG2 ILE 71 -8.701 17.487 -10.014 578 HD11 ILE 71 3HD1 ILE 71 -8.497 17.159 -6.282 579 HD12 ILE 71 1HD1 ILE 71 -6.843 16.534 -6.333 580 HD13 ILE 71 2HD1 ILE 71 -8.035 15.802 -5.258 581 H LEU 72 H LEU 72 -6.350 14.201 -11.152 582 HA LEU 72 HA LEU 72 -6.556 16.224 -13.164 583 HB2 LEU 72 2HB LEU 72 -4.422 15.338 -12.126 584 HB3 LEU 72 3HB LEU 72 -4.637 13.858 -13.033 585 HG LEU 72 HG LEU 72 -2.944 15.606 -13.917 586 HD11 LEU 72 1HD1 LEU 72 -3.620 13.676 -15.270 587 HD12 LEU 72 2HD1 LEU 72 -3.362 15.103 -16.271 588 HD13 LEU 72 3HD1 LEU 72 -5.005 14.578 -15.894 589 HD21 LEU 72 3HD2 LEU 72 -5.460 17.014 -14.885 590 HD22 LEU 72 1HD2 LEU 72 -3.799 17.424 -15.321 591 HD23 LEU 72 2HD2 LEU 72 -4.343 17.615 -13.657 592 H HIS 73 H HIS 73 -7.133 12.698 -13.081 593 HA HIS 73 HA HIS 73 -7.645 12.580 -15.951 594 HB2 HIS 73 2HB HIS 73 -7.774 10.503 -13.729 595 HB3 HIS 73 3HB HIS 73 -8.330 10.150 -15.363 596 HD1 HIS 73 HD1 HIS 73 -6.573 8.618 -16.269 597 HD2 HIS 73 HD2 HIS 73 -4.910 11.893 -14.326 598 HE1 HIS 73 HE1 HIS 73 -4.102 8.442 -16.649 599 HE2 HIS 73 HE2 HIS 73 -3.179 10.575 -15.704 600 H ASP 74 H ASP 74 -9.635 11.670 -13.090 601 HA ASP 74 HA ASP 74 -11.934 13.101 -13.566 602 HB2 ASP 74 2HB ASP 74 -13.504 11.494 -14.643 603 HB3 ASP 74 3HB ASP 74 -12.233 12.003 -15.737 604 H PHE 75 H PHE 75 -11.166 12.871 -11.284 605 HA PHE 75 HA PHE 75 -13.041 11.270 -9.830 606 HB2 PHE 75 2HB PHE 75 -11.033 9.670 -10.383 607 HB3 PHE 75 3HB PHE 75 -10.125 10.617 -9.216 608 HD1 PHE 75 HD2 PHE 75 -13.496 8.978 -9.407 609 HD2 PHE 75 HD1 PHE 75 -9.975 9.616 -7.104 610 HE1 PHE 75 HE2 PHE 75 -14.376 7.496 -7.663 611 HE2 PHE 75 HE1 PHE 75 -10.845 8.137 -5.375 612 HZ PHE 75 HZ PHE 75 -13.042 7.069 -5.633 613 H THR 76 H THR 76 -13.602 13.354 -9.282 614 HA THR 76 HA THR 76 -11.892 15.444 -8.481 615 HB THR 76 HB THR 76 -14.303 15.491 -9.484 616 HG1 THR 76 HG1 THR 76 -13.459 17.416 -9.107 617 HG21 THR 76 3HG2 THR 76 -15.475 14.209 -7.739 618 HG22 THR 76 1HG2 THR 76 -16.145 15.830 -7.893 619 HG23 THR 76 2HG2 THR 76 -15.074 15.445 -6.541 620 HA PRO 77 HA PRO 77 -10.952 14.899 -4.124 621 HB2 PRO 77 2HB PRO 77 -11.761 17.358 -2.992 622 HB3 PRO 77 3HB PRO 77 -10.202 17.041 -3.775 623 HG2 PRO 77 2HG PRO 77 -12.673 18.276 -4.945 624 HG3 PRO 77 3HG PRO 77 -10.966 18.750 -5.140 625 HD2 PRO 77 2HD PRO 77 -12.157 17.402 -7.078 626 HD3 PRO 77 3HD PRO 77 -10.503 16.972 -6.609 627 H GLU 78 H GLU 78 -14.192 16.015 -4.859 628 HA GLU 78 HA GLU 78 -15.450 15.588 -2.362 629 HB2 GLU 78 2HB GLU 78 -16.654 15.402 -5.152 630 HB3 GLU 78 3HB GLU 78 -17.566 15.574 -3.651 631 HG2 GLU 78 2HG GLU 78 -16.592 17.778 -3.265 632 HG3 GLU 78 3HG GLU 78 -15.575 17.611 -4.695 633 H GLU 79 H GLU 79 -14.956 13.469 -5.159 634 HA GLU 79 HA GLU 79 -16.416 11.221 -4.167 635 HB2 GLU 79 2HB GLU 79 -14.206 11.254 -6.271 636 HB3 GLU 79 3HB GLU 79 -15.387 9.969 -6.023 637 HG2 GLU 79 2HG GLU 79 -15.967 12.786 -6.969 638 HG3 GLU 79 3HG GLU 79 -15.961 11.339 -7.964 639 H ILE 80 H ILE 80 -12.960 12.022 -4.317 640 HA ILE 80 HA ILE 80 -11.865 9.697 -3.228 641 HB ILE 80 HB ILE 80 -10.696 12.498 -2.851 642 HG12 ILE 80 2HG1 ILE 80 -10.355 10.659 -5.267 643 HG13 ILE 80 3HG1 ILE 80 -11.342 12.114 -5.252 644 HG21 ILE 80 1HG2 ILE 80 -8.509 11.336 -2.872 645 HG22 ILE 80 2HG2 ILE 80 -9.324 9.785 -3.073 646 HG23 ILE 80 3HG2 ILE 80 -9.540 10.710 -1.589 647 HD11 ILE 80 3HD1 ILE 80 -9.320 13.452 -4.856 648 HD12 ILE 80 1HD1 ILE 80 -9.237 12.512 -6.348 649 HD13 ILE 80 2HD1 ILE 80 -8.351 11.976 -4.921 650 H LYS 81 H LYS 81 -12.808 12.712 -1.562 651 HA LYS 81 HA LYS 81 -11.920 11.943 1.030 652 HB2 LYS 81 2HB LYS 81 -12.882 13.988 1.834 653 HB3 LYS 81 3HB LYS 81 -12.175 14.316 0.261 654 HG2 LYS 81 2HG LYS 81 -14.539 14.049 -0.692 655 HG3 LYS 81 3HG LYS 81 -15.108 14.086 0.974 656 HD2 LYS 81 2HD LYS 81 -13.460 16.309 -0.319 657 HD3 LYS 81 3HD LYS 81 -15.224 16.299 -0.252 658 HE2 LYS 81 2HE LYS 81 -14.452 17.720 1.519 659 HE3 LYS 81 3HE LYS 81 -15.072 16.253 2.265 660 HZ1 LYS 81 3HZ LYS 81 -12.982 17.051 3.242 661 HZ2 LYS 81 1HZ LYS 81 -12.194 16.811 1.768 662 HZ3 LYS 81 2HZ LYS 81 -12.830 15.491 2.613 663 H SER 82 H SER 82 -14.881 11.387 -0.701 664 HA SER 82 HA SER 82 -16.616 10.787 1.456 665 HB2 SER 82 2HB SER 82 -17.390 11.229 -0.873 666 HB3 SER 82 3HB SER 82 -16.685 9.699 -1.394 667 HG SER 82 HG SER 82 -18.851 10.137 0.372 668 H PHE 83 H PHE 83 -14.228 8.863 -0.305 669 HA PHE 83 HA PHE 83 -15.000 6.349 0.956 670 HB2 PHE 83 2HB PHE 83 -12.658 6.989 -0.870 671 HB3 PHE 83 3HB PHE 83 -13.100 5.375 -0.324 672 HD1 PHE 83 HD2 PHE 83 -15.634 4.677 -0.843 673 HD2 PHE 83 HD1 PHE 83 -13.469 7.682 -2.976 674 HE1 PHE 83 HE2 PHE 83 -17.168 4.432 -2.751 675 HE2 PHE 83 HE1 PHE 83 -15.009 7.438 -4.874 676 HZ PHE 83 HZ PHE 83 -16.862 5.816 -4.769 677 H PHE 84 H PHE 84 -13.067 8.954 1.934 678 HA PHE 84 HA PHE 84 -11.409 7.454 3.781 679 HB2 PHE 84 2HB PHE 84 -12.088 10.407 3.541 680 HB3 PHE 84 3HB PHE 84 -11.192 9.789 4.925 681 HD1 PHE 84 HD1 PHE 84 -11.020 10.478 1.302 682 HD2 PHE 84 HD2 PHE 84 -8.883 8.976 4.677 683 HE1 PHE 84 HE1 PHE 84 -8.915 10.661 0.057 684 HE2 PHE 84 HE2 PHE 84 -6.779 9.161 3.420 685 HZ PHE 84 HZ PHE 84 -6.791 10.005 1.109 686 H GLU 85 H GLU 85 -14.548 9.024 3.818 687 HA GLU 85 HA GLU 85 -15.036 8.493 6.631 688 HB2 GLU 85 2HB GLU 85 -16.929 9.517 4.468 689 HB3 GLU 85 3HB GLU 85 -17.252 9.501 6.202 690 HG2 GLU 85 2HG GLU 85 -15.349 11.081 6.536 691 HG3 GLU 85 3HG GLU 85 -15.117 11.125 4.787 692 H ASN 86 H ASN 86 -15.105 6.314 6.991 693 HA ASN 86 HA ASN 86 -16.491 4.365 5.457 694 HB2 ASN 86 2HB ASN 86 -14.756 3.668 7.008 695 HB3 ASN 86 3HB ASN 86 -15.577 4.424 8.369 696 HD21 ASN 86 1HD2 ASN 86 -15.707 2.561 9.579 697 HD22 ASN 86 2HD2 ASN 86 -16.668 1.196 9.142 698 H LYS 87 H LYS 87 -18.491 5.310 4.973 699 HA LYS 87 HA LYS 87 -20.436 5.731 7.147 700 HB2 LYS 87 2HB LYS 87 -20.251 7.563 5.501 701 HB3 LYS 87 3HB LYS 87 -20.554 6.446 4.174 702 HG2 LYS 87 2HG LYS 87 -22.828 6.016 5.089 703 HG3 LYS 87 3HG LYS 87 -22.527 7.199 6.362 704 HD2 LYS 87 2HD LYS 87 -22.506 7.817 3.381 705 HD3 LYS 87 3HD LYS 87 -23.884 8.084 4.448 706 HE2 LYS 87 2HE LYS 87 -22.533 9.676 5.778 707 HE3 LYS 87 3HE LYS 87 -21.170 9.427 4.682 708 HZ1 LYS 87 3HZ LYS 87 -22.475 11.425 4.175 709 HZ2 LYS 87 1HZ LYS 87 -23.827 10.461 3.865 710 HZ3 LYS 87 2HZ LYS 87 -22.454 10.331 2.886 711 H GLY 88 H GLY 88 -20.532 3.461 7.615 712 HA2 GLY 88 2HA GLY 88 -21.660 1.463 7.636 713 HA3 GLY 88 3HA GLY 88 -22.779 2.175 6.485 714 H LYS 89 H LYS 89 -19.499 2.116 5.486 715 HA LYS 89 HA LYS 89 -19.546 -0.400 4.107 716 HB2 LYS 89 2HB LYS 89 -21.122 0.931 2.679 717 HB3 LYS 89 3HB LYS 89 -19.886 2.156 2.449 718 HG2 LYS 89 2HG LYS 89 -20.128 0.678 0.475 719 HG3 LYS 89 3HG LYS 89 -18.510 0.594 1.173 720 HD2 LYS 89 2HD LYS 89 -19.373 -1.654 0.504 721 HD3 LYS 89 3HD LYS 89 -19.009 -1.552 2.225 722 HE2 LYS 89 2HE LYS 89 -21.108 -2.784 1.814 723 HE3 LYS 89 3HE LYS 89 -21.401 -1.310 2.736 724 HZ1 LYS 89 3HZ LYS 89 -23.049 -1.596 1.040 725 HZ2 LYS 89 1HZ LYS 89 -21.867 -1.675 -0.165 726 HZ3 LYS 89 2HZ LYS 89 -22.111 -0.236 0.689 727 H ARG 90 H ARG 90 -17.594 -0.895 3.243 728 HA ARG 90 HA ARG 90 -15.364 -0.322 4.610 729 HB2 ARG 90 2HB ARG 90 -15.741 -1.372 1.804 730 HB3 ARG 90 3HB ARG 90 -14.127 -1.253 2.496 731 HG2 ARG 90 2HG ARG 90 -16.406 -2.834 3.728 732 HG3 ARG 90 3HG ARG 90 -15.131 -3.511 2.712 733 HD2 ARG 90 2HD ARG 90 -14.755 -2.148 5.399 734 HD3 ARG 90 3HD ARG 90 -14.565 -3.873 5.051 735 HE ARG 90 HE ARG 90 -12.881 -2.449 3.328 736 HH11 ARG 90 1HH1 ARG 90 -13.061 -3.101 6.779 737 HH12 ARG 90 2HH1 ARG 90 -11.350 -2.954 6.999 738 HH21 ARG 90 1HH2 ARG 90 -10.687 -2.258 3.624 739 HH22 ARG 90 2HH2 ARG 90 -9.996 -2.471 5.206 740 HA PRO 91 HA PRO 91 -13.851 3.582 2.991 741 HB2 PRO 91 2HB PRO 91 -11.602 3.743 4.638 742 HB3 PRO 91 3HB PRO 91 -13.241 4.200 5.131 743 HG2 PRO 91 2HG PRO 91 -11.649 1.951 6.035 744 HG3 PRO 91 3HG PRO 91 -13.203 2.538 6.659 745 HD2 PRO 91 2HD PRO 91 -12.677 0.281 4.863 746 HD3 PRO 91 3HD PRO 91 -14.173 0.696 5.719 747 H VAL 92 H VAL 92 -13.162 3.277 0.931 748 HA VAL 92 HA VAL 92 -11.204 1.417 0.055 749 HB VAL 92 HB VAL 92 -12.231 3.906 -1.395 750 HG11 VAL 92 1HG1 VAL 92 -10.880 1.431 -2.545 751 HG12 VAL 92 2HG1 VAL 92 -10.179 3.047 -2.441 752 HG13 VAL 92 3HG1 VAL 92 -11.568 2.760 -3.486 753 HG21 VAL 92 3HG2 VAL 92 -13.874 2.406 -2.476 754 HG22 VAL 92 1HG2 VAL 92 -14.084 2.422 -0.725 755 HG23 VAL 92 2HG2 VAL 92 -13.293 1.050 -1.505 756 H PHE 93 H PHE 93 -11.043 4.834 0.954 757 HA PHE 93 HA PHE 93 -8.077 4.782 0.719 758 HB2 PHE 93 2HB PHE 93 -9.876 7.247 0.720 759 HB3 PHE 93 3HB PHE 93 -8.131 7.214 0.470 760 HD1 PHE 93 HD1 PHE 93 -7.604 5.224 -1.505 761 HD2 PHE 93 HD2 PHE 93 -10.972 7.829 -1.258 762 HE1 PHE 93 HE1 PHE 93 -7.925 5.028 -3.929 763 HE2 PHE 93 HE2 PHE 93 -11.293 7.630 -3.673 764 HZ PHE 93 HZ PHE 93 -9.774 6.235 -5.021 765 H VAL 94 H VAL 94 -7.313 4.346 2.697 766 HA VAL 94 HA VAL 94 -8.504 5.678 5.075 767 HB VAL 94 HB VAL 94 -6.739 3.170 5.026 768 HG11 VAL 94 1HG1 VAL 94 -8.375 4.400 7.282 769 HG12 VAL 94 2HG1 VAL 94 -6.615 4.409 7.144 770 HG13 VAL 94 3HG1 VAL 94 -7.470 2.885 7.373 771 HG21 VAL 94 3HG2 VAL 94 -8.778 1.865 5.491 772 HG22 VAL 94 1HG2 VAL 94 -8.896 2.690 3.936 773 HG23 VAL 94 2HG2 VAL 94 -9.763 3.321 5.339 774 H LYS 95 H LYS 95 -7.001 6.624 6.607 775 HA LYS 95 HA LYS 95 -4.168 6.728 5.931 776 HB2 LYS 95 2HB LYS 95 -4.001 9.143 5.926 777 HB3 LYS 95 3HB LYS 95 -5.132 8.639 4.678 778 HG2 LYS 95 2HG LYS 95 -7.025 9.399 5.923 779 HG3 LYS 95 3HG LYS 95 -6.076 9.601 7.400 780 HD2 LYS 95 2HD LYS 95 -5.710 11.233 4.851 781 HD3 LYS 95 3HD LYS 95 -6.584 11.778 6.284 782 HE2 LYS 95 2HE LYS 95 -4.528 11.659 7.620 783 HE3 LYS 95 3HE LYS 95 -3.638 11.014 6.239 784 HZ1 LYS 95 3HZ LYS 95 -3.192 13.337 6.477 785 HZ2 LYS 95 1HZ LYS 95 -4.839 13.719 6.459 786 HZ3 LYS 95 2HZ LYS 95 -4.097 13.115 5.066 787 H GLY 96 H GLY 96 -2.997 8.123 7.559 788 HA2 GLY 96 2HA GLY 96 -3.352 9.085 9.913 789 HA3 GLY 96 3HA GLY 96 -3.892 7.445 10.298 790 H SER 97 H SER 97 -2.073 7.198 11.765 791 HA SER 97 HA SER 97 0.613 7.024 10.732 792 HB2 SER 97 2HB SER 97 0.153 7.324 13.157 793 HB3 SER 97 3HB SER 97 -0.619 5.740 13.212 794 HG SER 97 HG SER 97 1.880 6.220 13.656 795 H LEU 98 H LEU 98 1.746 4.740 10.955 796 HA LEU 98 HA LEU 98 0.860 2.969 9.003 797 HB2 LEU 98 2HB LEU 98 3.182 3.017 9.830 798 HB3 LEU 98 3HB LEU 98 2.667 2.384 11.387 799 HG LEU 98 HG LEU 98 1.976 0.250 10.269 800 HD11 LEU 98 1HD1 LEU 98 2.656 -0.230 7.956 801 HD12 LEU 98 2HD1 LEU 98 3.197 1.438 7.755 802 HD13 LEU 98 3HD1 LEU 98 1.487 1.086 8.023 803 HD21 LEU 98 3HD2 LEU 98 4.200 0.388 11.299 804 HD22 LEU 98 1HD2 LEU 98 4.883 0.998 9.787 805 HD23 LEU 98 2HD2 LEU 98 4.237 -0.643 9.870 806 H GLU 99 H GLU 99 0.517 2.740 12.507 807 HA GLU 99 HA GLU 99 -0.966 0.262 12.438 808 HB2 GLU 99 2HB GLU 99 -0.420 2.111 14.803 809 HB3 GLU 99 3HB GLU 99 -0.954 0.427 14.875 810 HG2 GLU 99 2HG GLU 99 1.192 -0.200 13.692 811 HG3 GLU 99 3HG GLU 99 1.724 1.465 13.909 812 H SER 100 H SER 100 -1.699 3.687 12.915 813 HA SER 100 HA SER 100 -4.350 3.457 13.868 814 HB2 SER 100 2HB SER 100 -3.060 5.700 12.270 815 HB3 SER 100 3HB SER 100 -4.531 5.847 13.230 816 HG SER 100 HG SER 100 -2.574 4.817 14.763 817 H ALA 101 H ALA 101 -3.090 4.008 10.588 818 HA ALA 101 HA ALA 101 -5.541 4.014 9.181 819 HB1 ALA 101 3HB ALA 101 -4.142 3.735 7.175 820 HB2 ALA 101 1HB ALA 101 -2.765 3.297 8.187 821 HB3 ALA 101 2HB ALA 101 -3.439 4.926 8.276 822 H ALA 102 H ALA 102 -3.489 1.439 10.354 823 HA ALA 102 HA ALA 102 -4.535 -0.698 8.763 824 HB1 ALA 102 3HB ALA 102 -2.323 -0.799 9.781 825 HB2 ALA 102 1HB ALA 102 -3.326 -2.131 10.365 826 HB3 ALA 102 2HB ALA 102 -3.033 -0.727 11.393 827 H GLU 103 H GLU 103 -5.242 0.569 12.017 828 HA GLU 103 HA GLU 103 -7.130 -1.405 12.810 829 HB2 GLU 103 2HB GLU 103 -6.899 1.482 13.771 830 HB3 GLU 103 3HB GLU 103 -7.777 0.188 14.591 831 HG2 GLU 103 2HG GLU 103 -5.667 -1.016 14.965 832 HG3 GLU 103 3HG GLU 103 -4.787 0.239 14.116 833 H GLN 104 H GLN 104 -7.437 1.742 11.237 834 HA GLN 104 HA GLN 104 -10.301 1.804 11.102 835 HB2 GLN 104 2HB GLN 104 -8.207 3.297 9.481 836 HB3 GLN 104 3HB GLN 104 -9.929 3.675 9.481 837 HG2 GLN 104 2HG GLN 104 -9.827 4.303 11.841 838 HG3 GLN 104 3HG GLN 104 -8.138 3.807 11.929 839 HE21 GLN 104 1HE2 GLN 104 -6.562 5.064 10.873 840 HE22 GLN 104 2HE2 GLN 104 -6.854 6.703 10.419 841 H ALA 105 H ALA 105 -7.768 0.618 8.914 842 HA ALA 105 HA ALA 105 -9.638 -0.093 6.792 843 HB1 ALA 105 3HB ALA 105 -7.361 0.633 6.222 844 HB2 ALA 105 1HB ALA 105 -7.667 -1.005 5.639 845 HB3 ALA 105 2HB ALA 105 -6.688 -0.748 7.087 846 H GLY 106 H GLY 106 -8.677 -1.509 9.730 847 HA2 GLY 106 2HA GLY 106 -9.421 -3.423 10.746 848 HA3 GLY 106 3HA GLY 106 -10.434 -3.721 9.341 849 H ILE 107 H ILE 107 -6.965 -3.352 9.149 850 HA ILE 107 HA ILE 107 -6.591 -6.109 8.192 851 HB ILE 107 HB ILE 107 -4.431 -3.955 8.428 852 HG12 ILE 107 2HG1 ILE 107 -6.217 -4.307 5.975 853 HG13 ILE 107 3HG1 ILE 107 -6.409 -3.010 7.150 854 HG21 ILE 107 1HG2 ILE 107 -4.727 -6.292 6.494 855 HG22 ILE 107 2HG2 ILE 107 -3.675 -6.252 7.910 856 HG23 ILE 107 3HG2 ILE 107 -3.369 -5.165 6.556 857 HD11 ILE 107 3HD1 ILE 107 -5.222 -2.244 5.199 858 HD12 ILE 107 1HD1 ILE 107 -3.993 -3.488 5.411 859 HD13 ILE 107 2HD1 ILE 107 -4.160 -2.195 6.606 860 H VAL 108 H VAL 108 -4.898 -7.502 9.235 861 HA VAL 108 HA VAL 108 -4.741 -7.229 12.086 862 HB VAL 108 HB VAL 108 -3.101 -9.097 10.315 863 HG11 VAL 108 1HG1 VAL 108 -3.581 -9.141 13.319 864 HG12 VAL 108 2HG1 VAL 108 -2.054 -8.801 12.503 865 HG13 VAL 108 3HG1 VAL 108 -2.763 -10.412 12.401 866 HG21 VAL 108 3HG2 VAL 108 -5.688 -9.676 11.815 867 HG22 VAL 108 1HG2 VAL 108 -4.742 -10.839 10.876 868 HG23 VAL 108 2HG2 VAL 108 -5.540 -9.489 10.067 869 H VAL 109 H VAL 109 -3.786 -5.478 12.749 870 HA VAL 109 HA VAL 109 -1.753 -3.961 11.605 871 HB VAL 109 HB VAL 109 -2.424 -4.093 14.584 872 HG11 VAL 109 1HG1 VAL 109 -1.694 -1.738 14.658 873 HG12 VAL 109 2HG1 VAL 109 -1.275 -1.804 12.945 874 HG13 VAL 109 3HG1 VAL 109 -0.391 -2.791 14.109 875 HG21 VAL 109 3HG2 VAL 109 -3.791 -2.405 12.457 876 HG22 VAL 109 1HG2 VAL 109 -4.100 -2.333 14.191 877 HG23 VAL 109 2HG2 VAL 109 -4.497 -3.794 13.282 878 H ASP 110 H ASP 110 -1.643 -6.479 14.035 879 HA ASP 110 HA ASP 110 0.953 -6.298 15.008 880 HB2 ASP 110 2HB ASP 110 -0.899 -7.679 15.973 881 HB3 ASP 110 3HB ASP 110 -0.745 -8.812 14.637 882 H GLU 111 H GLU 111 -0.244 -8.038 12.146 883 HA GLU 111 HA GLU 111 2.290 -9.279 11.530 884 HB2 GLU 111 2HB GLU 111 -0.210 -9.025 9.816 885 HB3 GLU 111 3HB GLU 111 1.177 -10.040 9.440 886 HG2 GLU 111 2HG GLU 111 -0.680 -10.352 11.810 887 HG3 GLU 111 3HG GLU 111 -0.683 -11.352 10.360 888 H LEU 112 H LEU 112 0.415 -6.513 10.147 889 HA LEU 112 HA LEU 112 2.254 -6.150 7.967 890 HB2 LEU 112 2HB LEU 112 1.056 -4.095 7.420 891 HB3 LEU 112 3HB LEU 112 -0.018 -5.447 7.700 892 HG LEU 112 HG LEU 112 -0.256 -4.381 10.130 893 HD11 LEU 112 1HD1 LEU 112 -0.215 -1.930 10.165 894 HD12 LEU 112 2HD1 LEU 112 0.494 -1.900 8.548 895 HD13 LEU 112 3HD1 LEU 112 1.399 -2.587 9.898 896 HD21 LEU 112 3HD2 LEU 112 -1.663 -3.171 7.737 897 HD22 LEU 112 1HD2 LEU 112 -2.239 -3.203 9.402 898 HD23 LEU 112 2HD2 LEU 112 -2.073 -4.705 8.511 899 H VAL 113 H VAL 113 2.253 -4.864 11.198 900 HA VAL 113 HA VAL 113 4.050 -2.683 10.775 901 HB VAL 113 HB VAL 113 3.431 -4.260 13.319 902 HG11 VAL 113 1HG1 VAL 113 4.540 -2.451 14.606 903 HG12 VAL 113 2HG1 VAL 113 5.081 -1.699 13.102 904 HG13 VAL 113 3HG1 VAL 113 5.688 -3.291 13.563 905 HG21 VAL 113 3HG2 VAL 113 2.120 -2.275 13.946 906 HG22 VAL 113 1HG2 VAL 113 1.555 -2.944 12.416 907 HG23 VAL 113 2HG2 VAL 113 2.548 -1.486 12.425 908 H GLN 114 H GLN 114 4.501 -6.107 11.566 909 HA GLN 114 HA GLN 114 7.348 -6.134 11.705 910 HB2 GLN 114 2HB GLN 114 5.409 -8.337 10.856 911 HB3 GLN 114 3HB GLN 114 7.117 -8.591 11.214 912 HG2 GLN 114 2HG GLN 114 5.067 -7.577 13.210 913 HG3 GLN 114 3HG GLN 114 5.591 -9.251 13.074 914 HE21 GLN 114 1HE2 GLN 114 6.607 -6.007 13.956 915 HE22 GLN 114 2HE2 GLN 114 7.968 -6.470 14.909 916 H THR 115 H THR 115 5.058 -6.888 9.131 917 HA THR 115 HA THR 115 6.706 -7.474 7.009 918 HB THR 115 HB THR 115 3.943 -6.260 7.214 919 HG1 THR 115 HG1 THR 115 3.310 -8.295 7.075 920 HG21 THR 115 3HG2 THR 115 4.726 -5.493 5.061 921 HG22 THR 115 1HG2 THR 115 3.559 -6.795 4.834 922 HG23 THR 115 2HG2 THR 115 5.285 -7.115 4.636 923 H VAL 116 H VAL 116 5.681 -4.214 8.074 924 HA VAL 116 HA VAL 116 6.877 -2.886 5.797 925 HB VAL 116 HB VAL 116 5.548 -1.776 8.309 926 HG11 VAL 116 1HG1 VAL 116 6.582 -0.168 5.930 927 HG12 VAL 116 2HG1 VAL 116 7.233 -0.132 7.569 928 HG13 VAL 116 3HG1 VAL 116 5.606 0.468 7.261 929 HG21 VAL 116 3HG2 VAL 116 3.726 -1.137 6.761 930 HG22 VAL 116 1HG2 VAL 116 4.016 -2.876 6.717 931 HG23 VAL 116 2HG2 VAL 116 4.606 -1.850 5.408 932 H LYS 117 H LYS 117 7.776 -3.403 9.244 933 HA LYS 117 HA LYS 117 10.121 -1.692 9.018 934 HB2 LYS 117 2HB LYS 117 10.660 -2.290 11.283 935 HB3 LYS 117 3HB LYS 117 8.927 -2.012 11.190 936 HG2 LYS 117 2HG LYS 117 8.572 -4.486 11.115 937 HG3 LYS 117 3HG LYS 117 10.308 -4.716 11.318 938 HD2 LYS 117 2HD LYS 117 8.450 -3.346 13.307 939 HD3 LYS 117 3HD LYS 117 9.089 -4.983 13.457 940 HE2 LYS 117 2HE LYS 117 11.392 -4.046 13.559 941 HE3 LYS 117 3HE LYS 117 10.715 -2.417 13.478 942 HZ1 LYS 117 3HZ LYS 117 11.215 -3.084 15.747 943 HZ2 LYS 117 1HZ LYS 117 10.164 -4.401 15.614 944 HZ3 LYS 117 2HZ LYS 117 9.559 -2.825 15.549 945 H ASN 118 H ASN 118 9.468 -5.051 8.441 946 HA ASN 118 HA ASN 118 12.217 -5.961 8.349 947 HB2 ASN 118 2HB ASN 118 9.657 -7.249 7.269 948 HB3 ASN 118 3HB ASN 118 11.241 -8.024 7.249 949 HD21 ASN 118 1HD2 ASN 118 8.773 -8.906 8.578 950 HD22 ASN 118 2HD2 ASN 118 9.132 -9.004 10.269 951 H TYR 119 H TYR 119 9.751 -4.881 6.090 952 HA TYR 119 HA TYR 119 11.179 -4.922 3.676 953 HB2 TYR 119 2HB TYR 119 8.839 -4.441 3.562 954 HB3 TYR 119 3HB TYR 119 8.957 -3.158 4.756 955 HD1 TYR 119 HD1 TYR 119 9.937 -3.997 1.217 956 HD2 TYR 119 HD2 TYR 119 9.164 -0.901 4.059 957 HE1 TYR 119 HE1 TYR 119 10.052 -2.323 -0.570 958 HE2 TYR 119 HE2 TYR 119 9.276 0.769 2.270 959 HH TYR 119 HH TYR 119 9.918 1.106 0.120 960 H GLN 120 H GLN 120 10.799 -2.251 5.998 961 HA GLN 120 HA GLN 120 12.636 -0.463 4.822 962 HB2 GLN 120 2HB GLN 120 11.481 -0.614 7.632 963 HB3 GLN 120 3HB GLN 120 12.501 0.715 7.084 964 HG2 GLN 120 2HG GLN 120 10.838 1.204 5.286 965 HG3 GLN 120 3HG GLN 120 9.799 -0.058 5.942 966 HE21 GLN 120 1HE2 GLN 120 9.368 2.862 5.634 967 HE22 GLN 120 2HE2 GLN 120 8.957 3.452 7.198 968 H GLY 121 H GLY 121 13.070 -3.169 6.945 969 HA2 GLY 121 2HA GLY 121 15.697 -2.610 7.922 970 HA3 GLY 121 3HA GLY 121 14.914 -4.185 7.849 971 H TYR 122 H TYR 122 14.485 -4.665 5.231 972 HA TYR 122 HA TYR 122 17.167 -5.269 4.375 973 HB2 TYR 122 2HB TYR 122 16.234 -6.673 2.675 974 HB3 TYR 122 3HB TYR 122 15.376 -6.939 4.170 975 HD1 TYR 122 HD2 TYR 122 14.867 -4.680 1.139 976 HD2 TYR 122 HD1 TYR 122 13.137 -7.520 3.819 977 HE1 TYR 122 HE2 TYR 122 12.786 -4.628 -0.147 978 HE2 TYR 122 HE1 TYR 122 11.067 -7.482 2.510 979 HH TYR 122 HH TYR 122 9.886 -6.071 0.948 980 H VAL 123 H VAL 123 14.979 -2.728 3.673 981 HA VAL 123 HA VAL 123 15.923 -1.890 1.137 982 HB VAL 123 HB VAL 123 14.607 -0.331 3.409 983 HG11 VAL 123 1HG1 VAL 123 14.315 1.566 1.826 984 HG12 VAL 123 2HG1 VAL 123 15.354 0.743 0.657 985 HG13 VAL 123 3HG1 VAL 123 16.011 1.273 2.206 986 HG21 VAL 123 3HG2 VAL 123 13.525 -1.125 0.671 987 HG22 VAL 123 1HG2 VAL 123 12.636 -0.294 1.951 988 HG23 VAL 123 2HG2 VAL 123 13.170 -1.957 2.182 989 H GLN 124 H GLN 124 16.851 -0.818 4.445 990 HA GLN 124 HA GLN 124 18.963 0.907 3.544 991 HB2 GLN 124 2HB GLN 124 19.610 1.000 5.976 992 HB3 GLN 124 3HB GLN 124 17.931 1.411 5.649 993 HG2 GLN 124 2HG GLN 124 17.281 -0.895 6.313 994 HG3 GLN 124 3HG GLN 124 18.960 -1.211 6.762 995 HE21 GLN 124 1HE2 GLN 124 16.492 -1.203 8.389 996 HE22 GLN 124 2HE2 GLN 124 16.763 -0.082 9.674 997 H ASP 125 H ASP 125 18.813 -2.498 4.224 998 HA ASP 125 HA ASP 125 21.641 -3.017 4.276 999 HB2 ASP 125 2HB ASP 125 19.261 -4.791 3.621 1000 HB3 ASP 125 3HB ASP 125 20.916 -5.395 3.716 1001 H GLY 126 H GLY 126 19.325 -2.331 1.788 1002 HA2 GLY 126 2HA GLY 126 19.505 -1.987 -0.490 1003 HA3 GLY 126 3HA GLY 126 21.247 -2.189 -0.329 1004 H HIS 127 H HIS 127 18.701 -4.482 0.527 1005 HA HIS 127 HA HIS 127 19.252 -6.239 -1.730 1006 HB2 HIS 127 2HB HIS 127 21.069 -6.869 -0.170 1007 HB3 HIS 127 3HB HIS 127 19.916 -7.081 1.140 1008 HD1 HIS 127 HD1 HIS 127 20.999 -8.691 -2.109 1009 HD2 HIS 127 HD2 HIS 127 18.663 -9.567 1.216 1010 HE1 HIS 127 HE1 HIS 127 20.421 -11.127 -2.316 1011 HE2 HIS 127 HE2 HIS 127 19.068 -11.652 -0.258 1012 H ASP 128 H ASP 128 17.205 -6.518 -2.354 1013 HA ASP 128 HA ASP 128 14.927 -6.572 -0.638 1014 HB2 ASP 128 2HB ASP 128 13.670 -7.289 -2.677 1015 HB3 ASP 128 3HB ASP 128 14.669 -5.870 -2.951 1016 H HIS 129 H HIS 129 13.510 -8.333 -0.212 1017 HA HIS 129 HA HIS 129 14.706 -11.056 -0.323 1018 HB2 HIS 129 2HB HIS 129 13.263 -9.665 1.975 1019 HB3 HIS 129 3HB HIS 129 13.274 -11.422 1.854 1020 HD1 HIS 129 HD1 HIS 129 15.104 -12.501 3.077 1021 HD2 HIS 129 HD2 HIS 129 16.118 -8.632 1.969 1022 HE1 HIS 129 HE1 HIS 129 17.380 -12.104 4.048 1023 HE2 HIS 129 HE2 HIS 129 17.865 -9.682 3.560 1024 H ASP 130 H ASP 130 11.655 -9.302 0.217 1025 HA ASP 130 HA ASP 130 10.128 -11.625 -0.678 1026 HB2 ASP 130 2HB ASP 130 9.094 -9.023 0.523 1027 HB3 ASP 130 3HB ASP 130 8.219 -10.543 0.359 1028 H PHE 131 H PHE 131 10.777 -11.353 -2.916 1029 HA PHE 131 HA PHE 131 10.554 -10.656 -5.076 1030 HB2 PHE 131 2HB PHE 131 7.815 -10.672 -5.538 1031 HB3 PHE 131 3HB PHE 131 8.824 -12.105 -5.443 1032 HD1 PHE 131 HD2 PHE 131 6.464 -9.953 -3.521 1033 HD2 PHE 131 HD1 PHE 131 8.547 -13.686 -3.645 1034 HE1 PHE 131 HE2 PHE 131 5.161 -10.760 -1.608 1035 HE2 PHE 131 HE1 PHE 131 7.242 -14.483 -1.718 1036 HZ PHE 131 HZ PHE 131 5.540 -13.016 -0.697 1037 H GLY 132 H GLY 132 11.268 -8.454 -3.920 1038 HA2 GLY 132 2HA GLY 132 9.336 -6.280 -4.127 1039 HA3 GLY 132 3HA GLY 132 10.985 -6.192 -3.520 1040 H ARG 133 H ARG 133 12.514 -5.332 -4.796 1041 HA ARG 133 HA ARG 133 12.696 -5.626 -7.601 1042 HB2 ARG 133 2HB ARG 133 12.282 -3.361 -8.381 1043 HB3 ARG 133 3HB ARG 133 10.839 -3.921 -7.556 1044 HG2 ARG 133 2HG ARG 133 12.893 -2.103 -6.261 1045 HG3 ARG 133 3HG ARG 133 11.498 -1.507 -7.151 1046 HD2 ARG 133 2HD ARG 133 9.990 -2.592 -5.531 1047 HD3 ARG 133 3HD ARG 133 11.388 -3.221 -4.649 1048 HE ARG 133 HE ARG 133 11.775 -0.504 -4.783 1049 HH11 ARG 133 1HH1 ARG 133 9.280 -2.548 -3.395 1050 HH12 ARG 133 2HH1 ARG 133 8.883 -1.402 -2.156 1051 HH21 ARG 133 1HH2 ARG 133 11.231 0.970 -3.179 1052 HH22 ARG 133 2HH2 ARG 133 9.985 0.583 -2.036 1053 H ASP 134 H ASP 134 14.403 -3.687 -8.335 1054 HA ASP 134 HA ASP 134 16.821 -4.463 -7.262 1055 HB2 ASP 134 2HB ASP 134 16.418 -3.333 -9.530 1056 HB3 ASP 134 3HB ASP 134 16.338 -1.799 -8.679 1057 HA PRO 135 HA PRO 135 17.621 -2.437 -3.268 1058 HB2 PRO 135 2HB PRO 135 20.259 -1.580 -4.220 1059 HB3 PRO 135 3HB PRO 135 19.852 -2.887 -3.102 1060 HG2 PRO 135 2HG PRO 135 20.328 -3.005 -6.033 1061 HG3 PRO 135 3HG PRO 135 20.576 -4.257 -4.789 1062 HD2 PRO 135 2HD PRO 135 18.557 -4.475 -6.491 1063 HD3 PRO 135 3HD PRO 135 18.303 -4.867 -4.771 1064 H LYS 136 H LYS 136 18.453 -0.579 -6.236 1065 HA LYS 136 HA LYS 136 18.690 1.944 -4.903 1066 HB2 LYS 136 2HB LYS 136 18.839 2.932 -7.118 1067 HB3 LYS 136 3HB LYS 136 19.770 1.433 -7.088 1068 HG2 LYS 136 2HG LYS 136 17.867 0.286 -8.224 1069 HG3 LYS 136 3HG LYS 136 17.013 1.827 -8.287 1070 HD2 LYS 136 2HD LYS 136 18.043 1.404 -10.441 1071 HD3 LYS 136 3HD LYS 136 18.854 2.772 -9.675 1072 HE2 LYS 136 2HE LYS 136 20.675 1.216 -8.942 1073 HE3 LYS 136 3HE LYS 136 19.874 -0.085 -9.828 1074 HZ1 LYS 136 3HZ LYS 136 21.642 0.911 -11.124 1075 HZ2 LYS 136 1HZ LYS 136 20.915 2.432 -11.005 1076 HZ3 LYS 136 2HZ LYS 136 20.144 1.196 -11.857 1077 H TYR 137 H TYR 137 15.966 0.251 -6.326 1078 HA TYR 137 HA TYR 137 14.167 2.551 -6.170 1079 HB2 TYR 137 2HB TYR 137 13.609 -0.332 -6.957 1080 HB3 TYR 137 3HB TYR 137 12.451 0.993 -7.072 1081 HD1 TYR 137 HD2 TYR 137 13.064 2.976 -8.616 1082 HD2 TYR 137 HD1 TYR 137 15.073 -0.775 -8.780 1083 HE1 TYR 137 HE2 TYR 137 13.896 3.526 -10.850 1084 HE2 TYR 137 HE1 TYR 137 15.927 -0.226 -11.010 1085 HH TYR 137 HH TYR 137 15.371 1.213 -12.896 1086 H LEU 138 H LEU 138 15.042 -0.245 -4.255 1087 HA LEU 138 HA LEU 138 12.918 -0.262 -2.389 1088 HB2 LEU 138 2HB LEU 138 15.889 -0.759 -1.894 1089 HB3 LEU 138 3HB LEU 138 14.617 -1.114 -0.743 1090 HG LEU 138 HG LEU 138 15.019 -2.496 -3.420 1091 HD11 LEU 138 1HD1 LEU 138 15.690 -4.443 -2.083 1092 HD12 LEU 138 2HD1 LEU 138 15.486 -3.520 -0.594 1093 HD13 LEU 138 3HD1 LEU 138 16.740 -3.068 -1.751 1094 HD21 LEU 138 3HD2 LEU 138 12.631 -2.422 -2.869 1095 HD22 LEU 138 1HD2 LEU 138 12.957 -3.073 -1.258 1096 HD23 LEU 138 2HD2 LEU 138 13.255 -4.059 -2.694 1097 H HIS 139 H HIS 139 12.218 1.470 -1.205 1098 HA HIS 139 HA HIS 139 14.155 3.177 0.173 1099 HB2 HIS 139 2HB HIS 139 13.669 4.412 -1.935 1100 HB3 HIS 139 3HB HIS 139 11.942 4.335 -1.598 1101 HD1 HIS 139 HD1 HIS 139 11.006 6.263 -0.330 1102 HD2 HIS 139 HD2 HIS 139 15.130 6.014 0.085 1103 HE1 HIS 139 HE1 HIS 139 11.674 8.313 0.949 1104 HE2 HIS 139 HE2 HIS 139 14.150 8.071 1.311 1105 H GLN 140 H GLN 140 13.501 3.588 2.227 1106 HA GLN 140 HA GLN 140 11.147 2.407 3.303 1107 HB2 GLN 140 2HB GLN 140 12.875 4.561 4.601 1108 HB3 GLN 140 3HB GLN 140 11.701 3.540 5.415 1109 HG2 GLN 140 2HG GLN 140 13.536 2.321 5.970 1110 HG3 GLN 140 3HG GLN 140 13.280 1.602 4.388 1111 HE21 GLN 140 1HE2 GLN 140 15.696 1.733 5.880 1112 HE22 GLN 140 2HE2 GLN 140 16.842 2.594 4.923 1113 H PHE 141 H PHE 141 9.195 3.326 3.889 1114 HA PHE 141 HA PHE 141 8.245 5.611 2.499 1115 HB2 PHE 141 2HB PHE 141 6.965 4.215 4.884 1116 HB3 PHE 141 3HB PHE 141 6.152 5.261 3.729 1117 HD1 PHE 141 HD1 PHE 141 6.339 4.452 1.181 1118 HD2 PHE 141 HD2 PHE 141 6.764 1.899 4.580 1119 HE1 PHE 141 HE1 PHE 141 5.739 2.510 -0.193 1120 HE2 PHE 141 HE2 PHE 141 6.157 -0.035 3.207 1121 HZ PHE 141 HZ PHE 141 5.646 0.258 0.806 1122 H GLU 142 H GLU 142 9.607 7.359 3.073 1123 HA GLU 142 HA GLU 142 9.818 8.283 5.801 1124 HB2 GLU 142 2HB GLU 142 10.560 9.665 3.183 1125 HB3 GLU 142 3HB GLU 142 10.916 10.287 4.792 1126 HG2 GLU 142 2HG GLU 142 12.268 8.223 5.237 1127 HG3 GLU 142 3HG GLU 142 12.008 7.742 3.560 1128 H GLY 143 H GLY 143 7.870 8.656 6.611 1129 HA2 GLY 143 2HA GLY 143 6.337 10.823 6.543 1130 HA3 GLY 143 3HA GLY 143 5.742 9.973 5.114 1131 H GLU 144 H GLU 144 5.781 10.109 8.533 1132 HA GLU 144 HA GLU 144 4.911 7.502 9.233 1133 HB2 GLU 144 2HB GLU 144 4.484 10.143 10.685 1134 HB3 GLU 144 3HB GLU 144 4.285 8.545 11.406 1135 HG2 GLU 144 2HG GLU 144 6.646 8.077 11.199 1136 HG3 GLU 144 3HG GLU 144 6.909 9.539 10.247 1137 H THR 145 H THR 145 3.211 10.257 7.958 1138 HA THR 145 HA THR 145 0.562 9.236 8.403 1139 HB THR 145 HB THR 145 1.490 11.315 6.361 1140 HG1 THR 145 HG1 THR 145 0.808 11.475 9.102 1141 HG21 THR 145 3HG2 THR 145 -0.859 12.099 6.446 1142 HG22 THR 145 1HG2 THR 145 -1.273 10.771 7.531 1143 HG23 THR 145 2HG2 THR 145 -0.772 10.435 5.872 1144 H PHE 146 H PHE 146 0.528 7.156 7.677 1145 HA PHE 146 HA PHE 146 1.215 6.421 4.941 1146 HB2 PHE 146 2HB PHE 146 0.297 4.874 7.394 1147 HB3 PHE 146 3HB PHE 146 0.288 4.122 5.804 1148 HD1 PHE 146 HD2 PHE 146 2.540 5.639 8.386 1149 HD2 PHE 146 HD1 PHE 146 2.301 3.324 4.803 1150 HE1 PHE 146 HE2 PHE 146 4.907 4.997 8.630 1151 HE2 PHE 146 HE1 PHE 146 4.649 2.695 5.054 1152 HZ PHE 146 HZ PHE 146 5.965 3.512 6.956 1153 H TYR 147 H TYR 147 -0.234 5.820 3.406 1154 HA TYR 147 HA TYR 147 -3.139 6.000 3.940 1155 HB2 TYR 147 2HB TYR 147 -1.554 6.707 1.431 1156 HB3 TYR 147 3HB TYR 147 -3.294 6.426 1.397 1157 HD1 TYR 147 HD1 TYR 147 -0.709 8.555 3.128 1158 HD2 TYR 147 HD2 TYR 147 -4.763 8.249 1.803 1159 HE1 TYR 147 HE1 TYR 147 -1.097 10.887 3.754 1160 HE2 TYR 147 HE2 TYR 147 -5.133 10.594 2.427 1161 HH TYR 147 HH TYR 147 -2.552 12.713 3.294 1162 H ILE 148 H ILE 148 -4.357 4.297 3.349 1163 HA ILE 148 HA ILE 148 -3.065 1.925 2.143 1164 HB ILE 148 HB ILE 148 -5.082 2.010 4.443 1165 HG12 ILE 148 2HG1 ILE 148 -2.178 1.037 4.335 1166 HG13 ILE 148 3HG1 ILE 148 -2.761 2.467 5.178 1167 HG21 ILE 148 1HG2 ILE 148 -4.992 -0.461 4.452 1168 HG22 ILE 148 2HG2 ILE 148 -3.962 -0.439 3.019 1169 HG23 ILE 148 3HG2 ILE 148 -5.624 0.147 2.922 1170 HD11 ILE 148 3HD1 ILE 148 -2.311 0.712 6.744 1171 HD12 ILE 148 1HD1 ILE 148 -3.354 -0.405 5.868 1172 HD13 ILE 148 2HD1 ILE 148 -4.051 0.991 6.693 1173 H ILE 149 H ILE 149 -3.872 1.803 0.162 1174 HA ILE 149 HA ILE 149 -6.636 2.563 -0.465 1175 HB ILE 149 HB ILE 149 -4.517 1.622 -2.455 1176 HG12 ILE 149 2HG1 ILE 149 -3.448 3.470 -1.310 1177 HG13 ILE 149 3HG1 ILE 149 -3.991 4.056 -2.873 1178 HG21 ILE 149 1HG2 ILE 149 -5.841 2.941 -4.081 1179 HG22 ILE 149 2HG2 ILE 149 -6.990 3.362 -2.810 1180 HG23 ILE 149 3HG2 ILE 149 -6.809 1.681 -3.316 1181 HD11 ILE 149 3HD1 ILE 149 -4.330 5.690 -1.104 1182 HD12 ILE 149 1HD1 ILE 149 -5.369 4.562 -0.233 1183 HD13 ILE 149 2HD1 ILE 149 -5.861 5.189 -1.808 1184 H GLU 150 H GLU 150 -8.017 0.934 -0.013 1185 HA GLU 150 HA GLU 150 -7.392 -1.815 0.023 1186 HB2 GLU 150 2HB GLU 150 -9.204 -0.959 1.392 1187 HB3 GLU 150 3HB GLU 150 -10.087 -0.399 -0.027 1188 HG2 GLU 150 2HG GLU 150 -10.429 -2.713 -0.768 1189 HG3 GLU 150 3HG GLU 150 -9.465 -3.313 0.578 1190 H GLN 151 H GLN 151 -7.192 -3.185 -1.566 1191 HA GLN 151 HA GLN 151 -8.361 -2.700 -4.237 1192 HB2 GLN 151 2HB GLN 151 -6.027 -4.528 -3.494 1193 HB3 GLN 151 3HB GLN 151 -6.552 -4.094 -5.117 1194 HG2 GLN 151 2HG GLN 151 -5.381 -2.159 -3.102 1195 HG3 GLN 151 3HG GLN 151 -4.470 -2.959 -4.376 1196 HE21 GLN 151 1HE2 GLN 151 -4.860 -0.108 -3.888 1197 HE22 GLN 151 2HE2 GLN 151 -5.561 0.538 -5.329 1198 H ARG 152 H ARG 152 -10.339 -3.728 -4.056 1199 HA ARG 152 HA ARG 152 -10.551 -6.478 -3.069 1200 HB2 ARG 152 2HB ARG 152 -12.555 -4.539 -4.297 1201 HB3 ARG 152 3HB ARG 152 -12.981 -6.190 -3.858 1202 HG2 ARG 152 2HG ARG 152 -11.818 -4.251 -1.839 1203 HG3 ARG 152 3HG ARG 152 -13.548 -4.318 -2.176 1204 HD2 ARG 152 2HD ARG 152 -13.624 -6.655 -1.460 1205 HD3 ARG 152 3HD ARG 152 -11.872 -6.665 -1.234 1206 HE ARG 152 HE ARG 152 -12.765 -4.624 0.356 1207 HH11 ARG 152 1HH1 ARG 152 -13.450 -8.069 0.225 1208 HH12 ARG 152 2HH1 ARG 152 -13.798 -8.180 1.918 1209 HH21 ARG 152 1HH2 ARG 152 -13.156 -4.795 2.561 1210 HH22 ARG 152 2HH2 ARG 152 -13.628 -6.317 3.248 1211 H LEU 153 H LEU 153 -11.560 -8.150 -4.516 1212 HA LEU 153 HA LEU 153 -10.045 -8.616 -6.851 1213 HB2 LEU 153 2HB LEU 153 -12.606 -9.926 -5.870 1214 HB3 LEU 153 3HB LEU 153 -11.674 -10.520 -7.235 1215 HG LEU 153 HG LEU 153 -10.692 -10.390 -4.354 1216 HD11 LEU 153 1HD1 LEU 153 -11.464 -12.782 -6.063 1217 HD12 LEU 153 2HD1 LEU 153 -12.375 -12.143 -4.691 1218 HD13 LEU 153 3HD1 LEU 153 -10.783 -12.850 -4.433 1219 HD21 LEU 153 3HD2 LEU 153 -9.284 -11.477 -6.828 1220 HD22 LEU 153 1HD2 LEU 153 -8.702 -11.622 -5.165 1221 HD23 LEU 153 2HD2 LEU 153 -8.823 -10.036 -5.918 1222 H GLU 154 H GLU 154 -10.803 -8.931 -9.049 1223 HA GLU 154 HA GLU 154 -11.786 -6.624 -10.223 1224 HB2 GLU 154 2HB GLU 154 -11.724 -9.444 -11.369 1225 HB3 GLU 154 3HB GLU 154 -11.956 -7.991 -12.336 1226 HG2 GLU 154 2HG GLU 154 -9.701 -7.195 -11.672 1227 HG3 GLU 154 3HG GLU 154 -9.473 -8.660 -10.715 1228 H HIS 155 H HIS 155 -13.509 -9.635 -9.576 1229 HA HIS 155 HA HIS 155 -16.101 -8.247 -9.851 1230 HB2 HIS 155 2HB HIS 155 -17.103 -10.261 -10.857 1231 HB3 HIS 155 3HB HIS 155 -15.773 -9.678 -11.855 1232 HD1 HIS 155 HD1 HIS 155 -17.045 -12.672 -10.284 1233 HD2 HIS 155 HD2 HIS 155 -13.312 -11.292 -11.441 1234 HE1 HIS 155 HE1 HIS 155 -15.575 -14.684 -10.282 1235 HE2 HIS 155 HE2 HIS 155 -13.282 -13.789 -10.763 1236 H HIS 156 H HIS 156 -17.535 -8.630 -8.201 1237 HA HIS 156 HA HIS 156 -17.117 -10.839 -6.321 1238 HB2 HIS 156 2HB HIS 156 -17.151 -9.381 -4.314 1239 HB3 HIS 156 3HB HIS 156 -15.751 -9.035 -5.315 1240 HD1 HIS 156 HD1 HIS 156 -19.001 -7.529 -4.177 1241 HD2 HIS 156 HD2 HIS 156 -15.651 -6.439 -6.373 1242 HE1 HIS 156 HE1 HIS 156 -19.187 -5.050 -4.487 1243 HE2 HIS 156 HE2 HIS 156 -17.251 -4.443 -5.972 1244 H HIS 157 H HIS 157 -19.009 -11.681 -5.718 1245 HA HIS 157 HA HIS 157 -21.423 -9.980 -5.531 1246 HB2 HIS 157 2HB HIS 157 -21.181 -12.733 -6.788 1247 HB3 HIS 157 3HB HIS 157 -22.691 -12.253 -6.026 1248 HD1 HIS 157 HD1 HIS 157 -24.189 -10.661 -7.294 1249 HD2 HIS 157 HD2 HIS 157 -20.527 -11.218 -9.161 1250 HE1 HIS 157 HE1 HIS 157 -24.423 -9.603 -9.556 1251 HE2 HIS 157 HE2 HIS 157 -22.221 -10.028 -10.704 1252 H HIS 158 H HIS 158 -20.618 -9.661 -3.432 1253 HA HIS 158 HA HIS 158 -21.673 -11.527 -1.477 1254 HB2 HIS 158 2HB HIS 158 -19.238 -12.208 -1.802 1255 HB3 HIS 158 3HB HIS 158 -18.753 -10.595 -1.305 1256 HD1 HIS 158 HD1 HIS 158 -19.045 -13.870 0.016 1257 HD2 HIS 158 HD2 HIS 158 -19.916 -10.093 1.524 1258 HE1 HIS 158 HE1 HIS 158 -19.108 -14.132 2.518 1259 HE2 HIS 158 HE2 HIS 158 -19.596 -11.831 3.403 1260 H HIS 159 H HIS 159 -23.000 -10.164 -0.440 1261 HA HIS 159 HA HIS 159 -22.450 -7.304 -0.184 1262 HB2 HIS 159 2HB HIS 159 -24.876 -8.991 0.584 1263 HB3 HIS 159 3HB HIS 159 -24.774 -7.253 0.871 1264 HD1 HIS 159 HD1 HIS 159 -26.322 -9.417 -1.379 1265 HD2 HIS 159 HD2 HIS 159 -24.028 -5.983 -1.890 1266 HE1 HIS 159 HE1 HIS 159 -26.958 -8.515 -3.638 1267 HE2 HIS 159 HE2 HIS 159 -25.528 -6.463 -3.940 1268 H HIS 160 H HIS 160 -22.053 -6.248 1.699 1269 HA HIS 160 HA HIS 160 -22.314 -7.590 4.292 1270 HB2 HIS 160 2HB HIS 160 -19.902 -7.844 3.601 1271 HB3 HIS 160 3HB HIS 160 -19.763 -6.095 3.470 1272 HD1 HIS 160 HD1 HIS 160 -19.835 -8.873 5.948 1273 HD2 HIS 160 HD2 HIS 160 -19.682 -4.720 5.982 1274 HE1 HIS 160 HE1 HIS 160 -19.235 -8.242 8.303 1275 HE2 HIS 160 HE2 HIS 160 -19.292 -5.728 8.328 Start of MODEL 15 1 H1 MET 1 1H MET 1 -23.707 -1.848 1.157 2 H2 MET 1 2H MET 1 -25.207 -2.162 1.863 3 H3 MET 1 3H MET 1 -24.590 -0.588 1.850 4 HA MET 1 HA MET 1 -25.361 -2.161 -0.534 5 HB2 MET 1 2HB MET 1 -26.723 0.231 0.784 6 HB3 MET 1 3HB MET 1 -27.209 -0.478 -0.751 7 HG2 MET 1 2HG MET 1 -27.800 -2.569 0.379 8 HG3 MET 1 3HG MET 1 -27.259 -1.903 1.919 9 HE1 MET 1 3HE MET 1 -30.942 -0.316 -0.395 10 HE2 MET 1 1HE MET 1 -29.933 -1.641 -0.969 11 HE3 MET 1 2HE MET 1 -29.293 0.004 -0.934 12 H VAL 2 H VAL 2 -25.865 -0.248 -2.288 13 HA VAL 2 HA VAL 2 -24.856 0.878 -3.951 14 HB VAL 2 HB VAL 2 -23.417 2.420 -1.741 15 HG11 VAL 2 1HG1 VAL 2 -23.279 4.261 -3.404 16 HG12 VAL 2 2HG1 VAL 2 -23.993 3.201 -4.622 17 HG13 VAL 2 3HG1 VAL 2 -22.409 2.820 -3.941 18 HG21 VAL 2 3HG2 VAL 2 -25.265 4.063 -1.881 19 HG22 VAL 2 1HG2 VAL 2 -25.864 2.474 -1.389 20 HG23 VAL 2 2HG2 VAL 2 -26.101 3.034 -3.048 21 H GLU 3 H GLU 3 -23.799 -0.829 -4.819 22 HA GLU 3 HA GLU 3 -22.183 -2.123 -5.651 23 HB2 GLU 3 2HB GLU 3 -20.312 -0.263 -4.167 24 HB3 GLU 3 3HB GLU 3 -19.697 -1.711 -4.937 25 HG2 GLU 3 2HG GLU 3 -19.353 0.195 -6.390 26 HG3 GLU 3 3HG GLU 3 -20.511 -0.913 -7.121 27 HA PRO 4 HA PRO 4 -21.857 -5.356 -2.524 28 HB2 PRO 4 2HB PRO 4 -19.934 -6.801 -4.255 29 HB3 PRO 4 3HB PRO 4 -21.620 -7.208 -3.883 30 HG2 PRO 4 2HG PRO 4 -20.841 -6.388 -6.345 31 HG3 PRO 4 3HG PRO 4 -22.453 -6.037 -5.684 32 HD2 PRO 4 2HD PRO 4 -20.047 -4.219 -5.823 33 HD3 PRO 4 3HD PRO 4 -21.752 -3.873 -6.188 34 H GLY 5 H GLY 5 -20.108 -3.143 -1.971 35 HA2 GLY 5 2HA GLY 5 -18.336 -2.588 -0.649 36 HA3 GLY 5 3HA GLY 5 -18.216 -4.290 -0.220 37 H VAL 6 H VAL 6 -17.903 -2.949 -3.484 38 HA VAL 6 HA VAL 6 -15.277 -4.198 -3.772 39 HB VAL 6 HB VAL 6 -15.454 -3.739 -6.174 40 HG11 VAL 6 1HG1 VAL 6 -18.042 -4.896 -5.069 41 HG12 VAL 6 2HG1 VAL 6 -16.531 -5.777 -5.316 42 HG13 VAL 6 3HG1 VAL 6 -17.418 -5.144 -6.705 43 HG21 VAL 6 3HG2 VAL 6 -17.453 -2.654 -7.168 44 HG22 VAL 6 1HG2 VAL 6 -16.564 -1.544 -6.121 45 HG23 VAL 6 2HG2 VAL 6 -18.057 -2.291 -5.549 46 H ALA 7 H ALA 7 -13.460 -3.076 -4.617 47 HA ALA 7 HA ALA 7 -13.039 -0.478 -3.420 48 HB1 ALA 7 3HB ALA 7 -11.170 -2.249 -5.023 49 HB2 ALA 7 1HB ALA 7 -11.302 -2.195 -3.264 50 HB3 ALA 7 2HB ALA 7 -10.702 -0.788 -4.145 51 H LYS 8 H LYS 8 -13.598 1.301 -4.495 52 HA LYS 8 HA LYS 8 -13.816 1.299 -7.426 53 HB2 LYS 8 2HB LYS 8 -14.814 3.396 -5.459 54 HB3 LYS 8 3HB LYS 8 -15.245 3.231 -7.163 55 HG2 LYS 8 2HG LYS 8 -16.280 0.988 -6.600 56 HG3 LYS 8 3HG LYS 8 -15.983 1.344 -4.896 57 HD2 LYS 8 2HD LYS 8 -18.280 1.906 -5.386 58 HD3 LYS 8 3HD LYS 8 -17.396 3.418 -5.150 59 HE2 LYS 8 2HE LYS 8 -17.192 3.624 -7.643 60 HE3 LYS 8 3HE LYS 8 -18.184 2.173 -7.808 61 HZ1 LYS 8 3HZ LYS 8 -18.991 4.759 -6.618 62 HZ2 LYS 8 1HZ LYS 8 -19.936 3.364 -6.583 63 HZ3 LYS 8 2HZ LYS 8 -19.551 4.074 -8.061 64 H LEU 9 H LEU 9 -11.571 1.365 -7.794 65 HA LEU 9 HA LEU 9 -10.369 4.046 -7.685 66 HB2 LEU 9 2HB LEU 9 -9.468 2.738 -5.721 67 HB3 LEU 9 3HB LEU 9 -8.868 1.519 -6.835 68 HG LEU 9 HG LEU 9 -7.402 3.332 -7.889 69 HD11 LEU 9 1HD1 LEU 9 -6.957 5.375 -6.621 70 HD12 LEU 9 2HD1 LEU 9 -8.233 4.955 -5.474 71 HD13 LEU 9 3HD1 LEU 9 -8.634 5.299 -7.159 72 HD21 LEU 9 3HD2 LEU 9 -6.877 2.728 -4.970 73 HD22 LEU 9 1HD2 LEU 9 -5.682 3.273 -6.151 74 HD23 LEU 9 2HD2 LEU 9 -6.455 1.700 -6.340 75 H THR 10 H THR 10 -8.755 4.355 -9.290 76 HA THR 10 HA THR 10 -9.160 2.802 -11.740 77 HB THR 10 HB THR 10 -7.886 4.743 -12.758 78 HG1 THR 10 HG1 THR 10 -8.058 6.537 -10.862 79 HG21 THR 10 3HG2 THR 10 -9.683 6.419 -12.461 80 HG22 THR 10 1HG2 THR 10 -10.308 5.520 -11.073 81 HG23 THR 10 2HG2 THR 10 -10.361 4.807 -12.688 82 H THR 11 H THR 11 -7.251 2.377 -13.133 83 HA THR 11 HA THR 11 -5.363 0.757 -11.733 84 HB THR 11 HB THR 11 -5.333 1.419 -14.711 85 HG1 THR 11 HG1 THR 11 -7.000 0.114 -14.941 86 HG21 THR 11 3HG2 THR 11 -3.338 0.172 -13.956 87 HG22 THR 11 1HG2 THR 11 -4.376 -0.871 -14.939 88 HG23 THR 11 2HG2 THR 11 -4.365 -1.035 -13.182 89 H TYR 12 H TYR 12 -5.098 3.852 -13.530 90 HA TYR 12 HA TYR 12 -2.297 4.040 -13.624 91 HB2 TYR 12 2HB TYR 12 -2.624 6.504 -13.968 92 HB3 TYR 12 3HB TYR 12 -3.606 5.504 -15.020 93 HD1 TYR 12 HD2 TYR 12 -3.806 7.545 -11.861 94 HD2 TYR 12 HD1 TYR 12 -5.953 5.900 -15.165 95 HE1 TYR 12 HE2 TYR 12 -5.791 8.812 -11.201 96 HE2 TYR 12 HE1 TYR 12 -7.940 7.184 -14.502 97 HH TYR 12 HH TYR 12 -7.831 9.670 -12.126 98 H ALA 13 H ALA 13 -4.525 4.859 -11.048 99 HA ALA 13 HA ALA 13 -2.807 6.418 -9.425 100 HB1 ALA 13 3HB ALA 13 -5.255 6.464 -9.211 101 HB2 ALA 13 1HB ALA 13 -4.499 6.056 -7.668 102 HB3 ALA 13 2HB ALA 13 -5.251 4.791 -8.648 103 H SER 14 H SER 14 -3.611 2.955 -9.488 104 HA SER 14 HA SER 14 -2.022 2.270 -7.198 105 HB2 SER 14 2HB SER 14 -2.600 -0.083 -7.846 106 HB3 SER 14 3HB SER 14 -4.012 0.964 -7.720 107 HG SER 14 HG SER 14 -4.060 -0.339 -9.591 108 H LYS 15 H LYS 15 -1.538 2.231 -10.692 109 HA LYS 15 HA LYS 15 0.795 0.644 -10.831 110 HB2 LYS 15 2HB LYS 15 -0.348 2.780 -12.669 111 HB3 LYS 15 3HB LYS 15 1.137 1.924 -13.071 112 HG2 LYS 15 2HG LYS 15 -1.538 0.561 -12.584 113 HG3 LYS 15 3HG LYS 15 -0.918 1.017 -14.173 114 HD2 LYS 15 2HD LYS 15 1.084 -0.445 -13.775 115 HD3 LYS 15 3HD LYS 15 0.368 -0.966 -12.245 116 HE2 LYS 15 2HE LYS 15 -1.455 -2.042 -13.383 117 HE3 LYS 15 3HE LYS 15 -1.010 -1.317 -14.928 118 HZ1 LYS 15 3HZ LYS 15 0.994 -2.624 -14.954 119 HZ2 LYS 15 1HZ LYS 15 -0.338 -3.645 -14.752 120 HZ3 LYS 15 2HZ LYS 15 0.655 -3.267 -13.440 121 H GLN 16 H GLN 16 0.390 4.189 -10.688 122 HA GLN 16 HA GLN 16 3.249 4.665 -10.754 123 HB2 GLN 16 2HB GLN 16 0.959 6.620 -10.348 124 HB3 GLN 16 3HB GLN 16 2.638 7.052 -10.668 125 HG2 GLN 16 2HG GLN 16 0.808 5.533 -12.557 126 HG3 GLN 16 3HG GLN 16 1.237 7.237 -12.688 127 HE21 GLN 16 1HE2 GLN 16 1.647 5.036 -14.595 128 HE22 GLN 16 2HE2 GLN 16 3.341 5.008 -14.934 129 H ALA 17 H ALA 17 0.801 4.320 -8.300 130 HA ALA 17 HA ALA 17 2.188 5.478 -6.107 131 HB1 ALA 17 3HB ALA 17 0.197 3.177 -6.086 132 HB2 ALA 17 1HB ALA 17 -0.206 4.892 -5.990 133 HB3 ALA 17 2HB ALA 17 0.705 4.129 -4.685 134 H THR 18 H THR 18 1.984 2.135 -7.347 135 HA THR 18 HA THR 18 3.770 0.987 -5.472 136 HB THR 18 HB THR 18 3.898 -0.919 -7.126 137 HG1 THR 18 HG1 THR 18 3.421 -0.461 -9.123 138 HG21 THR 18 3HG2 THR 18 1.540 -1.598 -6.917 139 HG22 THR 18 1HG2 THR 18 1.096 0.061 -6.495 140 HG23 THR 18 2HG2 THR 18 2.130 -0.880 -5.416 141 H ASP 19 H ASP 19 4.174 2.217 -8.762 142 HA ASP 19 HA ASP 19 6.852 1.735 -9.300 143 HB2 ASP 19 2HB ASP 19 5.278 2.627 -10.960 144 HB3 ASP 19 3HB ASP 19 5.086 4.114 -10.046 145 H MET 20 H MET 20 5.364 4.287 -7.376 146 HA MET 20 HA MET 20 7.689 5.858 -6.877 147 HB2 MET 20 2HB MET 20 5.155 6.468 -6.637 148 HB3 MET 20 3HB MET 20 5.268 5.742 -5.046 149 HG2 MET 20 2HG MET 20 5.573 8.047 -4.667 150 HG3 MET 20 3HG MET 20 7.214 7.395 -4.631 151 HE1 MET 20 3HE MET 20 5.028 7.872 -7.874 152 HE2 MET 20 1HE MET 20 5.418 9.537 -8.311 153 HE3 MET 20 2HE MET 20 4.511 9.203 -6.836 154 H GLY 21 H GLY 21 6.088 3.180 -5.138 155 HA2 GLY 21 2HA GLY 21 8.163 1.932 -3.971 156 HA3 GLY 21 3HA GLY 21 7.944 3.290 -2.877 157 H ALA 22 H ALA 22 4.885 2.739 -3.869 158 HA ALA 22 HA ALA 22 4.076 1.693 -1.369 159 HB1 ALA 22 3HB ALA 22 2.405 1.984 -3.880 160 HB2 ALA 22 1HB ALA 22 2.681 3.250 -2.680 161 HB3 ALA 22 2HB ALA 22 1.795 1.791 -2.233 162 H ILE 23 H ILE 23 3.031 -0.231 -0.829 163 HA ILE 23 HA ILE 23 3.700 -2.601 -2.508 164 HB ILE 23 HB ILE 23 4.066 -3.870 -0.394 165 HG12 ILE 23 2HG1 ILE 23 3.724 -1.169 1.014 166 HG13 ILE 23 3HG1 ILE 23 2.573 -2.497 1.078 167 HG21 ILE 23 1HG2 ILE 23 6.236 -2.873 0.249 168 HG22 ILE 23 2HG2 ILE 23 5.801 -1.378 -0.585 169 HG23 ILE 23 3HG2 ILE 23 6.019 -2.870 -1.505 170 HD11 ILE 23 3HD1 ILE 23 5.366 -2.520 2.206 171 HD12 ILE 23 1HD1 ILE 23 4.225 -3.869 2.241 172 HD13 ILE 23 2HD1 ILE 23 3.854 -2.377 3.101 173 H TYR 24 H TYR 24 2.345 -4.512 -2.059 174 HA TYR 24 HA TYR 24 -0.384 -3.877 -1.109 175 HB2 TYR 24 2HB TYR 24 0.606 -5.956 -3.097 176 HB3 TYR 24 3HB TYR 24 -1.000 -6.040 -2.375 177 HD1 TYR 24 HD1 TYR 24 -2.619 -4.111 -2.748 178 HD2 TYR 24 HD2 TYR 24 1.003 -4.515 -4.974 179 HE1 TYR 24 HE1 TYR 24 -3.503 -2.622 -4.485 180 HE2 TYR 24 HE2 TYR 24 0.109 -3.021 -6.696 181 HH TYR 24 HH TYR 24 -2.767 -1.195 -6.244 182 H VAL 25 H VAL 25 -1.102 -4.823 0.631 183 HA VAL 25 HA VAL 25 0.013 -7.392 1.568 184 HB VAL 25 HB VAL 25 -0.374 -6.697 3.910 185 HG11 VAL 25 1HG1 VAL 25 1.462 -4.768 2.449 186 HG12 VAL 25 2HG1 VAL 25 1.873 -6.396 2.999 187 HG13 VAL 25 3HG1 VAL 25 1.511 -5.134 4.177 188 HG21 VAL 25 3HG2 VAL 25 -2.172 -5.052 3.599 189 HG22 VAL 25 1HG2 VAL 25 -1.048 -3.937 2.815 190 HG23 VAL 25 2HG2 VAL 25 -0.847 -4.343 4.523 191 H ASN 26 H ASN 26 -1.547 -8.820 2.469 192 HA ASN 26 HA ASN 26 -4.281 -8.482 1.535 193 HB2 ASN 26 2HB ASN 26 -4.650 -10.735 2.478 194 HB3 ASN 26 3HB ASN 26 -3.192 -10.710 1.496 195 HD21 ASN 26 1HD2 ASN 26 -4.003 -12.523 3.646 196 HD22 ASN 26 2HD2 ASN 26 -2.714 -12.482 4.795 197 H SER 27 H SER 27 -5.898 -9.499 3.473 198 HA SER 27 HA SER 27 -6.279 -7.292 5.253 199 HB2 SER 27 2HB SER 27 -8.191 -8.457 4.253 200 HB3 SER 27 3HB SER 27 -7.733 -9.955 5.062 201 HG SER 27 HG SER 27 -8.115 -7.694 6.652 202 H LYS 28 H LYS 28 -4.432 -10.170 5.527 203 HA LYS 28 HA LYS 28 -4.243 -10.072 8.436 204 HB2 LYS 28 2HB LYS 28 -2.509 -11.574 6.428 205 HB3 LYS 28 3HB LYS 28 -2.533 -11.824 8.174 206 HG2 LYS 28 2HG LYS 28 -4.844 -12.342 6.278 207 HG3 LYS 28 3HG LYS 28 -3.774 -13.568 6.958 208 HD2 LYS 28 2HD LYS 28 -4.610 -13.162 9.199 209 HD3 LYS 28 3HD LYS 28 -5.516 -11.742 8.663 210 HE2 LYS 28 2HE LYS 28 -6.063 -14.573 7.704 211 HE3 LYS 28 3HE LYS 28 -6.947 -13.767 9.002 212 HZ1 LYS 28 3HZ LYS 28 -7.689 -12.099 7.460 213 HZ2 LYS 28 1HZ LYS 28 -8.076 -13.625 6.848 214 HZ3 LYS 28 2HZ LYS 28 -6.771 -12.770 6.208 215 H GLY 29 H GLY 29 -2.621 -8.722 5.653 216 HA2 GLY 29 2HA GLY 29 -1.207 -6.866 5.628 217 HA3 GLY 29 3HA GLY 29 -0.954 -7.021 7.363 218 H ASP 30 H ASP 30 -0.384 -8.901 4.394 219 HA ASP 30 HA ASP 30 2.377 -9.502 5.266 220 HB2 ASP 30 2HB ASP 30 0.954 -11.433 5.915 221 HB3 ASP 30 3HB ASP 30 0.338 -11.553 4.271 222 H ARG 31 H ARG 31 3.796 -10.012 3.597 223 HA ARG 31 HA ARG 31 3.531 -8.657 1.138 224 HB2 ARG 31 2HB ARG 31 5.500 -10.788 2.079 225 HB3 ARG 31 3HB ARG 31 5.691 -9.883 0.580 226 HG2 ARG 31 2HG ARG 31 5.573 -8.594 3.336 227 HG3 ARG 31 3HG ARG 31 7.070 -9.023 2.504 228 HD2 ARG 31 2HD ARG 31 4.983 -7.022 1.565 229 HD3 ARG 31 3HD ARG 31 6.602 -6.659 2.168 230 HE ARG 31 HE ARG 31 7.487 -7.842 0.183 231 HH11 ARG 31 1HH1 ARG 31 4.191 -6.595 0.007 232 HH12 ARG 31 2HH1 ARG 31 4.196 -6.511 -1.725 233 HH21 ARG 31 1HH2 ARG 31 7.433 -7.806 -2.095 234 HH22 ARG 31 2HH2 ARG 31 6.027 -7.194 -2.908 235 H ILE 32 H ILE 32 1.817 -9.328 -0.107 236 HA ILE 32 HA ILE 32 1.433 -12.172 -0.769 237 HB ILE 32 HB ILE 32 -0.638 -11.322 -1.998 238 HG12 ILE 32 2HG1 ILE 32 0.063 -8.676 -0.625 239 HG13 ILE 32 3HG1 ILE 32 0.106 -8.966 -2.359 240 HG21 ILE 32 1HG2 ILE 32 -0.462 -10.696 0.971 241 HG22 ILE 32 2HG2 ILE 32 -0.772 -12.280 0.255 242 HG23 ILE 32 3HG2 ILE 32 -1.950 -10.982 0.062 243 HD11 ILE 32 3HD1 ILE 32 -1.861 -7.726 -1.705 244 HD12 ILE 32 1HD1 ILE 32 -2.364 -9.029 -0.628 245 HD13 ILE 32 2HD1 ILE 32 -2.303 -9.295 -2.375 246 H VAL 33 H VAL 33 2.169 -9.100 -2.425 247 HA VAL 33 HA VAL 33 3.370 -10.516 -4.683 248 HB VAL 33 HB VAL 33 0.966 -10.178 -5.330 249 HG11 VAL 33 1HG1 VAL 33 1.546 -7.206 -5.135 250 HG12 VAL 33 2HG1 VAL 33 0.480 -8.132 -4.075 251 HG13 VAL 33 3HG1 VAL 33 0.067 -7.932 -5.780 252 HG21 VAL 33 3HG2 VAL 33 2.663 -10.280 -7.104 253 HG22 VAL 33 1HG2 VAL 33 2.905 -8.531 -6.999 254 HG23 VAL 33 2HG2 VAL 33 1.359 -9.180 -7.556 255 H ASN 34 H ASN 34 4.773 -9.122 -5.943 256 HA ASN 34 HA ASN 34 6.311 -7.295 -4.533 257 HB2 ASN 34 2HB ASN 34 7.244 -6.607 -6.825 258 HB3 ASN 34 3HB ASN 34 7.355 -8.305 -6.388 259 HD21 ASN 34 1HD2 ASN 34 7.667 -8.806 -8.581 260 HD22 ASN 34 2HD2 ASN 34 6.347 -8.851 -9.695 261 H GLU 35 H GLU 35 3.679 -6.669 -6.826 262 HA GLU 35 HA GLU 35 2.842 -4.202 -5.799 263 HB2 GLU 35 2HB GLU 35 3.714 -2.645 -7.500 264 HB3 GLU 35 3HB GLU 35 5.041 -3.363 -6.603 265 HG2 GLU 35 2HG GLU 35 5.530 -4.857 -8.466 266 HG3 GLU 35 3HG GLU 35 4.130 -4.253 -9.353 267 H SER 36 H SER 36 1.953 -2.943 -8.156 268 HA SER 36 HA SER 36 -0.124 -4.728 -9.118 269 HB2 SER 36 2HB SER 36 -0.990 -2.633 -10.212 270 HB3 SER 36 3HB SER 36 -0.712 -2.427 -8.483 271 HG SER 36 HG SER 36 0.547 -0.832 -9.010 272 H ASN 37 H ASN 37 2.795 -5.051 -9.959 273 HA ASN 37 HA ASN 37 3.763 -4.206 -12.294 274 HB2 ASN 37 2HB ASN 37 4.808 -5.920 -10.803 275 HB3 ASN 37 3HB ASN 37 3.714 -7.140 -11.435 276 HD21 ASN 37 1HD2 ASN 37 6.610 -7.157 -11.419 277 HD22 ASN 37 2HD2 ASN 37 7.114 -7.295 -13.068 278 H VAL 38 H VAL 38 1.694 -7.080 -12.169 279 HA VAL 38 HA VAL 38 0.230 -6.268 -14.538 280 HB VAL 38 HB VAL 38 1.997 -7.611 -15.553 281 HG11 VAL 38 1HG1 VAL 38 2.417 -9.968 -14.974 282 HG12 VAL 38 2HG1 VAL 38 1.252 -9.856 -13.650 283 HG13 VAL 38 3HG1 VAL 38 2.734 -8.897 -13.606 284 HG21 VAL 38 3HG2 VAL 38 -0.597 -9.200 -15.458 285 HG22 VAL 38 1HG2 VAL 38 0.658 -9.348 -16.693 286 HG23 VAL 38 2HG2 VAL 38 -0.247 -7.842 -16.531 287 H TYR 39 H TYR 39 -1.859 -7.050 -14.524 288 HA TYR 39 HA TYR 39 -3.085 -7.488 -12.069 289 HB2 TYR 39 2HB TYR 39 -5.154 -7.782 -13.294 290 HB3 TYR 39 3HB TYR 39 -4.202 -6.574 -14.147 291 HD1 TYR 39 HD2 TYR 39 -2.834 -7.371 -16.228 292 HD2 TYR 39 HD1 TYR 39 -5.950 -9.711 -14.464 293 HE1 TYR 39 HE2 TYR 39 -2.996 -8.714 -18.282 294 HE2 TYR 39 HE1 TYR 39 -6.103 -11.058 -16.505 295 HH TYR 39 HH TYR 39 -5.562 -10.806 -18.927 296 H THR 40 H THR 40 -1.729 -9.835 -14.318 297 HA THR 40 HA THR 40 -3.109 -12.146 -13.402 298 HB THR 40 HB THR 40 -1.228 -13.435 -14.480 299 HG1 THR 40 HG1 THR 40 0.422 -12.273 -15.499 300 HG21 THR 40 3HG2 THR 40 -3.149 -12.717 -15.863 301 HG22 THR 40 1HG2 THR 40 -1.649 -12.692 -16.797 302 HG23 THR 40 2HG2 THR 40 -2.342 -11.182 -16.199 303 H THR 41 H THR 41 0.287 -11.094 -12.760 304 HA THR 41 HA THR 41 0.824 -12.975 -10.738 305 HB THR 41 HB THR 41 2.131 -10.253 -11.184 306 HG1 THR 41 HG1 THR 41 2.277 -12.705 -12.499 307 HG21 THR 41 3HG2 THR 41 3.225 -12.733 -9.788 308 HG22 THR 41 1HG2 THR 41 2.769 -11.223 -8.990 309 HG23 THR 41 2HG2 THR 41 4.127 -11.253 -10.113 310 H PHE 42 H PHE 42 -0.588 -9.763 -10.615 311 HA PHE 42 HA PHE 42 -0.630 -9.324 -7.834 312 HB2 PHE 42 2HB PHE 42 -1.025 -7.502 -9.406 313 HB3 PHE 42 3HB PHE 42 -2.420 -8.323 -10.086 314 HD1 PHE 42 HD1 PHE 42 -1.211 -7.002 -6.777 315 HD2 PHE 42 HD2 PHE 42 -4.554 -7.599 -9.390 316 HE1 PHE 42 HE1 PHE 42 -2.663 -5.783 -5.221 317 HE2 PHE 42 HE2 PHE 42 -5.997 -6.374 -7.816 318 HZ PHE 42 HZ PHE 42 -5.050 -5.462 -5.732 319 H ARG 43 H ARG 43 -3.074 -10.738 -10.039 320 HA ARG 43 HA ARG 43 -5.084 -11.063 -8.035 321 HB2 ARG 43 2HB ARG 43 -5.555 -10.743 -10.477 322 HB3 ARG 43 3HB ARG 43 -4.920 -12.357 -10.790 323 HG2 ARG 43 2HG ARG 43 -6.743 -13.268 -9.280 324 HG3 ARG 43 3HG ARG 43 -7.408 -11.633 -9.197 325 HD2 ARG 43 2HD ARG 43 -7.051 -13.297 -11.712 326 HD3 ARG 43 3HD ARG 43 -8.579 -12.993 -10.879 327 HE ARG 43 HE ARG 43 -7.860 -10.497 -11.418 328 HH11 ARG 43 1HH1 ARG 43 -7.668 -13.309 -13.523 329 HH12 ARG 43 2HH1 ARG 43 -7.883 -12.388 -14.977 330 HH21 ARG 43 1HH2 ARG 43 -8.220 -9.313 -13.340 331 HH22 ARG 43 2HH2 ARG 43 -8.200 -10.130 -14.867 332 H ASN 44 H ASN 44 -2.948 -13.380 -9.746 333 HA ASN 44 HA ASN 44 -3.842 -15.745 -8.549 334 HB2 ASN 44 2HB ASN 44 -1.170 -15.055 -9.833 335 HB3 ASN 44 3HB ASN 44 -1.504 -16.661 -9.195 336 HD21 ASN 44 1HD2 ASN 44 -1.886 -14.595 -11.880 337 HD22 ASN 44 2HD2 ASN 44 -2.885 -15.627 -12.830 338 H ALA 45 H ALA 45 -1.496 -13.374 -7.424 339 HA ALA 45 HA ALA 45 -0.336 -14.776 -5.270 340 HB1 ALA 45 3HB ALA 45 0.545 -12.633 -6.100 341 HB2 ALA 45 1HB ALA 45 0.221 -12.544 -4.368 342 HB3 ALA 45 2HB ALA 45 -0.894 -11.796 -5.517 343 H ILE 46 H ILE 46 -3.211 -12.724 -5.451 344 HA ILE 46 HA ILE 46 -3.850 -12.914 -2.645 345 HB ILE 46 HB ILE 46 -5.571 -11.829 -4.929 346 HG12 ILE 46 2HG1 ILE 46 -3.565 -10.290 -3.207 347 HG13 ILE 46 3HG1 ILE 46 -3.267 -10.788 -4.867 348 HG21 ILE 46 1HG2 ILE 46 -6.618 -10.432 -3.180 349 HG22 ILE 46 2HG2 ILE 46 -5.595 -11.190 -1.956 350 HG23 ILE 46 3HG2 ILE 46 -6.800 -12.152 -2.817 351 HD11 ILE 46 3HD1 ILE 46 -3.883 -8.451 -4.713 352 HD12 ILE 46 1HD1 ILE 46 -5.426 -8.882 -3.977 353 HD13 ILE 46 2HD1 ILE 46 -5.069 -9.365 -5.638 354 H LEU 47 H LEU 47 -4.810 -14.567 -5.604 355 HA LEU 47 HA LEU 47 -7.031 -16.044 -4.542 356 HB2 LEU 47 2HB LEU 47 -5.310 -16.490 -7.009 357 HB3 LEU 47 3HB LEU 47 -6.697 -17.496 -6.608 358 HG LEU 47 HG LEU 47 -6.773 -14.528 -7.281 359 HD11 LEU 47 1HD1 LEU 47 -7.771 -16.927 -8.844 360 HD12 LEU 47 2HD1 LEU 47 -6.368 -15.927 -9.236 361 HD13 LEU 47 3HD1 LEU 47 -7.984 -15.229 -9.291 362 HD21 LEU 47 3HD2 LEU 47 -8.477 -15.004 -5.617 363 HD22 LEU 47 1HD2 LEU 47 -9.056 -16.395 -6.545 364 HD23 LEU 47 2HD2 LEU 47 -9.238 -14.759 -7.187 365 H LYS 48 H LYS 48 -3.570 -16.461 -4.605 366 HA LYS 48 HA LYS 48 -3.335 -19.212 -4.024 367 HB2 LYS 48 2HB LYS 48 -1.469 -17.735 -4.744 368 HB3 LYS 48 3HB LYS 48 -1.520 -16.911 -3.192 369 HG2 LYS 48 2HG LYS 48 -0.816 -18.990 -2.054 370 HG3 LYS 48 3HG LYS 48 -0.812 -19.841 -3.602 371 HD2 LYS 48 2HD LYS 48 0.986 -17.496 -2.850 372 HD3 LYS 48 3HD LYS 48 1.479 -19.188 -2.938 373 HE2 LYS 48 2HE LYS 48 0.935 -19.178 -5.383 374 HE3 LYS 48 3HE LYS 48 0.539 -17.461 -5.261 375 HZ1 LYS 48 3HZ LYS 48 3.197 -18.666 -4.703 376 HZ2 LYS 48 1HZ LYS 48 2.816 -17.028 -4.581 377 HZ3 LYS 48 2HZ LYS 48 2.777 -17.791 -6.083 378 H GLN 49 H GLN 49 -4.263 -16.515 -2.094 379 HA GLN 49 HA GLN 49 -4.166 -18.060 0.438 380 HB2 GLN 49 2HB GLN 49 -2.698 -16.020 0.213 381 HB3 GLN 49 3HB GLN 49 -4.143 -15.039 -0.011 382 HG2 GLN 49 2HG GLN 49 -4.848 -15.384 2.241 383 HG3 GLN 49 3HG GLN 49 -3.701 -16.707 2.478 384 HE21 GLN 49 1HE2 GLN 49 -2.762 -15.731 4.266 385 HE22 GLN 49 2HE2 GLN 49 -1.748 -14.337 4.138 386 H ALA 50 H ALA 50 -5.979 -17.573 1.944 387 HA ALA 50 HA ALA 50 -8.536 -17.834 0.761 388 HB1 ALA 50 3HB ALA 50 -7.851 -17.160 3.644 389 HB2 ALA 50 1HB ALA 50 -7.983 -18.782 2.961 390 HB3 ALA 50 2HB ALA 50 -9.412 -17.751 3.058 391 H ASP 51 H ASP 51 -6.808 -15.073 2.055 392 HA ASP 51 HA ASP 51 -8.899 -13.153 2.066 393 HB2 ASP 51 2HB ASP 51 -5.867 -12.817 1.819 394 HB3 ASP 51 3HB ASP 51 -6.986 -11.473 2.032 395 H LYS 52 H LYS 52 -9.952 -12.368 0.326 396 HA LYS 52 HA LYS 52 -8.686 -12.430 -2.357 397 HB2 LYS 52 2HB LYS 52 -11.654 -12.412 -1.631 398 HB3 LYS 52 3HB LYS 52 -10.995 -12.468 -3.266 399 HG2 LYS 52 2HG LYS 52 -10.666 -14.606 -1.134 400 HG3 LYS 52 3HG LYS 52 -11.726 -14.694 -2.545 401 HD2 LYS 52 2HD LYS 52 -9.787 -14.692 -4.054 402 HD3 LYS 52 3HD LYS 52 -8.684 -14.455 -2.694 403 HE2 LYS 52 2HE LYS 52 -8.672 -16.792 -3.446 404 HE3 LYS 52 3HE LYS 52 -9.301 -16.668 -1.802 405 HZ1 LYS 52 3HZ LYS 52 -10.583 -18.185 -3.196 406 HZ2 LYS 52 1HZ LYS 52 -10.971 -16.922 -4.245 407 HZ3 LYS 52 2HZ LYS 52 -11.529 -16.900 -2.652 408 H VAL 53 H VAL 53 -8.285 -10.383 -0.323 409 HA VAL 53 HA VAL 53 -8.799 -8.078 -2.023 410 HB VAL 53 HB VAL 53 -10.694 -7.932 -0.507 411 HG11 VAL 53 1HG1 VAL 53 -8.768 -8.026 1.843 412 HG12 VAL 53 2HG1 VAL 53 -9.883 -9.308 1.364 413 HG13 VAL 53 3HG1 VAL 53 -10.515 -7.761 1.930 414 HG21 VAL 53 3HG2 VAL 53 -8.588 -5.894 0.300 415 HG22 VAL 53 1HG2 VAL 53 -10.336 -5.708 0.482 416 HG23 VAL 53 2HG2 VAL 53 -9.623 -5.812 -1.128 417 H ALA 54 H ALA 54 -7.091 -6.804 -2.132 418 HA ALA 54 HA ALA 54 -4.778 -7.100 -0.333 419 HB1 ALA 54 3HB ALA 54 -4.978 -5.874 -3.113 420 HB2 ALA 54 1HB ALA 54 -4.312 -7.461 -2.718 421 HB3 ALA 54 2HB ALA 54 -3.500 -6.005 -2.149 422 H TYR 55 H TYR 55 -3.561 -4.996 -0.074 423 HA TYR 55 HA TYR 55 -5.240 -2.610 0.212 424 HB2 TYR 55 2HB TYR 55 -3.757 -3.984 2.509 425 HB3 TYR 55 3HB TYR 55 -4.334 -2.321 2.587 426 HD1 TYR 55 HD1 TYR 55 -6.762 -1.826 2.683 427 HD2 TYR 55 HD2 TYR 55 -5.361 -5.863 2.634 428 HE1 TYR 55 HE1 TYR 55 -8.987 -2.610 3.371 429 HE2 TYR 55 HE2 TYR 55 -7.585 -6.642 3.314 430 HH TYR 55 HH TYR 55 -10.330 -4.712 3.179 431 H LEU 56 H LEU 56 -4.148 -1.244 -0.982 432 HA LEU 56 HA LEU 56 -1.290 -1.355 -1.369 433 HB2 LEU 56 2HB LEU 56 -2.892 -0.790 -3.196 434 HB3 LEU 56 3HB LEU 56 -3.366 0.664 -2.332 435 HG LEU 56 HG LEU 56 -1.088 1.603 -2.628 436 HD11 LEU 56 1HD1 LEU 56 0.564 0.499 -4.073 437 HD12 LEU 56 2HD1 LEU 56 -0.467 -0.932 -4.164 438 HD13 LEU 56 3HD1 LEU 56 0.231 -0.439 -2.619 439 HD21 LEU 56 3HD2 LEU 56 -2.788 2.085 -4.316 440 HD22 LEU 56 1HD2 LEU 56 -2.325 0.643 -5.224 441 HD23 LEU 56 2HD2 LEU 56 -1.189 1.985 -5.051 442 H VAL 57 H VAL 57 -0.142 -0.758 0.352 443 HA VAL 57 HA VAL 57 -0.884 1.537 2.027 444 HB VAL 57 HB VAL 57 1.373 -0.488 2.438 445 HG11 VAL 57 1HG1 VAL 57 0.152 1.517 4.379 446 HG12 VAL 57 2HG1 VAL 57 1.752 1.634 3.642 447 HG13 VAL 57 3HG1 VAL 57 1.398 0.330 4.778 448 HG21 VAL 57 3HG2 VAL 57 -0.799 -1.643 2.465 449 HG22 VAL 57 1HG2 VAL 57 -1.419 -0.487 3.650 450 HG23 VAL 57 2HG2 VAL 57 -0.112 -1.588 4.091 451 H MET 58 H MET 58 -0.034 3.462 1.510 452 HA MET 58 HA MET 58 2.766 3.657 0.576 453 HB2 MET 58 2HB MET 58 2.215 5.440 -0.948 454 HB3 MET 58 3HB MET 58 1.135 4.108 -1.313 455 HG2 MET 58 2HG MET 58 0.320 6.498 0.361 456 HG3 MET 58 3HG MET 58 0.092 6.406 -1.383 457 HE1 MET 58 3HE MET 58 -1.675 4.863 -2.575 458 HE2 MET 58 1HE MET 58 -2.558 3.579 -1.748 459 HE3 MET 58 2HE MET 58 -0.811 3.459 -1.943 460 H ASP 59 H ASP 59 3.636 5.904 0.974 461 HA ASP 59 HA ASP 59 2.759 7.037 3.548 462 HB2 ASP 59 2HB ASP 59 4.826 8.446 3.327 463 HB3 ASP 59 3HB ASP 59 5.166 6.724 3.268 464 H GLU 60 H GLU 60 3.005 9.573 3.509 465 HA GLU 60 HA GLU 60 0.790 10.574 2.086 466 HB2 GLU 60 2HB GLU 60 1.433 11.403 4.309 467 HB3 GLU 60 3HB GLU 60 2.928 12.064 3.655 468 HG2 GLU 60 2HG GLU 60 1.648 13.671 2.296 469 HG3 GLU 60 3HG GLU 60 0.132 12.978 2.867 470 H ARG 61 H ARG 61 4.285 10.783 1.418 471 HA ARG 61 HA ARG 61 4.082 12.903 -0.523 472 HB2 ARG 61 2HB ARG 61 6.321 10.877 -0.072 473 HB3 ARG 61 3HB ARG 61 6.441 12.298 -1.107 474 HG2 ARG 61 2HG ARG 61 6.040 12.300 1.904 475 HG3 ARG 61 3HG ARG 61 7.536 12.684 1.047 476 HD2 ARG 61 2HD ARG 61 4.938 14.265 0.959 477 HD3 ARG 61 3HD ARG 61 6.439 14.742 1.762 478 HE ARG 61 HE ARG 61 7.272 14.426 -0.765 479 HH11 ARG 61 1HH1 ARG 61 4.511 16.218 0.483 480 HH12 ARG 61 2HH1 ARG 61 4.534 17.374 -0.810 481 HH21 ARG 61 1HH2 ARG 61 7.253 15.931 -2.465 482 HH22 ARG 61 2HH2 ARG 61 6.082 17.206 -2.468 483 H THR 62 H THR 62 4.210 9.345 -0.711 484 HA THR 62 HA THR 62 4.047 9.117 -3.537 485 HB THR 62 HB THR 62 3.122 7.196 -1.357 486 HG1 THR 62 HG1 THR 62 5.316 7.476 -1.233 487 HG21 THR 62 3HG2 THR 62 3.579 6.641 -4.316 488 HG22 THR 62 1HG2 THR 62 2.020 6.604 -3.490 489 HG23 THR 62 2HG2 THR 62 3.263 5.418 -3.085 490 H TRP 63 H TRP 63 1.616 9.428 -0.976 491 HA TRP 63 HA TRP 63 -0.722 9.152 -2.523 492 HB2 TRP 63 2HB TRP 63 -0.829 8.987 -0.100 493 HB3 TRP 63 3HB TRP 63 -0.225 10.629 0.094 494 HD1 TRP 63 HD1 TRP 63 -2.032 12.534 0.194 495 HE1 TRP 63 HE1 TRP 63 -4.585 12.615 -0.077 496 HE3 TRP 63 HE3 TRP 63 -2.828 7.785 -1.541 497 HZ2 TRP 63 HZ2 TRP 63 -6.656 10.918 -0.917 498 HZ3 TRP 63 HZ3 TRP 63 -5.132 7.098 -2.063 499 HH2 TRP 63 HH2 TRP 63 -7.005 8.636 -1.757 500 H LYS 64 H LYS 64 1.384 11.965 -1.921 501 HA LYS 64 HA LYS 64 -0.260 13.995 -2.921 502 HB2 LYS 64 2HB LYS 64 2.778 13.799 -3.046 503 HB3 LYS 64 3HB LYS 64 1.860 15.263 -3.397 504 HG2 LYS 64 2HG LYS 64 2.159 13.850 -0.742 505 HG3 LYS 64 3HG LYS 64 2.678 15.482 -1.176 506 HD2 LYS 64 2HD LYS 64 0.186 16.025 -1.517 507 HD3 LYS 64 3HD LYS 64 -0.168 14.472 -0.766 508 HE2 LYS 64 2HE LYS 64 0.964 15.199 1.285 509 HE3 LYS 64 3HE LYS 64 1.370 16.740 0.523 510 HZ1 LYS 64 3HZ LYS 64 -1.369 15.739 1.067 511 HZ2 LYS 64 1HZ LYS 64 -0.996 17.200 0.313 512 HZ3 LYS 64 2HZ LYS 64 -0.568 16.948 1.924 513 H LYS 65 H LYS 65 1.354 11.456 -4.649 514 HA LYS 65 HA LYS 65 0.643 12.687 -7.218 515 HB2 LYS 65 2HB LYS 65 2.379 10.280 -6.584 516 HB3 LYS 65 3HB LYS 65 1.900 10.717 -8.222 517 HG2 LYS 65 2HG LYS 65 3.610 12.342 -6.319 518 HG3 LYS 65 3HG LYS 65 4.120 11.575 -7.827 519 HD2 LYS 65 2HD LYS 65 2.184 13.921 -7.564 520 HD3 LYS 65 3HD LYS 65 3.856 14.013 -8.117 521 HE2 LYS 65 2HE LYS 65 3.309 12.718 -10.120 522 HE3 LYS 65 3HE LYS 65 1.658 12.467 -9.550 523 HZ1 LYS 65 3HZ LYS 65 1.239 14.811 -9.745 524 HZ2 LYS 65 1HZ LYS 65 1.842 14.237 -11.215 525 HZ3 LYS 65 2HZ LYS 65 2.842 15.118 -10.180 526 H VAL 66 H VAL 66 -0.299 9.940 -5.144 527 HA VAL 66 HA VAL 66 -1.943 8.613 -7.061 528 HB VAL 66 HB VAL 66 -2.320 8.691 -4.025 529 HG11 VAL 66 1HG1 VAL 66 -4.353 7.860 -5.157 530 HG12 VAL 66 2HG1 VAL 66 -3.546 6.548 -4.298 531 HG13 VAL 66 3HG1 VAL 66 -3.392 6.678 -6.053 532 HG21 VAL 66 3HG2 VAL 66 -1.041 6.562 -4.013 533 HG22 VAL 66 1HG2 VAL 66 -0.080 7.907 -4.636 534 HG23 VAL 66 2HG2 VAL 66 -0.770 6.729 -5.752 535 H TYR 67 H TYR 67 -2.912 10.777 -4.396 536 HA TYR 67 HA TYR 67 -5.527 11.390 -5.004 537 HB2 TYR 67 2HB TYR 67 -4.354 12.041 -2.916 538 HB3 TYR 67 3HB TYR 67 -3.375 13.196 -3.801 539 HD1 TYR 67 HD1 TYR 67 -6.760 12.491 -2.488 540 HD2 TYR 67 HD2 TYR 67 -4.285 15.404 -4.396 541 HE1 TYR 67 HE1 TYR 67 -8.442 14.218 -2.031 542 HE2 TYR 67 HE2 TYR 67 -5.968 17.130 -3.938 543 HH TYR 67 HH TYR 67 -8.391 17.253 -3.521 544 H ASP 68 H ASP 68 -2.566 12.842 -6.238 545 HA ASP 68 HA ASP 68 -3.585 15.047 -7.654 546 HB2 ASP 68 2HB ASP 68 -1.197 14.797 -7.080 547 HB3 ASP 68 3HB ASP 68 -1.060 13.405 -8.140 548 H LEU 69 H LEU 69 -2.567 11.825 -8.838 549 HA LEU 69 HA LEU 69 -3.157 12.186 -11.550 550 HB2 LEU 69 2HB LEU 69 -2.971 9.640 -9.906 551 HB3 LEU 69 3HB LEU 69 -3.122 9.647 -11.659 552 HG LEU 69 HG LEU 69 -0.791 10.843 -10.111 553 HD11 LEU 69 1HD1 LEU 69 -0.959 8.255 -11.670 554 HD12 LEU 69 2HD1 LEU 69 -0.816 8.426 -9.917 555 HD13 LEU 69 3HD1 LEU 69 0.503 8.949 -10.958 556 HD21 LEU 69 3HD2 LEU 69 0.298 11.066 -12.292 557 HD22 LEU 69 1HD2 LEU 69 -1.191 12.006 -12.244 558 HD23 LEU 69 2HD2 LEU 69 -1.150 10.463 -13.107 559 H LEU 70 H LEU 70 -5.130 10.970 -8.883 560 HA LEU 70 HA LEU 70 -7.311 9.949 -10.261 561 HB2 LEU 70 2HB LEU 70 -7.161 11.374 -7.580 562 HB3 LEU 70 3HB LEU 70 -8.639 10.622 -8.167 563 HG LEU 70 HG LEU 70 -6.022 9.147 -7.651 564 HD11 LEU 70 1HD1 LEU 70 -7.136 8.134 -5.726 565 HD12 LEU 70 2HD1 LEU 70 -8.568 9.131 -6.008 566 HD13 LEU 70 3HD1 LEU 70 -7.036 9.886 -5.555 567 HD21 LEU 70 3HD2 LEU 70 -8.747 8.059 -8.428 568 HD22 LEU 70 1HD2 LEU 70 -7.325 7.096 -8.012 569 HD23 LEU 70 2HD2 LEU 70 -7.309 8.106 -9.453 570 H ILE 71 H ILE 71 -6.903 13.278 -9.031 571 HA ILE 71 HA ILE 71 -9.232 14.325 -10.337 572 HB ILE 71 HB ILE 71 -6.853 15.849 -9.169 573 HG12 ILE 71 2HG1 ILE 71 -9.433 14.954 -7.786 574 HG13 ILE 71 3HG1 ILE 71 -7.839 14.251 -7.523 575 HG21 ILE 71 1HG2 ILE 71 -9.716 16.762 -9.654 576 HG22 ILE 71 2HG2 ILE 71 -8.302 17.262 -10.585 577 HG23 ILE 71 3HG2 ILE 71 -8.447 17.722 -8.889 578 HD11 ILE 71 3HD1 ILE 71 -7.059 16.384 -6.617 579 HD12 ILE 71 1HD1 ILE 71 -8.433 15.730 -5.727 580 HD13 ILE 71 2HD1 ILE 71 -8.674 17.065 -6.853 581 H LEU 72 H LEU 72 -5.869 14.011 -11.185 582 HA LEU 72 HA LEU 72 -5.587 16.028 -13.138 583 HB2 LEU 72 2HB LEU 72 -3.777 14.744 -11.831 584 HB3 LEU 72 3HB LEU 72 -4.003 13.433 -12.963 585 HG LEU 72 HG LEU 72 -1.979 14.885 -13.365 586 HD11 LEU 72 1HD1 LEU 72 -2.876 13.484 -15.161 587 HD12 LEU 72 2HD1 LEU 72 -2.122 14.959 -15.768 588 HD13 LEU 72 3HD1 LEU 72 -3.883 14.829 -15.709 589 HD21 LEU 72 3HD2 LEU 72 -3.997 16.994 -14.191 590 HD22 LEU 72 1HD2 LEU 72 -2.244 17.094 -14.386 591 HD23 LEU 72 2HD2 LEU 72 -2.948 17.051 -12.772 592 H HIS 73 H HIS 73 -6.363 12.561 -13.369 593 HA HIS 73 HA HIS 73 -6.811 12.655 -16.251 594 HB2 HIS 73 2HB HIS 73 -7.247 10.450 -14.191 595 HB3 HIS 73 3HB HIS 73 -7.564 10.255 -15.907 596 HD1 HIS 73 HD1 HIS 73 -5.769 8.979 -16.988 597 HD2 HIS 73 HD2 HIS 73 -4.280 11.324 -13.894 598 HE1 HIS 73 HE1 HIS 73 -3.318 8.459 -16.852 599 HE2 HIS 73 HE2 HIS 73 -2.430 9.954 -15.038 600 H ASP 74 H ASP 74 -8.850 11.719 -13.446 601 HA ASP 74 HA ASP 74 -11.029 13.362 -13.717 602 HB2 ASP 74 2HB ASP 74 -11.380 12.433 -16.016 603 HB3 ASP 74 3HB ASP 74 -11.480 10.808 -15.349 604 H PHE 75 H PHE 75 -11.110 13.107 -11.520 605 HA PHE 75 HA PHE 75 -12.901 11.296 -10.385 606 HB2 PHE 75 2HB PHE 75 -10.863 9.702 -10.650 607 HB3 PHE 75 3HB PHE 75 -10.064 10.669 -9.427 608 HD1 PHE 75 HD2 PHE 75 -13.229 8.717 -9.984 609 HD2 PHE 75 HD1 PHE 75 -10.276 9.981 -7.157 610 HE1 PHE 75 HE2 PHE 75 -14.235 7.270 -8.268 611 HE2 PHE 75 HE1 PHE 75 -11.292 8.526 -5.451 612 HZ PHE 75 HZ PHE 75 -13.272 7.169 -6.003 613 H THR 76 H THR 76 -13.713 13.131 -9.512 614 HA THR 76 HA THR 76 -12.323 15.422 -8.763 615 HB THR 76 HB THR 76 -14.765 15.273 -9.465 616 HG1 THR 76 HG1 THR 76 -15.440 16.849 -7.657 617 HG21 THR 76 3HG2 THR 76 -16.475 14.872 -7.738 618 HG22 THR 76 1HG2 THR 76 -15.203 14.480 -6.575 619 HG23 THR 76 2HG2 THR 76 -15.471 13.438 -7.976 620 HA PRO 77 HA PRO 77 -10.782 14.803 -4.595 621 HB2 PRO 77 2HB PRO 77 -11.462 17.263 -3.408 622 HB3 PRO 77 3HB PRO 77 -10.047 17.000 -4.452 623 HG2 PRO 77 2HG PRO 77 -12.757 18.077 -5.199 624 HG3 PRO 77 3HG PRO 77 -11.146 18.675 -5.649 625 HD2 PRO 77 2HD PRO 77 -12.520 17.234 -7.392 626 HD3 PRO 77 3HD PRO 77 -10.780 16.931 -7.204 627 H GLU 78 H GLU 78 -14.081 15.893 -5.063 628 HA GLU 78 HA GLU 78 -15.188 15.629 -2.507 629 HB2 GLU 78 2HB GLU 78 -16.555 15.120 -5.189 630 HB3 GLU 78 3HB GLU 78 -17.371 15.485 -3.669 631 HG2 GLU 78 2HG GLU 78 -16.446 17.728 -3.646 632 HG3 GLU 78 3HG GLU 78 -15.449 17.379 -5.059 633 H GLU 79 H GLU 79 -14.833 13.239 -5.124 634 HA GLU 79 HA GLU 79 -16.107 11.044 -3.895 635 HB2 GLU 79 2HB GLU 79 -13.902 11.178 -5.996 636 HB3 GLU 79 3HB GLU 79 -14.666 9.667 -5.507 637 HG2 GLU 79 2HG GLU 79 -16.148 12.027 -6.702 638 HG3 GLU 79 3HG GLU 79 -15.565 10.642 -7.627 639 H ILE 80 H ILE 80 -12.683 11.908 -4.122 640 HA ILE 80 HA ILE 80 -11.530 9.703 -2.870 641 HB ILE 80 HB ILE 80 -10.432 12.556 -2.817 642 HG12 ILE 80 2HG1 ILE 80 -10.046 10.498 -5.051 643 HG13 ILE 80 3HG1 ILE 80 -11.170 11.851 -5.139 644 HG21 ILE 80 1HG2 ILE 80 -8.216 11.454 -2.813 645 HG22 ILE 80 2HG2 ILE 80 -8.995 9.873 -2.777 646 HG23 ILE 80 3HG2 ILE 80 -9.177 10.976 -1.411 647 HD11 ILE 80 3HD1 ILE 80 -9.128 12.326 -6.342 648 HD12 ILE 80 1HD1 ILE 80 -8.172 12.066 -4.883 649 HD13 ILE 80 2HD1 ILE 80 -9.305 13.419 -4.971 650 H LYS 81 H LYS 81 -12.327 12.895 -1.512 651 HA LYS 81 HA LYS 81 -11.362 12.392 1.100 652 HB2 LYS 81 2HB LYS 81 -12.219 14.561 1.675 653 HB3 LYS 81 3HB LYS 81 -11.561 14.652 0.046 654 HG2 LYS 81 2HG LYS 81 -14.005 14.331 -0.760 655 HG3 LYS 81 3HG LYS 81 -14.469 14.692 0.904 656 HD2 LYS 81 2HD LYS 81 -12.838 16.535 -0.896 657 HD3 LYS 81 3HD LYS 81 -14.574 16.666 -0.630 658 HE2 LYS 81 2HE LYS 81 -13.626 18.294 0.795 659 HE3 LYS 81 3HE LYS 81 -14.007 16.952 1.867 660 HZ1 LYS 81 3HZ LYS 81 -11.829 17.914 2.304 661 HZ2 LYS 81 1HZ LYS 81 -11.326 17.528 0.740 662 HZ3 LYS 81 2HZ LYS 81 -11.702 16.298 1.835 663 H SER 82 H SER 82 -14.451 11.839 -0.454 664 HA SER 82 HA SER 82 -16.108 11.817 1.859 665 HB2 SER 82 2HB SER 82 -16.967 12.156 -0.460 666 HB3 SER 82 3HB SER 82 -16.607 10.469 -0.826 667 HG SER 82 HG SER 82 -18.478 11.502 1.032 668 H PHE 83 H PHE 83 -14.140 9.330 0.283 669 HA PHE 83 HA PHE 83 -15.194 7.097 1.717 670 HB2 PHE 83 2HB PHE 83 -12.469 7.500 0.425 671 HB3 PHE 83 3HB PHE 83 -13.017 5.970 1.095 672 HD1 PHE 83 HD2 PHE 83 -15.134 4.898 0.065 673 HD2 PHE 83 HD1 PHE 83 -12.969 8.062 -1.834 674 HE1 PHE 83 HE2 PHE 83 -16.117 4.278 -2.104 675 HE2 PHE 83 HE1 PHE 83 -13.951 7.433 -3.997 676 HZ PHE 83 HZ PHE 83 -15.525 5.543 -4.138 677 H PHE 84 H PHE 84 -12.776 9.565 2.457 678 HA PHE 84 HA PHE 84 -11.753 8.326 4.854 679 HB2 PHE 84 2HB PHE 84 -11.626 11.219 3.887 680 HB3 PHE 84 3HB PHE 84 -10.790 10.626 5.313 681 HD1 PHE 84 HD2 PHE 84 -8.928 8.957 5.054 682 HD2 PHE 84 HD1 PHE 84 -10.683 10.904 1.685 683 HE1 PHE 84 HE2 PHE 84 -6.969 8.394 3.693 684 HE2 PHE 84 HE1 PHE 84 -8.713 10.345 0.332 685 HZ PHE 84 HZ PHE 84 -6.851 9.090 1.346 686 H GLU 85 H GLU 85 -14.381 10.564 4.060 687 HA GLU 85 HA GLU 85 -15.004 11.365 6.740 688 HB2 GLU 85 2HB GLU 85 -16.887 11.431 4.342 689 HB3 GLU 85 3HB GLU 85 -17.027 12.369 5.825 690 HG2 GLU 85 2HG GLU 85 -14.991 12.698 3.612 691 HG3 GLU 85 3HG GLU 85 -16.278 13.808 4.057 692 H ASN 86 H ASN 86 -15.644 8.517 4.956 693 HA ASN 86 HA ASN 86 -18.216 7.737 5.576 694 HB2 ASN 86 2HB ASN 86 -16.708 6.573 3.960 695 HB3 ASN 86 3HB ASN 86 -15.790 5.915 5.303 696 HD21 ASN 86 1HD2 ASN 86 -16.235 3.824 4.494 697 HD22 ASN 86 2HD2 ASN 86 -17.769 3.077 4.714 698 H LYS 87 H LYS 87 -19.254 6.969 7.324 699 HA LYS 87 HA LYS 87 -17.829 7.014 9.900 700 HB2 LYS 87 2HB LYS 87 -20.809 7.300 9.329 701 HB3 LYS 87 3HB LYS 87 -20.022 7.513 10.893 702 HG2 LYS 87 2HG LYS 87 -18.736 9.440 9.905 703 HG3 LYS 87 3HG LYS 87 -19.690 9.264 8.431 704 HD2 LYS 87 2HD LYS 87 -20.599 11.060 9.846 705 HD3 LYS 87 3HD LYS 87 -21.758 9.735 9.708 706 HE2 LYS 87 2HE LYS 87 -21.073 8.914 11.944 707 HE3 LYS 87 3HE LYS 87 -19.908 10.234 12.073 708 HZ1 LYS 87 3HZ LYS 87 -22.849 10.563 11.818 709 HZ2 LYS 87 1HZ LYS 87 -21.723 11.806 12.012 710 HZ3 LYS 87 2HZ LYS 87 -21.971 10.694 13.256 711 H GLY 88 H GLY 88 -20.784 5.357 8.699 712 HA2 GLY 88 2HA GLY 88 -20.770 3.402 10.740 713 HA3 GLY 88 3HA GLY 88 -21.776 3.399 9.304 714 H LYS 89 H LYS 89 -19.819 3.223 7.329 715 HA LYS 89 HA LYS 89 -19.005 0.403 7.622 716 HB2 LYS 89 2HB LYS 89 -19.184 2.151 5.124 717 HB3 LYS 89 3HB LYS 89 -18.633 0.483 5.136 718 HG2 LYS 89 2HG LYS 89 -20.862 0.368 4.394 719 HG3 LYS 89 3HG LYS 89 -20.928 -0.143 6.080 720 HD2 LYS 89 2HD LYS 89 -22.811 1.338 5.585 721 HD3 LYS 89 3HD LYS 89 -21.718 2.139 6.718 722 HE2 LYS 89 2HE LYS 89 -20.753 3.444 4.837 723 HE3 LYS 89 3HE LYS 89 -21.860 2.641 3.721 724 HZ1 LYS 89 3HZ LYS 89 -22.686 4.343 6.011 725 HZ2 LYS 89 1HZ LYS 89 -23.714 3.616 4.879 726 HZ3 LYS 89 2HZ LYS 89 -22.645 4.827 4.396 727 H ARG 90 H ARG 90 -16.934 -0.162 6.434 728 HA ARG 90 HA ARG 90 -14.701 1.212 7.538 729 HB2 ARG 90 2HB ARG 90 -14.612 -1.208 7.140 730 HB3 ARG 90 3HB ARG 90 -14.882 -0.973 5.417 731 HG2 ARG 90 2HG ARG 90 -12.659 0.243 5.323 732 HG3 ARG 90 3HG ARG 90 -12.394 -0.231 7.004 733 HD2 ARG 90 2HD ARG 90 -12.832 -2.140 4.682 734 HD3 ARG 90 3HD ARG 90 -11.264 -1.738 5.389 735 HE ARG 90 HE ARG 90 -12.732 -2.645 7.508 736 HH11 ARG 90 1HH1 ARG 90 -11.918 -4.017 4.383 737 HH12 ARG 90 2HH1 ARG 90 -11.941 -5.650 4.954 738 HH21 ARG 90 1HH2 ARG 90 -12.716 -4.808 8.260 739 HH22 ARG 90 2HH2 ARG 90 -12.395 -6.101 7.150 740 HA PRO 91 HA PRO 91 -14.013 4.235 4.133 741 HB2 PRO 91 2HB PRO 91 -11.266 4.242 5.383 742 HB3 PRO 91 3HB PRO 91 -12.315 5.613 4.966 743 HG2 PRO 91 2HG PRO 91 -12.008 4.897 7.505 744 HG3 PRO 91 3HG PRO 91 -13.609 5.393 6.900 745 HD2 PRO 91 2HD PRO 91 -12.571 2.608 7.427 746 HD3 PRO 91 3HD PRO 91 -14.174 3.297 7.779 747 H VAL 92 H VAL 92 -13.573 3.502 2.095 748 HA VAL 92 HA VAL 92 -11.838 1.288 1.498 749 HB VAL 92 HB VAL 92 -12.920 3.410 -0.432 750 HG11 VAL 92 1HG1 VAL 92 -11.795 0.640 -1.034 751 HG12 VAL 92 2HG1 VAL 92 -11.012 2.179 -1.403 752 HG13 VAL 92 3HG1 VAL 92 -12.514 1.736 -2.220 753 HG21 VAL 92 3HG2 VAL 92 -14.760 2.260 0.738 754 HG22 VAL 92 1HG2 VAL 92 -14.094 0.689 0.276 755 HG23 VAL 92 2HG2 VAL 92 -14.713 1.787 -0.961 756 H PHE 93 H PHE 93 -11.601 4.807 1.276 757 HA PHE 93 HA PHE 93 -8.682 4.712 0.918 758 HB2 PHE 93 2HB PHE 93 -10.674 7.024 0.804 759 HB3 PHE 93 3HB PHE 93 -8.933 7.231 0.697 760 HD1 PHE 93 HD1 PHE 93 -11.212 4.731 -0.993 761 HD2 PHE 93 HD2 PHE 93 -8.491 7.987 -1.466 762 HE1 PHE 93 HE1 PHE 93 -11.335 4.476 -3.430 763 HE2 PHE 93 HE2 PHE 93 -8.618 7.727 -3.906 764 HZ PHE 93 HZ PHE 93 -10.036 5.970 -4.892 765 H VAL 94 H VAL 94 -7.666 4.424 2.811 766 HA VAL 94 HA VAL 94 -8.670 5.684 5.309 767 HB VAL 94 HB VAL 94 -6.810 3.263 5.045 768 HG11 VAL 94 1HG1 VAL 94 -7.294 2.884 7.442 769 HG12 VAL 94 2HG1 VAL 94 -8.253 4.367 7.479 770 HG13 VAL 94 3HG1 VAL 94 -6.517 4.447 7.169 771 HG21 VAL 94 3HG2 VAL 94 -9.784 3.254 5.657 772 HG22 VAL 94 1HG2 VAL 94 -8.720 1.845 5.688 773 HG23 VAL 94 2HG2 VAL 94 -9.033 2.682 4.165 774 H LYS 95 H LYS 95 -7.077 6.598 6.735 775 HA LYS 95 HA LYS 95 -4.311 6.940 5.825 776 HB2 LYS 95 2HB LYS 95 -4.348 9.366 6.170 777 HB3 LYS 95 3HB LYS 95 -5.505 8.909 4.924 778 HG2 LYS 95 2HG LYS 95 -7.370 9.182 6.462 779 HG3 LYS 95 3HG LYS 95 -6.267 9.483 7.810 780 HD2 LYS 95 2HD LYS 95 -6.554 11.247 5.344 781 HD3 LYS 95 3HD LYS 95 -7.275 11.574 6.919 782 HE2 LYS 95 2HE LYS 95 -4.951 11.631 7.900 783 HE3 LYS 95 3HE LYS 95 -4.306 11.463 6.264 784 HZ1 LYS 95 3HZ LYS 95 -4.359 13.763 7.010 785 HZ2 LYS 95 1HZ LYS 95 -6.039 13.687 7.197 786 HZ3 LYS 95 2HZ LYS 95 -5.351 13.532 5.663 787 H GLY 96 H GLY 96 -3.073 8.208 7.579 788 HA2 GLY 96 2HA GLY 96 -3.385 8.986 9.986 789 HA3 GLY 96 3HA GLY 96 -3.911 7.330 10.288 790 H SER 97 H SER 97 -2.069 7.396 11.844 791 HA SER 97 HA SER 97 0.605 7.111 10.811 792 HB2 SER 97 2HB SER 97 0.017 7.764 13.202 793 HB3 SER 97 3HB SER 97 -0.489 6.096 13.476 794 HG SER 97 HG SER 97 1.626 6.316 14.135 795 H LEU 98 H LEU 98 1.752 4.812 11.459 796 HA LEU 98 HA LEU 98 0.894 3.008 9.477 797 HB2 LEU 98 2HB LEU 98 3.236 3.130 10.290 798 HB3 LEU 98 3HB LEU 98 2.737 2.471 11.841 799 HG LEU 98 HG LEU 98 2.102 0.324 10.719 800 HD11 LEU 98 1HD1 LEU 98 1.551 1.168 8.501 801 HD12 LEU 98 2HD1 LEU 98 2.757 -0.112 8.395 802 HD13 LEU 98 3HD1 LEU 98 3.244 1.576 8.205 803 HD21 LEU 98 3HD2 LEU 98 4.334 0.533 11.705 804 HD22 LEU 98 1HD2 LEU 98 4.968 1.160 10.179 805 HD23 LEU 98 2HD2 LEU 98 4.365 -0.499 10.275 806 H GLU 99 H GLU 99 0.528 2.851 13.015 807 HA GLU 99 HA GLU 99 -0.949 0.403 13.084 808 HB2 GLU 99 2HB GLU 99 -0.657 2.593 15.192 809 HB3 GLU 99 3HB GLU 99 -1.377 1.006 15.484 810 HG2 GLU 99 2HG GLU 99 0.740 -0.107 15.036 811 HG3 GLU 99 3HG GLU 99 1.485 1.418 14.553 812 H SER 100 H SER 100 -1.815 3.848 13.282 813 HA SER 100 HA SER 100 -4.502 3.684 13.993 814 HB2 SER 100 2HB SER 100 -3.216 5.796 12.179 815 HB3 SER 100 3HB SER 100 -4.675 5.996 13.154 816 HG SER 100 HG SER 100 -3.257 5.509 14.990 817 H ALA 101 H ALA 101 -3.098 3.913 10.734 818 HA ALA 101 HA ALA 101 -5.502 3.901 9.259 819 HB1 ALA 101 3HB ALA 101 -2.697 3.143 8.360 820 HB2 ALA 101 1HB ALA 101 -3.383 4.770 8.364 821 HB3 ALA 101 2HB ALA 101 -4.056 3.531 7.299 822 H ALA 102 H ALA 102 -3.426 1.340 10.461 823 HA ALA 102 HA ALA 102 -4.522 -0.848 9.011 824 HB1 ALA 102 3HB ALA 102 -2.314 -0.909 10.117 825 HB2 ALA 102 1HB ALA 102 -3.348 -2.231 10.662 826 HB3 ALA 102 2HB ALA 102 -3.099 -0.820 11.697 827 H GLU 103 H GLU 103 -5.290 0.668 12.115 828 HA GLU 103 HA GLU 103 -7.151 -1.297 13.047 829 HB2 GLU 103 2HB GLU 103 -6.803 1.612 13.903 830 HB3 GLU 103 3HB GLU 103 -7.681 0.374 14.805 831 HG2 GLU 103 2HG GLU 103 -5.615 -0.899 15.108 832 HG3 GLU 103 3HG GLU 103 -4.736 0.266 14.140 833 H GLN 104 H GLN 104 -7.433 1.698 11.240 834 HA GLN 104 HA GLN 104 -10.311 1.819 11.207 835 HB2 GLN 104 2HB GLN 104 -8.224 3.188 9.469 836 HB3 GLN 104 3HB GLN 104 -9.943 3.584 9.457 837 HG2 GLN 104 2HG GLN 104 -9.832 4.344 11.759 838 HG3 GLN 104 3HG GLN 104 -8.161 3.814 11.899 839 HE21 GLN 104 1HE2 GLN 104 -6.536 5.049 10.977 840 HE22 GLN 104 2HE2 GLN 104 -6.791 6.641 10.363 841 H ALA 105 H ALA 105 -7.826 0.554 9.001 842 HA ALA 105 HA ALA 105 -9.716 -0.270 6.962 843 HB1 ALA 105 3HB ALA 105 -6.766 -0.928 7.261 844 HB2 ALA 105 1HB ALA 105 -7.441 0.421 6.342 845 HB3 ALA 105 2HB ALA 105 -7.761 -1.239 5.833 846 H GLY 106 H GLY 106 -8.581 -1.596 9.918 847 HA2 GLY 106 2HA GLY 106 -9.359 -3.441 11.064 848 HA3 GLY 106 3HA GLY 106 -10.329 -3.871 9.667 849 H ILE 107 H ILE 107 -6.910 -3.383 9.311 850 HA ILE 107 HA ILE 107 -6.471 -6.180 8.552 851 HB ILE 107 HB ILE 107 -4.390 -3.938 8.554 852 HG12 ILE 107 2HG1 ILE 107 -6.248 -4.583 6.217 853 HG13 ILE 107 3HG1 ILE 107 -6.444 -3.190 7.279 854 HG21 ILE 107 1HG2 ILE 107 -3.328 -5.240 6.751 855 HG22 ILE 107 2HG2 ILE 107 -4.627 -6.432 6.829 856 HG23 ILE 107 3HG2 ILE 107 -3.532 -6.231 8.198 857 HD11 ILE 107 3HD1 ILE 107 -5.363 -2.552 5.216 858 HD12 ILE 107 1HD1 ILE 107 -4.075 -3.727 5.481 859 HD13 ILE 107 2HD1 ILE 107 -4.253 -2.345 6.568 860 H VAL 108 H VAL 108 -4.746 -7.491 9.591 861 HA VAL 108 HA VAL 108 -4.428 -7.107 12.404 862 HB VAL 108 HB VAL 108 -2.751 -8.932 10.623 863 HG11 VAL 108 1HG1 VAL 108 -1.692 -8.552 12.807 864 HG12 VAL 108 2HG1 VAL 108 -2.306 -10.203 12.703 865 HG13 VAL 108 3HG1 VAL 108 -3.190 -8.993 13.637 866 HG21 VAL 108 3HG2 VAL 108 -4.301 -10.741 11.301 867 HG22 VAL 108 1HG2 VAL 108 -5.126 -9.479 10.382 868 HG23 VAL 108 2HG2 VAL 108 -5.312 -9.559 12.137 869 H VAL 109 H VAL 109 -3.394 -5.450 13.146 870 HA VAL 109 HA VAL 109 -1.696 -3.707 11.794 871 HB VAL 109 HB VAL 109 -1.882 -4.020 14.832 872 HG11 VAL 109 1HG1 VAL 109 -0.043 -2.542 14.126 873 HG12 VAL 109 2HG1 VAL 109 -1.316 -1.613 14.918 874 HG13 VAL 109 3HG1 VAL 109 -1.166 -1.581 13.159 875 HG21 VAL 109 3HG2 VAL 109 -3.675 -2.362 13.020 876 HG22 VAL 109 1HG2 VAL 109 -3.735 -2.390 14.786 877 HG23 VAL 109 2HG2 VAL 109 -4.144 -3.840 13.862 878 H ASP 110 H ASP 110 -0.946 -6.167 14.244 879 HA ASP 110 HA ASP 110 1.771 -5.640 14.622 880 HB2 ASP 110 2HB ASP 110 0.347 -7.001 16.162 881 HB3 ASP 110 3HB ASP 110 0.305 -8.302 14.979 882 H GLU 111 H GLU 111 0.175 -7.711 12.233 883 HA GLU 111 HA GLU 111 2.589 -8.940 11.284 884 HB2 GLU 111 2HB GLU 111 -0.190 -8.812 10.077 885 HB3 GLU 111 3HB GLU 111 1.131 -9.765 9.405 886 HG2 GLU 111 2HG GLU 111 -0.058 -10.125 12.172 887 HG3 GLU 111 3HG GLU 111 -0.470 -11.093 10.763 888 H LEU 112 H LEU 112 0.555 -6.179 10.089 889 HA LEU 112 HA LEU 112 2.307 -5.799 7.813 890 HB2 LEU 112 2HB LEU 112 1.069 -3.725 7.345 891 HB3 LEU 112 3HB LEU 112 0.049 -5.137 7.529 892 HG LEU 112 HG LEU 112 -0.449 -4.263 9.923 893 HD11 LEU 112 1HD1 LEU 112 1.310 -2.579 10.136 894 HD12 LEU 112 2HD1 LEU 112 -0.279 -1.833 10.275 895 HD13 LEU 112 3HD1 LEU 112 0.642 -1.674 8.775 896 HD21 LEU 112 3HD2 LEU 112 -1.446 -2.639 7.573 897 HD22 LEU 112 1HD2 LEU 112 -2.251 -2.870 9.124 898 HD23 LEU 112 2HD2 LEU 112 -2.038 -4.233 8.039 899 H VAL 113 H VAL 113 2.376 -4.661 11.067 900 HA VAL 113 HA VAL 113 4.269 -2.556 10.744 901 HB VAL 113 HB VAL 113 3.635 -4.284 13.187 902 HG11 VAL 113 1HG1 VAL 113 5.476 -1.856 13.066 903 HG12 VAL 113 2HG1 VAL 113 5.978 -3.516 13.392 904 HG13 VAL 113 3HG1 VAL 113 4.951 -2.663 14.547 905 HG21 VAL 113 3HG2 VAL 113 2.964 -1.380 12.560 906 HG22 VAL 113 1HG2 VAL 113 2.513 -2.245 14.035 907 HG23 VAL 113 2HG2 VAL 113 1.836 -2.731 12.481 908 H GLN 114 H GLN 114 4.494 -6.064 11.195 909 HA GLN 114 HA GLN 114 7.332 -6.309 11.297 910 HB2 GLN 114 2HB GLN 114 5.212 -8.252 10.271 911 HB3 GLN 114 3HB GLN 114 6.919 -8.671 10.416 912 HG2 GLN 114 2HG GLN 114 5.178 -7.817 12.747 913 HG3 GLN 114 3HG GLN 114 5.500 -9.491 12.300 914 HE21 GLN 114 1HE2 GLN 114 6.885 -6.557 13.606 915 HE22 GLN 114 2HE2 GLN 114 8.288 -7.293 14.291 916 H THR 115 H THR 115 4.998 -6.615 8.676 917 HA THR 115 HA THR 115 6.539 -6.999 6.467 918 HB THR 115 HB THR 115 3.941 -5.501 6.879 919 HG1 THR 115 HG1 THR 115 3.131 -7.443 6.781 920 HG21 THR 115 3HG2 THR 115 5.141 -6.297 4.224 921 HG22 THR 115 1HG2 THR 115 4.838 -4.652 4.793 922 HG23 THR 115 2HG2 THR 115 3.488 -5.741 4.485 923 H VAL 116 H VAL 116 5.720 -3.835 7.927 924 HA VAL 116 HA VAL 116 7.056 -2.326 5.848 925 HB VAL 116 HB VAL 116 5.630 -1.446 8.399 926 HG11 VAL 116 1HG1 VAL 116 7.380 0.234 7.916 927 HG12 VAL 116 2HG1 VAL 116 5.780 0.894 7.574 928 HG13 VAL 116 3HG1 VAL 116 6.817 0.362 6.247 929 HG21 VAL 116 3HG2 VAL 116 4.858 -1.200 5.462 930 HG22 VAL 116 1HG2 VAL 116 3.900 -0.617 6.827 931 HG23 VAL 116 2HG2 VAL 116 4.174 -2.348 6.615 932 H LYS 117 H LYS 117 7.862 -3.299 9.212 933 HA LYS 117 HA LYS 117 10.192 -1.584 9.320 934 HB2 LYS 117 2HB LYS 117 10.753 -2.614 11.419 935 HB3 LYS 117 3HB LYS 117 9.016 -2.343 11.402 936 HG2 LYS 117 2HG LYS 117 8.614 -4.720 10.958 937 HG3 LYS 117 3HG LYS 117 10.348 -5.026 10.855 938 HD2 LYS 117 2HD LYS 117 8.859 -4.083 13.344 939 HD3 LYS 117 3HD LYS 117 9.399 -5.735 13.035 940 HE2 LYS 117 2HE LYS 117 11.756 -4.927 12.986 941 HE3 LYS 117 3HE LYS 117 11.187 -3.300 13.363 942 HZ1 LYS 117 3HZ LYS 117 11.992 -4.527 15.312 943 HZ2 LYS 117 1HZ LYS 117 10.763 -5.669 15.101 944 HZ3 LYS 117 2HZ LYS 117 10.374 -4.071 15.461 945 H ASN 118 H ASN 118 9.550 -4.897 8.354 946 HA ASN 118 HA ASN 118 12.277 -5.723 8.031 947 HB2 ASN 118 2HB ASN 118 9.709 -6.880 6.850 948 HB3 ASN 118 3HB ASN 118 11.297 -7.623 6.679 949 HD21 ASN 118 1HD2 ASN 118 8.829 -8.604 7.942 950 HD22 ASN 118 2HD2 ASN 118 9.266 -9.040 9.555 951 H TYR 119 H TYR 119 9.719 -4.421 5.926 952 HA TYR 119 HA TYR 119 11.045 -4.331 3.480 953 HB2 TYR 119 2HB TYR 119 8.646 -3.788 3.695 954 HB3 TYR 119 3HB TYR 119 9.022 -2.354 4.638 955 HD1 TYR 119 HD1 TYR 119 9.193 -3.843 1.226 956 HD2 TYR 119 HD2 TYR 119 9.626 -0.261 3.529 957 HE1 TYR 119 HE1 TYR 119 9.230 -2.514 -0.842 958 HE2 TYR 119 HE2 TYR 119 9.663 1.065 1.459 959 HH TYR 119 HH TYR 119 8.642 -0.019 -1.454 960 H GLN 120 H GLN 120 10.719 -1.645 5.816 961 HA GLN 120 HA GLN 120 12.552 0.083 4.608 962 HB2 GLN 120 2HB GLN 120 11.574 0.003 7.497 963 HB3 GLN 120 3HB GLN 120 12.512 1.326 6.802 964 HG2 GLN 120 2HG GLN 120 10.653 1.618 5.094 965 HG3 GLN 120 3HG GLN 120 9.703 0.467 6.031 966 HE21 GLN 120 1HE2 GLN 120 9.219 3.320 5.433 967 HE22 GLN 120 2HE2 GLN 120 9.038 4.098 6.961 968 H GLY 121 H GLY 121 13.049 -2.589 6.780 969 HA2 GLY 121 2HA GLY 121 15.677 -1.887 7.713 970 HA3 GLY 121 3HA GLY 121 14.872 -3.439 7.875 971 H TYR 122 H TYR 122 14.356 -3.992 5.137 972 HA TYR 122 HA TYR 122 17.021 -4.880 4.411 973 HB2 TYR 122 2HB TYR 122 16.015 -6.419 2.872 974 HB3 TYR 122 3HB TYR 122 15.213 -6.526 4.414 975 HD1 TYR 122 HD2 TYR 122 14.404 -4.232 1.474 976 HD2 TYR 122 HD1 TYR 122 13.167 -7.525 3.901 977 HE1 TYR 122 HE2 TYR 122 12.271 -4.330 0.263 978 HE2 TYR 122 HE1 TYR 122 11.041 -7.633 2.674 979 HH TYR 122 HH TYR 122 10.499 -5.966 -0.239 980 H VAL 123 H VAL 123 14.880 -2.393 3.447 981 HA VAL 123 HA VAL 123 15.859 -1.771 0.864 982 HB VAL 123 HB VAL 123 14.503 -0.077 3.015 983 HG11 VAL 123 1HG1 VAL 123 15.318 0.851 0.236 984 HG12 VAL 123 2HG1 VAL 123 15.923 1.476 1.772 985 HG13 VAL 123 3HG1 VAL 123 14.239 1.733 1.321 986 HG21 VAL 123 3HG2 VAL 123 13.497 -1.029 0.301 987 HG22 VAL 123 1HG2 VAL 123 12.565 -0.109 1.488 988 HG23 VAL 123 2HG2 VAL 123 13.084 -1.755 1.851 989 H GLN 124 H GLN 124 16.645 -0.343 4.044 990 HA GLN 124 HA GLN 124 18.836 1.234 3.130 991 HB2 GLN 124 2HB GLN 124 19.239 1.649 5.551 992 HB3 GLN 124 3HB GLN 124 17.554 1.878 5.107 993 HG2 GLN 124 2HG GLN 124 17.059 -0.400 5.971 994 HG3 GLN 124 3HG GLN 124 18.724 -0.521 6.541 995 HE21 GLN 124 1HE2 GLN 124 18.098 -0.743 8.681 996 HE22 GLN 124 2HE2 GLN 124 17.436 0.560 9.607 997 H ASP 125 H ASP 125 18.534 -2.078 4.171 998 HA ASP 125 HA ASP 125 21.275 -2.558 4.850 999 HB2 ASP 125 2HB ASP 125 19.284 -3.988 5.560 1000 HB3 ASP 125 3HB ASP 125 19.202 -4.601 3.920 1001 H GLY 126 H GLY 126 19.479 -2.388 1.888 1002 HA2 GLY 126 2HA GLY 126 20.134 -2.440 -0.307 1003 HA3 GLY 126 3HA GLY 126 21.795 -2.685 0.208 1004 H HIS 127 H HIS 127 18.906 -4.631 0.897 1005 HA HIS 127 HA HIS 127 19.379 -6.593 -1.152 1006 HB2 HIS 127 2HB HIS 127 21.148 -7.306 0.446 1007 HB3 HIS 127 3HB HIS 127 19.974 -7.364 1.758 1008 HD1 HIS 127 HD1 HIS 127 20.739 -9.091 -1.538 1009 HD2 HIS 127 HD2 HIS 127 18.692 -9.804 2.007 1010 HE1 HIS 127 HE1 HIS 127 20.023 -11.492 -1.641 1011 HE2 HIS 127 HE2 HIS 127 18.766 -11.890 0.500 1012 H ASP 128 H ASP 128 17.262 -7.058 -1.716 1013 HA ASP 128 HA ASP 128 15.102 -6.772 0.203 1014 HB2 ASP 128 2HB ASP 128 13.585 -7.338 -1.622 1015 HB3 ASP 128 3HB ASP 128 14.747 -6.136 -2.169 1016 H HIS 129 H HIS 129 13.612 -8.449 0.755 1017 HA HIS 129 HA HIS 129 14.724 -11.204 0.762 1018 HB2 HIS 129 2HB HIS 129 13.311 -9.660 2.971 1019 HB3 HIS 129 3HB HIS 129 13.318 -11.418 2.967 1020 HD1 HIS 129 HD1 HIS 129 15.296 -12.541 3.984 1021 HD2 HIS 129 HD2 HIS 129 16.007 -8.526 3.183 1022 HE1 HIS 129 HE1 HIS 129 17.513 -12.020 5.044 1023 HE2 HIS 129 HE2 HIS 129 17.810 -9.540 4.714 1024 H ASP 130 H ASP 130 11.688 -9.381 1.229 1025 HA ASP 130 HA ASP 130 10.133 -11.720 0.358 1026 HB2 ASP 130 2HB ASP 130 9.255 -9.158 1.755 1027 HB3 ASP 130 3HB ASP 130 8.214 -10.538 1.411 1028 H PHE 131 H PHE 131 11.186 -10.988 -1.809 1029 HA PHE 131 HA PHE 131 10.979 -10.127 -3.917 1030 HB2 PHE 131 2HB PHE 131 8.772 -10.904 -4.971 1031 HB3 PHE 131 3HB PHE 131 9.723 -12.123 -4.150 1032 HD1 PHE 131 HD1 PHE 131 8.927 -13.174 -2.074 1033 HD2 PHE 131 HD2 PHE 131 6.568 -10.195 -4.046 1034 HE1 PHE 131 HE1 PHE 131 6.985 -13.798 -0.716 1035 HE2 PHE 131 HE2 PHE 131 4.637 -10.835 -2.672 1036 HZ PHE 131 HZ PHE 131 4.844 -12.631 -1.007 1037 H GLY 132 H GLY 132 11.055 -7.923 -2.621 1038 HA2 GLY 132 2HA GLY 132 8.662 -6.286 -2.876 1039 HA3 GLY 132 3HA GLY 132 10.202 -5.810 -2.168 1040 H ARG 133 H ARG 133 12.045 -5.909 -3.834 1041 HA ARG 133 HA ARG 133 11.754 -5.067 -6.487 1042 HB2 ARG 133 2HB ARG 133 10.496 -3.167 -5.483 1043 HB3 ARG 133 3HB ARG 133 11.860 -2.786 -4.443 1044 HG2 ARG 133 2HG ARG 133 13.136 -1.912 -6.247 1045 HG3 ARG 133 3HG ARG 133 12.109 -2.681 -7.458 1046 HD2 ARG 133 2HD ARG 133 11.230 -0.431 -5.613 1047 HD3 ARG 133 3HD ARG 133 11.719 -0.223 -7.301 1048 HE ARG 133 HE ARG 133 9.786 -2.071 -7.515 1049 HH11 ARG 133 1HH1 ARG 133 9.750 1.030 -5.831 1050 HH12 ARG 133 2HH1 ARG 133 8.045 1.249 -6.055 1051 HH21 ARG 133 1HH2 ARG 133 7.582 -1.765 -7.791 1052 HH22 ARG 133 2HH2 ARG 133 6.822 -0.347 -7.169 1053 H ASP 134 H ASP 134 13.888 -4.304 -7.351 1054 HA ASP 134 HA ASP 134 16.162 -5.506 -6.239 1055 HB2 ASP 134 2HB ASP 134 16.083 -3.099 -8.119 1056 HB3 ASP 134 3HB ASP 134 17.495 -4.117 -7.828 1057 HA PRO 135 HA PRO 135 17.445 -2.816 -2.833 1058 HB2 PRO 135 2HB PRO 135 20.245 -3.112 -3.159 1059 HB3 PRO 135 3HB PRO 135 19.180 -4.183 -2.231 1060 HG2 PRO 135 2HG PRO 135 20.186 -4.504 -5.035 1061 HG3 PRO 135 3HG PRO 135 19.993 -5.728 -3.756 1062 HD2 PRO 135 2HD PRO 135 18.209 -5.571 -5.732 1063 HD3 PRO 135 3HD PRO 135 17.663 -5.883 -4.066 1064 H LYS 136 H LYS 136 18.729 -2.338 -6.047 1065 HA LYS 136 HA LYS 136 19.881 0.248 -5.592 1066 HB2 LYS 136 2HB LYS 136 20.305 0.271 -7.973 1067 HB3 LYS 136 3HB LYS 136 20.615 -1.358 -7.383 1068 HG2 LYS 136 2HG LYS 136 18.267 -1.965 -8.178 1069 HG3 LYS 136 3HG LYS 136 18.219 -0.390 -8.967 1070 HD2 LYS 136 2HD LYS 136 18.861 -1.900 -10.676 1071 HD3 LYS 136 3HD LYS 136 20.373 -1.118 -10.201 1072 HE2 LYS 136 2HE LYS 136 20.896 -3.096 -8.766 1073 HE3 LYS 136 3HE LYS 136 19.393 -3.850 -9.313 1074 HZ1 LYS 136 3HZ LYS 136 21.337 -4.650 -10.521 1075 HZ2 LYS 136 1HZ LYS 136 21.657 -3.092 -11.079 1076 HZ3 LYS 136 2HZ LYS 136 20.242 -3.883 -11.555 1077 H TYR 137 H TYR 137 16.668 -0.879 -6.269 1078 HA TYR 137 HA TYR 137 15.686 1.877 -6.783 1079 HB2 TYR 137 2HB TYR 137 14.287 -0.756 -7.439 1080 HB3 TYR 137 3HB TYR 137 13.708 0.853 -7.835 1081 HD1 TYR 137 HD2 TYR 137 15.713 2.287 -9.175 1082 HD2 TYR 137 HD1 TYR 137 15.065 -1.942 -9.296 1083 HE1 TYR 137 HE2 TYR 137 16.852 2.167 -11.350 1084 HE2 TYR 137 HE1 TYR 137 16.211 -2.061 -11.465 1085 HH TYR 137 HH TYR 137 16.736 -0.601 -13.347 1086 H LEU 138 H LEU 138 15.887 -0.481 -4.366 1087 HA LEU 138 HA LEU 138 13.366 -0.319 -3.088 1088 HB2 LEU 138 2HB LEU 138 16.147 -1.040 -2.146 1089 HB3 LEU 138 3HB LEU 138 14.881 -0.833 -0.952 1090 HG LEU 138 HG LEU 138 14.879 -2.893 -3.192 1091 HD11 LEU 138 1HD1 LEU 138 15.152 -4.543 -1.411 1092 HD12 LEU 138 2HD1 LEU 138 15.218 -3.264 -0.197 1093 HD13 LEU 138 3HD1 LEU 138 16.496 -3.404 -1.409 1094 HD21 LEU 138 3HD2 LEU 138 12.591 -2.158 -2.707 1095 HD22 LEU 138 1HD2 LEU 138 12.838 -2.454 -0.981 1096 HD23 LEU 138 2HD2 LEU 138 12.854 -3.800 -2.125 1097 H HIS 139 H HIS 139 12.460 1.224 -1.838 1098 HA HIS 139 HA HIS 139 14.051 3.377 -0.635 1099 HB2 HIS 139 2HB HIS 139 13.481 4.227 -2.886 1100 HB3 HIS 139 3HB HIS 139 11.780 3.865 -2.616 1101 HD1 HIS 139 HD1 HIS 139 10.419 5.781 -1.779 1102 HD2 HIS 139 HD2 HIS 139 14.465 6.263 -0.942 1103 HE1 HIS 139 HE1 HIS 139 10.631 8.058 -0.758 1104 HE2 HIS 139 HE2 HIS 139 13.101 8.388 -0.432 1105 H GLN 140 H GLN 140 13.239 3.917 1.356 1106 HA GLN 140 HA GLN 140 10.963 2.535 2.418 1107 HB2 GLN 140 2HB GLN 140 12.499 4.855 3.680 1108 HB3 GLN 140 3HB GLN 140 11.316 3.849 4.495 1109 HG2 GLN 140 2HG GLN 140 13.125 2.724 5.233 1110 HG3 GLN 140 3HG GLN 140 13.043 1.922 3.673 1111 HE21 GLN 140 1HE2 GLN 140 15.319 2.246 5.374 1112 HE22 GLN 140 2HE2 GLN 140 16.502 3.144 4.491 1113 H PHE 141 H PHE 141 9.101 3.470 3.335 1114 HA PHE 141 HA PHE 141 7.785 5.548 1.906 1115 HB2 PHE 141 2HB PHE 141 7.065 4.299 4.602 1116 HB3 PHE 141 3HB PHE 141 5.982 5.217 3.565 1117 HD1 PHE 141 HD1 PHE 141 5.670 4.263 1.118 1118 HD2 PHE 141 HD2 PHE 141 7.023 1.952 4.462 1119 HE1 PHE 141 HE1 PHE 141 4.961 2.202 0.001 1120 HE2 PHE 141 HE2 PHE 141 6.312 -0.100 3.330 1121 HZ PHE 141 HZ PHE 141 5.279 0.018 1.092 1122 H GLU 142 H GLU 142 8.603 7.619 2.098 1123 HA GLU 142 HA GLU 142 9.498 8.612 4.731 1124 HB2 GLU 142 2HB GLU 142 9.780 9.884 1.971 1125 HB3 GLU 142 3HB GLU 142 10.434 10.540 3.472 1126 HG2 GLU 142 2HG GLU 142 11.782 8.386 3.691 1127 HG3 GLU 142 3HG GLU 142 11.271 7.987 2.050 1128 H GLY 143 H GLY 143 7.677 9.047 5.835 1129 HA2 GLY 143 2HA GLY 143 6.249 11.328 5.816 1130 HA3 GLY 143 3HA GLY 143 5.341 10.329 4.676 1131 H GLU 144 H GLU 144 5.477 11.222 7.846 1132 HA GLU 144 HA GLU 144 5.136 8.832 9.314 1133 HB2 GLU 144 2HB GLU 144 4.202 11.656 9.953 1134 HB3 GLU 144 3HB GLU 144 4.136 10.317 11.097 1135 HG2 GLU 144 2HG GLU 144 6.634 10.105 10.898 1136 HG3 GLU 144 3HG GLU 144 6.633 11.555 9.892 1137 H THR 145 H THR 145 2.809 10.898 7.643 1138 HA THR 145 HA THR 145 0.501 9.351 8.441 1139 HB THR 145 HB THR 145 0.762 11.491 6.279 1140 HG1 THR 145 HG1 THR 145 -0.280 11.631 8.934 1141 HG21 THR 145 3HG2 THR 145 -1.197 10.013 5.874 1142 HG22 THR 145 1HG2 THR 145 -1.705 11.627 6.383 1143 HG23 THR 145 2HG2 THR 145 -1.743 10.289 7.530 1144 H PHE 146 H PHE 146 0.499 7.305 7.721 1145 HA PHE 146 HA PHE 146 1.088 6.559 4.967 1146 HB2 PHE 146 2HB PHE 146 0.240 5.030 7.457 1147 HB3 PHE 146 3HB PHE 146 0.167 4.265 5.875 1148 HD1 PHE 146 HD2 PHE 146 2.475 5.704 8.424 1149 HD2 PHE 146 HD1 PHE 146 2.142 3.500 4.767 1150 HE1 PHE 146 HE2 PHE 146 4.841 5.042 8.592 1151 HE2 PHE 146 HE1 PHE 146 4.493 2.845 4.949 1152 HZ PHE 146 HZ PHE 146 5.850 3.607 6.850 1153 H TYR 147 H TYR 147 -0.483 5.638 3.611 1154 HA TYR 147 HA TYR 147 -3.338 6.031 4.230 1155 HB2 TYR 147 2HB TYR 147 -1.855 6.625 1.622 1156 HB3 TYR 147 3HB TYR 147 -3.603 6.444 1.698 1157 HD1 TYR 147 HD1 TYR 147 -0.764 8.563 2.953 1158 HD2 TYR 147 HD2 TYR 147 -4.990 8.276 2.353 1159 HE1 TYR 147 HE1 TYR 147 -1.008 10.948 3.497 1160 HE2 TYR 147 HE2 TYR 147 -5.224 10.659 2.904 1161 HH TYR 147 HH TYR 147 -2.596 12.782 3.079 1162 H ILE 148 H ILE 148 -4.559 4.250 3.842 1163 HA ILE 148 HA ILE 148 -3.363 1.939 2.417 1164 HB ILE 148 HB ILE 148 -5.106 1.854 4.931 1165 HG12 ILE 148 2HG1 ILE 148 -2.186 1.067 4.484 1166 HG13 ILE 148 3HG1 ILE 148 -2.767 2.405 5.466 1167 HG21 ILE 148 1HG2 ILE 148 -4.898 -0.602 4.812 1168 HG22 ILE 148 2HG2 ILE 148 -4.015 -0.462 3.291 1169 HG23 ILE 148 3HG2 ILE 148 -5.707 0.032 3.379 1170 HD11 ILE 148 3HD1 ILE 148 -2.050 0.580 6.861 1171 HD12 ILE 148 1HD1 ILE 148 -3.148 -0.535 6.050 1172 HD13 ILE 148 2HD1 ILE 148 -3.790 0.794 7.021 1173 H ILE 149 H ILE 149 -4.454 1.752 0.571 1174 HA ILE 149 HA ILE 149 -7.336 2.386 0.441 1175 HB ILE 149 HB ILE 149 -5.499 1.791 -1.929 1176 HG12 ILE 149 2HG1 ILE 149 -4.561 3.770 -0.809 1177 HG13 ILE 149 3HG1 ILE 149 -5.349 4.266 -2.300 1178 HG21 ILE 149 1HG2 ILE 149 -7.882 1.535 -2.420 1179 HG22 ILE 149 2HG2 ILE 149 -7.267 2.976 -3.233 1180 HG23 ILE 149 3HG2 ILE 149 -8.226 3.139 -1.761 1181 HD11 ILE 149 3HD1 ILE 149 -5.759 5.836 -0.513 1182 HD12 ILE 149 1HD1 ILE 149 -6.467 4.569 0.487 1183 HD13 ILE 149 2HD1 ILE 149 -7.269 5.072 -1.006 1184 H GLU 150 H GLU 150 -8.693 0.708 0.614 1185 HA GLU 150 HA GLU 150 -8.012 -2.030 0.472 1186 HB2 GLU 150 2HB GLU 150 -10.005 -1.209 1.716 1187 HB3 GLU 150 3HB GLU 150 -10.759 -0.710 0.204 1188 HG2 GLU 150 2HG GLU 150 -10.958 -3.010 -0.536 1189 HG3 GLU 150 3HG GLU 150 -10.003 -3.583 0.826 1190 H GLN 151 H GLN 151 -8.130 -3.471 -1.209 1191 HA GLN 151 HA GLN 151 -8.733 -2.529 -3.951 1192 HB2 GLN 151 2HB GLN 151 -6.178 -3.942 -3.033 1193 HB3 GLN 151 3HB GLN 151 -6.607 -3.670 -4.720 1194 HG2 GLN 151 2HG GLN 151 -6.237 -1.414 -2.724 1195 HG3 GLN 151 3HG GLN 151 -4.928 -2.050 -3.705 1196 HE21 GLN 151 1HE2 GLN 151 -7.914 -0.237 -3.757 1197 HE22 GLN 151 2HE2 GLN 151 -7.736 0.398 -5.347 1198 H ARG 152 H ARG 152 -10.435 -3.839 -4.366 1199 HA ARG 152 HA ARG 152 -10.580 -6.601 -3.411 1200 HB2 ARG 152 2HB ARG 152 -12.597 -4.793 -4.817 1201 HB3 ARG 152 3HB ARG 152 -12.937 -6.458 -4.348 1202 HG2 ARG 152 2HG ARG 152 -12.071 -4.376 -2.319 1203 HG3 ARG 152 3HG ARG 152 -13.761 -4.581 -2.788 1204 HD2 ARG 152 2HD ARG 152 -13.729 -6.893 -2.004 1205 HD3 ARG 152 3HD ARG 152 -12.007 -6.764 -1.611 1206 HE ARG 152 HE ARG 152 -13.363 -4.710 -0.276 1207 HH11 ARG 152 1HH1 ARG 152 -13.251 -8.230 -0.152 1208 HH12 ARG 152 2HH1 ARG 152 -13.646 -8.290 1.530 1209 HH21 ARG 152 1HH2 ARG 152 -13.795 -4.795 1.910 1210 HH22 ARG 152 2HH2 ARG 152 -13.959 -6.327 2.713 1211 H LEU 153 H LEU 153 -10.650 -8.380 -4.763 1212 HA LEU 153 HA LEU 153 -9.457 -8.196 -7.352 1213 HB2 LEU 153 2HB LEU 153 -10.730 -10.502 -5.849 1214 HB3 LEU 153 3HB LEU 153 -10.092 -10.691 -7.477 1215 HG LEU 153 HG LEU 153 -8.481 -9.922 -5.012 1216 HD11 LEU 153 1HD1 LEU 153 -8.513 -12.484 -6.636 1217 HD12 LEU 153 2HD1 LEU 153 -9.143 -12.268 -4.999 1218 HD13 LEU 153 3HD1 LEU 153 -7.416 -12.113 -5.302 1219 HD21 LEU 153 3HD2 LEU 153 -6.502 -10.127 -6.501 1220 HD22 LEU 153 1HD2 LEU 153 -7.556 -8.793 -6.961 1221 HD23 LEU 153 2HD2 LEU 153 -7.576 -10.295 -7.891 1222 H GLU 154 H GLU 154 -10.676 -7.052 -8.778 1223 HA GLU 154 HA GLU 154 -11.956 -6.885 -10.624 1224 HB2 GLU 154 2HB GLU 154 -12.375 -9.882 -10.292 1225 HB3 GLU 154 3HB GLU 154 -12.438 -8.970 -11.797 1226 HG2 GLU 154 2HG GLU 154 -9.999 -9.542 -10.095 1227 HG3 GLU 154 3HG GLU 154 -10.347 -10.188 -11.694 1228 H HIS 155 H HIS 155 -14.235 -8.332 -11.504 1229 HA HIS 155 HA HIS 155 -16.345 -7.447 -9.622 1230 HB2 HIS 155 2HB HIS 155 -16.361 -7.722 -12.663 1231 HB3 HIS 155 3HB HIS 155 -17.800 -7.391 -11.703 1232 HD1 HIS 155 HD1 HIS 155 -18.375 -5.008 -11.640 1233 HD2 HIS 155 HD2 HIS 155 -14.273 -5.569 -12.044 1234 HE1 HIS 155 HE1 HIS 155 -17.392 -2.705 -11.767 1235 HE2 HIS 155 HE2 HIS 155 -14.921 -3.068 -12.095 1236 H HIS 156 H HIS 156 -16.625 -9.294 -8.425 1237 HA HIS 156 HA HIS 156 -17.149 -11.881 -9.688 1238 HB2 HIS 156 2HB HIS 156 -16.991 -10.957 -6.789 1239 HB3 HIS 156 3HB HIS 156 -17.545 -12.571 -7.223 1240 HD1 HIS 156 HD1 HIS 156 -14.426 -10.400 -7.373 1241 HD2 HIS 156 HD2 HIS 156 -15.551 -14.372 -7.842 1242 HE1 HIS 156 HE1 HIS 156 -12.286 -11.704 -7.546 1243 HE2 HIS 156 HE2 HIS 156 -12.999 -14.103 -7.689 1244 H HIS 157 H HIS 157 -18.926 -11.020 -10.946 1245 HA HIS 157 HA HIS 157 -21.180 -9.707 -9.776 1246 HB2 HIS 157 2HB HIS 157 -20.345 -9.297 -12.108 1247 HB3 HIS 157 3HB HIS 157 -20.904 -10.902 -12.568 1248 HD1 HIS 157 HD1 HIS 157 -22.237 -7.545 -11.434 1249 HD2 HIS 157 HD2 HIS 157 -23.592 -11.013 -13.280 1250 HE1 HIS 157 HE1 HIS 157 -24.570 -7.034 -12.195 1251 HE2 HIS 157 HE2 HIS 157 -25.282 -9.077 -13.478 1252 H HIS 158 H HIS 158 -20.415 -13.054 -10.195 1253 HA HIS 158 HA HIS 158 -22.986 -14.227 -10.262 1254 HB2 HIS 158 2HB HIS 158 -20.543 -15.331 -8.816 1255 HB3 HIS 158 3HB HIS 158 -21.965 -16.250 -9.275 1256 HD1 HIS 158 HD1 HIS 158 -18.740 -16.272 -10.212 1257 HD2 HIS 158 HD2 HIS 158 -22.155 -15.538 -12.447 1258 HE1 HIS 158 HE1 HIS 158 -18.133 -16.851 -12.570 1259 HE2 HIS 158 HE2 HIS 158 -20.263 -16.561 -13.869 1260 H HIS 159 H HIS 159 -21.288 -12.579 -7.720 1261 HA HIS 159 HA HIS 159 -23.561 -12.971 -5.846 1262 HB2 HIS 159 2HB HIS 159 -20.640 -12.463 -5.078 1263 HB3 HIS 159 3HB HIS 159 -21.985 -12.712 -3.967 1264 HD1 HIS 159 HD1 HIS 159 -19.190 -14.458 -4.828 1265 HD2 HIS 159 HD2 HIS 159 -23.209 -15.515 -5.007 1266 HE1 HIS 159 HE1 HIS 159 -19.233 -16.969 -4.873 1267 HE2 HIS 159 HE2 HIS 159 -21.651 -17.562 -5.198 1268 H HIS 160 H HIS 160 -24.065 -11.061 -4.570 1269 HA HIS 160 HA HIS 160 -22.713 -8.561 -5.063 1270 HB2 HIS 160 2HB HIS 160 -24.824 -7.348 -5.782 1271 HB3 HIS 160 3HB HIS 160 -24.152 -8.439 -6.982 1272 HD1 HIS 160 HD1 HIS 160 -27.185 -7.777 -4.998 1273 HD2 HIS 160 HD2 HIS 160 -25.738 -10.813 -7.431 1274 HE1 HIS 160 HE1 HIS 160 -29.179 -9.175 -5.578 1275 HE2 HIS 160 HE2 HIS 160 -28.243 -11.103 -6.895 Start of MODEL 16 1 H1 MET 1 1H MET 1 -30.926 -6.309 -8.630 2 H2 MET 1 2H MET 1 -30.291 -6.948 -7.205 3 H3 MET 1 3H MET 1 -29.254 -6.400 -8.418 4 HA MET 1 HA MET 1 -30.018 -4.145 -8.116 5 HB2 MET 1 2HB MET 1 -31.630 -5.281 -5.783 6 HB3 MET 1 3HB MET 1 -31.510 -3.578 -6.211 7 HG2 MET 1 2HG MET 1 -32.644 -4.094 -8.372 8 HG3 MET 1 3HG MET 1 -32.833 -5.762 -7.834 9 HE1 MET 1 3HE MET 1 -34.235 -6.387 -5.545 10 HE2 MET 1 1HE MET 1 -35.180 -5.193 -4.654 11 HE3 MET 1 2HE MET 1 -33.421 -5.120 -4.626 12 H VAL 2 H VAL 2 -27.871 -3.890 -7.729 13 HA VAL 2 HA VAL 2 -26.935 -4.003 -4.919 14 HB VAL 2 HB VAL 2 -24.587 -4.440 -5.838 15 HG11 VAL 2 1HG1 VAL 2 -26.604 -6.679 -6.202 16 HG12 VAL 2 2HG1 VAL 2 -25.805 -6.214 -4.698 17 HG13 VAL 2 3HG1 VAL 2 -24.857 -6.882 -6.028 18 HG21 VAL 2 3HG2 VAL 2 -24.983 -3.836 -8.185 19 HG22 VAL 2 1HG2 VAL 2 -26.095 -5.195 -8.375 20 HG23 VAL 2 2HG2 VAL 2 -24.379 -5.489 -8.076 21 H GLU 3 H GLU 3 -24.690 -2.650 -4.965 22 HA GLU 3 HA GLU 3 -25.240 0.028 -5.441 23 HB2 GLU 3 2HB GLU 3 -22.568 -1.402 -5.170 24 HB3 GLU 3 3HB GLU 3 -22.717 0.353 -5.211 25 HG2 GLU 3 2HG GLU 3 -23.928 -1.484 -3.145 26 HG3 GLU 3 3HG GLU 3 -22.514 -0.467 -2.916 27 HA PRO 4 HA PRO 4 -24.588 1.017 -9.786 28 HB2 PRO 4 2HB PRO 4 -22.770 3.183 -8.703 29 HB3 PRO 4 3HB PRO 4 -24.086 3.301 -9.895 30 HG2 PRO 4 2HG PRO 4 -24.481 4.133 -7.416 31 HG3 PRO 4 3HG PRO 4 -25.758 3.238 -8.271 32 HD2 PRO 4 2HD PRO 4 -23.914 2.267 -6.092 33 HD3 PRO 4 3HD PRO 4 -25.614 1.856 -6.416 34 H GLY 5 H GLY 5 -22.806 1.435 -11.419 35 HA2 GLY 5 2HA GLY 5 -20.592 -0.374 -11.112 36 HA3 GLY 5 3HA GLY 5 -20.891 0.693 -12.474 37 H VAL 6 H VAL 6 -19.860 0.804 -9.074 38 HA VAL 6 HA VAL 6 -18.075 3.103 -9.598 39 HB VAL 6 HB VAL 6 -18.016 3.399 -7.132 40 HG11 VAL 6 1HG1 VAL 6 -20.338 4.190 -6.817 41 HG12 VAL 6 2HG1 VAL 6 -20.852 3.261 -8.229 42 HG13 VAL 6 3HG1 VAL 6 -19.727 4.608 -8.419 43 HG21 VAL 6 3HG2 VAL 6 -19.984 1.075 -7.019 44 HG22 VAL 6 1HG2 VAL 6 -19.540 2.108 -5.654 45 HG23 VAL 6 2HG2 VAL 6 -18.328 1.071 -6.407 46 H ALA 7 H ALA 7 -17.860 -0.049 -9.890 47 HA ALA 7 HA ALA 7 -15.494 -0.751 -8.398 48 HB1 ALA 7 3HB ALA 7 -15.571 -2.823 -9.748 49 HB2 ALA 7 1HB ALA 7 -16.854 -2.128 -10.744 50 HB3 ALA 7 2HB ALA 7 -17.141 -2.457 -9.034 51 H LYS 8 H LYS 8 -13.812 -1.979 -10.209 52 HA LYS 8 HA LYS 8 -11.947 -1.607 -11.428 53 HB2 LYS 8 2HB LYS 8 -13.827 0.198 -13.000 54 HB3 LYS 8 3HB LYS 8 -12.130 0.068 -13.432 55 HG2 LYS 8 2HG LYS 8 -13.402 -1.348 -14.883 56 HG3 LYS 8 3HG LYS 8 -12.442 -2.368 -13.811 57 HD2 LYS 8 2HD LYS 8 -14.403 -2.884 -12.469 58 HD3 LYS 8 3HD LYS 8 -15.387 -1.740 -13.391 59 HE2 LYS 8 2HE LYS 8 -15.778 -4.087 -14.087 60 HE3 LYS 8 3HE LYS 8 -15.140 -3.106 -15.407 61 HZ1 LYS 8 3HZ LYS 8 -12.967 -4.051 -15.047 62 HZ2 LYS 8 1HZ LYS 8 -14.087 -5.299 -15.256 63 HZ3 LYS 8 2HZ LYS 8 -13.510 -4.929 -13.713 64 H LEU 9 H LEU 9 -10.899 -0.750 -9.546 65 HA LEU 9 HA LEU 9 -10.793 2.075 -9.084 66 HB2 LEU 9 2HB LEU 9 -10.321 0.412 -7.274 67 HB3 LEU 9 3HB LEU 9 -8.846 -0.050 -8.104 68 HG LEU 9 HG LEU 9 -7.922 2.240 -7.754 69 HD11 LEU 9 1HD1 LEU 9 -10.477 2.816 -6.230 70 HD12 LEU 9 2HD1 LEU 9 -9.961 3.554 -7.749 71 HD13 LEU 9 3HD1 LEU 9 -9.047 3.853 -6.274 72 HD21 LEU 9 3HD2 LEU 9 -7.408 0.526 -6.094 73 HD22 LEU 9 1HD2 LEU 9 -8.869 0.927 -5.187 74 HD23 LEU 9 2HD2 LEU 9 -7.558 2.102 -5.320 75 H THR 10 H THR 10 -9.164 3.482 -9.557 76 HA THR 10 HA THR 10 -8.117 3.591 -12.093 77 HB THR 10 HB THR 10 -6.718 5.496 -11.112 78 HG1 THR 10 HG1 THR 10 -6.713 4.285 -8.962 79 HG21 THR 10 3HG2 THR 10 -9.668 5.431 -10.339 80 HG22 THR 10 1HG2 THR 10 -9.021 5.922 -11.909 81 HG23 THR 10 2HG2 THR 10 -8.674 6.885 -10.472 82 H THR 11 H THR 11 -6.772 2.076 -12.900 83 HA THR 11 HA THR 11 -4.883 0.576 -11.393 84 HB THR 11 HB THR 11 -4.197 -0.350 -13.647 85 HG1 THR 11 HG1 THR 11 -6.329 1.066 -14.829 86 HG21 THR 11 3HG2 THR 11 -7.206 -0.262 -13.178 87 HG22 THR 11 1HG2 THR 11 -6.078 -1.385 -12.406 88 HG23 THR 11 2HG2 THR 11 -6.342 -1.456 -14.149 89 H TYR 12 H TYR 12 -4.571 3.395 -13.535 90 HA TYR 12 HA TYR 12 -1.768 3.512 -13.733 91 HB2 TYR 12 2HB TYR 12 -2.065 5.928 -14.264 92 HB3 TYR 12 3HB TYR 12 -3.182 4.908 -15.155 93 HD1 TYR 12 HD2 TYR 12 -2.914 7.336 -12.347 94 HD2 TYR 12 HD1 TYR 12 -5.587 5.159 -14.874 95 HE1 TYR 12 HE2 TYR 12 -4.786 8.677 -11.527 96 HE2 TYR 12 HE1 TYR 12 -7.454 6.522 -14.046 97 HH TYR 12 HH TYR 12 -6.993 9.350 -12.171 98 H ALA 13 H ALA 13 -3.924 4.483 -11.154 99 HA ALA 13 HA ALA 13 -2.173 6.164 -9.684 100 HB1 ALA 13 3HB ALA 13 -4.613 4.600 -8.779 101 HB2 ALA 13 1HB ALA 13 -4.599 6.251 -9.398 102 HB3 ALA 13 2HB ALA 13 -3.824 5.880 -7.858 103 H SER 14 H SER 14 -2.934 2.697 -9.560 104 HA SER 14 HA SER 14 -1.309 2.118 -7.290 105 HB2 SER 14 2HB SER 14 -1.673 -0.277 -7.933 106 HB3 SER 14 3HB SER 14 -3.165 0.649 -7.807 107 HG SER 14 HG SER 14 -1.820 0.137 -10.253 108 H LYS 15 H LYS 15 -0.790 2.052 -10.781 109 HA LYS 15 HA LYS 15 1.694 0.733 -10.887 110 HB2 LYS 15 2HB LYS 15 0.576 2.913 -12.706 111 HB3 LYS 15 3HB LYS 15 2.006 1.959 -13.086 112 HG2 LYS 15 2HG LYS 15 -0.771 0.827 -12.674 113 HG3 LYS 15 3HG LYS 15 -0.053 1.189 -14.244 114 HD2 LYS 15 2HD LYS 15 1.682 -0.494 -13.889 115 HD3 LYS 15 3HD LYS 15 1.110 -0.788 -12.242 116 HE2 LYS 15 2HE LYS 15 -1.008 -1.656 -13.108 117 HE3 LYS 15 3HE LYS 15 -0.501 -1.307 -14.765 118 HZ1 LYS 15 3HZ LYS 15 -0.206 -3.660 -14.041 119 HZ2 LYS 15 1HZ LYS 15 0.986 -3.139 -12.967 120 HZ3 LYS 15 2HZ LYS 15 1.197 -2.931 -14.630 121 H GLN 16 H GLN 16 0.967 4.216 -10.760 122 HA GLN 16 HA GLN 16 3.670 5.096 -10.774 123 HB2 GLN 16 2HB GLN 16 1.108 6.542 -9.989 124 HB3 GLN 16 3HB GLN 16 2.671 7.332 -10.179 125 HG2 GLN 16 2HG GLN 16 1.160 5.881 -12.377 126 HG3 GLN 16 3HG GLN 16 1.226 7.629 -12.163 127 HE21 GLN 16 1HE2 GLN 16 2.071 6.045 -14.476 128 HE22 GLN 16 2HE2 GLN 16 3.751 6.382 -14.709 129 H ALA 17 H ALA 17 1.323 4.484 -8.182 130 HA ALA 17 HA ALA 17 2.700 5.590 -6.004 131 HB1 ALA 17 3HB ALA 17 0.351 4.844 -5.873 132 HB2 ALA 17 1HB ALA 17 1.322 4.134 -4.581 133 HB3 ALA 17 2HB ALA 17 0.872 3.162 -5.987 134 H THR 18 H THR 18 2.715 2.232 -7.216 135 HA THR 18 HA THR 18 4.577 1.232 -5.303 136 HB THR 18 HB THR 18 4.676 -0.769 -6.870 137 HG1 THR 18 HG1 THR 18 2.520 0.163 -8.330 138 HG21 THR 18 3HG2 THR 18 2.347 -1.477 -6.504 139 HG22 THR 18 1HG2 THR 18 1.888 0.188 -6.132 140 HG23 THR 18 2HG2 THR 18 2.993 -0.683 -5.065 141 H ASP 19 H ASP 19 4.879 2.417 -8.594 142 HA ASP 19 HA ASP 19 7.506 1.822 -9.273 143 HB2 ASP 19 2HB ASP 19 5.944 2.762 -10.882 144 HB3 ASP 19 3HB ASP 19 5.754 4.226 -9.936 145 H MET 20 H MET 20 6.251 4.696 -7.603 146 HA MET 20 HA MET 20 8.866 5.844 -7.155 147 HB2 MET 20 2HB MET 20 6.129 6.685 -6.121 148 HB3 MET 20 3HB MET 20 7.604 7.632 -5.964 149 HG2 MET 20 2HG MET 20 7.740 7.848 -8.411 150 HG3 MET 20 3HG MET 20 6.278 6.875 -8.583 151 HE1 MET 20 3HE MET 20 3.599 9.210 -6.863 152 HE2 MET 20 1HE MET 20 4.546 7.948 -6.084 153 HE3 MET 20 2HE MET 20 3.856 7.675 -7.686 154 H GLY 21 H GLY 21 6.622 3.842 -5.344 155 HA2 GLY 21 2HA GLY 21 8.155 2.528 -3.673 156 HA3 GLY 21 3HA GLY 21 8.203 4.086 -2.859 157 H ALA 22 H ALA 22 6.135 1.389 -3.812 158 HA ALA 22 HA ALA 22 4.669 1.603 -1.343 159 HB1 ALA 22 3HB ALA 22 3.316 3.100 -2.782 160 HB2 ALA 22 1HB ALA 22 2.412 1.662 -2.298 161 HB3 ALA 22 2HB ALA 22 3.084 1.779 -3.928 162 H ILE 23 H ILE 23 3.558 -0.302 -0.782 163 HA ILE 23 HA ILE 23 4.213 -2.712 -2.392 164 HB ILE 23 HB ILE 23 4.551 -3.953 -0.209 165 HG12 ILE 23 2HG1 ILE 23 5.322 -2.270 1.750 166 HG13 ILE 23 3HG1 ILE 23 4.190 -1.174 0.972 167 HG21 ILE 23 1HG2 ILE 23 6.866 -3.162 0.154 168 HG22 ILE 23 2HG2 ILE 23 6.509 -1.700 -0.767 169 HG23 ILE 23 3HG2 ILE 23 6.465 -3.275 -1.562 170 HD11 ILE 23 3HD1 ILE 23 3.204 -2.333 2.864 171 HD12 ILE 23 1HD1 ILE 23 3.526 -3.890 2.102 172 HD13 ILE 23 2HD1 ILE 23 2.382 -2.764 1.366 173 H TYR 24 H TYR 24 2.875 -4.668 -1.647 174 HA TYR 24 HA TYR 24 0.114 -3.871 -0.904 175 HB2 TYR 24 2HB TYR 24 1.057 -6.078 -2.770 176 HB3 TYR 24 3HB TYR 24 -0.578 -6.023 -2.121 177 HD1 TYR 24 HD1 TYR 24 -2.045 -4.021 -2.670 178 HD2 TYR 24 HD2 TYR 24 1.632 -4.783 -4.710 179 HE1 TYR 24 HE1 TYR 24 -2.771 -2.585 -4.523 180 HE2 TYR 24 HE2 TYR 24 0.899 -3.342 -6.561 181 HH TYR 24 HH TYR 24 -1.840 -1.311 -6.338 182 H VAL 25 H VAL 25 -0.480 -4.550 1.024 183 HA VAL 25 HA VAL 25 0.263 -7.276 1.910 184 HB VAL 25 HB VAL 25 -0.175 -6.583 4.242 185 HG11 VAL 25 1HG1 VAL 25 1.944 -4.883 2.904 186 HG12 VAL 25 2HG1 VAL 25 2.124 -6.548 3.461 187 HG13 VAL 25 3HG1 VAL 25 1.860 -5.252 4.629 188 HG21 VAL 25 3HG2 VAL 25 -0.408 -4.208 4.882 189 HG22 VAL 25 1HG2 VAL 25 -1.754 -4.747 3.872 190 HG23 VAL 25 2HG2 VAL 25 -0.472 -3.753 3.175 191 H ASN 26 H ASN 26 -1.408 -8.614 2.464 192 HA ASN 26 HA ASN 26 -4.121 -7.983 1.704 193 HB2 ASN 26 2HB ASN 26 -4.621 -10.288 2.523 194 HB3 ASN 26 3HB ASN 26 -3.269 -10.248 1.390 195 HD21 ASN 26 1HD2 ASN 26 -4.143 -11.927 3.849 196 HD22 ASN 26 2HD2 ASN 26 -2.633 -12.175 4.655 197 H SER 27 H SER 27 -5.815 -9.034 3.536 198 HA SER 27 HA SER 27 -5.949 -6.987 5.532 199 HB2 SER 27 2HB SER 27 -7.979 -7.938 4.451 200 HB3 SER 27 3HB SER 27 -7.714 -9.449 5.313 201 HG SER 27 HG SER 27 -7.778 -7.128 6.847 202 H LYS 28 H LYS 28 -4.472 -10.125 5.560 203 HA LYS 28 HA LYS 28 -4.147 -10.142 8.439 204 HB2 LYS 28 2HB LYS 28 -2.327 -11.452 6.369 205 HB3 LYS 28 3HB LYS 28 -2.414 -11.829 8.086 206 HG2 LYS 28 2HG LYS 28 -4.610 -12.315 6.054 207 HG3 LYS 28 3HG LYS 28 -3.512 -13.535 6.700 208 HD2 LYS 28 2HD LYS 28 -4.454 -13.224 8.950 209 HD3 LYS 28 3HD LYS 28 -5.526 -11.954 8.345 210 HE2 LYS 28 2HE LYS 28 -6.713 -13.536 6.948 211 HE3 LYS 28 3HE LYS 28 -5.553 -14.816 7.323 212 HZ1 LYS 28 3HZ LYS 28 -7.613 -15.024 8.585 213 HZ2 LYS 28 1HZ LYS 28 -7.359 -13.517 9.289 214 HZ3 LYS 28 2HZ LYS 28 -6.289 -14.784 9.610 215 H GLY 29 H GLY 29 -1.900 -9.447 5.733 216 HA2 GLY 29 2HA GLY 29 -0.736 -7.246 5.767 217 HA3 GLY 29 3HA GLY 29 -0.411 -7.538 7.472 218 H ASP 30 H ASP 30 0.012 -9.092 4.301 219 HA ASP 30 HA ASP 30 2.689 -10.089 5.086 220 HB2 ASP 30 2HB ASP 30 1.087 -11.956 5.363 221 HB3 ASP 30 3HB ASP 30 0.446 -11.687 3.747 222 H ARG 31 H ARG 31 4.125 -10.366 3.275 223 HA ARG 31 HA ARG 31 3.705 -8.565 1.092 224 HB2 ARG 31 2HB ARG 31 5.939 -9.204 0.335 225 HB3 ARG 31 3HB ARG 31 5.949 -8.866 2.052 226 HG2 ARG 31 2HG ARG 31 5.623 -11.745 1.429 227 HG3 ARG 31 3HG ARG 31 7.121 -11.062 0.815 228 HD2 ARG 31 2HD ARG 31 7.719 -11.870 2.916 229 HD3 ARG 31 3HD ARG 31 7.455 -10.153 3.217 230 HE ARG 31 HE ARG 31 5.136 -11.793 3.730 231 HH11 ARG 31 1HH1 ARG 31 8.171 -10.671 5.122 232 HH12 ARG 31 2HH1 ARG 31 7.639 -10.878 6.759 233 HH21 ARG 31 1HH2 ARG 31 4.445 -12.029 5.889 234 HH22 ARG 31 2HH2 ARG 31 5.533 -11.644 7.192 235 H ILE 32 H ILE 32 1.699 -9.551 0.320 236 HA ILE 32 HA ILE 32 1.636 -12.190 -0.818 237 HB ILE 32 HB ILE 32 -0.600 -11.477 -1.746 238 HG12 ILE 32 2HG1 ILE 32 -0.033 -8.830 -0.315 239 HG13 ILE 32 3HG1 ILE 32 -0.071 -9.045 -2.061 240 HG21 ILE 32 1HG2 ILE 32 -1.731 -11.308 0.448 241 HG22 ILE 32 2HG2 ILE 32 -0.183 -10.953 1.220 242 HG23 ILE 32 3HG2 ILE 32 -0.452 -12.525 0.462 243 HD11 ILE 32 3HD1 ILE 32 -2.406 -9.399 -0.187 244 HD12 ILE 32 1HD1 ILE 32 -2.441 -9.633 -1.938 245 HD13 ILE 32 2HD1 ILE 32 -2.108 -8.038 -1.266 246 H VAL 33 H VAL 33 2.104 -8.952 -2.098 247 HA VAL 33 HA VAL 33 3.589 -9.960 -4.340 248 HB VAL 33 HB VAL 33 1.388 -10.015 -5.387 249 HG11 VAL 33 1HG1 VAL 33 0.170 -8.494 -3.921 250 HG12 VAL 33 2HG1 VAL 33 -0.075 -8.062 -5.614 251 HG13 VAL 33 3HG1 VAL 33 1.023 -7.110 -4.610 252 HG21 VAL 33 3HG2 VAL 33 1.723 -8.491 -7.309 253 HG22 VAL 33 1HG2 VAL 33 3.220 -9.297 -6.840 254 HG23 VAL 33 2HG2 VAL 33 2.953 -7.610 -6.398 255 H ASN 34 H ASN 34 5.150 -8.516 -4.934 256 HA ASN 34 HA ASN 34 6.007 -6.654 -3.018 257 HB2 ASN 34 2HB ASN 34 7.843 -6.124 -4.630 258 HB3 ASN 34 3HB ASN 34 7.621 -7.847 -4.367 259 HD21 ASN 34 1HD2 ASN 34 8.762 -6.234 -6.618 260 HD22 ASN 34 2HD2 ASN 34 7.989 -6.866 -8.027 261 H GLU 35 H GLU 35 4.486 -6.160 -6.168 262 HA GLU 35 HA GLU 35 3.758 -3.416 -5.665 263 HB2 GLU 35 2HB GLU 35 5.126 -2.409 -7.454 264 HB3 GLU 35 3HB GLU 35 6.169 -3.151 -6.247 265 HG2 GLU 35 2HG GLU 35 6.482 -5.108 -7.740 266 HG3 GLU 35 3HG GLU 35 5.454 -4.340 -8.947 267 H SER 36 H SER 36 3.231 -2.510 -8.163 268 HA SER 36 HA SER 36 1.107 -4.227 -9.156 269 HB2 SER 36 2HB SER 36 2.025 -1.469 -10.104 270 HB3 SER 36 3HB SER 36 0.495 -2.251 -10.503 271 HG SER 36 HG SER 36 0.201 -2.250 -8.095 272 H ASN 37 H ASN 37 3.447 -5.568 -9.571 273 HA ASN 37 HA ASN 37 4.992 -5.008 -11.829 274 HB2 ASN 37 2HB ASN 37 5.670 -7.459 -11.688 275 HB3 ASN 37 3HB ASN 37 5.877 -6.525 -10.217 276 HD21 ASN 37 1HD2 ASN 37 5.932 -8.433 -8.998 277 HD22 ASN 37 2HD2 ASN 37 4.505 -9.342 -8.648 278 H VAL 38 H VAL 38 2.083 -6.921 -11.509 279 HA VAL 38 HA VAL 38 1.125 -6.327 -14.105 280 HB VAL 38 HB VAL 38 2.666 -8.112 -14.838 281 HG11 VAL 38 1HG1 VAL 38 1.232 -9.966 -12.913 282 HG12 VAL 38 2HG1 VAL 38 2.886 -9.370 -12.758 283 HG13 VAL 38 3HG1 VAL 38 2.460 -10.443 -14.091 284 HG21 VAL 38 3HG2 VAL 38 1.068 -9.573 -16.027 285 HG22 VAL 38 1HG2 VAL 38 0.535 -7.890 -16.044 286 HG23 VAL 38 2HG2 VAL 38 -0.229 -9.047 -14.949 287 H TYR 39 H TYR 39 -1.119 -6.781 -14.210 288 HA TYR 39 HA TYR 39 -2.559 -6.808 -11.801 289 HB2 TYR 39 2HB TYR 39 -4.581 -6.988 -13.202 290 HB3 TYR 39 3HB TYR 39 -3.443 -5.850 -13.902 291 HD1 TYR 39 HD2 TYR 39 -2.275 -6.392 -16.048 292 HD2 TYR 39 HD1 TYR 39 -5.131 -9.110 -14.388 293 HE1 TYR 39 HE2 TYR 39 -2.411 -7.569 -18.199 294 HE2 TYR 39 HE1 TYR 39 -5.270 -10.274 -16.544 295 HH TYR 39 HH TYR 39 -4.837 -9.714 -18.995 296 H THR 40 H THR 40 -1.447 -9.397 -13.798 297 HA THR 40 HA THR 40 -3.266 -11.429 -13.101 298 HB THR 40 HB THR 40 -0.406 -11.815 -14.108 299 HG1 THR 40 HG1 THR 40 -1.124 -11.335 -16.118 300 HG21 THR 40 3HG2 THR 40 -2.938 -13.465 -14.490 301 HG22 THR 40 1HG2 THR 40 -1.556 -13.908 -13.482 302 HG23 THR 40 2HG2 THR 40 -1.375 -13.811 -15.236 303 H THR 41 H THR 41 0.180 -11.011 -12.095 304 HA THR 41 HA THR 41 0.305 -12.970 -10.103 305 HB THR 41 HB THR 41 1.854 -10.340 -10.281 306 HG1 THR 41 HG1 THR 41 3.336 -11.554 -11.427 307 HG21 THR 41 3HG2 THR 41 2.606 -12.871 -8.749 308 HG22 THR 41 1HG2 THR 41 2.113 -11.341 -8.016 309 HG23 THR 41 2HG2 THR 41 3.614 -11.434 -8.936 310 H PHE 42 H PHE 42 -0.563 -9.567 -9.903 311 HA PHE 42 HA PHE 42 -0.896 -9.216 -7.154 312 HB2 PHE 42 2HB PHE 42 -0.811 -7.291 -8.590 313 HB3 PHE 42 3HB PHE 42 -2.133 -7.880 -9.587 314 HD1 PHE 42 HD1 PHE 42 -1.548 -7.044 -5.964 315 HD2 PHE 42 HD2 PHE 42 -4.151 -6.721 -9.347 316 HE1 PHE 42 HE1 PHE 42 -3.132 -5.729 -4.635 317 HE2 PHE 42 HE2 PHE 42 -5.729 -5.402 -7.998 318 HZ PHE 42 HZ PHE 42 -5.215 -4.916 -5.647 319 H ARG 43 H ARG 43 -3.298 -10.165 -9.629 320 HA ARG 43 HA ARG 43 -5.520 -10.325 -7.856 321 HB2 ARG 43 2HB ARG 43 -5.883 -9.949 -10.238 322 HB3 ARG 43 3HB ARG 43 -5.109 -11.477 -10.646 323 HG2 ARG 43 2HG ARG 43 -6.935 -12.728 -9.625 324 HG3 ARG 43 3HG ARG 43 -7.685 -11.235 -9.054 325 HD2 ARG 43 2HD ARG 43 -7.243 -11.902 -11.982 326 HD3 ARG 43 3HD ARG 43 -8.739 -12.232 -11.107 327 HE ARG 43 HE ARG 43 -7.677 -9.478 -11.312 328 HH11 ARG 43 1HH1 ARG 43 -10.289 -11.772 -11.911 329 HH12 ARG 43 2HH1 ARG 43 -11.412 -10.547 -12.403 330 HH21 ARG 43 1HH2 ARG 43 -9.161 -7.882 -11.978 331 HH22 ARG 43 2HH2 ARG 43 -10.773 -8.337 -12.441 332 H ASN 44 H ASN 44 -3.208 -12.711 -9.098 333 HA ASN 44 HA ASN 44 -4.410 -15.054 -8.043 334 HB2 ASN 44 2HB ASN 44 -1.475 -14.496 -8.659 335 HB3 ASN 44 3HB ASN 44 -2.136 -16.092 -8.311 336 HD21 ASN 44 1HD2 ASN 44 -0.757 -15.053 -10.690 337 HD22 ASN 44 2HD2 ASN 44 -1.823 -15.346 -12.022 338 H ALA 45 H ALA 45 -2.286 -12.623 -6.672 339 HA ALA 45 HA ALA 45 -1.540 -13.991 -4.291 340 HB1 ALA 45 3HB ALA 45 -0.838 -11.774 -3.499 341 HB2 ALA 45 1HB ALA 45 -1.706 -11.006 -4.833 342 HB3 ALA 45 2HB ALA 45 -0.314 -12.040 -5.161 343 H ILE 46 H ILE 46 -4.292 -11.970 -5.173 344 HA ILE 46 HA ILE 46 -5.476 -11.768 -2.561 345 HB ILE 46 HB ILE 46 -6.755 -11.365 -5.309 346 HG12 ILE 46 2HG1 ILE 46 -5.528 -9.292 -3.426 347 HG13 ILE 46 3HG1 ILE 46 -4.819 -9.843 -4.938 348 HG21 ILE 46 1HG2 ILE 46 -8.480 -10.052 -4.130 349 HG22 ILE 46 2HG2 ILE 46 -7.721 -10.438 -2.584 350 HG23 ILE 46 3HG2 ILE 46 -8.444 -11.721 -3.556 351 HD11 ILE 46 3HD1 ILE 46 -6.718 -8.880 -6.165 352 HD12 ILE 46 1HD1 ILE 46 -5.842 -7.681 -5.216 353 HD13 ILE 46 2HD1 ILE 46 -7.392 -8.294 -4.640 354 H LEU 47 H LEU 47 -5.955 -13.849 -5.408 355 HA LEU 47 HA LEU 47 -8.142 -15.397 -4.402 356 HB2 LEU 47 2HB LEU 47 -6.146 -15.995 -6.625 357 HB3 LEU 47 3HB LEU 47 -7.613 -16.919 -6.331 358 HG LEU 47 HG LEU 47 -7.491 -14.001 -7.198 359 HD11 LEU 47 1HD1 LEU 47 -8.344 -16.453 -8.768 360 HD12 LEU 47 2HD1 LEU 47 -6.866 -15.517 -9.008 361 HD13 LEU 47 3HD1 LEU 47 -8.433 -14.777 -9.327 362 HD21 LEU 47 3HD2 LEU 47 -9.909 -15.760 -6.693 363 HD22 LEU 47 1HD2 LEU 47 -9.946 -14.160 -7.440 364 HD23 LEU 47 2HD2 LEU 47 -9.419 -14.336 -5.770 365 H LYS 48 H LYS 48 -4.688 -15.608 -4.181 366 HA LYS 48 HA LYS 48 -4.329 -18.257 -3.214 367 HB2 LYS 48 2HB LYS 48 -2.493 -16.895 -4.111 368 HB3 LYS 48 3HB LYS 48 -2.720 -15.686 -2.856 369 HG2 LYS 48 2HG LYS 48 -1.972 -17.376 -1.162 370 HG3 LYS 48 3HG LYS 48 -1.654 -18.508 -2.479 371 HD2 LYS 48 2HD LYS 48 -0.311 -15.804 -2.066 372 HD3 LYS 48 3HD LYS 48 0.426 -17.379 -1.777 373 HE2 LYS 48 2HE LYS 48 -0.474 -16.305 -4.477 374 HE3 LYS 48 3HE LYS 48 1.191 -16.415 -3.907 375 HZ1 LYS 48 3HZ LYS 48 0.930 -18.833 -3.794 376 HZ2 LYS 48 1HZ LYS 48 0.680 -18.247 -5.357 377 HZ3 LYS 48 2HZ LYS 48 -0.637 -18.703 -4.409 378 H GLN 49 H GLN 49 -5.125 -15.188 -1.724 379 HA GLN 49 HA GLN 49 -4.651 -16.188 0.989 380 HB2 GLN 49 2HB GLN 49 -3.770 -13.956 0.189 381 HB3 GLN 49 3HB GLN 49 -5.434 -13.387 0.078 382 HG2 GLN 49 2HG GLN 49 -4.349 -12.643 2.148 383 HG3 GLN 49 3HG GLN 49 -5.727 -13.688 2.482 384 HE21 GLN 49 1HE2 GLN 49 -2.210 -13.499 2.465 385 HE22 GLN 49 2HE2 GLN 49 -1.945 -14.851 3.509 386 H ALA 50 H ALA 50 -6.198 -16.137 2.616 387 HA ALA 50 HA ALA 50 -8.742 -17.144 1.941 388 HB1 ALA 50 3HB ALA 50 -7.732 -16.144 4.632 389 HB2 ALA 50 1HB ALA 50 -7.547 -17.777 3.989 390 HB3 ALA 50 2HB ALA 50 -9.153 -17.165 4.375 391 H ASP 51 H ASP 51 -7.747 -13.963 3.181 392 HA ASP 51 HA ASP 51 -10.371 -13.039 3.808 393 HB2 ASP 51 2HB ASP 51 -9.223 -10.784 4.145 394 HB3 ASP 51 3HB ASP 51 -8.609 -12.120 5.102 395 H LYS 52 H LYS 52 -8.587 -12.953 0.858 396 HA LYS 52 HA LYS 52 -9.046 -12.309 -1.246 397 HB2 LYS 52 2HB LYS 52 -11.932 -12.148 -0.274 398 HB3 LYS 52 3HB LYS 52 -11.439 -12.106 -1.962 399 HG2 LYS 52 2HG LYS 52 -11.054 -14.428 -0.056 400 HG3 LYS 52 3HG LYS 52 -12.273 -14.317 -1.327 401 HD2 LYS 52 2HD LYS 52 -10.495 -14.297 -3.044 402 HD3 LYS 52 3HD LYS 52 -9.260 -14.359 -1.780 403 HE2 LYS 52 2HE LYS 52 -11.317 -16.508 -2.401 404 HE3 LYS 52 3HE LYS 52 -9.585 -16.583 -2.721 405 HZ1 LYS 52 3HZ LYS 52 -10.233 -17.806 -0.720 406 HZ2 LYS 52 1HZ LYS 52 -10.795 -16.374 -0.015 407 HZ3 LYS 52 2HZ LYS 52 -9.154 -16.558 -0.369 408 H VAL 53 H VAL 53 -8.082 -10.282 0.413 409 HA VAL 53 HA VAL 53 -8.763 -8.041 -1.288 410 HB VAL 53 HB VAL 53 -10.448 -7.682 0.416 411 HG11 VAL 53 1HG1 VAL 53 -8.267 -7.763 2.519 412 HG12 VAL 53 2HG1 VAL 53 -9.515 -8.983 2.251 413 HG13 VAL 53 3HG1 VAL 53 -9.969 -7.366 2.795 414 HG21 VAL 53 3HG2 VAL 53 -8.178 -5.702 0.828 415 HG22 VAL 53 1HG2 VAL 53 -9.885 -5.416 1.193 416 HG23 VAL 53 2HG2 VAL 53 -9.368 -5.666 -0.475 417 H ALA 54 H ALA 54 -7.017 -6.867 -1.723 418 HA ALA 54 HA ALA 54 -4.562 -7.121 -0.090 419 HB1 ALA 54 3HB ALA 54 -4.919 -6.207 -2.971 420 HB2 ALA 54 1HB ALA 54 -4.308 -7.777 -2.443 421 HB3 ALA 54 2HB ALA 54 -3.379 -6.316 -2.106 422 H TYR 55 H TYR 55 -3.245 -5.026 -0.065 423 HA TYR 55 HA TYR 55 -4.860 -2.562 -0.077 424 HB2 TYR 55 2HB TYR 55 -3.277 -3.535 2.350 425 HB3 TYR 55 3HB TYR 55 -3.957 -1.920 2.184 426 HD1 TYR 55 HD1 TYR 55 -6.402 -1.553 2.367 427 HD2 TYR 55 HD2 TYR 55 -4.729 -5.458 2.811 428 HE1 TYR 55 HE1 TYR 55 -8.509 -2.353 3.358 429 HE2 TYR 55 HE2 TYR 55 -6.827 -6.240 3.782 430 HH TYR 55 HH TYR 55 -8.730 -5.275 5.009 431 H LEU 56 H LEU 56 -3.779 -1.151 -1.199 432 HA LEU 56 HA LEU 56 -0.924 -1.279 -1.631 433 HB2 LEU 56 2HB LEU 56 -2.496 -0.690 -3.449 434 HB3 LEU 56 3HB LEU 56 -3.014 0.730 -2.555 435 HG LEU 56 HG LEU 56 -0.762 1.722 -2.785 436 HD11 LEU 56 1HD1 LEU 56 -0.043 -0.754 -4.365 437 HD12 LEU 56 2HD1 LEU 56 0.601 -0.284 -2.790 438 HD13 LEU 56 3HD1 LEU 56 0.947 0.699 -4.209 439 HD21 LEU 56 3HD2 LEU 56 -0.826 2.170 -5.200 440 HD22 LEU 56 1HD2 LEU 56 -2.439 2.215 -4.491 441 HD23 LEU 56 2HD2 LEU 56 -1.928 0.810 -5.430 442 H VAL 57 H VAL 57 0.261 -0.672 0.073 443 HA VAL 57 HA VAL 57 -0.505 1.588 1.795 444 HB VAL 57 HB VAL 57 1.789 -0.406 2.109 445 HG11 VAL 57 1HG1 VAL 57 0.679 1.594 4.110 446 HG12 VAL 57 2HG1 VAL 57 2.240 1.693 3.293 447 HG13 VAL 57 3HG1 VAL 57 1.930 0.391 4.443 448 HG21 VAL 57 3HG2 VAL 57 0.410 -1.525 3.812 449 HG22 VAL 57 1HG2 VAL 57 -0.368 -1.557 2.229 450 HG23 VAL 57 2HG2 VAL 57 -0.929 -0.426 3.463 451 H MET 58 H MET 58 0.267 3.550 1.237 452 HA MET 58 HA MET 58 3.125 3.818 0.511 453 HB2 MET 58 2HB MET 58 2.692 5.545 -1.089 454 HB3 MET 58 3HB MET 58 1.618 4.223 -1.507 455 HG2 MET 58 2HG MET 58 0.769 6.690 0.029 456 HG3 MET 58 3HG MET 58 0.587 6.483 -1.709 457 HE1 MET 58 3HE MET 58 -2.035 3.617 -1.936 458 HE2 MET 58 1HE MET 58 -0.281 3.524 -2.060 459 HE3 MET 58 2HE MET 58 -1.152 4.849 -2.837 460 H ASP 59 H ASP 59 3.789 6.231 0.885 461 HA ASP 59 HA ASP 59 2.715 7.196 3.456 462 HB2 ASP 59 2HB ASP 59 4.696 8.701 3.483 463 HB3 ASP 59 3HB ASP 59 5.164 7.016 3.304 464 H GLU 60 H GLU 60 2.957 9.808 3.437 465 HA GLU 60 HA GLU 60 0.604 10.606 2.071 466 HB2 GLU 60 2HB GLU 60 1.162 11.375 4.336 467 HB3 GLU 60 3HB GLU 60 2.555 12.254 3.718 468 HG2 GLU 60 2HG GLU 60 1.132 13.801 2.523 469 HG3 GLU 60 3HG GLU 60 -0.306 12.854 2.894 470 H ARG 61 H ARG 61 4.046 11.306 1.527 471 HA ARG 61 HA ARG 61 3.681 13.366 -0.416 472 HB2 ARG 61 2HB ARG 61 5.825 13.231 0.703 473 HB3 ARG 61 3HB ARG 61 6.053 11.558 0.214 474 HG2 ARG 61 2HG ARG 61 7.500 13.086 -1.065 475 HG3 ARG 61 3HG ARG 61 6.365 12.237 -2.111 476 HD2 ARG 61 2HD ARG 61 4.893 14.389 -1.884 477 HD3 ARG 61 3HD ARG 61 6.377 15.153 -1.302 478 HE ARG 61 HE ARG 61 7.194 14.002 -3.592 479 HH11 ARG 61 1HH1 ARG 61 4.426 16.112 -2.953 480 HH12 ARG 61 2HH1 ARG 61 4.420 16.763 -4.565 481 HH21 ARG 61 1HH2 ARG 61 7.109 14.838 -5.708 482 HH22 ARG 61 2HH2 ARG 61 5.928 16.047 -6.113 483 H THR 62 H THR 62 4.198 9.831 -0.666 484 HA THR 62 HA THR 62 4.055 9.636 -3.489 485 HB THR 62 HB THR 62 3.229 7.515 -1.450 486 HG1 THR 62 HG1 THR 62 5.289 7.274 -1.053 487 HG21 THR 62 3HG2 THR 62 4.231 7.196 -4.314 488 HG22 THR 62 1HG2 THR 62 2.576 6.906 -3.768 489 HG23 THR 62 2HG2 THR 62 3.889 5.878 -3.191 490 H TRP 63 H TRP 63 1.555 9.757 -0.964 491 HA TRP 63 HA TRP 63 -0.678 9.107 -2.592 492 HB2 TRP 63 2HB TRP 63 -0.950 8.946 -0.198 493 HB3 TRP 63 3HB TRP 63 -0.528 10.639 0.030 494 HD1 TRP 63 HD1 TRP 63 -2.536 12.300 0.154 495 HE1 TRP 63 HE1 TRP 63 -5.057 12.171 -0.320 496 HE3 TRP 63 HE3 TRP 63 -2.749 7.631 -1.958 497 HZ2 TRP 63 HZ2 TRP 63 -6.890 10.359 -1.441 498 HZ3 TRP 63 HZ3 TRP 63 -4.934 6.787 -2.714 499 HH2 TRP 63 HH2 TRP 63 -6.964 8.122 -2.461 500 H LYS 64 H LYS 64 0.889 12.251 -1.853 501 HA LYS 64 HA LYS 64 -1.029 13.992 -2.871 502 HB2 LYS 64 2HB LYS 64 1.996 14.289 -3.094 503 HB3 LYS 64 3HB LYS 64 0.829 15.597 -3.279 504 HG2 LYS 64 2HG LYS 64 1.426 14.033 -0.765 505 HG3 LYS 64 3HG LYS 64 1.822 15.722 -1.095 506 HD2 LYS 64 2HD LYS 64 -0.650 16.191 -1.258 507 HD3 LYS 64 3HD LYS 64 -0.960 14.533 -0.751 508 HE2 LYS 64 2HE LYS 64 0.104 14.936 1.385 509 HE3 LYS 64 3HE LYS 64 0.613 16.545 0.866 510 HZ1 LYS 64 3HZ LYS 64 -1.640 17.267 0.807 511 HZ2 LYS 64 1HZ LYS 64 -1.389 16.531 2.307 512 HZ3 LYS 64 2HZ LYS 64 -2.223 15.710 1.086 513 H LYS 65 H LYS 65 1.338 12.050 -4.546 514 HA LYS 65 HA LYS 65 0.894 13.090 -7.168 515 HB2 LYS 65 2HB LYS 65 2.101 10.450 -6.250 516 HB3 LYS 65 3HB LYS 65 2.206 11.095 -7.885 517 HG2 LYS 65 2HG LYS 65 3.359 12.401 -5.398 518 HG3 LYS 65 3HG LYS 65 4.281 11.479 -6.585 519 HD2 LYS 65 2HD LYS 65 2.758 14.048 -7.185 520 HD3 LYS 65 3HD LYS 65 4.493 13.946 -6.877 521 HE2 LYS 65 2HE LYS 65 4.811 12.562 -8.857 522 HE3 LYS 65 3HE LYS 65 3.068 12.515 -9.142 523 HZ1 LYS 65 3HZ LYS 65 4.186 14.128 -10.562 524 HZ2 LYS 65 1HZ LYS 65 4.742 14.968 -9.204 525 HZ3 LYS 65 2HZ LYS 65 3.086 14.883 -9.528 526 H VAL 66 H VAL 66 -0.177 10.110 -5.483 527 HA VAL 66 HA VAL 66 -1.747 8.974 -7.497 528 HB VAL 66 HB VAL 66 -2.100 8.798 -4.465 529 HG11 VAL 66 1HG1 VAL 66 -3.321 6.679 -4.866 530 HG12 VAL 66 2HG1 VAL 66 -3.257 6.977 -6.602 531 HG13 VAL 66 3HG1 VAL 66 -4.168 8.066 -5.558 532 HG21 VAL 66 3HG2 VAL 66 -0.621 6.947 -6.377 533 HG22 VAL 66 1HG2 VAL 66 -0.819 6.690 -4.640 534 HG23 VAL 66 2HG2 VAL 66 0.123 8.061 -5.228 535 H TYR 67 H TYR 67 -2.912 10.870 -4.727 536 HA TYR 67 HA TYR 67 -5.532 11.321 -5.219 537 HB2 TYR 67 2HB TYR 67 -4.215 12.026 -3.203 538 HB3 TYR 67 3HB TYR 67 -3.540 13.357 -4.126 539 HD1 TYR 67 HD1 TYR 67 -6.600 12.045 -2.522 540 HD2 TYR 67 HD2 TYR 67 -4.874 15.409 -4.502 541 HE1 TYR 67 HE1 TYR 67 -8.468 13.441 -1.770 542 HE2 TYR 67 HE2 TYR 67 -6.756 16.807 -3.758 543 HH TYR 67 HH TYR 67 -8.985 15.789 -1.374 544 H ASP 68 H ASP 68 -2.816 13.194 -6.546 545 HA ASP 68 HA ASP 68 -4.350 15.164 -7.911 546 HB2 ASP 68 2HB ASP 68 -1.997 15.538 -7.274 547 HB3 ASP 68 3HB ASP 68 -1.478 14.249 -8.356 548 H LEU 69 H LEU 69 -2.829 12.128 -8.937 549 HA LEU 69 HA LEU 69 -3.416 12.194 -11.701 550 HB2 LEU 69 2HB LEU 69 -3.029 9.824 -9.824 551 HB3 LEU 69 3HB LEU 69 -3.074 9.693 -11.574 552 HG LEU 69 HG LEU 69 -0.973 11.264 -10.038 553 HD11 LEU 69 1HD1 LEU 69 -0.764 8.885 -9.536 554 HD12 LEU 69 2HD1 LEU 69 0.565 9.421 -10.558 555 HD13 LEU 69 3HD1 LEU 69 -0.765 8.494 -11.258 556 HD21 LEU 69 3HD2 LEU 69 -1.115 10.484 -12.959 557 HD22 LEU 69 1HD2 LEU 69 0.230 11.312 -12.167 558 HD23 LEU 69 2HD2 LEU 69 -1.336 12.105 -12.296 559 H LEU 70 H LEU 70 -5.231 11.047 -8.897 560 HA LEU 70 HA LEU 70 -7.315 9.630 -10.098 561 HB2 LEU 70 2HB LEU 70 -7.384 11.340 -7.569 562 HB3 LEU 70 3HB LEU 70 -8.653 10.225 -8.038 563 HG LEU 70 HG LEU 70 -5.822 9.489 -7.224 564 HD11 LEU 70 1HD1 LEU 70 -7.225 10.129 -5.330 565 HD12 LEU 70 2HD1 LEU 70 -6.869 8.405 -5.291 566 HD13 LEU 70 3HD1 LEU 70 -8.460 8.964 -5.822 567 HD21 LEU 70 3HD2 LEU 70 -6.561 7.982 -8.983 568 HD22 LEU 70 1HD2 LEU 70 -8.063 7.657 -8.111 569 HD23 LEU 70 2HD2 LEU 70 -6.513 7.145 -7.436 570 H ILE 71 H ILE 71 -7.211 13.032 -9.089 571 HA ILE 71 HA ILE 71 -9.749 13.775 -10.152 572 HB ILE 71 HB ILE 71 -7.413 15.595 -9.389 573 HG12 ILE 71 2HG1 ILE 71 -9.694 14.630 -7.596 574 HG13 ILE 71 3HG1 ILE 71 -8.056 13.992 -7.551 575 HG21 ILE 71 1HG2 ILE 71 -10.392 16.197 -9.518 576 HG22 ILE 71 2HG2 ILE 71 -9.169 16.775 -10.650 577 HG23 ILE 71 3HG2 ILE 71 -9.139 17.317 -8.971 578 HD11 ILE 71 3HD1 ILE 71 -7.213 16.174 -6.865 579 HD12 ILE 71 1HD1 ILE 71 -8.432 15.554 -5.754 580 HD13 ILE 71 2HD1 ILE 71 -8.855 16.825 -6.901 581 H LEU 72 H LEU 72 -6.485 13.757 -11.426 582 HA LEU 72 HA LEU 72 -6.803 15.539 -13.598 583 HB2 LEU 72 2HB LEU 72 -4.633 14.845 -12.577 584 HB3 LEU 72 3HB LEU 72 -4.817 13.251 -13.268 585 HG LEU 72 HG LEU 72 -3.185 14.896 -14.415 586 HD11 LEU 72 1HD1 LEU 72 -5.237 13.577 -16.197 587 HD12 LEU 72 2HD1 LEU 72 -3.848 12.789 -15.449 588 HD13 LEU 72 3HD1 LEU 72 -3.595 14.060 -16.642 589 HD21 LEU 72 3HD2 LEU 72 -4.641 16.881 -14.404 590 HD22 LEU 72 1HD2 LEU 72 -5.741 16.093 -15.539 591 HD23 LEU 72 2HD2 LEU 72 -4.090 16.485 -16.030 592 H HIS 73 H HIS 73 -7.050 11.958 -13.435 593 HA HIS 73 HA HIS 73 -7.922 11.804 -16.218 594 HB2 HIS 73 2HB HIS 73 -7.364 9.743 -14.086 595 HB3 HIS 73 3HB HIS 73 -8.248 9.285 -15.532 596 HD1 HIS 73 HD1 HIS 73 -6.914 8.731 -17.552 597 HD2 HIS 73 HD2 HIS 73 -4.648 10.674 -14.658 598 HE1 HIS 73 HE1 HIS 73 -4.546 8.632 -18.374 599 HE2 HIS 73 HE2 HIS 73 -3.233 9.985 -16.708 600 H ASP 74 H ASP 74 -9.414 10.750 -13.085 601 HA ASP 74 HA ASP 74 -12.041 11.629 -13.843 602 HB2 ASP 74 2HB ASP 74 -11.826 9.636 -15.328 603 HB3 ASP 74 3HB ASP 74 -11.524 8.615 -13.927 604 H PHE 75 H PHE 75 -11.787 12.587 -11.817 605 HA PHE 75 HA PHE 75 -13.309 11.415 -9.778 606 HB2 PHE 75 2HB PHE 75 -10.354 11.162 -9.365 607 HB3 PHE 75 3HB PHE 75 -11.192 11.884 -8.012 608 HD1 PHE 75 HD1 PHE 75 -13.606 10.434 -7.627 609 HD2 PHE 75 HD2 PHE 75 -9.829 8.912 -8.933 610 HE1 PHE 75 HE1 PHE 75 -14.173 8.222 -6.719 611 HE2 PHE 75 HE2 PHE 75 -10.411 6.700 -8.030 612 HZ PHE 75 HZ PHE 75 -12.582 6.353 -6.916 613 H THR 76 H THR 76 -13.389 12.925 -7.841 614 HA THR 76 HA THR 76 -12.213 15.584 -8.200 615 HB THR 76 HB THR 76 -14.631 15.560 -9.185 616 HG1 THR 76 HG1 THR 76 -13.932 17.556 -8.795 617 HG21 THR 76 3HG2 THR 76 -15.745 14.220 -7.429 618 HG22 THR 76 1HG2 THR 76 -16.495 15.810 -7.597 619 HG23 THR 76 2HG2 THR 76 -15.408 15.484 -6.247 620 HA PRO 77 HA PRO 77 -11.090 15.140 -3.906 621 HB2 PRO 77 2HB PRO 77 -12.036 17.624 -2.834 622 HB3 PRO 77 3HB PRO 77 -10.429 17.286 -3.497 623 HG2 PRO 77 2HG PRO 77 -12.775 18.548 -4.830 624 HG3 PRO 77 3HG PRO 77 -11.044 18.889 -5.026 625 HD2 PRO 77 2HD PRO 77 -12.365 17.528 -6.900 626 HD3 PRO 77 3HD PRO 77 -10.706 17.060 -6.462 627 H GLU 78 H GLU 78 -14.420 16.269 -4.408 628 HA GLU 78 HA GLU 78 -15.510 15.612 -1.885 629 HB2 GLU 78 2HB GLU 78 -16.856 15.761 -4.615 630 HB3 GLU 78 3HB GLU 78 -17.735 15.614 -3.094 631 HG2 GLU 78 2HG GLU 78 -16.788 17.775 -2.347 632 HG3 GLU 78 3HG GLU 78 -15.944 17.931 -3.889 633 H GLU 79 H GLU 79 -15.204 13.687 -4.861 634 HA GLU 79 HA GLU 79 -16.598 11.382 -3.958 635 HB2 GLU 79 2HB GLU 79 -14.431 11.667 -6.085 636 HB3 GLU 79 3HB GLU 79 -15.362 10.198 -5.821 637 HG2 GLU 79 2HG GLU 79 -16.512 12.872 -6.646 638 HG3 GLU 79 3HG GLU 79 -16.193 11.518 -7.727 639 H ILE 80 H ILE 80 -13.159 12.234 -4.006 640 HA ILE 80 HA ILE 80 -12.098 9.750 -3.179 641 HB ILE 80 HB ILE 80 -10.865 12.534 -2.902 642 HG12 ILE 80 2HG1 ILE 80 -10.606 10.542 -5.212 643 HG13 ILE 80 3HG1 ILE 80 -11.577 12.008 -5.245 644 HG21 ILE 80 1HG2 ILE 80 -8.678 11.374 -2.924 645 HG22 ILE 80 2HG2 ILE 80 -9.503 9.817 -2.952 646 HG23 ILE 80 3HG2 ILE 80 -9.663 10.871 -1.548 647 HD11 ILE 80 3HD1 ILE 80 -9.497 12.314 -6.433 648 HD12 ILE 80 1HD1 ILE 80 -8.572 11.891 -4.992 649 HD13 ILE 80 2HD1 ILE 80 -9.553 13.360 -5.014 650 H LYS 81 H LYS 81 -12.842 12.727 -1.355 651 HA LYS 81 HA LYS 81 -11.950 11.789 1.177 652 HB2 LYS 81 2HB LYS 81 -12.931 13.778 2.113 653 HB3 LYS 81 3HB LYS 81 -12.189 14.196 0.573 654 HG2 LYS 81 2HG LYS 81 -14.531 13.980 -0.450 655 HG3 LYS 81 3HG LYS 81 -15.137 13.929 1.207 656 HD2 LYS 81 2HD LYS 81 -13.510 16.192 -0.020 657 HD3 LYS 81 3HD LYS 81 -15.259 16.202 0.223 658 HE2 LYS 81 2HE LYS 81 -14.955 16.094 2.652 659 HE3 LYS 81 3HE LYS 81 -13.201 16.006 2.450 660 HZ1 LYS 81 3HZ LYS 81 -13.224 18.201 1.472 661 HZ2 LYS 81 1HZ LYS 81 -13.960 18.254 2.991 662 HZ3 LYS 81 2HZ LYS 81 -14.907 18.286 1.592 663 H SER 82 H SER 82 -14.923 11.370 -0.584 664 HA SER 82 HA SER 82 -16.670 10.755 1.575 665 HB2 SER 82 2HB SER 82 -17.447 11.370 -0.722 666 HB3 SER 82 3HB SER 82 -16.854 9.820 -1.324 667 HG SER 82 HG SER 82 -18.888 10.237 0.623 668 H PHE 83 H PHE 83 -14.359 8.861 -0.295 669 HA PHE 83 HA PHE 83 -15.086 6.291 0.753 670 HB2 PHE 83 2HB PHE 83 -12.485 7.194 -0.554 671 HB3 PHE 83 3HB PHE 83 -12.882 5.523 -0.164 672 HD1 PHE 83 HD2 PHE 83 -15.140 4.611 -1.198 673 HD2 PHE 83 HD1 PHE 83 -12.995 7.984 -2.718 674 HE1 PHE 83 HE2 PHE 83 -16.254 4.346 -3.378 675 HE2 PHE 83 HE1 PHE 83 -14.115 7.713 -4.887 676 HZ PHE 83 HZ PHE 83 -15.746 5.899 -5.223 677 H PHE 84 H PHE 84 -12.997 8.885 1.879 678 HA PHE 84 HA PHE 84 -11.698 7.366 3.961 679 HB2 PHE 84 2HB PHE 84 -12.021 10.372 3.537 680 HB3 PHE 84 3HB PHE 84 -11.176 9.702 4.923 681 HD1 PHE 84 HD2 PHE 84 -8.969 8.632 4.660 682 HD2 PHE 84 HD1 PHE 84 -10.979 10.334 1.294 683 HE1 PHE 84 HE2 PHE 84 -6.869 8.605 3.382 684 HE2 PHE 84 HE1 PHE 84 -8.873 10.312 0.028 685 HZ PHE 84 HZ PHE 84 -6.814 9.445 1.070 686 H GLU 85 H GLU 85 -14.620 9.330 3.699 687 HA GLU 85 HA GLU 85 -15.139 9.346 6.569 688 HB2 GLU 85 2HB GLU 85 -16.783 10.482 4.261 689 HB3 GLU 85 3HB GLU 85 -17.103 10.746 5.971 690 HG2 GLU 85 2HG GLU 85 -14.719 11.733 4.387 691 HG3 GLU 85 3HG GLU 85 -16.024 12.703 5.067 692 H ASN 86 H ASN 86 -15.268 6.739 5.018 693 HA ASN 86 HA ASN 86 -18.019 5.901 5.057 694 HB2 ASN 86 2HB ASN 86 -16.170 4.833 3.651 695 HB3 ASN 86 3HB ASN 86 -15.566 4.090 5.127 696 HD21 ASN 86 1HD2 ASN 86 -16.410 2.644 2.875 697 HD22 ASN 86 2HD2 ASN 86 -17.815 1.732 3.288 698 H LYS 87 H LYS 87 -18.904 6.262 7.047 699 HA LYS 87 HA LYS 87 -17.600 5.324 9.504 700 HB2 LYS 87 2HB LYS 87 -20.131 6.976 9.159 701 HB3 LYS 87 3HB LYS 87 -19.319 6.628 10.682 702 HG2 LYS 87 2HG LYS 87 -17.309 7.894 9.803 703 HG3 LYS 87 3HG LYS 87 -18.288 8.350 8.405 704 HD2 LYS 87 2HD LYS 87 -18.285 10.156 10.080 705 HD3 LYS 87 3HD LYS 87 -19.909 9.484 9.904 706 HE2 LYS 87 2HE LYS 87 -19.553 8.132 11.953 707 HE3 LYS 87 3HE LYS 87 -17.941 8.831 12.126 708 HZ1 LYS 87 3HZ LYS 87 -20.489 10.361 12.185 709 HZ2 LYS 87 1HZ LYS 87 -18.941 11.000 12.402 710 HZ3 LYS 87 2HZ LYS 87 -19.575 9.926 13.535 711 H GLY 88 H GLY 88 -17.917 3.056 9.050 712 HA2 GLY 88 2HA GLY 88 -19.605 1.675 10.549 713 HA3 GLY 88 3HA GLY 88 -20.673 1.999 9.187 714 H LYS 89 H LYS 89 -19.104 1.734 7.029 715 HA LYS 89 HA LYS 89 -18.275 -1.098 7.027 716 HB2 LYS 89 2HB LYS 89 -18.538 0.832 4.678 717 HB3 LYS 89 3HB LYS 89 -18.319 -0.908 4.579 718 HG2 LYS 89 2HG LYS 89 -20.775 0.464 5.723 719 HG3 LYS 89 3HG LYS 89 -20.642 -0.140 4.074 720 HD2 LYS 89 2HD LYS 89 -20.526 -1.817 6.610 721 HD3 LYS 89 3HD LYS 89 -21.893 -1.701 5.502 722 HE2 LYS 89 2HE LYS 89 -19.175 -2.924 4.929 723 HE3 LYS 89 3HE LYS 89 -20.717 -3.763 5.056 724 HZ1 LYS 89 3HZ LYS 89 -19.990 -3.446 2.755 725 HZ2 LYS 89 1HZ LYS 89 -20.047 -1.770 2.956 726 HZ3 LYS 89 2HZ LYS 89 -21.462 -2.682 3.059 727 H ARG 90 H ARG 90 -16.305 -1.338 5.315 728 HA ARG 90 HA ARG 90 -14.020 -0.069 6.523 729 HB2 ARG 90 2HB ARG 90 -13.930 -2.422 5.798 730 HB3 ARG 90 3HB ARG 90 -14.218 -1.945 4.128 731 HG2 ARG 90 2HG ARG 90 -12.047 -0.715 4.131 732 HG3 ARG 90 3HG ARG 90 -11.766 -1.255 5.790 733 HD2 ARG 90 2HD ARG 90 -12.055 -3.045 3.358 734 HD3 ARG 90 3HD ARG 90 -10.540 -2.644 4.172 735 HE ARG 90 HE ARG 90 -11.895 -3.718 6.185 736 HH11 ARG 90 1HH1 ARG 90 -11.503 -4.889 2.896 737 HH12 ARG 90 2HH1 ARG 90 -11.650 -6.563 3.347 738 HH21 ARG 90 1HH2 ARG 90 -12.120 -5.895 6.770 739 HH22 ARG 90 2HH2 ARG 90 -12.004 -7.136 5.559 740 HA PRO 91 HA PRO 91 -13.934 3.379 3.503 741 HB2 PRO 91 2HB PRO 91 -11.233 3.868 4.707 742 HB3 PRO 91 3HB PRO 91 -12.619 4.968 4.574 743 HG2 PRO 91 2HG PRO 91 -11.916 3.935 6.935 744 HG3 PRO 91 3HG PRO 91 -13.628 4.172 6.508 745 HD2 PRO 91 2HD PRO 91 -12.004 1.632 6.453 746 HD3 PRO 91 3HD PRO 91 -13.664 1.897 7.039 747 H VAL 92 H VAL 92 -13.308 3.159 1.416 748 HA VAL 92 HA VAL 92 -11.479 1.164 0.510 749 HB VAL 92 HB VAL 92 -12.656 3.541 -1.015 750 HG11 VAL 92 1HG1 VAL 92 -11.294 1.054 -2.125 751 HG12 VAL 92 2HG1 VAL 92 -10.649 2.697 -2.160 752 HG13 VAL 92 3HG1 VAL 92 -12.100 2.303 -3.083 753 HG21 VAL 92 3HG2 VAL 92 -14.306 1.929 -1.891 754 HG22 VAL 92 1HG2 VAL 92 -14.388 2.025 -0.131 755 HG23 VAL 92 2HG2 VAL 92 -13.599 0.647 -0.902 756 H PHE 93 H PHE 93 -11.283 4.680 0.872 757 HA PHE 93 HA PHE 93 -8.332 4.565 0.667 758 HB2 PHE 93 2HB PHE 93 -10.187 6.987 0.561 759 HB3 PHE 93 3HB PHE 93 -8.436 7.031 0.396 760 HD1 PHE 93 HD1 PHE 93 -8.538 4.377 -1.478 761 HD2 PHE 93 HD2 PHE 93 -10.412 8.221 -1.560 762 HE1 PHE 93 HE1 PHE 93 -8.753 4.224 -3.920 763 HE2 PHE 93 HE2 PHE 93 -10.625 8.055 -4.007 764 HZ PHE 93 HZ PHE 93 -9.797 6.053 -5.191 765 H VAL 94 H VAL 94 -7.469 4.222 2.656 766 HA VAL 94 HA VAL 94 -8.635 5.563 5.043 767 HB VAL 94 HB VAL 94 -6.738 3.159 5.062 768 HG11 VAL 94 1HG1 VAL 94 -8.496 4.320 7.250 769 HG12 VAL 94 2HG1 VAL 94 -6.740 4.460 7.140 770 HG13 VAL 94 3HG1 VAL 94 -7.482 2.880 7.397 771 HG21 VAL 94 3HG2 VAL 94 -8.852 2.492 3.969 772 HG22 VAL 94 1HG2 VAL 94 -9.754 3.065 5.374 773 HG23 VAL 94 2HG2 VAL 94 -8.643 1.704 5.535 774 H LYS 95 H LYS 95 -7.118 6.547 6.552 775 HA LYS 95 HA LYS 95 -4.299 6.788 5.799 776 HB2 LYS 95 2HB LYS 95 -4.288 9.224 5.928 777 HB3 LYS 95 3HB LYS 95 -5.395 8.685 4.672 778 HG2 LYS 95 2HG LYS 95 -7.317 9.118 6.132 779 HG3 LYS 95 3HG LYS 95 -6.240 9.617 7.440 780 HD2 LYS 95 2HD LYS 95 -6.444 10.986 4.725 781 HD3 LYS 95 3HD LYS 95 -7.231 11.550 6.200 782 HE2 LYS 95 2HE LYS 95 -5.109 12.009 7.244 783 HE3 LYS 95 3HE LYS 95 -4.228 11.215 5.935 784 HZ1 LYS 95 3HZ LYS 95 -4.207 13.651 5.780 785 HZ2 LYS 95 1HZ LYS 95 -5.884 13.659 5.602 786 HZ3 LYS 95 2HZ LYS 95 -4.910 12.929 4.429 787 H GLY 96 H GLY 96 -3.119 8.128 7.471 788 HA2 GLY 96 2HA GLY 96 -3.387 8.986 9.866 789 HA3 GLY 96 3HA GLY 96 -3.951 7.344 10.207 790 H SER 97 H SER 97 -2.071 7.184 11.673 791 HA SER 97 HA SER 97 0.577 6.895 10.620 792 HB2 SER 97 2HB SER 97 0.151 7.218 13.030 793 HB3 SER 97 3HB SER 97 -0.730 5.693 13.100 794 HG SER 97 HG SER 97 2.039 6.078 12.595 795 H LEU 98 H LEU 98 1.717 4.693 10.598 796 HA LEU 98 HA LEU 98 0.674 2.910 8.735 797 HB2 LEU 98 2HB LEU 98 3.071 3.040 9.335 798 HB3 LEU 98 3HB LEU 98 2.722 2.382 10.927 799 HG LEU 98 HG LEU 98 2.016 0.224 9.845 800 HD11 LEU 98 1HD1 LEU 98 1.367 1.037 7.639 801 HD12 LEU 98 2HD1 LEU 98 2.582 -0.231 7.503 802 HD13 LEU 98 3HD1 LEU 98 3.043 1.457 7.274 803 HD21 LEU 98 3HD2 LEU 98 4.273 0.466 10.750 804 HD22 LEU 98 1HD2 LEU 98 4.847 1.103 9.204 805 HD23 LEU 98 2HD2 LEU 98 4.279 -0.566 9.323 806 H GLU 99 H GLU 99 0.544 2.792 12.263 807 HA GLU 99 HA GLU 99 -0.832 0.248 12.406 808 HB2 GLU 99 2HB GLU 99 -0.230 2.258 14.615 809 HB3 GLU 99 3HB GLU 99 -0.739 0.584 14.838 810 HG2 GLU 99 2HG GLU 99 1.353 -0.160 13.679 811 HG3 GLU 99 3HG GLU 99 1.868 1.522 13.596 812 H SER 100 H SER 100 -1.676 3.685 12.817 813 HA SER 100 HA SER 100 -4.280 3.400 13.862 814 HB2 SER 100 2HB SER 100 -3.180 5.659 12.125 815 HB3 SER 100 3HB SER 100 -4.618 5.753 13.139 816 HG SER 100 HG SER 100 -2.786 4.976 14.775 817 H ALA 101 H ALA 101 -3.209 3.949 10.508 818 HA ALA 101 HA ALA 101 -5.702 3.847 9.220 819 HB1 ALA 101 3HB ALA 101 -3.679 4.815 8.213 820 HB2 ALA 101 1HB ALA 101 -4.398 3.601 7.151 821 HB3 ALA 101 2HB ALA 101 -2.956 3.208 8.095 822 H ALA 102 H ALA 102 -3.519 1.335 10.279 823 HA ALA 102 HA ALA 102 -4.555 -0.864 8.827 824 HB1 ALA 102 3HB ALA 102 -3.408 -2.239 10.502 825 HB2 ALA 102 1HB ALA 102 -3.189 -0.823 11.538 826 HB3 ALA 102 2HB ALA 102 -2.380 -0.907 9.973 827 H GLU 103 H GLU 103 -5.240 0.419 12.082 828 HA GLU 103 HA GLU 103 -7.175 -1.485 12.890 829 HB2 GLU 103 2HB GLU 103 -6.952 1.420 13.800 830 HB3 GLU 103 3HB GLU 103 -7.722 0.100 14.679 831 HG2 GLU 103 2HG GLU 103 -5.559 -1.012 14.960 832 HG3 GLU 103 3HG GLU 103 -4.770 0.242 14.021 833 H GLN 104 H GLN 104 -7.461 1.617 11.249 834 HA GLN 104 HA GLN 104 -10.304 1.817 11.206 835 HB2 GLN 104 2HB GLN 104 -8.169 3.163 9.513 836 HB3 GLN 104 3HB GLN 104 -9.868 3.626 9.506 837 HG2 GLN 104 2HG GLN 104 -9.745 4.340 11.820 838 HG3 GLN 104 3HG GLN 104 -8.100 3.715 11.969 839 HE21 GLN 104 1HE2 GLN 104 -6.418 4.835 10.921 840 HE22 GLN 104 2HE2 GLN 104 -6.576 6.480 10.432 841 H ALA 105 H ALA 105 -7.946 0.393 8.995 842 HA ALA 105 HA ALA 105 -9.896 -0.174 6.905 843 HB1 ALA 105 3HB ALA 105 -8.013 -1.262 5.752 844 HB2 ALA 105 1HB ALA 105 -7.007 -1.074 7.195 845 HB3 ALA 105 2HB ALA 105 -7.569 0.349 6.316 846 H GLY 106 H GLY 106 -8.722 -1.744 9.766 847 HA2 GLY 106 2HA GLY 106 -9.371 -3.714 10.767 848 HA3 GLY 106 3HA GLY 106 -10.448 -4.034 9.414 849 H ILE 107 H ILE 107 -6.955 -3.562 9.701 850 HA ILE 107 HA ILE 107 -6.397 -6.202 8.462 851 HB ILE 107 HB ILE 107 -4.419 -3.873 8.658 852 HG12 ILE 107 2HG1 ILE 107 -6.187 -4.457 6.242 853 HG13 ILE 107 3HG1 ILE 107 -6.415 -3.108 7.350 854 HG21 ILE 107 1HG2 ILE 107 -3.224 -5.035 6.857 855 HG22 ILE 107 2HG2 ILE 107 -4.481 -6.268 6.787 856 HG23 ILE 107 3HG2 ILE 107 -3.473 -6.121 8.226 857 HD11 ILE 107 3HD1 ILE 107 -4.233 -2.208 6.709 858 HD12 ILE 107 1HD1 ILE 107 -5.312 -2.399 5.329 859 HD13 ILE 107 2HD1 ILE 107 -4.007 -3.554 5.585 860 H VAL 108 H VAL 108 -4.708 -7.482 9.514 861 HA VAL 108 HA VAL 108 -4.540 -7.155 12.365 862 HB VAL 108 HB VAL 108 -2.861 -9.041 10.651 863 HG11 VAL 108 1HG1 VAL 108 -3.631 -9.177 13.590 864 HG12 VAL 108 2HG1 VAL 108 -2.031 -8.795 12.941 865 HG13 VAL 108 3HG1 VAL 108 -2.715 -10.404 12.708 866 HG21 VAL 108 3HG2 VAL 108 -5.604 -9.581 11.856 867 HG22 VAL 108 1HG2 VAL 108 -4.575 -10.777 11.060 868 HG23 VAL 108 2HG2 VAL 108 -5.232 -9.426 10.136 869 H VAL 109 H VAL 109 -3.383 -5.570 13.171 870 HA VAL 109 HA VAL 109 -1.622 -3.916 11.792 871 HB VAL 109 HB VAL 109 -1.940 -4.212 14.815 872 HG11 VAL 109 1HG1 VAL 109 0.098 -2.953 14.302 873 HG12 VAL 109 2HG1 VAL 109 -1.129 -1.876 14.970 874 HG13 VAL 109 3HG1 VAL 109 -0.805 -1.873 13.236 875 HG21 VAL 109 3HG2 VAL 109 -3.589 -2.392 14.666 876 HG22 VAL 109 1HG2 VAL 109 -4.085 -3.755 13.660 877 HG23 VAL 109 2HG2 VAL 109 -3.382 -2.320 12.915 878 H ASP 110 H ASP 110 -0.916 -6.411 14.230 879 HA ASP 110 HA ASP 110 1.845 -6.082 14.470 880 HB2 ASP 110 2HB ASP 110 0.584 -7.417 16.077 881 HB3 ASP 110 3HB ASP 110 0.150 -8.593 14.840 882 H GLU 111 H GLU 111 0.001 -8.106 12.196 883 HA GLU 111 HA GLU 111 2.143 -9.465 10.986 884 HB2 GLU 111 2HB GLU 111 -0.595 -8.708 9.918 885 HB3 GLU 111 3HB GLU 111 0.542 -9.674 8.988 886 HG2 GLU 111 2HG GLU 111 -0.635 -10.434 11.671 887 HG3 GLU 111 3HG GLU 111 -1.176 -11.031 10.104 888 H LEU 112 H LEU 112 0.430 -6.471 9.879 889 HA LEU 112 HA LEU 112 2.151 -6.201 7.607 890 HB2 LEU 112 2HB LEU 112 1.032 -4.120 7.102 891 HB3 LEU 112 3HB LEU 112 -0.123 -5.356 7.553 892 HG LEU 112 HG LEU 112 -0.013 -4.164 9.938 893 HD11 LEU 112 1HD1 LEU 112 0.223 -1.727 9.823 894 HD12 LEU 112 2HD1 LEU 112 0.749 -1.840 8.142 895 HD13 LEU 112 3HD1 LEU 112 1.742 -2.529 9.427 896 HD21 LEU 112 3HD2 LEU 112 -1.553 -3.006 7.615 897 HD22 LEU 112 1HD2 LEU 112 -1.926 -2.810 9.326 898 HD23 LEU 112 2HD2 LEU 112 -2.012 -4.399 8.598 899 H VAL 113 H VAL 113 2.214 -4.762 10.841 900 HA VAL 113 HA VAL 113 4.165 -2.790 10.354 901 HB VAL 113 HB VAL 113 3.458 -4.225 12.959 902 HG11 VAL 113 1HG1 VAL 113 5.352 -1.855 12.646 903 HG12 VAL 113 2HG1 VAL 113 5.809 -3.480 13.161 904 HG13 VAL 113 3HG1 VAL 113 4.759 -2.497 14.182 905 HG21 VAL 113 3HG2 VAL 113 2.872 -1.405 11.975 906 HG22 VAL 113 1HG2 VAL 113 2.373 -2.074 13.535 907 HG23 VAL 113 2HG2 VAL 113 1.717 -2.737 12.036 908 H GLN 114 H GLN 114 4.472 -6.245 11.228 909 HA GLN 114 HA GLN 114 7.295 -6.295 11.378 910 HB2 GLN 114 2HB GLN 114 5.352 -8.512 10.631 911 HB3 GLN 114 3HB GLN 114 7.079 -8.770 10.852 912 HG2 GLN 114 2HG GLN 114 5.097 -7.875 12.957 913 HG3 GLN 114 3HG GLN 114 5.899 -9.439 12.854 914 HE21 GLN 114 1HE2 GLN 114 6.223 -6.107 13.756 915 HE22 GLN 114 2HE2 GLN 114 7.756 -6.247 14.540 916 H THR 115 H THR 115 5.169 -7.185 8.580 917 HA THR 115 HA THR 115 7.401 -7.714 6.890 918 HB THR 115 HB THR 115 5.160 -8.739 6.522 919 HG1 THR 115 HG1 THR 115 6.487 -7.396 4.402 920 HG21 THR 115 3HG2 THR 115 4.377 -6.047 5.364 921 HG22 THR 115 1HG2 THR 115 3.735 -6.754 6.851 922 HG23 THR 115 2HG2 THR 115 3.421 -7.528 5.298 923 H VAL 116 H VAL 116 5.787 -4.702 7.621 924 HA VAL 116 HA VAL 116 6.888 -3.267 5.337 925 HB VAL 116 HB VAL 116 5.309 -2.264 7.749 926 HG11 VAL 116 1HG1 VAL 116 5.187 -0.048 6.643 927 HG12 VAL 116 2HG1 VAL 116 6.307 -0.607 5.397 928 HG13 VAL 116 3HG1 VAL 116 6.848 -0.469 7.070 929 HG21 VAL 116 3HG2 VAL 116 3.509 -1.843 6.110 930 HG22 VAL 116 1HG2 VAL 116 3.986 -3.543 6.103 931 HG23 VAL 116 2HG2 VAL 116 4.530 -2.470 4.812 932 H LYS 117 H LYS 117 7.585 -3.486 8.871 933 HA LYS 117 HA LYS 117 9.670 -1.493 8.772 934 HB2 LYS 117 2HB LYS 117 10.096 -1.957 11.075 935 HB3 LYS 117 3HB LYS 117 8.358 -2.125 10.868 936 HG2 LYS 117 2HG LYS 117 8.711 -4.632 10.718 937 HG3 LYS 117 3HG LYS 117 10.395 -4.358 11.166 938 HD2 LYS 117 2HD LYS 117 7.964 -3.627 12.851 939 HD3 LYS 117 3HD LYS 117 9.017 -5.018 13.113 940 HE2 LYS 117 2HE LYS 117 10.917 -3.480 13.540 941 HE3 LYS 117 3HE LYS 117 9.838 -2.100 13.310 942 HZ1 LYS 117 3HZ LYS 117 8.549 -2.800 15.203 943 HZ2 LYS 117 1HZ LYS 117 10.167 -2.667 15.665 944 HZ3 LYS 117 2HZ LYS 117 9.486 -4.188 15.401 945 H ASN 118 H ASN 118 9.534 -4.967 8.444 946 HA ASN 118 HA ASN 118 12.372 -5.447 8.487 947 HB2 ASN 118 2HB ASN 118 10.067 -7.222 7.559 948 HB3 ASN 118 3HB ASN 118 11.748 -7.749 7.663 949 HD21 ASN 118 1HD2 ASN 118 9.377 -8.751 9.085 950 HD22 ASN 118 2HD2 ASN 118 9.732 -8.601 10.770 951 H TYR 119 H TYR 119 9.870 -4.933 6.022 952 HA TYR 119 HA TYR 119 11.417 -5.097 3.702 953 HB2 TYR 119 2HB TYR 119 9.043 -4.729 3.450 954 HB3 TYR 119 3HB TYR 119 9.091 -3.266 4.417 955 HD1 TYR 119 HD1 TYR 119 10.359 -4.655 1.145 956 HD2 TYR 119 HD2 TYR 119 9.167 -1.163 3.315 957 HE1 TYR 119 HE1 TYR 119 10.529 -3.311 -0.908 958 HE2 TYR 119 HE2 TYR 119 9.347 0.176 1.261 959 HH TYR 119 HH TYR 119 10.353 0.146 -0.888 960 H GLN 120 H GLN 120 10.757 -2.216 5.707 961 HA GLN 120 HA GLN 120 12.568 -0.463 4.482 962 HB2 GLN 120 2HB GLN 120 11.438 -0.413 7.315 963 HB3 GLN 120 3HB GLN 120 12.295 0.930 6.564 964 HG2 GLN 120 2HG GLN 120 10.489 0.900 4.752 965 HG3 GLN 120 3HG GLN 120 9.597 -0.211 5.784 966 HE21 GLN 120 1HE2 GLN 120 8.833 2.426 4.878 967 HE22 GLN 120 2HE2 GLN 120 8.587 3.402 6.278 968 H GLY 121 H GLY 121 13.100 -2.984 6.777 969 HA2 GLY 121 2HA GLY 121 15.656 -2.184 7.776 970 HA3 GLY 121 3HA GLY 121 14.943 -3.792 7.853 971 H TYR 122 H TYR 122 14.731 -4.801 5.464 972 HA TYR 122 HA TYR 122 17.442 -5.220 4.710 973 HB2 TYR 122 2HB TYR 122 16.618 -6.854 3.087 974 HB3 TYR 122 3HB TYR 122 15.966 -7.095 4.688 975 HD1 TYR 122 HD2 TYR 122 14.876 -5.261 1.536 976 HD2 TYR 122 HD1 TYR 122 13.794 -7.920 4.702 977 HE1 TYR 122 HE2 TYR 122 12.662 -5.587 0.515 978 HE2 TYR 122 HE1 TYR 122 11.592 -8.252 3.670 979 HH TYR 122 HH TYR 122 10.083 -7.131 2.134 980 H VAL 123 H VAL 123 15.106 -2.981 3.572 981 HA VAL 123 HA VAL 123 16.112 -2.389 1.001 982 HB VAL 123 HB VAL 123 14.622 -0.688 3.048 983 HG11 VAL 123 1HG1 VAL 123 15.439 0.168 0.250 984 HG12 VAL 123 2HG1 VAL 123 15.969 0.894 1.769 985 HG13 VAL 123 3HG1 VAL 123 14.282 1.026 1.272 986 HG21 VAL 123 3HG2 VAL 123 13.344 -2.505 1.934 987 HG22 VAL 123 1HG2 VAL 123 13.728 -1.807 0.365 988 HG23 VAL 123 2HG2 VAL 123 12.722 -0.912 1.505 989 H GLN 124 H GLN 124 16.956 -1.001 4.219 990 HA GLN 124 HA GLN 124 19.005 0.721 3.113 991 HB2 GLN 124 2HB GLN 124 19.507 1.326 5.483 992 HB3 GLN 124 3HB GLN 124 17.809 1.517 5.060 993 HG2 GLN 124 2HG GLN 124 17.308 -0.647 6.156 994 HG3 GLN 124 3HG GLN 124 19.000 -0.783 6.638 995 HE21 GLN 124 1HE2 GLN 124 16.577 -0.689 8.264 996 HE22 GLN 124 2HE2 GLN 124 16.790 0.632 9.358 997 H ASP 125 H ASP 125 18.928 -2.521 4.400 998 HA ASP 125 HA ASP 125 21.759 -2.946 4.573 999 HB2 ASP 125 2HB ASP 125 19.370 -4.780 4.185 1000 HB3 ASP 125 3HB ASP 125 21.005 -5.425 4.125 1001 H GLY 126 H GLY 126 19.511 -2.709 1.947 1002 HA2 GLY 126 2HA GLY 126 19.901 -2.382 -0.291 1003 HA3 GLY 126 3HA GLY 126 21.613 -2.689 -0.037 1004 H HIS 127 H HIS 127 18.813 -4.769 0.707 1005 HA HIS 127 HA HIS 127 19.226 -6.551 -1.531 1006 HB2 HIS 127 2HB HIS 127 21.085 -7.270 -0.063 1007 HB3 HIS 127 3HB HIS 127 19.976 -7.477 1.285 1008 HD1 HIS 127 HD1 HIS 127 21.063 -9.080 -1.927 1009 HD2 HIS 127 HD2 HIS 127 18.517 -9.891 1.260 1010 HE1 HIS 127 HE1 HIS 127 20.442 -11.504 -2.149 1011 HE2 HIS 127 HE2 HIS 127 18.781 -11.922 -0.306 1012 H ASP 128 H ASP 128 17.115 -7.000 -2.074 1013 HA ASP 128 HA ASP 128 14.956 -7.008 -0.183 1014 HB2 ASP 128 2HB ASP 128 13.489 -7.453 -2.010 1015 HB3 ASP 128 3HB ASP 128 14.750 -6.435 -2.690 1016 H HIS 129 H HIS 129 13.713 -8.828 0.513 1017 HA HIS 129 HA HIS 129 15.216 -11.375 0.582 1018 HB2 HIS 129 2HB HIS 129 13.164 -10.184 2.474 1019 HB3 HIS 129 3HB HIS 129 13.574 -11.894 2.533 1020 HD1 HIS 129 HD1 HIS 129 14.473 -11.491 4.972 1021 HD2 HIS 129 HD2 HIS 129 16.561 -9.454 2.008 1022 HE1 HIS 129 HE1 HIS 129 16.599 -10.703 6.052 1023 HE2 HIS 129 HE2 HIS 129 17.905 -9.630 4.194 1024 H ASP 130 H ASP 130 11.921 -10.083 0.111 1025 HA ASP 130 HA ASP 130 11.171 -12.624 -1.233 1026 HB2 ASP 130 2HB ASP 130 9.398 -10.751 0.387 1027 HB3 ASP 130 3HB ASP 130 8.814 -12.134 -0.533 1028 H PHE 131 H PHE 131 11.743 -11.957 -3.247 1029 HA PHE 131 HA PHE 131 11.546 -11.059 -5.309 1030 HB2 PHE 131 2HB PHE 131 9.119 -11.179 -6.185 1031 HB3 PHE 131 3HB PHE 131 9.812 -12.645 -5.523 1032 HD1 PHE 131 HD2 PHE 131 7.501 -9.817 -4.717 1033 HD2 PHE 131 HD1 PHE 131 8.694 -13.819 -3.779 1034 HE1 PHE 131 HE2 PHE 131 5.581 -10.041 -3.200 1035 HE2 PHE 131 HE1 PHE 131 6.771 -14.030 -2.264 1036 HZ PHE 131 HZ PHE 131 5.223 -12.141 -1.964 1037 H GLY 132 H GLY 132 11.838 -8.907 -3.433 1038 HA2 GLY 132 2HA GLY 132 9.976 -6.798 -3.888 1039 HA3 GLY 132 3HA GLY 132 11.586 -6.639 -3.191 1040 H ARG 133 H ARG 133 13.297 -6.008 -4.477 1041 HA ARG 133 HA ARG 133 13.530 -6.215 -7.234 1042 HB2 ARG 133 2HB ARG 133 13.245 -3.856 -8.004 1043 HB3 ARG 133 3HB ARG 133 11.739 -4.615 -7.514 1044 HG2 ARG 133 2HG ARG 133 12.019 -3.389 -5.270 1045 HG3 ARG 133 3HG ARG 133 13.293 -2.456 -6.064 1046 HD2 ARG 133 2HD ARG 133 11.650 -1.806 -7.838 1047 HD3 ARG 133 3HD ARG 133 10.393 -2.662 -6.943 1048 HE ARG 133 HE ARG 133 11.723 -0.624 -5.402 1049 HH11 ARG 133 1HH1 ARG 133 9.086 -1.250 -7.654 1050 HH12 ARG 133 2HH1 ARG 133 8.204 0.171 -7.188 1051 HH21 ARG 133 1HH2 ARG 133 10.585 1.310 -4.901 1052 HH22 ARG 133 2HH2 ARG 133 9.044 1.607 -5.644 1053 H ASP 134 H ASP 134 15.170 -4.227 -7.978 1054 HA ASP 134 HA ASP 134 17.597 -4.864 -6.765 1055 HB2 ASP 134 2HB ASP 134 17.233 -3.973 -9.131 1056 HB3 ASP 134 3HB ASP 134 17.023 -2.376 -8.438 1057 HA PRO 135 HA PRO 135 17.875 -2.431 -2.972 1058 HB2 PRO 135 2HB PRO 135 20.577 -1.556 -3.364 1059 HB3 PRO 135 3HB PRO 135 20.029 -2.995 -2.494 1060 HG2 PRO 135 2HG PRO 135 20.942 -2.759 -5.333 1061 HG3 PRO 135 3HG PRO 135 21.243 -4.056 -4.150 1062 HD2 PRO 135 2HD PRO 135 19.459 -4.460 -6.045 1063 HD3 PRO 135 3HD PRO 135 19.065 -4.944 -4.377 1064 H LYS 136 H LYS 136 18.989 -0.860 -5.981 1065 HA LYS 136 HA LYS 136 19.007 1.803 -4.907 1066 HB2 LYS 136 2HB LYS 136 19.373 2.577 -7.172 1067 HB3 LYS 136 3HB LYS 136 20.315 1.108 -6.940 1068 HG2 LYS 136 2HG LYS 136 18.509 -0.155 -8.143 1069 HG3 LYS 136 3HG LYS 136 17.699 1.380 -8.452 1070 HD2 LYS 136 2HD LYS 136 18.947 0.732 -10.427 1071 HD3 LYS 136 3HD LYS 136 19.726 2.152 -9.713 1072 HE2 LYS 136 2HE LYS 136 21.395 0.617 -8.642 1073 HE3 LYS 136 3HE LYS 136 20.621 -0.736 -9.476 1074 HZ1 LYS 136 3HZ LYS 136 21.228 0.216 -11.580 1075 HZ2 LYS 136 1HZ LYS 136 22.615 0.085 -10.617 1076 HZ3 LYS 136 2HZ LYS 136 21.877 1.589 -10.838 1077 H TYR 137 H TYR 137 16.552 -0.198 -6.402 1078 HA TYR 137 HA TYR 137 14.609 2.002 -6.582 1079 HB2 TYR 137 2HB TYR 137 14.322 -0.952 -7.287 1080 HB3 TYR 137 3HB TYR 137 13.125 0.300 -7.608 1081 HD1 TYR 137 HD2 TYR 137 14.094 2.404 -8.976 1082 HD2 TYR 137 HD1 TYR 137 15.739 -1.530 -9.074 1083 HE1 TYR 137 HE2 TYR 137 15.134 2.884 -11.146 1084 HE2 TYR 137 HE1 TYR 137 16.793 -1.050 -11.238 1085 HH TYR 137 HH TYR 137 16.343 0.518 -13.185 1086 H LEU 138 H LEU 138 15.482 -0.589 -4.440 1087 HA LEU 138 HA LEU 138 13.124 -0.671 -2.853 1088 HB2 LEU 138 2HB LEU 138 16.042 -1.180 -2.142 1089 HB3 LEU 138 3HB LEU 138 14.725 -1.442 -1.020 1090 HG LEU 138 HG LEU 138 15.173 -2.963 -3.613 1091 HD11 LEU 138 1HD1 LEU 138 15.492 -3.891 -0.738 1092 HD12 LEU 138 2HD1 LEU 138 16.805 -3.517 -1.858 1093 HD13 LEU 138 3HD1 LEU 138 15.726 -4.867 -2.193 1094 HD21 LEU 138 3HD2 LEU 138 13.324 -4.420 -2.904 1095 HD22 LEU 138 1HD2 LEU 138 12.775 -2.764 -3.152 1096 HD23 LEU 138 2HD2 LEU 138 13.013 -3.376 -1.512 1097 H HIS 139 H HIS 139 12.263 1.123 -1.942 1098 HA HIS 139 HA HIS 139 14.004 2.989 -0.438 1099 HB2 HIS 139 2HB HIS 139 11.795 3.733 -2.401 1100 HB3 HIS 139 3HB HIS 139 12.291 4.834 -1.121 1101 HD1 HIS 139 HD1 HIS 139 14.192 6.352 -1.658 1102 HD2 HIS 139 HD2 HIS 139 14.026 3.111 -4.240 1103 HE1 HIS 139 HE1 HIS 139 15.956 6.772 -3.394 1104 HE2 HIS 139 HE2 HIS 139 15.990 4.691 -4.791 1105 H GLN 140 H GLN 140 13.094 3.859 1.413 1106 HA GLN 140 HA GLN 140 10.811 2.424 2.567 1107 HB2 GLN 140 2HB GLN 140 12.634 4.487 3.883 1108 HB3 GLN 140 3HB GLN 140 11.437 3.489 4.691 1109 HG2 GLN 140 2HG GLN 140 13.271 2.229 5.201 1110 HG3 GLN 140 3HG GLN 140 12.923 1.515 3.637 1111 HE21 GLN 140 1HE2 GLN 140 15.419 1.533 5.011 1112 HE22 GLN 140 2HE2 GLN 140 16.552 2.365 4.007 1113 H PHE 141 H PHE 141 9.145 3.630 3.666 1114 HA PHE 141 HA PHE 141 7.998 5.683 2.025 1115 HB2 PHE 141 2HB PHE 141 6.996 4.522 4.664 1116 HB3 PHE 141 3HB PHE 141 6.054 5.484 3.530 1117 HD1 PHE 141 HD1 PHE 141 5.570 4.545 1.241 1118 HD2 PHE 141 HD2 PHE 141 7.179 2.146 4.394 1119 HE1 PHE 141 HE1 PHE 141 4.859 2.519 0.080 1120 HE2 PHE 141 HE2 PHE 141 6.464 0.118 3.215 1121 HZ PHE 141 HZ PHE 141 5.307 0.301 1.043 1122 H GLU 142 H GLU 142 9.276 7.504 2.245 1123 HA GLU 142 HA GLU 142 9.867 8.655 4.849 1124 HB2 GLU 142 2HB GLU 142 10.298 9.730 2.030 1125 HB3 GLU 142 3HB GLU 142 10.891 10.497 3.502 1126 HG2 GLU 142 2HG GLU 142 12.324 8.555 3.968 1127 HG3 GLU 142 3HG GLU 142 11.680 7.721 2.554 1128 H GLY 143 H GLY 143 7.970 9.128 5.829 1129 HA2 GLY 143 2HA GLY 143 6.559 11.490 5.357 1130 HA3 GLY 143 3HA GLY 143 5.626 10.174 4.636 1131 H GLU 144 H GLU 144 4.946 11.858 6.923 1132 HA GLU 144 HA GLU 144 5.148 10.283 9.343 1133 HB2 GLU 144 2HB GLU 144 3.329 12.672 8.787 1134 HB3 GLU 144 3HB GLU 144 3.817 12.056 10.365 1135 HG2 GLU 144 2HG GLU 144 6.151 12.738 9.914 1136 HG3 GLU 144 3HG GLU 144 5.672 13.341 8.329 1137 H THR 145 H THR 145 2.530 11.229 7.114 1138 HA THR 145 HA THR 145 0.635 9.363 8.319 1139 HB THR 145 HB THR 145 0.237 11.259 5.960 1140 HG1 THR 145 HG1 THR 145 0.017 12.777 7.381 1141 HG21 THR 145 3HG2 THR 145 -1.447 9.437 6.054 1142 HG22 THR 145 1HG2 THR 145 -2.162 11.013 6.407 1143 HG23 THR 145 2HG2 THR 145 -1.822 9.885 7.720 1144 H PHE 146 H PHE 146 0.519 7.318 7.619 1145 HA PHE 146 HA PHE 146 1.188 6.523 4.880 1146 HB2 PHE 146 2HB PHE 146 0.398 5.001 7.391 1147 HB3 PHE 146 3HB PHE 146 0.353 4.215 5.818 1148 HD1 PHE 146 HD2 PHE 146 2.682 6.051 8.126 1149 HD2 PHE 146 HD1 PHE 146 2.292 3.239 4.931 1150 HE1 PHE 146 HE2 PHE 146 5.072 5.486 8.315 1151 HE2 PHE 146 HE1 PHE 146 4.671 2.682 5.130 1152 HZ PHE 146 HZ PHE 146 6.069 3.798 6.814 1153 H TYR 147 H TYR 147 -0.297 5.724 3.422 1154 HA TYR 147 HA TYR 147 -3.186 5.969 4.016 1155 HB2 TYR 147 2HB TYR 147 -1.697 6.613 1.429 1156 HB3 TYR 147 3HB TYR 147 -3.445 6.406 1.503 1157 HD1 TYR 147 HD1 TYR 147 -0.658 8.458 2.959 1158 HD2 TYR 147 HD2 TYR 147 -4.829 8.259 2.051 1159 HE1 TYR 147 HE1 TYR 147 -0.914 10.808 3.603 1160 HE2 TYR 147 HE2 TYR 147 -5.076 10.619 2.699 1161 HH TYR 147 HH TYR 147 -2.371 12.674 3.245 1162 H ILE 148 H ILE 148 -4.240 4.136 3.870 1163 HA ILE 148 HA ILE 148 -3.037 1.806 2.493 1164 HB ILE 148 HB ILE 148 -4.807 1.931 4.977 1165 HG12 ILE 148 2HG1 ILE 148 -1.937 0.976 4.542 1166 HG13 ILE 148 3HG1 ILE 148 -2.441 2.391 5.455 1167 HG21 ILE 148 1HG2 ILE 148 -3.860 -0.548 3.510 1168 HG22 ILE 148 2HG2 ILE 148 -5.520 0.052 3.547 1169 HG23 ILE 148 3HG2 ILE 148 -4.756 -0.515 5.030 1170 HD11 ILE 148 3HD1 ILE 148 -1.786 0.640 6.955 1171 HD12 ILE 148 1HD1 ILE 148 -2.907 -0.497 6.203 1172 HD13 ILE 148 2HD1 ILE 148 -3.525 0.892 7.100 1173 H ILE 149 H ILE 149 -4.005 1.563 0.602 1174 HA ILE 149 HA ILE 149 -6.803 2.389 0.188 1175 HB ILE 149 HB ILE 149 -4.684 1.710 -1.908 1176 HG12 ILE 149 2HG1 ILE 149 -3.875 3.657 -0.709 1177 HG13 ILE 149 3HG1 ILE 149 -4.513 4.216 -2.247 1178 HG21 ILE 149 1HG2 ILE 149 -6.185 2.884 -3.488 1179 HG22 ILE 149 2HG2 ILE 149 -7.368 3.100 -2.198 1180 HG23 ILE 149 3HG2 ILE 149 -6.966 1.477 -2.760 1181 HD11 ILE 149 3HD1 ILE 149 -5.092 5.729 -0.456 1182 HD12 ILE 149 1HD1 ILE 149 -5.884 4.431 0.435 1183 HD13 ILE 149 2HD1 ILE 149 -6.551 4.983 -1.104 1184 H GLU 150 H GLU 150 -8.232 0.773 0.428 1185 HA GLU 150 HA GLU 150 -7.749 -1.974 0.325 1186 HB2 GLU 150 2HB GLU 150 -9.725 -1.121 1.459 1187 HB3 GLU 150 3HB GLU 150 -10.368 -0.448 -0.040 1188 HG2 GLU 150 2HG GLU 150 -10.666 -2.715 -0.954 1189 HG3 GLU 150 3HG GLU 150 -9.931 -3.409 0.483 1190 H GLN 151 H GLN 151 -7.698 -3.419 -1.233 1191 HA GLN 151 HA GLN 151 -8.388 -2.747 -4.034 1192 HB2 GLN 151 2HB GLN 151 -6.148 -4.618 -3.130 1193 HB3 GLN 151 3HB GLN 151 -6.506 -4.112 -4.774 1194 HG2 GLN 151 2HG GLN 151 -5.535 -2.247 -2.590 1195 HG3 GLN 151 3HG GLN 151 -4.485 -3.030 -3.768 1196 HE21 GLN 151 1HE2 GLN 151 -4.993 -0.173 -3.263 1197 HE22 GLN 151 2HE2 GLN 151 -5.508 0.489 -4.772 1198 H ARG 152 H ARG 152 -10.350 -3.767 -4.105 1199 HA ARG 152 HA ARG 152 -10.640 -6.535 -3.135 1200 HB2 ARG 152 2HB ARG 152 -12.629 -4.390 -3.946 1201 HB3 ARG 152 3HB ARG 152 -13.125 -6.075 -3.905 1202 HG2 ARG 152 2HG ARG 152 -11.979 -4.584 -1.522 1203 HG3 ARG 152 3HG ARG 152 -13.702 -4.793 -1.841 1204 HD2 ARG 152 2HD ARG 152 -13.372 -7.276 -1.755 1205 HD3 ARG 152 3HD ARG 152 -11.680 -7.002 -1.319 1206 HE ARG 152 HE ARG 152 -13.338 -5.591 0.469 1207 HH11 ARG 152 1HH1 ARG 152 -12.391 -8.926 -0.245 1208 HH12 ARG 152 2HH1 ARG 152 -12.694 -9.472 1.373 1209 HH21 ARG 152 1HH2 ARG 152 -13.750 -6.344 2.560 1210 HH22 ARG 152 2HH2 ARG 152 -13.464 -8.009 2.960 1211 H LEU 153 H LEU 153 -11.759 -8.082 -4.530 1212 HA LEU 153 HA LEU 153 -10.975 -8.140 -7.295 1213 HB2 LEU 153 2HB LEU 153 -12.934 -9.862 -5.722 1214 HB3 LEU 153 3HB LEU 153 -12.414 -10.208 -7.365 1215 HG LEU 153 HG LEU 153 -10.534 -10.120 -4.972 1216 HD11 LEU 153 1HD1 LEU 153 -12.145 -11.946 -4.705 1217 HD12 LEU 153 2HD1 LEU 153 -10.530 -12.565 -5.034 1218 HD13 LEU 153 3HD1 LEU 153 -11.746 -12.557 -6.314 1219 HD21 LEU 153 3HD2 LEU 153 -10.091 -11.102 -7.815 1220 HD22 LEU 153 1HD2 LEU 153 -8.936 -11.238 -6.484 1221 HD23 LEU 153 2HD2 LEU 153 -9.401 -9.649 -7.085 1222 H GLU 154 H GLU 154 -12.693 -8.510 -9.012 1223 HA GLU 154 HA GLU 154 -14.387 -6.271 -9.310 1224 HB2 GLU 154 2HB GLU 154 -15.143 -7.412 -11.388 1225 HB3 GLU 154 3HB GLU 154 -13.390 -7.408 -11.220 1226 HG2 GLU 154 2HG GLU 154 -13.463 -9.760 -10.427 1227 HG3 GLU 154 3HG GLU 154 -15.217 -9.759 -10.633 1228 H HIS 155 H HIS 155 -16.785 -6.705 -10.116 1229 HA HIS 155 HA HIS 155 -18.326 -7.220 -7.830 1230 HB2 HIS 155 2HB HIS 155 -20.305 -6.856 -9.253 1231 HB3 HIS 155 3HB HIS 155 -19.066 -5.655 -9.573 1232 HD1 HIS 155 HD1 HIS 155 -21.501 -6.790 -11.468 1233 HD2 HIS 155 HD2 HIS 155 -17.409 -7.345 -11.924 1234 HE1 HIS 155 HE1 HIS 155 -21.145 -7.254 -13.904 1235 HE2 HIS 155 HE2 HIS 155 -18.709 -7.800 -14.102 1236 H HIS 156 H HIS 156 -17.823 -9.272 -7.078 1237 HA HIS 156 HA HIS 156 -19.032 -11.565 -8.525 1238 HB2 HIS 156 2HB HIS 156 -17.561 -13.047 -7.265 1239 HB3 HIS 156 3HB HIS 156 -16.597 -11.808 -8.053 1240 HD1 HIS 156 HD1 HIS 156 -17.639 -13.057 -4.684 1241 HD2 HIS 156 HD2 HIS 156 -15.207 -10.095 -6.289 1242 HE1 HIS 156 HE1 HIS 156 -16.279 -12.186 -2.770 1243 HE2 HIS 156 HE2 HIS 156 -14.992 -10.249 -3.720 1244 H HIS 157 H HIS 157 -19.015 -9.689 -5.575 1245 HA HIS 157 HA HIS 157 -20.970 -11.369 -4.219 1246 HB2 HIS 157 2HB HIS 157 -19.200 -10.111 -2.941 1247 HB3 HIS 157 3HB HIS 157 -19.929 -8.599 -3.465 1248 HD1 HIS 157 HD1 HIS 157 -21.776 -7.679 -2.018 1249 HD2 HIS 157 HD2 HIS 157 -20.986 -11.678 -1.196 1250 HE1 HIS 157 HE1 HIS 157 -23.149 -8.239 0.004 1251 HE2 HIS 157 HE2 HIS 157 -22.529 -10.609 0.576 1252 H HIS 158 H HIS 158 -22.747 -11.378 -5.561 1253 HA HIS 158 HA HIS 158 -23.992 -8.803 -6.344 1254 HB2 HIS 158 2HB HIS 158 -25.062 -10.068 -8.191 1255 HB3 HIS 158 3HB HIS 158 -23.306 -10.166 -8.264 1256 HD1 HIS 158 HD1 HIS 158 -26.337 -12.257 -7.382 1257 HD2 HIS 158 HD2 HIS 158 -22.299 -12.769 -8.215 1258 HE1 HIS 158 HE1 HIS 158 -26.002 -14.729 -7.599 1259 HE2 HIS 158 HE2 HIS 158 -23.539 -15.024 -7.994 1260 H HIS 159 H HIS 159 -26.413 -8.946 -6.597 1261 HA HIS 159 HA HIS 159 -27.873 -10.722 -4.807 1262 HB2 HIS 159 2HB HIS 159 -27.135 -9.044 -3.199 1263 HB3 HIS 159 3HB HIS 159 -27.600 -7.729 -4.270 1264 HD1 HIS 159 HD1 HIS 159 -29.121 -10.361 -2.006 1265 HD2 HIS 159 HD2 HIS 159 -30.242 -6.897 -4.016 1266 HE1 HIS 159 HE1 HIS 159 -31.411 -9.792 -1.158 1267 HE2 HIS 159 HE2 HIS 159 -32.094 -7.735 -2.427 1268 H HIS 160 H HIS 160 -29.827 -11.115 -5.651 1269 HA HIS 160 HA HIS 160 -30.881 -9.821 -7.953 1270 HB2 HIS 160 2HB HIS 160 -31.370 -12.181 -7.542 1271 HB3 HIS 160 3HB HIS 160 -32.152 -11.805 -6.010 1272 HD1 HIS 160 HD1 HIS 160 -32.663 -11.373 -9.745 1273 HD2 HIS 160 HD2 HIS 160 -34.862 -11.238 -6.219 1274 HE1 HIS 160 HE1 HIS 160 -35.066 -11.185 -10.449 1275 HE2 HIS 160 HE2 HIS 160 -36.373 -11.053 -8.303 Start of MODEL 17 1 H1 MET 1 1H MET 1 -10.643 4.219 -29.285 2 H2 MET 1 2H MET 1 -11.598 2.827 -29.295 3 H3 MET 1 3H MET 1 -9.916 2.697 -29.212 4 HA MET 1 HA MET 1 -11.669 3.899 -27.160 5 HB2 MET 1 2HB MET 1 -11.814 1.379 -27.351 6 HB3 MET 1 3HB MET 1 -10.083 1.288 -27.052 7 HG2 MET 1 2HG MET 1 -11.172 0.779 -24.995 8 HG3 MET 1 3HG MET 1 -10.514 2.405 -24.817 9 HE1 MET 1 3HE MET 1 -15.000 1.422 -25.409 10 HE2 MET 1 1HE MET 1 -13.735 0.209 -25.226 11 HE3 MET 1 2HE MET 1 -13.825 1.175 -26.701 12 H VAL 2 H VAL 2 -10.415 5.763 -26.856 13 HA VAL 2 HA VAL 2 -7.641 5.482 -25.913 14 HB VAL 2 HB VAL 2 -9.374 8.009 -25.980 15 HG11 VAL 2 1HG1 VAL 2 -7.493 8.172 -24.411 16 HG12 VAL 2 2HG1 VAL 2 -7.241 9.241 -25.790 17 HG13 VAL 2 3HG1 VAL 2 -6.357 7.716 -25.685 18 HG21 VAL 2 3HG2 VAL 2 -7.356 7.092 -28.069 19 HG22 VAL 2 1HG2 VAL 2 -8.200 8.644 -28.055 20 HG23 VAL 2 2HG2 VAL 2 -9.110 7.149 -28.268 21 H GLU 3 H GLU 3 -8.256 4.036 -24.237 22 HA GLU 3 HA GLU 3 -8.764 3.301 -22.209 23 HB2 GLU 3 2HB GLU 3 -8.806 6.249 -21.563 24 HB3 GLU 3 3HB GLU 3 -9.260 5.066 -20.343 25 HG2 GLU 3 2HG GLU 3 -6.910 5.730 -20.136 26 HG3 GLU 3 3HG GLU 3 -7.098 4.015 -20.448 27 HA PRO 4 HA PRO 4 -13.240 3.028 -22.202 28 HB2 PRO 4 2HB PRO 4 -13.562 1.125 -20.266 29 HB3 PRO 4 3HB PRO 4 -12.904 0.735 -21.868 30 HG2 PRO 4 2HG PRO 4 -11.486 1.036 -19.272 31 HG3 PRO 4 3HG PRO 4 -11.135 -0.048 -20.631 32 HD2 PRO 4 2HD PRO 4 -9.804 2.379 -20.089 33 HD3 PRO 4 3HD PRO 4 -9.744 1.491 -21.624 34 H GLY 5 H GLY 5 -14.911 2.717 -20.046 35 HA2 GLY 5 2HA GLY 5 -14.670 5.325 -18.752 36 HA3 GLY 5 3HA GLY 5 -16.055 4.247 -18.692 37 H VAL 6 H VAL 6 -12.636 4.218 -17.666 38 HA VAL 6 HA VAL 6 -13.415 3.535 -14.912 39 HB VAL 6 HB VAL 6 -11.456 1.925 -14.766 40 HG11 VAL 6 1HG1 VAL 6 -13.690 1.086 -16.659 41 HG12 VAL 6 2HG1 VAL 6 -13.754 1.070 -14.895 42 HG13 VAL 6 3HG1 VAL 6 -12.645 -0.008 -15.743 43 HG21 VAL 6 3HG2 VAL 6 -10.171 2.596 -16.735 44 HG22 VAL 6 1HG2 VAL 6 -11.484 2.101 -17.806 45 HG23 VAL 6 2HG2 VAL 6 -10.601 0.890 -16.869 46 H ALA 7 H ALA 7 -13.102 5.894 -14.899 47 HA ALA 7 HA ALA 7 -10.273 6.674 -14.412 48 HB1 ALA 7 3HB ALA 7 -11.046 9.010 -14.714 49 HB2 ALA 7 1HB ALA 7 -12.680 8.428 -15.049 50 HB3 ALA 7 2HB ALA 7 -11.354 8.028 -16.142 51 H LYS 8 H LYS 8 -13.052 5.735 -12.827 52 HA LYS 8 HA LYS 8 -13.206 7.582 -10.651 53 HB2 LYS 8 2HB LYS 8 -14.960 5.780 -11.628 54 HB3 LYS 8 3HB LYS 8 -14.219 4.725 -10.437 55 HG2 LYS 8 2HG LYS 8 -16.191 5.639 -9.445 56 HG3 LYS 8 3HG LYS 8 -14.823 6.446 -8.674 57 HD2 LYS 8 2HD LYS 8 -15.149 8.409 -10.163 58 HD3 LYS 8 3HD LYS 8 -16.524 7.607 -10.928 59 HE2 LYS 8 2HE LYS 8 -16.375 8.353 -7.981 60 HE3 LYS 8 3HE LYS 8 -17.175 9.315 -9.223 61 HZ1 LYS 8 3HZ LYS 8 -18.734 7.559 -9.594 62 HZ2 LYS 8 1HZ LYS 8 -18.690 7.894 -7.939 63 HZ3 LYS 8 2HZ LYS 8 -17.913 6.520 -8.543 64 H LEU 9 H LEU 9 -12.295 4.114 -10.581 65 HA LEU 9 HA LEU 9 -9.747 4.664 -9.336 66 HB2 LEU 9 2HB LEU 9 -11.287 4.629 -7.352 67 HB3 LEU 9 3HB LEU 9 -11.774 2.997 -7.780 68 HG LEU 9 HG LEU 9 -9.427 2.209 -7.409 69 HD11 LEU 9 1HD1 LEU 9 -8.197 4.257 -7.911 70 HD12 LEU 9 2HD1 LEU 9 -7.771 3.653 -6.313 71 HD13 LEU 9 3HD1 LEU 9 -8.853 5.040 -6.467 72 HD21 LEU 9 3HD2 LEU 9 -9.437 2.333 -4.959 73 HD22 LEU 9 1HD2 LEU 9 -11.057 2.031 -5.587 74 HD23 LEU 9 2HD2 LEU 9 -10.621 3.643 -5.012 75 H THR 10 H THR 10 -8.449 3.451 -10.472 76 HA THR 10 HA THR 10 -9.098 0.677 -11.229 77 HB THR 10 HB THR 10 -8.049 2.717 -13.257 78 HG1 THR 10 HG1 THR 10 -10.695 1.864 -12.696 79 HG21 THR 10 3HG2 THR 10 -7.520 0.342 -13.816 80 HG22 THR 10 1HG2 THR 10 -8.655 1.056 -14.965 81 HG23 THR 10 2HG2 THR 10 -9.239 -0.053 -13.723 82 H THR 11 H THR 11 -6.973 -0.296 -12.282 83 HA THR 11 HA THR 11 -4.985 -0.428 -10.382 84 HB THR 11 HB THR 11 -3.611 -1.570 -12.207 85 HG1 THR 11 HG1 THR 11 -4.388 -1.619 -14.245 86 HG21 THR 11 3HG2 THR 11 -6.510 -2.483 -11.932 87 HG22 THR 11 1HG2 THR 11 -5.198 -2.880 -10.820 88 HG23 THR 11 2HG2 THR 11 -5.166 -3.487 -12.477 89 H TYR 12 H TYR 12 -5.189 1.926 -13.029 90 HA TYR 12 HA TYR 12 -2.498 2.651 -13.250 91 HB2 TYR 12 2HB TYR 12 -3.182 4.649 -14.371 92 HB3 TYR 12 3HB TYR 12 -4.393 3.444 -14.769 93 HD1 TYR 12 HD1 TYR 12 -6.733 3.697 -13.934 94 HD2 TYR 12 HD2 TYR 12 -3.760 6.612 -12.961 95 HE1 TYR 12 HE1 TYR 12 -8.491 5.252 -13.181 96 HE2 TYR 12 HE2 TYR 12 -5.512 8.152 -12.213 97 HH TYR 12 HH TYR 12 -8.762 7.215 -11.755 98 H ALA 13 H ALA 13 -4.942 3.707 -10.914 99 HA ALA 13 HA ALA 13 -3.527 5.886 -9.774 100 HB1 ALA 13 3HB ALA 13 -5.211 5.757 -7.975 101 HB2 ALA 13 1HB ALA 13 -5.715 4.160 -8.552 102 HB3 ALA 13 2HB ALA 13 -5.966 5.586 -9.558 103 H SER 14 H SER 14 -3.680 2.441 -9.006 104 HA SER 14 HA SER 14 -2.085 2.672 -6.591 105 HB2 SER 14 2HB SER 14 -2.380 0.154 -6.516 106 HB3 SER 14 3HB SER 14 -3.888 1.068 -6.537 107 HG SER 14 HG SER 14 -4.348 -0.214 -8.132 108 H LYS 15 H LYS 15 -1.518 1.900 -9.966 109 HA LYS 15 HA LYS 15 1.057 0.627 -9.455 110 HB2 LYS 15 2HB LYS 15 -0.414 1.208 -12.058 111 HB3 LYS 15 3HB LYS 15 1.190 0.482 -11.996 112 HG2 LYS 15 2HG LYS 15 -1.370 -0.692 -10.862 113 HG3 LYS 15 3HG LYS 15 -0.472 -1.268 -12.272 114 HD2 LYS 15 2HD LYS 15 1.436 -1.876 -10.824 115 HD3 LYS 15 3HD LYS 15 0.585 -1.247 -9.412 116 HE2 LYS 15 2HE LYS 15 -1.164 -2.983 -9.705 117 HE3 LYS 15 3HE LYS 15 -0.287 -3.621 -11.100 118 HZ1 LYS 15 3HZ LYS 15 1.591 -4.115 -9.652 119 HZ2 LYS 15 1HZ LYS 15 0.189 -4.881 -9.092 120 HZ3 LYS 15 2HZ LYS 15 0.756 -3.491 -8.319 121 H GLN 16 H GLN 16 -0.112 3.759 -10.573 122 HA GLN 16 HA GLN 16 2.509 4.833 -11.099 123 HB2 GLN 16 2HB GLN 16 -0.123 6.269 -10.549 124 HB3 GLN 16 3HB GLN 16 1.361 7.059 -11.069 125 HG2 GLN 16 2HG GLN 16 -0.258 5.047 -12.658 126 HG3 GLN 16 3HG GLN 16 -0.160 6.782 -12.950 127 HE21 GLN 16 1HE2 GLN 16 1.484 3.718 -13.267 128 HE22 GLN 16 2HE2 GLN 16 2.723 4.269 -14.338 129 H ALA 17 H ALA 17 0.683 4.176 -8.243 130 HA ALA 17 HA ALA 17 2.245 5.781 -6.426 131 HB1 ALA 17 3HB ALA 17 -0.042 5.013 -5.879 132 HB2 ALA 17 1HB ALA 17 1.130 4.475 -4.675 133 HB3 ALA 17 2HB ALA 17 0.514 3.340 -5.881 134 H THR 18 H THR 18 2.173 2.298 -7.327 135 HA THR 18 HA THR 18 4.444 1.480 -5.836 136 HB THR 18 HB THR 18 4.420 -0.584 -7.233 137 HG1 THR 18 HG1 THR 18 3.509 0.848 -9.139 138 HG21 THR 18 3HG2 THR 18 2.825 -0.449 -5.368 139 HG22 THR 18 1HG2 THR 18 2.132 -1.349 -6.715 140 HG23 THR 18 2HG2 THR 18 1.634 0.316 -6.419 141 H ASP 19 H ASP 19 4.168 3.185 -8.808 142 HA ASP 19 HA ASP 19 6.561 2.773 -10.110 143 HB2 ASP 19 2HB ASP 19 4.720 4.250 -10.901 144 HB3 ASP 19 3HB ASP 19 5.154 5.448 -9.684 145 H MET 20 H MET 20 5.980 4.826 -7.227 146 HA MET 20 HA MET 20 8.813 5.534 -6.993 147 HB2 MET 20 2HB MET 20 6.366 6.348 -5.375 148 HB3 MET 20 3HB MET 20 7.997 6.726 -4.831 149 HG2 MET 20 2HG MET 20 7.190 8.664 -5.919 150 HG3 MET 20 3HG MET 20 8.347 7.930 -7.027 151 HE1 MET 20 3HE MET 20 4.534 7.094 -6.235 152 HE2 MET 20 1HE MET 20 3.770 7.986 -7.552 153 HE3 MET 20 2HE MET 20 4.658 8.855 -6.301 154 H GLY 21 H GLY 21 6.691 3.100 -5.737 155 HA2 GLY 21 2HA GLY 21 7.752 1.142 -4.719 156 HA3 GLY 21 3HA GLY 21 8.777 2.235 -3.793 157 H ALA 22 H ALA 22 5.709 0.707 -4.021 158 HA ALA 22 HA ALA 22 4.873 1.557 -1.359 159 HB1 ALA 22 3HB ALA 22 3.887 3.265 -2.844 160 HB2 ALA 22 1HB ALA 22 2.625 2.229 -2.172 161 HB3 ALA 22 2HB ALA 22 3.160 2.001 -3.839 162 H ILE 23 H ILE 23 4.585 -0.461 -0.407 163 HA ILE 23 HA ILE 23 4.331 -2.776 -2.150 164 HB ILE 23 HB ILE 23 4.737 -4.152 -0.083 165 HG12 ILE 23 2HG1 ILE 23 5.713 -2.602 1.919 166 HG13 ILE 23 3HG1 ILE 23 4.531 -1.459 1.296 167 HG21 ILE 23 1HG2 ILE 23 7.104 -3.487 0.183 168 HG22 ILE 23 2HG2 ILE 23 6.762 -1.943 -0.601 169 HG23 ILE 23 3HG2 ILE 23 6.595 -3.450 -1.507 170 HD11 ILE 23 3HD1 ILE 23 3.930 -4.235 2.317 171 HD12 ILE 23 1HD1 ILE 23 2.743 -3.063 1.738 172 HD13 ILE 23 2HD1 ILE 23 3.686 -2.724 3.188 173 H TYR 24 H TYR 24 2.875 -4.547 -1.829 174 HA TYR 24 HA TYR 24 0.168 -3.728 -0.962 175 HB2 TYR 24 2HB TYR 24 1.070 -5.966 -2.829 176 HB3 TYR 24 3HB TYR 24 -0.594 -5.723 -2.322 177 HD1 TYR 24 HD1 TYR 24 -1.634 -3.345 -2.866 178 HD2 TYR 24 HD2 TYR 24 1.785 -4.974 -4.854 179 HE1 TYR 24 HE1 TYR 24 -2.059 -1.888 -4.805 180 HE2 TYR 24 HE2 TYR 24 1.360 -3.515 -6.780 181 HH TYR 24 HH TYR 24 -0.759 -0.909 -6.716 182 H VAL 25 H VAL 25 -0.502 -4.496 0.903 183 HA VAL 25 HA VAL 25 0.228 -7.230 1.790 184 HB VAL 25 HB VAL 25 -0.490 -6.577 4.055 185 HG11 VAL 25 1HG1 VAL 25 1.362 -5.053 4.647 186 HG12 VAL 25 2HG1 VAL 25 1.596 -4.679 2.936 187 HG13 VAL 25 3HG1 VAL 25 1.864 -6.321 3.528 188 HG21 VAL 25 3HG2 VAL 25 -0.994 -4.219 4.659 189 HG22 VAL 25 1HG2 VAL 25 -2.188 -4.889 3.543 190 HG23 VAL 25 2HG2 VAL 25 -0.955 -3.777 2.948 191 H ASN 26 H ASN 26 -1.609 -8.499 2.657 192 HA ASN 26 HA ASN 26 -4.163 -7.888 1.318 193 HB2 ASN 26 2HB ASN 26 -4.830 -10.165 1.943 194 HB3 ASN 26 3HB ASN 26 -3.262 -10.190 1.154 195 HD21 ASN 26 1HD2 ASN 26 -4.387 -12.240 2.819 196 HD22 ASN 26 2HD2 ASN 26 -3.304 -12.443 4.151 197 H SER 27 H SER 27 -6.019 -8.961 2.988 198 HA SER 27 HA SER 27 -6.619 -6.948 4.863 199 HB2 SER 27 2HB SER 27 -8.469 -8.497 5.546 200 HB3 SER 27 3HB SER 27 -8.337 -8.354 3.791 201 HG SER 27 HG SER 27 -8.432 -10.560 4.970 202 H LYS 28 H LYS 28 -4.719 -9.864 5.166 203 HA LYS 28 HA LYS 28 -4.700 -9.920 8.059 204 HB2 LYS 28 2HB LYS 28 -2.882 -11.353 6.066 205 HB3 LYS 28 3HB LYS 28 -2.944 -11.665 7.799 206 HG2 LYS 28 2HG LYS 28 -5.169 -12.146 5.800 207 HG3 LYS 28 3HG LYS 28 -4.173 -13.374 6.583 208 HD2 LYS 28 2HD LYS 28 -5.120 -12.686 8.797 209 HD3 LYS 28 3HD LYS 28 -6.147 -11.514 7.962 210 HE2 LYS 28 2HE LYS 28 -7.230 -13.372 6.712 211 HE3 LYS 28 3HE LYS 28 -6.234 -14.530 7.602 212 HZ1 LYS 28 3HZ LYS 28 -7.257 -13.775 9.663 213 HZ2 LYS 28 1HZ LYS 28 -8.439 -14.306 8.574 214 HZ3 LYS 28 2HZ LYS 28 -8.197 -12.654 8.816 215 H GLY 29 H GLY 29 -2.645 -8.597 5.486 216 HA2 GLY 29 2HA GLY 29 -1.209 -6.692 5.868 217 HA3 GLY 29 3HA GLY 29 -0.963 -7.221 7.529 218 H ASP 30 H ASP 30 -0.948 -9.750 5.340 219 HA ASP 30 HA ASP 30 1.920 -10.176 5.480 220 HB2 ASP 30 2HB ASP 30 0.342 -12.048 5.863 221 HB3 ASP 30 3HB ASP 30 -0.341 -11.842 4.261 222 H ARG 31 H ARG 31 3.320 -9.835 3.814 223 HA ARG 31 HA ARG 31 2.605 -8.528 1.416 224 HB2 ARG 31 2HB ARG 31 4.895 -8.780 0.695 225 HB3 ARG 31 3HB ARG 31 4.923 -8.441 2.413 226 HG2 ARG 31 2HG ARG 31 5.355 -11.175 1.159 227 HG3 ARG 31 3HG ARG 31 6.629 -10.093 1.699 228 HD2 ARG 31 2HD ARG 31 5.756 -10.300 4.044 229 HD3 ARG 31 3HD ARG 31 4.557 -11.467 3.459 230 HE ARG 31 HE ARG 31 7.362 -12.053 2.881 231 HH11 ARG 31 1HH1 ARG 31 4.625 -12.779 4.984 232 HH12 ARG 31 2HH1 ARG 31 5.320 -14.267 5.561 233 HH21 ARG 31 1HH2 ARG 31 8.213 -14.031 3.618 234 HH22 ARG 31 2HH2 ARG 31 7.336 -14.965 4.791 235 H ILE 32 H ILE 32 1.472 -9.371 -0.222 236 HA ILE 32 HA ILE 32 1.284 -12.307 -0.557 237 HB ILE 32 HB ILE 32 -0.756 -11.828 -1.929 238 HG12 ILE 32 2HG1 ILE 32 -0.406 -8.917 -1.025 239 HG13 ILE 32 3HG1 ILE 32 -0.110 -9.491 -2.661 240 HG21 ILE 32 1HG2 ILE 32 -2.191 -11.230 -0.020 241 HG22 ILE 32 2HG2 ILE 32 -0.780 -10.654 0.871 242 HG23 ILE 32 3HG2 ILE 32 -0.924 -12.365 0.455 243 HD11 ILE 32 3HD1 ILE 32 -2.255 -8.400 -2.513 244 HD12 ILE 32 1HD1 ILE 32 -2.767 -9.500 -1.232 245 HD13 ILE 32 2HD1 ILE 32 -2.476 -10.114 -2.863 246 H VAL 33 H VAL 33 2.816 -9.686 -2.019 247 HA VAL 33 HA VAL 33 3.496 -11.154 -4.424 248 HB VAL 33 HB VAL 33 1.306 -10.060 -5.000 249 HG11 VAL 33 1HG1 VAL 33 1.436 -8.088 -3.580 250 HG12 VAL 33 2HG1 VAL 33 1.133 -7.616 -5.253 251 HG13 VAL 33 3HG1 VAL 33 2.749 -7.430 -4.559 252 HG21 VAL 33 3HG2 VAL 33 1.991 -9.049 -7.150 253 HG22 VAL 33 1HG2 VAL 33 2.894 -10.528 -6.809 254 HG23 VAL 33 2HG2 VAL 33 3.659 -8.955 -6.579 255 H ASN 34 H ASN 34 5.204 -10.011 -5.655 256 HA ASN 34 HA ASN 34 7.168 -8.599 -4.119 257 HB2 ASN 34 2HB ASN 34 8.396 -8.546 -6.336 258 HB3 ASN 34 3HB ASN 34 7.876 -10.146 -5.833 259 HD21 ASN 34 1HD2 ASN 34 8.117 -10.825 -8.009 260 HD22 ASN 34 2HD2 ASN 34 6.931 -10.457 -9.211 261 H GLU 35 H GLU 35 4.600 -7.171 -4.417 262 HA GLU 35 HA GLU 35 3.666 -5.176 -4.693 263 HB2 GLU 35 2HB GLU 35 5.671 -4.248 -3.628 264 HB3 GLU 35 3HB GLU 35 6.520 -4.229 -5.170 265 HG2 GLU 35 2HG GLU 35 4.708 -2.629 -5.992 266 HG3 GLU 35 3HG GLU 35 4.186 -2.506 -4.311 267 H SER 36 H SER 36 6.250 -4.804 -7.131 268 HA SER 36 HA SER 36 4.165 -4.498 -9.219 269 HB2 SER 36 2HB SER 36 5.254 -2.330 -8.589 270 HB3 SER 36 3HB SER 36 6.824 -2.999 -9.045 271 HG SER 36 HG SER 36 5.757 -1.728 -10.705 272 H ASN 37 H ASN 37 4.404 -5.634 -11.014 273 HA ASN 37 HA ASN 37 6.811 -6.651 -12.129 274 HB2 ASN 37 2HB ASN 37 6.546 -8.320 -10.275 275 HB3 ASN 37 3HB ASN 37 4.934 -8.715 -10.853 276 HD21 ASN 37 1HD2 ASN 37 7.806 -8.193 -12.898 277 HD22 ASN 37 2HD2 ASN 37 7.906 -9.824 -13.459 278 H VAL 38 H VAL 38 3.422 -7.655 -11.855 279 HA VAL 38 HA VAL 38 2.499 -6.368 -14.197 280 HB VAL 38 HB VAL 38 3.749 -8.231 -15.306 281 HG11 VAL 38 1HG1 VAL 38 1.823 -10.125 -13.917 282 HG12 VAL 38 2HG1 VAL 38 3.560 -9.984 -13.627 283 HG13 VAL 38 3HG1 VAL 38 2.975 -10.566 -15.187 284 HG21 VAL 38 3HG2 VAL 38 1.972 -8.948 -16.852 285 HG22 VAL 38 1HG2 VAL 38 1.823 -7.236 -16.451 286 HG23 VAL 38 2HG2 VAL 38 0.742 -8.414 -15.703 287 H TYR 39 H TYR 39 0.145 -6.752 -14.492 288 HA TYR 39 HA TYR 39 -1.348 -6.844 -12.141 289 HB2 TYR 39 2HB TYR 39 -3.347 -6.865 -13.536 290 HB3 TYR 39 3HB TYR 39 -2.145 -5.833 -14.288 291 HD1 TYR 39 HD2 TYR 39 -1.026 -6.560 -16.426 292 HD2 TYR 39 HD1 TYR 39 -4.129 -8.919 -14.666 293 HE1 TYR 39 HE2 TYR 39 -1.302 -7.786 -18.538 294 HE2 TYR 39 HE1 TYR 39 -4.405 -10.130 -16.788 295 HH TYR 39 HH TYR 39 -3.955 -9.814 -19.173 296 H THR 40 H THR 40 -0.420 -9.438 -14.306 297 HA THR 40 HA THR 40 -2.316 -11.391 -13.580 298 HB THR 40 HB THR 40 0.498 -11.950 -14.638 299 HG1 THR 40 HG1 THR 40 -1.735 -11.481 -16.310 300 HG21 THR 40 3HG2 THR 40 -0.833 -13.966 -14.049 301 HG22 THR 40 1HG2 THR 40 -0.602 -13.839 -15.796 302 HG23 THR 40 2HG2 THR 40 -2.149 -13.390 -15.077 303 H THR 41 H THR 41 1.031 -10.853 -12.482 304 HA THR 41 HA THR 41 1.234 -12.978 -10.632 305 HB THR 41 HB THR 41 2.710 -10.297 -10.589 306 HG1 THR 41 HG1 THR 41 4.155 -11.245 -11.969 307 HG21 THR 41 3HG2 THR 41 3.566 -12.995 -9.460 308 HG22 THR 41 1HG2 THR 41 3.066 -11.599 -8.501 309 HG23 THR 41 2HG2 THR 41 4.538 -11.521 -9.470 310 H PHE 42 H PHE 42 0.192 -9.613 -10.305 311 HA PHE 42 HA PHE 42 -0.154 -9.579 -7.472 312 HB2 PHE 42 2HB PHE 42 0.243 -7.514 -8.725 313 HB3 PHE 42 3HB PHE 42 -1.211 -7.764 -9.684 314 HD1 PHE 42 HD1 PHE 42 -0.649 -7.941 -5.957 315 HD2 PHE 42 HD2 PHE 42 -2.642 -5.959 -9.184 316 HE1 PHE 42 HE1 PHE 42 -1.919 -6.585 -4.351 317 HE2 PHE 42 HE2 PHE 42 -3.907 -4.606 -7.565 318 HZ PHE 42 HZ PHE 42 -3.548 -4.919 -5.148 319 H ARG 43 H ARG 43 -2.270 -10.340 -10.192 320 HA ARG 43 HA ARG 43 -4.758 -10.254 -8.795 321 HB2 ARG 43 2HB ARG 43 -4.675 -10.015 -11.245 322 HB3 ARG 43 3HB ARG 43 -3.993 -11.630 -11.414 323 HG2 ARG 43 2HG ARG 43 -6.077 -12.629 -10.592 324 HG3 ARG 43 3HG ARG 43 -6.768 -11.026 -10.326 325 HD2 ARG 43 2HD ARG 43 -6.744 -10.570 -12.724 326 HD3 ARG 43 3HD ARG 43 -5.880 -12.077 -13.031 327 HE ARG 43 HE ARG 43 -7.902 -13.262 -12.228 328 HH11 ARG 43 1HH1 ARG 43 -8.282 -9.981 -13.461 329 HH12 ARG 43 2HH1 ARG 43 -9.941 -10.216 -13.916 330 HH21 ARG 43 1HH2 ARG 43 -10.040 -13.581 -12.861 331 HH22 ARG 43 2HH2 ARG 43 -10.945 -12.280 -13.572 332 H ASN 44 H ASN 44 -2.608 -12.905 -9.834 333 HA ASN 44 HA ASN 44 -3.948 -15.105 -8.762 334 HB2 ASN 44 2HB ASN 44 -0.971 -14.622 -9.210 335 HB3 ASN 44 3HB ASN 44 -1.616 -16.190 -8.729 336 HD21 ASN 44 1HD2 ASN 44 -0.198 -15.330 -11.202 337 HD22 ASN 44 2HD2 ASN 44 -1.234 -15.783 -12.506 338 H ALA 45 H ALA 45 -1.778 -12.810 -7.213 339 HA ALA 45 HA ALA 45 -1.382 -14.113 -4.738 340 HB1 ALA 45 3HB ALA 45 -0.001 -12.236 -5.521 341 HB2 ALA 45 1HB ALA 45 -0.677 -11.894 -3.928 342 HB3 ALA 45 2HB ALA 45 -1.375 -11.141 -5.367 343 H ILE 46 H ILE 46 -3.898 -11.908 -5.882 344 HA ILE 46 HA ILE 46 -5.280 -11.740 -3.336 345 HB ILE 46 HB ILE 46 -6.285 -10.834 -6.078 346 HG12 ILE 46 2HG1 ILE 46 -4.701 -9.187 -4.041 347 HG13 ILE 46 3HG1 ILE 46 -4.064 -9.795 -5.564 348 HG21 ILE 46 1HG2 ILE 46 -8.029 -10.945 -4.367 349 HG22 ILE 46 2HG2 ILE 46 -7.680 -9.265 -4.769 350 HG23 ILE 46 3HG2 ILE 46 -7.054 -9.959 -3.271 351 HD11 ILE 46 3HD1 ILE 46 -6.287 -7.782 -5.252 352 HD12 ILE 46 1HD1 ILE 46 -5.697 -8.426 -6.787 353 HD13 ILE 46 2HD1 ILE 46 -4.632 -7.469 -5.764 354 H LEU 47 H LEU 47 -5.469 -13.700 -6.249 355 HA LEU 47 HA LEU 47 -8.042 -14.873 -5.792 356 HB2 LEU 47 2HB LEU 47 -5.673 -15.909 -7.412 357 HB3 LEU 47 3HB LEU 47 -7.271 -16.642 -7.414 358 HG LEU 47 HG LEU 47 -6.593 -13.859 -8.443 359 HD11 LEU 47 1HD1 LEU 47 -7.367 -16.360 -9.981 360 HD12 LEU 47 2HD1 LEU 47 -5.760 -15.628 -9.915 361 HD13 LEU 47 3HD1 LEU 47 -7.091 -14.754 -10.667 362 HD21 LEU 47 3HD2 LEU 47 -9.274 -15.285 -8.421 363 HD22 LEU 47 1HD2 LEU 47 -8.927 -13.757 -9.237 364 HD23 LEU 47 2HD2 LEU 47 -8.834 -13.856 -7.480 365 H LYS 48 H LYS 48 -4.774 -15.545 -4.735 366 HA LYS 48 HA LYS 48 -5.125 -18.150 -3.690 367 HB2 LYS 48 2HB LYS 48 -2.907 -17.106 -4.175 368 HB3 LYS 48 3HB LYS 48 -3.123 -16.016 -2.810 369 HG2 LYS 48 2HG LYS 48 -3.143 -17.959 -1.265 370 HG3 LYS 48 3HG LYS 48 -2.927 -19.055 -2.632 371 HD2 LYS 48 2HD LYS 48 -0.954 -16.933 -1.697 372 HD3 LYS 48 3HD LYS 48 -0.799 -18.673 -1.448 373 HE2 LYS 48 2HE LYS 48 -0.730 -17.210 -4.108 374 HE3 LYS 48 3HE LYS 48 0.634 -17.963 -3.285 375 HZ1 LYS 48 3HZ LYS 48 -1.705 -19.337 -4.494 376 HZ2 LYS 48 1HZ LYS 48 -0.549 -20.116 -3.537 377 HZ3 LYS 48 2HZ LYS 48 -0.097 -19.411 -4.998 378 H GLN 49 H GLN 49 -5.674 -14.943 -2.283 379 HA GLN 49 HA GLN 49 -6.292 -16.040 0.357 380 HB2 GLN 49 2HB GLN 49 -6.529 -13.766 1.113 381 HB3 GLN 49 3HB GLN 49 -5.097 -13.828 0.092 382 HG2 GLN 49 2HG GLN 49 -6.503 -12.905 -1.784 383 HG3 GLN 49 3HG GLN 49 -7.815 -12.694 -0.624 384 HE21 GLN 49 1HE2 GLN 49 -7.458 -11.224 1.149 385 HE22 GLN 49 2HE2 GLN 49 -6.395 -9.881 0.942 386 H ALA 50 H ALA 50 -8.336 -16.129 1.264 387 HA ALA 50 HA ALA 50 -10.574 -16.621 -0.422 388 HB1 ALA 50 3HB ALA 50 -10.451 -16.278 2.599 389 HB2 ALA 50 1HB ALA 50 -10.236 -17.790 1.715 390 HB3 ALA 50 2HB ALA 50 -11.801 -16.976 1.698 391 H ASP 51 H ASP 51 -9.415 -13.796 1.204 392 HA ASP 51 HA ASP 51 -11.822 -12.353 1.646 393 HB2 ASP 51 2HB ASP 51 -9.006 -11.222 1.309 394 HB3 ASP 51 3HB ASP 51 -10.344 -10.469 2.172 395 H LYS 52 H LYS 52 -9.535 -12.492 -1.037 396 HA LYS 52 HA LYS 52 -9.430 -11.627 -3.110 397 HB2 LYS 52 2HB LYS 52 -12.460 -11.347 -2.823 398 HB3 LYS 52 3HB LYS 52 -11.579 -11.212 -4.341 399 HG2 LYS 52 2HG LYS 52 -11.709 -13.710 -2.610 400 HG3 LYS 52 3HG LYS 52 -12.660 -13.428 -4.071 401 HD2 LYS 52 2HD LYS 52 -10.548 -13.302 -5.391 402 HD3 LYS 52 3HD LYS 52 -9.623 -13.635 -3.926 403 HE2 LYS 52 2HE LYS 52 -11.669 -15.516 -5.160 404 HE3 LYS 52 3HE LYS 52 -9.921 -15.637 -5.369 405 HZ1 LYS 52 3HZ LYS 52 -9.685 -16.003 -3.008 406 HZ2 LYS 52 1HZ LYS 52 -10.754 -17.138 -3.658 407 HZ3 LYS 52 2HZ LYS 52 -11.349 -15.831 -2.773 408 H VAL 53 H VAL 53 -8.971 -9.836 -0.893 409 HA VAL 53 HA VAL 53 -9.151 -7.305 -2.346 410 HB VAL 53 HB VAL 53 -11.096 -7.142 -0.885 411 HG11 VAL 53 1HG1 VAL 53 -9.271 -7.664 1.490 412 HG12 VAL 53 2HG1 VAL 53 -10.495 -8.764 0.852 413 HG13 VAL 53 3HG1 VAL 53 -10.984 -7.229 1.570 414 HG21 VAL 53 3HG2 VAL 53 -8.836 -5.385 0.161 415 HG22 VAL 53 1HG2 VAL 53 -10.565 -5.051 0.323 416 HG23 VAL 53 2HG2 VAL 53 -9.817 -5.075 -1.275 417 H ALA 54 H ALA 54 -7.209 -6.456 -2.433 418 HA ALA 54 HA ALA 54 -5.158 -6.974 -0.369 419 HB1 ALA 54 3HB ALA 54 -4.882 -5.935 -3.225 420 HB2 ALA 54 1HB ALA 54 -4.529 -7.577 -2.679 421 HB3 ALA 54 2HB ALA 54 -3.547 -6.231 -2.102 422 H TYR 55 H TYR 55 -3.654 -4.985 -0.179 423 HA TYR 55 HA TYR 55 -5.084 -2.428 -0.023 424 HB2 TYR 55 2HB TYR 55 -3.856 -3.917 2.348 425 HB3 TYR 55 3HB TYR 55 -4.241 -2.203 2.385 426 HD1 TYR 55 HD2 TYR 55 -5.730 -5.615 2.237 427 HD2 TYR 55 HD1 TYR 55 -6.542 -1.442 2.707 428 HE1 TYR 55 HE2 TYR 55 -8.002 -6.138 3.017 429 HE2 TYR 55 HE1 TYR 55 -8.805 -1.979 3.494 430 HH TYR 55 HH TYR 55 -10.415 -3.715 3.396 431 H LEU 56 H LEU 56 -3.785 -0.884 -0.729 432 HA LEU 56 HA LEU 56 -0.942 -1.345 -1.207 433 HB2 LEU 56 2HB LEU 56 -2.307 -0.456 -3.033 434 HB3 LEU 56 3HB LEU 56 -2.879 0.864 -2.026 435 HG LEU 56 HG LEU 56 -0.492 1.739 -1.950 436 HD11 LEU 56 1HD1 LEU 56 0.697 -0.321 -2.482 437 HD12 LEU 56 2HD1 LEU 56 1.110 0.962 -3.615 438 HD13 LEU 56 3HD1 LEU 56 0.005 -0.322 -4.107 439 HD21 LEU 56 3HD2 LEU 56 -0.566 2.742 -4.186 440 HD22 LEU 56 1HD2 LEU 56 -2.156 2.740 -3.429 441 HD23 LEU 56 2HD2 LEU 56 -1.778 1.565 -4.690 442 H VAL 57 H VAL 57 0.274 -0.975 0.605 443 HA VAL 57 HA VAL 57 -0.157 1.348 2.339 444 HB VAL 57 HB VAL 57 2.139 -0.689 2.385 445 HG11 VAL 57 1HG1 VAL 57 2.749 1.414 3.491 446 HG12 VAL 57 2HG1 VAL 57 2.564 0.131 4.686 447 HG13 VAL 57 3HG1 VAL 57 1.295 1.344 4.493 448 HG21 VAL 57 3HG2 VAL 57 -0.405 -0.677 4.055 449 HG22 VAL 57 1HG2 VAL 57 0.960 -1.782 4.256 450 HG23 VAL 57 2HG2 VAL 57 0.003 -1.824 2.776 451 H MET 58 H MET 58 0.625 3.290 1.709 452 HA MET 58 HA MET 58 3.322 3.503 0.540 453 HB2 MET 58 2HB MET 58 2.610 5.216 -1.063 454 HB3 MET 58 3HB MET 58 1.747 3.720 -1.370 455 HG2 MET 58 2HG MET 58 -0.264 4.613 -0.390 456 HG3 MET 58 3HG MET 58 0.580 6.094 0.083 457 HE1 MET 58 3HE MET 58 -2.053 6.357 -1.604 458 HE2 MET 58 1HE MET 58 -1.802 4.767 -2.333 459 HE3 MET 58 2HE MET 58 -1.900 6.203 -3.354 460 H ASP 59 H ASP 59 3.970 5.903 0.521 461 HA ASP 59 HA ASP 59 3.270 7.209 3.073 462 HB2 ASP 59 2HB ASP 59 5.303 8.619 2.581 463 HB3 ASP 59 3HB ASP 59 5.637 6.903 2.737 464 H GLU 60 H GLU 60 3.478 9.765 2.803 465 HA GLU 60 HA GLU 60 1.151 10.455 1.283 466 HB2 GLU 60 2HB GLU 60 1.579 11.354 3.569 467 HB3 GLU 60 3HB GLU 60 2.920 12.299 2.926 468 HG2 GLU 60 2HG GLU 60 1.429 13.620 1.557 469 HG3 GLU 60 3HG GLU 60 0.067 12.574 1.931 470 H ARG 61 H ARG 61 4.619 10.903 0.757 471 HA ARG 61 HA ARG 61 4.457 12.961 -1.219 472 HB2 ARG 61 2HB ARG 61 6.611 12.412 -0.135 473 HB3 ARG 61 3HB ARG 61 6.582 10.795 -0.830 474 HG2 ARG 61 2HG ARG 61 6.780 11.760 -3.096 475 HG3 ARG 61 3HG ARG 61 6.779 13.385 -2.412 476 HD2 ARG 61 2HD ARG 61 8.893 12.854 -1.212 477 HD3 ARG 61 3HD ARG 61 8.884 11.250 -1.951 478 HE ARG 61 HE ARG 61 9.215 12.272 -4.111 479 HH11 ARG 61 1HH1 ARG 61 9.703 14.471 -1.401 480 HH12 ARG 61 2HH1 ARG 61 10.662 15.584 -2.329 481 HH21 ARG 61 1HH2 ARG 61 10.467 13.773 -5.311 482 HH22 ARG 61 2HH2 ARG 61 11.089 15.191 -4.515 483 H THR 62 H THR 62 4.455 9.439 -1.349 484 HA THR 62 HA THR 62 4.142 9.082 -4.138 485 HB THR 62 HB THR 62 3.396 7.303 -1.770 486 HG1 THR 62 HG1 THR 62 5.544 7.373 -1.735 487 HG21 THR 62 3HG2 THR 62 2.178 6.540 -3.791 488 HG22 THR 62 1HG2 THR 62 3.443 5.401 -3.322 489 HG23 THR 62 2HG2 THR 62 3.698 6.490 -4.686 490 H TRP 63 H TRP 63 1.827 9.582 -1.498 491 HA TRP 63 HA TRP 63 -0.568 9.154 -2.962 492 HB2 TRP 63 2HB TRP 63 -0.656 9.021 -0.571 493 HB3 TRP 63 3HB TRP 63 0.024 10.629 -0.374 494 HD1 TRP 63 HD1 TRP 63 -1.673 12.571 -0.060 495 HE1 TRP 63 HE1 TRP 63 -4.232 12.793 -0.162 496 HE3 TRP 63 HE3 TRP 63 -2.838 7.987 -2.024 497 HZ2 TRP 63 HZ2 TRP 63 -6.439 11.251 -0.969 498 HZ3 TRP 63 HZ3 TRP 63 -5.201 7.442 -2.439 499 HH2 TRP 63 HH2 TRP 63 -6.967 9.049 -1.920 500 H LYS 64 H LYS 64 1.491 12.045 -2.625 501 HA LYS 64 HA LYS 64 -0.260 14.063 -3.444 502 HB2 LYS 64 2HB LYS 64 2.665 13.850 -4.260 503 HB3 LYS 64 3HB LYS 64 1.706 15.326 -4.216 504 HG2 LYS 64 2HG LYS 64 2.593 13.668 -1.851 505 HG3 LYS 64 3HG LYS 64 3.222 15.238 -2.334 506 HD2 LYS 64 2HD LYS 64 0.887 16.174 -1.921 507 HD3 LYS 64 3HD LYS 64 0.466 14.614 -1.213 508 HE2 LYS 64 2HE LYS 64 2.305 14.901 0.442 509 HE3 LYS 64 3HE LYS 64 2.657 16.484 -0.254 510 HZ1 LYS 64 3HZ LYS 64 0.119 15.691 1.076 511 HZ2 LYS 64 1HZ LYS 64 0.421 17.205 0.387 512 HZ3 LYS 64 2HZ LYS 64 1.310 16.691 1.731 513 H LYS 65 H LYS 65 1.399 11.621 -5.317 514 HA LYS 65 HA LYS 65 0.743 12.648 -7.916 515 HB2 LYS 65 2HB LYS 65 1.681 9.878 -7.029 516 HB3 LYS 65 3HB LYS 65 1.548 10.397 -8.705 517 HG2 LYS 65 2HG LYS 65 3.415 11.529 -6.601 518 HG3 LYS 65 3HG LYS 65 3.869 10.528 -7.982 519 HD2 LYS 65 2HD LYS 65 2.707 13.342 -8.133 520 HD3 LYS 65 3HD LYS 65 4.404 12.916 -8.344 521 HE2 LYS 65 2HE LYS 65 3.937 11.726 -10.384 522 HE3 LYS 65 3HE LYS 65 2.197 11.839 -10.122 523 HZ1 LYS 65 3HZ LYS 65 2.335 14.238 -10.390 524 HZ2 LYS 65 1HZ LYS 65 2.946 13.448 -11.758 525 HZ3 LYS 65 2HZ LYS 65 4.003 14.147 -10.643 526 H VAL 66 H VAL 66 -0.515 9.990 -5.897 527 HA VAL 66 HA VAL 66 -2.354 8.926 -7.744 528 HB VAL 66 HB VAL 66 -2.434 8.737 -4.691 529 HG11 VAL 66 1HG1 VAL 66 -4.559 7.978 -5.691 530 HG12 VAL 66 2HG1 VAL 66 -3.663 6.615 -5.022 531 HG13 VAL 66 3HG1 VAL 66 -3.682 6.883 -6.767 532 HG21 VAL 66 3HG2 VAL 66 -1.129 6.648 -4.987 533 HG22 VAL 66 1HG2 VAL 66 -0.252 8.060 -5.580 534 HG23 VAL 66 2HG2 VAL 66 -1.026 6.960 -6.722 535 H TYR 67 H TYR 67 -2.966 11.058 -4.936 536 HA TYR 67 HA TYR 67 -5.718 11.406 -5.096 537 HB2 TYR 67 2HB TYR 67 -4.311 12.178 -3.204 538 HB3 TYR 67 3HB TYR 67 -3.600 13.425 -4.213 539 HD1 TYR 67 HD1 TYR 67 -6.763 12.344 -2.566 540 HD2 TYR 67 HD2 TYR 67 -4.727 15.591 -4.456 541 HE1 TYR 67 HE1 TYR 67 -8.504 13.882 -1.801 542 HE2 TYR 67 HE2 TYR 67 -6.489 17.128 -3.683 543 HH TYR 67 HH TYR 67 -8.846 17.020 -3.002 544 H ASP 68 H ASP 68 -3.126 13.198 -6.693 545 HA ASP 68 HA ASP 68 -4.691 15.206 -7.945 546 HB2 ASP 68 2HB ASP 68 -2.248 15.470 -7.582 547 HB3 ASP 68 3HB ASP 68 -1.922 14.148 -8.697 548 H LEU 69 H LEU 69 -3.433 12.063 -9.079 549 HA LEU 69 HA LEU 69 -4.213 12.237 -11.792 550 HB2 LEU 69 2HB LEU 69 -3.774 9.784 -10.036 551 HB3 LEU 69 3HB LEU 69 -4.011 9.707 -11.776 552 HG LEU 69 HG LEU 69 -1.683 11.091 -10.394 553 HD11 LEU 69 1HD1 LEU 69 -0.314 9.240 -11.209 554 HD12 LEU 69 2HD1 LEU 69 -1.741 8.445 -11.877 555 HD13 LEU 69 3HD1 LEU 69 -1.581 8.657 -10.130 556 HD21 LEU 69 3HD2 LEU 69 -0.710 11.291 -12.642 557 HD22 LEU 69 1HD2 LEU 69 -2.230 12.175 -12.515 558 HD23 LEU 69 2HD2 LEU 69 -2.183 10.622 -13.353 559 H LEU 70 H LEU 70 -5.862 10.958 -8.941 560 HA LEU 70 HA LEU 70 -8.078 9.732 -10.108 561 HB2 LEU 70 2HB LEU 70 -7.779 11.171 -7.439 562 HB3 LEU 70 3HB LEU 70 -9.200 10.236 -7.871 563 HG LEU 70 HG LEU 70 -6.391 9.085 -7.665 564 HD11 LEU 70 1HD1 LEU 70 -7.120 8.024 -5.580 565 HD12 LEU 70 2HD1 LEU 70 -8.676 8.854 -5.681 566 HD13 LEU 70 3HD1 LEU 70 -7.190 9.781 -5.460 567 HD21 LEU 70 3HD2 LEU 70 -7.762 7.849 -9.261 568 HD22 LEU 70 1HD2 LEU 70 -9.061 7.692 -8.072 569 HD23 LEU 70 2HD2 LEU 70 -7.511 6.886 -7.808 570 H ILE 71 H ILE 71 -7.786 13.068 -8.875 571 HA ILE 71 HA ILE 71 -10.340 13.978 -9.742 572 HB ILE 71 HB ILE 71 -7.860 15.657 -9.113 573 HG12 ILE 71 2HG1 ILE 71 -10.095 14.717 -7.242 574 HG13 ILE 71 3HG1 ILE 71 -8.440 14.120 -7.240 575 HG21 ILE 71 1HG2 ILE 71 -9.447 17.491 -8.616 576 HG22 ILE 71 2HG2 ILE 71 -10.798 16.461 -9.094 577 HG23 ILE 71 3HG2 ILE 71 -9.603 16.953 -10.294 578 HD11 ILE 71 3HD1 ILE 71 -8.798 15.657 -5.427 579 HD12 ILE 71 1HD1 ILE 71 -9.318 16.914 -6.550 580 HD13 ILE 71 2HD1 ILE 71 -7.648 16.337 -6.580 581 H LEU 72 H LEU 72 -7.146 13.989 -11.195 582 HA LEU 72 HA LEU 72 -7.568 15.782 -13.346 583 HB2 LEU 72 2HB LEU 72 -5.354 15.059 -12.364 584 HB3 LEU 72 3HB LEU 72 -5.551 13.491 -13.107 585 HG LEU 72 HG LEU 72 -3.930 15.134 -14.225 586 HD11 LEU 72 1HD1 LEU 72 -6.080 13.995 -16.031 587 HD12 LEU 72 2HD1 LEU 72 -4.693 13.116 -15.386 588 HD13 LEU 72 3HD1 LEU 72 -4.440 14.453 -16.503 589 HD21 LEU 72 3HD2 LEU 72 -4.828 16.857 -15.710 590 HD22 LEU 72 1HD2 LEU 72 -5.307 17.164 -14.042 591 HD23 LEU 72 2HD2 LEU 72 -6.473 16.493 -15.186 592 H HIS 73 H HIS 73 -8.093 12.300 -12.965 593 HA HIS 73 HA HIS 73 -8.708 11.879 -15.789 594 HB2 HIS 73 2HB HIS 73 -8.657 10.052 -13.359 595 HB3 HIS 73 3HB HIS 73 -9.340 9.517 -14.888 596 HD1 HIS 73 HD1 HIS 73 -7.709 8.033 -15.983 597 HD2 HIS 73 HD2 HIS 73 -5.819 11.239 -14.135 598 HE1 HIS 73 HE1 HIS 73 -5.264 7.752 -16.473 599 HE2 HIS 73 HE2 HIS 73 -4.148 9.717 -15.376 600 H ASP 74 H ASP 74 -10.587 11.178 -12.797 601 HA ASP 74 HA ASP 74 -12.706 12.884 -13.059 602 HB2 ASP 74 2HB ASP 74 -13.249 11.712 -15.247 603 HB3 ASP 74 3HB ASP 74 -13.489 10.218 -14.355 604 H PHE 75 H PHE 75 -12.048 12.644 -10.858 605 HA PHE 75 HA PHE 75 -13.841 11.022 -9.314 606 HB2 PHE 75 2HB PHE 75 -11.903 9.434 -9.865 607 HB3 PHE 75 3HB PHE 75 -10.855 10.486 -8.928 608 HD1 PHE 75 HD2 PHE 75 -14.172 8.779 -8.489 609 HD2 PHE 75 HD1 PHE 75 -10.399 9.688 -6.765 610 HE1 PHE 75 HE2 PHE 75 -14.737 7.405 -6.530 611 HE2 PHE 75 HE1 PHE 75 -10.951 8.315 -4.825 612 HZ PHE 75 HZ PHE 75 -13.117 7.167 -4.696 613 H THR 76 H THR 76 -14.450 13.091 -8.763 614 HA THR 76 HA THR 76 -12.901 15.277 -8.008 615 HB THR 76 HB THR 76 -15.344 15.279 -8.712 616 HG1 THR 76 HG1 THR 76 -15.952 16.930 -7.000 617 HG21 THR 76 3HG2 THR 76 -16.169 13.509 -7.222 618 HG22 THR 76 1HG2 THR 76 -17.075 15.008 -6.989 619 HG23 THR 76 2HG2 THR 76 -15.838 14.533 -5.822 620 HA PRO 77 HA PRO 77 -11.393 14.588 -3.826 621 HB2 PRO 77 2HB PRO 77 -12.034 17.005 -2.563 622 HB3 PRO 77 3HB PRO 77 -10.631 16.758 -3.625 623 HG2 PRO 77 2HG PRO 77 -13.333 17.890 -4.330 624 HG3 PRO 77 3HG PRO 77 -11.711 18.493 -4.748 625 HD2 PRO 77 2HD PRO 77 -13.062 17.130 -6.558 626 HD3 PRO 77 3HD PRO 77 -11.336 16.778 -6.334 627 H GLU 78 H GLU 78 -14.692 15.654 -4.233 628 HA GLU 78 HA GLU 78 -15.783 15.224 -1.685 629 HB2 GLU 78 2HB GLU 78 -17.145 14.869 -4.392 630 HB3 GLU 78 3HB GLU 78 -17.961 15.115 -2.851 631 HG2 GLU 78 2HG GLU 78 -17.097 17.375 -2.675 632 HG3 GLU 78 3HG GLU 78 -16.082 17.132 -4.106 633 H GLU 79 H GLU 79 -15.453 13.019 -4.466 634 HA GLU 79 HA GLU 79 -16.647 10.742 -3.288 635 HB2 GLU 79 2HB GLU 79 -14.517 10.867 -5.473 636 HB3 GLU 79 3HB GLU 79 -15.493 9.458 -5.073 637 HG2 GLU 79 2HG GLU 79 -16.525 12.074 -6.176 638 HG3 GLU 79 3HG GLU 79 -16.301 10.585 -7.089 639 H ILE 80 H ILE 80 -13.259 11.735 -3.640 640 HA ILE 80 HA ILE 80 -11.927 9.561 -2.532 641 HB ILE 80 HB ILE 80 -11.047 12.490 -2.327 642 HG12 ILE 80 2HG1 ILE 80 -10.593 10.538 -4.637 643 HG13 ILE 80 3HG1 ILE 80 -11.684 11.914 -4.670 644 HG21 ILE 80 1HG2 ILE 80 -9.675 10.958 -0.973 645 HG22 ILE 80 2HG2 ILE 80 -8.744 11.587 -2.331 646 HG23 ILE 80 3HG2 ILE 80 -9.381 9.940 -2.386 647 HD11 ILE 80 3HD1 ILE 80 -9.643 12.383 -5.877 648 HD12 ILE 80 1HD1 ILE 80 -8.680 12.039 -4.439 649 HD13 ILE 80 2HD1 ILE 80 -9.772 13.425 -4.460 650 H LYS 81 H LYS 81 -13.094 12.521 -0.929 651 HA LYS 81 HA LYS 81 -12.072 11.852 1.661 652 HB2 LYS 81 2HB LYS 81 -13.138 13.876 2.451 653 HB3 LYS 81 3HB LYS 81 -12.375 14.200 0.900 654 HG2 LYS 81 2HG LYS 81 -14.734 13.798 -0.110 655 HG3 LYS 81 3HG LYS 81 -15.322 13.974 1.545 656 HD2 LYS 81 2HD LYS 81 -13.665 16.055 0.054 657 HD3 LYS 81 3HD LYS 81 -15.426 16.082 0.187 658 HE2 LYS 81 2HE LYS 81 -15.300 16.367 2.592 659 HE3 LYS 81 3HE LYS 81 -13.540 16.192 2.564 660 HZ1 LYS 81 3HZ LYS 81 -15.098 18.378 1.282 661 HZ2 LYS 81 1HZ LYS 81 -13.419 18.206 1.215 662 HZ3 LYS 81 2HZ LYS 81 -14.178 18.512 2.692 663 H SER 82 H SER 82 -15.168 11.320 0.034 664 HA SER 82 HA SER 82 -16.648 10.570 2.379 665 HB2 SER 82 2HB SER 82 -17.157 9.918 -0.557 666 HB3 SER 82 3HB SER 82 -18.286 9.579 0.758 667 HG SER 82 HG SER 82 -17.271 12.170 0.237 668 H PHE 83 H PHE 83 -14.442 8.926 0.237 669 HA PHE 83 HA PHE 83 -14.972 6.291 1.424 670 HB2 PHE 83 2HB PHE 83 -13.017 7.172 -0.726 671 HB3 PHE 83 3HB PHE 83 -13.179 5.513 -0.166 672 HD1 PHE 83 HD2 PHE 83 -16.064 5.082 -0.018 673 HD2 PHE 83 HD1 PHE 83 -13.809 7.250 -2.937 674 HE1 PHE 83 HE2 PHE 83 -17.821 4.681 -1.692 675 HE2 PHE 83 HE1 PHE 83 -15.577 6.842 -4.600 676 HZ PHE 83 HZ PHE 83 -17.582 5.560 -3.977 677 H PHE 84 H PHE 84 -12.983 9.009 2.060 678 HA PHE 84 HA PHE 84 -11.156 7.621 3.838 679 HB2 PHE 84 2HB PHE 84 -11.829 10.528 3.329 680 HB3 PHE 84 3HB PHE 84 -11.042 10.115 4.844 681 HD1 PHE 84 HD2 PHE 84 -8.864 8.683 4.679 682 HD2 PHE 84 HD1 PHE 84 -10.457 10.963 1.429 683 HE1 PHE 84 HE2 PHE 84 -6.647 8.733 3.628 684 HE2 PHE 84 HE1 PHE 84 -8.219 11.016 0.388 685 HZ PHE 84 HZ PHE 84 -6.317 9.901 1.487 686 H GLU 85 H GLU 85 -14.255 9.234 4.040 687 HA GLU 85 HA GLU 85 -14.658 8.882 6.880 688 HB2 GLU 85 2HB GLU 85 -16.565 9.686 4.627 689 HB3 GLU 85 3HB GLU 85 -16.984 9.715 6.340 690 HG2 GLU 85 2HG GLU 85 -15.426 11.464 6.799 691 HG3 GLU 85 3HG GLU 85 -14.654 11.294 5.227 692 H ASN 86 H ASN 86 -16.685 7.723 7.623 693 HA ASN 86 HA ASN 86 -17.390 5.322 6.125 694 HB2 ASN 86 2HB ASN 86 -16.752 3.791 7.969 695 HB3 ASN 86 3HB ASN 86 -15.354 4.624 7.304 696 HD21 ASN 86 1HD2 ASN 86 -14.358 6.286 8.559 697 HD22 ASN 86 2HD2 ASN 86 -14.541 6.328 10.279 698 H LYS 87 H LYS 87 -19.410 4.681 6.522 699 HA LYS 87 HA LYS 87 -20.882 5.636 8.901 700 HB2 LYS 87 2HB LYS 87 -21.915 5.687 6.017 701 HB3 LYS 87 3HB LYS 87 -22.913 5.963 7.441 702 HG2 LYS 87 2HG LYS 87 -21.553 7.995 7.967 703 HG3 LYS 87 3HG LYS 87 -20.616 7.715 6.496 704 HD2 LYS 87 2HD LYS 87 -22.369 9.441 6.167 705 HD3 LYS 87 3HD LYS 87 -22.610 8.048 5.109 706 HE2 LYS 87 2HE LYS 87 -24.732 8.862 6.104 707 HE3 LYS 87 3HE LYS 87 -24.377 7.202 6.567 708 HZ1 LYS 87 3HZ LYS 87 -25.150 8.409 8.473 709 HZ2 LYS 87 1HZ LYS 87 -24.002 9.626 8.248 710 HZ3 LYS 87 2HZ LYS 87 -23.512 8.076 8.700 711 H GLY 88 H GLY 88 -20.211 3.458 9.585 712 HA2 GLY 88 2HA GLY 88 -20.914 1.305 10.128 713 HA3 GLY 88 3HA GLY 88 -22.113 1.367 8.845 714 H LYS 89 H LYS 89 -20.562 1.945 6.636 715 HA LYS 89 HA LYS 89 -19.119 -0.510 6.110 716 HB2 LYS 89 2HB LYS 89 -20.609 0.534 4.405 717 HB3 LYS 89 3HB LYS 89 -19.578 1.957 4.367 718 HG2 LYS 89 2HG LYS 89 -19.113 0.586 2.430 719 HG3 LYS 89 3HG LYS 89 -17.710 0.558 3.497 720 HD2 LYS 89 2HD LYS 89 -18.186 -1.677 2.552 721 HD3 LYS 89 3HD LYS 89 -18.332 -1.673 4.309 722 HE2 LYS 89 2HE LYS 89 -20.139 -2.971 3.194 723 HE3 LYS 89 3HE LYS 89 -20.773 -1.622 4.141 724 HZ1 LYS 89 3HZ LYS 89 -21.843 -1.807 1.980 725 HZ2 LYS 89 1HZ LYS 89 -20.359 -1.617 1.202 726 HZ3 LYS 89 2HZ LYS 89 -21.003 -0.349 2.109 727 H ARG 90 H ARG 90 -16.951 -0.726 5.865 728 HA ARG 90 HA ARG 90 -15.135 0.991 7.200 729 HB2 ARG 90 2HB ARG 90 -14.846 -1.446 7.084 730 HB3 ARG 90 3HB ARG 90 -14.677 -1.383 5.336 731 HG2 ARG 90 2HG ARG 90 -12.537 -0.267 5.526 732 HG3 ARG 90 3HG ARG 90 -12.725 -0.098 7.273 733 HD2 ARG 90 2HD ARG 90 -12.414 -2.701 5.737 734 HD3 ARG 90 3HD ARG 90 -11.203 -1.936 6.765 735 HE ARG 90 HE ARG 90 -13.327 -3.631 7.586 736 HH11 ARG 90 1HH1 ARG 90 -11.517 -0.815 8.748 737 HH12 ARG 90 2HH1 ARG 90 -11.827 -1.180 10.415 738 HH21 ARG 90 1HH2 ARG 90 -13.679 -4.066 9.766 739 HH22 ARG 90 2HH2 ARG 90 -13.040 -3.006 10.981 740 HA PRO 91 HA PRO 91 -14.169 3.859 3.859 741 HB2 PRO 91 2HB PRO 91 -11.767 4.886 4.719 742 HB3 PRO 91 3HB PRO 91 -13.314 5.283 5.492 743 HG2 PRO 91 2HG PRO 91 -11.248 3.285 6.356 744 HG3 PRO 91 3HG PRO 91 -12.135 4.483 7.328 745 HD2 PRO 91 2HD PRO 91 -12.890 1.881 7.249 746 HD3 PRO 91 3HD PRO 91 -14.069 3.196 7.416 747 H VAL 92 H VAL 92 -13.151 3.819 1.891 748 HA VAL 92 HA VAL 92 -11.521 1.555 1.136 749 HB VAL 92 HB VAL 92 -12.290 4.005 -0.526 750 HG11 VAL 92 1HG1 VAL 92 -11.292 1.278 -1.440 751 HG12 VAL 92 2HG1 VAL 92 -10.393 2.797 -1.499 752 HG13 VAL 92 3HG1 VAL 92 -11.831 2.589 -2.497 753 HG21 VAL 92 3HG2 VAL 92 -14.141 2.646 -1.434 754 HG22 VAL 92 1HG2 VAL 92 -14.303 2.867 0.309 755 HG23 VAL 92 2HG2 VAL 92 -13.729 1.326 -0.335 756 H PHE 93 H PHE 93 -11.064 5.101 1.008 757 HA PHE 93 HA PHE 93 -8.154 4.883 0.959 758 HB2 PHE 93 2HB PHE 93 -9.978 7.337 1.052 759 HB3 PHE 93 3HB PHE 93 -8.224 7.388 0.891 760 HD1 PHE 93 HD1 PHE 93 -7.174 6.250 -1.161 761 HD2 PHE 93 HD2 PHE 93 -11.318 7.137 -0.894 762 HE1 PHE 93 HE1 PHE 93 -7.371 6.018 -3.601 763 HE2 PHE 93 HE2 PHE 93 -11.531 6.910 -3.327 764 HZ PHE 93 HZ PHE 93 -9.555 6.348 -4.688 765 H VAL 94 H VAL 94 -7.118 4.561 2.790 766 HA VAL 94 HA VAL 94 -8.152 5.639 5.353 767 HB VAL 94 HB VAL 94 -6.454 3.130 4.884 768 HG11 VAL 94 1HG1 VAL 94 -7.615 4.238 7.462 769 HG12 VAL 94 2HG1 VAL 94 -5.909 4.193 7.011 770 HG13 VAL 94 3HG1 VAL 94 -6.785 2.688 7.288 771 HG21 VAL 94 3HG2 VAL 94 -8.781 2.773 4.148 772 HG22 VAL 94 1HG2 VAL 94 -9.381 3.320 5.719 773 HG23 VAL 94 2HG2 VAL 94 -8.432 1.835 5.602 774 H LYS 95 H LYS 95 -6.719 6.846 6.570 775 HA LYS 95 HA LYS 95 -3.856 6.895 5.892 776 HB2 LYS 95 2HB LYS 95 -3.734 9.313 5.910 777 HB3 LYS 95 3HB LYS 95 -4.893 8.808 4.690 778 HG2 LYS 95 2HG LYS 95 -6.762 9.461 6.096 779 HG3 LYS 95 3HG LYS 95 -5.686 9.826 7.449 780 HD2 LYS 95 2HD LYS 95 -5.698 11.282 4.764 781 HD3 LYS 95 3HD LYS 95 -6.435 11.883 6.249 782 HE2 LYS 95 2HE LYS 95 -4.256 12.057 7.323 783 HE3 LYS 95 3HE LYS 95 -3.476 11.276 5.950 784 HZ1 LYS 95 3HZ LYS 95 -4.125 13.170 4.564 785 HZ2 LYS 95 1HZ LYS 95 -3.143 13.640 5.856 786 HZ3 LYS 95 2HZ LYS 95 -4.801 13.935 5.910 787 H GLY 96 H GLY 96 -2.529 7.812 7.525 788 HA2 GLY 96 2HA GLY 96 -2.892 8.958 9.888 789 HA3 GLY 96 3HA GLY 96 -3.438 7.320 10.266 790 H SER 97 H SER 97 -1.517 7.439 11.797 791 HA SER 97 HA SER 97 1.079 6.903 10.719 792 HB2 SER 97 2HB SER 97 0.584 7.489 13.146 793 HB3 SER 97 3HB SER 97 -0.075 5.864 13.353 794 HG SER 97 HG SER 97 2.547 6.715 13.177 795 H LEU 98 H LEU 98 2.071 4.573 11.043 796 HA LEU 98 HA LEU 98 0.875 2.908 9.127 797 HB2 LEU 98 2HB LEU 98 3.291 2.901 9.638 798 HB3 LEU 98 3HB LEU 98 2.967 2.205 11.220 799 HG LEU 98 HG LEU 98 2.110 0.128 10.115 800 HD11 LEU 98 1HD1 LEU 98 3.018 1.401 7.512 801 HD12 LEU 98 2HD1 LEU 98 1.349 1.071 7.982 802 HD13 LEU 98 3HD1 LEU 98 2.466 -0.265 7.724 803 HD21 LEU 98 3HD2 LEU 98 4.431 0.237 10.856 804 HD22 LEU 98 1HD2 LEU 98 4.922 0.919 9.301 805 HD23 LEU 98 2HD2 LEU 98 4.292 -0.729 9.390 806 H GLU 99 H GLU 99 0.915 2.635 12.668 807 HA GLU 99 HA GLU 99 -0.666 0.242 12.843 808 HB2 GLU 99 2HB GLU 99 0.024 2.316 14.976 809 HB3 GLU 99 3HB GLU 99 -0.667 0.723 15.290 810 HG2 GLU 99 2HG GLU 99 1.323 -0.385 14.495 811 HG3 GLU 99 3HG GLU 99 2.007 1.128 13.913 812 H SER 100 H SER 100 -1.358 3.693 12.987 813 HA SER 100 HA SER 100 -3.997 3.609 14.024 814 HB2 SER 100 2HB SER 100 -2.692 5.713 12.239 815 HB3 SER 100 3HB SER 100 -4.118 5.950 13.244 816 HG SER 100 HG SER 100 -2.329 5.033 14.890 817 H ALA 101 H ALA 101 -2.720 3.759 10.744 818 HA ALA 101 HA ALA 101 -5.185 3.800 9.335 819 HB1 ALA 101 3HB ALA 101 -2.378 3.107 8.390 820 HB2 ALA 101 1HB ALA 101 -3.108 4.714 8.395 821 HB3 ALA 101 2HB ALA 101 -3.758 3.453 7.341 822 H ALA 102 H ALA 102 -3.194 1.300 10.709 823 HA ALA 102 HA ALA 102 -4.142 -0.954 9.246 824 HB1 ALA 102 3HB ALA 102 -2.052 -0.947 10.556 825 HB2 ALA 102 1HB ALA 102 -3.124 -2.253 11.059 826 HB3 ALA 102 2HB ALA 102 -2.981 -0.797 12.050 827 H GLU 103 H GLU 103 -4.996 0.500 12.372 828 HA GLU 103 HA GLU 103 -7.102 -1.173 13.179 829 HB2 GLU 103 2HB GLU 103 -6.803 1.822 13.696 830 HB3 GLU 103 3HB GLU 103 -7.790 0.708 14.638 831 HG2 GLU 103 2HG GLU 103 -5.789 -0.453 15.428 832 HG3 GLU 103 3HG GLU 103 -4.772 0.554 14.405 833 H GLN 104 H GLN 104 -7.182 1.871 11.336 834 HA GLN 104 HA GLN 104 -10.001 2.037 10.991 835 HB2 GLN 104 2HB GLN 104 -7.725 3.327 9.435 836 HB3 GLN 104 3HB GLN 104 -9.422 3.768 9.244 837 HG2 GLN 104 2HG GLN 104 -9.521 4.559 11.543 838 HG3 GLN 104 3HG GLN 104 -7.882 3.988 11.846 839 HE21 GLN 104 1HE2 GLN 104 -6.142 5.152 11.032 840 HE22 GLN 104 2HE2 GLN 104 -6.295 6.764 10.427 841 H ALA 105 H ALA 105 -7.467 0.502 9.059 842 HA ALA 105 HA ALA 105 -9.298 -0.200 6.883 843 HB1 ALA 105 3HB ALA 105 -7.328 -1.219 5.824 844 HB2 ALA 105 1HB ALA 105 -6.374 -0.918 7.284 845 HB3 ALA 105 2HB ALA 105 -6.989 0.436 6.333 846 H GLY 106 H GLY 106 -8.431 -1.500 9.900 847 HA2 GLY 106 2HA GLY 106 -9.373 -3.297 11.004 848 HA3 GLY 106 3HA GLY 106 -10.164 -3.786 9.516 849 H ILE 107 H ILE 107 -6.853 -3.313 9.117 850 HA ILE 107 HA ILE 107 -6.402 -6.124 8.538 851 HB ILE 107 HB ILE 107 -4.428 -3.789 8.390 852 HG12 ILE 107 2HG1 ILE 107 -6.186 -4.822 6.117 853 HG13 ILE 107 3HG1 ILE 107 -6.476 -3.329 7.007 854 HG21 ILE 107 1HG2 ILE 107 -3.353 -5.991 8.286 855 HG22 ILE 107 2HG2 ILE 107 -3.238 -5.169 6.728 856 HG23 ILE 107 3HG2 ILE 107 -4.411 -6.466 6.954 857 HD11 ILE 107 3HD1 ILE 107 -4.285 -2.477 6.235 858 HD12 ILE 107 1HD1 ILE 107 -5.409 -2.837 4.928 859 HD13 ILE 107 2HD1 ILE 107 -4.088 -3.947 5.271 860 H VAL 108 H VAL 108 -4.849 -7.458 9.647 861 HA VAL 108 HA VAL 108 -4.508 -7.067 12.426 862 HB VAL 108 HB VAL 108 -2.844 -8.928 10.672 863 HG11 VAL 108 1HG1 VAL 108 -2.629 -10.314 12.709 864 HG12 VAL 108 2HG1 VAL 108 -3.486 -9.075 13.633 865 HG13 VAL 108 3HG1 VAL 108 -1.917 -8.708 12.904 866 HG21 VAL 108 3HG2 VAL 108 -5.224 -9.336 10.219 867 HG22 VAL 108 1HG2 VAL 108 -5.545 -9.518 11.948 868 HG23 VAL 108 2HG2 VAL 108 -4.523 -10.688 11.106 869 H VAL 109 H VAL 109 -3.394 -5.497 13.235 870 HA VAL 109 HA VAL 109 -1.749 -3.711 11.948 871 HB VAL 109 HB VAL 109 -1.863 -4.267 14.942 872 HG11 VAL 109 1HG1 VAL 109 -1.124 -1.931 15.280 873 HG12 VAL 109 2HG1 VAL 109 -0.911 -1.750 13.537 874 HG13 VAL 109 3HG1 VAL 109 0.098 -2.887 14.434 875 HG21 VAL 109 3HG2 VAL 109 -3.567 -2.494 15.071 876 HG22 VAL 109 1HG2 VAL 109 -4.093 -3.791 13.997 877 HG23 VAL 109 2HG2 VAL 109 -3.490 -2.277 13.321 878 H ASP 110 H ASP 110 -0.745 -6.302 14.193 879 HA ASP 110 HA ASP 110 2.005 -5.771 14.223 880 HB2 ASP 110 2HB ASP 110 0.840 -7.245 15.877 881 HB3 ASP 110 3HB ASP 110 0.639 -8.475 14.640 882 H GLU 111 H GLU 111 0.092 -7.787 12.006 883 HA GLU 111 HA GLU 111 2.232 -9.064 10.683 884 HB2 GLU 111 2HB GLU 111 -0.574 -8.414 9.742 885 HB3 GLU 111 3HB GLU 111 0.548 -9.392 8.803 886 HG2 GLU 111 2HG GLU 111 -0.398 -10.091 11.594 887 HG3 GLU 111 3HG GLU 111 -1.163 -10.674 10.122 888 H LEU 112 H LEU 112 0.325 -6.122 9.727 889 HA LEU 112 HA LEU 112 1.990 -5.682 7.435 890 HB2 LEU 112 2HB LEU 112 0.839 -3.531 7.117 891 HB3 LEU 112 3HB LEU 112 -0.245 -4.892 7.308 892 HG LEU 112 HG LEU 112 -0.558 -4.103 9.759 893 HD11 LEU 112 1HD1 LEU 112 -0.282 -1.704 10.204 894 HD12 LEU 112 2HD1 LEU 112 0.579 -1.508 8.676 895 HD13 LEU 112 3HD1 LEU 112 1.268 -2.501 9.959 896 HD21 LEU 112 3HD2 LEU 112 -2.369 -2.716 9.186 897 HD22 LEU 112 1HD2 LEU 112 -2.208 -3.875 7.881 898 HD23 LEU 112 2HD2 LEU 112 -1.638 -2.224 7.655 899 H VAL 113 H VAL 113 2.127 -4.442 10.731 900 HA VAL 113 HA VAL 113 3.998 -2.371 10.315 901 HB VAL 113 HB VAL 113 3.463 -4.033 12.830 902 HG11 VAL 113 1HG1 VAL 113 5.232 -1.558 12.605 903 HG12 VAL 113 2HG1 VAL 113 5.781 -3.197 12.966 904 HG13 VAL 113 3HG1 VAL 113 4.751 -2.344 14.115 905 HG21 VAL 113 3HG2 VAL 113 2.314 -2.002 13.641 906 HG22 VAL 113 1HG2 VAL 113 1.618 -2.546 12.114 907 HG23 VAL 113 2HG2 VAL 113 2.712 -1.163 12.136 908 H GLN 114 H GLN 114 4.384 -5.834 11.001 909 HA GLN 114 HA GLN 114 7.213 -5.813 11.159 910 HB2 GLN 114 2HB GLN 114 5.252 -8.060 10.624 911 HB3 GLN 114 3HB GLN 114 6.985 -8.326 10.728 912 HG2 GLN 114 2HG GLN 114 5.269 -7.167 12.934 913 HG3 GLN 114 3HG GLN 114 5.844 -8.832 12.846 914 HE21 GLN 114 1HE2 GLN 114 6.336 -6.654 14.805 915 HE22 GLN 114 2HE2 GLN 114 8.052 -6.546 14.949 916 H THR 115 H THR 115 5.035 -6.573 8.386 917 HA THR 115 HA THR 115 7.220 -7.217 6.651 918 HB THR 115 HB THR 115 4.904 -8.122 6.301 919 HG1 THR 115 HG1 THR 115 5.966 -6.724 4.039 920 HG21 THR 115 3HG2 THR 115 4.288 -5.377 5.158 921 HG22 THR 115 1HG2 THR 115 3.623 -6.034 6.656 922 HG23 THR 115 2HG2 THR 115 3.235 -6.793 5.112 923 H VAL 116 H VAL 116 5.772 -4.175 7.561 924 HA VAL 116 HA VAL 116 7.067 -2.662 5.425 925 HB VAL 116 HB VAL 116 5.436 -1.762 7.844 926 HG11 VAL 116 1HG1 VAL 116 5.538 0.562 6.962 927 HG12 VAL 116 2HG1 VAL 116 6.736 0.053 5.769 928 HG13 VAL 116 3HG1 VAL 116 7.120 -0.019 7.489 929 HG21 VAL 116 3HG2 VAL 116 3.788 -1.044 6.141 930 HG22 VAL 116 1HG2 VAL 116 4.148 -2.766 5.994 931 HG23 VAL 116 2HG2 VAL 116 4.853 -1.617 4.853 932 H LYS 117 H LYS 117 7.734 -3.348 8.889 933 HA LYS 117 HA LYS 117 9.866 -1.372 9.021 934 HB2 LYS 117 2HB LYS 117 10.196 -2.032 11.323 935 HB3 LYS 117 3HB LYS 117 8.470 -1.917 11.024 936 HG2 LYS 117 2HG LYS 117 8.380 -4.401 10.815 937 HG3 LYS 117 3HG LYS 117 10.083 -4.481 11.243 938 HD2 LYS 117 2HD LYS 117 7.981 -3.243 13.065 939 HD3 LYS 117 3HD LYS 117 8.393 -4.954 13.106 940 HE2 LYS 117 2HE LYS 117 9.599 -3.867 14.870 941 HE3 LYS 117 3HE LYS 117 10.765 -4.315 13.634 942 HZ1 LYS 117 3HZ LYS 117 10.759 -2.011 12.873 943 HZ2 LYS 117 1HZ LYS 117 11.185 -2.122 14.501 944 HZ3 LYS 117 2HZ LYS 117 9.641 -1.604 14.071 945 H ASN 118 H ASN 118 9.668 -4.885 8.689 946 HA ASN 118 HA ASN 118 12.524 -5.288 8.643 947 HB2 ASN 118 2HB ASN 118 10.245 -7.159 7.847 948 HB3 ASN 118 3HB ASN 118 11.945 -7.612 7.792 949 HD21 ASN 118 1HD2 ASN 118 9.200 -7.302 9.781 950 HD22 ASN 118 2HD2 ASN 118 9.928 -7.705 11.284 951 H TYR 119 H TYR 119 9.983 -4.651 6.277 952 HA TYR 119 HA TYR 119 11.448 -4.928 3.895 953 HB2 TYR 119 2HB TYR 119 9.071 -4.463 3.744 954 HB3 TYR 119 3HB TYR 119 9.246 -2.962 4.638 955 HD1 TYR 119 HD1 TYR 119 10.557 -4.515 1.447 956 HD2 TYR 119 HD2 TYR 119 9.103 -0.989 3.377 957 HE1 TYR 119 HE1 TYR 119 10.714 -3.287 -0.674 958 HE2 TYR 119 HE2 TYR 119 9.267 0.234 1.256 959 HH TYR 119 HH TYR 119 10.216 0.164 -0.858 960 H GLN 120 H GLN 120 10.895 -1.931 5.766 961 HA GLN 120 HA GLN 120 12.879 -0.366 4.553 962 HB2 GLN 120 2HB GLN 120 11.478 -0.131 7.246 963 HB3 GLN 120 3HB GLN 120 12.663 1.057 6.699 964 HG2 GLN 120 2HG GLN 120 11.192 1.338 4.611 965 HG3 GLN 120 3HG GLN 120 9.975 0.410 5.483 966 HE21 GLN 120 1HE2 GLN 120 8.746 2.398 5.123 967 HE22 GLN 120 2HE2 GLN 120 8.878 3.702 6.244 968 H GLY 121 H GLY 121 13.073 -2.763 7.044 969 HA2 GLY 121 2HA GLY 121 15.574 -2.069 8.208 970 HA3 GLY 121 3HA GLY 121 14.798 -3.652 8.245 971 H TYR 122 H TYR 122 14.613 -4.243 5.521 972 HA TYR 122 HA TYR 122 17.402 -4.861 4.973 973 HB2 TYR 122 2HB TYR 122 16.654 -6.472 3.347 974 HB3 TYR 122 3HB TYR 122 15.845 -6.709 4.873 975 HD1 TYR 122 HD2 TYR 122 15.000 -4.672 1.767 976 HD2 TYR 122 HD1 TYR 122 13.777 -7.703 4.516 977 HE1 TYR 122 HE2 TYR 122 12.921 -4.997 0.506 978 HE2 TYR 122 HE1 TYR 122 11.707 -8.032 3.232 979 HH TYR 122 HH TYR 122 10.292 -6.779 1.665 980 H VAL 123 H VAL 123 15.123 -2.551 3.872 981 HA VAL 123 HA VAL 123 16.205 -1.864 1.355 982 HB VAL 123 HB VAL 123 14.858 -0.067 3.439 983 HG11 VAL 123 1HG1 VAL 123 15.613 0.635 0.570 984 HG12 VAL 123 2HG1 VAL 123 16.251 1.370 2.043 985 HG13 VAL 123 3HG1 VAL 123 14.561 1.609 1.603 986 HG21 VAL 123 3HG2 VAL 123 12.867 -0.192 1.994 987 HG22 VAL 123 1HG2 VAL 123 13.381 -1.808 2.466 988 HG23 VAL 123 2HG2 VAL 123 13.732 -1.215 0.849 989 H GLN 124 H GLN 124 16.975 -0.688 4.634 990 HA GLN 124 HA GLN 124 19.141 1.003 3.759 991 HB2 GLN 124 2HB GLN 124 19.477 1.444 6.192 992 HB3 GLN 124 3HB GLN 124 17.820 1.702 5.662 993 HG2 GLN 124 2HG GLN 124 17.211 -0.530 6.581 994 HG3 GLN 124 3HG GLN 124 18.854 -0.691 7.206 995 HE21 GLN 124 1HE2 GLN 124 16.272 -0.596 8.621 996 HE22 GLN 124 2HE2 GLN 124 16.409 0.690 9.762 997 H ASP 125 H ASP 125 18.911 -2.334 4.751 998 HA ASP 125 HA ASP 125 21.779 -2.713 5.041 999 HB2 ASP 125 2HB ASP 125 19.391 -4.592 4.893 1000 HB3 ASP 125 3HB ASP 125 21.018 -5.239 4.716 1001 H GLY 126 H GLY 126 19.485 -2.667 2.412 1002 HA2 GLY 126 2HA GLY 126 19.801 -2.624 0.134 1003 HA3 GLY 126 3HA GLY 126 21.534 -2.713 0.404 1004 H HIS 127 H HIS 127 19.017 -5.039 1.402 1005 HA HIS 127 HA HIS 127 19.455 -6.867 -0.775 1006 HB2 HIS 127 2HB HIS 127 21.501 -7.430 0.504 1007 HB3 HIS 127 3HB HIS 127 20.565 -7.639 1.975 1008 HD1 HIS 127 HD1 HIS 127 21.263 -9.314 -1.337 1009 HD2 HIS 127 HD2 HIS 127 19.385 -10.184 2.276 1010 HE1 HIS 127 HE1 HIS 127 20.830 -11.789 -1.374 1011 HE2 HIS 127 HE2 HIS 127 19.552 -12.256 0.738 1012 H ASP 128 H ASP 128 17.356 -7.464 -1.084 1013 HA ASP 128 HA ASP 128 15.402 -7.521 1.000 1014 HB2 ASP 128 2HB ASP 128 13.814 -8.237 -0.647 1015 HB3 ASP 128 3HB ASP 128 14.882 -7.098 -1.455 1016 H HIS 129 H HIS 129 14.203 -9.415 1.734 1017 HA HIS 129 HA HIS 129 15.961 -11.802 2.006 1018 HB2 HIS 129 2HB HIS 129 14.147 -10.429 4.014 1019 HB3 HIS 129 3HB HIS 129 14.690 -12.084 4.255 1020 HD1 HIS 129 HD1 HIS 129 16.602 -12.154 5.816 1021 HD2 HIS 129 HD2 HIS 129 16.684 -8.715 3.491 1022 HE1 HIS 129 HE1 HIS 129 18.651 -10.903 6.538 1023 HE2 HIS 129 HE2 HIS 129 18.524 -8.723 5.296 1024 H ASP 130 H ASP 130 12.875 -10.775 0.873 1025 HA ASP 130 HA ASP 130 11.955 -13.521 0.516 1026 HB2 ASP 130 2HB ASP 130 11.172 -12.839 2.807 1027 HB3 ASP 130 3HB ASP 130 10.288 -11.499 2.091 1028 H PHE 131 H PHE 131 12.349 -12.971 -1.651 1029 HA PHE 131 HA PHE 131 12.158 -12.035 -3.713 1030 HB2 PHE 131 2HB PHE 131 9.908 -12.393 -4.752 1031 HB3 PHE 131 3HB PHE 131 10.502 -13.772 -3.844 1032 HD1 PHE 131 HD2 PHE 131 8.082 -10.928 -3.733 1033 HD2 PHE 131 HD1 PHE 131 9.201 -14.707 -2.071 1034 HE1 PHE 131 HE2 PHE 131 5.958 -11.021 -2.496 1035 HE2 PHE 131 HE1 PHE 131 7.083 -14.786 -0.844 1036 HZ PHE 131 HZ PHE 131 5.454 -12.945 -1.047 1037 H GLY 132 H GLY 132 12.281 -9.925 -1.816 1038 HA2 GLY 132 2HA GLY 132 10.180 -8.066 -1.906 1039 HA3 GLY 132 3HA GLY 132 11.824 -7.737 -1.395 1040 H ARG 133 H ARG 133 13.438 -7.402 -3.213 1041 HA ARG 133 HA ARG 133 12.853 -6.416 -5.729 1042 HB2 ARG 133 2HB ARG 133 11.275 -4.873 -4.804 1043 HB3 ARG 133 3HB ARG 133 12.347 -4.419 -3.490 1044 HG2 ARG 133 2HG ARG 133 13.700 -3.090 -4.924 1045 HG3 ARG 133 3HG ARG 133 12.939 -3.743 -6.379 1046 HD2 ARG 133 2HD ARG 133 11.426 -2.146 -4.285 1047 HD3 ARG 133 3HD ARG 133 12.184 -1.419 -5.703 1048 HE ARG 133 HE ARG 133 10.648 -3.399 -6.771 1049 HH11 ARG 133 1HH1 ARG 133 9.897 -0.735 -4.601 1050 HH12 ARG 133 2HH1 ARG 133 8.266 -0.575 -5.168 1051 HH21 ARG 133 1HH2 ARG 133 8.499 -3.133 -7.545 1052 HH22 ARG 133 2HH2 ARG 133 7.474 -1.913 -6.818 1053 H ASP 134 H ASP 134 14.630 -5.225 -6.667 1054 HA ASP 134 HA ASP 134 17.214 -5.777 -5.722 1055 HB2 ASP 134 2HB ASP 134 16.505 -5.155 -8.142 1056 HB3 ASP 134 3HB ASP 134 16.549 -3.484 -7.626 1057 HA PRO 135 HA PRO 135 18.151 -2.827 -2.377 1058 HB2 PRO 135 2HB PRO 135 20.761 -2.208 -3.513 1059 HB3 PRO 135 3HB PRO 135 20.376 -3.287 -2.166 1060 HG2 PRO 135 2HG PRO 135 20.794 -3.952 -5.041 1061 HG3 PRO 135 3HG PRO 135 21.119 -4.928 -3.587 1062 HD2 PRO 135 2HD PRO 135 19.049 -5.533 -5.135 1063 HD3 PRO 135 3HD PRO 135 18.866 -5.587 -3.363 1064 H LYS 136 H LYS 136 19.031 -1.761 -5.701 1065 HA LYS 136 HA LYS 136 19.280 1.009 -4.994 1066 HB2 LYS 136 2HB LYS 136 19.587 1.433 -7.366 1067 HB3 LYS 136 3HB LYS 136 20.444 -0.046 -6.942 1068 HG2 LYS 136 2HG LYS 136 18.530 -1.374 -7.848 1069 HG3 LYS 136 3HG LYS 136 17.753 0.133 -8.324 1070 HD2 LYS 136 2HD LYS 136 18.814 -0.904 -10.240 1071 HD3 LYS 136 3HD LYS 136 19.628 0.624 -9.864 1072 HE2 LYS 136 2HE LYS 136 21.389 -0.755 -8.656 1073 HE3 LYS 136 3HE LYS 136 20.586 -2.194 -9.311 1074 HZ1 LYS 136 3HZ LYS 136 20.963 -1.274 -11.549 1075 HZ2 LYS 136 1HZ LYS 136 22.408 -1.569 -10.725 1076 HZ3 LYS 136 2HZ LYS 136 21.826 0.008 -10.877 1077 H TYR 137 H TYR 137 16.551 -0.939 -5.904 1078 HA TYR 137 HA TYR 137 14.834 1.410 -6.417 1079 HB2 TYR 137 2HB TYR 137 14.223 -1.549 -6.822 1080 HB3 TYR 137 3HB TYR 137 13.170 -0.212 -7.265 1081 HD1 TYR 137 HD2 TYR 137 14.386 1.615 -8.863 1082 HD2 TYR 137 HD1 TYR 137 15.471 -2.503 -8.556 1083 HE1 TYR 137 HE2 TYR 137 15.439 1.725 -11.081 1084 HE2 TYR 137 HE1 TYR 137 16.540 -2.390 -10.764 1085 HH TYR 137 HH TYR 137 16.375 -1.049 -12.812 1086 H LEU 138 H LEU 138 15.646 -0.760 -3.917 1087 HA LEU 138 HA LEU 138 13.245 -0.965 -2.460 1088 HB2 LEU 138 2HB LEU 138 16.168 -1.021 -1.663 1089 HB3 LEU 138 3HB LEU 138 14.925 -1.123 -0.438 1090 HG LEU 138 HG LEU 138 15.335 -3.114 -2.706 1091 HD11 LEU 138 1HD1 LEU 138 15.874 -3.472 0.267 1092 HD12 LEU 138 2HD1 LEU 138 17.096 -3.272 -0.989 1093 HD13 LEU 138 3HD1 LEU 138 16.064 -4.697 -0.994 1094 HD21 LEU 138 3HD2 LEU 138 13.333 -3.192 -0.422 1095 HD22 LEU 138 1HD2 LEU 138 13.618 -4.481 -1.597 1096 HD23 LEU 138 2HD2 LEU 138 12.966 -2.934 -2.130 1097 H HIS 139 H HIS 139 12.008 0.621 -1.674 1098 HA HIS 139 HA HIS 139 13.170 3.283 -1.017 1099 HB2 HIS 139 2HB HIS 139 11.958 3.422 -3.139 1100 HB3 HIS 139 3HB HIS 139 10.556 2.621 -2.450 1101 HD1 HIS 139 HD1 HIS 139 8.726 4.187 -1.804 1102 HD2 HIS 139 HD2 HIS 139 12.441 6.062 -1.755 1103 HE1 HIS 139 HE1 HIS 139 8.261 6.590 -1.233 1104 HE2 HIS 139 HE2 HIS 139 10.542 7.638 -0.993 1105 H GLN 140 H GLN 140 12.908 3.736 1.099 1106 HA GLN 140 HA GLN 140 10.848 2.554 2.753 1107 HB2 GLN 140 2HB GLN 140 12.671 4.894 3.450 1108 HB3 GLN 140 3HB GLN 140 11.754 3.909 4.574 1109 HG2 GLN 140 2HG GLN 140 13.118 1.956 4.026 1110 HG3 GLN 140 3HG GLN 140 14.019 2.897 2.848 1111 HE21 GLN 140 1HE2 GLN 140 15.028 1.430 5.142 1112 HE22 GLN 140 2HE2 GLN 140 15.850 2.574 6.139 1113 H PHE 141 H PHE 141 9.207 3.796 3.854 1114 HA PHE 141 HA PHE 141 7.804 5.499 2.005 1115 HB2 PHE 141 2HB PHE 141 6.992 4.544 4.781 1116 HB3 PHE 141 3HB PHE 141 5.931 5.331 3.612 1117 HD1 PHE 141 HD1 PHE 141 5.697 4.174 1.282 1118 HD2 PHE 141 HD2 PHE 141 7.145 2.188 4.774 1119 HE1 PHE 141 HE1 PHE 141 5.194 1.996 0.270 1120 HE2 PHE 141 HE2 PHE 141 6.634 0.023 3.763 1121 HZ PHE 141 HZ PHE 141 5.669 -0.080 1.494 1122 H GLU 142 H GLU 142 8.784 7.397 1.853 1123 HA GLU 142 HA GLU 142 9.604 9.011 4.116 1124 HB2 GLU 142 2HB GLU 142 9.533 9.631 1.127 1125 HB3 GLU 142 3HB GLU 142 10.286 10.649 2.359 1126 HG2 GLU 142 2HG GLU 142 11.879 8.849 2.883 1127 HG3 GLU 142 3HG GLU 142 11.110 7.811 1.682 1128 H GLY 143 H GLY 143 7.810 9.631 5.273 1129 HA2 GLY 143 2HA GLY 143 6.357 11.887 4.601 1130 HA3 GLY 143 3HA GLY 143 5.343 10.520 4.126 1131 H GLU 144 H GLU 144 5.123 12.606 6.301 1132 HA GLU 144 HA GLU 144 5.383 11.403 8.860 1133 HB2 GLU 144 2HB GLU 144 3.506 13.631 7.936 1134 HB3 GLU 144 3HB GLU 144 3.853 13.236 9.619 1135 HG2 GLU 144 2HG GLU 144 6.194 13.896 9.326 1136 HG3 GLU 144 3HG GLU 144 5.921 14.197 7.612 1137 H THR 145 H THR 145 3.064 10.963 6.335 1138 HA THR 145 HA THR 145 1.270 9.416 8.117 1139 HB THR 145 HB THR 145 0.422 11.232 5.802 1140 HG1 THR 145 HG1 THR 145 0.992 12.350 7.728 1141 HG21 THR 145 3HG2 THR 145 -1.300 9.583 7.703 1142 HG22 THR 145 1HG2 THR 145 -1.073 9.275 5.978 1143 HG23 THR 145 2HG2 THR 145 -1.888 10.741 6.512 1144 H PHE 146 H PHE 146 0.882 7.399 7.469 1145 HA PHE 146 HA PHE 146 1.571 6.366 4.823 1146 HB2 PHE 146 2HB PHE 146 0.580 5.082 7.405 1147 HB3 PHE 146 3HB PHE 146 0.646 4.175 5.899 1148 HD1 PHE 146 HD2 PHE 146 2.803 6.061 8.335 1149 HD2 PHE 146 HD1 PHE 146 2.650 3.148 5.204 1150 HE1 PHE 146 HE2 PHE 146 5.155 5.451 8.768 1151 HE2 PHE 146 HE1 PHE 146 4.985 2.551 5.647 1152 HZ PHE 146 HZ PHE 146 6.248 3.687 7.413 1153 H TYR 147 H TYR 147 0.072 5.663 3.334 1154 HA TYR 147 HA TYR 147 -2.817 6.025 3.885 1155 HB2 TYR 147 2HB TYR 147 -1.246 6.628 1.338 1156 HB3 TYR 147 3HB TYR 147 -2.997 6.441 1.342 1157 HD1 TYR 147 HD1 TYR 147 -0.233 8.497 2.827 1158 HD2 TYR 147 HD2 TYR 147 -4.402 8.279 1.915 1159 HE1 TYR 147 HE1 TYR 147 -0.493 10.864 3.433 1160 HE2 TYR 147 HE2 TYR 147 -4.657 10.647 2.516 1161 HH TYR 147 HH TYR 147 -1.916 12.709 3.139 1162 H ILE 148 H ILE 148 -3.736 4.105 4.042 1163 HA ILE 148 HA ILE 148 -2.815 1.797 2.451 1164 HB ILE 148 HB ILE 148 -4.638 1.918 4.907 1165 HG12 ILE 148 2HG1 ILE 148 -1.804 0.831 4.516 1166 HG13 ILE 148 3HG1 ILE 148 -2.261 2.233 5.473 1167 HG21 ILE 148 1HG2 ILE 148 -5.404 0.128 3.396 1168 HG22 ILE 148 2HG2 ILE 148 -4.680 -0.547 4.853 1169 HG23 ILE 148 3HG2 ILE 148 -3.770 -0.540 3.341 1170 HD11 ILE 148 3HD1 ILE 148 -3.473 0.731 7.024 1171 HD12 ILE 148 1HD1 ILE 148 -1.748 0.383 6.909 1172 HD13 ILE 148 2HD1 ILE 148 -2.908 -0.651 6.079 1173 H ILE 149 H ILE 149 -3.841 1.538 0.563 1174 HA ILE 149 HA ILE 149 -6.527 2.695 0.121 1175 HB ILE 149 HB ILE 149 -4.552 1.736 -2.016 1176 HG12 ILE 149 2HG1 ILE 149 -3.404 3.488 -0.749 1177 HG13 ILE 149 3HG1 ILE 149 -3.880 4.130 -2.313 1178 HG21 ILE 149 1HG2 ILE 149 -6.868 1.940 -2.795 1179 HG22 ILE 149 2HG2 ILE 149 -5.863 3.186 -3.532 1180 HG23 ILE 149 3HG2 ILE 149 -6.951 3.607 -2.207 1181 HD11 ILE 149 3HD1 ILE 149 -4.199 5.764 -0.559 1182 HD12 ILE 149 1HD1 ILE 149 -5.258 4.661 0.321 1183 HD13 ILE 149 2HD1 ILE 149 -5.751 5.299 -1.247 1184 H GLU 150 H GLU 150 -8.090 1.205 0.406 1185 HA GLU 150 HA GLU 150 -7.826 -1.605 0.209 1186 HB2 GLU 150 2HB GLU 150 -9.510 -0.344 1.576 1187 HB3 GLU 150 3HB GLU 150 -10.352 0.108 0.106 1188 HG2 GLU 150 2HG GLU 150 -9.962 -2.820 0.548 1189 HG3 GLU 150 3HG GLU 150 -11.031 -2.009 1.682 1190 H GLN 151 H GLN 151 -7.319 -2.554 -1.625 1191 HA GLN 151 HA GLN 151 -8.588 -1.814 -4.204 1192 HB2 GLN 151 2HB GLN 151 -5.865 -3.108 -3.664 1193 HB3 GLN 151 3HB GLN 151 -6.551 -2.896 -5.270 1194 HG2 GLN 151 2HG GLN 151 -5.865 -0.634 -3.366 1195 HG3 GLN 151 3HG GLN 151 -4.842 -1.190 -4.690 1196 HE21 GLN 151 1HE2 GLN 151 -7.851 0.446 -3.890 1197 HE22 GLN 151 2HE2 GLN 151 -8.082 1.173 -5.439 1198 H ARG 152 H ARG 152 -10.322 -3.161 -4.279 1199 HA ARG 152 HA ARG 152 -10.079 -6.055 -3.703 1200 HB2 ARG 152 2HB ARG 152 -11.864 -4.719 -2.604 1201 HB3 ARG 152 3HB ARG 152 -12.523 -4.310 -4.183 1202 HG2 ARG 152 2HG ARG 152 -13.134 -6.620 -4.588 1203 HG3 ARG 152 3HG ARG 152 -12.316 -7.143 -3.107 1204 HD2 ARG 152 2HD ARG 152 -14.758 -6.980 -2.843 1205 HD3 ARG 152 3HD ARG 152 -13.906 -5.909 -1.741 1206 HE ARG 152 HE ARG 152 -15.407 -5.085 -4.166 1207 HH11 ARG 152 1HH1 ARG 152 -13.901 -4.217 -1.115 1208 HH12 ARG 152 2HH1 ARG 152 -14.532 -2.602 -1.111 1209 HH21 ARG 152 1HH2 ARG 152 -16.180 -2.937 -4.200 1210 HH22 ARG 152 2HH2 ARG 152 -15.833 -1.872 -2.870 1211 H LEU 153 H LEU 153 -10.986 -7.589 -5.281 1212 HA LEU 153 HA LEU 153 -10.202 -7.079 -7.974 1213 HB2 LEU 153 2HB LEU 153 -11.769 -9.396 -6.792 1214 HB3 LEU 153 3HB LEU 153 -11.223 -9.338 -8.465 1215 HG LEU 153 HG LEU 153 -9.394 -9.365 -6.023 1216 HD11 LEU 153 1HD1 LEU 153 -10.543 -11.510 -6.336 1217 HD12 LEU 153 2HD1 LEU 153 -8.822 -11.647 -6.688 1218 HD13 LEU 153 3HD1 LEU 153 -9.989 -11.579 -8.013 1219 HD21 LEU 153 3HD2 LEU 153 -8.387 -8.127 -7.885 1220 HD22 LEU 153 1HD2 LEU 153 -8.701 -9.474 -8.984 1221 HD23 LEU 153 2HD2 LEU 153 -7.559 -9.664 -7.650 1222 H GLU 154 H GLU 154 -11.771 -7.993 -9.713 1223 HA GLU 154 HA GLU 154 -13.743 -6.020 -10.257 1224 HB2 GLU 154 2HB GLU 154 -12.090 -7.755 -11.714 1225 HB3 GLU 154 3HB GLU 154 -13.669 -8.474 -11.959 1226 HG2 GLU 154 2HG GLU 154 -13.084 -5.566 -12.511 1227 HG3 GLU 154 3HG GLU 154 -12.885 -6.835 -13.718 1228 H HIS 155 H HIS 155 -15.984 -6.869 -11.209 1229 HA HIS 155 HA HIS 155 -17.313 -8.751 -9.410 1230 HB2 HIS 155 2HB HIS 155 -18.959 -6.973 -8.686 1231 HB3 HIS 155 3HB HIS 155 -17.327 -6.695 -8.088 1232 HD1 HIS 155 HD1 HIS 155 -20.031 -4.953 -9.659 1233 HD2 HIS 155 HD2 HIS 155 -15.882 -4.747 -9.940 1234 HE1 HIS 155 HE1 HIS 155 -19.538 -2.721 -10.682 1235 HE2 HIS 155 HE2 HIS 155 -17.034 -2.534 -10.628 1236 H HIS 156 H HIS 156 -17.657 -6.363 -12.074 1237 HA HIS 156 HA HIS 156 -19.352 -8.181 -13.602 1238 HB2 HIS 156 2HB HIS 156 -20.351 -5.424 -12.747 1239 HB3 HIS 156 3HB HIS 156 -21.061 -6.336 -14.072 1240 HD1 HIS 156 HD1 HIS 156 -22.318 -8.562 -13.395 1241 HD2 HIS 156 HD2 HIS 156 -21.281 -6.083 -10.233 1242 HE1 HIS 156 HE1 HIS 156 -23.632 -9.398 -11.432 1243 HE2 HIS 156 HE2 HIS 156 -22.862 -7.989 -9.500 1244 H HIS 157 H HIS 157 -18.174 -8.278 -15.379 1245 HA HIS 157 HA HIS 157 -16.105 -6.568 -16.138 1246 HB2 HIS 157 2HB HIS 157 -16.121 -8.939 -16.716 1247 HB3 HIS 157 3HB HIS 157 -17.556 -8.739 -17.704 1248 HD1 HIS 157 HD1 HIS 157 -17.246 -7.668 -20.062 1249 HD2 HIS 157 HD2 HIS 157 -13.689 -8.335 -18.005 1250 HE1 HIS 157 HE1 HIS 157 -15.426 -7.445 -21.779 1251 HE2 HIS 157 HE2 HIS 157 -13.286 -7.851 -20.511 1252 H HIS 158 H HIS 158 -16.890 -4.455 -16.284 1253 HA HIS 158 HA HIS 158 -17.712 -2.550 -17.213 1254 HB2 HIS 158 2HB HIS 158 -16.059 -3.170 -18.940 1255 HB3 HIS 158 3HB HIS 158 -17.249 -4.157 -19.772 1256 HD1 HIS 158 HD1 HIS 158 -17.091 -0.492 -18.704 1257 HD2 HIS 158 HD2 HIS 158 -18.118 -2.841 -21.976 1258 HE1 HIS 158 HE1 HIS 158 -17.914 1.105 -20.453 1259 HE2 HIS 158 HE2 HIS 158 -18.619 -0.345 -22.376 1260 H HIS 159 H HIS 159 -19.658 -4.271 -16.203 1261 HA HIS 159 HA HIS 159 -22.028 -3.860 -17.886 1262 HB2 HIS 159 2HB HIS 159 -20.898 -6.126 -18.424 1263 HB3 HIS 159 3HB HIS 159 -21.330 -6.632 -16.800 1264 HD1 HIS 159 HD1 HIS 159 -23.754 -7.376 -16.422 1265 HD2 HIS 159 HD2 HIS 159 -23.104 -5.796 -20.209 1266 HE1 HIS 159 HE1 HIS 159 -25.813 -7.931 -17.748 1267 HE2 HIS 159 HE2 HIS 159 -25.322 -7.101 -20.068 1268 H HIS 160 H HIS 160 -24.012 -4.699 -16.629 1269 HA HIS 160 HA HIS 160 -23.763 -4.370 -13.698 1270 HB2 HIS 160 2HB HIS 160 -24.904 -2.431 -14.711 1271 HB3 HIS 160 3HB HIS 160 -26.012 -3.482 -15.580 1272 HD1 HIS 160 HD1 HIS 160 -25.513 -1.782 -12.337 1273 HD2 HIS 160 HD2 HIS 160 -28.056 -4.680 -13.892 1274 HE1 HIS 160 HE1 HIS 160 -27.448 -1.913 -10.742 1275 HE2 HIS 160 HE2 HIS 160 -28.853 -3.808 -11.599 Start of MODEL 18 1 H1 MET 1 1H MET 1 -19.225 20.094 -22.776 2 H2 MET 1 2H MET 1 -19.173 20.599 -21.166 3 H3 MET 1 3H MET 1 -20.518 20.961 -22.120 4 HA MET 1 HA MET 1 -20.978 19.145 -20.586 5 HB2 MET 1 2HB MET 1 -20.859 18.350 -23.533 6 HB3 MET 1 3HB MET 1 -21.751 17.448 -22.313 7 HG2 MET 1 2HG MET 1 -22.301 20.317 -23.088 8 HG3 MET 1 3HG MET 1 -23.191 18.911 -23.684 9 HE1 MET 1 3HE MET 1 -24.857 21.243 -22.416 10 HE2 MET 1 1HE MET 1 -25.920 20.323 -21.352 11 HE3 MET 1 2HE MET 1 -25.517 19.695 -22.949 12 H VAL 2 H VAL 2 -19.473 18.191 -19.240 13 HA VAL 2 HA VAL 2 -17.288 16.574 -20.230 14 HB VAL 2 HB VAL 2 -16.805 16.013 -17.887 15 HG11 VAL 2 1HG1 VAL 2 -17.474 18.969 -18.184 16 HG12 VAL 2 2HG1 VAL 2 -15.978 18.180 -18.678 17 HG13 VAL 2 3HG1 VAL 2 -16.391 18.283 -16.967 18 HG21 VAL 2 3HG2 VAL 2 -18.215 16.807 -16.006 19 HG22 VAL 2 1HG2 VAL 2 -19.095 15.683 -17.045 20 HG23 VAL 2 2HG2 VAL 2 -19.409 17.415 -17.154 21 H GLU 3 H GLU 3 -17.038 14.334 -19.685 22 HA GLU 3 HA GLU 3 -19.384 12.728 -20.277 23 HB2 GLU 3 2HB GLU 3 -16.407 12.086 -20.040 24 HB3 GLU 3 3HB GLU 3 -17.620 10.829 -20.246 25 HG2 GLU 3 2HG GLU 3 -16.587 11.351 -22.382 26 HG3 GLU 3 3HG GLU 3 -18.292 11.786 -22.395 27 HA PRO 4 HA PRO 4 -20.410 11.626 -16.138 28 HB2 PRO 4 2HB PRO 4 -21.411 9.118 -16.284 29 HB3 PRO 4 3HB PRO 4 -22.133 10.446 -17.216 30 HG2 PRO 4 2HG PRO 4 -20.160 8.371 -18.146 31 HG3 PRO 4 3HG PRO 4 -21.698 8.868 -18.893 32 HD2 PRO 4 2HD PRO 4 -19.322 9.878 -19.725 33 HD3 PRO 4 3HD PRO 4 -20.817 10.842 -19.742 34 H GLY 5 H GLY 5 -17.446 11.049 -16.614 35 HA2 GLY 5 2HA GLY 5 -15.928 10.625 -14.858 36 HA3 GLY 5 3HA GLY 5 -17.093 9.550 -14.100 37 H VAL 6 H VAL 6 -17.648 7.601 -15.520 38 HA VAL 6 HA VAL 6 -17.147 5.631 -16.508 39 HB VAL 6 HB VAL 6 -14.821 7.081 -17.841 40 HG11 VAL 6 1HG1 VAL 6 -14.851 5.255 -19.517 41 HG12 VAL 6 2HG1 VAL 6 -16.051 4.391 -18.554 42 HG13 VAL 6 3HG1 VAL 6 -14.435 4.672 -17.906 43 HG21 VAL 6 3HG2 VAL 6 -17.623 6.536 -18.909 44 HG22 VAL 6 1HG2 VAL 6 -16.299 7.281 -19.813 45 HG23 VAL 6 2HG2 VAL 6 -16.985 8.107 -18.414 46 H ALA 7 H ALA 7 -13.889 6.987 -15.813 47 HA ALA 7 HA ALA 7 -13.112 4.663 -14.226 48 HB1 ALA 7 3HB ALA 7 -11.668 7.296 -14.754 49 HB2 ALA 7 1HB ALA 7 -11.426 5.786 -15.640 50 HB3 ALA 7 2HB ALA 7 -10.974 5.893 -13.938 51 H LYS 8 H LYS 8 -14.245 4.579 -12.323 52 HA LYS 8 HA LYS 8 -14.649 6.928 -10.612 53 HB2 LYS 8 2HB LYS 8 -15.425 4.007 -10.118 54 HB3 LYS 8 3HB LYS 8 -15.838 5.357 -9.071 55 HG2 LYS 8 2HG LYS 8 -17.814 4.903 -10.290 56 HG3 LYS 8 3HG LYS 8 -17.131 6.344 -11.041 57 HD2 LYS 8 2HD LYS 8 -17.975 4.791 -12.744 58 HD3 LYS 8 3HD LYS 8 -16.224 4.963 -12.881 59 HE2 LYS 8 2HE LYS 8 -16.032 2.818 -11.511 60 HE3 LYS 8 3HE LYS 8 -17.772 2.627 -11.718 61 HZ1 LYS 8 3HZ LYS 8 -17.441 2.565 -14.115 62 HZ2 LYS 8 1HZ LYS 8 -16.512 1.367 -13.357 63 HZ3 LYS 8 2HZ LYS 8 -15.779 2.785 -13.915 64 H LEU 9 H LEU 9 -13.130 3.728 -10.421 65 HA LEU 9 HA LEU 9 -10.682 4.796 -9.391 66 HB2 LEU 9 2HB LEU 9 -11.999 4.544 -7.269 67 HB3 LEU 9 3HB LEU 9 -12.190 2.833 -7.611 68 HG LEU 9 HG LEU 9 -9.718 2.531 -7.449 69 HD11 LEU 9 1HD1 LEU 9 -9.633 5.466 -6.668 70 HD12 LEU 9 2HD1 LEU 9 -8.971 4.756 -8.141 71 HD13 LEU 9 3HD1 LEU 9 -8.280 4.334 -6.577 72 HD21 LEU 9 3HD2 LEU 9 -11.097 2.143 -5.457 73 HD22 LEU 9 1HD2 LEU 9 -10.942 3.843 -4.995 74 HD23 LEU 9 2HD2 LEU 9 -9.521 2.793 -5.011 75 H THR 10 H THR 10 -9.168 3.695 -10.393 76 HA THR 10 HA THR 10 -9.551 0.912 -11.274 77 HB THR 10 HB THR 10 -8.789 3.230 -13.134 78 HG1 THR 10 HG1 THR 10 -11.101 1.577 -13.235 79 HG21 THR 10 3HG2 THR 10 -9.240 0.301 -13.827 80 HG22 THR 10 1HG2 THR 10 -7.677 1.116 -13.809 81 HG23 THR 10 2HG2 THR 10 -8.909 1.604 -14.974 82 H THR 11 H THR 11 -7.474 -0.054 -11.950 83 HA THR 11 HA THR 11 -5.533 0.173 -10.014 84 HB THR 11 HB THR 11 -4.082 -1.267 -11.598 85 HG1 THR 11 HG1 THR 11 -6.496 -1.240 -13.123 86 HG21 THR 11 3HG2 THR 11 -5.489 -3.258 -11.296 87 HG22 THR 11 1HG2 THR 11 -6.887 -2.239 -10.948 88 HG23 THR 11 2HG2 THR 11 -5.512 -2.259 -9.840 89 H TYR 12 H TYR 12 -5.644 2.224 -12.843 90 HA TYR 12 HA TYR 12 -2.942 2.821 -13.234 91 HB2 TYR 12 2HB TYR 12 -3.612 4.865 -14.306 92 HB3 TYR 12 3HB TYR 12 -4.885 3.698 -14.626 93 HD1 TYR 12 HD1 TYR 12 -7.098 3.904 -13.339 94 HD2 TYR 12 HD2 TYR 12 -4.108 6.956 -13.168 95 HE1 TYR 12 HE1 TYR 12 -8.768 5.505 -12.496 96 HE2 TYR 12 HE2 TYR 12 -5.783 8.546 -12.328 97 HH TYR 12 HH TYR 12 -8.895 7.599 -11.282 98 H ALA 13 H ALA 13 -5.148 4.057 -10.770 99 HA ALA 13 HA ALA 13 -3.481 5.998 -9.553 100 HB1 ALA 13 3HB ALA 13 -5.917 5.865 -9.180 101 HB2 ALA 13 1HB ALA 13 -5.054 5.798 -7.643 102 HB3 ALA 13 2HB ALA 13 -5.717 4.322 -8.346 103 H SER 14 H SER 14 -3.889 2.539 -9.067 104 HA SER 14 HA SER 14 -2.170 2.285 -6.779 105 HB2 SER 14 2HB SER 14 -3.221 0.086 -8.610 106 HB3 SER 14 3HB SER 14 -2.688 -0.081 -6.934 107 HG SER 14 HG SER 14 -4.430 1.175 -6.285 108 H LYS 15 H LYS 15 -1.769 2.123 -10.224 109 HA LYS 15 HA LYS 15 0.639 0.580 -10.341 110 HB2 LYS 15 2HB LYS 15 -0.892 2.271 -12.348 111 HB3 LYS 15 3HB LYS 15 0.713 1.670 -12.752 112 HG2 LYS 15 2HG LYS 15 -1.630 -0.075 -11.952 113 HG3 LYS 15 3HG LYS 15 -1.114 0.240 -13.611 114 HD2 LYS 15 2HD LYS 15 1.102 -0.776 -13.085 115 HD3 LYS 15 3HD LYS 15 0.522 -1.146 -11.459 116 HE2 LYS 15 2HE LYS 15 -1.180 -2.645 -12.370 117 HE3 LYS 15 3HE LYS 15 -0.711 -2.215 -14.020 118 HZ1 LYS 15 3HZ LYS 15 1.018 -3.564 -12.019 119 HZ2 LYS 15 1HZ LYS 15 1.496 -3.120 -13.579 120 HZ3 LYS 15 2HZ LYS 15 0.298 -4.292 -13.363 121 H GLN 16 H GLN 16 -0.091 4.047 -10.625 122 HA GLN 16 HA GLN 16 2.638 4.866 -10.907 123 HB2 GLN 16 2HB GLN 16 0.259 6.564 -10.047 124 HB3 GLN 16 3HB GLN 16 1.796 7.155 -10.662 125 HG2 GLN 16 2HG GLN 16 -0.298 5.606 -12.208 126 HG3 GLN 16 3HG GLN 16 0.089 7.315 -12.383 127 HE21 GLN 16 1HE2 GLN 16 1.073 4.062 -13.098 128 HE22 GLN 16 2HE2 GLN 16 2.323 4.457 -14.221 129 H ALA 17 H ALA 17 0.606 4.098 -8.214 130 HA ALA 17 HA ALA 17 2.086 5.457 -6.166 131 HB1 ALA 17 3HB ALA 17 -0.277 4.847 -5.874 132 HB2 ALA 17 1HB ALA 17 0.728 4.153 -4.601 133 HB3 ALA 17 2HB ALA 17 0.147 3.136 -5.925 134 H THR 18 H THR 18 1.994 2.065 -7.370 135 HA THR 18 HA THR 18 4.046 1.096 -5.634 136 HB THR 18 HB THR 18 4.195 -0.828 -7.300 137 HG1 THR 18 HG1 THR 18 3.548 0.014 -9.209 138 HG21 THR 18 3HG2 THR 18 1.413 -0.146 -6.298 139 HG22 THR 18 1HG2 THR 18 2.679 -0.942 -5.358 140 HG23 THR 18 2HG2 THR 18 1.984 -1.748 -6.765 141 H ASP 19 H ASP 19 4.011 2.342 -8.921 142 HA ASP 19 HA ASP 19 6.721 2.069 -9.630 143 HB2 ASP 19 2HB ASP 19 4.880 2.585 -11.223 144 HB3 ASP 19 3HB ASP 19 4.700 4.185 -10.515 145 H MET 20 H MET 20 5.007 4.444 -7.721 146 HA MET 20 HA MET 20 7.164 6.335 -7.418 147 HB2 MET 20 2HB MET 20 4.595 6.722 -7.154 148 HB3 MET 20 3HB MET 20 4.764 6.012 -5.562 149 HG2 MET 20 2HG MET 20 4.798 8.356 -5.259 150 HG3 MET 20 3HG MET 20 6.477 7.841 -5.080 151 HE1 MET 20 3HE MET 20 3.827 9.232 -7.604 152 HE2 MET 20 1HE MET 20 4.645 8.007 -8.571 153 HE3 MET 20 2HE MET 20 4.837 9.715 -8.975 154 H GLY 21 H GLY 21 5.861 3.583 -5.652 155 HA2 GLY 21 2HA GLY 21 7.635 2.338 -4.320 156 HA3 GLY 21 3HA GLY 21 7.817 3.855 -3.442 157 H ALA 22 H ALA 22 5.656 1.163 -4.139 158 HA ALA 22 HA ALA 22 4.450 1.327 -1.513 159 HB1 ALA 22 3HB ALA 22 2.963 2.833 -2.798 160 HB2 ALA 22 1HB ALA 22 2.114 1.381 -2.264 161 HB3 ALA 22 2HB ALA 22 2.637 1.534 -3.944 162 H ILE 23 H ILE 23 3.238 -0.589 -0.957 163 HA ILE 23 HA ILE 23 3.918 -2.988 -2.573 164 HB ILE 23 HB ILE 23 4.148 -4.252 -0.412 165 HG12 ILE 23 2HG1 ILE 23 4.041 -1.497 0.929 166 HG13 ILE 23 3HG1 ILE 23 2.766 -2.703 1.014 167 HG21 ILE 23 1HG2 ILE 23 6.392 -3.418 0.203 168 HG22 ILE 23 2HG2 ILE 23 6.078 -1.916 -0.669 169 HG23 ILE 23 3HG2 ILE 23 6.173 -3.444 -1.550 170 HD11 ILE 23 3HD1 ILE 23 4.037 -2.662 3.054 171 HD12 ILE 23 1HD1 ILE 23 5.538 -2.952 2.173 172 HD13 ILE 23 2HD1 ILE 23 4.289 -4.200 2.232 173 H TYR 24 H TYR 24 2.374 -4.664 -2.649 174 HA TYR 24 HA TYR 24 -0.336 -4.023 -1.661 175 HB2 TYR 24 2HB TYR 24 0.577 -6.273 -3.508 176 HB3 TYR 24 3HB TYR 24 -1.085 -5.954 -3.039 177 HD1 TYR 24 HD1 TYR 24 -2.128 -3.690 -3.779 178 HD2 TYR 24 HD2 TYR 24 1.481 -5.259 -5.450 179 HE1 TYR 24 HE1 TYR 24 -2.423 -2.267 -5.768 180 HE2 TYR 24 HE2 TYR 24 1.182 -3.835 -7.428 181 HH TYR 24 HH TYR 24 -0.870 -1.257 -7.586 182 H VAL 25 H VAL 25 -0.862 -4.834 0.228 183 HA VAL 25 HA VAL 25 0.166 -7.440 1.170 184 HB VAL 25 HB VAL 25 -0.286 -6.701 3.459 185 HG11 VAL 25 1HG1 VAL 25 1.937 -6.194 2.588 186 HG12 VAL 25 2HG1 VAL 25 1.435 -4.935 3.714 187 HG13 VAL 25 3HG1 VAL 25 1.380 -4.634 1.975 188 HG21 VAL 25 3HG2 VAL 25 -1.201 -4.027 2.325 189 HG22 VAL 25 1HG2 VAL 25 -0.985 -4.399 4.037 190 HG23 VAL 25 2HG2 VAL 25 -2.231 -5.228 3.105 191 H ASN 26 H ASN 26 -1.556 -8.534 2.659 192 HA ASN 26 HA ASN 26 -4.204 -8.417 1.317 193 HB2 ASN 26 2HB ASN 26 -4.600 -10.671 2.284 194 HB3 ASN 26 3HB ASN 26 -3.170 -10.644 1.272 195 HD21 ASN 26 1HD2 ASN 26 -3.903 -12.523 3.327 196 HD22 ASN 26 2HD2 ASN 26 -2.614 -12.520 4.474 197 H SER 27 H SER 27 -5.917 -9.363 3.083 198 HA SER 27 HA SER 27 -6.386 -7.295 4.960 199 HB2 SER 27 2HB SER 27 -8.242 -8.494 3.904 200 HB3 SER 27 3HB SER 27 -7.735 -10.005 4.642 201 HG SER 27 HG SER 27 -8.018 -8.450 6.667 202 H LYS 28 H LYS 28 -4.551 -10.261 5.264 203 HA LYS 28 HA LYS 28 -4.302 -10.093 8.130 204 HB2 LYS 28 2HB LYS 28 -2.405 -11.378 6.111 205 HB3 LYS 28 3HB LYS 28 -2.325 -11.578 7.860 206 HG2 LYS 28 2HG LYS 28 -4.547 -12.518 6.028 207 HG3 LYS 28 3HG LYS 28 -3.365 -13.526 6.869 208 HD2 LYS 28 2HD LYS 28 -4.318 -12.854 9.048 209 HD3 LYS 28 3HD LYS 28 -5.473 -11.793 8.233 210 HE2 LYS 28 2HE LYS 28 -5.334 -14.810 7.990 211 HE3 LYS 28 3HE LYS 28 -6.543 -13.885 8.879 212 HZ1 LYS 28 3HZ LYS 28 -7.205 -12.874 6.758 213 HZ2 LYS 28 1HZ LYS 28 -7.420 -14.550 6.775 214 HZ3 LYS 28 2HZ LYS 28 -6.112 -13.875 5.944 215 H GLY 29 H GLY 29 -2.305 -8.982 5.373 216 HA2 GLY 29 2HA GLY 29 -1.468 -6.674 5.473 217 HA3 GLY 29 3HA GLY 29 -1.035 -6.951 7.153 218 H ASP 30 H ASP 30 -0.356 -9.738 5.488 219 HA ASP 30 HA ASP 30 2.484 -9.216 5.281 220 HB2 ASP 30 2HB ASP 30 1.837 -11.434 6.003 221 HB3 ASP 30 3HB ASP 30 0.767 -11.646 4.623 222 H ARG 31 H ARG 31 3.654 -8.954 3.391 223 HA ARG 31 HA ARG 31 2.388 -7.793 1.155 224 HB2 ARG 31 2HB ARG 31 4.827 -8.131 0.092 225 HB3 ARG 31 3HB ARG 31 4.492 -6.907 1.295 226 HG2 ARG 31 2HG ARG 31 6.511 -7.757 2.024 227 HG3 ARG 31 3HG ARG 31 5.372 -8.653 3.020 228 HD2 ARG 31 2HD ARG 31 6.485 -9.818 0.454 229 HD3 ARG 31 3HD ARG 31 7.379 -9.910 1.971 230 HE ARG 31 HE ARG 31 4.814 -10.906 2.448 231 HH11 ARG 31 1HH1 ARG 31 7.627 -11.836 0.511 232 HH12 ARG 31 2HH1 ARG 31 7.256 -13.524 0.588 233 HH21 ARG 31 1HH2 ARG 31 4.358 -13.125 2.517 234 HH22 ARG 31 2HH2 ARG 31 5.406 -14.261 1.717 235 H ILE 32 H ILE 32 1.137 -8.811 -0.201 236 HA ILE 32 HA ILE 32 1.410 -11.624 -0.842 237 HB ILE 32 HB ILE 32 -0.623 -11.385 -2.158 238 HG12 ILE 32 2HG1 ILE 32 -0.459 -8.362 -1.676 239 HG13 ILE 32 3HG1 ILE 32 -0.142 -9.153 -3.214 240 HG21 ILE 32 1HG2 ILE 32 -0.842 -11.566 0.284 241 HG22 ILE 32 2HG2 ILE 32 -2.154 -10.602 -0.391 242 HG23 ILE 32 3HG2 ILE 32 -0.812 -9.804 0.433 243 HD11 ILE 32 3HD1 ILE 32 -2.467 -9.920 -3.289 244 HD12 ILE 32 1HD1 ILE 32 -2.331 -8.165 -3.201 245 HD13 ILE 32 2HD1 ILE 32 -2.781 -9.082 -1.765 246 H VAL 33 H VAL 33 2.001 -8.545 -2.395 247 HA VAL 33 HA VAL 33 4.081 -9.611 -4.022 248 HB VAL 33 HB VAL 33 2.119 -10.175 -5.469 249 HG11 VAL 33 1HG1 VAL 33 1.572 -7.190 -5.626 250 HG12 VAL 33 2HG1 VAL 33 0.561 -8.401 -4.838 251 HG13 VAL 33 3HG1 VAL 33 0.776 -8.443 -6.588 252 HG21 VAL 33 3HG2 VAL 33 4.286 -9.754 -6.523 253 HG22 VAL 33 1HG2 VAL 33 3.913 -8.034 -6.664 254 HG23 VAL 33 2HG2 VAL 33 2.977 -9.222 -7.577 255 H ASN 34 H ASN 34 5.572 -7.972 -4.435 256 HA ASN 34 HA ASN 34 5.367 -5.626 -2.825 257 HB2 ASN 34 2HB ASN 34 7.511 -6.879 -3.382 258 HB3 ASN 34 3HB ASN 34 7.438 -6.194 -4.997 259 HD21 ASN 34 1HD2 ASN 34 9.461 -5.923 -2.857 260 HD22 ASN 34 2HD2 ASN 34 9.644 -4.227 -2.592 261 H GLU 35 H GLU 35 5.422 -6.162 -6.314 262 HA GLU 35 HA GLU 35 3.649 -3.883 -6.793 263 HB2 GLU 35 2HB GLU 35 5.855 -2.886 -7.122 264 HB3 GLU 35 3HB GLU 35 6.370 -4.238 -8.119 265 HG2 GLU 35 2HG GLU 35 4.793 -3.569 -9.880 266 HG3 GLU 35 3HG GLU 35 4.209 -2.244 -8.878 267 H SER 36 H SER 36 2.301 -4.227 -8.500 268 HA SER 36 HA SER 36 1.940 -6.869 -9.520 269 HB2 SER 36 2HB SER 36 0.073 -5.731 -10.854 270 HB3 SER 36 3HB SER 36 -0.031 -5.540 -9.105 271 HG SER 36 HG SER 36 0.202 -3.456 -9.329 272 H ASN 37 H ASN 37 3.816 -7.374 -10.626 273 HA ASN 37 HA ASN 37 5.026 -5.938 -12.732 274 HB2 ASN 37 2HB ASN 37 6.115 -7.830 -11.530 275 HB3 ASN 37 3HB ASN 37 4.956 -8.955 -12.233 276 HD21 ASN 37 1HD2 ASN 37 6.486 -10.189 -13.284 277 HD22 ASN 37 2HD2 ASN 37 7.430 -9.616 -14.615 278 H VAL 38 H VAL 38 2.565 -8.447 -12.689 279 HA VAL 38 HA VAL 38 1.363 -7.515 -15.171 280 HB VAL 38 HB VAL 38 2.902 -9.216 -16.019 281 HG11 VAL 38 1HG1 VAL 38 3.344 -10.465 -13.966 282 HG12 VAL 38 2HG1 VAL 38 2.905 -11.560 -15.276 283 HG13 VAL 38 3HG1 VAL 38 1.728 -11.174 -14.017 284 HG21 VAL 38 3HG2 VAL 38 0.079 -10.357 -15.960 285 HG22 VAL 38 1HG2 VAL 38 1.345 -10.786 -17.117 286 HG23 VAL 38 2HG2 VAL 38 0.688 -9.149 -17.095 287 H TYR 39 H TYR 39 -0.896 -8.161 -15.309 288 HA TYR 39 HA TYR 39 -2.286 -8.056 -12.874 289 HB2 TYR 39 2HB TYR 39 -4.323 -8.244 -14.155 290 HB3 TYR 39 3HB TYR 39 -3.183 -7.324 -15.124 291 HD1 TYR 39 HD2 TYR 39 -1.906 -8.630 -17.022 292 HD2 TYR 39 HD1 TYR 39 -5.407 -10.165 -15.102 293 HE1 TYR 39 HE2 TYR 39 -2.278 -10.147 -18.910 294 HE2 TYR 39 HE1 TYR 39 -5.769 -11.681 -17.008 295 HH TYR 39 HH TYR 39 -5.143 -11.817 -19.418 296 H THR 40 H THR 40 -1.180 -10.836 -14.690 297 HA THR 40 HA THR 40 -2.902 -12.815 -13.583 298 HB THR 40 HB THR 40 -1.134 -14.446 -14.431 299 HG1 THR 40 HG1 THR 40 0.773 -13.668 -14.898 300 HG21 THR 40 3HG2 THR 40 -2.021 -12.320 -16.413 301 HG22 THR 40 1HG2 THR 40 -2.964 -13.734 -15.937 302 HG23 THR 40 2HG2 THR 40 -1.456 -13.936 -16.832 303 H THR 41 H THR 41 0.492 -11.914 -12.815 304 HA THR 41 HA THR 41 0.809 -13.631 -10.576 305 HB THR 41 HB THR 41 2.289 -11.049 -11.275 306 HG1 THR 41 HG1 THR 41 3.732 -12.459 -12.301 307 HG21 THR 41 3HG2 THR 41 2.730 -11.713 -8.915 308 HG22 THR 41 1HG2 THR 41 4.163 -11.922 -9.923 309 HG23 THR 41 2HG2 THR 41 3.199 -13.326 -9.457 310 H PHE 42 H PHE 42 -0.330 -10.310 -10.903 311 HA PHE 42 HA PHE 42 -0.495 -9.557 -8.181 312 HB2 PHE 42 2HB PHE 42 -0.623 -7.858 -9.913 313 HB3 PHE 42 3HB PHE 42 -2.036 -8.614 -10.637 314 HD1 PHE 42 HD1 PHE 42 -0.989 -7.247 -7.281 315 HD2 PHE 42 HD2 PHE 42 -4.085 -7.549 -10.219 316 HE1 PHE 42 HE1 PHE 42 -2.440 -5.814 -5.910 317 HE2 PHE 42 HE2 PHE 42 -5.528 -6.107 -8.839 318 HZ PHE 42 HZ PHE 42 -4.707 -5.242 -6.682 319 H ARG 43 H ARG 43 -2.924 -10.930 -10.395 320 HA ARG 43 HA ARG 43 -5.078 -11.110 -8.573 321 HB2 ARG 43 2HB ARG 43 -5.438 -11.223 -11.009 322 HB3 ARG 43 3HB ARG 43 -4.508 -12.715 -11.108 323 HG2 ARG 43 2HG ARG 43 -6.229 -13.853 -9.723 324 HG3 ARG 43 3HG ARG 43 -7.172 -12.362 -9.689 325 HD2 ARG 43 2HD ARG 43 -7.518 -12.465 -12.088 326 HD3 ARG 43 3HD ARG 43 -6.412 -13.835 -12.236 327 HE ARG 43 HE ARG 43 -8.812 -14.147 -10.567 328 HH11 ARG 43 1HH1 ARG 43 -7.174 -14.941 -13.578 329 HH12 ARG 43 2HH1 ARG 43 -8.247 -16.249 -13.955 330 HH21 ARG 43 1HH2 ARG 43 -10.207 -15.869 -11.068 331 HH22 ARG 43 2HH2 ARG 43 -9.971 -16.776 -12.529 332 H ASN 44 H ASN 44 -2.532 -13.391 -9.539 333 HA ASN 44 HA ASN 44 -3.459 -15.645 -8.049 334 HB2 ASN 44 2HB ASN 44 -0.812 -14.996 -9.387 335 HB3 ASN 44 3HB ASN 44 -1.001 -16.453 -8.420 336 HD21 ASN 44 1HD2 ASN 44 -3.535 -15.071 -10.523 337 HD22 ASN 44 2HD2 ASN 44 -3.542 -16.383 -11.639 338 H ALA 45 H ALA 45 -1.451 -12.902 -7.259 339 HA ALA 45 HA ALA 45 -0.413 -13.833 -4.777 340 HB1 ALA 45 3HB ALA 45 -0.993 -10.985 -5.670 341 HB2 ALA 45 1HB ALA 45 0.512 -11.866 -5.932 342 HB3 ALA 45 2HB ALA 45 0.009 -11.453 -4.292 343 H ILE 46 H ILE 46 -3.412 -12.209 -5.723 344 HA ILE 46 HA ILE 46 -4.548 -11.992 -3.074 345 HB ILE 46 HB ILE 46 -5.911 -11.761 -5.809 346 HG12 ILE 46 2HG1 ILE 46 -4.756 -9.545 -4.039 347 HG13 ILE 46 3HG1 ILE 46 -4.035 -10.130 -5.533 348 HG21 ILE 46 1HG2 ILE 46 -6.874 -10.749 -3.101 349 HG22 ILE 46 2HG2 ILE 46 -7.542 -12.122 -3.983 350 HG23 ILE 46 3HG2 ILE 46 -7.686 -10.497 -4.649 351 HD11 ILE 46 3HD1 ILE 46 -5.159 -8.039 -5.895 352 HD12 ILE 46 1HD1 ILE 46 -6.672 -8.697 -5.273 353 HD13 ILE 46 2HD1 ILE 46 -5.988 -9.320 -6.776 354 H LEU 47 H LEU 47 -4.514 -14.403 -5.623 355 HA LEU 47 HA LEU 47 -6.655 -16.041 -4.524 356 HB2 LEU 47 2HB LEU 47 -4.655 -16.644 -6.743 357 HB3 LEU 47 3HB LEU 47 -6.010 -17.673 -6.307 358 HG LEU 47 HG LEU 47 -6.180 -14.890 -7.517 359 HD11 LEU 47 1HD1 LEU 47 -7.143 -16.000 -9.481 360 HD12 LEU 47 2HD1 LEU 47 -6.903 -17.575 -8.720 361 HD13 LEU 47 3HD1 LEU 47 -5.510 -16.576 -9.144 362 HD21 LEU 47 3HD2 LEU 47 -8.030 -15.155 -5.961 363 HD22 LEU 47 1HD2 LEU 47 -8.463 -16.708 -6.682 364 HD23 LEU 47 2HD2 LEU 47 -8.628 -15.219 -7.615 365 H LYS 48 H LYS 48 -3.285 -15.665 -4.015 366 HA LYS 48 HA LYS 48 -2.422 -18.312 -3.617 367 HB2 LYS 48 2HB LYS 48 -0.950 -16.350 -4.061 368 HB3 LYS 48 3HB LYS 48 -1.259 -15.753 -2.435 369 HG2 LYS 48 2HG LYS 48 -0.126 -17.670 -1.457 370 HG3 LYS 48 3HG LYS 48 0.055 -18.429 -3.042 371 HD2 LYS 48 2HD LYS 48 1.368 -15.836 -2.135 372 HD3 LYS 48 3HD LYS 48 2.167 -17.400 -2.307 373 HE2 LYS 48 2HE LYS 48 1.599 -17.349 -4.754 374 HE3 LYS 48 3HE LYS 48 0.977 -15.710 -4.531 375 HZ1 LYS 48 3HZ LYS 48 3.766 -16.642 -4.117 376 HZ2 LYS 48 1HZ LYS 48 3.219 -15.094 -3.711 377 HZ3 LYS 48 2HZ LYS 48 3.214 -15.592 -5.323 378 H GLN 49 H GLN 49 -3.803 -15.988 -1.362 379 HA GLN 49 HA GLN 49 -3.870 -18.034 0.786 380 HB2 GLN 49 2HB GLN 49 -3.699 -16.309 2.491 381 HB3 GLN 49 3HB GLN 49 -2.333 -16.156 1.404 382 HG2 GLN 49 2HG GLN 49 -4.780 -14.365 1.444 383 HG3 GLN 49 3HG GLN 49 -3.192 -13.974 2.105 384 HE21 GLN 49 1HE2 GLN 49 -1.416 -13.774 0.600 385 HE22 GLN 49 2HE2 GLN 49 -1.734 -13.239 -1.012 386 H ALA 50 H ALA 50 -5.671 -17.086 2.459 387 HA ALA 50 HA ALA 50 -8.121 -17.755 1.240 388 HB1 ALA 50 3HB ALA 50 -9.107 -17.330 3.452 389 HB2 ALA 50 1HB ALA 50 -7.641 -16.484 3.961 390 HB3 ALA 50 2HB ALA 50 -7.587 -18.211 3.610 391 H ASP 51 H ASP 51 -6.694 -14.673 2.090 392 HA ASP 51 HA ASP 51 -9.024 -13.043 2.069 393 HB2 ASP 51 2HB ASP 51 -6.112 -12.200 1.707 394 HB3 ASP 51 3HB ASP 51 -7.446 -11.169 2.226 395 H LYS 52 H LYS 52 -10.137 -12.321 0.399 396 HA LYS 52 HA LYS 52 -8.997 -12.228 -2.340 397 HB2 LYS 52 2HB LYS 52 -11.891 -12.548 -1.418 398 HB3 LYS 52 3HB LYS 52 -11.422 -12.303 -3.101 399 HG2 LYS 52 2HG LYS 52 -10.489 -14.601 -1.368 400 HG3 LYS 52 3HG LYS 52 -11.816 -14.704 -2.529 401 HD2 LYS 52 2HD LYS 52 -10.370 -14.612 -4.390 402 HD3 LYS 52 3HD LYS 52 -9.110 -13.748 -3.504 403 HE2 LYS 52 2HE LYS 52 -9.815 -16.673 -3.081 404 HE3 LYS 52 3HE LYS 52 -8.462 -16.077 -4.048 405 HZ1 LYS 52 3HZ LYS 52 -7.581 -15.001 -2.066 406 HZ2 LYS 52 1HZ LYS 52 -7.744 -16.673 -1.848 407 HZ3 LYS 52 2HZ LYS 52 -8.862 -15.621 -1.151 408 H VAL 53 H VAL 53 -8.671 -10.204 -0.273 409 HA VAL 53 HA VAL 53 -9.211 -7.945 -2.016 410 HB VAL 53 HB VAL 53 -11.130 -7.760 -0.535 411 HG11 VAL 53 1HG1 VAL 53 -10.988 -7.568 1.903 412 HG12 VAL 53 2HG1 VAL 53 -9.250 -7.873 1.843 413 HG13 VAL 53 3HG1 VAL 53 -10.385 -9.127 1.339 414 HG21 VAL 53 3HG2 VAL 53 -10.788 -5.513 0.432 415 HG22 VAL 53 1HG2 VAL 53 -10.052 -5.643 -1.166 416 HG23 VAL 53 2HG2 VAL 53 -9.038 -5.700 0.278 417 H ALA 54 H ALA 54 -7.517 -6.610 -2.082 418 HA ALA 54 HA ALA 54 -5.160 -7.154 -0.383 419 HB1 ALA 54 3HB ALA 54 -4.859 -7.564 -2.801 420 HB2 ALA 54 1HB ALA 54 -3.864 -6.205 -2.274 421 HB3 ALA 54 2HB ALA 54 -5.364 -5.912 -3.163 422 H TYR 55 H TYR 55 -3.764 -5.122 -0.167 423 HA TYR 55 HA TYR 55 -5.207 -2.580 0.047 424 HB2 TYR 55 2HB TYR 55 -3.858 -3.960 2.423 425 HB3 TYR 55 3HB TYR 55 -4.339 -2.267 2.412 426 HD1 TYR 55 HD1 TYR 55 -6.758 -1.647 2.407 427 HD2 TYR 55 HD2 TYR 55 -5.529 -5.732 2.741 428 HE1 TYR 55 HE1 TYR 55 -9.010 -2.272 3.158 429 HE2 TYR 55 HE2 TYR 55 -7.790 -6.341 3.482 430 HH TYR 55 HH TYR 55 -9.719 -5.255 4.549 431 H LEU 56 H LEU 56 -3.905 -0.988 -0.652 432 HA LEU 56 HA LEU 56 -1.078 -1.587 -1.194 433 HB2 LEU 56 2HB LEU 56 -2.616 -0.797 -3.017 434 HB3 LEU 56 3HB LEU 56 -2.808 0.722 -2.159 435 HG LEU 56 HG LEU 56 -0.385 1.194 -2.460 436 HD11 LEU 56 1HD1 LEU 56 0.476 -1.089 -2.555 437 HD12 LEU 56 2HD1 LEU 56 1.002 -0.145 -3.942 438 HD13 LEU 56 3HD1 LEU 56 -0.293 -1.327 -4.123 439 HD21 LEU 56 3HD2 LEU 56 -1.962 2.083 -4.085 440 HD22 LEU 56 1HD2 LEU 56 -1.871 0.595 -5.034 441 HD23 LEU 56 2HD2 LEU 56 -0.457 1.642 -4.886 442 H VAL 57 H VAL 57 0.329 -0.960 0.308 443 HA VAL 57 HA VAL 57 -0.289 1.244 2.173 444 HB VAL 57 HB VAL 57 1.907 -0.885 2.367 445 HG11 VAL 57 1HG1 VAL 57 2.537 1.157 3.576 446 HG12 VAL 57 2HG1 VAL 57 2.173 -0.134 4.719 447 HG13 VAL 57 3HG1 VAL 57 0.999 1.155 4.442 448 HG21 VAL 57 3HG2 VAL 57 -0.769 -0.746 3.808 449 HG22 VAL 57 1HG2 VAL 57 0.502 -1.935 4.115 450 HG23 VAL 57 2HG2 VAL 57 -0.316 -1.901 2.552 451 H MET 58 H MET 58 0.633 3.171 1.798 452 HA MET 58 HA MET 58 3.405 3.406 0.858 453 HB2 MET 58 2HB MET 58 2.916 4.988 -0.885 454 HB3 MET 58 3HB MET 58 1.832 3.635 -1.165 455 HG2 MET 58 2HG MET 58 1.033 6.216 0.203 456 HG3 MET 58 3HG MET 58 0.784 5.874 -1.503 457 HE1 MET 58 3HE MET 58 -1.012 4.270 -2.443 458 HE2 MET 58 1HE MET 58 -1.880 3.095 -1.459 459 HE3 MET 58 2HE MET 58 -0.133 2.964 -1.648 460 H ASP 59 H ASP 59 3.787 6.019 0.862 461 HA ASP 59 HA ASP 59 2.798 7.107 3.423 462 HB2 ASP 59 2HB ASP 59 4.728 8.739 3.147 463 HB3 ASP 59 3HB ASP 59 5.211 7.064 3.349 464 H GLU 60 H GLU 60 2.748 9.647 3.286 465 HA GLU 60 HA GLU 60 0.448 10.233 1.705 466 HB2 GLU 60 2HB GLU 60 0.740 11.113 3.993 467 HB3 GLU 60 3HB GLU 60 2.115 12.076 3.468 468 HG2 GLU 60 2HG GLU 60 0.715 13.516 2.149 469 HG3 GLU 60 3HG GLU 60 -0.664 12.433 2.320 470 H ARG 61 H ARG 61 3.864 10.837 1.204 471 HA ARG 61 HA ARG 61 3.750 12.994 -0.654 472 HB2 ARG 61 2HB ARG 61 5.769 10.719 -0.721 473 HB3 ARG 61 3HB ARG 61 6.002 12.366 -1.296 474 HG2 ARG 61 2HG ARG 61 6.091 13.205 0.979 475 HG3 ARG 61 3HG ARG 61 5.634 11.621 1.620 476 HD2 ARG 61 2HD ARG 61 8.199 12.294 0.134 477 HD3 ARG 61 3HD ARG 61 8.046 11.948 1.859 478 HE ARG 61 HE ARG 61 7.394 9.661 1.260 479 HH11 ARG 61 1HH1 ARG 61 9.052 11.470 -1.271 480 HH12 ARG 61 2HH1 ARG 61 9.575 10.039 -2.094 481 HH21 ARG 61 1HH2 ARG 61 8.053 7.833 0.165 482 HH22 ARG 61 2HH2 ARG 61 9.009 7.970 -1.276 483 H THR 62 H THR 62 3.895 9.487 -1.081 484 HA THR 62 HA THR 62 3.520 9.256 -3.847 485 HB THR 62 HB THR 62 2.741 7.341 -1.600 486 HG1 THR 62 HG1 THR 62 5.003 8.048 -1.806 487 HG21 THR 62 3HG2 THR 62 2.974 5.538 -3.313 488 HG22 THR 62 1HG2 THR 62 3.145 6.771 -4.566 489 HG23 THR 62 2HG2 THR 62 1.633 6.627 -3.669 490 H TRP 63 H TRP 63 1.180 9.526 -1.167 491 HA TRP 63 HA TRP 63 -1.161 9.061 -2.694 492 HB2 TRP 63 2HB TRP 63 -1.325 8.863 -0.289 493 HB3 TRP 63 3HB TRP 63 -0.823 10.540 -0.052 494 HD1 TRP 63 HD1 TRP 63 -2.760 12.278 0.136 495 HE1 TRP 63 HE1 TRP 63 -5.279 12.274 -0.328 496 HE3 TRP 63 HE3 TRP 63 -3.225 7.652 -2.041 497 HZ2 TRP 63 HZ2 TRP 63 -7.200 10.597 -1.452 498 HZ3 TRP 63 HZ3 TRP 63 -5.460 6.944 -2.800 499 HH2 TRP 63 HH2 TRP 63 -7.408 8.391 -2.510 500 H LYS 64 H LYS 64 0.640 12.090 -2.005 501 HA LYS 64 HA LYS 64 -1.147 13.983 -2.989 502 HB2 LYS 64 2HB LYS 64 1.880 13.981 -3.334 503 HB3 LYS 64 3HB LYS 64 0.844 15.390 -3.524 504 HG2 LYS 64 2HG LYS 64 1.398 13.861 -0.979 505 HG3 LYS 64 3HG LYS 64 1.940 15.489 -1.390 506 HD2 LYS 64 2HD LYS 64 -0.510 16.168 -1.465 507 HD3 LYS 64 3HD LYS 64 -0.904 14.582 -0.809 508 HE2 LYS 64 2HE LYS 64 0.443 15.066 1.192 509 HE3 LYS 64 3HE LYS 64 0.881 16.638 0.519 510 HZ1 LYS 64 3HZ LYS 64 -0.940 16.754 2.158 511 HZ2 LYS 64 1HZ LYS 64 -1.898 15.794 1.150 512 HZ3 LYS 64 2HZ LYS 64 -1.406 17.326 0.639 513 H LYS 65 H LYS 65 0.826 11.688 -4.693 514 HA LYS 65 HA LYS 65 0.394 12.780 -7.333 515 HB2 LYS 65 2HB LYS 65 1.509 10.056 -6.538 516 HB3 LYS 65 3HB LYS 65 1.674 10.839 -8.107 517 HG2 LYS 65 2HG LYS 65 2.890 11.772 -5.487 518 HG3 LYS 65 3HG LYS 65 3.754 11.028 -6.827 519 HD2 LYS 65 2HD LYS 65 2.368 13.736 -6.891 520 HD3 LYS 65 3HD LYS 65 4.105 13.467 -6.750 521 HE2 LYS 65 2HE LYS 65 4.145 12.432 -8.974 522 HE3 LYS 65 3HE LYS 65 2.399 12.643 -9.121 523 HZ1 LYS 65 3HZ LYS 65 2.725 15.042 -8.994 524 HZ2 LYS 65 1HZ LYS 65 3.580 14.381 -10.295 525 HZ3 LYS 65 2HZ LYS 65 4.397 14.830 -8.885 526 H VAL 66 H VAL 66 -0.821 9.964 -5.464 527 HA VAL 66 HA VAL 66 -2.429 8.805 -7.485 528 HB VAL 66 HB VAL 66 -2.763 8.609 -4.446 529 HG11 VAL 66 1HG1 VAL 66 -3.952 6.477 -4.889 530 HG12 VAL 66 2HG1 VAL 66 -3.859 6.784 -6.626 531 HG13 VAL 66 3HG1 VAL 66 -4.799 7.858 -5.589 532 HG21 VAL 66 3HG2 VAL 66 -1.217 6.804 -6.355 533 HG22 VAL 66 1HG2 VAL 66 -1.448 6.517 -4.628 534 HG23 VAL 66 2HG2 VAL 66 -0.518 7.913 -5.174 535 H TYR 67 H TYR 67 -3.439 10.742 -4.674 536 HA TYR 67 HA TYR 67 -6.072 11.309 -5.099 537 HB2 TYR 67 2HB TYR 67 -4.825 12.025 -3.103 538 HB3 TYR 67 3HB TYR 67 -3.878 13.159 -4.050 539 HD1 TYR 67 HD1 TYR 67 -7.217 12.521 -2.554 540 HD2 TYR 67 HD2 TYR 67 -4.796 15.366 -4.633 541 HE1 TYR 67 HE1 TYR 67 -8.864 14.285 -2.074 542 HE2 TYR 67 HE2 TYR 67 -6.443 17.119 -4.139 543 HH TYR 67 HH TYR 67 -8.725 17.375 -3.593 544 H ASP 68 H ASP 68 -3.289 13.045 -6.437 545 HA ASP 68 HA ASP 68 -4.598 15.037 -7.910 546 HB2 ASP 68 2HB ASP 68 -2.207 15.220 -7.508 547 HB3 ASP 68 3HB ASP 68 -1.891 13.699 -8.333 548 H LEU 69 H LEU 69 -3.450 11.795 -8.921 549 HA LEU 69 HA LEU 69 -4.058 11.937 -11.659 550 HB2 LEU 69 2HB LEU 69 -3.953 9.520 -9.813 551 HB3 LEU 69 3HB LEU 69 -4.016 9.415 -11.569 552 HG LEU 69 HG LEU 69 -1.782 10.836 -10.093 553 HD11 LEU 69 1HD1 LEU 69 -1.814 8.497 -9.390 554 HD12 LEU 69 2HD1 LEU 69 -0.412 8.843 -10.396 555 HD13 LEU 69 3HD1 LEU 69 -1.788 7.970 -11.077 556 HD21 LEU 69 3HD2 LEU 69 -1.980 9.849 -12.955 557 HD22 LEU 69 1HD2 LEU 69 -0.566 10.610 -12.218 558 HD23 LEU 69 2HD2 LEU 69 -2.054 11.529 -12.420 559 H LEU 70 H LEU 70 -6.068 10.961 -8.933 560 HA LEU 70 HA LEU 70 -8.291 9.951 -10.350 561 HB2 LEU 70 2HB LEU 70 -8.207 11.358 -7.652 562 HB3 LEU 70 3HB LEU 70 -9.567 10.423 -8.255 563 HG LEU 70 HG LEU 70 -6.799 9.315 -7.631 564 HD11 LEU 70 1HD1 LEU 70 -7.873 8.143 -5.763 565 HD12 LEU 70 2HD1 LEU 70 -9.408 8.930 -6.135 566 HD13 LEU 70 3HD1 LEU 70 -8.030 9.892 -5.597 567 HD21 LEU 70 3HD2 LEU 70 -9.286 7.837 -8.569 568 HD22 LEU 70 1HD2 LEU 70 -7.769 7.086 -8.060 569 HD23 LEU 70 2HD2 LEU 70 -7.811 8.095 -9.503 570 H ILE 71 H ILE 71 -7.679 13.236 -9.087 571 HA ILE 71 HA ILE 71 -9.990 14.447 -10.311 572 HB ILE 71 HB ILE 71 -7.516 15.843 -9.182 573 HG12 ILE 71 2HG1 ILE 71 -10.072 15.013 -7.724 574 HG13 ILE 71 3HG1 ILE 71 -8.487 14.280 -7.510 575 HG21 ILE 71 1HG2 ILE 71 -10.357 16.892 -9.539 576 HG22 ILE 71 2HG2 ILE 71 -8.963 17.341 -10.521 577 HG23 ILE 71 3HG2 ILE 71 -9.013 17.782 -8.815 578 HD11 ILE 71 3HD1 ILE 71 -9.012 15.756 -5.692 579 HD12 ILE 71 1HD1 ILE 71 -9.247 17.103 -6.805 580 HD13 ILE 71 2HD1 ILE 71 -7.644 16.386 -6.610 581 H LEU 72 H LEU 72 -6.817 13.696 -11.367 582 HA LEU 72 HA LEU 72 -6.527 15.744 -13.382 583 HB2 LEU 72 2HB LEU 72 -4.651 14.593 -12.067 584 HB3 LEU 72 3HB LEU 72 -4.908 13.173 -13.053 585 HG LEU 72 HG LEU 72 -2.928 14.612 -13.688 586 HD11 LEU 72 1HD1 LEU 72 -4.944 14.260 -15.923 587 HD12 LEU 72 2HD1 LEU 72 -3.845 13.023 -15.308 588 HD13 LEU 72 3HD1 LEU 72 -3.196 14.458 -16.101 589 HD21 LEU 72 3HD2 LEU 72 -5.006 16.616 -14.653 590 HD22 LEU 72 1HD2 LEU 72 -3.259 16.719 -14.897 591 HD23 LEU 72 2HD2 LEU 72 -3.928 16.829 -13.271 592 H HIS 73 H HIS 73 -7.448 12.310 -13.244 593 HA HIS 73 HA HIS 73 -7.837 12.162 -16.134 594 HB2 HIS 73 2HB HIS 73 -8.182 10.117 -13.897 595 HB3 HIS 73 3HB HIS 73 -8.620 9.782 -15.570 596 HD1 HIS 73 HD1 HIS 73 -6.865 8.266 -16.436 597 HD2 HIS 73 HD2 HIS 73 -5.219 11.325 -14.159 598 HE1 HIS 73 HE1 HIS 73 -4.383 7.980 -16.611 599 HE2 HIS 73 HE2 HIS 73 -3.419 9.734 -15.103 600 H ASP 74 H ASP 74 -10.004 11.357 -13.342 601 HA ASP 74 HA ASP 74 -12.204 12.989 -14.030 602 HB2 ASP 74 2HB ASP 74 -12.330 10.177 -15.218 603 HB3 ASP 74 3HB ASP 74 -13.800 11.006 -14.741 604 H PHE 75 H PHE 75 -11.954 13.131 -11.688 605 HA PHE 75 HA PHE 75 -13.932 11.651 -10.315 606 HB2 PHE 75 2HB PHE 75 -11.848 10.003 -10.392 607 HB3 PHE 75 3HB PHE 75 -11.185 11.043 -9.142 608 HD1 PHE 75 HD2 PHE 75 -14.661 9.759 -9.738 609 HD2 PHE 75 HD1 PHE 75 -11.277 9.815 -7.120 610 HE1 PHE 75 HE2 PHE 75 -15.904 8.423 -8.098 611 HE2 PHE 75 HE1 PHE 75 -12.530 8.468 -5.486 612 HZ PHE 75 HZ PHE 75 -14.845 7.774 -5.978 613 H THR 76 H THR 76 -14.747 13.343 -9.229 614 HA THR 76 HA THR 76 -13.354 15.745 -8.745 615 HB THR 76 HB THR 76 -15.894 15.445 -9.114 616 HG1 THR 76 HG1 THR 76 -15.682 17.474 -8.621 617 HG21 THR 76 3HG2 THR 76 -15.862 14.956 -6.118 618 HG22 THR 76 1HG2 THR 76 -16.367 13.800 -7.351 619 HG23 THR 76 2HG2 THR 76 -17.304 15.274 -7.091 620 HA PRO 77 HA PRO 77 -11.271 15.158 -4.792 621 HB2 PRO 77 2HB PRO 77 -11.808 17.648 -3.583 622 HB3 PRO 77 3HB PRO 77 -10.506 17.334 -4.747 623 HG2 PRO 77 2HG PRO 77 -13.241 18.466 -5.259 624 HG3 PRO 77 3HG PRO 77 -11.669 18.992 -5.895 625 HD2 PRO 77 2HD PRO 77 -13.268 17.550 -7.432 626 HD3 PRO 77 3HD PRO 77 -11.524 17.193 -7.407 627 H GLU 78 H GLU 78 -14.563 16.383 -4.800 628 HA GLU 78 HA GLU 78 -15.251 16.129 -2.089 629 HB2 GLU 78 2HB GLU 78 -17.092 15.966 -4.508 630 HB3 GLU 78 3HB GLU 78 -17.576 16.349 -2.859 631 HG2 GLU 78 2HG GLU 78 -16.283 18.437 -2.935 632 HG3 GLU 78 3HG GLU 78 -15.714 18.036 -4.557 633 H GLU 79 H GLU 79 -15.293 13.767 -4.701 634 HA GLU 79 HA GLU 79 -16.709 11.698 -3.321 635 HB2 GLU 79 2HB GLU 79 -14.838 11.695 -5.720 636 HB3 GLU 79 3HB GLU 79 -15.518 10.207 -5.080 637 HG2 GLU 79 2HG GLU 79 -17.176 12.537 -6.058 638 HG3 GLU 79 3HG GLU 79 -16.739 11.145 -7.046 639 H ILE 80 H ILE 80 -13.290 12.364 -3.895 640 HA ILE 80 HA ILE 80 -12.155 10.040 -2.821 641 HB ILE 80 HB ILE 80 -10.820 12.791 -2.908 642 HG12 ILE 80 2HG1 ILE 80 -10.925 10.738 -5.180 643 HG13 ILE 80 3HG1 ILE 80 -11.871 12.223 -5.130 644 HG21 ILE 80 1HG2 ILE 80 -8.715 11.518 -3.163 645 HG22 ILE 80 2HG2 ILE 80 -9.611 10.001 -3.076 646 HG23 ILE 80 3HG2 ILE 80 -9.551 11.068 -1.674 647 HD11 ILE 80 3HD1 ILE 80 -9.954 12.491 -6.560 648 HD12 ILE 80 1HD1 ILE 80 -8.867 12.029 -5.252 649 HD13 ILE 80 2HD1 ILE 80 -9.792 13.529 -5.144 650 H LYS 81 H LYS 81 -12.575 13.252 -1.384 651 HA LYS 81 HA LYS 81 -11.412 12.650 1.143 652 HB2 LYS 81 2HB LYS 81 -12.206 14.884 1.819 653 HB3 LYS 81 3HB LYS 81 -11.417 14.929 0.249 654 HG2 LYS 81 2HG LYS 81 -13.792 14.808 -0.758 655 HG3 LYS 81 3HG LYS 81 -14.370 15.175 0.863 656 HD2 LYS 81 2HD LYS 81 -12.442 16.945 -0.696 657 HD3 LYS 81 3HD LYS 81 -14.187 17.162 -0.698 658 HE2 LYS 81 2HE LYS 81 -13.235 18.746 0.845 659 HE3 LYS 81 3HE LYS 81 -14.084 17.526 1.789 660 HZ1 LYS 81 3HZ LYS 81 -11.157 17.504 1.311 661 HZ2 LYS 81 1HZ LYS 81 -12.023 16.535 2.393 662 HZ3 LYS 81 2HZ LYS 81 -11.880 18.195 2.668 663 H SER 82 H SER 82 -14.594 12.230 -0.148 664 HA SER 82 HA SER 82 -16.023 11.988 2.339 665 HB2 SER 82 2HB SER 82 -17.164 12.651 0.243 666 HB3 SER 82 3HB SER 82 -16.789 11.081 -0.469 667 HG SER 82 HG SER 82 -18.323 11.464 1.893 668 H PHE 83 H PHE 83 -14.110 9.816 0.344 669 HA PHE 83 HA PHE 83 -15.025 7.375 1.568 670 HB2 PHE 83 2HB PHE 83 -12.512 7.948 -0.047 671 HB3 PHE 83 3HB PHE 83 -12.918 6.349 0.579 672 HD1 PHE 83 HD2 PHE 83 -15.507 5.645 0.034 673 HD2 PHE 83 HD1 PHE 83 -13.104 8.307 -2.296 674 HE1 PHE 83 HE2 PHE 83 -16.917 5.201 -1.939 675 HE2 PHE 83 HE1 PHE 83 -14.524 7.862 -4.248 676 HZ PHE 83 HZ PHE 83 -16.428 6.312 -4.083 677 H PHE 84 H PHE 84 -12.714 9.804 2.516 678 HA PHE 84 HA PHE 84 -11.491 8.241 4.625 679 HB2 PHE 84 2HB PHE 84 -11.675 11.265 4.250 680 HB3 PHE 84 3HB PHE 84 -10.724 10.476 5.506 681 HD1 PHE 84 HD1 PHE 84 -10.977 11.085 1.862 682 HD2 PHE 84 HD2 PHE 84 -8.578 9.451 4.989 683 HE1 PHE 84 HE1 PHE 84 -9.058 10.972 0.326 684 HE2 PHE 84 HE2 PHE 84 -6.663 9.339 3.453 685 HZ PHE 84 HZ PHE 84 -6.898 10.100 1.123 686 H GLU 85 H GLU 85 -14.378 10.096 4.219 687 HA GLU 85 HA GLU 85 -15.129 10.038 7.066 688 HB2 GLU 85 2HB GLU 85 -16.489 11.398 4.698 689 HB3 GLU 85 3HB GLU 85 -16.893 11.616 6.402 690 HG2 GLU 85 2HG GLU 85 -14.598 12.552 6.768 691 HG3 GLU 85 3HG GLU 85 -14.319 12.450 5.031 692 H ASN 86 H ASN 86 -15.187 7.782 4.881 693 HA ASN 86 HA ASN 86 -17.960 7.153 4.494 694 HB2 ASN 86 2HB ASN 86 -16.175 6.563 2.852 695 HB3 ASN 86 3HB ASN 86 -15.501 5.421 4.008 696 HD21 ASN 86 1HD2 ASN 86 -15.814 3.885 2.270 697 HD22 ASN 86 2HD2 ASN 86 -17.362 3.168 2.027 698 H LYS 87 H LYS 87 -19.061 6.764 6.289 699 HA LYS 87 HA LYS 87 -18.083 5.057 8.461 700 HB2 LYS 87 2HB LYS 87 -20.647 6.673 8.114 701 HB3 LYS 87 3HB LYS 87 -20.253 5.745 9.558 702 HG2 LYS 87 2HG LYS 87 -18.386 7.198 10.073 703 HG3 LYS 87 3HG LYS 87 -18.538 8.021 8.516 704 HD2 LYS 87 2HD LYS 87 -19.471 9.387 10.367 705 HD3 LYS 87 3HD LYS 87 -20.700 8.967 9.174 706 HE2 LYS 87 2HE LYS 87 -21.484 7.137 10.684 707 HE3 LYS 87 3HE LYS 87 -20.305 7.658 11.888 708 HZ1 LYS 87 3HZ LYS 87 -21.414 9.756 12.079 709 HZ2 LYS 87 1HZ LYS 87 -22.560 8.533 12.278 710 HZ3 LYS 87 2HZ LYS 87 -22.477 9.387 10.820 711 H GLY 88 H GLY 88 -20.690 5.145 6.027 712 HA2 GLY 88 2HA GLY 88 -22.195 2.933 6.914 713 HA3 GLY 88 3HA GLY 88 -22.239 3.617 5.298 714 H LYS 89 H LYS 89 -19.480 3.158 4.724 715 HA LYS 89 HA LYS 89 -19.171 0.204 4.749 716 HB2 LYS 89 2HB LYS 89 -18.572 2.157 2.483 717 HB3 LYS 89 3HB LYS 89 -18.023 0.487 2.497 718 HG2 LYS 89 2HG LYS 89 -20.926 1.374 2.510 719 HG3 LYS 89 3HG LYS 89 -20.038 0.804 1.095 720 HD2 LYS 89 2HD LYS 89 -20.676 -0.825 3.591 721 HD3 LYS 89 3HD LYS 89 -21.458 -0.988 2.018 722 HE2 LYS 89 2HE LYS 89 -18.543 -1.585 2.645 723 HE3 LYS 89 3HE LYS 89 -19.812 -2.770 2.329 724 HZ1 LYS 89 3HZ LYS 89 -20.028 -1.888 0.098 725 HZ2 LYS 89 1HZ LYS 89 -18.444 -2.396 0.389 726 HZ3 LYS 89 2HZ LYS 89 -18.812 -0.752 0.400 727 H ARG 90 H ARG 90 -16.672 -0.189 4.014 728 HA ARG 90 HA ARG 90 -15.051 1.046 6.030 729 HB2 ARG 90 2HB ARG 90 -14.552 -1.254 5.438 730 HB3 ARG 90 3HB ARG 90 -14.316 -0.835 3.742 731 HG2 ARG 90 2HG ARG 90 -12.259 0.319 4.215 732 HG3 ARG 90 3HG ARG 90 -12.563 0.293 5.952 733 HD2 ARG 90 2HD ARG 90 -12.041 -2.151 4.238 734 HD3 ARG 90 3HD ARG 90 -10.841 -1.345 5.260 735 HE ARG 90 HE ARG 90 -12.661 -1.840 7.087 736 HH11 ARG 90 1HH1 ARG 90 -11.615 -3.984 4.509 737 HH12 ARG 90 2HH1 ARG 90 -11.951 -5.426 5.421 738 HH21 ARG 90 1HH2 ARG 90 -13.069 -3.722 8.278 739 HH22 ARG 90 2HH2 ARG 90 -12.776 -5.278 7.564 740 HA PRO 91 HA PRO 91 -13.573 4.653 3.660 741 HB2 PRO 91 2HB PRO 91 -11.156 4.105 5.404 742 HB3 PRO 91 3HB PRO 91 -11.970 5.647 5.065 743 HG2 PRO 91 2HG PRO 91 -12.346 4.437 7.393 744 HG3 PRO 91 3HG PRO 91 -13.709 5.219 6.558 745 HD2 PRO 91 2HD PRO 91 -13.057 2.296 6.777 746 HD3 PRO 91 3HD PRO 91 -14.642 3.102 6.771 747 H VAL 92 H VAL 92 -13.128 4.075 1.618 748 HA VAL 92 HA VAL 92 -11.459 1.937 0.771 749 HB VAL 92 HB VAL 92 -12.403 4.342 -0.867 750 HG11 VAL 92 1HG1 VAL 92 -11.468 1.601 -1.810 751 HG12 VAL 92 2HG1 VAL 92 -10.598 3.124 -2.001 752 HG13 VAL 92 3HG1 VAL 92 -12.125 2.876 -2.845 753 HG21 VAL 92 3HG2 VAL 92 -14.311 3.193 0.184 754 HG22 VAL 92 1HG2 VAL 92 -13.770 1.647 -0.476 755 HG23 VAL 92 2HG2 VAL 92 -14.315 2.932 -1.560 756 H PHE 93 H PHE 93 -10.917 5.318 1.404 757 HA PHE 93 HA PHE 93 -8.010 5.011 0.928 758 HB2 PHE 93 2HB PHE 93 -9.614 7.611 0.960 759 HB3 PHE 93 3HB PHE 93 -7.906 7.430 0.567 760 HD1 PHE 93 HD1 PHE 93 -7.813 5.219 -1.338 761 HD2 PHE 93 HD2 PHE 93 -10.724 8.330 -0.996 762 HE1 PHE 93 HE1 PHE 93 -8.357 4.973 -3.723 763 HE2 PHE 93 HE2 PHE 93 -11.262 8.073 -3.386 764 HZ PHE 93 HZ PHE 93 -10.081 6.398 -4.751 765 H VAL 94 H VAL 94 -7.136 4.546 2.863 766 HA VAL 94 HA VAL 94 -8.164 5.832 5.341 767 HB VAL 94 HB VAL 94 -6.498 3.266 5.134 768 HG11 VAL 94 1HG1 VAL 94 -6.232 4.426 7.276 769 HG12 VAL 94 2HG1 VAL 94 -7.124 2.921 7.495 770 HG13 VAL 94 3HG1 VAL 94 -7.983 4.465 7.499 771 HG21 VAL 94 3HG2 VAL 94 -8.732 2.917 4.134 772 HG22 VAL 94 1HG2 VAL 94 -9.488 3.490 5.623 773 HG23 VAL 94 2HG2 VAL 94 -8.539 2.001 5.630 774 H LYS 95 H LYS 95 -6.640 6.778 6.782 775 HA LYS 95 HA LYS 95 -3.798 6.848 6.074 776 HB2 LYS 95 2HB LYS 95 -3.664 9.272 6.076 777 HB3 LYS 95 3HB LYS 95 -4.815 8.750 4.856 778 HG2 LYS 95 2HG LYS 95 -6.694 9.395 6.262 779 HG3 LYS 95 3HG LYS 95 -5.610 9.807 7.593 780 HD2 LYS 95 2HD LYS 95 -5.660 11.185 4.876 781 HD3 LYS 95 3HD LYS 95 -6.403 11.817 6.347 782 HE2 LYS 95 2HE LYS 95 -4.238 12.046 7.410 783 HE3 LYS 95 3HE LYS 95 -3.440 11.224 6.069 784 HZ1 LYS 95 3HZ LYS 95 -3.093 13.552 5.842 785 HZ2 LYS 95 1HZ LYS 95 -4.747 13.886 6.005 786 HZ3 LYS 95 2HZ LYS 95 -4.178 13.080 4.634 787 H GLY 96 H GLY 96 -2.621 8.286 7.690 788 HA2 GLY 96 2HA GLY 96 -2.931 9.307 10.004 789 HA3 GLY 96 3HA GLY 96 -3.492 7.691 10.457 790 H SER 97 H SER 97 -1.726 7.279 11.870 791 HA SER 97 HA SER 97 0.952 7.002 10.767 792 HB2 SER 97 2HB SER 97 0.442 7.409 13.234 793 HB3 SER 97 3HB SER 97 -0.169 5.755 13.321 794 HG SER 97 HG SER 97 2.430 6.702 13.183 795 H LEU 98 H LEU 98 1.929 4.624 11.047 796 HA LEU 98 HA LEU 98 0.831 2.993 9.057 797 HB2 LEU 98 2HB LEU 98 3.204 2.914 9.705 798 HB3 LEU 98 3HB LEU 98 2.777 2.277 11.286 799 HG LEU 98 HG LEU 98 1.921 0.191 10.190 800 HD11 LEU 98 1HD1 LEU 98 1.330 1.078 7.989 801 HD12 LEU 98 2HD1 LEU 98 2.431 -0.287 7.836 802 HD13 LEU 98 3HD1 LEU 98 3.034 1.357 7.617 803 HD21 LEU 98 3HD2 LEU 98 4.203 0.252 11.087 804 HD22 LEU 98 1HD2 LEU 98 4.816 0.835 9.536 805 HD23 LEU 98 2HD2 LEU 98 4.113 -0.780 9.663 806 H GLU 99 H GLU 99 0.774 2.560 12.582 807 HA GLU 99 HA GLU 99 -0.847 0.207 12.616 808 HB2 GLU 99 2HB GLU 99 -0.125 2.157 14.843 809 HB3 GLU 99 3HB GLU 99 -0.942 0.612 15.088 810 HG2 GLU 99 2HG GLU 99 1.018 -0.568 14.138 811 HG3 GLU 99 3HG GLU 99 1.832 0.980 13.932 812 H SER 100 H SER 100 -1.521 3.659 12.919 813 HA SER 100 HA SER 100 -4.185 3.557 13.841 814 HB2 SER 100 2HB SER 100 -2.836 5.678 12.092 815 HB3 SER 100 3HB SER 100 -4.324 5.910 13.004 816 HG SER 100 HG SER 100 -3.054 5.392 14.904 817 H ALA 101 H ALA 101 -2.867 3.855 10.562 818 HA ALA 101 HA ALA 101 -5.291 3.806 9.107 819 HB1 ALA 101 3HB ALA 101 -3.189 4.695 8.183 820 HB2 ALA 101 1HB ALA 101 -3.840 3.434 7.135 821 HB3 ALA 101 2HB ALA 101 -2.476 3.080 8.202 822 H ALA 102 H ALA 102 -3.261 1.299 10.445 823 HA ALA 102 HA ALA 102 -4.217 -0.954 9.010 824 HB1 ALA 102 3HB ALA 102 -2.125 -0.932 10.313 825 HB2 ALA 102 1HB ALA 102 -3.182 -2.253 10.812 826 HB3 ALA 102 2HB ALA 102 -3.054 -0.801 11.808 827 H GLU 103 H GLU 103 -5.067 0.418 12.187 828 HA GLU 103 HA GLU 103 -7.035 -1.453 12.949 829 HB2 GLU 103 2HB GLU 103 -6.816 1.467 13.818 830 HB3 GLU 103 3HB GLU 103 -7.684 0.191 14.668 831 HG2 GLU 103 2HG GLU 103 -5.543 -0.969 15.080 832 HG3 GLU 103 3HG GLU 103 -4.694 0.305 14.237 833 H GLN 104 H GLN 104 -7.258 1.647 11.250 834 HA GLN 104 HA GLN 104 -10.122 1.785 11.120 835 HB2 GLN 104 2HB GLN 104 -7.996 3.216 9.483 836 HB3 GLN 104 3HB GLN 104 -9.711 3.624 9.469 837 HG2 GLN 104 2HG GLN 104 -9.609 4.259 11.825 838 HG3 GLN 104 3HG GLN 104 -7.914 3.766 11.903 839 HE21 GLN 104 1HE2 GLN 104 -6.342 5.045 10.826 840 HE22 GLN 104 2HE2 GLN 104 -6.671 6.671 10.340 841 H ALA 105 H ALA 105 -7.638 0.518 8.921 842 HA ALA 105 HA ALA 105 -9.548 -0.205 6.841 843 HB1 ALA 105 3HB ALA 105 -7.254 0.457 6.234 844 HB2 ALA 105 1HB ALA 105 -7.607 -1.184 5.685 845 HB3 ALA 105 2HB ALA 105 -6.609 -0.926 7.120 846 H GLY 106 H GLY 106 -8.580 -1.557 9.808 847 HA2 GLY 106 2HA GLY 106 -9.516 -3.351 10.918 848 HA3 GLY 106 3HA GLY 106 -10.393 -3.776 9.458 849 H ILE 107 H ILE 107 -6.954 -3.397 9.333 850 HA ILE 107 HA ILE 107 -6.583 -6.207 8.548 851 HB ILE 107 HB ILE 107 -4.537 -3.934 8.468 852 HG12 ILE 107 2HG1 ILE 107 -6.426 -4.712 6.202 853 HG13 ILE 107 3HG1 ILE 107 -6.572 -3.256 7.184 854 HG21 ILE 107 1HG2 ILE 107 -3.609 -6.206 8.183 855 HG22 ILE 107 2HG2 ILE 107 -3.441 -5.250 6.713 856 HG23 ILE 107 3HG2 ILE 107 -4.697 -6.484 6.819 857 HD11 ILE 107 3HD1 ILE 107 -4.297 -3.946 5.337 858 HD12 ILE 107 1HD1 ILE 107 -4.371 -2.515 6.373 859 HD13 ILE 107 2HD1 ILE 107 -5.554 -2.738 5.086 860 H VAL 108 H VAL 108 -4.777 -7.492 9.511 861 HA VAL 108 HA VAL 108 -4.421 -7.170 12.323 862 HB VAL 108 HB VAL 108 -2.708 -8.863 10.453 863 HG11 VAL 108 1HG1 VAL 108 -3.084 -9.043 13.462 864 HG12 VAL 108 2HG1 VAL 108 -1.633 -8.504 12.618 865 HG13 VAL 108 3HG1 VAL 108 -2.159 -10.180 12.475 866 HG21 VAL 108 3HG2 VAL 108 -5.078 -9.473 10.229 867 HG22 VAL 108 1HG2 VAL 108 -5.206 -9.681 11.977 868 HG23 VAL 108 2HG2 VAL 108 -4.173 -10.757 11.032 869 H VAL 109 H VAL 109 -3.447 -5.493 13.058 870 HA VAL 109 HA VAL 109 -1.706 -3.713 11.919 871 HB VAL 109 HB VAL 109 -2.047 -4.403 14.870 872 HG11 VAL 109 1HG1 VAL 109 -0.747 -1.925 13.686 873 HG12 VAL 109 2HG1 VAL 109 0.066 -3.184 14.616 874 HG13 VAL 109 3HG1 VAL 109 -1.134 -2.152 15.395 875 HG21 VAL 109 3HG2 VAL 109 -3.603 -2.482 14.933 876 HG22 VAL 109 1HG2 VAL 109 -4.131 -3.684 13.753 877 HG23 VAL 109 2HG2 VAL 109 -3.339 -2.206 13.211 878 H ASP 110 H ASP 110 -0.871 -6.416 14.096 879 HA ASP 110 HA ASP 110 1.873 -6.038 14.286 880 HB2 ASP 110 2HB ASP 110 0.682 -7.613 15.760 881 HB3 ASP 110 3HB ASP 110 0.350 -8.686 14.400 882 H GLU 111 H GLU 111 0.075 -8.038 11.941 883 HA GLU 111 HA GLU 111 2.227 -9.172 10.576 884 HB2 GLU 111 2HB GLU 111 -0.585 -8.506 9.660 885 HB3 GLU 111 3HB GLU 111 0.563 -9.304 8.596 886 HG2 GLU 111 2HG GLU 111 -0.248 -10.412 11.293 887 HG3 GLU 111 3HG GLU 111 -1.074 -10.810 9.792 888 H LEU 112 H LEU 112 0.386 -6.176 9.671 889 HA LEU 112 HA LEU 112 2.153 -5.646 7.461 890 HB2 LEU 112 2HB LEU 112 0.949 -3.496 7.202 891 HB3 LEU 112 3HB LEU 112 -0.081 -4.910 7.239 892 HG LEU 112 HG LEU 112 -0.499 -4.298 9.745 893 HD11 LEU 112 1HD1 LEU 112 -0.399 -1.904 10.305 894 HD12 LEU 112 2HD1 LEU 112 0.472 -1.580 8.804 895 HD13 LEU 112 3HD1 LEU 112 1.207 -2.585 10.054 896 HD21 LEU 112 3HD2 LEU 112 -2.400 -2.972 9.166 897 HD22 LEU 112 1HD2 LEU 112 -2.154 -4.166 7.901 898 HD23 LEU 112 2HD2 LEU 112 -1.683 -2.487 7.628 899 H VAL 113 H VAL 113 2.274 -4.763 10.780 900 HA VAL 113 HA VAL 113 4.118 -2.581 10.581 901 HB VAL 113 HB VAL 113 3.373 -4.382 12.937 902 HG11 VAL 113 1HG1 VAL 113 4.715 -2.901 14.419 903 HG12 VAL 113 2HG1 VAL 113 5.370 -2.079 13.000 904 HG13 VAL 113 3HG1 VAL 113 5.736 -3.782 13.281 905 HG21 VAL 113 3HG2 VAL 113 1.703 -2.703 12.244 906 HG22 VAL 113 1HG2 VAL 113 2.904 -1.420 12.405 907 HG23 VAL 113 2HG2 VAL 113 2.361 -2.308 13.831 908 H GLN 114 H GLN 114 4.404 -6.087 10.997 909 HA GLN 114 HA GLN 114 7.266 -6.196 11.178 910 HB2 GLN 114 2HB GLN 114 5.316 -8.357 10.244 911 HB3 GLN 114 3HB GLN 114 7.016 -8.621 10.629 912 HG2 GLN 114 2HG GLN 114 4.828 -7.836 12.566 913 HG3 GLN 114 3HG GLN 114 5.644 -9.392 12.466 914 HE21 GLN 114 1HE2 GLN 114 5.887 -6.092 13.540 915 HE22 GLN 114 2HE2 GLN 114 7.299 -6.290 14.515 916 H THR 115 H THR 115 4.898 -6.433 8.614 917 HA THR 115 HA THR 115 6.459 -7.132 6.433 918 HB THR 115 HB THR 115 3.923 -5.466 6.649 919 HG1 THR 115 HG1 THR 115 2.980 -7.340 6.760 920 HG21 THR 115 3HG2 THR 115 5.060 -6.745 4.157 921 HG22 THR 115 1HG2 THR 115 4.954 -5.014 4.472 922 HG23 THR 115 2HG2 THR 115 3.483 -5.969 4.306 923 H VAL 116 H VAL 116 5.645 -3.892 7.698 924 HA VAL 116 HA VAL 116 7.097 -2.503 5.607 925 HB VAL 116 HB VAL 116 5.534 -1.477 8.021 926 HG11 VAL 116 1HG1 VAL 116 7.319 0.156 7.537 927 HG12 VAL 116 2HG1 VAL 116 5.749 0.811 7.074 928 HG13 VAL 116 3HG1 VAL 116 6.850 0.201 5.835 929 HG21 VAL 116 3HG2 VAL 116 4.897 -1.407 5.038 930 HG22 VAL 116 1HG2 VAL 116 3.893 -0.727 6.322 931 HG23 VAL 116 2HG2 VAL 116 4.153 -2.469 6.236 932 H LYS 117 H LYS 117 7.661 -3.247 9.076 933 HA LYS 117 HA LYS 117 9.924 -1.464 9.266 934 HB2 LYS 117 2HB LYS 117 10.265 -2.245 11.490 935 HB3 LYS 117 3HB LYS 117 8.525 -2.178 11.260 936 HG2 LYS 117 2HG LYS 117 8.549 -4.670 10.874 937 HG3 LYS 117 3HG LYS 117 10.262 -4.672 11.291 938 HD2 LYS 117 2HD LYS 117 7.970 -3.834 13.119 939 HD3 LYS 117 3HD LYS 117 8.881 -5.340 13.220 940 HE2 LYS 117 2HE LYS 117 10.921 -4.098 13.781 941 HE3 LYS 117 3HE LYS 117 10.056 -2.569 13.610 942 HZ1 LYS 117 3HZ LYS 117 9.374 -4.675 15.587 943 HZ2 LYS 117 1HZ LYS 117 8.666 -3.148 15.464 944 HZ3 LYS 117 2HZ LYS 117 10.284 -3.298 15.940 945 H ASN 118 H ASN 118 9.485 -4.871 8.529 946 HA ASN 118 HA ASN 118 12.332 -5.461 8.403 947 HB2 ASN 118 2HB ASN 118 9.970 -7.174 7.485 948 HB3 ASN 118 3HB ASN 118 11.650 -7.707 7.578 949 HD21 ASN 118 1HD2 ASN 118 9.255 -8.725 8.960 950 HD22 ASN 118 2HD2 ASN 118 9.593 -8.630 10.648 951 H TYR 119 H TYR 119 9.726 -4.536 6.182 952 HA TYR 119 HA TYR 119 11.038 -4.719 3.720 953 HB2 TYR 119 2HB TYR 119 8.687 -3.960 3.835 954 HB3 TYR 119 3HB TYR 119 9.163 -2.504 4.690 955 HD1 TYR 119 HD1 TYR 119 9.214 -4.216 1.398 956 HD2 TYR 119 HD2 TYR 119 9.976 -0.552 3.453 957 HE1 TYR 119 HE1 TYR 119 9.389 -3.044 -0.753 958 HE2 TYR 119 HE2 TYR 119 10.150 0.628 1.299 959 HH TYR 119 HH TYR 119 9.121 -0.683 -1.614 960 H GLN 120 H GLN 120 10.851 -1.907 5.838 961 HA GLN 120 HA GLN 120 12.852 -0.335 4.708 962 HB2 GLN 120 2HB GLN 120 11.742 -0.378 7.548 963 HB3 GLN 120 3HB GLN 120 12.769 0.905 6.910 964 HG2 GLN 120 2HG GLN 120 11.044 1.388 5.177 965 HG3 GLN 120 3HG GLN 120 10.012 0.152 5.891 966 HE21 GLN 120 1HE2 GLN 120 9.642 3.101 5.557 967 HE22 GLN 120 2HE2 GLN 120 9.283 3.697 7.133 968 H GLY 121 H GLY 121 13.013 -2.905 7.079 969 HA2 GLY 121 2HA GLY 121 15.598 -2.577 8.135 970 HA3 GLY 121 3HA GLY 121 14.710 -4.097 8.010 971 H TYR 122 H TYR 122 14.475 -4.568 5.337 972 HA TYR 122 HA TYR 122 17.196 -5.291 4.696 973 HB2 TYR 122 2HB TYR 122 16.349 -6.700 2.948 974 HB3 TYR 122 3HB TYR 122 15.386 -6.937 4.386 975 HD1 TYR 122 HD2 TYR 122 15.298 -4.999 1.161 976 HD2 TYR 122 HD1 TYR 122 13.031 -7.102 4.097 977 HE1 TYR 122 HE2 TYR 122 13.291 -4.764 -0.196 978 HE2 TYR 122 HE1 TYR 122 11.025 -6.868 2.693 979 HH TYR 122 HH TYR 122 11.172 -5.748 -0.523 980 H VAL 123 H VAL 123 15.089 -2.740 3.778 981 HA VAL 123 HA VAL 123 16.256 -1.988 1.295 982 HB VAL 123 HB VAL 123 14.775 -0.287 3.364 983 HG11 VAL 123 1HG1 VAL 123 16.236 1.180 2.047 984 HG12 VAL 123 2HG1 VAL 123 14.554 1.440 1.594 985 HG13 VAL 123 3HG1 VAL 123 15.614 0.494 0.543 986 HG21 VAL 123 3HG2 VAL 123 13.411 -2.049 2.253 987 HG22 VAL 123 1HG2 VAL 123 13.822 -1.368 0.682 988 HG23 VAL 123 2HG2 VAL 123 12.865 -0.429 1.832 989 H GLN 124 H GLN 124 16.831 -0.828 4.646 990 HA GLN 124 HA GLN 124 19.160 0.730 3.925 991 HB2 GLN 124 2HB GLN 124 19.430 1.101 6.382 992 HB3 GLN 124 3HB GLN 124 17.815 1.491 5.807 993 HG2 GLN 124 2HG GLN 124 17.040 -0.719 6.632 994 HG3 GLN 124 3HG GLN 124 18.638 -0.992 7.321 995 HE21 GLN 124 1HE2 GLN 124 16.051 -0.855 8.661 996 HE22 GLN 124 2HE2 GLN 124 16.181 0.411 9.829 997 H ASP 125 H ASP 125 18.607 -2.585 4.763 998 HA ASP 125 HA ASP 125 21.290 -3.314 5.475 999 HB2 ASP 125 2HB ASP 125 19.308 -4.740 5.953 1000 HB3 ASP 125 3HB ASP 125 19.044 -4.972 4.240 1001 H GLY 126 H GLY 126 19.586 -2.713 2.470 1002 HA2 GLY 126 2HA GLY 126 20.334 -2.429 0.309 1003 HA3 GLY 126 3HA GLY 126 21.973 -2.730 0.862 1004 H HIS 127 H HIS 127 19.218 -4.941 1.290 1005 HA HIS 127 HA HIS 127 19.924 -6.569 -1.033 1006 HB2 HIS 127 2HB HIS 127 21.521 -7.381 0.703 1007 HB3 HIS 127 3HB HIS 127 20.184 -7.706 1.794 1008 HD1 HIS 127 HD1 HIS 127 21.678 -8.937 -1.457 1009 HD2 HIS 127 HD2 HIS 127 19.010 -10.202 1.470 1010 HE1 HIS 127 HE1 HIS 127 21.218 -11.349 -1.959 1011 HE2 HIS 127 HE2 HIS 127 19.481 -12.042 -0.285 1012 H ASP 128 H ASP 128 18.157 -7.673 -1.784 1013 HA ASP 128 HA ASP 128 15.554 -7.040 -0.794 1014 HB2 ASP 128 2HB ASP 128 14.734 -8.428 -2.661 1015 HB3 ASP 128 3HB ASP 128 16.013 -7.350 -3.191 1016 H HIS 129 H HIS 129 13.915 -8.507 -0.060 1017 HA HIS 129 HA HIS 129 14.654 -11.175 0.893 1018 HB2 HIS 129 2HB HIS 129 14.074 -8.907 2.822 1019 HB3 HIS 129 3HB HIS 129 13.638 -10.549 3.264 1020 HD1 HIS 129 HD1 HIS 129 15.491 -12.068 4.082 1021 HD2 HIS 129 HD2 HIS 129 16.934 -8.447 2.653 1022 HE1 HIS 129 HE1 HIS 129 17.914 -12.005 4.723 1023 HE2 HIS 129 HE2 HIS 129 18.683 -9.708 4.068 1024 H ASP 130 H ASP 130 12.262 -8.713 0.256 1025 HA ASP 130 HA ASP 130 9.870 -9.906 0.952 1026 HB2 ASP 130 2HB ASP 130 8.847 -8.492 -0.864 1027 HB3 ASP 130 3HB ASP 130 9.965 -7.598 0.154 1028 H PHE 131 H PHE 131 11.497 -10.115 -2.201 1029 HA PHE 131 HA PHE 131 10.342 -12.650 -2.965 1030 HB2 PHE 131 2HB PHE 131 9.510 -10.079 -4.437 1031 HB3 PHE 131 3HB PHE 131 9.258 -11.704 -5.066 1032 HD1 PHE 131 HD1 PHE 131 7.714 -13.295 -3.732 1033 HD2 PHE 131 HD2 PHE 131 7.883 -9.084 -2.996 1034 HE1 PHE 131 HE1 PHE 131 5.541 -13.401 -2.571 1035 HE2 PHE 131 HE2 PHE 131 5.713 -9.205 -1.838 1036 HZ PHE 131 HZ PHE 131 4.546 -11.358 -1.626 1037 H GLY 132 H GLY 132 11.916 -9.615 -4.044 1038 HA2 GLY 132 2HA GLY 132 14.383 -10.521 -4.780 1039 HA3 GLY 132 3HA GLY 132 13.383 -10.919 -6.172 1040 H ARG 133 H ARG 133 12.661 -8.003 -4.305 1041 HA ARG 133 HA ARG 133 13.276 -6.363 -6.634 1042 HB2 ARG 133 2HB ARG 133 11.230 -5.841 -5.464 1043 HB3 ARG 133 3HB ARG 133 12.074 -5.693 -3.924 1044 HG2 ARG 133 2HG ARG 133 13.135 -3.647 -4.591 1045 HG3 ARG 133 3HG ARG 133 12.639 -3.846 -6.271 1046 HD2 ARG 133 2HD ARG 133 10.720 -3.419 -3.957 1047 HD3 ARG 133 3HD ARG 133 11.315 -2.128 -5.009 1048 HE ARG 133 HE ARG 133 9.555 -4.363 -5.803 1049 HH11 ARG 133 1HH1 ARG 133 10.950 -1.226 -6.559 1050 HH12 ARG 133 2HH1 ARG 133 9.932 -0.977 -7.936 1051 HH21 ARG 133 1HH2 ARG 133 8.311 -4.065 -7.660 1052 HH22 ARG 133 2HH2 ARG 133 8.434 -2.586 -8.563 1053 H ASP 134 H ASP 134 15.335 -5.944 -6.964 1054 HA ASP 134 HA ASP 134 17.496 -6.149 -5.258 1055 HB2 ASP 134 2HB ASP 134 17.532 -6.127 -7.795 1056 HB3 ASP 134 3HB ASP 134 17.326 -4.385 -7.757 1057 HA PRO 135 HA PRO 135 17.882 -2.545 -2.467 1058 HB2 PRO 135 2HB PRO 135 20.639 -2.079 -3.301 1059 HB3 PRO 135 3HB PRO 135 20.047 -2.847 -1.820 1060 HG2 PRO 135 2HG PRO 135 20.897 -4.107 -4.378 1061 HG3 PRO 135 3HG PRO 135 20.978 -4.742 -2.716 1062 HD2 PRO 135 2HD PRO 135 19.180 -5.728 -4.381 1063 HD3 PRO 135 3HD PRO 135 18.706 -5.369 -2.703 1064 H LYS 136 H LYS 136 18.942 -2.170 -5.848 1065 HA LYS 136 HA LYS 136 19.218 0.652 -5.818 1066 HB2 LYS 136 2HB LYS 136 19.357 0.529 -8.236 1067 HB3 LYS 136 3HB LYS 136 20.225 -0.839 -7.546 1068 HG2 LYS 136 2HG LYS 136 18.236 -2.283 -8.042 1069 HG3 LYS 136 3HG LYS 136 17.474 -0.897 -8.826 1070 HD2 LYS 136 2HD LYS 136 18.427 -2.247 -10.567 1071 HD3 LYS 136 3HD LYS 136 19.447 -0.816 -10.420 1072 HE2 LYS 136 2HE LYS 136 21.086 -2.121 -9.119 1073 HE3 LYS 136 3HE LYS 136 20.047 -3.545 -9.237 1074 HZ1 LYS 136 3HZ LYS 136 21.327 -2.141 -11.521 1075 HZ2 LYS 136 1HZ LYS 136 20.321 -3.495 -11.638 1076 HZ3 LYS 136 2HZ LYS 136 21.818 -3.616 -10.863 1077 H TYR 137 H TYR 137 16.395 -1.377 -6.220 1078 HA TYR 137 HA TYR 137 14.627 0.842 -7.017 1079 HB2 TYR 137 2HB TYR 137 13.896 -2.075 -6.462 1080 HB3 TYR 137 3HB TYR 137 12.896 -0.872 -7.275 1081 HD1 TYR 137 HD2 TYR 137 14.075 0.228 -9.438 1082 HD2 TYR 137 HD1 TYR 137 15.037 -3.620 -7.835 1083 HE1 TYR 137 HE2 TYR 137 15.020 -0.446 -11.601 1084 HE2 TYR 137 HE1 TYR 137 15.992 -4.276 -10.002 1085 HH TYR 137 HH TYR 137 16.643 -2.052 -12.474 1086 H LEU 138 H LEU 138 15.725 -0.659 -4.168 1087 HA LEU 138 HA LEU 138 13.347 -0.436 -2.563 1088 HB2 LEU 138 2HB LEU 138 16.246 -1.013 -1.856 1089 HB3 LEU 138 3HB LEU 138 14.940 -1.029 -0.683 1090 HG LEU 138 HG LEU 138 15.183 -2.888 -3.074 1091 HD11 LEU 138 1HD1 LEU 138 16.827 -3.419 -1.322 1092 HD12 LEU 138 2HD1 LEU 138 15.590 -4.667 -1.431 1093 HD13 LEU 138 3HD1 LEU 138 15.540 -3.491 -0.115 1094 HD21 LEU 138 3HD2 LEU 138 13.070 -2.812 -0.890 1095 HD22 LEU 138 1HD2 LEU 138 13.222 -4.060 -2.133 1096 HD23 LEU 138 2HD2 LEU 138 12.833 -2.405 -2.591 1097 H HIS 139 H HIS 139 12.616 1.312 -1.539 1098 HA HIS 139 HA HIS 139 14.479 3.056 -0.120 1099 HB2 HIS 139 2HB HIS 139 13.949 4.241 -2.300 1100 HB3 HIS 139 3HB HIS 139 12.249 4.248 -1.842 1101 HD1 HIS 139 HD1 HIS 139 11.503 6.012 -0.142 1102 HD2 HIS 139 HD2 HIS 139 15.615 5.966 -0.736 1103 HE1 HIS 139 HE1 HIS 139 12.371 8.079 0.983 1104 HE2 HIS 139 HE2 HIS 139 14.815 8.137 0.411 1105 H GLN 140 H GLN 140 13.661 3.635 1.866 1106 HA GLN 140 HA GLN 140 11.378 2.297 2.928 1107 HB2 GLN 140 2HB GLN 140 12.969 4.607 4.149 1108 HB3 GLN 140 3HB GLN 140 11.789 3.627 5.000 1109 HG2 GLN 140 2HG GLN 140 13.643 2.512 5.699 1110 HG3 GLN 140 3HG GLN 140 13.415 1.645 4.197 1111 HE21 GLN 140 1HE2 GLN 140 15.794 1.892 5.695 1112 HE22 GLN 140 2HE2 GLN 140 16.969 2.654 4.691 1113 H PHE 141 H PHE 141 9.322 3.054 3.399 1114 HA PHE 141 HA PHE 141 8.222 5.309 2.078 1115 HB2 PHE 141 2HB PHE 141 7.071 3.902 4.529 1116 HB3 PHE 141 3HB PHE 141 6.184 4.877 3.364 1117 HD1 PHE 141 HD1 PHE 141 6.137 4.001 0.914 1118 HD2 PHE 141 HD2 PHE 141 7.138 1.563 4.279 1119 HE1 PHE 141 HE1 PHE 141 5.574 1.987 -0.364 1120 HE2 PHE 141 HE2 PHE 141 6.572 -0.454 2.990 1121 HZ PHE 141 HZ PHE 141 5.789 -0.245 0.658 1122 H GLU 142 H GLU 142 8.659 7.390 2.602 1123 HA GLU 142 HA GLU 142 9.650 8.181 5.202 1124 HB2 GLU 142 2HB GLU 142 8.717 9.916 2.865 1125 HB3 GLU 142 3HB GLU 142 9.558 10.499 4.303 1126 HG2 GLU 142 2HG GLU 142 11.511 9.070 3.691 1127 HG3 GLU 142 3HG GLU 142 10.667 8.608 2.212 1128 H GLY 143 H GLY 143 8.211 7.789 6.754 1129 HA2 GLY 143 2HA GLY 143 5.350 7.895 6.281 1130 HA3 GLY 143 3HA GLY 143 6.171 7.245 7.679 1131 H GLU 144 H GLU 144 6.002 10.472 6.164 1132 HA GLU 144 HA GLU 144 5.580 11.986 8.506 1133 HB2 GLU 144 2HB GLU 144 4.468 12.561 5.708 1134 HB3 GLU 144 3HB GLU 144 4.711 13.736 6.996 1135 HG2 GLU 144 2HG GLU 144 7.157 13.371 6.853 1136 HG3 GLU 144 3HG GLU 144 6.900 12.223 5.541 1137 H THR 145 H THR 145 3.367 10.572 6.181 1138 HA THR 145 HA THR 145 1.509 9.722 8.245 1139 HB THR 145 HB THR 145 0.669 11.474 5.883 1140 HG1 THR 145 HG1 THR 145 1.067 11.926 8.523 1141 HG21 THR 145 3HG2 THR 145 -1.676 11.099 6.541 1142 HG22 THR 145 1HG2 THR 145 -1.157 9.933 7.770 1143 HG23 THR 145 2HG2 THR 145 -0.925 9.585 6.057 1144 H PHE 146 H PHE 146 0.952 7.630 7.791 1145 HA PHE 146 HA PHE 146 1.599 6.435 5.190 1146 HB2 PHE 146 2HB PHE 146 1.024 5.365 7.943 1147 HB3 PHE 146 3HB PHE 146 0.547 4.341 6.599 1148 HD1 PHE 146 HD2 PHE 146 3.445 5.850 8.345 1149 HD2 PHE 146 HD1 PHE 146 2.191 3.263 5.179 1150 HE1 PHE 146 HE2 PHE 146 5.739 4.983 8.128 1151 HE2 PHE 146 HE1 PHE 146 4.487 2.413 4.971 1152 HZ PHE 146 HZ PHE 146 6.260 3.266 6.445 1153 H TYR 147 H TYR 147 0.129 5.485 3.855 1154 HA TYR 147 HA TYR 147 -2.766 5.795 4.375 1155 HB2 TYR 147 2HB TYR 147 -1.175 6.362 1.849 1156 HB3 TYR 147 3HB TYR 147 -2.864 5.885 1.734 1157 HD1 TYR 147 HD1 TYR 147 -0.675 8.434 3.439 1158 HD2 TYR 147 HD2 TYR 147 -4.521 7.552 1.803 1159 HE1 TYR 147 HE1 TYR 147 -1.357 10.774 3.763 1160 HE2 TYR 147 HE2 TYR 147 -5.185 9.888 2.124 1161 HH TYR 147 HH TYR 147 -2.950 12.367 2.856 1162 H ILE 148 H ILE 148 -3.959 4.032 4.054 1163 HA ILE 148 HA ILE 148 -2.845 1.674 2.650 1164 HB ILE 148 HB ILE 148 -4.571 1.669 5.181 1165 HG12 ILE 148 2HG1 ILE 148 -1.739 0.627 4.662 1166 HG13 ILE 148 3HG1 ILE 148 -2.172 1.998 5.675 1167 HG21 ILE 148 1HG2 ILE 148 -4.579 -0.790 5.014 1168 HG22 ILE 148 2HG2 ILE 148 -3.715 -0.702 3.480 1169 HG23 ILE 148 3HG2 ILE 148 -5.354 -0.062 3.607 1170 HD11 ILE 148 3HD1 ILE 148 -1.599 0.100 7.032 1171 HD12 ILE 148 1HD1 ILE 148 -2.801 -0.901 6.218 1172 HD13 ILE 148 2HD1 ILE 148 -3.315 0.456 7.222 1173 H ILE 149 H ILE 149 -3.918 1.604 0.803 1174 HA ILE 149 HA ILE 149 -6.648 2.671 0.563 1175 HB ILE 149 HB ILE 149 -4.731 1.787 -1.645 1176 HG12 ILE 149 2HG1 ILE 149 -3.647 3.615 -0.486 1177 HG13 ILE 149 3HG1 ILE 149 -4.301 4.261 -1.982 1178 HG21 ILE 149 1HG2 ILE 149 -6.177 3.126 -3.147 1179 HG22 ILE 149 2HG2 ILE 149 -7.268 3.457 -1.800 1180 HG23 ILE 149 3HG2 ILE 149 -7.065 1.805 -2.383 1181 HD11 ILE 149 3HD1 ILE 149 -6.168 5.247 -0.717 1182 HD12 ILE 149 1HD1 ILE 149 -4.601 5.817 -0.149 1183 HD13 ILE 149 2HD1 ILE 149 -5.485 4.605 0.776 1184 H GLU 150 H GLU 150 -8.305 1.303 0.553 1185 HA GLU 150 HA GLU 150 -8.121 -1.521 0.588 1186 HB2 GLU 150 2HB GLU 150 -9.947 -0.213 1.655 1187 HB3 GLU 150 3HB GLU 150 -10.522 0.290 0.072 1188 HG2 GLU 150 2HG GLU 150 -11.082 -2.048 -0.475 1189 HG3 GLU 150 3HG GLU 150 -10.484 -2.567 1.102 1190 H GLN 151 H GLN 151 -7.431 -2.622 -1.110 1191 HA GLN 151 HA GLN 151 -8.024 -1.792 -3.887 1192 HB2 GLN 151 2HB GLN 151 -5.908 -3.677 -2.745 1193 HB3 GLN 151 3HB GLN 151 -6.149 -3.388 -4.461 1194 HG2 GLN 151 2HG GLN 151 -5.363 -1.271 -2.451 1195 HG3 GLN 151 3HG GLN 151 -4.239 -2.143 -3.490 1196 HE21 GLN 151 1HE2 GLN 151 -6.050 -2.096 -5.830 1197 HE22 GLN 151 2HE2 GLN 151 -5.996 -0.475 -6.417 1198 H ARG 152 H ARG 152 -9.814 -2.754 -4.607 1199 HA ARG 152 HA ARG 152 -10.159 -5.673 -4.296 1200 HB2 ARG 152 2HB ARG 152 -12.056 -3.464 -5.199 1201 HB3 ARG 152 3HB ARG 152 -12.367 -5.142 -5.618 1202 HG2 ARG 152 2HG ARG 152 -13.674 -4.558 -3.670 1203 HG3 ARG 152 3HG ARG 152 -12.438 -5.729 -3.199 1204 HD2 ARG 152 2HD ARG 152 -12.733 -3.916 -1.529 1205 HD3 ARG 152 3HD ARG 152 -11.102 -3.970 -2.190 1206 HE ARG 152 HE ARG 152 -11.537 -2.000 -3.420 1207 HH11 ARG 152 1HH1 ARG 152 -14.204 -2.784 -1.269 1208 HH12 ARG 152 2HH1 ARG 152 -14.864 -1.182 -1.325 1209 HH21 ARG 152 1HH2 ARG 152 -12.394 0.082 -3.467 1210 HH22 ARG 152 2HH2 ARG 152 -13.842 0.450 -2.574 1211 H LEU 153 H LEU 153 -10.984 -6.686 -6.438 1212 HA LEU 153 HA LEU 153 -9.098 -6.324 -8.571 1213 HB2 LEU 153 2HB LEU 153 -11.736 -7.842 -8.470 1214 HB3 LEU 153 3HB LEU 153 -10.615 -7.917 -9.820 1215 HG LEU 153 HG LEU 153 -9.970 -8.839 -6.989 1216 HD11 LEU 153 1HD1 LEU 153 -10.655 -10.530 -9.417 1217 HD12 LEU 153 2HD1 LEU 153 -11.671 -10.291 -7.992 1218 HD13 LEU 153 3HD1 LEU 153 -10.131 -11.133 -7.842 1219 HD21 LEU 153 3HD2 LEU 153 -7.968 -9.873 -7.985 1220 HD22 LEU 153 1HD2 LEU 153 -7.960 -8.122 -8.195 1221 HD23 LEU 153 2HD2 LEU 153 -8.371 -9.171 -9.554 1222 H GLU 154 H GLU 154 -9.821 -5.863 -10.844 1223 HA GLU 154 HA GLU 154 -10.762 -3.251 -11.169 1224 HB2 GLU 154 2HB GLU 154 -10.393 -5.538 -13.134 1225 HB3 GLU 154 3HB GLU 154 -10.861 -3.928 -13.666 1226 HG2 GLU 154 2HG GLU 154 -8.370 -4.346 -12.018 1227 HG3 GLU 154 3HG GLU 154 -8.366 -4.619 -13.755 1228 H HIS 155 H HIS 155 -12.572 -6.191 -11.047 1229 HA HIS 155 HA HIS 155 -15.003 -4.919 -12.154 1230 HB2 HIS 155 2HB HIS 155 -14.409 -7.882 -11.672 1231 HB3 HIS 155 3HB HIS 155 -15.876 -7.227 -12.401 1232 HD1 HIS 155 HD1 HIS 155 -15.828 -6.862 -14.907 1233 HD2 HIS 155 HD2 HIS 155 -12.029 -7.457 -13.331 1234 HE1 HIS 155 HE1 HIS 155 -14.292 -7.042 -16.887 1235 HE2 HIS 155 HE2 HIS 155 -11.988 -7.258 -15.902 1236 H HIS 156 H HIS 156 -16.070 -3.918 -10.523 1237 HA HIS 156 HA HIS 156 -17.240 -5.452 -8.398 1238 HB2 HIS 156 2HB HIS 156 -15.029 -4.926 -7.348 1239 HB3 HIS 156 3HB HIS 156 -15.339 -3.207 -7.573 1240 HD1 HIS 156 HD1 HIS 156 -16.085 -2.157 -5.446 1241 HD2 HIS 156 HD2 HIS 156 -17.420 -6.080 -5.752 1242 HE1 HIS 156 HE1 HIS 156 -17.408 -2.583 -3.359 1243 HE2 HIS 156 HE2 HIS 156 -18.378 -4.879 -3.681 1244 H HIS 157 H HIS 157 -16.579 -2.210 -9.707 1245 HA HIS 157 HA HIS 157 -19.443 -1.524 -9.534 1246 HB2 HIS 157 2HB HIS 157 -18.309 -0.447 -7.573 1247 HB3 HIS 157 3HB HIS 157 -17.197 0.363 -8.671 1248 HD1 HIS 157 HD1 HIS 157 -20.818 0.390 -7.597 1249 HD2 HIS 157 HD2 HIS 157 -18.207 2.730 -9.822 1250 HE1 HIS 157 HE1 HIS 157 -22.016 2.557 -7.988 1251 HE2 HIS 157 HE2 HIS 157 -20.315 4.029 -9.090 1252 H HIS 158 H HIS 158 -19.966 -1.361 -11.647 1253 HA HIS 158 HA HIS 158 -17.943 -0.430 -13.605 1254 HB2 HIS 158 2HB HIS 158 -19.242 -1.763 -15.268 1255 HB3 HIS 158 3HB HIS 158 -18.699 -2.750 -13.920 1256 HD1 HIS 158 HD1 HIS 158 -20.542 -3.645 -12.289 1257 HD2 HIS 158 HD2 HIS 158 -22.013 -1.592 -15.580 1258 HE1 HIS 158 HE1 HIS 158 -22.988 -4.194 -12.383 1259 HE2 HIS 158 HE2 HIS 158 -23.883 -2.748 -14.232 1260 H HIS 159 H HIS 159 -19.701 0.060 -15.756 1261 HA HIS 159 HA HIS 159 -20.489 2.746 -15.430 1262 HB2 HIS 159 2HB HIS 159 -19.847 1.668 -17.598 1263 HB3 HIS 159 3HB HIS 159 -21.337 0.738 -17.580 1264 HD1 HIS 159 HD1 HIS 159 -23.574 2.141 -17.945 1265 HD2 HIS 159 HD2 HIS 159 -20.049 4.211 -18.661 1266 HE1 HIS 159 HE1 HIS 159 -24.245 4.163 -19.254 1267 HE2 HIS 159 HE2 HIS 159 -22.070 5.236 -19.890 1268 H HIS 160 H HIS 160 -22.664 3.674 -15.557 1269 HA HIS 160 HA HIS 160 -24.659 2.136 -14.027 1270 HB2 HIS 160 2HB HIS 160 -24.501 5.132 -14.624 1271 HB3 HIS 160 3HB HIS 160 -25.743 4.365 -13.635 1272 HD1 HIS 160 HD1 HIS 160 -22.743 6.168 -13.254 1273 HD2 HIS 160 HD2 HIS 160 -24.344 2.835 -11.382 1274 HE1 HIS 160 HE1 HIS 160 -21.555 6.004 -11.059 1275 HE2 HIS 160 HE2 HIS 160 -22.750 4.157 -9.846 Start of MODEL 19 1 H1 MET 1 1H MET 1 -29.756 2.852 -7.991 2 H2 MET 1 2H MET 1 -31.204 2.054 -8.320 3 H3 MET 1 3H MET 1 -29.790 1.169 -8.088 4 HA MET 1 HA MET 1 -31.131 2.825 -6.045 5 HB2 MET 1 2HB MET 1 -32.357 0.708 -6.700 6 HB3 MET 1 3HB MET 1 -30.931 -0.218 -6.263 7 HG2 MET 1 2HG MET 1 -32.420 1.521 -4.281 8 HG3 MET 1 3HG MET 1 -32.821 -0.168 -4.564 9 HE1 MET 1 3HE MET 1 -29.944 -1.501 -4.971 10 HE2 MET 1 1HE MET 1 -31.171 -2.214 -3.923 11 HE3 MET 1 2HE MET 1 -29.534 -1.968 -3.321 12 H VAL 2 H VAL 2 -29.464 3.769 -5.024 13 HA VAL 2 HA VAL 2 -27.476 4.286 -4.121 14 HB VAL 2 HB VAL 2 -26.716 3.020 -2.235 15 HG11 VAL 2 1HG1 VAL 2 -29.726 2.670 -2.463 16 HG12 VAL 2 2HG1 VAL 2 -28.877 4.130 -1.951 17 HG13 VAL 2 3HG1 VAL 2 -28.789 2.673 -0.963 18 HG21 VAL 2 3HG2 VAL 2 -28.238 0.592 -3.269 19 HG22 VAL 2 1HG2 VAL 2 -27.420 0.701 -1.705 20 HG23 VAL 2 2HG2 VAL 2 -26.487 0.779 -3.199 21 H GLU 3 H GLU 3 -27.343 2.955 -6.746 22 HA GLU 3 HA GLU 3 -26.000 2.100 -8.294 23 HB2 GLU 3 2HB GLU 3 -23.787 2.902 -6.362 24 HB3 GLU 3 3HB GLU 3 -23.485 2.309 -7.997 25 HG2 GLU 3 2HG GLU 3 -24.766 4.187 -8.937 26 HG3 GLU 3 3HG GLU 3 -25.095 4.784 -7.312 27 HA PRO 4 HA PRO 4 -25.371 -2.222 -7.225 28 HB2 PRO 4 2HB PRO 4 -24.481 -3.191 -9.583 29 HB3 PRO 4 3HB PRO 4 -26.114 -2.501 -9.445 30 HG2 PRO 4 2HG PRO 4 -23.612 -1.212 -10.504 31 HG3 PRO 4 3HG PRO 4 -25.247 -1.218 -11.204 32 HD2 PRO 4 2HD PRO 4 -24.255 0.873 -9.706 33 HD3 PRO 4 3HD PRO 4 -25.988 0.483 -9.819 34 H GLY 5 H GLY 5 -23.014 -0.209 -6.804 35 HA2 GLY 5 2HA GLY 5 -20.967 -0.406 -5.797 36 HA3 GLY 5 3HA GLY 5 -21.108 -2.154 -5.920 37 H VAL 6 H VAL 6 -20.955 0.486 -8.326 38 HA VAL 6 HA VAL 6 -19.097 -0.975 -10.011 39 HB VAL 6 HB VAL 6 -19.257 0.954 -11.556 40 HG11 VAL 6 1HG1 VAL 6 -21.982 0.075 -10.530 41 HG12 VAL 6 2HG1 VAL 6 -20.978 -0.799 -11.688 42 HG13 VAL 6 3HG1 VAL 6 -21.648 0.774 -12.119 43 HG21 VAL 6 3HG2 VAL 6 -20.985 2.266 -9.418 44 HG22 VAL 6 1HG2 VAL 6 -20.733 2.885 -11.054 45 HG23 VAL 6 2HG2 VAL 6 -19.380 2.791 -9.927 46 H ALA 7 H ALA 7 -18.640 0.948 -7.297 47 HA ALA 7 HA ALA 7 -16.449 2.600 -8.030 48 HB1 ALA 7 3HB ALA 7 -16.120 2.912 -5.606 49 HB2 ALA 7 1HB ALA 7 -17.237 1.584 -5.279 50 HB3 ALA 7 2HB ALA 7 -17.823 3.061 -6.045 51 H LYS 8 H LYS 8 -14.764 1.562 -9.012 52 HA LYS 8 HA LYS 8 -13.061 -0.166 -7.355 53 HB2 LYS 8 2HB LYS 8 -14.545 -1.396 -9.255 54 HB3 LYS 8 3HB LYS 8 -13.273 -0.821 -10.314 55 HG2 LYS 8 2HG LYS 8 -12.905 -2.648 -7.912 56 HG3 LYS 8 3HG LYS 8 -12.903 -3.149 -9.602 57 HD2 LYS 8 2HD LYS 8 -10.862 -1.785 -9.991 58 HD3 LYS 8 3HD LYS 8 -10.872 -1.298 -8.295 59 HE2 LYS 8 2HE LYS 8 -9.250 -3.062 -8.579 60 HE3 LYS 8 3HE LYS 8 -10.611 -3.714 -7.665 61 HZ1 LYS 8 3HZ LYS 8 -11.445 -4.705 -9.712 62 HZ2 LYS 8 1HZ LYS 8 -9.883 -5.250 -9.376 63 HZ3 LYS 8 2HZ LYS 8 -10.137 -4.085 -10.574 64 H LEU 9 H LEU 9 -10.932 0.477 -7.481 65 HA LEU 9 HA LEU 9 -10.281 2.925 -8.876 66 HB2 LEU 9 2HB LEU 9 -9.506 2.429 -6.555 67 HB3 LEU 9 3HB LEU 9 -8.549 1.096 -7.176 68 HG LEU 9 HG LEU 9 -7.185 2.753 -8.502 69 HD11 LEU 9 1HD1 LEU 9 -7.339 5.136 -7.947 70 HD12 LEU 9 2HD1 LEU 9 -8.770 4.823 -6.962 71 HD13 LEU 9 3HD1 LEU 9 -8.813 4.539 -8.705 72 HD21 LEU 9 3HD2 LEU 9 -5.878 3.589 -6.601 73 HD22 LEU 9 1HD2 LEU 9 -6.378 1.919 -6.335 74 HD23 LEU 9 2HD2 LEU 9 -7.213 3.232 -5.501 75 H THR 10 H THR 10 -9.057 3.128 -10.690 76 HA THR 10 HA THR 10 -8.462 0.812 -12.315 77 HB THR 10 HB THR 10 -7.662 2.720 -13.942 78 HG1 THR 10 HG1 THR 10 -9.033 4.687 -13.147 79 HG21 THR 10 3HG2 THR 10 -9.803 1.501 -14.223 80 HG22 THR 10 1HG2 THR 10 -9.985 3.211 -14.615 81 HG23 THR 10 2HG2 THR 10 -10.579 2.593 -13.073 82 H THR 11 H THR 11 -6.331 1.027 -13.647 83 HA THR 11 HA THR 11 -4.510 0.014 -11.697 84 HB THR 11 HB THR 11 -3.209 -0.690 -13.815 85 HG1 THR 11 HG1 THR 11 -3.856 0.283 -15.577 86 HG21 THR 11 3HG2 THR 11 -4.747 -2.237 -12.659 87 HG22 THR 11 1HG2 THR 11 -4.865 -2.438 -14.408 88 HG23 THR 11 2HG2 THR 11 -6.117 -1.552 -13.536 89 H TYR 12 H TYR 12 -4.432 2.911 -13.787 90 HA TYR 12 HA TYR 12 -1.675 3.395 -13.804 91 HB2 TYR 12 2HB TYR 12 -2.178 5.745 -14.336 92 HB3 TYR 12 3HB TYR 12 -3.222 4.662 -15.240 93 HD1 TYR 12 HD2 TYR 12 -3.139 7.068 -12.385 94 HD2 TYR 12 HD1 TYR 12 -5.642 4.787 -14.991 95 HE1 TYR 12 HE2 TYR 12 -5.094 8.300 -11.587 96 HE2 TYR 12 HE1 TYR 12 -7.597 6.046 -14.187 97 HH TYR 12 HH TYR 12 -7.297 8.885 -12.317 98 H ALA 13 H ALA 13 -4.027 4.063 -11.314 99 HA ALA 13 HA ALA 13 -2.571 5.846 -9.679 100 HB1 ALA 13 3HB ALA 13 -4.282 5.288 -7.976 101 HB2 ALA 13 1HB ALA 13 -4.822 3.934 -8.974 102 HB3 ALA 13 2HB ALA 13 -5.009 5.588 -9.555 103 H SER 14 H SER 14 -2.900 2.305 -9.685 104 HA SER 14 HA SER 14 -1.342 1.891 -7.295 105 HB2 SER 14 2HB SER 14 -1.612 -0.535 -7.859 106 HB3 SER 14 3HB SER 14 -3.145 0.334 -7.835 107 HG SER 14 HG SER 14 -3.402 -0.426 -9.763 108 H LYS 15 H LYS 15 -0.736 1.894 -10.758 109 HA LYS 15 HA LYS 15 1.751 0.558 -10.850 110 HB2 LYS 15 2HB LYS 15 0.601 2.724 -12.667 111 HB3 LYS 15 3HB LYS 15 2.082 1.844 -13.029 112 HG2 LYS 15 2HG LYS 15 -0.643 0.559 -12.699 113 HG3 LYS 15 3HG LYS 15 0.082 1.000 -14.247 114 HD2 LYS 15 2HD LYS 15 1.951 -0.575 -13.816 115 HD3 LYS 15 3HD LYS 15 1.227 -1.013 -12.264 116 HE2 LYS 15 2HE LYS 15 -0.722 -1.951 -13.396 117 HE3 LYS 15 3HE LYS 15 -0.116 -1.412 -14.962 118 HZ1 LYS 15 3HZ LYS 15 1.221 -3.397 -13.208 119 HZ2 LYS 15 1HZ LYS 15 1.745 -2.911 -14.738 120 HZ3 LYS 15 2HZ LYS 15 0.297 -3.762 -14.571 121 H GLN 16 H GLN 16 0.965 4.022 -10.601 122 HA GLN 16 HA GLN 16 3.703 4.892 -10.607 123 HB2 GLN 16 2HB GLN 16 1.154 6.430 -9.973 124 HB3 GLN 16 3HB GLN 16 2.738 7.154 -10.244 125 HG2 GLN 16 2HG GLN 16 1.106 5.600 -12.271 126 HG3 GLN 16 3HG GLN 16 1.359 7.344 -12.249 127 HE21 GLN 16 1HE2 GLN 16 1.980 5.399 -14.359 128 HE22 GLN 16 2HE2 GLN 16 3.671 5.550 -14.666 129 H ALA 17 H ALA 17 1.404 4.058 -8.134 130 HA ALA 17 HA ALA 17 2.685 5.329 -5.926 131 HB1 ALA 17 3HB ALA 17 0.333 4.648 -5.851 132 HB2 ALA 17 1HB ALA 17 1.245 3.897 -4.541 133 HB3 ALA 17 2HB ALA 17 0.801 2.951 -5.966 134 H THR 18 H THR 18 2.760 2.002 -7.230 135 HA THR 18 HA THR 18 4.661 0.999 -5.328 136 HB THR 18 HB THR 18 4.786 -0.962 -6.923 137 HG1 THR 18 HG1 THR 18 3.763 -0.877 -8.819 138 HG21 THR 18 3HG2 THR 18 2.460 -1.717 -6.554 139 HG22 THR 18 1HG2 THR 18 1.981 -0.064 -6.153 140 HG23 THR 18 2HG2 THR 18 3.109 -0.938 -5.110 141 H ASP 19 H ASP 19 4.858 2.395 -8.544 142 HA ASP 19 HA ASP 19 7.580 2.076 -9.148 143 HB2 ASP 19 2HB ASP 19 5.917 2.916 -10.772 144 HB3 ASP 19 3HB ASP 19 5.682 4.374 -9.819 145 H MET 20 H MET 20 5.865 4.408 -7.167 146 HA MET 20 HA MET 20 8.011 6.177 -6.584 147 HB2 MET 20 2HB MET 20 5.405 6.481 -6.323 148 HB3 MET 20 3HB MET 20 5.625 5.742 -4.749 149 HG2 MET 20 2HG MET 20 5.616 8.096 -4.411 150 HG3 MET 20 3HG MET 20 7.298 7.587 -4.245 151 HE1 MET 20 3HE MET 20 5.496 7.828 -7.779 152 HE2 MET 20 1HE MET 20 5.689 9.548 -8.126 153 HE3 MET 20 2HE MET 20 4.647 9.026 -6.800 154 H GLY 21 H GLY 21 6.769 3.217 -5.084 155 HA2 GLY 21 2HA GLY 21 8.646 1.868 -4.024 156 HA3 GLY 21 3HA GLY 21 8.904 3.277 -3.005 157 H ALA 22 H ALA 22 5.602 2.592 -3.774 158 HA ALA 22 HA ALA 22 4.965 1.930 -1.030 159 HB1 ALA 22 3HB ALA 22 3.163 2.058 -3.473 160 HB2 ALA 22 1HB ALA 22 3.489 3.388 -2.361 161 HB3 ALA 22 2HB ALA 22 2.625 1.958 -1.793 162 H ILE 23 H ILE 23 3.749 0.013 -0.390 163 HA ILE 23 HA ILE 23 4.595 -2.430 -1.866 164 HB ILE 23 HB ILE 23 4.751 -3.608 0.276 165 HG12 ILE 23 2HG1 ILE 23 3.926 -0.974 1.606 166 HG13 ILE 23 3HG1 ILE 23 2.917 -2.408 1.482 167 HG21 ILE 23 1HG2 ILE 23 6.259 -0.972 0.420 168 HG22 ILE 23 2HG2 ILE 23 6.766 -2.402 -0.482 169 HG23 ILE 23 3HG2 ILE 23 6.685 -2.455 1.280 170 HD11 ILE 23 3HD1 ILE 23 4.472 -3.626 2.918 171 HD12 ILE 23 1HD1 ILE 23 3.836 -2.180 3.696 172 HD13 ILE 23 2HD1 ILE 23 5.478 -2.183 3.054 173 H TYR 24 H TYR 24 3.256 -4.366 -1.305 174 HA TYR 24 HA TYR 24 0.390 -3.749 -0.940 175 HB2 TYR 24 2HB TYR 24 1.770 -5.413 -3.036 176 HB3 TYR 24 3HB TYR 24 0.262 -6.056 -2.398 177 HD1 TYR 24 HD1 TYR 24 -1.725 -4.312 -2.243 178 HD2 TYR 24 HD2 TYR 24 1.600 -3.935 -4.908 179 HE1 TYR 24 HE1 TYR 24 -3.049 -2.835 -3.676 180 HE2 TYR 24 HE2 TYR 24 0.265 -2.449 -6.346 181 HH TYR 24 HH TYR 24 -2.668 -1.075 -5.342 182 H VAL 25 H VAL 25 -0.670 -4.840 0.518 183 HA VAL 25 HA VAL 25 0.363 -7.336 1.693 184 HB VAL 25 HB VAL 25 -0.343 -6.612 3.962 185 HG11 VAL 25 1HG1 VAL 25 2.009 -6.293 3.363 186 HG12 VAL 25 2HG1 VAL 25 1.478 -5.016 4.457 187 HG13 VAL 25 3HG1 VAL 25 1.658 -4.681 2.732 188 HG21 VAL 25 3HG2 VAL 25 -2.092 -4.990 3.376 189 HG22 VAL 25 1HG2 VAL 25 -0.879 -3.879 2.735 190 HG23 VAL 25 2HG2 VAL 25 -0.913 -4.253 4.461 191 H ASN 26 H ASN 26 -1.404 -8.489 2.936 192 HA ASN 26 HA ASN 26 -4.085 -8.107 1.708 193 HB2 ASN 26 2HB ASN 26 -4.560 -10.447 2.524 194 HB3 ASN 26 3HB ASN 26 -3.270 -10.365 1.336 195 HD21 ASN 26 1HD2 ASN 26 -1.190 -10.927 1.941 196 HD22 ASN 26 2HD2 ASN 26 -0.837 -11.691 3.444 197 H SER 27 H SER 27 -5.663 -9.364 3.613 198 HA SER 27 HA SER 27 -6.123 -7.151 5.336 199 HB2 SER 27 2HB SER 27 -7.956 -8.508 4.316 200 HB3 SER 27 3HB SER 27 -7.514 -9.860 5.353 201 HG SER 27 HG SER 27 -7.834 -7.857 6.988 202 H LYS 28 H LYS 28 -4.115 -9.863 5.723 203 HA LYS 28 HA LYS 28 -4.114 -9.725 8.661 204 HB2 LYS 28 2HB LYS 28 -2.330 -11.442 6.877 205 HB3 LYS 28 3HB LYS 28 -2.586 -11.613 8.613 206 HG2 LYS 28 2HG LYS 28 -4.633 -12.112 6.434 207 HG3 LYS 28 3HG LYS 28 -3.808 -13.338 7.399 208 HD2 LYS 28 2HD LYS 28 -4.968 -12.626 9.415 209 HD3 LYS 28 3HD LYS 28 -5.658 -11.226 8.586 210 HE2 LYS 28 2HE LYS 28 -7.332 -13.003 8.835 211 HE3 LYS 28 3HE LYS 28 -6.972 -12.732 7.131 212 HZ1 LYS 28 3HZ LYS 28 -5.897 -14.934 8.809 213 HZ2 LYS 28 1HZ LYS 28 -5.529 -14.672 7.183 214 HZ3 LYS 28 2HZ LYS 28 -7.102 -15.077 7.630 215 H GLY 29 H GLY 29 -1.931 -9.179 5.877 216 HA2 GLY 29 2HA GLY 29 -0.783 -6.938 6.001 217 HA3 GLY 29 3HA GLY 29 -0.231 -7.426 7.597 218 H ASP 30 H ASP 30 -0.273 -10.064 5.521 219 HA ASP 30 HA ASP 30 2.619 -10.121 5.212 220 HB2 ASP 30 2HB ASP 30 0.484 -12.055 4.194 221 HB3 ASP 30 3HB ASP 30 2.219 -12.356 4.203 222 H ARG 31 H ARG 31 3.647 -10.493 3.100 223 HA ARG 31 HA ARG 31 2.949 -8.940 0.889 224 HB2 ARG 31 2HB ARG 31 4.492 -11.572 0.956 225 HB3 ARG 31 3HB ARG 31 4.377 -10.562 -0.477 226 HG2 ARG 31 2HG ARG 31 5.611 -9.633 2.124 227 HG3 ARG 31 3HG ARG 31 6.516 -10.398 0.819 228 HD2 ARG 31 2HD ARG 31 6.865 -8.106 0.436 229 HD3 ARG 31 3HD ARG 31 5.560 -8.494 -0.686 230 HE ARG 31 HE ARG 31 4.105 -7.209 0.569 231 HH11 ARG 31 1HH1 ARG 31 7.200 -7.439 2.260 232 HH12 ARG 31 2HH1 ARG 31 6.784 -6.204 3.405 233 HH21 ARG 31 1HH2 ARG 31 3.563 -5.676 2.119 234 HH22 ARG 31 2HH2 ARG 31 4.720 -5.206 3.321 235 H ILE 32 H ILE 32 1.522 -9.190 -0.790 236 HA ILE 32 HA ILE 32 0.221 -11.821 -1.193 237 HB ILE 32 HB ILE 32 -1.392 -10.658 -2.668 238 HG12 ILE 32 2HG1 ILE 32 -0.015 -8.054 -1.846 239 HG13 ILE 32 3HG1 ILE 32 0.092 -8.790 -3.437 240 HG21 ILE 32 1HG2 ILE 32 -1.160 -9.348 0.064 241 HG22 ILE 32 2HG2 ILE 32 -1.905 -10.910 -0.275 242 HG23 ILE 32 3HG2 ILE 32 -2.622 -9.436 -0.922 243 HD11 ILE 32 3HD1 ILE 32 -2.314 -8.472 -3.743 244 HD12 ILE 32 1HD1 ILE 32 -1.457 -6.959 -3.450 245 HD13 ILE 32 2HD1 ILE 32 -2.404 -7.697 -2.158 246 H VAL 33 H VAL 33 2.175 -9.343 -2.758 247 HA VAL 33 HA VAL 33 2.982 -11.125 -4.928 248 HB VAL 33 HB VAL 33 0.877 -9.873 -5.644 249 HG11 VAL 33 1HG1 VAL 33 2.617 -7.397 -5.499 250 HG12 VAL 33 2HG1 VAL 33 1.237 -7.767 -4.466 251 HG13 VAL 33 3HG1 VAL 33 0.993 -7.480 -6.189 252 HG21 VAL 33 3HG2 VAL 33 1.701 -9.207 -7.874 253 HG22 VAL 33 1HG2 VAL 33 2.394 -10.744 -7.348 254 HG23 VAL 33 2HG2 VAL 33 3.362 -9.269 -7.277 255 H ASN 34 H ASN 34 4.818 -10.208 -6.111 256 HA ASN 34 HA ASN 34 6.849 -8.941 -4.685 257 HB2 ASN 34 2HB ASN 34 7.033 -10.303 -6.843 258 HB3 ASN 34 3HB ASN 34 6.480 -8.890 -7.721 259 HD21 ASN 34 1HD2 ASN 34 8.117 -6.922 -6.246 260 HD22 ASN 34 2HD2 ASN 34 9.749 -7.251 -6.668 261 H GLU 35 H GLU 35 4.561 -7.659 -7.044 262 HA GLU 35 HA GLU 35 4.276 -5.068 -5.952 263 HB2 GLU 35 2HB GLU 35 6.696 -5.062 -6.932 264 HB3 GLU 35 3HB GLU 35 5.949 -5.156 -8.523 265 HG2 GLU 35 2HG GLU 35 4.810 -3.006 -8.108 266 HG3 GLU 35 3HG GLU 35 5.540 -2.930 -6.504 267 H SER 36 H SER 36 3.099 -3.637 -7.796 268 HA SER 36 HA SER 36 1.101 -5.284 -9.127 269 HB2 SER 36 2HB SER 36 0.110 -3.048 -9.765 270 HB3 SER 36 3HB SER 36 0.364 -3.215 -8.029 271 HG SER 36 HG SER 36 1.142 -1.225 -8.615 272 H ASN 37 H ASN 37 3.361 -6.093 -10.219 273 HA ASN 37 HA ASN 37 4.588 -4.619 -12.281 274 HB2 ASN 37 2HB ASN 37 4.409 -7.661 -11.997 275 HB3 ASN 37 3HB ASN 37 5.564 -6.790 -13.001 276 HD21 ASN 37 1HD2 ASN 37 7.232 -5.581 -11.959 277 HD22 ASN 37 2HD2 ASN 37 7.713 -5.938 -10.338 278 H VAL 38 H VAL 38 2.275 -7.321 -12.527 279 HA VAL 38 HA VAL 38 0.941 -6.036 -14.811 280 HB VAL 38 HB VAL 38 2.611 -7.637 -15.786 281 HG11 VAL 38 1HG1 VAL 38 2.338 -10.071 -15.546 282 HG12 VAL 38 2HG1 VAL 38 1.063 -9.817 -14.351 283 HG13 VAL 38 3HG1 VAL 38 2.717 -9.305 -14.001 284 HG21 VAL 38 3HG2 VAL 38 -0.276 -8.480 -16.228 285 HG22 VAL 38 1HG2 VAL 38 1.072 -8.806 -17.324 286 HG23 VAL 38 2HG2 VAL 38 0.552 -7.145 -17.032 287 H TYR 39 H TYR 39 -1.246 -6.800 -15.102 288 HA TYR 39 HA TYR 39 -2.752 -7.089 -12.790 289 HB2 TYR 39 2HB TYR 39 -4.688 -7.532 -14.269 290 HB3 TYR 39 3HB TYR 39 -3.697 -6.232 -14.917 291 HD1 TYR 39 HD2 TYR 39 -2.384 -6.568 -17.015 292 HD2 TYR 39 HD1 TYR 39 -4.855 -9.706 -15.469 293 HE1 TYR 39 HE2 TYR 39 -2.197 -7.781 -19.147 294 HE2 TYR 39 HE1 TYR 39 -4.663 -10.904 -17.599 295 HH TYR 39 HH TYR 39 -4.152 -10.499 -19.910 296 H THR 40 H THR 40 -1.409 -9.557 -14.921 297 HA THR 40 HA THR 40 -2.936 -11.770 -14.153 298 HB THR 40 HB THR 40 -0.016 -11.890 -15.054 299 HG1 THR 40 HG1 THR 40 -1.231 -12.086 -17.203 300 HG21 THR 40 3HG2 THR 40 -2.358 -13.783 -15.509 301 HG22 THR 40 1HG2 THR 40 -1.020 -14.063 -14.389 302 HG23 THR 40 2HG2 THR 40 -0.719 -14.004 -16.127 303 H THR 41 H THR 41 0.365 -10.865 -13.110 304 HA THR 41 HA THR 41 0.664 -12.859 -11.147 305 HB THR 41 HB THR 41 2.136 -10.187 -11.322 306 HG1 THR 41 HG1 THR 41 2.559 -12.675 -12.643 307 HG21 THR 41 3HG2 THR 41 4.016 -11.395 -10.287 308 HG22 THR 41 1HG2 THR 41 3.051 -12.870 -10.201 309 HG23 THR 41 2HG2 THR 41 2.605 -11.464 -9.230 310 H PHE 42 H PHE 42 -0.490 -9.506 -10.974 311 HA PHE 42 HA PHE 42 -0.488 -9.231 -8.141 312 HB2 PHE 42 2HB PHE 42 -0.424 -7.255 -9.568 313 HB3 PHE 42 3HB PHE 42 -1.945 -7.695 -10.336 314 HD1 PHE 42 HD1 PHE 42 -0.588 -7.010 -6.895 315 HD2 PHE 42 HD2 PHE 42 -3.881 -6.566 -9.597 316 HE1 PHE 42 HE1 PHE 42 -1.802 -5.704 -5.213 317 HE2 PHE 42 HE2 PHE 42 -5.088 -5.253 -7.899 318 HZ PHE 42 HZ PHE 42 -4.048 -4.824 -5.708 319 H ARG 43 H ARG 43 -3.107 -9.889 -10.470 320 HA ARG 43 HA ARG 43 -5.252 -10.057 -8.631 321 HB2 ARG 43 2HB ARG 43 -5.578 -9.657 -11.037 322 HB3 ARG 43 3HB ARG 43 -4.912 -11.239 -11.418 323 HG2 ARG 43 2HG ARG 43 -6.855 -12.305 -10.293 324 HG3 ARG 43 3HG ARG 43 -7.527 -10.701 -9.969 325 HD2 ARG 43 2HD ARG 43 -7.585 -10.256 -12.421 326 HD3 ARG 43 3HD ARG 43 -6.958 -11.880 -12.709 327 HE ARG 43 HE ARG 43 -9.035 -12.729 -11.688 328 HH11 ARG 43 1HH1 ARG 43 -9.071 -9.457 -13.000 329 HH12 ARG 43 2HH1 ARG 43 -10.783 -9.463 -13.283 330 HH21 ARG 43 1HH2 ARG 43 -11.248 -12.743 -12.109 331 HH22 ARG 43 2HH2 ARG 43 -12.023 -11.340 -12.775 332 H ASN 44 H ASN 44 -3.359 -12.591 -10.295 333 HA ASN 44 HA ASN 44 -4.468 -14.853 -9.052 334 HB2 ASN 44 2HB ASN 44 -1.730 -14.411 -10.312 335 HB3 ASN 44 3HB ASN 44 -2.254 -15.986 -9.720 336 HD21 ASN 44 1HD2 ASN 44 -1.592 -15.010 -12.443 337 HD22 ASN 44 2HD2 ASN 44 -2.959 -15.432 -13.412 338 H ALA 45 H ALA 45 -2.037 -12.606 -7.927 339 HA ALA 45 HA ALA 45 -0.963 -14.138 -5.784 340 HB1 ALA 45 3HB ALA 45 0.157 -12.151 -6.665 341 HB2 ALA 45 1HB ALA 45 -0.150 -11.978 -4.941 342 HB3 ALA 45 2HB ALA 45 -1.165 -11.127 -6.103 343 H ILE 46 H ILE 46 -3.713 -11.863 -5.989 344 HA ILE 46 HA ILE 46 -4.377 -11.937 -3.190 345 HB ILE 46 HB ILE 46 -6.226 -11.178 -5.507 346 HG12 ILE 46 2HG1 ILE 46 -4.382 -9.307 -3.938 347 HG13 ILE 46 3HG1 ILE 46 -4.019 -9.920 -5.548 348 HG21 ILE 46 1HG2 ILE 46 -7.386 -9.782 -3.821 349 HG22 ILE 46 2HG2 ILE 46 -6.272 -10.346 -2.576 350 HG23 ILE 46 3HG2 ILE 46 -7.384 -11.481 -3.341 351 HD11 ILE 46 3HD1 ILE 46 -5.999 -8.793 -6.427 352 HD12 ILE 46 1HD1 ILE 46 -4.885 -7.671 -5.648 353 HD13 ILE 46 2HD1 ILE 46 -6.357 -8.165 -4.815 354 H LEU 47 H LEU 47 -5.397 -13.701 -6.074 355 HA LEU 47 HA LEU 47 -7.422 -15.338 -4.918 356 HB2 LEU 47 2HB LEU 47 -5.635 -15.959 -7.304 357 HB3 LEU 47 3HB LEU 47 -7.175 -16.726 -6.939 358 HG LEU 47 HG LEU 47 -6.819 -13.797 -7.714 359 HD11 LEU 47 1HD1 LEU 47 -6.327 -15.282 -9.586 360 HD12 LEU 47 2HD1 LEU 47 -7.812 -14.373 -9.853 361 HD13 LEU 47 3HD1 LEU 47 -7.894 -16.075 -9.389 362 HD21 LEU 47 3HD2 LEU 47 -8.767 -14.133 -6.245 363 HD22 LEU 47 1HD2 LEU 47 -9.385 -15.371 -7.343 364 HD23 LEU 47 2HD2 LEU 47 -9.249 -13.695 -7.882 365 H LYS 48 H LYS 48 -3.951 -15.565 -5.183 366 HA LYS 48 HA LYS 48 -3.469 -18.232 -4.342 367 HB2 LYS 48 2HB LYS 48 -1.735 -17.066 -5.501 368 HB3 LYS 48 3HB LYS 48 -1.846 -15.674 -4.443 369 HG2 LYS 48 2HG LYS 48 -0.872 -17.123 -2.603 370 HG3 LYS 48 3HG LYS 48 -0.554 -18.343 -3.847 371 HD2 LYS 48 2HD LYS 48 0.851 -16.758 -5.091 372 HD3 LYS 48 3HD LYS 48 0.452 -15.466 -3.951 373 HE2 LYS 48 2HE LYS 48 2.669 -16.331 -3.484 374 HE3 LYS 48 3HE LYS 48 1.582 -16.736 -2.157 375 HZ1 LYS 48 3HZ LYS 48 2.384 -18.578 -4.347 376 HZ2 LYS 48 1HZ LYS 48 1.378 -18.968 -3.044 377 HZ3 LYS 48 2HZ LYS 48 3.003 -18.597 -2.775 378 H GLN 49 H GLN 49 -3.845 -15.167 -2.583 379 HA GLN 49 HA GLN 49 -3.231 -16.310 0.016 380 HB2 GLN 49 2HB GLN 49 -4.732 -13.697 -0.449 381 HB3 GLN 49 3HB GLN 49 -3.784 -14.164 0.958 382 HG2 GLN 49 2HG GLN 49 -2.796 -13.342 -1.768 383 HG3 GLN 49 3HG GLN 49 -2.522 -12.536 -0.232 384 HE21 GLN 49 1HE2 GLN 49 -0.651 -13.557 -2.325 385 HE22 GLN 49 2HE2 GLN 49 0.463 -14.562 -1.467 386 H ALA 50 H ALA 50 -4.809 -16.515 1.733 387 HA ALA 50 HA ALA 50 -7.319 -17.675 1.038 388 HB1 ALA 50 3HB ALA 50 -7.726 -17.739 3.471 389 HB2 ALA 50 1HB ALA 50 -6.340 -16.679 3.744 390 HB3 ALA 50 2HB ALA 50 -6.099 -18.300 3.091 391 H ASP 51 H ASP 51 -6.274 -14.464 2.023 392 HA ASP 51 HA ASP 51 -8.870 -13.266 2.265 393 HB2 ASP 51 2HB ASP 51 -6.157 -11.926 1.823 394 HB3 ASP 51 3HB ASP 51 -7.634 -11.115 2.347 395 H LYS 52 H LYS 52 -9.944 -11.943 0.798 396 HA LYS 52 HA LYS 52 -9.080 -12.030 -2.045 397 HB2 LYS 52 2HB LYS 52 -11.892 -12.141 -0.862 398 HB3 LYS 52 3HB LYS 52 -11.570 -11.914 -2.581 399 HG2 LYS 52 2HG LYS 52 -10.663 -14.311 -0.953 400 HG3 LYS 52 3HG LYS 52 -12.093 -14.285 -1.989 401 HD2 LYS 52 2HD LYS 52 -10.826 -14.245 -3.974 402 HD3 LYS 52 3HD LYS 52 -9.407 -13.555 -3.187 403 HE2 LYS 52 2HE LYS 52 -10.387 -16.404 -2.839 404 HE3 LYS 52 3HE LYS 52 -9.041 -15.893 -3.860 405 HZ1 LYS 52 3HZ LYS 52 -8.182 -16.668 -1.792 406 HZ2 LYS 52 1HZ LYS 52 -9.206 -15.657 -0.907 407 HZ3 LYS 52 2HZ LYS 52 -7.963 -14.993 -1.842 408 H VAL 53 H VAL 53 -8.129 -10.098 -0.379 409 HA VAL 53 HA VAL 53 -9.007 -7.693 -1.708 410 HB VAL 53 HB VAL 53 -10.559 -7.634 0.162 411 HG11 VAL 53 1HG1 VAL 53 -9.880 -7.639 2.522 412 HG12 VAL 53 2HG1 VAL 53 -8.203 -7.935 2.053 413 HG13 VAL 53 3HG1 VAL 53 -9.439 -9.152 1.722 414 HG21 VAL 53 3HG2 VAL 53 -9.967 -5.480 1.208 415 HG22 VAL 53 1HG2 VAL 53 -9.604 -5.478 -0.519 416 HG23 VAL 53 2HG2 VAL 53 -8.298 -5.659 0.656 417 H ALA 54 H ALA 54 -7.375 -6.255 -1.915 418 HA ALA 54 HA ALA 54 -4.739 -6.826 -0.689 419 HB1 ALA 54 3HB ALA 54 -4.767 -7.094 -3.122 420 HB2 ALA 54 1HB ALA 54 -3.780 -5.707 -2.664 421 HB3 ALA 54 2HB ALA 54 -5.403 -5.461 -3.319 422 H TYR 55 H TYR 55 -3.437 -4.947 -0.170 423 HA TYR 55 HA TYR 55 -4.841 -2.373 0.180 424 HB2 TYR 55 2HB TYR 55 -3.295 -3.804 2.394 425 HB3 TYR 55 3HB TYR 55 -3.956 -2.179 2.499 426 HD1 TYR 55 HD2 TYR 55 -4.830 -5.774 2.369 427 HD2 TYR 55 HD1 TYR 55 -6.336 -1.823 2.964 428 HE1 TYR 55 HE2 TYR 55 -6.924 -6.703 3.224 429 HE2 TYR 55 HE1 TYR 55 -8.439 -2.764 3.827 430 HH TYR 55 HH TYR 55 -9.722 -4.867 3.624 431 H LEU 56 H LEU 56 -3.626 -0.806 -0.586 432 HA LEU 56 HA LEU 56 -0.770 -1.209 -1.174 433 HB2 LEU 56 2HB LEU 56 -2.303 -0.607 -3.014 434 HB3 LEU 56 3HB LEU 56 -2.821 0.827 -2.152 435 HG LEU 56 HG LEU 56 -0.619 1.868 -2.470 436 HD11 LEU 56 1HD1 LEU 56 0.208 -0.675 -3.900 437 HD12 LEU 56 2HD1 LEU 56 0.837 -0.085 -2.361 438 HD13 LEU 56 3HD1 LEU 56 1.138 0.826 -3.838 439 HD21 LEU 56 3HD2 LEU 56 -1.742 0.731 -5.052 440 HD22 LEU 56 1HD2 LEU 56 -0.690 2.142 -4.917 441 HD23 LEU 56 2HD2 LEU 56 -2.304 2.182 -4.216 442 H VAL 57 H VAL 57 0.409 -0.655 0.586 443 HA VAL 57 HA VAL 57 -0.335 1.620 2.292 444 HB VAL 57 HB VAL 57 2.028 -0.298 2.620 445 HG11 VAL 57 1HG1 VAL 57 2.091 0.507 4.963 446 HG12 VAL 57 2HG1 VAL 57 0.782 1.637 4.611 447 HG13 VAL 57 3HG1 VAL 57 2.347 1.829 3.819 448 HG21 VAL 57 3HG2 VAL 57 -0.718 -0.453 3.917 449 HG22 VAL 57 1HG2 VAL 57 0.663 -1.481 4.318 450 HG23 VAL 57 2HG2 VAL 57 -0.070 -1.570 2.715 451 H MET 58 H MET 58 0.582 3.574 2.037 452 HA MET 58 HA MET 58 3.144 3.940 0.648 453 HB2 MET 58 2HB MET 58 2.229 5.544 -0.942 454 HB3 MET 58 3HB MET 58 1.308 4.056 -1.088 455 HG2 MET 58 2HG MET 58 -0.533 5.044 0.193 456 HG3 MET 58 3HG MET 58 0.401 6.520 0.426 457 HE1 MET 58 3HE MET 58 -0.115 4.250 -2.830 458 HE2 MET 58 1HE MET 58 -1.423 5.153 -3.589 459 HE3 MET 58 2HE MET 58 -1.693 4.343 -2.046 460 H ASP 59 H ASP 59 3.676 6.369 0.643 461 HA ASP 59 HA ASP 59 3.051 7.643 3.230 462 HB2 ASP 59 2HB ASP 59 5.433 7.494 2.673 463 HB3 ASP 59 3HB ASP 59 5.158 8.205 1.089 464 H GLU 60 H GLU 60 2.635 10.070 3.132 465 HA GLU 60 HA GLU 60 0.334 10.606 1.601 466 HB2 GLU 60 2HB GLU 60 0.760 11.672 3.793 467 HB3 GLU 60 3HB GLU 60 2.073 12.616 3.090 468 HG2 GLU 60 2HG GLU 60 0.519 13.801 1.636 469 HG3 GLU 60 3HG GLU 60 -0.815 12.767 2.140 470 H ARG 61 H ARG 61 3.724 11.535 1.078 471 HA ARG 61 HA ARG 61 3.250 13.396 -1.038 472 HB2 ARG 61 2HB ARG 61 5.749 11.732 -0.514 473 HB3 ARG 61 3HB ARG 61 5.662 13.174 -1.527 474 HG2 ARG 61 2HG ARG 61 5.187 14.576 0.417 475 HG3 ARG 61 3HG ARG 61 5.099 13.152 1.463 476 HD2 ARG 61 2HD ARG 61 7.553 14.236 0.039 477 HD3 ARG 61 3HD ARG 61 7.259 14.194 1.780 478 HE ARG 61 HE ARG 61 7.317 11.700 1.585 479 HH11 ARG 61 1HH1 ARG 61 8.987 13.626 -0.850 480 HH12 ARG 61 2HH1 ARG 61 10.095 12.363 -1.257 481 HH21 ARG 61 1HH2 ARG 61 8.745 10.047 0.995 482 HH22 ARG 61 2HH2 ARG 61 9.962 10.332 -0.211 483 H THR 62 H THR 62 3.575 9.903 -0.928 484 HA THR 62 HA THR 62 3.629 9.406 -3.748 485 HB THR 62 HB THR 62 2.709 7.588 -1.474 486 HG1 THR 62 HG1 THR 62 5.110 8.559 -1.983 487 HG21 THR 62 3HG2 THR 62 3.607 6.892 -4.298 488 HG22 THR 62 1HG2 THR 62 1.967 6.728 -3.665 489 HG23 THR 62 2HG2 THR 62 3.267 5.721 -3.023 490 H TRP 63 H TRP 63 1.096 9.663 -1.272 491 HA TRP 63 HA TRP 63 -1.120 8.985 -2.885 492 HB2 TRP 63 2HB TRP 63 -1.368 8.882 -0.480 493 HB3 TRP 63 3HB TRP 63 -0.946 10.583 -0.297 494 HD1 TRP 63 HD1 TRP 63 -2.969 12.192 -0.105 495 HE1 TRP 63 HE1 TRP 63 -5.475 12.070 -0.629 496 HE3 TRP 63 HE3 TRP 63 -3.128 7.592 -2.370 497 HZ2 TRP 63 HZ2 TRP 63 -7.280 10.293 -1.837 498 HZ3 TRP 63 HZ3 TRP 63 -5.297 6.767 -3.197 499 HH2 TRP 63 HH2 TRP 63 -7.335 8.093 -2.935 500 H LYS 64 H LYS 64 0.537 12.095 -2.294 501 HA LYS 64 HA LYS 64 -1.309 13.860 -3.415 502 HB2 LYS 64 2HB LYS 64 1.732 14.015 -3.584 503 HB3 LYS 64 3HB LYS 64 0.634 15.349 -3.924 504 HG2 LYS 64 2HG LYS 64 1.133 14.020 -1.254 505 HG3 LYS 64 3HG LYS 64 1.577 15.657 -1.742 506 HD2 LYS 64 2HD LYS 64 -0.943 16.095 -2.023 507 HD3 LYS 64 3HD LYS 64 -1.207 14.560 -1.204 508 HE2 LYS 64 2HE LYS 64 -0.023 15.393 0.780 509 HE3 LYS 64 3HE LYS 64 0.316 16.914 -0.049 510 HZ1 LYS 64 3HZ LYS 64 -1.569 17.119 1.439 511 HZ2 LYS 64 1HZ LYS 64 -2.387 15.887 0.622 512 HZ3 LYS 64 2HZ LYS 64 -2.054 17.346 -0.163 513 H LYS 65 H LYS 65 1.069 11.749 -4.920 514 HA LYS 65 HA LYS 65 0.748 12.666 -7.605 515 HB2 LYS 65 2HB LYS 65 1.842 10.015 -6.558 516 HB3 LYS 65 3HB LYS 65 2.028 10.611 -8.204 517 HG2 LYS 65 2HG LYS 65 3.146 11.938 -5.715 518 HG3 LYS 65 3HG LYS 65 4.067 10.950 -6.844 519 HD2 LYS 65 2HD LYS 65 2.726 13.609 -7.485 520 HD3 LYS 65 3HD LYS 65 4.453 13.349 -7.238 521 HE2 LYS 65 2HE LYS 65 4.525 11.881 -9.220 522 HE3 LYS 65 3HE LYS 65 2.795 12.128 -9.470 523 HZ1 LYS 65 3HZ LYS 65 4.912 14.205 -9.609 524 HZ2 LYS 65 1HZ LYS 65 3.254 14.509 -9.743 525 HZ3 LYS 65 2HZ LYS 65 4.032 13.566 -10.902 526 H VAL 66 H VAL 66 -0.513 9.837 -5.807 527 HA VAL 66 HA VAL 66 -1.994 8.652 -7.890 528 HB VAL 66 HB VAL 66 -2.430 8.490 -4.866 529 HG11 VAL 66 1HG1 VAL 66 -3.550 6.674 -7.036 530 HG12 VAL 66 2HG1 VAL 66 -4.481 7.770 -6.014 531 HG13 VAL 66 3HG1 VAL 66 -3.666 6.378 -5.300 532 HG21 VAL 66 3HG2 VAL 66 -1.155 6.364 -5.028 533 HG22 VAL 66 1HG2 VAL 66 -0.193 7.742 -5.574 534 HG23 VAL 66 2HG2 VAL 66 -0.913 6.645 -6.754 535 H TYR 67 H TYR 67 -3.248 10.547 -5.146 536 HA TYR 67 HA TYR 67 -5.844 11.029 -5.777 537 HB2 TYR 67 2HB TYR 67 -4.801 11.699 -3.656 538 HB3 TYR 67 3HB TYR 67 -3.844 12.925 -4.470 539 HD1 TYR 67 HD1 TYR 67 -7.330 11.992 -3.544 540 HD2 TYR 67 HD2 TYR 67 -4.738 15.149 -4.784 541 HE1 TYR 67 HE1 TYR 67 -9.104 13.623 -3.089 542 HE2 TYR 67 HE2 TYR 67 -6.518 16.783 -4.325 543 HH TYR 67 HH TYR 67 -8.911 16.888 -4.106 544 H ASP 68 H ASP 68 -3.034 12.914 -6.894 545 HA ASP 68 HA ASP 68 -4.378 14.934 -8.321 546 HB2 ASP 68 2HB ASP 68 -1.993 15.132 -7.761 547 HB3 ASP 68 3HB ASP 68 -1.606 13.746 -8.776 548 H LEU 69 H LEU 69 -3.013 11.823 -9.393 549 HA LEU 69 HA LEU 69 -3.665 11.996 -12.128 550 HB2 LEU 69 2HB LEU 69 -3.223 9.571 -10.344 551 HB3 LEU 69 3HB LEU 69 -3.369 9.476 -12.091 552 HG LEU 69 HG LEU 69 -1.171 10.965 -10.610 553 HD11 LEU 69 1HD1 LEU 69 -1.056 8.302 -12.064 554 HD12 LEU 69 2HD1 LEU 69 -0.958 8.550 -10.318 555 HD13 LEU 69 3HD1 LEU 69 0.318 9.167 -11.362 556 HD21 LEU 69 3HD2 LEU 69 -1.527 10.455 -13.579 557 HD22 LEU 69 1HD2 LEU 69 -0.103 11.169 -12.821 558 HD23 LEU 69 2HD2 LEU 69 -1.647 12.012 -12.756 559 H LEU 70 H LEU 70 -5.527 10.858 -9.346 560 HA LEU 70 HA LEU 70 -7.602 9.498 -10.673 561 HB2 LEU 70 2HB LEU 70 -7.750 11.045 -8.050 562 HB3 LEU 70 3HB LEU 70 -8.959 9.903 -8.615 563 HG LEU 70 HG LEU 70 -6.115 9.275 -7.757 564 HD11 LEU 70 1HD1 LEU 70 -7.629 9.617 -5.890 565 HD12 LEU 70 2HD1 LEU 70 -7.176 7.918 -6.007 566 HD13 LEU 70 3HD1 LEU 70 -8.770 8.445 -6.558 567 HD21 LEU 70 3HD2 LEU 70 -6.630 7.894 -9.695 568 HD22 LEU 70 1HD2 LEU 70 -8.149 7.372 -8.955 569 HD23 LEU 70 2HD2 LEU 70 -6.603 6.913 -8.234 570 H ILE 71 H ILE 71 -7.473 12.849 -9.496 571 HA ILE 71 HA ILE 71 -9.944 13.672 -10.679 572 HB ILE 71 HB ILE 71 -7.643 15.404 -9.655 573 HG12 ILE 71 2HG1 ILE 71 -10.093 14.375 -8.139 574 HG13 ILE 71 3HG1 ILE 71 -8.448 13.778 -7.933 575 HG21 ILE 71 1HG2 ILE 71 -9.346 17.165 -9.330 576 HG22 ILE 71 2HG2 ILE 71 -10.582 16.106 -10.012 577 HG23 ILE 71 3HG2 ILE 71 -9.259 16.682 -11.027 578 HD11 ILE 71 3HD1 ILE 71 -9.057 15.291 -6.159 579 HD12 ILE 71 1HD1 ILE 71 -9.404 16.568 -7.323 580 HD13 ILE 71 2HD1 ILE 71 -7.752 15.970 -7.129 581 H LEU 72 H LEU 72 -6.623 13.570 -11.757 582 HA LEU 72 HA LEU 72 -6.715 15.480 -13.853 583 HB2 LEU 72 2HB LEU 72 -4.632 14.579 -12.757 584 HB3 LEU 72 3HB LEU 72 -4.883 13.056 -13.575 585 HG LEU 72 HG LEU 72 -3.089 14.633 -14.534 586 HD11 LEU 72 1HD1 LEU 72 -5.184 13.687 -16.501 587 HD12 LEU 72 2HD1 LEU 72 -3.895 12.703 -15.808 588 HD13 LEU 72 3HD1 LEU 72 -3.495 14.061 -16.857 589 HD21 LEU 72 3HD2 LEU 72 -4.356 16.739 -14.383 590 HD22 LEU 72 1HD2 LEU 72 -5.488 16.159 -15.609 591 HD23 LEU 72 2HD2 LEU 72 -3.795 16.441 -16.026 592 H HIS 73 H HIS 73 -7.320 11.955 -13.742 593 HA HIS 73 HA HIS 73 -7.983 11.849 -16.587 594 HB2 HIS 73 2HB HIS 73 -8.014 9.761 -14.377 595 HB3 HIS 73 3HB HIS 73 -8.659 9.427 -15.977 596 HD1 HIS 73 HD1 HIS 73 -7.054 8.644 -17.685 597 HD2 HIS 73 HD2 HIS 73 -5.124 10.386 -14.454 598 HE1 HIS 73 HE1 HIS 73 -4.622 8.154 -18.012 599 HE2 HIS 73 HE2 HIS 73 -3.479 9.421 -16.181 600 H ASP 74 H ASP 74 -9.827 10.982 -13.612 601 HA ASP 74 HA ASP 74 -12.159 12.466 -14.093 602 HB2 ASP 74 2HB ASP 74 -12.080 9.846 -15.554 603 HB3 ASP 74 3HB ASP 74 -13.546 10.098 -14.621 604 H PHE 75 H PHE 75 -12.085 12.735 -11.867 605 HA PHE 75 HA PHE 75 -13.595 10.835 -10.349 606 HB2 PHE 75 2HB PHE 75 -10.930 10.196 -10.267 607 HB3 PHE 75 3HB PHE 75 -10.951 11.369 -8.963 608 HD1 PHE 75 HD1 PHE 75 -13.743 10.645 -7.827 609 HD2 PHE 75 HD2 PHE 75 -10.419 8.235 -9.050 610 HE1 PHE 75 HE1 PHE 75 -14.440 8.880 -6.270 611 HE2 PHE 75 HE2 PHE 75 -11.134 6.471 -7.490 612 HZ PHE 75 HZ PHE 75 -13.143 6.792 -6.101 613 H THR 76 H THR 76 -14.723 11.959 -8.808 614 HA THR 76 HA THR 76 -14.413 14.786 -8.544 615 HB THR 76 HB THR 76 -16.233 12.882 -7.001 616 HG1 THR 76 HG1 THR 76 -16.919 12.640 -9.030 617 HG21 THR 76 3HG2 THR 76 -16.050 15.104 -5.963 618 HG22 THR 76 1HG2 THR 76 -17.653 14.863 -6.665 619 HG23 THR 76 2HG2 THR 76 -16.464 15.864 -7.500 620 HA PRO 77 HA PRO 77 -11.411 14.519 -5.082 621 HB2 PRO 77 2HB PRO 77 -11.931 17.143 -4.149 622 HB3 PRO 77 3HB PRO 77 -10.740 16.706 -5.387 623 HG2 PRO 77 2HG PRO 77 -13.537 17.718 -5.757 624 HG3 PRO 77 3HG PRO 77 -12.054 18.140 -6.647 625 HD2 PRO 77 2HD PRO 77 -13.820 16.469 -7.737 626 HD3 PRO 77 3HD PRO 77 -12.077 16.148 -7.902 627 H GLU 78 H GLU 78 -14.693 15.782 -4.781 628 HA GLU 78 HA GLU 78 -15.025 15.684 -2.001 629 HB2 GLU 78 2HB GLU 78 -17.191 15.378 -4.121 630 HB3 GLU 78 3HB GLU 78 -17.437 15.838 -2.438 631 HG2 GLU 78 2HG GLU 78 -16.034 17.887 -2.857 632 HG3 GLU 78 3HG GLU 78 -15.985 17.443 -4.563 633 H GLU 79 H GLU 79 -15.604 13.201 -4.479 634 HA GLU 79 HA GLU 79 -16.773 11.276 -2.736 635 HB2 GLU 79 2HB GLU 79 -15.465 11.019 -5.473 636 HB3 GLU 79 3HB GLU 79 -16.126 9.631 -4.617 637 HG2 GLU 79 2HG GLU 79 -17.703 12.084 -5.443 638 HG3 GLU 79 3HG GLU 79 -17.705 10.531 -6.278 639 H ILE 80 H ILE 80 -13.472 11.821 -3.886 640 HA ILE 80 HA ILE 80 -12.232 9.526 -2.865 641 HB ILE 80 HB ILE 80 -10.977 12.287 -3.231 642 HG12 ILE 80 2HG1 ILE 80 -11.123 9.985 -5.247 643 HG13 ILE 80 3HG1 ILE 80 -12.124 11.431 -5.305 644 HG21 ILE 80 1HG2 ILE 80 -9.552 10.794 -1.901 645 HG22 ILE 80 2HG2 ILE 80 -8.843 11.044 -3.494 646 HG23 ILE 80 3HG2 ILE 80 -9.679 9.536 -3.132 647 HD11 ILE 80 3HD1 ILE 80 -10.303 11.571 -6.884 648 HD12 ILE 80 1HD1 ILE 80 -9.123 11.347 -5.591 649 HD13 ILE 80 2HD1 ILE 80 -10.124 12.802 -5.635 650 H LYS 81 H LYS 81 -12.598 12.772 -1.423 651 HA LYS 81 HA LYS 81 -11.251 12.136 1.025 652 HB2 LYS 81 2HB LYS 81 -11.977 14.377 1.782 653 HB3 LYS 81 3HB LYS 81 -11.212 14.409 0.198 654 HG2 LYS 81 2HG LYS 81 -13.656 14.330 -0.724 655 HG3 LYS 81 3HG LYS 81 -14.115 14.841 0.902 656 HD2 LYS 81 2HD LYS 81 -12.142 16.319 -0.887 657 HD3 LYS 81 3HD LYS 81 -13.851 16.725 -0.747 658 HE2 LYS 81 2HE LYS 81 -11.891 16.777 1.577 659 HE3 LYS 81 3HE LYS 81 -12.356 18.187 0.623 660 HZ1 LYS 81 3HZ LYS 81 -13.639 18.044 2.652 661 HZ2 LYS 81 1HZ LYS 81 -14.206 16.510 2.224 662 HZ3 LYS 81 2HZ LYS 81 -14.645 17.857 1.307 663 H SER 82 H SER 82 -14.522 11.727 -0.059 664 HA SER 82 HA SER 82 -15.652 11.347 2.591 665 HB2 SER 82 2HB SER 82 -16.761 10.777 -0.186 666 HB3 SER 82 3HB SER 82 -17.665 10.513 1.307 667 HG SER 82 HG SER 82 -16.551 12.988 0.486 668 H PHE 83 H PHE 83 -14.000 9.378 0.227 669 HA PHE 83 HA PHE 83 -14.810 6.829 1.324 670 HB2 PHE 83 2HB PHE 83 -12.523 7.551 -0.547 671 HB3 PHE 83 3HB PHE 83 -12.919 5.900 -0.080 672 HD1 PHE 83 HD2 PHE 83 -15.971 6.118 -0.202 673 HD2 PHE 83 HD1 PHE 83 -12.912 7.433 -2.895 674 HE1 PHE 83 HE2 PHE 83 -17.546 5.960 -2.087 675 HE2 PHE 83 HE1 PHE 83 -14.495 7.266 -4.764 676 HZ PHE 83 HZ PHE 83 -16.808 6.534 -4.367 677 H PHE 84 H PHE 84 -12.813 9.222 2.528 678 HA PHE 84 HA PHE 84 -11.092 7.459 4.091 679 HB2 PHE 84 2HB PHE 84 -11.479 10.476 4.061 680 HB3 PHE 84 3HB PHE 84 -10.453 9.668 5.243 681 HD1 PHE 84 HD2 PHE 84 -8.333 8.637 4.583 682 HD2 PHE 84 HD1 PHE 84 -10.792 10.593 1.703 683 HE1 PHE 84 HE2 PHE 84 -6.464 8.668 2.997 684 HE2 PHE 84 HE1 PHE 84 -8.918 10.628 0.114 685 HZ PHE 84 HZ PHE 84 -6.747 9.663 0.764 686 H GLU 85 H GLU 85 -14.292 8.496 4.300 687 HA GLU 85 HA GLU 85 -14.415 7.973 7.222 688 HB2 GLU 85 2HB GLU 85 -16.196 9.930 5.689 689 HB3 GLU 85 3HB GLU 85 -16.154 9.668 7.431 690 HG2 GLU 85 2HG GLU 85 -13.870 10.607 7.527 691 HG3 GLU 85 3HG GLU 85 -13.898 10.855 5.782 692 H ASN 86 H ASN 86 -16.244 6.796 7.921 693 HA ASN 86 HA ASN 86 -18.519 6.345 6.247 694 HB2 ASN 86 2HB ASN 86 -16.678 4.560 5.528 695 HB3 ASN 86 3HB ASN 86 -17.129 3.746 7.020 696 HD21 ASN 86 1HD2 ASN 86 -18.044 4.470 3.786 697 HD22 ASN 86 2HD2 ASN 86 -19.518 3.567 3.765 698 H LYS 87 H LYS 87 -20.250 5.276 7.442 699 HA LYS 87 HA LYS 87 -20.044 5.893 10.308 700 HB2 LYS 87 2HB LYS 87 -22.527 5.477 8.600 701 HB3 LYS 87 3HB LYS 87 -22.503 6.029 10.275 702 HG2 LYS 87 2HG LYS 87 -21.231 8.065 9.531 703 HG3 LYS 87 3HG LYS 87 -21.409 7.513 7.863 704 HD2 LYS 87 2HD LYS 87 -23.111 9.179 8.307 705 HD3 LYS 87 3HD LYS 87 -23.900 7.609 8.140 706 HE2 LYS 87 2HE LYS 87 -24.859 8.888 10.008 707 HE3 LYS 87 3HE LYS 87 -24.058 7.434 10.605 708 HZ1 LYS 87 3HZ LYS 87 -22.141 8.794 11.199 709 HZ2 LYS 87 1HZ LYS 87 -23.538 9.355 11.967 710 HZ3 LYS 87 2HZ LYS 87 -22.919 10.180 10.630 711 H GLY 88 H GLY 88 -20.369 3.172 8.191 712 HA2 GLY 88 2HA GLY 88 -20.918 1.370 10.484 713 HA3 GLY 88 3HA GLY 88 -21.919 1.266 9.042 714 H LYS 89 H LYS 89 -20.283 1.383 6.971 715 HA LYS 89 HA LYS 89 -18.750 -1.077 7.053 716 HB2 LYS 89 2HB LYS 89 -19.317 0.917 4.804 717 HB3 LYS 89 3HB LYS 89 -18.266 -0.479 4.596 718 HG2 LYS 89 2HG LYS 89 -20.390 -1.083 3.701 719 HG3 LYS 89 3HG LYS 89 -20.209 -1.959 5.222 720 HD2 LYS 89 2HD LYS 89 -22.485 -1.110 5.035 721 HD3 LYS 89 3HD LYS 89 -21.659 -0.259 6.340 722 HE2 LYS 89 2HE LYS 89 -21.320 1.690 4.882 723 HE3 LYS 89 3HE LYS 89 -22.049 0.825 3.526 724 HZ1 LYS 89 3HZ LYS 89 -23.600 2.357 4.583 725 HZ2 LYS 89 1HZ LYS 89 -23.453 1.531 6.048 726 HZ3 LYS 89 2HZ LYS 89 -24.140 0.762 4.710 727 H ARG 90 H ARG 90 -16.639 -0.640 5.425 728 HA ARG 90 HA ARG 90 -14.812 0.859 7.143 729 HB2 ARG 90 2HB ARG 90 -14.349 -1.524 6.651 730 HB3 ARG 90 3HB ARG 90 -14.281 -1.160 4.929 731 HG2 ARG 90 2HG ARG 90 -12.291 0.241 5.286 732 HG3 ARG 90 3HG ARG 90 -12.382 -0.052 7.026 733 HD2 ARG 90 2HD ARG 90 -11.907 -2.131 4.879 734 HD3 ARG 90 3HD ARG 90 -10.696 -1.481 5.990 735 HE ARG 90 HE ARG 90 -12.682 -2.503 7.607 736 HH11 ARG 90 1HH1 ARG 90 -10.557 -3.799 5.138 737 HH12 ARG 90 2HH1 ARG 90 -10.524 -5.392 5.830 738 HH21 ARG 90 1HH2 ARG 90 -12.636 -4.583 8.519 739 HH22 ARG 90 2HH2 ARG 90 -11.714 -5.840 7.760 740 HA PRO 91 HA PRO 91 -14.166 4.089 3.941 741 HB2 PRO 91 2HB PRO 91 -11.618 4.842 4.822 742 HB3 PRO 91 3HB PRO 91 -13.133 5.459 5.508 743 HG2 PRO 91 2HG PRO 91 -11.386 3.238 6.521 744 HG3 PRO 91 3HG PRO 91 -12.170 4.556 7.424 745 HD2 PRO 91 2HD PRO 91 -13.240 2.107 7.424 746 HD3 PRO 91 3HD PRO 91 -14.289 3.544 7.336 747 H VAL 92 H VAL 92 -13.322 3.880 1.929 748 HA VAL 92 HA VAL 92 -11.881 1.543 1.117 749 HB VAL 92 HB VAL 92 -12.497 4.057 -0.514 750 HG11 VAL 92 1HG1 VAL 92 -12.202 2.610 -2.509 751 HG12 VAL 92 2HG1 VAL 92 -11.723 1.269 -1.465 752 HG13 VAL 92 3HG1 VAL 92 -10.719 2.717 -1.557 753 HG21 VAL 92 3HG2 VAL 92 -14.564 3.047 0.376 754 HG22 VAL 92 1HG2 VAL 92 -14.106 1.480 -0.298 755 HG23 VAL 92 2HG2 VAL 92 -14.469 2.833 -1.373 756 H PHE 93 H PHE 93 -11.103 5.013 1.170 757 HA PHE 93 HA PHE 93 -8.209 4.456 0.987 758 HB2 PHE 93 2HB PHE 93 -9.670 7.134 0.848 759 HB3 PHE 93 3HB PHE 93 -7.961 6.861 0.527 760 HD1 PHE 93 HD1 PHE 93 -8.082 4.439 -1.244 761 HD2 PHE 93 HD2 PHE 93 -10.495 7.970 -1.198 762 HE1 PHE 93 HE1 PHE 93 -8.552 4.157 -3.643 763 HE2 PHE 93 HE2 PHE 93 -10.960 7.675 -3.594 764 HZ PHE 93 HZ PHE 93 -9.992 5.773 -4.821 765 H VAL 94 H VAL 94 -7.045 4.536 2.849 766 HA VAL 94 HA VAL 94 -8.258 5.748 5.283 767 HB VAL 94 HB VAL 94 -6.519 3.230 5.133 768 HG11 VAL 94 1HG1 VAL 94 -7.057 2.949 7.525 769 HG12 VAL 94 2HG1 VAL 94 -7.927 4.484 7.514 770 HG13 VAL 94 3HG1 VAL 94 -6.186 4.456 7.232 771 HG21 VAL 94 3HG2 VAL 94 -9.510 3.464 5.659 772 HG22 VAL 94 1HG2 VAL 94 -8.563 1.977 5.775 773 HG23 VAL 94 2HG2 VAL 94 -8.757 2.781 4.217 774 H LYS 95 H LYS 95 -6.799 6.767 6.747 775 HA LYS 95 HA LYS 95 -3.973 7.038 6.019 776 HB2 LYS 95 2HB LYS 95 -4.033 9.502 6.146 777 HB3 LYS 95 3HB LYS 95 -5.042 8.901 4.836 778 HG2 LYS 95 2HG LYS 95 -7.064 9.264 6.188 779 HG3 LYS 95 3HG LYS 95 -6.079 9.831 7.540 780 HD2 LYS 95 2HD LYS 95 -6.192 11.165 4.801 781 HD3 LYS 95 3HD LYS 95 -7.123 11.685 6.205 782 HE2 LYS 95 2HE LYS 95 -5.049 12.200 7.419 783 HE3 LYS 95 3HE LYS 95 -4.089 11.615 6.055 784 HZ1 LYS 95 3HZ LYS 95 -4.328 14.050 6.121 785 HZ2 LYS 95 1HZ LYS 95 -5.995 13.893 5.906 786 HZ3 LYS 95 2HZ LYS 95 -4.930 13.377 4.694 787 H GLY 96 H GLY 96 -2.740 8.240 7.686 788 HA2 GLY 96 2HA GLY 96 -3.092 9.295 10.009 789 HA3 GLY 96 3HA GLY 96 -3.710 7.699 10.430 790 H SER 97 H SER 97 -2.069 7.310 11.944 791 HA SER 97 HA SER 97 0.721 7.147 11.184 792 HB2 SER 97 2HB SER 97 0.062 7.585 13.532 793 HB3 SER 97 3HB SER 97 -0.771 6.033 13.606 794 HG SER 97 HG SER 97 1.633 6.416 14.327 795 H LEU 98 H LEU 98 1.794 4.833 11.711 796 HA LEU 98 HA LEU 98 1.032 3.033 9.682 797 HB2 LEU 98 2HB LEU 98 3.331 3.150 10.598 798 HB3 LEU 98 3HB LEU 98 2.760 2.524 12.136 799 HG LEU 98 HG LEU 98 2.142 0.365 10.996 800 HD11 LEU 98 1HD1 LEU 98 2.978 -0.124 8.743 801 HD12 LEU 98 2HD1 LEU 98 3.511 1.550 8.565 802 HD13 LEU 98 3HD1 LEU 98 1.792 1.180 8.723 803 HD21 LEU 98 3HD2 LEU 98 5.057 1.151 10.708 804 HD22 LEU 98 1HD2 LEU 98 4.426 -0.499 10.750 805 HD23 LEU 98 2HD2 LEU 98 4.278 0.537 12.168 806 H GLU 99 H GLU 99 0.569 2.877 13.212 807 HA GLU 99 HA GLU 99 -0.925 0.438 13.228 808 HB2 GLU 99 2HB GLU 99 -0.651 2.614 15.340 809 HB3 GLU 99 3HB GLU 99 -1.461 1.071 15.605 810 HG2 GLU 99 2HG GLU 99 0.672 -0.105 15.114 811 HG3 GLU 99 3HG GLU 99 1.469 1.458 14.940 812 H SER 100 H SER 100 -1.820 3.881 13.340 813 HA SER 100 HA SER 100 -4.556 3.608 13.937 814 HB2 SER 100 2HB SER 100 -3.171 5.835 12.356 815 HB3 SER 100 3HB SER 100 -4.741 5.955 13.151 816 HG SER 100 HG SER 100 -3.395 5.262 15.096 817 H ALA 101 H ALA 101 -2.933 4.058 10.794 818 HA ALA 101 HA ALA 101 -5.240 3.931 9.165 819 HB1 ALA 101 3HB ALA 101 -3.665 3.731 7.281 820 HB2 ALA 101 1HB ALA 101 -2.341 3.409 8.411 821 HB3 ALA 101 2HB ALA 101 -3.143 4.980 8.414 822 H ALA 102 H ALA 102 -3.204 1.470 10.581 823 HA ALA 102 HA ALA 102 -3.959 -0.758 8.981 824 HB1 ALA 102 3HB ALA 102 -3.026 -2.103 10.809 825 HB2 ALA 102 1HB ALA 102 -2.997 -0.685 11.863 826 HB3 ALA 102 2HB ALA 102 -1.965 -0.745 10.435 827 H GLU 103 H GLU 103 -5.149 0.550 12.069 828 HA GLU 103 HA GLU 103 -7.063 -1.467 12.647 829 HB2 GLU 103 2HB GLU 103 -7.006 1.428 13.618 830 HB3 GLU 103 3HB GLU 103 -7.921 0.109 14.350 831 HG2 GLU 103 2HG GLU 103 -5.789 -1.043 14.871 832 HG3 GLU 103 3HG GLU 103 -4.906 0.302 14.182 833 H GLN 104 H GLN 104 -7.326 1.701 11.083 834 HA GLN 104 HA GLN 104 -10.179 1.600 10.727 835 HB2 GLN 104 2HB GLN 104 -8.145 3.380 9.336 836 HB3 GLN 104 3HB GLN 104 -9.881 3.662 9.433 837 HG2 GLN 104 2HG GLN 104 -9.739 4.043 11.826 838 HG3 GLN 104 3HG GLN 104 -8.035 3.585 11.840 839 HE21 GLN 104 1HE2 GLN 104 -6.521 4.996 10.816 840 HE22 GLN 104 2HE2 GLN 104 -6.857 6.678 10.617 841 H ALA 105 H ALA 105 -7.408 0.542 8.830 842 HA ALA 105 HA ALA 105 -9.034 -0.126 6.482 843 HB1 ALA 105 3HB ALA 105 -6.097 -0.686 7.026 844 HB2 ALA 105 1HB ALA 105 -6.741 0.693 6.131 845 HB3 ALA 105 2HB ALA 105 -6.939 -0.940 5.492 846 H GLY 106 H GLY 106 -8.307 -1.573 9.473 847 HA2 GLY 106 2HA GLY 106 -9.139 -3.520 10.374 848 HA3 GLY 106 3HA GLY 106 -9.912 -3.862 8.838 849 H ILE 107 H ILE 107 -6.511 -3.298 8.872 850 HA ILE 107 HA ILE 107 -5.891 -6.094 8.245 851 HB ILE 107 HB ILE 107 -3.872 -3.815 8.396 852 HG12 ILE 107 2HG1 ILE 107 -5.482 -4.486 5.893 853 HG13 ILE 107 3HG1 ILE 107 -5.775 -3.078 6.913 854 HG21 ILE 107 1HG2 ILE 107 -2.635 -5.138 6.730 855 HG22 ILE 107 2HG2 ILE 107 -3.930 -6.335 6.698 856 HG23 ILE 107 3HG2 ILE 107 -2.979 -6.105 8.167 857 HD11 ILE 107 3HD1 ILE 107 -3.516 -2.259 6.432 858 HD12 ILE 107 1HD1 ILE 107 -4.476 -2.481 4.972 859 HD13 ILE 107 2HD1 ILE 107 -3.235 -3.659 5.389 860 H VAL 108 H VAL 108 -4.496 -7.372 9.598 861 HA VAL 108 HA VAL 108 -4.529 -6.817 12.385 862 HB VAL 108 HB VAL 108 -2.748 -8.840 10.956 863 HG11 VAL 108 1HG1 VAL 108 -3.590 -8.685 13.879 864 HG12 VAL 108 2HG1 VAL 108 -1.970 -8.381 13.240 865 HG13 VAL 108 3HG1 VAL 108 -2.664 -10.000 13.146 866 HG21 VAL 108 3HG2 VAL 108 -4.503 -10.508 11.481 867 HG22 VAL 108 1HG2 VAL 108 -5.109 -9.240 10.411 868 HG23 VAL 108 2HG2 VAL 108 -5.532 -9.226 12.126 869 H VAL 109 H VAL 109 -3.435 -5.305 13.315 870 HA VAL 109 HA VAL 109 -1.558 -3.626 12.190 871 HB VAL 109 HB VAL 109 -2.059 -4.100 15.160 872 HG11 VAL 109 1HG1 VAL 109 0.028 -2.837 14.835 873 HG12 VAL 109 2HG1 VAL 109 -1.221 -1.801 15.527 874 HG13 VAL 109 3HG1 VAL 109 -0.820 -1.672 13.813 875 HG21 VAL 109 3HG2 VAL 109 -3.680 -2.249 15.021 876 HG22 VAL 109 1HG2 VAL 109 -4.125 -3.555 13.918 877 HG23 VAL 109 2HG2 VAL 109 -3.366 -2.091 13.292 878 H ASP 110 H ASP 110 -1.006 -6.261 14.523 879 HA ASP 110 HA ASP 110 1.741 -5.809 14.958 880 HB2 ASP 110 2HB ASP 110 0.216 -7.114 16.480 881 HB3 ASP 110 3HB ASP 110 0.213 -8.432 15.315 882 H GLU 111 H GLU 111 0.050 -7.800 12.564 883 HA GLU 111 HA GLU 111 2.346 -9.225 11.651 884 HB2 GLU 111 2HB GLU 111 -0.326 -8.770 10.279 885 HB3 GLU 111 3HB GLU 111 0.921 -9.856 9.681 886 HG2 GLU 111 2HG GLU 111 -0.574 -10.120 12.299 887 HG3 GLU 111 3HG GLU 111 -0.840 -11.086 10.850 888 H LEU 112 H LEU 112 0.641 -6.274 10.440 889 HA LEU 112 HA LEU 112 2.521 -5.994 8.268 890 HB2 LEU 112 2HB LEU 112 1.478 -3.838 7.763 891 HB3 LEU 112 3HB LEU 112 0.323 -5.143 7.904 892 HG LEU 112 HG LEU 112 -0.174 -4.225 10.285 893 HD11 LEU 112 1HD1 LEU 112 1.171 -1.737 9.172 894 HD12 LEU 112 2HD1 LEU 112 1.711 -2.686 10.555 895 HD13 LEU 112 3HD1 LEU 112 0.186 -1.814 10.638 896 HD21 LEU 112 3HD2 LEU 112 -0.956 -2.537 7.902 897 HD22 LEU 112 1HD2 LEU 112 -1.821 -2.696 9.428 898 HD23 LEU 112 2HD2 LEU 112 -1.689 -4.075 8.354 899 H VAL 113 H VAL 113 2.428 -4.772 11.569 900 HA VAL 113 HA VAL 113 4.452 -2.817 11.387 901 HB VAL 113 HB VAL 113 3.650 -4.625 13.723 902 HG11 VAL 113 1HG1 VAL 113 5.732 -2.396 13.805 903 HG12 VAL 113 2HG1 VAL 113 6.037 -4.116 14.055 904 HG13 VAL 113 3HG1 VAL 113 5.063 -3.218 15.220 905 HG21 VAL 113 3HG2 VAL 113 3.267 -1.638 13.249 906 HG22 VAL 113 1HG2 VAL 113 2.715 -2.529 14.672 907 HG23 VAL 113 2HG2 VAL 113 2.025 -2.877 13.087 908 H GLN 114 H GLN 114 4.564 -6.331 11.730 909 HA GLN 114 HA GLN 114 7.372 -6.651 11.798 910 HB2 GLN 114 2HB GLN 114 5.150 -8.507 10.877 911 HB3 GLN 114 3HB GLN 114 6.838 -8.998 10.881 912 HG2 GLN 114 2HG GLN 114 5.257 -8.137 13.323 913 HG3 GLN 114 3HG GLN 114 5.625 -9.801 12.872 914 HE21 GLN 114 1HE2 GLN 114 6.897 -6.858 14.232 915 HE22 GLN 114 2HE2 GLN 114 8.408 -7.511 14.753 916 H THR 115 H THR 115 5.080 -6.814 8.994 917 HA THR 115 HA THR 115 7.125 -7.389 7.122 918 HB THR 115 HB THR 115 4.538 -7.767 6.878 919 HG1 THR 115 HG1 THR 115 6.377 -8.114 5.290 920 HG21 THR 115 3HG2 THR 115 4.777 -5.071 5.483 921 HG22 THR 115 1HG2 THR 115 3.858 -5.366 6.963 922 HG23 THR 115 2HG2 THR 115 3.379 -6.148 5.454 923 H VAL 116 H VAL 116 5.992 -4.340 8.378 924 HA VAL 116 HA VAL 116 7.125 -2.701 6.262 925 HB VAL 116 HB VAL 116 5.719 -1.985 8.876 926 HG11 VAL 116 1HG1 VAL 116 7.397 -0.227 8.490 927 HG12 VAL 116 2HG1 VAL 116 5.777 0.398 8.182 928 HG13 VAL 116 3HG1 VAL 116 6.832 -0.022 6.830 929 HG21 VAL 116 3HG2 VAL 116 3.942 -1.124 7.378 930 HG22 VAL 116 1HG2 VAL 116 4.264 -2.832 7.069 931 HG23 VAL 116 2HG2 VAL 116 4.890 -1.602 5.969 932 H LYS 117 H LYS 117 7.938 -3.497 9.685 933 HA LYS 117 HA LYS 117 10.260 -1.812 9.742 934 HB2 LYS 117 2HB LYS 117 10.820 -2.819 11.856 935 HB3 LYS 117 3HB LYS 117 9.073 -2.623 11.819 936 HG2 LYS 117 2HG LYS 117 8.848 -5.045 11.250 937 HG3 LYS 117 3HG LYS 117 10.596 -5.222 11.393 938 HD2 LYS 117 2HD LYS 117 8.735 -4.343 13.638 939 HD3 LYS 117 3HD LYS 117 9.373 -5.974 13.431 940 HE2 LYS 117 2HE LYS 117 11.660 -5.152 13.766 941 HE3 LYS 117 3HE LYS 117 11.068 -3.493 13.891 942 HZ1 LYS 117 3HZ LYS 117 10.436 -5.719 15.758 943 HZ2 LYS 117 1HZ LYS 117 9.801 -4.156 15.859 944 HZ3 LYS 117 2HZ LYS 117 11.459 -4.412 16.071 945 H ASN 118 H ASN 118 9.659 -5.161 8.851 946 HA ASN 118 HA ASN 118 12.407 -5.922 8.520 947 HB2 ASN 118 2HB ASN 118 9.839 -7.233 7.518 948 HB3 ASN 118 3HB ASN 118 11.444 -7.932 7.302 949 HD21 ASN 118 1HD2 ASN 118 9.133 -8.971 8.767 950 HD22 ASN 118 2HD2 ASN 118 9.662 -9.223 10.393 951 H TYR 119 H TYR 119 9.818 -4.733 6.383 952 HA TYR 119 HA TYR 119 11.130 -4.777 3.922 953 HB2 TYR 119 2HB TYR 119 8.765 -4.161 4.022 954 HB3 TYR 119 3HB TYR 119 9.125 -2.745 5.003 955 HD1 TYR 119 HD1 TYR 119 10.025 -4.188 1.634 956 HD2 TYR 119 HD2 TYR 119 9.175 -0.658 3.891 957 HE1 TYR 119 HE1 TYR 119 10.203 -2.843 -0.409 958 HE2 TYR 119 HE2 TYR 119 9.356 0.687 1.841 959 HH TYR 119 HH TYR 119 10.255 0.605 -0.352 960 H GLN 120 H GLN 120 10.856 -1.952 6.108 961 HA GLN 120 HA GLN 120 12.706 -0.314 4.795 962 HB2 GLN 120 2HB GLN 120 11.881 -0.240 7.730 963 HB3 GLN 120 3HB GLN 120 12.694 1.064 6.867 964 HG2 GLN 120 2HG GLN 120 10.715 1.205 5.330 965 HG3 GLN 120 3HG GLN 120 9.898 0.015 6.337 966 HE21 GLN 120 1HE2 GLN 120 9.155 2.770 5.770 967 HE22 GLN 120 2HE2 GLN 120 9.072 3.596 7.267 968 H GLY 121 H GLY 121 13.177 -2.847 7.139 969 HA2 GLY 121 2HA GLY 121 15.795 -2.191 8.041 970 HA3 GLY 121 3HA GLY 121 15.017 -3.767 8.133 971 H TYR 122 H TYR 122 14.576 -4.475 5.566 972 HA TYR 122 HA TYR 122 17.235 -5.191 4.762 973 HB2 TYR 122 2HB TYR 122 16.244 -6.727 3.223 974 HB3 TYR 122 3HB TYR 122 15.385 -6.826 4.736 975 HD1 TYR 122 HD1 TYR 122 14.846 -4.634 1.666 976 HD2 TYR 122 HD2 TYR 122 13.222 -7.585 4.283 977 HE1 TYR 122 HE1 TYR 122 12.787 -4.653 0.365 978 HE2 TYR 122 HE2 TYR 122 11.145 -7.589 2.966 979 HH TYR 122 HH TYR 122 9.964 -6.428 1.358 980 H VAL 123 H VAL 123 15.038 -2.708 3.835 981 HA VAL 123 HA VAL 123 15.924 -2.081 1.225 982 HB VAL 123 HB VAL 123 14.755 -0.282 3.408 983 HG11 VAL 123 1HG1 VAL 123 16.074 1.162 1.938 984 HG12 VAL 123 2HG1 VAL 123 14.358 1.427 1.629 985 HG13 VAL 123 3HG1 VAL 123 15.317 0.457 0.508 986 HG21 VAL 123 3HG2 VAL 123 12.679 -0.379 2.084 987 HG22 VAL 123 1HG2 VAL 123 13.214 -2.002 2.512 988 HG23 VAL 123 2HG2 VAL 123 13.473 -1.397 0.885 989 H GLN 124 H GLN 124 16.962 -0.822 4.407 990 HA GLN 124 HA GLN 124 19.138 0.714 3.310 991 HB2 GLN 124 2HB GLN 124 19.733 1.155 5.702 992 HB3 GLN 124 3HB GLN 124 18.075 1.570 5.285 993 HG2 GLN 124 2HG GLN 124 17.302 -0.551 6.332 994 HG3 GLN 124 3HG GLN 124 18.970 -0.902 6.796 995 HE21 GLN 124 1HE2 GLN 124 18.403 -0.919 9.005 996 HE22 GLN 124 2HE2 GLN 124 18.054 0.530 9.878 997 H ASP 125 H ASP 125 18.774 -2.570 4.322 998 HA ASP 125 HA ASP 125 21.634 -3.120 4.452 999 HB2 ASP 125 2HB ASP 125 19.194 -4.933 4.412 1000 HB3 ASP 125 3HB ASP 125 20.837 -5.565 4.428 1001 H GLY 126 H GLY 126 19.228 -2.841 1.997 1002 HA2 GLY 126 2HA GLY 126 19.502 -2.672 -0.265 1003 HA3 GLY 126 3HA GLY 126 21.209 -3.020 -0.067 1004 H HIS 127 H HIS 127 18.594 -5.145 1.014 1005 HA HIS 127 HA HIS 127 18.733 -6.848 -1.352 1006 HB2 HIS 127 2HB HIS 127 20.620 -7.757 -0.127 1007 HB3 HIS 127 3HB HIS 127 19.721 -7.769 1.384 1008 HD1 HIS 127 HD1 HIS 127 19.885 -9.588 -1.936 1009 HD2 HIS 127 HD2 HIS 127 18.285 -10.100 1.866 1010 HE1 HIS 127 HE1 HIS 127 19.099 -11.967 -1.846 1011 HE2 HIS 127 HE2 HIS 127 18.133 -12.257 0.457 1012 H ASP 128 H ASP 128 16.687 -7.505 -1.763 1013 HA ASP 128 HA ASP 128 14.579 -7.118 0.159 1014 HB2 ASP 128 2HB ASP 128 13.055 -7.764 -1.619 1015 HB3 ASP 128 3HB ASP 128 14.267 -6.675 -2.276 1016 H HIS 129 H HIS 129 13.339 -8.669 1.203 1017 HA HIS 129 HA HIS 129 14.551 -11.365 1.481 1018 HB2 HIS 129 2HB HIS 129 12.991 -9.648 3.440 1019 HB3 HIS 129 3HB HIS 129 13.236 -11.365 3.715 1020 HD1 HIS 129 HD1 HIS 129 14.448 -10.652 5.911 1021 HD2 HIS 129 HD2 HIS 129 16.368 -9.478 2.416 1022 HE1 HIS 129 HE1 HIS 129 16.776 -10.024 6.595 1023 HE2 HIS 129 HE2 HIS 129 17.910 -9.324 4.474 1024 H ASP 130 H ASP 130 11.346 -9.735 1.639 1025 HA ASP 130 HA ASP 130 10.035 -12.333 1.206 1026 HB2 ASP 130 2HB ASP 130 7.940 -11.050 1.904 1027 HB3 ASP 130 3HB ASP 130 9.170 -11.256 3.138 1028 H PHE 131 H PHE 131 11.105 -11.969 -0.989 1029 HA PHE 131 HA PHE 131 11.200 -11.343 -3.148 1030 HB2 PHE 131 2HB PHE 131 9.165 -12.021 -4.500 1031 HB3 PHE 131 3HB PHE 131 9.845 -13.251 -3.461 1032 HD1 PHE 131 HD1 PHE 131 8.603 -14.039 -1.467 1033 HD2 PHE 131 HD2 PHE 131 6.873 -11.183 -4.143 1034 HE1 PHE 131 HE1 PHE 131 6.378 -14.492 -0.527 1035 HE2 PHE 131 HE2 PHE 131 4.652 -11.645 -3.185 1036 HZ PHE 131 HZ PHE 131 4.402 -13.292 -1.375 1037 H GLY 132 H GLY 132 11.470 -9.127 -2.247 1038 HA2 GLY 132 2HA GLY 132 9.458 -7.182 -3.144 1039 HA3 GLY 132 3HA GLY 132 10.953 -6.842 -2.276 1040 H ARG 133 H ARG 133 11.674 -5.275 -3.709 1041 HA ARG 133 HA ARG 133 12.395 -6.157 -6.453 1042 HB2 ARG 133 2HB ARG 133 12.296 -3.630 -7.019 1043 HB3 ARG 133 3HB ARG 133 10.772 -4.482 -6.853 1044 HG2 ARG 133 2HG ARG 133 11.882 -2.985 -4.477 1045 HG3 ARG 133 3HG ARG 133 11.097 -2.091 -5.773 1046 HD2 ARG 133 2HD ARG 133 9.024 -3.353 -5.444 1047 HD3 ARG 133 3HD ARG 133 9.800 -4.367 -4.228 1048 HE ARG 133 HE ARG 133 10.004 -2.312 -2.846 1049 HH11 ARG 133 1HH1 ARG 133 7.525 -2.354 -5.357 1050 HH12 ARG 133 2HH1 ARG 133 6.528 -1.196 -4.530 1051 HH21 ARG 133 1HH2 ARG 133 8.637 -0.862 -1.779 1052 HH22 ARG 133 2HH2 ARG 133 7.156 -0.363 -2.522 1053 H ASP 134 H ASP 134 14.116 -4.315 -7.244 1054 HA ASP 134 HA ASP 134 16.554 -5.015 -5.997 1055 HB2 ASP 134 2HB ASP 134 16.212 -4.399 -8.443 1056 HB3 ASP 134 3HB ASP 134 16.059 -2.721 -7.957 1057 HA PRO 135 HA PRO 135 17.204 -2.086 -2.552 1058 HB2 PRO 135 2HB PRO 135 19.835 -1.318 -3.554 1059 HB3 PRO 135 3HB PRO 135 19.442 -2.428 -2.234 1060 HG2 PRO 135 2HG PRO 135 20.007 -3.034 -5.094 1061 HG3 PRO 135 3HG PRO 135 20.329 -4.018 -3.643 1062 HD2 PRO 135 2HD PRO 135 18.360 -4.716 -5.267 1063 HD3 PRO 135 3HD PRO 135 18.084 -4.775 -3.505 1064 H LYS 136 H LYS 136 17.733 -0.969 -5.900 1065 HA LYS 136 HA LYS 136 17.852 1.824 -5.194 1066 HB2 LYS 136 2HB LYS 136 17.872 2.273 -7.595 1067 HB3 LYS 136 3HB LYS 136 18.966 0.942 -7.224 1068 HG2 LYS 136 2HG LYS 136 17.204 -0.649 -8.008 1069 HG3 LYS 136 3HG LYS 136 16.204 0.733 -8.457 1070 HD2 LYS 136 2HD LYS 136 17.308 -0.110 -10.446 1071 HD3 LYS 136 3HD LYS 136 17.996 1.465 -10.049 1072 HE2 LYS 136 2HE LYS 136 19.960 0.370 -9.057 1073 HE3 LYS 136 3HE LYS 136 19.246 -1.217 -9.370 1074 HZ1 LYS 136 3HZ LYS 136 19.400 -0.829 -11.713 1075 HZ2 LYS 136 1HZ LYS 136 20.917 -0.551 -11.025 1076 HZ3 LYS 136 2HZ LYS 136 19.946 0.755 -11.481 1077 H TYR 137 H TYR 137 15.263 -0.363 -6.285 1078 HA TYR 137 HA TYR 137 13.251 1.754 -6.408 1079 HB2 TYR 137 2HB TYR 137 12.883 -1.274 -6.602 1080 HB3 TYR 137 3HB TYR 137 11.652 -0.061 -6.949 1081 HD1 TYR 137 HD2 TYR 137 11.937 1.458 -8.950 1082 HD2 TYR 137 HD1 TYR 137 14.511 -1.877 -8.261 1083 HE1 TYR 137 HE2 TYR 137 12.709 1.564 -11.278 1084 HE2 TYR 137 HE1 TYR 137 15.292 -1.760 -10.581 1085 HH TYR 137 HH TYR 137 14.694 0.878 -12.596 1086 H LEU 138 H LEU 138 14.391 -0.660 -4.175 1087 HA LEU 138 HA LEU 138 12.326 -0.668 -2.262 1088 HB2 LEU 138 2HB LEU 138 15.327 -1.095 -1.995 1089 HB3 LEU 138 3HB LEU 138 14.226 -1.295 -0.650 1090 HG LEU 138 HG LEU 138 14.261 -2.960 -3.192 1091 HD11 LEU 138 1HD1 LEU 138 16.134 -3.466 -1.702 1092 HD12 LEU 138 2HD1 LEU 138 14.981 -4.798 -1.736 1093 HD13 LEU 138 3HD1 LEU 138 15.023 -3.708 -0.347 1094 HD21 LEU 138 3HD2 LEU 138 11.958 -2.707 -2.400 1095 HD22 LEU 138 1HD2 LEU 138 12.432 -3.230 -0.781 1096 HD23 LEU 138 2HD2 LEU 138 12.530 -4.352 -2.142 1097 H HIS 139 H HIS 139 11.522 1.262 -1.648 1098 HA HIS 139 HA HIS 139 13.344 3.304 -0.484 1099 HB2 HIS 139 2HB HIS 139 10.663 3.749 -1.892 1100 HB3 HIS 139 3HB HIS 139 11.621 5.007 -1.115 1101 HD1 HIS 139 HD1 HIS 139 10.825 4.186 -4.333 1102 HD2 HIS 139 HD2 HIS 139 14.512 4.602 -2.460 1103 HE1 HIS 139 HE1 HIS 139 12.466 4.661 -6.171 1104 HE2 HIS 139 HE2 HIS 139 14.707 4.712 -5.028 1105 H GLN 140 H GLN 140 13.094 3.455 1.685 1106 HA GLN 140 HA GLN 140 11.011 2.247 3.198 1107 HB2 GLN 140 2HB GLN 140 12.711 4.597 4.146 1108 HB3 GLN 140 3HB GLN 140 11.933 3.371 5.132 1109 HG2 GLN 140 2HG GLN 140 13.479 1.671 4.318 1110 HG3 GLN 140 3HG GLN 140 14.229 2.840 3.233 1111 HE21 GLN 140 1HE2 GLN 140 15.492 1.282 5.324 1112 HE22 GLN 140 2HE2 GLN 140 16.202 2.410 6.419 1113 H PHE 141 H PHE 141 9.182 3.239 4.207 1114 HA PHE 141 HA PHE 141 7.883 5.400 2.950 1115 HB2 PHE 141 2HB PHE 141 7.369 4.343 5.766 1116 HB3 PHE 141 3HB PHE 141 6.257 5.308 4.796 1117 HD1 PHE 141 HD1 PHE 141 5.443 4.298 2.559 1118 HD2 PHE 141 HD2 PHE 141 7.305 1.985 5.644 1119 HE1 PHE 141 HE1 PHE 141 4.492 2.242 1.606 1120 HE2 PHE 141 HE2 PHE 141 6.348 -0.056 4.686 1121 HZ PHE 141 HZ PHE 141 4.951 0.073 2.664 1122 H GLU 142 H GLU 142 9.335 7.065 2.860 1123 HA GLU 142 HA GLU 142 10.047 8.476 5.355 1124 HB2 GLU 142 2HB GLU 142 11.662 9.723 3.893 1125 HB3 GLU 142 3HB GLU 142 11.998 8.006 4.003 1126 HG2 GLU 142 2HG GLU 142 11.814 7.713 1.766 1127 HG3 GLU 142 3HG GLU 142 10.301 8.609 1.685 1128 H GLY 143 H GLY 143 9.174 10.411 5.745 1129 HA2 GLY 143 2HA GLY 143 8.088 12.439 4.487 1130 HA3 GLY 143 3HA GLY 143 6.886 11.210 4.071 1131 H GLU 144 H GLU 144 5.128 11.440 5.386 1132 HA GLU 144 HA GLU 144 5.543 11.674 8.297 1133 HB2 GLU 144 2HB GLU 144 3.786 13.551 6.660 1134 HB3 GLU 144 3HB GLU 144 3.720 13.432 8.416 1135 HG2 GLU 144 2HG GLU 144 6.056 14.206 8.571 1136 HG3 GLU 144 3HG GLU 144 6.156 14.282 6.814 1137 H THR 145 H THR 145 2.651 11.820 6.155 1138 HA THR 145 HA THR 145 1.235 10.096 8.030 1139 HB THR 145 HB THR 145 0.113 11.410 5.514 1140 HG1 THR 145 HG1 THR 145 0.095 13.253 6.535 1141 HG21 THR 145 3HG2 THR 145 -1.346 9.686 6.557 1142 HG22 THR 145 1HG2 THR 145 -2.040 11.305 6.708 1143 HG23 THR 145 2HG2 THR 145 -1.250 10.549 8.093 1144 H PHE 146 H PHE 146 0.587 8.039 7.644 1145 HA PHE 146 HA PHE 146 1.363 6.606 5.215 1146 HB2 PHE 146 2HB PHE 146 0.274 5.776 7.933 1147 HB3 PHE 146 3HB PHE 146 0.211 4.646 6.586 1148 HD1 PHE 146 HD2 PHE 146 2.525 6.562 8.799 1149 HD2 PHE 146 HD1 PHE 146 2.155 3.480 5.850 1150 HE1 PHE 146 HE2 PHE 146 4.837 5.833 9.253 1151 HE2 PHE 146 HE1 PHE 146 4.452 2.764 6.310 1152 HZ PHE 146 HZ PHE 146 5.798 3.929 8.001 1153 H TYR 147 H TYR 147 -0.052 5.988 3.654 1154 HA TYR 147 HA TYR 147 -2.974 6.207 4.102 1155 HB2 TYR 147 2HB TYR 147 -1.353 6.980 1.638 1156 HB3 TYR 147 3HB TYR 147 -3.069 6.613 1.526 1157 HD1 TYR 147 HD1 TYR 147 -0.708 8.841 3.434 1158 HD2 TYR 147 HD2 TYR 147 -4.607 8.376 1.764 1159 HE1 TYR 147 HE1 TYR 147 -1.242 11.158 4.017 1160 HE2 TYR 147 HE2 TYR 147 -5.129 10.702 2.352 1161 HH TYR 147 HH TYR 147 -2.724 12.920 3.392 1162 H ILE 148 H ILE 148 -3.846 4.250 4.113 1163 HA ILE 148 HA ILE 148 -2.681 2.056 2.499 1164 HB ILE 148 HB ILE 148 -4.503 1.893 4.950 1165 HG12 ILE 148 2HG1 ILE 148 -1.535 1.241 4.600 1166 HG13 ILE 148 3HG1 ILE 148 -2.206 2.546 5.569 1167 HG21 ILE 148 1HG2 ILE 148 -4.961 0.070 3.345 1168 HG22 ILE 148 2HG2 ILE 148 -4.197 -0.545 4.808 1169 HG23 ILE 148 3HG2 ILE 148 -3.247 -0.357 3.334 1170 HD11 ILE 148 3HD1 ILE 148 -2.474 -0.409 6.117 1171 HD12 ILE 148 1HD1 ILE 148 -3.219 0.879 7.069 1172 HD13 ILE 148 2HD1 ILE 148 -1.464 0.749 6.979 1173 H ILE 149 H ILE 149 -3.773 1.515 0.743 1174 HA ILE 149 HA ILE 149 -6.489 2.589 0.280 1175 HB ILE 149 HB ILE 149 -4.395 1.706 -1.768 1176 HG12 ILE 149 2HG1 ILE 149 -3.503 3.654 -0.621 1177 HG13 ILE 149 3HG1 ILE 149 -4.069 4.182 -2.199 1178 HG21 ILE 149 1HG2 ILE 149 -5.803 2.886 -3.428 1179 HG22 ILE 149 2HG2 ILE 149 -6.996 3.224 -2.174 1180 HG23 ILE 149 3HG2 ILE 149 -6.672 1.559 -2.652 1181 HD11 ILE 149 3HD1 ILE 149 -4.620 5.811 -0.516 1182 HD12 ILE 149 1HD1 ILE 149 -5.467 4.599 0.444 1183 HD13 ILE 149 2HD1 ILE 149 -6.107 5.087 -1.128 1184 H GLU 150 H GLU 150 -7.943 1.010 0.792 1185 HA GLU 150 HA GLU 150 -7.500 -1.800 0.437 1186 HB2 GLU 150 2HB GLU 150 -9.017 -1.083 2.204 1187 HB3 GLU 150 3HB GLU 150 -10.049 -0.233 1.057 1188 HG2 GLU 150 2HG GLU 150 -10.803 -2.298 0.077 1189 HG3 GLU 150 3HG GLU 150 -9.605 -3.235 0.961 1190 H GLN 151 H GLN 151 -7.970 -3.064 -1.251 1191 HA GLN 151 HA GLN 151 -9.736 -2.169 -3.429 1192 HB2 GLN 151 2HB GLN 151 -6.961 -3.391 -3.778 1193 HB3 GLN 151 3HB GLN 151 -8.146 -3.289 -5.081 1194 HG2 GLN 151 2HG GLN 151 -6.918 -0.953 -3.586 1195 HG3 GLN 151 3HG GLN 151 -6.550 -1.448 -5.240 1196 HE21 GLN 151 1HE2 GLN 151 -7.852 1.006 -3.888 1197 HE22 GLN 151 2HE2 GLN 151 -9.241 1.319 -4.854 1198 H ARG 152 H ARG 152 -11.373 -3.446 -2.938 1199 HA ARG 152 HA ARG 152 -11.207 -6.263 -2.353 1200 HB2 ARG 152 2HB ARG 152 -13.559 -4.472 -3.135 1201 HB3 ARG 152 3HB ARG 152 -13.711 -6.129 -2.568 1202 HG2 ARG 152 2HG ARG 152 -12.431 -3.954 -0.887 1203 HG3 ARG 152 3HG ARG 152 -14.164 -4.281 -0.858 1204 HD2 ARG 152 2HD ARG 152 -13.750 -6.554 -0.067 1205 HD3 ARG 152 3HD ARG 152 -12.005 -6.310 -0.198 1206 HE ARG 152 HE ARG 152 -13.058 -4.316 1.477 1207 HH11 ARG 152 1HH1 ARG 152 -12.517 -7.805 1.570 1208 HH12 ARG 152 2HH1 ARG 152 -12.359 -7.842 3.294 1209 HH21 ARG 152 1HH2 ARG 152 -12.781 -4.395 3.725 1210 HH22 ARG 152 2HH2 ARG 152 -12.508 -5.923 4.510 1211 H LEU 153 H LEU 153 -11.883 -7.963 -3.802 1212 HA LEU 153 HA LEU 153 -10.986 -7.640 -6.495 1213 HB2 LEU 153 2HB LEU 153 -12.210 -9.967 -5.001 1214 HB3 LEU 153 3HB LEU 153 -11.866 -10.079 -6.722 1215 HG LEU 153 HG LEU 153 -9.816 -9.602 -4.523 1216 HD11 LEU 153 1HD1 LEU 153 -10.649 -11.899 -4.585 1217 HD12 LEU 153 2HD1 LEU 153 -8.970 -11.813 -5.112 1218 HD13 LEU 153 3HD1 LEU 153 -10.258 -12.013 -6.305 1219 HD21 LEU 153 3HD2 LEU 153 -8.113 -9.784 -6.302 1220 HD22 LEU 153 1HD2 LEU 153 -9.157 -8.385 -6.543 1221 HD23 LEU 153 2HD2 LEU 153 -9.385 -9.834 -7.525 1222 H GLU 154 H GLU 154 -12.362 -8.911 -8.211 1223 HA GLU 154 HA GLU 154 -14.158 -7.033 -9.206 1224 HB2 GLU 154 2HB GLU 154 -14.066 -9.926 -10.140 1225 HB3 GLU 154 3HB GLU 154 -14.444 -8.496 -11.087 1226 HG2 GLU 154 2HG GLU 154 -11.750 -9.437 -10.104 1227 HG3 GLU 154 3HG GLU 154 -12.283 -9.205 -11.765 1228 H HIS 155 H HIS 155 -14.768 -10.060 -7.510 1229 HA HIS 155 HA HIS 155 -17.665 -9.791 -7.639 1230 HB2 HIS 155 2HB HIS 155 -15.958 -11.732 -6.008 1231 HB3 HIS 155 3HB HIS 155 -17.705 -11.820 -6.204 1232 HD1 HIS 155 HD1 HIS 155 -18.590 -12.552 -8.561 1233 HD2 HIS 155 HD2 HIS 155 -14.473 -12.823 -8.087 1234 HE1 HIS 155 HE1 HIS 155 -17.793 -14.019 -10.434 1235 HE2 HIS 155 HE2 HIS 155 -15.316 -14.275 -10.045 1236 H HIS 156 H HIS 156 -17.791 -7.680 -6.750 1237 HA HIS 156 HA HIS 156 -16.727 -6.832 -4.297 1238 HB2 HIS 156 2HB HIS 156 -18.295 -4.933 -4.434 1239 HB3 HIS 156 3HB HIS 156 -17.606 -5.260 -6.021 1240 HD1 HIS 156 HD1 HIS 156 -20.808 -5.001 -4.226 1241 HD2 HIS 156 HD2 HIS 156 -19.495 -6.529 -7.857 1242 HE1 HIS 156 HE1 HIS 156 -22.879 -5.337 -5.600 1243 HE2 HIS 156 HE2 HIS 156 -22.058 -6.245 -7.798 1244 H HIS 157 H HIS 157 -17.222 -7.376 -2.279 1245 HA HIS 157 HA HIS 157 -19.345 -9.195 -1.669 1246 HB2 HIS 157 2HB HIS 157 -17.154 -7.907 -0.031 1247 HB3 HIS 157 3HB HIS 157 -18.476 -8.747 0.777 1248 HD1 HIS 157 HD1 HIS 157 -15.605 -9.400 -1.596 1249 HD2 HIS 157 HD2 HIS 157 -18.322 -11.503 0.731 1250 HE1 HIS 157 HE1 HIS 157 -14.845 -11.788 -1.668 1251 HE2 HIS 157 HE2 HIS 157 -16.630 -13.054 -0.438 1252 H HIS 158 H HIS 158 -21.347 -8.585 -1.513 1253 HA HIS 158 HA HIS 158 -22.222 -6.043 -0.340 1254 HB2 HIS 158 2HB HIS 158 -24.506 -6.832 -0.921 1255 HB3 HIS 158 3HB HIS 158 -23.433 -6.903 -2.313 1256 HD1 HIS 158 HD1 HIS 158 -25.307 -9.104 0.091 1257 HD2 HIS 158 HD2 HIS 158 -23.003 -9.485 -3.346 1258 HE1 HIS 158 HE1 HIS 158 -25.633 -11.467 -0.680 1259 HE2 HIS 158 HE2 HIS 158 -24.133 -11.705 -2.685 1260 H HIS 159 H HIS 159 -20.918 -8.542 1.034 1261 HA HIS 159 HA HIS 159 -22.523 -8.508 3.476 1262 HB2 HIS 159 2HB HIS 159 -23.348 -10.461 2.173 1263 HB3 HIS 159 3HB HIS 159 -21.707 -11.065 2.000 1264 HD1 HIS 159 HD1 HIS 159 -20.631 -12.189 4.085 1265 HD2 HIS 159 HD2 HIS 159 -24.567 -10.994 4.653 1266 HE1 HIS 159 HE1 HIS 159 -21.390 -13.350 6.170 1267 HE2 HIS 159 HE2 HIS 159 -23.820 -12.755 6.382 1268 H HIS 160 H HIS 160 -21.245 -8.758 5.288 1269 HA HIS 160 HA HIS 160 -18.384 -8.450 4.999 1270 HB2 HIS 160 2HB HIS 160 -20.199 -8.506 7.451 1271 HB3 HIS 160 3HB HIS 160 -18.456 -8.265 7.539 1272 HD1 HIS 160 HD1 HIS 160 -17.644 -5.927 7.293 1273 HD2 HIS 160 HD2 HIS 160 -21.568 -6.333 6.004 1274 HE1 HIS 160 HE1 HIS 160 -18.435 -3.599 6.804 1275 HE2 HIS 160 HE2 HIS 160 -20.871 -3.864 6.263 Start of MODEL 20 1 H1 MET 1 1H MET 1 -28.850 16.026 -7.645 2 H2 MET 1 2H MET 1 -28.809 16.843 -9.122 3 H3 MET 1 3H MET 1 -27.970 17.460 -7.795 4 HA MET 1 HA MET 1 -26.548 16.379 -9.457 5 HB2 MET 1 2HB MET 1 -25.221 15.078 -7.787 6 HB3 MET 1 3HB MET 1 -25.756 16.631 -7.168 7 HG2 MET 1 2HG MET 1 -27.037 13.972 -6.509 8 HG3 MET 1 3HG MET 1 -25.907 14.857 -5.477 9 HE1 MET 1 3HE MET 1 -28.900 13.812 -4.696 10 HE2 MET 1 1HE MET 1 -29.501 15.177 -3.755 11 HE3 MET 1 2HE MET 1 -27.852 14.601 -3.514 12 H VAL 2 H VAL 2 -26.598 14.887 -11.024 13 HA VAL 2 HA VAL 2 -27.358 12.143 -10.617 14 HB VAL 2 HB VAL 2 -29.614 13.181 -10.809 15 HG11 VAL 2 1HG1 VAL 2 -29.121 15.105 -12.225 16 HG12 VAL 2 2HG1 VAL 2 -30.448 14.161 -12.900 17 HG13 VAL 2 3HG1 VAL 2 -28.836 14.048 -13.609 18 HG21 VAL 2 3HG2 VAL 2 -28.982 11.382 -13.183 19 HG22 VAL 2 1HG2 VAL 2 -30.577 11.643 -12.474 20 HG23 VAL 2 2HG2 VAL 2 -29.316 10.843 -11.536 21 H GLU 3 H GLU 3 -25.022 13.152 -11.219 22 HA GLU 3 HA GLU 3 -24.396 13.353 -14.028 23 HB2 GLU 3 2HB GLU 3 -22.635 13.125 -11.530 24 HB3 GLU 3 3HB GLU 3 -21.980 13.260 -13.160 25 HG2 GLU 3 2HG GLU 3 -21.915 15.421 -12.092 26 HG3 GLU 3 3HG GLU 3 -23.067 15.461 -13.419 27 HA PRO 4 HA PRO 4 -23.619 8.955 -14.763 28 HB2 PRO 4 2HB PRO 4 -21.778 9.033 -16.781 29 HB3 PRO 4 3HB PRO 4 -23.466 9.522 -17.022 30 HG2 PRO 4 2HG PRO 4 -21.048 11.233 -16.626 31 HG3 PRO 4 3HG PRO 4 -22.423 11.464 -17.726 32 HD2 PRO 4 2HD PRO 4 -22.151 12.765 -15.308 33 HD3 PRO 4 3HD PRO 4 -23.711 12.474 -16.100 34 H GLY 5 H GLY 5 -21.120 7.772 -15.559 35 HA2 GLY 5 2HA GLY 5 -19.906 7.474 -12.947 36 HA3 GLY 5 3HA GLY 5 -19.517 6.572 -14.399 37 H VAL 6 H VAL 6 -19.226 9.914 -13.170 38 HA VAL 6 HA VAL 6 -16.894 10.497 -14.796 39 HB VAL 6 HB VAL 6 -17.034 12.778 -13.806 40 HG11 VAL 6 1HG1 VAL 6 -19.718 11.725 -14.788 41 HG12 VAL 6 2HG1 VAL 6 -18.380 12.275 -15.798 42 HG13 VAL 6 3HG1 VAL 6 -19.228 13.422 -14.762 43 HG21 VAL 6 3HG2 VAL 6 -18.895 13.388 -12.260 44 HG22 VAL 6 1HG2 VAL 6 -17.785 12.229 -11.524 45 HG23 VAL 6 2HG2 VAL 6 -19.346 11.685 -12.139 46 H ALA 7 H ALA 7 -17.252 8.910 -11.894 47 HA ALA 7 HA ALA 7 -14.493 9.519 -11.012 48 HB1 ALA 7 3HB ALA 7 -16.044 10.672 -9.478 49 HB2 ALA 7 1HB ALA 7 -15.234 9.340 -8.651 50 HB3 ALA 7 2HB ALA 7 -16.908 9.163 -9.185 51 H LYS 8 H LYS 8 -13.298 7.689 -11.004 52 HA LYS 8 HA LYS 8 -14.371 5.094 -10.278 53 HB2 LYS 8 2HB LYS 8 -13.731 3.979 -12.428 54 HB3 LYS 8 3HB LYS 8 -15.032 5.143 -12.640 55 HG2 LYS 8 2HG LYS 8 -13.330 6.801 -13.476 56 HG3 LYS 8 3HG LYS 8 -12.121 5.523 -13.396 57 HD2 LYS 8 2HD LYS 8 -12.877 5.731 -15.693 58 HD3 LYS 8 3HD LYS 8 -13.473 4.201 -15.049 59 HE2 LYS 8 2HE LYS 8 -15.704 5.144 -14.756 60 HE3 LYS 8 3HE LYS 8 -15.124 6.747 -15.224 61 HZ1 LYS 8 3HZ LYS 8 -14.670 5.927 -17.431 62 HZ2 LYS 8 1HZ LYS 8 -16.279 5.586 -17.032 63 HZ3 LYS 8 2HZ LYS 8 -15.121 4.356 -16.996 64 H LEU 9 H LEU 9 -12.872 4.152 -9.075 65 HA LEU 9 HA LEU 9 -10.069 4.902 -9.105 66 HB2 LEU 9 2HB LEU 9 -11.238 4.371 -6.959 67 HB3 LEU 9 3HB LEU 9 -11.539 2.739 -7.530 68 HG LEU 9 HG LEU 9 -9.037 2.366 -7.603 69 HD11 LEU 9 1HD1 LEU 9 -8.258 4.667 -7.783 70 HD12 LEU 9 2HD1 LEU 9 -7.548 3.889 -6.372 71 HD13 LEU 9 3HD1 LEU 9 -8.875 5.036 -6.169 72 HD21 LEU 9 3HD2 LEU 9 -8.774 2.034 -5.172 73 HD22 LEU 9 1HD2 LEU 9 -10.361 1.509 -5.732 74 HD23 LEU 9 2HD2 LEU 9 -10.192 3.041 -4.874 75 H THR 10 H THR 10 -9.177 4.254 -11.024 76 HA THR 10 HA THR 10 -9.482 1.439 -11.910 77 HB THR 10 HB THR 10 -8.563 3.697 -13.742 78 HG1 THR 10 HG1 THR 10 -10.618 4.263 -12.688 79 HG21 THR 10 3HG2 THR 10 -9.655 2.345 -15.499 80 HG22 THR 10 1HG2 THR 10 -10.163 1.160 -14.290 81 HG23 THR 10 2HG2 THR 10 -8.448 1.388 -14.641 82 H THR 11 H THR 11 -7.421 0.917 -13.395 83 HA THR 11 HA THR 11 -5.482 0.075 -11.674 84 HB THR 11 HB THR 11 -5.095 0.475 -14.671 85 HG1 THR 11 HG1 THR 11 -6.427 -1.177 -15.015 86 HG21 THR 11 3HG2 THR 11 -3.099 -0.411 -13.541 87 HG22 THR 11 1HG2 THR 11 -3.834 -1.653 -14.555 88 HG23 THR 11 2HG2 THR 11 -4.057 -1.694 -12.806 89 H TYR 12 H TYR 12 -5.450 3.106 -13.497 90 HA TYR 12 HA TYR 12 -2.746 3.721 -13.639 91 HB2 TYR 12 2HB TYR 12 -3.417 6.073 -13.989 92 HB3 TYR 12 3HB TYR 12 -4.461 4.985 -14.884 93 HD1 TYR 12 HD1 TYR 12 -6.884 4.772 -14.263 94 HD2 TYR 12 HD2 TYR 12 -4.330 7.442 -12.103 95 HE1 TYR 12 HE1 TYR 12 -8.855 5.880 -13.277 96 HE2 TYR 12 HE2 TYR 12 -6.301 8.530 -11.118 97 HH TYR 12 HH TYR 12 -9.459 7.258 -11.332 98 H ALA 13 H ALA 13 -4.996 4.344 -10.982 99 HA ALA 13 HA ALA 13 -3.276 6.023 -9.422 100 HB1 ALA 13 3HB ALA 13 -5.011 5.811 -7.696 101 HB2 ALA 13 1HB ALA 13 -5.759 4.484 -8.595 102 HB3 ALA 13 2HB ALA 13 -5.736 6.110 -9.276 103 H SER 14 H SER 14 -3.782 2.580 -9.643 104 HA SER 14 HA SER 14 -2.491 1.930 -7.123 105 HB2 SER 14 2HB SER 14 -3.513 0.136 -9.367 106 HB3 SER 14 3HB SER 14 -2.984 -0.415 -7.774 107 HG SER 14 HG SER 14 -4.976 1.557 -7.908 108 H LYS 15 H LYS 15 -1.661 1.938 -10.572 109 HA LYS 15 HA LYS 15 0.747 0.373 -10.311 110 HB2 LYS 15 2HB LYS 15 -0.367 2.000 -12.634 111 HB3 LYS 15 3HB LYS 15 1.128 1.076 -12.739 112 HG2 LYS 15 2HG LYS 15 -1.626 -0.062 -12.182 113 HG3 LYS 15 3HG LYS 15 -0.758 -0.149 -13.717 114 HD2 LYS 15 2HD LYS 15 1.002 -1.511 -12.665 115 HD3 LYS 15 3HD LYS 15 0.189 -1.391 -11.104 116 HE2 LYS 15 2HE LYS 15 -1.744 -2.623 -12.029 117 HE3 LYS 15 3HE LYS 15 -0.915 -2.753 -13.584 118 HZ1 LYS 15 3HZ LYS 15 0.091 -3.860 -11.018 119 HZ2 LYS 15 1HZ LYS 15 0.828 -4.021 -12.532 120 HZ3 LYS 15 2HZ LYS 15 -0.666 -4.757 -12.237 121 H GLN 16 H GLN 16 0.087 3.853 -10.904 122 HA GLN 16 HA GLN 16 2.796 4.703 -10.956 123 HB2 GLN 16 2HB GLN 16 0.268 6.261 -10.283 124 HB3 GLN 16 3HB GLN 16 1.842 7.011 -10.505 125 HG2 GLN 16 2HG GLN 16 0.257 5.513 -12.606 126 HG3 GLN 16 3HG GLN 16 0.469 7.262 -12.499 127 HE21 GLN 16 1HE2 GLN 16 2.528 8.143 -12.992 128 HE22 GLN 16 2HE2 GLN 16 3.682 7.275 -13.940 129 H ALA 17 H ALA 17 0.649 3.967 -8.341 130 HA ALA 17 HA ALA 17 2.005 5.374 -6.254 131 HB1 ALA 17 3HB ALA 17 0.049 3.071 -6.131 132 HB2 ALA 17 1HB ALA 17 -0.356 4.787 -6.106 133 HB3 ALA 17 2HB ALA 17 0.542 4.076 -4.763 134 H THR 18 H THR 18 1.978 1.921 -7.241 135 HA THR 18 HA THR 18 3.997 1.097 -5.375 136 HB THR 18 HB THR 18 4.146 -0.923 -7.079 137 HG1 THR 18 HG1 THR 18 1.577 -0.252 -7.880 138 HG21 THR 18 3HG2 THR 18 3.020 -1.032 -4.870 139 HG22 THR 18 1HG2 THR 18 2.162 -1.952 -6.106 140 HG23 THR 18 2HG2 THR 18 1.550 -0.379 -5.600 141 H ASP 19 H ASP 19 4.014 2.256 -8.673 142 HA ASP 19 HA ASP 19 6.755 1.798 -9.301 143 HB2 ASP 19 2HB ASP 19 4.910 2.234 -10.977 144 HB3 ASP 19 3HB ASP 19 4.860 3.908 -10.437 145 H MET 20 H MET 20 5.006 4.290 -7.586 146 HA MET 20 HA MET 20 7.024 6.291 -7.389 147 HB2 MET 20 2HB MET 20 4.526 6.544 -6.859 148 HB3 MET 20 3HB MET 20 4.827 5.700 -5.352 149 HG2 MET 20 2HG MET 20 4.775 8.021 -4.843 150 HG3 MET 20 3HG MET 20 6.472 7.543 -4.775 151 HE1 MET 20 3HE MET 20 4.709 9.700 -8.467 152 HE2 MET 20 1HE MET 20 3.707 9.087 -7.150 153 HE3 MET 20 2HE MET 20 4.565 7.964 -8.210 154 H GLY 21 H GLY 21 6.249 3.376 -5.565 155 HA2 GLY 21 2HA GLY 21 8.239 2.283 -4.479 156 HA3 GLY 21 3HA GLY 21 8.482 3.822 -3.651 157 H ALA 22 H ALA 22 5.819 1.547 -4.303 158 HA ALA 22 HA ALA 22 5.138 1.471 -1.437 159 HB1 ALA 22 3HB ALA 22 3.602 3.104 -2.468 160 HB2 ALA 22 1HB ALA 22 2.730 1.671 -1.925 161 HB3 ALA 22 2HB ALA 22 3.081 1.896 -3.642 162 H ILE 23 H ILE 23 3.514 -0.330 -1.007 163 HA ILE 23 HA ILE 23 4.259 -2.758 -2.553 164 HB ILE 23 HB ILE 23 4.328 -4.031 -0.406 165 HG12 ILE 23 2HG1 ILE 23 3.976 -1.307 0.946 166 HG13 ILE 23 3HG1 ILE 23 2.779 -2.593 0.924 167 HG21 ILE 23 1HG2 ILE 23 6.229 -1.650 -0.390 168 HG22 ILE 23 2HG2 ILE 23 6.458 -3.150 -1.287 169 HG23 ILE 23 3HG2 ILE 23 6.480 -3.170 0.475 170 HD11 ILE 23 3HD1 ILE 23 4.245 -3.984 2.289 171 HD12 ILE 23 1HD1 ILE 23 3.895 -2.438 3.062 172 HD13 ILE 23 2HD1 ILE 23 5.462 -2.703 2.296 173 H TYR 24 H TYR 24 2.701 -4.392 -2.690 174 HA TYR 24 HA TYR 24 -0.059 -3.741 -1.855 175 HB2 TYR 24 2HB TYR 24 1.014 -5.867 -3.760 176 HB3 TYR 24 3HB TYR 24 -0.670 -5.760 -3.269 177 HD1 TYR 24 HD1 TYR 24 -1.642 -3.176 -3.613 178 HD2 TYR 24 HD2 TYR 24 1.427 -5.054 -5.926 179 HE1 TYR 24 HE1 TYR 24 -2.185 -1.726 -5.527 180 HE2 TYR 24 HE2 TYR 24 0.886 -3.601 -7.829 181 HH TYR 24 HH TYR 24 -1.078 -0.871 -7.566 182 H VAL 25 H VAL 25 -0.757 -4.644 -0.013 183 HA VAL 25 HA VAL 25 0.269 -7.300 0.819 184 HB VAL 25 HB VAL 25 -0.195 -6.785 3.137 185 HG11 VAL 25 1HG1 VAL 25 1.447 -4.553 1.888 186 HG12 VAL 25 2HG1 VAL 25 2.017 -6.161 2.342 187 HG13 VAL 25 3HG1 VAL 25 1.492 -5.033 3.590 188 HG21 VAL 25 3HG2 VAL 25 -0.954 -4.580 3.958 189 HG22 VAL 25 1HG2 VAL 25 -2.173 -5.334 2.927 190 HG23 VAL 25 2HG2 VAL 25 -1.172 -4.025 2.296 191 H ASN 26 H ASN 26 -1.408 -8.517 2.176 192 HA ASN 26 HA ASN 26 -4.042 -8.410 0.845 193 HB2 ASN 26 2HB ASN 26 -4.425 -10.647 1.838 194 HB3 ASN 26 3HB ASN 26 -2.948 -10.613 0.895 195 HD21 ASN 26 1HD2 ASN 26 -3.668 -12.527 2.939 196 HD22 ASN 26 2HD2 ASN 26 -2.440 -12.409 4.153 197 H SER 27 H SER 27 -5.776 -9.372 2.606 198 HA SER 27 HA SER 27 -6.482 -7.292 4.364 199 HB2 SER 27 2HB SER 27 -8.207 -8.953 5.172 200 HB3 SER 27 3HB SER 27 -8.133 -8.818 3.412 201 HG SER 27 HG SER 27 -8.158 -10.989 4.001 202 H LYS 28 H LYS 28 -4.177 -9.780 4.833 203 HA LYS 28 HA LYS 28 -4.351 -9.724 7.769 204 HB2 LYS 28 2HB LYS 28 -2.555 -11.435 5.992 205 HB3 LYS 28 3HB LYS 28 -2.789 -11.609 7.727 206 HG2 LYS 28 2HG LYS 28 -4.881 -12.090 5.589 207 HG3 LYS 28 3HG LYS 28 -4.034 -13.326 6.522 208 HD2 LYS 28 2HD LYS 28 -5.077 -12.473 8.598 209 HD3 LYS 28 3HD LYS 28 -5.917 -11.228 7.671 210 HE2 LYS 28 2HE LYS 28 -7.131 -13.009 6.427 211 HE3 LYS 28 3HE LYS 28 -6.316 -14.229 7.411 212 HZ1 LYS 28 3HZ LYS 28 -7.338 -13.235 9.385 213 HZ2 LYS 28 1HZ LYS 28 -8.504 -13.758 8.276 214 HZ3 LYS 28 2HZ LYS 28 -8.150 -12.115 8.411 215 H GLY 29 H GLY 29 -2.180 -8.862 5.073 216 HA2 GLY 29 2HA GLY 29 -0.994 -6.702 5.418 217 HA3 GLY 29 3HA GLY 29 -0.470 -7.322 6.974 218 H ASP 30 H ASP 30 -0.318 -9.938 5.047 219 HA ASP 30 HA ASP 30 2.511 -10.026 4.812 220 HB2 ASP 30 2HB ASP 30 0.524 -11.715 3.216 221 HB3 ASP 30 3HB ASP 30 2.189 -12.127 3.631 222 H ARG 31 H ARG 31 3.830 -9.922 2.975 223 HA ARG 31 HA ARG 31 3.065 -8.042 0.921 224 HB2 ARG 31 2HB ARG 31 5.646 -9.678 1.072 225 HB3 ARG 31 3HB ARG 31 5.364 -8.258 0.074 226 HG2 ARG 31 2HG ARG 31 6.557 -7.294 1.792 227 HG3 ARG 31 3HG ARG 31 4.925 -7.084 2.416 228 HD2 ARG 31 2HD ARG 31 6.083 -7.897 4.278 229 HD3 ARG 31 3HD ARG 31 5.357 -9.373 3.635 230 HE ARG 31 HE ARG 31 7.817 -9.141 2.446 231 HH11 ARG 31 1HH1 ARG 31 6.754 -9.502 5.777 232 HH12 ARG 31 2HH1 ARG 31 8.221 -10.290 6.256 233 HH21 ARG 31 1HH2 ARG 31 9.715 -10.096 3.083 234 HH22 ARG 31 2HH2 ARG 31 9.916 -10.632 4.725 235 H ILE 32 H ILE 32 1.378 -9.068 -0.206 236 HA ILE 32 HA ILE 32 1.512 -11.678 -1.332 237 HB ILE 32 HB ILE 32 -0.418 -11.000 -2.764 238 HG12 ILE 32 2HG1 ILE 32 -0.181 -8.249 -1.450 239 HG13 ILE 32 3HG1 ILE 32 0.208 -8.596 -3.129 240 HG21 ILE 32 1HG2 ILE 32 -0.795 -11.896 -0.528 241 HG22 ILE 32 2HG2 ILE 32 -2.026 -10.699 -0.927 242 HG23 ILE 32 3HG2 ILE 32 -0.707 -10.273 0.165 243 HD11 ILE 32 3HD1 ILE 32 -2.143 -9.197 -3.534 244 HD12 ILE 32 1HD1 ILE 32 -1.948 -7.541 -2.957 245 HD13 ILE 32 2HD1 ILE 32 -2.517 -8.793 -1.855 246 H VAL 33 H VAL 33 2.357 -8.497 -2.542 247 HA VAL 33 HA VAL 33 4.426 -9.681 -4.124 248 HB VAL 33 HB VAL 33 2.501 -9.721 -5.733 249 HG11 VAL 33 1HG1 VAL 33 1.601 -7.653 -6.699 250 HG12 VAL 33 2HG1 VAL 33 2.532 -6.697 -5.543 251 HG13 VAL 33 3HG1 VAL 33 1.254 -7.772 -4.973 252 HG21 VAL 33 3HG2 VAL 33 3.713 -8.718 -7.650 253 HG22 VAL 33 1HG2 VAL 33 4.783 -9.643 -6.593 254 HG23 VAL 33 2HG2 VAL 33 4.787 -7.878 -6.529 255 H ASN 34 H ASN 34 6.117 -8.255 -4.407 256 HA ASN 34 HA ASN 34 6.497 -6.314 -2.416 257 HB2 ASN 34 2HB ASN 34 8.684 -5.877 -3.559 258 HB3 ASN 34 3HB ASN 34 8.372 -7.590 -3.318 259 HD21 ASN 34 1HD2 ASN 34 10.224 -6.537 -5.152 260 HD22 ASN 34 2HD2 ASN 34 9.728 -6.974 -6.745 261 H GLU 35 H GLU 35 5.864 -5.924 -5.884 262 HA GLU 35 HA GLU 35 4.454 -3.460 -5.542 263 HB2 GLU 35 2HB GLU 35 5.995 -2.228 -7.289 264 HB3 GLU 35 3HB GLU 35 6.470 -2.255 -5.603 265 HG2 GLU 35 2HG GLU 35 8.439 -2.585 -6.904 266 HG3 GLU 35 3HG GLU 35 8.063 -4.115 -6.122 267 H SER 36 H SER 36 4.613 -2.721 -8.394 268 HA SER 36 HA SER 36 2.868 -4.765 -9.521 269 HB2 SER 36 2HB SER 36 3.885 -2.087 -10.612 270 HB3 SER 36 3HB SER 36 2.752 -3.137 -11.470 271 HG SER 36 HG SER 36 2.129 -1.315 -9.752 272 H ASN 37 H ASN 37 4.891 -6.243 -9.202 273 HA ASN 37 HA ASN 37 7.030 -6.194 -11.077 274 HB2 ASN 37 2HB ASN 37 6.991 -7.409 -8.812 275 HB3 ASN 37 3HB ASN 37 5.990 -8.647 -9.561 276 HD21 ASN 37 1HD2 ASN 37 9.183 -7.322 -9.281 277 HD22 ASN 37 2HD2 ASN 37 9.999 -8.560 -10.170 278 H VAL 38 H VAL 38 4.113 -8.247 -10.812 279 HA VAL 38 HA VAL 38 3.520 -8.025 -13.601 280 HB VAL 38 HB VAL 38 5.204 -9.813 -13.783 281 HG11 VAL 38 1HG1 VAL 38 3.499 -11.473 -11.897 282 HG12 VAL 38 2HG1 VAL 38 5.080 -10.777 -11.534 283 HG13 VAL 38 3HG1 VAL 38 4.935 -12.031 -12.765 284 HG21 VAL 38 3HG2 VAL 38 2.397 -10.885 -14.270 285 HG22 VAL 38 1HG2 VAL 38 3.879 -11.476 -15.027 286 HG23 VAL 38 2HG2 VAL 38 3.312 -9.839 -15.358 287 H TYR 39 H TYR 39 1.375 -8.533 -14.036 288 HA TYR 39 HA TYR 39 -0.483 -8.260 -11.942 289 HB2 TYR 39 2HB TYR 39 -2.211 -8.466 -13.665 290 HB3 TYR 39 3HB TYR 39 -0.886 -7.487 -14.268 291 HD1 TYR 39 HD2 TYR 39 0.817 -8.587 -15.887 292 HD2 TYR 39 HD1 TYR 39 -2.921 -10.414 -14.883 293 HE1 TYR 39 HE2 TYR 39 0.979 -10.023 -17.871 294 HE2 TYR 39 HE1 TYR 39 -2.746 -11.845 -16.870 295 HH TYR 39 HH TYR 39 -1.594 -11.802 -19.080 296 H THR 40 H THR 40 0.798 -11.132 -13.509 297 HA THR 40 HA THR 40 -1.209 -12.990 -12.819 298 HB THR 40 HB THR 40 0.602 -14.740 -13.117 299 HG1 THR 40 HG1 THR 40 2.665 -14.066 -13.632 300 HG21 THR 40 3HG2 THR 40 -0.657 -13.971 -15.101 301 HG22 THR 40 1HG2 THR 40 1.024 -14.303 -15.520 302 HG23 THR 40 2HG2 THR 40 0.480 -12.638 -15.316 303 H THR 41 H THR 41 1.949 -12.360 -11.232 304 HA THR 41 HA THR 41 1.592 -13.964 -8.970 305 HB THR 41 HB THR 41 3.254 -11.420 -9.259 306 HG1 THR 41 HG1 THR 41 4.915 -12.962 -9.771 307 HG21 THR 41 3HG2 THR 41 4.679 -12.355 -7.477 308 HG22 THR 41 1HG2 THR 41 3.573 -13.719 -7.286 309 HG23 THR 41 2HG2 THR 41 3.041 -12.084 -6.882 310 H PHE 42 H PHE 42 0.826 -10.520 -9.471 311 HA PHE 42 HA PHE 42 0.052 -9.817 -6.862 312 HB2 PHE 42 2HB PHE 42 0.505 -8.073 -8.460 313 HB3 PHE 42 3HB PHE 42 -0.692 -8.693 -9.590 314 HD1 PHE 42 HD1 PHE 42 -0.821 -7.724 -5.927 315 HD2 PHE 42 HD2 PHE 42 -2.427 -7.144 -9.854 316 HE1 PHE 42 HE1 PHE 42 -2.472 -6.136 -5.028 317 HE2 PHE 42 HE2 PHE 42 -4.070 -5.557 -8.941 318 HZ PHE 42 HZ PHE 42 -4.095 -5.051 -6.530 319 H ARG 43 H ARG 43 -2.054 -10.655 -9.633 320 HA ARG 43 HA ARG 43 -4.496 -10.470 -8.230 321 HB2 ARG 43 2HB ARG 43 -4.270 -10.215 -10.688 322 HB3 ARG 43 3HB ARG 43 -3.889 -11.927 -10.837 323 HG2 ARG 43 2HG ARG 43 -6.145 -12.516 -10.059 324 HG3 ARG 43 3HG ARG 43 -6.525 -10.808 -9.820 325 HD2 ARG 43 2HD ARG 43 -6.168 -10.439 -12.279 326 HD3 ARG 43 3HD ARG 43 -5.917 -12.177 -12.459 327 HE ARG 43 HE ARG 43 -8.219 -12.541 -11.849 328 HH11 ARG 43 1HH1 ARG 43 -7.447 -9.179 -12.552 329 HH12 ARG 43 2HH1 ARG 43 -9.093 -8.744 -12.892 330 HH21 ARG 43 1HH2 ARG 43 -10.365 -11.970 -12.326 331 HH22 ARG 43 2HH2 ARG 43 -10.756 -10.338 -12.763 332 H ASN 44 H ASN 44 -2.480 -13.269 -9.108 333 HA ASN 44 HA ASN 44 -4.206 -15.311 -8.141 334 HB2 ASN 44 2HB ASN 44 -1.194 -15.318 -8.609 335 HB3 ASN 44 3HB ASN 44 -2.105 -16.756 -8.149 336 HD21 ASN 44 1HD2 ASN 44 -0.573 -16.111 -10.610 337 HD22 ASN 44 2HD2 ASN 44 -1.684 -16.353 -11.910 338 H ALA 45 H ALA 45 -1.692 -13.372 -6.571 339 HA ALA 45 HA ALA 45 -1.616 -14.877 -4.140 340 HB1 ALA 45 3HB ALA 45 -0.356 -12.987 -3.233 341 HB2 ALA 45 1HB ALA 45 -0.797 -12.004 -4.635 342 HB3 ALA 45 2HB ALA 45 0.231 -13.423 -4.839 343 H ILE 46 H ILE 46 -3.679 -12.290 -5.317 344 HA ILE 46 HA ILE 46 -5.106 -11.815 -2.858 345 HB ILE 46 HB ILE 46 -6.119 -11.338 -5.705 346 HG12 ILE 46 2HG1 ILE 46 -4.648 -9.338 -3.921 347 HG13 ILE 46 3HG1 ILE 46 -3.928 -10.168 -5.295 348 HG21 ILE 46 1HG2 ILE 46 -6.979 -10.054 -3.078 349 HG22 ILE 46 2HG2 ILE 46 -7.901 -11.245 -3.997 350 HG23 ILE 46 3HG2 ILE 46 -7.608 -9.645 -4.677 351 HD11 ILE 46 3HD1 ILE 46 -5.505 -9.071 -6.798 352 HD12 ILE 46 1HD1 ILE 46 -4.573 -7.906 -5.862 353 HD13 ILE 46 2HD1 ILE 46 -6.246 -8.244 -5.424 354 H LEU 47 H LEU 47 -5.447 -13.990 -5.628 355 HA LEU 47 HA LEU 47 -7.966 -15.151 -4.891 356 HB2 LEU 47 2HB LEU 47 -5.799 -16.151 -6.774 357 HB3 LEU 47 3HB LEU 47 -7.385 -16.890 -6.617 358 HG LEU 47 HG LEU 47 -6.843 -14.074 -7.646 359 HD11 LEU 47 1HD1 LEU 47 -7.711 -16.548 -9.181 360 HD12 LEU 47 2HD1 LEU 47 -6.118 -15.788 -9.244 361 HD13 LEU 47 3HD1 LEU 47 -7.527 -14.920 -9.844 362 HD21 LEU 47 3HD2 LEU 47 -8.988 -14.153 -6.475 363 HD22 LEU 47 1HD2 LEU 47 -9.483 -15.565 -7.416 364 HD23 LEU 47 2HD2 LEU 47 -9.247 -14.005 -8.211 365 H LYS 48 H LYS 48 -4.681 -15.733 -3.911 366 HA LYS 48 HA LYS 48 -4.942 -18.410 -2.946 367 HB2 LYS 48 2HB LYS 48 -2.981 -16.171 -2.311 368 HB3 LYS 48 3HB LYS 48 -2.875 -17.753 -1.543 369 HG2 LYS 48 2HG LYS 48 -2.487 -18.831 -3.695 370 HG3 LYS 48 3HG LYS 48 -2.738 -17.304 -4.539 371 HD2 LYS 48 2HD LYS 48 -0.329 -17.874 -4.337 372 HD3 LYS 48 3HD LYS 48 -0.722 -16.358 -3.524 373 HE2 LYS 48 2HE LYS 48 0.801 -17.681 -2.150 374 HE3 LYS 48 3HE LYS 48 -0.761 -17.558 -1.346 375 HZ1 LYS 48 3HZ LYS 48 0.157 -19.883 -2.941 376 HZ2 LYS 48 1HZ LYS 48 -1.294 -19.774 -2.089 377 HZ3 LYS 48 2HZ LYS 48 0.174 -19.804 -1.253 378 H GLN 49 H GLN 49 -5.495 -15.230 -1.513 379 HA GLN 49 HA GLN 49 -7.139 -16.288 0.577 380 HB2 GLN 49 2HB GLN 49 -4.804 -16.692 1.498 381 HB3 GLN 49 3HB GLN 49 -4.532 -14.956 1.446 382 HG2 GLN 49 2HG GLN 49 -6.603 -14.769 2.980 383 HG3 GLN 49 3HG GLN 49 -6.419 -16.507 3.220 384 HE21 GLN 49 1HE2 GLN 49 -5.988 -16.230 5.415 385 HE22 GLN 49 2HE2 GLN 49 -4.496 -15.586 5.994 386 H ALA 50 H ALA 50 -5.609 -13.386 1.590 387 HA ALA 50 HA ALA 50 -6.048 -11.211 1.609 388 HB1 ALA 50 3HB ALA 50 -5.258 -11.400 -0.716 389 HB2 ALA 50 1HB ALA 50 -6.419 -10.085 -0.521 390 HB3 ALA 50 2HB ALA 50 -6.921 -11.604 -1.268 391 H ASP 51 H ASP 51 -8.673 -13.256 1.692 392 HA ASP 51 HA ASP 51 -10.939 -13.197 1.517 393 HB2 ASP 51 2HB ASP 51 -10.477 -10.455 2.776 394 HB3 ASP 51 3HB ASP 51 -12.066 -11.204 2.633 395 H LYS 52 H LYS 52 -9.420 -12.357 -0.802 396 HA LYS 52 HA LYS 52 -9.621 -11.593 -2.897 397 HB2 LYS 52 2HB LYS 52 -12.604 -11.414 -2.286 398 HB3 LYS 52 3HB LYS 52 -11.887 -11.399 -3.894 399 HG2 LYS 52 2HG LYS 52 -11.751 -13.701 -1.922 400 HG3 LYS 52 3HG LYS 52 -12.810 -13.615 -3.332 401 HD2 LYS 52 2HD LYS 52 -10.877 -13.664 -4.836 402 HD3 LYS 52 3HD LYS 52 -9.766 -13.589 -3.463 403 HE2 LYS 52 2HE LYS 52 -9.998 -15.884 -4.433 404 HE3 LYS 52 3HE LYS 52 -10.448 -15.802 -2.729 405 HZ1 LYS 52 3HZ LYS 52 -12.754 -15.805 -3.329 406 HZ2 LYS 52 1HZ LYS 52 -11.999 -17.104 -4.098 407 HZ3 LYS 52 2HZ LYS 52 -12.390 -15.719 -4.977 408 H VAL 53 H VAL 53 -9.061 -9.739 -0.756 409 HA VAL 53 HA VAL 53 -9.401 -7.286 -2.292 410 HB VAL 53 HB VAL 53 -11.207 -7.047 -0.700 411 HG11 VAL 53 1HG1 VAL 53 -10.547 -8.673 1.012 412 HG12 VAL 53 2HG1 VAL 53 -10.944 -7.121 1.750 413 HG13 VAL 53 3HG1 VAL 53 -9.255 -7.603 1.562 414 HG21 VAL 53 3HG2 VAL 53 -10.548 -4.965 0.461 415 HG22 VAL 53 1HG2 VAL 53 -9.904 -5.024 -1.182 416 HG23 VAL 53 2HG2 VAL 53 -8.846 -5.350 0.193 417 H ALA 54 H ALA 54 -7.546 -6.279 -2.507 418 HA ALA 54 HA ALA 54 -5.212 -6.904 -0.803 419 HB1 ALA 54 3HB ALA 54 -4.931 -7.332 -3.222 420 HB2 ALA 54 1HB ALA 54 -3.879 -6.018 -2.701 421 HB3 ALA 54 2HB ALA 54 -5.364 -5.662 -3.589 422 H TYR 55 H TYR 55 -3.798 -5.053 -0.343 423 HA TYR 55 HA TYR 55 -5.160 -2.462 0.013 424 HB2 TYR 55 2HB TYR 55 -3.876 -4.136 2.224 425 HB3 TYR 55 3HB TYR 55 -4.275 -2.429 2.396 426 HD1 TYR 55 HD1 TYR 55 -6.670 -1.686 2.381 427 HD2 TYR 55 HD2 TYR 55 -5.639 -5.836 2.355 428 HE1 TYR 55 HE1 TYR 55 -8.963 -2.266 3.031 429 HE2 TYR 55 HE2 TYR 55 -7.935 -6.399 3.010 430 HH TYR 55 HH TYR 55 -10.477 -4.173 2.871 431 H LEU 56 H LEU 56 -3.904 -1.253 -1.168 432 HA LEU 56 HA LEU 56 -1.053 -1.504 -1.431 433 HB2 LEU 56 2HB LEU 56 -2.454 -0.778 -3.267 434 HB3 LEU 56 3HB LEU 56 -3.109 0.547 -2.323 435 HG LEU 56 HG LEU 56 -1.024 1.781 -2.481 436 HD11 LEU 56 1HD1 LEU 56 0.609 -0.011 -2.305 437 HD12 LEU 56 2HD1 LEU 56 0.928 0.955 -3.743 438 HD13 LEU 56 3HD1 LEU 56 0.157 -0.627 -3.897 439 HD21 LEU 56 3HD2 LEU 56 -1.851 0.632 -5.174 440 HD22 LEU 56 1HD2 LEU 56 -0.930 2.115 -4.932 441 HD23 LEU 56 2HD2 LEU 56 -2.584 2.012 -4.350 442 H VAL 57 H VAL 57 0.146 -1.066 0.323 443 HA VAL 57 HA VAL 57 -0.489 1.108 2.178 444 HB VAL 57 HB VAL 57 1.819 -0.905 2.208 445 HG11 VAL 57 1HG1 VAL 57 2.221 -0.194 4.546 446 HG12 VAL 57 2HG1 VAL 57 0.974 1.046 4.389 447 HG13 VAL 57 3HG1 VAL 57 2.444 1.147 3.419 448 HG21 VAL 57 3HG2 VAL 57 -0.763 -0.891 3.815 449 HG22 VAL 57 1HG2 VAL 57 0.565 -2.039 4.020 450 HG23 VAL 57 2HG2 VAL 57 -0.351 -2.008 2.513 451 H MET 58 H MET 58 0.221 3.072 1.757 452 HA MET 58 HA MET 58 2.860 3.589 0.538 453 HB2 MET 58 2HB MET 58 1.957 5.291 -0.933 454 HB3 MET 58 3HB MET 58 0.990 3.852 -1.200 455 HG2 MET 58 2HG MET 58 -0.814 4.790 0.168 456 HG3 MET 58 3HG MET 58 0.167 6.213 0.511 457 HE1 MET 58 3HE MET 58 -0.383 4.244 -2.952 458 HE2 MET 58 1HE MET 58 -1.700 5.221 -3.596 459 HE3 MET 58 2HE MET 58 -1.944 4.269 -2.131 460 H ASP 59 H ASP 59 3.322 6.051 0.874 461 HA ASP 59 HA ASP 59 2.169 7.027 3.436 462 HB2 ASP 59 2HB ASP 59 4.710 6.528 3.337 463 HB3 ASP 59 3HB ASP 59 4.839 7.879 2.217 464 H GLU 60 H GLU 60 2.350 9.583 3.410 465 HA GLU 60 HA GLU 60 0.486 10.501 1.524 466 HB2 GLU 60 2HB GLU 60 0.789 11.370 3.883 467 HB3 GLU 60 3HB GLU 60 2.218 12.244 3.330 468 HG2 GLU 60 2HG GLU 60 0.814 13.511 1.734 469 HG3 GLU 60 3HG GLU 60 -0.606 12.623 2.277 470 H ARG 61 H ARG 61 3.984 10.570 1.490 471 HA ARG 61 HA ARG 61 4.596 12.447 -0.460 472 HB2 ARG 61 2HB ARG 61 6.092 10.723 0.887 473 HB3 ARG 61 3HB ARG 61 5.878 9.681 -0.506 474 HG2 ARG 61 2HG ARG 61 7.127 12.455 -0.548 475 HG3 ARG 61 3HG ARG 61 8.017 10.939 -0.530 476 HD2 ARG 61 2HD ARG 61 7.119 10.360 -2.753 477 HD3 ARG 61 3HD ARG 61 6.156 11.840 -2.764 478 HE ARG 61 HE ARG 61 9.086 11.991 -2.567 479 HH11 ARG 61 1HH1 ARG 61 6.196 12.663 -4.467 480 HH12 ARG 61 2HH1 ARG 61 7.029 13.696 -5.578 481 HH21 ARG 61 1HH2 ARG 61 10.146 13.381 -3.951 482 HH22 ARG 61 2HH2 ARG 61 9.306 14.113 -5.280 483 H THR 62 H THR 62 3.737 9.050 -0.923 484 HA THR 62 HA THR 62 3.522 9.019 -3.734 485 HB THR 62 HB THR 62 2.246 7.190 -1.641 486 HG1 THR 62 HG1 THR 62 4.339 6.032 -2.682 487 HG21 THR 62 3HG2 THR 62 2.828 6.674 -4.585 488 HG22 THR 62 1HG2 THR 62 1.227 6.831 -3.857 489 HG23 THR 62 2HG2 THR 62 2.264 5.470 -3.426 490 H TRP 63 H TRP 63 1.220 9.633 -1.114 491 HA TRP 63 HA TRP 63 -1.159 9.422 -2.616 492 HB2 TRP 63 2HB TRP 63 -1.238 9.178 -0.205 493 HB3 TRP 63 3HB TRP 63 -0.639 10.822 0.034 494 HD1 TRP 63 HD1 TRP 63 -2.491 12.624 0.385 495 HE1 TRP 63 HE1 TRP 63 -5.025 12.750 -0.026 496 HE3 TRP 63 HE3 TRP 63 -3.171 8.141 -2.013 497 HZ2 TRP 63 HZ2 TRP 63 -7.029 11.185 -1.219 498 HZ3 TRP 63 HZ3 TRP 63 -5.435 7.542 -2.775 499 HH2 TRP 63 HH2 TRP 63 -7.327 9.039 -2.384 500 H LYS 64 H LYS 64 0.899 12.300 -1.941 501 HA LYS 64 HA LYS 64 -0.812 14.320 -2.818 502 HB2 LYS 64 2HB LYS 64 2.192 14.148 -3.268 503 HB3 LYS 64 3HB LYS 64 1.237 15.616 -3.408 504 HG2 LYS 64 2HG LYS 64 1.804 14.040 -0.893 505 HG3 LYS 64 3HG LYS 64 2.423 15.630 -1.322 506 HD2 LYS 64 2HD LYS 64 -0.020 16.424 -1.308 507 HD3 LYS 64 3HD LYS 64 -0.412 14.881 -0.551 508 HE2 LYS 64 2HE LYS 64 1.175 15.418 1.299 509 HE3 LYS 64 3HE LYS 64 1.485 16.982 0.541 510 HZ1 LYS 64 3HZ LYS 64 -0.140 17.102 2.353 511 HZ2 LYS 64 1HZ LYS 64 -1.170 16.065 1.505 512 HZ3 LYS 64 2HZ LYS 64 -0.808 17.591 0.879 513 H LYS 65 H LYS 65 1.015 11.986 -4.658 514 HA LYS 65 HA LYS 65 0.527 13.170 -7.259 515 HB2 LYS 65 2HB LYS 65 1.680 10.436 -6.554 516 HB3 LYS 65 3HB LYS 65 1.738 11.207 -8.135 517 HG2 LYS 65 2HG LYS 65 3.144 12.145 -5.616 518 HG3 LYS 65 3HG LYS 65 3.902 11.404 -7.021 519 HD2 LYS 65 2HD LYS 65 2.475 14.093 -7.020 520 HD3 LYS 65 3HD LYS 65 4.221 13.875 -6.931 521 HE2 LYS 65 2HE LYS 65 4.261 12.888 -9.150 522 HE3 LYS 65 3HE LYS 65 2.499 12.921 -9.236 523 HZ1 LYS 65 3HZ LYS 65 3.430 14.754 -10.462 524 HZ2 LYS 65 1HZ LYS 65 4.285 15.290 -9.102 525 HZ3 LYS 65 2HZ LYS 65 2.595 15.341 -9.115 526 H VAL 66 H VAL 66 -0.604 10.272 -5.450 527 HA VAL 66 HA VAL 66 -2.206 9.150 -7.500 528 HB VAL 66 HB VAL 66 -2.439 8.790 -4.469 529 HG11 VAL 66 1HG1 VAL 66 -3.636 6.669 -4.944 530 HG12 VAL 66 2HG1 VAL 66 -3.634 7.044 -6.669 531 HG13 VAL 66 3HG1 VAL 66 -4.534 8.065 -5.545 532 HG21 VAL 66 3HG2 VAL 66 -0.229 8.158 -5.342 533 HG22 VAL 66 1HG2 VAL 66 -0.977 7.102 -6.544 534 HG23 VAL 66 2HG2 VAL 66 -1.116 6.726 -4.824 535 H TYR 67 H TYR 67 -3.098 11.174 -4.729 536 HA TYR 67 HA TYR 67 -5.824 11.563 -5.050 537 HB2 TYR 67 2HB TYR 67 -4.450 12.351 -3.120 538 HB3 TYR 67 3HB TYR 67 -3.727 13.587 -4.134 539 HD1 TYR 67 HD1 TYR 67 -7.127 12.442 -3.010 540 HD2 TYR 67 HD2 TYR 67 -4.647 15.793 -3.951 541 HE1 TYR 67 HE1 TYR 67 -8.901 13.963 -2.278 542 HE2 TYR 67 HE2 TYR 67 -6.441 17.315 -3.217 543 HH TYR 67 HH TYR 67 -8.821 17.331 -2.869 544 H ASP 68 H ASP 68 -3.123 13.350 -6.489 545 HA ASP 68 HA ASP 68 -4.618 15.271 -7.933 546 HB2 ASP 68 2HB ASP 68 -2.241 15.635 -7.417 547 HB3 ASP 68 3HB ASP 68 -1.777 14.251 -8.400 548 H LEU 69 H LEU 69 -3.221 12.114 -8.872 549 HA LEU 69 HA LEU 69 -3.847 12.193 -11.631 550 HB2 LEU 69 2HB LEU 69 -3.494 9.758 -9.832 551 HB3 LEU 69 3HB LEU 69 -3.552 9.702 -11.580 552 HG LEU 69 HG LEU 69 -1.397 11.172 -10.016 553 HD11 LEU 69 1HD1 LEU 69 0.107 9.306 -10.577 554 HD12 LEU 69 2HD1 LEU 69 -1.247 8.415 -11.280 555 HD13 LEU 69 3HD1 LEU 69 -1.230 8.780 -9.554 556 HD21 LEU 69 3HD2 LEU 69 -0.202 11.251 -12.164 557 HD22 LEU 69 1HD2 LEU 69 -1.757 12.077 -12.260 558 HD23 LEU 69 2HD2 LEU 69 -1.569 10.471 -12.963 559 H LEU 70 H LEU 70 -5.648 11.041 -8.812 560 HA LEU 70 HA LEU 70 -7.821 9.805 -10.119 561 HB2 LEU 70 2HB LEU 70 -7.615 11.184 -7.405 562 HB3 LEU 70 3HB LEU 70 -9.071 10.359 -7.934 563 HG LEU 70 HG LEU 70 -6.370 9.012 -7.551 564 HD11 LEU 70 1HD1 LEU 70 -7.338 7.978 -5.544 565 HD12 LEU 70 2HD1 LEU 70 -8.823 8.907 -5.762 566 HD13 LEU 70 3HD1 LEU 70 -7.307 9.735 -5.402 567 HD21 LEU 70 3HD2 LEU 70 -7.601 6.894 -7.833 568 HD22 LEU 70 1HD2 LEU 70 -7.716 7.899 -9.276 569 HD23 LEU 70 2HD2 LEU 70 -9.085 7.789 -8.169 570 H ILE 71 H ILE 71 -7.595 13.111 -8.739 571 HA ILE 71 HA ILE 71 -10.091 14.076 -9.653 572 HB ILE 71 HB ILE 71 -7.585 15.691 -8.973 573 HG12 ILE 71 2HG1 ILE 71 -9.919 14.905 -7.162 574 HG13 ILE 71 3HG1 ILE 71 -8.318 14.179 -7.120 575 HG21 ILE 71 1HG2 ILE 71 -10.487 16.615 -9.042 576 HG22 ILE 71 2HG2 ILE 71 -9.234 17.068 -10.197 577 HG23 ILE 71 3HG2 ILE 71 -9.109 17.590 -8.517 578 HD11 ILE 71 3HD1 ILE 71 -8.607 15.766 -5.325 579 HD12 ILE 71 1HD1 ILE 71 -8.973 17.050 -6.477 580 HD13 ILE 71 2HD1 ILE 71 -7.362 16.324 -6.442 581 H LEU 72 H LEU 72 -6.935 13.999 -11.153 582 HA LEU 72 HA LEU 72 -7.432 15.756 -13.355 583 HB2 LEU 72 2HB LEU 72 -5.170 15.283 -12.482 584 HB3 LEU 72 3HB LEU 72 -5.317 13.595 -12.901 585 HG LEU 72 HG LEU 72 -3.824 15.115 -14.378 586 HD11 LEU 72 1HD1 LEU 72 -4.354 12.823 -15.035 587 HD12 LEU 72 2HD1 LEU 72 -4.280 13.885 -16.437 588 HD13 LEU 72 3HD1 LEU 72 -5.846 13.364 -15.809 589 HD21 LEU 72 3HD2 LEU 72 -5.401 16.991 -14.634 590 HD22 LEU 72 1HD2 LEU 72 -6.488 15.961 -15.572 591 HD23 LEU 72 2HD2 LEU 72 -4.884 16.357 -16.193 592 H HIS 73 H HIS 73 -7.541 12.223 -12.890 593 HA HIS 73 HA HIS 73 -7.824 11.736 -15.750 594 HB2 HIS 73 2HB HIS 73 -6.455 10.384 -13.921 595 HB3 HIS 73 3HB HIS 73 -7.981 9.583 -13.609 596 HD1 HIS 73 HD1 HIS 73 -8.970 8.185 -15.689 597 HD2 HIS 73 HD2 HIS 73 -5.005 9.413 -15.967 598 HE1 HIS 73 HE1 HIS 73 -7.944 6.751 -17.480 599 HE2 HIS 73 HE2 HIS 73 -5.599 7.623 -17.742 600 H ASP 74 H ASP 74 -9.620 10.614 -12.840 601 HA ASP 74 HA ASP 74 -12.239 11.203 -13.893 602 HB2 ASP 74 2HB ASP 74 -11.374 8.274 -13.721 603 HB3 ASP 74 3HB ASP 74 -13.055 8.776 -13.769 604 H PHE 75 H PHE 75 -11.923 12.353 -11.819 605 HA PHE 75 HA PHE 75 -13.548 11.218 -9.821 606 HB2 PHE 75 2HB PHE 75 -10.700 10.684 -9.381 607 HB3 PHE 75 3HB PHE 75 -11.256 11.770 -8.128 608 HD1 PHE 75 HD1 PHE 75 -13.479 11.010 -6.868 609 HD2 PHE 75 HD2 PHE 75 -10.914 8.366 -9.040 610 HE1 PHE 75 HE1 PHE 75 -14.333 9.098 -5.575 611 HE2 PHE 75 HE2 PHE 75 -11.784 6.468 -7.750 612 HZ PHE 75 HZ PHE 75 -13.491 6.829 -6.015 613 H THR 76 H THR 76 -13.373 12.696 -7.746 614 HA THR 76 HA THR 76 -12.620 15.475 -8.309 615 HB THR 76 HB THR 76 -15.088 15.191 -8.974 616 HG1 THR 76 HG1 THR 76 -15.756 17.058 -7.778 617 HG21 THR 76 3HG2 THR 76 -15.479 14.767 -5.994 618 HG22 THR 76 1HG2 THR 76 -15.804 13.584 -7.263 619 HG23 THR 76 2HG2 THR 76 -16.769 15.058 -7.168 620 HA PRO 77 HA PRO 77 -11.116 15.320 -4.056 621 HB2 PRO 77 2HB PRO 77 -12.002 17.805 -3.079 622 HB3 PRO 77 3HB PRO 77 -10.521 17.549 -4.019 623 HG2 PRO 77 2HG PRO 77 -13.224 18.427 -4.994 624 HG3 PRO 77 3HG PRO 77 -11.616 19.061 -5.409 625 HD2 PRO 77 2HD PRO 77 -12.823 17.430 -7.104 626 HD3 PRO 77 3HD PRO 77 -11.090 17.204 -6.774 627 H GLU 78 H GLU 78 -14.474 16.312 -4.580 628 HA GLU 78 HA GLU 78 -15.387 16.182 -1.923 629 HB2 GLU 78 2HB GLU 78 -16.971 15.908 -4.504 630 HB3 GLU 78 3HB GLU 78 -17.665 16.228 -2.918 631 HG2 GLU 78 2HG GLU 78 -16.321 18.358 -2.835 632 HG3 GLU 78 3HG GLU 78 -15.820 18.042 -4.496 633 H GLU 79 H GLU 79 -15.243 13.670 -4.421 634 HA GLU 79 HA GLU 79 -16.726 11.730 -2.852 635 HB2 GLU 79 2HB GLU 79 -15.112 11.404 -5.420 636 HB3 GLU 79 3HB GLU 79 -16.046 10.117 -4.667 637 HG2 GLU 79 2HG GLU 79 -17.168 12.701 -5.764 638 HG3 GLU 79 3HG GLU 79 -17.257 11.126 -6.539 639 H ILE 80 H ILE 80 -13.311 12.325 -3.659 640 HA ILE 80 HA ILE 80 -12.181 9.960 -2.613 641 HB ILE 80 HB ILE 80 -10.861 12.705 -2.848 642 HG12 ILE 80 2HG1 ILE 80 -10.825 10.409 -4.872 643 HG13 ILE 80 3HG1 ILE 80 -11.810 11.860 -5.024 644 HG21 ILE 80 1HG2 ILE 80 -9.566 11.205 -1.397 645 HG22 ILE 80 2HG2 ILE 80 -8.713 11.453 -2.920 646 HG23 ILE 80 3HG2 ILE 80 -9.589 9.948 -2.635 647 HD11 ILE 80 3HD1 ILE 80 -8.798 11.753 -5.017 648 HD12 ILE 80 1HD1 ILE 80 -9.772 13.222 -5.133 649 HD13 ILE 80 2HD1 ILE 80 -9.846 12.009 -6.412 650 H LYS 81 H LYS 81 -12.445 13.212 -1.182 651 HA LYS 81 HA LYS 81 -11.394 12.653 1.370 652 HB2 LYS 81 2HB LYS 81 -12.390 14.781 2.086 653 HB3 LYS 81 3HB LYS 81 -11.670 14.958 0.492 654 HG2 LYS 81 2HG LYS 81 -13.993 14.645 -0.483 655 HG3 LYS 81 3HG LYS 81 -14.621 14.758 1.155 656 HD2 LYS 81 2HD LYS 81 -12.862 16.968 0.055 657 HD3 LYS 81 3HD LYS 81 -14.562 16.887 -0.401 658 HE2 LYS 81 2HE LYS 81 -14.201 18.424 1.496 659 HE3 LYS 81 3HE LYS 81 -15.257 17.085 1.931 660 HZ1 LYS 81 3HZ LYS 81 -13.665 17.595 3.658 661 HZ2 LYS 81 1HZ LYS 81 -12.375 17.290 2.610 662 HZ3 LYS 81 2HZ LYS 81 -13.418 16.035 3.066 663 H SER 82 H SER 82 -14.608 12.227 0.027 664 HA SER 82 HA SER 82 -16.028 11.848 2.467 665 HB2 SER 82 2HB SER 82 -17.107 12.497 0.322 666 HB3 SER 82 3HB SER 82 -16.719 10.920 -0.360 667 HG SER 82 HG SER 82 -18.727 10.647 0.352 668 H PHE 83 H PHE 83 -14.080 9.705 0.456 669 HA PHE 83 HA PHE 83 -14.904 7.246 1.692 670 HB2 PHE 83 2HB PHE 83 -12.380 7.956 0.140 671 HB3 PHE 83 3HB PHE 83 -12.699 6.340 0.768 672 HD1 PHE 83 HD2 PHE 83 -15.128 5.382 0.130 673 HD2 PHE 83 HD1 PHE 83 -13.010 8.348 -2.107 674 HE1 PHE 83 HE2 PHE 83 -16.441 4.820 -1.872 675 HE2 PHE 83 HE1 PHE 83 -14.335 7.782 -4.100 676 HZ PHE 83 HZ PHE 83 -16.048 6.019 -3.986 677 H PHE 84 H PHE 84 -12.516 9.719 2.509 678 HA PHE 84 HA PHE 84 -11.325 8.238 4.697 679 HB2 PHE 84 2HB PHE 84 -11.275 11.216 4.024 680 HB3 PHE 84 3HB PHE 84 -10.347 10.484 5.332 681 HD1 PHE 84 HD2 PHE 84 -8.559 8.788 4.785 682 HD2 PHE 84 HD1 PHE 84 -10.466 11.115 1.751 683 HE1 PHE 84 HE2 PHE 84 -6.725 8.275 3.234 684 HE2 PHE 84 HE1 PHE 84 -8.631 10.590 0.202 685 HZ PHE 84 HZ PHE 84 -6.757 9.174 0.943 686 H GLU 85 H GLU 85 -13.863 10.626 4.308 687 HA GLU 85 HA GLU 85 -14.471 10.834 7.168 688 HB2 GLU 85 2HB GLU 85 -15.766 12.202 4.757 689 HB3 GLU 85 3HB GLU 85 -15.995 12.632 6.450 690 HG2 GLU 85 2HG GLU 85 -13.652 13.318 6.631 691 HG3 GLU 85 3HG GLU 85 -13.356 12.799 4.974 692 H ASN 86 H ASN 86 -14.977 8.430 5.298 693 HA ASN 86 HA ASN 86 -17.799 8.006 5.182 694 HB2 ASN 86 2HB ASN 86 -16.131 6.982 3.611 695 HB3 ASN 86 3HB ASN 86 -15.492 6.018 4.938 696 HD21 ASN 86 1HD2 ASN 86 -15.958 4.175 3.652 697 HD22 ASN 86 2HD2 ASN 86 -17.561 3.558 3.525 698 H LYS 87 H LYS 87 -18.678 8.210 7.193 699 HA LYS 87 HA LYS 87 -17.669 6.658 9.482 700 HB2 LYS 87 2HB LYS 87 -19.988 8.636 9.388 701 HB3 LYS 87 3HB LYS 87 -19.207 8.000 10.832 702 HG2 LYS 87 2HG LYS 87 -17.139 9.200 10.253 703 HG3 LYS 87 3HG LYS 87 -17.888 9.809 8.780 704 HD2 LYS 87 2HD LYS 87 -18.851 10.447 11.601 705 HD3 LYS 87 3HD LYS 87 -17.794 11.482 10.649 706 HE2 LYS 87 2HE LYS 87 -19.992 12.391 10.470 707 HE3 LYS 87 3HE LYS 87 -19.648 11.628 8.921 708 HZ1 LYS 87 3HZ LYS 87 -21.894 11.184 9.711 709 HZ2 LYS 87 1HZ LYS 87 -21.288 10.439 11.101 710 HZ3 LYS 87 2HZ LYS 87 -21.013 9.752 9.578 711 H GLY 88 H GLY 88 -20.458 6.978 7.341 712 HA2 GLY 88 2HA GLY 88 -22.299 5.273 8.641 713 HA3 GLY 88 3HA GLY 88 -22.329 5.723 6.942 714 H LYS 89 H LYS 89 -19.822 4.672 6.219 715 HA LYS 89 HA LYS 89 -19.990 1.743 6.696 716 HB2 LYS 89 2HB LYS 89 -19.072 3.133 4.132 717 HB3 LYS 89 3HB LYS 89 -19.193 1.398 4.383 718 HG2 LYS 89 2HG LYS 89 -21.542 3.315 4.361 719 HG3 LYS 89 3HG LYS 89 -21.037 2.335 2.988 720 HD2 LYS 89 2HD LYS 89 -21.959 1.231 5.669 721 HD3 LYS 89 3HD LYS 89 -22.974 1.360 4.233 722 HE2 LYS 89 2HE LYS 89 -21.409 -0.172 3.030 723 HE3 LYS 89 3HE LYS 89 -20.471 -0.339 4.514 724 HZ1 LYS 89 3HZ LYS 89 -23.291 -1.179 4.106 725 HZ2 LYS 89 1HZ LYS 89 -22.476 -1.245 5.588 726 HZ3 LYS 89 2HZ LYS 89 -21.949 -2.189 4.289 727 H ARG 90 H ARG 90 -17.636 0.825 5.917 728 HA ARG 90 HA ARG 90 -15.653 2.289 7.480 729 HB2 ARG 90 2HB ARG 90 -15.735 -0.053 7.953 730 HB3 ARG 90 3HB ARG 90 -15.666 -0.490 6.250 731 HG2 ARG 90 2HG ARG 90 -13.358 -0.136 6.104 732 HG3 ARG 90 3HG ARG 90 -13.334 0.998 7.452 733 HD2 ARG 90 2HD ARG 90 -13.820 -1.981 7.751 734 HD3 ARG 90 3HD ARG 90 -12.245 -1.199 7.945 735 HE ARG 90 HE ARG 90 -14.533 -0.325 9.597 736 HH11 ARG 90 1HH1 ARG 90 -11.359 -1.795 9.431 737 HH12 ARG 90 2HH1 ARG 90 -11.093 -1.712 11.142 738 HH21 ARG 90 1HH2 ARG 90 -14.147 -0.151 11.829 739 HH22 ARG 90 2HH2 ARG 90 -12.675 -0.778 12.499 740 HA PRO 91 HA PRO 91 -13.904 4.625 4.078 741 HB2 PRO 91 2HB PRO 91 -11.335 4.126 5.617 742 HB3 PRO 91 3HB PRO 91 -11.971 5.649 4.959 743 HG2 PRO 91 2HG PRO 91 -12.192 5.178 7.532 744 HG3 PRO 91 3HG PRO 91 -13.576 5.857 6.647 745 HD2 PRO 91 2HD PRO 91 -13.139 3.035 7.590 746 HD3 PRO 91 3HD PRO 91 -14.630 4.008 7.586 747 H VAL 92 H VAL 92 -13.489 3.887 2.058 748 HA VAL 92 HA VAL 92 -12.002 1.503 1.428 749 HB VAL 92 HB VAL 92 -12.761 3.828 -0.417 750 HG11 VAL 92 1HG1 VAL 92 -11.025 2.401 -1.407 751 HG12 VAL 92 2HG1 VAL 92 -12.551 2.206 -2.268 752 HG13 VAL 92 3HG1 VAL 92 -12.014 0.963 -1.133 753 HG21 VAL 92 3HG2 VAL 92 -14.752 2.506 -1.054 754 HG22 VAL 92 1HG2 VAL 92 -14.771 2.917 0.661 755 HG23 VAL 92 2HG2 VAL 92 -14.336 1.284 0.151 756 H PHE 93 H PHE 93 -11.375 4.997 1.266 757 HA PHE 93 HA PHE 93 -8.464 4.579 1.047 758 HB2 PHE 93 2HB PHE 93 -10.071 7.171 0.944 759 HB3 PHE 93 3HB PHE 93 -8.343 7.015 0.651 760 HD1 PHE 93 HD1 PHE 93 -8.848 4.325 -1.092 761 HD2 PHE 93 HD2 PHE 93 -10.354 8.332 -1.207 762 HE1 PHE 93 HE1 PHE 93 -9.267 4.110 -3.505 763 HE2 PHE 93 HE2 PHE 93 -10.771 8.097 -3.620 764 HZ PHE 93 HZ PHE 93 -10.231 5.990 -4.772 765 H VAL 94 H VAL 94 -7.452 4.375 2.952 766 HA VAL 94 HA VAL 94 -8.518 5.689 5.399 767 HB VAL 94 HB VAL 94 -6.760 3.181 5.261 768 HG11 VAL 94 1HG1 VAL 94 -8.324 4.371 7.584 769 HG12 VAL 94 2HG1 VAL 94 -6.570 4.405 7.385 770 HG13 VAL 94 3HG1 VAL 94 -7.399 2.866 7.627 771 HG21 VAL 94 3HG2 VAL 94 -8.979 2.728 4.237 772 HG22 VAL 94 1HG2 VAL 94 -9.768 3.279 5.718 773 HG23 VAL 94 2HG2 VAL 94 -8.753 1.835 5.741 774 H LYS 95 H LYS 95 -6.925 6.564 6.896 775 HA LYS 95 HA LYS 95 -4.127 6.762 6.105 776 HB2 LYS 95 2HB LYS 95 -4.078 9.235 6.207 777 HB3 LYS 95 3HB LYS 95 -5.093 8.662 4.890 778 HG2 LYS 95 2HG LYS 95 -7.115 9.153 6.152 779 HG3 LYS 95 3HG LYS 95 -6.171 9.600 7.570 780 HD2 LYS 95 2HD LYS 95 -6.021 11.059 4.906 781 HD3 LYS 95 3HD LYS 95 -7.059 11.556 6.242 782 HE2 LYS 95 2HE LYS 95 -5.121 11.968 7.661 783 HE3 LYS 95 3HE LYS 95 -4.035 11.323 6.423 784 HZ1 LYS 95 3HZ LYS 95 -5.763 13.707 6.066 785 HZ2 LYS 95 1HZ LYS 95 -4.606 13.129 4.979 786 HZ3 LYS 95 2HZ LYS 95 -4.125 13.765 6.469 787 H GLY 96 H GLY 96 -2.891 8.080 7.726 788 HA2 GLY 96 2HA GLY 96 -3.212 9.203 10.011 789 HA3 GLY 96 3HA GLY 96 -3.804 7.613 10.504 790 H SER 97 H SER 97 -2.103 7.125 11.933 791 HA SER 97 HA SER 97 0.636 6.922 11.012 792 HB2 SER 97 2HB SER 97 -0.736 5.671 13.437 793 HB3 SER 97 3HB SER 97 1.008 5.751 13.169 794 HG SER 97 HG SER 97 0.866 8.014 13.265 795 H LEU 98 H LEU 98 1.676 4.587 11.220 796 HA LEU 98 HA LEU 98 0.688 2.965 9.143 797 HB2 LEU 98 2HB LEU 98 3.075 3.009 9.827 798 HB3 LEU 98 3HB LEU 98 2.661 2.257 11.361 799 HG LEU 98 HG LEU 98 1.924 0.201 10.135 800 HD11 LEU 98 1HD1 LEU 98 1.298 1.165 7.986 801 HD12 LEU 98 2HD1 LEU 98 2.477 -0.123 7.766 802 HD13 LEU 98 3HD1 LEU 98 2.985 1.564 7.640 803 HD21 LEU 98 3HD2 LEU 98 4.191 0.297 11.055 804 HD22 LEU 98 1HD2 LEU 98 4.793 1.007 9.553 805 HD23 LEU 98 2HD2 LEU 98 4.159 -0.642 9.565 806 H GLU 99 H GLU 99 0.523 2.594 12.662 807 HA GLU 99 HA GLU 99 -0.919 0.100 12.636 808 HB2 GLU 99 2HB GLU 99 -0.465 2.029 14.955 809 HB3 GLU 99 3HB GLU 99 -0.995 0.351 15.078 810 HG2 GLU 99 2HG GLU 99 1.167 -0.363 14.057 811 HG3 GLU 99 3HG GLU 99 1.702 1.316 14.090 812 H SER 100 H SER 100 -1.777 3.511 13.069 813 HA SER 100 HA SER 100 -4.440 3.199 13.965 814 HB2 SER 100 2HB SER 100 -3.225 5.482 12.354 815 HB3 SER 100 3HB SER 100 -4.691 5.575 13.325 816 HG SER 100 HG SER 100 -3.063 4.793 15.064 817 H ALA 101 H ALA 101 -3.121 3.790 10.713 818 HA ALA 101 HA ALA 101 -5.546 3.733 9.250 819 HB1 ALA 101 3HB ALA 101 -4.086 3.575 7.268 820 HB2 ALA 101 1HB ALA 101 -2.706 3.183 8.306 821 HB3 ALA 101 2HB ALA 101 -3.471 4.769 8.412 822 H ALA 102 H ALA 102 -3.412 1.239 10.433 823 HA ALA 102 HA ALA 102 -4.236 -0.959 8.841 824 HB1 ALA 102 3HB ALA 102 -3.157 -2.326 10.570 825 HB2 ALA 102 1HB ALA 102 -3.104 -0.934 11.659 826 HB3 ALA 102 2HB ALA 102 -2.158 -0.929 10.171 827 H GLU 103 H GLU 103 -5.232 0.238 12.036 828 HA GLU 103 HA GLU 103 -7.134 -1.775 12.676 829 HB2 GLU 103 2HB GLU 103 -7.021 1.110 13.661 830 HB3 GLU 103 3HB GLU 103 -7.866 -0.220 14.447 831 HG2 GLU 103 2HG GLU 103 -5.749 -1.322 14.929 832 HG3 GLU 103 3HG GLU 103 -4.873 -0.095 14.042 833 H GLN 104 H GLN 104 -7.477 1.447 11.224 834 HA GLN 104 HA GLN 104 -10.342 1.415 11.032 835 HB2 GLN 104 2HB GLN 104 -8.321 3.189 9.616 836 HB3 GLN 104 3HB GLN 104 -10.052 3.497 9.719 837 HG2 GLN 104 2HG GLN 104 -9.892 3.817 12.133 838 HG3 GLN 104 3HG GLN 104 -8.185 3.365 12.101 839 HE21 GLN 104 1HE2 GLN 104 -6.682 4.808 11.129 840 HE22 GLN 104 2HE2 GLN 104 -7.039 6.490 10.953 841 H ALA 105 H ALA 105 -7.753 0.340 8.905 842 HA ALA 105 HA ALA 105 -9.489 -0.093 6.604 843 HB1 ALA 105 3HB ALA 105 -7.528 -1.180 5.582 844 HB2 ALA 105 1HB ALA 105 -6.663 -1.092 7.122 845 HB3 ALA 105 2HB ALA 105 -7.097 0.388 6.266 846 H GLY 106 H GLY 106 -8.448 -1.845 9.430 847 HA2 GLY 106 2HA GLY 106 -9.576 -3.660 10.392 848 HA3 GLY 106 3HA GLY 106 -10.297 -4.051 8.840 849 H ILE 107 H ILE 107 -6.936 -3.482 8.733 850 HA ILE 107 HA ILE 107 -6.350 -6.265 8.053 851 HB ILE 107 HB ILE 107 -4.370 -3.939 8.139 852 HG12 ILE 107 2HG1 ILE 107 -6.063 -4.675 5.709 853 HG13 ILE 107 3HG1 ILE 107 -6.378 -3.287 6.748 854 HG21 ILE 107 1HG2 ILE 107 -3.160 -5.206 6.408 855 HG22 ILE 107 2HG2 ILE 107 -4.402 -6.458 6.430 856 HG23 ILE 107 3HG2 ILE 107 -3.393 -6.192 7.854 857 HD11 ILE 107 3HD1 ILE 107 -4.171 -2.374 6.175 858 HD12 ILE 107 1HD1 ILE 107 -5.205 -2.610 4.768 859 HD13 ILE 107 2HD1 ILE 107 -3.902 -3.747 5.096 860 H VAL 108 H VAL 108 -4.635 -7.501 9.143 861 HA VAL 108 HA VAL 108 -4.490 -7.176 11.975 862 HB VAL 108 HB VAL 108 -2.676 -8.941 10.267 863 HG11 VAL 108 1HG1 VAL 108 -3.445 -9.136 13.204 864 HG12 VAL 108 2HG1 VAL 108 -1.873 -8.641 12.566 865 HG13 VAL 108 3HG1 VAL 108 -2.440 -10.294 12.327 866 HG21 VAL 108 3HG2 VAL 108 -5.397 -9.626 11.452 867 HG22 VAL 108 1HG2 VAL 108 -4.306 -10.773 10.666 868 HG23 VAL 108 2HG2 VAL 108 -5.020 -9.455 9.737 869 H VAL 109 H VAL 109 -3.443 -5.611 12.879 870 HA VAL 109 HA VAL 109 -1.844 -3.714 11.683 871 HB VAL 109 HB VAL 109 -2.103 -4.377 14.640 872 HG11 VAL 109 1HG1 VAL 109 -1.419 -2.036 15.102 873 HG12 VAL 109 2HG1 VAL 109 -1.082 -1.810 13.384 874 HG13 VAL 109 3HG1 VAL 109 -0.133 -2.962 14.323 875 HG21 VAL 109 3HG2 VAL 109 -3.844 -2.624 14.698 876 HG22 VAL 109 1HG2 VAL 109 -4.273 -3.907 13.564 877 HG23 VAL 109 2HG2 VAL 109 -3.653 -2.369 12.964 878 H ASP 110 H ASP 110 -0.798 -6.293 13.932 879 HA ASP 110 HA ASP 110 1.923 -5.592 14.043 880 HB2 ASP 110 2HB ASP 110 0.839 -7.107 15.705 881 HB3 ASP 110 3HB ASP 110 0.730 -8.371 14.483 882 H GLU 111 H GLU 111 0.169 -7.808 11.893 883 HA GLU 111 HA GLU 111 2.417 -9.022 10.695 884 HB2 GLU 111 2HB GLU 111 -0.421 -8.713 9.671 885 HB3 GLU 111 3HB GLU 111 0.800 -9.701 8.876 886 HG2 GLU 111 2HG GLU 111 -0.230 -10.117 11.695 887 HG3 GLU 111 3HG GLU 111 -0.739 -11.028 10.278 888 H LEU 112 H LEU 112 0.499 -6.125 9.699 889 HA LEU 112 HA LEU 112 2.237 -5.685 7.411 890 HB2 LEU 112 2HB LEU 112 1.042 -3.573 7.027 891 HB3 LEU 112 3HB LEU 112 -0.015 -4.960 7.148 892 HG LEU 112 HG LEU 112 -0.459 -4.186 9.592 893 HD11 LEU 112 1HD1 LEU 112 1.285 -2.507 9.864 894 HD12 LEU 112 2HD1 LEU 112 -0.301 -1.762 10.021 895 HD13 LEU 112 3HD1 LEU 112 0.626 -1.555 8.532 896 HD21 LEU 112 3HD2 LEU 112 -2.057 -4.075 7.681 897 HD22 LEU 112 1HD2 LEU 112 -1.530 -2.422 7.377 898 HD23 LEU 112 2HD2 LEU 112 -2.307 -2.849 8.906 899 H VAL 113 H VAL 113 2.281 -4.646 10.748 900 HA VAL 113 HA VAL 113 4.178 -2.531 10.482 901 HB VAL 113 HB VAL 113 3.563 -4.335 12.877 902 HG11 VAL 113 1HG1 VAL 113 5.499 -1.976 12.835 903 HG12 VAL 113 2HG1 VAL 113 5.919 -3.668 13.110 904 HG13 VAL 113 3HG1 VAL 113 4.935 -2.806 14.289 905 HG21 VAL 113 3HG2 VAL 113 1.796 -2.719 12.288 906 HG22 VAL 113 1HG2 VAL 113 2.954 -1.391 12.377 907 HG23 VAL 113 2HG2 VAL 113 2.531 -2.297 13.833 908 H GLN 114 H GLN 114 4.461 -6.033 10.957 909 HA GLN 114 HA GLN 114 7.292 -6.240 11.060 910 HB2 GLN 114 2HB GLN 114 5.262 -8.277 10.030 911 HB3 GLN 114 3HB GLN 114 6.956 -8.628 10.362 912 HG2 GLN 114 2HG GLN 114 4.827 -7.891 12.379 913 HG3 GLN 114 3HG GLN 114 5.602 -9.453 12.183 914 HE21 GLN 114 1HE2 GLN 114 5.923 -6.237 13.431 915 HE22 GLN 114 2HE2 GLN 114 7.365 -6.500 14.343 916 H THR 115 H THR 115 4.967 -6.647 8.456 917 HA THR 115 HA THR 115 6.515 -7.101 6.257 918 HB THR 115 HB THR 115 3.874 -5.770 6.758 919 HG1 THR 115 HG1 THR 115 3.209 -7.722 6.368 920 HG21 THR 115 3HG2 THR 115 4.625 -4.545 4.803 921 HG22 THR 115 1HG2 THR 115 3.378 -5.704 4.340 922 HG23 THR 115 2HG2 THR 115 5.071 -6.044 3.992 923 H VAL 116 H VAL 116 5.663 -3.878 7.582 924 HA VAL 116 HA VAL 116 7.068 -2.464 5.487 925 HB VAL 116 HB VAL 116 5.712 -1.459 8.034 926 HG11 VAL 116 1HG1 VAL 116 7.518 0.129 7.467 927 HG12 VAL 116 2HG1 VAL 116 5.940 0.846 7.147 928 HG13 VAL 116 3HG1 VAL 116 6.921 0.244 5.808 929 HG21 VAL 116 3HG2 VAL 116 4.171 -2.347 6.326 930 HG22 VAL 116 1HG2 VAL 116 4.869 -1.272 5.110 931 HG23 VAL 116 2HG2 VAL 116 3.986 -0.601 6.483 932 H LYS 117 H LYS 117 7.782 -3.318 8.897 933 HA LYS 117 HA LYS 117 10.113 -1.612 9.046 934 HB2 LYS 117 2HB LYS 117 10.463 -2.478 11.258 935 HB3 LYS 117 3HB LYS 117 8.731 -2.281 11.052 936 HG2 LYS 117 2HG LYS 117 8.571 -4.743 10.584 937 HG3 LYS 117 3HG LYS 117 10.278 -4.891 10.976 938 HD2 LYS 117 2HD LYS 117 8.186 -3.840 12.924 939 HD3 LYS 117 3HD LYS 117 8.670 -5.530 12.826 940 HE2 LYS 117 2HE LYS 117 9.858 -4.540 14.652 941 HE3 LYS 117 3HE LYS 117 11.023 -4.822 13.362 942 HZ1 LYS 117 3HZ LYS 117 10.975 -2.499 12.825 943 HZ2 LYS 117 1HZ LYS 117 11.275 -2.671 14.475 944 HZ3 LYS 117 2HZ LYS 117 9.742 -2.208 13.944 945 H ASN 118 H ASN 118 9.541 -4.953 8.180 946 HA ASN 118 HA ASN 118 12.343 -5.743 8.184 947 HB2 ASN 118 2HB ASN 118 9.901 -7.237 7.096 948 HB3 ASN 118 3HB ASN 118 11.526 -7.909 7.244 949 HD21 ASN 118 1HD2 ASN 118 9.045 -8.820 8.471 950 HD22 ASN 118 2HD2 ASN 118 9.294 -8.782 10.178 951 H TYR 119 H TYR 119 9.842 -4.848 5.823 952 HA TYR 119 HA TYR 119 11.319 -5.001 3.454 953 HB2 TYR 119 2HB TYR 119 8.981 -4.541 3.250 954 HB3 TYR 119 3HB TYR 119 9.074 -3.155 4.327 955 HD1 TYR 119 HD1 TYR 119 10.282 -4.300 0.928 956 HD2 TYR 119 HD2 TYR 119 9.138 -0.995 3.393 957 HE1 TYR 119 HE1 TYR 119 10.429 -2.787 -1.009 958 HE2 TYR 119 HE2 TYR 119 9.287 0.509 1.459 959 HH TYR 119 HH TYR 119 10.222 0.665 -0.690 960 H GLN 120 H GLN 120 10.771 -2.088 5.424 961 HA GLN 120 HA GLN 120 12.716 -0.430 4.305 962 HB2 GLN 120 2HB GLN 120 11.471 -0.390 7.091 963 HB3 GLN 120 3HB GLN 120 12.456 0.917 6.441 964 HG2 GLN 120 2HG GLN 120 10.782 1.187 4.585 965 HG3 GLN 120 3HG GLN 120 9.772 -0.023 5.371 966 HE21 GLN 120 1HE2 GLN 120 9.194 2.800 4.782 967 HE22 GLN 120 2HE2 GLN 120 8.797 3.534 6.285 968 H GLY 121 H GLY 121 12.996 -2.946 6.686 969 HA2 GLY 121 2HA GLY 121 15.531 -2.377 7.807 970 HA3 GLY 121 3HA GLY 121 14.742 -3.949 7.740 971 H TYR 122 H TYR 122 14.633 -4.693 5.173 972 HA TYR 122 HA TYR 122 17.413 -5.203 4.618 973 HB2 TYR 122 2HB TYR 122 16.730 -6.785 2.945 974 HB3 TYR 122 3HB TYR 122 15.748 -7.007 4.374 975 HD1 TYR 122 HD2 TYR 122 15.632 -5.451 0.945 976 HD2 TYR 122 HD1 TYR 122 13.388 -7.223 4.113 977 HE1 TYR 122 HE2 TYR 122 13.647 -5.513 -0.488 978 HE2 TYR 122 HE1 TYR 122 11.408 -7.287 2.658 979 HH TYR 122 HH TYR 122 10.515 -6.459 0.721 980 H VAL 123 H VAL 123 15.133 -2.882 3.499 981 HA VAL 123 HA VAL 123 16.392 -2.048 1.110 982 HB VAL 123 HB VAL 123 14.777 -0.432 3.140 983 HG11 VAL 123 1HG1 VAL 123 15.727 0.438 0.383 984 HG12 VAL 123 2HG1 VAL 123 16.240 1.114 1.931 985 HG13 VAL 123 3HG1 VAL 123 14.576 1.324 1.390 986 HG21 VAL 123 3HG2 VAL 123 13.488 -2.196 1.939 987 HG22 VAL 123 1HG2 VAL 123 13.953 -1.478 0.398 988 HG23 VAL 123 2HG2 VAL 123 12.934 -0.578 1.522 989 H GLN 124 H GLN 124 16.781 -0.751 4.478 990 HA GLN 124 HA GLN 124 19.027 0.904 3.780 991 HB2 GLN 124 2HB GLN 124 19.245 1.333 6.209 992 HB3 GLN 124 3HB GLN 124 17.593 1.537 5.647 993 HG2 GLN 124 2HG GLN 124 17.020 -0.685 6.537 994 HG3 GLN 124 3HG GLN 124 18.662 -0.861 7.153 995 HE21 GLN 124 1HE2 GLN 124 16.153 -0.897 8.630 996 HE22 GLN 124 2HE2 GLN 124 16.252 0.384 9.784 997 H ASP 125 H ASP 125 18.721 -2.427 4.664 998 HA ASP 125 HA ASP 125 21.477 -2.900 5.382 999 HB2 ASP 125 2HB ASP 125 19.594 -4.388 6.083 1000 HB3 ASP 125 3HB ASP 125 19.323 -4.839 4.408 1001 H GLY 126 H GLY 126 19.627 -2.685 2.430 1002 HA2 GLY 126 2HA GLY 126 20.275 -2.428 0.246 1003 HA3 GLY 126 3HA GLY 126 21.955 -2.596 0.737 1004 H HIS 127 H HIS 127 19.453 -4.996 1.441 1005 HA HIS 127 HA HIS 127 20.505 -6.797 -0.663 1006 HB2 HIS 127 2HB HIS 127 21.633 -7.311 1.516 1007 HB3 HIS 127 3HB HIS 127 20.063 -7.599 2.255 1008 HD1 HIS 127 HD1 HIS 127 22.499 -9.069 -0.183 1009 HD2 HIS 127 HD2 HIS 127 18.951 -10.129 1.715 1010 HE1 HIS 127 HE1 HIS 127 22.217 -11.517 -0.613 1011 HE2 HIS 127 HE2 HIS 127 19.942 -12.059 0.303 1012 H ASP 128 H ASP 128 18.915 -7.764 -1.790 1013 HA ASP 128 HA ASP 128 16.184 -7.087 -1.429 1014 HB2 ASP 128 2HB ASP 128 15.798 -8.353 -3.473 1015 HB3 ASP 128 3HB ASP 128 17.319 -7.494 -3.647 1016 H HIS 129 H HIS 129 14.387 -8.411 -0.919 1017 HA HIS 129 HA HIS 129 14.859 -11.216 -0.126 1018 HB2 HIS 129 2HB HIS 129 13.567 -9.084 1.595 1019 HB3 HIS 129 3HB HIS 129 12.984 -10.738 1.717 1020 HD1 HIS 129 HD1 HIS 129 14.172 -12.161 3.357 1021 HD2 HIS 129 HD2 HIS 129 16.507 -8.929 2.190 1022 HE1 HIS 129 HE1 HIS 129 16.239 -12.276 4.768 1023 HE2 HIS 129 HE2 HIS 129 17.594 -10.266 4.115 1024 H ASP 130 H ASP 130 12.114 -8.870 -0.345 1025 HA ASP 130 HA ASP 130 10.321 -10.908 -1.246 1026 HB2 ASP 130 2HB ASP 130 9.990 -7.902 -0.994 1027 HB3 ASP 130 3HB ASP 130 8.701 -8.943 -1.590 1028 H PHE 131 H PHE 131 10.527 -11.770 -3.148 1029 HA PHE 131 HA PHE 131 10.482 -12.141 -5.359 1030 HB2 PHE 131 2HB PHE 131 9.195 -9.383 -5.456 1031 HB3 PHE 131 3HB PHE 131 9.122 -10.583 -6.744 1032 HD1 PHE 131 HD2 PHE 131 7.953 -9.767 -3.307 1033 HD2 PHE 131 HD1 PHE 131 7.606 -12.497 -6.582 1034 HE1 PHE 131 HE2 PHE 131 5.979 -10.783 -2.252 1035 HE2 PHE 131 HE1 PHE 131 5.633 -13.506 -5.515 1036 HZ PHE 131 HZ PHE 131 4.816 -12.651 -3.355 1037 H GLY 132 H GLY 132 12.811 -10.787 -4.152 1038 HA2 GLY 132 2HA GLY 132 14.904 -10.199 -4.764 1039 HA3 GLY 132 3HA GLY 132 14.498 -10.803 -6.357 1040 H ARG 133 H ARG 133 13.100 -7.982 -4.628 1041 HA ARG 133 HA ARG 133 13.567 -6.278 -6.916 1042 HB2 ARG 133 2HB ARG 133 11.640 -6.020 -5.192 1043 HB3 ARG 133 3HB ARG 133 12.831 -5.262 -4.140 1044 HG2 ARG 133 2HG ARG 133 13.291 -3.751 -6.282 1045 HG3 ARG 133 3HG ARG 133 11.675 -4.273 -6.740 1046 HD2 ARG 133 2HD ARG 133 12.379 -2.854 -4.159 1047 HD3 ARG 133 3HD ARG 133 11.745 -2.071 -5.600 1048 HE ARG 133 HE ARG 133 9.949 -4.091 -4.825 1049 HH11 ARG 133 1HH1 ARG 133 11.123 -0.959 -3.756 1050 HH12 ARG 133 2HH1 ARG 133 9.667 -0.546 -2.913 1051 HH21 ARG 133 1HH2 ARG 133 8.009 -3.535 -3.698 1052 HH22 ARG 133 2HH2 ARG 133 7.894 -2.012 -2.885 1053 H ASP 134 H ASP 134 15.492 -5.385 -7.378 1054 HA ASP 134 HA ASP 134 17.828 -5.708 -5.889 1055 HB2 ASP 134 2HB ASP 134 17.313 -3.622 -8.054 1056 HB3 ASP 134 3HB ASP 134 18.899 -4.132 -7.491 1057 HA PRO 135 HA PRO 135 18.034 -2.439 -2.753 1058 HB2 PRO 135 2HB PRO 135 20.764 -1.743 -3.132 1059 HB3 PRO 135 3HB PRO 135 20.146 -2.994 -2.045 1060 HG2 PRO 135 2HG PRO 135 21.249 -3.270 -4.805 1061 HG3 PRO 135 3HG PRO 135 21.440 -4.341 -3.397 1062 HD2 PRO 135 2HD PRO 135 19.779 -4.999 -5.378 1063 HD3 PRO 135 3HD PRO 135 19.330 -5.320 -3.689 1064 H LYS 136 H LYS 136 19.029 -1.746 -6.059 1065 HA LYS 136 HA LYS 136 19.142 1.106 -5.851 1066 HB2 LYS 136 2HB LYS 136 19.177 1.089 -8.317 1067 HB3 LYS 136 3HB LYS 136 20.263 -0.136 -7.673 1068 HG2 LYS 136 2HG LYS 136 18.343 -1.805 -8.068 1069 HG3 LYS 136 3HG LYS 136 17.574 -0.520 -8.996 1070 HD2 LYS 136 2HD LYS 136 18.712 -1.912 -10.575 1071 HD3 LYS 136 3HD LYS 136 19.673 -0.437 -10.440 1072 HE2 LYS 136 2HE LYS 136 21.176 -1.650 -8.832 1073 HE3 LYS 136 3HE LYS 136 20.247 -3.120 -9.144 1074 HZ1 LYS 136 3HZ LYS 136 20.919 -3.064 -11.423 1075 HZ2 LYS 136 1HZ LYS 136 22.301 -2.956 -10.457 1076 HZ3 LYS 136 2HZ LYS 136 21.698 -1.576 -11.226 1077 H TYR 137 H TYR 137 16.513 -1.167 -6.432 1078 HA TYR 137 HA TYR 137 14.506 0.930 -6.928 1079 HB2 TYR 137 2HB TYR 137 14.186 -2.105 -6.764 1080 HB3 TYR 137 3HB TYR 137 12.935 -0.968 -7.256 1081 HD1 TYR 137 HD2 TYR 137 13.336 0.400 -9.409 1082 HD2 TYR 137 HD1 TYR 137 15.667 -3.029 -8.388 1083 HE1 TYR 137 HE2 TYR 137 14.046 0.185 -11.742 1084 HE2 TYR 137 HE1 TYR 137 16.391 -3.240 -10.728 1085 HH TYR 137 HH TYR 137 15.632 -2.570 -12.968 1086 H LEU 138 H LEU 138 15.818 -0.854 -4.314 1087 HA LEU 138 HA LEU 138 13.553 -0.807 -2.544 1088 HB2 LEU 138 2HB LEU 138 16.526 -1.260 -2.073 1089 HB3 LEU 138 3HB LEU 138 15.341 -1.314 -0.780 1090 HG LEU 138 HG LEU 138 15.465 -3.201 -3.164 1091 HD11 LEU 138 1HD1 LEU 138 17.235 -3.638 -1.521 1092 HD12 LEU 138 2HD1 LEU 138 16.047 -4.938 -1.526 1093 HD13 LEU 138 3HD1 LEU 138 16.038 -3.741 -0.226 1094 HD21 LEU 138 3HD2 LEU 138 13.129 -2.788 -2.520 1095 HD22 LEU 138 1HD2 LEU 138 13.495 -3.216 -0.847 1096 HD23 LEU 138 2HD2 LEU 138 13.612 -4.433 -2.123 1097 H HIS 139 H HIS 139 12.746 1.013 -1.723 1098 HA HIS 139 HA HIS 139 14.468 3.000 -0.432 1099 HB2 HIS 139 2HB HIS 139 14.115 3.942 -2.688 1100 HB3 HIS 139 3HB HIS 139 12.378 3.709 -2.552 1101 HD1 HIS 139 HD1 HIS 139 11.055 5.538 -1.431 1102 HD2 HIS 139 HD2 HIS 139 15.150 6.097 -1.057 1103 HE1 HIS 139 HE1 HIS 139 11.328 7.841 -0.491 1104 HE2 HIS 139 HE2 HIS 139 13.797 8.085 -0.101 1105 H GLN 140 H GLN 140 13.499 3.767 1.471 1106 HA GLN 140 HA GLN 140 11.176 2.324 2.425 1107 HB2 GLN 140 2HB GLN 140 12.769 4.533 3.806 1108 HB3 GLN 140 3HB GLN 140 11.550 3.521 4.565 1109 HG2 GLN 140 2HG GLN 140 13.335 2.312 5.258 1110 HG3 GLN 140 3HG GLN 140 13.219 1.581 3.668 1111 HE21 GLN 140 1HE2 GLN 140 15.502 1.760 5.380 1112 HE22 GLN 140 2HE2 GLN 140 16.722 2.605 4.498 1113 H PHE 141 H PHE 141 9.180 3.209 3.104 1114 HA PHE 141 HA PHE 141 8.096 5.547 1.929 1115 HB2 PHE 141 2HB PHE 141 7.129 4.240 4.516 1116 HB3 PHE 141 3HB PHE 141 6.183 5.222 3.409 1117 HD1 PHE 141 HD1 PHE 141 5.461 4.263 1.210 1118 HD2 PHE 141 HD2 PHE 141 7.414 1.863 4.167 1119 HE1 PHE 141 HE1 PHE 141 4.640 2.227 0.119 1120 HE2 PHE 141 HE2 PHE 141 6.587 -0.168 3.056 1121 HZ PHE 141 HZ PHE 141 5.199 0.012 1.027 1122 H GLU 142 H GLU 142 9.164 7.487 2.363 1123 HA GLU 142 HA GLU 142 10.248 8.184 4.909 1124 HB2 GLU 142 2HB GLU 142 9.585 9.935 2.504 1125 HB3 GLU 142 3HB GLU 142 10.491 10.479 3.916 1126 HG2 GLU 142 2HG GLU 142 12.206 8.740 3.462 1127 HG3 GLU 142 3HG GLU 142 11.323 8.262 2.017 1128 H GLY 143 H GLY 143 8.975 8.267 6.609 1129 HA2 GLY 143 2HA GLY 143 6.149 8.228 6.362 1130 HA3 GLY 143 3HA GLY 143 7.079 8.092 7.834 1131 H GLU 144 H GLU 144 5.039 10.082 6.033 1132 HA GLU 144 HA GLU 144 5.137 12.071 8.223 1133 HB2 GLU 144 2HB GLU 144 4.123 12.412 5.360 1134 HB3 GLU 144 3HB GLU 144 3.767 13.554 6.656 1135 HG2 GLU 144 2HG GLU 144 6.251 13.883 6.960 1136 HG3 GLU 144 3HG GLU 144 6.502 12.885 5.529 1137 H THR 145 H THR 145 2.920 10.416 5.965 1138 HA THR 145 HA THR 145 1.138 9.614 8.129 1139 HB THR 145 HB THR 145 0.111 11.355 5.819 1140 HG1 THR 145 HG1 THR 145 0.732 11.849 8.493 1141 HG21 THR 145 3HG2 THR 145 -1.547 9.609 6.403 1142 HG22 THR 145 1HG2 THR 145 -2.102 11.199 6.927 1143 HG23 THR 145 2HG2 THR 145 -1.439 10.065 8.104 1144 H PHE 146 H PHE 146 0.628 7.496 7.704 1145 HA PHE 146 HA PHE 146 1.175 6.359 5.067 1146 HB2 PHE 146 2HB PHE 146 0.648 5.211 7.818 1147 HB3 PHE 146 3HB PHE 146 0.324 4.186 6.428 1148 HD1 PHE 146 HD2 PHE 146 3.023 5.982 8.266 1149 HD2 PHE 146 HD1 PHE 146 2.120 3.232 5.116 1150 HE1 PHE 146 HE2 PHE 146 5.403 5.352 8.123 1151 HE2 PHE 146 HE1 PHE 146 4.496 2.616 4.978 1152 HZ PHE 146 HZ PHE 146 6.139 3.667 6.475 1153 H TYR 147 H TYR 147 -0.286 6.074 3.567 1154 HA TYR 147 HA TYR 147 -3.184 6.055 4.169 1155 HB2 TYR 147 2HB TYR 147 -1.643 6.797 1.639 1156 HB3 TYR 147 3HB TYR 147 -3.381 6.517 1.635 1157 HD1 TYR 147 HD1 TYR 147 -0.805 8.603 3.438 1158 HD2 TYR 147 HD2 TYR 147 -4.793 8.375 1.932 1159 HE1 TYR 147 HE1 TYR 147 -1.176 10.951 4.050 1160 HE2 TYR 147 HE2 TYR 147 -5.157 10.724 2.544 1161 HH TYR 147 HH TYR 147 -2.610 12.822 3.444 1162 H ILE 148 H ILE 148 -4.174 4.159 4.008 1163 HA ILE 148 HA ILE 148 -3.028 1.982 2.356 1164 HB ILE 148 HB ILE 148 -4.947 1.805 4.733 1165 HG12 ILE 148 2HG1 ILE 148 -2.020 0.951 4.446 1166 HG13 ILE 148 3HG1 ILE 148 -2.618 2.276 5.435 1167 HG21 ILE 148 1HG2 ILE 148 -3.797 -0.459 3.051 1168 HG22 ILE 148 2HG2 ILE 148 -5.480 0.075 3.049 1169 HG23 ILE 148 3HG2 ILE 148 -4.787 -0.648 4.498 1170 HD11 ILE 148 3HD1 ILE 148 -2.046 0.391 6.810 1171 HD12 ILE 148 1HD1 ILE 148 -3.115 -0.665 5.887 1172 HD13 ILE 148 2HD1 ILE 148 -3.790 0.643 6.863 1173 H ILE 149 H ILE 149 -3.929 2.027 0.422 1174 HA ILE 149 HA ILE 149 -6.710 2.862 -0.026 1175 HB ILE 149 HB ILE 149 -4.534 2.170 -2.063 1176 HG12 ILE 149 2HG1 ILE 149 -3.799 4.117 -0.791 1177 HG13 ILE 149 3HG1 ILE 149 -4.315 4.656 -2.381 1178 HG21 ILE 149 1HG2 ILE 149 -7.205 3.576 -2.473 1179 HG22 ILE 149 2HG2 ILE 149 -6.795 1.944 -3.005 1180 HG23 ILE 149 3HG2 ILE 149 -5.969 3.333 -3.709 1181 HD11 ILE 149 3HD1 ILE 149 -5.031 6.210 -0.675 1182 HD12 ILE 149 1HD1 ILE 149 -5.882 4.930 0.190 1183 HD13 ILE 149 2HD1 ILE 149 -6.440 5.443 -1.404 1184 H GLU 150 H GLU 150 -8.266 1.413 -0.415 1185 HA GLU 150 HA GLU 150 -7.659 -1.449 -0.314 1186 HB2 GLU 150 2HB GLU 150 -9.301 -0.582 1.253 1187 HB3 GLU 150 3HB GLU 150 -10.231 0.160 -0.043 1188 HG2 GLU 150 2HG GLU 150 -10.829 -2.077 -0.898 1189 HG3 GLU 150 3HG GLU 150 -9.871 -2.822 0.381 1190 H GLN 151 H GLN 151 -7.421 -2.520 -2.167 1191 HA GLN 151 HA GLN 151 -9.115 -1.911 -4.528 1192 HB2 GLN 151 2HB GLN 151 -6.592 -3.658 -4.382 1193 HB3 GLN 151 3HB GLN 151 -7.520 -3.306 -5.832 1194 HG2 GLN 151 2HG GLN 151 -5.598 -1.946 -5.963 1195 HG3 GLN 151 3HG GLN 151 -6.907 -0.860 -5.501 1196 HE21 GLN 151 1HE2 GLN 151 -5.568 0.657 -4.571 1197 HE22 GLN 151 2HE2 GLN 151 -4.701 0.385 -3.107 1198 H ARG 152 H ARG 152 -11.022 -3.045 -3.987 1199 HA ARG 152 HA ARG 152 -10.908 -5.888 -3.319 1200 HB2 ARG 152 2HB ARG 152 -13.318 -4.170 -4.060 1201 HB3 ARG 152 3HB ARG 152 -13.379 -5.833 -3.472 1202 HG2 ARG 152 2HG ARG 152 -12.252 -5.045 -1.354 1203 HG3 ARG 152 3HG ARG 152 -12.426 -3.396 -1.953 1204 HD2 ARG 152 2HD ARG 152 -14.911 -3.748 -2.022 1205 HD3 ARG 152 3HD ARG 152 -14.661 -5.337 -1.283 1206 HE ARG 152 HE ARG 152 -13.614 -2.949 0.049 1207 HH11 ARG 152 1HH1 ARG 152 -16.002 -5.528 0.131 1208 HH12 ARG 152 2HH1 ARG 152 -16.412 -5.235 1.789 1209 HH21 ARG 152 1HH2 ARG 152 -14.077 -2.624 2.192 1210 HH22 ARG 152 2HH2 ARG 152 -15.307 -3.575 2.962 1211 H LEU 153 H LEU 153 -11.465 -7.583 -4.788 1212 HA LEU 153 HA LEU 153 -10.582 -7.276 -7.435 1213 HB2 LEU 153 2HB LEU 153 -12.179 -9.504 -6.136 1214 HB3 LEU 153 3HB LEU 153 -11.682 -9.582 -7.822 1215 HG LEU 153 HG LEU 153 -9.835 -9.472 -5.406 1216 HD11 LEU 153 1HD1 LEU 153 -10.908 -11.653 -5.735 1217 HD12 LEU 153 2HD1 LEU 153 -9.179 -11.734 -6.056 1218 HD13 LEU 153 3HD1 LEU 153 -10.322 -11.706 -7.401 1219 HD21 LEU 153 3HD2 LEU 153 -7.963 -9.719 -7.004 1220 HD22 LEU 153 1HD2 LEU 153 -8.825 -8.202 -7.251 1221 HD23 LEU 153 2HD2 LEU 153 -9.082 -9.551 -8.358 1222 H GLU 154 H GLU 154 -11.665 -7.487 -9.394 1223 HA GLU 154 HA GLU 154 -13.830 -5.743 -9.733 1224 HB2 GLU 154 2HB GLU 154 -13.668 -6.476 -12.152 1225 HB3 GLU 154 3HB GLU 154 -12.173 -5.902 -11.433 1226 HG2 GLU 154 2HG GLU 154 -11.532 -8.309 -11.062 1227 HG3 GLU 154 3HG GLU 154 -12.924 -8.770 -12.037 1228 H HIS 155 H HIS 155 -15.748 -6.273 -8.890 1229 HA HIS 155 HA HIS 155 -17.186 -8.693 -9.058 1230 HB2 HIS 155 2HB HIS 155 -19.197 -7.312 -8.562 1231 HB3 HIS 155 3HB HIS 155 -17.852 -6.929 -7.497 1232 HD1 HIS 155 HD1 HIS 155 -20.407 -5.099 -8.462 1233 HD2 HIS 155 HD2 HIS 155 -16.388 -4.673 -9.471 1234 HE1 HIS 155 HE1 HIS 155 -20.101 -2.668 -9.003 1235 HE2 HIS 155 HE2 HIS 155 -17.637 -2.411 -9.436 1236 H HIS 156 H HIS 156 -16.380 -6.459 -11.519 1237 HA HIS 156 HA HIS 156 -18.032 -7.986 -13.436 1238 HB2 HIS 156 2HB HIS 156 -18.033 -6.000 -14.927 1239 HB3 HIS 156 3HB HIS 156 -18.822 -5.657 -13.393 1240 HD1 HIS 156 HD1 HIS 156 -15.848 -4.728 -15.462 1241 HD2 HIS 156 HD2 HIS 156 -17.509 -3.733 -11.785 1242 HE1 HIS 156 HE1 HIS 156 -14.630 -2.667 -14.705 1243 HE2 HIS 156 HE2 HIS 156 -15.749 -2.005 -12.553 1244 H HIS 157 H HIS 157 -16.685 -9.420 -14.377 1245 HA HIS 157 HA HIS 157 -13.884 -9.176 -14.669 1246 HB2 HIS 157 2HB HIS 157 -14.030 -11.123 -16.189 1247 HB3 HIS 157 3HB HIS 157 -15.038 -11.378 -14.770 1248 HD1 HIS 157 HD1 HIS 157 -15.103 -11.705 -18.338 1249 HD2 HIS 157 HD2 HIS 157 -17.924 -10.783 -15.435 1250 HE1 HIS 157 HE1 HIS 157 -17.334 -12.135 -19.402 1251 HE2 HIS 157 HE2 HIS 157 -19.008 -11.736 -17.572 1252 H HIS 158 H HIS 158 -12.617 -8.190 -16.267 1253 HA HIS 158 HA HIS 158 -14.091 -6.627 -18.322 1254 HB2 HIS 158 2HB HIS 158 -12.399 -4.950 -18.228 1255 HB3 HIS 158 3HB HIS 158 -12.739 -5.364 -16.562 1256 HD1 HIS 158 HD1 HIS 158 -10.818 -6.560 -15.222 1257 HD2 HIS 158 HD2 HIS 158 -9.768 -5.411 -19.070 1258 HE1 HIS 158 HE1 HIS 158 -8.315 -6.688 -15.299 1259 HE2 HIS 158 HE2 HIS 158 -7.704 -6.006 -17.650 1260 H HIS 159 H HIS 159 -13.874 -7.153 -20.405 1261 HA HIS 159 HA HIS 159 -11.496 -8.656 -21.332 1262 HB2 HIS 159 2HB HIS 159 -14.240 -8.293 -22.600 1263 HB3 HIS 159 3HB HIS 159 -12.864 -8.932 -23.494 1264 HD1 HIS 159 HD1 HIS 159 -15.716 -10.143 -21.887 1265 HD2 HIS 159 HD2 HIS 159 -11.726 -11.286 -21.784 1266 HE1 HIS 159 HE1 HIS 159 -15.731 -12.542 -21.150 1267 HE2 HIS 159 HE2 HIS 159 -13.312 -13.228 -21.158 1268 H HIS 160 H HIS 160 -10.333 -6.625 -20.956 1269 HA HIS 160 HA HIS 160 -9.902 -5.316 -23.497 1270 HB2 HIS 160 2HB HIS 160 -11.530 -3.746 -22.431 1271 HB3 HIS 160 3HB HIS 160 -10.479 -3.607 -21.024 1272 HD1 HIS 160 HD1 HIS 160 -8.346 -2.148 -21.276 1273 HD2 HIS 160 HD2 HIS 160 -10.654 -2.317 -24.726 1274 HE1 HIS 160 HE1 HIS 160 -7.442 -0.355 -22.778 1275 HE2 HIS 160 HE2 HIS 160 -8.968 -0.357 -24.773
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