NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
26086 | 2keq | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -1 H GLY -1 0.991 -0.408 -0.691 2 HA2 GLY -1 HA2 GLY -1 -1.377 -0.596 -0.673 3 HA3 GLY -1 HA3 GLY -1 -1.415 0.632 0.609 4 H GLY 0 H GLY 0 0.308 0.835 -2.554 5 HA2 GLY 0 HA2 GLY 0 0.249 2.418 -4.178 6 HA3 GLY 0 HA3 GLY 0 -1.455 2.600 -3.814 7 H ALA 1 H ALA 1 -0.865 4.779 -4.562 8 HA ALA 1 HA ALA 1 -0.900 6.508 -2.218 9 HB1 ALA 1 HB1 ALA 1 1.452 6.386 -2.407 10 HB2 ALA 1 HB2 ALA 1 1.398 6.541 -4.178 11 HB3 ALA 1 HB3 ALA 1 0.992 7.913 -3.123 12 H LEU 2 H LEU 2 -1.137 8.817 -2.898 13 HA LEU 2 HA LEU 2 -3.055 9.089 -5.188 14 HB2 LEU 2 HB2 LEU 2 -2.992 10.319 -2.405 15 HB3 LEU 2 HB3 LEU 2 -4.183 10.692 -3.637 16 HG LEU 2 HG LEU 2 -3.856 7.828 -2.683 17 HD11 LEU 2 HD11 LEU 2 -4.108 9.180 -0.661 18 HD12 LEU 2 HD12 LEU 2 -5.579 9.921 -1.322 19 HD13 LEU 2 HD13 LEU 2 -5.528 8.178 -0.983 20 HD21 LEU 2 HD21 LEU 2 -6.280 9.378 -3.673 21 HD22 LEU 2 HD22 LEU 2 -5.283 8.285 -4.651 22 HD23 LEU 2 HD23 LEU 2 -6.204 7.648 -3.278 23 H SER 3 H SER 3 -3.053 11.117 -6.282 24 HA SER 3 HA SER 3 -0.407 12.292 -6.576 25 HB2 SER 3 HB2 SER 3 -2.301 11.916 -8.325 26 HB3 SER 3 HB3 SER 3 -2.941 13.456 -7.724 27 HG SER 3 HG SER 3 -1.371 14.447 -8.657 28 H TYR 4 H TYR 4 -0.031 14.738 -6.560 29 HA TYR 4 HA TYR 4 -0.356 15.808 -3.969 30 HB2 TYR 4 HB2 TYR 4 1.334 16.607 -5.525 31 HB3 TYR 4 HB3 TYR 4 0.108 17.203 -6.634 32 HD1 TYR 4 HD1 TYR 4 -1.222 19.220 -6.119 33 HD2 TYR 4 HD2 TYR 4 1.933 17.881 -3.504 34 HE1 TYR 4 HE1 TYR 4 -1.314 21.389 -4.905 35 HE2 TYR 4 HE2 TYR 4 1.848 20.056 -2.287 36 HH TYR 4 HH TYR 4 -0.450 22.640 -3.237 37 H GLU 5 H GLU 5 -2.284 16.451 -6.901 38 HA GLU 5 HA GLU 5 -4.016 18.414 -5.814 39 HB2 GLU 5 HB2 GLU 5 -5.385 17.964 -7.802 40 HB3 GLU 5 HB3 GLU 5 -3.688 18.173 -8.190 41 HG2 GLU 5 HG2 GLU 5 -4.590 15.335 -7.773 42 HG3 GLU 5 HG3 GLU 5 -5.282 16.175 -9.156 43 H THR 6 H THR 6 -4.006 15.111 -4.953 44 HA THR 6 HA THR 6 -6.876 14.749 -4.563 45 HB THR 6 HB THR 6 -4.538 13.288 -3.279 46 HG1 THR 6 HG1 THR 6 -6.072 12.676 -5.593 47 HG21 THR 6 HG21 THR 6 -6.952 13.033 -2.305 48 HG22 THR 6 HG22 THR 6 -7.306 12.156 -3.807 49 HG23 THR 6 HG23 THR 6 -6.039 11.593 -2.702 50 H GLU 7 H GLU 7 -7.972 16.028 -3.150 51 HA GLU 7 HA GLU 7 -6.592 17.125 -0.794 52 HB2 GLU 7 HB2 GLU 7 -9.464 17.562 -1.602 53 HB3 GLU 7 HB3 GLU 7 -8.512 18.490 -0.445 54 HG2 GLU 7 HG2 GLU 7 -6.934 19.060 -2.380 55 HG3 GLU 7 HG3 GLU 7 -8.154 18.383 -3.464 56 H ILE 8 H ILE 8 -6.839 16.557 1.242 57 HA ILE 8 HA ILE 8 -8.696 14.337 2.003 58 HB ILE 8 HB ILE 8 -6.188 15.322 3.425 59 HG12 ILE 8 HG12 ILE 8 -5.363 14.440 1.410 60 HG13 ILE 8 HG13 ILE 8 -5.073 13.245 2.662 61 HG21 ILE 8 HG21 ILE 8 -7.655 14.228 4.975 62 HG22 ILE 8 HG22 ILE 8 -7.960 12.885 3.857 63 HG23 ILE 8 HG23 ILE 8 -6.362 13.093 4.595 64 HD11 ILE 8 HD11 ILE 8 -5.790 11.931 0.864 65 HD12 ILE 8 HD12 ILE 8 -7.310 12.142 1.747 66 HD13 ILE 8 HD13 ILE 8 -6.951 13.137 0.316 67 H LEU 9 H LEU 9 -10.403 14.952 3.204 68 HA LEU 9 HA LEU 9 -10.692 17.554 4.427 69 HB2 LEU 9 HB2 LEU 9 -12.569 15.987 3.707 70 HB3 LEU 9 HB3 LEU 9 -12.146 14.955 5.072 71 HG LEU 9 HG LEU 9 -12.581 17.023 6.572 72 HD11 LEU 9 HD11 LEU 9 -12.575 18.759 4.799 73 HD12 LEU 9 HD12 LEU 9 -14.004 17.995 4.065 74 HD13 LEU 9 HD13 LEU 9 -14.107 18.718 5.679 75 HD21 LEU 9 HD21 LEU 9 -14.906 15.860 4.972 76 HD22 LEU 9 HD22 LEU 9 -14.144 15.106 6.387 77 HD23 LEU 9 HD23 LEU 9 -15.012 16.635 6.571 78 H THR 10 H THR 10 -10.014 18.311 6.337 79 HA THR 10 HA THR 10 -9.087 16.444 8.460 80 HB THR 10 HB THR 10 -7.191 17.921 8.942 81 HG1 THR 10 HG1 THR 10 -7.845 19.191 6.502 82 HG21 THR 10 HG21 THR 10 -6.723 16.010 7.510 83 HG22 THR 10 HG22 THR 10 -7.160 16.937 6.061 84 HG23 THR 10 HG23 THR 10 -5.745 17.403 7.022 85 H VAL 11 H VAL 11 -9.171 17.157 10.590 86 HA VAL 11 HA VAL 11 -11.346 19.041 11.129 87 HB VAL 11 HB VAL 11 -9.505 17.682 13.117 88 HG11 VAL 11 HG11 VAL 11 -10.752 19.475 14.196 89 HG12 VAL 11 HG12 VAL 11 -12.271 18.909 13.461 90 HG13 VAL 11 HG13 VAL 11 -11.434 17.927 14.684 91 HG21 VAL 11 HG21 VAL 11 -12.238 16.757 12.139 92 HG22 VAL 11 HG22 VAL 11 -10.706 15.985 11.691 93 HG23 VAL 11 HG23 VAL 11 -11.237 15.972 13.374 94 H GLU 12 H GLU 12 -7.837 19.166 11.312 95 HA GLU 12 HA GLU 12 -7.648 21.569 12.902 96 HB2 GLU 12 HB2 GLU 12 -5.822 19.940 11.159 97 HB3 GLU 12 HB3 GLU 12 -5.288 21.560 11.607 98 HG2 GLU 12 HG2 GLU 12 -6.076 19.376 13.577 99 HG3 GLU 12 HG3 GLU 12 -4.428 19.836 13.150 100 H TYR 13 H TYR 13 -8.046 21.109 9.411 101 HA TYR 13 HA TYR 13 -8.175 24.084 9.082 102 HB2 TYR 13 HB2 TYR 13 -6.537 22.138 7.414 103 HB3 TYR 13 HB3 TYR 13 -6.902 23.783 6.926 104 HD1 TYR 13 HD1 TYR 13 -6.396 25.568 9.025 105 HD2 TYR 13 HD2 TYR 13 -4.305 21.902 8.109 106 HE1 TYR 13 HE1 TYR 13 -4.340 26.467 10.105 107 HE2 TYR 13 HE2 TYR 13 -2.247 22.814 9.163 108 HH TYR 13 HH TYR 13 -1.293 24.597 10.226 109 H GLY 14 H GLY 14 -8.753 20.955 7.356 110 HA2 GLY 14 HA2 GLY 14 -11.214 20.850 6.513 111 HA3 GLY 14 HA3 GLY 14 -10.790 22.336 5.665 112 H LEU 15 H LEU 15 -11.061 21.483 3.647 113 HA LEU 15 HA LEU 15 -9.765 19.092 2.622 114 HB2 LEU 15 HB2 LEU 15 -10.983 21.532 1.249 115 HB3 LEU 15 HB3 LEU 15 -10.513 20.044 0.435 116 HG LEU 15 HG LEU 15 -12.684 20.250 2.580 117 HD11 LEU 15 HD11 LEU 15 -13.337 21.394 0.519 118 HD12 LEU 15 HD12 LEU 15 -12.884 19.967 -0.437 119 HD13 LEU 15 HD13 LEU 15 -14.244 19.886 0.711 120 HD21 LEU 15 HD21 LEU 15 -11.769 17.960 0.799 121 HD22 LEU 15 HD22 LEU 15 -11.715 18.024 2.556 122 HD23 LEU 15 HD23 LEU 15 -13.280 17.961 1.747 123 H LEU 16 H LEU 16 -7.552 19.023 2.703 124 HA LEU 16 HA LEU 16 -6.057 21.127 1.202 125 HB2 LEU 16 HB2 LEU 16 -5.369 19.772 3.838 126 HB3 LEU 16 HB3 LEU 16 -4.147 20.561 2.853 127 HG LEU 16 HG LEU 16 -6.571 21.959 4.070 128 HD11 LEU 16 HD11 LEU 16 -4.889 21.251 5.712 129 HD12 LEU 16 HD12 LEU 16 -3.601 22.021 4.758 130 HD13 LEU 16 HD13 LEU 16 -4.864 23.015 5.511 131 HD21 LEU 16 HD21 LEU 16 -4.188 23.059 2.503 132 HD22 LEU 16 HD22 LEU 16 -5.898 23.114 2.011 133 HD23 LEU 16 HD23 LEU 16 -5.360 24.044 3.406 134 HA PRO 17 HA PRO 17 -4.468 17.892 -1.288 135 HB2 PRO 17 HB2 PRO 17 -1.993 18.870 -2.033 136 HB3 PRO 17 HB3 PRO 17 -3.557 19.482 -2.657 137 HG2 PRO 17 HG2 PRO 17 -1.849 20.600 -0.431 138 HG3 PRO 17 HG3 PRO 17 -2.628 21.484 -1.781 139 HD2 PRO 17 HD2 PRO 17 -3.727 21.381 0.696 140 HD3 PRO 17 HD3 PRO 17 -4.752 21.325 -0.767 141 H ILE 18 H ILE 18 -3.734 15.918 -0.739 142 HA ILE 18 HA ILE 18 -2.344 15.308 1.623 143 HB ILE 18 HB ILE 18 -3.697 13.712 0.261 144 HG12 ILE 18 HG12 ILE 18 -0.915 12.712 1.001 145 HG13 ILE 18 HG13 ILE 18 -2.218 13.043 2.149 146 HG21 ILE 18 HG21 ILE 18 -2.644 14.234 -1.965 147 HG22 ILE 18 HG22 ILE 18 -1.235 13.276 -1.460 148 HG23 ILE 18 HG23 ILE 18 -2.829 12.522 -1.604 149 HD11 ILE 18 HD11 ILE 18 -3.610 11.295 1.001 150 HD12 ILE 18 HD12 ILE 18 -2.201 10.900 -0.011 151 HD13 ILE 18 HD13 ILE 18 -2.129 10.676 1.744 152 H GLY 19 H GLY 19 -0.981 16.040 -1.578 153 HA2 GLY 19 HA2 GLY 19 1.661 15.111 -1.037 154 HA3 GLY 19 HA3 GLY 19 1.212 16.318 -2.251 155 H LYS 20 H LYS 20 0.082 18.226 -0.230 156 HA LYS 20 HA LYS 20 2.611 19.468 0.589 157 HB2 LYS 20 HB2 LYS 20 0.638 20.761 -0.209 158 HB3 LYS 20 HB3 LYS 20 -0.263 20.262 1.233 159 HG2 LYS 20 HG2 LYS 20 1.220 21.448 2.691 160 HG3 LYS 20 HG3 LYS 20 2.399 21.740 1.408 161 HD2 LYS 20 HD2 LYS 20 -0.437 22.841 1.285 162 HD3 LYS 20 HD3 LYS 20 0.877 23.699 2.110 163 HE2 LYS 20 HE2 LYS 20 2.208 23.798 0.081 164 HE3 LYS 20 HE3 LYS 20 1.054 22.787 -0.790 165 HZ1 LYS 20 HZ1 LYS 20 -0.596 24.567 -0.555 166 HZ2 LYS 20 HZ2 LYS 20 0.467 25.505 0.264 167 HZ3 LYS 20 HZ3 LYS 20 0.739 25.139 -1.302 168 H ILE 21 H ILE 21 0.106 17.521 2.135 169 HA ILE 21 HA ILE 21 0.916 18.010 4.850 170 HB ILE 21 HB ILE 21 -0.487 15.589 3.704 171 HG12 ILE 21 HG12 ILE 21 -1.767 18.025 5.047 172 HG13 ILE 21 HG13 ILE 21 -1.644 17.864 3.308 173 HG21 ILE 21 HG21 ILE 21 0.345 15.070 5.916 174 HG22 ILE 21 HG22 ILE 21 -0.399 16.546 6.570 175 HG23 ILE 21 HG23 ILE 21 -1.403 15.225 5.962 176 HD11 ILE 21 HD11 ILE 21 -3.681 16.972 3.418 177 HD12 ILE 21 HD12 ILE 21 -2.858 15.479 3.896 178 HD13 ILE 21 HD13 ILE 21 -3.535 16.557 5.139 179 H VAL 22 H VAL 22 1.939 15.656 2.388 180 HA VAL 22 HA VAL 22 3.824 14.370 4.256 181 HB VAL 22 HB VAL 22 3.264 13.923 1.307 182 HG11 VAL 22 HG11 VAL 22 5.528 13.099 1.965 183 HG12 VAL 22 HG12 VAL 22 4.792 12.155 3.276 184 HG13 VAL 22 HG13 VAL 22 4.414 11.798 1.581 185 HG21 VAL 22 HG21 VAL 22 2.311 12.520 3.859 186 HG22 VAL 22 HG22 VAL 22 1.304 13.369 2.669 187 HG23 VAL 22 HG23 VAL 22 2.094 11.847 2.242 188 H GLU 23 H GLU 23 4.123 16.605 1.429 189 HA GLU 23 HA GLU 23 7.018 16.581 1.441 190 HB2 GLU 23 HB2 GLU 23 5.009 18.597 0.356 191 HB3 GLU 23 HB3 GLU 23 6.754 18.782 0.209 192 HG2 GLU 23 HG2 GLU 23 6.879 16.565 -0.955 193 HG3 GLU 23 HG3 GLU 23 5.121 16.529 -1.002 194 H LYS 24 H LYS 24 4.667 18.349 3.344 195 HA LYS 24 HA LYS 24 6.860 19.926 4.655 196 HB2 LYS 24 HB2 LYS 24 3.898 20.554 4.650 197 HB3 LYS 24 HB3 LYS 24 5.193 21.580 5.231 198 HG2 LYS 24 HG2 LYS 24 4.695 20.805 2.323 199 HG3 LYS 24 HG3 LYS 24 4.232 22.319 3.101 200 HD2 LYS 24 HD2 LYS 24 6.677 22.754 3.585 201 HD3 LYS 24 HD3 LYS 24 7.068 21.337 2.582 202 HE2 LYS 24 HE2 LYS 24 5.874 22.367 0.662 203 HE3 LYS 24 HE3 LYS 24 5.439 23.754 1.668 204 HZ1 LYS 24 HZ1 LYS 24 7.820 24.251 1.897 205 HZ2 LYS 24 HZ2 LYS 24 8.216 22.987 0.935 206 HZ3 LYS 24 HZ3 LYS 24 7.383 24.253 0.326 207 H ARG 25 H ARG 25 5.212 17.187 5.179 208 HA ARG 25 HA ARG 25 4.585 15.882 6.933 209 HB2 ARG 25 HB2 ARG 25 6.907 17.225 8.358 210 HB3 ARG 25 HB3 ARG 25 6.195 15.647 8.701 211 HG2 ARG 25 HG2 ARG 25 7.754 14.767 7.333 212 HG3 ARG 25 HG3 ARG 25 6.782 15.387 6.010 213 HD2 ARG 25 HD2 ARG 25 8.882 16.228 5.472 214 HD3 ARG 25 HD3 ARG 25 8.163 17.596 6.302 215 HE ARG 25 HE ARG 25 9.660 17.330 8.085 216 HH11 ARG 25 HH11 ARG 25 10.007 14.530 5.985 217 HH12 ARG 25 HH12 ARG 25 11.457 13.998 6.796 218 HH21 ARG 25 HH21 ARG 25 11.507 16.577 9.068 219 HH22 ARG 25 HH22 ARG 25 12.272 15.123 8.486 220 H ILE 26 H ILE 26 2.738 17.624 6.765 221 HA ILE 26 HA ILE 26 2.378 19.342 9.123 222 HB ILE 26 HB ILE 26 0.450 18.641 6.873 223 HG12 ILE 26 HG12 ILE 26 2.101 21.174 7.304 224 HG13 ILE 26 HG13 ILE 26 2.559 19.871 6.213 225 HG21 ILE 26 HG21 ILE 26 -0.783 19.371 8.879 226 HG22 ILE 26 HG22 ILE 26 0.263 20.801 9.022 227 HG23 ILE 26 HG23 ILE 26 -0.850 20.616 7.651 228 HD11 ILE 26 HD11 ILE 26 0.546 20.231 4.846 229 HD12 ILE 26 HD12 ILE 26 0.079 21.595 5.892 230 HD13 ILE 26 HD13 ILE 26 1.575 21.669 4.957 231 H GLU 27 H GLU 27 1.353 18.827 10.970 232 HA GLU 27 HA GLU 27 0.070 16.165 11.221 233 HB2 GLU 27 HB2 GLU 27 0.077 16.828 13.728 234 HB3 GLU 27 HB3 GLU 27 1.493 16.176 12.931 235 HG2 GLU 27 HG2 GLU 27 2.204 17.907 14.372 236 HG3 GLU 27 HG3 GLU 27 2.488 18.393 12.710 237 H CYS 28 H CYS 28 -1.905 15.850 11.563 238 HA CYS 28 HA CYS 28 -3.881 17.858 12.272 239 HB2 CYS 28 HB2 CYS 28 -5.088 17.758 10.075 240 HB3 CYS 28 HB3 CYS 28 -3.512 18.530 9.954 241 HG CYS 28 HG CYS 28 -2.208 16.477 9.035 242 H THR 29 H THR 29 -6.135 16.946 11.872 243 HA THR 29 HA THR 29 -6.271 14.040 12.569 244 HB THR 29 HB THR 29 -8.631 15.830 12.817 245 HG1 THR 29 HG1 THR 29 -6.565 15.898 14.742 246 HG21 THR 29 HG21 THR 29 -8.784 13.494 13.488 247 HG22 THR 29 HG22 THR 29 -7.519 13.751 14.724 248 HG23 THR 29 HG23 THR 29 -9.085 14.584 14.848 249 H VAL 30 H VAL 30 -7.757 12.738 11.423 250 HA VAL 30 HA VAL 30 -8.874 13.803 8.853 251 HB VAL 30 HB VAL 30 -8.214 11.857 7.674 252 HG11 VAL 30 HG11 VAL 30 -6.456 13.601 7.926 253 HG12 VAL 30 HG12 VAL 30 -5.759 12.670 9.274 254 HG13 VAL 30 HG13 VAL 30 -5.814 11.977 7.644 255 HG21 VAL 30 HG21 VAL 30 -7.100 10.712 10.262 256 HG22 VAL 30 HG22 VAL 30 -8.473 10.081 9.321 257 HG23 VAL 30 HG23 VAL 30 -6.846 10.024 8.649 258 H TYR 31 H TYR 31 -10.458 12.047 7.918 259 HA TYR 31 HA TYR 31 -12.335 11.255 10.117 260 HB2 TYR 31 HB2 TYR 31 -12.842 12.214 7.279 261 HB3 TYR 31 HB3 TYR 31 -14.079 11.559 8.335 262 HD1 TYR 31 HD1 TYR 31 -11.605 14.364 8.015 263 HD2 TYR 31 HD2 TYR 31 -15.223 12.934 9.879 264 HE1 TYR 31 HE1 TYR 31 -12.059 16.650 8.902 265 HE2 TYR 31 HE2 TYR 31 -15.691 15.226 10.731 266 HH TYR 31 HH TYR 31 -14.989 17.400 10.797 267 H SER 32 H SER 32 -13.208 9.218 10.105 268 HA SER 32 HA SER 32 -12.909 7.320 7.865 269 HB2 SER 32 HB2 SER 32 -10.671 7.182 8.745 270 HB3 SER 32 HB3 SER 32 -11.253 7.178 10.418 271 HG SER 32 HG SER 32 -10.674 5.100 9.078 272 H VAL 33 H VAL 33 -14.161 5.358 8.225 273 HA VAL 33 HA VAL 33 -16.089 5.516 10.466 274 HB VAL 33 HB VAL 33 -17.135 3.486 9.516 275 HG11 VAL 33 HG11 VAL 33 -18.037 5.692 9.171 276 HG12 VAL 33 HG12 VAL 33 -17.027 5.911 7.710 277 HG13 VAL 33 HG13 VAL 33 -18.307 4.674 7.754 278 HG21 VAL 33 HG21 VAL 33 -15.336 4.005 7.127 279 HG22 VAL 33 HG22 VAL 33 -15.305 2.574 8.185 280 HG23 VAL 33 HG23 VAL 33 -16.725 2.891 7.184 281 H ASP 34 H ASP 34 -16.298 4.115 12.092 282 HA ASP 34 HA ASP 34 -14.093 2.268 12.714 283 HB2 ASP 34 HB2 ASP 34 -15.556 3.784 14.341 284 HB3 ASP 34 HB3 ASP 34 -16.656 2.410 14.292 285 H ASN 35 H ASN 35 -14.990 0.118 13.818 286 HA ASN 35 HA ASN 35 -15.778 -1.734 11.801 287 HB2 ASN 35 HB2 ASN 35 -15.836 -1.865 14.854 288 HB3 ASN 35 HB3 ASN 35 -16.135 -3.248 13.809 289 HD21 ASN 35 HD22 ASN 35 -13.681 -1.536 15.436 290 HD22 ASN 35 HD21 ASN 35 -12.328 -2.291 14.603 291 H ASN 36 H ASN 36 -17.747 0.342 13.792 292 HA ASN 36 HA ASN 36 -20.254 -1.144 13.284 293 HB2 ASN 36 HB2 ASN 36 -19.822 1.528 14.674 294 HB3 ASN 36 HB3 ASN 36 -21.238 0.490 14.787 295 HD21 ASN 36 HD22 ASN 36 -18.564 1.441 16.485 296 HD22 ASN 36 HD21 ASN 36 -18.358 0.014 17.484 297 H GLY 37 H GLY 37 -18.459 1.176 11.532 298 HA2 GLY 37 HA2 GLY 37 -19.075 2.262 9.555 299 HA3 GLY 37 HA3 GLY 37 -20.781 1.995 9.894 300 H ASN 38 H ASN 38 -18.960 3.420 12.498 301 HA ASN 38 HA ASN 38 -20.476 5.958 12.235 302 HB2 ASN 38 HB2 ASN 38 -18.602 4.961 14.431 303 HB3 ASN 38 HB3 ASN 38 -19.632 6.384 14.517 304 HD21 ASN 38 HD22 ASN 38 -19.588 4.188 16.364 305 HD22 ASN 38 HD21 ASN 38 -21.177 3.435 16.287 306 H ILE 39 H ILE 39 -19.532 7.678 11.172 307 HA ILE 39 HA ILE 39 -16.719 7.792 10.544 308 HB ILE 39 HB ILE 39 -18.772 10.023 10.392 309 HG12 ILE 39 HG12 ILE 39 -17.861 8.031 8.262 310 HG13 ILE 39 HG13 ILE 39 -19.446 8.022 9.044 311 HG21 ILE 39 HG21 ILE 39 -17.201 11.110 8.905 312 HG22 ILE 39 HG22 ILE 39 -16.283 10.669 10.331 313 HG23 ILE 39 HG23 ILE 39 -16.145 9.681 8.866 314 HD11 ILE 39 HD11 ILE 39 -19.917 10.270 8.079 315 HD12 ILE 39 HD12 ILE 39 -18.362 10.176 7.214 316 HD13 ILE 39 HD13 ILE 39 -19.640 9.011 6.856 317 H TYR 40 H TYR 40 -15.324 7.896 12.140 318 HA TYR 40 HA TYR 40 -15.586 9.913 14.331 319 HB2 TYR 40 HB2 TYR 40 -14.113 8.593 15.625 320 HB3 TYR 40 HB3 TYR 40 -15.358 7.530 15.023 321 HD1 TYR 40 HD1 TYR 40 -11.760 8.394 14.883 322 HD2 TYR 40 HD2 TYR 40 -14.805 5.698 13.455 323 HE1 TYR 40 HE1 TYR 40 -10.016 6.791 14.105 324 HE2 TYR 40 HE2 TYR 40 -13.021 4.122 12.699 325 HH TYR 40 HH TYR 40 -10.735 3.654 12.627 326 H THR 41 H THR 41 -13.233 10.601 15.052 327 HA THR 41 HA THR 41 -11.597 11.253 12.658 328 HB THR 41 HB THR 41 -11.056 13.455 13.798 329 HG1 THR 41 HG1 THR 41 -11.979 12.989 15.825 330 HG21 THR 41 HG21 THR 41 -12.409 13.460 11.831 331 HG22 THR 41 HG22 THR 41 -13.858 12.953 12.734 332 HG23 THR 41 HG23 THR 41 -13.161 14.557 13.002 333 H GLN 42 H GLN 42 -9.423 11.213 12.820 334 HA GLN 42 HA GLN 42 -8.158 10.540 15.430 335 HB2 GLN 42 HB2 GLN 42 -7.081 8.564 14.448 336 HB3 GLN 42 HB3 GLN 42 -8.835 8.445 14.482 337 HG2 GLN 42 HG2 GLN 42 -8.877 9.071 12.018 338 HG3 GLN 42 HG3 GLN 42 -7.112 9.081 12.033 339 HE21 GLN 42 HE22 GLN 42 -8.529 7.428 10.241 340 HE22 GLN 42 HE21 GLN 42 -8.226 5.776 10.734 341 HA PRO 43 HA PRO 43 -4.833 12.961 13.693 342 HB2 PRO 43 HB2 PRO 43 -2.727 12.280 15.288 343 HB3 PRO 43 HB3 PRO 43 -4.116 13.253 15.860 344 HG2 PRO 43 HG2 PRO 43 -3.667 10.272 16.193 345 HG3 PRO 43 HG3 PRO 43 -4.157 11.470 17.438 346 HD2 PRO 43 HD2 PRO 43 -5.962 9.888 16.136 347 HD3 PRO 43 HD3 PRO 43 -6.352 11.566 16.616 348 H VAL 44 H VAL 44 -3.069 12.838 12.308 349 HA VAL 44 HA VAL 44 -2.444 10.413 10.851 350 HB VAL 44 HB VAL 44 -0.892 13.033 11.119 351 HG11 VAL 44 HG11 VAL 44 0.626 11.328 10.272 352 HG12 VAL 44 HG12 VAL 44 -0.600 10.745 9.121 353 HG13 VAL 44 HG13 VAL 44 0.134 12.348 8.928 354 HG21 VAL 44 HG21 VAL 44 -2.777 12.086 8.917 355 HG22 VAL 44 HG22 VAL 44 -3.159 13.331 10.117 356 HG23 VAL 44 HG23 VAL 44 -1.870 13.612 8.945 357 H ALA 45 H ALA 45 -0.939 8.843 11.208 358 HA ALA 45 HA ALA 45 0.578 8.896 13.760 359 HB1 ALA 45 HB1 ALA 45 -0.711 6.890 13.139 360 HB2 ALA 45 HB2 ALA 45 0.260 6.706 11.665 361 HB3 ALA 45 HB3 ALA 45 1.029 6.547 13.252 362 H GLN 46 H GLN 46 1.213 8.556 10.237 363 HA GLN 46 HA GLN 46 3.911 9.716 10.502 364 HB2 GLN 46 HB2 GLN 46 3.413 6.881 9.489 365 HB3 GLN 46 HB3 GLN 46 4.902 7.766 9.201 366 HG2 GLN 46 HG2 GLN 46 3.859 6.886 11.907 367 HG3 GLN 46 HG3 GLN 46 5.202 6.201 11.013 368 HE21 GLN 46 HE22 GLN 46 5.158 7.456 13.750 369 HE22 GLN 46 HE21 GLN 46 6.386 8.712 13.660 370 H TRP 47 H TRP 47 4.979 9.647 8.215 371 HA TRP 47 HA TRP 47 3.001 10.373 6.084 372 HB2 TRP 47 HB2 TRP 47 5.505 11.916 6.882 373 HB3 TRP 47 HB3 TRP 47 4.446 12.301 5.539 374 HD1 TRP 47 HD1 TRP 47 2.414 13.812 6.006 375 HE1 TRP 47 HE1 TRP 47 1.451 15.015 8.073 376 HE3 TRP 47 HE3 TRP 47 5.303 11.639 9.646 377 HZ2 TRP 47 HZ2 TRP 47 1.688 14.806 10.922 378 HZ3 TRP 47 HZ3 TRP 47 4.860 12.119 12.042 379 HH2 TRP 47 HH2 TRP 47 3.040 13.687 12.694 380 H HIS 48 H HIS 48 3.461 9.388 4.154 381 HA HIS 48 HA HIS 48 6.227 8.373 3.679 382 HB2 HIS 48 HB2 HIS 48 3.755 6.823 2.902 383 HB3 HIS 48 HB3 HIS 48 5.420 6.301 2.885 384 HD1 HIS 48 HD1 HIS 48 6.517 6.097 5.564 385 HD2 HIS 48 HD2 HIS 48 2.349 6.099 4.957 386 HE1 HIS 48 HE1 HIS 48 5.486 5.110 7.678 387 H ASP 49 H ASP 49 7.032 8.640 1.755 388 HA ASP 49 HA ASP 49 5.423 9.868 -0.433 389 HB2 ASP 49 HB2 ASP 49 7.352 11.276 -0.935 390 HB3 ASP 49 HB3 ASP 49 6.659 11.616 0.632 391 H ARG 50 H ARG 50 5.332 8.604 -2.100 392 HA ARG 50 HA ARG 50 7.165 6.343 -2.528 393 HB2 ARG 50 HB2 ARG 50 4.994 7.405 -4.327 394 HB3 ARG 50 HB3 ARG 50 5.705 5.787 -4.332 395 HG2 ARG 50 HG2 ARG 50 3.895 6.995 -2.190 396 HG3 ARG 50 HG3 ARG 50 3.493 5.705 -3.298 397 HD2 ARG 50 HD2 ARG 50 5.578 5.516 -1.087 398 HD3 ARG 50 HD3 ARG 50 3.941 4.911 -0.985 399 HE ARG 50 HE ARG 50 6.181 3.696 -2.422 400 HH11 ARG 50 HH11 ARG 50 2.688 3.590 -1.967 401 HH12 ARG 50 HH12 ARG 50 2.590 1.989 -2.664 402 HH21 ARG 50 HH21 ARG 50 5.949 1.650 -3.224 403 HH22 ARG 50 HH22 ARG 50 4.381 0.905 -3.294 404 H GLY 51 H GLY 51 6.729 9.554 -3.886 405 HA2 GLY 51 HA2 GLY 51 8.509 10.833 -4.755 406 HA3 GLY 51 HA3 GLY 51 9.380 9.368 -5.188 407 H GLU 52 H GLU 52 7.816 7.950 -6.806 408 HA GLU 52 HA GLU 52 6.301 9.393 -8.811 409 HB2 GLU 52 HB2 GLU 52 9.207 8.714 -9.383 410 HB3 GLU 52 HB3 GLU 52 7.969 8.604 -10.630 411 HG2 GLU 52 HG2 GLU 52 7.360 10.993 -10.203 412 HG3 GLU 52 HG3 GLU 52 8.803 11.120 -9.188 413 H GLN 53 H GLN 53 4.744 7.798 -8.851 414 HA GLN 53 HA GLN 53 5.598 5.165 -9.993 415 HB2 GLN 53 HB2 GLN 53 3.317 5.681 -8.048 416 HB3 GLN 53 HB3 GLN 53 3.733 4.119 -8.788 417 HG2 GLN 53 HG2 GLN 53 6.079 4.443 -7.769 418 HG3 GLN 53 HG3 GLN 53 5.361 5.759 -6.818 419 HE21 GLN 53 HE22 GLN 53 2.951 4.710 -5.836 420 HE22 GLN 53 HE21 GLN 53 4.044 4.432 -4.612 421 H GLU 54 H GLU 54 3.867 4.039 -11.171 422 HA GLU 54 HA GLU 54 2.829 5.636 -13.285 423 HB2 GLU 54 HB2 GLU 54 1.690 3.526 -13.981 424 HB3 GLU 54 HB3 GLU 54 3.427 3.442 -13.800 425 HG2 GLU 54 HG2 GLU 54 2.001 2.605 -11.333 426 HG3 GLU 54 HG3 GLU 54 1.536 1.671 -12.749 427 H VAL 55 H VAL 55 1.374 7.182 -12.914 428 HA VAL 55 HA VAL 55 -1.009 6.691 -11.210 429 HB VAL 55 HB VAL 55 -0.054 9.246 -12.569 430 HG11 VAL 55 HG11 VAL 55 -2.501 9.317 -12.243 431 HG12 VAL 55 HG12 VAL 55 -2.304 8.788 -10.553 432 HG13 VAL 55 HG13 VAL 55 -1.701 10.372 -11.086 433 HG21 VAL 55 HG21 VAL 55 0.170 8.125 -9.756 434 HG22 VAL 55 HG22 VAL 55 1.461 8.754 -10.795 435 HG23 VAL 55 HG23 VAL 55 0.293 9.864 -10.074 436 H PHE 56 H PHE 56 -2.994 6.546 -11.897 437 HA PHE 56 HA PHE 56 -3.601 6.697 -14.825 438 HB2 PHE 56 HB2 PHE 56 -4.594 4.778 -12.686 439 HB3 PHE 56 HB3 PHE 56 -5.390 5.006 -14.240 440 HD1 PHE 56 HD1 PHE 56 -1.979 4.137 -12.833 441 HD2 PHE 56 HD2 PHE 56 -4.806 3.680 -16.053 442 HE1 PHE 56 HE1 PHE 56 -0.443 2.558 -13.960 443 HE2 PHE 56 HE2 PHE 56 -3.313 2.006 -17.121 444 HZ PHE 56 HZ PHE 56 -1.105 1.483 -16.103 445 H GLU 57 H GLU 57 -5.410 7.736 -15.418 446 HA GLU 57 HA GLU 57 -6.674 9.658 -13.621 447 HB2 GLU 57 HB2 GLU 57 -6.392 9.998 -16.091 448 HB3 GLU 57 HB3 GLU 57 -7.463 8.635 -16.402 449 HG2 GLU 57 HG2 GLU 57 -9.331 9.837 -15.308 450 HG3 GLU 57 HG3 GLU 57 -8.241 11.165 -14.891 451 H TYR 58 H TYR 58 -8.361 9.217 -12.232 452 HA TYR 58 HA TYR 58 -10.184 6.951 -12.859 453 HB2 TYR 58 HB2 TYR 58 -9.054 6.416 -10.876 454 HB3 TYR 58 HB3 TYR 58 -9.128 8.063 -10.254 455 HD1 TYR 58 HD1 TYR 58 -12.142 6.506 -11.760 456 HD2 TYR 58 HD2 TYR 58 -9.956 7.175 -8.092 457 HE1 TYR 58 HE1 TYR 58 -14.090 5.802 -10.478 458 HE2 TYR 58 HE2 TYR 58 -11.942 6.390 -6.797 459 HH TYR 58 HH TYR 58 -14.947 5.354 -8.505 460 H CYS 59 H CYS 59 -11.816 7.827 -13.950 461 HA CYS 59 HA CYS 59 -13.067 10.345 -12.927 462 HB2 CYS 59 HB2 CYS 59 -11.978 10.491 -15.179 463 HB3 CYS 59 HB3 CYS 59 -13.085 9.228 -15.744 464 HG CYS 59 HG CYS 59 -13.915 11.581 -16.594 465 H LEU 60 H LEU 60 -15.187 10.395 -12.593 466 HA LEU 60 HA LEU 60 -16.612 7.787 -12.371 467 HB2 LEU 60 HB2 LEU 60 -16.175 10.044 -10.654 468 HB3 LEU 60 HB3 LEU 60 -17.854 10.085 -11.116 469 HG LEU 60 HG LEU 60 -18.179 7.808 -10.264 470 HD11 LEU 60 HD11 LEU 60 -15.941 6.911 -10.543 471 HD12 LEU 60 HD12 LEU 60 -15.309 8.046 -9.322 472 HD13 LEU 60 HD13 LEU 60 -16.472 6.775 -8.862 473 HD21 LEU 60 HD21 LEU 60 -16.861 9.646 -8.225 474 HD22 LEU 60 HD22 LEU 60 -18.492 9.906 -8.873 475 HD23 LEU 60 HD23 LEU 60 -18.154 8.452 -7.937 476 H GLU 61 H GLU 61 -18.961 7.802 -12.569 477 HA GLU 61 HA GLU 61 -19.833 8.689 -15.154 478 HB2 GLU 61 HB2 GLU 61 -21.388 7.679 -12.751 479 HB3 GLU 61 HB3 GLU 61 -22.088 7.876 -14.349 480 HG2 GLU 61 HG2 GLU 61 -19.729 6.035 -13.751 481 HG3 GLU 61 HG3 GLU 61 -21.407 5.536 -13.676 482 H ASP 62 H ASP 62 -20.060 10.270 -12.041 483 HA ASP 62 HA ASP 62 -22.028 12.288 -12.882 484 HB2 ASP 62 HB2 ASP 62 -21.919 11.477 -10.572 485 HB3 ASP 62 HB3 ASP 62 -20.238 12.003 -10.435 486 H GLY 63 H GLY 63 -18.568 11.922 -13.098 487 HA2 GLY 63 HA2 GLY 63 -17.302 13.410 -14.513 488 HA3 GLY 63 HA3 GLY 63 -18.216 14.788 -13.900 489 H SER 64 H SER 64 -17.576 12.972 -11.186 490 HA SER 64 HA SER 64 -15.542 14.674 -10.107 491 HB2 SER 64 HB2 SER 64 -16.308 11.840 -9.289 492 HB3 SER 64 HB3 SER 64 -15.244 12.914 -8.378 493 HG SER 64 HG SER 64 -17.996 13.345 -8.969 494 H LEU 65 H LEU 65 -13.349 14.586 -10.079 495 HA LEU 65 HA LEU 65 -12.005 12.513 -11.760 496 HB2 LEU 65 HB2 LEU 65 -12.439 15.005 -12.586 497 HB3 LEU 65 HB3 LEU 65 -11.074 15.383 -11.560 498 HG LEU 65 HG LEU 65 -10.258 15.162 -13.759 499 HD11 LEU 65 HD11 LEU 65 -8.854 13.939 -12.062 500 HD12 LEU 65 HD12 LEU 65 -9.606 12.420 -12.634 501 HD13 LEU 65 HD13 LEU 65 -8.661 13.417 -13.743 502 HD21 LEU 65 HD21 LEU 65 -11.799 12.553 -13.961 503 HD22 LEU 65 HD22 LEU 65 -12.084 14.059 -14.850 504 HD23 LEU 65 HD23 LEU 65 -10.621 13.119 -15.164 505 H ILE 66 H ILE 66 -10.480 11.430 -10.840 506 HA ILE 66 HA ILE 66 -9.062 12.338 -8.387 507 HB ILE 66 HB ILE 66 -10.315 9.597 -8.832 508 HG12 ILE 66 HG12 ILE 66 -11.332 11.738 -6.921 509 HG13 ILE 66 HG13 ILE 66 -12.074 11.374 -8.476 510 HG21 ILE 66 HG21 ILE 66 -8.347 9.499 -7.366 511 HG22 ILE 66 HG22 ILE 66 -8.960 10.866 -6.399 512 HG23 ILE 66 HG23 ILE 66 -9.772 9.293 -6.379 513 HD11 ILE 66 HD11 ILE 66 -12.674 9.133 -7.803 514 HD12 ILE 66 HD12 ILE 66 -11.949 9.381 -6.190 515 HD13 ILE 66 HD13 ILE 66 -13.343 10.338 -6.709 516 H ARG 67 H ARG 67 -6.997 11.319 -8.090 517 HA ARG 67 HA ARG 67 -5.758 10.051 -10.522 518 HB2 ARG 67 HB2 ARG 67 -4.744 12.488 -8.994 519 HB3 ARG 67 HB3 ARG 67 -3.859 11.625 -10.265 520 HG2 ARG 67 HG2 ARG 67 -6.567 12.856 -10.835 521 HG3 ARG 67 HG3 ARG 67 -5.097 13.825 -10.835 522 HD2 ARG 67 HD2 ARG 67 -4.082 12.363 -12.529 523 HD3 ARG 67 HD3 ARG 67 -5.506 11.318 -12.497 524 HE ARG 67 HE ARG 67 -6.615 12.778 -13.883 525 HH11 ARG 67 HH11 ARG 67 -3.993 14.692 -12.492 526 HH12 ARG 67 HH12 ARG 67 -4.178 15.933 -13.692 527 HH21 ARG 67 HH21 ARG 67 -6.785 14.431 -15.344 528 HH22 ARG 67 HH22 ARG 67 -5.741 15.816 -15.214 529 H ALA 68 H ALA 68 -5.064 8.193 -9.840 530 HA ALA 68 HA ALA 68 -3.433 7.939 -7.372 531 HB1 ALA 68 HB1 ALA 68 -5.871 7.688 -6.743 532 HB2 ALA 68 HB2 ALA 68 -5.956 6.276 -7.815 533 HB3 ALA 68 HB3 ALA 68 -4.885 6.258 -6.395 534 H THR 69 H THR 69 -2.688 5.676 -7.029 535 HA THR 69 HA THR 69 -1.742 4.426 -9.561 536 HB THR 69 HB THR 69 -0.395 3.000 -7.998 537 HG1 THR 69 HG1 THR 69 -2.010 3.574 -6.224 538 HG21 THR 69 HG21 THR 69 0.499 5.105 -8.951 539 HG22 THR 69 HG22 THR 69 -0.035 5.975 -7.491 540 HG23 THR 69 HG23 THR 69 1.193 4.686 -7.373 541 H LYS 70 H LYS 70 -1.998 2.264 -10.008 542 HA LYS 70 HA LYS 70 -4.452 0.928 -9.324 543 HB2 LYS 70 HB2 LYS 70 -1.939 0.255 -10.869 544 HB3 LYS 70 HB3 LYS 70 -3.094 -1.030 -10.520 545 HG2 LYS 70 HG2 LYS 70 -4.880 0.079 -11.646 546 HG3 LYS 70 HG3 LYS 70 -3.949 1.572 -11.842 547 HD2 LYS 70 HD2 LYS 70 -2.518 0.662 -13.431 548 HD3 LYS 70 HD3 LYS 70 -2.790 -0.992 -12.947 549 HE2 LYS 70 HE2 LYS 70 -3.710 -0.154 -15.211 550 HE3 LYS 70 HE3 LYS 70 -4.640 -1.273 -14.219 551 HZ1 LYS 70 HZ1 LYS 70 -6.031 0.533 -13.478 552 HZ2 LYS 70 HZ2 LYS 70 -5.108 1.661 -14.253 553 HZ3 LYS 70 HZ3 LYS 70 -5.985 0.553 -15.108 554 H ASP 71 H ASP 71 -1.758 1.163 -7.372 555 HA ASP 71 HA ASP 71 -2.212 -1.480 -6.043 556 HB2 ASP 71 HB2 ASP 71 -0.010 0.608 -5.866 557 HB3 ASP 71 HB3 ASP 71 -0.167 -0.706 -4.704 558 H HIS 72 H HIS 72 -3.495 1.634 -5.869 559 HA HIS 72 HA HIS 72 -3.583 1.703 -2.904 560 HB2 HIS 72 HB2 HIS 72 -3.291 3.794 -4.407 561 HB3 HIS 72 HB3 HIS 72 -4.991 3.636 -4.768 562 HD1 HIS 72 HD1 HIS 72 -6.282 3.243 -1.870 563 HD2 HIS 72 HD2 HIS 72 -2.789 5.440 -2.590 564 HE1 HIS 72 HE1 HIS 72 -5.867 4.650 0.193 565 H LYS 73 H LYS 73 -5.257 0.855 -1.788 566 HA LYS 73 HA LYS 73 -7.574 -0.239 -3.282 567 HB2 LYS 73 HB2 LYS 73 -6.833 -0.559 -0.337 568 HB3 LYS 73 HB3 LYS 73 -8.182 -1.307 -1.173 569 HG2 LYS 73 HG2 LYS 73 -6.745 -3.035 -1.257 570 HG3 LYS 73 HG3 LYS 73 -6.345 -2.274 -2.798 571 HD2 LYS 73 HD2 LYS 73 -4.340 -1.291 -1.857 572 HD3 LYS 73 HD3 LYS 73 -4.779 -1.792 -0.219 573 HE2 LYS 73 HE2 LYS 73 -4.414 -3.773 -2.499 574 HE3 LYS 73 HE3 LYS 73 -3.044 -3.201 -1.536 575 HZ1 LYS 73 HZ1 LYS 73 -4.151 -4.062 0.457 576 HZ2 LYS 73 HZ2 LYS 73 -5.405 -4.636 -0.429 577 HZ3 LYS 73 HZ3 LYS 73 -3.909 -5.259 -0.623 578 H PHE 74 H PHE 74 -9.712 0.193 -2.680 579 HA PHE 74 HA PHE 74 -10.198 2.654 -1.048 580 HB2 PHE 74 HB2 PHE 74 -11.230 2.132 -3.850 581 HB3 PHE 74 HB3 PHE 74 -11.874 3.344 -2.740 582 HD1 PHE 74 HD2 PHE 74 -8.829 2.378 -4.692 583 HD2 PHE 74 HD1 PHE 74 -10.952 5.544 -2.659 584 HE1 PHE 74 HE2 PHE 74 -7.242 4.044 -5.616 585 HE2 PHE 74 HE1 PHE 74 -9.352 7.197 -3.574 586 HZ PHE 74 HZ PHE 74 -7.495 6.455 -5.054 587 H MET 75 H MET 75 -12.124 2.657 0.033 588 HA MET 75 HA MET 75 -13.113 0.016 0.683 589 HB2 MET 75 HB2 MET 75 -12.708 1.917 2.287 590 HB3 MET 75 HB3 MET 75 -14.148 2.711 1.637 591 HG2 MET 75 HG2 MET 75 -15.536 0.815 2.301 592 HG3 MET 75 HG3 MET 75 -14.106 -0.106 2.778 593 HE1 MET 75 HE1 MET 75 -14.455 3.812 4.015 594 HE2 MET 75 HE2 MET 75 -15.923 3.169 3.245 595 HE3 MET 75 HE3 MET 75 -15.904 3.492 4.988 596 H THR 76 H THR 76 -14.381 -1.018 -0.818 597 HA THR 76 HA THR 76 -16.268 0.278 -2.545 598 HB THR 76 HB THR 76 -17.173 -1.913 -3.063 599 HG1 THR 76 HG1 THR 76 -16.318 -3.707 -2.023 600 HG21 THR 76 HG21 THR 76 -15.233 -1.349 -4.301 601 HG22 THR 76 HG22 THR 76 -14.147 -1.833 -2.976 602 HG23 THR 76 HG23 THR 76 -15.111 -3.046 -3.854 603 H VAL 77 H VAL 77 -18.618 -0.391 -2.687 604 HA VAL 77 HA VAL 77 -20.048 0.779 -0.612 605 HB VAL 77 HB VAL 77 -22.092 -0.203 -1.619 606 HG11 VAL 77 HG11 VAL 77 -21.044 1.862 -2.475 607 HG12 VAL 77 HG12 VAL 77 -20.106 0.903 -3.631 608 HG13 VAL 77 HG13 VAL 77 -21.879 0.943 -3.743 609 HG21 VAL 77 HG21 VAL 77 -20.166 -1.651 -3.504 610 HG22 VAL 77 HG22 VAL 77 -21.240 -2.419 -2.313 611 HG23 VAL 77 HG23 VAL 77 -21.925 -1.536 -3.681 612 H ASP 78 H ASP 78 -19.022 -2.549 -0.736 613 HA ASP 78 HA ASP 78 -20.695 -3.294 1.609 614 HB2 ASP 78 HB2 ASP 78 -20.497 -4.759 -0.415 615 HB3 ASP 78 HB3 ASP 78 -18.775 -4.939 -0.077 616 H GLY 79 H GLY 79 -17.619 -1.978 1.021 617 HA2 GLY 79 HA2 GLY 79 -16.298 -1.192 2.832 618 HA3 GLY 79 HA3 GLY 79 -16.654 -2.642 3.762 619 H GLN 80 H GLN 80 -15.987 -3.805 0.709 620 HA GLN 80 HA GLN 80 -13.605 -5.095 1.586 621 HB2 GLN 80 HB2 GLN 80 -14.535 -4.760 -1.290 622 HB3 GLN 80 HB3 GLN 80 -13.447 -5.990 -0.673 623 HG2 GLN 80 HG2 GLN 80 -16.396 -5.762 0.094 624 HG3 GLN 80 HG3 GLN 80 -15.745 -6.803 -1.155 625 HE21 GLN 80 HE22 GLN 80 -15.146 -8.887 -0.547 626 HE22 GLN 80 HE21 GLN 80 -14.909 -9.374 1.127 627 H MET 81 H MET 81 -11.470 -4.780 1.229 628 HA MET 81 HA MET 81 -10.618 -2.154 0.118 629 HB2 MET 81 HB2 MET 81 -8.835 -4.007 1.716 630 HB3 MET 81 HB3 MET 81 -8.695 -2.277 1.417 631 HG2 MET 81 HG2 MET 81 -9.500 -2.158 3.536 632 HG3 MET 81 HG3 MET 81 -11.062 -2.276 2.729 633 HE1 MET 81 HE1 MET 81 -11.582 -2.670 5.251 634 HE2 MET 81 HE2 MET 81 -12.717 -3.843 4.540 635 HE3 MET 81 HE3 MET 81 -11.730 -4.309 5.932 636 H LEU 82 H LEU 82 -10.845 -2.712 -2.080 637 HA LEU 82 HA LEU 82 -8.861 -4.691 -3.143 638 HB2 LEU 82 HB2 LEU 82 -11.392 -3.757 -4.524 639 HB3 LEU 82 HB3 LEU 82 -10.320 -5.049 -5.023 640 HG LEU 82 HG LEU 82 -12.103 -5.095 -2.548 641 HD11 LEU 82 HD11 LEU 82 -13.335 -5.264 -4.674 642 HD12 LEU 82 HD12 LEU 82 -12.288 -6.608 -5.182 643 HD13 LEU 82 HD13 LEU 82 -13.369 -6.793 -3.782 644 HD21 LEU 82 HD21 LEU 82 -10.344 -7.292 -3.727 645 HD22 LEU 82 HD22 LEU 82 -10.071 -6.465 -2.182 646 HD23 LEU 82 HD23 LEU 82 -11.496 -7.483 -2.386 647 HA PRO 83 HA PRO 83 -6.914 -1.256 -5.182 648 HB2 PRO 83 HB2 PRO 83 -5.724 -2.488 -7.335 649 HB3 PRO 83 HB3 PRO 83 -5.136 -2.675 -5.648 650 HG2 PRO 83 HG2 PRO 83 -6.976 -4.503 -7.232 651 HG3 PRO 83 HG3 PRO 83 -5.519 -4.956 -6.281 652 HD2 PRO 83 HD2 PRO 83 -8.021 -5.190 -5.271 653 HD3 PRO 83 HD3 PRO 83 -6.672 -4.636 -4.235 654 H ILE 84 H ILE 84 -7.281 0.225 -6.862 655 HA ILE 84 HA ILE 84 -9.802 0.100 -8.081 656 HB ILE 84 HB ILE 84 -8.575 2.144 -7.491 657 HG12 ILE 84 HG12 ILE 84 -9.491 2.138 -10.395 658 HG13 ILE 84 HG13 ILE 84 -10.569 1.952 -8.997 659 HG21 ILE 84 HG21 ILE 84 -6.354 1.608 -8.402 660 HG22 ILE 84 HG22 ILE 84 -6.994 1.670 -10.063 661 HG23 ILE 84 HG23 ILE 84 -6.945 3.133 -9.058 662 HD11 ILE 84 HD11 ILE 84 -9.858 4.120 -8.124 663 HD12 ILE 84 HD12 ILE 84 -8.851 4.377 -9.581 664 HD13 ILE 84 HD13 ILE 84 -10.611 4.207 -9.729 665 H ASP 85 H ASP 85 -6.812 -1.098 -9.403 666 HA ASP 85 HA ASP 85 -7.510 -1.456 -12.128 667 HB2 ASP 85 HB2 ASP 85 -5.286 -1.945 -10.917 668 HB3 ASP 85 HB3 ASP 85 -6.020 -3.431 -10.348 669 H GLU 86 H GLU 86 -8.589 -3.177 -9.249 670 HA GLU 86 HA GLU 86 -9.891 -5.328 -10.834 671 HB2 GLU 86 HB2 GLU 86 -8.485 -5.844 -8.850 672 HB3 GLU 86 HB3 GLU 86 -9.640 -4.982 -7.816 673 HG2 GLU 86 HG2 GLU 86 -11.358 -6.572 -8.258 674 HG3 GLU 86 HG3 GLU 86 -10.486 -7.240 -9.650 675 H ILE 87 H ILE 87 -10.741 -2.421 -8.901 676 HA ILE 87 HA ILE 87 -13.561 -2.875 -8.770 677 HB ILE 87 HB ILE 87 -11.983 -0.272 -8.950 678 HG12 ILE 87 HG12 ILE 87 -12.988 -1.824 -6.510 679 HG13 ILE 87 HG13 ILE 87 -11.312 -1.752 -7.042 680 HG21 ILE 87 HG21 ILE 87 -14.477 -0.054 -9.436 681 HG22 ILE 87 HG22 ILE 87 -14.777 -0.711 -7.821 682 HG23 ILE 87 HG23 ILE 87 -13.935 0.838 -8.030 683 HD11 ILE 87 HD11 ILE 87 -11.264 0.697 -6.643 684 HD12 ILE 87 HD12 ILE 87 -12.933 0.606 -6.067 685 HD13 ILE 87 HD13 ILE 87 -11.648 -0.237 -5.186 686 H PHE 88 H PHE 88 -11.512 -1.364 -11.301 687 HA PHE 88 HA PHE 88 -13.631 -0.584 -13.051 688 HB2 PHE 88 HB2 PHE 88 -11.298 0.221 -13.217 689 HB3 PHE 88 HB3 PHE 88 -10.764 -1.384 -13.677 690 HD1 PHE 88 HD1 PHE 88 -12.772 1.595 -14.799 691 HD2 PHE 88 HD2 PHE 88 -11.047 -2.213 -15.928 692 HE1 PHE 88 HE1 PHE 88 -13.181 2.112 -17.180 693 HE2 PHE 88 HE2 PHE 88 -11.458 -1.673 -18.320 694 HZ PHE 88 HZ PHE 88 -12.525 0.484 -18.949 695 H GLU 89 H GLU 89 -11.910 -3.716 -12.810 696 HA GLU 89 HA GLU 89 -13.107 -4.841 -15.199 697 HB2 GLU 89 HB2 GLU 89 -11.621 -5.998 -12.811 698 HB3 GLU 89 HB3 GLU 89 -12.286 -7.030 -14.068 699 HG2 GLU 89 HG2 GLU 89 -10.741 -4.811 -15.242 700 HG3 GLU 89 HG3 GLU 89 -9.783 -5.712 -14.084 701 H ARG 90 H ARG 90 -13.921 -5.287 -11.683 702 HA ARG 90 HA ARG 90 -16.329 -6.806 -12.350 703 HB2 ARG 90 HB2 ARG 90 -15.322 -5.573 -9.743 704 HB3 ARG 90 HB3 ARG 90 -16.791 -6.543 -9.914 705 HG2 ARG 90 HG2 ARG 90 -15.323 -8.123 -9.205 706 HG3 ARG 90 HG3 ARG 90 -15.294 -8.359 -10.959 707 HD2 ARG 90 HD2 ARG 90 -13.133 -7.133 -11.064 708 HD3 ARG 90 HD3 ARG 90 -13.259 -6.813 -9.332 709 HE ARG 90 HE ARG 90 -12.441 -8.912 -8.891 710 HH11 ARG 90 HH11 ARG 90 -13.527 -9.040 -12.232 711 HH12 ARG 90 HH12 ARG 90 -12.667 -10.529 -12.529 712 HH21 ARG 90 HH21 ARG 90 -11.305 -10.705 -9.375 713 HH22 ARG 90 HH22 ARG 90 -11.491 -11.483 -10.928 714 H GLU 91 H GLU 91 -15.680 -3.443 -12.397 715 HA GLU 91 HA GLU 91 -16.916 -1.611 -12.592 716 HB2 GLU 91 HB2 GLU 91 -19.279 -3.341 -13.389 717 HB3 GLU 91 HB3 GLU 91 -19.009 -1.628 -13.725 718 HG2 GLU 91 HG2 GLU 91 -16.949 -2.308 -15.056 719 HG3 GLU 91 HG3 GLU 91 -17.462 -3.989 -14.873 720 H LEU 92 H LEU 92 -16.539 -2.600 -10.054 721 HA LEU 92 HA LEU 92 -19.044 -2.405 -8.517 722 HB2 LEU 92 HB2 LEU 92 -16.107 -2.730 -7.784 723 HB3 LEU 92 HB3 LEU 92 -17.362 -2.503 -6.568 724 HG LEU 92 HG LEU 92 -17.360 -4.784 -8.582 725 HD11 LEU 92 HD11 LEU 92 -15.432 -4.932 -7.042 726 HD12 LEU 92 HD12 LEU 92 -16.529 -4.769 -5.651 727 HD13 LEU 92 HD13 LEU 92 -16.626 -6.197 -6.707 728 HD21 LEU 92 HD21 LEU 92 -19.013 -4.301 -6.067 729 HD22 LEU 92 HD22 LEU 92 -19.614 -4.341 -7.742 730 HD23 LEU 92 HD23 LEU 92 -18.990 -5.813 -7.002 731 H ASP 93 H ASP 93 -19.524 -0.825 -7.048 732 HA ASP 93 HA ASP 93 -18.464 1.876 -7.659 733 HB2 ASP 93 HB2 ASP 93 -20.733 1.290 -5.784 734 HB3 ASP 93 HB3 ASP 93 -20.427 2.713 -6.760 735 H LEU 94 H LEU 94 -18.208 3.385 -5.736 736 HA LEU 94 HA LEU 94 -16.928 2.022 -3.396 737 HB2 LEU 94 HB2 LEU 94 -16.175 4.533 -4.889 738 HB3 LEU 94 HB3 LEU 94 -15.564 4.178 -3.276 739 HG LEU 94 HG LEU 94 -15.051 2.496 -5.780 740 HD11 LEU 94 HD11 LEU 94 -13.695 4.489 -5.794 741 HD12 LEU 94 HD12 LEU 94 -13.272 4.307 -4.099 742 HD13 LEU 94 HD13 LEU 94 -12.673 3.162 -5.338 743 HD21 LEU 94 HD21 LEU 94 -14.370 2.088 -2.856 744 HD22 LEU 94 HD22 LEU 94 -15.044 0.936 -4.056 745 HD23 LEU 94 HD23 LEU 94 -13.361 1.390 -4.111 746 H MET 95 H MET 95 -17.207 2.835 -1.354 747 HA MET 95 HA MET 95 -19.855 3.883 -0.863 748 HB2 MET 95 HB2 MET 95 -18.756 2.185 0.514 749 HB3 MET 95 HB3 MET 95 -17.543 3.348 1.050 750 HG2 MET 95 HG2 MET 95 -19.023 4.424 2.460 751 HG3 MET 95 HG3 MET 95 -20.416 4.109 1.431 752 HE1 MET 95 HE1 MET 95 -18.101 1.035 2.551 753 HE2 MET 95 HE2 MET 95 -17.859 2.248 3.833 754 HE3 MET 95 HE3 MET 95 -18.747 0.753 4.178 755 H ARG 96 H ARG 96 -20.473 5.871 0.095 756 HA ARG 96 HA ARG 96 -18.433 8.019 0.188 757 HB2 ARG 96 HB2 ARG 96 -21.065 7.971 -1.286 758 HB3 ARG 96 HB3 ARG 96 -20.662 9.436 -0.409 759 HG2 ARG 96 HG2 ARG 96 -19.629 10.064 -2.244 760 HG3 ARG 96 HG3 ARG 96 -18.291 9.120 -1.647 761 HD2 ARG 96 HD2 ARG 96 -18.338 8.276 -3.754 762 HD3 ARG 96 HD3 ARG 96 -19.495 7.167 -3.041 763 HE ARG 96 HE ARG 96 -21.122 8.059 -4.444 764 HH11 ARG 96 HH11 ARG 96 -18.709 10.616 -4.151 765 HH12 ARG 96 HH12 ARG 96 -19.356 11.469 -5.523 766 HH21 ARG 96 HH21 ARG 96 -21.861 9.207 -6.153 767 HH22 ARG 96 HH22 ARG 96 -21.104 10.721 -6.602 768 H VAL 97 H VAL 97 -18.669 9.641 1.502 769 HA VAL 97 HA VAL 97 -19.678 9.149 4.169 770 HB VAL 97 HB VAL 97 -18.120 11.316 2.744 771 HG11 VAL 97 HG11 VAL 97 -19.199 12.701 4.304 772 HG12 VAL 97 HG12 VAL 97 -19.043 11.513 5.608 773 HG13 VAL 97 HG13 VAL 97 -17.599 12.341 4.970 774 HG21 VAL 97 HG21 VAL 97 -17.387 9.466 5.049 775 HG22 VAL 97 HG22 VAL 97 -17.022 9.165 3.339 776 HG23 VAL 97 HG23 VAL 97 -16.296 10.549 4.153 777 H ASP 98 H ASP 98 -20.696 11.284 1.538 778 HA ASP 98 HA ASP 98 -22.631 12.686 3.251 779 HB2 ASP 98 HB2 ASP 98 -21.091 13.744 1.534 780 HB3 ASP 98 HB3 ASP 98 -22.092 13.027 0.289 781 H ASN 99 H ASN 99 -22.916 9.747 2.133 782 HA ASN 99 HA ASN 99 -24.444 8.324 1.288 783 HB2 ASN 99 HB2 ASN 99 -26.308 10.270 2.683 784 HB3 ASN 99 HB3 ASN 99 -26.884 8.789 1.903 785 HD21 ASN 99 HD22 ASN 99 -24.339 9.880 4.115 786 HD22 ASN 99 HD21 ASN 99 -23.872 8.276 4.471 787 H LEU 100 H LEU 100 -23.318 10.116 -0.349 788 HA LEU 100 HA LEU 100 -25.079 10.879 -2.557 789 HB2 LEU 100 HB2 LEU 100 -22.103 10.419 -2.252 790 HB3 LEU 100 HB3 LEU 100 -22.770 10.710 -3.839 791 HG LEU 100 HG LEU 100 -23.307 12.640 -1.560 792 HD11 LEU 100 HD11 LEU 100 -20.853 12.426 -1.831 793 HD12 LEU 100 HD12 LEU 100 -21.017 12.719 -3.575 794 HD13 LEU 100 HD13 LEU 100 -21.432 13.995 -2.408 795 HD21 LEU 100 HD21 LEU 100 -23.302 12.965 -4.593 796 HD22 LEU 100 HD22 LEU 100 -24.747 12.862 -3.563 797 HD23 LEU 100 HD23 LEU 100 -23.651 14.239 -3.407 798 HA PRO 101 HA PRO 101 -25.774 6.958 -4.506 799 HB2 PRO 101 HB2 PRO 101 -25.787 7.577 -7.187 800 HB3 PRO 101 HB3 PRO 101 -27.095 8.029 -6.053 801 HG2 PRO 101 HG2 PRO 101 -24.800 9.738 -7.037 802 HG3 PRO 101 HG3 PRO 101 -26.530 10.178 -6.882 803 HD2 PRO 101 HD2 PRO 101 -24.647 10.843 -5.005 804 HD3 PRO 101 HD3 PRO 101 -26.326 10.479 -4.544 805 H ASN 102 H ASN 102 -24.411 5.281 -4.776 806 HA ASN 102 HA ASN 102 -21.569 5.766 -5.261 807 HB2 ASN 102 HB2 ASN 102 -22.985 3.087 -4.981 808 HB3 ASN 102 HB3 ASN 102 -21.282 3.463 -4.680 809 HD21 ASN 102 HD22 ASN 102 -20.806 4.979 -2.852 810 HD22 ASN 102 HD21 ASN 102 -21.992 5.092 -1.533 811 H ILE 103 H ILE 103 -20.480 5.531 -7.127 812 HA ILE 103 HA ILE 103 -21.660 4.121 -9.452 813 HB ILE 103 HB ILE 103 -20.793 6.159 -10.837 814 HG12 ILE 103 HG12 ILE 103 -21.687 7.632 -8.324 815 HG13 ILE 103 HG13 ILE 103 -19.998 7.383 -8.753 816 HG21 ILE 103 HG21 ILE 103 -23.106 5.238 -10.780 817 HG22 ILE 103 HG22 ILE 103 -23.472 6.296 -9.400 818 HG23 ILE 103 HG23 ILE 103 -23.074 6.988 -10.985 819 HD11 ILE 103 HD11 ILE 103 -20.323 8.650 -10.837 820 HD12 ILE 103 HD12 ILE 103 -22.035 8.916 -10.426 821 HD13 ILE 103 HD13 ILE 103 -20.763 9.609 -9.411 822 H LYS 104 H LYS 104 -20.321 2.865 -10.307 823 HA LYS 104 HA LYS 104 -17.553 2.624 -9.822 824 HB2 LYS 104 HB2 LYS 104 -17.591 0.925 -11.568 825 HB3 LYS 104 HB3 LYS 104 -18.975 0.818 -10.503 826 HG2 LYS 104 HG2 LYS 104 -19.964 0.375 -12.479 827 HG3 LYS 104 HG3 LYS 104 -20.289 2.104 -12.353 828 HD2 LYS 104 HD2 LYS 104 -18.289 2.503 -13.829 829 HD3 LYS 104 HD3 LYS 104 -18.097 0.754 -14.021 830 HE2 LYS 104 HE2 LYS 104 -20.586 2.383 -14.758 831 HE3 LYS 104 HE3 LYS 104 -19.300 1.995 -15.895 832 HZ1 LYS 104 HZ1 LYS 104 -19.816 -0.358 -15.633 833 HZ2 LYS 104 HZ2 LYS 104 -20.978 -0.042 -14.517 834 HZ3 LYS 104 HZ3 LYS 104 -21.160 0.444 -16.061 835 H ILE 105 H ILE 105 -15.867 2.551 -11.479 836 HA ILE 105 HA ILE 105 -15.209 5.187 -12.401 837 HB ILE 105 HB ILE 105 -14.095 2.454 -13.215 838 HG12 ILE 105 HG12 ILE 105 -12.544 4.045 -11.249 839 HG13 ILE 105 HG13 ILE 105 -14.030 3.345 -10.616 840 HG21 ILE 105 HG21 ILE 105 -13.261 4.105 -14.769 841 HG22 ILE 105 HG22 ILE 105 -12.872 5.234 -13.459 842 HG23 ILE 105 HG23 ILE 105 -11.949 3.732 -13.648 843 HD11 ILE 105 HD11 ILE 105 -13.209 1.128 -11.566 844 HD12 ILE 105 HD12 ILE 105 -11.636 1.963 -11.815 845 HD13 ILE 105 HD13 ILE 105 -12.339 1.805 -10.191 846 H ALA 106 H ALA 106 -15.951 6.208 -14.110 847 HA ALA 106 HA ALA 106 -17.570 4.925 -16.196 848 HB1 ALA 106 HB1 ALA 106 -18.153 7.127 -15.320 849 HB2 ALA 106 HB2 ALA 106 -16.584 7.796 -15.821 850 HB3 ALA 106 HB3 ALA 106 -17.761 7.253 -17.039 851 H THR 107 H THR 107 -14.390 6.489 -15.924 852 HA THR 107 HA THR 107 -13.394 5.084 -18.320 853 HB THR 107 HB THR 107 -12.322 7.283 -19.116 854 HG1 THR 107 HG1 THR 107 -13.640 9.106 -18.730 855 HG21 THR 107 HG21 THR 107 -14.136 6.078 -20.348 856 HG22 THR 107 HG22 THR 107 -15.329 7.096 -19.509 857 HG23 THR 107 HG23 THR 107 -14.128 7.830 -20.593 858 H ARG 108 H ARG 108 -11.272 4.811 -18.409 859 HA ARG 108 HA ARG 108 -9.438 5.953 -16.388 860 HB2 ARG 108 HB2 ARG 108 -10.187 4.004 -15.254 861 HB3 ARG 108 HB3 ARG 108 -10.132 2.998 -16.694 862 HG2 ARG 108 HG2 ARG 108 -7.570 4.236 -15.653 863 HG3 ARG 108 HG3 ARG 108 -8.253 2.869 -14.805 864 HD2 ARG 108 HD2 ARG 108 -7.791 2.713 -17.809 865 HD3 ARG 108 HD3 ARG 108 -6.495 2.407 -16.661 866 HE ARG 108 HE ARG 108 -8.790 0.863 -15.932 867 HH11 ARG 108 HH11 ARG 108 -6.500 0.935 -18.594 868 HH12 ARG 108 HH12 ARG 108 -6.532 -0.797 -18.788 869 HH21 ARG 108 HH21 ARG 108 -8.701 -1.367 -16.189 870 HH22 ARG 108 HH22 ARG 108 -7.749 -2.051 -17.475 871 H LYS 109 H LYS 109 -7.423 6.125 -17.072 872 HA LYS 109 HA LYS 109 -6.235 4.640 -19.268 873 HB2 LYS 109 HB2 LYS 109 -6.873 7.609 -19.590 874 HB3 LYS 109 HB3 LYS 109 -5.409 6.927 -20.278 875 HG2 LYS 109 HG2 LYS 109 -6.985 5.139 -21.371 876 HG3 LYS 109 HG3 LYS 109 -8.279 6.279 -20.983 877 HD2 LYS 109 HD2 LYS 109 -7.589 6.637 -23.254 878 HD3 LYS 109 HD3 LYS 109 -7.072 8.039 -22.300 879 HE2 LYS 109 HE2 LYS 109 -4.775 7.117 -22.173 880 HE3 LYS 109 HE3 LYS 109 -5.295 5.659 -23.027 881 HZ1 LYS 109 HZ1 LYS 109 -5.777 7.046 -24.973 882 HZ2 LYS 109 HZ2 LYS 109 -5.320 8.404 -24.181 883 HZ3 LYS 109 HZ3 LYS 109 -4.221 7.247 -24.527 884 H TYR 110 H TYR 110 -4.008 4.739 -19.246 885 HA TYR 110 HA TYR 110 -2.656 5.598 -16.836 886 HB2 TYR 110 HB2 TYR 110 -1.900 3.682 -18.265 887 HB3 TYR 110 HB3 TYR 110 -1.577 4.800 -19.574 888 HD1 TYR 110 HD2 TYR 110 -0.786 5.187 -15.897 889 HD2 TYR 110 HD1 TYR 110 0.773 4.617 -19.884 890 HE1 TYR 110 HE2 TYR 110 1.484 5.556 -15.060 891 HE2 TYR 110 HE1 TYR 110 3.083 4.878 -19.007 892 HH TYR 110 HH TYR 110 4.374 5.248 -17.160 893 H LEU 111 H LEU 111 -1.730 7.564 -16.392 894 HA LEU 111 HA LEU 111 -1.786 9.683 -18.516 895 HB2 LEU 111 HB2 LEU 111 -1.452 9.770 -15.485 896 HB3 LEU 111 HB3 LEU 111 -1.363 11.183 -16.539 897 HG LEU 111 HG LEU 111 -3.810 9.388 -16.304 898 HD11 LEU 111 HD11 LEU 111 -3.312 10.566 -14.195 899 HD12 LEU 111 HD12 LEU 111 -3.238 12.113 -15.071 900 HD13 LEU 111 HD13 LEU 111 -4.764 11.207 -14.980 901 HD21 LEU 111 HD21 LEU 111 -3.307 12.101 -17.609 902 HD22 LEU 111 HD22 LEU 111 -3.772 10.595 -18.438 903 HD23 LEU 111 HD23 LEU 111 -4.925 11.401 -17.371 904 H GLY 112 H GLY 112 0.370 8.190 -16.119 905 HA2 GLY 112 HA2 GLY 112 2.742 7.973 -17.323 906 HA3 GLY 112 HA3 GLY 112 2.697 9.730 -17.104 907 H LYS 113 H LYS 113 4.268 9.955 -15.589 908 HA LYS 113 HA LYS 113 4.077 8.344 -13.070 909 HB2 LYS 113 HB2 LYS 113 5.922 7.805 -14.905 910 HB3 LYS 113 HB3 LYS 113 6.765 9.130 -14.078 911 HG2 LYS 113 HG2 LYS 113 6.231 7.928 -11.894 912 HG3 LYS 113 HG3 LYS 113 5.714 6.544 -12.853 913 HD2 LYS 113 HD2 LYS 113 8.512 7.752 -13.069 914 HD3 LYS 113 HD3 LYS 113 8.077 6.532 -11.888 915 HE2 LYS 113 HE2 LYS 113 9.099 5.342 -13.597 916 HE3 LYS 113 HE3 LYS 113 7.379 4.990 -13.745 917 HZ1 LYS 113 HZ1 LYS 113 7.288 6.511 -15.635 918 HZ2 LYS 113 HZ2 LYS 113 8.846 6.982 -15.412 919 HZ3 LYS 113 HZ3 LYS 113 8.505 5.460 -15.886 920 H GLN 114 H GLN 114 3.080 9.838 -11.949 921 HA GLN 114 HA GLN 114 4.252 12.508 -11.536 922 HB2 GLN 114 HB2 GLN 114 1.543 11.614 -10.600 923 HB3 GLN 114 HB3 GLN 114 2.150 13.240 -10.958 924 HG2 GLN 114 HG2 GLN 114 2.587 12.415 -13.345 925 HG3 GLN 114 HG3 GLN 114 1.650 10.975 -12.915 926 HE21 GLN 114 HE22 GLN 114 0.399 11.457 -14.709 927 HE22 GLN 114 HE21 GLN 114 -0.438 12.950 -14.776 928 H ASN 115 H ASN 115 4.461 13.366 -9.332 929 HA ASN 115 HA ASN 115 5.373 11.576 -7.363 930 HB2 ASN 115 HB2 ASN 115 5.729 14.214 -7.840 931 HB3 ASN 115 HB3 ASN 115 4.451 14.344 -6.617 932 HD21 ASN 115 HD22 ASN 115 5.136 12.147 -4.908 933 HD22 ASN 115 HD21 ASN 115 6.820 12.285 -4.505 934 H VAL 116 H VAL 116 4.187 10.202 -6.186 935 HA VAL 116 HA VAL 116 1.512 11.124 -5.215 936 HB VAL 116 HB VAL 116 0.827 8.767 -5.214 937 HG11 VAL 116 HG11 VAL 116 0.236 10.269 -7.088 938 HG12 VAL 116 HG12 VAL 116 1.656 9.681 -7.972 939 HG13 VAL 116 HG13 VAL 116 0.340 8.565 -7.532 940 HG21 VAL 116 HG21 VAL 116 3.333 8.238 -6.883 941 HG22 VAL 116 HG22 VAL 116 3.060 7.672 -5.221 942 HG23 VAL 116 HG23 VAL 116 2.024 7.095 -6.531 943 H TYR 117 H TYR 117 0.819 10.522 -3.220 944 HA TYR 117 HA TYR 117 2.908 9.826 -1.196 945 HB2 TYR 117 HB2 TYR 117 0.916 12.086 -0.893 946 HB3 TYR 117 HB3 TYR 117 2.354 11.755 0.052 947 HD1 TYR 117 HD2 TYR 117 1.051 13.130 -3.122 948 HD2 TYR 117 HD1 TYR 117 4.566 12.513 -0.697 949 HE1 TYR 117 HE2 TYR 117 2.285 14.799 -4.489 950 HE2 TYR 117 HE1 TYR 117 5.790 14.216 -2.042 951 HH TYR 117 HH TYR 117 4.214 16.018 -4.701 952 H ASP 118 H ASP 118 2.028 9.251 0.912 953 HA ASP 118 HA ASP 118 -0.825 8.726 1.207 954 HB2 ASP 118 HB2 ASP 118 -0.648 6.359 1.546 955 HB3 ASP 118 HB3 ASP 118 -0.235 6.778 -0.100 956 H ILE 119 H ILE 119 -1.222 9.419 3.198 957 HA ILE 119 HA ILE 119 0.810 9.536 5.282 958 HB ILE 119 HB ILE 119 -1.034 10.256 6.737 959 HG12 ILE 119 HG12 ILE 119 -2.860 10.133 4.293 960 HG13 ILE 119 HG13 ILE 119 -2.855 8.905 5.561 961 HG21 ILE 119 HG21 ILE 119 0.303 11.830 5.384 962 HG22 ILE 119 HG22 ILE 119 -0.860 11.713 4.054 963 HG23 ILE 119 HG23 ILE 119 -1.341 12.431 5.609 964 HD11 ILE 119 HD11 ILE 119 -3.454 10.593 7.248 965 HD12 ILE 119 HD12 ILE 119 -3.524 11.842 5.977 966 HD13 ILE 119 HD13 ILE 119 -4.652 10.476 5.949 967 H GLY 120 H GLY 120 0.735 8.450 7.297 968 HA2 GLY 120 HA2 GLY 120 -0.379 5.670 7.183 969 HA3 GLY 120 HA3 GLY 120 1.097 6.129 8.033 970 H VAL 121 H VAL 121 -1.241 4.807 9.112 971 HA VAL 121 HA VAL 121 -2.089 6.673 11.276 972 HB VAL 121 HB VAL 121 -4.023 5.042 9.633 973 HG11 VAL 121 HG11 VAL 121 -4.811 5.406 11.918 974 HG12 VAL 121 HG12 VAL 121 -4.430 7.147 11.808 975 HG13 VAL 121 HG13 VAL 121 -5.717 6.429 10.822 976 HG21 VAL 121 HG21 VAL 121 -3.598 8.055 9.511 977 HG22 VAL 121 HG22 VAL 121 -3.344 6.892 8.185 978 HG23 VAL 121 HG23 VAL 121 -4.968 7.182 8.789 979 H GLU 122 H GLU 122 -2.528 5.596 13.226 980 HA GLU 122 HA GLU 122 -1.482 2.875 13.454 981 HB2 GLU 122 HB2 GLU 122 -0.906 4.593 15.062 982 HB3 GLU 122 HB3 GLU 122 -2.609 4.845 15.479 983 HG2 GLU 122 HG2 GLU 122 -2.753 2.606 16.453 984 HG3 GLU 122 HG3 GLU 122 -1.135 2.206 15.866 985 H ARG 123 H ARG 123 -4.711 4.353 14.122 986 HA ARG 123 HA ARG 123 -5.856 1.912 15.126 987 HB2 ARG 123 HB2 ARG 123 -6.684 4.685 14.769 988 HB3 ARG 123 HB3 ARG 123 -7.955 3.623 14.164 989 HG2 ARG 123 HG2 ARG 123 -7.714 2.343 16.399 990 HG3 ARG 123 HG3 ARG 123 -6.752 3.728 16.936 991 HD2 ARG 123 HD2 ARG 123 -8.768 4.579 17.595 992 HD3 ARG 123 HD3 ARG 123 -8.917 5.050 15.908 993 HE ARG 123 HE ARG 123 -10.617 3.477 15.632 994 HH11 ARG 123 HH11 ARG 123 -8.938 2.651 18.607 995 HH12 ARG 123 HH12 ARG 123 -10.123 1.447 19.043 996 HH21 ARG 123 HH21 ARG 123 -12.155 1.999 16.325 997 HH22 ARG 123 HH22 ARG 123 -11.853 1.069 17.772 998 H ASP 124 H ASP 124 -6.391 3.552 12.037 999 HA ASP 124 HA ASP 124 -6.888 1.009 10.608 1000 HB2 ASP 124 HB2 ASP 124 -8.891 3.308 10.793 1001 HB3 ASP 124 HB3 ASP 124 -8.903 2.095 9.515 1002 H HIS 125 H HIS 125 -5.785 1.122 8.732 1003 HA HIS 125 HA HIS 125 -4.471 3.568 7.862 1004 HB2 HIS 125 HB2 HIS 125 -4.532 0.746 6.733 1005 HB3 HIS 125 HB3 HIS 125 -3.588 2.073 6.071 1006 HD1 HIS 125 HD1 HIS 125 -1.260 2.563 7.148 1007 HD2 HIS 125 HD2 HIS 125 -3.681 -0.188 9.220 1008 HE1 HIS 125 HE1 HIS 125 0.229 1.496 8.921 1009 H ASN 126 H ASN 126 -6.882 4.465 7.691 1010 HA ASN 126 HA ASN 126 -7.445 4.754 4.818 1011 HB2 ASN 126 HB2 ASN 126 -9.793 4.212 5.030 1012 HB3 ASN 126 HB3 ASN 126 -8.859 2.836 5.599 1013 HD21 ASN 126 HD22 ASN 126 -11.517 2.981 6.261 1014 HD22 ASN 126 HD21 ASN 126 -11.677 3.410 7.957 1015 H PHE 127 H PHE 127 -9.106 6.448 4.385 1016 HA PHE 127 HA PHE 127 -9.667 8.491 6.333 1017 HB2 PHE 127 HB2 PHE 127 -8.230 10.281 5.228 1018 HB3 PHE 127 HB3 PHE 127 -7.414 9.157 6.287 1019 HD1 PHE 127 HD1 PHE 127 -8.011 10.002 2.702 1020 HD2 PHE 127 HD2 PHE 127 -5.641 7.731 5.501 1021 HE1 PHE 127 HE1 PHE 127 -6.459 9.380 0.886 1022 HE2 PHE 127 HE2 PHE 127 -4.080 7.105 3.671 1023 HZ PHE 127 HZ PHE 127 -4.493 7.911 1.356 1024 H ALA 128 H ALA 128 -11.091 10.034 5.589 1025 HA ALA 128 HA ALA 128 -12.477 9.539 3.125 1026 HB1 ALA 128 HB1 ALA 128 -13.557 10.341 5.226 1027 HB2 ALA 128 HB2 ALA 128 -12.726 11.905 5.017 1028 HB3 ALA 128 HB3 ALA 128 -13.928 11.364 3.832 1029 H LEU 129 H LEU 129 -12.975 11.196 1.527 1030 HA LEU 129 HA LEU 129 -10.755 13.076 0.776 1031 HB2 LEU 129 HB2 LEU 129 -12.412 11.084 -0.808 1032 HB3 LEU 129 HB3 LEU 129 -11.459 12.339 -1.588 1033 HG LEU 129 HG LEU 129 -10.181 10.261 0.251 1034 HD11 LEU 129 HD11 LEU 129 -11.109 8.949 -1.511 1035 HD12 LEU 129 HD12 LEU 129 -10.680 10.155 -2.753 1036 HD13 LEU 129 HD13 LEU 129 -9.422 9.204 -1.936 1037 HD21 LEU 129 HD21 LEU 129 -9.130 12.034 -1.987 1038 HD22 LEU 129 HD22 LEU 129 -8.940 12.355 -0.252 1039 HD23 LEU 129 HD23 LEU 129 -8.162 10.933 -0.972 1040 H LYS 130 H LYS 130 -11.423 14.776 -0.777 1041 HA LYS 130 HA LYS 130 -13.527 16.349 0.157 1042 HB2 LYS 130 HB2 LYS 130 -13.131 17.832 -1.625 1043 HB3 LYS 130 HB3 LYS 130 -11.575 17.105 -1.235 1044 HG2 LYS 130 HG2 LYS 130 -11.817 15.560 -3.163 1045 HG3 LYS 130 HG3 LYS 130 -13.348 16.329 -3.593 1046 HD2 LYS 130 HD2 LYS 130 -10.714 17.837 -3.539 1047 HD3 LYS 130 HD3 LYS 130 -11.337 16.980 -4.932 1048 HE2 LYS 130 HE2 LYS 130 -11.954 19.163 -5.349 1049 HE3 LYS 130 HE3 LYS 130 -13.447 18.396 -4.810 1050 HZ1 LYS 130 HZ1 LYS 130 -13.213 19.513 -2.696 1051 HZ2 LYS 130 HZ2 LYS 130 -11.669 20.004 -3.033 1052 HZ3 LYS 130 HZ3 LYS 130 -12.949 20.642 -3.837 1053 H ASN 131 H ASN 131 -13.779 13.955 -2.347 1054 HA ASN 131 HA ASN 131 -16.468 14.787 -3.220 1055 HB2 ASN 131 HB2 ASN 131 -14.647 12.456 -3.984 1056 HB3 ASN 131 HB3 ASN 131 -16.160 12.863 -4.802 1057 HD21 ASN 131 HD22 ASN 131 -12.891 13.142 -5.133 1058 HD22 ASN 131 HD21 ASN 131 -12.849 14.619 -6.078 1059 H GLY 132 H GLY 132 -15.671 13.463 -0.423 1060 HA2 GLY 132 HA2 GLY 132 -16.855 12.310 1.154 1061 HA3 GLY 132 HA3 GLY 132 -18.093 11.868 -0.026 1062 H PHE 133 H PHE 133 -15.094 11.033 -1.335 1063 HA PHE 133 HA PHE 133 -15.567 8.186 -1.113 1064 HB2 PHE 133 HB2 PHE 133 -13.464 9.994 -2.329 1065 HB3 PHE 133 HB3 PHE 133 -13.101 8.290 -2.112 1066 HD1 PHE 133 HD2 PHE 133 -15.705 10.547 -3.577 1067 HD2 PHE 133 HD1 PHE 133 -13.725 6.731 -3.648 1068 HE1 PHE 133 HE2 PHE 133 -16.910 9.966 -5.690 1069 HE2 PHE 133 HE1 PHE 133 -15.000 6.135 -5.688 1070 HZ PHE 133 HZ PHE 133 -16.572 7.704 -6.696 1071 H ILE 134 H ILE 134 -13.885 6.607 -0.398 1072 HA ILE 134 HA ILE 134 -12.134 7.567 1.800 1073 HB ILE 134 HB ILE 134 -13.716 4.981 1.988 1074 HG12 ILE 134 HG12 ILE 134 -14.611 6.162 4.144 1075 HG13 ILE 134 HG13 ILE 134 -14.194 7.669 3.337 1076 HG21 ILE 134 HG21 ILE 134 -11.528 4.795 3.033 1077 HG22 ILE 134 HG22 ILE 134 -11.732 6.362 3.848 1078 HG23 ILE 134 HG23 ILE 134 -12.705 4.975 4.323 1079 HD11 ILE 134 HD11 ILE 134 -15.829 7.221 1.594 1080 HD12 ILE 134 HD12 ILE 134 -15.990 5.526 2.095 1081 HD13 ILE 134 HD13 ILE 134 -16.606 6.830 3.126 1082 H ALA 135 H ALA 135 -10.158 7.035 1.504 1083 HA ALA 135 HA ALA 135 -9.354 4.883 -0.410 1084 HB1 ALA 135 HB1 ALA 135 -7.745 6.298 -1.089 1085 HB2 ALA 135 HB2 ALA 135 -8.465 7.574 -0.098 1086 HB3 ALA 135 HB3 ALA 135 -7.183 6.561 0.574 1087 H SER 136 H SER 136 -7.888 3.274 0.313 1088 HA SER 136 HA SER 136 -7.076 3.264 3.166 1089 HB2 SER 136 HB2 SER 136 -9.158 2.068 3.197 1090 HB3 SER 136 HB3 SER 136 -8.673 1.070 1.813 1091 HG SER 136 HG SER 136 -7.384 1.109 4.360 1092 H ASN 137 H ASN 137 -5.187 2.290 3.618 1093 HA ASN 137 HA ASN 137 -3.418 1.748 1.313 1094 HB2 ASN 137 HB2 ASN 137 -3.059 3.446 3.323 1095 HB3 ASN 137 HB3 ASN 137 -2.516 2.015 4.184 1096 HD21 ASN 137 HD22 ASN 137 -1.791 4.282 1.648 1097 HD22 ASN 137 HD21 ASN 137 -0.079 3.900 1.637 Start of MODEL 2 1 H1 GLY -1 H GLY -1 4.080 -1.251 -2.086 2 HA2 GLY -1 HA2 GLY -1 2.021 -0.329 -1.834 3 HA3 GLY -1 HA3 GLY -1 3.078 0.792 -0.966 4 H GLY 0 H GLY 0 0.523 0.730 -2.852 5 HA2 GLY 0 HA2 GLY 0 0.794 2.734 -4.858 6 HA3 GLY 0 HA3 GLY 0 -0.672 2.161 -4.110 7 H ALA 1 H ALA 1 -0.454 4.739 -4.813 8 HA ALA 1 HA ALA 1 -0.770 6.250 -2.318 9 HB1 ALA 1 HB1 ALA 1 1.602 6.280 -2.456 10 HB2 ALA 1 HB2 ALA 1 1.575 6.606 -4.204 11 HB3 ALA 1 HB3 ALA 1 1.065 7.844 -3.041 12 H LEU 2 H LEU 2 -0.933 8.683 -2.972 13 HA LEU 2 HA LEU 2 -2.911 8.940 -5.213 14 HB2 LEU 2 HB2 LEU 2 -2.844 10.161 -2.424 15 HB3 LEU 2 HB3 LEU 2 -4.050 10.503 -3.643 16 HG LEU 2 HG LEU 2 -3.597 7.698 -2.540 17 HD11 LEU 2 HD11 LEU 2 -4.171 9.138 -0.681 18 HD12 LEU 2 HD12 LEU 2 -5.576 9.776 -1.559 19 HD13 LEU 2 HD13 LEU 2 -5.513 8.061 -1.087 20 HD21 LEU 2 HD21 LEU 2 -5.145 8.602 -4.720 21 HD22 LEU 2 HD22 LEU 2 -5.245 7.031 -3.901 22 HD23 LEU 2 HD23 LEU 2 -6.310 8.360 -3.417 23 H SER 3 H SER 3 -2.983 10.947 -6.315 24 HA SER 3 HA SER 3 -0.409 12.275 -6.625 25 HB2 SER 3 HB2 SER 3 -2.061 11.840 -8.456 26 HB3 SER 3 HB3 SER 3 -3.118 13.076 -7.737 27 HG SER 3 HG SER 3 -1.620 13.785 -9.458 28 H TYR 4 H TYR 4 -0.174 14.664 -6.591 29 HA TYR 4 HA TYR 4 -0.564 15.820 -4.036 30 HB2 TYR 4 HB2 TYR 4 1.090 16.587 -5.662 31 HB3 TYR 4 HB3 TYR 4 -0.171 17.125 -6.759 32 HD1 TYR 4 HD2 TYR 4 -1.518 19.137 -6.283 33 HD2 TYR 4 HD1 TYR 4 1.681 17.896 -3.668 34 HE1 TYR 4 HE2 TYR 4 -1.608 21.340 -5.131 35 HE2 TYR 4 HE1 TYR 4 1.570 20.092 -2.492 36 HH TYR 4 HH TYR 4 -0.735 22.644 -3.496 37 H GLU 5 H GLU 5 -2.564 16.157 -6.998 38 HA GLU 5 HA GLU 5 -4.410 18.103 -6.142 39 HB2 GLU 5 HB2 GLU 5 -4.027 17.585 -8.436 40 HB3 GLU 5 HB3 GLU 5 -4.231 15.862 -8.171 41 HG2 GLU 5 HG2 GLU 5 -6.031 16.657 -9.413 42 HG3 GLU 5 HG3 GLU 5 -6.585 16.078 -7.860 43 H THR 6 H THR 6 -4.160 14.768 -5.175 44 HA THR 6 HA THR 6 -6.973 14.352 -4.561 45 HB THR 6 HB THR 6 -4.562 12.799 -3.533 46 HG1 THR 6 HG1 THR 6 -6.191 12.331 -5.803 47 HG21 THR 6 HG21 THR 6 -6.570 12.191 -2.326 48 HG22 THR 6 HG22 THR 6 -7.517 12.121 -3.837 49 HG23 THR 6 HG23 THR 6 -6.257 10.922 -3.511 50 H GLU 7 H GLU 7 -7.572 16.163 -3.365 51 HA GLU 7 HA GLU 7 -6.315 16.703 -0.820 52 HB2 GLU 7 HB2 GLU 7 -9.043 17.695 -1.597 53 HB3 GLU 7 HB3 GLU 7 -7.904 18.409 -0.479 54 HG2 GLU 7 HG2 GLU 7 -6.342 18.723 -2.517 55 HG3 GLU 7 HG3 GLU 7 -7.739 18.343 -3.509 56 H ILE 8 H ILE 8 -7.012 16.465 1.206 57 HA ILE 8 HA ILE 8 -8.939 14.248 1.795 58 HB ILE 8 HB ILE 8 -6.424 15.065 3.311 59 HG12 ILE 8 HG12 ILE 8 -5.633 14.211 1.223 60 HG13 ILE 8 HG13 ILE 8 -5.307 13.047 2.491 61 HG21 ILE 8 HG21 ILE 8 -6.669 12.936 4.496 62 HG22 ILE 8 HG22 ILE 8 -8.102 13.941 4.711 63 HG23 ILE 8 HG23 ILE 8 -8.142 12.573 3.591 64 HD11 ILE 8 HD11 ILE 8 -7.195 11.641 1.709 65 HD12 ILE 8 HD12 ILE 8 -7.565 12.844 0.461 66 HD13 ILE 8 HD13 ILE 8 -6.038 11.954 0.403 67 H LEU 9 H LEU 9 -10.648 14.935 2.979 68 HA LEU 9 HA LEU 9 -10.826 17.521 4.233 69 HB2 LEU 9 HB2 LEU 9 -12.779 16.001 3.609 70 HB3 LEU 9 HB3 LEU 9 -12.345 14.997 4.991 71 HG LEU 9 HG LEU 9 -12.637 17.126 6.445 72 HD11 LEU 9 HD11 LEU 9 -12.615 18.825 4.662 73 HD12 LEU 9 HD12 LEU 9 -14.085 18.108 3.958 74 HD13 LEU 9 HD13 LEU 9 -14.131 18.855 5.566 75 HD21 LEU 9 HD21 LEU 9 -15.067 16.031 4.949 76 HD22 LEU 9 HD22 LEU 9 -14.297 15.273 6.357 77 HD23 LEU 9 HD23 LEU 9 -15.088 16.845 6.531 78 H THR 10 H THR 10 -10.105 18.303 6.112 79 HA THR 10 HA THR 10 -9.192 16.451 8.257 80 HB THR 10 HB THR 10 -7.314 17.953 8.740 81 HG1 THR 10 HG1 THR 10 -8.032 19.184 6.293 82 HG21 THR 10 HG21 THR 10 -6.907 15.997 7.294 83 HG22 THR 10 HG22 THR 10 -7.230 16.989 5.855 84 HG23 THR 10 HG23 THR 10 -5.845 17.359 6.899 85 H VAL 11 H VAL 11 -9.345 17.116 10.374 86 HA VAL 11 HA VAL 11 -11.488 19.017 10.934 87 HB VAL 11 HB VAL 11 -9.648 17.708 12.959 88 HG11 VAL 11 HG11 VAL 11 -11.020 19.473 13.952 89 HG12 VAL 11 HG12 VAL 11 -12.482 18.797 13.200 90 HG13 VAL 11 HG13 VAL 11 -11.622 17.902 14.470 91 HG21 VAL 11 HG21 VAL 11 -12.265 16.621 11.871 92 HG22 VAL 11 HG22 VAL 11 -10.663 15.913 11.578 93 HG23 VAL 11 HG23 VAL 11 -11.326 15.940 13.212 94 H GLU 12 H GLU 12 -7.973 19.113 11.170 95 HA GLU 12 HA GLU 12 -7.765 21.484 12.785 96 HB2 GLU 12 HB2 GLU 12 -5.963 19.921 10.956 97 HB3 GLU 12 HB3 GLU 12 -5.432 21.532 11.447 98 HG2 GLU 12 HG2 GLU 12 -6.173 19.293 13.373 99 HG3 GLU 12 HG3 GLU 12 -4.535 19.750 12.907 100 H TYR 13 H TYR 13 -8.332 21.110 9.322 101 HA TYR 13 HA TYR 13 -8.457 24.081 9.046 102 HB2 TYR 13 HB2 TYR 13 -6.836 22.193 7.315 103 HB3 TYR 13 HB3 TYR 13 -7.173 23.884 6.931 104 HD1 TYR 13 HD1 TYR 13 -6.520 25.592 8.936 105 HD2 TYR 13 HD2 TYR 13 -4.667 21.766 8.135 106 HE1 TYR 13 HE1 TYR 13 -4.437 26.352 10.075 107 HE2 TYR 13 HE2 TYR 13 -2.599 22.534 9.268 108 HH TYR 13 HH TYR 13 -1.558 24.247 10.356 109 H GLY 14 H GLY 14 -8.760 21.134 6.910 110 HA2 GLY 14 HA2 GLY 14 -11.410 21.053 6.301 111 HA3 GLY 14 HA3 GLY 14 -10.872 22.470 5.391 112 H LEU 15 H LEU 15 -11.218 21.533 3.396 113 HA LEU 15 HA LEU 15 -9.971 19.059 2.473 114 HB2 LEU 15 HB2 LEU 15 -11.161 21.464 1.013 115 HB3 LEU 15 HB3 LEU 15 -10.678 19.959 0.241 116 HG LEU 15 HG LEU 15 -12.891 20.222 2.333 117 HD11 LEU 15 HD11 LEU 15 -13.480 21.298 0.203 118 HD12 LEU 15 HD12 LEU 15 -13.039 19.821 -0.681 119 HD13 LEU 15 HD13 LEU 15 -14.412 19.814 0.448 120 HD21 LEU 15 HD21 LEU 15 -11.888 17.892 0.664 121 HD22 LEU 15 HD22 LEU 15 -11.948 18.001 2.418 122 HD23 LEU 15 HD23 LEU 15 -13.459 17.896 1.514 123 H LEU 16 H LEU 16 -7.740 18.987 2.610 124 HA LEU 16 HA LEU 16 -6.248 21.007 0.980 125 HB2 LEU 16 HB2 LEU 16 -5.567 19.858 3.706 126 HB3 LEU 16 HB3 LEU 16 -4.322 20.487 2.652 127 HG LEU 16 HG LEU 16 -6.426 22.470 2.717 128 HD11 LEU 16 HD11 LEU 16 -7.143 21.418 4.798 129 HD12 LEU 16 HD12 LEU 16 -5.503 21.628 5.462 130 HD13 LEU 16 HD13 LEU 16 -6.488 23.050 5.015 131 HD21 LEU 16 HD21 LEU 16 -3.664 22.465 4.001 132 HD22 LEU 16 HD22 LEU 16 -4.019 22.921 2.318 133 HD23 LEU 16 HD23 LEU 16 -4.665 23.892 3.651 134 HA PRO 17 HA PRO 17 -4.610 17.714 -1.401 135 HB2 PRO 17 HB2 PRO 17 -2.164 18.709 -2.174 136 HB3 PRO 17 HB3 PRO 17 -3.743 19.276 -2.804 137 HG2 PRO 17 HG2 PRO 17 -2.038 20.487 -0.633 138 HG3 PRO 17 HG3 PRO 17 -2.852 21.313 -2.000 139 HD2 PRO 17 HD2 PRO 17 -3.918 21.265 0.491 140 HD3 PRO 17 HD3 PRO 17 -4.954 21.149 -0.958 141 H ILE 18 H ILE 18 -3.844 15.751 -0.847 142 HA ILE 18 HA ILE 18 -2.431 15.194 1.510 143 HB ILE 18 HB ILE 18 -3.764 13.570 0.193 144 HG12 ILE 18 HG12 ILE 18 -0.958 12.599 0.871 145 HG13 ILE 18 HG13 ILE 18 -2.233 12.931 2.052 146 HG21 ILE 18 HG21 ILE 18 -2.718 14.105 -2.057 147 HG22 ILE 18 HG22 ILE 18 -1.309 13.149 -1.556 148 HG23 ILE 18 HG23 ILE 18 -2.908 12.396 -1.694 149 HD11 ILE 18 HD11 ILE 18 -3.660 11.188 0.921 150 HD12 ILE 18 HD12 ILE 18 -2.256 10.783 -0.098 151 HD13 ILE 18 HD13 ILE 18 -2.164 10.567 1.654 152 H GLY 19 H GLY 19 -1.085 15.939 -1.690 153 HA2 GLY 19 HA2 GLY 19 1.587 15.099 -1.137 154 HA3 GLY 19 HA3 GLY 19 1.106 16.292 -2.350 155 H LYS 20 H LYS 20 -0.102 18.155 -0.314 156 HA LYS 20 HA LYS 20 2.413 19.467 0.468 157 HB2 LYS 20 HB2 LYS 20 0.457 20.753 -0.355 158 HB3 LYS 20 HB3 LYS 20 -0.486 20.234 1.052 159 HG2 LYS 20 HG2 LYS 20 0.938 21.424 2.565 160 HG3 LYS 20 HG3 LYS 20 2.142 21.758 1.318 161 HD2 LYS 20 HD2 LYS 20 -0.709 22.843 1.225 162 HD3 LYS 20 HD3 LYS 20 0.639 23.688 2.006 163 HE2 LYS 20 HE2 LYS 20 1.913 23.632 -0.145 164 HE3 LYS 20 HE3 LYS 20 0.518 22.887 -0.934 165 HZ1 LYS 20 HZ1 LYS 20 -0.770 24.891 -0.389 166 HZ2 LYS 20 HZ2 LYS 20 0.521 25.571 0.350 167 HZ3 LYS 20 HZ3 LYS 20 0.552 25.297 -1.257 168 H ILE 21 H ILE 21 -0.014 17.458 2.014 169 HA ILE 21 HA ILE 21 0.781 17.991 4.744 170 HB ILE 21 HB ILE 21 -0.631 15.566 3.606 171 HG12 ILE 21 HG12 ILE 21 -1.849 18.035 4.953 172 HG13 ILE 21 HG13 ILE 21 -1.798 17.822 3.211 173 HG21 ILE 21 HG21 ILE 21 0.263 15.057 5.803 174 HG22 ILE 21 HG22 ILE 21 -0.540 16.491 6.474 175 HG23 ILE 21 HG23 ILE 21 -1.484 15.137 5.846 176 HD11 ILE 21 HD11 ILE 21 -3.126 15.692 3.481 177 HD12 ILE 21 HD12 ILE 21 -3.402 16.177 5.171 178 HD13 ILE 21 HD13 ILE 21 -3.964 17.209 3.842 179 H VAL 22 H VAL 22 1.786 15.613 2.283 180 HA VAL 22 HA VAL 22 3.636 14.320 4.169 181 HB VAL 22 HB VAL 22 3.078 13.907 1.221 182 HG11 VAL 22 HG11 VAL 22 5.360 13.099 1.793 183 HG12 VAL 22 HG12 VAL 22 4.683 12.139 3.125 184 HG13 VAL 22 HG13 VAL 22 4.256 11.783 1.439 185 HG21 VAL 22 HG21 VAL 22 2.224 12.413 3.756 186 HG22 VAL 22 HG22 VAL 22 1.163 13.324 2.663 187 HG23 VAL 22 HG23 VAL 22 1.923 11.826 2.118 188 H GLU 23 H GLU 23 4.003 16.572 1.374 189 HA GLU 23 HA GLU 23 6.905 16.486 1.429 190 HB2 GLU 23 HB2 GLU 23 4.968 18.554 0.311 191 HB3 GLU 23 HB3 GLU 23 6.727 18.661 0.165 192 HG2 GLU 23 HG2 GLU 23 6.727 16.378 -0.905 193 HG3 GLU 23 HG3 GLU 23 4.969 16.472 -0.982 194 H LYS 24 H LYS 24 4.560 18.243 3.318 195 HA LYS 24 HA LYS 24 6.747 19.826 4.641 196 HB2 LYS 24 HB2 LYS 24 3.814 20.563 4.564 197 HB3 LYS 24 HB3 LYS 24 5.153 21.545 5.116 198 HG2 LYS 24 HG2 LYS 24 4.571 20.732 2.238 199 HG3 LYS 24 HG3 LYS 24 4.281 22.306 2.975 200 HD2 LYS 24 HD2 LYS 24 6.798 22.436 3.421 201 HD3 LYS 24 HD3 LYS 24 6.982 21.035 2.363 202 HE2 LYS 24 HE2 LYS 24 5.710 23.705 1.600 203 HE3 LYS 24 HE3 LYS 24 7.364 23.224 1.223 204 HZ1 LYS 24 HZ1 LYS 24 6.479 21.415 -0.146 205 HZ2 LYS 24 HZ2 LYS 24 4.932 21.854 0.191 206 HZ3 LYS 24 HZ3 LYS 24 5.903 22.849 -0.660 207 H ARG 25 H ARG 25 5.073 17.135 5.108 208 HA ARG 25 HA ARG 25 4.410 15.807 6.818 209 HB2 ARG 25 HB2 ARG 25 6.675 17.098 8.361 210 HB3 ARG 25 HB3 ARG 25 5.990 15.487 8.546 211 HG2 ARG 25 HG2 ARG 25 7.816 14.924 7.335 212 HG3 ARG 25 HG3 ARG 25 6.703 15.209 5.985 213 HD2 ARG 25 HD2 ARG 25 7.744 17.212 5.375 214 HD3 ARG 25 HD3 ARG 25 8.405 17.491 6.998 215 HE ARG 25 HE ARG 25 9.633 15.151 6.058 216 HH11 ARG 25 HH11 ARG 25 9.600 18.498 5.002 217 HH12 ARG 25 HH12 ARG 25 11.287 18.462 4.556 218 HH21 ARG 25 HH21 ARG 25 11.766 15.176 5.448 219 HH22 ARG 25 HH22 ARG 25 12.466 16.626 4.779 220 H ILE 26 H ILE 26 2.575 17.553 6.673 221 HA ILE 26 HA ILE 26 2.203 19.258 9.014 222 HB ILE 26 HB ILE 26 0.250 18.549 6.794 223 HG12 ILE 26 HG12 ILE 26 2.053 20.988 7.143 224 HG13 ILE 26 HG13 ILE 26 2.344 19.667 6.014 225 HG21 ILE 26 HG21 ILE 26 -0.905 19.369 8.840 226 HG22 ILE 26 HG22 ILE 26 0.138 20.807 8.844 227 HG23 ILE 26 HG23 ILE 26 -1.029 20.526 7.534 228 HD11 ILE 26 HD11 ILE 26 0.248 20.196 4.810 229 HD12 ILE 26 HD12 ILE 26 0.030 21.616 5.868 230 HD13 ILE 26 HD13 ILE 26 1.441 21.508 4.807 231 H GLU 27 H GLU 27 1.444 18.653 10.897 232 HA GLU 27 HA GLU 27 0.047 16.082 11.288 233 HB2 GLU 27 HB2 GLU 27 0.122 16.779 13.718 234 HB3 GLU 27 HB3 GLU 27 1.642 16.358 12.933 235 HG2 GLU 27 HG2 GLU 27 2.269 18.676 12.679 236 HG3 GLU 27 HG3 GLU 27 0.713 19.227 13.314 237 H CYS 28 H CYS 28 -1.955 15.835 11.283 238 HA CYS 28 HA CYS 28 -3.914 17.881 12.003 239 HB2 CYS 28 HB2 CYS 28 -5.025 17.791 9.761 240 HB3 CYS 28 HB3 CYS 28 -3.411 18.489 9.685 241 HG CYS 28 HG CYS 28 -2.158 16.387 8.838 242 H THR 29 H THR 29 -6.186 16.849 11.253 243 HA THR 29 HA THR 29 -6.301 14.034 12.277 244 HB THR 29 HB THR 29 -8.385 16.142 12.781 245 HG1 THR 29 HG1 THR 29 -7.198 17.016 14.221 246 HG21 THR 29 HG21 THR 29 -8.942 13.707 13.209 247 HG22 THR 29 HG22 THR 29 -7.705 13.743 14.499 248 HG23 THR 29 HG23 THR 29 -9.131 14.787 14.600 249 H VAL 30 H VAL 30 -7.836 12.730 11.292 250 HA VAL 30 HA VAL 30 -9.020 13.710 8.716 251 HB VAL 30 HB VAL 30 -8.282 11.754 7.582 252 HG11 VAL 30 HG11 VAL 30 -6.644 13.626 7.769 253 HG12 VAL 30 HG12 VAL 30 -5.868 12.778 9.127 254 HG13 VAL 30 HG13 VAL 30 -5.893 12.042 7.516 255 HG21 VAL 30 HG21 VAL 30 -6.945 10.759 10.132 256 HG22 VAL 30 HG22 VAL 30 -8.400 10.057 9.393 257 HG23 VAL 30 HG23 VAL 30 -6.865 10.011 8.529 258 H TYR 31 H TYR 31 -10.468 11.698 7.808 259 HA TYR 31 HA TYR 31 -12.355 11.004 10.026 260 HB2 TYR 31 HB2 TYR 31 -13.035 11.894 7.197 261 HB3 TYR 31 HB3 TYR 31 -14.168 11.332 8.393 262 HD1 TYR 31 HD2 TYR 31 -11.636 14.056 7.803 263 HD2 TYR 31 HD1 TYR 31 -15.231 12.820 9.833 264 HE1 TYR 31 HE2 TYR 31 -12.008 16.396 8.573 265 HE2 TYR 31 HE1 TYR 31 -15.642 15.178 10.540 266 HH TYR 31 HH TYR 31 -14.892 17.338 10.452 267 H SER 32 H SER 32 -13.268 9.020 10.005 268 HA SER 32 HA SER 32 -13.046 7.109 7.757 269 HB2 SER 32 HB2 SER 32 -10.808 6.931 8.697 270 HB3 SER 32 HB3 SER 32 -11.442 6.843 10.338 271 HG SER 32 HG SER 32 -12.316 4.788 9.834 272 H VAL 33 H VAL 33 -14.429 5.241 8.122 273 HA VAL 33 HA VAL 33 -16.329 5.409 10.373 274 HB VAL 33 HB VAL 33 -17.301 3.339 9.575 275 HG11 VAL 33 HG11 VAL 33 -17.982 5.500 8.573 276 HG12 VAL 33 HG12 VAL 33 -16.855 5.177 7.213 277 HG13 VAL 33 HG13 VAL 33 -18.231 4.098 7.521 278 HG21 VAL 33 HG21 VAL 33 -15.167 3.388 7.423 279 HG22 VAL 33 HG22 VAL 33 -15.319 2.180 8.724 280 HG23 VAL 33 HG23 VAL 33 -16.567 2.286 7.475 281 H ASP 34 H ASP 34 -16.612 3.701 11.922 282 HA ASP 34 HA ASP 34 -14.176 2.162 12.643 283 HB2 ASP 34 HB2 ASP 34 -14.929 2.153 14.838 284 HB3 ASP 34 HB3 ASP 34 -15.321 3.772 14.287 285 H ASN 35 H ASN 35 -15.022 0.147 14.056 286 HA ASN 35 HA ASN 35 -15.970 -1.847 12.206 287 HB2 ASN 35 HB2 ASN 35 -15.601 -1.865 15.231 288 HB3 ASN 35 HB3 ASN 35 -16.030 -3.294 14.300 289 HD21 ASN 35 HD22 ASN 35 -13.552 -2.600 15.912 290 HD22 ASN 35 HD21 ASN 35 -12.249 -2.938 14.777 291 H ASN 36 H ASN 36 -17.835 0.425 13.940 292 HA ASN 36 HA ASN 36 -20.308 -1.241 13.814 293 HB2 ASN 36 HB2 ASN 36 -19.735 1.372 15.281 294 HB3 ASN 36 HB3 ASN 36 -21.254 0.491 15.309 295 HD21 ASN 36 HD22 ASN 36 -18.237 0.865 16.838 296 HD22 ASN 36 HD21 ASN 36 -18.385 -0.537 17.911 297 H GLY 37 H GLY 37 -18.609 0.884 11.858 298 HA2 GLY 37 HA2 GLY 37 -19.238 1.795 9.837 299 HA3 GLY 37 HA3 GLY 37 -20.928 1.410 10.157 300 H ASN 38 H ASN 38 -18.842 3.388 12.319 301 HA ASN 38 HA ASN 38 -20.628 5.759 11.798 302 HB2 ASN 38 HB2 ASN 38 -19.374 4.692 14.363 303 HB3 ASN 38 HB3 ASN 38 -19.985 6.332 14.205 304 HD21 ASN 38 HD22 ASN 38 -20.968 2.921 14.070 305 HD22 ASN 38 HD21 ASN 38 -22.662 3.243 14.423 306 H ILE 39 H ILE 39 -19.633 7.458 10.933 307 HA ILE 39 HA ILE 39 -16.809 7.601 10.493 308 HB ILE 39 HB ILE 39 -18.907 9.775 10.262 309 HG12 ILE 39 HG12 ILE 39 -17.624 8.164 8.008 310 HG13 ILE 39 HG13 ILE 39 -19.119 7.631 8.776 311 HG21 ILE 39 HG21 ILE 39 -16.670 10.763 10.448 312 HG22 ILE 39 HG22 ILE 39 -16.011 9.593 9.287 313 HG23 ILE 39 HG23 ILE 39 -17.148 10.844 8.763 314 HD11 ILE 39 HD11 ILE 39 -20.263 9.697 8.185 315 HD12 ILE 39 HD12 ILE 39 -18.791 10.318 7.411 316 HD13 ILE 39 HD13 ILE 39 -19.609 8.889 6.746 317 H TYR 40 H TYR 40 -15.340 7.992 11.915 318 HA TYR 40 HA TYR 40 -15.733 10.015 14.091 319 HB2 TYR 40 HB2 TYR 40 -14.449 8.734 15.589 320 HB3 TYR 40 HB3 TYR 40 -15.647 7.645 14.931 321 HD1 TYR 40 HD2 TYR 40 -12.057 8.467 15.133 322 HD2 TYR 40 HD1 TYR 40 -14.959 5.754 13.444 323 HE1 TYR 40 HE2 TYR 40 -10.244 6.894 14.509 324 HE2 TYR 40 HE1 TYR 40 -13.122 4.189 12.853 325 HH TYR 40 HH TYR 40 -9.684 5.012 13.437 326 H THR 41 H THR 41 -13.425 10.692 14.928 327 HA THR 41 HA THR 41 -11.688 11.253 12.576 328 HB THR 41 HB THR 41 -11.208 13.486 13.709 329 HG1 THR 41 HG1 THR 41 -12.210 13.038 15.700 330 HG21 THR 41 HG21 THR 41 -12.482 13.426 11.684 331 HG22 THR 41 HG22 THR 41 -13.957 12.920 12.541 332 HG23 THR 41 HG23 THR 41 -13.288 14.539 12.801 333 H GLN 42 H GLN 42 -9.519 11.242 12.780 334 HA GLN 42 HA GLN 42 -8.273 10.725 15.420 335 HB2 GLN 42 HB2 GLN 42 -7.207 8.659 14.627 336 HB3 GLN 42 HB3 GLN 42 -8.960 8.548 14.647 337 HG2 GLN 42 HG2 GLN 42 -8.924 9.030 12.126 338 HG3 GLN 42 HG3 GLN 42 -7.169 8.904 12.195 339 HE21 GLN 42 HE22 GLN 42 -8.651 7.264 10.490 340 HE22 GLN 42 HE21 GLN 42 -8.532 5.623 11.086 341 HA PRO 43 HA PRO 43 -4.981 13.034 13.529 342 HB2 PRO 43 HB2 PRO 43 -2.849 12.475 15.136 343 HB3 PRO 43 HB3 PRO 43 -4.246 13.462 15.659 344 HG2 PRO 43 HG2 PRO 43 -3.760 10.511 16.163 345 HG3 PRO 43 HG3 PRO 43 -4.256 11.774 17.339 346 HD2 PRO 43 HD2 PRO 43 -6.053 10.101 16.151 347 HD3 PRO 43 HD3 PRO 43 -6.456 11.804 16.524 348 H VAL 44 H VAL 44 -3.147 12.880 12.209 349 HA VAL 44 HA VAL 44 -2.566 10.409 10.810 350 HB VAL 44 HB VAL 44 -0.926 12.984 10.984 351 HG11 VAL 44 HG11 VAL 44 0.462 11.195 10.100 352 HG12 VAL 44 HG12 VAL 44 -0.845 10.651 9.024 353 HG13 VAL 44 HG13 VAL 44 -0.039 12.209 8.753 354 HG21 VAL 44 HG21 VAL 44 -3.001 12.105 8.934 355 HG22 VAL 44 HG22 VAL 44 -3.181 13.437 10.080 356 HG23 VAL 44 HG23 VAL 44 -1.967 13.543 8.809 357 H ALA 45 H ALA 45 -1.057 8.846 11.182 358 HA ALA 45 HA ALA 45 0.470 8.941 13.729 359 HB1 ALA 45 HB1 ALA 45 -0.914 6.955 13.185 360 HB2 ALA 45 HB2 ALA 45 0.064 6.673 11.733 361 HB3 ALA 45 HB3 ALA 45 0.815 6.561 13.333 362 H GLN 46 H GLN 46 1.055 8.565 10.207 363 HA GLN 46 HA GLN 46 3.816 9.568 10.452 364 HB2 GLN 46 HB2 GLN 46 3.139 6.788 9.394 365 HB3 GLN 46 HB3 GLN 46 4.662 7.596 9.066 366 HG2 GLN 46 HG2 GLN 46 3.670 6.722 11.792 367 HG3 GLN 46 HG3 GLN 46 4.940 5.982 10.834 368 HE21 GLN 46 HE22 GLN 46 5.029 7.218 13.597 369 HE22 GLN 46 HE21 GLN 46 6.344 8.381 13.483 370 H TRP 47 H TRP 47 4.845 9.581 8.187 371 HA TRP 47 HA TRP 47 2.895 10.277 6.026 372 HB2 TRP 47 HB2 TRP 47 5.339 11.915 6.815 373 HB3 TRP 47 HB3 TRP 47 4.258 12.252 5.478 374 HD1 TRP 47 HD1 TRP 47 2.253 13.801 5.962 375 HE1 TRP 47 HE1 TRP 47 1.311 15.012 8.034 376 HE3 TRP 47 HE3 TRP 47 5.121 11.564 9.577 377 HZ2 TRP 47 HZ2 TRP 47 1.535 14.734 10.896 378 HZ3 TRP 47 HZ3 TRP 47 4.677 12.006 11.978 379 HH2 TRP 47 HH2 TRP 47 2.871 13.576 12.651 380 H HIS 48 H HIS 48 3.459 9.354 4.085 381 HA HIS 48 HA HIS 48 6.245 8.337 3.731 382 HB2 HIS 48 HB2 HIS 48 3.750 6.861 2.893 383 HB3 HIS 48 HB3 HIS 48 5.401 6.278 2.877 384 HD1 HIS 48 HD1 HIS 48 6.424 5.627 5.403 385 HD2 HIS 48 HD2 HIS 48 2.325 6.527 5.074 386 HE1 HIS 48 HE1 HIS 48 5.331 4.773 7.542 387 H ASP 49 H ASP 49 7.130 8.615 1.816 388 HA ASP 49 HA ASP 49 5.566 9.873 -0.393 389 HB2 ASP 49 HB2 ASP 49 7.569 11.268 -0.829 390 HB3 ASP 49 HB3 ASP 49 6.706 11.642 0.646 391 H ARG 50 H ARG 50 5.485 8.654 -2.045 392 HA ARG 50 HA ARG 50 7.285 6.382 -2.537 393 HB2 ARG 50 HB2 ARG 50 5.019 7.552 -4.162 394 HB3 ARG 50 HB3 ARG 50 5.783 5.986 -4.393 395 HG2 ARG 50 HG2 ARG 50 4.090 6.874 -2.019 396 HG3 ARG 50 HG3 ARG 50 3.675 5.667 -3.220 397 HD2 ARG 50 HD2 ARG 50 5.813 5.441 -1.076 398 HD3 ARG 50 HD3 ARG 50 4.282 4.565 -1.165 399 HE ARG 50 HE ARG 50 5.683 3.968 -3.553 400 HH11 ARG 50 HH11 ARG 50 6.192 3.310 -0.149 401 HH12 ARG 50 HH12 ARG 50 7.093 1.855 -0.497 402 HH21 ARG 50 HH21 ARG 50 6.760 2.179 -3.928 403 HH22 ARG 50 HH22 ARG 50 7.456 1.246 -2.616 404 H GLY 51 H GLY 51 6.799 9.580 -3.899 405 HA2 GLY 51 HA2 GLY 51 8.514 10.870 -4.878 406 HA3 GLY 51 HA3 GLY 51 9.427 9.410 -5.232 407 H GLU 52 H GLU 52 7.631 7.873 -6.731 408 HA GLU 52 HA GLU 52 6.596 9.265 -9.064 409 HB2 GLU 52 HB2 GLU 52 9.488 8.361 -9.184 410 HB3 GLU 52 HB3 GLU 52 8.406 8.377 -10.571 411 HG2 GLU 52 HG2 GLU 52 8.006 10.856 -10.111 412 HG3 GLU 52 HG3 GLU 52 9.442 10.768 -9.067 413 H GLN 53 H GLN 53 4.997 7.664 -8.745 414 HA GLN 53 HA GLN 53 5.700 5.035 -10.001 415 HB2 GLN 53 HB2 GLN 53 3.543 5.664 -7.969 416 HB3 GLN 53 HB3 GLN 53 3.941 4.054 -8.620 417 HG2 GLN 53 HG2 GLN 53 6.297 4.349 -7.711 418 HG3 GLN 53 HG3 GLN 53 5.736 5.840 -6.913 419 HE21 GLN 53 HE22 GLN 53 3.108 4.861 -5.972 420 HE22 GLN 53 HE21 GLN 53 3.778 4.207 -4.535 421 H GLU 54 H GLU 54 3.875 3.940 -11.041 422 HA GLU 54 HA GLU 54 2.888 5.551 -13.172 423 HB2 GLU 54 HB2 GLU 54 1.806 3.415 -13.923 424 HB3 GLU 54 HB3 GLU 54 3.542 3.377 -13.667 425 HG2 GLU 54 HG2 GLU 54 3.158 2.242 -11.446 426 HG3 GLU 54 HG3 GLU 54 1.438 2.171 -11.822 427 H VAL 55 H VAL 55 1.409 7.057 -12.909 428 HA VAL 55 HA VAL 55 -0.980 6.602 -11.210 429 HB VAL 55 HB VAL 55 -0.155 9.162 -12.633 430 HG11 VAL 55 HG11 VAL 55 -2.545 9.077 -11.869 431 HG12 VAL 55 HG12 VAL 55 -1.979 8.686 -10.231 432 HG13 VAL 55 HG13 VAL 55 -1.591 10.253 -10.974 433 HG21 VAL 55 HG21 VAL 55 0.557 8.068 -9.890 434 HG22 VAL 55 HG22 VAL 55 1.632 8.745 -11.129 435 HG23 VAL 55 HG23 VAL 55 0.548 9.808 -10.230 436 H PHE 56 H PHE 56 -2.981 6.518 -11.890 437 HA PHE 56 HA PHE 56 -3.662 6.649 -14.803 438 HB2 PHE 56 HB2 PHE 56 -4.627 4.735 -12.656 439 HB3 PHE 56 HB3 PHE 56 -5.306 4.868 -14.274 440 HD1 PHE 56 HD2 PHE 56 -2.164 4.038 -12.401 441 HD2 PHE 56 HD1 PHE 56 -4.293 3.753 -16.139 442 HE1 PHE 56 HE2 PHE 56 -0.427 2.506 -13.276 443 HE2 PHE 56 HE1 PHE 56 -2.591 2.140 -16.971 444 HZ PHE 56 HZ PHE 56 -0.616 1.578 -15.572 445 H GLU 57 H GLU 57 -5.461 7.747 -15.355 446 HA GLU 57 HA GLU 57 -6.673 9.628 -13.530 447 HB2 GLU 57 HB2 GLU 57 -6.407 9.779 -16.087 448 HB3 GLU 57 HB3 GLU 57 -7.776 8.679 -16.208 449 HG2 GLU 57 HG2 GLU 57 -9.197 10.299 -14.988 450 HG3 GLU 57 HG3 GLU 57 -7.801 11.352 -14.734 451 H TYR 58 H TYR 58 -8.430 9.388 -12.203 452 HA TYR 58 HA TYR 58 -10.252 7.064 -12.589 453 HB2 TYR 58 HB2 TYR 58 -8.863 6.550 -10.761 454 HB3 TYR 58 HB3 TYR 58 -8.941 8.179 -10.106 455 HD1 TYR 58 HD1 TYR 58 -12.069 6.523 -11.252 456 HD2 TYR 58 HD2 TYR 58 -9.436 7.220 -7.897 457 HE1 TYR 58 HE1 TYR 58 -13.815 5.754 -9.715 458 HE2 TYR 58 HE2 TYR 58 -11.234 6.459 -6.345 459 HH TYR 58 HH TYR 58 -14.446 5.451 -7.589 460 H CYS 59 H CYS 59 -11.799 8.088 -13.703 461 HA CYS 59 HA CYS 59 -13.070 10.533 -12.535 462 HB2 CYS 59 HB2 CYS 59 -12.180 10.616 -14.887 463 HB3 CYS 59 HB3 CYS 59 -13.310 9.321 -15.313 464 HG CYS 59 HG CYS 59 -14.185 11.687 -16.155 465 H LEU 60 H LEU 60 -15.187 10.483 -11.948 466 HA LEU 60 HA LEU 60 -16.571 7.827 -11.865 467 HB2 LEU 60 HB2 LEU 60 -16.118 9.927 -9.925 468 HB3 LEU 60 HB3 LEU 60 -17.811 9.881 -10.264 469 HG LEU 60 HG LEU 60 -18.052 7.612 -9.570 470 HD11 LEU 60 HD11 LEU 60 -15.901 6.636 -10.274 471 HD12 LEU 60 HD12 LEU 60 -15.083 7.590 -9.015 472 HD13 LEU 60 HD13 LEU 60 -16.251 6.309 -8.571 473 HD21 LEU 60 HD21 LEU 60 -16.282 9.025 -7.520 474 HD22 LEU 60 HD22 LEU 60 -17.972 9.440 -7.804 475 HD23 LEU 60 HD23 LEU 60 -17.556 7.837 -7.189 476 H GLU 61 H GLU 61 -18.886 7.791 -12.013 477 HA GLU 61 HA GLU 61 -19.811 8.975 -14.460 478 HB2 GLU 61 HB2 GLU 61 -21.259 7.510 -12.237 479 HB3 GLU 61 HB3 GLU 61 -22.037 7.947 -13.750 480 HG2 GLU 61 HG2 GLU 61 -19.537 6.205 -13.619 481 HG3 GLU 61 HG3 GLU 61 -21.164 5.567 -13.510 482 H ASP 62 H ASP 62 -20.008 10.193 -11.227 483 HA ASP 62 HA ASP 62 -22.068 12.231 -11.722 484 HB2 ASP 62 HB2 ASP 62 -21.730 11.483 -9.479 485 HB3 ASP 62 HB3 ASP 62 -19.986 11.763 -9.560 486 H GLY 63 H GLY 63 -18.593 11.949 -12.252 487 HA2 GLY 63 HA2 GLY 63 -17.487 13.476 -13.769 488 HA3 GLY 63 HA3 GLY 63 -18.418 14.818 -13.102 489 H SER 64 H SER 64 -17.582 13.004 -10.454 490 HA SER 64 HA SER 64 -15.494 14.690 -9.451 491 HB2 SER 64 HB2 SER 64 -16.512 11.927 -8.701 492 HB3 SER 64 HB3 SER 64 -15.106 12.640 -7.905 493 HG SER 64 HG SER 64 -17.718 13.772 -8.058 494 H LEU 65 H LEU 65 -13.303 14.561 -9.493 495 HA LEU 65 HA LEU 65 -12.068 12.559 -11.326 496 HB2 LEU 65 HB2 LEU 65 -12.589 14.998 -12.176 497 HB3 LEU 65 HB3 LEU 65 -11.245 15.468 -11.142 498 HG LEU 65 HG LEU 65 -9.871 13.648 -12.414 499 HD11 LEU 65 HD11 LEU 65 -11.830 12.517 -13.476 500 HD12 LEU 65 HD12 LEU 65 -12.204 14.006 -14.355 501 HD13 LEU 65 HD13 LEU 65 -10.695 13.132 -14.689 502 HD21 LEU 65 HD21 LEU 65 -10.881 16.107 -13.904 503 HD22 LEU 65 HD22 LEU 65 -9.528 16.053 -12.753 504 HD23 LEU 65 HD23 LEU 65 -9.411 15.184 -14.293 505 H ILE 66 H ILE 66 -10.439 11.503 -10.585 506 HA ILE 66 HA ILE 66 -8.855 12.377 -8.219 507 HB ILE 66 HB ILE 66 -10.116 9.634 -8.672 508 HG12 ILE 66 HG12 ILE 66 -11.072 11.683 -6.633 509 HG13 ILE 66 HG13 ILE 66 -11.879 11.403 -8.170 510 HG21 ILE 66 HG21 ILE 66 -8.078 9.536 -7.301 511 HG22 ILE 66 HG22 ILE 66 -8.695 10.839 -6.250 512 HG23 ILE 66 HG23 ILE 66 -9.468 9.246 -6.281 513 HD11 ILE 66 HD11 ILE 66 -12.402 9.100 -7.597 514 HD12 ILE 66 HD12 ILE 66 -11.666 9.320 -5.987 515 HD13 ILE 66 HD13 ILE 66 -13.088 10.255 -6.459 516 H ARG 67 H ARG 67 -6.735 11.391 -8.128 517 HA ARG 67 HA ARG 67 -5.797 9.859 -10.519 518 HB2 ARG 67 HB2 ARG 67 -4.616 12.466 -9.462 519 HB3 ARG 67 HB3 ARG 67 -3.755 11.346 -10.530 520 HG2 ARG 67 HG2 ARG 67 -5.627 11.554 -12.187 521 HG3 ARG 67 HG3 ARG 67 -6.353 12.814 -11.176 522 HD2 ARG 67 HD2 ARG 67 -4.440 14.269 -11.478 523 HD3 ARG 67 HD3 ARG 67 -3.513 12.976 -12.225 524 HE ARG 67 HE ARG 67 -4.777 13.123 -14.219 525 HH11 ARG 67 HH11 ARG 67 -5.880 15.612 -11.992 526 HH12 ARG 67 HH12 ARG 67 -6.701 16.482 -13.262 527 HH21 ARG 67 HH21 ARG 67 -5.900 14.248 -15.748 528 HH22 ARG 67 HH22 ARG 67 -6.695 15.734 -15.322 529 H ALA 68 H ALA 68 -4.957 8.054 -9.832 530 HA ALA 68 HA ALA 68 -3.234 7.933 -7.417 531 HB1 ALA 68 HB1 ALA 68 -5.628 7.597 -6.698 532 HB2 ALA 68 HB2 ALA 68 -5.730 6.211 -7.796 533 HB3 ALA 68 HB3 ALA 68 -4.605 6.175 -6.419 534 H THR 69 H THR 69 -2.289 5.734 -7.136 535 HA THR 69 HA THR 69 -1.451 4.493 -9.694 536 HB THR 69 HB THR 69 -0.171 2.960 -8.135 537 HG1 THR 69 HG1 THR 69 -1.796 3.645 -6.398 538 HG21 THR 69 HG21 THR 69 1.060 4.782 -8.985 539 HG22 THR 69 HG22 THR 69 0.268 5.955 -7.909 540 HG23 THR 69 HG23 THR 69 1.376 4.730 -7.243 541 H LYS 70 H LYS 70 -1.739 2.294 -10.171 542 HA LYS 70 HA LYS 70 -4.299 1.122 -9.506 543 HB2 LYS 70 HB2 LYS 70 -1.898 0.235 -11.121 544 HB3 LYS 70 HB3 LYS 70 -3.203 -0.906 -10.778 545 HG2 LYS 70 HG2 LYS 70 -4.866 0.495 -11.836 546 HG3 LYS 70 HG3 LYS 70 -3.735 1.834 -11.953 547 HD2 LYS 70 HD2 LYS 70 -3.807 1.060 -14.097 548 HD3 LYS 70 HD3 LYS 70 -2.316 0.329 -13.509 549 HE2 LYS 70 HE2 LYS 70 -4.969 -1.138 -13.539 550 HE3 LYS 70 HE3 LYS 70 -3.986 -1.017 -14.987 551 HZ1 LYS 70 HZ1 LYS 70 -2.201 -2.183 -13.931 552 HZ2 LYS 70 HZ2 LYS 70 -2.945 -2.199 -12.469 553 HZ3 LYS 70 HZ3 LYS 70 -3.578 -3.055 -13.702 554 H ASP 71 H ASP 71 -1.522 1.113 -7.675 555 HA ASP 71 HA ASP 71 -2.029 -1.492 -6.334 556 HB2 ASP 71 HB2 ASP 71 0.184 0.594 -6.165 557 HB3 ASP 71 HB3 ASP 71 0.072 -0.778 -5.067 558 H HIS 72 H HIS 72 -3.140 1.738 -6.008 559 HA HIS 72 HA HIS 72 -3.123 1.720 -3.051 560 HB2 HIS 72 HB2 HIS 72 -2.801 3.824 -4.432 561 HB3 HIS 72 HB3 HIS 72 -4.489 3.703 -4.895 562 HD1 HIS 72 HD1 HIS 72 -6.249 3.958 -2.601 563 HD2 HIS 72 HD2 HIS 72 -2.144 4.575 -1.990 564 HE1 HIS 72 HE1 HIS 72 -6.008 5.123 -0.358 565 H LYS 73 H LYS 73 -4.950 1.070 -1.852 566 HA LYS 73 HA LYS 73 -7.191 -0.143 -3.374 567 HB2 LYS 73 HB2 LYS 73 -6.517 -0.373 -0.414 568 HB3 LYS 73 HB3 LYS 73 -7.850 -1.143 -1.198 569 HG2 LYS 73 HG2 LYS 73 -6.476 -2.901 -1.503 570 HG3 LYS 73 HG3 LYS 73 -5.684 -1.970 -2.781 571 HD2 LYS 73 HD2 LYS 73 -4.080 -1.058 -1.102 572 HD3 LYS 73 HD3 LYS 73 -4.913 -1.963 0.179 573 HE2 LYS 73 HE2 LYS 73 -4.383 -4.093 -1.060 574 HE3 LYS 73 HE3 LYS 73 -3.428 -3.135 -2.208 575 HZ1 LYS 73 HZ1 LYS 73 -2.052 -2.409 -0.296 576 HZ2 LYS 73 HZ2 LYS 73 -2.910 -3.363 0.715 577 HZ3 LYS 73 HZ3 LYS 73 -2.009 -4.037 -0.466 578 H PHE 74 H PHE 74 -9.365 0.080 -2.496 579 HA PHE 74 HA PHE 74 -9.982 2.656 -1.185 580 HB2 PHE 74 HB2 PHE 74 -11.038 1.854 -3.919 581 HB3 PHE 74 HB3 PHE 74 -11.761 3.080 -2.896 582 HD1 PHE 74 HD1 PHE 74 -8.597 2.273 -4.809 583 HD2 PHE 74 HD2 PHE 74 -11.015 5.313 -2.906 584 HE1 PHE 74 HE1 PHE 74 -7.178 4.032 -5.801 585 HE2 PHE 74 HE2 PHE 74 -9.598 7.066 -3.942 586 HZ PHE 74 HZ PHE 74 -7.673 6.434 -5.375 587 H MET 75 H MET 75 -11.979 2.681 -0.154 588 HA MET 75 HA MET 75 -12.897 0.049 0.765 589 HB2 MET 75 HB2 MET 75 -12.469 1.861 2.345 590 HB3 MET 75 HB3 MET 75 -13.607 2.905 1.491 591 HG2 MET 75 HG2 MET 75 -15.457 1.347 2.063 592 HG3 MET 75 HG3 MET 75 -14.328 0.358 2.990 593 HE1 MET 75 HE1 MET 75 -13.924 0.714 5.484 594 HE2 MET 75 HE2 MET 75 -12.662 1.809 4.863 595 HE3 MET 75 HE3 MET 75 -13.720 2.330 6.199 596 H THR 76 H THR 76 -14.224 -1.019 -0.647 597 HA THR 76 HA THR 76 -16.164 0.314 -2.363 598 HB THR 76 HB THR 76 -16.998 -1.876 -2.915 599 HG1 THR 76 HG1 THR 76 -16.138 -3.693 -1.887 600 HG21 THR 76 HG21 THR 76 -14.866 -1.112 -3.922 601 HG22 THR 76 HG22 THR 76 -13.978 -2.027 -2.686 602 HG23 THR 76 HG23 THR 76 -15.025 -2.875 -3.850 603 H VAL 77 H VAL 77 -18.543 -0.348 -2.304 604 HA VAL 77 HA VAL 77 -19.760 0.489 0.083 605 HB VAL 77 HB VAL 77 -21.890 -0.417 -0.853 606 HG11 VAL 77 HG11 VAL 77 -21.103 1.834 -1.391 607 HG12 VAL 77 HG12 VAL 77 -20.190 1.201 -2.778 608 HG13 VAL 77 HG13 VAL 77 -21.955 1.089 -2.756 609 HG21 VAL 77 HG21 VAL 77 -20.173 -1.334 -3.201 610 HG22 VAL 77 HG22 VAL 77 -20.961 -2.410 -2.027 611 HG23 VAL 77 HG23 VAL 77 -21.939 -1.385 -3.081 612 H ASP 78 H ASP 78 -18.639 -2.706 -0.654 613 HA ASP 78 HA ASP 78 -20.161 -3.950 1.567 614 HB2 ASP 78 HB2 ASP 78 -18.189 -5.036 -0.475 615 HB3 ASP 78 HB3 ASP 78 -18.927 -6.007 0.800 616 H GLY 79 H GLY 79 -17.375 -2.068 1.394 617 HA2 GLY 79 HA2 GLY 79 -15.920 -1.537 3.104 618 HA3 GLY 79 HA3 GLY 79 -16.510 -2.893 4.070 619 H GLN 80 H GLN 80 -15.474 -3.601 0.795 620 HA GLN 80 HA GLN 80 -13.164 -5.152 1.769 621 HB2 GLN 80 HB2 GLN 80 -14.331 -4.800 -1.025 622 HB3 GLN 80 HB3 GLN 80 -13.117 -5.982 -0.523 623 HG2 GLN 80 HG2 GLN 80 -14.775 -7.050 0.988 624 HG3 GLN 80 HG3 GLN 80 -16.002 -5.878 0.491 625 HE21 GLN 80 HE22 GLN 80 -13.793 -8.371 -0.864 626 HE22 GLN 80 HE21 GLN 80 -14.888 -8.825 -2.169 627 H MET 81 H MET 81 -11.148 -4.295 1.808 628 HA MET 81 HA MET 81 -10.413 -1.851 0.333 629 HB2 MET 81 HB2 MET 81 -8.774 -3.689 2.143 630 HB3 MET 81 HB3 MET 81 -8.183 -2.225 1.353 631 HG2 MET 81 HG2 MET 81 -8.688 -1.482 3.480 632 HG3 MET 81 HG3 MET 81 -10.079 -0.976 2.531 633 HE1 MET 81 HE1 MET 81 -11.422 -0.499 4.736 634 HE2 MET 81 HE2 MET 81 -12.372 -1.211 3.405 635 HE3 MET 81 HE3 MET 81 -12.633 -1.758 5.075 636 H LEU 82 H LEU 82 -10.576 -2.396 -1.830 637 HA LEU 82 HA LEU 82 -8.676 -4.480 -2.864 638 HB2 LEU 82 HB2 LEU 82 -11.221 -3.500 -4.198 639 HB3 LEU 82 HB3 LEU 82 -10.187 -4.800 -4.747 640 HG LEU 82 HG LEU 82 -11.795 -4.873 -2.158 641 HD11 LEU 82 HD11 LEU 82 -13.224 -4.885 -4.169 642 HD12 LEU 82 HD12 LEU 82 -12.306 -6.264 -4.810 643 HD13 LEU 82 HD13 LEU 82 -13.259 -6.437 -3.320 644 HD21 LEU 82 HD21 LEU 82 -10.224 -7.051 -3.603 645 HD22 LEU 82 HD22 LEU 82 -9.799 -6.324 -2.040 646 HD23 LEU 82 HD23 LEU 82 -11.265 -7.298 -2.186 647 HA PRO 83 HA PRO 83 -6.637 -1.204 -5.119 648 HB2 PRO 83 HB2 PRO 83 -5.600 -2.572 -7.264 649 HB3 PRO 83 HB3 PRO 83 -4.937 -2.688 -5.607 650 HG2 PRO 83 HG2 PRO 83 -6.918 -4.540 -6.990 651 HG3 PRO 83 HG3 PRO 83 -5.431 -4.992 -6.087 652 HD2 PRO 83 HD2 PRO 83 -7.887 -5.090 -4.952 653 HD3 PRO 83 HD3 PRO 83 -6.474 -4.528 -4.008 654 H ILE 84 H ILE 84 -7.066 0.225 -6.776 655 HA ILE 84 HA ILE 84 -9.602 0.179 -7.978 656 HB ILE 84 HB ILE 84 -8.350 2.200 -7.505 657 HG12 ILE 84 HG12 ILE 84 -9.005 2.096 -10.476 658 HG13 ILE 84 HG13 ILE 84 -10.223 1.995 -9.196 659 HG21 ILE 84 HG21 ILE 84 -6.096 1.496 -8.211 660 HG22 ILE 84 HG22 ILE 84 -6.617 1.480 -9.915 661 HG23 ILE 84 HG23 ILE 84 -6.554 3.004 -9.002 662 HD11 ILE 84 HD11 ILE 84 -9.577 4.168 -8.329 663 HD12 ILE 84 HD12 ILE 84 -8.358 4.346 -9.622 664 HD13 ILE 84 HD13 ILE 84 -10.081 4.242 -10.031 665 H ASP 85 H ASP 85 -6.642 -1.179 -9.260 666 HA ASP 85 HA ASP 85 -7.336 -1.674 -11.966 667 HB2 ASP 85 HB2 ASP 85 -5.138 -2.153 -11.074 668 HB3 ASP 85 HB3 ASP 85 -5.795 -3.282 -9.892 669 H GLU 86 H GLU 86 -8.482 -3.270 -8.998 670 HA GLU 86 HA GLU 86 -9.918 -5.348 -10.565 671 HB2 GLU 86 HB2 GLU 86 -8.681 -5.923 -8.484 672 HB3 GLU 86 HB3 GLU 86 -9.815 -4.939 -7.548 673 HG2 GLU 86 HG2 GLU 86 -11.648 -6.382 -8.066 674 HG3 GLU 86 HG3 GLU 86 -10.779 -7.160 -9.392 675 H ILE 87 H ILE 87 -10.617 -2.332 -8.734 676 HA ILE 87 HA ILE 87 -13.447 -2.662 -8.609 677 HB ILE 87 HB ILE 87 -11.761 -0.127 -8.743 678 HG12 ILE 87 HG12 ILE 87 -12.848 -1.715 -6.360 679 HG13 ILE 87 HG13 ILE 87 -11.170 -1.703 -6.890 680 HG21 ILE 87 HG21 ILE 87 -14.185 0.295 -9.240 681 HG22 ILE 87 HG22 ILE 87 -14.602 -0.545 -7.739 682 HG23 ILE 87 HG23 ILE 87 -13.710 0.991 -7.704 683 HD11 ILE 87 HD11 ILE 87 -11.012 0.726 -6.394 684 HD12 ILE 87 HD12 ILE 87 -12.672 0.660 -5.772 685 HD13 ILE 87 HD13 ILE 87 -11.400 -0.275 -4.978 686 H PHE 88 H PHE 88 -11.347 -1.349 -11.176 687 HA PHE 88 HA PHE 88 -13.492 -0.471 -12.888 688 HB2 PHE 88 HB2 PHE 88 -11.124 0.288 -13.022 689 HB3 PHE 88 HB3 PHE 88 -10.659 -1.303 -13.596 690 HD1 PHE 88 HD1 PHE 88 -12.813 1.690 -14.440 691 HD2 PHE 88 HD2 PHE 88 -10.868 -1.878 -15.898 692 HE1 PHE 88 HE1 PHE 88 -13.212 2.425 -16.769 693 HE2 PHE 88 HE2 PHE 88 -11.283 -1.137 -18.240 694 HZ PHE 88 HZ PHE 88 -12.443 1.021 -18.674 695 H GLU 89 H GLU 89 -12.010 -3.683 -12.504 696 HA GLU 89 HA GLU 89 -13.323 -4.746 -14.940 697 HB2 GLU 89 HB2 GLU 89 -11.682 -6.047 -12.719 698 HB3 GLU 89 HB3 GLU 89 -12.481 -6.956 -14.003 699 HG2 GLU 89 HG2 GLU 89 -11.218 -5.488 -15.680 700 HG3 GLU 89 HG3 GLU 89 -10.260 -4.896 -14.323 701 H ARG 90 H ARG 90 -13.755 -4.971 -11.398 702 HA ARG 90 HA ARG 90 -16.138 -6.669 -11.640 703 HB2 ARG 90 HB2 ARG 90 -15.042 -5.107 -9.265 704 HB3 ARG 90 HB3 ARG 90 -16.316 -6.326 -9.207 705 HG2 ARG 90 HG2 ARG 90 -13.375 -6.769 -9.799 706 HG3 ARG 90 HG3 ARG 90 -14.292 -7.308 -8.403 707 HD2 ARG 90 HD2 ARG 90 -14.453 -8.286 -11.267 708 HD3 ARG 90 HD3 ARG 90 -13.893 -9.192 -9.865 709 HE ARG 90 HE ARG 90 -16.605 -8.886 -10.808 710 HH11 ARG 90 HH11 ARG 90 -14.829 -9.468 -7.833 711 HH12 ARG 90 HH12 ARG 90 -16.236 -10.104 -7.017 712 HH21 ARG 90 HH21 ARG 90 -18.354 -9.678 -9.691 713 HH22 ARG 90 HH22 ARG 90 -18.167 -10.228 -8.048 714 H GLU 91 H GLU 91 -15.618 -3.303 -11.978 715 HA GLU 91 HA GLU 91 -16.943 -1.505 -12.153 716 HB2 GLU 91 HB2 GLU 91 -19.225 -3.411 -12.791 717 HB3 GLU 91 HB3 GLU 91 -19.121 -1.688 -13.159 718 HG2 GLU 91 HG2 GLU 91 -17.129 -2.162 -14.628 719 HG3 GLU 91 HG3 GLU 91 -17.352 -3.884 -14.313 720 H LEU 92 H LEU 92 -16.571 -2.590 -9.533 721 HA LEU 92 HA LEU 92 -19.097 -2.350 -8.056 722 HB2 LEU 92 HB2 LEU 92 -16.195 -2.694 -7.215 723 HB3 LEU 92 HB3 LEU 92 -17.504 -2.508 -6.049 724 HG LEU 92 HG LEU 92 -17.486 -4.702 -8.158 725 HD11 LEU 92 HD11 LEU 92 -15.539 -4.964 -6.657 726 HD12 LEU 92 HD12 LEU 92 -16.618 -4.878 -5.245 727 HD13 LEU 92 HD13 LEU 92 -16.745 -6.230 -6.394 728 HD21 LEU 92 HD21 LEU 92 -19.086 -4.377 -5.585 729 HD22 LEU 92 HD22 LEU 92 -19.723 -4.260 -7.240 730 HD23 LEU 92 HD23 LEU 92 -19.109 -5.800 -6.647 731 H ASP 93 H ASP 93 -19.964 -0.605 -7.200 732 HA ASP 93 HA ASP 93 -18.713 2.018 -7.425 733 HB2 ASP 93 HB2 ASP 93 -20.810 2.628 -5.950 734 HB3 ASP 93 HB3 ASP 93 -20.919 2.296 -7.670 735 H LEU 94 H LEU 94 -18.098 3.439 -5.771 736 HA LEU 94 HA LEU 94 -16.870 2.110 -3.421 737 HB2 LEU 94 HB2 LEU 94 -16.604 4.916 -4.600 738 HB3 LEU 94 HB3 LEU 94 -16.020 4.500 -2.998 739 HG LEU 94 HG LEU 94 -14.969 3.550 -5.659 740 HD11 LEU 94 HD11 LEU 94 -14.128 5.634 -4.501 741 HD12 LEU 94 HD12 LEU 94 -13.635 4.629 -3.126 742 HD13 LEU 94 HD13 LEU 94 -12.884 4.396 -4.722 743 HD21 LEU 94 HD21 LEU 94 -14.455 2.252 -2.958 744 HD22 LEU 94 HD22 LEU 94 -15.031 1.460 -4.452 745 HD23 LEU 94 HD23 LEU 94 -13.389 2.091 -4.351 746 H MET 95 H MET 95 -17.029 2.919 -1.278 747 HA MET 95 HA MET 95 -19.770 3.688 -0.571 748 HB2 MET 95 HB2 MET 95 -18.409 2.006 0.711 749 HB3 MET 95 HB3 MET 95 -17.380 3.316 1.287 750 HG2 MET 95 HG2 MET 95 -19.070 4.211 2.619 751 HG3 MET 95 HG3 MET 95 -20.359 3.654 1.557 752 HE1 MET 95 HE1 MET 95 -17.655 2.409 4.108 753 HE2 MET 95 HE2 MET 95 -18.237 0.781 4.512 754 HE3 MET 95 HE3 MET 95 -17.581 1.106 2.897 755 H ARG 96 H ARG 96 -20.428 5.620 0.106 756 HA ARG 96 HA ARG 96 -18.587 7.933 -0.203 757 HB2 ARG 96 HB2 ARG 96 -20.670 9.257 -0.605 758 HB3 ARG 96 HB3 ARG 96 -20.309 8.070 -1.826 759 HG2 ARG 96 HG2 ARG 96 -22.182 7.335 0.426 760 HG3 ARG 96 HG3 ARG 96 -22.755 8.369 -0.867 761 HD2 ARG 96 HD2 ARG 96 -22.741 6.699 -2.464 762 HD3 ARG 96 HD3 ARG 96 -21.343 5.915 -1.815 763 HE ARG 96 HE ARG 96 -22.656 4.669 -0.289 764 HH11 ARG 96 HH11 ARG 96 -24.810 6.984 -1.842 765 HH12 ARG 96 HH12 ARG 96 -26.227 6.169 -1.222 766 HH21 ARG 96 HH21 ARG 96 -24.507 3.729 0.465 767 HH22 ARG 96 HH22 ARG 96 -26.051 4.388 0.015 768 H VAL 97 H VAL 97 -19.046 9.831 0.974 769 HA VAL 97 HA VAL 97 -19.730 9.379 3.858 770 HB VAL 97 HB VAL 97 -17.324 9.816 2.914 771 HG11 VAL 97 HG11 VAL 97 -18.022 11.958 1.738 772 HG12 VAL 97 HG12 VAL 97 -18.143 12.709 3.331 773 HG13 VAL 97 HG13 VAL 97 -16.584 12.070 2.774 774 HG21 VAL 97 HG21 VAL 97 -18.329 11.299 5.354 775 HG22 VAL 97 HG22 VAL 97 -17.802 9.595 5.277 776 HG23 VAL 97 HG23 VAL 97 -16.637 10.896 4.997 777 H ASP 98 H ASP 98 -20.468 11.319 1.088 778 HA ASP 98 HA ASP 98 -22.045 13.284 2.692 779 HB2 ASP 98 HB2 ASP 98 -20.781 13.391 -0.068 780 HB3 ASP 98 HB3 ASP 98 -21.979 14.567 0.463 781 H ASN 99 H ASN 99 -22.725 10.404 1.644 782 HA ASN 99 HA ASN 99 -24.612 9.280 1.086 783 HB2 ASN 99 HB2 ASN 99 -26.326 11.746 1.406 784 HB3 ASN 99 HB3 ASN 99 -26.715 10.067 1.769 785 HD21 ASN 99 HD22 ASN 99 -25.212 12.954 2.850 786 HD22 ASN 99 HD21 ASN 99 -24.274 12.264 4.119 787 H LEU 100 H LEU 100 -23.237 11.155 -0.841 788 HA LEU 100 HA LEU 100 -24.547 11.644 -3.237 789 HB2 LEU 100 HB2 LEU 100 -21.904 10.279 -2.640 790 HB3 LEU 100 HB3 LEU 100 -22.336 10.667 -4.281 791 HG LEU 100 HG LEU 100 -22.351 12.843 -2.159 792 HD11 LEU 100 HD11 LEU 100 -20.134 11.789 -2.067 793 HD12 LEU 100 HD12 LEU 100 -19.977 11.926 -3.829 794 HD13 LEU 100 HD13 LEU 100 -20.045 13.387 -2.820 795 HD21 LEU 100 HD21 LEU 100 -21.885 12.873 -5.177 796 HD22 LEU 100 HD22 LEU 100 -23.401 13.329 -4.370 797 HD23 LEU 100 HD23 LEU 100 -21.936 14.290 -4.110 798 HA PRO 101 HA PRO 101 -26.283 7.832 -4.761 799 HB2 PRO 101 HB2 PRO 101 -25.992 8.028 -7.487 800 HB3 PRO 101 HB3 PRO 101 -27.144 9.020 -6.542 801 HG2 PRO 101 HG2 PRO 101 -24.382 9.790 -7.515 802 HG3 PRO 101 HG3 PRO 101 -25.896 10.742 -7.609 803 HD2 PRO 101 HD2 PRO 101 -24.023 11.118 -5.648 804 HD3 PRO 101 HD3 PRO 101 -25.758 11.337 -5.318 805 H ASN 102 H ASN 102 -25.640 5.697 -5.384 806 HA ASN 102 HA ASN 102 -22.799 5.116 -5.178 807 HB2 ASN 102 HB2 ASN 102 -25.226 3.385 -5.816 808 HB3 ASN 102 HB3 ASN 102 -23.583 2.758 -5.732 809 HD21 ASN 102 HD22 ASN 102 -22.334 3.479 -3.580 810 HD22 ASN 102 HD21 ASN 102 -23.320 3.231 -2.160 811 H ILE 103 H ILE 103 -21.324 5.111 -6.692 812 HA ILE 103 HA ILE 103 -21.907 4.661 -9.553 813 HB ILE 103 HB ILE 103 -20.598 6.773 -10.083 814 HG12 ILE 103 HG12 ILE 103 -21.225 7.453 -7.178 815 HG13 ILE 103 HG13 ILE 103 -19.649 7.257 -7.899 816 HG21 ILE 103 HG21 ILE 103 -23.083 6.469 -10.376 817 HG22 ILE 103 HG22 ILE 103 -23.308 7.301 -8.821 818 HG23 ILE 103 HG23 ILE 103 -22.556 8.140 -10.191 819 HD11 ILE 103 HD11 ILE 103 -20.112 9.255 -9.340 820 HD12 ILE 103 HD12 ILE 103 -21.685 9.437 -8.510 821 HD13 ILE 103 HD13 ILE 103 -20.194 9.621 -7.600 822 H LYS 104 H LYS 104 -20.120 4.257 -10.812 823 HA LYS 104 HA LYS 104 -17.620 3.463 -9.375 824 HB2 LYS 104 HB2 LYS 104 -17.547 1.439 -10.644 825 HB3 LYS 104 HB3 LYS 104 -19.088 1.569 -9.840 826 HG2 LYS 104 HG2 LYS 104 -19.659 0.686 -11.889 827 HG3 LYS 104 HG3 LYS 104 -20.063 2.385 -12.099 828 HD2 LYS 104 HD2 LYS 104 -18.052 2.750 -13.401 829 HD3 LYS 104 HD3 LYS 104 -17.433 1.124 -13.012 830 HE2 LYS 104 HE2 LYS 104 -19.406 0.169 -14.248 831 HE3 LYS 104 HE3 LYS 104 -19.887 1.815 -14.686 832 HZ1 LYS 104 HZ1 LYS 104 -17.741 2.061 -15.835 833 HZ2 LYS 104 HZ2 LYS 104 -17.303 0.537 -15.440 834 HZ3 LYS 104 HZ3 LYS 104 -18.567 0.783 -16.444 835 H ILE 105 H ILE 105 -15.930 2.864 -11.200 836 HA ILE 105 HA ILE 105 -15.012 5.380 -12.175 837 HB ILE 105 HB ILE 105 -14.162 2.576 -12.992 838 HG12 ILE 105 HG12 ILE 105 -12.631 4.179 -10.966 839 HG13 ILE 105 HG13 ILE 105 -14.035 3.268 -10.418 840 HG21 ILE 105 HG21 ILE 105 -13.216 4.215 -14.544 841 HG22 ILE 105 HG22 ILE 105 -12.736 5.277 -13.207 842 HG23 ILE 105 HG23 ILE 105 -11.923 3.724 -13.449 843 HD11 ILE 105 HD11 ILE 105 -12.991 1.234 -11.484 844 HD12 ILE 105 HD12 ILE 105 -11.504 2.213 -11.687 845 HD13 ILE 105 HD13 ILE 105 -12.177 1.903 -10.072 846 H ALA 106 H ALA 106 -15.811 6.470 -13.770 847 HA ALA 106 HA ALA 106 -17.530 5.399 -15.888 848 HB1 ALA 106 HB1 ALA 106 -17.968 7.579 -14.855 849 HB2 ALA 106 HB2 ALA 106 -16.384 8.190 -15.369 850 HB3 ALA 106 HB3 ALA 106 -17.626 7.785 -16.576 851 H THR 107 H THR 107 -14.247 6.748 -15.637 852 HA THR 107 HA THR 107 -13.383 5.325 -18.067 853 HB THR 107 HB THR 107 -12.137 7.431 -18.855 854 HG1 THR 107 HG1 THR 107 -14.299 8.736 -17.610 855 HG21 THR 107 HG21 THR 107 -14.008 6.438 -20.141 856 HG22 THR 107 HG22 THR 107 -15.153 7.468 -19.252 857 HG23 THR 107 HG23 THR 107 -13.915 8.200 -20.292 858 H ARG 108 H ARG 108 -11.233 4.924 -18.164 859 HA ARG 108 HA ARG 108 -9.364 6.002 -16.142 860 HB2 ARG 108 HB2 ARG 108 -10.354 3.865 -15.215 861 HB3 ARG 108 HB3 ARG 108 -9.756 3.025 -16.643 862 HG2 ARG 108 HG2 ARG 108 -7.386 3.878 -15.918 863 HG3 ARG 108 HG3 ARG 108 -8.157 4.350 -14.403 864 HD2 ARG 108 HD2 ARG 108 -7.055 2.204 -14.180 865 HD3 ARG 108 HD3 ARG 108 -8.803 2.007 -14.007 866 HE ARG 108 HE ARG 108 -8.930 0.872 -16.050 867 HH11 ARG 108 HH11 ARG 108 -5.594 1.876 -15.647 868 HH12 ARG 108 HH12 ARG 108 -5.083 1.005 -17.072 869 HH21 ARG 108 HH21 ARG 108 -8.197 -0.228 -17.813 870 HH22 ARG 108 HH22 ARG 108 -6.512 -0.167 -18.241 871 H LYS 109 H LYS 109 -7.333 6.154 -16.865 872 HA LYS 109 HA LYS 109 -6.219 4.719 -19.123 873 HB2 LYS 109 HB2 LYS 109 -7.555 6.408 -20.334 874 HB3 LYS 109 HB3 LYS 109 -6.769 7.715 -19.454 875 HG2 LYS 109 HG2 LYS 109 -4.725 7.428 -20.565 876 HG3 LYS 109 HG3 LYS 109 -5.073 5.766 -21.043 877 HD2 LYS 109 HD2 LYS 109 -6.574 8.176 -22.139 878 HD3 LYS 109 HD3 LYS 109 -5.134 7.512 -22.904 879 HE2 LYS 109 HE2 LYS 109 -7.683 5.908 -22.385 880 HE3 LYS 109 HE3 LYS 109 -7.324 6.741 -23.897 881 HZ1 LYS 109 HZ1 LYS 109 -5.339 5.348 -24.138 882 HZ2 LYS 109 HZ2 LYS 109 -5.676 4.544 -22.752 883 HZ3 LYS 109 HZ3 LYS 109 -6.676 4.422 -24.033 884 H TYR 110 H TYR 110 -3.965 4.913 -19.235 885 HA TYR 110 HA TYR 110 -2.580 5.701 -16.843 886 HB2 TYR 110 HB2 TYR 110 -1.840 3.879 -18.371 887 HB3 TYR 110 HB3 TYR 110 -1.532 5.063 -19.631 888 HD1 TYR 110 HD1 TYR 110 -0.735 5.012 -15.932 889 HD2 TYR 110 HD2 TYR 110 0.807 5.209 -19.963 890 HE1 TYR 110 HE1 TYR 110 1.506 5.408 -15.045 891 HE2 TYR 110 HE2 TYR 110 3.108 5.505 -19.054 892 HH TYR 110 HH TYR 110 3.742 5.688 -15.542 893 H LEU 111 H LEU 111 -1.808 7.644 -16.230 894 HA LEU 111 HA LEU 111 -1.908 9.940 -18.135 895 HB2 LEU 111 HB2 LEU 111 -1.442 9.716 -15.128 896 HB3 LEU 111 HB3 LEU 111 -1.436 11.231 -16.026 897 HG LEU 111 HG LEU 111 -3.837 9.379 -15.988 898 HD11 LEU 111 HD11 LEU 111 -3.371 10.024 -13.712 899 HD12 LEU 111 HD12 LEU 111 -3.141 11.717 -14.183 900 HD13 LEU 111 HD13 LEU 111 -4.758 10.948 -14.294 901 HD21 LEU 111 HD21 LEU 111 -3.443 12.324 -16.703 902 HD22 LEU 111 HD22 LEU 111 -3.856 11.010 -17.828 903 HD23 LEU 111 HD23 LEU 111 -5.022 11.518 -16.606 904 H GLY 112 H GLY 112 0.369 8.235 -15.998 905 HA2 GLY 112 HA2 GLY 112 2.715 8.252 -17.294 906 HA3 GLY 112 HA3 GLY 112 2.623 9.958 -16.845 907 H LYS 113 H LYS 113 4.309 9.973 -15.434 908 HA LYS 113 HA LYS 113 4.215 8.189 -13.029 909 HB2 LYS 113 HB2 LYS 113 5.810 7.581 -14.971 910 HB3 LYS 113 HB3 LYS 113 6.771 8.957 -14.391 911 HG2 LYS 113 HG2 LYS 113 7.080 7.973 -12.236 912 HG3 LYS 113 HG3 LYS 113 5.861 6.737 -12.532 913 HD2 LYS 113 HD2 LYS 113 8.127 5.793 -12.659 914 HD3 LYS 113 HD3 LYS 113 7.209 5.614 -14.148 915 HE2 LYS 113 HE2 LYS 113 9.407 6.148 -14.805 916 HE3 LYS 113 HE3 LYS 113 8.442 7.590 -15.117 917 HZ1 LYS 113 HZ1 LYS 113 9.381 8.601 -13.113 918 HZ2 LYS 113 HZ2 LYS 113 10.162 7.203 -12.715 919 HZ3 LYS 113 HZ3 LYS 113 10.600 8.052 -14.036 920 H GLN 114 H GLN 114 3.210 9.836 -12.029 921 HA GLN 114 HA GLN 114 4.494 12.419 -11.596 922 HB2 GLN 114 HB2 GLN 114 1.804 11.588 -10.552 923 HB3 GLN 114 HB3 GLN 114 2.436 13.201 -10.934 924 HG2 GLN 114 HG2 GLN 114 2.775 12.375 -13.332 925 HG3 GLN 114 HG3 GLN 114 1.832 10.943 -12.875 926 HE21 GLN 114 HE22 GLN 114 0.770 11.700 -14.791 927 HE22 GLN 114 HE21 GLN 114 -0.395 12.966 -14.597 928 H ASN 115 H ASN 115 4.740 13.321 -9.385 929 HA ASN 115 HA ASN 115 5.580 11.582 -7.342 930 HB2 ASN 115 HB2 ASN 115 5.905 14.234 -7.879 931 HB3 ASN 115 HB3 ASN 115 4.621 14.346 -6.666 932 HD21 ASN 115 HD22 ASN 115 5.272 12.271 -4.882 933 HD22 ASN 115 HD21 ASN 115 6.961 12.375 -4.473 934 H VAL 116 H VAL 116 4.376 10.226 -6.181 935 HA VAL 116 HA VAL 116 1.676 11.145 -5.284 936 HB VAL 116 HB VAL 116 0.995 8.766 -5.280 937 HG11 VAL 116 HG11 VAL 116 0.375 10.318 -7.113 938 HG12 VAL 116 HG12 VAL 116 1.790 9.770 -8.028 939 HG13 VAL 116 HG13 VAL 116 0.484 8.632 -7.619 940 HG21 VAL 116 HG21 VAL 116 3.467 8.287 -7.013 941 HG22 VAL 116 HG22 VAL 116 3.236 7.677 -5.360 942 HG23 VAL 116 HG23 VAL 116 2.167 7.134 -6.658 943 H TYR 117 H TYR 117 0.928 10.463 -3.307 944 HA TYR 117 HA TYR 117 3.007 9.896 -1.233 945 HB2 TYR 117 HB2 TYR 117 0.922 12.080 -1.022 946 HB3 TYR 117 HB3 TYR 117 2.363 11.849 -0.061 947 HD1 TYR 117 HD1 TYR 117 0.995 13.060 -3.262 948 HD2 TYR 117 HD2 TYR 117 4.555 12.709 -0.848 949 HE1 TYR 117 HE1 TYR 117 2.139 14.745 -4.697 950 HE2 TYR 117 HE2 TYR 117 5.676 14.432 -2.255 951 HH TYR 117 HH TYR 117 5.364 16.058 -3.917 952 H ASP 118 H ASP 118 2.124 9.325 0.868 953 HA ASP 118 HA ASP 118 -0.730 8.810 1.161 954 HB2 ASP 118 HB2 ASP 118 -0.517 6.447 1.623 955 HB3 ASP 118 HB3 ASP 118 -0.110 6.804 -0.042 956 H ILE 119 H ILE 119 -1.331 9.076 3.228 957 HA ILE 119 HA ILE 119 0.748 9.398 5.322 958 HB ILE 119 HB ILE 119 -1.082 10.223 6.725 959 HG12 ILE 119 HG12 ILE 119 -2.848 10.080 4.238 960 HG13 ILE 119 HG13 ILE 119 -2.954 8.969 5.608 961 HG21 ILE 119 HG21 ILE 119 0.372 11.695 5.347 962 HG22 ILE 119 HG22 ILE 119 -0.829 11.658 4.042 963 HG23 ILE 119 HG23 ILE 119 -1.223 12.397 5.612 964 HD11 ILE 119 HD11 ILE 119 -3.502 10.844 7.110 965 HD12 ILE 119 HD12 ILE 119 -3.472 11.964 5.722 966 HD13 ILE 119 HD13 ILE 119 -4.669 10.661 5.790 967 H GLY 120 H GLY 120 0.576 8.377 7.356 968 HA2 GLY 120 HA2 GLY 120 -0.561 5.598 7.281 969 HA3 GLY 120 HA3 GLY 120 0.901 6.071 8.144 970 H VAL 121 H VAL 121 -1.363 4.752 9.281 971 HA VAL 121 HA VAL 121 -2.384 6.716 11.279 972 HB VAL 121 HB VAL 121 -4.239 4.839 9.835 973 HG11 VAL 121 HG11 VAL 121 -5.159 5.703 11.921 974 HG12 VAL 121 HG12 VAL 121 -4.678 7.369 11.490 975 HG13 VAL 121 HG13 VAL 121 -5.954 6.527 10.595 976 HG21 VAL 121 HG21 VAL 121 -3.764 7.751 9.064 977 HG22 VAL 121 HG22 VAL 121 -3.488 6.324 8.033 978 HG23 VAL 121 HG23 VAL 121 -5.123 6.753 8.500 979 H GLU 122 H GLU 122 -3.361 5.683 13.158 980 HA GLU 122 HA GLU 122 -1.693 3.726 14.245 981 HB2 GLU 122 HB2 GLU 122 -2.869 5.476 15.477 982 HB3 GLU 122 HB3 GLU 122 -4.424 4.691 15.173 983 HG2 GLU 122 HG2 GLU 122 -3.783 2.775 16.544 984 HG3 GLU 122 HG3 GLU 122 -2.129 3.381 16.691 985 H ARG 123 H ARG 123 -4.982 3.163 12.947 986 HA ARG 123 HA ARG 123 -4.462 0.222 12.877 987 HB2 ARG 123 HB2 ARG 123 -6.734 1.533 14.424 988 HB3 ARG 123 HB3 ARG 123 -6.926 -0.055 13.687 989 HG2 ARG 123 HG2 ARG 123 -4.925 -0.869 14.965 990 HG3 ARG 123 HG3 ARG 123 -4.925 0.674 15.852 991 HD2 ARG 123 HD2 ARG 123 -7.226 0.255 16.623 992 HD3 ARG 123 HD3 ARG 123 -7.307 -1.218 15.638 993 HE ARG 123 HE ARG 123 -5.101 -1.335 17.502 994 HH11 ARG 123 HH11 ARG 123 -8.585 -1.758 17.373 995 HH12 ARG 123 HH12 ARG 123 -8.590 -2.868 18.721 996 HH21 ARG 123 HH21 ARG 123 -5.187 -2.753 19.218 997 HH22 ARG 123 HH22 ARG 123 -6.720 -3.405 19.734 998 H ASP 124 H ASP 124 -7.025 2.632 12.205 999 HA ASP 124 HA ASP 124 -7.834 1.202 9.761 1000 HB2 ASP 124 HB2 ASP 124 -8.842 3.627 11.250 1001 HB3 ASP 124 HB3 ASP 124 -9.348 3.307 9.596 1002 H HIS 125 H HIS 125 -6.018 1.219 8.523 1003 HA HIS 125 HA HIS 125 -4.413 3.442 7.767 1004 HB2 HIS 125 HB2 HIS 125 -4.867 0.812 6.302 1005 HB3 HIS 125 HB3 HIS 125 -3.460 1.863 6.168 1006 HD1 HIS 125 HD1 HIS 125 -4.435 -1.218 7.859 1007 HD2 HIS 125 HD2 HIS 125 -2.120 2.180 8.773 1008 HE1 HIS 125 HE1 HIS 125 -2.898 -1.897 9.771 1009 H ASN 126 H ASN 126 -7.115 4.249 7.373 1010 HA ASN 126 HA ASN 126 -7.330 4.820 4.484 1011 HB2 ASN 126 HB2 ASN 126 -9.658 3.890 4.459 1012 HB3 ASN 126 HB3 ASN 126 -8.442 2.653 4.760 1013 HD21 ASN 126 HD22 ASN 126 -11.054 4.536 6.238 1014 HD22 ASN 126 HD21 ASN 126 -11.115 3.594 7.704 1015 H PHE 127 H PHE 127 -9.061 6.362 3.992 1016 HA PHE 127 HA PHE 127 -9.960 8.187 6.090 1017 HB2 PHE 127 HB2 PHE 127 -8.487 10.074 5.125 1018 HB3 PHE 127 HB3 PHE 127 -7.754 8.924 6.220 1019 HD1 PHE 127 HD1 PHE 127 -8.185 9.582 2.535 1020 HD2 PHE 127 HD2 PHE 127 -5.756 7.806 5.628 1021 HE1 PHE 127 HE1 PHE 127 -6.463 9.016 0.859 1022 HE2 PHE 127 HE2 PHE 127 -4.026 7.240 3.939 1023 HZ PHE 127 HZ PHE 127 -4.379 7.831 1.547 1024 H ALA 128 H ALA 128 -11.248 9.950 5.292 1025 HA ALA 128 HA ALA 128 -12.571 9.432 2.759 1026 HB1 ALA 128 HB1 ALA 128 -13.794 10.189 4.769 1027 HB2 ALA 128 HB2 ALA 128 -12.922 11.742 4.702 1028 HB3 ALA 128 HB3 ALA 128 -14.029 11.280 3.390 1029 H LEU 129 H LEU 129 -12.888 10.941 1.081 1030 HA LEU 129 HA LEU 129 -10.582 12.734 0.405 1031 HB2 LEU 129 HB2 LEU 129 -12.567 11.107 -1.251 1032 HB3 LEU 129 HB3 LEU 129 -11.429 12.264 -1.930 1033 HG LEU 129 HG LEU 129 -10.391 9.940 -0.266 1034 HD11 LEU 129 HD11 LEU 129 -11.754 8.901 -2.016 1035 HD12 LEU 129 HD12 LEU 129 -11.055 9.981 -3.249 1036 HD13 LEU 129 HD13 LEU 129 -10.039 8.777 -2.453 1037 HD21 LEU 129 HD21 LEU 129 -9.294 11.498 -2.636 1038 HD22 LEU 129 HD22 LEU 129 -8.932 11.901 -0.953 1039 HD23 LEU 129 HD23 LEU 129 -8.396 10.342 -1.616 1040 H LYS 130 H LYS 130 -11.017 14.600 -0.921 1041 HA LYS 130 HA LYS 130 -13.145 16.285 -0.187 1042 HB2 LYS 130 HB2 LYS 130 -12.352 17.785 -1.822 1043 HB3 LYS 130 HB3 LYS 130 -10.945 16.867 -1.299 1044 HG2 LYS 130 HG2 LYS 130 -11.236 15.417 -3.381 1045 HG3 LYS 130 HG3 LYS 130 -12.545 16.507 -3.869 1046 HD2 LYS 130 HD2 LYS 130 -10.661 18.377 -3.567 1047 HD3 LYS 130 HD3 LYS 130 -9.592 16.980 -3.771 1048 HE2 LYS 130 HE2 LYS 130 -9.831 17.842 -5.938 1049 HE3 LYS 130 HE3 LYS 130 -10.888 16.426 -5.901 1050 HZ1 LYS 130 HZ1 LYS 130 -12.782 17.966 -5.554 1051 HZ2 LYS 130 HZ2 LYS 130 -11.775 19.256 -5.556 1052 HZ3 LYS 130 HZ3 LYS 130 -11.971 18.378 -6.914 1053 H ASN 131 H ASN 131 -13.093 14.019 -2.869 1054 HA ASN 131 HA ASN 131 -15.544 14.961 -4.090 1055 HB2 ASN 131 HB2 ASN 131 -13.984 12.347 -4.373 1056 HB3 ASN 131 HB3 ASN 131 -15.324 12.844 -5.409 1057 HD21 ASN 131 HD22 ASN 131 -15.056 14.839 -6.710 1058 HD22 ASN 131 HD21 ASN 131 -13.419 15.351 -7.129 1059 H GLY 132 H GLY 132 -14.967 13.058 -1.300 1060 HA2 GLY 132 HA2 GLY 132 -16.608 12.695 0.260 1061 HA3 GLY 132 HA3 GLY 132 -17.871 12.592 -0.958 1062 H PHE 133 H PHE 133 -14.811 10.714 -0.852 1063 HA PHE 133 HA PHE 133 -16.308 8.185 -0.317 1064 HB2 PHE 133 HB2 PHE 133 -14.264 8.583 -2.539 1065 HB3 PHE 133 HB3 PHE 133 -15.110 7.092 -2.153 1066 HD1 PHE 133 HD1 PHE 133 -17.521 6.816 -2.698 1067 HD2 PHE 133 HD2 PHE 133 -15.343 10.379 -3.768 1068 HE1 PHE 133 HE1 PHE 133 -19.387 7.501 -4.190 1069 HE2 PHE 133 HE2 PHE 133 -17.235 11.083 -5.239 1070 HZ PHE 133 HZ PHE 133 -19.259 9.655 -5.427 1071 H ILE 134 H ILE 134 -14.752 6.340 0.192 1072 HA ILE 134 HA ILE 134 -12.485 7.407 1.831 1073 HB ILE 134 HB ILE 134 -14.113 4.887 2.226 1074 HG12 ILE 134 HG12 ILE 134 -14.580 5.971 4.495 1075 HG13 ILE 134 HG13 ILE 134 -14.008 7.488 3.811 1076 HG21 ILE 134 HG21 ILE 134 -11.762 4.477 2.891 1077 HG22 ILE 134 HG22 ILE 134 -11.769 5.979 3.847 1078 HG23 ILE 134 HG23 ILE 134 -12.783 4.604 4.311 1079 HD11 ILE 134 HD11 ILE 134 -16.339 5.853 2.681 1080 HD12 ILE 134 HD12 ILE 134 -16.512 7.149 3.880 1081 HD13 ILE 134 HD13 ILE 134 -15.914 7.532 2.272 1082 H ALA 135 H ALA 135 -10.481 6.853 1.434 1083 HA ALA 135 HA ALA 135 -9.850 4.696 -0.539 1084 HB1 ALA 135 HB1 ALA 135 -9.326 6.998 -1.297 1085 HB2 ALA 135 HB2 ALA 135 -8.273 7.213 0.120 1086 HB3 ALA 135 HB3 ALA 135 -7.887 5.995 -1.124 1087 H SER 136 H SER 136 -7.913 3.440 -0.065 1088 HA SER 136 HA SER 136 -7.169 3.291 2.830 1089 HB2 SER 136 HB2 SER 136 -7.763 0.873 2.759 1090 HB3 SER 136 HB3 SER 136 -9.165 1.921 2.541 1091 HG SER 136 HG SER 136 -7.738 0.848 0.387 1092 H ASN 137 H ASN 137 -5.067 2.991 3.122 1093 HA ASN 137 HA ASN 137 -3.301 2.565 0.848 1094 HB2 ASN 137 HB2 ASN 137 -2.889 4.226 2.685 1095 HB3 ASN 137 HB3 ASN 137 -2.687 2.885 3.818 1096 HD21 ASN 137 HD22 ASN 137 -1.450 4.039 0.648 1097 HD22 ASN 137 HD21 ASN 137 0.221 3.639 1.010 Start of MODEL 3 1 H1 GLY -1 H GLY -1 2.008 -0.728 0.380 2 HA2 GLY -1 HA2 GLY -1 3.332 0.423 -1.321 3 HA3 GLY -1 HA3 GLY -1 2.610 -1.100 -1.840 4 H GLY 0 H GLY 0 0.824 1.973 -1.605 5 HA2 GLY 0 HA2 GLY 0 0.820 2.575 -4.409 6 HA3 GLY 0 HA3 GLY 0 -0.721 1.932 -3.798 7 H ALA 1 H ALA 1 -0.466 4.645 -4.699 8 HA ALA 1 HA ALA 1 -0.908 6.218 -2.236 9 HB1 ALA 1 HB1 ALA 1 1.473 6.079 -2.201 10 HB2 ALA 1 HB2 ALA 1 1.589 6.415 -3.937 11 HB3 ALA 1 HB3 ALA 1 1.074 7.679 -2.803 12 H LEU 2 H LEU 2 -0.977 8.629 -2.830 13 HA LEU 2 HA LEU 2 -2.814 8.937 -5.180 14 HB2 LEU 2 HB2 LEU 2 -2.831 10.293 -2.456 15 HB3 LEU 2 HB3 LEU 2 -4.015 10.511 -3.732 16 HG LEU 2 HG LEU 2 -3.513 7.888 -2.261 17 HD11 LEU 2 HD11 LEU 2 -4.493 9.537 -0.768 18 HD12 LEU 2 HD12 LEU 2 -5.807 9.835 -1.928 19 HD13 LEU 2 HD13 LEU 2 -5.625 8.236 -1.177 20 HD21 LEU 2 HD21 LEU 2 -5.682 8.709 -4.240 21 HD22 LEU 2 HD22 LEU 2 -4.410 7.483 -4.474 22 HD23 LEU 2 HD23 LEU 2 -5.685 7.206 -3.289 23 H SER 3 H SER 3 -2.851 10.915 -6.291 24 HA SER 3 HA SER 3 -0.269 12.206 -6.605 25 HB2 SER 3 HB2 SER 3 -2.016 11.875 -8.395 26 HB3 SER 3 HB3 SER 3 -2.950 13.187 -7.639 27 HG SER 3 HG SER 3 -1.254 13.611 -9.430 28 H TYR 4 H TYR 4 0.075 14.592 -6.488 29 HA TYR 4 HA TYR 4 -0.356 15.703 -3.895 30 HB2 TYR 4 HB2 TYR 4 1.398 16.432 -5.464 31 HB3 TYR 4 HB3 TYR 4 0.190 17.073 -6.562 32 HD1 TYR 4 HD2 TYR 4 -1.167 19.088 -5.934 33 HD2 TYR 4 HD1 TYR 4 2.091 17.657 -3.495 34 HE1 TYR 4 HE2 TYR 4 -1.123 21.262 -4.715 35 HE2 TYR 4 HE1 TYR 4 2.146 19.833 -2.286 36 HH TYR 4 HH TYR 4 1.269 21.929 -2.142 37 H GLU 5 H GLU 5 -2.090 16.202 -6.951 38 HA GLU 5 HA GLU 5 -3.926 18.211 -6.253 39 HB2 GLU 5 HB2 GLU 5 -4.266 15.811 -8.101 40 HB3 GLU 5 HB3 GLU 5 -5.298 17.240 -8.124 41 HG2 GLU 5 HG2 GLU 5 -2.294 17.372 -8.618 42 HG3 GLU 5 HG3 GLU 5 -3.480 17.062 -9.869 43 H THR 6 H THR 6 -3.959 14.879 -5.351 44 HA THR 6 HA THR 6 -6.765 14.518 -4.840 45 HB THR 6 HB THR 6 -4.418 13.009 -3.618 46 HG1 THR 6 HG1 THR 6 -5.678 11.798 -5.643 47 HG21 THR 6 HG21 THR 6 -6.395 12.377 -2.483 48 HG22 THR 6 HG22 THR 6 -7.369 12.421 -3.982 49 HG23 THR 6 HG23 THR 6 -6.175 11.139 -3.726 50 H GLU 7 H GLU 7 -7.817 15.910 -3.508 51 HA GLU 7 HA GLU 7 -6.491 16.895 -1.089 52 HB2 GLU 7 HB2 GLU 7 -9.308 17.523 -1.996 53 HB3 GLU 7 HB3 GLU 7 -8.342 18.360 -0.784 54 HG2 GLU 7 HG2 GLU 7 -6.633 18.811 -2.666 55 HG3 GLU 7 HG3 GLU 7 -7.901 18.299 -3.785 56 H ILE 8 H ILE 8 -7.002 16.571 0.957 57 HA ILE 8 HA ILE 8 -8.807 14.298 1.694 58 HB ILE 8 HB ILE 8 -6.212 15.205 3.012 59 HG12 ILE 8 HG12 ILE 8 -5.710 14.275 0.793 60 HG13 ILE 8 HG13 ILE 8 -5.069 13.310 2.110 61 HG21 ILE 8 HG21 ILE 8 -7.699 14.111 4.600 62 HG22 ILE 8 HG22 ILE 8 -7.965 12.755 3.490 63 HG23 ILE 8 HG23 ILE 8 -6.366 13.019 4.211 64 HD11 ILE 8 HD11 ILE 8 -6.678 11.597 1.789 65 HD12 ILE 8 HD12 ILE 8 -7.675 12.599 0.727 66 HD13 ILE 8 HD13 ILE 8 -6.089 12.018 0.171 67 H LEU 9 H LEU 9 -10.491 15.008 2.819 68 HA LEU 9 HA LEU 9 -10.715 17.592 4.042 69 HB2 LEU 9 HB2 LEU 9 -12.589 15.993 3.329 70 HB3 LEU 9 HB3 LEU 9 -12.215 15.042 4.764 71 HG LEU 9 HG LEU 9 -12.692 17.161 6.138 72 HD11 LEU 9 HD11 LEU 9 -12.518 18.842 4.338 73 HD12 LEU 9 HD12 LEU 9 -13.906 18.098 3.513 74 HD13 LEU 9 HD13 LEU 9 -14.111 18.871 5.096 75 HD21 LEU 9 HD21 LEU 9 -14.956 16.009 4.455 76 HD22 LEU 9 HD22 LEU 9 -14.301 15.301 5.947 77 HD23 LEU 9 HD23 LEU 9 -15.131 16.861 6.007 78 H THR 10 H THR 10 -9.919 18.367 5.953 79 HA THR 10 HA THR 10 -9.188 16.448 8.115 80 HB THR 10 HB THR 10 -7.373 17.841 8.797 81 HG1 THR 10 HG1 THR 10 -6.910 19.571 7.080 82 HG21 THR 10 HG21 THR 10 -6.894 16.248 6.934 83 HG22 THR 10 HG22 THR 10 -7.118 17.583 5.783 84 HG23 THR 10 HG23 THR 10 -5.808 17.646 6.984 85 H VAL 11 H VAL 11 -9.300 17.171 10.280 86 HA VAL 11 HA VAL 11 -11.572 18.968 10.857 87 HB VAL 11 HB VAL 11 -9.669 17.692 12.846 88 HG11 VAL 11 HG11 VAL 11 -11.040 19.441 13.864 89 HG12 VAL 11 HG12 VAL 11 -12.510 18.747 13.145 90 HG13 VAL 11 HG13 VAL 11 -11.611 17.864 14.398 91 HG21 VAL 11 HG21 VAL 11 -12.320 16.578 11.847 92 HG22 VAL 11 HG22 VAL 11 -10.728 15.906 11.440 93 HG23 VAL 11 HG23 VAL 11 -11.286 15.884 13.112 94 H GLU 12 H GLU 12 -8.050 19.087 11.076 95 HA GLU 12 HA GLU 12 -7.857 21.473 12.653 96 HB2 GLU 12 HB2 GLU 12 -6.065 19.699 11.082 97 HB3 GLU 12 HB3 GLU 12 -5.481 21.349 11.197 98 HG2 GLU 12 HG2 GLU 12 -6.271 19.592 13.551 99 HG3 GLU 12 HG3 GLU 12 -4.622 19.900 13.011 100 H TYR 13 H TYR 13 -8.246 21.049 9.183 101 HA TYR 13 HA TYR 13 -8.457 24.022 8.880 102 HB2 TYR 13 HB2 TYR 13 -6.789 22.124 7.194 103 HB3 TYR 13 HB3 TYR 13 -7.210 23.751 6.692 104 HD1 TYR 13 HD2 TYR 13 -6.717 25.617 8.637 105 HD2 TYR 13 HD1 TYR 13 -4.567 21.914 8.020 106 HE1 TYR 13 HE2 TYR 13 -4.710 26.586 9.749 107 HE2 TYR 13 HE1 TYR 13 -2.571 22.894 9.114 108 HH TYR 13 HH TYR 13 -1.675 24.733 10.132 109 H GLY 14 H GLY 14 -8.904 20.928 7.044 110 HA2 GLY 14 HA2 GLY 14 -11.374 20.759 6.173 111 HA3 GLY 14 HA3 GLY 14 -10.983 22.294 5.396 112 H LEU 15 H LEU 15 -11.136 21.565 3.318 113 HA LEU 15 HA LEU 15 -9.872 19.157 2.273 114 HB2 LEU 15 HB2 LEU 15 -11.083 21.634 0.966 115 HB3 LEU 15 HB3 LEU 15 -10.529 20.224 0.070 116 HG LEU 15 HG LEU 15 -12.739 20.128 2.176 117 HD11 LEU 15 HD11 LEU 15 -13.447 21.537 0.329 118 HD12 LEU 15 HD12 LEU 15 -12.916 20.325 -0.854 119 HD13 LEU 15 HD13 LEU 15 -14.279 19.977 0.239 120 HD21 LEU 15 HD21 LEU 15 -11.819 18.142 0.055 121 HD22 LEU 15 HD22 LEU 15 -11.669 17.945 1.812 122 HD23 LEU 15 HD23 LEU 15 -13.271 17.965 1.074 123 H LEU 16 H LEU 16 -7.684 19.043 2.365 124 HA LEU 16 HA LEU 16 -6.117 21.118 0.900 125 HB2 LEU 16 HB2 LEU 16 -5.637 19.796 3.586 126 HB3 LEU 16 HB3 LEU 16 -4.277 20.414 2.662 127 HG LEU 16 HG LEU 16 -6.655 22.183 3.379 128 HD11 LEU 16 HD11 LEU 16 -5.694 21.287 5.414 129 HD12 LEU 16 HD12 LEU 16 -4.060 21.765 4.901 130 HD13 LEU 16 HD13 LEU 16 -5.292 23.008 5.234 131 HD21 LEU 16 HD21 LEU 16 -3.768 22.806 2.605 132 HD22 LEU 16 HD22 LEU 16 -5.189 23.024 1.558 133 HD23 LEU 16 HD23 LEU 16 -5.020 23.997 3.022 134 HA PRO 17 HA PRO 17 -4.442 17.770 -1.479 135 HB2 PRO 17 HB2 PRO 17 -1.928 18.717 -2.100 136 HB3 PRO 17 HB3 PRO 17 -3.448 19.325 -2.829 137 HG2 PRO 17 HG2 PRO 17 -1.869 20.492 -0.532 138 HG3 PRO 17 HG3 PRO 17 -2.549 21.344 -1.955 139 HD2 PRO 17 HD2 PRO 17 -3.797 21.313 0.452 140 HD3 PRO 17 HD3 PRO 17 -4.736 21.231 -1.068 141 H ILE 18 H ILE 18 -3.708 15.810 -0.895 142 HA ILE 18 HA ILE 18 -2.452 15.240 1.562 143 HB ILE 18 HB ILE 18 -3.710 13.632 0.154 144 HG12 ILE 18 HG12 ILE 18 -0.961 12.614 0.961 145 HG13 ILE 18 HG13 ILE 18 -2.279 12.960 2.086 146 HG21 ILE 18 HG21 ILE 18 -2.578 14.176 -2.026 147 HG22 ILE 18 HG22 ILE 18 -1.192 13.207 -1.479 148 HG23 ILE 18 HG23 ILE 18 -2.788 12.466 -1.687 149 HD11 ILE 18 HD11 ILE 18 -3.691 11.249 0.896 150 HD12 ILE 18 HD12 ILE 18 -2.271 10.829 -0.089 151 HD13 ILE 18 HD13 ILE 18 -2.228 10.588 1.663 152 H GLY 19 H GLY 19 -0.920 15.905 -1.596 153 HA2 GLY 19 HA2 GLY 19 1.671 14.957 -0.870 154 HA3 GLY 19 HA3 GLY 19 1.310 16.075 -2.191 155 H LYS 20 H LYS 20 0.135 18.110 -0.309 156 HA LYS 20 HA LYS 20 2.605 19.446 0.489 157 HB2 LYS 20 HB2 LYS 20 0.448 20.558 -0.340 158 HB3 LYS 20 HB3 LYS 20 -0.244 20.204 1.251 159 HG2 LYS 20 HG2 LYS 20 1.680 21.505 2.279 160 HG3 LYS 20 HG3 LYS 20 2.220 21.901 0.639 161 HD2 LYS 20 HD2 LYS 20 0.004 23.020 0.220 162 HD3 LYS 20 HD3 LYS 20 -0.493 22.591 1.861 163 HE2 LYS 20 HE2 LYS 20 0.184 24.856 1.975 164 HE3 LYS 20 HE3 LYS 20 1.460 23.918 2.755 165 HZ1 LYS 20 HZ1 LYS 20 2.754 24.119 0.673 166 HZ2 LYS 20 HZ2 LYS 20 1.551 24.981 -0.029 167 HZ3 LYS 20 HZ3 LYS 20 2.362 25.597 1.242 168 H ILE 21 H ILE 21 0.084 17.559 2.091 169 HA ILE 21 HA ILE 21 0.870 18.212 4.799 170 HB ILE 21 HB ILE 21 -0.814 15.969 3.687 171 HG12 ILE 21 HG12 ILE 21 -1.703 18.390 5.318 172 HG13 ILE 21 HG13 ILE 21 -1.614 18.454 3.563 173 HG21 ILE 21 HG21 ILE 21 0.049 15.133 5.758 174 HG22 ILE 21 HG22 ILE 21 -0.289 16.668 6.587 175 HG23 ILE 21 HG23 ILE 21 -1.608 15.620 6.045 176 HD11 ILE 21 HD11 ILE 21 -3.216 16.592 3.368 177 HD12 ILE 21 HD12 ILE 21 -3.391 16.559 5.141 178 HD13 ILE 21 HD13 ILE 21 -3.885 17.994 4.227 179 H VAL 22 H VAL 22 1.615 15.560 2.513 180 HA VAL 22 HA VAL 22 3.418 14.238 4.360 181 HB VAL 22 HB VAL 22 3.087 13.966 1.355 182 HG11 VAL 22 HG11 VAL 22 5.305 13.092 2.055 183 HG12 VAL 22 HG12 VAL 22 4.515 12.083 3.287 184 HG13 VAL 22 HG13 VAL 22 4.210 11.814 1.566 185 HG21 VAL 22 HG21 VAL 22 1.780 12.758 3.796 186 HG22 VAL 22 HG22 VAL 22 1.071 13.237 2.252 187 HG23 VAL 22 HG23 VAL 22 1.985 11.727 2.375 188 H GLU 23 H GLU 23 4.071 16.568 1.656 189 HA GLU 23 HA GLU 23 6.920 16.194 2.010 190 HB2 GLU 23 HB2 GLU 23 7.225 17.636 0.269 191 HB3 GLU 23 HB3 GLU 23 5.674 16.868 -0.105 192 HG2 GLU 23 HG2 GLU 23 4.578 18.926 0.930 193 HG3 GLU 23 HG3 GLU 23 6.172 19.660 0.972 194 H LYS 24 H LYS 24 4.623 18.261 3.569 195 HA LYS 24 HA LYS 24 6.812 19.790 4.954 196 HB2 LYS 24 HB2 LYS 24 3.865 20.494 4.818 197 HB3 LYS 24 HB3 LYS 24 5.158 21.482 5.471 198 HG2 LYS 24 HG2 LYS 24 4.733 20.762 2.548 199 HG3 LYS 24 HG3 LYS 24 4.385 22.306 3.317 200 HD2 LYS 24 HD2 LYS 24 6.828 22.562 3.847 201 HD3 LYS 24 HD3 LYS 24 7.148 21.072 2.931 202 HE2 LYS 24 HE2 LYS 24 6.122 22.098 0.909 203 HE3 LYS 24 HE3 LYS 24 5.797 23.575 1.828 204 HZ1 LYS 24 HZ1 LYS 24 8.208 23.833 2.132 205 HZ2 LYS 24 HZ2 LYS 24 8.503 22.489 1.248 206 HZ3 LYS 24 HZ3 LYS 24 7.832 23.799 0.546 207 H ARG 25 H ARG 25 5.046 17.103 5.380 208 HA ARG 25 HA ARG 25 4.263 15.839 7.105 209 HB2 ARG 25 HB2 ARG 25 6.520 17.067 8.708 210 HB3 ARG 25 HB3 ARG 25 5.754 15.500 8.929 211 HG2 ARG 25 HG2 ARG 25 7.503 14.698 7.742 212 HG3 ARG 25 HG3 ARG 25 6.557 15.211 6.346 213 HD2 ARG 25 HD2 ARG 25 8.852 15.939 6.092 214 HD3 ARG 25 HD3 ARG 25 7.818 17.357 6.291 215 HE ARG 25 HE ARG 25 8.873 16.484 8.839 216 HH11 ARG 25 HH11 ARG 25 9.930 18.206 5.967 217 HH12 ARG 25 HH12 ARG 25 11.123 19.120 6.855 218 HH21 ARG 25 HH21 ARG 25 10.397 17.690 9.899 219 HH22 ARG 25 HH22 ARG 25 11.380 18.828 9.018 220 H ILE 26 H ILE 26 2.485 17.679 6.876 221 HA ILE 26 HA ILE 26 2.254 19.506 9.139 222 HB ILE 26 HB ILE 26 0.100 18.829 7.102 223 HG12 ILE 26 HG12 ILE 26 2.268 20.972 6.989 224 HG13 ILE 26 HG13 ILE 26 2.180 19.536 5.969 225 HG21 ILE 26 HG21 ILE 26 -0.651 20.049 9.163 226 HG22 ILE 26 HG22 ILE 26 0.533 21.324 8.809 227 HG23 ILE 26 HG23 ILE 26 -0.834 21.013 7.712 228 HD11 ILE 26 HD11 ILE 26 1.372 21.285 4.623 229 HD12 ILE 26 HD12 ILE 26 -0.064 20.367 5.107 230 HD13 ILE 26 HD13 ILE 26 0.315 21.917 5.900 231 H GLU 27 H GLU 27 1.345 19.134 11.061 232 HA GLU 27 HA GLU 27 0.138 16.496 11.605 233 HB2 GLU 27 HB2 GLU 27 0.598 18.672 13.639 234 HB3 GLU 27 HB3 GLU 27 0.316 16.931 13.856 235 HG2 GLU 27 HG2 GLU 27 2.510 16.496 12.710 236 HG3 GLU 27 HG3 GLU 27 2.806 18.235 12.675 237 H CYS 28 H CYS 28 -1.853 16.260 11.000 238 HA CYS 28 HA CYS 28 -3.972 18.156 11.907 239 HB2 CYS 28 HB2 CYS 28 -3.481 17.078 9.104 240 HB3 CYS 28 HB3 CYS 28 -5.057 17.700 9.601 241 HG CYS 28 HG CYS 28 -3.724 19.455 8.152 242 H THR 29 H THR 29 -6.182 16.973 11.130 243 HA THR 29 HA THR 29 -6.214 14.177 12.209 244 HB THR 29 HB THR 29 -8.545 16.001 12.570 245 HG1 THR 29 HG1 THR 29 -6.348 16.099 14.338 246 HG21 THR 29 HG21 THR 29 -8.699 13.672 13.325 247 HG22 THR 29 HG22 THR 29 -7.350 13.957 14.461 248 HG23 THR 29 HG23 THR 29 -8.889 14.818 14.658 249 H VAL 30 H VAL 30 -7.714 12.799 11.193 250 HA VAL 30 HA VAL 30 -9.008 13.786 8.674 251 HB VAL 30 HB VAL 30 -8.191 11.918 7.445 252 HG11 VAL 30 HG11 VAL 30 -6.686 13.916 7.666 253 HG12 VAL 30 HG12 VAL 30 -5.775 13.034 8.917 254 HG13 VAL 30 HG13 VAL 30 -5.860 12.405 7.263 255 HG21 VAL 30 HG21 VAL 30 -6.708 10.953 9.926 256 HG22 VAL 30 HG22 VAL 30 -8.124 10.162 9.187 257 HG23 VAL 30 HG23 VAL 30 -6.600 10.267 8.293 258 H TYR 31 H TYR 31 -10.440 11.940 7.720 259 HA TYR 31 HA TYR 31 -12.235 11.037 9.933 260 HB2 TYR 31 HB2 TYR 31 -12.923 11.840 7.087 261 HB3 TYR 31 HB3 TYR 31 -14.058 11.335 8.320 262 HD1 TYR 31 HD2 TYR 31 -11.633 14.009 7.381 263 HD2 TYR 31 HD1 TYR 31 -14.960 12.900 9.886 264 HE1 TYR 31 HE2 TYR 31 -11.908 16.378 8.058 265 HE2 TYR 31 HE1 TYR 31 -15.275 15.303 10.517 266 HH TYR 31 HH TYR 31 -13.159 17.887 9.208 267 H SER 32 H SER 32 -13.176 9.037 9.827 268 HA SER 32 HA SER 32 -12.567 7.023 7.733 269 HB2 SER 32 HB2 SER 32 -10.462 7.032 8.906 270 HB3 SER 32 HB3 SER 32 -11.256 7.200 10.473 271 HG SER 32 HG SER 32 -10.824 5.131 10.477 272 H VAL 33 H VAL 33 -13.842 5.030 8.104 273 HA VAL 33 HA VAL 33 -15.932 5.294 10.224 274 HB VAL 33 HB VAL 33 -17.005 3.306 9.391 275 HG11 VAL 33 HG11 VAL 33 -17.822 5.362 8.636 276 HG12 VAL 33 HG12 VAL 33 -16.610 5.469 7.318 277 HG13 VAL 33 HG13 VAL 33 -17.887 4.231 7.285 278 HG21 VAL 33 HG21 VAL 33 -14.801 3.275 7.347 279 HG22 VAL 33 HG22 VAL 33 -15.334 1.987 8.440 280 HG23 VAL 33 HG23 VAL 33 -16.371 2.456 7.088 281 H ASP 34 H ASP 34 -16.092 3.979 11.908 282 HA ASP 34 HA ASP 34 -13.799 2.305 12.680 283 HB2 ASP 34 HB2 ASP 34 -15.405 3.815 14.166 284 HB3 ASP 34 HB3 ASP 34 -16.410 2.378 14.162 285 H ASN 35 H ASN 35 -14.615 0.139 13.800 286 HA ASN 35 HA ASN 35 -15.211 -1.743 11.695 287 HB2 ASN 35 HB2 ASN 35 -14.051 -1.898 14.174 288 HB3 ASN 35 HB3 ASN 35 -15.636 -2.519 14.567 289 HD21 ASN 35 HD22 ASN 35 -12.668 -3.089 12.765 290 HD22 ASN 35 HD21 ASN 35 -13.039 -4.756 12.344 291 H ASN 36 H ASN 36 -17.219 0.064 13.887 292 HA ASN 36 HA ASN 36 -19.603 -1.594 13.516 293 HB2 ASN 36 HB2 ASN 36 -19.113 1.030 15.005 294 HB3 ASN 36 HB3 ASN 36 -20.610 0.102 15.073 295 HD21 ASN 36 HD22 ASN 36 -17.962 0.719 16.883 296 HD22 ASN 36 HD21 ASN 36 -17.844 -0.819 17.726 297 H GLY 37 H GLY 37 -18.163 0.624 11.487 298 HA2 GLY 37 HA2 GLY 37 -18.941 1.687 9.601 299 HA3 GLY 37 HA3 GLY 37 -20.587 1.159 9.971 300 H ASN 38 H ASN 38 -18.564 3.072 12.153 301 HA ASN 38 HA ASN 38 -20.449 5.410 11.954 302 HB2 ASN 38 HB2 ASN 38 -18.872 4.209 14.273 303 HB3 ASN 38 HB3 ASN 38 -19.437 5.873 14.297 304 HD21 ASN 38 HD22 ASN 38 -20.716 2.539 13.791 305 HD22 ASN 38 HD21 ASN 38 -22.251 2.897 14.555 306 H ILE 39 H ILE 39 -19.583 7.206 11.057 307 HA ILE 39 HA ILE 39 -16.770 7.399 10.413 308 HB ILE 39 HB ILE 39 -18.977 9.474 10.178 309 HG12 ILE 39 HG12 ILE 39 -17.745 7.519 8.184 310 HG13 ILE 39 HG13 ILE 39 -19.385 7.416 8.844 311 HG21 ILE 39 HG21 ILE 39 -16.702 10.500 10.234 312 HG22 ILE 39 HG22 ILE 39 -16.170 9.383 8.958 313 HG23 ILE 39 HG23 ILE 39 -17.406 10.618 8.630 314 HD11 ILE 39 HD11 ILE 39 -19.793 9.690 7.710 315 HD12 ILE 39 HD12 ILE 39 -18.267 9.337 6.834 316 HD13 ILE 39 HD13 ILE 39 -19.648 8.247 6.681 317 H TYR 40 H TYR 40 -15.259 7.888 11.736 318 HA TYR 40 HA TYR 40 -15.637 9.853 13.965 319 HB2 TYR 40 HB2 TYR 40 -14.356 8.538 15.427 320 HB3 TYR 40 HB3 TYR 40 -15.507 7.432 14.714 321 HD1 TYR 40 HD1 TYR 40 -14.731 5.719 13.025 322 HD2 TYR 40 HD2 TYR 40 -11.961 8.269 15.127 323 HE1 TYR 40 HE1 TYR 40 -12.821 4.326 12.243 324 HE2 TYR 40 HE2 TYR 40 -10.077 6.851 14.335 325 HH TYR 40 HH TYR 40 -9.429 5.239 12.874 326 H THR 41 H THR 41 -13.294 10.494 14.787 327 HA THR 41 HA THR 41 -11.600 11.157 12.425 328 HB THR 41 HB THR 41 -11.086 13.329 13.666 329 HG1 THR 41 HG1 THR 41 -12.091 12.819 15.636 330 HG21 THR 41 HG21 THR 41 -12.348 13.389 11.642 331 HG22 THR 41 HG22 THR 41 -13.827 12.818 12.455 332 HG23 THR 41 HG23 THR 41 -13.182 14.429 12.812 333 H GLN 42 H GLN 42 -9.425 11.199 12.618 334 HA GLN 42 HA GLN 42 -8.165 10.501 15.217 335 HB2 GLN 42 HB2 GLN 42 -6.952 8.618 14.143 336 HB3 GLN 42 HB3 GLN 42 -8.688 8.397 14.280 337 HG2 GLN 42 HG2 GLN 42 -8.924 9.006 11.835 338 HG3 GLN 42 HG3 GLN 42 -7.167 9.117 11.733 339 HE21 GLN 42 HE22 GLN 42 -7.959 7.415 9.930 340 HE22 GLN 42 HE21 GLN 42 -7.895 5.752 10.475 341 HA PRO 43 HA PRO 43 -4.981 13.195 13.670 342 HB2 PRO 43 HB2 PRO 43 -2.830 12.495 15.205 343 HB3 PRO 43 HB3 PRO 43 -4.250 13.375 15.846 344 HG2 PRO 43 HG2 PRO 43 -3.688 10.397 15.974 345 HG3 PRO 43 HG3 PRO 43 -4.205 11.484 17.304 346 HD2 PRO 43 HD2 PRO 43 -5.977 9.939 15.931 347 HD3 PRO 43 HD3 PRO 43 -6.414 11.582 16.487 348 H VAL 44 H VAL 44 -3.197 13.237 12.290 349 HA VAL 44 HA VAL 44 -2.516 10.905 10.684 350 HB VAL 44 HB VAL 44 -1.041 13.560 11.048 351 HG11 VAL 44 HG11 VAL 44 0.496 11.976 10.095 352 HG12 VAL 44 HG12 VAL 44 -0.747 11.321 9.002 353 HG13 VAL 44 HG13 VAL 44 -0.112 12.956 8.764 354 HG21 VAL 44 HG21 VAL 44 -2.935 12.734 8.810 355 HG22 VAL 44 HG22 VAL 44 -3.344 13.852 10.123 356 HG23 VAL 44 HG23 VAL 44 -2.069 14.284 8.988 357 H ALA 45 H ALA 45 -1.282 9.227 11.309 358 HA ALA 45 HA ALA 45 0.269 9.331 13.786 359 HB1 ALA 45 HB1 ALA 45 -0.987 7.320 13.056 360 HB2 ALA 45 HB2 ALA 45 0.091 7.165 11.650 361 HB3 ALA 45 HB3 ALA 45 0.747 6.990 13.287 362 H GLN 46 H GLN 46 1.072 9.009 10.311 363 HA GLN 46 HA GLN 46 3.726 10.228 10.621 364 HB2 GLN 46 HB2 GLN 46 3.355 7.350 9.667 365 HB3 GLN 46 HB3 GLN 46 4.832 8.273 9.443 366 HG2 GLN 46 HG2 GLN 46 3.680 7.387 12.100 367 HG3 GLN 46 HG3 GLN 46 5.078 6.728 11.274 368 HE21 GLN 46 HE22 GLN 46 4.824 8.041 13.993 369 HE22 GLN 46 HE21 GLN 46 6.055 9.298 13.958 370 H TRP 47 H TRP 47 4.839 10.012 8.302 371 HA TRP 47 HA TRP 47 2.858 10.523 6.121 372 HB2 TRP 47 HB2 TRP 47 5.283 12.244 6.767 373 HB3 TRP 47 HB3 TRP 47 4.148 12.481 5.455 374 HD1 TRP 47 HD1 TRP 47 2.000 13.881 5.960 375 HE1 TRP 47 HE1 TRP 47 1.108 15.161 7.992 376 HE3 TRP 47 HE3 TRP 47 5.280 12.160 9.507 377 HZ2 TRP 47 HZ2 TRP 47 1.535 15.145 10.838 378 HZ3 TRP 47 HZ3 TRP 47 4.957 12.757 11.896 379 HH2 TRP 47 HH2 TRP 47 3.057 14.221 12.577 380 H HIS 48 H HIS 48 3.410 9.502 4.233 381 HA HIS 48 HA HIS 48 6.217 8.549 3.865 382 HB2 HIS 48 HB2 HIS 48 3.773 6.919 3.171 383 HB3 HIS 48 HB3 HIS 48 5.446 6.406 3.190 384 HD1 HIS 48 HD1 HIS 48 6.521 6.117 5.794 385 HD2 HIS 48 HD2 HIS 48 2.359 6.580 5.349 386 HE1 HIS 48 HE1 HIS 48 5.478 5.363 7.995 387 H ASP 49 H ASP 49 7.028 8.583 1.865 388 HA ASP 49 HA ASP 49 5.419 9.716 -0.388 389 HB2 ASP 49 HB2 ASP 49 6.548 11.583 0.591 390 HB3 ASP 49 HB3 ASP 49 8.028 10.661 0.837 391 H ARG 50 H ARG 50 5.533 8.581 -2.094 392 HA ARG 50 HA ARG 50 7.436 6.310 -2.397 393 HB2 ARG 50 HB2 ARG 50 5.084 7.225 -4.069 394 HB3 ARG 50 HB3 ARG 50 5.947 5.707 -4.247 395 HG2 ARG 50 HG2 ARG 50 4.353 6.575 -1.785 396 HG3 ARG 50 HG3 ARG 50 3.780 5.462 -3.003 397 HD2 ARG 50 HD2 ARG 50 6.146 4.991 -1.143 398 HD3 ARG 50 HD3 ARG 50 4.540 4.272 -1.020 399 HE ARG 50 HE ARG 50 5.789 3.744 -3.614 400 HH11 ARG 50 HH11 ARG 50 5.950 2.567 -0.320 401 HH12 ARG 50 HH12 ARG 50 6.500 0.992 -0.843 402 HH21 ARG 50 HH21 ARG 50 6.334 1.770 -4.207 403 HH22 ARG 50 HH22 ARG 50 6.738 0.553 -3.012 404 H GLY 51 H GLY 51 6.906 9.444 -3.724 405 HA2 GLY 51 HA2 GLY 51 8.490 10.762 -4.795 406 HA3 GLY 51 HA3 GLY 51 9.447 9.332 -5.157 407 H GLU 52 H GLU 52 7.678 7.781 -6.693 408 HA GLU 52 HA GLU 52 6.529 9.201 -8.941 409 HB2 GLU 52 HB2 GLU 52 9.414 8.316 -9.253 410 HB3 GLU 52 HB3 GLU 52 8.254 8.341 -10.580 411 HG2 GLU 52 HG2 GLU 52 7.860 10.810 -10.028 412 HG3 GLU 52 HG3 GLU 52 9.385 10.706 -9.123 413 H GLN 53 H GLN 53 4.917 7.611 -8.752 414 HA GLN 53 HA GLN 53 5.636 5.010 -10.056 415 HB2 GLN 53 HB2 GLN 53 3.479 5.572 -8.007 416 HB3 GLN 53 HB3 GLN 53 3.861 3.983 -8.709 417 HG2 GLN 53 HG2 GLN 53 6.193 4.161 -7.771 418 HG3 GLN 53 HG3 GLN 53 5.721 5.674 -6.965 419 HE21 GLN 53 HE22 GLN 53 3.211 5.111 -5.831 420 HE22 GLN 53 HE21 GLN 53 3.784 4.216 -4.498 421 H GLU 54 H GLU 54 3.735 3.958 -11.117 422 HA GLU 54 HA GLU 54 2.738 5.644 -13.187 423 HB2 GLU 54 HB2 GLU 54 1.512 3.595 -13.920 424 HB3 GLU 54 HB3 GLU 54 3.245 3.413 -13.704 425 HG2 GLU 54 HG2 GLU 54 2.826 2.304 -11.480 426 HG3 GLU 54 HG3 GLU 54 1.098 2.373 -11.802 427 H VAL 55 H VAL 55 1.309 7.212 -12.880 428 HA VAL 55 HA VAL 55 -1.093 6.751 -11.168 429 HB VAL 55 HB VAL 55 -0.049 9.368 -12.310 430 HG11 VAL 55 HG11 VAL 55 -2.490 9.428 -11.806 431 HG12 VAL 55 HG12 VAL 55 -2.161 8.822 -10.171 432 HG13 VAL 55 HG13 VAL 55 -1.571 10.420 -10.684 433 HG21 VAL 55 HG21 VAL 55 0.266 8.011 -9.611 434 HG22 VAL 55 HG22 VAL 55 1.536 8.652 -10.671 435 HG23 VAL 55 HG23 VAL 55 0.465 9.762 -9.818 436 H PHE 56 H PHE 56 -3.082 6.840 -11.841 437 HA PHE 56 HA PHE 56 -3.715 7.334 -14.729 438 HB2 PHE 56 HB2 PHE 56 -4.992 5.345 -12.841 439 HB3 PHE 56 HB3 PHE 56 -5.392 5.566 -14.531 440 HD1 PHE 56 HD2 PHE 56 -2.783 4.340 -12.156 441 HD2 PHE 56 HD1 PHE 56 -4.061 4.510 -16.266 442 HE1 PHE 56 HE2 PHE 56 -0.988 2.753 -12.777 443 HE2 PHE 56 HE1 PHE 56 -2.273 2.876 -16.877 444 HZ PHE 56 HZ PHE 56 -0.702 2.055 -15.147 445 H GLU 57 H GLU 57 -5.774 8.171 -15.174 446 HA GLU 57 HA GLU 57 -7.055 9.742 -12.973 447 HB2 GLU 57 HB2 GLU 57 -6.294 11.005 -14.938 448 HB3 GLU 57 HB3 GLU 57 -7.261 10.009 -16.014 449 HG2 GLU 57 HG2 GLU 57 -9.306 10.889 -15.044 450 HG3 GLU 57 HG3 GLU 57 -8.413 11.622 -13.705 451 H TYR 58 H TYR 58 -8.641 8.564 -12.049 452 HA TYR 58 HA TYR 58 -10.365 6.767 -13.697 453 HB2 TYR 58 HB2 TYR 58 -10.403 7.050 -10.693 454 HB3 TYR 58 HB3 TYR 58 -11.086 5.783 -11.674 455 HD1 TYR 58 HD1 TYR 58 -9.557 4.092 -12.798 456 HD2 TYR 58 HD2 TYR 58 -8.102 7.076 -10.040 457 HE1 TYR 58 HE1 TYR 58 -7.442 2.791 -12.486 458 HE2 TYR 58 HE2 TYR 58 -5.995 5.798 -9.776 459 HH TYR 58 HH TYR 58 -4.828 3.991 -10.363 460 H CYS 59 H CYS 59 -11.910 7.884 -14.706 461 HA CYS 59 HA CYS 59 -13.175 10.278 -13.528 462 HB2 CYS 59 HB2 CYS 59 -12.450 10.097 -15.938 463 HB3 CYS 59 HB3 CYS 59 -13.659 8.820 -16.165 464 HG CYS 59 HG CYS 59 -14.525 11.086 -17.196 465 H LEU 60 H LEU 60 -15.348 10.425 -12.961 466 HA LEU 60 HA LEU 60 -16.745 7.839 -12.401 467 HB2 LEU 60 HB2 LEU 60 -16.228 10.281 -10.890 468 HB3 LEU 60 HB3 LEU 60 -17.942 10.030 -11.011 469 HG LEU 60 HG LEU 60 -17.829 7.855 -10.005 470 HD11 LEU 60 HD11 LEU 60 -15.738 6.910 -10.764 471 HD12 LEU 60 HD12 LEU 60 -14.804 8.194 -9.964 472 HD13 LEU 60 HD13 LEU 60 -15.704 6.984 -9.015 473 HD21 LEU 60 HD21 LEU 60 -16.024 9.681 -8.371 474 HD22 LEU 60 HD22 LEU 60 -17.751 10.008 -8.614 475 HD23 LEU 60 HD23 LEU 60 -17.252 8.522 -7.807 476 H GLU 61 H GLU 61 -19.016 7.749 -12.384 477 HA GLU 61 HA GLU 61 -20.101 8.450 -14.941 478 HB2 GLU 61 HB2 GLU 61 -21.663 7.484 -12.517 479 HB3 GLU 61 HB3 GLU 61 -22.119 7.371 -14.215 480 HG2 GLU 61 HG2 GLU 61 -19.666 6.050 -14.188 481 HG3 GLU 61 HG3 GLU 61 -20.313 5.663 -12.600 482 H ASP 62 H ASP 62 -20.156 10.174 -11.974 483 HA ASP 62 HA ASP 62 -22.369 11.999 -12.745 484 HB2 ASP 62 HB2 ASP 62 -22.124 11.224 -10.426 485 HB3 ASP 62 HB3 ASP 62 -20.515 11.954 -10.334 486 H GLY 63 H GLY 63 -18.979 11.784 -13.280 487 HA2 GLY 63 HA2 GLY 63 -18.005 13.284 -14.896 488 HA3 GLY 63 HA3 GLY 63 -18.824 14.649 -14.142 489 H SER 64 H SER 64 -17.766 12.899 -11.557 490 HA SER 64 HA SER 64 -15.593 14.717 -10.979 491 HB2 SER 64 HB2 SER 64 -17.248 13.665 -9.331 492 HB3 SER 64 HB3 SER 64 -16.222 12.212 -9.399 493 HG SER 64 HG SER 64 -15.811 14.131 -7.829 494 H LEU 65 H LEU 65 -13.535 13.752 -9.938 495 HA LEU 65 HA LEU 65 -12.192 11.799 -11.755 496 HB2 LEU 65 HB2 LEU 65 -11.423 14.704 -11.239 497 HB3 LEU 65 HB3 LEU 65 -10.338 13.533 -11.978 498 HG LEU 65 HG LEU 65 -13.026 14.318 -13.198 499 HD11 LEU 65 HD11 LEU 65 -11.548 16.267 -13.093 500 HD12 LEU 65 HD12 LEU 65 -10.221 15.328 -13.815 501 HD13 LEU 65 HD13 LEU 65 -11.689 15.683 -14.758 502 HD21 LEU 65 HD21 LEU 65 -10.586 12.926 -14.363 503 HD22 LEU 65 HD22 LEU 65 -12.111 12.124 -13.957 504 HD23 LEU 65 HD23 LEU 65 -12.071 13.331 -15.244 505 H ILE 66 H ILE 66 -10.609 10.672 -10.867 506 HA ILE 66 HA ILE 66 -9.545 11.300 -8.133 507 HB ILE 66 HB ILE 66 -10.422 8.617 -9.244 508 HG12 ILE 66 HG12 ILE 66 -11.678 9.963 -6.832 509 HG13 ILE 66 HG13 ILE 66 -12.301 10.240 -8.453 510 HG21 ILE 66 HG21 ILE 66 -8.497 8.306 -7.754 511 HG22 ILE 66 HG22 ILE 66 -9.279 9.299 -6.498 512 HG23 ILE 66 HG23 ILE 66 -9.940 7.722 -6.960 513 HD11 ILE 66 HD11 ILE 66 -12.638 7.821 -8.796 514 HD12 ILE 66 HD12 ILE 66 -12.155 7.537 -7.110 515 HD13 ILE 66 HD13 ILE 66 -13.595 8.511 -7.474 516 H ARG 67 H ARG 67 -7.376 10.770 -7.821 517 HA ARG 67 HA ARG 67 -5.771 9.951 -10.224 518 HB2 ARG 67 HB2 ARG 67 -5.286 12.319 -8.373 519 HB3 ARG 67 HB3 ARG 67 -4.185 11.740 -9.635 520 HG2 ARG 67 HG2 ARG 67 -7.000 12.607 -10.329 521 HG3 ARG 67 HG3 ARG 67 -5.680 13.771 -10.127 522 HD2 ARG 67 HD2 ARG 67 -4.344 12.348 -11.788 523 HD3 ARG 67 HD3 ARG 67 -5.848 11.477 -12.101 524 HE ARG 67 HE ARG 67 -6.606 13.275 -13.385 525 HH11 ARG 67 HH11 ARG 67 -3.848 14.531 -11.564 526 HH12 ARG 67 HH12 ARG 67 -3.833 15.987 -12.523 527 HH21 ARG 67 HH21 ARG 67 -6.482 14.996 -14.504 528 HH22 ARG 67 HH22 ARG 67 -5.310 16.276 -14.168 529 H ALA 68 H ALA 68 -5.003 8.071 -9.631 530 HA ALA 68 HA ALA 68 -3.275 7.816 -7.238 531 HB1 ALA 68 HB1 ALA 68 -5.628 7.402 -6.456 532 HB2 ALA 68 HB2 ALA 68 -5.755 6.062 -7.602 533 HB3 ALA 68 HB3 ALA 68 -4.578 5.980 -6.285 534 H THR 69 H THR 69 -2.258 5.647 -7.059 535 HA THR 69 HA THR 69 -1.538 4.497 -9.688 536 HB THR 69 HB THR 69 -0.122 2.952 -8.414 537 HG1 THR 69 HG1 THR 69 0.057 3.032 -6.307 538 HG21 THR 69 HG21 THR 69 1.105 4.804 -8.994 539 HG22 THR 69 HG22 THR 69 0.202 5.915 -7.950 540 HG23 THR 69 HG23 THR 69 1.347 4.744 -7.244 541 H LYS 70 H LYS 70 -1.646 2.139 -9.979 542 HA LYS 70 HA LYS 70 -4.348 1.115 -9.422 543 HB2 LYS 70 HB2 LYS 70 -2.022 0.234 -11.147 544 HB3 LYS 70 HB3 LYS 70 -3.220 -0.963 -10.678 545 HG2 LYS 70 HG2 LYS 70 -5.023 0.669 -11.445 546 HG3 LYS 70 HG3 LYS 70 -3.752 1.606 -12.221 547 HD2 LYS 70 HD2 LYS 70 -4.132 -1.363 -12.798 548 HD3 LYS 70 HD3 LYS 70 -5.176 -0.156 -13.525 549 HE2 LYS 70 HE2 LYS 70 -3.583 -0.629 -15.140 550 HE3 LYS 70 HE3 LYS 70 -3.177 0.964 -14.515 551 HZ1 LYS 70 HZ1 LYS 70 -1.368 -0.075 -13.228 552 HZ2 LYS 70 HZ2 LYS 70 -1.830 -1.580 -13.702 553 HZ3 LYS 70 HZ3 LYS 70 -1.216 -0.523 -14.777 554 H ASP 71 H ASP 71 -1.663 1.123 -7.550 555 HA ASP 71 HA ASP 71 -1.980 -1.589 -6.391 556 HB2 ASP 71 HB2 ASP 71 0.021 0.625 -5.807 557 HB3 ASP 71 HB3 ASP 71 0.071 -1.030 -5.193 558 H HIS 72 H HIS 72 -2.906 1.737 -5.732 559 HA HIS 72 HA HIS 72 -3.049 1.456 -2.827 560 HB2 HIS 72 HB2 HIS 72 -2.912 3.642 -4.205 561 HB3 HIS 72 HB3 HIS 72 -4.605 3.419 -4.581 562 HD1 HIS 72 HD1 HIS 72 -5.673 2.718 -1.538 563 HD2 HIS 72 HD2 HIS 72 -2.954 5.686 -2.713 564 HE1 HIS 72 HE1 HIS 72 -5.495 4.344 0.402 565 H LYS 73 H LYS 73 -4.773 0.484 -1.693 566 HA LYS 73 HA LYS 73 -7.082 -0.564 -3.214 567 HB2 LYS 73 HB2 LYS 73 -6.330 -0.921 -0.301 568 HB3 LYS 73 HB3 LYS 73 -7.673 -1.714 -1.100 569 HG2 LYS 73 HG2 LYS 73 -6.282 -3.107 -2.375 570 HG3 LYS 73 HG3 LYS 73 -4.893 -2.025 -2.264 571 HD2 LYS 73 HD2 LYS 73 -4.801 -2.543 0.231 572 HD3 LYS 73 HD3 LYS 73 -5.974 -3.845 -0.088 573 HE2 LYS 73 HE2 LYS 73 -4.403 -4.795 -1.784 574 HE3 LYS 73 HE3 LYS 73 -3.276 -3.461 -1.476 575 HZ1 LYS 73 HZ1 LYS 73 -3.053 -4.269 0.818 576 HZ2 LYS 73 HZ2 LYS 73 -4.089 -5.504 0.534 577 HZ3 LYS 73 HZ3 LYS 73 -2.648 -5.452 -0.230 578 H PHE 74 H PHE 74 -9.264 -0.251 -2.562 579 HA PHE 74 HA PHE 74 -9.883 2.373 -1.250 580 HB2 PHE 74 HB2 PHE 74 -10.513 1.439 -4.055 581 HB3 PHE 74 HB3 PHE 74 -11.622 2.480 -3.190 582 HD1 PHE 74 HD1 PHE 74 -8.008 2.339 -4.218 583 HD2 PHE 74 HD2 PHE 74 -11.505 4.762 -3.527 584 HE1 PHE 74 HE1 PHE 74 -6.777 4.320 -5.026 585 HE2 PHE 74 HE2 PHE 74 -10.247 6.773 -4.289 586 HZ PHE 74 HZ PHE 74 -7.885 6.559 -5.035 587 H MET 75 H MET 75 -11.847 2.480 -0.256 588 HA MET 75 HA MET 75 -12.937 -0.092 0.566 589 HB2 MET 75 HB2 MET 75 -12.305 2.007 1.992 590 HB3 MET 75 HB3 MET 75 -13.920 2.571 1.554 591 HG2 MET 75 HG2 MET 75 -14.951 0.694 2.618 592 HG3 MET 75 HG3 MET 75 -13.412 -0.176 2.730 593 HE1 MET 75 HE1 MET 75 -14.704 3.383 3.523 594 HE2 MET 75 HE2 MET 75 -15.756 2.498 4.650 595 HE3 MET 75 HE3 MET 75 -14.446 3.544 5.260 596 H THR 76 H THR 76 -14.484 -1.046 -0.644 597 HA THR 76 HA THR 76 -16.298 0.417 -2.386 598 HB THR 76 HB THR 76 -17.368 -1.736 -2.802 599 HG1 THR 76 HG1 THR 76 -16.584 -3.553 -1.740 600 HG21 THR 76 HG21 THR 76 -15.273 -1.085 -3.939 601 HG22 THR 76 HG22 THR 76 -14.347 -2.019 -2.741 602 HG23 THR 76 HG23 THR 76 -15.499 -2.844 -3.822 603 H VAL 77 H VAL 77 -18.741 -0.209 -2.277 604 HA VAL 77 HA VAL 77 -19.945 1.026 -0.071 605 HB VAL 77 HB VAL 77 -22.085 0.042 -0.874 606 HG11 VAL 77 HG11 VAL 77 -21.111 2.092 -1.858 607 HG12 VAL 77 HG12 VAL 77 -20.340 1.113 -3.121 608 HG13 VAL 77 HG13 VAL 77 -22.108 1.175 -3.005 609 HG21 VAL 77 HG21 VAL 77 -20.375 -1.401 -2.956 610 HG22 VAL 77 HG22 VAL 77 -21.290 -2.178 -1.647 611 HG23 VAL 77 HG23 VAL 77 -22.144 -1.305 -2.923 612 H ASP 78 H ASP 78 -18.990 -2.342 -0.326 613 HA ASP 78 HA ASP 78 -20.479 -3.113 2.131 614 HB2 ASP 78 HB2 ASP 78 -18.775 -4.653 0.136 615 HB3 ASP 78 HB3 ASP 78 -19.438 -5.370 1.602 616 H GLY 79 H GLY 79 -17.459 -1.721 1.452 617 HA2 GLY 79 HA2 GLY 79 -15.916 -1.112 3.117 618 HA3 GLY 79 HA3 GLY 79 -16.428 -2.441 4.140 619 H GLN 80 H GLN 80 -15.803 -3.462 0.888 620 HA GLN 80 HA GLN 80 -13.609 -5.155 1.701 621 HB2 GLN 80 HB2 GLN 80 -14.484 -4.391 -1.113 622 HB3 GLN 80 HB3 GLN 80 -13.489 -5.767 -0.663 623 HG2 GLN 80 HG2 GLN 80 -16.404 -5.421 0.182 624 HG3 GLN 80 HG3 GLN 80 -15.849 -6.355 -1.195 625 HE21 GLN 80 HE22 GLN 80 -14.515 -8.317 -0.784 626 HE22 GLN 80 HE21 GLN 80 -14.633 -9.096 0.787 627 H MET 81 H MET 81 -11.427 -5.038 1.184 628 HA MET 81 HA MET 81 -10.322 -2.347 0.469 629 HB2 MET 81 HB2 MET 81 -9.306 -4.575 2.266 630 HB3 MET 81 HB3 MET 81 -8.304 -3.210 1.750 631 HG2 MET 81 HG2 MET 81 -9.677 -1.616 2.837 632 HG3 MET 81 HG3 MET 81 -10.980 -2.770 3.109 633 HE1 MET 81 HE1 MET 81 -11.468 -3.393 5.509 634 HE2 MET 81 HE2 MET 81 -10.837 -4.832 4.682 635 HE3 MET 81 HE3 MET 81 -10.306 -4.450 6.338 636 H LEU 82 H LEU 82 -10.529 -2.765 -1.761 637 HA LEU 82 HA LEU 82 -8.726 -4.856 -2.929 638 HB2 LEU 82 HB2 LEU 82 -11.226 -3.657 -4.171 639 HB3 LEU 82 HB3 LEU 82 -10.294 -5.016 -4.773 640 HG LEU 82 HG LEU 82 -11.954 -4.998 -2.221 641 HD11 LEU 82 HD11 LEU 82 -13.323 -4.921 -4.254 642 HD12 LEU 82 HD12 LEU 82 -12.457 -6.331 -4.903 643 HD13 LEU 82 HD13 LEU 82 -13.463 -6.492 -3.446 644 HD21 LEU 82 HD21 LEU 82 -10.497 -7.299 -3.586 645 HD22 LEU 82 HD22 LEU 82 -10.072 -6.577 -2.017 646 HD23 LEU 82 HD23 LEU 82 -11.600 -7.442 -2.199 647 HA PRO 83 HA PRO 83 -6.620 -1.463 -4.965 648 HB2 PRO 83 HB2 PRO 83 -5.735 -2.614 -7.282 649 HB3 PRO 83 HB3 PRO 83 -4.989 -2.889 -5.685 650 HG2 PRO 83 HG2 PRO 83 -7.037 -4.602 -7.134 651 HG3 PRO 83 HG3 PRO 83 -5.536 -5.131 -6.306 652 HD2 PRO 83 HD2 PRO 83 -7.978 -5.305 -5.119 653 HD3 PRO 83 HD3 PRO 83 -6.524 -4.865 -4.173 654 H ILE 84 H ILE 84 -7.160 0.160 -6.350 655 HA ILE 84 HA ILE 84 -9.712 0.325 -7.505 656 HB ILE 84 HB ILE 84 -8.291 2.170 -6.809 657 HG12 ILE 84 HG12 ILE 84 -8.810 2.912 -9.645 658 HG13 ILE 84 HG13 ILE 84 -10.165 2.157 -8.808 659 HG21 ILE 84 HG21 ILE 84 -6.118 1.449 -7.683 660 HG22 ILE 84 HG22 ILE 84 -6.691 1.661 -9.347 661 HG23 ILE 84 HG23 ILE 84 -6.523 3.063 -8.271 662 HD11 ILE 84 HD11 ILE 84 -10.154 3.765 -7.058 663 HD12 ILE 84 HD12 ILE 84 -8.653 4.523 -7.662 664 HD13 ILE 84 HD13 ILE 84 -10.151 4.645 -8.603 665 H ASP 85 H ASP 85 -6.825 -1.009 -8.921 666 HA ASP 85 HA ASP 85 -7.527 -1.251 -11.669 667 HB2 ASP 85 HB2 ASP 85 -5.324 -1.811 -10.787 668 HB3 ASP 85 HB3 ASP 85 -6.004 -3.071 -9.763 669 H GLU 86 H GLU 86 -8.553 -3.174 -8.829 670 HA GLU 86 HA GLU 86 -9.944 -5.151 -10.550 671 HB2 GLU 86 HB2 GLU 86 -8.788 -5.896 -8.503 672 HB3 GLU 86 HB3 GLU 86 -9.898 -4.937 -7.513 673 HG2 GLU 86 HG2 GLU 86 -11.776 -6.281 -8.124 674 HG3 GLU 86 HG3 GLU 86 -10.945 -7.004 -9.498 675 H ILE 87 H ILE 87 -10.733 -2.318 -8.475 676 HA ILE 87 HA ILE 87 -13.564 -2.673 -8.546 677 HB ILE 87 HB ILE 87 -11.920 -0.123 -8.295 678 HG12 ILE 87 HG12 ILE 87 -13.076 -2.008 -6.174 679 HG13 ILE 87 HG13 ILE 87 -11.372 -1.888 -6.616 680 HG21 ILE 87 HG21 ILE 87 -14.273 0.365 -8.877 681 HG22 ILE 87 HG22 ILE 87 -14.826 -0.734 -7.600 682 HG23 ILE 87 HG23 ILE 87 -13.974 0.770 -7.194 683 HD11 ILE 87 HD11 ILE 87 -11.388 0.510 -5.930 684 HD12 ILE 87 HD12 ILE 87 -13.008 0.237 -5.228 685 HD13 ILE 87 HD13 ILE 87 -11.614 -0.673 -4.625 686 H PHE 88 H PHE 88 -11.374 -0.956 -10.794 687 HA PHE 88 HA PHE 88 -13.327 0.008 -12.633 688 HB2 PHE 88 HB2 PHE 88 -10.954 0.666 -12.642 689 HB3 PHE 88 HB3 PHE 88 -10.476 -0.966 -13.073 690 HD1 PHE 88 HD1 PHE 88 -12.486 1.958 -14.296 691 HD2 PHE 88 HD2 PHE 88 -10.419 -1.668 -15.356 692 HE1 PHE 88 HE1 PHE 88 -12.720 2.536 -16.693 693 HE2 PHE 88 HE2 PHE 88 -10.647 -1.087 -17.766 694 HZ PHE 88 HZ PHE 88 -11.787 1.021 -18.438 695 H GLU 89 H GLU 89 -11.838 -3.211 -12.365 696 HA GLU 89 HA GLU 89 -12.943 -4.185 -14.911 697 HB2 GLU 89 HB2 GLU 89 -11.243 -5.314 -12.665 698 HB3 GLU 89 HB3 GLU 89 -11.967 -6.414 -13.825 699 HG2 GLU 89 HG2 GLU 89 -10.288 -4.028 -14.709 700 HG3 GLU 89 HG3 GLU 89 -9.575 -5.579 -14.292 701 H ARG 90 H ARG 90 -13.656 -4.692 -11.449 702 HA ARG 90 HA ARG 90 -15.925 -6.480 -11.971 703 HB2 ARG 90 HB2 ARG 90 -15.168 -4.923 -9.453 704 HB3 ARG 90 HB3 ARG 90 -16.375 -6.203 -9.570 705 HG2 ARG 90 HG2 ARG 90 -13.376 -6.527 -9.812 706 HG3 ARG 90 HG3 ARG 90 -14.450 -7.130 -8.550 707 HD2 ARG 90 HD2 ARG 90 -15.591 -8.457 -10.467 708 HD3 ARG 90 HD3 ARG 90 -14.135 -8.041 -11.414 709 HE ARG 90 HE ARG 90 -13.081 -9.096 -9.118 710 HH11 ARG 90 HH11 ARG 90 -15.365 -10.383 -11.455 711 HH12 ARG 90 HH12 ARG 90 -14.963 -12.037 -11.069 712 HH21 ARG 90 HH21 ARG 90 -12.647 -11.229 -8.656 713 HH22 ARG 90 HH22 ARG 90 -13.461 -12.495 -9.535 714 H GLU 91 H GLU 91 -15.516 -3.050 -12.050 715 HA GLU 91 HA GLU 91 -16.914 -1.313 -12.318 716 HB2 GLU 91 HB2 GLU 91 -18.983 -3.323 -13.285 717 HB3 GLU 91 HB3 GLU 91 -19.002 -1.576 -13.522 718 HG2 GLU 91 HG2 GLU 91 -16.858 -1.763 -14.817 719 HG3 GLU 91 HG3 GLU 91 -16.952 -3.517 -14.656 720 H LEU 92 H LEU 92 -16.670 -2.388 -9.743 721 HA LEU 92 HA LEU 92 -19.357 -2.283 -8.479 722 HB2 LEU 92 HB2 LEU 92 -16.567 -2.883 -7.436 723 HB3 LEU 92 HB3 LEU 92 -17.957 -2.710 -6.369 724 HG LEU 92 HG LEU 92 -17.848 -4.736 -8.638 725 HD11 LEU 92 HD11 LEU 92 -16.101 -5.205 -6.948 726 HD12 LEU 92 HD12 LEU 92 -17.332 -5.153 -5.666 727 HD13 LEU 92 HD13 LEU 92 -17.390 -6.418 -6.914 728 HD21 LEU 92 HD21 LEU 92 -19.714 -4.484 -6.237 729 HD22 LEU 92 HD22 LEU 92 -20.150 -4.219 -7.940 730 HD23 LEU 92 HD23 LEU 92 -19.693 -5.830 -7.398 731 H ASP 93 H ASP 93 -20.042 -0.780 -7.033 732 HA ASP 93 HA ASP 93 -18.968 1.922 -7.393 733 HB2 ASP 93 HB2 ASP 93 -21.254 1.026 -5.614 734 HB3 ASP 93 HB3 ASP 93 -20.930 2.639 -6.247 735 H LEU 94 H LEU 94 -18.728 3.415 -5.478 736 HA LEU 94 HA LEU 94 -17.532 2.072 -3.093 737 HB2 LEU 94 HB2 LEU 94 -16.638 4.644 -4.439 738 HB3 LEU 94 HB3 LEU 94 -16.026 4.000 -2.932 739 HG LEU 94 HG LEU 94 -15.582 1.810 -4.439 740 HD11 LEU 94 HD11 LEU 94 -16.157 2.405 -6.618 741 HD12 LEU 94 HD12 LEU 94 -15.686 4.097 -6.401 742 HD13 LEU 94 HD13 LEU 94 -14.441 2.871 -6.582 743 HD21 LEU 94 HD21 LEU 94 -13.799 4.265 -4.326 744 HD22 LEU 94 HD22 LEU 94 -13.931 3.004 -3.085 745 HD23 LEU 94 HD23 LEU 94 -13.270 2.610 -4.681 746 H MET 95 H MET 95 -17.461 3.182 -1.173 747 HA MET 95 HA MET 95 -19.976 4.384 -0.323 748 HB2 MET 95 HB2 MET 95 -18.535 2.720 0.906 749 HB3 MET 95 HB3 MET 95 -17.334 3.984 1.147 750 HG2 MET 95 HG2 MET 95 -19.092 5.302 2.399 751 HG3 MET 95 HG3 MET 95 -20.188 3.932 2.208 752 HE1 MET 95 HE1 MET 95 -19.570 1.476 3.158 753 HE2 MET 95 HE2 MET 95 -17.837 1.470 2.743 754 HE3 MET 95 HE3 MET 95 -18.347 1.182 4.415 755 H ARG 96 H ARG 96 -20.254 6.472 0.662 756 HA ARG 96 HA ARG 96 -18.058 8.450 0.507 757 HB2 ARG 96 HB2 ARG 96 -20.810 8.759 -0.778 758 HB3 ARG 96 HB3 ARG 96 -19.886 10.154 -0.243 759 HG2 ARG 96 HG2 ARG 96 -19.044 10.157 -2.267 760 HG3 ARG 96 HG3 ARG 96 -17.923 8.974 -1.641 761 HD2 ARG 96 HD2 ARG 96 -18.511 7.791 -3.477 762 HD3 ARG 96 HD3 ARG 96 -19.880 7.295 -2.507 763 HE ARG 96 HE ARG 96 -21.237 8.334 -4.047 764 HH11 ARG 96 HH11 ARG 96 -18.228 10.180 -4.257 765 HH12 ARG 96 HH12 ARG 96 -18.828 11.087 -5.617 766 HH21 ARG 96 HH21 ARG 96 -21.845 9.474 -5.745 767 HH22 ARG 96 HH22 ARG 96 -20.857 10.783 -6.372 768 H VAL 97 H VAL 97 -18.314 10.350 1.712 769 HA VAL 97 HA VAL 97 -19.673 9.988 4.331 770 HB VAL 97 HB VAL 97 -17.264 10.484 4.296 771 HG11 VAL 97 HG11 VAL 97 -17.365 12.104 2.309 772 HG12 VAL 97 HG12 VAL 97 -17.913 13.331 3.426 773 HG13 VAL 97 HG13 VAL 97 -16.324 12.575 3.663 774 HG21 VAL 97 HG21 VAL 97 -18.596 12.920 5.528 775 HG22 VAL 97 HG22 VAL 97 -18.828 11.321 6.203 776 HG23 VAL 97 HG23 VAL 97 -17.186 11.992 6.091 777 H ASP 98 H ASP 98 -19.811 12.068 1.515 778 HA ASP 98 HA ASP 98 -21.620 14.035 2.719 779 HB2 ASP 98 HB2 ASP 98 -20.472 13.602 -0.063 780 HB3 ASP 98 HB3 ASP 98 -21.628 14.883 0.293 781 H ASN 99 H ASN 99 -22.414 11.125 2.514 782 HA ASN 99 HA ASN 99 -23.966 9.695 1.854 783 HB2 ASN 99 HB2 ASN 99 -26.238 10.232 2.396 784 HB3 ASN 99 HB3 ASN 99 -25.123 10.902 3.580 785 HD21 ASN 99 HD22 ASN 99 -24.830 13.147 3.676 786 HD22 ASN 99 HD21 ASN 99 -25.542 14.205 2.504 787 H LEU 100 H LEU 100 -22.816 11.261 -0.396 788 HA LEU 100 HA LEU 100 -24.679 11.570 -2.507 789 HB2 LEU 100 HB2 LEU 100 -21.714 10.924 -2.417 790 HB3 LEU 100 HB3 LEU 100 -22.538 11.206 -3.934 791 HG LEU 100 HG LEU 100 -22.350 13.262 -1.705 792 HD11 LEU 100 HD11 LEU 100 -20.180 12.751 -2.771 793 HD12 LEU 100 HD12 LEU 100 -20.886 13.056 -4.370 794 HD13 LEU 100 HD13 LEU 100 -20.741 14.376 -3.187 795 HD21 LEU 100 HD21 LEU 100 -23.362 13.480 -4.580 796 HD22 LEU 100 HD22 LEU 100 -24.345 13.644 -3.107 797 HD23 LEU 100 HD23 LEU 100 -23.107 14.844 -3.473 798 HA PRO 101 HA PRO 101 -25.713 7.529 -3.941 799 HB2 PRO 101 HB2 PRO 101 -25.774 7.782 -6.684 800 HB3 PRO 101 HB3 PRO 101 -27.004 8.486 -5.591 801 HG2 PRO 101 HG2 PRO 101 -24.596 9.854 -6.817 802 HG3 PRO 101 HG3 PRO 101 -26.286 10.446 -6.739 803 HD2 PRO 101 HD2 PRO 101 -24.401 11.257 -4.974 804 HD3 PRO 101 HD3 PRO 101 -26.072 10.991 -4.434 805 H ASN 102 H ASN 102 -24.733 5.601 -4.573 806 HA ASN 102 HA ASN 102 -21.816 5.670 -4.631 807 HB2 ASN 102 HB2 ASN 102 -23.725 3.296 -4.812 808 HB3 ASN 102 HB3 ASN 102 -22.010 3.258 -4.383 809 HD21 ASN 102 HD22 ASN 102 -21.384 4.621 -2.418 810 HD22 ASN 102 HD21 ASN 102 -22.559 4.645 -1.093 811 H ILE 103 H ILE 103 -20.532 5.639 -6.382 812 HA ILE 103 HA ILE 103 -21.505 4.635 -9.003 813 HB ILE 103 HB ILE 103 -20.509 6.670 -10.093 814 HG12 ILE 103 HG12 ILE 103 -20.904 7.888 -7.325 815 HG13 ILE 103 HG13 ILE 103 -19.356 7.622 -8.118 816 HG21 ILE 103 HG21 ILE 103 -22.950 6.097 -9.929 817 HG22 ILE 103 HG22 ILE 103 -23.052 7.138 -8.492 818 HG23 ILE 103 HG23 ILE 103 -22.625 7.821 -10.074 819 HD11 ILE 103 HD11 ILE 103 -20.105 9.175 -9.965 820 HD12 ILE 103 HD12 ILE 103 -21.563 9.521 -8.995 821 HD13 ILE 103 HD13 ILE 103 -19.974 9.948 -8.370 822 H LYS 104 H LYS 104 -20.217 3.510 -10.078 823 HA LYS 104 HA LYS 104 -17.442 3.050 -9.308 824 HB2 LYS 104 HB2 LYS 104 -17.539 1.225 -10.869 825 HB3 LYS 104 HB3 LYS 104 -18.993 1.262 -9.909 826 HG2 LYS 104 HG2 LYS 104 -19.818 0.716 -11.952 827 HG3 LYS 104 HG3 LYS 104 -20.137 2.445 -11.920 828 HD2 LYS 104 HD2 LYS 104 -18.384 2.883 -13.496 829 HD3 LYS 104 HD3 LYS 104 -17.611 1.319 -13.177 830 HE2 LYS 104 HE2 LYS 104 -18.567 0.944 -15.242 831 HE3 LYS 104 HE3 LYS 104 -19.738 0.233 -14.129 832 HZ1 LYS 104 HZ1 LYS 104 -20.988 2.423 -14.333 833 HZ2 LYS 104 HZ2 LYS 104 -19.971 2.824 -15.550 834 HZ3 LYS 104 HZ3 LYS 104 -20.935 1.522 -15.704 835 H ILE 105 H ILE 105 -15.832 2.763 -11.146 836 HA ILE 105 HA ILE 105 -15.236 5.372 -12.252 837 HB ILE 105 HB ILE 105 -13.904 2.692 -12.755 838 HG12 ILE 105 HG12 ILE 105 -13.036 4.876 -10.820 839 HG13 ILE 105 HG13 ILE 105 -13.958 3.478 -10.297 840 HG21 ILE 105 HG21 ILE 105 -13.333 4.383 -14.481 841 HG22 ILE 105 HG22 ILE 105 -12.978 5.579 -13.221 842 HG23 ILE 105 HG23 ILE 105 -11.943 4.166 -13.437 843 HD11 ILE 105 HD11 ILE 105 -11.531 2.741 -11.847 844 HD12 ILE 105 HD12 ILE 105 -11.256 3.569 -10.315 845 HD13 ILE 105 HD13 ILE 105 -12.206 2.066 -10.361 846 H ALA 106 H ALA 106 -16.106 6.195 -13.999 847 HA ALA 106 HA ALA 106 -17.726 4.787 -15.938 848 HB1 ALA 106 HB1 ALA 106 -18.098 7.157 -15.272 849 HB2 ALA 106 HB2 ALA 106 -16.529 7.608 -15.947 850 HB3 ALA 106 HB3 ALA 106 -17.822 7.015 -17.012 851 H THR 107 H THR 107 -14.480 6.278 -16.031 852 HA THR 107 HA THR 107 -13.486 4.381 -18.032 853 HB THR 107 HB THR 107 -12.481 6.315 -19.391 854 HG1 THR 107 HG1 THR 107 -14.756 7.685 -18.455 855 HG21 THR 107 HG21 THR 107 -14.262 4.814 -20.279 856 HG22 THR 107 HG22 THR 107 -15.484 5.975 -19.716 857 HG23 THR 107 HG23 THR 107 -14.296 6.455 -20.944 858 H ARG 108 H ARG 108 -11.198 4.485 -18.292 859 HA ARG 108 HA ARG 108 -9.654 5.955 -16.189 860 HB2 ARG 108 HB2 ARG 108 -9.953 3.567 -15.569 861 HB3 ARG 108 HB3 ARG 108 -9.320 3.088 -17.143 862 HG2 ARG 108 HG2 ARG 108 -7.113 4.230 -16.492 863 HG3 ARG 108 HG3 ARG 108 -7.806 4.490 -14.888 864 HD2 ARG 108 HD2 ARG 108 -6.378 2.501 -14.892 865 HD3 ARG 108 HD3 ARG 108 -8.060 2.016 -14.657 866 HE ARG 108 HE ARG 108 -8.134 1.043 -16.757 867 HH11 ARG 108 HH11 ARG 108 -4.991 2.556 -16.507 868 HH12 ARG 108 HH12 ARG 108 -4.483 1.935 -18.061 869 HH21 ARG 108 HH21 ARG 108 -7.379 0.197 -18.651 870 HH22 ARG 108 HH22 ARG 108 -5.781 0.606 -19.207 871 H LYS 109 H LYS 109 -7.622 6.655 -16.813 872 HA LYS 109 HA LYS 109 -6.515 5.977 -19.457 873 HB2 LYS 109 HB2 LYS 109 -8.089 7.875 -19.873 874 HB3 LYS 109 HB3 LYS 109 -7.160 8.887 -18.766 875 HG2 LYS 109 HG2 LYS 109 -5.234 8.857 -20.193 876 HG3 LYS 109 HG3 LYS 109 -5.863 7.520 -21.165 877 HD2 LYS 109 HD2 LYS 109 -7.129 10.294 -21.072 878 HD3 LYS 109 HD3 LYS 109 -5.954 9.756 -22.286 879 HE2 LYS 109 HE2 LYS 109 -7.511 7.847 -22.865 880 HE3 LYS 109 HE3 LYS 109 -8.719 8.561 -21.788 881 HZ1 LYS 109 HZ1 LYS 109 -8.665 10.569 -23.192 882 HZ2 LYS 109 HZ2 LYS 109 -7.572 9.881 -24.194 883 HZ3 LYS 109 HZ3 LYS 109 -9.074 9.261 -24.076 884 H TYR 110 H TYR 110 -4.336 5.922 -19.408 885 HA TYR 110 HA TYR 110 -2.919 6.387 -16.908 886 HB2 TYR 110 HB2 TYR 110 -2.327 4.556 -18.469 887 HB3 TYR 110 HB3 TYR 110 -1.923 5.733 -19.707 888 HD1 TYR 110 HD1 TYR 110 -1.071 5.577 -16.010 889 HD2 TYR 110 HD2 TYR 110 0.406 5.662 -20.069 890 HE1 TYR 110 HE1 TYR 110 1.227 5.674 -15.163 891 HE2 TYR 110 HE2 TYR 110 2.741 5.712 -19.198 892 HH TYR 110 HH TYR 110 3.445 5.742 -15.696 893 H LEU 111 H LEU 111 -1.878 8.166 -16.224 894 HA LEU 111 HA LEU 111 -1.817 10.555 -18.009 895 HB2 LEU 111 HB2 LEU 111 -1.292 10.172 -15.038 896 HB3 LEU 111 HB3 LEU 111 -1.337 11.722 -15.873 897 HG LEU 111 HG LEU 111 -3.743 9.848 -15.768 898 HD11 LEU 111 HD11 LEU 111 -2.809 10.722 -13.517 899 HD12 LEU 111 HD12 LEU 111 -3.384 12.306 -14.059 900 HD13 LEU 111 HD13 LEU 111 -4.507 10.923 -13.874 901 HD21 LEU 111 HD21 LEU 111 -3.354 12.790 -16.483 902 HD22 LEU 111 HD22 LEU 111 -3.834 11.483 -17.590 903 HD23 LEU 111 HD23 LEU 111 -4.937 12.007 -16.317 904 H GLY 112 H GLY 112 0.327 8.506 -16.034 905 HA2 GLY 112 HA2 GLY 112 2.662 8.404 -17.257 906 HA3 GLY 112 HA3 GLY 112 2.705 10.107 -16.795 907 H LYS 113 H LYS 113 4.201 10.146 -15.282 908 HA LYS 113 HA LYS 113 4.098 8.271 -12.953 909 HB2 LYS 113 HB2 LYS 113 5.732 7.728 -14.872 910 HB3 LYS 113 HB3 LYS 113 6.668 9.101 -14.253 911 HG2 LYS 113 HG2 LYS 113 6.597 8.051 -11.967 912 HG3 LYS 113 HG3 LYS 113 5.838 6.625 -12.671 913 HD2 LYS 113 HD2 LYS 113 8.554 7.708 -13.545 914 HD3 LYS 113 HD3 LYS 113 8.339 6.461 -12.305 915 HE2 LYS 113 HE2 LYS 113 7.215 4.981 -13.902 916 HE3 LYS 113 HE3 LYS 113 7.316 6.211 -15.170 917 HZ1 LYS 113 HZ1 LYS 113 9.731 6.038 -15.083 918 HZ2 LYS 113 HZ2 LYS 113 9.670 4.948 -13.865 919 HZ3 LYS 113 HZ3 LYS 113 9.101 4.555 -15.344 920 H GLN 114 H GLN 114 3.092 9.894 -11.880 921 HA GLN 114 HA GLN 114 4.413 12.429 -11.304 922 HB2 GLN 114 HB2 GLN 114 1.726 11.530 -10.285 923 HB3 GLN 114 HB3 GLN 114 2.349 13.171 -10.559 924 HG2 GLN 114 HG2 GLN 114 2.676 12.516 -13.006 925 HG3 GLN 114 HG3 GLN 114 1.742 11.050 -12.663 926 HE21 GLN 114 HE22 GLN 114 0.925 12.312 -14.634 927 HE22 GLN 114 HE21 GLN 114 -0.395 13.356 -14.256 928 H ASN 115 H ASN 115 4.691 13.200 -9.038 929 HA ASN 115 HA ASN 115 5.597 11.309 -7.143 930 HB2 ASN 115 HB2 ASN 115 6.149 13.871 -7.539 931 HB3 ASN 115 HB3 ASN 115 4.731 14.155 -6.516 932 HD21 ASN 115 HD22 ASN 115 5.077 11.888 -4.705 933 HD22 ASN 115 HD21 ASN 115 6.590 12.114 -3.914 934 H VAL 116 H VAL 116 4.391 9.988 -5.945 935 HA VAL 116 HA VAL 116 1.703 10.936 -5.077 936 HB VAL 116 HB VAL 116 1.004 8.570 -5.047 937 HG11 VAL 116 HG11 VAL 116 0.425 10.117 -6.903 938 HG12 VAL 116 HG12 VAL 116 1.826 9.514 -7.802 939 HG13 VAL 116 HG13 VAL 116 0.491 8.416 -7.369 940 HG21 VAL 116 HG21 VAL 116 3.490 8.047 -6.742 941 HG22 VAL 116 HG22 VAL 116 3.219 7.459 -5.085 942 HG23 VAL 116 HG23 VAL 116 2.162 6.917 -6.401 943 H TYR 117 H TYR 117 0.933 10.389 -3.120 944 HA TYR 117 HA TYR 117 2.964 9.787 -1.005 945 HB2 TYR 117 HB2 TYR 117 0.874 11.976 -0.875 946 HB3 TYR 117 HB3 TYR 117 2.277 11.743 0.144 947 HD1 TYR 117 HD1 TYR 117 1.078 12.914 -3.157 948 HD2 TYR 117 HD2 TYR 117 4.482 12.603 -0.527 949 HE1 TYR 117 HE1 TYR 117 2.306 14.586 -4.532 950 HE2 TYR 117 HE2 TYR 117 5.660 14.350 -1.835 951 HH TYR 117 HH TYR 117 5.540 15.792 -3.606 952 H ASP 118 H ASP 118 2.053 9.259 1.086 953 HA ASP 118 HA ASP 118 -0.789 8.675 1.354 954 HB2 ASP 118 HB2 ASP 118 -0.558 6.333 1.864 955 HB3 ASP 118 HB3 ASP 118 -0.089 6.649 0.207 956 H ILE 119 H ILE 119 -1.344 9.266 3.348 957 HA ILE 119 HA ILE 119 0.691 9.675 5.437 958 HB ILE 119 HB ILE 119 -1.199 10.448 6.810 959 HG12 ILE 119 HG12 ILE 119 -2.958 10.163 4.335 960 HG13 ILE 119 HG13 ILE 119 -2.972 9.012 5.673 961 HG21 ILE 119 HG21 ILE 119 0.160 11.958 5.426 962 HG22 ILE 119 HG22 ILE 119 -0.954 11.755 4.061 963 HG23 ILE 119 HG23 ILE 119 -1.497 12.553 5.558 964 HD11 ILE 119 HD11 ILE 119 -3.608 10.819 7.243 965 HD12 ILE 119 HD12 ILE 119 -3.689 11.958 5.875 966 HD13 ILE 119 HD13 ILE 119 -4.789 10.571 5.944 967 H GLY 120 H GLY 120 0.504 8.789 7.562 968 HA2 GLY 120 HA2 GLY 120 -0.495 5.967 7.659 969 HA3 GLY 120 HA3 GLY 120 0.756 6.656 8.687 970 H VAL 121 H VAL 121 -1.660 5.286 9.437 971 HA VAL 121 HA VAL 121 -2.781 7.100 11.464 972 HB VAL 121 HB VAL 121 -5.130 6.392 10.893 973 HG11 VAL 121 HG11 VAL 121 -4.321 8.670 10.400 974 HG12 VAL 121 HG12 VAL 121 -3.891 8.141 8.755 975 HG13 VAL 121 HG13 VAL 121 -5.577 8.100 9.289 976 HG21 VAL 121 HG21 VAL 121 -3.988 5.734 8.153 977 HG22 VAL 121 HG22 VAL 121 -4.549 4.536 9.346 978 HG23 VAL 121 HG23 VAL 121 -5.692 5.696 8.650 979 H GLU 122 H GLU 122 -4.667 5.518 12.570 980 HA GLU 122 HA GLU 122 -3.317 3.313 13.835 981 HB2 GLU 122 HB2 GLU 122 -6.291 3.955 13.693 982 HB3 GLU 122 HB3 GLU 122 -5.504 2.925 14.882 983 HG2 GLU 122 HG2 GLU 122 -5.163 5.936 14.597 984 HG3 GLU 122 HG3 GLU 122 -6.029 5.076 15.861 985 H ARG 123 H ARG 123 -4.767 1.183 14.025 986 HA ARG 123 HA ARG 123 -4.340 -0.630 11.992 987 HB2 ARG 123 HB2 ARG 123 -6.728 -0.470 13.886 988 HB3 ARG 123 HB3 ARG 123 -6.308 -1.902 12.966 989 HG2 ARG 123 HG2 ARG 123 -4.429 -0.664 15.028 990 HG3 ARG 123 HG3 ARG 123 -5.659 -1.870 15.395 991 HD2 ARG 123 HD2 ARG 123 -4.569 -3.359 13.595 992 HD3 ARG 123 HD3 ARG 123 -3.238 -2.201 13.589 993 HE ARG 123 HE ARG 123 -2.520 -3.010 15.652 994 HH11 ARG 123 HH11 ARG 123 -5.750 -4.313 15.133 995 HH12 ARG 123 HH12 ARG 123 -5.662 -5.313 16.560 996 HH21 ARG 123 HH21 ARG 123 -2.498 -4.311 17.450 997 HH22 ARG 123 HH22 ARG 123 -3.876 -5.312 17.822 998 H ASP 124 H ASP 124 -7.168 1.439 12.241 999 HA ASP 124 HA ASP 124 -8.480 0.526 9.793 1000 HB2 ASP 124 HB2 ASP 124 -8.887 2.909 11.622 1001 HB3 ASP 124 HB3 ASP 124 -9.915 2.537 10.231 1002 H HIS 125 H HIS 125 -6.432 0.650 8.596 1003 HA HIS 125 HA HIS 125 -5.079 3.011 7.871 1004 HB2 HIS 125 HB2 HIS 125 -5.301 0.359 6.408 1005 HB3 HIS 125 HB3 HIS 125 -4.081 1.594 6.113 1006 HD1 HIS 125 HD1 HIS 125 -4.181 -1.572 7.719 1007 HD2 HIS 125 HD2 HIS 125 -2.710 2.245 8.709 1008 HE1 HIS 125 HE1 HIS 125 -2.345 -1.943 9.447 1009 H ASN 126 H ASN 126 -7.484 4.093 7.504 1010 HA ASN 126 HA ASN 126 -7.699 4.540 4.575 1011 HB2 ASN 126 HB2 ASN 126 -9.951 4.040 4.419 1012 HB3 ASN 126 HB3 ASN 126 -9.356 2.712 5.384 1013 HD21 ASN 126 HD22 ASN 126 -10.164 2.530 7.581 1014 HD22 ASN 126 HD21 ASN 126 -11.223 3.756 8.275 1015 H PHE 127 H PHE 127 -9.006 6.379 4.001 1016 HA PHE 127 HA PHE 127 -9.745 8.318 6.020 1017 HB2 PHE 127 HB2 PHE 127 -8.262 10.142 5.035 1018 HB3 PHE 127 HB3 PHE 127 -7.497 8.963 6.081 1019 HD1 PHE 127 HD2 PHE 127 -8.098 9.742 2.462 1020 HD2 PHE 127 HD1 PHE 127 -5.595 7.730 5.340 1021 HE1 PHE 127 HE2 PHE 127 -6.527 9.142 0.672 1022 HE2 PHE 127 HE1 PHE 127 -4.002 7.129 3.529 1023 HZ PHE 127 HZ PHE 127 -4.472 7.815 1.182 1024 H ALA 128 H ALA 128 -11.028 10.048 5.208 1025 HA ALA 128 HA ALA 128 -12.412 9.451 2.710 1026 HB1 ALA 128 HB1 ALA 128 -13.601 10.104 4.793 1027 HB2 ALA 128 HB2 ALA 128 -12.826 11.705 4.715 1028 HB3 ALA 128 HB3 ALA 128 -13.955 11.196 3.444 1029 H LEU 129 H LEU 129 -12.629 10.745 0.910 1030 HA LEU 129 HA LEU 129 -10.548 12.816 0.369 1031 HB2 LEU 129 HB2 LEU 129 -12.276 10.963 -1.323 1032 HB3 LEU 129 HB3 LEU 129 -11.283 12.241 -2.013 1033 HG LEU 129 HG LEU 129 -9.948 10.230 -0.173 1034 HD11 LEU 129 HD11 LEU 129 -11.035 8.741 -1.693 1035 HD12 LEU 129 HD12 LEU 129 -10.667 9.777 -3.098 1036 HD13 LEU 129 HD13 LEU 129 -9.371 8.907 -2.248 1037 HD21 LEU 129 HD21 LEU 129 -9.057 11.641 -2.711 1038 HD22 LEU 129 HD22 LEU 129 -8.802 12.296 -1.093 1039 HD23 LEU 129 HD23 LEU 129 -8.032 10.764 -1.545 1040 H LYS 130 H LYS 130 -11.254 14.444 -1.358 1041 HA LYS 130 HA LYS 130 -13.116 16.301 -0.476 1042 HB2 LYS 130 HB2 LYS 130 -11.345 16.678 -2.160 1043 HB3 LYS 130 HB3 LYS 130 -12.259 15.745 -3.350 1044 HG2 LYS 130 HG2 LYS 130 -14.121 17.439 -3.190 1045 HG3 LYS 130 HG3 LYS 130 -13.155 18.335 -2.017 1046 HD2 LYS 130 HD2 LYS 130 -12.871 19.433 -4.101 1047 HD3 LYS 130 HD3 LYS 130 -11.362 18.552 -3.810 1048 HE2 LYS 130 HE2 LYS 130 -12.177 16.714 -5.308 1049 HE3 LYS 130 HE3 LYS 130 -13.677 17.617 -5.576 1050 HZ1 LYS 130 HZ1 LYS 130 -12.338 19.403 -6.572 1051 HZ2 LYS 130 HZ2 LYS 130 -10.958 18.555 -6.339 1052 HZ3 LYS 130 HZ3 LYS 130 -12.096 18.003 -7.375 1053 H ASN 131 H ASN 131 -13.779 13.883 -2.996 1054 HA ASN 131 HA ASN 131 -16.624 14.594 -3.208 1055 HB2 ASN 131 HB2 ASN 131 -14.976 12.260 -4.315 1056 HB3 ASN 131 HB3 ASN 131 -16.667 12.571 -4.702 1057 HD21 ASN 131 HD22 ASN 131 -13.380 13.532 -5.397 1058 HD22 ASN 131 HD21 ASN 131 -13.833 14.680 -6.639 1059 H GLY 132 H GLY 132 -14.902 12.864 -0.907 1060 HA2 GLY 132 HA2 GLY 132 -15.801 11.925 0.965 1061 HA3 GLY 132 HA3 GLY 132 -17.312 11.514 0.107 1062 H PHE 133 H PHE 133 -14.953 10.420 -1.912 1063 HA PHE 133 HA PHE 133 -15.239 7.642 -1.432 1064 HB2 PHE 133 HB2 PHE 133 -13.269 9.378 -2.926 1065 HB3 PHE 133 HB3 PHE 133 -12.821 7.716 -2.585 1066 HD1 PHE 133 HD2 PHE 133 -16.205 9.045 -3.506 1067 HD2 PHE 133 HD1 PHE 133 -12.802 6.660 -4.610 1068 HE1 PHE 133 HE2 PHE 133 -17.477 8.110 -5.456 1069 HE2 PHE 133 HE1 PHE 133 -14.053 5.754 -6.552 1070 HZ PHE 133 HZ PHE 133 -16.413 6.439 -6.934 1071 H ILE 134 H ILE 134 -13.888 6.078 -0.492 1072 HA ILE 134 HA ILE 134 -11.970 7.121 1.548 1073 HB ILE 134 HB ILE 134 -13.748 4.695 1.817 1074 HG12 ILE 134 HG12 ILE 134 -14.333 6.158 3.999 1075 HG13 ILE 134 HG13 ILE 134 -13.895 7.497 2.938 1076 HG21 ILE 134 HG21 ILE 134 -11.549 4.296 2.798 1077 HG22 ILE 134 HG22 ILE 134 -11.588 5.878 3.615 1078 HG23 ILE 134 HG23 ILE 134 -12.693 4.589 4.098 1079 HD11 ILE 134 HD11 ILE 134 -15.615 6.640 1.293 1080 HD12 ILE 134 HD12 ILE 134 -16.017 5.361 2.456 1081 HD13 ILE 134 HD13 ILE 134 -16.308 7.064 2.869 1082 H ALA 135 H ALA 135 -10.060 6.823 0.907 1083 HA ALA 135 HA ALA 135 -9.250 4.503 -0.774 1084 HB1 ALA 135 HB1 ALA 135 -8.509 6.820 -1.419 1085 HB2 ALA 135 HB2 ALA 135 -7.623 6.912 0.122 1086 HB3 ALA 135 HB3 ALA 135 -7.188 5.699 -1.103 1087 H SER 136 H SER 136 -7.850 2.971 0.091 1088 HA SER 136 HA SER 136 -7.372 3.023 3.035 1089 HB2 SER 136 HB2 SER 136 -8.446 0.678 1.445 1090 HB3 SER 136 HB3 SER 136 -8.052 0.703 3.178 1091 HG SER 136 HG SER 136 -10.255 1.056 2.911 1092 H ASN 137 H ASN 137 -5.221 3.047 3.249 1093 HA ASN 137 HA ASN 137 -3.381 2.353 1.135 1094 HB2 ASN 137 HB2 ASN 137 -2.892 4.135 2.729 1095 HB3 ASN 137 HB3 ASN 137 -2.969 2.993 4.073 1096 HD21 ASN 137 HD22 ASN 137 -0.875 3.136 4.838 1097 HD22 ASN 137 HD21 ASN 137 0.534 2.794 3.847 Start of MODEL 4 1 H1 GLY -1 H GLY -1 3.092 -1.707 -4.051 2 HA2 GLY -1 HA2 GLY -1 2.156 -0.604 -2.106 3 HA3 GLY -1 HA3 GLY -1 3.549 0.486 -2.125 4 H GLY 0 H GLY 0 0.743 1.200 -2.320 5 HA2 GLY 0 HA2 GLY 0 0.671 2.651 -4.916 6 HA3 GLY 0 HA3 GLY 0 -0.761 1.957 -4.169 7 H ALA 1 H ALA 1 -0.459 4.698 -4.734 8 HA ALA 1 HA ALA 1 -0.889 5.978 -2.122 9 HB1 ALA 1 HB1 ALA 1 1.479 5.988 -2.101 10 HB2 ALA 1 HB2 ALA 1 1.563 6.502 -3.800 11 HB3 ALA 1 HB3 ALA 1 0.976 7.610 -2.547 12 H LEU 2 H LEU 2 -1.104 8.444 -2.510 13 HA LEU 2 HA LEU 2 -3.037 8.811 -4.764 14 HB2 LEU 2 HB2 LEU 2 -2.814 10.228 -2.081 15 HB3 LEU 2 HB3 LEU 2 -4.066 10.421 -3.281 16 HG LEU 2 HG LEU 2 -5.067 9.210 -1.596 17 HD11 LEU 2 HD11 LEU 2 -5.528 8.234 -3.799 18 HD12 LEU 2 HD12 LEU 2 -4.243 7.032 -3.519 19 HD13 LEU 2 HD13 LEU 2 -5.673 7.068 -2.478 20 HD21 LEU 2 HD21 LEU 2 -2.843 7.203 -1.396 21 HD22 LEU 2 HD22 LEU 2 -3.006 8.631 -0.361 22 HD23 LEU 2 HD23 LEU 2 -4.270 7.399 -0.375 23 H SER 3 H SER 3 -3.009 10.791 -5.958 24 HA SER 3 HA SER 3 -0.384 12.023 -6.279 25 HB2 SER 3 HB2 SER 3 -2.077 11.640 -8.103 26 HB3 SER 3 HB3 SER 3 -3.041 12.963 -7.406 27 HG SER 3 HG SER 3 -1.460 13.499 -9.142 28 H TYR 4 H TYR 4 -0.053 14.422 -6.239 29 HA TYR 4 HA TYR 4 -0.469 15.590 -3.687 30 HB2 TYR 4 HB2 TYR 4 1.242 16.317 -5.307 31 HB3 TYR 4 HB3 TYR 4 0.001 16.921 -6.386 32 HD1 TYR 4 HD1 TYR 4 -1.347 18.933 -5.780 33 HD2 TYR 4 HD2 TYR 4 1.959 17.586 -3.363 34 HE1 TYR 4 HE1 TYR 4 -1.335 21.113 -4.595 35 HE2 TYR 4 HE2 TYR 4 1.978 19.781 -2.173 36 HH TYR 4 HH TYR 4 -0.328 22.394 -2.996 37 H GLU 5 H GLU 5 -2.325 15.990 -6.695 38 HA GLU 5 HA GLU 5 -4.199 17.936 -5.819 39 HB2 GLU 5 HB2 GLU 5 -4.633 15.774 -7.920 40 HB3 GLU 5 HB3 GLU 5 -5.456 17.338 -7.797 41 HG2 GLU 5 HG2 GLU 5 -3.136 18.406 -8.049 42 HG3 GLU 5 HG3 GLU 5 -2.560 16.805 -8.533 43 H THR 6 H THR 6 -4.029 14.669 -4.893 44 HA THR 6 HA THR 6 -6.873 14.206 -4.413 45 HB THR 6 HB THR 6 -4.487 12.688 -3.286 46 HG1 THR 6 HG1 THR 6 -5.953 11.797 -5.476 47 HG21 THR 6 HG21 THR 6 -7.458 12.164 -3.451 48 HG22 THR 6 HG22 THR 6 -6.322 10.798 -3.504 49 HG23 THR 6 HG23 THR 6 -6.318 11.886 -2.110 50 H GLU 7 H GLU 7 -7.384 16.119 -3.304 51 HA GLU 7 HA GLU 7 -6.237 16.679 -0.723 52 HB2 GLU 7 HB2 GLU 7 -8.961 17.622 -1.555 53 HB3 GLU 7 HB3 GLU 7 -7.824 18.390 -0.465 54 HG2 GLU 7 HG2 GLU 7 -6.251 18.620 -2.504 55 HG3 GLU 7 HG3 GLU 7 -7.649 18.206 -3.491 56 H ILE 8 H ILE 8 -6.945 16.357 1.289 57 HA ILE 8 HA ILE 8 -8.947 14.170 1.763 58 HB ILE 8 HB ILE 8 -6.409 14.813 3.317 59 HG12 ILE 8 HG12 ILE 8 -5.637 13.927 1.273 60 HG13 ILE 8 HG13 ILE 8 -5.478 12.675 2.493 61 HG21 ILE 8 HG21 ILE 8 -6.762 12.756 4.535 62 HG22 ILE 8 HG22 ILE 8 -8.202 13.760 4.685 63 HG23 ILE 8 HG23 ILE 8 -8.200 12.374 3.587 64 HD11 ILE 8 HD11 ILE 8 -7.596 11.611 1.548 65 HD12 ILE 8 HD12 ILE 8 -7.515 12.796 0.231 66 HD13 ILE 8 HD13 ILE 8 -6.202 11.640 0.456 67 H LEU 9 H LEU 9 -10.602 14.839 2.998 68 HA LEU 9 HA LEU 9 -10.787 17.431 4.209 69 HB2 LEU 9 HB2 LEU 9 -12.713 15.867 3.655 70 HB3 LEU 9 HB3 LEU 9 -12.243 14.894 5.047 71 HG LEU 9 HG LEU 9 -12.602 16.968 6.494 72 HD11 LEU 9 HD11 LEU 9 -12.522 18.718 4.744 73 HD12 LEU 9 HD12 LEU 9 -14.001 18.041 4.019 74 HD13 LEU 9 HD13 LEU 9 -14.040 18.747 5.643 75 HD21 LEU 9 HD21 LEU 9 -14.997 15.940 4.906 76 HD22 LEU 9 HD22 LEU 9 -14.272 15.143 6.316 77 HD23 LEU 9 HD23 LEU 9 -15.056 16.716 6.507 78 H THR 10 H THR 10 -10.001 18.281 6.036 79 HA THR 10 HA THR 10 -8.906 16.523 8.182 80 HB THR 10 HB THR 10 -7.092 18.149 8.528 81 HG1 THR 10 HG1 THR 10 -7.974 19.249 6.083 82 HG21 THR 10 HG21 THR 10 -6.338 16.299 7.308 83 HG22 THR 10 HG22 THR 10 -7.189 16.775 5.832 84 HG23 THR 10 HG23 THR 10 -5.779 17.697 6.379 85 H VAL 11 H VAL 11 -9.098 17.213 10.311 86 HA VAL 11 HA VAL 11 -11.264 19.105 10.812 87 HB VAL 11 HB VAL 11 -9.444 17.852 12.889 88 HG11 VAL 11 HG11 VAL 11 -10.751 19.654 13.856 89 HG12 VAL 11 HG12 VAL 11 -12.232 19.049 13.086 90 HG13 VAL 11 HG13 VAL 11 -11.441 18.122 14.376 91 HG21 VAL 11 HG21 VAL 11 -12.105 16.815 11.842 92 HG22 VAL 11 HG22 VAL 11 -10.534 16.056 11.529 93 HG23 VAL 11 HG23 VAL 11 -11.165 16.124 13.174 94 H GLU 12 H GLU 12 -7.749 19.304 10.992 95 HA GLU 12 HA GLU 12 -7.587 21.741 12.510 96 HB2 GLU 12 HB2 GLU 12 -5.774 20.196 10.677 97 HB3 GLU 12 HB3 GLU 12 -5.381 21.891 10.980 98 HG2 GLU 12 HG2 GLU 12 -5.826 21.050 13.548 99 HG3 GLU 12 HG3 GLU 12 -5.202 19.569 12.833 100 H TYR 13 H TYR 13 -8.080 21.231 9.015 101 HA TYR 13 HA TYR 13 -8.343 24.197 8.676 102 HB2 TYR 13 HB2 TYR 13 -6.695 22.345 6.925 103 HB3 TYR 13 HB3 TYR 13 -6.991 24.055 6.636 104 HD1 TYR 13 HD2 TYR 13 -6.383 25.585 8.858 105 HD2 TYR 13 HD1 TYR 13 -4.532 21.871 7.660 106 HE1 TYR 13 HE2 TYR 13 -4.308 26.232 10.066 107 HE2 TYR 13 HE1 TYR 13 -2.452 22.531 8.865 108 HH TYR 13 HH TYR 13 -2.177 25.641 10.613 109 H GLY 14 H GLY 14 -8.872 21.028 6.983 110 HA2 GLY 14 HA2 GLY 14 -11.363 20.940 6.194 111 HA3 GLY 14 HA3 GLY 14 -10.913 22.363 5.255 112 H LEU 15 H LEU 15 -11.210 21.463 3.269 113 HA LEU 15 HA LEU 15 -10.025 18.954 2.356 114 HB2 LEU 15 HB2 LEU 15 -11.249 21.332 0.884 115 HB3 LEU 15 HB3 LEU 15 -10.818 19.795 0.140 116 HG LEU 15 HG LEU 15 -12.939 20.164 2.313 117 HD11 LEU 15 HD11 LEU 15 -13.581 21.165 0.161 118 HD12 LEU 15 HD12 LEU 15 -13.202 19.640 -0.673 119 HD13 LEU 15 HD13 LEU 15 -14.534 19.713 0.505 120 HD21 LEU 15 HD21 LEU 15 -12.026 17.758 0.706 121 HD22 LEU 15 HD22 LEU 15 -12.030 17.931 2.455 122 HD23 LEU 15 HD23 LEU 15 -13.569 17.812 1.592 123 H LEU 16 H LEU 16 -7.815 18.939 2.603 124 HA LEU 16 HA LEU 16 -6.242 20.957 1.052 125 HB2 LEU 16 HB2 LEU 16 -5.827 19.876 3.852 126 HB3 LEU 16 HB3 LEU 16 -4.441 20.331 2.896 127 HG LEU 16 HG LEU 16 -4.949 22.079 4.393 128 HD11 LEU 16 HD11 LEU 16 -4.079 22.753 2.192 129 HD12 LEU 16 HD12 LEU 16 -5.744 23.013 1.611 130 HD13 LEU 16 HD13 LEU 16 -5.092 24.003 2.924 131 HD21 LEU 16 HD21 LEU 16 -7.658 22.513 3.115 132 HD22 LEU 16 HD22 LEU 16 -7.384 21.700 4.676 133 HD23 LEU 16 HD23 LEU 16 -6.930 23.401 4.443 134 HA PRO 17 HA PRO 17 -4.460 17.618 -1.210 135 HB2 PRO 17 HB2 PRO 17 -1.983 18.626 -1.863 136 HB3 PRO 17 HB3 PRO 17 -3.529 19.139 -2.606 137 HG2 PRO 17 HG2 PRO 17 -2.015 20.460 -0.353 138 HG3 PRO 17 HG3 PRO 17 -2.723 21.222 -1.816 139 HD2 PRO 17 HD2 PRO 17 -3.997 21.254 0.559 140 HD3 PRO 17 HD3 PRO 17 -4.916 21.007 -0.951 141 H ILE 18 H ILE 18 -3.700 15.691 -0.591 142 HA ILE 18 HA ILE 18 -2.361 15.183 1.839 143 HB ILE 18 HB ILE 18 -3.669 13.541 0.540 144 HG12 ILE 18 HG12 ILE 18 -0.867 12.545 1.191 145 HG13 ILE 18 HG13 ILE 18 -2.115 12.915 2.396 146 HG21 ILE 18 HG21 ILE 18 -2.649 14.042 -1.723 147 HG22 ILE 18 HG22 ILE 18 -1.237 13.084 -1.224 148 HG23 ILE 18 HG23 ILE 18 -2.843 12.347 -1.331 149 HD11 ILE 18 HD11 ILE 18 -2.127 10.543 2.019 150 HD12 ILE 18 HD12 ILE 18 -3.607 11.199 1.288 151 HD13 ILE 18 HD13 ILE 18 -2.225 10.752 0.264 152 H GLY 19 H GLY 19 -0.950 15.778 -1.385 153 HA2 GLY 19 HA2 GLY 19 1.680 14.888 -0.739 154 HA3 GLY 19 HA3 GLY 19 1.256 16.000 -2.047 155 H LYS 20 H LYS 20 0.089 18.015 -0.168 156 HA LYS 20 HA LYS 20 2.550 19.385 0.588 157 HB2 LYS 20 HB2 LYS 20 0.275 20.385 -0.248 158 HB3 LYS 20 HB3 LYS 20 -0.237 20.229 1.439 159 HG2 LYS 20 HG2 LYS 20 1.900 21.571 2.035 160 HG3 LYS 20 HG3 LYS 20 2.116 21.799 0.297 161 HD2 LYS 20 HD2 LYS 20 1.050 23.762 0.998 162 HD3 LYS 20 HD3 LYS 20 -0.262 22.812 0.280 163 HE2 LYS 20 HE2 LYS 20 -0.939 22.058 2.568 164 HE3 LYS 20 HE3 LYS 20 0.416 22.965 3.261 165 HZ1 LYS 20 HZ1 LYS 20 -0.604 25.013 2.394 166 HZ2 LYS 20 HZ2 LYS 20 -1.877 24.179 1.800 167 HZ3 LYS 20 HZ3 LYS 20 -1.620 24.252 3.416 168 H ILE 21 H ILE 21 0.053 17.500 2.239 169 HA ILE 21 HA ILE 21 0.852 18.203 4.940 170 HB ILE 21 HB ILE 21 -0.812 15.947 3.813 171 HG12 ILE 21 HG12 ILE 21 -1.710 18.313 5.518 172 HG13 ILE 21 HG13 ILE 21 -1.637 18.425 3.766 173 HG21 ILE 21 HG21 ILE 21 0.104 15.071 5.846 174 HG22 ILE 21 HG22 ILE 21 -0.307 16.552 6.736 175 HG23 ILE 21 HG23 ILE 21 -1.573 15.473 6.122 176 HD11 ILE 21 HD11 ILE 21 -3.238 16.567 3.534 177 HD12 ILE 21 HD12 ILE 21 -3.386 16.473 5.305 178 HD13 ILE 21 HD13 ILE 21 -3.899 17.935 4.447 179 H VAL 22 H VAL 22 1.635 15.580 2.653 180 HA VAL 22 HA VAL 22 3.412 14.249 4.511 181 HB VAL 22 HB VAL 22 2.886 13.948 1.545 182 HG11 VAL 22 HG11 VAL 22 5.181 13.153 1.903 183 HG12 VAL 22 HG12 VAL 22 4.661 12.186 3.301 184 HG13 VAL 22 HG13 VAL 22 4.097 11.790 1.674 185 HG21 VAL 22 HG21 VAL 22 2.187 12.285 4.017 186 HG22 VAL 22 HG22 VAL 22 1.058 13.305 3.091 187 HG23 VAL 22 HG23 VAL 22 1.759 11.852 2.361 188 H GLU 23 H GLU 23 4.074 16.490 1.748 189 HA GLU 23 HA GLU 23 6.920 16.176 2.113 190 HB2 GLU 23 HB2 GLU 23 7.194 17.634 0.377 191 HB3 GLU 23 HB3 GLU 23 5.654 16.833 0.009 192 HG2 GLU 23 HG2 GLU 23 4.514 18.863 1.028 193 HG3 GLU 23 HG3 GLU 23 6.091 19.632 1.092 194 H LYS 24 H LYS 24 4.592 18.221 3.680 195 HA LYS 24 HA LYS 24 6.769 19.789 5.030 196 HB2 LYS 24 HB2 LYS 24 3.810 20.448 4.910 197 HB3 LYS 24 HB3 LYS 24 5.083 21.460 5.558 198 HG2 LYS 24 HG2 LYS 24 4.615 20.717 2.651 199 HG3 LYS 24 HG3 LYS 24 4.305 22.267 3.393 200 HD2 LYS 24 HD2 LYS 24 7.040 20.996 2.950 201 HD3 LYS 24 HD3 LYS 24 6.353 22.330 2.040 202 HE2 LYS 24 HE2 LYS 24 7.080 22.388 5.006 203 HE3 LYS 24 HE3 LYS 24 8.056 23.048 3.692 204 HZ1 LYS 24 HZ1 LYS 24 6.222 24.589 3.188 205 HZ2 LYS 24 HZ2 LYS 24 5.351 24.020 4.453 206 HZ3 LYS 24 HZ3 LYS 24 6.760 24.795 4.714 207 H ARG 25 H ARG 25 5.041 17.093 5.512 208 HA ARG 25 HA ARG 25 4.270 15.855 7.266 209 HB2 ARG 25 HB2 ARG 25 6.582 17.107 8.774 210 HB3 ARG 25 HB3 ARG 25 5.792 15.571 9.101 211 HG2 ARG 25 HG2 ARG 25 7.440 14.641 7.873 212 HG3 ARG 25 HG3 ARG 25 6.495 15.175 6.482 213 HD2 ARG 25 HD2 ARG 25 8.818 15.796 6.180 214 HD3 ARG 25 HD3 ARG 25 7.848 17.263 6.379 215 HE ARG 25 HE ARG 25 8.921 16.351 8.912 216 HH11 ARG 25 HH11 ARG 25 9.956 18.061 6.029 217 HH12 ARG 25 HH12 ARG 25 11.185 18.950 6.897 218 HH21 ARG 25 HH21 ARG 25 10.486 17.524 9.949 219 HH22 ARG 25 HH22 ARG 25 11.475 18.646 9.054 220 H ILE 26 H ILE 26 2.437 17.562 7.084 221 HA ILE 26 HA ILE 26 2.214 19.435 9.324 222 HB ILE 26 HB ILE 26 0.172 18.709 7.189 223 HG12 ILE 26 HG12 ILE 26 1.975 21.155 7.474 224 HG13 ILE 26 HG13 ILE 26 2.356 19.801 6.425 225 HG21 ILE 26 HG21 ILE 26 -0.900 19.621 9.245 226 HG22 ILE 26 HG22 ILE 26 0.231 20.987 9.233 227 HG23 ILE 26 HG23 ILE 26 -0.976 20.796 7.951 228 HD11 ILE 26 HD11 ILE 26 0.857 20.387 4.813 229 HD12 ILE 26 HD12 ILE 26 -0.291 21.126 5.938 230 HD13 ILE 26 HD13 ILE 26 1.196 21.981 5.488 231 H GLU 27 H GLU 27 1.565 18.976 11.260 232 HA GLU 27 HA GLU 27 0.478 16.397 12.070 233 HB2 GLU 27 HB2 GLU 27 1.178 18.930 13.586 234 HB3 GLU 27 HB3 GLU 27 0.478 17.490 14.350 235 HG2 GLU 27 HG2 GLU 27 2.337 16.112 13.598 236 HG3 GLU 27 HG3 GLU 27 3.090 17.495 12.790 237 H CYS 28 H CYS 28 -1.459 16.308 10.920 238 HA CYS 28 HA CYS 28 -3.676 18.071 11.901 239 HB2 CYS 28 HB2 CYS 28 -4.649 17.856 9.606 240 HB3 CYS 28 HB3 CYS 28 -3.089 18.682 9.645 241 HG CYS 28 HG CYS 28 -1.620 16.706 8.882 242 H THR 29 H THR 29 -5.862 17.039 11.105 243 HA THR 29 HA THR 29 -6.034 14.244 12.192 244 HB THR 29 HB THR 29 -8.240 16.269 12.395 245 HG1 THR 29 HG1 THR 29 -6.646 17.297 13.509 246 HG21 THR 29 HG21 THR 29 -8.720 13.875 12.979 247 HG22 THR 29 HG22 THR 29 -7.540 14.031 14.312 248 HG23 THR 29 HG23 THR 29 -9.009 15.017 14.298 249 H VAL 30 H VAL 30 -7.645 12.926 11.165 250 HA VAL 30 HA VAL 30 -8.719 13.901 8.542 251 HB VAL 30 HB VAL 30 -8.064 11.902 7.428 252 HG11 VAL 30 HG11 VAL 30 -6.397 13.775 7.619 253 HG12 VAL 30 HG12 VAL 30 -5.583 12.845 8.902 254 HG13 VAL 30 HG13 VAL 30 -5.721 12.184 7.260 255 HG21 VAL 30 HG21 VAL 30 -6.742 10.929 9.996 256 HG22 VAL 30 HG22 VAL 30 -8.199 10.233 9.250 257 HG23 VAL 30 HG23 VAL 30 -6.654 10.150 8.403 258 H TYR 31 H TYR 31 -10.202 11.979 7.626 259 HA TYR 31 HA TYR 31 -12.134 11.261 9.790 260 HB2 TYR 31 HB2 TYR 31 -12.702 12.274 6.972 261 HB3 TYR 31 HB3 TYR 31 -13.897 11.596 8.049 262 HD1 TYR 31 HD1 TYR 31 -11.373 14.386 7.918 263 HD2 TYR 31 HD2 TYR 31 -15.175 12.999 9.393 264 HE1 TYR 31 HE1 TYR 31 -11.868 16.668 8.789 265 HE2 TYR 31 HE2 TYR 31 -15.692 15.293 10.217 266 HH TYR 31 HH TYR 31 -14.967 17.459 10.365 267 H SER 32 H SER 32 -13.099 9.281 9.652 268 HA SER 32 HA SER 32 -12.803 7.466 7.362 269 HB2 SER 32 HB2 SER 32 -10.528 7.442 8.379 270 HB3 SER 32 HB3 SER 32 -11.230 7.041 9.951 271 HG SER 32 HG SER 32 -10.413 5.255 8.633 272 H VAL 33 H VAL 33 -13.996 5.402 7.766 273 HA VAL 33 HA VAL 33 -16.009 5.671 9.929 274 HB VAL 33 HB VAL 33 -17.148 3.746 9.063 275 HG11 VAL 33 HG11 VAL 33 -17.700 5.952 8.205 276 HG12 VAL 33 HG12 VAL 33 -16.552 5.710 6.841 277 HG13 VAL 33 HG13 VAL 33 -17.982 4.671 7.010 278 HG21 VAL 33 HG21 VAL 33 -14.977 3.659 6.956 279 HG22 VAL 33 HG22 VAL 33 -15.393 2.403 8.153 280 HG23 VAL 33 HG23 VAL 33 -16.529 2.786 6.855 281 H ASP 34 H ASP 34 -16.282 4.320 11.582 282 HA ASP 34 HA ASP 34 -14.063 2.547 12.371 283 HB2 ASP 34 HB2 ASP 34 -15.640 4.174 13.841 284 HB3 ASP 34 HB3 ASP 34 -16.635 2.729 13.898 285 H ASN 35 H ASN 35 -14.924 0.425 13.542 286 HA ASN 35 HA ASN 35 -15.826 -1.425 11.532 287 HB2 ASN 35 HB2 ASN 35 -15.581 -1.645 14.569 288 HB3 ASN 35 HB3 ASN 35 -16.038 -2.993 13.534 289 HD21 ASN 35 HD22 ASN 35 -14.488 -3.717 11.853 290 HD22 ASN 35 HD21 ASN 35 -12.776 -3.482 12.176 291 H ASN 36 H ASN 36 -17.638 0.634 13.647 292 HA ASN 36 HA ASN 36 -20.168 -0.878 13.338 293 HB2 ASN 36 HB2 ASN 36 -19.451 1.704 14.803 294 HB3 ASN 36 HB3 ASN 36 -21.034 0.927 14.841 295 HD21 ASN 36 HD22 ASN 36 -18.323 1.270 16.673 296 HD22 ASN 36 HD21 ASN 36 -18.410 -0.251 17.548 297 H GLY 37 H GLY 37 -18.507 1.154 11.280 298 HA2 GLY 37 HA2 GLY 37 -19.188 2.195 9.336 299 HA3 GLY 37 HA3 GLY 37 -20.866 1.773 9.689 300 H ASN 38 H ASN 38 -18.729 3.672 11.784 301 HA ASN 38 HA ASN 38 -20.494 6.095 11.494 302 HB2 ASN 38 HB2 ASN 38 -19.023 4.910 13.893 303 HB3 ASN 38 HB3 ASN 38 -19.538 6.590 13.841 304 HD21 ASN 38 HD22 ASN 38 -20.813 3.254 13.636 305 HD22 ASN 38 HD21 ASN 38 -22.400 3.690 14.233 306 H ILE 39 H ILE 39 -19.498 7.767 10.509 307 HA ILE 39 HA ILE 39 -16.662 7.882 10.005 308 HB ILE 39 HB ILE 39 -18.721 10.102 9.820 309 HG12 ILE 39 HG12 ILE 39 -17.631 8.284 7.615 310 HG13 ILE 39 HG13 ILE 39 -19.214 8.073 8.367 311 HG21 ILE 39 HG21 ILE 39 -16.339 10.886 9.941 312 HG22 ILE 39 HG22 ILE 39 -15.933 9.817 8.583 313 HG23 ILE 39 HG23 ILE 39 -17.037 11.193 8.364 314 HD11 ILE 39 HD11 ILE 39 -19.872 10.354 7.612 315 HD12 ILE 39 HD12 ILE 39 -18.326 10.463 6.735 316 HD13 ILE 39 HD13 ILE 39 -19.512 9.222 6.292 317 H TYR 40 H TYR 40 -15.229 8.147 11.527 318 HA TYR 40 HA TYR 40 -15.631 10.141 13.732 319 HB2 TYR 40 HB2 TYR 40 -14.351 8.810 15.192 320 HB3 TYR 40 HB3 TYR 40 -15.527 7.729 14.481 321 HD1 TYR 40 HD2 TYR 40 -14.806 5.989 12.827 322 HD2 TYR 40 HD1 TYR 40 -11.955 8.541 14.814 323 HE1 TYR 40 HE2 TYR 40 -12.944 4.519 12.076 324 HE2 TYR 40 HE1 TYR 40 -10.107 7.084 13.996 325 HH TYR 40 HH TYR 40 -10.655 4.232 11.937 326 H THR 41 H THR 41 -13.292 10.773 14.588 327 HA THR 41 HA THR 41 -11.534 11.342 12.256 328 HB THR 41 HB THR 41 -11.043 13.576 13.368 329 HG1 THR 41 HG1 THR 41 -12.058 13.167 15.363 330 HG21 THR 41 HG21 THR 41 -12.320 13.522 11.343 331 HG22 THR 41 HG22 THR 41 -13.804 13.049 12.204 332 HG23 THR 41 HG23 THR 41 -13.106 14.658 12.451 333 H GLN 42 H GLN 42 -9.345 11.412 12.531 334 HA GLN 42 HA GLN 42 -8.225 10.822 15.217 335 HB2 GLN 42 HB2 GLN 42 -6.977 8.900 14.389 336 HB3 GLN 42 HB3 GLN 42 -8.715 8.654 14.282 337 HG2 GLN 42 HG2 GLN 42 -8.624 9.102 11.821 338 HG3 GLN 42 HG3 GLN 42 -6.885 9.382 11.938 339 HE21 GLN 42 HE22 GLN 42 -7.995 7.384 10.210 340 HE22 GLN 42 HE21 GLN 42 -7.533 5.822 10.855 341 HA PRO 43 HA PRO 43 -4.881 13.354 13.688 342 HB2 PRO 43 HB2 PRO 43 -2.883 12.774 15.445 343 HB3 PRO 43 HB3 PRO 43 -4.343 13.706 15.898 344 HG2 PRO 43 HG2 PRO 43 -3.819 10.748 16.314 345 HG3 PRO 43 HG3 PRO 43 -4.440 11.945 17.498 346 HD2 PRO 43 HD2 PRO 43 -6.089 10.284 16.099 347 HD3 PRO 43 HD3 PRO 43 -6.569 11.955 16.518 348 H VAL 44 H VAL 44 -3.073 13.241 12.388 349 HA VAL 44 HA VAL 44 -2.282 10.790 11.108 350 HB VAL 44 HB VAL 44 -2.147 13.027 10.084 351 HG11 VAL 44 HG11 VAL 44 -1.183 14.283 12.042 352 HG12 VAL 44 HG12 VAL 44 0.362 13.470 11.750 353 HG13 VAL 44 HG13 VAL 44 -0.327 14.532 10.509 354 HG21 VAL 44 HG21 VAL 44 0.579 11.692 10.119 355 HG22 VAL 44 HG22 VAL 44 -0.833 11.051 9.252 356 HG23 VAL 44 HG23 VAL 44 -0.165 12.631 8.818 357 H ALA 45 H ALA 45 -0.391 9.532 11.359 358 HA ALA 45 HA ALA 45 1.054 9.842 13.969 359 HB1 ALA 45 HB1 ALA 45 -0.398 7.823 13.683 360 HB2 ALA 45 HB2 ALA 45 0.618 7.327 12.312 361 HB3 ALA 45 HB3 ALA 45 1.315 7.447 13.936 362 H GLN 46 H GLN 46 1.532 8.992 10.517 363 HA GLN 46 HA GLN 46 4.259 10.151 10.577 364 HB2 GLN 46 HB2 GLN 46 3.655 7.356 9.501 365 HB3 GLN 46 HB3 GLN 46 5.146 8.239 9.268 366 HG2 GLN 46 HG2 GLN 46 5.762 6.849 10.923 367 HG3 GLN 46 HG3 GLN 46 5.383 8.310 11.826 368 HE21 GLN 46 HE22 GLN 46 3.465 5.445 10.588 369 HE22 GLN 46 HE21 GLN 46 2.767 5.095 12.164 370 H TRP 47 H TRP 47 5.143 10.037 8.193 371 HA TRP 47 HA TRP 47 3.017 10.567 6.165 372 HB2 TRP 47 HB2 TRP 47 5.415 12.346 6.747 373 HB3 TRP 47 HB3 TRP 47 4.256 12.559 5.459 374 HD1 TRP 47 HD1 TRP 47 2.003 13.811 6.052 375 HE1 TRP 47 HE1 TRP 47 1.158 15.092 8.102 376 HE3 TRP 47 HE3 TRP 47 5.550 12.315 9.433 377 HZ2 TRP 47 HZ2 TRP 47 1.908 15.377 10.868 378 HZ3 TRP 47 HZ3 TRP 47 5.429 13.089 11.794 379 HH2 TRP 47 HH2 TRP 47 3.596 14.612 12.518 380 H HIS 48 H HIS 48 3.427 9.237 4.443 381 HA HIS 48 HA HIS 48 6.253 8.429 3.906 382 HB2 HIS 48 HB2 HIS 48 3.813 6.790 3.226 383 HB3 HIS 48 HB3 HIS 48 5.492 6.303 3.220 384 HD1 HIS 48 HD1 HIS 48 6.622 6.091 5.828 385 HD2 HIS 48 HD2 HIS 48 2.439 6.271 5.380 386 HE1 HIS 48 HE1 HIS 48 5.632 5.205 8.003 387 H ASP 49 H ASP 49 7.026 8.509 1.910 388 HA ASP 49 HA ASP 49 5.403 9.722 -0.294 389 HB2 ASP 49 HB2 ASP 49 6.605 11.507 0.778 390 HB3 ASP 49 HB3 ASP 49 8.076 10.546 0.884 391 H ARG 50 H ARG 50 5.399 8.492 -1.959 392 HA ARG 50 HA ARG 50 7.221 6.199 -2.334 393 HB2 ARG 50 HB2 ARG 50 5.007 7.303 -4.058 394 HB3 ARG 50 HB3 ARG 50 5.768 5.733 -4.222 395 HG2 ARG 50 HG2 ARG 50 4.041 6.678 -1.880 396 HG3 ARG 50 HG3 ARG 50 3.574 5.534 -3.119 397 HD2 ARG 50 HD2 ARG 50 5.723 5.102 -1.017 398 HD3 ARG 50 HD3 ARG 50 4.110 4.384 -1.061 399 HE ARG 50 HE ARG 50 5.600 3.793 -3.498 400 HH11 ARG 50 HH11 ARG 50 5.476 2.737 -0.161 401 HH12 ARG 50 HH12 ARG 50 6.157 1.179 -0.556 402 HH21 ARG 50 HH21 ARG 50 6.345 1.847 -3.949 403 HH22 ARG 50 HH22 ARG 50 6.726 0.716 -2.664 404 H GLY 51 H GLY 51 6.770 9.367 -3.732 405 HA2 GLY 51 HA2 GLY 51 8.432 10.631 -4.769 406 HA3 GLY 51 HA3 GLY 51 9.324 9.174 -5.173 407 H GLU 52 H GLU 52 7.538 7.685 -6.714 408 HA GLU 52 HA GLU 52 6.387 9.173 -8.924 409 HB2 GLU 52 HB2 GLU 52 9.273 8.278 -9.209 410 HB3 GLU 52 HB3 GLU 52 8.141 8.308 -10.558 411 HG2 GLU 52 HG2 GLU 52 7.732 10.756 -10.074 412 HG3 GLU 52 HG3 GLU 52 9.159 10.690 -9.026 413 H GLN 53 H GLN 53 4.764 7.587 -8.731 414 HA GLN 53 HA GLN 53 5.436 4.983 -10.057 415 HB2 GLN 53 HB2 GLN 53 3.398 5.537 -7.895 416 HB3 GLN 53 HB3 GLN 53 3.768 3.944 -8.600 417 HG2 GLN 53 HG2 GLN 53 6.133 4.180 -7.738 418 HG3 GLN 53 HG3 GLN 53 5.637 5.691 -6.932 419 HE21 GLN 53 HE22 GLN 53 3.079 4.965 -5.911 420 HE22 GLN 53 HE21 GLN 53 3.639 4.153 -4.515 421 H GLU 54 H GLU 54 3.469 3.876 -10.952 422 HA GLU 54 HA GLU 54 2.444 5.476 -13.068 423 HB2 GLU 54 HB2 GLU 54 1.420 3.383 -13.833 424 HB3 GLU 54 HB3 GLU 54 3.114 3.235 -13.401 425 HG2 GLU 54 HG2 GLU 54 2.157 2.339 -11.082 426 HG3 GLU 54 HG3 GLU 54 0.701 2.049 -12.029 427 H VAL 55 H VAL 55 1.033 7.070 -12.639 428 HA VAL 55 HA VAL 55 -1.376 6.583 -10.959 429 HB VAL 55 HB VAL 55 -0.386 9.185 -12.193 430 HG11 VAL 55 HG11 VAL 55 -2.832 9.203 -11.628 431 HG12 VAL 55 HG12 VAL 55 -2.425 8.699 -9.977 432 HG13 VAL 55 HG13 VAL 55 -1.894 10.275 -10.597 433 HG21 VAL 55 HG21 VAL 55 0.013 7.923 -9.459 434 HG22 VAL 55 HG22 VAL 55 1.244 8.571 -10.562 435 HG23 VAL 55 HG23 VAL 55 0.158 9.674 -9.719 436 H PHE 56 H PHE 56 -3.394 6.590 -11.674 437 HA PHE 56 HA PHE 56 -3.953 7.042 -14.602 438 HB2 PHE 56 HB2 PHE 56 -5.106 4.979 -12.754 439 HB3 PHE 56 HB3 PHE 56 -5.802 5.420 -14.291 440 HD1 PHE 56 HD1 PHE 56 -2.600 4.159 -12.741 441 HD2 PHE 56 HD2 PHE 56 -5.100 4.296 -16.252 442 HE1 PHE 56 HE1 PHE 56 -1.072 2.590 -13.889 443 HE2 PHE 56 HE2 PHE 56 -3.648 2.595 -17.342 444 HZ PHE 56 HZ PHE 56 -1.622 1.755 -16.171 445 H GLU 57 H GLU 57 -5.778 8.116 -15.134 446 HA GLU 57 HA GLU 57 -7.112 9.816 -13.107 447 HB2 GLU 57 HB2 GLU 57 -6.407 10.680 -15.342 448 HB3 GLU 57 HB3 GLU 57 -7.478 9.539 -16.136 449 HG2 GLU 57 HG2 GLU 57 -9.435 10.627 -15.177 450 HG3 GLU 57 HG3 GLU 57 -8.419 11.627 -14.129 451 H TYR 58 H TYR 58 -8.865 9.013 -12.038 452 HA TYR 58 HA TYR 58 -10.655 7.068 -13.426 453 HB2 TYR 58 HB2 TYR 58 -10.602 7.652 -10.467 454 HB3 TYR 58 HB3 TYR 58 -11.286 6.277 -11.301 455 HD1 TYR 58 HD1 TYR 58 -9.567 4.666 -12.528 456 HD2 TYR 58 HD2 TYR 58 -8.475 7.592 -9.548 457 HE1 TYR 58 HE1 TYR 58 -7.408 3.458 -12.103 458 HE2 TYR 58 HE2 TYR 58 -6.340 6.398 -9.172 459 HH TYR 58 HH TYR 58 -4.927 4.842 -9.961 460 H CYS 59 H CYS 59 -12.184 8.193 -14.465 461 HA CYS 59 HA CYS 59 -13.419 10.591 -13.179 462 HB2 CYS 59 HB2 CYS 59 -12.538 10.700 -15.541 463 HB3 CYS 59 HB3 CYS 59 -13.774 9.510 -16.000 464 HG CYS 59 HG CYS 59 -14.489 11.994 -16.678 465 H LEU 60 H LEU 60 -15.275 10.359 -12.122 466 HA LEU 60 HA LEU 60 -16.855 7.843 -12.262 467 HB2 LEU 60 HB2 LEU 60 -16.537 10.117 -10.402 468 HB3 LEU 60 HB3 LEU 60 -18.205 9.736 -10.683 469 HG LEU 60 HG LEU 60 -18.006 7.517 -9.895 470 HD11 LEU 60 HD11 LEU 60 -15.787 6.810 -10.663 471 HD12 LEU 60 HD12 LEU 60 -15.007 7.956 -9.552 472 HD13 LEU 60 HD13 LEU 60 -15.935 6.569 -8.924 473 HD21 LEU 60 HD21 LEU 60 -16.365 9.234 -7.978 474 HD22 LEU 60 HD22 LEU 60 -18.107 9.408 -8.199 475 HD23 LEU 60 HD23 LEU 60 -17.459 7.894 -7.568 476 H GLU 61 H GLU 61 -19.102 7.864 -12.679 477 HA GLU 61 HA GLU 61 -19.693 9.188 -15.174 478 HB2 GLU 61 HB2 GLU 61 -21.910 8.139 -15.023 479 HB3 GLU 61 HB3 GLU 61 -20.605 6.987 -14.808 480 HG2 GLU 61 HG2 GLU 61 -21.047 6.631 -12.569 481 HG3 GLU 61 HG3 GLU 61 -21.832 8.195 -12.355 482 H ASP 62 H ASP 62 -20.216 10.265 -11.947 483 HA ASP 62 HA ASP 62 -22.378 12.163 -12.580 484 HB2 ASP 62 HB2 ASP 62 -22.105 11.188 -10.342 485 HB3 ASP 62 HB3 ASP 62 -20.510 11.936 -10.189 486 H GLY 63 H GLY 63 -18.890 12.150 -12.755 487 HA2 GLY 63 HA2 GLY 63 -17.937 13.867 -14.278 488 HA3 GLY 63 HA3 GLY 63 -18.793 15.095 -13.343 489 H SER 64 H SER 64 -17.934 13.221 -10.893 490 HA SER 64 HA SER 64 -15.730 14.749 -9.968 491 HB2 SER 64 HB2 SER 64 -16.749 12.000 -9.147 492 HB3 SER 64 HB3 SER 64 -15.490 12.891 -8.273 493 HG SER 64 HG SER 64 -17.668 13.225 -7.473 494 H LEU 65 H LEU 65 -13.557 14.314 -9.709 495 HA LEU 65 HA LEU 65 -12.309 12.217 -11.451 496 HB2 LEU 65 HB2 LEU 65 -11.726 15.175 -11.114 497 HB3 LEU 65 HB3 LEU 65 -10.487 14.064 -11.682 498 HG LEU 65 HG LEU 65 -13.153 14.403 -13.112 499 HD11 LEU 65 HD11 LEU 65 -11.922 16.545 -13.082 500 HD12 LEU 65 HD12 LEU 65 -10.455 15.725 -13.655 501 HD13 LEU 65 HD13 LEU 65 -11.890 15.824 -14.699 502 HD21 LEU 65 HD21 LEU 65 -10.457 13.241 -13.971 503 HD22 LEU 65 HD22 LEU 65 -11.922 12.302 -13.622 504 HD23 LEU 65 HD23 LEU 65 -11.893 13.404 -15.002 505 H ILE 66 H ILE 66 -10.759 11.062 -10.583 506 HA ILE 66 HA ILE 66 -9.461 11.838 -8.005 507 HB ILE 66 HB ILE 66 -10.527 9.063 -8.665 508 HG12 ILE 66 HG12 ILE 66 -11.763 11.131 -6.796 509 HG13 ILE 66 HG13 ILE 66 -12.450 10.578 -8.323 510 HG21 ILE 66 HG21 ILE 66 -8.556 9.121 -7.130 511 HG22 ILE 66 HG22 ILE 66 -9.449 10.222 -6.054 512 HG23 ILE 66 HG23 ILE 66 -9.992 8.554 -6.315 513 HD11 ILE 66 HD11 ILE 66 -12.644 8.272 -7.405 514 HD12 ILE 66 HD12 ILE 66 -12.162 8.915 -5.812 515 HD13 ILE 66 HD13 ILE 66 -13.640 9.492 -6.593 516 H ARG 67 H ARG 67 -7.299 11.228 -7.862 517 HA ARG 67 HA ARG 67 -6.047 9.779 -10.167 518 HB2 ARG 67 HB2 ARG 67 -5.149 12.444 -8.986 519 HB3 ARG 67 HB3 ARG 67 -4.197 11.448 -10.101 520 HG2 ARG 67 HG2 ARG 67 -6.091 11.570 -11.752 521 HG3 ARG 67 HG3 ARG 67 -6.907 12.722 -10.681 522 HD2 ARG 67 HD2 ARG 67 -5.052 14.295 -10.890 523 HD3 ARG 67 HD3 ARG 67 -4.135 13.138 -11.850 524 HE ARG 67 HE ARG 67 -5.724 13.364 -13.669 525 HH11 ARG 67 HH11 ARG 67 -5.962 16.008 -11.389 526 HH12 ARG 67 HH12 ARG 67 -7.325 16.705 -12.221 527 HH21 ARG 67 HH21 ARG 67 -7.312 14.417 -14.788 528 HH22 ARG 67 HH22 ARG 67 -7.918 15.937 -14.180 529 H ALA 68 H ALA 68 -5.162 8.038 -9.430 530 HA ALA 68 HA ALA 68 -3.307 8.080 -7.151 531 HB1 ALA 68 HB1 ALA 68 -5.605 7.646 -6.131 532 HB2 ALA 68 HB2 ALA 68 -5.693 6.151 -7.090 533 HB3 ALA 68 HB3 ALA 68 -4.434 6.340 -5.877 534 H THR 69 H THR 69 -2.217 5.896 -6.921 535 HA THR 69 HA THR 69 -1.591 4.758 -9.545 536 HB THR 69 HB THR 69 -0.346 3.034 -8.190 537 HG1 THR 69 HG1 THR 69 -1.893 3.633 -6.343 538 HG21 THR 69 HG21 THR 69 0.606 5.279 -8.948 539 HG22 THR 69 HG22 THR 69 0.331 5.840 -7.282 540 HG23 THR 69 HG23 THR 69 1.418 4.455 -7.594 541 H LYS 70 H LYS 70 -2.045 2.711 -10.277 542 HA LYS 70 HA LYS 70 -4.644 1.735 -9.776 543 HB2 LYS 70 HB2 LYS 70 -4.256 0.157 -11.430 544 HB3 LYS 70 HB3 LYS 70 -3.224 1.506 -11.838 545 HG2 LYS 70 HG2 LYS 70 -1.422 0.165 -10.381 546 HG3 LYS 70 HG3 LYS 70 -2.480 -1.220 -10.716 547 HD2 LYS 70 HD2 LYS 70 -1.414 0.683 -12.812 548 HD3 LYS 70 HD3 LYS 70 -0.474 -0.712 -12.297 549 HE2 LYS 70 HE2 LYS 70 -3.300 -0.990 -13.397 550 HE3 LYS 70 HE3 LYS 70 -1.890 -0.895 -14.461 551 HZ1 LYS 70 HZ1 LYS 70 -0.968 -2.850 -13.365 552 HZ2 LYS 70 HZ2 LYS 70 -2.263 -2.975 -12.368 553 HZ3 LYS 70 HZ3 LYS 70 -2.445 -3.199 -13.969 554 H ASP 71 H ASP 71 -1.786 1.118 -8.043 555 HA ASP 71 HA ASP 71 -2.459 -1.503 -6.910 556 HB2 ASP 71 HB2 ASP 71 -0.218 0.507 -6.373 557 HB3 ASP 71 HB3 ASP 71 -0.310 -1.111 -5.683 558 H HIS 72 H HIS 72 -3.254 1.770 -6.156 559 HA HIS 72 HA HIS 72 -3.169 1.490 -3.235 560 HB2 HIS 72 HB2 HIS 72 -2.881 3.681 -4.436 561 HB3 HIS 72 HB3 HIS 72 -4.549 3.585 -4.979 562 HD1 HIS 72 HD1 HIS 72 -6.398 3.537 -2.703 563 HD2 HIS 72 HD2 HIS 72 -2.395 4.590 -2.022 564 HE1 HIS 72 HE1 HIS 72 -6.277 4.539 -0.385 565 H LYS 73 H LYS 73 -4.934 0.846 -1.973 566 HA LYS 73 HA LYS 73 -7.195 -0.415 -3.386 567 HB2 LYS 73 HB2 LYS 73 -6.162 -0.570 -0.534 568 HB3 LYS 73 HB3 LYS 73 -7.617 -1.403 -1.079 569 HG2 LYS 73 HG2 LYS 73 -6.444 -2.852 -2.499 570 HG3 LYS 73 HG3 LYS 73 -5.040 -1.794 -2.627 571 HD2 LYS 73 HD2 LYS 73 -4.485 -2.271 -0.243 572 HD3 LYS 73 HD3 LYS 73 -5.818 -3.451 -0.195 573 HE2 LYS 73 HE2 LYS 73 -4.783 -4.682 -2.083 574 HE3 LYS 73 HE3 LYS 73 -3.505 -3.457 -2.187 575 HZ1 LYS 73 HZ1 LYS 73 -3.963 -5.211 0.178 576 HZ2 LYS 73 HZ2 LYS 73 -2.793 -5.444 -0.939 577 HZ3 LYS 73 HZ3 LYS 73 -2.751 -4.121 0.020 578 H PHE 74 H PHE 74 -9.388 -0.158 -2.789 579 HA PHE 74 HA PHE 74 -10.041 2.376 -1.341 580 HB2 PHE 74 HB2 PHE 74 -10.946 1.614 -4.126 581 HB3 PHE 74 HB3 PHE 74 -11.734 2.833 -3.134 582 HD1 PHE 74 HD2 PHE 74 -8.513 2.013 -4.845 583 HD2 PHE 74 HD1 PHE 74 -10.923 5.051 -2.959 584 HE1 PHE 74 HE2 PHE 74 -6.946 3.760 -5.658 585 HE2 PHE 74 HE1 PHE 74 -9.360 6.793 -3.795 586 HZ PHE 74 HZ PHE 74 -7.369 6.155 -5.120 587 H MET 75 H MET 75 -12.001 2.513 -0.354 588 HA MET 75 HA MET 75 -13.002 -0.025 0.640 589 HB2 MET 75 HB2 MET 75 -12.659 1.937 2.088 590 HB3 MET 75 HB3 MET 75 -13.899 2.801 1.154 591 HG2 MET 75 HG2 MET 75 -15.572 1.129 1.805 592 HG3 MET 75 HG3 MET 75 -14.368 0.242 2.735 593 HE1 MET 75 HE1 MET 75 -13.560 0.640 4.802 594 HE2 MET 75 HE2 MET 75 -13.204 2.306 5.330 595 HE3 MET 75 HE3 MET 75 -14.572 1.430 6.029 596 H THR 76 H THR 76 -14.259 -1.198 -0.739 597 HA THR 76 HA THR 76 -16.215 -0.029 -2.576 598 HB THR 76 HB THR 76 -17.048 -2.325 -2.839 599 HG1 THR 76 HG1 THR 76 -15.977 -3.977 -1.757 600 HG21 THR 76 HG21 THR 76 -15.245 -1.697 -4.250 601 HG22 THR 76 HG22 THR 76 -14.035 -1.986 -2.982 602 HG23 THR 76 HG23 THR 76 -14.925 -3.352 -3.692 603 H VAL 77 H VAL 77 -18.569 -0.586 -2.431 604 HA VAL 77 HA VAL 77 -19.731 0.372 -0.066 605 HB VAL 77 HB VAL 77 -21.891 -0.561 -0.934 606 HG11 VAL 77 HG11 VAL 77 -21.086 1.653 -1.586 607 HG12 VAL 77 HG12 VAL 77 -20.187 0.952 -2.947 608 HG13 VAL 77 HG13 VAL 77 -21.953 0.854 -2.916 609 HG21 VAL 77 HG21 VAL 77 -20.216 -1.588 -3.271 610 HG22 VAL 77 HG22 VAL 77 -21.003 -2.613 -2.050 611 HG23 VAL 77 HG23 VAL 77 -21.978 -1.610 -3.125 612 H ASP 78 H ASP 78 -18.773 -2.911 -0.760 613 HA ASP 78 HA ASP 78 -20.261 -4.120 1.458 614 HB2 ASP 78 HB2 ASP 78 -18.020 -5.129 -0.337 615 HB3 ASP 78 HB3 ASP 78 -18.860 -6.115 0.861 616 H GLY 79 H GLY 79 -17.389 -2.252 1.290 617 HA2 GLY 79 HA2 GLY 79 -16.141 -1.538 3.142 618 HA3 GLY 79 HA3 GLY 79 -16.648 -2.947 4.077 619 H GLN 80 H GLN 80 -15.639 -3.952 0.995 620 HA GLN 80 HA GLN 80 -13.171 -5.160 1.964 621 HB2 GLN 80 HB2 GLN 80 -14.118 -4.895 -0.910 622 HB3 GLN 80 HB3 GLN 80 -12.977 -6.062 -0.272 623 HG2 GLN 80 HG2 GLN 80 -15.955 -6.000 0.425 624 HG3 GLN 80 HG3 GLN 80 -15.223 -6.990 -0.812 625 HE21 GLN 80 HE22 GLN 80 -14.764 -9.084 -0.175 626 HE22 GLN 80 HE21 GLN 80 -14.469 -9.559 1.494 627 H MET 81 H MET 81 -11.087 -4.816 0.884 628 HA MET 81 HA MET 81 -10.618 -2.015 -0.040 629 HB2 MET 81 HB2 MET 81 -8.653 -1.838 1.350 630 HB3 MET 81 HB3 MET 81 -10.110 -2.103 2.296 631 HG2 MET 81 HG2 MET 81 -9.316 -4.660 2.169 632 HG3 MET 81 HG3 MET 81 -7.758 -3.908 1.848 633 HE1 MET 81 HE1 MET 81 -10.611 -2.575 4.578 634 HE2 MET 81 HE2 MET 81 -10.767 -4.293 4.141 635 HE3 MET 81 HE3 MET 81 -10.195 -3.835 5.758 636 H LEU 82 H LEU 82 -10.707 -2.747 -2.125 637 HA LEU 82 HA LEU 82 -8.632 -4.700 -3.036 638 HB2 LEU 82 HB2 LEU 82 -11.104 -3.755 -4.525 639 HB3 LEU 82 HB3 LEU 82 -10.057 -5.104 -4.940 640 HG LEU 82 HG LEU 82 -12.004 -4.927 -2.624 641 HD11 LEU 82 HD11 LEU 82 -12.436 -5.608 -5.293 642 HD12 LEU 82 HD12 LEU 82 -12.232 -7.179 -4.516 643 HD13 LEU 82 HD13 LEU 82 -13.460 -6.050 -3.915 644 HD21 LEU 82 HD21 LEU 82 -10.117 -7.215 -3.305 645 HD22 LEU 82 HD22 LEU 82 -10.075 -6.218 -1.837 646 HD23 LEU 82 HD23 LEU 82 -11.451 -7.288 -2.128 647 HA PRO 83 HA PRO 83 -6.597 -1.374 -5.228 648 HB2 PRO 83 HB2 PRO 83 -5.585 -2.641 -7.447 649 HB3 PRO 83 HB3 PRO 83 -4.898 -2.811 -5.803 650 HG2 PRO 83 HG2 PRO 83 -6.834 -4.650 -7.242 651 HG3 PRO 83 HG3 PRO 83 -5.352 -5.080 -6.332 652 HD2 PRO 83 HD2 PRO 83 -7.832 -5.266 -5.220 653 HD3 PRO 83 HD3 PRO 83 -6.424 -4.743 -4.252 654 H ILE 84 H ILE 84 -7.179 0.162 -6.742 655 HA ILE 84 HA ILE 84 -9.761 -0.017 -7.918 656 HB ILE 84 HB ILE 84 -8.685 2.033 -7.208 657 HG12 ILE 84 HG12 ILE 84 -9.328 2.353 -10.153 658 HG13 ILE 84 HG13 ILE 84 -10.566 1.830 -9.009 659 HG21 ILE 84 HG21 ILE 84 -6.392 1.549 -8.064 660 HG22 ILE 84 HG22 ILE 84 -6.980 1.841 -9.715 661 HG23 ILE 84 HG23 ILE 84 -6.982 3.144 -8.499 662 HD11 ILE 84 HD11 ILE 84 -10.317 3.818 -7.675 663 HD12 ILE 84 HD12 ILE 84 -8.960 4.382 -8.675 664 HD13 ILE 84 HD13 ILE 84 -10.587 4.281 -9.369 665 H ASP 85 H ASP 85 -6.708 -1.039 -9.234 666 HA ASP 85 HA ASP 85 -7.421 -1.300 -11.960 667 HB2 ASP 85 HB2 ASP 85 -5.149 -1.696 -10.784 668 HB3 ASP 85 HB3 ASP 85 -5.751 -3.293 -10.383 669 H GLU 86 H GLU 86 -8.479 -3.174 -9.201 670 HA GLU 86 HA GLU 86 -9.793 -5.251 -10.898 671 HB2 GLU 86 HB2 GLU 86 -8.623 -6.007 -8.904 672 HB3 GLU 86 HB3 GLU 86 -9.607 -4.950 -7.878 673 HG2 GLU 86 HG2 GLU 86 -11.596 -6.206 -8.317 674 HG3 GLU 86 HG3 GLU 86 -10.851 -7.047 -9.682 675 H ILE 87 H ILE 87 -10.621 -2.471 -8.765 676 HA ILE 87 HA ILE 87 -13.423 -2.919 -8.723 677 HB ILE 87 HB ILE 87 -11.910 -0.284 -8.513 678 HG12 ILE 87 HG12 ILE 87 -12.892 -2.166 -6.314 679 HG13 ILE 87 HG13 ILE 87 -11.227 -2.162 -6.903 680 HG21 ILE 87 HG21 ILE 87 -14.374 0.029 -8.914 681 HG22 ILE 87 HG22 ILE 87 -14.707 -1.055 -7.560 682 HG23 ILE 87 HG23 ILE 87 -13.936 0.519 -7.293 683 HD11 ILE 87 HD11 ILE 87 -10.725 -0.071 -5.994 684 HD12 ILE 87 HD12 ILE 87 -12.423 0.345 -5.751 685 HD13 ILE 87 HD13 ILE 87 -11.668 -0.902 -4.751 686 H PHE 88 H PHE 88 -11.426 -1.142 -11.076 687 HA PHE 88 HA PHE 88 -13.549 -0.152 -12.725 688 HB2 PHE 88 HB2 PHE 88 -11.248 0.637 -12.878 689 HB3 PHE 88 HB3 PHE 88 -10.692 -0.957 -13.374 690 HD1 PHE 88 HD1 PHE 88 -12.776 1.964 -14.436 691 HD2 PHE 88 HD2 PHE 88 -10.854 -1.687 -15.664 692 HE1 PHE 88 HE1 PHE 88 -13.151 2.579 -16.809 693 HE2 PHE 88 HE2 PHE 88 -11.215 -1.067 -18.049 694 HZ PHE 88 HZ PHE 88 -12.360 1.066 -18.622 695 H GLU 89 H GLU 89 -12.040 -3.395 -12.642 696 HA GLU 89 HA GLU 89 -13.321 -4.266 -15.159 697 HB2 GLU 89 HB2 GLU 89 -11.700 -5.715 -13.019 698 HB3 GLU 89 HB3 GLU 89 -12.483 -6.543 -14.363 699 HG2 GLU 89 HG2 GLU 89 -11.228 -4.978 -15.936 700 HG3 GLU 89 HG3 GLU 89 -10.295 -4.428 -14.542 701 H ARG 90 H ARG 90 -13.771 -4.836 -11.657 702 HA ARG 90 HA ARG 90 -16.099 -6.565 -12.051 703 HB2 ARG 90 HB2 ARG 90 -15.133 -5.135 -9.541 704 HB3 ARG 90 HB3 ARG 90 -16.317 -6.442 -9.613 705 HG2 ARG 90 HG2 ARG 90 -13.343 -6.624 -10.169 706 HG3 ARG 90 HG3 ARG 90 -14.239 -7.342 -8.843 707 HD2 ARG 90 HD2 ARG 90 -14.371 -8.082 -11.787 708 HD3 ARG 90 HD3 ARG 90 -13.627 -9.028 -10.504 709 HE ARG 90 HE ARG 90 -16.435 -8.917 -11.233 710 HH11 ARG 90 HH11 ARG 90 -14.309 -9.717 -8.554 711 HH12 ARG 90 HH12 ARG 90 -15.536 -10.655 -7.743 712 HH21 ARG 90 HH21 ARG 90 -17.958 -10.108 -10.121 713 HH22 ARG 90 HH22 ARG 90 -17.535 -10.874 -8.613 714 H GLU 91 H GLU 91 -15.715 -3.175 -12.151 715 HA GLU 91 HA GLU 91 -17.117 -1.418 -12.245 716 HB2 GLU 91 HB2 GLU 91 -19.309 -3.393 -12.992 717 HB3 GLU 91 HB3 GLU 91 -19.311 -1.650 -13.253 718 HG2 GLU 91 HG2 GLU 91 -17.239 -1.944 -14.689 719 HG3 GLU 91 HG3 GLU 91 -17.499 -3.690 -14.592 720 H LEU 92 H LEU 92 -16.696 -2.685 -9.702 721 HA LEU 92 HA LEU 92 -19.217 -2.558 -8.188 722 HB2 LEU 92 HB2 LEU 92 -16.298 -2.938 -7.415 723 HB3 LEU 92 HB3 LEU 92 -17.592 -2.829 -6.223 724 HG LEU 92 HG LEU 92 -17.546 -4.888 -8.469 725 HD11 LEU 92 HD11 LEU 92 -15.635 -5.208 -6.945 726 HD12 LEU 92 HD12 LEU 92 -16.758 -5.276 -5.564 727 HD13 LEU 92 HD13 LEU 92 -16.813 -6.519 -6.842 728 HD21 LEU 92 HD21 LEU 92 -19.096 -5.933 -6.440 729 HD22 LEU 92 HD22 LEU 92 -19.513 -4.217 -6.356 730 HD23 LEU 92 HD23 LEU 92 -19.708 -5.107 -7.877 731 H ASP 93 H ASP 93 -20.058 -0.825 -7.249 732 HA ASP 93 HA ASP 93 -18.806 1.801 -7.454 733 HB2 ASP 93 HB2 ASP 93 -20.861 2.317 -5.822 734 HB3 ASP 93 HB3 ASP 93 -20.972 2.216 -7.567 735 H LEU 94 H LEU 94 -18.310 3.212 -5.734 736 HA LEU 94 HA LEU 94 -16.872 1.854 -3.511 737 HB2 LEU 94 HB2 LEU 94 -16.656 4.582 -4.838 738 HB3 LEU 94 HB3 LEU 94 -15.833 4.210 -3.328 739 HG LEU 94 HG LEU 94 -15.417 2.640 -5.915 740 HD11 LEU 94 HD11 LEU 94 -14.575 4.952 -6.104 741 HD12 LEU 94 HD12 LEU 94 -13.662 4.752 -4.591 742 HD13 LEU 94 HD13 LEU 94 -13.247 3.787 -6.025 743 HD21 LEU 94 HD21 LEU 94 -14.075 2.583 -3.181 744 HD22 LEU 94 HD22 LEU 94 -14.861 1.232 -4.034 745 HD23 LEU 94 HD23 LEU 94 -13.348 1.894 -4.636 746 H MET 95 H MET 95 -16.920 2.633 -1.367 747 HA MET 95 HA MET 95 -19.577 3.463 -0.486 748 HB2 MET 95 HB2 MET 95 -17.964 1.879 0.758 749 HB3 MET 95 HB3 MET 95 -17.087 3.332 1.254 750 HG2 MET 95 HG2 MET 95 -19.329 4.225 2.113 751 HG3 MET 95 HG3 MET 95 -20.017 2.645 1.762 752 HE1 MET 95 HE1 MET 95 -19.249 0.385 3.096 753 HE2 MET 95 HE2 MET 95 -17.536 0.721 2.752 754 HE3 MET 95 HE3 MET 95 -18.053 0.407 4.416 755 H ARG 96 H ARG 96 -20.197 5.433 0.243 756 HA ARG 96 HA ARG 96 -18.318 7.715 -0.069 757 HB2 ARG 96 HB2 ARG 96 -20.305 9.111 -0.621 758 HB3 ARG 96 HB3 ARG 96 -19.927 7.908 -1.816 759 HG2 ARG 96 HG2 ARG 96 -21.974 7.194 0.285 760 HG3 ARG 96 HG3 ARG 96 -22.403 8.376 -0.947 761 HD2 ARG 96 HD2 ARG 96 -21.857 6.817 -2.748 762 HD3 ARG 96 HD3 ARG 96 -21.373 5.580 -1.605 763 HE ARG 96 HE ARG 96 -24.109 6.555 -2.187 764 HH11 ARG 96 HH11 ARG 96 -22.352 4.619 0.181 765 HH12 ARG 96 HH12 ARG 96 -23.791 3.765 0.652 766 HH21 ARG 96 HH21 ARG 96 -25.860 5.350 -1.561 767 HH22 ARG 96 HH22 ARG 96 -25.699 4.161 -0.302 768 H VAL 97 H VAL 97 -18.723 9.622 1.113 769 HA VAL 97 HA VAL 97 -19.762 9.152 3.895 770 HB VAL 97 HB VAL 97 -18.366 11.064 4.582 771 HG11 VAL 97 HG11 VAL 97 -17.583 8.662 4.722 772 HG12 VAL 97 HG12 VAL 97 -16.694 8.942 3.209 773 HG13 VAL 97 HG13 VAL 97 -16.289 9.871 4.662 774 HG21 VAL 97 HG21 VAL 97 -16.970 10.879 1.906 775 HG22 VAL 97 HG22 VAL 97 -18.107 12.183 2.331 776 HG23 VAL 97 HG23 VAL 97 -16.608 11.967 3.246 777 H ASP 98 H ASP 98 -20.278 11.153 1.078 778 HA ASP 98 HA ASP 98 -21.855 13.110 2.651 779 HB2 ASP 98 HB2 ASP 98 -20.012 13.710 0.999 780 HB3 ASP 98 HB3 ASP 98 -21.103 13.220 -0.280 781 H ASN 99 H ASN 99 -22.646 10.240 1.460 782 HA ASN 99 HA ASN 99 -24.577 9.182 0.966 783 HB2 ASN 99 HB2 ASN 99 -26.214 11.656 1.547 784 HB3 ASN 99 HB3 ASN 99 -26.622 9.957 1.825 785 HD21 ASN 99 HD22 ASN 99 -24.570 8.928 3.194 786 HD22 ASN 99 HD21 ASN 99 -23.726 10.062 4.175 787 H LEU 100 H LEU 100 -23.110 10.782 -0.910 788 HA LEU 100 HA LEU 100 -24.640 11.485 -3.225 789 HB2 LEU 100 HB2 LEU 100 -21.900 10.224 -2.842 790 HB3 LEU 100 HB3 LEU 100 -22.465 10.662 -4.431 791 HG LEU 100 HG LEU 100 -22.228 12.661 -2.147 792 HD11 LEU 100 HD11 LEU 100 -20.019 11.742 -2.773 793 HD12 LEU 100 HD12 LEU 100 -20.334 12.136 -4.474 794 HD13 LEU 100 HD13 LEU 100 -20.182 13.432 -3.268 795 HD21 LEU 100 HD21 LEU 100 -22.596 13.052 -5.150 796 HD22 LEU 100 HD22 LEU 100 -23.810 13.388 -3.896 797 HD23 LEU 100 HD23 LEU 100 -22.331 14.345 -3.959 798 HA PRO 101 HA PRO 101 -26.228 7.608 -4.783 799 HB2 PRO 101 HB2 PRO 101 -25.946 7.837 -7.508 800 HB3 PRO 101 HB3 PRO 101 -27.155 8.751 -6.557 801 HG2 PRO 101 HG2 PRO 101 -24.446 9.694 -7.525 802 HG3 PRO 101 HG3 PRO 101 -26.018 10.552 -7.609 803 HD2 PRO 101 HD2 PRO 101 -24.179 11.042 -5.654 804 HD3 PRO 101 HD3 PRO 101 -25.920 11.125 -5.313 805 H ASN 102 H ASN 102 -25.446 5.515 -5.292 806 HA ASN 102 HA ASN 102 -22.579 5.084 -5.228 807 HB2 ASN 102 HB2 ASN 102 -24.967 3.262 -5.741 808 HB3 ASN 102 HB3 ASN 102 -23.311 2.691 -5.832 809 HD21 ASN 102 HD22 ASN 102 -21.924 3.623 -3.696 810 HD22 ASN 102 HD21 ASN 102 -22.773 3.149 -2.245 811 H ILE 103 H ILE 103 -21.189 5.238 -6.803 812 HA ILE 103 HA ILE 103 -21.854 4.694 -9.643 813 HB ILE 103 HB ILE 103 -20.714 6.835 -10.268 814 HG12 ILE 103 HG12 ILE 103 -21.178 7.574 -7.347 815 HG13 ILE 103 HG13 ILE 103 -19.647 7.446 -8.172 816 HG21 ILE 103 HG21 ILE 103 -23.208 6.391 -10.333 817 HG22 ILE 103 HG22 ILE 103 -23.336 7.246 -8.780 818 HG23 ILE 103 HG23 ILE 103 -22.766 8.093 -10.225 819 HD11 ILE 103 HD11 ILE 103 -20.342 9.370 -9.650 820 HD12 ILE 103 HD12 ILE 103 -21.837 9.505 -8.687 821 HD13 ILE 103 HD13 ILE 103 -20.286 9.790 -7.920 822 H LYS 104 H LYS 104 -20.269 3.865 -10.792 823 HA LYS 104 HA LYS 104 -17.652 3.249 -9.462 824 HB2 LYS 104 HB2 LYS 104 -17.533 1.304 -10.807 825 HB3 LYS 104 HB3 LYS 104 -19.102 1.368 -10.050 826 HG2 LYS 104 HG2 LYS 104 -19.538 0.557 -12.169 827 HG3 LYS 104 HG3 LYS 104 -20.046 2.239 -12.283 828 HD2 LYS 104 HD2 LYS 104 -18.109 2.815 -13.576 829 HD3 LYS 104 HD3 LYS 104 -17.282 1.293 -13.152 830 HE2 LYS 104 HE2 LYS 104 -19.166 0.102 -14.411 831 HE3 LYS 104 HE3 LYS 104 -19.670 1.687 -14.999 832 HZ1 LYS 104 HZ1 LYS 104 -17.485 1.937 -16.038 833 HZ2 LYS 104 HZ2 LYS 104 -16.956 0.524 -15.411 834 HZ3 LYS 104 HZ3 LYS 104 -18.144 0.510 -16.524 835 H ILE 105 H ILE 105 -15.874 2.891 -11.182 836 HA ILE 105 HA ILE 105 -15.213 5.466 -12.307 837 HB ILE 105 HB ILE 105 -13.872 2.796 -12.783 838 HG12 ILE 105 HG12 ILE 105 -12.379 4.359 -10.910 839 HG13 ILE 105 HG13 ILE 105 -14.027 4.370 -10.323 840 HG21 ILE 105 HG21 ILE 105 -13.146 4.505 -14.382 841 HG22 ILE 105 HG22 ILE 105 -12.884 5.670 -13.070 842 HG23 ILE 105 HG23 ILE 105 -11.860 4.223 -13.213 843 HD11 ILE 105 HD11 ILE 105 -14.037 1.834 -10.539 844 HD12 ILE 105 HD12 ILE 105 -12.317 1.932 -10.982 845 HD13 ILE 105 HD13 ILE 105 -12.856 2.470 -9.376 846 H ALA 106 H ALA 106 -16.258 6.278 -14.005 847 HA ALA 106 HA ALA 106 -17.710 4.697 -15.937 848 HB1 ALA 106 HB1 ALA 106 -18.401 6.918 -15.095 849 HB2 ALA 106 HB2 ALA 106 -17.013 7.673 -15.896 850 HB3 ALA 106 HB3 ALA 106 -18.281 6.894 -16.865 851 H THR 107 H THR 107 -14.656 6.533 -16.025 852 HA THR 107 HA THR 107 -13.655 4.860 -18.233 853 HB THR 107 HB THR 107 -12.664 6.907 -19.370 854 HG1 THR 107 HG1 THR 107 -14.817 8.213 -18.100 855 HG21 THR 107 HG21 THR 107 -14.533 5.614 -20.371 856 HG22 THR 107 HG22 THR 107 -15.690 6.714 -19.589 857 HG23 THR 107 HG23 THR 107 -14.548 7.333 -20.801 858 H ARG 108 H ARG 108 -11.413 4.865 -18.442 859 HA ARG 108 HA ARG 108 -9.802 6.159 -16.309 860 HB2 ARG 108 HB2 ARG 108 -10.122 4.027 -15.396 861 HB3 ARG 108 HB3 ARG 108 -9.997 3.214 -16.960 862 HG2 ARG 108 HG2 ARG 108 -7.634 3.498 -17.069 863 HG3 ARG 108 HG3 ARG 108 -7.616 4.629 -15.695 864 HD2 ARG 108 HD2 ARG 108 -7.885 2.998 -14.135 865 HD3 ARG 108 HD3 ARG 108 -8.790 1.928 -15.232 866 HE ARG 108 HE ARG 108 -5.953 2.252 -15.913 867 HH11 ARG 108 HH11 ARG 108 -8.200 0.234 -14.068 868 HH12 ARG 108 HH12 ARG 108 -6.975 -1.044 -13.971 869 HH21 ARG 108 HH21 ARG 108 -4.570 0.464 -15.705 870 HH22 ARG 108 HH22 ARG 108 -5.170 -0.926 -14.788 871 H LYS 109 H LYS 109 -7.862 6.881 -16.888 872 HA LYS 109 HA LYS 109 -6.636 6.160 -19.519 873 HB2 LYS 109 HB2 LYS 109 -7.444 8.962 -18.628 874 HB3 LYS 109 HB3 LYS 109 -6.158 8.658 -19.805 875 HG2 LYS 109 HG2 LYS 109 -7.765 7.393 -21.235 876 HG3 LYS 109 HG3 LYS 109 -9.060 7.751 -20.087 877 HD2 LYS 109 HD2 LYS 109 -9.162 9.213 -22.028 878 HD3 LYS 109 HD3 LYS 109 -8.883 10.144 -20.547 879 HE2 LYS 109 HE2 LYS 109 -6.537 10.427 -21.074 880 HE3 LYS 109 HE3 LYS 109 -6.633 9.268 -22.406 881 HZ1 LYS 109 HZ1 LYS 109 -8.051 10.815 -23.602 882 HZ2 LYS 109 HZ2 LYS 109 -8.074 11.870 -22.354 883 HZ3 LYS 109 HZ3 LYS 109 -6.688 11.599 -23.172 884 H TYR 110 H TYR 110 -4.507 5.826 -19.306 885 HA TYR 110 HA TYR 110 -3.142 6.239 -16.794 886 HB2 TYR 110 HB2 TYR 110 -2.541 4.434 -18.405 887 HB3 TYR 110 HB3 TYR 110 -2.011 5.644 -19.557 888 HD1 TYR 110 HD1 TYR 110 -1.443 5.376 -15.818 889 HD2 TYR 110 HD2 TYR 110 0.336 5.370 -19.755 890 HE1 TYR 110 HE1 TYR 110 0.807 5.421 -14.809 891 HE2 TYR 110 HE2 TYR 110 2.599 5.322 -18.717 892 HH TYR 110 HH TYR 110 3.789 5.241 -16.766 893 H LEU 111 H LEU 111 -2.259 8.066 -16.027 894 HA LEU 111 HA LEU 111 -2.086 10.468 -17.768 895 HB2 LEU 111 HB2 LEU 111 -1.652 9.989 -14.783 896 HB3 LEU 111 HB3 LEU 111 -1.508 11.558 -15.574 897 HG LEU 111 HG LEU 111 -4.050 9.918 -15.639 898 HD11 LEU 111 HD11 LEU 111 -3.440 10.505 -13.329 899 HD12 LEU 111 HD12 LEU 111 -3.313 12.217 -13.796 900 HD13 LEU 111 HD13 LEU 111 -4.880 11.359 -13.869 901 HD21 LEU 111 HD21 LEU 111 -3.384 12.831 -16.289 902 HD22 LEU 111 HD22 LEU 111 -3.957 11.586 -17.425 903 HD23 LEU 111 HD23 LEU 111 -5.035 12.202 -16.177 904 H GLY 112 H GLY 112 0.004 8.341 -15.866 905 HA2 GLY 112 HA2 GLY 112 2.339 8.155 -17.054 906 HA3 GLY 112 HA3 GLY 112 2.429 9.873 -16.669 907 H LYS 113 H LYS 113 4.014 9.835 -15.247 908 HA LYS 113 HA LYS 113 3.884 8.042 -12.856 909 HB2 LYS 113 HB2 LYS 113 5.499 7.455 -14.758 910 HB3 LYS 113 HB3 LYS 113 6.427 8.861 -14.209 911 HG2 LYS 113 HG2 LYS 113 6.426 7.876 -11.887 912 HG3 LYS 113 HG3 LYS 113 5.674 6.419 -12.538 913 HD2 LYS 113 HD2 LYS 113 8.360 7.541 -13.459 914 HD3 LYS 113 HD3 LYS 113 8.173 6.276 -12.234 915 HE2 LYS 113 HE2 LYS 113 7.065 4.799 -13.852 916 HE3 LYS 113 HE3 LYS 113 7.136 6.056 -15.096 917 HZ1 LYS 113 HZ1 LYS 113 9.555 5.935 -15.018 918 HZ2 LYS 113 HZ2 LYS 113 9.519 4.804 -13.837 919 HZ3 LYS 113 HZ3 LYS 113 8.950 4.451 -15.326 920 H GLN 114 H GLN 114 2.867 9.706 -11.817 921 HA GLN 114 HA GLN 114 4.206 12.229 -11.283 922 HB2 GLN 114 HB2 GLN 114 1.510 11.380 -10.236 923 HB3 GLN 114 HB3 GLN 114 2.142 13.006 -10.575 924 HG2 GLN 114 HG2 GLN 114 2.486 12.189 -12.997 925 HG3 GLN 114 HG3 GLN 114 1.463 10.809 -12.572 926 HE21 GLN 114 HE22 GLN 114 0.898 12.195 -14.655 927 HE22 GLN 114 HE21 GLN 114 -0.474 13.196 -14.349 928 H ASN 115 H ASN 115 4.476 13.091 -9.080 929 HA ASN 115 HA ASN 115 5.402 11.304 -7.118 930 HB2 ASN 115 HB2 ASN 115 5.860 13.887 -7.648 931 HB3 ASN 115 HB3 ASN 115 4.529 14.137 -6.507 932 HD21 ASN 115 HD22 ASN 115 5.082 11.932 -4.696 933 HD22 ASN 115 HD21 ASN 115 6.673 12.178 -4.077 934 H VAL 116 H VAL 116 4.241 9.993 -5.896 935 HA VAL 116 HA VAL 116 1.555 10.894 -4.957 936 HB VAL 116 HB VAL 116 0.928 8.492 -4.917 937 HG11 VAL 116 HG11 VAL 116 0.198 9.992 -6.740 938 HG12 VAL 116 HG12 VAL 116 1.617 9.509 -7.686 939 HG13 VAL 116 HG13 VAL 116 0.375 8.313 -7.241 940 HG21 VAL 116 HG21 VAL 116 3.389 8.090 -6.689 941 HG22 VAL 116 HG22 VAL 116 3.170 7.462 -5.042 942 HG23 VAL 116 HG23 VAL 116 2.121 6.902 -6.343 943 H TYR 117 H TYR 117 0.864 10.301 -2.959 944 HA TYR 117 HA TYR 117 2.968 9.722 -0.917 945 HB2 TYR 117 HB2 TYR 117 0.927 11.952 -0.728 946 HB3 TYR 117 HB3 TYR 117 2.349 11.690 0.253 947 HD1 TYR 117 HD2 TYR 117 1.090 12.893 -3.006 948 HD2 TYR 117 HD1 TYR 117 4.541 12.538 -0.447 949 HE1 TYR 117 HE2 TYR 117 2.313 14.560 -4.403 950 HE2 TYR 117 HE1 TYR 117 5.719 14.271 -1.777 951 HH TYR 117 HH TYR 117 5.579 15.722 -3.537 952 H ASP 118 H ASP 118 2.113 9.210 1.212 953 HA ASP 118 HA ASP 118 -0.726 8.714 1.579 954 HB2 ASP 118 HB2 ASP 118 -0.599 6.359 1.986 955 HB3 ASP 118 HB3 ASP 118 -0.134 6.697 0.333 956 H ILE 119 H ILE 119 -1.166 9.280 3.616 957 HA ILE 119 HA ILE 119 0.981 9.704 5.556 958 HB ILE 119 HB ILE 119 -0.845 10.411 7.059 959 HG12 ILE 119 HG12 ILE 119 -2.719 10.007 4.684 960 HG13 ILE 119 HG13 ILE 119 -2.633 8.919 6.075 961 HG21 ILE 119 HG21 ILE 119 0.372 11.964 5.594 962 HG22 ILE 119 HG22 ILE 119 -0.804 11.707 4.294 963 HG23 ILE 119 HG23 ILE 119 -1.295 12.498 5.811 964 HD11 ILE 119 HD11 ILE 119 -3.245 10.810 7.578 965 HD12 ILE 119 HD12 ILE 119 -3.465 11.838 6.136 966 HD13 ILE 119 HD13 ILE 119 -4.483 10.405 6.370 967 H GLY 120 H GLY 120 1.057 8.796 7.674 968 HA2 GLY 120 HA2 GLY 120 0.225 5.926 7.789 969 HA3 GLY 120 HA3 GLY 120 1.596 6.632 8.641 970 H VAL 121 H VAL 121 -0.688 5.127 9.627 971 HA VAL 121 HA VAL 121 -1.777 6.813 11.794 972 HB VAL 121 HB VAL 121 -4.095 5.751 11.093 973 HG11 VAL 121 HG11 VAL 121 -3.736 8.147 11.362 974 HG12 VAL 121 HG12 VAL 121 -3.057 8.252 9.719 975 HG13 VAL 121 HG13 VAL 121 -4.756 7.802 9.959 976 HG21 VAL 121 HG21 VAL 121 -2.892 6.176 8.312 977 HG22 VAL 121 HG22 VAL 121 -3.193 4.583 9.050 978 HG23 VAL 121 HG23 VAL 121 -4.544 5.685 8.712 979 H GLU 122 H GLU 122 -2.715 5.542 13.489 980 HA GLU 122 HA GLU 122 -1.437 2.856 13.614 981 HB2 GLU 122 HB2 GLU 122 -2.484 4.782 15.715 982 HB3 GLU 122 HB3 GLU 122 -1.842 3.189 16.097 983 HG2 GLU 122 HG2 GLU 122 -0.242 5.335 14.638 984 HG3 GLU 122 HG3 GLU 122 -0.228 5.102 16.381 985 H ARG 123 H ARG 123 -4.703 4.237 13.959 986 HA ARG 123 HA ARG 123 -5.853 1.922 15.268 987 HB2 ARG 123 HB2 ARG 123 -6.679 4.278 15.419 988 HB3 ARG 123 HB3 ARG 123 -7.206 4.180 13.732 989 HG2 ARG 123 HG2 ARG 123 -8.841 2.484 14.246 990 HG3 ARG 123 HG3 ARG 123 -8.203 2.288 15.895 991 HD2 ARG 123 HD2 ARG 123 -8.863 4.614 16.438 992 HD3 ARG 123 HD3 ARG 123 -9.431 4.849 14.798 993 HE ARG 123 HE ARG 123 -11.346 3.544 15.221 994 HH11 ARG 123 HH11 ARG 123 -9.279 3.392 18.073 995 HH12 ARG 123 HH12 ARG 123 -10.522 2.596 19.005 996 HH21 ARG 123 HH21 ARG 123 -12.793 2.544 16.409 997 HH22 ARG 123 HH22 ARG 123 -12.487 2.121 18.093 998 H ASP 124 H ASP 124 -6.021 3.105 11.954 999 HA ASP 124 HA ASP 124 -5.940 0.527 10.725 1000 HB2 ASP 124 HB2 ASP 124 -8.107 0.775 9.465 1001 HB3 ASP 124 HB3 ASP 124 -8.246 0.297 11.137 1002 H HIS 125 H HIS 125 -5.950 0.774 8.309 1003 HA HIS 125 HA HIS 125 -4.418 3.242 7.678 1004 HB2 HIS 125 HB2 HIS 125 -4.370 0.536 6.328 1005 HB3 HIS 125 HB3 HIS 125 -3.299 1.908 6.028 1006 HD1 HIS 125 HD1 HIS 125 -3.444 -1.189 8.048 1007 HD2 HIS 125 HD2 HIS 125 -1.598 2.594 8.174 1008 HE1 HIS 125 HE1 HIS 125 -1.461 -1.416 9.634 1009 H ASN 126 H ASN 126 -6.862 4.054 7.476 1010 HA ASN 126 HA ASN 126 -7.294 4.471 4.633 1011 HB2 ASN 126 HB2 ASN 126 -9.609 3.623 4.580 1012 HB3 ASN 126 HB3 ASN 126 -8.470 2.345 4.957 1013 HD21 ASN 126 HD22 ASN 126 -11.283 4.011 6.044 1014 HD22 ASN 126 HD21 ASN 126 -11.410 3.173 7.569 1015 H PHE 127 H PHE 127 -8.907 6.074 4.088 1016 HA PHE 127 HA PHE 127 -9.933 7.900 6.117 1017 HB2 PHE 127 HB2 PHE 127 -8.483 9.829 5.299 1018 HB3 PHE 127 HB3 PHE 127 -7.737 8.669 6.367 1019 HD1 PHE 127 HD2 PHE 127 -8.067 9.429 2.672 1020 HD2 PHE 127 HD1 PHE 127 -5.646 7.766 5.833 1021 HE1 PHE 127 HE2 PHE 127 -6.197 9.103 1.075 1022 HE2 PHE 127 HE1 PHE 127 -3.776 7.454 4.233 1023 HZ PHE 127 HZ PHE 127 -4.045 8.126 1.858 1024 H ALA 128 H ALA 128 -11.017 9.793 5.183 1025 HA ALA 128 HA ALA 128 -12.258 9.135 2.601 1026 HB1 ALA 128 HB1 ALA 128 -13.695 9.586 4.530 1027 HB2 ALA 128 HB2 ALA 128 -12.991 11.214 4.689 1028 HB3 ALA 128 HB3 ALA 128 -13.950 10.792 3.252 1029 H LEU 129 H LEU 129 -12.517 10.499 0.890 1030 HA LEU 129 HA LEU 129 -10.353 12.495 0.410 1031 HB2 LEU 129 HB2 LEU 129 -12.358 11.235 -1.511 1032 HB3 LEU 129 HB3 LEU 129 -10.897 12.135 -1.921 1033 HG LEU 129 HG LEU 129 -10.925 9.377 -0.596 1034 HD11 LEU 129 HD11 LEU 129 -11.833 9.383 -2.909 1035 HD12 LEU 129 HD12 LEU 129 -10.352 10.190 -3.477 1036 HD13 LEU 129 HD13 LEU 129 -10.280 8.551 -2.788 1037 HD21 LEU 129 HD21 LEU 129 -8.522 9.397 -1.418 1038 HD22 LEU 129 HD22 LEU 129 -8.716 11.148 -1.664 1039 HD23 LEU 129 HD23 LEU 129 -8.884 10.445 -0.037 1040 H LYS 130 H LYS 130 -10.824 14.419 -0.930 1041 HA LYS 130 HA LYS 130 -13.033 16.012 -0.154 1042 HB2 LYS 130 HB2 LYS 130 -12.412 17.537 -1.916 1043 HB3 LYS 130 HB3 LYS 130 -10.975 16.948 -1.097 1044 HG2 LYS 130 HG2 LYS 130 -10.291 15.635 -2.962 1045 HG3 LYS 130 HG3 LYS 130 -11.888 15.702 -3.714 1046 HD2 LYS 130 HD2 LYS 130 -11.673 18.092 -4.146 1047 HD3 LYS 130 HD3 LYS 130 -10.072 18.103 -3.400 1048 HE2 LYS 130 HE2 LYS 130 -9.319 16.402 -5.113 1049 HE3 LYS 130 HE3 LYS 130 -10.915 16.524 -5.866 1050 HZ1 LYS 130 HZ1 LYS 130 -10.434 18.958 -6.157 1051 HZ2 LYS 130 HZ2 LYS 130 -8.898 18.700 -5.646 1052 HZ3 LYS 130 HZ3 LYS 130 -9.434 17.992 -7.016 1053 H ASN 131 H ASN 131 -12.894 13.763 -2.852 1054 HA ASN 131 HA ASN 131 -15.331 14.721 -4.102 1055 HB2 ASN 131 HB2 ASN 131 -13.796 12.099 -4.424 1056 HB3 ASN 131 HB3 ASN 131 -15.089 12.665 -5.486 1057 HD21 ASN 131 HD22 ASN 131 -14.713 14.723 -6.710 1058 HD22 ASN 131 HD21 ASN 131 -13.042 15.090 -7.127 1059 H GLY 132 H GLY 132 -14.833 12.849 -1.297 1060 HA2 GLY 132 HA2 GLY 132 -16.551 12.410 0.191 1061 HA3 GLY 132 HA3 GLY 132 -17.739 12.274 -1.095 1062 H PHE 133 H PHE 133 -14.645 10.450 -1.028 1063 HA PHE 133 HA PHE 133 -16.139 7.919 -0.456 1064 HB2 PHE 133 HB2 PHE 133 -13.961 8.236 -2.548 1065 HB3 PHE 133 HB3 PHE 133 -14.901 6.790 -2.210 1066 HD1 PHE 133 HD1 PHE 133 -17.355 6.715 -2.792 1067 HD2 PHE 133 HD2 PHE 133 -14.786 9.967 -3.974 1068 HE1 PHE 133 HE1 PHE 133 -19.092 7.492 -4.390 1069 HE2 PHE 133 HE2 PHE 133 -16.541 10.757 -5.571 1070 HZ PHE 133 HZ PHE 133 -18.698 9.536 -5.751 1071 H ILE 134 H ILE 134 -14.628 6.082 0.156 1072 HA ILE 134 HA ILE 134 -12.367 7.123 1.826 1073 HB ILE 134 HB ILE 134 -13.962 4.591 2.211 1074 HG12 ILE 134 HG12 ILE 134 -14.609 5.668 4.424 1075 HG13 ILE 134 HG13 ILE 134 -14.122 7.211 3.719 1076 HG21 ILE 134 HG21 ILE 134 -11.683 4.236 2.990 1077 HG22 ILE 134 HG22 ILE 134 -11.751 5.759 3.923 1078 HG23 ILE 134 HG23 ILE 134 -12.775 4.377 4.354 1079 HD11 ILE 134 HD11 ILE 134 -15.928 7.075 2.105 1080 HD12 ILE 134 HD12 ILE 134 -16.188 5.345 2.449 1081 HD13 ILE 134 HD13 ILE 134 -16.608 6.564 3.657 1082 H ALA 135 H ALA 135 -10.373 6.314 1.656 1083 HA ALA 135 HA ALA 135 -9.812 4.133 -0.299 1084 HB1 ALA 135 HB1 ALA 135 -9.408 6.520 -1.128 1085 HB2 ALA 135 HB2 ALA 135 -8.113 6.619 0.082 1086 HB3 ALA 135 HB3 ALA 135 -8.046 5.410 -1.228 1087 H SER 136 H SER 136 -7.846 2.892 0.165 1088 HA SER 136 HA SER 136 -6.869 3.041 2.970 1089 HB2 SER 136 HB2 SER 136 -8.767 1.490 2.951 1090 HB3 SER 136 HB3 SER 136 -8.075 0.598 1.611 1091 HG SER 136 HG SER 136 -6.730 0.966 4.102 1092 H ASN 137 H ASN 137 -4.798 2.295 3.327 1093 HA ASN 137 HA ASN 137 -3.011 2.873 1.306 1094 HB2 ASN 137 HB2 ASN 137 -1.295 2.496 2.766 1095 HB3 ASN 137 HB3 ASN 137 -2.619 2.853 3.850 1096 HD21 ASN 137 HD22 ASN 137 0.005 1.308 4.114 1097 HD22 ASN 137 HD21 ASN 137 -0.501 -0.216 4.827 Start of MODEL 5 1 H1 GLY -1 H GLY -1 2.297 -0.324 0.259 2 HA2 GLY -1 HA2 GLY -1 1.839 -1.083 -1.956 3 HA3 GLY -1 HA3 GLY -1 0.387 -0.422 -1.211 4 H GLY 0 H GLY 0 0.017 1.922 -1.658 5 HA2 GLY 0 HA2 GLY 0 0.586 2.848 -4.391 6 HA3 GLY 0 HA3 GLY 0 -1.063 2.423 -3.957 7 H ALA 1 H ALA 1 -0.817 4.988 -4.659 8 HA ALA 1 HA ALA 1 -1.250 6.557 -2.226 9 HB1 ALA 1 HB1 ALA 1 1.144 6.510 -2.083 10 HB2 ALA 1 HB2 ALA 1 1.322 6.789 -3.829 11 HB3 ALA 1 HB3 ALA 1 0.726 8.071 -2.768 12 H LEU 2 H LEU 2 -1.431 8.958 -2.770 13 HA LEU 2 HA LEU 2 -3.119 9.204 -5.236 14 HB2 LEU 2 HB2 LEU 2 -3.135 10.809 -2.657 15 HB3 LEU 2 HB3 LEU 2 -4.191 11.023 -4.032 16 HG LEU 2 HG LEU 2 -5.548 10.037 -2.492 17 HD11 LEU 2 HD11 LEU 2 -5.731 8.878 -4.634 18 HD12 LEU 2 HD12 LEU 2 -4.554 7.662 -4.090 19 HD13 LEU 2 HD13 LEU 2 -6.118 7.808 -3.273 20 HD21 LEU 2 HD21 LEU 2 -3.421 8.065 -1.699 21 HD22 LEU 2 HD22 LEU 2 -3.940 9.507 -0.807 22 HD23 LEU 2 HD23 LEU 2 -5.073 8.180 -1.065 23 H SER 3 H SER 3 -3.050 11.145 -6.441 24 HA SER 3 HA SER 3 -0.453 12.407 -6.775 25 HB2 SER 3 HB2 SER 3 -2.231 12.146 -8.546 26 HB3 SER 3 HB3 SER 3 -3.163 13.403 -7.704 27 HG SER 3 HG SER 3 -0.903 13.612 -9.288 28 H TYR 4 H TYR 4 -0.054 14.755 -6.594 29 HA TYR 4 HA TYR 4 -0.420 15.877 -4.006 30 HB2 TYR 4 HB2 TYR 4 1.305 16.560 -5.619 31 HB3 TYR 4 HB3 TYR 4 0.094 17.227 -6.690 32 HD1 TYR 4 HD1 TYR 4 -1.184 19.286 -6.061 33 HD2 TYR 4 HD2 TYR 4 2.097 17.809 -3.683 34 HE1 TYR 4 HE1 TYR 4 -1.064 21.466 -4.873 35 HE2 TYR 4 HE2 TYR 4 2.224 19.992 -2.495 36 HH TYR 4 HH TYR 4 1.368 22.106 -2.323 37 H GLU 5 H GLU 5 -2.228 16.391 -7.011 38 HA GLU 5 HA GLU 5 -3.972 18.467 -6.229 39 HB2 GLU 5 HB2 GLU 5 -4.447 16.161 -8.160 40 HB3 GLU 5 HB3 GLU 5 -5.364 17.664 -8.147 41 HG2 GLU 5 HG2 GLU 5 -2.350 17.655 -8.595 42 HG3 GLU 5 HG3 GLU 5 -3.493 17.307 -9.872 43 H THR 6 H THR 6 -4.098 15.107 -5.399 44 HA THR 6 HA THR 6 -6.927 14.868 -4.870 45 HB THR 6 HB THR 6 -4.617 13.263 -3.742 46 HG1 THR 6 HG1 THR 6 -6.403 12.832 -5.905 47 HG21 THR 6 HG21 THR 6 -7.614 12.980 -3.518 48 HG22 THR 6 HG22 THR 6 -6.620 11.527 -3.677 49 HG23 THR 6 HG23 THR 6 -6.329 12.640 -2.326 50 H GLU 7 H GLU 7 -8.041 15.994 -3.378 51 HA GLU 7 HA GLU 7 -6.603 17.112 -1.058 52 HB2 GLU 7 HB2 GLU 7 -9.460 17.627 -1.899 53 HB3 GLU 7 HB3 GLU 7 -8.517 18.510 -0.702 54 HG2 GLU 7 HG2 GLU 7 -6.853 19.093 -2.541 55 HG3 GLU 7 HG3 GLU 7 -7.994 18.410 -3.700 56 H ILE 8 H ILE 8 -7.001 16.762 1.008 57 HA ILE 8 HA ILE 8 -8.823 14.532 1.830 58 HB ILE 8 HB ILE 8 -6.210 15.421 3.115 59 HG12 ILE 8 HG12 ILE 8 -5.552 14.478 1.060 60 HG13 ILE 8 HG13 ILE 8 -5.223 13.302 2.322 61 HG21 ILE 8 HG21 ILE 8 -7.698 14.403 4.734 62 HG22 ILE 8 HG22 ILE 8 -8.011 13.024 3.662 63 HG23 ILE 8 HG23 ILE 8 -6.399 13.271 4.365 64 HD11 ILE 8 HD11 ILE 8 -6.062 12.059 0.475 65 HD12 ILE 8 HD12 ILE 8 -7.427 12.143 1.605 66 HD13 ILE 8 HD13 ILE 8 -7.373 13.201 0.181 67 H LEU 9 H LEU 9 -10.417 15.184 3.090 68 HA LEU 9 HA LEU 9 -10.650 17.767 4.341 69 HB2 LEU 9 HB2 LEU 9 -12.536 16.209 3.690 70 HB3 LEU 9 HB3 LEU 9 -12.041 15.135 4.995 71 HG LEU 9 HG LEU 9 -12.473 17.067 6.608 72 HD11 LEU 9 HD11 LEU 9 -12.433 18.945 4.999 73 HD12 LEU 9 HD12 LEU 9 -13.873 18.279 4.195 74 HD13 LEU 9 HD13 LEU 9 -13.968 18.863 5.867 75 HD21 LEU 9 HD21 LEU 9 -14.820 16.066 4.940 76 HD22 LEU 9 HD22 LEU 9 -14.060 15.203 6.294 77 HD23 LEU 9 HD23 LEU 9 -14.913 16.723 6.593 78 H THR 10 H THR 10 -9.732 18.524 6.189 79 HA THR 10 HA THR 10 -8.916 16.627 8.350 80 HB THR 10 HB THR 10 -7.044 17.998 8.887 81 HG1 THR 10 HG1 THR 10 -6.673 19.684 7.080 82 HG21 THR 10 HG21 THR 10 -6.669 16.357 7.061 83 HG22 THR 10 HG22 THR 10 -6.988 17.634 5.867 84 HG23 THR 10 HG23 THR 10 -5.598 17.763 6.963 85 H VAL 11 H VAL 11 -8.991 17.396 10.509 86 HA VAL 11 HA VAL 11 -11.158 19.306 11.059 87 HB VAL 11 HB VAL 11 -9.263 17.990 13.021 88 HG11 VAL 11 HG11 VAL 11 -10.447 19.852 14.071 89 HG12 VAL 11 HG12 VAL 11 -11.999 19.262 13.430 90 HG13 VAL 11 HG13 VAL 11 -11.112 18.330 14.655 91 HG21 VAL 11 HG21 VAL 11 -12.045 17.083 12.150 92 HG22 VAL 11 HG22 VAL 11 -10.534 16.262 11.710 93 HG23 VAL 11 HG23 VAL 11 -11.038 16.324 13.399 94 H GLU 12 H GLU 12 -7.637 19.422 11.070 95 HA GLU 12 HA GLU 12 -7.323 21.850 12.573 96 HB2 GLU 12 HB2 GLU 12 -5.665 20.248 10.636 97 HB3 GLU 12 HB3 GLU 12 -5.104 21.865 11.069 98 HG2 GLU 12 HG2 GLU 12 -5.696 19.658 13.080 99 HG3 GLU 12 HG3 GLU 12 -4.098 20.085 12.467 100 H TYR 13 H TYR 13 -7.907 21.338 9.101 101 HA TYR 13 HA TYR 13 -8.113 24.314 8.738 102 HB2 TYR 13 HB2 TYR 13 -6.591 22.360 6.974 103 HB3 TYR 13 HB3 TYR 13 -6.892 24.047 6.592 104 HD1 TYR 13 HD1 TYR 13 -6.119 25.788 8.479 105 HD2 TYR 13 HD2 TYR 13 -4.460 21.841 7.877 106 HE1 TYR 13 HE1 TYR 13 -3.997 26.503 9.578 107 HE2 TYR 13 HE2 TYR 13 -2.349 22.563 8.960 108 HH TYR 13 HH TYR 13 -1.220 24.278 9.953 109 H GLY 14 H GLY 14 -8.779 21.111 7.223 110 HA2 GLY 14 HA2 GLY 14 -11.194 20.837 6.443 111 HA3 GLY 14 HA3 GLY 14 -10.972 22.379 5.619 112 H LEU 15 H LEU 15 -11.128 21.707 3.557 113 HA LEU 15 HA LEU 15 -9.890 19.358 2.398 114 HB2 LEU 15 HB2 LEU 15 -10.967 21.921 1.123 115 HB3 LEU 15 HB3 LEU 15 -10.660 20.403 0.288 116 HG LEU 15 HG LEU 15 -12.754 20.811 2.489 117 HD11 LEU 15 HD11 LEU 15 -13.357 22.038 0.494 118 HD12 LEU 15 HD12 LEU 15 -13.020 20.632 -0.529 119 HD13 LEU 15 HD13 LEU 15 -14.373 20.594 0.629 120 HD21 LEU 15 HD21 LEU 15 -12.067 18.453 0.714 121 HD22 LEU 15 HD22 LEU 15 -12.017 18.509 2.479 122 HD23 LEU 15 HD23 LEU 15 -13.579 18.583 1.652 123 H LEU 16 H LEU 16 -7.664 19.195 2.355 124 HA LEU 16 HA LEU 16 -6.154 21.312 0.906 125 HB2 LEU 16 HB2 LEU 16 -5.434 19.909 3.514 126 HB3 LEU 16 HB3 LEU 16 -4.229 20.717 2.526 127 HG LEU 16 HG LEU 16 -6.623 22.095 3.819 128 HD11 LEU 16 HD11 LEU 16 -4.943 21.341 5.421 129 HD12 LEU 16 HD12 LEU 16 -3.645 22.093 4.462 130 HD13 LEU 16 HD13 LEU 16 -4.873 23.108 5.245 131 HD21 LEU 16 HD21 LEU 16 -4.250 23.233 2.264 132 HD22 LEU 16 HD22 LEU 16 -5.954 23.277 1.759 133 HD23 LEU 16 HD23 LEU 16 -5.442 24.188 3.177 134 HA PRO 17 HA PRO 17 -4.455 18.018 -1.532 135 HB2 PRO 17 HB2 PRO 17 -1.960 19.009 -2.175 136 HB3 PRO 17 HB3 PRO 17 -3.496 19.599 -2.882 137 HG2 PRO 17 HG2 PRO 17 -1.917 20.773 -0.586 138 HG3 PRO 17 HG3 PRO 17 -2.616 21.622 -2.001 139 HD2 PRO 17 HD2 PRO 17 -3.872 21.575 0.395 140 HD3 PRO 17 HD3 PRO 17 -4.805 21.450 -1.124 141 H ILE 18 H ILE 18 -3.690 16.067 -0.958 142 HA ILE 18 HA ILE 18 -2.370 15.535 1.486 143 HB ILE 18 HB ILE 18 -3.695 13.905 0.209 144 HG12 ILE 18 HG12 ILE 18 -0.911 12.830 0.781 145 HG13 ILE 18 HG13 ILE 18 -2.047 13.321 2.047 146 HG21 ILE 18 HG21 ILE 18 -2.722 14.383 -2.067 147 HG22 ILE 18 HG22 ILE 18 -1.297 13.435 -1.590 148 HG23 ILE 18 HG23 ILE 18 -2.901 12.690 -1.651 149 HD11 ILE 18 HD11 ILE 18 -3.714 11.665 1.127 150 HD12 ILE 18 HD12 ILE 18 -2.442 11.084 0.033 151 HD13 ILE 18 HD13 ILE 18 -2.231 10.954 1.794 152 H GLY 19 H GLY 19 -0.947 16.158 -1.717 153 HA2 GLY 19 HA2 GLY 19 1.665 15.195 -1.087 154 HA3 GLY 19 HA3 GLY 19 1.266 16.349 -2.362 155 H LYS 20 H LYS 20 0.112 18.306 -0.351 156 HA LYS 20 HA LYS 20 2.614 19.620 0.417 157 HB2 LYS 20 HB2 LYS 20 0.501 20.782 -0.374 158 HB3 LYS 20 HB3 LYS 20 -0.237 20.380 1.185 159 HG2 LYS 20 HG2 LYS 20 1.524 21.661 2.358 160 HG3 LYS 20 HG3 LYS 20 2.348 21.969 0.816 161 HD2 LYS 20 HD2 LYS 20 0.362 23.227 0.008 162 HD3 LYS 20 HD3 LYS 20 -0.451 22.936 1.564 163 HE2 LYS 20 HE2 LYS 20 1.353 24.143 2.748 164 HE3 LYS 20 HE3 LYS 20 2.221 24.379 1.225 165 HZ1 LYS 20 HZ1 LYS 20 0.350 25.724 0.434 166 HZ2 LYS 20 HZ2 LYS 20 -0.464 25.505 1.836 167 HZ3 LYS 20 HZ3 LYS 20 0.933 26.349 1.822 168 H ILE 21 H ILE 21 0.104 17.720 2.058 169 HA ILE 21 HA ILE 21 1.027 18.220 4.734 170 HB ILE 21 HB ILE 21 -0.577 15.935 3.591 171 HG12 ILE 21 HG12 ILE 21 -1.552 18.217 5.363 172 HG13 ILE 21 HG13 ILE 21 -1.523 18.378 3.614 173 HG21 ILE 21 HG21 ILE 21 0.387 15.027 5.541 174 HG22 ILE 21 HG22 ILE 21 0.017 16.480 6.484 175 HG23 ILE 21 HG23 ILE 21 -1.277 15.413 5.926 176 HD11 ILE 21 HD11 ILE 21 -3.039 16.453 3.368 177 HD12 ILE 21 HD12 ILE 21 -3.156 16.318 5.139 178 HD13 ILE 21 HD13 ILE 21 -3.744 17.772 4.313 179 H VAL 22 H VAL 22 1.876 15.762 2.307 180 HA VAL 22 HA VAL 22 3.730 14.430 4.147 181 HB VAL 22 HB VAL 22 3.142 14.055 1.200 182 HG11 VAL 22 HG11 VAL 22 5.363 13.130 1.715 183 HG12 VAL 22 HG12 VAL 22 4.705 12.265 3.121 184 HG13 VAL 22 HG13 VAL 22 4.198 11.829 1.481 185 HG21 VAL 22 HG21 VAL 22 2.218 12.599 3.734 186 HG22 VAL 22 HG22 VAL 22 1.198 13.559 2.644 187 HG23 VAL 22 HG23 VAL 22 1.891 12.035 2.097 188 H GLU 23 H GLU 23 4.131 16.704 1.382 189 HA GLU 23 HA GLU 23 7.025 16.628 1.458 190 HB2 GLU 23 HB2 GLU 23 5.038 18.648 0.360 191 HB3 GLU 23 HB3 GLU 23 6.774 18.876 0.237 192 HG2 GLU 23 HG2 GLU 23 5.449 16.358 -0.827 193 HG3 GLU 23 HG3 GLU 23 5.584 17.833 -1.781 194 H LYS 24 H LYS 24 4.666 18.407 3.345 195 HA LYS 24 HA LYS 24 6.858 19.924 4.722 196 HB2 LYS 24 HB2 LYS 24 3.884 20.494 4.653 197 HB3 LYS 24 HB3 LYS 24 5.098 21.519 5.378 198 HG2 LYS 24 HG2 LYS 24 4.948 20.850 2.406 199 HG3 LYS 24 HG3 LYS 24 4.162 22.237 3.128 200 HD2 LYS 24 HD2 LYS 24 7.174 21.791 3.296 201 HD3 LYS 24 HD3 LYS 24 6.374 22.719 2.016 202 HE2 LYS 24 HE2 LYS 24 5.360 24.223 3.710 203 HE3 LYS 24 HE3 LYS 24 6.179 23.335 5.001 204 HZ1 LYS 24 HZ1 LYS 24 8.308 24.006 4.031 205 HZ2 LYS 24 HZ2 LYS 24 7.559 24.810 2.818 206 HZ3 LYS 24 HZ3 LYS 24 7.410 25.328 4.358 207 H ARG 25 H ARG 25 5.252 17.143 5.197 208 HA ARG 25 HA ARG 25 4.570 15.824 6.929 209 HB2 ARG 25 HB2 ARG 25 6.893 17.188 8.321 210 HB3 ARG 25 HB3 ARG 25 6.162 15.657 8.800 211 HG2 ARG 25 HG2 ARG 25 7.325 14.465 7.267 212 HG3 ARG 25 HG3 ARG 25 6.928 15.572 5.964 213 HD2 ARG 25 HD2 ARG 25 9.267 15.663 6.132 214 HD3 ARG 25 HD3 ARG 25 8.663 17.167 6.849 215 HE ARG 25 HE ARG 25 9.078 15.009 8.794 216 HH11 ARG 25 HH11 ARG 25 10.781 17.618 7.169 217 HH12 ARG 25 HH12 ARG 25 12.045 17.650 8.373 218 HH21 ARG 25 HH21 ARG 25 10.731 15.093 10.262 219 HH22 ARG 25 HH22 ARG 25 12.017 16.253 10.066 220 H ILE 26 H ILE 26 2.786 17.634 6.724 221 HA ILE 26 HA ILE 26 2.396 19.368 9.039 222 HB ILE 26 HB ILE 26 0.408 18.612 6.864 223 HG12 ILE 26 HG12 ILE 26 2.322 20.977 7.081 224 HG13 ILE 26 HG13 ILE 26 2.440 19.625 5.956 225 HG21 ILE 26 HG21 ILE 26 -0.693 19.516 8.893 226 HG22 ILE 26 HG22 ILE 26 0.372 20.940 8.830 227 HG23 ILE 26 HG23 ILE 26 -0.820 20.630 7.547 228 HD11 ILE 26 HD11 ILE 26 0.278 20.324 4.907 229 HD12 ILE 26 HD12 ILE 26 0.325 21.789 5.922 230 HD13 ILE 26 HD13 ILE 26 1.611 21.480 4.740 231 H GLU 27 H GLU 27 1.640 18.786 10.950 232 HA GLU 27 HA GLU 27 0.291 16.193 11.381 233 HB2 GLU 27 HB2 GLU 27 0.266 17.046 13.805 234 HB3 GLU 27 HB3 GLU 27 1.777 16.488 13.093 235 HG2 GLU 27 HG2 GLU 27 2.628 18.670 12.815 236 HG3 GLU 27 HG3 GLU 27 1.058 19.429 13.077 237 H CYS 28 H CYS 28 -1.731 15.934 11.207 238 HA CYS 28 HA CYS 28 -3.673 17.890 12.206 239 HB2 CYS 28 HB2 CYS 28 -4.931 17.905 10.015 240 HB3 CYS 28 HB3 CYS 28 -3.388 18.750 9.981 241 HG CYS 28 HG CYS 28 -3.984 15.620 8.997 242 H THR 29 H THR 29 -5.863 17.147 12.133 243 HA THR 29 HA THR 29 -6.151 14.234 12.639 244 HB THR 29 HB THR 29 -8.455 16.100 12.833 245 HG1 THR 29 HG1 THR 29 -6.421 16.130 14.793 246 HG21 THR 29 HG21 THR 29 -8.705 13.783 13.546 247 HG22 THR 29 HG22 THR 29 -7.420 14.007 14.769 248 HG23 THR 29 HG23 THR 29 -8.952 14.902 14.893 249 H VAL 30 H VAL 30 -7.613 12.953 11.506 250 HA VAL 30 HA VAL 30 -8.738 13.984 8.924 251 HB VAL 30 HB VAL 30 -8.022 12.010 7.775 252 HG11 VAL 30 HG11 VAL 30 -6.414 13.904 7.909 253 HG12 VAL 30 HG12 VAL 30 -5.602 13.088 9.268 254 HG13 VAL 30 HG13 VAL 30 -5.644 12.328 7.672 255 HG21 VAL 30 HG21 VAL 30 -6.654 11.065 10.330 256 HG22 VAL 30 HG22 VAL 30 -8.092 10.325 9.586 257 HG23 VAL 30 HG23 VAL 30 -6.549 10.306 8.730 258 H TYR 31 H TYR 31 -10.177 12.013 7.967 259 HA TYR 31 HA TYR 31 -12.056 11.190 10.134 260 HB2 TYR 31 HB2 TYR 31 -12.790 12.165 7.344 261 HB3 TYR 31 HB3 TYR 31 -13.889 11.556 8.547 262 HD1 TYR 31 HD2 TYR 31 -11.430 14.346 7.960 263 HD2 TYR 31 HD1 TYR 31 -15.000 13.014 9.982 264 HE1 TYR 31 HE2 TYR 31 -11.828 16.657 8.776 265 HE2 TYR 31 HE1 TYR 31 -15.444 15.360 10.725 266 HH TYR 31 HH TYR 31 -13.263 18.061 9.853 267 H SER 32 H SER 32 -13.024 9.233 9.937 268 HA SER 32 HA SER 32 -12.715 7.485 7.603 269 HB2 SER 32 HB2 SER 32 -10.508 7.232 8.595 270 HB3 SER 32 HB3 SER 32 -11.204 6.988 10.201 271 HG SER 32 HG SER 32 -10.557 5.024 9.068 272 H VAL 33 H VAL 33 -13.699 5.270 8.149 273 HA VAL 33 HA VAL 33 -16.092 5.605 9.907 274 HB VAL 33 HB VAL 33 -15.835 3.356 7.902 275 HG11 VAL 33 HG11 VAL 33 -17.563 3.379 9.641 276 HG12 VAL 33 HG12 VAL 33 -18.223 4.882 8.957 277 HG13 VAL 33 HG13 VAL 33 -18.202 3.383 7.987 278 HG21 VAL 33 HG21 VAL 33 -16.871 6.160 7.268 279 HG22 VAL 33 HG22 VAL 33 -15.492 5.348 6.484 280 HG23 VAL 33 HG23 VAL 33 -17.124 4.712 6.266 281 H ASP 34 H ASP 34 -16.134 4.499 11.776 282 HA ASP 34 HA ASP 34 -13.954 2.767 12.528 283 HB2 ASP 34 HB2 ASP 34 -14.699 2.948 14.687 284 HB3 ASP 34 HB3 ASP 34 -15.151 4.489 13.979 285 H ASN 35 H ASN 35 -14.624 0.823 14.031 286 HA ASN 35 HA ASN 35 -15.445 -1.331 12.319 287 HB2 ASN 35 HB2 ASN 35 -15.139 -1.231 15.353 288 HB3 ASN 35 HB3 ASN 35 -15.270 -2.700 14.395 289 HD21 ASN 35 HD22 ASN 35 -13.025 -0.824 15.921 290 HD22 ASN 35 HD21 ASN 35 -11.636 -1.214 14.915 291 H ASN 36 H ASN 36 -17.405 0.815 14.187 292 HA ASN 36 HA ASN 36 -19.759 -0.995 14.261 293 HB2 ASN 36 HB2 ASN 36 -19.510 1.881 15.242 294 HB3 ASN 36 HB3 ASN 36 -20.781 0.732 15.613 295 HD21 ASN 36 HD22 ASN 36 -17.911 2.104 16.749 296 HD22 ASN 36 HD21 ASN 36 -17.618 0.934 18.038 297 H GLY 37 H GLY 37 -18.258 1.008 12.038 298 HA2 GLY 37 HA2 GLY 37 -18.887 1.780 9.990 299 HA3 GLY 37 HA3 GLY 37 -20.527 1.261 10.222 300 H ASN 38 H ASN 38 -18.799 3.460 12.476 301 HA ASN 38 HA ASN 38 -20.585 5.737 11.648 302 HB2 ASN 38 HB2 ASN 38 -19.438 4.898 14.345 303 HB3 ASN 38 HB3 ASN 38 -20.011 6.531 14.030 304 HD21 ASN 38 HD22 ASN 38 -21.124 3.116 13.890 305 HD22 ASN 38 HD21 ASN 38 -22.789 3.518 14.273 306 H ILE 39 H ILE 39 -19.648 7.714 11.215 307 HA ILE 39 HA ILE 39 -16.851 7.780 10.549 308 HB ILE 39 HB ILE 39 -18.863 10.046 10.714 309 HG12 ILE 39 HG12 ILE 39 -17.843 8.485 8.284 310 HG13 ILE 39 HG13 ILE 39 -19.407 8.199 9.051 311 HG21 ILE 39 HG21 ILE 39 -16.512 10.860 10.851 312 HG22 ILE 39 HG22 ILE 39 -16.095 9.910 9.408 313 HG23 ILE 39 HG23 ILE 39 -17.210 11.290 9.311 314 HD11 ILE 39 HD11 ILE 39 -20.083 10.542 8.583 315 HD12 ILE 39 HD12 ILE 39 -18.557 10.772 7.697 316 HD13 ILE 39 HD13 ILE 39 -19.747 9.582 7.129 317 H TYR 40 H TYR 40 -15.215 8.425 11.691 318 HA TYR 40 HA TYR 40 -15.518 10.047 14.155 319 HB2 TYR 40 HB2 TYR 40 -14.282 8.638 15.521 320 HB3 TYR 40 HB3 TYR 40 -15.421 7.570 14.741 321 HD1 TYR 40 HD2 TYR 40 -14.484 6.314 12.533 322 HD2 TYR 40 HD1 TYR 40 -12.046 8.012 15.668 323 HE1 TYR 40 HE2 TYR 40 -12.624 4.790 11.909 324 HE2 TYR 40 HE1 TYR 40 -10.215 6.428 15.082 325 HH TYR 40 HH TYR 40 -10.520 4.040 12.425 326 H THR 41 H THR 41 -13.390 10.884 14.932 327 HA THR 41 HA THR 41 -11.553 11.453 12.662 328 HB THR 41 HB THR 41 -11.054 13.624 13.913 329 HG1 THR 41 HG1 THR 41 -12.831 14.381 15.131 330 HG21 THR 41 HG21 THR 41 -12.233 13.662 11.816 331 HG22 THR 41 HG22 THR 41 -13.766 13.215 12.603 332 HG23 THR 41 HG23 THR 41 -13.014 14.794 12.922 333 H GLN 42 H GLN 42 -9.401 11.519 12.972 334 HA GLN 42 HA GLN 42 -8.243 10.699 15.572 335 HB2 GLN 42 HB2 GLN 42 -7.212 8.702 14.564 336 HB3 GLN 42 HB3 GLN 42 -8.972 8.608 14.560 337 HG2 GLN 42 HG2 GLN 42 -8.991 9.284 12.143 338 HG3 GLN 42 HG3 GLN 42 -7.224 9.299 12.147 339 HE21 GLN 42 HE22 GLN 42 -8.591 7.702 10.318 340 HE22 GLN 42 HE21 GLN 42 -8.377 6.025 10.774 341 HA PRO 43 HA PRO 43 -4.852 13.103 13.879 342 HB2 PRO 43 HB2 PRO 43 -2.787 12.398 15.512 343 HB3 PRO 43 HB3 PRO 43 -4.168 13.395 16.061 344 HG2 PRO 43 HG2 PRO 43 -3.764 10.412 16.419 345 HG3 PRO 43 HG3 PRO 43 -4.262 11.622 17.645 346 HD2 PRO 43 HD2 PRO 43 -6.062 10.048 16.316 347 HD3 PRO 43 HD3 PRO 43 -6.444 11.730 16.793 348 H VAL 44 H VAL 44 -3.116 12.926 12.473 349 HA VAL 44 HA VAL 44 -2.539 10.517 11.063 350 HB VAL 44 HB VAL 44 -2.176 12.753 10.158 351 HG11 VAL 44 HG11 VAL 44 -1.225 13.912 12.159 352 HG12 VAL 44 HG12 VAL 44 0.279 12.996 11.945 353 HG13 VAL 44 HG13 VAL 44 -0.258 14.119 10.686 354 HG21 VAL 44 HG21 VAL 44 0.457 11.239 10.220 355 HG22 VAL 44 HG22 VAL 44 -0.948 10.801 9.221 356 HG23 VAL 44 HG23 VAL 44 -0.125 12.347 8.971 357 H ALA 45 H ALA 45 -1.025 8.937 11.273 358 HA ALA 45 HA ALA 45 0.599 8.853 13.780 359 HB1 ALA 45 HB1 ALA 45 -0.979 7.005 13.302 360 HB2 ALA 45 HB2 ALA 45 -0.085 6.637 11.809 361 HB3 ALA 45 HB3 ALA 45 0.705 6.461 13.387 362 H GLN 46 H GLN 46 0.968 8.773 10.228 363 HA GLN 46 HA GLN 46 3.704 9.645 10.442 364 HB2 GLN 46 HB2 GLN 46 4.858 7.876 9.378 365 HB3 GLN 46 HB3 GLN 46 4.030 7.259 10.795 366 HG2 GLN 46 HG2 GLN 46 2.193 6.757 8.788 367 HG3 GLN 46 HG3 GLN 46 3.729 6.572 7.945 368 HE21 GLN 46 HE22 GLN 46 2.046 5.616 11.002 369 HE22 GLN 46 HE21 GLN 46 2.900 4.101 11.169 370 H TRP 47 H TRP 47 4.731 9.695 8.121 371 HA TRP 47 HA TRP 47 2.698 10.419 6.044 372 HB2 TRP 47 HB2 TRP 47 5.319 11.827 6.678 373 HB3 TRP 47 HB3 TRP 47 4.231 12.247 5.371 374 HD1 TRP 47 HD1 TRP 47 2.308 13.882 5.876 375 HE1 TRP 47 HE1 TRP 47 1.528 15.231 7.936 376 HE3 TRP 47 HE3 TRP 47 5.178 11.603 9.469 377 HZ2 TRP 47 HZ2 TRP 47 2.038 15.229 10.751 378 HZ3 TRP 47 HZ3 TRP 47 4.934 12.252 11.854 379 HH2 TRP 47 HH2 TRP 47 3.340 14.060 12.506 380 H HIS 48 H HIS 48 3.061 9.560 4.056 381 HA HIS 48 HA HIS 48 5.485 7.841 3.650 382 HB2 HIS 48 HB2 HIS 48 2.601 7.372 2.850 383 HB3 HIS 48 HB3 HIS 48 3.959 6.357 2.387 384 HD1 HIS 48 HD1 HIS 48 5.176 5.042 4.605 385 HD2 HIS 48 HD2 HIS 48 1.280 6.602 4.906 386 HE1 HIS 48 HE1 HIS 48 4.047 3.785 6.513 387 H ASP 49 H ASP 49 6.687 8.504 2.035 388 HA ASP 49 HA ASP 49 5.484 9.927 -0.306 389 HB2 ASP 49 HB2 ASP 49 7.566 11.157 -0.489 390 HB3 ASP 49 HB3 ASP 49 6.796 11.430 1.064 391 H ARG 50 H ARG 50 5.355 8.684 -1.955 392 HA ARG 50 HA ARG 50 7.042 6.281 -2.326 393 HB2 ARG 50 HB2 ARG 50 4.762 7.452 -3.933 394 HB3 ARG 50 HB3 ARG 50 5.459 5.848 -4.135 395 HG2 ARG 50 HG2 ARG 50 3.932 6.880 -1.699 396 HG3 ARG 50 HG3 ARG 50 3.340 5.726 -2.871 397 HD2 ARG 50 HD2 ARG 50 5.635 5.267 -0.919 398 HD3 ARG 50 HD3 ARG 50 3.995 4.625 -0.796 399 HE ARG 50 HE ARG 50 5.326 3.883 -3.305 400 HH11 ARG 50 HH11 ARG 50 5.278 2.893 0.058 401 HH12 ARG 50 HH12 ARG 50 5.757 1.267 -0.354 402 HH21 ARG 50 HH21 ARG 50 5.708 1.843 -3.760 403 HH22 ARG 50 HH22 ARG 50 5.990 0.670 -2.488 404 H GLY 51 H GLY 51 6.656 9.426 -3.809 405 HA2 GLY 51 HA2 GLY 51 8.393 10.608 -4.867 406 HA3 GLY 51 HA3 GLY 51 9.260 9.108 -5.147 407 H GLU 52 H GLU 52 7.460 7.570 -6.610 408 HA GLU 52 HA GLU 52 6.467 8.915 -8.991 409 HB2 GLU 52 HB2 GLU 52 9.298 7.796 -9.093 410 HB3 GLU 52 HB3 GLU 52 8.228 7.899 -10.488 411 HG2 GLU 52 HG2 GLU 52 8.051 10.388 -10.077 412 HG3 GLU 52 HG3 GLU 52 9.438 10.204 -8.980 413 H GLN 53 H GLN 53 4.796 7.423 -8.677 414 HA GLN 53 HA GLN 53 5.388 4.702 -9.796 415 HB2 GLN 53 HB2 GLN 53 3.252 5.562 -7.839 416 HB3 GLN 53 HB3 GLN 53 3.531 3.893 -8.412 417 HG2 GLN 53 HG2 GLN 53 5.876 4.070 -7.441 418 HG3 GLN 53 HG3 GLN 53 5.399 5.635 -6.736 419 HE21 GLN 53 HE22 GLN 53 2.769 5.057 -5.697 420 HE22 GLN 53 HE21 GLN 53 3.369 4.345 -4.270 421 H GLU 54 H GLU 54 3.562 3.682 -10.926 422 HA GLU 54 HA GLU 54 2.720 5.373 -13.079 423 HB2 GLU 54 HB2 GLU 54 1.729 3.337 -14.013 424 HB3 GLU 54 HB3 GLU 54 3.399 3.151 -13.503 425 HG2 GLU 54 HG2 GLU 54 2.486 2.044 -11.362 426 HG3 GLU 54 HG3 GLU 54 0.921 1.994 -12.177 427 H VAL 55 H VAL 55 1.269 6.897 -12.823 428 HA VAL 55 HA VAL 55 -1.184 6.481 -11.207 429 HB VAL 55 HB VAL 55 -0.220 9.048 -12.530 430 HG11 VAL 55 HG11 VAL 55 -2.636 9.003 -11.831 431 HG12 VAL 55 HG12 VAL 55 -2.115 8.593 -10.184 432 HG13 VAL 55 HG13 VAL 55 -1.672 10.153 -10.911 433 HG21 VAL 55 HG21 VAL 55 0.368 7.890 -9.782 434 HG22 VAL 55 HG22 VAL 55 1.508 8.531 -10.985 435 HG23 VAL 55 HG23 VAL 55 0.442 9.631 -10.112 436 H PHE 56 H PHE 56 -3.176 6.471 -11.997 437 HA PHE 56 HA PHE 56 -3.667 6.761 -14.956 438 HB2 PHE 56 HB2 PHE 56 -4.659 4.711 -12.983 439 HB3 PHE 56 HB3 PHE 56 -5.446 5.038 -14.525 440 HD1 PHE 56 HD2 PHE 56 -2.025 4.117 -13.162 441 HD2 PHE 56 HD1 PHE 56 -4.890 3.717 -16.368 442 HE1 PHE 56 HE2 PHE 56 -0.605 2.394 -14.220 443 HE2 PHE 56 HE1 PHE 56 -3.480 1.961 -17.395 444 HZ PHE 56 HZ PHE 56 -1.329 1.302 -16.332 445 H GLU 57 H GLU 57 -5.505 7.815 -15.545 446 HA GLU 57 HA GLU 57 -6.836 9.610 -13.731 447 HB2 GLU 57 HB2 GLU 57 -6.492 9.843 -16.257 448 HB3 GLU 57 HB3 GLU 57 -7.791 8.670 -16.470 449 HG2 GLU 57 HG2 GLU 57 -9.321 10.183 -15.180 450 HG3 GLU 57 HG3 GLU 57 -7.998 11.343 -15.013 451 H TYR 58 H TYR 58 -8.441 9.193 -12.348 452 HA TYR 58 HA TYR 58 -10.285 6.897 -12.786 453 HB2 TYR 58 HB2 TYR 58 -8.887 6.430 -10.954 454 HB3 TYR 58 HB3 TYR 58 -8.991 8.063 -10.317 455 HD1 TYR 58 HD2 TYR 58 -12.087 6.344 -11.432 456 HD2 TYR 58 HD1 TYR 58 -9.460 7.132 -8.091 457 HE1 TYR 58 HE2 TYR 58 -13.813 5.545 -9.880 458 HE2 TYR 58 HE1 TYR 58 -11.253 6.386 -6.524 459 HH TYR 58 HH TYR 58 -14.447 5.304 -7.758 460 H CYS 59 H CYS 59 -11.653 8.077 -14.080 461 HA CYS 59 HA CYS 59 -13.039 10.467 -12.982 462 HB2 CYS 59 HB2 CYS 59 -12.274 10.315 -15.400 463 HB3 CYS 59 HB3 CYS 59 -13.434 8.996 -15.629 464 HG CYS 59 HG CYS 59 -15.561 10.439 -14.795 465 H LEU 60 H LEU 60 -15.160 10.449 -12.344 466 HA LEU 60 HA LEU 60 -16.583 7.805 -12.236 467 HB2 LEU 60 HB2 LEU 60 -16.162 9.953 -10.288 468 HB3 LEU 60 HB3 LEU 60 -17.852 9.781 -10.614 469 HG LEU 60 HG LEU 60 -17.926 7.478 -9.987 470 HD11 LEU 60 HD11 LEU 60 -15.696 6.690 -10.652 471 HD12 LEU 60 HD12 LEU 60 -14.973 7.676 -9.356 472 HD13 LEU 60 HD13 LEU 60 -16.063 6.308 -8.971 473 HD21 LEU 60 HD21 LEU 60 -16.369 9.118 -7.956 474 HD22 LEU 60 HD22 LEU 60 -18.117 9.213 -8.220 475 HD23 LEU 60 HD23 LEU 60 -17.393 7.711 -7.600 476 H GLU 61 H GLU 61 -18.894 7.839 -12.331 477 HA GLU 61 HA GLU 61 -19.763 8.961 -14.819 478 HB2 GLU 61 HB2 GLU 61 -21.353 7.593 -12.617 479 HB3 GLU 61 HB3 GLU 61 -21.914 7.891 -14.271 480 HG2 GLU 61 HG2 GLU 61 -19.971 6.502 -15.102 481 HG3 GLU 61 HG3 GLU 61 -19.625 6.078 -13.422 482 H ASP 62 H ASP 62 -19.997 10.251 -11.611 483 HA ASP 62 HA ASP 62 -22.096 12.227 -12.178 484 HB2 ASP 62 HB2 ASP 62 -21.708 11.420 -9.904 485 HB3 ASP 62 HB3 ASP 62 -20.033 11.978 -9.954 486 H GLY 63 H GLY 63 -18.615 11.997 -12.643 487 HA2 GLY 63 HA2 GLY 63 -17.583 13.482 -14.266 488 HA3 GLY 63 HA3 GLY 63 -18.500 14.838 -13.607 489 H SER 64 H SER 64 -17.533 13.064 -10.952 490 HA SER 64 HA SER 64 -15.414 14.805 -10.100 491 HB2 SER 64 HB2 SER 64 -15.140 12.629 -8.499 492 HB3 SER 64 HB3 SER 64 -16.318 13.918 -8.247 493 HG SER 64 HG SER 64 -17.751 12.425 -8.366 494 H LEU 65 H LEU 65 -13.231 14.393 -9.877 495 HA LEU 65 HA LEU 65 -12.018 12.315 -11.649 496 HB2 LEU 65 HB2 LEU 65 -11.698 15.329 -11.652 497 HB3 LEU 65 HB3 LEU 65 -10.397 14.291 -12.226 498 HG LEU 65 HG LEU 65 -13.199 14.184 -13.408 499 HD11 LEU 65 HD11 LEU 65 -12.238 16.437 -13.724 500 HD12 LEU 65 HD12 LEU 65 -10.745 15.722 -14.370 501 HD13 LEU 65 HD13 LEU 65 -12.279 15.544 -15.252 502 HD21 LEU 65 HD21 LEU 65 -10.473 13.244 -14.433 503 HD22 LEU 65 HD22 LEU 65 -11.763 12.191 -13.826 504 HD23 LEU 65 HD23 LEU 65 -12.017 13.123 -15.304 505 H ILE 66 H ILE 66 -10.407 11.303 -10.833 506 HA ILE 66 HA ILE 66 -8.900 12.276 -8.453 507 HB ILE 66 HB ILE 66 -10.108 9.504 -8.834 508 HG12 ILE 66 HG12 ILE 66 -11.076 11.569 -6.815 509 HG13 ILE 66 HG13 ILE 66 -11.871 11.303 -8.360 510 HG21 ILE 66 HG21 ILE 66 -8.069 9.452 -7.462 511 HG22 ILE 66 HG22 ILE 66 -8.685 10.786 -6.452 512 HG23 ILE 66 HG23 ILE 66 -9.453 9.190 -6.426 513 HD11 ILE 66 HD11 ILE 66 -12.321 8.964 -7.815 514 HD12 ILE 66 HD12 ILE 66 -11.673 9.236 -6.170 515 HD13 ILE 66 HD13 ILE 66 -13.099 10.115 -6.742 516 H ARG 67 H ARG 67 -6.788 11.333 -8.277 517 HA ARG 67 HA ARG 67 -5.732 9.851 -10.655 518 HB2 ARG 67 HB2 ARG 67 -4.621 12.463 -9.530 519 HB3 ARG 67 HB3 ARG 67 -3.775 11.399 -10.669 520 HG2 ARG 67 HG2 ARG 67 -5.745 11.622 -12.231 521 HG3 ARG 67 HG3 ARG 67 -6.413 12.860 -11.164 522 HD2 ARG 67 HD2 ARG 67 -4.605 14.368 -11.593 523 HD3 ARG 67 HD3 ARG 67 -3.613 13.098 -12.296 524 HE ARG 67 HE ARG 67 -4.804 13.168 -14.307 525 HH11 ARG 67 HH11 ARG 67 -6.297 15.467 -12.106 526 HH12 ARG 67 HH12 ARG 67 -7.257 16.174 -13.380 527 HH21 ARG 67 HH21 ARG 67 -6.077 14.104 -15.855 528 HH22 ARG 67 HH22 ARG 67 -7.128 15.423 -15.432 529 H ALA 68 H ALA 68 -5.115 8.011 -9.859 530 HA ALA 68 HA ALA 68 -3.384 7.867 -7.447 531 HB1 ALA 68 HB1 ALA 68 -5.758 7.622 -6.700 532 HB2 ALA 68 HB2 ALA 68 -5.962 6.260 -7.830 533 HB3 ALA 68 HB3 ALA 68 -4.835 6.123 -6.473 534 H THR 69 H THR 69 -2.501 5.658 -7.131 535 HA THR 69 HA THR 69 -1.668 4.485 -9.718 536 HB THR 69 HB THR 69 -0.139 3.112 -8.375 537 HG1 THR 69 HG1 THR 69 0.023 3.357 -6.256 538 HG21 THR 69 HG21 THR 69 0.748 5.189 -9.120 539 HG22 THR 69 HG22 THR 69 -0.057 6.098 -7.815 540 HG23 THR 69 HG23 THR 69 1.241 4.950 -7.429 541 H LYS 70 H LYS 70 -1.670 2.254 -10.126 542 HA LYS 70 HA LYS 70 -4.194 0.934 -9.477 543 HB2 LYS 70 HB2 LYS 70 -1.960 0.579 -11.415 544 HB3 LYS 70 HB3 LYS 70 -2.664 -0.933 -10.867 545 HG2 LYS 70 HG2 LYS 70 -3.740 -0.078 -12.915 546 HG3 LYS 70 HG3 LYS 70 -4.866 -0.299 -11.574 547 HD2 LYS 70 HD2 LYS 70 -4.877 2.134 -11.133 548 HD3 LYS 70 HD3 LYS 70 -3.761 2.369 -12.463 549 HE2 LYS 70 HE2 LYS 70 -5.355 1.983 -14.071 550 HE3 LYS 70 HE3 LYS 70 -6.153 0.723 -13.138 551 HZ1 LYS 70 HZ1 LYS 70 -7.633 2.620 -13.273 552 HZ2 LYS 70 HZ2 LYS 70 -7.149 2.487 -11.725 553 HZ3 LYS 70 HZ3 LYS 70 -6.503 3.655 -12.673 554 H ASP 71 H ASP 71 -1.451 1.019 -7.651 555 HA ASP 71 HA ASP 71 -1.879 -1.662 -6.432 556 HB2 ASP 71 HB2 ASP 71 0.085 0.588 -5.860 557 HB3 ASP 71 HB3 ASP 71 0.000 -0.928 -4.960 558 H HIS 72 H HIS 72 -3.087 1.588 -6.074 559 HA HIS 72 HA HIS 72 -3.400 1.490 -3.191 560 HB2 HIS 72 HB2 HIS 72 -3.128 3.553 -4.738 561 HB3 HIS 72 HB3 HIS 72 -4.811 3.334 -5.177 562 HD1 HIS 72 HD1 HIS 72 -5.904 2.788 -2.045 563 HD2 HIS 72 HD2 HIS 72 -3.273 5.744 -3.443 564 HE1 HIS 72 HE1 HIS 72 -5.755 4.522 -0.224 565 H LYS 73 H LYS 73 -5.088 0.747 -2.054 566 HA LYS 73 HA LYS 73 -7.394 -0.480 -3.447 567 HB2 LYS 73 HB2 LYS 73 -6.427 -0.559 -0.562 568 HB3 LYS 73 HB3 LYS 73 -7.881 -1.381 -1.128 569 HG2 LYS 73 HG2 LYS 73 -6.691 -2.935 -2.416 570 HG3 LYS 73 HG3 LYS 73 -5.273 -1.904 -2.573 571 HD2 LYS 73 HD2 LYS 73 -4.792 -2.213 -0.151 572 HD3 LYS 73 HD3 LYS 73 -6.112 -3.394 -0.046 573 HE2 LYS 73 HE2 LYS 73 -3.971 -3.609 -2.187 574 HE3 LYS 73 HE3 LYS 73 -3.594 -4.133 -0.538 575 HZ1 LYS 73 HZ1 LYS 73 -5.426 -5.706 -0.637 576 HZ2 LYS 73 HZ2 LYS 73 -5.844 -5.236 -2.143 577 HZ3 LYS 73 HZ3 LYS 73 -4.411 -5.985 -1.885 578 H PHE 74 H PHE 74 -9.558 -0.070 -2.870 579 HA PHE 74 HA PHE 74 -10.114 2.479 -1.408 580 HB2 PHE 74 HB2 PHE 74 -10.990 1.773 -4.227 581 HB3 PHE 74 HB3 PHE 74 -11.781 2.978 -3.228 582 HD1 PHE 74 HD1 PHE 74 -8.553 2.203 -4.989 583 HD2 PHE 74 HD2 PHE 74 -10.934 5.176 -2.941 584 HE1 PHE 74 HE1 PHE 74 -7.056 3.986 -5.817 585 HE2 PHE 74 HE2 PHE 74 -9.417 6.953 -3.775 586 HZ PHE 74 HZ PHE 74 -7.474 6.362 -5.208 587 H MET 75 H MET 75 -12.096 2.591 -0.407 588 HA MET 75 HA MET 75 -13.188 0.017 0.425 589 HB2 MET 75 HB2 MET 75 -12.810 1.870 1.995 590 HB3 MET 75 HB3 MET 75 -13.930 2.876 1.066 591 HG2 MET 75 HG2 MET 75 -15.768 1.262 1.556 592 HG3 MET 75 HG3 MET 75 -14.672 0.353 2.592 593 HE1 MET 75 HE1 MET 75 -14.593 0.709 5.053 594 HE2 MET 75 HE2 MET 75 -13.299 1.864 4.651 595 HE3 MET 75 HE3 MET 75 -14.562 2.304 5.838 596 H THR 76 H THR 76 -14.431 -1.030 -1.036 597 HA THR 76 HA THR 76 -16.271 0.279 -2.858 598 HB THR 76 HB THR 76 -17.133 -1.940 -3.359 599 HG1 THR 76 HG1 THR 76 -16.149 -3.706 -2.332 600 HG21 THR 76 HG21 THR 76 -15.085 -1.116 -4.439 601 HG22 THR 76 HG22 THR 76 -14.100 -1.901 -3.186 602 HG23 THR 76 HG23 THR 76 -15.096 -2.881 -4.284 603 H VAL 77 H VAL 77 -18.642 -0.317 -2.900 604 HA VAL 77 HA VAL 77 -20.007 0.521 -0.605 605 HB VAL 77 HB VAL 77 -22.061 -0.531 -1.670 606 HG11 VAL 77 HG11 VAL 77 -21.381 1.778 -2.008 607 HG12 VAL 77 HG12 VAL 77 -20.332 1.311 -3.356 608 HG13 VAL 77 HG13 VAL 77 -22.095 1.091 -3.481 609 HG21 VAL 77 HG21 VAL 77 -20.155 -1.175 -3.966 610 HG22 VAL 77 HG22 VAL 77 -20.918 -2.379 -2.905 611 HG23 VAL 77 HG23 VAL 77 -21.915 -1.351 -3.947 612 H ASP 78 H ASP 78 -18.856 -2.716 -1.245 613 HA ASP 78 HA ASP 78 -20.415 -3.864 1.014 614 HB2 ASP 78 HB2 ASP 78 -18.452 -5.077 -0.965 615 HB3 ASP 78 HB3 ASP 78 -19.250 -5.975 0.327 616 H GLY 79 H GLY 79 -17.549 -2.119 0.702 617 HA2 GLY 79 HA2 GLY 79 -16.037 -1.543 2.349 618 HA3 GLY 79 HA3 GLY 79 -16.670 -2.803 3.412 619 H GLN 80 H GLN 80 -15.597 -3.576 0.128 620 HA GLN 80 HA GLN 80 -13.460 -5.324 1.211 621 HB2 GLN 80 HB2 GLN 80 -14.536 -5.004 -1.618 622 HB3 GLN 80 HB3 GLN 80 -13.368 -6.210 -1.053 623 HG2 GLN 80 HG2 GLN 80 -15.137 -7.080 0.532 624 HG3 GLN 80 HG3 GLN 80 -16.290 -5.980 -0.221 625 HE21 GLN 80 HE22 GLN 80 -17.438 -6.819 -2.004 626 HE22 GLN 80 HE21 GLN 80 -16.905 -8.228 -2.908 627 H MET 81 H MET 81 -11.445 -4.553 1.388 628 HA MET 81 HA MET 81 -10.528 -2.171 -0.034 629 HB2 MET 81 HB2 MET 81 -8.878 -4.005 1.740 630 HB3 MET 81 HB3 MET 81 -8.521 -2.340 1.260 631 HG2 MET 81 HG2 MET 81 -10.688 -3.350 3.110 632 HG3 MET 81 HG3 MET 81 -9.314 -2.339 3.528 633 HE1 MET 81 HE1 MET 81 -12.529 -2.296 3.997 634 HE2 MET 81 HE2 MET 81 -11.499 -1.174 4.909 635 HE3 MET 81 HE3 MET 81 -12.916 -0.560 4.021 636 H LEU 82 H LEU 82 -10.757 -2.897 -2.215 637 HA LEU 82 HA LEU 82 -8.663 -4.825 -3.171 638 HB2 LEU 82 HB2 LEU 82 -11.192 -3.902 -4.590 639 HB3 LEU 82 HB3 LEU 82 -10.124 -5.192 -5.102 640 HG LEU 82 HG LEU 82 -11.895 -5.238 -2.622 641 HD11 LEU 82 HD11 LEU 82 -13.056 -5.380 -4.851 642 HD12 LEU 82 HD12 LEU 82 -12.128 -6.861 -5.177 643 HD13 LEU 82 HD13 LEU 82 -13.265 -6.798 -3.808 644 HD21 LEU 82 HD21 LEU 82 -10.151 -7.436 -3.819 645 HD22 LEU 82 HD22 LEU 82 -9.883 -6.624 -2.259 646 HD23 LEU 82 HD23 LEU 82 -11.313 -7.638 -2.488 647 HA PRO 83 HA PRO 83 -6.658 -1.468 -5.234 648 HB2 PRO 83 HB2 PRO 83 -5.504 -2.684 -7.412 649 HB3 PRO 83 HB3 PRO 83 -4.895 -2.865 -5.742 650 HG2 PRO 83 HG2 PRO 83 -6.768 -4.695 -7.292 651 HG3 PRO 83 HG3 PRO 83 -5.313 -5.156 -6.347 652 HD2 PRO 83 HD2 PRO 83 -7.823 -5.375 -5.340 653 HD3 PRO 83 HD3 PRO 83 -6.466 -4.841 -4.303 654 H ILE 84 H ILE 84 -7.075 0.051 -6.856 655 HA ILE 84 HA ILE 84 -9.578 -0.044 -8.130 656 HB ILE 84 HB ILE 84 -8.372 1.981 -7.509 657 HG12 ILE 84 HG12 ILE 84 -9.064 1.964 -10.474 658 HG13 ILE 84 HG13 ILE 84 -10.241 1.859 -9.159 659 HG21 ILE 84 HG21 ILE 84 -6.103 1.430 -8.154 660 HG22 ILE 84 HG22 ILE 84 -6.563 1.310 -9.860 661 HG23 ILE 84 HG23 ILE 84 -6.583 2.886 -9.017 662 HD11 ILE 84 HD11 ILE 84 -9.526 4.030 -8.293 663 HD12 ILE 84 HD12 ILE 84 -8.377 4.206 -9.650 664 HD13 ILE 84 HD13 ILE 84 -10.117 4.109 -9.967 665 H ASP 85 H ASP 85 -6.593 -1.343 -9.368 666 HA ASP 85 HA ASP 85 -7.212 -1.723 -12.105 667 HB2 ASP 85 HB2 ASP 85 -5.031 -2.290 -10.817 668 HB3 ASP 85 HB3 ASP 85 -5.841 -3.748 -10.292 669 H GLU 86 H GLU 86 -8.402 -3.413 -9.237 670 HA GLU 86 HA GLU 86 -9.760 -5.551 -10.777 671 HB2 GLU 86 HB2 GLU 86 -8.727 -5.725 -8.366 672 HB3 GLU 86 HB3 GLU 86 -10.177 -4.876 -7.849 673 HG2 GLU 86 HG2 GLU 86 -10.719 -7.125 -7.523 674 HG3 GLU 86 HG3 GLU 86 -11.510 -6.766 -9.041 675 H ILE 87 H ILE 87 -10.572 -2.490 -9.031 676 HA ILE 87 HA ILE 87 -13.383 -2.810 -9.029 677 HB ILE 87 HB ILE 87 -11.700 -0.273 -9.049 678 HG12 ILE 87 HG12 ILE 87 -12.780 -1.992 -6.760 679 HG13 ILE 87 HG13 ILE 87 -11.096 -1.852 -7.249 680 HG21 ILE 87 HG21 ILE 87 -14.120 0.182 -9.555 681 HG22 ILE 87 HG22 ILE 87 -14.548 -0.654 -8.052 682 HG23 ILE 87 HG23 ILE 87 -13.610 0.852 -8.015 683 HD11 ILE 87 HD11 ILE 87 -11.180 0.601 -6.666 684 HD12 ILE 87 HD12 ILE 87 -12.779 0.278 -5.943 685 HD13 ILE 87 HD13 ILE 87 -11.342 -0.533 -5.310 686 H PHE 88 H PHE 88 -11.246 -1.454 -11.521 687 HA PHE 88 HA PHE 88 -13.337 -0.479 -13.241 688 HB2 PHE 88 HB2 PHE 88 -10.919 0.168 -13.325 689 HB3 PHE 88 HB3 PHE 88 -10.538 -1.418 -13.954 690 HD1 PHE 88 HD2 PHE 88 -12.769 1.574 -14.696 691 HD2 PHE 88 HD1 PHE 88 -10.568 -1.783 -16.279 692 HE1 PHE 88 HE2 PHE 88 -13.159 2.405 -16.994 693 HE2 PHE 88 HE1 PHE 88 -10.965 -0.942 -18.591 694 HZ PHE 88 HZ PHE 88 -12.256 1.155 -18.947 695 H GLU 89 H GLU 89 -11.920 -3.742 -13.003 696 HA GLU 89 HA GLU 89 -13.408 -4.672 -15.406 697 HB2 GLU 89 HB2 GLU 89 -11.543 -6.077 -13.442 698 HB3 GLU 89 HB3 GLU 89 -12.447 -6.914 -14.707 699 HG2 GLU 89 HG2 GLU 89 -11.390 -5.288 -16.383 700 HG3 GLU 89 HG3 GLU 89 -10.287 -4.813 -15.087 701 H ARG 90 H ARG 90 -13.592 -4.985 -11.865 702 HA ARG 90 HA ARG 90 -15.925 -6.749 -11.892 703 HB2 ARG 90 HB2 ARG 90 -14.825 -4.950 -9.692 704 HB3 ARG 90 HB3 ARG 90 -16.015 -6.241 -9.487 705 HG2 ARG 90 HG2 ARG 90 -13.164 -6.719 -10.395 706 HG3 ARG 90 HG3 ARG 90 -13.752 -6.841 -8.720 707 HD2 ARG 90 HD2 ARG 90 -15.379 -8.554 -9.551 708 HD3 ARG 90 HD3 ARG 90 -14.514 -8.510 -11.114 709 HE ARG 90 HE ARG 90 -12.444 -9.074 -9.637 710 HH11 ARG 90 HH11 ARG 90 -15.630 -10.530 -9.298 711 HH12 ARG 90 HH12 ARG 90 -14.989 -11.954 -8.523 712 HH21 ARG 90 HH21 ARG 90 -11.717 -10.905 -8.608 713 HH22 ARG 90 HH22 ARG 90 -12.842 -12.157 -8.150 714 H GLU 91 H GLU 91 -15.543 -3.335 -12.348 715 HA GLU 91 HA GLU 91 -16.937 -1.578 -12.438 716 HB2 GLU 91 HB2 GLU 91 -19.153 -3.578 -13.022 717 HB3 GLU 91 HB3 GLU 91 -19.178 -1.844 -13.339 718 HG2 GLU 91 HG2 GLU 91 -17.208 -2.138 -14.881 719 HG3 GLU 91 HG3 GLU 91 -17.336 -3.883 -14.655 720 H LEU 92 H LEU 92 -16.347 -2.566 -9.875 721 HA LEU 92 HA LEU 92 -18.766 -2.480 -8.206 722 HB2 LEU 92 HB2 LEU 92 -15.791 -2.579 -7.594 723 HB3 LEU 92 HB3 LEU 92 -17.002 -2.424 -6.325 724 HG LEU 92 HG LEU 92 -17.034 -4.697 -8.334 725 HD11 LEU 92 HD11 LEU 92 -14.913 -4.724 -7.022 726 HD12 LEU 92 HD12 LEU 92 -15.868 -4.720 -5.521 727 HD13 LEU 92 HD13 LEU 92 -15.967 -6.094 -6.642 728 HD21 LEU 92 HD21 LEU 92 -18.360 -4.373 -5.612 729 HD22 LEU 92 HD22 LEU 92 -19.179 -4.374 -7.191 730 HD23 LEU 92 HD23 LEU 92 -18.390 -5.841 -6.611 731 H ASP 93 H ASP 93 -19.461 -0.887 -6.873 732 HA ASP 93 HA ASP 93 -18.629 1.883 -7.504 733 HB2 ASP 93 HB2 ASP 93 -20.791 0.922 -5.608 734 HB3 ASP 93 HB3 ASP 93 -20.616 2.523 -6.316 735 H LEU 94 H LEU 94 -17.780 3.343 -5.937 736 HA LEU 94 HA LEU 94 -16.704 2.178 -3.424 737 HB2 LEU 94 HB2 LEU 94 -16.517 5.010 -4.506 738 HB3 LEU 94 HB3 LEU 94 -15.828 4.439 -2.996 739 HG LEU 94 HG LEU 94 -14.964 3.799 -5.806 740 HD11 LEU 94 HD11 LEU 94 -14.035 5.758 -4.560 741 HD12 LEU 94 HD12 LEU 94 -13.499 4.674 -3.261 742 HD13 LEU 94 HD13 LEU 94 -12.794 4.543 -4.888 743 HD21 LEU 94 HD21 LEU 94 -14.138 2.225 -3.341 744 HD22 LEU 94 HD22 LEU 94 -14.974 1.589 -4.783 745 HD23 LEU 94 HD23 LEU 94 -13.326 2.195 -4.919 746 H MET 95 H MET 95 -17.085 3.009 -1.364 747 HA MET 95 HA MET 95 -19.828 4.037 -0.857 748 HB2 MET 95 HB2 MET 95 -18.817 2.078 0.351 749 HB3 MET 95 HB3 MET 95 -17.653 3.167 1.101 750 HG2 MET 95 HG2 MET 95 -19.270 4.132 2.471 751 HG3 MET 95 HG3 MET 95 -20.575 3.849 1.319 752 HE1 MET 95 HE1 MET 95 -18.057 0.999 2.474 753 HE2 MET 95 HE2 MET 95 -18.188 2.023 3.926 754 HE3 MET 95 HE3 MET 95 -18.886 0.389 3.918 755 H ARG 96 H ARG 96 -20.116 5.877 0.633 756 HA ARG 96 HA ARG 96 -17.900 7.859 0.709 757 HB2 ARG 96 HB2 ARG 96 -20.700 8.668 -0.167 758 HB3 ARG 96 HB3 ARG 96 -19.259 9.669 -0.086 759 HG2 ARG 96 HG2 ARG 96 -19.241 9.323 -2.327 760 HG3 ARG 96 HG3 ARG 96 -18.317 7.904 -1.856 761 HD2 ARG 96 HD2 ARG 96 -20.754 6.786 -1.713 762 HD3 ARG 96 HD3 ARG 96 -21.214 8.118 -2.761 763 HE ARG 96 HE ARG 96 -19.587 5.785 -3.399 764 HH11 ARG 96 HH11 ARG 96 -20.437 8.975 -4.579 765 HH12 ARG 96 HH12 ARG 96 -19.935 8.602 -6.196 766 HH21 ARG 96 HH21 ARG 96 -18.883 5.400 -5.379 767 HH22 ARG 96 HH22 ARG 96 -18.921 6.620 -6.614 768 H VAL 97 H VAL 97 -18.364 9.737 2.080 769 HA VAL 97 HA VAL 97 -19.615 8.910 4.633 770 HB VAL 97 HB VAL 97 -18.656 11.013 5.533 771 HG11 VAL 97 HG11 VAL 97 -17.451 8.829 5.650 772 HG12 VAL 97 HG12 VAL 97 -16.589 9.263 4.157 773 HG13 VAL 97 HG13 VAL 97 -16.371 10.233 5.625 774 HG21 VAL 97 HG21 VAL 97 -17.125 11.302 2.966 775 HG22 VAL 97 HG22 VAL 97 -18.515 12.330 3.401 776 HG23 VAL 97 HG23 VAL 97 -17.053 12.326 4.400 777 H ASP 98 H ASP 98 -20.482 11.013 1.996 778 HA ASP 98 HA ASP 98 -22.372 12.558 3.682 779 HB2 ASP 98 HB2 ASP 98 -20.644 13.583 2.132 780 HB3 ASP 98 HB3 ASP 98 -21.595 12.990 0.785 781 H ASN 99 H ASN 99 -22.755 9.704 2.533 782 HA ASN 99 HA ASN 99 -24.316 8.364 1.609 783 HB2 ASN 99 HB2 ASN 99 -26.415 10.431 2.326 784 HB3 ASN 99 HB3 ASN 99 -26.568 8.664 2.297 785 HD21 ASN 99 HD22 ASN 99 -24.528 7.695 3.680 786 HD22 ASN 99 HD21 ASN 99 -23.901 8.744 4.890 787 H LEU 100 H LEU 100 -22.964 10.142 -0.003 788 HA LEU 100 HA LEU 100 -24.458 11.037 -2.291 789 HB2 LEU 100 HB2 LEU 100 -21.618 10.157 -1.806 790 HB3 LEU 100 HB3 LEU 100 -22.113 10.488 -3.450 791 HG LEU 100 HG LEU 100 -22.517 12.528 -1.234 792 HD11 LEU 100 HD11 LEU 100 -20.131 11.964 -1.302 793 HD12 LEU 100 HD12 LEU 100 -20.109 12.159 -3.072 794 HD13 LEU 100 HD13 LEU 100 -20.407 13.558 -2.015 795 HD21 LEU 100 HD21 LEU 100 -22.255 12.796 -4.262 796 HD22 LEU 100 HD22 LEU 100 -23.769 12.931 -3.336 797 HD23 LEU 100 HD23 LEU 100 -22.487 14.128 -3.110 798 HA PRO 101 HA PRO 101 -25.823 7.389 -4.303 799 HB2 PRO 101 HB2 PRO 101 -25.696 8.006 -6.975 800 HB3 PRO 101 HB3 PRO 101 -26.851 8.771 -5.841 801 HG2 PRO 101 HG2 PRO 101 -24.181 9.847 -6.789 802 HG3 PRO 101 HG3 PRO 101 -25.754 10.703 -6.706 803 HD2 PRO 101 HD2 PRO 101 -23.859 10.934 -4.755 804 HD3 PRO 101 HD3 PRO 101 -25.594 10.939 -4.352 805 H ASN 102 H ASN 102 -25.052 5.426 -5.020 806 HA ASN 102 HA ASN 102 -22.151 5.146 -5.077 807 HB2 ASN 102 HB2 ASN 102 -24.332 3.037 -5.356 808 HB3 ASN 102 HB3 ASN 102 -22.628 2.754 -4.999 809 HD21 ASN 102 HD22 ASN 102 -21.815 4.104 -2.953 810 HD22 ASN 102 HD21 ASN 102 -22.961 4.125 -1.616 811 H ILE 103 H ILE 103 -20.914 5.203 -6.807 812 HA ILE 103 HA ILE 103 -21.765 4.182 -9.440 813 HB ILE 103 HB ILE 103 -20.726 6.238 -10.514 814 HG12 ILE 103 HG12 ILE 103 -21.378 7.514 -7.822 815 HG13 ILE 103 HG13 ILE 103 -19.752 7.183 -8.427 816 HG21 ILE 103 HG21 ILE 103 -23.153 5.628 -10.534 817 HG22 ILE 103 HG22 ILE 103 -23.389 6.667 -9.110 818 HG23 ILE 103 HG23 ILE 103 -22.855 7.360 -10.655 819 HD11 ILE 103 HD11 ILE 103 -20.142 8.726 -10.310 820 HD12 ILE 103 HD12 ILE 103 -21.769 9.084 -9.672 821 HD13 ILE 103 HD13 ILE 103 -20.342 9.523 -8.732 822 H LYS 104 H LYS 104 -20.148 3.722 -10.863 823 HA LYS 104 HA LYS 104 -17.516 3.102 -9.602 824 HB2 LYS 104 HB2 LYS 104 -17.401 1.176 -11.043 825 HB3 LYS 104 HB3 LYS 104 -18.890 1.193 -10.137 826 HG2 LYS 104 HG2 LYS 104 -19.518 0.399 -12.201 827 HG3 LYS 104 HG3 LYS 104 -20.070 2.069 -12.242 828 HD2 LYS 104 HD2 LYS 104 -18.242 2.695 -13.699 829 HD3 LYS 104 HD3 LYS 104 -17.418 1.136 -13.436 830 HE2 LYS 104 HE2 LYS 104 -19.448 0.019 -14.487 831 HE3 LYS 104 HE3 LYS 104 -20.042 1.629 -14.908 832 HZ1 LYS 104 HZ1 LYS 104 -17.991 1.952 -16.216 833 HZ2 LYS 104 HZ2 LYS 104 -17.458 0.456 -15.815 834 HZ3 LYS 104 HZ3 LYS 104 -18.795 0.611 -16.728 835 H ILE 105 H ILE 105 -15.857 2.624 -11.506 836 HA ILE 105 HA ILE 105 -15.028 5.229 -12.380 837 HB ILE 105 HB ILE 105 -14.103 2.477 -13.287 838 HG12 ILE 105 HG12 ILE 105 -12.535 4.057 -11.276 839 HG13 ILE 105 HG13 ILE 105 -13.920 3.139 -10.696 840 HG21 ILE 105 HG21 ILE 105 -12.751 5.218 -13.464 841 HG22 ILE 105 HG22 ILE 105 -11.918 3.691 -13.801 842 HG23 ILE 105 HG23 ILE 105 -13.265 4.195 -14.820 843 HD11 ILE 105 HD11 ILE 105 -12.945 1.115 -11.778 844 HD12 ILE 105 HD12 ILE 105 -11.479 2.074 -12.139 845 HD13 ILE 105 HD13 ILE 105 -11.986 1.787 -10.462 846 H ALA 106 H ALA 106 -15.795 6.339 -13.994 847 HA ALA 106 HA ALA 106 -17.600 5.318 -16.044 848 HB1 ALA 106 HB1 ALA 106 -17.849 7.554 -15.070 849 HB2 ALA 106 HB2 ALA 106 -16.250 8.037 -15.669 850 HB3 ALA 106 HB3 ALA 106 -17.564 7.682 -16.810 851 H THR 107 H THR 107 -14.247 6.467 -15.964 852 HA THR 107 HA THR 107 -13.512 4.998 -18.387 853 HB THR 107 HB THR 107 -12.408 7.560 -18.913 854 HG1 THR 107 HG1 THR 107 -14.251 8.804 -19.276 855 HG21 THR 107 HG21 THR 107 -12.970 5.853 -20.577 856 HG22 THR 107 HG22 THR 107 -14.705 6.127 -20.298 857 HG23 THR 107 HG23 THR 107 -13.691 7.413 -20.998 858 H ARG 108 H ARG 108 -11.264 5.015 -18.819 859 HA ARG 108 HA ARG 108 -9.456 5.899 -16.615 860 HB2 ARG 108 HB2 ARG 108 -10.190 3.486 -16.299 861 HB3 ARG 108 HB3 ARG 108 -9.485 3.118 -17.874 862 HG2 ARG 108 HG2 ARG 108 -7.255 4.080 -16.872 863 HG3 ARG 108 HG3 ARG 108 -8.092 4.029 -15.324 864 HD2 ARG 108 HD2 ARG 108 -6.733 2.077 -15.583 865 HD3 ARG 108 HD3 ARG 108 -8.440 1.559 -15.689 866 HE ARG 108 HE ARG 108 -7.273 2.128 -18.289 867 HH11 ARG 108 HH11 ARG 108 -7.353 -0.438 -15.886 868 HH12 ARG 108 HH12 ARG 108 -6.909 -1.649 -17.058 869 HH21 ARG 108 HH21 ARG 108 -6.746 0.528 -19.712 870 HH22 ARG 108 HH22 ARG 108 -6.592 -1.118 -19.159 871 H LYS 109 H LYS 109 -7.466 6.488 -17.260 872 HA LYS 109 HA LYS 109 -6.312 5.672 -19.831 873 HB2 LYS 109 HB2 LYS 109 -7.671 7.866 -20.219 874 HB3 LYS 109 HB3 LYS 109 -6.505 8.649 -19.168 875 HG2 LYS 109 HG2 LYS 109 -5.718 9.091 -21.342 876 HG3 LYS 109 HG3 LYS 109 -4.677 7.802 -20.765 877 HD2 LYS 109 HD2 LYS 109 -5.217 7.233 -23.012 878 HD3 LYS 109 HD3 LYS 109 -6.168 6.148 -22.011 879 HE2 LYS 109 HE2 LYS 109 -7.618 6.856 -23.739 880 HE3 LYS 109 HE3 LYS 109 -8.145 7.735 -22.303 881 HZ1 LYS 109 HZ1 LYS 109 -6.903 9.680 -23.152 882 HZ2 LYS 109 HZ2 LYS 109 -6.423 8.837 -24.470 883 HZ3 LYS 109 HZ3 LYS 109 -8.000 9.184 -24.252 884 H TYR 110 H TYR 110 -4.114 5.343 -19.548 885 HA TYR 110 HA TYR 110 -2.819 5.846 -17.016 886 HB2 TYR 110 HB2 TYR 110 -2.090 4.049 -18.519 887 HB3 TYR 110 HB3 TYR 110 -1.676 5.221 -19.762 888 HD1 TYR 110 HD1 TYR 110 -0.967 5.121 -16.042 889 HD2 TYR 110 HD2 TYR 110 0.671 5.222 -20.033 890 HE1 TYR 110 HE1 TYR 110 1.300 5.315 -15.103 891 HE2 TYR 110 HE2 TYR 110 2.961 5.339 -19.082 892 HH TYR 110 HH TYR 110 4.223 5.391 -17.183 893 H LEU 111 H LEU 111 -1.959 7.723 -16.241 894 HA LEU 111 HA LEU 111 -1.892 10.110 -18.020 895 HB2 LEU 111 HB2 LEU 111 -1.512 9.716 -15.019 896 HB3 LEU 111 HB3 LEU 111 -1.446 11.275 -15.837 897 HG LEU 111 HG LEU 111 -3.887 9.510 -16.019 898 HD11 LEU 111 HD11 LEU 111 -3.506 9.853 -13.678 899 HD12 LEU 111 HD12 LEU 111 -3.191 11.582 -13.920 900 HD13 LEU 111 HD13 LEU 111 -4.831 10.900 -14.189 901 HD21 LEU 111 HD21 LEU 111 -3.454 12.515 -16.332 902 HD22 LEU 111 HD22 LEU 111 -3.756 11.363 -17.651 903 HD23 LEU 111 HD23 LEU 111 -5.022 11.675 -16.463 904 H GLY 112 H GLY 112 0.262 8.205 -15.924 905 HA2 GLY 112 HA2 GLY 112 2.625 8.158 -17.159 906 HA3 GLY 112 HA3 GLY 112 2.615 9.853 -16.657 907 H LYS 113 H LYS 113 4.280 9.723 -15.231 908 HA LYS 113 HA LYS 113 4.077 7.861 -12.894 909 HB2 LYS 113 HB2 LYS 113 5.674 7.239 -14.795 910 HB3 LYS 113 HB3 LYS 113 6.663 8.596 -14.231 911 HG2 LYS 113 HG2 LYS 113 6.568 7.577 -11.896 912 HG3 LYS 113 HG3 LYS 113 5.783 6.163 -12.589 913 HD2 LYS 113 HD2 LYS 113 8.535 7.194 -13.409 914 HD3 LYS 113 HD3 LYS 113 8.256 5.912 -12.217 915 HE2 LYS 113 HE2 LYS 113 7.122 4.530 -13.909 916 HE3 LYS 113 HE3 LYS 113 7.325 5.803 -15.124 917 HZ1 LYS 113 HZ1 LYS 113 9.729 5.538 -14.931 918 HZ2 LYS 113 HZ2 LYS 113 9.568 4.390 -13.775 919 HZ3 LYS 113 HZ3 LYS 113 9.055 4.096 -15.298 920 H GLN 114 H GLN 114 3.032 9.706 -12.090 921 HA GLN 114 HA GLN 114 4.400 12.190 -11.565 922 HB2 GLN 114 HB2 GLN 114 1.686 11.419 -10.509 923 HB3 GLN 114 HB3 GLN 114 2.334 13.021 -10.911 924 HG2 GLN 114 HG2 GLN 114 2.683 12.121 -13.297 925 HG3 GLN 114 HG3 GLN 114 1.659 10.754 -12.825 926 HE21 GLN 114 HE22 GLN 114 0.981 11.899 -14.944 927 HE22 GLN 114 HE21 GLN 114 -0.308 13.025 -14.703 928 H ASN 115 H ASN 115 4.689 13.103 -9.390 929 HA ASN 115 HA ASN 115 5.481 11.371 -7.319 930 HB2 ASN 115 HB2 ASN 115 5.878 14.020 -7.901 931 HB3 ASN 115 HB3 ASN 115 4.632 14.171 -6.652 932 HD21 ASN 115 HD22 ASN 115 5.223 12.118 -4.874 933 HD22 ASN 115 HD21 ASN 115 6.915 12.170 -4.467 934 H VAL 116 H VAL 116 4.231 10.096 -6.095 935 HA VAL 116 HA VAL 116 1.571 11.154 -5.247 936 HB VAL 116 HB VAL 116 0.786 8.817 -5.130 937 HG11 VAL 116 HG11 VAL 116 0.247 10.306 -7.043 938 HG12 VAL 116 HG12 VAL 116 1.639 9.647 -7.920 939 HG13 VAL 116 HG13 VAL 116 0.278 8.593 -7.469 940 HG21 VAL 116 HG21 VAL 116 3.232 8.131 -6.827 941 HG22 VAL 116 HG22 VAL 116 2.979 7.627 -5.144 942 HG23 VAL 116 HG23 VAL 116 1.877 7.066 -6.408 943 H TYR 117 H TYR 117 0.791 10.662 -3.256 944 HA TYR 117 HA TYR 117 2.792 10.087 -1.121 945 HB2 TYR 117 HB2 TYR 117 0.850 12.416 -1.142 946 HB3 TYR 117 HB3 TYR 117 2.189 12.130 -0.056 947 HD1 TYR 117 HD2 TYR 117 4.525 12.641 -0.746 948 HD2 TYR 117 HD1 TYR 117 1.165 13.367 -3.348 949 HE1 TYR 117 HE2 TYR 117 5.906 14.226 -2.085 950 HE2 TYR 117 HE1 TYR 117 2.556 14.924 -4.708 951 HH TYR 117 HH TYR 117 4.553 16.044 -4.854 952 H ASP 118 H ASP 118 1.873 9.699 0.966 953 HA ASP 118 HA ASP 118 -1.006 9.185 1.294 954 HB2 ASP 118 HB2 ASP 118 -0.284 7.153 0.213 955 HB3 ASP 118 HB3 ASP 118 1.115 7.010 1.266 956 H ILE 119 H ILE 119 -1.391 8.361 3.606 957 HA ILE 119 HA ILE 119 0.631 9.214 5.586 958 HB ILE 119 HB ILE 119 -1.105 10.412 6.910 959 HG12 ILE 119 HG12 ILE 119 -2.692 10.576 4.308 960 HG13 ILE 119 HG13 ILE 119 -3.124 9.557 5.682 961 HG21 ILE 119 HG21 ILE 119 0.693 11.554 5.624 962 HG22 ILE 119 HG22 ILE 119 -0.430 11.756 4.263 963 HG23 ILE 119 HG23 ILE 119 -0.744 12.550 5.821 964 HD11 ILE 119 HD11 ILE 119 -3.289 11.582 7.123 965 HD12 ILE 119 HD12 ILE 119 -3.009 12.593 5.681 966 HD13 ILE 119 HD13 ILE 119 -4.441 11.560 5.767 967 H GLY 120 H GLY 120 0.494 8.230 7.561 968 HA2 GLY 120 HA2 GLY 120 -1.172 5.751 7.664 969 HA3 GLY 120 HA3 GLY 120 0.241 6.105 8.649 970 H VAL 121 H VAL 121 -2.160 5.126 9.661 971 HA VAL 121 HA VAL 121 -2.808 7.136 11.728 972 HB VAL 121 HB VAL 121 -5.267 6.481 11.537 973 HG11 VAL 121 HG11 VAL 121 -5.772 8.222 9.855 974 HG12 VAL 121 HG12 VAL 121 -4.521 8.734 11.003 975 HG13 VAL 121 HG13 VAL 121 -4.076 8.233 9.355 976 HG21 VAL 121 HG21 VAL 121 -4.543 5.834 8.647 977 HG22 VAL 121 HG22 VAL 121 -5.017 4.633 9.862 978 HG23 VAL 121 HG23 VAL 121 -6.162 5.885 9.361 979 H GLU 122 H GLU 122 -3.612 6.194 13.674 980 HA GLU 122 HA GLU 122 -2.779 3.382 14.092 981 HB2 GLU 122 HB2 GLU 122 -3.869 5.479 16.022 982 HB3 GLU 122 HB3 GLU 122 -3.318 3.856 16.460 983 HG2 GLU 122 HG2 GLU 122 -1.060 4.449 15.432 984 HG3 GLU 122 HG3 GLU 122 -1.632 6.120 15.332 985 H ARG 123 H ARG 123 -4.118 1.742 14.891 986 HA ARG 123 HA ARG 123 -5.938 0.383 14.947 987 HB2 ARG 123 HB2 ARG 123 -6.265 2.138 16.825 988 HB3 ARG 123 HB3 ARG 123 -7.560 2.797 15.827 989 HG2 ARG 123 HG2 ARG 123 -8.796 0.670 15.986 990 HG3 ARG 123 HG3 ARG 123 -7.411 -0.097 16.789 991 HD2 ARG 123 HD2 ARG 123 -7.642 1.542 18.657 992 HD3 ARG 123 HD3 ARG 123 -9.090 2.206 17.872 993 HE ARG 123 HE ARG 123 -9.693 -0.461 18.037 994 HH11 ARG 123 HH11 ARG 123 -8.684 1.808 20.525 995 HH12 ARG 123 HH12 ARG 123 -9.431 0.871 21.796 996 HH21 ARG 123 HH21 ARG 123 -10.609 -1.594 19.706 997 HH22 ARG 123 HH22 ARG 123 -10.495 -0.991 21.337 998 H ASP 124 H ASP 124 -5.565 2.022 12.388 999 HA ASP 124 HA ASP 124 -8.071 1.312 10.999 1000 HB2 ASP 124 HB2 ASP 124 -8.072 3.685 12.273 1001 HB3 ASP 124 HB3 ASP 124 -7.155 4.188 10.872 1002 H HIS 125 H HIS 125 -7.909 1.843 8.604 1003 HA HIS 125 HA HIS 125 -5.125 2.072 7.578 1004 HB2 HIS 125 HB2 HIS 125 -6.991 -0.193 6.764 1005 HB3 HIS 125 HB3 HIS 125 -5.325 0.043 6.261 1006 HD1 HIS 125 HD1 HIS 125 -7.289 -1.744 8.874 1007 HD2 HIS 125 HD2 HIS 125 -3.391 -0.257 8.304 1008 HE1 HIS 125 HE1 HIS 125 -5.820 -2.919 10.595 1009 H ASN 126 H ASN 126 -7.648 3.752 7.415 1010 HA ASN 126 HA ASN 126 -7.557 4.377 4.578 1011 HB2 ASN 126 HB2 ASN 126 -9.978 3.979 4.193 1012 HB3 ASN 126 HB3 ASN 126 -9.151 2.493 4.606 1013 HD21 ASN 126 HD22 ASN 126 -11.420 4.929 5.783 1014 HD22 ASN 126 HD21 ASN 126 -11.853 4.044 7.225 1015 H PHE 127 H PHE 127 -9.209 6.197 4.060 1016 HA PHE 127 HA PHE 127 -10.026 7.960 6.228 1017 HB2 PHE 127 HB2 PHE 127 -8.539 9.866 5.495 1018 HB3 PHE 127 HB3 PHE 127 -7.731 8.578 6.352 1019 HD1 PHE 127 HD2 PHE 127 -8.320 9.969 2.911 1020 HD2 PHE 127 HD1 PHE 127 -5.929 7.364 5.388 1021 HE1 PHE 127 HE2 PHE 127 -6.713 9.651 1.040 1022 HE2 PHE 127 HE1 PHE 127 -4.330 7.061 3.521 1023 HZ PHE 127 HZ PHE 127 -4.717 8.195 1.347 1024 H ALA 128 H ALA 128 -10.898 10.087 5.341 1025 HA ALA 128 HA ALA 128 -12.449 9.464 2.913 1026 HB1 ALA 128 HB1 ALA 128 -13.608 9.992 5.024 1027 HB2 ALA 128 HB2 ALA 128 -12.835 11.597 5.039 1028 HB3 ALA 128 HB3 ALA 128 -13.977 11.170 3.748 1029 H LEU 129 H LEU 129 -12.520 10.668 1.119 1030 HA LEU 129 HA LEU 129 -10.541 12.833 0.639 1031 HB2 LEU 129 HB2 LEU 129 -12.424 11.412 -1.279 1032 HB3 LEU 129 HB3 LEU 129 -11.110 12.512 -1.704 1033 HG LEU 129 HG LEU 129 -10.806 9.744 -0.460 1034 HD11 LEU 129 HD11 LEU 129 -10.748 8.963 -2.554 1035 HD12 LEU 129 HD12 LEU 129 -11.094 10.575 -3.199 1036 HD13 LEU 129 HD13 LEU 129 -9.425 10.058 -2.975 1037 HD21 LEU 129 HD21 LEU 129 -8.679 11.749 -1.233 1038 HD22 LEU 129 HD22 LEU 129 -9.035 11.089 0.387 1039 HD23 LEU 129 HD23 LEU 129 -8.382 10.031 -0.865 1040 H LYS 130 H LYS 130 -11.298 14.653 -0.778 1041 HA LYS 130 HA LYS 130 -12.966 16.403 0.508 1042 HB2 LYS 130 HB2 LYS 130 -11.456 17.182 -1.127 1043 HB3 LYS 130 HB3 LYS 130 -12.152 16.190 -2.412 1044 HG2 LYS 130 HG2 LYS 130 -14.159 17.583 -2.494 1045 HG3 LYS 130 HG3 LYS 130 -13.647 18.471 -1.065 1046 HD2 LYS 130 HD2 LYS 130 -13.250 19.846 -2.974 1047 HD3 LYS 130 HD3 LYS 130 -11.667 19.321 -2.376 1048 HE2 LYS 130 HE2 LYS 130 -11.545 17.601 -4.142 1049 HE3 LYS 130 HE3 LYS 130 -13.184 18.004 -4.683 1050 HZ1 LYS 130 HZ1 LYS 130 -10.931 19.950 -4.693 1051 HZ2 LYS 130 HZ2 LYS 130 -11.379 19.077 -6.008 1052 HZ3 LYS 130 HZ3 LYS 130 -12.420 20.160 -5.371 1053 H ASN 131 H ASN 131 -14.097 14.627 -2.387 1054 HA ASN 131 HA ASN 131 -16.786 15.706 -2.203 1055 HB2 ASN 131 HB2 ASN 131 -15.392 13.573 -3.816 1056 HB3 ASN 131 HB3 ASN 131 -17.147 13.504 -3.723 1057 HD21 ASN 131 HD22 ASN 131 -14.436 15.628 -4.722 1058 HD22 ASN 131 HD21 ASN 131 -15.439 16.582 -5.806 1059 H GLY 132 H GLY 132 -15.258 12.776 -1.015 1060 HA2 GLY 132 HA2 GLY 132 -16.282 12.332 1.273 1061 HA3 GLY 132 HA3 GLY 132 -17.750 11.894 0.383 1062 H PHE 133 H PHE 133 -15.237 10.812 -1.535 1063 HA PHE 133 HA PHE 133 -15.766 8.063 -1.140 1064 HB2 PHE 133 HB2 PHE 133 -13.184 9.186 -2.259 1065 HB3 PHE 133 HB3 PHE 133 -13.996 7.696 -2.711 1066 HD1 PHE 133 HD2 PHE 133 -16.505 8.076 -3.659 1067 HD2 PHE 133 HD1 PHE 133 -13.343 11.011 -3.717 1068 HE1 PHE 133 HE2 PHE 133 -17.649 9.309 -5.491 1069 HE2 PHE 133 HE1 PHE 133 -14.481 12.204 -5.567 1070 HZ PHE 133 HZ PHE 133 -16.654 11.364 -6.434 1071 H ILE 134 H ILE 134 -14.247 6.333 -0.447 1072 HA ILE 134 HA ILE 134 -12.276 7.222 1.615 1073 HB ILE 134 HB ILE 134 -14.110 4.834 1.816 1074 HG12 ILE 134 HG12 ILE 134 -14.536 6.076 4.134 1075 HG13 ILE 134 HG13 ILE 134 -14.063 7.504 3.220 1076 HG21 ILE 134 HG21 ILE 134 -11.892 4.227 2.660 1077 HG22 ILE 134 HG22 ILE 134 -11.852 5.708 3.649 1078 HG23 ILE 134 HG23 ILE 134 -13.020 4.413 3.992 1079 HD11 ILE 134 HD11 ILE 134 -15.909 7.046 1.615 1080 HD12 ILE 134 HD12 ILE 134 -16.296 5.545 2.481 1081 HD13 ILE 134 HD13 ILE 134 -16.523 7.114 3.271 1082 H ALA 135 H ALA 135 -10.325 6.550 1.424 1083 HA ALA 135 HA ALA 135 -9.591 4.464 -0.600 1084 HB1 ALA 135 HB1 ALA 135 -9.104 6.835 -1.267 1085 HB2 ALA 135 HB2 ALA 135 -8.062 6.987 0.163 1086 HB3 ALA 135 HB3 ALA 135 -7.657 5.828 -1.122 1087 H SER 136 H SER 136 -7.892 3.032 -0.022 1088 HA SER 136 HA SER 136 -7.089 3.002 2.854 1089 HB2 SER 136 HB2 SER 136 -9.144 1.659 2.479 1090 HB3 SER 136 HB3 SER 136 -8.290 0.699 1.265 1091 HG SER 136 HG SER 136 -7.359 0.978 3.944 1092 H ASN 137 H ASN 137 -5.292 1.844 3.436 1093 HA ASN 137 HA ASN 137 -3.020 1.622 3.230 1094 HB2 ASN 137 HB2 ASN 137 -3.911 -0.702 2.969 1095 HB3 ASN 137 HB3 ASN 137 -3.844 -0.492 1.219 1096 HD21 ASN 137 HD22 ASN 137 -2.214 -1.925 0.624 1097 HD22 ASN 137 HD21 ASN 137 -0.612 -1.926 1.347 Start of MODEL 6 1 H1 GLY -1 H GLY -1 0.182 -0.335 1.357 2 HA2 GLY -1 HA2 GLY -1 0.788 -0.289 -0.989 3 HA3 GLY -1 HA3 GLY -1 -0.902 -0.764 -0.743 4 H GLY 0 H GLY 0 0.893 1.002 -2.823 5 HA2 GLY 0 HA2 GLY 0 0.536 2.608 -4.318 6 HA3 GLY 0 HA3 GLY 0 -1.168 2.532 -3.931 7 H ALA 1 H ALA 1 -0.483 4.826 -4.688 8 HA ALA 1 HA ALA 1 -0.676 6.554 -2.308 9 HB1 ALA 1 HB1 ALA 1 1.688 6.367 -2.560 10 HB2 ALA 1 HB2 ALA 1 1.588 6.655 -4.314 11 HB3 ALA 1 HB3 ALA 1 1.209 7.947 -3.151 12 H LEU 2 H LEU 2 -1.004 8.847 -2.968 13 HA LEU 2 HA LEU 2 -2.905 9.053 -5.281 14 HB2 LEU 2 HB2 LEU 2 -2.984 10.304 -2.500 15 HB3 LEU 2 HB3 LEU 2 -4.160 10.590 -3.768 16 HG LEU 2 HG LEU 2 -3.661 7.827 -2.580 17 HD11 LEU 2 HD11 LEU 2 -4.379 9.313 -0.784 18 HD12 LEU 2 HD12 LEU 2 -5.766 9.853 -1.745 19 HD13 LEU 2 HD13 LEU 2 -5.653 8.165 -1.216 20 HD21 LEU 2 HD21 LEU 2 -5.998 8.987 -4.159 21 HD22 LEU 2 HD22 LEU 2 -4.773 7.847 -4.754 22 HD23 LEU 2 HD23 LEU 2 -5.897 7.342 -3.488 23 H SER 3 H SER 3 -2.971 11.073 -6.396 24 HA SER 3 HA SER 3 -0.374 12.432 -6.530 25 HB2 SER 3 HB2 SER 3 -1.887 12.049 -8.506 26 HB3 SER 3 HB3 SER 3 -3.006 13.241 -7.809 27 HG SER 3 HG SER 3 -0.478 13.610 -8.964 28 H TYR 4 H TYR 4 -0.108 14.779 -6.335 29 HA TYR 4 HA TYR 4 -0.802 15.949 -3.850 30 HB2 TYR 4 HB2 TYR 4 1.019 16.735 -5.247 31 HB3 TYR 4 HB3 TYR 4 -0.084 17.194 -6.532 32 HD1 TYR 4 HD2 TYR 4 -1.582 19.174 -6.302 33 HD2 TYR 4 HD1 TYR 4 1.379 18.188 -3.319 34 HE1 TYR 4 HE2 TYR 4 -1.808 21.448 -5.321 35 HE2 TYR 4 HE1 TYR 4 1.128 20.449 -2.321 36 HH TYR 4 HH TYR 4 -1.102 22.891 -3.700 37 H GLU 5 H GLU 5 -2.405 16.183 -6.978 38 HA GLU 5 HA GLU 5 -4.414 18.108 -6.499 39 HB2 GLU 5 HB2 GLU 5 -4.525 15.559 -8.160 40 HB3 GLU 5 HB3 GLU 5 -5.625 16.925 -8.341 41 HG2 GLU 5 HG2 GLU 5 -2.610 17.138 -8.755 42 HG3 GLU 5 HG3 GLU 5 -3.756 16.707 -10.007 43 H THR 6 H THR 6 -4.221 14.860 -5.325 44 HA THR 6 HA THR 6 -7.064 14.509 -4.694 45 HB THR 6 HB THR 6 -4.673 12.935 -3.675 46 HG1 THR 6 HG1 THR 6 -4.977 12.760 -5.898 47 HG21 THR 6 HG21 THR 6 -6.487 12.536 -2.183 48 HG22 THR 6 HG22 THR 6 -7.679 12.507 -3.507 49 HG23 THR 6 HG23 THR 6 -6.497 11.196 -3.335 50 H GLU 7 H GLU 7 -7.883 16.036 -3.362 51 HA GLU 7 HA GLU 7 -6.407 16.805 -0.931 52 HB2 GLU 7 HB2 GLU 7 -9.199 17.698 -1.592 53 HB3 GLU 7 HB3 GLU 7 -8.022 18.459 -0.540 54 HG2 GLU 7 HG2 GLU 7 -6.570 18.843 -2.606 55 HG3 GLU 7 HG3 GLU 7 -7.948 18.332 -3.579 56 H ILE 8 H ILE 8 -7.029 16.482 1.123 57 HA ILE 8 HA ILE 8 -8.989 14.295 1.712 58 HB ILE 8 HB ILE 8 -6.336 14.890 3.092 59 HG12 ILE 8 HG12 ILE 8 -5.798 13.991 0.924 60 HG13 ILE 8 HG13 ILE 8 -5.459 12.806 2.177 61 HG21 ILE 8 HG21 ILE 8 -7.925 13.911 4.640 62 HG22 ILE 8 HG22 ILE 8 -8.333 12.623 3.494 63 HG23 ILE 8 HG23 ILE 8 -6.717 12.697 4.220 64 HD11 ILE 8 HD11 ILE 8 -7.585 11.615 1.573 65 HD12 ILE 8 HD12 ILE 8 -7.828 12.768 0.257 66 HD13 ILE 8 HD13 ILE 8 -6.419 11.699 0.243 67 H LEU 9 H LEU 9 -10.520 14.912 3.088 68 HA LEU 9 HA LEU 9 -10.659 17.501 4.332 69 HB2 LEU 9 HB2 LEU 9 -12.593 15.951 3.758 70 HB3 LEU 9 HB3 LEU 9 -12.097 14.928 5.103 71 HG LEU 9 HG LEU 9 -12.441 16.951 6.629 72 HD11 LEU 9 HD11 LEU 9 -12.407 18.748 4.925 73 HD12 LEU 9 HD12 LEU 9 -13.884 18.072 4.198 74 HD13 LEU 9 HD13 LEU 9 -13.918 18.739 5.840 75 HD21 LEU 9 HD21 LEU 9 -14.854 15.935 5.065 76 HD22 LEU 9 HD22 LEU 9 -14.087 15.115 6.441 77 HD23 LEU 9 HD23 LEU 9 -14.889 16.671 6.685 78 H THR 10 H THR 10 -9.630 18.280 6.108 79 HA THR 10 HA THR 10 -8.762 16.399 8.258 80 HB THR 10 HB THR 10 -6.868 17.704 8.728 81 HG1 THR 10 HG1 THR 10 -6.403 19.484 7.210 82 HG21 THR 10 HG21 THR 10 -5.497 17.463 6.766 83 HG22 THR 10 HG22 THR 10 -6.643 16.113 6.809 84 HG23 THR 10 HG23 THR 10 -6.913 17.475 5.699 85 H VAL 11 H VAL 11 -8.873 17.048 10.394 86 HA VAL 11 HA VAL 11 -11.072 18.854 11.025 87 HB VAL 11 HB VAL 11 -9.130 17.571 12.967 88 HG11 VAL 11 HG11 VAL 11 -10.515 19.263 14.057 89 HG12 VAL 11 HG12 VAL 11 -11.984 18.572 13.330 90 HG13 VAL 11 HG13 VAL 11 -11.061 17.662 14.545 91 HG21 VAL 11 HG21 VAL 11 -11.783 16.458 11.975 92 HG22 VAL 11 HG22 VAL 11 -10.197 15.799 11.538 93 HG23 VAL 11 HG23 VAL 11 -10.738 15.740 13.215 94 H GLU 12 H GLU 12 -7.569 19.120 11.123 95 HA GLU 12 HA GLU 12 -7.385 21.492 12.745 96 HB2 GLU 12 HB2 GLU 12 -5.620 20.092 10.739 97 HB3 GLU 12 HB3 GLU 12 -5.129 21.669 11.367 98 HG2 GLU 12 HG2 GLU 12 -5.687 19.211 13.075 99 HG3 GLU 12 HG3 GLU 12 -4.097 19.810 12.599 100 H TYR 13 H TYR 13 -8.042 21.085 9.293 101 HA TYR 13 HA TYR 13 -8.281 24.053 8.991 102 HB2 TYR 13 HB2 TYR 13 -6.658 22.166 7.254 103 HB3 TYR 13 HB3 TYR 13 -7.085 23.801 6.786 104 HD1 TYR 13 HD2 TYR 13 -6.497 25.652 8.705 105 HD2 TYR 13 HD1 TYR 13 -4.439 21.907 8.046 106 HE1 TYR 13 HE2 TYR 13 -4.449 26.590 9.756 107 HE2 TYR 13 HE1 TYR 13 -2.390 22.860 9.092 108 HH TYR 13 HH TYR 13 -2.283 26.212 10.344 109 H GLY 14 H GLY 14 -8.697 20.964 7.121 110 HA2 GLY 14 HA2 GLY 14 -11.239 20.770 6.431 111 HA3 GLY 14 HA3 GLY 14 -10.882 22.277 5.586 112 H LEU 15 H LEU 15 -11.181 21.490 3.558 113 HA LEU 15 HA LEU 15 -9.977 19.079 2.465 114 HB2 LEU 15 HB2 LEU 15 -11.207 21.559 1.167 115 HB3 LEU 15 HB3 LEU 15 -10.789 20.079 0.312 116 HG LEU 15 HG LEU 15 -12.884 20.299 2.531 117 HD11 LEU 15 HD11 LEU 15 -13.559 21.430 0.450 118 HD12 LEU 15 HD12 LEU 15 -13.192 19.956 -0.478 119 HD13 LEU 15 HD13 LEU 15 -14.504 19.956 0.724 120 HD21 LEU 15 HD21 LEU 15 -11.973 18.014 0.762 121 HD22 LEU 15 HD22 LEU 15 -11.965 18.067 2.527 122 HD23 LEU 15 HD23 LEU 15 -13.510 17.995 1.671 123 H LEU 16 H LEU 16 -7.761 18.996 2.569 124 HA LEU 16 HA LEU 16 -6.263 21.036 0.988 125 HB2 LEU 16 HB2 LEU 16 -5.681 19.802 3.695 126 HB3 LEU 16 HB3 LEU 16 -4.371 20.442 2.715 127 HG LEU 16 HG LEU 16 -6.782 22.116 3.554 128 HD11 LEU 16 HD11 LEU 16 -5.514 21.335 5.490 129 HD12 LEU 16 HD12 LEU 16 -3.997 21.912 4.769 130 HD13 LEU 16 HD13 LEU 16 -5.262 23.076 5.230 131 HD21 LEU 16 HD21 LEU 16 -4.040 22.870 2.434 132 HD22 LEU 16 HD22 LEU 16 -5.593 23.011 1.575 133 HD23 LEU 16 HD23 LEU 16 -5.283 24.013 2.994 134 HA PRO 17 HA PRO 17 -4.583 17.762 -1.422 135 HB2 PRO 17 HB2 PRO 17 -2.117 18.763 -2.117 136 HB3 PRO 17 HB3 PRO 17 -3.676 19.351 -2.774 137 HG2 PRO 17 HG2 PRO 17 -2.051 20.525 -0.519 138 HG3 PRO 17 HG3 PRO 17 -2.792 21.369 -1.918 139 HD2 PRO 17 HD2 PRO 17 -3.987 21.311 0.503 140 HD3 PRO 17 HD3 PRO 17 -4.955 21.175 -0.994 141 H ILE 18 H ILE 18 -3.791 15.800 -0.906 142 HA ILE 18 HA ILE 18 -2.490 15.220 1.527 143 HB ILE 18 HB ILE 18 -3.757 13.599 0.170 144 HG12 ILE 18 HG12 ILE 18 -0.947 12.594 0.782 145 HG13 ILE 18 HG13 ILE 18 -2.147 12.981 2.023 146 HG21 ILE 18 HG21 ILE 18 -2.719 14.166 -2.073 147 HG22 ILE 18 HG22 ILE 18 -1.286 13.247 -1.574 148 HG23 ILE 18 HG23 ILE 18 -2.859 12.449 -1.721 149 HD11 ILE 18 HD11 ILE 18 -3.685 11.271 1.019 150 HD12 ILE 18 HD12 ILE 18 -2.369 10.807 -0.090 151 HD13 ILE 18 HD13 ILE 18 -2.169 10.612 1.659 152 H GLY 19 H GLY 19 -1.028 15.999 -1.613 153 HA2 GLY 19 HA2 GLY 19 1.613 15.108 -0.983 154 HA3 GLY 19 HA3 GLY 19 1.198 16.322 -2.200 155 H LYS 20 H LYS 20 -0.060 18.151 -0.158 156 HA LYS 20 HA LYS 20 2.420 19.474 0.678 157 HB2 LYS 20 HB2 LYS 20 0.208 20.517 -0.204 158 HB3 LYS 20 HB3 LYS 20 -0.389 20.335 1.451 159 HG2 LYS 20 HG2 LYS 20 1.402 21.804 2.276 160 HG3 LYS 20 HG3 LYS 20 2.215 21.749 0.708 161 HD2 LYS 20 HD2 LYS 20 1.124 23.868 0.803 162 HD3 LYS 20 HD3 LYS 20 0.258 22.871 -0.353 163 HE2 LYS 20 HE2 LYS 20 -1.434 23.956 0.847 164 HE3 LYS 20 HE3 LYS 20 -1.411 22.328 1.529 165 HZ1 LYS 20 HZ1 LYS 20 -0.083 23.237 3.398 166 HZ2 LYS 20 HZ2 LYS 20 -0.114 24.731 2.729 167 HZ3 LYS 20 HZ3 LYS 20 -1.496 24.052 3.262 168 H ILE 21 H ILE 21 0.028 17.416 2.168 169 HA ILE 21 HA ILE 21 0.800 17.955 4.929 170 HB ILE 21 HB ILE 21 -0.767 15.692 3.684 171 HG12 ILE 21 HG12 ILE 21 -1.816 18.062 5.303 172 HG13 ILE 21 HG13 ILE 21 -1.768 18.060 3.545 173 HG21 ILE 21 HG21 ILE 21 0.142 14.905 5.792 174 HG22 ILE 21 HG22 ILE 21 -0.507 16.326 6.638 175 HG23 ILE 21 HG23 ILE 21 -1.588 15.121 5.927 176 HD11 ILE 21 HD11 ILE 21 -3.247 16.055 3.504 177 HD12 ILE 21 HD12 ILE 21 -3.441 16.209 5.268 178 HD13 ILE 21 HD13 ILE 21 -3.986 17.507 4.196 179 H VAL 22 H VAL 22 1.566 15.475 2.475 180 HA VAL 22 HA VAL 22 3.384 14.052 4.251 181 HB VAL 22 HB VAL 22 2.802 13.872 1.284 182 HG11 VAL 22 HG11 VAL 22 5.078 13.013 1.664 183 HG12 VAL 22 HG12 VAL 22 4.488 11.980 2.984 184 HG13 VAL 22 HG13 VAL 22 3.956 11.709 1.319 185 HG21 VAL 22 HG21 VAL 22 2.032 12.134 3.686 186 HG22 VAL 22 HG22 VAL 22 0.938 13.205 2.779 187 HG23 VAL 22 HG23 VAL 22 1.624 11.771 2.010 188 H GLU 23 H GLU 23 3.934 16.419 1.583 189 HA GLU 23 HA GLU 23 6.804 16.150 1.654 190 HB2 GLU 23 HB2 GLU 23 4.996 18.393 0.691 191 HB3 GLU 23 HB3 GLU 23 6.738 18.430 0.494 192 HG2 GLU 23 HG2 GLU 23 5.147 16.075 -0.562 193 HG3 GLU 23 HG3 GLU 23 5.224 17.591 -1.453 194 H LYS 24 H LYS 24 4.581 18.010 3.614 195 HA LYS 24 HA LYS 24 6.880 19.319 5.030 196 HB2 LYS 24 HB2 LYS 24 3.970 20.176 5.005 197 HB3 LYS 24 HB3 LYS 24 5.303 21.073 5.688 198 HG2 LYS 24 HG2 LYS 24 4.786 20.492 2.749 199 HG3 LYS 24 HG3 LYS 24 4.573 22.028 3.565 200 HD2 LYS 24 HD2 LYS 24 7.271 20.662 3.091 201 HD3 LYS 24 HD3 LYS 24 6.561 21.938 2.126 202 HE2 LYS 24 HE2 LYS 24 7.978 23.167 3.407 203 HE3 LYS 24 HE3 LYS 24 6.479 23.340 4.318 204 HZ1 LYS 24 HZ1 LYS 24 7.318 21.641 5.868 205 HZ2 LYS 24 HZ2 LYS 24 8.670 21.417 4.957 206 HZ3 LYS 24 HZ3 LYS 24 8.418 22.830 5.724 207 H ARG 25 H ARG 25 4.997 16.714 5.426 208 HA ARG 25 HA ARG 25 4.218 15.413 7.123 209 HB2 ARG 25 HB2 ARG 25 6.665 16.506 8.537 210 HB3 ARG 25 HB3 ARG 25 5.760 15.077 9.030 211 HG2 ARG 25 HG2 ARG 25 6.757 13.745 7.496 212 HG3 ARG 25 HG3 ARG 25 6.479 14.885 6.193 213 HD2 ARG 25 HD2 ARG 25 8.797 14.728 6.296 214 HD3 ARG 25 HD3 ARG 25 8.409 16.266 7.086 215 HE ARG 25 HE ARG 25 8.568 14.080 8.997 216 HH11 ARG 25 HH11 ARG 25 10.669 16.240 7.197 217 HH12 ARG 25 HH12 ARG 25 12.010 15.978 8.284 218 HH21 ARG 25 HH21 ARG 25 10.325 13.770 10.314 219 HH22 ARG 25 HH22 ARG 25 11.817 14.614 9.993 220 H ILE 26 H ILE 26 2.578 17.300 6.933 221 HA ILE 26 HA ILE 26 2.316 19.096 9.213 222 HB ILE 26 HB ILE 26 0.226 18.341 7.136 223 HG12 ILE 26 HG12 ILE 26 2.201 20.667 7.239 224 HG13 ILE 26 HG13 ILE 26 2.250 19.302 6.124 225 HG21 ILE 26 HG21 ILE 26 -0.758 19.314 9.206 226 HG22 ILE 26 HG22 ILE 26 0.325 20.713 9.050 227 HG23 ILE 26 HG23 ILE 26 -0.937 20.394 7.837 228 HD11 ILE 26 HD11 ILE 26 0.023 20.034 5.198 229 HD12 ILE 26 HD12 ILE 26 0.187 21.517 6.173 230 HD13 ILE 26 HD13 ILE 26 1.380 21.138 4.915 231 H GLU 27 H GLU 27 1.665 18.571 11.188 232 HA GLU 27 HA GLU 27 0.430 15.944 11.692 233 HB2 GLU 27 HB2 GLU 27 1.059 17.967 13.828 234 HB3 GLU 27 HB3 GLU 27 0.820 16.207 13.911 235 HG2 GLU 27 HG2 GLU 27 2.936 15.938 12.566 236 HG3 GLU 27 HG3 GLU 27 3.194 17.679 12.687 237 H CYS 28 H CYS 28 -1.564 15.903 11.015 238 HA CYS 28 HA CYS 28 -3.566 17.712 12.277 239 HB2 CYS 28 HB2 CYS 28 -4.729 17.865 10.088 240 HB3 CYS 28 HB3 CYS 28 -3.085 18.507 10.010 241 HG CYS 28 HG CYS 28 -3.446 17.325 7.773 242 H THR 29 H THR 29 -5.831 16.684 11.319 243 HA THR 29 HA THR 29 -5.939 13.851 12.276 244 HB THR 29 HB THR 29 -8.146 15.796 12.810 245 HG1 THR 29 HG1 THR 29 -5.928 15.545 14.535 246 HG21 THR 29 HG21 THR 29 -8.441 13.401 13.361 247 HG22 THR 29 HG22 THR 29 -7.119 13.544 14.552 248 HG23 THR 29 HG23 THR 29 -8.619 14.475 14.757 249 H VAL 30 H VAL 30 -7.471 12.591 11.226 250 HA VAL 30 HA VAL 30 -8.727 13.730 8.748 251 HB VAL 30 HB VAL 30 -8.148 11.768 7.517 252 HG11 VAL 30 HG11 VAL 30 -6.455 13.604 7.651 253 HG12 VAL 30 HG12 VAL 30 -5.610 12.684 8.919 254 HG13 VAL 30 HG13 VAL 30 -5.775 12.010 7.287 255 HG21 VAL 30 HG21 VAL 30 -6.740 10.693 9.994 256 HG22 VAL 30 HG22 VAL 30 -8.211 10.027 9.248 257 HG23 VAL 30 HG23 VAL 30 -6.680 9.985 8.369 258 H TYR 31 H TYR 31 -10.334 11.925 7.834 259 HA TYR 31 HA TYR 31 -12.159 11.229 10.091 260 HB2 TYR 31 HB2 TYR 31 -12.849 12.271 7.316 261 HB3 TYR 31 HB3 TYR 31 -14.001 11.687 8.489 262 HD1 TYR 31 HD2 TYR 31 -11.361 14.331 8.041 263 HD2 TYR 31 HD1 TYR 31 -15.061 13.192 9.937 264 HE1 TYR 31 HE2 TYR 31 -11.674 16.660 8.860 265 HE2 TYR 31 HE1 TYR 31 -15.382 15.525 10.726 266 HH TYR 31 HH TYR 31 -14.544 17.657 10.726 267 H SER 32 H SER 32 -13.291 9.344 9.948 268 HA SER 32 HA SER 32 -13.127 7.526 7.650 269 HB2 SER 32 HB2 SER 32 -10.924 7.199 8.649 270 HB3 SER 32 HB3 SER 32 -11.634 7.017 10.252 271 HG SER 32 HG SER 32 -11.273 4.951 9.397 272 H VAL 33 H VAL 33 -14.258 5.387 8.302 273 HA VAL 33 HA VAL 33 -16.525 5.944 10.179 274 HB VAL 33 HB VAL 33 -17.632 6.032 8.199 275 HG11 VAL 33 HG11 VAL 33 -15.874 5.346 6.586 276 HG12 VAL 33 HG12 VAL 33 -16.038 3.658 7.134 277 HG13 VAL 33 HG13 VAL 33 -17.374 4.465 6.287 278 HG21 VAL 33 HG21 VAL 33 -17.860 3.097 8.775 279 HG22 VAL 33 HG22 VAL 33 -18.558 4.409 9.759 280 HG23 VAL 33 HG23 VAL 33 -19.057 4.199 8.066 281 H ASP 34 H ASP 34 -16.836 4.642 11.766 282 HA ASP 34 HA ASP 34 -15.026 2.383 12.225 283 HB2 ASP 34 HB2 ASP 34 -15.887 4.144 13.943 284 HB3 ASP 34 HB3 ASP 34 -17.380 3.209 13.922 285 H ASN 35 H ASN 35 -16.209 0.501 13.424 286 HA ASN 35 HA ASN 35 -17.613 -1.160 11.543 287 HB2 ASN 35 HB2 ASN 35 -17.395 -1.393 14.581 288 HB3 ASN 35 HB3 ASN 35 -17.903 -2.678 13.491 289 HD21 ASN 35 HD22 ASN 35 -15.321 -1.744 15.267 290 HD22 ASN 35 HD21 ASN 35 -14.042 -2.420 14.269 291 H ASN 36 H ASN 36 -18.785 1.172 13.853 292 HA ASN 36 HA ASN 36 -21.591 0.267 13.767 293 HB2 ASN 36 HB2 ASN 36 -20.142 2.574 15.159 294 HB3 ASN 36 HB3 ASN 36 -21.864 2.248 15.315 295 HD21 ASN 36 HD22 ASN 36 -18.687 1.289 16.442 296 HD22 ASN 36 HD21 ASN 36 -19.293 0.051 17.527 297 H GLY 37 H GLY 37 -19.718 2.139 11.618 298 HA2 GLY 37 HA2 GLY 37 -20.433 3.295 9.768 299 HA3 GLY 37 HA3 GLY 37 -22.078 3.304 10.321 300 H ASN 38 H ASN 38 -20.044 4.449 12.794 301 HA ASN 38 HA ASN 38 -20.993 7.220 12.488 302 HB2 ASN 38 HB2 ASN 38 -19.151 5.882 14.528 303 HB3 ASN 38 HB3 ASN 38 -19.718 7.544 14.622 304 HD21 ASN 38 HD22 ASN 38 -20.149 5.106 16.403 305 HD22 ASN 38 HD21 ASN 38 -21.897 5.073 16.600 306 H ILE 39 H ILE 39 -19.871 8.807 11.472 307 HA ILE 39 HA ILE 39 -17.162 8.425 10.498 308 HB ILE 39 HB ILE 39 -18.761 10.998 10.630 309 HG12 ILE 39 HG12 ILE 39 -18.439 9.029 8.309 310 HG13 ILE 39 HG13 ILE 39 -19.907 9.215 9.270 311 HG21 ILE 39 HG21 ILE 39 -17.103 11.779 8.973 312 HG22 ILE 39 HG22 ILE 39 -16.260 11.223 10.407 313 HG23 ILE 39 HG23 ILE 39 -16.318 10.184 8.972 314 HD11 ILE 39 HD11 ILE 39 -20.077 11.594 8.567 315 HD12 ILE 39 HD12 ILE 39 -18.689 11.343 7.485 316 HD13 ILE 39 HD13 ILE 39 -20.190 10.435 7.227 317 H TYR 40 H TYR 40 -15.572 8.314 11.922 318 HA TYR 40 HA TYR 40 -15.468 10.133 14.296 319 HB2 TYR 40 HB2 TYR 40 -14.225 8.517 15.454 320 HB3 TYR 40 HB3 TYR 40 -15.577 7.646 14.764 321 HD1 TYR 40 HD1 TYR 40 -15.203 6.005 12.900 322 HD2 TYR 40 HD2 TYR 40 -11.933 8.104 14.782 323 HE1 TYR 40 HE1 TYR 40 -13.586 4.411 11.880 324 HE2 TYR 40 HE2 TYR 40 -10.322 6.550 13.694 325 HH TYR 40 HH TYR 40 -11.288 3.966 11.466 326 H THR 41 H THR 41 -13.041 10.512 14.918 327 HA THR 41 HA THR 41 -11.416 11.000 12.480 328 HB THR 41 HB THR 41 -10.680 13.178 13.535 329 HG1 THR 41 HG1 THR 41 -12.164 14.085 14.996 330 HG21 THR 41 HG21 THR 41 -12.136 13.286 11.652 331 HG22 THR 41 HG22 THR 41 -13.568 12.886 12.633 332 HG23 THR 41 HG23 THR 41 -12.744 14.436 12.847 333 H GLN 42 H GLN 42 -9.204 11.086 12.673 334 HA GLN 42 HA GLN 42 -7.969 10.129 15.197 335 HB2 GLN 42 HB2 GLN 42 -6.946 8.210 14.084 336 HB3 GLN 42 HB3 GLN 42 -8.703 8.120 14.022 337 HG2 GLN 42 HG2 GLN 42 -8.594 9.022 11.644 338 HG3 GLN 42 HG3 GLN 42 -6.834 8.894 11.734 339 HE21 GLN 42 HE22 GLN 42 -8.153 7.536 9.706 340 HE22 GLN 42 HE21 GLN 42 -8.142 5.825 10.075 341 HA PRO 43 HA PRO 43 -4.723 12.791 13.699 342 HB2 PRO 43 HB2 PRO 43 -2.608 12.071 15.257 343 HB3 PRO 43 HB3 PRO 43 -4.046 12.918 15.905 344 HG2 PRO 43 HG2 PRO 43 -3.461 9.940 15.951 345 HG3 PRO 43 HG3 PRO 43 -3.995 10.985 17.308 346 HD2 PRO 43 HD2 PRO 43 -5.749 9.473 15.859 347 HD3 PRO 43 HD3 PRO 43 -6.197 11.089 16.484 348 H VAL 44 H VAL 44 -2.958 12.830 12.293 349 HA VAL 44 HA VAL 44 -2.243 10.459 10.753 350 HB VAL 44 HB VAL 44 -0.792 13.144 10.985 351 HG11 VAL 44 HG11 VAL 44 0.710 11.539 10.031 352 HG12 VAL 44 HG12 VAL 44 -0.569 10.825 9.018 353 HG13 VAL 44 HG13 VAL 44 0.042 12.446 8.679 354 HG21 VAL 44 HG21 VAL 44 -2.808 12.235 8.892 355 HG22 VAL 44 HG22 VAL 44 -3.091 13.466 10.141 356 HG23 VAL 44 HG23 VAL 44 -1.882 13.757 8.897 357 H ALA 45 H ALA 45 -0.871 8.862 11.351 358 HA ALA 45 HA ALA 45 0.747 9.173 13.792 359 HB1 ALA 45 HB1 ALA 45 -0.570 7.116 13.304 360 HB2 ALA 45 HB2 ALA 45 0.487 6.797 11.909 361 HB3 ALA 45 HB3 ALA 45 1.164 6.805 13.545 362 H GLN 46 H GLN 46 1.325 8.575 10.303 363 HA GLN 46 HA GLN 46 3.991 9.829 10.417 364 HB2 GLN 46 HB2 GLN 46 3.562 6.946 9.512 365 HB3 GLN 46 HB3 GLN 46 5.033 7.863 9.229 366 HG2 GLN 46 HG2 GLN 46 3.972 7.011 11.938 367 HG3 GLN 46 HG3 GLN 46 5.330 6.326 11.068 368 HE21 GLN 46 HE22 GLN 46 5.373 7.495 13.774 369 HE22 GLN 46 HE21 GLN 46 6.530 8.815 13.686 370 H TRP 47 H TRP 47 4.974 9.573 8.049 371 HA TRP 47 HA TRP 47 2.903 10.053 5.955 372 HB2 TRP 47 HB2 TRP 47 5.310 11.845 6.446 373 HB3 TRP 47 HB3 TRP 47 4.080 12.042 5.213 374 HD1 TRP 47 HD1 TRP 47 1.984 13.445 5.832 375 HE1 TRP 47 HE1 TRP 47 1.172 14.690 7.923 376 HE3 TRP 47 HE3 TRP 47 5.449 11.726 9.200 377 HZ2 TRP 47 HZ2 TRP 47 1.716 14.623 10.742 378 HZ3 TRP 47 HZ3 TRP 47 5.217 12.274 11.613 379 HH2 TRP 47 HH2 TRP 47 3.323 13.683 12.399 380 H HIS 48 H HIS 48 3.488 9.325 3.932 381 HA HIS 48 HA HIS 48 6.273 8.332 3.505 382 HB2 HIS 48 HB2 HIS 48 3.768 6.838 2.703 383 HB3 HIS 48 HB3 HIS 48 5.426 6.284 2.594 384 HD1 HIS 48 HD1 HIS 48 6.613 5.863 5.186 385 HD2 HIS 48 HD2 HIS 48 2.430 6.206 4.834 386 HE1 HIS 48 HE1 HIS 48 5.633 4.910 7.339 387 H ASP 49 H ASP 49 7.142 8.811 1.630 388 HA ASP 49 HA ASP 49 5.481 9.913 -0.591 389 HB2 ASP 49 HB2 ASP 49 7.252 11.483 -1.054 390 HB3 ASP 49 HB3 ASP 49 6.613 11.707 0.563 391 H ARG 50 H ARG 50 5.549 8.817 -2.362 392 HA ARG 50 HA ARG 50 7.392 6.540 -2.730 393 HB2 ARG 50 HB2 ARG 50 5.126 7.626 -4.406 394 HB3 ARG 50 HB3 ARG 50 5.929 6.077 -4.636 395 HG2 ARG 50 HG2 ARG 50 4.268 6.917 -2.212 396 HG3 ARG 50 HG3 ARG 50 3.776 5.795 -3.459 397 HD2 ARG 50 HD2 ARG 50 5.997 5.357 -1.427 398 HD3 ARG 50 HD3 ARG 50 4.404 4.594 -1.459 399 HE ARG 50 HE ARG 50 5.970 4.126 -3.903 400 HH11 ARG 50 HH11 ARG 50 5.601 2.881 -0.646 401 HH12 ARG 50 HH12 ARG 50 6.122 1.285 -1.128 402 HH21 ARG 50 HH21 ARG 50 6.446 2.115 -4.464 403 HH22 ARG 50 HH22 ARG 50 6.638 0.867 -3.249 404 H GLY 51 H GLY 51 6.883 9.675 -4.168 405 HA2 GLY 51 HA2 GLY 51 8.609 10.978 -5.145 406 HA3 GLY 51 HA3 GLY 51 9.501 9.521 -5.545 407 H GLU 52 H GLU 52 7.724 8.032 -7.061 408 HA GLU 52 HA GLU 52 6.528 9.484 -9.270 409 HB2 GLU 52 HB2 GLU 52 9.406 8.567 -9.613 410 HB3 GLU 52 HB3 GLU 52 8.236 8.606 -10.930 411 HG2 GLU 52 HG2 GLU 52 7.878 11.061 -10.463 412 HG3 GLU 52 HG3 GLU 52 9.311 10.985 -9.424 413 H GLN 53 H GLN 53 4.917 7.892 -9.036 414 HA GLN 53 HA GLN 53 5.600 5.296 -10.368 415 HB2 GLN 53 HB2 GLN 53 3.485 5.880 -8.279 416 HB3 GLN 53 HB3 GLN 53 3.858 4.280 -8.978 417 HG2 GLN 53 HG2 GLN 53 6.240 4.549 -8.117 418 HG3 GLN 53 HG3 GLN 53 5.696 6.012 -7.257 419 HE21 GLN 53 HE22 GLN 53 3.176 5.113 -6.170 420 HE22 GLN 53 HE21 GLN 53 3.933 4.420 -4.808 421 H GLU 54 H GLU 54 3.814 4.293 -11.558 422 HA GLU 54 HA GLU 54 2.758 6.102 -13.501 423 HB2 GLU 54 HB2 GLU 54 1.726 4.098 -14.496 424 HB3 GLU 54 HB3 GLU 54 3.452 3.982 -14.192 425 HG2 GLU 54 HG2 GLU 54 2.937 2.625 -12.109 426 HG3 GLU 54 HG3 GLU 54 1.244 2.613 -12.602 427 H VAL 55 H VAL 55 1.243 7.515 -13.120 428 HA VAL 55 HA VAL 55 -1.085 6.898 -11.383 429 HB VAL 55 HB VAL 55 -0.313 9.570 -12.622 430 HG11 VAL 55 HG11 VAL 55 -2.708 9.370 -11.902 431 HG12 VAL 55 HG12 VAL 55 -2.155 8.882 -10.288 432 HG13 VAL 55 HG13 VAL 55 -1.800 10.509 -10.910 433 HG21 VAL 55 HG21 VAL 55 0.364 8.320 -9.938 434 HG22 VAL 55 HG22 VAL 55 1.468 9.039 -11.127 435 HG23 VAL 55 HG23 VAL 55 0.381 10.077 -10.204 436 H PHE 56 H PHE 56 -3.066 6.670 -12.057 437 HA PHE 56 HA PHE 56 -3.805 7.260 -14.908 438 HB2 PHE 56 HB2 PHE 56 -4.685 5.013 -13.081 439 HB3 PHE 56 HB3 PHE 56 -5.447 5.391 -14.620 440 HD1 PHE 56 HD1 PHE 56 -2.321 4.136 -13.006 441 HD2 PHE 56 HD2 PHE 56 -4.448 4.704 -16.717 442 HE1 PHE 56 HE1 PHE 56 -0.554 2.892 -14.207 443 HE2 PHE 56 HE2 PHE 56 -2.711 3.370 -17.901 444 HZ PHE 56 HZ PHE 56 -0.727 2.531 -16.664 445 H GLU 57 H GLU 57 -5.651 8.363 -15.269 446 HA GLU 57 HA GLU 57 -7.117 9.615 -13.029 447 HB2 GLU 57 HB2 GLU 57 -6.531 10.848 -15.145 448 HB3 GLU 57 HB3 GLU 57 -7.563 9.756 -16.050 449 HG2 GLU 57 HG2 GLU 57 -9.531 10.543 -14.836 450 HG3 GLU 57 HG3 GLU 57 -8.522 11.496 -13.739 451 H TYR 58 H TYR 58 -8.917 8.762 -12.239 452 HA TYR 58 HA TYR 58 -10.458 6.696 -13.773 453 HB2 TYR 58 HB2 TYR 58 -10.078 6.974 -10.778 454 HB3 TYR 58 HB3 TYR 58 -11.072 5.778 -11.587 455 HD1 TYR 58 HD2 TYR 58 -9.960 4.042 -13.095 456 HD2 TYR 58 HD1 TYR 58 -7.706 6.677 -10.534 457 HE1 TYR 58 HE2 TYR 58 -8.077 2.446 -13.139 458 HE2 TYR 58 HE1 TYR 58 -5.776 5.099 -10.633 459 HH TYR 58 HH TYR 58 -5.953 2.036 -12.462 460 H CYS 59 H CYS 59 -11.818 8.090 -14.783 461 HA CYS 59 HA CYS 59 -13.224 10.254 -13.413 462 HB2 CYS 59 HB2 CYS 59 -12.556 10.303 -15.830 463 HB3 CYS 59 HB3 CYS 59 -13.685 8.967 -16.141 464 HG CYS 59 HG CYS 59 -14.713 11.258 -16.969 465 H LEU 60 H LEU 60 -15.086 10.090 -12.317 466 HA LEU 60 HA LEU 60 -16.604 7.533 -12.284 467 HB2 LEU 60 HB2 LEU 60 -16.044 9.603 -10.378 468 HB3 LEU 60 HB3 LEU 60 -17.757 9.658 -10.669 469 HG LEU 60 HG LEU 60 -17.975 7.261 -10.163 470 HD11 LEU 60 HD11 LEU 60 -16.306 5.809 -9.793 471 HD12 LEU 60 HD12 LEU 60 -15.225 6.987 -10.573 472 HD13 LEU 60 HD13 LEU 60 -15.359 6.936 -8.818 473 HD21 LEU 60 HD21 LEU 60 -16.496 8.786 -7.991 474 HD22 LEU 60 HD22 LEU 60 -18.211 8.981 -8.385 475 HD23 LEU 60 HD23 LEU 60 -17.627 7.430 -7.756 476 H GLU 61 H GLU 61 -18.975 7.592 -12.323 477 HA GLU 61 HA GLU 61 -19.923 8.623 -14.817 478 HB2 GLU 61 HB2 GLU 61 -21.498 7.558 -12.440 479 HB3 GLU 61 HB3 GLU 61 -22.145 7.826 -14.061 480 HG2 GLU 61 HG2 GLU 61 -20.483 6.202 -14.978 481 HG3 GLU 61 HG3 GLU 61 -19.915 5.882 -13.339 482 H ASP 62 H ASP 62 -19.924 10.110 -11.695 483 HA ASP 62 HA ASP 62 -21.911 12.200 -12.348 484 HB2 ASP 62 HB2 ASP 62 -21.644 11.343 -10.046 485 HB3 ASP 62 HB3 ASP 62 -19.973 11.914 -10.017 486 H GLY 63 H GLY 63 -18.440 11.768 -12.655 487 HA2 GLY 63 HA2 GLY 63 -17.266 13.250 -14.203 488 HA3 GLY 63 HA3 GLY 63 -18.075 14.636 -13.473 489 H SER 64 H SER 64 -17.363 12.752 -10.847 490 HA SER 64 HA SER 64 -15.158 14.268 -9.878 491 HB2 SER 64 HB2 SER 64 -15.827 11.411 -9.076 492 HB3 SER 64 HB3 SER 64 -15.020 12.648 -8.107 493 HG SER 64 HG SER 64 -16.995 13.811 -8.093 494 H LEU 65 H LEU 65 -12.946 13.925 -9.881 495 HA LEU 65 HA LEU 65 -11.885 11.705 -11.601 496 HB2 LEU 65 HB2 LEU 65 -10.740 14.494 -11.260 497 HB3 LEU 65 HB3 LEU 65 -10.100 13.199 -12.271 498 HG LEU 65 HG LEU 65 -12.723 14.688 -12.709 499 HD11 LEU 65 HD11 LEU 65 -10.674 15.997 -13.188 500 HD12 LEU 65 HD12 LEU 65 -10.129 14.709 -14.291 501 HD13 LEU 65 HD13 LEU 65 -11.600 15.634 -14.654 502 HD21 LEU 65 HD21 LEU 65 -11.384 12.496 -14.356 503 HD22 LEU 65 HD22 LEU 65 -12.977 12.435 -13.566 504 HD23 LEU 65 HD23 LEU 65 -12.721 13.519 -14.927 505 H ILE 66 H ILE 66 -10.713 10.309 -10.550 506 HA ILE 66 HA ILE 66 -9.284 11.063 -8.025 507 HB ILE 66 HB ILE 66 -10.280 8.336 -8.947 508 HG12 ILE 66 HG12 ILE 66 -11.364 10.155 -6.744 509 HG13 ILE 66 HG13 ILE 66 -12.151 9.838 -8.290 510 HG21 ILE 66 HG21 ILE 66 -8.202 8.236 -7.566 511 HG22 ILE 66 HG22 ILE 66 -9.016 9.181 -6.295 512 HG23 ILE 66 HG23 ILE 66 -9.581 7.553 -6.728 513 HD11 ILE 66 HD11 ILE 66 -12.293 7.402 -7.686 514 HD12 ILE 66 HD12 ILE 66 -11.742 7.842 -6.047 515 HD13 ILE 66 HD13 ILE 66 -13.257 8.502 -6.685 516 H ARG 67 H ARG 67 -7.099 10.917 -8.081 517 HA ARG 67 HA ARG 67 -5.786 9.789 -10.536 518 HB2 ARG 67 HB2 ARG 67 -5.163 12.414 -9.123 519 HB3 ARG 67 HB3 ARG 67 -4.166 11.651 -10.378 520 HG2 ARG 67 HG2 ARG 67 -6.178 11.682 -11.909 521 HG3 ARG 67 HG3 ARG 67 -7.037 12.639 -10.692 522 HD2 ARG 67 HD2 ARG 67 -5.342 14.412 -10.849 523 HD3 ARG 67 HD3 ARG 67 -4.398 13.447 -11.980 524 HE ARG 67 HE ARG 67 -6.220 13.600 -13.623 525 HH11 ARG 67 HH11 ARG 67 -6.407 16.030 -11.076 526 HH12 ARG 67 HH12 ARG 67 -7.420 17.057 -12.053 527 HH21 ARG 67 HH21 ARG 67 -7.595 14.843 -14.684 528 HH22 ARG 67 HH22 ARG 67 -8.016 16.443 -14.089 529 H ALA 68 H ALA 68 -5.039 7.975 -9.831 530 HA ALA 68 HA ALA 68 -3.222 7.871 -7.474 531 HB1 ALA 68 HB1 ALA 68 -5.628 7.481 -6.793 532 HB2 ALA 68 HB2 ALA 68 -5.661 6.076 -7.876 533 HB3 ALA 68 HB3 ALA 68 -4.559 6.097 -6.479 534 H THR 69 H THR 69 -2.279 5.702 -7.189 535 HA THR 69 HA THR 69 -1.393 4.441 -9.722 536 HB THR 69 HB THR 69 -0.054 3.006 -8.119 537 HG1 THR 69 HG1 THR 69 -1.625 3.620 -6.353 538 HG21 THR 69 HG21 THR 69 0.909 4.996 -9.163 539 HG22 THR 69 HG22 THR 69 0.288 6.018 -7.848 540 HG23 THR 69 HG23 THR 69 1.516 4.769 -7.507 541 H LYS 70 H LYS 70 -1.662 2.256 -10.165 542 HA LYS 70 HA LYS 70 -4.180 1.043 -9.529 543 HB2 LYS 70 HB2 LYS 70 -1.725 0.246 -11.096 544 HB3 LYS 70 HB3 LYS 70 -2.808 -1.038 -10.584 545 HG2 LYS 70 HG2 LYS 70 -4.739 0.315 -11.549 546 HG3 LYS 70 HG3 LYS 70 -3.522 1.350 -12.324 547 HD2 LYS 70 HD2 LYS 70 -3.640 -1.674 -12.646 548 HD3 LYS 70 HD3 LYS 70 -4.545 -0.599 -13.696 549 HE2 LYS 70 HE2 LYS 70 -1.564 -0.170 -13.355 550 HE3 LYS 70 HE3 LYS 70 -2.134 -1.529 -14.326 551 HZ1 LYS 70 HZ1 LYS 70 -3.383 -0.019 -15.705 552 HZ2 LYS 70 HZ2 LYS 70 -2.861 1.288 -14.832 553 HZ3 LYS 70 HZ3 LYS 70 -1.799 0.389 -15.701 554 H ASP 71 H ASP 71 -1.454 1.098 -7.596 555 HA ASP 71 HA ASP 71 -1.895 -1.533 -6.298 556 HB2 ASP 71 HB2 ASP 71 0.178 0.680 -6.008 557 HB3 ASP 71 HB3 ASP 71 0.074 -0.668 -4.883 558 H HIS 72 H HIS 72 -3.140 1.677 -5.988 559 HA HIS 72 HA HIS 72 -3.196 1.561 -3.045 560 HB2 HIS 72 HB2 HIS 72 -2.915 3.732 -4.421 561 HB3 HIS 72 HB3 HIS 72 -4.599 3.593 -4.837 562 HD1 HIS 72 HD1 HIS 72 -6.033 3.202 -2.033 563 HD2 HIS 72 HD2 HIS 72 -2.472 5.355 -2.507 564 HE1 HIS 72 HE1 HIS 72 -5.717 4.546 0.076 565 H LYS 73 H LYS 73 -4.963 0.971 -1.837 566 HA LYS 73 HA LYS 73 -7.218 -0.323 -3.237 567 HB2 LYS 73 HB2 LYS 73 -6.349 -0.278 -0.326 568 HB3 LYS 73 HB3 LYS 73 -7.766 -1.142 -0.912 569 HG2 LYS 73 HG2 LYS 73 -6.518 -2.725 -2.073 570 HG3 LYS 73 HG3 LYS 73 -5.122 -1.675 -2.271 571 HD2 LYS 73 HD2 LYS 73 -4.581 -1.864 0.118 572 HD3 LYS 73 HD3 LYS 73 -5.944 -2.978 0.365 573 HE2 LYS 73 HE2 LYS 73 -3.918 -3.467 -1.834 574 HE3 LYS 73 HE3 LYS 73 -3.473 -3.867 -0.171 575 HZ1 LYS 73 HZ1 LYS 73 -5.277 -5.411 -0.029 576 HZ2 LYS 73 HZ2 LYS 73 -5.931 -4.961 -1.448 577 HZ3 LYS 73 HZ3 LYS 73 -4.498 -5.757 -1.417 578 H PHE 74 H PHE 74 -9.415 0.007 -2.633 579 HA PHE 74 HA PHE 74 -10.065 2.565 -1.279 580 HB2 PHE 74 HB2 PHE 74 -11.041 1.825 -4.050 581 HB3 PHE 74 HB3 PHE 74 -11.828 3.003 -3.029 582 HD1 PHE 74 HD2 PHE 74 -8.527 2.277 -4.714 583 HD2 PHE 74 HD1 PHE 74 -11.186 5.259 -3.077 584 HE1 PHE 74 HE2 PHE 74 -7.058 4.067 -5.588 585 HE2 PHE 74 HE1 PHE 74 -9.734 7.044 -4.014 586 HZ PHE 74 HZ PHE 74 -7.659 6.456 -5.235 587 H MET 75 H MET 75 -12.002 2.558 -0.211 588 HA MET 75 HA MET 75 -12.796 -0.130 0.590 589 HB2 MET 75 HB2 MET 75 -12.311 1.808 2.137 590 HB3 MET 75 HB3 MET 75 -13.895 2.457 1.676 591 HG2 MET 75 HG2 MET 75 -15.020 0.529 2.598 592 HG3 MET 75 HG3 MET 75 -13.499 -0.362 2.728 593 HE1 MET 75 HE1 MET 75 -14.766 3.183 3.641 594 HE2 MET 75 HE2 MET 75 -15.845 2.288 4.731 595 HE3 MET 75 HE3 MET 75 -14.527 3.273 5.397 596 H THR 76 H THR 76 -14.184 -1.206 -0.660 597 HA THR 76 HA THR 76 -16.047 0.057 -2.470 598 HB THR 76 HB THR 76 -16.908 -2.147 -2.941 599 HG1 THR 76 HG1 THR 76 -16.160 -3.911 -1.800 600 HG21 THR 76 HG21 THR 76 -14.750 -1.461 -3.927 601 HG22 THR 76 HG22 THR 76 -13.895 -2.289 -2.603 602 HG23 THR 76 HG23 THR 76 -14.904 -3.217 -3.744 603 H VAL 77 H VAL 77 -18.438 -0.498 -2.503 604 HA VAL 77 HA VAL 77 -19.716 0.504 -0.218 605 HB VAL 77 HB VAL 77 -21.857 -0.440 -1.176 606 HG11 VAL 77 HG11 VAL 77 -21.028 1.787 -1.746 607 HG12 VAL 77 HG12 VAL 77 -20.081 1.110 -3.085 608 HG13 VAL 77 HG13 VAL 77 -21.854 1.026 -3.122 609 HG21 VAL 77 HG21 VAL 77 -20.057 -1.436 -3.433 610 HG22 VAL 77 HG22 VAL 77 -20.932 -2.465 -2.277 611 HG23 VAL 77 HG23 VAL 77 -21.829 -1.437 -3.400 612 H ASP 78 H ASP 78 -18.808 -2.819 -0.813 613 HA ASP 78 HA ASP 78 -20.401 -3.906 1.404 614 HB2 ASP 78 HB2 ASP 78 -19.850 -5.134 -0.718 615 HB3 ASP 78 HB3 ASP 78 -18.156 -5.148 -0.230 616 H GLY 79 H GLY 79 -17.413 -2.243 1.177 617 HA2 GLY 79 HA2 GLY 79 -16.163 -1.527 3.025 618 HA3 GLY 79 HA3 GLY 79 -16.683 -2.917 3.974 619 H GLN 80 H GLN 80 -15.614 -3.874 0.850 620 HA GLN 80 HA GLN 80 -13.248 -5.206 1.941 621 HB2 GLN 80 HB2 GLN 80 -14.161 -4.949 -0.958 622 HB3 GLN 80 HB3 GLN 80 -12.949 -6.065 -0.316 623 HG2 GLN 80 HG2 GLN 80 -14.765 -7.075 1.144 624 HG3 GLN 80 HG3 GLN 80 -15.940 -6.101 0.252 625 HE21 GLN 80 HE22 GLN 80 -15.876 -6.429 -2.266 626 HE22 GLN 80 HE21 GLN 80 -15.547 -8.069 -2.794 627 H MET 81 H MET 81 -11.076 -4.914 1.153 628 HA MET 81 HA MET 81 -10.450 -2.126 0.271 629 HB2 MET 81 HB2 MET 81 -8.527 -2.101 1.693 630 HB3 MET 81 HB3 MET 81 -9.985 -2.438 2.619 631 HG2 MET 81 HG2 MET 81 -9.266 -4.945 2.423 632 HG3 MET 81 HG3 MET 81 -7.708 -4.282 1.919 633 HE1 MET 81 HE1 MET 81 -10.330 -3.232 4.832 634 HE2 MET 81 HE2 MET 81 -10.185 -5.002 4.718 635 HE3 MET 81 HE3 MET 81 -9.545 -4.151 6.134 636 H LEU 82 H LEU 82 -10.658 -2.867 -1.863 637 HA LEU 82 HA LEU 82 -8.542 -4.732 -2.844 638 HB2 LEU 82 HB2 LEU 82 -11.069 -3.785 -4.251 639 HB3 LEU 82 HB3 LEU 82 -10.002 -5.082 -4.758 640 HG LEU 82 HG LEU 82 -11.798 -5.097 -2.293 641 HD11 LEU 82 HD11 LEU 82 -12.991 -5.315 -4.417 642 HD12 LEU 82 HD12 LEU 82 -11.934 -6.661 -4.894 643 HD13 LEU 82 HD13 LEU 82 -13.028 -6.833 -3.505 644 HD21 LEU 82 HD21 LEU 82 -9.972 -7.284 -3.370 645 HD22 LEU 82 HD22 LEU 82 -9.787 -6.428 -1.822 646 HD23 LEU 82 HD23 LEU 82 -11.178 -7.485 -2.078 647 HA PRO 83 HA PRO 83 -6.465 -1.379 -4.900 648 HB2 PRO 83 HB2 PRO 83 -5.410 -2.628 -7.113 649 HB3 PRO 83 HB3 PRO 83 -4.746 -2.790 -5.461 650 HG2 PRO 83 HG2 PRO 83 -6.666 -4.624 -6.939 651 HG3 PRO 83 HG3 PRO 83 -5.198 -5.082 -6.010 652 HD2 PRO 83 HD2 PRO 83 -7.681 -5.271 -4.947 653 HD3 PRO 83 HD3 PRO 83 -6.305 -4.719 -3.947 654 H ILE 84 H ILE 84 -6.880 0.151 -6.485 655 HA ILE 84 HA ILE 84 -9.393 0.131 -7.748 656 HB ILE 84 HB ILE 84 -8.119 2.106 -7.102 657 HG12 ILE 84 HG12 ILE 84 -8.814 2.391 -10.032 658 HG13 ILE 84 HG13 ILE 84 -10.054 1.943 -8.857 659 HG21 ILE 84 HG21 ILE 84 -5.895 1.496 -7.938 660 HG22 ILE 84 HG22 ILE 84 -6.481 1.575 -9.612 661 HG23 ILE 84 HG23 ILE 84 -6.401 3.046 -8.622 662 HD11 ILE 84 HD11 ILE 84 -9.658 3.915 -7.535 663 HD12 ILE 84 HD12 ILE 84 -8.326 4.419 -8.607 664 HD13 ILE 84 HD13 ILE 84 -10.000 4.365 -9.217 665 H ASP 85 H ASP 85 -6.438 -1.183 -8.953 666 HA ASP 85 HA ASP 85 -6.988 -1.569 -11.721 667 HB2 ASP 85 HB2 ASP 85 -4.839 -2.118 -10.682 668 HB3 ASP 85 HB3 ASP 85 -5.601 -3.301 -9.631 669 H GLU 86 H GLU 86 -8.202 -3.275 -8.848 670 HA GLU 86 HA GLU 86 -9.601 -5.326 -10.471 671 HB2 GLU 86 HB2 GLU 86 -8.506 -5.944 -8.342 672 HB3 GLU 86 HB3 GLU 86 -9.597 -4.860 -7.455 673 HG2 GLU 86 HG2 GLU 86 -11.528 -6.166 -8.097 674 HG3 GLU 86 HG3 GLU 86 -10.569 -7.117 -9.244 675 H ILE 87 H ILE 87 -10.340 -2.383 -8.532 676 HA ILE 87 HA ILE 87 -13.163 -2.652 -8.579 677 HB ILE 87 HB ILE 87 -11.451 -0.136 -8.459 678 HG12 ILE 87 HG12 ILE 87 -12.711 -1.771 -6.207 679 HG13 ILE 87 HG13 ILE 87 -11.044 -1.986 -6.709 680 HG21 ILE 87 HG21 ILE 87 -13.790 0.426 -9.022 681 HG22 ILE 87 HG22 ILE 87 -14.367 -0.625 -7.725 682 HG23 ILE 87 HG23 ILE 87 -13.488 0.865 -7.350 683 HD11 ILE 87 HD11 ILE 87 -11.802 0.795 -5.962 684 HD12 ILE 87 HD12 ILE 87 -11.641 -0.430 -4.681 685 HD13 ILE 87 HD13 ILE 87 -10.286 -0.077 -5.760 686 H PHE 88 H PHE 88 -10.979 -1.069 -10.923 687 HA PHE 88 HA PHE 88 -13.033 -0.053 -12.652 688 HB2 PHE 88 HB2 PHE 88 -10.741 0.748 -12.722 689 HB3 PHE 88 HB3 PHE 88 -10.147 -0.850 -13.160 690 HD1 PHE 88 HD2 PHE 88 -12.608 1.743 -14.381 691 HD2 PHE 88 HD1 PHE 88 -9.809 -1.365 -15.433 692 HE1 PHE 88 HE2 PHE 88 -12.866 2.328 -16.778 693 HE2 PHE 88 HE1 PHE 88 -10.071 -0.777 -17.838 694 HZ PHE 88 HZ PHE 88 -11.587 1.078 -18.511 695 H GLU 89 H GLU 89 -11.415 -3.237 -12.592 696 HA GLU 89 HA GLU 89 -12.638 -4.125 -15.115 697 HB2 GLU 89 HB2 GLU 89 -10.854 -5.347 -12.986 698 HB3 GLU 89 HB3 GLU 89 -11.615 -6.383 -14.188 699 HG2 GLU 89 HG2 GLU 89 -10.040 -3.915 -15.040 700 HG3 GLU 89 HG3 GLU 89 -9.214 -5.408 -14.644 701 H ARG 90 H ARG 90 -13.155 -4.790 -11.652 702 HA ARG 90 HA ARG 90 -15.413 -6.611 -12.159 703 HB2 ARG 90 HB2 ARG 90 -14.378 -5.355 -9.587 704 HB3 ARG 90 HB3 ARG 90 -15.572 -6.647 -9.690 705 HG2 ARG 90 HG2 ARG 90 -12.622 -6.799 -10.396 706 HG3 ARG 90 HG3 ARG 90 -13.450 -7.574 -9.054 707 HD2 ARG 90 HD2 ARG 90 -13.671 -8.187 -12.013 708 HD3 ARG 90 HD3 ARG 90 -12.946 -9.203 -10.768 709 HE ARG 90 HE ARG 90 -15.733 -9.027 -11.512 710 HH11 ARG 90 HH11 ARG 90 -13.698 -9.825 -8.757 711 HH12 ARG 90 HH12 ARG 90 -14.966 -10.729 -7.973 712 HH21 ARG 90 HH21 ARG 90 -17.308 -10.167 -10.427 713 HH22 ARG 90 HH22 ARG 90 -16.947 -10.918 -8.896 714 H GLU 91 H GLU 91 -15.085 -3.203 -11.992 715 HA GLU 91 HA GLU 91 -16.538 -1.497 -12.005 716 HB2 GLU 91 HB2 GLU 91 -18.678 -3.502 -12.808 717 HB3 GLU 91 HB3 GLU 91 -18.710 -1.754 -13.030 718 HG2 GLU 91 HG2 GLU 91 -16.645 -1.964 -14.480 719 HG3 GLU 91 HG3 GLU 91 -16.831 -3.718 -14.398 720 H LEU 92 H LEU 92 -16.002 -2.711 -9.543 721 HA LEU 92 HA LEU 92 -18.394 -2.952 -7.899 722 HB2 LEU 92 HB2 LEU 92 -15.424 -2.691 -7.280 723 HB3 LEU 92 HB3 LEU 92 -16.643 -2.881 -6.025 724 HG LEU 92 HG LEU 92 -16.401 -4.886 -8.301 725 HD11 LEU 92 HD11 LEU 92 -14.204 -4.750 -7.166 726 HD12 LEU 92 HD12 LEU 92 -15.008 -5.049 -5.607 727 HD13 LEU 92 HD13 LEU 92 -15.018 -6.292 -6.884 728 HD21 LEU 92 HD21 LEU 92 -17.505 -5.124 -5.471 729 HD22 LEU 92 HD22 LEU 92 -18.472 -4.995 -6.956 730 HD23 LEU 92 HD23 LEU 92 -17.454 -6.415 -6.690 731 H ASP 93 H ASP 93 -19.480 -1.425 -6.791 732 HA ASP 93 HA ASP 93 -18.908 1.407 -7.153 733 HB2 ASP 93 HB2 ASP 93 -20.862 -0.004 -5.299 734 HB3 ASP 93 HB3 ASP 93 -20.836 1.724 -5.647 735 H LEU 94 H LEU 94 -18.447 2.953 -5.477 736 HA LEU 94 HA LEU 94 -16.812 1.868 -3.218 737 HB2 LEU 94 HB2 LEU 94 -16.705 4.560 -4.617 738 HB3 LEU 94 HB3 LEU 94 -15.752 4.112 -3.203 739 HG LEU 94 HG LEU 94 -15.562 2.858 -5.974 740 HD11 LEU 94 HD11 LEU 94 -14.516 5.087 -5.722 741 HD12 LEU 94 HD12 LEU 94 -13.578 4.491 -4.334 742 HD13 LEU 94 HD13 LEU 94 -13.305 3.816 -5.956 743 HD21 LEU 94 HD21 LEU 94 -14.153 2.125 -3.372 744 HD22 LEU 94 HD22 LEU 94 -15.127 1.067 -4.429 745 HD23 LEU 94 HD23 LEU 94 -13.569 1.660 -4.980 746 H MET 95 H MET 95 -16.936 2.666 -1.163 747 HA MET 95 HA MET 95 -19.565 3.556 -0.282 748 HB2 MET 95 HB2 MET 95 -17.843 2.035 0.932 749 HB3 MET 95 HB3 MET 95 -17.038 3.534 1.402 750 HG2 MET 95 HG2 MET 95 -19.272 4.297 2.361 751 HG3 MET 95 HG3 MET 95 -19.920 2.706 1.969 752 HE1 MET 95 HE1 MET 95 -18.937 0.423 3.076 753 HE2 MET 95 HE2 MET 95 -17.235 0.884 2.817 754 HE3 MET 95 HE3 MET 95 -17.787 0.418 4.435 755 H ARG 96 H ARG 96 -20.048 5.601 0.712 756 HA ARG 96 HA ARG 96 -18.032 7.768 0.451 757 HB2 ARG 96 HB2 ARG 96 -20.925 8.364 -0.182 758 HB3 ARG 96 HB3 ARG 96 -19.500 9.327 -0.501 759 HG2 ARG 96 HG2 ARG 96 -19.634 8.649 -2.607 760 HG3 ARG 96 HG3 ARG 96 -19.022 7.085 -2.097 761 HD2 ARG 96 HD2 ARG 96 -21.922 7.948 -2.326 762 HD3 ARG 96 HD3 ARG 96 -21.075 6.869 -3.434 763 HE ARG 96 HE ARG 96 -20.939 5.188 -1.702 764 HH11 ARG 96 HH11 ARG 96 -23.511 7.520 -1.198 765 HH12 ARG 96 HH12 ARG 96 -24.054 6.746 0.265 766 HH21 ARG 96 HH21 ARG 96 -21.877 4.126 0.104 767 HH22 ARG 96 HH22 ARG 96 -23.195 4.894 0.927 768 H VAL 97 H VAL 97 -18.780 9.786 1.597 769 HA VAL 97 HA VAL 97 -20.273 9.213 4.143 770 HB VAL 97 HB VAL 97 -18.837 10.804 5.302 771 HG11 VAL 97 HG11 VAL 97 -18.377 8.395 5.411 772 HG12 VAL 97 HG12 VAL 97 -17.283 8.557 4.021 773 HG13 VAL 97 HG13 VAL 97 -16.893 9.364 5.552 774 HG21 VAL 97 HG21 VAL 97 -16.892 10.748 2.999 775 HG22 VAL 97 HG22 VAL 97 -18.018 12.094 3.278 776 HG23 VAL 97 HG23 VAL 97 -16.805 11.672 4.496 777 H ASP 98 H ASP 98 -20.560 10.953 1.383 778 HA ASP 98 HA ASP 98 -21.882 13.310 2.673 779 HB2 ASP 98 HB2 ASP 98 -20.182 12.924 0.250 780 HB3 ASP 98 HB3 ASP 98 -21.523 14.031 0.056 781 H ASN 99 H ASN 99 -22.990 10.506 1.914 782 HA ASN 99 HA ASN 99 -24.889 9.546 1.148 783 HB2 ASN 99 HB2 ASN 99 -26.288 12.221 1.427 784 HB3 ASN 99 HB3 ASN 99 -26.945 10.596 1.687 785 HD21 ASN 99 HD22 ASN 99 -25.286 9.329 3.303 786 HD22 ASN 99 HD21 ASN 99 -24.370 10.341 4.353 787 H LEU 100 H LEU 100 -23.112 10.688 -0.663 788 HA LEU 100 HA LEU 100 -24.395 11.496 -3.140 789 HB2 LEU 100 HB2 LEU 100 -21.715 10.249 -2.439 790 HB3 LEU 100 HB3 LEU 100 -22.130 10.548 -4.103 791 HG LEU 100 HG LEU 100 -21.945 12.691 -1.948 792 HD11 LEU 100 HD11 LEU 100 -19.766 11.731 -2.554 793 HD12 LEU 100 HD12 LEU 100 -20.119 11.959 -4.282 794 HD13 LEU 100 HD13 LEU 100 -19.926 13.366 -3.216 795 HD21 LEU 100 HD21 LEU 100 -22.367 12.940 -4.963 796 HD22 LEU 100 HD22 LEU 100 -23.539 13.389 -3.699 797 HD23 LEU 100 HD23 LEU 100 -22.031 14.285 -3.853 798 HA PRO 101 HA PRO 101 -25.938 7.660 -4.751 799 HB2 PRO 101 HB2 PRO 101 -25.396 7.804 -7.445 800 HB3 PRO 101 HB3 PRO 101 -26.646 8.791 -6.628 801 HG2 PRO 101 HG2 PRO 101 -23.816 9.592 -7.349 802 HG3 PRO 101 HG3 PRO 101 -25.333 10.512 -7.612 803 HD2 PRO 101 HD2 PRO 101 -23.692 10.992 -5.495 804 HD3 PRO 101 HD3 PRO 101 -25.454 11.123 -5.323 805 H ASN 102 H ASN 102 -25.275 5.553 -5.181 806 HA ASN 102 HA ASN 102 -22.405 4.941 -5.008 807 HB2 ASN 102 HB2 ASN 102 -24.798 3.094 -5.421 808 HB3 ASN 102 HB3 ASN 102 -23.148 2.605 -5.037 809 HD21 ASN 102 HD22 ASN 102 -22.241 3.529 -2.872 810 HD22 ASN 102 HD21 ASN 102 -23.434 3.623 -1.581 811 H ILE 103 H ILE 103 -21.156 5.108 -6.743 812 HA ILE 103 HA ILE 103 -21.978 4.024 -9.366 813 HB ILE 103 HB ILE 103 -20.942 6.016 -10.500 814 HG12 ILE 103 HG12 ILE 103 -21.521 7.455 -7.873 815 HG13 ILE 103 HG13 ILE 103 -19.910 7.020 -8.438 816 HG21 ILE 103 HG21 ILE 103 -23.389 5.478 -10.430 817 HG22 ILE 103 HG22 ILE 103 -23.554 6.582 -9.046 818 HG23 ILE 103 HG23 ILE 103 -23.049 7.193 -10.632 819 HD11 ILE 103 HD11 ILE 103 -20.223 8.446 -10.435 820 HD12 ILE 103 HD12 ILE 103 -21.838 8.912 -9.851 821 HD13 ILE 103 HD13 ILE 103 -20.406 9.365 -8.927 822 H LYS 104 H LYS 104 -20.369 3.433 -10.712 823 HA LYS 104 HA LYS 104 -17.731 2.881 -9.417 824 HB2 LYS 104 HB2 LYS 104 -17.566 0.943 -10.814 825 HB3 LYS 104 HB3 LYS 104 -19.085 0.944 -9.958 826 HG2 LYS 104 HG2 LYS 104 -19.661 0.145 -12.038 827 HG3 LYS 104 HG3 LYS 104 -20.188 1.820 -12.126 828 HD2 LYS 104 HD2 LYS 104 -18.279 2.407 -13.514 829 HD3 LYS 104 HD3 LYS 104 -17.489 0.860 -13.172 830 HE2 LYS 104 HE2 LYS 104 -18.274 0.532 -15.311 831 HE3 LYS 104 HE3 LYS 104 -19.520 -0.241 -14.332 832 HZ1 LYS 104 HZ1 LYS 104 -20.850 1.823 -14.589 833 HZ2 LYS 104 HZ2 LYS 104 -19.685 2.466 -15.552 834 HZ3 LYS 104 HZ3 LYS 104 -20.503 1.142 -16.035 835 H ILE 105 H ILE 105 -15.959 2.553 -11.142 836 HA ILE 105 HA ILE 105 -15.366 5.169 -12.195 837 HB ILE 105 HB ILE 105 -13.991 2.503 -12.650 838 HG12 ILE 105 HG12 ILE 105 -13.158 4.736 -10.740 839 HG13 ILE 105 HG13 ILE 105 -14.190 3.415 -10.216 840 HG21 ILE 105 HG21 ILE 105 -13.381 4.174 -14.393 841 HG22 ILE 105 HG22 ILE 105 -13.017 5.370 -13.135 842 HG23 ILE 105 HG23 ILE 105 -12.043 3.895 -13.306 843 HD11 ILE 105 HD11 ILE 105 -12.466 1.762 -10.893 844 HD12 ILE 105 HD12 ILE 105 -11.360 3.111 -11.249 845 HD13 ILE 105 HD13 ILE 105 -11.977 2.872 -9.603 846 H ALA 106 H ALA 106 -16.133 6.045 -13.973 847 HA ALA 106 HA ALA 106 -17.767 4.630 -15.890 848 HB1 ALA 106 HB1 ALA 106 -18.175 6.968 -15.112 849 HB2 ALA 106 HB2 ALA 106 -16.682 7.490 -15.906 850 HB3 ALA 106 HB3 ALA 106 -18.027 6.859 -16.876 851 H THR 107 H THR 107 -14.553 6.202 -16.042 852 HA THR 107 HA THR 107 -13.576 4.295 -18.051 853 HB THR 107 HB THR 107 -12.645 6.187 -19.468 854 HG1 THR 107 HG1 THR 107 -13.911 8.094 -19.442 855 HG21 THR 107 HG21 THR 107 -14.592 4.772 -20.193 856 HG22 THR 107 HG22 THR 107 -15.671 6.054 -19.600 857 HG23 THR 107 HG23 THR 107 -14.523 6.387 -20.911 858 H ARG 108 H ARG 108 -11.284 4.471 -18.421 859 HA ARG 108 HA ARG 108 -9.709 5.825 -16.262 860 HB2 ARG 108 HB2 ARG 108 -9.660 3.460 -15.866 861 HB3 ARG 108 HB3 ARG 108 -9.366 3.106 -17.573 862 HG2 ARG 108 HG2 ARG 108 -7.124 4.084 -17.451 863 HG3 ARG 108 HG3 ARG 108 -7.397 4.576 -15.773 864 HD2 ARG 108 HD2 ARG 108 -6.786 2.571 -15.006 865 HD3 ARG 108 HD3 ARG 108 -7.910 1.724 -16.061 866 HE ARG 108 HE ARG 108 -5.034 2.259 -16.507 867 HH11 ARG 108 HH11 ARG 108 -7.961 1.006 -18.005 868 HH12 ARG 108 HH12 ARG 108 -7.067 0.249 -19.298 869 HH21 ARG 108 HH21 ARG 108 -3.989 1.334 -18.255 870 HH22 ARG 108 HH22 ARG 108 -4.900 0.405 -19.405 871 H LYS 109 H LYS 109 -7.856 6.950 -16.875 872 HA LYS 109 HA LYS 109 -6.877 6.758 -19.682 873 HB2 LYS 109 HB2 LYS 109 -8.634 8.480 -19.674 874 HB3 LYS 109 HB3 LYS 109 -7.818 9.362 -18.386 875 HG2 LYS 109 HG2 LYS 109 -5.993 9.962 -19.784 876 HG3 LYS 109 HG3 LYS 109 -6.404 8.765 -21.014 877 HD2 LYS 109 HD2 LYS 109 -8.149 11.165 -20.304 878 HD3 LYS 109 HD3 LYS 109 -6.962 11.175 -21.606 879 HE2 LYS 109 HE2 LYS 109 -9.354 9.276 -21.455 880 HE3 LYS 109 HE3 LYS 109 -9.320 10.788 -22.360 881 HZ1 LYS 109 HZ1 LYS 109 -7.499 9.889 -23.703 882 HZ2 LYS 109 HZ2 LYS 109 -7.534 8.469 -22.887 883 HZ3 LYS 109 HZ3 LYS 109 -8.806 8.923 -23.799 884 H TYR 110 H TYR 110 -4.719 6.528 -19.610 885 HA TYR 110 HA TYR 110 -3.192 6.888 -17.201 886 HB2 TYR 110 HB2 TYR 110 -2.603 5.296 -19.034 887 HB3 TYR 110 HB3 TYR 110 -2.242 6.652 -20.080 888 HD1 TYR 110 HD2 TYR 110 -1.319 6.046 -16.440 889 HD2 TYR 110 HD1 TYR 110 0.075 6.572 -20.495 890 HE1 TYR 110 HE2 TYR 110 1.021 6.067 -15.638 891 HE2 TYR 110 HE1 TYR 110 2.424 6.515 -19.681 892 HH TYR 110 HH TYR 110 3.797 6.273 -17.875 893 H LEU 111 H LEU 111 -2.008 8.581 -16.432 894 HA LEU 111 HA LEU 111 -2.103 11.159 -17.967 895 HB2 LEU 111 HB2 LEU 111 -1.605 10.550 -15.026 896 HB3 LEU 111 HB3 LEU 111 -1.686 12.158 -15.749 897 HG LEU 111 HG LEU 111 -4.023 10.222 -15.788 898 HD11 LEU 111 HD11 LEU 111 -3.389 10.738 -13.490 899 HD12 LEU 111 HD12 LEU 111 -3.423 12.480 -13.849 900 HD13 LEU 111 HD13 LEU 111 -4.915 11.502 -13.906 901 HD21 LEU 111 HD21 LEU 111 -3.762 13.222 -16.274 902 HD22 LEU 111 HD22 LEU 111 -4.147 11.986 -17.497 903 HD23 LEU 111 HD23 LEU 111 -5.303 12.335 -16.215 904 H GLY 112 H GLY 112 0.087 8.955 -16.260 905 HA2 GLY 112 HA2 GLY 112 2.399 8.970 -17.471 906 HA3 GLY 112 HA3 GLY 112 2.447 10.650 -16.932 907 H LYS 113 H LYS 113 4.075 10.520 -15.529 908 HA LYS 113 HA LYS 113 3.950 8.595 -13.238 909 HB2 LYS 113 HB2 LYS 113 5.519 8.068 -15.229 910 HB3 LYS 113 HB3 LYS 113 6.529 9.364 -14.563 911 HG2 LYS 113 HG2 LYS 113 6.571 8.207 -12.367 912 HG3 LYS 113 HG3 LYS 113 5.547 6.922 -13.024 913 HD2 LYS 113 HD2 LYS 113 7.270 6.310 -14.653 914 HD3 LYS 113 HD3 LYS 113 8.328 7.614 -14.062 915 HE2 LYS 113 HE2 LYS 113 8.500 6.589 -11.874 916 HE3 LYS 113 HE3 LYS 113 7.250 5.402 -12.262 917 HZ1 LYS 113 HZ1 LYS 113 8.748 4.435 -13.907 918 HZ2 LYS 113 HZ2 LYS 113 9.906 5.548 -13.590 919 HZ3 LYS 113 HZ3 LYS 113 9.483 4.458 -12.451 920 H GLN 114 H GLN 114 2.989 10.265 -12.164 921 HA GLN 114 HA GLN 114 4.376 12.751 -11.588 922 HB2 GLN 114 HB2 GLN 114 1.681 11.907 -10.536 923 HB3 GLN 114 HB3 GLN 114 2.337 13.535 -10.814 924 HG2 GLN 114 HG2 GLN 114 2.637 12.803 -13.282 925 HG3 GLN 114 HG3 GLN 114 1.603 11.423 -12.873 926 HE21 GLN 114 HE22 GLN 114 0.655 12.454 -14.794 927 HE22 GLN 114 HE21 GLN 114 -0.462 13.739 -14.488 928 H ASN 115 H ASN 115 4.659 13.559 -9.354 929 HA ASN 115 HA ASN 115 5.532 11.740 -7.396 930 HB2 ASN 115 HB2 ASN 115 5.790 14.442 -7.843 931 HB3 ASN 115 HB3 ASN 115 4.572 14.463 -6.563 932 HD21 ASN 115 HD22 ASN 115 5.341 12.310 -4.929 933 HD22 ASN 115 HD21 ASN 115 7.043 12.436 -4.577 934 H VAL 116 H VAL 116 4.344 10.347 -6.239 935 HA VAL 116 HA VAL 116 1.632 11.229 -5.330 936 HB VAL 116 HB VAL 116 0.984 8.845 -5.339 937 HG11 VAL 116 HG11 VAL 116 0.328 10.404 -7.150 938 HG12 VAL 116 HG12 VAL 116 1.744 9.882 -8.081 939 HG13 VAL 116 HG13 VAL 116 0.457 8.723 -7.670 940 HG21 VAL 116 HG21 VAL 116 3.453 8.408 -7.086 941 HG22 VAL 116 HG22 VAL 116 3.237 7.789 -5.434 942 HG23 VAL 116 HG23 VAL 116 2.171 7.236 -6.731 943 H TYR 117 H TYR 117 0.895 10.593 -3.369 944 HA TYR 117 HA TYR 117 2.967 10.009 -1.288 945 HB2 TYR 117 HB2 TYR 117 0.852 12.179 -1.192 946 HB3 TYR 117 HB3 TYR 117 2.197 11.943 -0.107 947 HD1 TYR 117 HD1 TYR 117 4.537 12.481 -0.831 948 HD2 TYR 117 HD2 TYR 117 1.106 13.376 -3.282 949 HE1 TYR 117 HE1 TYR 117 5.876 14.148 -2.084 950 HE2 TYR 117 HE2 TYR 117 2.456 15.052 -4.553 951 HH TYR 117 HH TYR 117 5.816 15.875 -3.557 952 H ASP 118 H ASP 118 2.083 9.422 0.814 953 HA ASP 118 HA ASP 118 -0.748 8.900 1.129 954 HB2 ASP 118 HB2 ASP 118 -0.621 6.540 1.479 955 HB3 ASP 118 HB3 ASP 118 -0.159 6.917 -0.164 956 H ILE 119 H ILE 119 -1.310 9.017 3.235 957 HA ILE 119 HA ILE 119 0.825 9.434 5.235 958 HB ILE 119 HB ILE 119 -0.977 10.023 6.763 959 HG12 ILE 119 HG12 ILE 119 -2.897 9.592 4.427 960 HG13 ILE 119 HG13 ILE 119 -2.758 8.539 5.838 961 HG21 ILE 119 HG21 ILE 119 0.172 11.649 5.282 962 HG22 ILE 119 HG22 ILE 119 -1.117 11.475 4.080 963 HG23 ILE 119 HG23 ILE 119 -1.469 12.161 5.687 964 HD11 ILE 119 HD11 ILE 119 -3.382 10.463 7.307 965 HD12 ILE 119 HD12 ILE 119 -3.684 11.431 5.838 966 HD13 ILE 119 HD13 ILE 119 -4.644 9.978 6.158 967 H GLY 120 H GLY 120 0.819 8.382 7.287 968 HA2 GLY 120 HA2 GLY 120 0.044 5.488 7.165 969 HA3 GLY 120 HA3 GLY 120 1.438 6.131 8.026 970 H VAL 121 H VAL 121 -1.093 4.646 8.772 971 HA VAL 121 HA VAL 121 -1.630 6.014 11.325 972 HB VAL 121 HB VAL 121 -4.118 5.414 11.027 973 HG11 VAL 121 HG11 VAL 121 -3.252 7.721 11.216 974 HG12 VAL 121 HG12 VAL 121 -3.056 7.786 9.450 975 HG13 VAL 121 HG13 VAL 121 -4.671 7.606 10.163 976 HG21 VAL 121 HG21 VAL 121 -3.522 5.810 8.064 977 HG22 VAL 121 HG22 VAL 121 -3.874 4.238 8.802 978 HG23 VAL 121 HG23 VAL 121 -5.094 5.524 8.834 979 H GLU 122 H GLU 122 -2.282 4.627 12.952 980 HA GLU 122 HA GLU 122 -1.963 1.679 12.407 981 HB2 GLU 122 HB2 GLU 122 -1.265 3.369 14.839 982 HB3 GLU 122 HB3 GLU 122 -1.200 1.604 14.794 983 HG2 GLU 122 HG2 GLU 122 0.485 1.669 13.005 984 HG3 GLU 122 HG3 GLU 122 0.422 3.435 12.975 985 H ARG 123 H ARG 123 -4.030 4.085 13.897 986 HA ARG 123 HA ARG 123 -5.753 2.348 15.416 987 HB2 ARG 123 HB2 ARG 123 -5.533 4.772 15.768 988 HB3 ARG 123 HB3 ARG 123 -6.118 5.095 14.150 989 HG2 ARG 123 HG2 ARG 123 -7.844 5.568 15.797 990 HG3 ARG 123 HG3 ARG 123 -8.354 4.265 14.734 991 HD2 ARG 123 HD2 ARG 123 -8.998 3.770 17.017 992 HD3 ARG 123 HD3 ARG 123 -7.783 2.600 16.490 993 HE ARG 123 HE ARG 123 -6.463 4.774 17.803 994 HH11 ARG 123 HH11 ARG 123 -8.559 2.101 18.677 995 HH12 ARG 123 HH12 ARG 123 -7.927 2.023 20.304 996 HH21 ARG 123 HH21 ARG 123 -5.694 4.607 19.879 997 HH22 ARG 123 HH22 ARG 123 -6.351 3.406 20.959 998 H ASP 124 H ASP 124 -5.609 3.126 12.011 999 HA ASP 124 HA ASP 124 -7.518 1.043 11.314 1000 HB2 ASP 124 HB2 ASP 124 -8.801 3.253 11.859 1001 HB3 ASP 124 HB3 ASP 124 -8.159 3.846 10.330 1002 H HIS 125 H HIS 125 -7.894 1.447 8.690 1003 HA HIS 125 HA HIS 125 -5.296 2.130 7.381 1004 HB2 HIS 125 HB2 HIS 125 -5.678 0.011 5.967 1005 HB3 HIS 125 HB3 HIS 125 -5.041 -0.137 7.566 1006 HD1 HIS 125 HD1 HIS 125 -8.871 0.096 6.803 1007 HD2 HIS 125 HD2 HIS 125 -5.882 -2.509 8.233 1008 HE1 HIS 125 HE1 HIS 125 -10.075 -1.958 7.672 1009 H ASN 126 H ASN 126 -7.524 3.862 7.406 1010 HA ASN 126 HA ASN 126 -7.867 4.353 4.597 1011 HB2 ASN 126 HB2 ASN 126 -10.474 4.128 4.777 1012 HB3 ASN 126 HB3 ASN 126 -9.512 2.730 4.388 1013 HD21 ASN 126 HD22 ASN 126 -11.284 4.297 7.090 1014 HD22 ASN 126 HD21 ASN 126 -11.244 2.876 8.088 1015 H PHE 127 H PHE 127 -9.154 6.218 4.082 1016 HA PHE 127 HA PHE 127 -9.981 8.061 6.221 1017 HB2 PHE 127 HB2 PHE 127 -8.441 9.858 5.342 1018 HB3 PHE 127 HB3 PHE 127 -7.673 8.580 6.256 1019 HD1 PHE 127 HD2 PHE 127 -8.321 9.721 2.731 1020 HD2 PHE 127 HD1 PHE 127 -5.845 7.357 5.354 1021 HE1 PHE 127 HE2 PHE 127 -6.748 9.288 0.863 1022 HE2 PHE 127 HE1 PHE 127 -4.267 6.936 3.482 1023 HZ PHE 127 HZ PHE 127 -4.724 7.890 1.231 1024 H ALA 128 H ALA 128 -11.143 9.912 5.432 1025 HA ALA 128 HA ALA 128 -12.628 9.352 2.976 1026 HB1 ALA 128 HB1 ALA 128 -13.749 9.928 5.106 1027 HB2 ALA 128 HB2 ALA 128 -12.962 11.524 5.081 1028 HB3 ALA 128 HB3 ALA 128 -14.130 11.088 3.819 1029 H LEU 129 H LEU 129 -12.508 10.375 1.094 1030 HA LEU 129 HA LEU 129 -10.515 12.483 0.587 1031 HB2 LEU 129 HB2 LEU 129 -12.501 11.227 -1.334 1032 HB3 LEU 129 HB3 LEU 129 -11.049 12.154 -1.726 1033 HG LEU 129 HG LEU 129 -11.142 9.359 -0.524 1034 HD11 LEU 129 HD11 LEU 129 -11.656 9.713 -3.015 1035 HD12 LEU 129 HD12 LEU 129 -9.991 10.282 -3.182 1036 HD13 LEU 129 HD13 LEU 129 -10.318 8.626 -2.620 1037 HD21 LEU 129 HD21 LEU 129 -8.738 11.070 -1.216 1038 HD22 LEU 129 HD22 LEU 129 -9.203 10.448 0.392 1039 HD23 LEU 129 HD23 LEU 129 -8.691 9.329 -0.872 1040 H LYS 130 H LYS 130 -11.117 14.312 -0.869 1041 HA LYS 130 HA LYS 130 -12.883 16.084 0.328 1042 HB2 LYS 130 HB2 LYS 130 -12.425 17.569 -1.513 1043 HB3 LYS 130 HB3 LYS 130 -10.980 16.627 -1.155 1044 HG2 LYS 130 HG2 LYS 130 -11.633 15.097 -3.114 1045 HG3 LYS 130 HG3 LYS 130 -12.913 16.273 -3.471 1046 HD2 LYS 130 HD2 LYS 130 -11.070 18.049 -3.628 1047 HD3 LYS 130 HD3 LYS 130 -9.917 16.709 -3.538 1048 HE2 LYS 130 HE2 LYS 130 -10.165 17.206 -5.843 1049 HE3 LYS 130 HE3 LYS 130 -11.013 15.679 -5.558 1050 HZ1 LYS 130 HZ1 LYS 130 -13.106 16.893 -5.573 1051 HZ2 LYS 130 HZ2 LYS 130 -12.341 18.343 -5.722 1052 HZ3 LYS 130 HZ3 LYS 130 -12.291 17.257 -6.940 1053 H ASN 131 H ASN 131 -13.683 14.073 -2.487 1054 HA ASN 131 HA ASN 131 -16.333 15.253 -2.829 1055 HB2 ASN 131 HB2 ASN 131 -14.940 12.761 -3.905 1056 HB3 ASN 131 HB3 ASN 131 -16.619 13.137 -4.286 1057 HD21 ASN 131 HD22 ASN 131 -17.112 14.989 -5.600 1058 HD22 ASN 131 HD21 ASN 131 -15.847 15.767 -6.540 1059 H GLY 132 H GLY 132 -15.019 12.594 -0.956 1060 HA2 GLY 132 HA2 GLY 132 -16.406 12.120 1.075 1061 HA3 GLY 132 HA3 GLY 132 -17.744 11.766 -0.023 1062 H PHE 133 H PHE 133 -15.197 10.507 -1.706 1063 HA PHE 133 HA PHE 133 -15.913 7.797 -1.007 1064 HB2 PHE 133 HB2 PHE 133 -13.499 8.585 -2.634 1065 HB3 PHE 133 HB3 PHE 133 -14.452 7.118 -2.746 1066 HD1 PHE 133 HD2 PHE 133 -17.072 7.573 -3.289 1067 HD2 PHE 133 HD1 PHE 133 -13.795 10.175 -4.333 1068 HE1 PHE 133 HE2 PHE 133 -18.501 8.698 -4.990 1069 HE2 PHE 133 HE1 PHE 133 -15.214 11.270 -6.050 1070 HZ PHE 133 HZ PHE 133 -17.579 10.568 -6.347 1071 H ILE 134 H ILE 134 -14.045 6.115 -0.648 1072 HA ILE 134 HA ILE 134 -12.156 7.131 1.439 1073 HB ILE 134 HB ILE 134 -13.847 4.621 1.627 1074 HG12 ILE 134 HG12 ILE 134 -14.324 5.875 3.956 1075 HG13 ILE 134 HG13 ILE 134 -13.937 7.308 2.998 1076 HG21 ILE 134 HG21 ILE 134 -11.578 4.165 2.470 1077 HG22 ILE 134 HG22 ILE 134 -11.624 5.665 3.427 1078 HG23 ILE 134 HG23 ILE 134 -12.690 4.306 3.820 1079 HD11 ILE 134 HD11 ILE 134 -15.730 6.322 1.329 1080 HD12 ILE 134 HD12 ILE 134 -16.199 5.321 2.713 1081 HD13 ILE 134 HD13 ILE 134 -16.267 7.089 2.818 1082 H ALA 135 H ALA 135 -10.186 6.727 1.049 1083 HA ALA 135 HA ALA 135 -9.368 4.540 -0.815 1084 HB1 ALA 135 HB1 ALA 135 -8.692 6.888 -1.376 1085 HB2 ALA 135 HB2 ALA 135 -7.764 6.937 0.140 1086 HB3 ALA 135 HB3 ALA 135 -7.346 5.780 -1.147 1087 H SER 136 H SER 136 -8.269 2.828 0.041 1088 HA SER 136 HA SER 136 -7.750 2.785 2.969 1089 HB2 SER 136 HB2 SER 136 -7.995 0.216 2.576 1090 HB3 SER 136 HB3 SER 136 -9.425 1.237 2.700 1091 HG SER 136 HG SER 136 -9.718 -0.059 0.977 1092 H ASN 137 H ASN 137 -5.850 1.834 3.772 1093 HA ASN 137 HA ASN 137 -3.658 1.310 1.859 1094 HB2 ASN 137 HB2 ASN 137 -4.074 3.841 2.003 1095 HB3 ASN 137 HB3 ASN 137 -3.532 3.762 3.670 1096 HD21 ASN 137 HD22 ASN 137 -2.542 4.477 0.597 1097 HD22 ASN 137 HD21 ASN 137 -0.825 4.180 0.812 Start of MODEL 7 1 H1 GLY -1 H GLY -1 4.159 -1.700 -3.024 2 HA2 GLY -1 HA2 GLY -1 2.107 -0.611 -2.417 3 HA3 GLY -1 HA3 GLY -1 3.496 0.481 -2.259 4 H GLY 0 H GLY 0 1.008 1.566 -2.437 5 HA2 GLY 0 HA2 GLY 0 0.905 2.919 -5.078 6 HA3 GLY 0 HA3 GLY 0 -0.538 2.194 -4.392 7 H ALA 1 H ALA 1 -0.451 4.872 -4.966 8 HA ALA 1 HA ALA 1 -0.953 6.212 -2.409 9 HB1 ALA 1 HB1 ALA 1 1.420 6.369 -2.321 10 HB2 ALA 1 HB2 ALA 1 1.532 6.813 -4.037 11 HB3 ALA 1 HB3 ALA 1 0.857 7.945 -2.856 12 H LEU 2 H LEU 2 -1.163 8.719 -2.905 13 HA LEU 2 HA LEU 2 -3.025 9.010 -5.236 14 HB2 LEU 2 HB2 LEU 2 -3.022 10.440 -2.547 15 HB3 LEU 2 HB3 LEU 2 -4.196 10.603 -3.828 16 HG LEU 2 HG LEU 2 -5.247 9.375 -2.162 17 HD11 LEU 2 HD11 LEU 2 -5.641 8.488 -4.421 18 HD12 LEU 2 HD12 LEU 2 -4.369 7.272 -4.154 19 HD13 LEU 2 HD13 LEU 2 -5.833 7.264 -3.156 20 HD21 LEU 2 HD21 LEU 2 -3.076 7.319 -1.966 21 HD22 LEU 2 HD22 LEU 2 -3.198 8.737 -0.908 22 HD23 LEU 2 HD23 LEU 2 -4.504 7.550 -0.958 23 H SER 3 H SER 3 -3.106 11.074 -6.307 24 HA SER 3 HA SER 3 -0.517 12.402 -6.572 25 HB2 SER 3 HB2 SER 3 -2.150 12.045 -8.435 26 HB3 SER 3 HB3 SER 3 -3.218 13.245 -7.673 27 HG SER 3 HG SER 3 -1.726 14.043 -9.345 28 H TYR 4 H TYR 4 -0.276 14.784 -6.437 29 HA TYR 4 HA TYR 4 -0.750 15.925 -3.884 30 HB2 TYR 4 HB2 TYR 4 0.927 16.737 -5.476 31 HB3 TYR 4 HB3 TYR 4 -0.318 17.236 -6.602 32 HD1 TYR 4 HD2 TYR 4 -1.727 19.225 -6.161 33 HD2 TYR 4 HD1 TYR 4 1.478 18.089 -3.508 34 HE1 TYR 4 HE2 TYR 4 -1.843 21.455 -5.062 35 HE2 TYR 4 HE1 TYR 4 1.342 20.300 -2.388 36 HH TYR 4 HH TYR 4 0.347 22.361 -2.381 37 H GLU 5 H GLU 5 -2.630 16.206 -6.890 38 HA GLU 5 HA GLU 5 -4.509 18.162 -6.062 39 HB2 GLU 5 HB2 GLU 5 -4.920 15.913 -8.083 40 HB3 GLU 5 HB3 GLU 5 -5.839 17.426 -7.970 41 HG2 GLU 5 HG2 GLU 5 -3.619 18.642 -8.296 42 HG3 GLU 5 HG3 GLU 5 -2.921 17.079 -8.732 43 H THR 6 H THR 6 -4.327 14.916 -5.046 44 HA THR 6 HA THR 6 -7.161 14.466 -4.519 45 HB THR 6 HB THR 6 -4.742 13.023 -3.387 46 HG1 THR 6 HG1 THR 6 -6.542 12.346 -5.475 47 HG21 THR 6 HG21 THR 6 -6.635 12.552 -1.985 48 HG22 THR 6 HG22 THR 6 -7.728 12.396 -3.377 49 HG23 THR 6 HG23 THR 6 -6.467 11.179 -3.084 50 H GLU 7 H GLU 7 -8.143 15.952 -3.250 51 HA GLU 7 HA GLU 7 -6.816 17.047 -0.878 52 HB2 GLU 7 HB2 GLU 7 -9.667 17.500 -1.778 53 HB3 GLU 7 HB3 GLU 7 -8.726 18.459 -0.630 54 HG2 GLU 7 HG2 GLU 7 -7.090 18.896 -2.577 55 HG3 GLU 7 HG3 GLU 7 -8.347 18.248 -3.638 56 H ILE 8 H ILE 8 -7.244 16.677 1.201 57 HA ILE 8 HA ILE 8 -9.103 14.451 1.956 58 HB ILE 8 HB ILE 8 -6.396 15.128 3.174 59 HG12 ILE 8 HG12 ILE 8 -5.901 14.263 1.007 60 HG13 ILE 8 HG13 ILE 8 -5.519 13.053 2.218 61 HG21 ILE 8 HG21 ILE 8 -7.887 14.092 4.795 62 HG22 ILE 8 HG22 ILE 8 -8.283 12.786 3.666 63 HG23 ILE 8 HG23 ILE 8 -6.644 12.931 4.321 64 HD11 ILE 8 HD11 ILE 8 -7.721 11.909 1.638 65 HD12 ILE 8 HD12 ILE 8 -7.878 13.043 0.297 66 HD13 ILE 8 HD13 ILE 8 -6.507 11.929 0.346 67 H LEU 9 H LEU 9 -10.692 15.223 3.197 68 HA LEU 9 HA LEU 9 -10.596 17.768 4.524 69 HB2 LEU 9 HB2 LEU 9 -12.597 16.264 3.735 70 HB3 LEU 9 HB3 LEU 9 -12.514 15.558 5.341 71 HG LEU 9 HG LEU 9 -12.644 18.573 4.951 72 HD11 LEU 9 HD11 LEU 9 -14.536 17.546 3.665 73 HD12 LEU 9 HD12 LEU 9 -15.048 16.713 5.141 74 HD13 LEU 9 HD13 LEU 9 -15.081 18.491 5.056 75 HD21 LEU 9 HD21 LEU 9 -13.746 16.857 7.161 76 HD22 LEU 9 HD22 LEU 9 -12.230 17.796 7.238 77 HD23 LEU 9 HD23 LEU 9 -13.772 18.629 7.076 78 H THR 10 H THR 10 -9.686 18.370 6.382 79 HA THR 10 HA THR 10 -9.049 16.367 8.502 80 HB THR 10 HB THR 10 -7.074 17.614 9.076 81 HG1 THR 10 HG1 THR 10 -6.579 19.214 7.215 82 HG21 THR 10 HG21 THR 10 -5.645 17.190 7.195 83 HG22 THR 10 HG22 THR 10 -6.874 15.920 7.241 84 HG23 THR 10 HG23 THR 10 -7.015 17.237 6.063 85 H VAL 11 H VAL 11 -9.031 17.064 10.668 86 HA VAL 11 HA VAL 11 -11.099 19.068 11.289 87 HB VAL 11 HB VAL 11 -9.365 17.549 13.259 88 HG11 VAL 11 HG11 VAL 11 -10.602 19.400 14.300 89 HG12 VAL 11 HG12 VAL 11 -12.110 18.849 13.536 90 HG13 VAL 11 HG13 VAL 11 -11.315 17.861 14.780 91 HG21 VAL 11 HG21 VAL 11 -12.083 16.735 12.171 92 HG22 VAL 11 HG22 VAL 11 -10.561 15.904 11.800 93 HG23 VAL 11 HG23 VAL 11 -11.172 15.916 13.456 94 H GLU 12 H GLU 12 -7.588 18.875 11.449 95 HA GLU 12 HA GLU 12 -7.206 21.225 13.107 96 HB2 GLU 12 HB2 GLU 12 -5.523 19.339 11.510 97 HB3 GLU 12 HB3 GLU 12 -4.808 20.916 11.843 98 HG2 GLU 12 HG2 GLU 12 -5.953 19.058 13.973 99 HG3 GLU 12 HG3 GLU 12 -4.248 19.161 13.546 100 H TYR 13 H TYR 13 -7.633 20.840 9.653 101 HA TYR 13 HA TYR 13 -7.343 23.805 9.306 102 HB2 TYR 13 HB2 TYR 13 -6.045 21.616 7.645 103 HB3 TYR 13 HB3 TYR 13 -6.294 23.242 7.048 104 HD1 TYR 13 HD1 TYR 13 -5.361 25.223 8.401 105 HD2 TYR 13 HD2 TYR 13 -4.048 21.140 8.893 106 HE1 TYR 13 HE1 TYR 13 -3.233 26.034 9.403 107 HE2 TYR 13 HE2 TYR 13 -1.913 21.957 9.900 108 HH TYR 13 HH TYR 13 -1.224 25.448 10.294 109 H GLY 14 H GLY 14 -8.404 20.812 7.566 110 HA2 GLY 14 HA2 GLY 14 -10.917 20.955 6.938 111 HA3 GLY 14 HA3 GLY 14 -10.456 22.459 6.148 112 H LEU 15 H LEU 15 -10.893 21.861 4.132 113 HA LEU 15 HA LEU 15 -9.977 19.418 2.792 114 HB2 LEU 15 HB2 LEU 15 -11.268 22.043 1.903 115 HB3 LEU 15 HB3 LEU 15 -10.940 20.710 0.807 116 HG LEU 15 HG LEU 15 -12.687 20.374 3.291 117 HD11 LEU 15 HD11 LEU 15 -13.737 22.084 2.022 118 HD12 LEU 15 HD12 LEU 15 -13.461 21.241 0.497 119 HD13 LEU 15 HD13 LEU 15 -14.607 20.579 1.696 120 HD21 LEU 15 HD21 LEU 15 -12.196 18.751 0.769 121 HD22 LEU 15 HD22 LEU 15 -11.889 18.272 2.437 122 HD23 LEU 15 HD23 LEU 15 -13.556 18.456 1.874 123 H LEU 16 H LEU 16 -7.784 19.244 2.570 124 HA LEU 16 HA LEU 16 -6.464 21.207 0.833 125 HB2 LEU 16 HB2 LEU 16 -4.433 21.116 2.362 126 HB3 LEU 16 HB3 LEU 16 -5.772 22.191 2.727 127 HG LEU 16 HG LEU 16 -6.447 20.894 4.611 128 HD11 LEU 16 HD11 LEU 16 -6.207 18.639 3.827 129 HD12 LEU 16 HD12 LEU 16 -4.463 18.841 3.577 130 HD13 LEU 16 HD13 LEU 16 -5.146 18.808 5.227 131 HD21 LEU 16 HD21 LEU 16 -3.420 21.055 4.405 132 HD22 LEU 16 HD22 LEU 16 -4.509 22.360 4.879 133 HD23 LEU 16 HD23 LEU 16 -4.338 20.937 5.909 134 HA PRO 17 HA PRO 17 -4.758 17.821 -1.279 135 HB2 PRO 17 HB2 PRO 17 -2.263 18.714 -2.069 136 HB3 PRO 17 HB3 PRO 17 -3.819 19.282 -2.754 137 HG2 PRO 17 HG2 PRO 17 -2.125 20.585 -0.627 138 HG3 PRO 17 HG3 PRO 17 -2.897 21.340 -2.059 139 HD2 PRO 17 HD2 PRO 17 -4.002 21.470 0.392 140 HD3 PRO 17 HD3 PRO 17 -5.027 21.263 -1.057 141 H ILE 18 H ILE 18 -3.936 15.871 -0.731 142 HA ILE 18 HA ILE 18 -2.537 15.348 1.666 143 HB ILE 18 HB ILE 18 -3.848 13.699 0.399 144 HG12 ILE 18 HG12 ILE 18 -1.008 12.723 0.902 145 HG13 ILE 18 HG13 ILE 18 -2.173 13.104 2.183 146 HG21 ILE 18 HG21 ILE 18 -2.942 14.230 -1.901 147 HG22 ILE 18 HG22 ILE 18 -1.467 13.348 -1.463 148 HG23 ILE 18 HG23 ILE 18 -3.027 12.517 -1.514 149 HD11 ILE 18 HD11 ILE 18 -3.734 11.383 1.190 150 HD12 ILE 18 HD12 ILE 18 -2.408 10.907 0.097 151 HD13 ILE 18 HD13 ILE 18 -2.221 10.745 1.854 152 H GLY 19 H GLY 19 -1.207 16.080 -1.550 153 HA2 GLY 19 HA2 GLY 19 1.462 15.223 -1.007 154 HA3 GLY 19 HA3 GLY 19 0.991 16.412 -2.225 155 H LYS 20 H LYS 20 -0.192 18.262 -0.182 156 HA LYS 20 HA LYS 20 2.264 19.647 0.605 157 HB2 LYS 20 HB2 LYS 20 0.159 20.748 -0.204 158 HB3 LYS 20 HB3 LYS 20 -0.638 20.282 1.308 159 HG2 LYS 20 HG2 LYS 20 0.903 21.674 2.596 160 HG3 LYS 20 HG3 LYS 20 1.899 21.973 1.156 161 HD2 LYS 20 HD2 LYS 20 -0.008 23.137 0.075 162 HD3 LYS 20 HD3 LYS 20 -0.998 22.868 1.526 163 HE2 LYS 20 HE2 LYS 20 0.551 24.205 2.879 164 HE3 LYS 20 HE3 LYS 20 1.663 24.367 1.510 165 HZ1 LYS 20 HZ1 LYS 20 -0.050 25.629 0.333 166 HZ2 LYS 20 HZ2 LYS 20 -1.100 25.473 1.578 167 HZ3 LYS 20 HZ3 LYS 20 0.269 26.344 1.763 168 H ILE 21 H ILE 21 -0.076 17.546 2.173 169 HA ILE 21 HA ILE 21 0.769 18.057 4.899 170 HB ILE 21 HB ILE 21 -0.660 15.668 3.698 171 HG12 ILE 21 HG12 ILE 21 -1.926 17.851 5.390 172 HG13 ILE 21 HG13 ILE 21 -1.871 17.983 3.639 173 HG21 ILE 21 HG21 ILE 21 0.278 14.904 5.735 174 HG22 ILE 21 HG22 ILE 21 -0.163 16.391 6.598 175 HG23 ILE 21 HG23 ILE 21 -1.401 15.235 6.100 176 HD11 ILE 21 HD11 ILE 21 -2.944 15.360 4.476 177 HD12 ILE 21 HD12 ILE 21 -3.885 16.736 5.072 178 HD13 ILE 21 HD13 ILE 21 -3.576 16.554 3.336 179 H VAL 22 H VAL 22 1.592 15.610 2.428 180 HA VAL 22 HA VAL 22 3.476 14.257 4.199 181 HB VAL 22 HB VAL 22 2.805 13.964 1.262 182 HG11 VAL 22 HG11 VAL 22 5.059 13.065 1.646 183 HG12 VAL 22 HG12 VAL 22 4.475 12.104 3.017 184 HG13 VAL 22 HG13 VAL 22 3.909 11.760 1.375 185 HG21 VAL 22 HG21 VAL 22 2.026 12.356 3.755 186 HG22 VAL 22 HG22 VAL 22 0.942 13.378 2.791 187 HG23 VAL 22 HG23 VAL 22 1.610 11.899 2.103 188 H GLU 23 H GLU 23 3.878 16.573 1.467 189 HA GLU 23 HA GLU 23 6.758 16.434 1.426 190 HB2 GLU 23 HB2 GLU 23 4.779 18.581 0.580 191 HB3 GLU 23 HB3 GLU 23 6.511 18.793 0.407 192 HG2 GLU 23 HG2 GLU 23 5.130 16.379 -0.799 193 HG3 GLU 23 HG3 GLU 23 5.203 17.928 -1.635 194 H LYS 24 H LYS 24 4.535 18.144 3.529 195 HA LYS 24 HA LYS 24 6.847 19.505 4.880 196 HB2 LYS 24 HB2 LYS 24 3.932 20.330 4.875 197 HB3 LYS 24 HB3 LYS 24 5.261 21.238 5.565 198 HG2 LYS 24 HG2 LYS 24 4.835 20.629 2.605 199 HG3 LYS 24 HG3 LYS 24 4.456 22.143 3.399 200 HD2 LYS 24 HD2 LYS 24 7.242 20.952 3.052 201 HD3 LYS 24 HD3 LYS 24 6.563 22.268 2.112 202 HE2 LYS 24 HE2 LYS 24 7.107 22.353 5.117 203 HE3 LYS 24 HE3 LYS 24 8.164 23.013 3.869 204 HZ1 LYS 24 HZ1 LYS 24 6.367 24.531 3.221 205 HZ2 LYS 24 HZ2 LYS 24 5.396 23.956 4.408 206 HZ3 LYS 24 HZ3 LYS 24 6.770 24.749 4.785 207 H ARG 25 H ARG 25 5.004 16.884 5.333 208 HA ARG 25 HA ARG 25 4.305 15.559 7.038 209 HB2 ARG 25 HB2 ARG 25 6.805 16.656 8.355 210 HB3 ARG 25 HB3 ARG 25 5.916 15.231 8.890 211 HG2 ARG 25 HG2 ARG 25 6.899 13.901 7.355 212 HG3 ARG 25 HG3 ARG 25 6.441 14.970 6.042 213 HD2 ARG 25 HD2 ARG 25 8.756 14.903 5.901 214 HD3 ARG 25 HD3 ARG 25 8.420 16.454 6.688 215 HE ARG 25 HE ARG 25 8.815 14.431 8.691 216 HH11 ARG 25 HH11 ARG 25 10.751 16.225 6.376 217 HH12 ARG 25 HH12 ARG 25 12.230 15.937 7.258 218 HH21 ARG 25 HH21 ARG 25 10.741 14.084 9.745 219 HH22 ARG 25 HH22 ARG 25 12.218 14.759 9.109 220 H ILE 26 H ILE 26 2.603 17.362 6.931 221 HA ILE 26 HA ILE 26 2.417 19.140 9.236 222 HB ILE 26 HB ILE 26 0.292 18.515 7.150 223 HG12 ILE 26 HG12 ILE 26 2.419 20.706 7.243 224 HG13 ILE 26 HG13 ILE 26 2.354 19.356 6.111 225 HG21 ILE 26 HG21 ILE 26 -0.600 19.549 9.242 226 HG22 ILE 26 HG22 ILE 26 0.573 20.873 9.068 227 HG23 ILE 26 HG23 ILE 26 -0.721 20.636 7.873 228 HD11 ILE 26 HD11 ILE 26 0.185 20.244 5.212 229 HD12 ILE 26 HD12 ILE 26 0.431 21.697 6.218 230 HD13 ILE 26 HD13 ILE 26 1.597 21.288 4.952 231 H GLU 27 H GLU 27 1.739 18.611 11.175 232 HA GLU 27 HA GLU 27 0.459 16.072 11.813 233 HB2 GLU 27 HB2 GLU 27 0.951 18.504 13.575 234 HB3 GLU 27 HB3 GLU 27 0.418 16.898 14.102 235 HG2 GLU 27 HG2 GLU 27 2.547 15.973 13.037 236 HG3 GLU 27 HG3 GLU 27 3.102 17.641 12.870 237 H CYS 28 H CYS 28 -1.573 15.714 11.218 238 HA CYS 28 HA CYS 28 -3.692 17.562 12.099 239 HB2 CYS 28 HB2 CYS 28 -4.750 17.526 9.802 240 HB3 CYS 28 HB3 CYS 28 -3.268 18.469 9.939 241 HG CYS 28 HG CYS 28 -1.649 16.631 8.974 242 H THR 29 H THR 29 -5.810 16.783 11.928 243 HA THR 29 HA THR 29 -6.087 13.874 12.444 244 HB THR 29 HB THR 29 -8.367 15.789 12.668 245 HG1 THR 29 HG1 THR 29 -7.638 16.451 14.731 246 HG21 THR 29 HG21 THR 29 -8.640 13.442 13.384 247 HG22 THR 29 HG22 THR 29 -7.349 13.674 14.595 248 HG23 THR 29 HG23 THR 29 -8.877 14.572 14.722 249 H VAL 30 H VAL 30 -7.757 12.623 11.371 250 HA VAL 30 HA VAL 30 -8.859 13.754 8.821 251 HB VAL 30 HB VAL 30 -8.340 11.718 7.632 252 HG11 VAL 30 HG11 VAL 30 -6.695 13.588 7.641 253 HG12 VAL 30 HG12 VAL 30 -5.786 12.746 8.916 254 HG13 VAL 30 HG13 VAL 30 -5.992 12.002 7.319 255 HG21 VAL 30 HG21 VAL 30 -6.808 10.763 10.087 256 HG22 VAL 30 HG22 VAL 30 -8.321 10.062 9.469 257 HG23 VAL 30 HG23 VAL 30 -6.847 9.979 8.499 258 H TYR 31 H TYR 31 -10.497 12.119 7.848 259 HA TYR 31 HA TYR 31 -12.368 11.264 10.016 260 HB2 TYR 31 HB2 TYR 31 -12.896 12.518 7.294 261 HB3 TYR 31 HB3 TYR 31 -14.128 11.720 8.239 262 HD1 TYR 31 HD1 TYR 31 -11.895 14.703 8.125 263 HD2 TYR 31 HD2 TYR 31 -15.197 12.761 10.109 264 HE1 TYR 31 HE1 TYR 31 -12.458 16.827 9.292 265 HE2 TYR 31 HE2 TYR 31 -15.783 14.888 11.235 266 HH TYR 31 HH TYR 31 -15.268 17.088 11.494 267 H SER 32 H SER 32 -13.367 9.300 9.834 268 HA SER 32 HA SER 32 -13.278 7.611 7.430 269 HB2 SER 32 HB2 SER 32 -11.010 7.278 8.230 270 HB3 SER 32 HB3 SER 32 -11.569 7.063 9.898 271 HG SER 32 HG SER 32 -12.128 5.066 9.435 272 H VAL 33 H VAL 33 -14.633 5.663 7.755 273 HA VAL 33 HA VAL 33 -16.482 5.826 10.068 274 HB VAL 33 HB VAL 33 -17.685 3.934 9.094 275 HG11 VAL 33 HG11 VAL 33 -18.406 6.191 8.610 276 HG12 VAL 33 HG12 VAL 33 -17.318 6.270 7.195 277 HG13 VAL 33 HG13 VAL 33 -18.682 5.133 7.217 278 HG21 VAL 33 HG21 VAL 33 -15.825 4.228 6.716 279 HG22 VAL 33 HG22 VAL 33 -15.877 2.842 7.837 280 HG23 VAL 33 HG23 VAL 33 -17.271 3.196 6.811 281 H ASP 34 H ASP 34 -16.874 4.125 11.499 282 HA ASP 34 HA ASP 34 -14.615 2.268 12.017 283 HB2 ASP 34 HB2 ASP 34 -15.382 2.128 14.215 284 HB3 ASP 34 HB3 ASP 34 -15.539 3.823 13.798 285 H ASN 35 H ASN 35 -15.616 0.211 13.270 286 HA ASN 35 HA ASN 35 -16.780 -1.524 11.297 287 HB2 ASN 35 HB2 ASN 35 -16.413 -1.811 14.312 288 HB3 ASN 35 HB3 ASN 35 -16.963 -3.114 13.266 289 HD21 ASN 35 HD22 ASN 35 -14.294 -2.297 14.851 290 HD22 ASN 35 HD21 ASN 35 -13.086 -2.842 13.694 291 H ASN 36 H ASN 36 -18.382 0.771 13.273 292 HA ASN 36 HA ASN 36 -21.010 -0.627 13.112 293 HB2 ASN 36 HB2 ASN 36 -20.231 1.925 14.589 294 HB3 ASN 36 HB3 ASN 36 -21.763 1.071 14.698 295 HD21 ASN 36 HD22 ASN 36 -18.639 1.392 16.027 296 HD22 ASN 36 HD21 ASN 36 -18.750 0.013 17.133 297 H GLY 37 H GLY 37 -19.129 1.522 11.253 298 HA2 GLY 37 HA2 GLY 37 -19.715 2.571 9.284 299 HA3 GLY 37 HA3 GLY 37 -21.430 2.343 9.625 300 H ASN 38 H ASN 38 -19.217 3.913 11.980 301 HA ASN 38 HA ASN 38 -20.757 6.472 11.602 302 HB2 ASN 38 HB2 ASN 38 -19.484 5.193 14.057 303 HB3 ASN 38 HB3 ASN 38 -20.007 6.872 13.995 304 HD21 ASN 38 HD22 ASN 38 -21.156 3.536 13.836 305 HD22 ASN 38 HD21 ASN 38 -22.831 3.925 14.226 306 H ILE 39 H ILE 39 -19.670 8.137 10.814 307 HA ILE 39 HA ILE 39 -16.869 8.043 10.232 308 HB ILE 39 HB ILE 39 -18.620 10.497 10.157 309 HG12 ILE 39 HG12 ILE 39 -18.098 8.547 7.865 310 HG13 ILE 39 HG13 ILE 39 -19.593 8.546 8.802 311 HG21 ILE 39 HG21 ILE 39 -16.927 11.307 8.590 312 HG22 ILE 39 HG22 ILE 39 -16.075 10.720 10.013 313 HG23 ILE 39 HG23 ILE 39 -16.126 9.722 8.555 314 HD11 ILE 39 HD11 ILE 39 -20.022 10.892 8.165 315 HD12 ILE 39 HD12 ILE 39 -18.567 10.858 7.142 316 HD13 ILE 39 HD13 ILE 39 -19.943 9.787 6.779 317 H TYR 40 H TYR 40 -15.477 7.998 11.881 318 HA TYR 40 HA TYR 40 -15.669 9.940 14.151 319 HB2 TYR 40 HB2 TYR 40 -14.263 8.492 15.390 320 HB3 TYR 40 HB3 TYR 40 -15.552 7.517 14.724 321 HD1 TYR 40 HD1 TYR 40 -11.929 8.232 14.651 322 HD2 TYR 40 HD2 TYR 40 -15.077 5.785 13.018 323 HE1 TYR 40 HE1 TYR 40 -10.246 6.717 13.649 324 HE2 TYR 40 HE2 TYR 40 -13.353 4.228 12.101 325 HH TYR 40 HH TYR 40 -9.861 4.939 12.353 326 H THR 41 H THR 41 -13.284 10.491 14.930 327 HA THR 41 HA THR 41 -11.599 11.181 12.582 328 HB THR 41 HB THR 41 -10.962 13.288 13.819 329 HG1 THR 41 HG1 THR 41 -12.555 14.050 15.268 330 HG21 THR 41 HG21 THR 41 -12.372 13.433 11.882 331 HG22 THR 41 HG22 THR 41 -13.817 12.967 12.812 332 HG23 THR 41 HG23 THR 41 -13.031 14.523 13.112 333 H GLN 42 H GLN 42 -9.419 11.124 12.763 334 HA GLN 42 HA GLN 42 -8.183 10.209 15.302 335 HB2 GLN 42 HB2 GLN 42 -7.124 8.290 14.194 336 HB3 GLN 42 HB3 GLN 42 -8.877 8.190 14.202 337 HG2 GLN 42 HG2 GLN 42 -8.866 9.020 11.789 338 HG3 GLN 42 HG3 GLN 42 -7.106 8.949 11.831 339 HE21 GLN 42 HE22 GLN 42 -8.013 7.582 9.804 340 HE22 GLN 42 HE21 GLN 42 -8.000 5.868 10.138 341 HA PRO 43 HA PRO 43 -4.861 12.793 13.739 342 HB2 PRO 43 HB2 PRO 43 -2.801 12.086 15.368 343 HB3 PRO 43 HB3 PRO 43 -4.220 13.011 15.944 344 HG2 PRO 43 HG2 PRO 43 -3.730 10.025 16.171 345 HG3 PRO 43 HG3 PRO 43 -4.267 11.163 17.448 346 HD2 PRO 43 HD2 PRO 43 -6.015 9.610 16.036 347 HD3 PRO 43 HD3 PRO 43 -6.445 11.260 16.581 348 H VAL 44 H VAL 44 -3.160 12.690 12.275 349 HA VAL 44 HA VAL 44 -2.488 10.289 10.875 350 HB VAL 44 HB VAL 44 -2.256 12.538 9.936 351 HG11 VAL 44 HG11 VAL 44 -1.266 13.720 11.940 352 HG12 VAL 44 HG12 VAL 44 0.264 12.895 11.614 353 HG13 VAL 44 HG13 VAL 44 -0.408 14.010 10.412 354 HG21 VAL 44 HG21 VAL 44 0.454 11.164 9.949 355 HG22 VAL 44 HG22 VAL 44 -0.956 10.566 9.053 356 HG23 VAL 44 HG23 VAL 44 -0.261 12.151 8.669 357 H ALA 45 H ALA 45 -0.866 8.781 11.105 358 HA ALA 45 HA ALA 45 0.648 8.816 13.670 359 HB1 ALA 45 HB1 ALA 45 -0.724 6.836 13.067 360 HB2 ALA 45 HB2 ALA 45 0.286 6.586 11.627 361 HB3 ALA 45 HB3 ALA 45 1.005 6.461 13.239 362 H GLN 46 H GLN 46 1.167 8.863 10.158 363 HA GLN 46 HA GLN 46 3.837 9.916 10.354 364 HB2 GLN 46 HB2 GLN 46 5.004 8.031 9.236 365 HB3 GLN 46 HB3 GLN 46 4.565 7.806 10.907 366 HG2 GLN 46 HG2 GLN 46 2.456 6.522 9.900 367 HG3 GLN 46 HG3 GLN 46 3.466 6.460 8.450 368 HE21 GLN 46 HE22 GLN 46 3.543 5.860 12.008 369 HE22 GLN 46 HE21 GLN 46 4.719 4.568 11.922 370 H TRP 47 H TRP 47 4.907 9.719 8.002 371 HA TRP 47 HA TRP 47 2.847 10.261 5.897 372 HB2 TRP 47 HB2 TRP 47 5.335 11.913 6.465 373 HB3 TRP 47 HB3 TRP 47 4.135 12.206 5.221 374 HD1 TRP 47 HD1 TRP 47 2.039 13.588 5.863 375 HE1 TRP 47 HE1 TRP 47 1.228 14.817 7.976 376 HE3 TRP 47 HE3 TRP 47 5.492 11.807 9.202 377 HZ2 TRP 47 HZ2 TRP 47 1.926 14.904 10.757 378 HZ3 TRP 47 HZ3 TRP 47 5.360 12.451 11.600 379 HH2 TRP 47 HH2 TRP 47 3.563 13.980 12.390 380 H HIS 48 H HIS 48 3.316 9.409 3.925 381 HA HIS 48 HA HIS 48 6.016 8.203 3.457 382 HB2 HIS 48 HB2 HIS 48 3.355 7.059 2.560 383 HB3 HIS 48 HB3 HIS 48 4.960 6.371 2.352 384 HD1 HIS 48 HD1 HIS 48 6.183 5.707 4.898 385 HD2 HIS 48 HD2 HIS 48 2.007 6.150 4.560 386 HE1 HIS 48 HE1 HIS 48 5.170 4.471 6.883 387 H ASP 49 H ASP 49 7.011 9.191 1.904 388 HA ASP 49 HA ASP 49 5.539 10.322 -0.429 389 HB2 ASP 49 HB2 ASP 49 7.502 11.714 -0.806 390 HB3 ASP 49 HB3 ASP 49 6.772 12.025 0.755 391 H ARG 50 H ARG 50 5.424 8.965 -1.998 392 HA ARG 50 HA ARG 50 7.282 6.726 -2.382 393 HB2 ARG 50 HB2 ARG 50 4.984 7.746 -4.068 394 HB3 ARG 50 HB3 ARG 50 5.779 6.185 -4.213 395 HG2 ARG 50 HG2 ARG 50 4.121 7.165 -1.836 396 HG3 ARG 50 HG3 ARG 50 3.645 5.951 -3.002 397 HD2 ARG 50 HD2 ARG 50 5.906 5.699 -0.982 398 HD3 ARG 50 HD3 ARG 50 4.328 4.920 -0.903 399 HE ARG 50 HE ARG 50 5.525 4.178 -3.389 400 HH11 ARG 50 HH11 ARG 50 6.210 3.543 -0.007 401 HH12 ARG 50 HH12 ARG 50 7.049 2.061 -0.392 402 HH21 ARG 50 HH21 ARG 50 6.537 2.353 -3.798 403 HH22 ARG 50 HH22 ARG 50 7.252 1.406 -2.509 404 H GLY 51 H GLY 51 6.781 9.852 -3.825 405 HA2 GLY 51 HA2 GLY 51 8.512 11.126 -4.811 406 HA3 GLY 51 HA3 GLY 51 9.396 9.651 -5.181 407 H GLU 52 H GLU 52 7.496 8.178 -6.627 408 HA GLU 52 HA GLU 52 6.310 9.446 -8.854 409 HB2 GLU 52 HB2 GLU 52 7.961 9.164 -10.588 410 HB3 GLU 52 HB3 GLU 52 8.350 10.438 -9.474 411 HG2 GLU 52 HG2 GLU 52 9.912 8.744 -8.297 412 HG3 GLU 52 HG3 GLU 52 9.688 7.730 -9.720 413 H GLN 53 H GLN 53 4.868 7.835 -8.781 414 HA GLN 53 HA GLN 53 5.738 5.194 -9.904 415 HB2 GLN 53 HB2 GLN 53 3.526 5.776 -7.922 416 HB3 GLN 53 HB3 GLN 53 3.966 4.170 -8.549 417 HG2 GLN 53 HG2 GLN 53 6.248 4.422 -7.532 418 HG3 GLN 53 HG3 GLN 53 5.739 5.990 -6.854 419 HE21 GLN 53 HE22 GLN 53 3.154 5.448 -5.946 420 HE22 GLN 53 HE21 GLN 53 3.549 4.670 -4.469 421 H GLU 54 H GLU 54 3.930 3.988 -10.936 422 HA GLU 54 HA GLU 54 2.931 5.521 -13.129 423 HB2 GLU 54 HB2 GLU 54 2.009 3.333 -13.888 424 HB3 GLU 54 HB3 GLU 54 3.726 3.353 -13.518 425 HG2 GLU 54 HG2 GLU 54 3.166 2.276 -11.268 426 HG3 GLU 54 HG3 GLU 54 1.516 2.079 -11.852 427 H VAL 55 H VAL 55 1.385 6.991 -12.848 428 HA VAL 55 HA VAL 55 -0.994 6.439 -11.168 429 HB VAL 55 HB VAL 55 -0.221 9.023 -12.576 430 HG11 VAL 55 HG11 VAL 55 -2.615 8.884 -11.838 431 HG12 VAL 55 HG12 VAL 55 -2.051 8.517 -10.192 432 HG13 VAL 55 HG13 VAL 55 -1.688 10.085 -10.943 433 HG21 VAL 55 HG21 VAL 55 0.472 7.962 -9.812 434 HG22 VAL 55 HG22 VAL 55 1.552 8.648 -11.045 435 HG23 VAL 55 HG23 VAL 55 0.439 9.699 -10.174 436 H PHE 56 H PHE 56 -3.037 6.374 -11.873 437 HA PHE 56 HA PHE 56 -3.634 6.434 -14.804 438 HB2 PHE 56 HB2 PHE 56 -4.607 4.542 -12.650 439 HB3 PHE 56 HB3 PHE 56 -5.299 4.668 -14.264 440 HD1 PHE 56 HD2 PHE 56 -2.091 3.905 -12.456 441 HD2 PHE 56 HD1 PHE 56 -4.349 3.500 -16.103 442 HE1 PHE 56 HE2 PHE 56 -0.355 2.388 -13.363 443 HE2 PHE 56 HE1 PHE 56 -2.653 1.897 -16.962 444 HZ PHE 56 HZ PHE 56 -0.611 1.408 -15.630 445 H GLU 57 H GLU 57 -5.425 7.471 -15.437 446 HA GLU 57 HA GLU 57 -6.751 9.438 -13.804 447 HB2 GLU 57 HB2 GLU 57 -6.549 9.563 -16.269 448 HB3 GLU 57 HB3 GLU 57 -7.542 8.117 -16.442 449 HG2 GLU 57 HG2 GLU 57 -9.483 9.285 -15.482 450 HG3 GLU 57 HG3 GLU 57 -8.483 10.699 -15.123 451 H TYR 58 H TYR 58 -8.367 9.166 -12.328 452 HA TYR 58 HA TYR 58 -10.185 6.825 -12.597 453 HB2 TYR 58 HB2 TYR 58 -8.704 6.347 -10.846 454 HB3 TYR 58 HB3 TYR 58 -8.707 8.001 -10.246 455 HD1 TYR 58 HD2 TYR 58 -11.901 6.281 -11.103 456 HD2 TYR 58 HD1 TYR 58 -9.058 7.220 -7.985 457 HE1 TYR 58 HE2 TYR 58 -13.577 5.721 -9.392 458 HE2 TYR 58 HE1 TYR 58 -10.797 6.726 -6.267 459 HH TYR 58 HH TYR 58 -14.126 5.872 -7.217 460 H CYS 59 H CYS 59 -11.810 7.800 -13.638 461 HA CYS 59 HA CYS 59 -13.017 10.268 -12.452 462 HB2 CYS 59 HB2 CYS 59 -12.148 10.462 -14.779 463 HB3 CYS 59 HB3 CYS 59 -13.225 9.148 -15.275 464 HG CYS 59 HG CYS 59 -14.179 11.929 -13.713 465 H LEU 60 H LEU 60 -15.156 10.284 -11.941 466 HA LEU 60 HA LEU 60 -16.594 7.655 -11.899 467 HB2 LEU 60 HB2 LEU 60 -16.211 9.819 -9.947 468 HB3 LEU 60 HB3 LEU 60 -17.896 9.581 -10.260 469 HG LEU 60 HG LEU 60 -17.885 7.298 -9.574 470 HD11 LEU 60 HD11 LEU 60 -15.673 6.538 -10.314 471 HD12 LEU 60 HD12 LEU 60 -14.911 7.593 -9.103 472 HD13 LEU 60 HD13 LEU 60 -15.922 6.205 -8.599 473 HD21 LEU 60 HD21 LEU 60 -16.223 8.832 -7.536 474 HD22 LEU 60 HD22 LEU 60 -17.941 9.128 -7.800 475 HD23 LEU 60 HD23 LEU 60 -17.411 7.551 -7.212 476 H GLU 61 H GLU 61 -18.883 7.677 -12.083 477 HA GLU 61 HA GLU 61 -19.707 8.791 -14.576 478 HB2 GLU 61 HB2 GLU 61 -21.307 7.454 -12.368 479 HB3 GLU 61 HB3 GLU 61 -21.913 7.755 -14.000 480 HG2 GLU 61 HG2 GLU 61 -20.251 6.301 -14.988 481 HG3 GLU 61 HG3 GLU 61 -19.416 6.095 -13.457 482 H ASP 62 H ASP 62 -20.013 10.140 -11.404 483 HA ASP 62 HA ASP 62 -22.064 12.141 -12.060 484 HB2 ASP 62 HB2 ASP 62 -21.786 11.385 -9.779 485 HB3 ASP 62 HB3 ASP 62 -20.077 11.839 -9.778 486 H GLY 63 H GLY 63 -18.560 11.880 -12.401 487 HA2 GLY 63 HA2 GLY 63 -17.483 13.362 -14.002 488 HA3 GLY 63 HA3 GLY 63 -18.396 14.723 -13.354 489 H SER 64 H SER 64 -17.465 12.915 -10.705 490 HA SER 64 HA SER 64 -15.381 14.672 -9.780 491 HB2 SER 64 HB2 SER 64 -16.125 11.840 -8.940 492 HB3 SER 64 HB3 SER 64 -14.931 12.850 -8.113 493 HG SER 64 HG SER 64 -17.651 13.598 -8.528 494 H LEU 65 H LEU 65 -13.151 14.391 -9.650 495 HA LEU 65 HA LEU 65 -11.921 12.463 -11.564 496 HB2 LEU 65 HB2 LEU 65 -12.411 15.054 -12.226 497 HB3 LEU 65 HB3 LEU 65 -10.892 15.285 -11.396 498 HG LEU 65 HG LEU 65 -10.395 15.111 -13.691 499 HD11 LEU 65 HD11 LEU 65 -8.875 13.690 -12.272 500 HD12 LEU 65 HD12 LEU 65 -9.844 12.269 -12.748 501 HD13 LEU 65 HD13 LEU 65 -8.976 13.200 -13.972 502 HD21 LEU 65 HD21 LEU 65 -12.093 12.596 -13.795 503 HD22 LEU 65 HD22 LEU 65 -12.517 14.186 -14.457 504 HD23 LEU 65 HD23 LEU 65 -11.163 13.279 -15.149 505 H ILE 66 H ILE 66 -10.331 11.399 -10.766 506 HA ILE 66 HA ILE 66 -8.748 12.301 -8.415 507 HB ILE 66 HB ILE 66 -10.004 9.546 -8.781 508 HG12 ILE 66 HG12 ILE 66 -10.960 11.646 -6.790 509 HG13 ILE 66 HG13 ILE 66 -11.764 11.337 -8.326 510 HG21 ILE 66 HG21 ILE 66 -7.965 9.493 -7.423 511 HG22 ILE 66 HG22 ILE 66 -8.562 10.839 -6.417 512 HG23 ILE 66 HG23 ILE 66 -9.342 9.251 -6.372 513 HD11 ILE 66 HD11 ILE 66 -12.275 9.047 -7.723 514 HD12 ILE 66 HD12 ILE 66 -11.554 9.292 -6.107 515 HD13 ILE 66 HD13 ILE 66 -12.973 10.216 -6.616 516 H ARG 67 H ARG 67 -6.658 11.340 -8.292 517 HA ARG 67 HA ARG 67 -5.694 9.773 -10.651 518 HB2 ARG 67 HB2 ARG 67 -4.498 12.385 -9.622 519 HB3 ARG 67 HB3 ARG 67 -3.683 11.258 -10.718 520 HG2 ARG 67 HG2 ARG 67 -5.639 11.468 -12.291 521 HG3 ARG 67 HG3 ARG 67 -6.270 12.773 -11.283 522 HD2 ARG 67 HD2 ARG 67 -4.421 14.203 -11.776 523 HD3 ARG 67 HD3 ARG 67 -3.455 12.871 -12.396 524 HE ARG 67 HE ARG 67 -4.632 12.861 -14.423 525 HH11 ARG 67 HH11 ARG 67 -5.954 15.399 -12.395 526 HH12 ARG 67 HH12 ARG 67 -6.976 16.000 -13.675 527 HH21 ARG 67 HH21 ARG 67 -5.879 13.740 -16.023 528 HH22 ARG 67 HH22 ARG 67 -6.900 15.103 -15.679 529 H ALA 68 H ALA 68 -5.007 7.966 -9.879 530 HA ALA 68 HA ALA 68 -3.241 7.828 -7.494 531 HB1 ALA 68 HB1 ALA 68 -5.590 7.557 -6.693 532 HB2 ALA 68 HB2 ALA 68 -5.821 6.221 -7.842 533 HB3 ALA 68 HB3 ALA 68 -4.656 6.059 -6.512 534 H THR 69 H THR 69 -2.182 5.727 -7.286 535 HA THR 69 HA THR 69 -1.381 4.502 -9.835 536 HB THR 69 HB THR 69 -0.144 2.922 -8.233 537 HG1 THR 69 HG1 THR 69 -1.752 3.597 -6.550 538 HG21 THR 69 HG21 THR 69 1.115 4.715 -9.123 539 HG22 THR 69 HG22 THR 69 0.353 5.913 -8.054 540 HG23 THR 69 HG23 THR 69 1.438 4.667 -7.385 541 H LYS 70 H LYS 70 -1.740 2.328 -10.458 542 HA LYS 70 HA LYS 70 -4.267 1.159 -9.723 543 HB2 LYS 70 HB2 LYS 70 -1.911 0.225 -11.363 544 HB3 LYS 70 HB3 LYS 70 -3.172 -0.937 -10.916 545 HG2 LYS 70 HG2 LYS 70 -4.911 0.351 -11.974 546 HG3 LYS 70 HG3 LYS 70 -3.833 1.720 -12.198 547 HD2 LYS 70 HD2 LYS 70 -3.946 0.807 -14.297 548 HD3 LYS 70 HD3 LYS 70 -2.404 0.183 -13.711 549 HE2 LYS 70 HE2 LYS 70 -4.994 -1.382 -13.595 550 HE3 LYS 70 HE3 LYS 70 -4.009 -1.329 -15.050 551 HZ1 LYS 70 HZ1 LYS 70 -2.150 -2.277 -13.819 552 HZ2 LYS 70 HZ2 LYS 70 -3.039 -2.387 -12.444 553 HZ3 LYS 70 HZ3 LYS 70 -3.446 -3.266 -13.758 554 H ASP 71 H ASP 71 -1.263 0.939 -8.132 555 HA ASP 71 HA ASP 71 -1.685 -1.620 -6.788 556 HB2 ASP 71 HB2 ASP 71 0.276 0.679 -6.383 557 HB3 ASP 71 HB3 ASP 71 0.363 -0.878 -5.553 558 H HIS 72 H HIS 72 -2.897 1.566 -6.308 559 HA HIS 72 HA HIS 72 -2.879 1.524 -3.380 560 HB2 HIS 72 HB2 HIS 72 -2.618 3.626 -4.673 561 HB3 HIS 72 HB3 HIS 72 -4.211 3.397 -5.401 562 HD1 HIS 72 HD1 HIS 72 -6.337 3.506 -3.629 563 HD2 HIS 72 HD2 HIS 72 -2.578 4.761 -2.220 564 HE1 HIS 72 HE1 HIS 72 -6.717 4.531 -1.368 565 H LYS 73 H LYS 73 -4.587 0.813 -2.119 566 HA LYS 73 HA LYS 73 -6.905 -0.480 -3.438 567 HB2 LYS 73 HB2 LYS 73 -5.680 -0.640 -0.664 568 HB3 LYS 73 HB3 LYS 73 -7.198 -1.444 -1.078 569 HG2 LYS 73 HG2 LYS 73 -6.192 -2.936 -2.572 570 HG3 LYS 73 HG3 LYS 73 -4.807 -1.894 -2.872 571 HD2 LYS 73 HD2 LYS 73 -3.993 -2.345 -0.558 572 HD3 LYS 73 HD3 LYS 73 -5.286 -3.543 -0.352 573 HE2 LYS 73 HE2 LYS 73 -3.529 -3.614 -2.813 574 HE3 LYS 73 HE3 LYS 73 -2.825 -4.163 -1.288 575 HZ1 LYS 73 HZ1 LYS 73 -4.537 -5.839 -1.100 576 HZ2 LYS 73 HZ2 LYS 73 -5.328 -5.308 -2.427 577 HZ3 LYS 73 HZ3 LYS 73 -3.847 -5.993 -2.568 578 H PHE 74 H PHE 74 -9.050 -0.122 -2.932 579 HA PHE 74 HA PHE 74 -9.653 2.413 -1.420 580 HB2 PHE 74 HB2 PHE 74 -10.653 1.535 -4.133 581 HB3 PHE 74 HB3 PHE 74 -11.472 2.714 -3.131 582 HD1 PHE 74 HD1 PHE 74 -8.287 2.047 -4.991 583 HD2 PHE 74 HD2 PHE 74 -10.812 4.993 -3.100 584 HE1 PHE 74 HE1 PHE 74 -6.905 3.868 -5.967 585 HE2 PHE 74 HE2 PHE 74 -9.384 6.803 -4.020 586 HZ PHE 74 HZ PHE 74 -7.438 6.245 -5.458 587 H MET 75 H MET 75 -11.719 2.603 -0.515 588 HA MET 75 HA MET 75 -12.599 -0.006 0.520 589 HB2 MET 75 HB2 MET 75 -11.842 1.989 1.951 590 HB3 MET 75 HB3 MET 75 -13.445 2.657 1.637 591 HG2 MET 75 HG2 MET 75 -14.507 0.692 2.628 592 HG3 MET 75 HG3 MET 75 -12.957 -0.155 2.697 593 HE1 MET 75 HE1 MET 75 -14.494 3.269 3.704 594 HE2 MET 75 HE2 MET 75 -15.396 2.189 4.789 595 HE3 MET 75 HE3 MET 75 -14.203 3.324 5.456 596 H THR 76 H THR 76 -14.074 -0.942 -0.768 597 HA THR 76 HA THR 76 -16.041 0.510 -2.342 598 HB THR 76 HB THR 76 -16.950 -1.696 -2.886 599 HG1 THR 76 HG1 THR 76 -15.901 -3.509 -1.987 600 HG21 THR 76 HG21 THR 76 -14.945 -0.853 -4.046 601 HG22 THR 76 HG22 THR 76 -13.911 -1.725 -2.884 602 HG23 THR 76 HG23 THR 76 -15.001 -2.622 -3.964 603 H VAL 77 H VAL 77 -18.424 -0.143 -2.235 604 HA VAL 77 HA VAL 77 -19.608 0.778 0.092 605 HB VAL 77 HB VAL 77 -21.729 -0.360 -0.718 606 HG11 VAL 77 HG11 VAL 77 -21.187 1.913 -1.351 607 HG12 VAL 77 HG12 VAL 77 -20.171 1.342 -2.690 608 HG13 VAL 77 HG13 VAL 77 -21.917 1.041 -2.717 609 HG21 VAL 77 HG21 VAL 77 -20.005 -1.197 -3.099 610 HG22 VAL 77 HG22 VAL 77 -20.677 -2.307 -1.883 611 HG23 VAL 77 HG23 VAL 77 -21.759 -1.374 -2.926 612 H ASP 78 H ASP 78 -18.600 -2.539 -0.470 613 HA ASP 78 HA ASP 78 -20.035 -3.571 1.900 614 HB2 ASP 78 HB2 ASP 78 -18.073 -4.844 -0.042 615 HB3 ASP 78 HB3 ASP 78 -18.887 -5.700 1.268 616 H GLY 79 H GLY 79 -17.095 -1.912 1.421 617 HA2 GLY 79 HA2 GLY 79 -15.592 -1.283 3.089 618 HA3 GLY 79 HA3 GLY 79 -16.126 -2.603 4.129 619 H GLN 80 H GLN 80 -15.391 -3.603 0.902 620 HA GLN 80 HA GLN 80 -13.066 -5.155 1.725 621 HB2 GLN 80 HB2 GLN 80 -14.072 -4.576 -1.088 622 HB3 GLN 80 HB3 GLN 80 -12.933 -5.829 -0.593 623 HG2 GLN 80 HG2 GLN 80 -14.751 -6.870 0.808 624 HG3 GLN 80 HG3 GLN 80 -15.887 -5.700 0.132 625 HE21 GLN 80 HE22 GLN 80 -16.792 -6.149 -1.948 626 HE22 GLN 80 HE21 GLN 80 -16.264 -7.516 -2.914 627 H MET 81 H MET 81 -10.943 -4.956 0.739 628 HA MET 81 HA MET 81 -10.067 -2.136 0.202 629 HB2 MET 81 HB2 MET 81 -8.868 -4.256 2.018 630 HB3 MET 81 HB3 MET 81 -8.018 -2.779 1.540 631 HG2 MET 81 HG2 MET 81 -9.491 -1.369 2.684 632 HG3 MET 81 HG3 MET 81 -10.746 -2.594 2.837 633 HE1 MET 81 HE1 MET 81 -11.128 -4.058 4.873 634 HE2 MET 81 HE2 MET 81 -9.963 -5.054 3.982 635 HE3 MET 81 HE3 MET 81 -9.774 -4.823 5.731 636 H LEU 82 H LEU 82 -10.370 -2.842 -2.035 637 HA LEU 82 HA LEU 82 -8.307 -4.761 -3.059 638 HB2 LEU 82 HB2 LEU 82 -10.866 -3.895 -4.452 639 HB3 LEU 82 HB3 LEU 82 -9.843 -5.266 -4.844 640 HG LEU 82 HG LEU 82 -11.637 -4.989 -2.408 641 HD11 LEU 82 HD11 LEU 82 -12.790 -5.398 -4.578 642 HD12 LEU 82 HD12 LEU 82 -11.834 -6.886 -4.769 643 HD13 LEU 82 HD13 LEU 82 -12.973 -6.726 -3.422 644 HD21 LEU 82 HD21 LEU 82 -9.903 -7.351 -3.249 645 HD22 LEU 82 HD22 LEU 82 -9.675 -6.356 -1.797 646 HD23 LEU 82 HD23 LEU 82 -11.114 -7.368 -1.949 647 HA PRO 83 HA PRO 83 -6.427 -1.419 -5.296 648 HB2 PRO 83 HB2 PRO 83 -5.442 -2.656 -7.546 649 HB3 PRO 83 HB3 PRO 83 -4.707 -2.808 -5.928 650 HG2 PRO 83 HG2 PRO 83 -6.609 -4.693 -7.349 651 HG3 PRO 83 HG3 PRO 83 -5.140 -5.110 -6.416 652 HD2 PRO 83 HD2 PRO 83 -7.672 -5.300 -5.382 653 HD3 PRO 83 HD3 PRO 83 -6.270 -4.854 -4.369 654 H ILE 84 H ILE 84 -6.920 0.067 -6.964 655 HA ILE 84 HA ILE 84 -9.570 0.032 -7.895 656 HB ILE 84 HB ILE 84 -8.157 2.022 -7.529 657 HG12 ILE 84 HG12 ILE 84 -9.493 1.875 -10.254 658 HG13 ILE 84 HG13 ILE 84 -10.312 1.985 -8.682 659 HG21 ILE 84 HG21 ILE 84 -6.112 1.279 -8.683 660 HG22 ILE 84 HG22 ILE 84 -6.940 1.398 -10.257 661 HG23 ILE 84 HG23 ILE 84 -6.650 2.850 -9.277 662 HD11 ILE 84 HD11 ILE 84 -9.204 4.158 -8.280 663 HD12 ILE 84 HD12 ILE 84 -8.523 4.088 -9.930 664 HD13 ILE 84 HD13 ILE 84 -10.274 4.123 -9.693 665 H ASP 85 H ASP 85 -6.785 -1.288 -9.505 666 HA ASP 85 HA ASP 85 -7.798 -1.801 -12.116 667 HB2 ASP 85 HB2 ASP 85 -5.482 -2.177 -11.436 668 HB3 ASP 85 HB3 ASP 85 -5.982 -3.413 -10.282 669 H GLU 86 H GLU 86 -8.496 -3.413 -9.030 670 HA GLU 86 HA GLU 86 -9.946 -5.671 -10.218 671 HB2 GLU 86 HB2 GLU 86 -8.668 -5.553 -7.918 672 HB3 GLU 86 HB3 GLU 86 -10.097 -4.712 -7.343 673 HG2 GLU 86 HG2 GLU 86 -10.895 -6.729 -6.839 674 HG3 GLU 86 HG3 GLU 86 -11.227 -6.923 -8.549 675 H ILE 87 H ILE 87 -10.707 -2.460 -8.834 676 HA ILE 87 HA ILE 87 -13.550 -2.888 -8.523 677 HB ILE 87 HB ILE 87 -11.874 -0.354 -8.695 678 HG12 ILE 87 HG12 ILE 87 -12.828 -1.957 -6.275 679 HG13 ILE 87 HG13 ILE 87 -11.173 -1.877 -6.869 680 HG21 ILE 87 HG21 ILE 87 -13.643 0.953 -8.074 681 HG22 ILE 87 HG22 ILE 87 -14.591 -0.268 -8.914 682 HG23 ILE 87 HG23 ILE 87 -14.436 -0.311 -7.161 683 HD11 ILE 87 HD11 ILE 87 -11.102 0.552 -6.378 684 HD12 ILE 87 HD12 ILE 87 -12.717 0.421 -5.638 685 HD13 ILE 87 HD13 ILE 87 -11.355 -0.484 -4.960 686 H PHE 88 H PHE 88 -11.488 -1.504 -11.095 687 HA PHE 88 HA PHE 88 -13.607 -0.591 -12.777 688 HB2 PHE 88 HB2 PHE 88 -11.247 0.101 -12.970 689 HB3 PHE 88 HB3 PHE 88 -10.804 -1.517 -13.487 690 HD1 PHE 88 HD1 PHE 88 -13.071 1.372 -14.446 691 HD2 PHE 88 HD2 PHE 88 -10.794 -2.045 -15.784 692 HE1 PHE 88 HE1 PHE 88 -13.475 2.024 -16.797 693 HE2 PHE 88 HE2 PHE 88 -11.207 -1.382 -18.147 694 HZ PHE 88 HZ PHE 88 -12.539 0.657 -18.653 695 H GLU 89 H GLU 89 -12.111 -3.859 -12.591 696 HA GLU 89 HA GLU 89 -13.555 -4.823 -14.943 697 HB2 GLU 89 HB2 GLU 89 -12.033 -6.249 -12.723 698 HB3 GLU 89 HB3 GLU 89 -12.872 -7.100 -14.024 699 HG2 GLU 89 HG2 GLU 89 -11.515 -5.723 -15.680 700 HG3 GLU 89 HG3 GLU 89 -10.524 -5.198 -14.315 701 H ARG 90 H ARG 90 -14.088 -5.338 -11.384 702 HA ARG 90 HA ARG 90 -16.636 -6.689 -11.895 703 HB2 ARG 90 HB2 ARG 90 -15.236 -5.751 -9.360 704 HB3 ARG 90 HB3 ARG 90 -16.798 -6.584 -9.389 705 HG2 ARG 90 HG2 ARG 90 -15.446 -8.356 -9.052 706 HG3 ARG 90 HG3 ARG 90 -15.483 -8.378 -10.824 707 HD2 ARG 90 HD2 ARG 90 -13.315 -7.213 -10.862 708 HD3 ARG 90 HD3 ARG 90 -13.325 -7.132 -9.089 709 HE ARG 90 HE ARG 90 -13.485 -9.771 -9.369 710 HH11 ARG 90 HH11 ARG 90 -11.417 -7.620 -11.211 711 HH12 ARG 90 HH12 ARG 90 -10.219 -8.847 -11.483 712 HH21 ARG 90 HH21 ARG 90 -11.899 -11.288 -9.724 713 HH22 ARG 90 HH22 ARG 90 -10.473 -10.860 -10.634 714 H GLU 91 H GLU 91 -15.822 -3.424 -11.959 715 HA GLU 91 HA GLU 91 -16.991 -1.516 -12.026 716 HB2 GLU 91 HB2 GLU 91 -19.449 -3.221 -12.574 717 HB3 GLU 91 HB3 GLU 91 -19.233 -1.510 -12.929 718 HG2 GLU 91 HG2 GLU 91 -17.289 -2.154 -14.448 719 HG3 GLU 91 HG3 GLU 91 -17.760 -3.839 -14.219 720 H LEU 92 H LEU 92 -16.459 -2.531 -9.510 721 HA LEU 92 HA LEU 92 -18.719 -2.479 -7.712 722 HB2 LEU 92 HB2 LEU 92 -15.778 -2.006 -7.109 723 HB3 LEU 92 HB3 LEU 92 -17.020 -2.386 -5.927 724 HG LEU 92 HG LEU 92 -16.086 -4.194 -8.178 725 HD11 LEU 92 HD11 LEU 92 -14.376 -3.843 -6.401 726 HD12 LEU 92 HD12 LEU 92 -15.539 -4.464 -5.206 727 HD13 LEU 92 HD13 LEU 92 -14.948 -5.512 -6.507 728 HD21 LEU 92 HD21 LEU 92 -17.955 -4.763 -5.840 729 HD22 LEU 92 HD22 LEU 92 -18.396 -4.739 -7.565 730 HD23 LEU 92 HD23 LEU 92 -17.309 -5.990 -6.952 731 H ASP 93 H ASP 93 -19.731 -0.821 -6.735 732 HA ASP 93 HA ASP 93 -18.979 1.957 -7.297 733 HB2 ASP 93 HB2 ASP 93 -21.026 0.886 -5.322 734 HB3 ASP 93 HB3 ASP 93 -20.895 2.532 -5.938 735 H LEU 94 H LEU 94 -17.762 3.328 -5.963 736 HA LEU 94 HA LEU 94 -16.498 2.340 -3.548 737 HB2 LEU 94 HB2 LEU 94 -16.743 5.011 -4.977 738 HB3 LEU 94 HB3 LEU 94 -16.128 4.939 -3.332 739 HG LEU 94 HG LEU 94 -14.502 5.013 -5.069 740 HD11 LEU 94 HD11 LEU 94 -14.167 4.182 -2.666 741 HD12 LEU 94 HD12 LEU 94 -14.026 2.560 -3.387 742 HD13 LEU 94 HD13 LEU 94 -12.937 3.892 -3.885 743 HD21 LEU 94 HD21 LEU 94 -15.008 2.063 -5.566 744 HD22 LEU 94 HD22 LEU 94 -15.261 3.378 -6.736 745 HD23 LEU 94 HD23 LEU 94 -13.625 3.006 -6.149 746 H MET 95 H MET 95 -16.838 3.057 -1.421 747 HA MET 95 HA MET 95 -19.602 3.593 -0.631 748 HB2 MET 95 HB2 MET 95 -17.768 2.276 0.656 749 HB3 MET 95 HB3 MET 95 -17.133 3.851 1.118 750 HG2 MET 95 HG2 MET 95 -19.530 4.367 1.953 751 HG3 MET 95 HG3 MET 95 -19.883 2.669 1.685 752 HE1 MET 95 HE1 MET 95 -18.438 0.707 2.941 753 HE2 MET 95 HE2 MET 95 -16.844 1.467 2.721 754 HE3 MET 95 HE3 MET 95 -17.390 1.007 4.346 755 H ARG 96 H ARG 96 -20.362 5.531 0.290 756 HA ARG 96 HA ARG 96 -18.704 8.002 -0.001 757 HB2 ARG 96 HB2 ARG 96 -20.776 9.247 -0.524 758 HB3 ARG 96 HB3 ARG 96 -20.312 8.123 -1.771 759 HG2 ARG 96 HG2 ARG 96 -22.351 7.341 0.334 760 HG3 ARG 96 HG3 ARG 96 -22.804 8.301 -1.058 761 HD2 ARG 96 HD2 ARG 96 -22.741 6.564 -2.506 762 HD3 ARG 96 HD3 ARG 96 -21.252 5.947 -1.867 763 HE ARG 96 HE ARG 96 -22.415 4.593 -0.301 764 HH11 ARG 96 HH11 ARG 96 -24.816 6.631 -1.890 765 HH12 ARG 96 HH12 ARG 96 -26.126 5.651 -1.279 766 HH21 ARG 96 HH21 ARG 96 -24.146 3.436 0.431 767 HH22 ARG 96 HH22 ARG 96 -25.753 3.908 -0.034 768 H VAL 97 H VAL 97 -19.177 9.712 1.351 769 HA VAL 97 HA VAL 97 -20.325 9.028 4.033 770 HB VAL 97 HB VAL 97 -18.904 10.722 4.960 771 HG11 VAL 97 HG11 VAL 97 -18.021 8.427 4.673 772 HG12 VAL 97 HG12 VAL 97 -17.248 8.947 3.159 773 HG13 VAL 97 HG13 VAL 97 -16.758 9.669 4.701 774 HG21 VAL 97 HG21 VAL 97 -17.014 11.566 3.224 775 HG22 VAL 97 HG22 VAL 97 -18.444 11.563 2.174 776 HG23 VAL 97 HG23 VAL 97 -18.456 12.489 3.669 777 H ASP 98 H ASP 98 -20.977 11.056 1.346 778 HA ASP 98 HA ASP 98 -22.725 12.863 2.971 779 HB2 ASP 98 HB2 ASP 98 -21.436 13.169 0.236 780 HB3 ASP 98 HB3 ASP 98 -22.642 14.286 0.871 781 H ASN 99 H ASN 99 -23.174 10.012 1.670 782 HA ASN 99 HA ASN 99 -24.951 8.818 0.930 783 HB2 ASN 99 HB2 ASN 99 -26.808 11.103 1.633 784 HB3 ASN 99 HB3 ASN 99 -27.099 9.360 1.743 785 HD21 ASN 99 HD22 ASN 99 -25.073 8.330 3.105 786 HD22 ASN 99 HD21 ASN 99 -24.322 9.409 4.217 787 H LEU 100 H LEU 100 -23.553 10.520 -0.786 788 HA LEU 100 HA LEU 100 -25.037 11.339 -3.108 789 HB2 LEU 100 HB2 LEU 100 -22.256 10.165 -2.720 790 HB3 LEU 100 HB3 LEU 100 -22.803 10.676 -4.290 791 HG LEU 100 HG LEU 100 -22.593 12.521 -1.874 792 HD11 LEU 100 HD11 LEU 100 -20.400 11.759 -2.683 793 HD12 LEU 100 HD12 LEU 100 -20.837 12.207 -4.347 794 HD13 LEU 100 HD13 LEU 100 -20.665 13.458 -3.098 795 HD21 LEU 100 HD21 LEU 100 -23.173 13.110 -4.817 796 HD22 LEU 100 HD22 LEU 100 -24.296 13.348 -3.457 797 HD23 LEU 100 HD23 LEU 100 -22.840 14.334 -3.574 798 HA PRO 101 HA PRO 101 -26.475 7.543 -4.917 799 HB2 PRO 101 HB2 PRO 101 -26.094 7.919 -7.622 800 HB3 PRO 101 HB3 PRO 101 -27.362 8.752 -6.672 801 HG2 PRO 101 HG2 PRO 101 -24.636 9.806 -7.473 802 HG3 PRO 101 HG3 PRO 101 -26.222 10.634 -7.585 803 HD2 PRO 101 HD2 PRO 101 -24.493 11.066 -5.529 804 HD3 PRO 101 HD3 PRO 101 -26.249 11.063 -5.247 805 H ASN 102 H ASN 102 -25.623 5.497 -5.392 806 HA ASN 102 HA ASN 102 -22.748 5.160 -5.285 807 HB2 ASN 102 HB2 ASN 102 -25.037 3.232 -5.861 808 HB3 ASN 102 HB3 ASN 102 -23.350 2.741 -5.859 809 HD21 ASN 102 HD22 ASN 102 -22.079 3.667 -3.689 810 HD22 ASN 102 HD21 ASN 102 -22.986 3.222 -2.272 811 H ILE 103 H ILE 103 -21.301 5.077 -6.802 812 HA ILE 103 HA ILE 103 -21.883 4.737 -9.668 813 HB ILE 103 HB ILE 103 -20.495 6.824 -10.116 814 HG12 ILE 103 HG12 ILE 103 -21.227 7.463 -7.220 815 HG13 ILE 103 HG13 ILE 103 -19.626 7.264 -7.892 816 HG21 ILE 103 HG21 ILE 103 -22.967 6.578 -10.510 817 HG22 ILE 103 HG22 ILE 103 -23.244 7.363 -8.939 818 HG23 ILE 103 HG23 ILE 103 -22.429 8.235 -10.251 819 HD11 ILE 103 HD11 ILE 103 -20.052 9.308 -9.314 820 HD12 ILE 103 HD12 ILE 103 -21.617 9.491 -8.479 821 HD13 ILE 103 HD13 ILE 103 -20.123 9.623 -7.562 822 H LYS 104 H LYS 104 -20.117 4.212 -10.893 823 HA LYS 104 HA LYS 104 -17.667 3.341 -9.388 824 HB2 LYS 104 HB2 LYS 104 -17.600 1.345 -10.669 825 HB3 LYS 104 HB3 LYS 104 -19.160 1.503 -9.915 826 HG2 LYS 104 HG2 LYS 104 -19.624 0.611 -11.992 827 HG3 LYS 104 HG3 LYS 104 -20.078 2.294 -12.184 828 HD2 LYS 104 HD2 LYS 104 -18.113 2.752 -13.506 829 HD3 LYS 104 HD3 LYS 104 -17.349 1.231 -13.011 830 HE2 LYS 104 HE2 LYS 104 -18.010 0.537 -15.037 831 HE3 LYS 104 HE3 LYS 104 -19.505 0.170 -14.179 832 HZ1 LYS 104 HZ1 LYS 104 -20.371 2.344 -14.979 833 HZ2 LYS 104 HZ2 LYS 104 -18.974 2.602 -15.806 834 HZ3 LYS 104 HZ3 LYS 104 -19.947 1.363 -16.218 835 H ILE 105 H ILE 105 -15.930 2.705 -11.151 836 HA ILE 105 HA ILE 105 -14.934 5.199 -12.140 837 HB ILE 105 HB ILE 105 -14.096 2.362 -12.833 838 HG12 ILE 105 HG12 ILE 105 -12.653 4.059 -10.803 839 HG13 ILE 105 HG13 ILE 105 -14.040 3.105 -10.296 840 HG21 ILE 105 HG21 ILE 105 -13.117 3.965 -14.428 841 HG22 ILE 105 HG22 ILE 105 -12.623 5.036 -13.104 842 HG23 ILE 105 HG23 ILE 105 -11.847 3.456 -13.322 843 HD11 ILE 105 HD11 ILE 105 -12.948 1.077 -11.244 844 HD12 ILE 105 HD12 ILE 105 -11.484 2.060 -11.535 845 HD13 ILE 105 HD13 ILE 105 -12.106 1.822 -9.888 846 H ALA 106 H ALA 106 -15.824 6.247 -13.748 847 HA ALA 106 HA ALA 106 -17.519 5.101 -15.815 848 HB1 ALA 106 HB1 ALA 106 -17.899 7.334 -14.840 849 HB2 ALA 106 HB2 ALA 106 -16.341 7.904 -15.464 850 HB3 ALA 106 HB3 ALA 106 -17.643 7.448 -16.588 851 H THR 107 H THR 107 -14.255 6.485 -15.688 852 HA THR 107 HA THR 107 -13.390 4.986 -18.084 853 HB THR 107 HB THR 107 -12.208 7.111 -18.919 854 HG1 THR 107 HG1 THR 107 -13.372 9.026 -18.474 855 HG21 THR 107 HG21 THR 107 -14.123 6.059 -20.113 856 HG22 THR 107 HG22 THR 107 -15.235 7.116 -19.213 857 HG23 THR 107 HG23 THR 107 -14.036 7.813 -20.322 858 H ARG 108 H ARG 108 -11.223 4.647 -18.221 859 HA ARG 108 HA ARG 108 -9.366 5.748 -16.202 860 HB2 ARG 108 HB2 ARG 108 -10.333 3.600 -15.279 861 HB3 ARG 108 HB3 ARG 108 -9.731 2.769 -16.710 862 HG2 ARG 108 HG2 ARG 108 -7.365 3.592 -15.993 863 HG3 ARG 108 HG3 ARG 108 -8.121 4.117 -14.489 864 HD2 ARG 108 HD2 ARG 108 -7.038 1.967 -14.224 865 HD3 ARG 108 HD3 ARG 108 -8.786 1.813 -14.003 866 HE ARG 108 HE ARG 108 -8.986 0.599 -15.989 867 HH11 ARG 108 HH11 ARG 108 -5.643 1.631 -15.772 868 HH12 ARG 108 HH12 ARG 108 -5.184 0.703 -17.180 869 HH21 ARG 108 HH21 ARG 108 -8.316 -0.594 -17.723 870 HH22 ARG 108 HH22 ARG 108 -6.651 -0.533 -18.228 871 H LYS 109 H LYS 109 -7.296 5.838 -16.881 872 HA LYS 109 HA LYS 109 -6.222 4.511 -19.229 873 HB2 LYS 109 HB2 LYS 109 -7.602 6.620 -20.067 874 HB3 LYS 109 HB3 LYS 109 -6.312 7.562 -19.343 875 HG2 LYS 109 HG2 LYS 109 -5.698 7.383 -21.606 876 HG3 LYS 109 HG3 LYS 109 -4.684 6.198 -20.811 877 HD2 LYS 109 HD2 LYS 109 -5.465 5.077 -22.744 878 HD3 LYS 109 HD3 LYS 109 -6.465 4.436 -21.452 879 HE2 LYS 109 HE2 LYS 109 -7.970 4.850 -23.212 880 HE3 LYS 109 HE3 LYS 109 -8.231 6.189 -22.092 881 HZ1 LYS 109 HZ1 LYS 109 -6.798 7.562 -23.555 882 HZ2 LYS 109 HZ2 LYS 109 -6.580 6.300 -24.572 883 HZ3 LYS 109 HZ3 LYS 109 -8.060 6.958 -24.395 884 H TYR 110 H TYR 110 -3.905 4.638 -19.256 885 HA TYR 110 HA TYR 110 -2.581 5.440 -16.812 886 HB2 TYR 110 HB2 TYR 110 -1.739 3.637 -18.314 887 HB3 TYR 110 HB3 TYR 110 -1.438 4.829 -19.567 888 HD1 TYR 110 HD2 TYR 110 -0.732 4.868 -15.845 889 HD2 TYR 110 HD1 TYR 110 0.911 4.992 -19.837 890 HE1 TYR 110 HE2 TYR 110 1.496 5.315 -14.917 891 HE2 TYR 110 HE1 TYR 110 3.182 5.321 -18.882 892 HH TYR 110 HH TYR 110 4.423 5.534 -16.971 893 H LEU 111 H LEU 111 -1.789 7.408 -16.206 894 HA LEU 111 HA LEU 111 -1.958 9.685 -18.139 895 HB2 LEU 111 HB2 LEU 111 -1.459 9.495 -15.138 896 HB3 LEU 111 HB3 LEU 111 -1.480 11.000 -16.051 897 HG LEU 111 HG LEU 111 -3.872 9.143 -16.050 898 HD11 LEU 111 HD11 LEU 111 -3.416 9.592 -13.750 899 HD12 LEU 111 HD12 LEU 111 -3.124 11.311 -14.063 900 HD13 LEU 111 HD13 LEU 111 -4.769 10.615 -14.237 901 HD21 LEU 111 HD21 LEU 111 -3.522 12.145 -16.525 902 HD22 LEU 111 HD22 LEU 111 -3.873 10.920 -17.763 903 HD23 LEU 111 HD23 LEU 111 -5.079 11.284 -16.525 904 H GLY 112 H GLY 112 0.355 8.082 -15.956 905 HA2 GLY 112 HA2 GLY 112 2.732 8.111 -17.194 906 HA3 GLY 112 HA3 GLY 112 2.569 9.835 -16.840 907 H LYS 113 H LYS 113 4.284 9.898 -15.413 908 HA LYS 113 HA LYS 113 4.133 8.230 -12.932 909 HB2 LYS 113 HB2 LYS 113 5.903 7.638 -14.738 910 HB3 LYS 113 HB3 LYS 113 6.728 9.088 -14.145 911 HG2 LYS 113 HG2 LYS 113 6.359 8.073 -11.768 912 HG3 LYS 113 HG3 LYS 113 6.065 6.554 -12.601 913 HD2 LYS 113 HD2 LYS 113 8.573 8.281 -12.842 914 HD3 LYS 113 HD3 LYS 113 8.438 6.875 -11.795 915 HE2 LYS 113 HE2 LYS 113 8.103 6.762 -14.826 916 HE3 LYS 113 HE3 LYS 113 9.647 6.535 -14.002 917 HZ1 LYS 113 HZ1 LYS 113 8.676 4.647 -12.803 918 HZ2 LYS 113 HZ2 LYS 113 7.254 4.814 -13.605 919 HZ3 LYS 113 HZ3 LYS 113 8.612 4.403 -14.414 920 H GLN 114 H GLN 114 3.085 9.797 -11.882 921 HA GLN 114 HA GLN 114 4.253 12.461 -11.506 922 HB2 GLN 114 HB2 GLN 114 1.603 11.576 -10.402 923 HB3 GLN 114 HB3 GLN 114 2.176 13.191 -10.869 924 HG2 GLN 114 HG2 GLN 114 2.510 12.262 -13.225 925 HG3 GLN 114 HG3 GLN 114 1.594 10.838 -12.694 926 HE21 GLN 114 HE22 GLN 114 0.530 11.418 -14.594 927 HE22 GLN 114 HE21 GLN 114 -0.523 12.786 -14.614 928 H ASN 115 H ASN 115 4.573 13.375 -9.364 929 HA ASN 115 HA ASN 115 5.488 11.699 -7.298 930 HB2 ASN 115 HB2 ASN 115 5.756 14.342 -7.901 931 HB3 ASN 115 HB3 ASN 115 4.483 14.473 -6.679 932 HD21 ASN 115 HD22 ASN 115 5.183 12.422 -4.862 933 HD22 ASN 115 HD21 ASN 115 6.872 12.571 -4.464 934 H VAL 116 H VAL 116 4.282 10.337 -6.111 935 HA VAL 116 HA VAL 116 1.562 11.237 -5.258 936 HB VAL 116 HB VAL 116 0.918 8.844 -5.195 937 HG11 VAL 116 HG11 VAL 116 0.236 10.365 -7.028 938 HG12 VAL 116 HG12 VAL 116 1.647 9.841 -7.962 939 HG13 VAL 116 HG13 VAL 116 0.373 8.677 -7.527 940 HG21 VAL 116 HG21 VAL 116 3.360 8.380 -6.969 941 HG22 VAL 116 HG22 VAL 116 3.182 7.798 -5.300 942 HG23 VAL 116 HG23 VAL 116 2.085 7.217 -6.567 943 H TYR 117 H TYR 117 0.798 10.609 -3.284 944 HA TYR 117 HA TYR 117 2.848 10.135 -1.169 945 HB2 TYR 117 HB2 TYR 117 0.733 12.308 -1.120 946 HB3 TYR 117 HB3 TYR 117 2.110 12.113 -0.066 947 HD1 TYR 117 HD2 TYR 117 4.404 12.752 -0.837 948 HD2 TYR 117 HD1 TYR 117 0.904 13.353 -3.276 949 HE1 TYR 117 HE2 TYR 117 5.643 14.438 -2.192 950 HE2 TYR 117 HE1 TYR 117 2.146 15.029 -4.646 951 HH TYR 117 HH TYR 117 4.075 16.249 -4.853 952 H ASP 118 H ASP 118 1.960 9.594 0.895 953 HA ASP 118 HA ASP 118 -0.904 9.075 1.167 954 HB2 ASP 118 HB2 ASP 118 0.407 7.089 -0.043 955 HB3 ASP 118 HB3 ASP 118 0.939 6.717 1.593 956 H ILE 119 H ILE 119 -1.485 8.842 3.391 957 HA ILE 119 HA ILE 119 0.699 9.440 5.357 958 HB ILE 119 HB ILE 119 -1.119 10.123 6.878 959 HG12 ILE 119 HG12 ILE 119 -2.904 10.343 4.424 960 HG13 ILE 119 HG13 ILE 119 -2.991 8.982 5.546 961 HG21 ILE 119 HG21 ILE 119 0.330 11.709 5.687 962 HG22 ILE 119 HG22 ILE 119 -0.783 11.733 4.305 963 HG23 ILE 119 HG23 ILE 119 -1.287 12.386 5.882 964 HD11 ILE 119 HD11 ILE 119 -3.501 10.504 7.414 965 HD12 ILE 119 HD12 ILE 119 -3.485 11.886 6.290 966 HD13 ILE 119 HD13 ILE 119 -4.687 10.597 6.098 967 H GLY 120 H GLY 120 0.962 8.233 7.185 968 HA2 GLY 120 HA2 GLY 120 -0.198 5.485 7.106 969 HA3 GLY 120 HA3 GLY 120 1.222 5.990 8.000 970 H VAL 121 H VAL 121 -1.100 4.561 8.930 971 HA VAL 121 HA VAL 121 -1.941 6.212 11.251 972 HB VAL 121 HB VAL 121 -3.927 4.710 9.551 973 HG11 VAL 121 HG11 VAL 121 -4.547 4.893 11.926 974 HG12 VAL 121 HG12 VAL 121 -4.281 6.653 11.878 975 HG13 VAL 121 HG13 VAL 121 -5.591 5.905 10.947 976 HG21 VAL 121 HG21 VAL 121 -3.536 7.724 9.642 977 HG22 VAL 121 HG22 VAL 121 -3.333 6.665 8.223 978 HG23 VAL 121 HG23 VAL 121 -4.930 6.887 8.922 979 H GLU 122 H GLU 122 -1.933 4.921 13.093 980 HA GLU 122 HA GLU 122 -1.197 2.089 12.853 981 HB2 GLU 122 HB2 GLU 122 -1.780 3.903 15.226 982 HB3 GLU 122 HB3 GLU 122 -1.316 2.200 15.372 983 HG2 GLU 122 HG2 GLU 122 0.812 2.616 14.242 984 HG3 GLU 122 HG3 GLU 122 0.368 4.294 13.943 985 H ARG 123 H ARG 123 -4.127 3.852 13.788 986 HA ARG 123 HA ARG 123 -5.654 1.589 14.731 987 HB2 ARG 123 HB2 ARG 123 -6.097 3.846 15.471 988 HB3 ARG 123 HB3 ARG 123 -6.362 4.407 13.831 989 HG2 ARG 123 HG2 ARG 123 -8.431 4.285 15.064 990 HG3 ARG 123 HG3 ARG 123 -8.484 3.197 13.693 991 HD2 ARG 123 HD2 ARG 123 -7.775 2.250 16.497 992 HD3 ARG 123 HD3 ARG 123 -9.453 2.408 15.954 993 HE ARG 123 HE ARG 123 -8.642 0.898 13.973 994 HH11 ARG 123 HH11 ARG 123 -7.952 0.359 17.383 995 HH12 ARG 123 HH12 ARG 123 -7.636 -1.339 17.126 996 HH21 ARG 123 HH21 ARG 123 -8.086 -1.183 13.717 997 HH22 ARG 123 HH22 ARG 123 -7.749 -2.206 15.095 998 H ASP 124 H ASP 124 -6.292 3.524 11.788 999 HA ASP 124 HA ASP 124 -7.004 1.068 10.254 1000 HB2 ASP 124 HB2 ASP 124 -8.833 3.307 11.090 1001 HB3 ASP 124 HB3 ASP 124 -9.041 2.591 9.502 1002 H HIS 125 H HIS 125 -5.988 1.127 8.452 1003 HA HIS 125 HA HIS 125 -4.430 3.312 7.507 1004 HB2 HIS 125 HB2 HIS 125 -5.081 0.624 6.213 1005 HB3 HIS 125 HB3 HIS 125 -3.714 1.658 5.827 1006 HD1 HIS 125 HD1 HIS 125 -4.719 -1.071 8.234 1007 HD2 HIS 125 HD2 HIS 125 -1.671 1.780 7.657 1008 HE1 HIS 125 HE1 HIS 125 -2.786 -1.781 9.731 1009 H ASN 126 H ASN 126 -6.950 4.433 7.339 1010 HA ASN 126 HA ASN 126 -7.297 4.994 4.498 1011 HB2 ASN 126 HB2 ASN 126 -9.810 4.315 4.656 1012 HB3 ASN 126 HB3 ASN 126 -8.609 3.074 4.420 1013 HD21 ASN 126 HD22 ASN 126 -10.637 4.530 7.058 1014 HD22 ASN 126 HD21 ASN 126 -10.645 3.034 7.945 1015 H PHE 127 H PHE 127 -9.030 6.545 4.024 1016 HA PHE 127 HA PHE 127 -9.914 8.387 6.109 1017 HB2 PHE 127 HB2 PHE 127 -8.550 10.299 5.124 1018 HB3 PHE 127 HB3 PHE 127 -7.689 9.154 6.124 1019 HD1 PHE 127 HD2 PHE 127 -8.426 9.860 2.481 1020 HD2 PHE 127 HD1 PHE 127 -5.679 8.209 5.366 1021 HE1 PHE 127 HE2 PHE 127 -6.759 9.487 0.684 1022 HE2 PHE 127 HE1 PHE 127 -4.014 7.854 3.564 1023 HZ PHE 127 HZ PHE 127 -4.542 8.498 1.230 1024 H ALA 128 H ALA 128 -11.199 10.126 5.298 1025 HA ALA 128 HA ALA 128 -12.594 9.528 2.801 1026 HB1 ALA 128 HB1 ALA 128 -13.798 10.052 4.891 1027 HB2 ALA 128 HB2 ALA 128 -13.047 11.665 4.922 1028 HB3 ALA 128 HB3 ALA 128 -14.169 11.228 3.615 1029 H LEU 129 H LEU 129 -12.836 10.870 1.041 1030 HA LEU 129 HA LEU 129 -10.778 12.982 0.580 1031 HB2 LEU 129 HB2 LEU 129 -12.641 11.721 -1.449 1032 HB3 LEU 129 HB3 LEU 129 -11.163 12.647 -1.729 1033 HG LEU 129 HG LEU 129 -11.326 9.822 -0.585 1034 HD11 LEU 129 HD11 LEU 129 -11.820 10.032 -3.020 1035 HD12 LEU 129 HD12 LEU 129 -10.259 10.844 -3.248 1036 HD13 LEU 129 HD13 LEU 129 -10.314 9.154 -2.703 1037 HD21 LEU 129 HD21 LEU 129 -8.894 11.505 -1.228 1038 HD22 LEU 129 HD22 LEU 129 -9.411 10.928 0.377 1039 HD23 LEU 129 HD23 LEU 129 -8.879 9.768 -0.843 1040 H LYS 130 H LYS 130 -11.473 14.875 -0.801 1041 HA LYS 130 HA LYS 130 -13.463 16.513 0.252 1042 HB2 LYS 130 HB2 LYS 130 -11.791 17.449 -1.163 1043 HB3 LYS 130 HB3 LYS 130 -12.176 16.368 -2.497 1044 HG2 LYS 130 HG2 LYS 130 -12.919 18.580 -3.065 1045 HG3 LYS 130 HG3 LYS 130 -14.323 17.554 -2.873 1046 HD2 LYS 130 HD2 LYS 130 -14.393 18.534 -0.409 1047 HD3 LYS 130 HD3 LYS 130 -13.250 19.710 -1.061 1048 HE2 LYS 130 HE2 LYS 130 -15.367 20.736 -1.145 1049 HE3 LYS 130 HE3 LYS 130 -14.983 20.305 -2.814 1050 HZ1 LYS 130 HZ1 LYS 130 -16.485 18.408 -2.610 1051 HZ2 LYS 130 HZ2 LYS 130 -16.730 18.687 -1.011 1052 HZ3 LYS 130 HZ3 LYS 130 -17.291 19.739 -2.124 1053 H ASN 131 H ASN 131 -13.879 14.458 -2.643 1054 HA ASN 131 HA ASN 131 -16.570 15.385 -3.120 1055 HB2 ASN 131 HB2 ASN 131 -14.985 13.027 -4.209 1056 HB3 ASN 131 HB3 ASN 131 -16.570 13.518 -4.815 1057 HD21 ASN 131 HD22 ASN 131 -16.775 15.751 -5.720 1058 HD22 ASN 131 HD21 ASN 131 -15.351 16.465 -6.456 1059 H GLY 132 H GLY 132 -15.384 12.928 -1.001 1060 HA2 GLY 132 HA2 GLY 132 -16.986 12.414 0.750 1061 HA3 GLY 132 HA3 GLY 132 -18.182 11.961 -0.473 1062 H PHE 133 H PHE 133 -15.312 10.721 -1.628 1063 HA PHE 133 HA PHE 133 -16.126 8.026 -0.857 1064 HB2 PHE 133 HB2 PHE 133 -13.738 8.680 -2.561 1065 HB3 PHE 133 HB3 PHE 133 -14.818 7.295 -2.659 1066 HD1 PHE 133 HD1 PHE 133 -17.496 8.290 -2.930 1067 HD2 PHE 133 HD2 PHE 133 -13.856 10.044 -4.439 1068 HE1 PHE 133 HE1 PHE 133 -18.809 9.625 -4.566 1069 HE2 PHE 133 HE2 PHE 133 -15.168 11.336 -6.101 1070 HZ PHE 133 HZ PHE 133 -17.647 11.165 -6.136 1071 H ILE 134 H ILE 134 -14.276 6.341 -0.440 1072 HA ILE 134 HA ILE 134 -12.295 7.437 1.515 1073 HB ILE 134 HB ILE 134 -13.824 4.835 1.808 1074 HG12 ILE 134 HG12 ILE 134 -14.516 5.890 4.052 1075 HG13 ILE 134 HG13 ILE 134 -14.059 7.444 3.367 1076 HG21 ILE 134 HG21 ILE 134 -11.543 4.555 2.647 1077 HG22 ILE 134 HG22 ILE 134 -11.669 6.077 3.563 1078 HG23 ILE 134 HG23 ILE 134 -12.633 4.676 4.013 1079 HD11 ILE 134 HD11 ILE 134 -15.894 7.364 1.825 1080 HD12 ILE 134 HD12 ILE 134 -16.046 5.601 1.979 1081 HD13 ILE 134 HD13 ILE 134 -16.546 6.655 3.305 1082 H ALA 135 H ALA 135 -10.294 6.691 1.420 1083 HA ALA 135 HA ALA 135 -9.520 4.675 -0.652 1084 HB1 ALA 135 HB1 ALA 135 -9.299 7.125 -1.311 1085 HB2 ALA 135 HB2 ALA 135 -8.139 7.315 0.021 1086 HB3 ALA 135 HB3 ALA 135 -7.781 6.247 -1.346 1087 H SER 136 H SER 136 -7.594 3.397 -0.072 1088 HA SER 136 HA SER 136 -6.828 3.563 2.789 1089 HB2 SER 136 HB2 SER 136 -8.654 1.984 2.578 1090 HB3 SER 136 HB3 SER 136 -7.795 1.089 1.326 1091 HG SER 136 HG SER 136 -6.648 1.569 3.880 1092 H ASN 137 H ASN 137 -4.864 3.434 3.231 1093 HA ASN 137 HA ASN 137 -2.688 3.310 1.397 1094 HB2 ASN 137 HB2 ASN 137 -2.597 4.643 3.420 1095 HB3 ASN 137 HB3 ASN 137 -2.874 3.231 4.435 1096 HD21 ASN 137 HD22 ASN 137 -0.614 4.274 1.874 1097 HD22 ASN 137 HD21 ASN 137 0.837 3.662 2.694 Start of MODEL 8 1 H1 GLY -1 H GLY -1 2.935 -1.586 -3.501 2 HA2 GLY -1 HA2 GLY -1 1.588 -0.554 -1.763 3 HA3 GLY -1 HA3 GLY -1 2.938 0.550 -1.459 4 H GLY 0 H GLY 0 0.285 1.270 -2.179 5 HA2 GLY 0 HA2 GLY 0 0.540 2.638 -4.823 6 HA3 GLY 0 HA3 GLY 0 -0.973 2.058 -4.162 7 H ALA 1 H ALA 1 -0.772 4.714 -4.794 8 HA ALA 1 HA ALA 1 -1.227 6.091 -2.243 9 HB1 ALA 1 HB1 ALA 1 1.134 6.167 -2.147 10 HB2 ALA 1 HB2 ALA 1 1.278 6.572 -3.870 11 HB3 ALA 1 HB3 ALA 1 0.636 7.751 -2.711 12 H LEU 2 H LEU 2 -1.420 8.564 -2.680 13 HA LEU 2 HA LEU 2 -3.300 8.920 -4.980 14 HB2 LEU 2 HB2 LEU 2 -3.102 10.422 -2.334 15 HB3 LEU 2 HB3 LEU 2 -4.301 10.644 -3.582 16 HG LEU 2 HG LEU 2 -5.392 9.533 -1.871 17 HD11 LEU 2 HD11 LEU 2 -5.884 8.631 -4.112 18 HD12 LEU 2 HD12 LEU 2 -4.716 7.320 -3.822 19 HD13 LEU 2 HD13 LEU 2 -6.161 7.464 -2.809 20 HD21 LEU 2 HD21 LEU 2 -3.336 7.351 -1.677 21 HD22 LEU 2 HD22 LEU 2 -3.380 8.784 -0.633 22 HD23 LEU 2 HD23 LEU 2 -4.741 7.653 -0.653 23 H SER 3 H SER 3 -3.311 10.929 -6.117 24 HA SER 3 HA SER 3 -0.718 12.151 -6.590 25 HB2 SER 3 HB2 SER 3 -2.561 11.887 -8.290 26 HB3 SER 3 HB3 SER 3 -3.475 13.128 -7.408 27 HG SER 3 HG SER 3 -1.216 13.363 -9.025 28 H TYR 4 H TYR 4 -0.316 14.482 -6.446 29 HA TYR 4 HA TYR 4 -0.563 15.655 -3.869 30 HB2 TYR 4 HB2 TYR 4 1.072 16.297 -5.606 31 HB3 TYR 4 HB3 TYR 4 -0.204 16.950 -6.607 32 HD1 TYR 4 HD1 TYR 4 -1.367 19.053 -6.005 33 HD2 TYR 4 HD2 TYR 4 1.899 17.515 -3.646 34 HE1 TYR 4 HE1 TYR 4 -1.126 21.264 -4.899 35 HE2 TYR 4 HE2 TYR 4 2.132 19.726 -2.521 36 HH TYR 4 HH TYR 4 1.404 21.886 -2.441 37 H GLU 5 H GLU 5 -2.493 16.128 -6.805 38 HA GLU 5 HA GLU 5 -4.211 18.211 -6.002 39 HB2 GLU 5 HB2 GLU 5 -4.740 15.850 -7.855 40 HB3 GLU 5 HB3 GLU 5 -5.696 17.329 -7.821 41 HG2 GLU 5 HG2 GLU 5 -2.714 17.300 -8.456 42 HG3 GLU 5 HG3 GLU 5 -3.977 17.077 -9.648 43 H THR 6 H THR 6 -4.324 14.862 -5.116 44 HA THR 6 HA THR 6 -7.121 14.616 -4.478 45 HB THR 6 HB THR 6 -4.778 13.094 -3.281 46 HG1 THR 6 HG1 THR 6 -6.536 12.432 -5.406 47 HG21 THR 6 HG21 THR 6 -6.747 12.732 -1.923 48 HG22 THR 6 HG22 THR 6 -7.772 12.513 -3.359 49 HG23 THR 6 HG23 THR 6 -6.529 11.314 -2.951 50 H GLU 7 H GLU 7 -8.217 15.825 -3.054 51 HA GLU 7 HA GLU 7 -6.792 17.061 -0.778 52 HB2 GLU 7 HB2 GLU 7 -9.644 17.580 -1.589 53 HB3 GLU 7 HB3 GLU 7 -8.602 18.572 -0.580 54 HG2 GLU 7 HG2 GLU 7 -7.131 19.029 -2.553 55 HG3 GLU 7 HG3 GLU 7 -8.224 18.068 -3.556 56 H ILE 8 H ILE 8 -7.170 16.659 1.300 57 HA ILE 8 HA ILE 8 -9.060 14.452 2.058 58 HB ILE 8 HB ILE 8 -6.378 15.208 3.290 59 HG12 ILE 8 HG12 ILE 8 -5.864 14.297 1.155 60 HG13 ILE 8 HG13 ILE 8 -5.491 13.099 2.385 61 HG21 ILE 8 HG21 ILE 8 -7.823 14.207 4.949 62 HG22 ILE 8 HG22 ILE 8 -8.264 12.884 3.853 63 HG23 ILE 8 HG23 ILE 8 -6.609 13.017 4.477 64 HD11 ILE 8 HD11 ILE 8 -7.665 11.936 1.808 65 HD12 ILE 8 HD12 ILE 8 -7.863 13.080 0.475 66 HD13 ILE 8 HD13 ILE 8 -6.477 11.984 0.488 67 H LEU 9 H LEU 9 -10.650 15.120 3.357 68 HA LEU 9 HA LEU 9 -10.724 17.739 4.532 69 HB2 LEU 9 HB2 LEU 9 -12.652 16.120 3.896 70 HB3 LEU 9 HB3 LEU 9 -12.450 15.421 5.488 71 HG LEU 9 HG LEU 9 -12.746 18.431 5.208 72 HD11 LEU 9 HD11 LEU 9 -14.593 17.460 3.855 73 HD12 LEU 9 HD12 LEU 9 -15.076 16.467 5.242 74 HD13 LEU 9 HD13 LEU 9 -15.183 18.245 5.322 75 HD21 LEU 9 HD21 LEU 9 -13.791 16.558 7.311 76 HD22 LEU 9 HD22 LEU 9 -12.291 17.519 7.435 77 HD23 LEU 9 HD23 LEU 9 -13.850 18.334 7.327 78 H THR 10 H THR 10 -9.727 18.519 6.286 79 HA THR 10 HA THR 10 -9.005 16.679 8.519 80 HB THR 10 HB THR 10 -7.087 18.007 9.003 81 HG1 THR 10 HG1 THR 10 -6.574 19.657 7.321 82 HG21 THR 10 HG21 THR 10 -5.667 17.532 7.165 83 HG22 THR 10 HG22 THR 10 -6.926 16.290 7.124 84 HG23 THR 10 HG23 THR 10 -6.992 17.657 5.993 85 H VAL 11 H VAL 11 -9.092 17.450 10.650 86 HA VAL 11 HA VAL 11 -11.229 19.391 11.165 87 HB VAL 11 HB VAL 11 -9.376 18.077 13.175 88 HG11 VAL 11 HG11 VAL 11 -10.595 19.946 14.175 89 HG12 VAL 11 HG12 VAL 11 -12.124 19.350 13.491 90 HG13 VAL 11 HG13 VAL 11 -11.278 18.430 14.753 91 HG21 VAL 11 HG21 VAL 11 -12.114 17.150 12.211 92 HG22 VAL 11 HG22 VAL 11 -10.582 16.321 11.873 93 HG23 VAL 11 HG23 VAL 11 -11.178 16.421 13.529 94 H GLU 12 H GLU 12 -7.715 19.487 11.191 95 HA GLU 12 HA GLU 12 -7.369 21.943 12.639 96 HB2 GLU 12 HB2 GLU 12 -5.745 20.292 10.709 97 HB3 GLU 12 HB3 GLU 12 -5.171 21.909 11.115 98 HG2 GLU 12 HG2 GLU 12 -5.741 19.715 13.145 99 HG3 GLU 12 HG3 GLU 12 -4.153 20.168 12.527 100 H TYR 13 H TYR 13 -7.979 21.364 9.164 101 HA TYR 13 HA TYR 13 -8.221 24.327 8.785 102 HB2 TYR 13 HB2 TYR 13 -6.642 22.445 6.999 103 HB3 TYR 13 HB3 TYR 13 -6.959 24.150 6.701 104 HD1 TYR 13 HD1 TYR 13 -6.204 25.803 8.657 105 HD2 TYR 13 HD2 TYR 13 -4.527 21.906 7.862 106 HE1 TYR 13 HE1 TYR 13 -4.085 26.493 9.763 107 HE2 TYR 13 HE2 TYR 13 -2.403 22.602 8.972 108 HH TYR 13 HH TYR 13 -1.967 25.870 10.351 109 H GLY 14 H GLY 14 -8.768 21.142 7.135 110 HA2 GLY 14 HA2 GLY 14 -11.266 20.942 6.442 111 HA3 GLY 14 HA3 GLY 14 -10.955 22.426 5.543 112 H LEU 15 H LEU 15 -11.323 21.545 3.556 113 HA LEU 15 HA LEU 15 -10.071 19.203 2.441 114 HB2 LEU 15 HB2 LEU 15 -11.208 21.659 1.033 115 HB3 LEU 15 HB3 LEU 15 -10.925 20.072 0.325 116 HG LEU 15 HG LEU 15 -12.998 20.792 2.447 117 HD11 LEU 15 HD11 LEU 15 -13.540 21.561 0.203 118 HD12 LEU 15 HD12 LEU 15 -13.240 19.942 -0.459 119 HD13 LEU 15 HD13 LEU 15 -14.594 20.215 0.666 120 HD21 LEU 15 HD21 LEU 15 -12.166 18.120 1.298 121 HD22 LEU 15 HD22 LEU 15 -12.337 18.590 2.982 122 HD23 LEU 15 HD23 LEU 15 -13.787 18.401 1.978 123 H LEU 16 H LEU 16 -7.831 19.195 2.670 124 HA LEU 16 HA LEU 16 -6.302 21.234 1.098 125 HB2 LEU 16 HB2 LEU 16 -5.783 20.058 3.840 126 HB3 LEU 16 HB3 LEU 16 -4.426 20.500 2.834 127 HG LEU 16 HG LEU 16 -4.849 22.211 4.429 128 HD11 LEU 16 HD11 LEU 16 -3.954 22.919 2.255 129 HD12 LEU 16 HD12 LEU 16 -5.608 23.238 1.669 130 HD13 LEU 16 HD13 LEU 16 -4.936 24.183 3.006 131 HD21 LEU 16 HD21 LEU 16 -7.537 22.807 3.175 132 HD22 LEU 16 HD22 LEU 16 -7.308 21.929 4.707 133 HD23 LEU 16 HD23 LEU 16 -6.770 23.614 4.529 134 HA PRO 17 HA PRO 17 -4.655 17.868 -1.275 135 HB2 PRO 17 HB2 PRO 17 -2.187 18.851 -2.014 136 HB3 PRO 17 HB3 PRO 17 -3.748 19.396 -2.704 137 HG2 PRO 17 HG2 PRO 17 -2.119 20.678 -0.502 138 HG3 PRO 17 HG3 PRO 17 -2.876 21.463 -1.924 139 HD2 PRO 17 HD2 PRO 17 -4.041 21.480 0.521 140 HD3 PRO 17 HD3 PRO 17 -5.031 21.306 -0.960 141 H ILE 18 H ILE 18 -3.871 15.951 -0.701 142 HA ILE 18 HA ILE 18 -2.529 15.433 1.722 143 HB ILE 18 HB ILE 18 -3.857 13.805 0.450 144 HG12 ILE 18 HG12 ILE 18 -1.065 12.747 1.033 145 HG13 ILE 18 HG13 ILE 18 -2.251 13.177 2.276 146 HG21 ILE 18 HG21 ILE 18 -2.905 14.266 -1.837 147 HG22 ILE 18 HG22 ILE 18 -1.462 13.344 -1.365 148 HG23 ILE 18 HG23 ILE 18 -3.051 12.567 -1.424 149 HD11 ILE 18 HD11 ILE 18 -3.845 11.502 1.264 150 HD12 ILE 18 HD12 ILE 18 -2.521 10.976 0.196 151 HD13 ILE 18 HD13 ILE 18 -2.368 10.810 1.955 152 H GLY 19 H GLY 19 -1.098 16.037 -1.491 153 HA2 GLY 19 HA2 GLY 19 1.521 15.084 -0.837 154 HA3 GLY 19 HA3 GLY 19 1.117 16.205 -2.138 155 H LYS 20 H LYS 20 -0.030 18.217 -0.219 156 HA LYS 20 HA LYS 20 2.466 19.567 0.489 157 HB2 LYS 20 HB2 LYS 20 0.252 20.560 -0.468 158 HB3 LYS 20 HB3 LYS 20 -0.331 20.510 1.202 159 HG2 LYS 20 HG2 LYS 20 1.619 21.949 1.875 160 HG3 LYS 20 HG3 LYS 20 2.201 21.902 0.208 161 HD2 LYS 20 HD2 LYS 20 1.110 23.978 0.325 162 HD3 LYS 20 HD3 LYS 20 -0.036 22.931 -0.495 163 HE2 LYS 20 HE2 LYS 20 -1.374 24.093 1.019 164 HE3 LYS 20 HE3 LYS 20 -1.121 22.542 1.827 165 HZ1 LYS 20 HZ1 LYS 20 0.657 23.648 3.147 166 HZ2 LYS 20 HZ2 LYS 20 0.367 25.067 2.384 167 HZ3 LYS 20 HZ3 LYS 20 -0.775 24.416 3.346 168 H ILE 21 H ILE 21 -0.002 17.704 2.138 169 HA ILE 21 HA ILE 21 0.820 18.408 4.857 170 HB ILE 21 HB ILE 21 -0.917 16.206 3.739 171 HG12 ILE 21 HG12 ILE 21 -1.749 18.590 5.454 172 HG13 ILE 21 HG13 ILE 21 -1.712 18.692 3.700 173 HG21 ILE 21 HG21 ILE 21 0.035 15.327 5.758 174 HG22 ILE 21 HG22 ILE 21 -0.373 16.804 6.656 175 HG23 ILE 21 HG23 ILE 21 -1.642 15.722 6.055 176 HD11 ILE 21 HD11 ILE 21 -3.336 16.838 3.520 177 HD12 ILE 21 HD12 ILE 21 -3.455 16.779 5.297 178 HD13 ILE 21 HD13 ILE 21 -3.969 18.229 4.420 179 H VAL 22 H VAL 22 1.465 15.751 2.551 180 HA VAL 22 HA VAL 22 3.236 14.366 4.380 181 HB VAL 22 HB VAL 22 2.691 14.121 1.414 182 HG11 VAL 22 HG11 VAL 22 4.947 13.284 1.717 183 HG12 VAL 22 HG12 VAL 22 4.478 12.364 3.159 184 HG13 VAL 22 HG13 VAL 22 3.860 11.904 1.567 185 HG21 VAL 22 HG21 VAL 22 1.949 12.445 3.870 186 HG22 VAL 22 HG22 VAL 22 0.848 13.500 2.962 187 HG23 VAL 22 HG23 VAL 22 1.503 12.040 2.212 188 H GLU 23 H GLU 23 3.918 16.675 1.686 189 HA GLU 23 HA GLU 23 6.765 16.250 1.991 190 HB2 GLU 23 HB2 GLU 23 7.087 17.748 0.304 191 HB3 GLU 23 HB3 GLU 23 5.529 17.007 -0.091 192 HG2 GLU 23 HG2 GLU 23 4.447 19.053 0.983 193 HG3 GLU 23 HG3 GLU 23 6.049 19.766 1.066 194 H LYS 24 H LYS 24 4.530 18.320 3.655 195 HA LYS 24 HA LYS 24 6.790 19.766 5.010 196 HB2 LYS 24 HB2 LYS 24 3.857 20.536 4.927 197 HB3 LYS 24 HB3 LYS 24 5.168 21.473 5.628 198 HG2 LYS 24 HG2 LYS 24 4.702 20.883 2.688 199 HG3 LYS 24 HG3 LYS 24 4.446 22.412 3.522 200 HD2 LYS 24 HD2 LYS 24 6.946 22.479 4.017 201 HD3 LYS 24 HD3 LYS 24 7.117 21.031 3.022 202 HE2 LYS 24 HE2 LYS 24 7.657 22.789 1.566 203 HE3 LYS 24 HE3 LYS 24 6.019 22.309 1.112 204 HZ1 LYS 24 HZ1 LYS 24 5.192 24.226 2.405 205 HZ2 LYS 24 HZ2 LYS 24 6.718 24.641 2.829 206 HZ3 LYS 24 HZ3 LYS 24 6.253 24.731 1.271 207 H ARG 25 H ARG 25 4.960 17.122 5.417 208 HA ARG 25 HA ARG 25 4.190 15.834 7.124 209 HB2 ARG 25 HB2 ARG 25 6.509 16.956 8.719 210 HB3 ARG 25 HB3 ARG 25 5.704 15.407 8.915 211 HG2 ARG 25 HG2 ARG 25 7.403 14.577 7.678 212 HG3 ARG 25 HG3 ARG 25 6.469 15.169 6.304 213 HD2 ARG 25 HD2 ARG 25 8.796 15.835 6.077 214 HD3 ARG 25 HD3 ARG 25 7.791 17.269 6.314 215 HE ARG 25 HE ARG 25 8.956 16.151 8.776 216 HH11 ARG 25 HH11 ARG 25 9.604 18.435 6.187 217 HH12 ARG 25 HH12 ARG 25 10.648 19.404 7.197 218 HH21 ARG 25 HH21 ARG 25 10.293 17.425 9.987 219 HH22 ARG 25 HH22 ARG 25 11.039 18.833 9.281 220 H ILE 26 H ILE 26 2.447 17.677 6.978 221 HA ILE 26 HA ILE 26 2.302 19.468 9.285 222 HB ILE 26 HB ILE 26 0.260 18.882 7.113 223 HG12 ILE 26 HG12 ILE 26 2.037 21.318 7.566 224 HG13 ILE 26 HG13 ILE 26 2.447 20.002 6.480 225 HG21 ILE 26 HG21 ILE 26 0.211 20.789 9.487 226 HG22 ILE 26 HG22 ILE 26 -0.769 21.077 8.042 227 HG23 ILE 26 HG23 ILE 26 -1.022 19.610 8.980 228 HD11 ILE 26 HD11 ILE 26 0.534 20.470 5.040 229 HD12 ILE 26 HD12 ILE 26 -0.006 21.765 6.128 230 HD13 ILE 26 HD13 ILE 26 1.531 21.909 5.261 231 H GLU 27 H GLU 27 1.634 18.978 11.222 232 HA GLU 27 HA GLU 27 0.359 16.424 11.894 233 HB2 GLU 27 HB2 GLU 27 1.191 18.834 13.547 234 HB3 GLU 27 HB3 GLU 27 0.337 17.433 14.216 235 HG2 GLU 27 HG2 GLU 27 2.125 15.937 13.397 236 HG3 GLU 27 HG3 GLU 27 3.041 17.335 12.815 237 H CYS 28 H CYS 28 -1.672 16.169 11.259 238 HA CYS 28 HA CYS 28 -3.721 18.013 12.328 239 HB2 CYS 28 HB2 CYS 28 -4.880 18.072 10.105 240 HB3 CYS 28 HB3 CYS 28 -3.316 18.890 10.118 241 HG CYS 28 HG CYS 28 -3.481 17.739 7.822 242 H THR 29 H THR 29 -5.886 17.259 12.131 243 HA THR 29 HA THR 29 -6.143 14.352 12.708 244 HB THR 29 HB THR 29 -8.404 16.281 12.968 245 HG1 THR 29 HG1 THR 29 -7.667 16.922 15.010 246 HG21 THR 29 HG21 THR 29 -8.696 13.909 13.618 247 HG22 THR 29 HG22 THR 29 -7.427 14.118 14.858 248 HG23 THR 29 HG23 THR 29 -8.954 15.020 14.967 249 H VAL 30 H VAL 30 -7.648 13.053 11.643 250 HA VAL 30 HA VAL 30 -8.857 14.074 9.098 251 HB VAL 30 HB VAL 30 -8.181 12.113 7.921 252 HG11 VAL 30 HG11 VAL 30 -6.584 14.033 8.048 253 HG12 VAL 30 HG12 VAL 30 -5.702 13.169 9.328 254 HG13 VAL 30 HG13 VAL 30 -5.828 12.471 7.706 255 HG21 VAL 30 HG21 VAL 30 -6.705 11.135 10.402 256 HG22 VAL 30 HG22 VAL 30 -8.198 10.427 9.747 257 HG23 VAL 30 HG23 VAL 30 -6.713 10.378 8.797 258 H TYR 31 H TYR 31 -10.302 12.126 8.183 259 HA TYR 31 HA TYR 31 -12.141 11.259 10.365 260 HB2 TYR 31 HB2 TYR 31 -12.836 12.336 7.598 261 HB3 TYR 31 HB3 TYR 31 -13.954 11.487 8.626 262 HD1 TYR 31 HD2 TYR 31 -11.896 14.618 8.407 263 HD2 TYR 31 HD1 TYR 31 -15.203 12.571 10.285 264 HE1 TYR 31 HE2 TYR 31 -12.566 16.726 9.552 265 HE2 TYR 31 HE1 TYR 31 -15.925 14.699 11.341 266 HH TYR 31 HH TYR 31 -15.490 16.922 11.602 267 H SER 32 H SER 32 -12.993 9.248 10.222 268 HA SER 32 HA SER 32 -12.500 7.475 7.908 269 HB2 SER 32 HB2 SER 32 -10.377 7.357 9.074 270 HB3 SER 32 HB3 SER 32 -11.187 7.190 10.636 271 HG SER 32 HG SER 32 -10.446 5.179 9.804 272 H VAL 33 H VAL 33 -13.692 5.468 8.108 273 HA VAL 33 HA VAL 33 -15.994 5.625 9.999 274 HB VAL 33 HB VAL 33 -15.942 3.499 7.893 275 HG11 VAL 33 HG11 VAL 33 -17.685 3.746 9.631 276 HG12 VAL 33 HG12 VAL 33 -18.129 5.321 8.940 277 HG13 VAL 33 HG13 VAL 33 -18.305 3.838 7.969 278 HG21 VAL 33 HG21 VAL 33 -16.621 6.406 7.253 279 HG22 VAL 33 HG22 VAL 33 -15.339 5.435 6.496 280 HG23 VAL 33 HG23 VAL 33 -17.032 5.001 6.246 281 H ASP 34 H ASP 34 -16.052 4.359 11.722 282 HA ASP 34 HA ASP 34 -13.925 2.505 12.347 283 HB2 ASP 34 HB2 ASP 34 -15.359 4.016 13.931 284 HB3 ASP 34 HB3 ASP 34 -16.569 2.732 13.786 285 H ASN 35 H ASN 35 -14.670 0.405 13.434 286 HA ASN 35 HA ASN 35 -15.423 -1.495 11.413 287 HB2 ASN 35 HB2 ASN 35 -15.353 -1.825 14.447 288 HB3 ASN 35 HB3 ASN 35 -15.359 -3.132 13.268 289 HD21 ASN 35 HD22 ASN 35 -13.324 -1.577 15.306 290 HD22 ASN 35 HD21 ASN 35 -11.831 -1.759 14.395 291 H ASN 36 H ASN 36 -17.339 0.239 13.774 292 HA ASN 36 HA ASN 36 -19.778 -1.368 13.409 293 HB2 ASN 36 HB2 ASN 36 -19.234 1.238 14.916 294 HB3 ASN 36 HB3 ASN 36 -20.708 0.280 15.020 295 HD21 ASN 36 HD22 ASN 36 -17.645 0.763 16.454 296 HD22 ASN 36 HD21 ASN 36 -17.665 -0.695 17.428 297 H GLY 37 H GLY 37 -18.330 0.893 11.416 298 HA2 GLY 37 HA2 GLY 37 -19.103 2.102 9.638 299 HA3 GLY 37 HA3 GLY 37 -20.746 1.597 9.969 300 H ASN 38 H ASN 38 -18.939 3.153 12.526 301 HA ASN 38 HA ASN 38 -20.563 5.664 12.336 302 HB2 ASN 38 HB2 ASN 38 -19.046 4.249 14.568 303 HB3 ASN 38 HB3 ASN 38 -19.368 5.976 14.654 304 HD21 ASN 38 HD22 ASN 38 -21.272 2.992 13.849 305 HD22 ASN 38 HD21 ASN 38 -22.642 3.490 14.828 306 H ILE 39 H ILE 39 -19.569 7.534 11.663 307 HA ILE 39 HA ILE 39 -16.754 7.514 10.897 308 HB ILE 39 HB ILE 39 -18.765 9.793 10.901 309 HG12 ILE 39 HG12 ILE 39 -17.872 7.924 8.649 310 HG13 ILE 39 HG13 ILE 39 -19.456 7.893 9.427 311 HG21 ILE 39 HG21 ILE 39 -16.385 10.544 10.918 312 HG22 ILE 39 HG22 ILE 39 -16.047 9.494 9.524 313 HG23 ILE 39 HG23 ILE 39 -17.138 10.891 9.380 314 HD11 ILE 39 HD11 ILE 39 -19.856 10.244 8.640 315 HD12 ILE 39 HD12 ILE 39 -18.347 10.118 7.700 316 HD13 ILE 39 HD13 ILE 39 -19.714 9.031 7.354 317 H TYR 40 H TYR 40 -15.131 8.285 11.989 318 HA TYR 40 HA TYR 40 -15.484 9.996 14.391 319 HB2 TYR 40 HB2 TYR 40 -14.159 8.659 15.789 320 HB3 TYR 40 HB3 TYR 40 -15.347 7.577 15.101 321 HD1 TYR 40 HD1 TYR 40 -14.597 6.043 13.110 322 HD2 TYR 40 HD2 TYR 40 -11.847 8.180 15.669 323 HE1 TYR 40 HE1 TYR 40 -12.775 4.504 12.444 324 HE2 TYR 40 HE2 TYR 40 -10.042 6.580 15.044 325 HH TYR 40 HH TYR 40 -10.631 3.848 12.807 326 H THR 41 H THR 41 -13.358 10.880 15.165 327 HA THR 41 HA THR 41 -11.553 11.465 12.874 328 HB THR 41 HB THR 41 -11.030 13.612 14.145 329 HG1 THR 41 HG1 THR 41 -12.780 14.338 15.431 330 HG21 THR 41 HG21 THR 41 -12.295 13.669 12.094 331 HG22 THR 41 HG22 THR 41 -13.794 13.221 12.955 332 HG23 THR 41 HG23 THR 41 -13.014 14.793 13.246 333 H GLN 42 H GLN 42 -9.377 11.560 13.146 334 HA GLN 42 HA GLN 42 -8.168 10.913 15.754 335 HB2 GLN 42 HB2 GLN 42 -7.096 8.868 14.940 336 HB3 GLN 42 HB3 GLN 42 -8.851 8.731 14.925 337 HG2 GLN 42 HG2 GLN 42 -8.801 9.226 12.424 338 HG3 GLN 42 HG3 GLN 42 -7.039 9.156 12.504 339 HE21 GLN 42 HE22 GLN 42 -8.718 7.382 10.924 340 HE22 GLN 42 HE21 GLN 42 -8.488 5.770 11.593 341 HA PRO 43 HA PRO 43 -4.868 13.293 13.946 342 HB2 PRO 43 HB2 PRO 43 -2.751 12.697 15.546 343 HB3 PRO 43 HB3 PRO 43 -4.163 13.642 16.108 344 HG2 PRO 43 HG2 PRO 43 -3.637 10.679 16.489 345 HG3 PRO 43 HG3 PRO 43 -4.145 11.885 17.717 346 HD2 PRO 43 HD2 PRO 43 -5.925 10.244 16.459 347 HD3 PRO 43 HD3 PRO 43 -6.347 11.923 16.908 348 H VAL 44 H VAL 44 -3.193 13.158 12.475 349 HA VAL 44 HA VAL 44 -2.503 10.726 11.144 350 HB VAL 44 HB VAL 44 -2.309 12.963 10.152 351 HG11 VAL 44 HG11 VAL 44 -1.304 14.187 12.113 352 HG12 VAL 44 HG12 VAL 44 0.231 13.369 11.783 353 HG13 VAL 44 HG13 VAL 44 -0.474 14.454 10.568 354 HG21 VAL 44 HG21 VAL 44 0.395 11.577 10.131 355 HG22 VAL 44 HG22 VAL 44 -1.031 11.014 9.237 356 HG23 VAL 44 HG23 VAL 44 -0.315 12.588 8.869 357 H ALA 45 H ALA 45 -0.818 9.293 11.357 358 HA ALA 45 HA ALA 45 0.738 9.396 13.910 359 HB1 ALA 45 HB1 ALA 45 -0.732 7.444 13.472 360 HB2 ALA 45 HB2 ALA 45 0.204 7.074 12.010 361 HB3 ALA 45 HB3 ALA 45 0.978 6.995 13.604 362 H GLN 46 H GLN 46 1.113 9.327 10.393 363 HA GLN 46 HA GLN 46 3.851 10.189 10.453 364 HB2 GLN 46 HB2 GLN 46 4.813 8.199 9.285 365 HB3 GLN 46 HB3 GLN 46 4.496 8.062 10.995 366 HG2 GLN 46 HG2 GLN 46 2.225 6.891 10.168 367 HG3 GLN 46 HG3 GLN 46 3.157 6.693 8.680 368 HE21 GLN 46 HE22 GLN 46 3.358 6.254 12.258 369 HE22 GLN 46 HE21 GLN 46 4.428 4.870 12.188 370 H TRP 47 H TRP 47 4.806 10.016 8.107 371 HA TRP 47 HA TRP 47 2.700 10.485 6.033 372 HB2 TRP 47 HB2 TRP 47 5.140 12.228 6.526 373 HB3 TRP 47 HB3 TRP 47 3.921 12.448 5.291 374 HD1 TRP 47 HD1 TRP 47 1.838 13.892 5.920 375 HE1 TRP 47 HE1 TRP 47 1.066 15.163 7.999 376 HE3 TRP 47 HE3 TRP 47 5.321 12.148 9.247 377 HZ2 TRP 47 HZ2 TRP 47 1.818 15.319 10.786 378 HZ3 TRP 47 HZ3 TRP 47 5.249 12.865 11.625 379 HH2 TRP 47 HH2 TRP 47 3.482 14.433 12.405 380 H HIS 48 H HIS 48 3.089 9.225 4.276 381 HA HIS 48 HA HIS 48 5.875 8.244 3.784 382 HB2 HIS 48 HB2 HIS 48 3.311 6.945 2.856 383 HB3 HIS 48 HB3 HIS 48 4.937 6.309 2.753 384 HD1 HIS 48 HD1 HIS 48 6.050 5.620 5.277 385 HD2 HIS 48 HD2 HIS 48 1.898 6.210 4.898 386 HE1 HIS 48 HE1 HIS 48 4.975 4.438 7.262 387 H ASP 49 H ASP 49 6.847 8.825 2.011 388 HA ASP 49 HA ASP 49 5.335 10.041 -0.250 389 HB2 ASP 49 HB2 ASP 49 7.156 11.544 -0.595 390 HB3 ASP 49 HB3 ASP 49 6.577 11.694 1.055 391 H ARG 50 H ARG 50 5.169 8.601 -1.744 392 HA ARG 50 HA ARG 50 6.992 6.365 -2.167 393 HB2 ARG 50 HB2 ARG 50 4.746 7.456 -3.873 394 HB3 ARG 50 HB3 ARG 50 5.488 5.873 -4.005 395 HG2 ARG 50 HG2 ARG 50 3.819 6.926 -1.673 396 HG3 ARG 50 HG3 ARG 50 3.336 5.706 -2.830 397 HD2 ARG 50 HD2 ARG 50 5.524 5.417 -0.735 398 HD3 ARG 50 HD3 ARG 50 3.909 4.707 -0.693 399 HE ARG 50 HE ARG 50 5.353 3.918 -3.100 400 HH11 ARG 50 HH11 ARG 50 5.209 3.083 0.309 401 HH12 ARG 50 HH12 ARG 50 5.856 1.492 0.009 402 HH21 ARG 50 HH21 ARG 50 6.080 1.948 -3.411 403 HH22 ARG 50 HH22 ARG 50 6.425 0.888 -2.057 404 H GLY 51 H GLY 51 6.583 9.499 -3.643 405 HA2 GLY 51 HA2 GLY 51 8.304 10.729 -4.659 406 HA3 GLY 51 HA3 GLY 51 9.212 9.252 -4.943 407 H GLU 52 H GLU 52 7.480 7.680 -6.449 408 HA GLU 52 HA GLU 52 6.329 9.013 -8.737 409 HB2 GLU 52 HB2 GLU 52 9.206 8.063 -9.051 410 HB3 GLU 52 HB3 GLU 52 8.036 8.123 -10.368 411 HG2 GLU 52 HG2 GLU 52 7.746 10.589 -9.910 412 HG3 GLU 52 HG3 GLU 52 9.203 10.480 -8.900 413 H GLN 53 H GLN 53 4.719 7.418 -8.601 414 HA GLN 53 HA GLN 53 5.548 4.724 -9.625 415 HB2 GLN 53 HB2 GLN 53 3.328 5.432 -7.695 416 HB3 GLN 53 HB3 GLN 53 3.723 3.790 -8.267 417 HG2 GLN 53 HG2 GLN 53 6.024 4.043 -7.284 418 HG3 GLN 53 HG3 GLN 53 5.529 5.621 -6.616 419 HE21 GLN 53 HE22 GLN 53 2.877 4.957 -5.693 420 HE22 GLN 53 HE21 GLN 53 3.405 4.330 -4.190 421 H GLU 54 H GLU 54 3.680 3.527 -10.625 422 HA GLU 54 HA GLU 54 2.852 5.041 -12.914 423 HB2 GLU 54 HB2 GLU 54 1.857 2.891 -13.666 424 HB3 GLU 54 HB3 GLU 54 3.550 2.811 -13.207 425 HG2 GLU 54 HG2 GLU 54 2.819 1.825 -10.971 426 HG3 GLU 54 HG3 GLU 54 1.185 1.723 -11.627 427 H VAL 55 H VAL 55 1.376 6.576 -12.748 428 HA VAL 55 HA VAL 55 -1.089 6.181 -11.140 429 HB VAL 55 HB VAL 55 -0.027 8.676 -12.516 430 HG11 VAL 55 HG11 VAL 55 -2.501 8.783 -12.174 431 HG12 VAL 55 HG12 VAL 55 -2.259 8.370 -10.461 432 HG13 VAL 55 HG13 VAL 55 -1.633 9.894 -11.122 433 HG21 VAL 55 HG21 VAL 55 0.111 7.643 -9.654 434 HG22 VAL 55 HG22 VAL 55 1.448 8.165 -10.698 435 HG23 VAL 55 HG23 VAL 55 0.324 9.355 -10.051 436 H PHE 56 H PHE 56 -3.058 6.068 -11.896 437 HA PHE 56 HA PHE 56 -3.587 6.200 -14.838 438 HB2 PHE 56 HB2 PHE 56 -4.708 4.332 -12.714 439 HB3 PHE 56 HB3 PHE 56 -5.373 4.509 -14.331 440 HD1 PHE 56 HD1 PHE 56 -2.220 3.547 -12.511 441 HD2 PHE 56 HD2 PHE 56 -4.526 3.251 -16.142 442 HE1 PHE 56 HE1 PHE 56 -0.560 1.955 -13.437 443 HE2 PHE 56 HE2 PHE 56 -2.893 1.611 -17.040 444 HZ PHE 56 HZ PHE 56 -0.872 1.014 -15.717 445 H GLU 57 H GLU 57 -5.419 7.217 -15.495 446 HA GLU 57 HA GLU 57 -6.679 9.212 -13.838 447 HB2 GLU 57 HB2 GLU 57 -6.445 9.348 -16.314 448 HB3 GLU 57 HB3 GLU 57 -7.514 7.958 -16.503 449 HG2 GLU 57 HG2 GLU 57 -9.381 9.230 -15.503 450 HG3 GLU 57 HG3 GLU 57 -8.301 10.590 -15.190 451 H TYR 58 H TYR 58 -8.409 9.049 -12.508 452 HA TYR 58 HA TYR 58 -10.273 6.743 -12.749 453 HB2 TYR 58 HB2 TYR 58 -8.887 6.332 -10.877 454 HB3 TYR 58 HB3 TYR 58 -8.981 7.992 -10.316 455 HD1 TYR 58 HD1 TYR 58 -12.084 6.284 -11.434 456 HD2 TYR 58 HD2 TYR 58 -9.522 7.148 -8.064 457 HE1 TYR 58 HE1 TYR 58 -13.866 5.583 -9.886 458 HE2 TYR 58 HE2 TYR 58 -11.359 6.509 -6.514 459 HH TYR 58 HH TYR 58 -13.553 5.800 -6.370 460 H CYS 59 H CYS 59 -11.532 7.970 -14.152 461 HA CYS 59 HA CYS 59 -12.819 10.434 -13.074 462 HB2 CYS 59 HB2 CYS 59 -11.745 10.417 -15.368 463 HB3 CYS 59 HB3 CYS 59 -12.959 9.228 -15.860 464 HG CYS 59 HG CYS 59 -13.570 12.207 -14.482 465 H LEU 60 H LEU 60 -15.024 10.611 -12.918 466 HA LEU 60 HA LEU 60 -16.569 8.044 -12.716 467 HB2 LEU 60 HB2 LEU 60 -16.058 10.292 -10.876 468 HB3 LEU 60 HB3 LEU 60 -17.752 10.019 -11.105 469 HG LEU 60 HG LEU 60 -17.740 7.843 -10.259 470 HD11 LEU 60 HD11 LEU 60 -15.687 6.890 -11.159 471 HD12 LEU 60 HD12 LEU 60 -14.710 7.997 -10.166 472 HD13 LEU 60 HD13 LEU 60 -15.719 6.733 -9.405 473 HD21 LEU 60 HD21 LEU 60 -15.806 9.460 -8.537 474 HD22 LEU 60 HD22 LEU 60 -17.550 9.753 -8.615 475 HD23 LEU 60 HD23 LEU 60 -16.942 8.202 -8.004 476 H GLU 61 H GLU 61 -18.799 8.113 -12.949 477 HA GLU 61 HA GLU 61 -19.542 9.362 -15.426 478 HB2 GLU 61 HB2 GLU 61 -21.698 8.255 -15.134 479 HB3 GLU 61 HB3 GLU 61 -20.359 7.147 -14.863 480 HG2 GLU 61 HG2 GLU 61 -20.827 6.813 -12.681 481 HG3 GLU 61 HG3 GLU 61 -21.405 8.451 -12.419 482 H ASP 62 H ASP 62 -19.893 10.541 -12.197 483 HA ASP 62 HA ASP 62 -22.016 12.488 -12.782 484 HB2 ASP 62 HB2 ASP 62 -21.657 11.606 -10.526 485 HB3 ASP 62 HB3 ASP 62 -20.010 12.246 -10.503 486 H GLY 63 H GLY 63 -18.521 12.356 -13.110 487 HA2 GLY 63 HA2 GLY 63 -17.546 13.991 -14.690 488 HA3 GLY 63 HA3 GLY 63 -18.375 15.273 -13.804 489 H SER 64 H SER 64 -17.488 13.401 -11.304 490 HA SER 64 HA SER 64 -15.279 14.959 -10.443 491 HB2 SER 64 HB2 SER 64 -16.136 12.172 -9.564 492 HB3 SER 64 HB3 SER 64 -14.978 13.203 -8.709 493 HG SER 64 HG SER 64 -16.608 14.185 -7.844 494 H LEU 65 H LEU 65 -13.085 14.489 -10.178 495 HA LEU 65 HA LEU 65 -11.921 12.417 -11.960 496 HB2 LEU 65 HB2 LEU 65 -12.208 14.756 -13.022 497 HB3 LEU 65 HB3 LEU 65 -11.041 15.331 -11.837 498 HG LEU 65 HG LEU 65 -9.394 13.606 -12.761 499 HD11 LEU 65 HD11 LEU 65 -11.019 12.081 -13.858 500 HD12 LEU 65 HD12 LEU 65 -11.523 13.392 -14.941 501 HD13 LEU 65 HD13 LEU 65 -9.877 12.736 -15.042 502 HD21 LEU 65 HD21 LEU 65 -10.501 15.747 -14.623 503 HD22 LEU 65 HD22 LEU 65 -9.221 15.937 -13.404 504 HD23 LEU 65 HD23 LEU 65 -8.936 14.932 -14.836 505 H ILE 66 H ILE 66 -10.438 11.272 -11.023 506 HA ILE 66 HA ILE 66 -8.846 12.272 -8.709 507 HB ILE 66 HB ILE 66 -10.140 9.518 -8.943 508 HG12 ILE 66 HG12 ILE 66 -11.032 11.821 -7.162 509 HG13 ILE 66 HG13 ILE 66 -11.886 11.303 -8.606 510 HG21 ILE 66 HG21 ILE 66 -8.089 9.506 -7.610 511 HG22 ILE 66 HG22 ILE 66 -8.633 10.932 -6.688 512 HG23 ILE 66 HG23 ILE 66 -9.441 9.371 -6.511 513 HD11 ILE 66 HD11 ILE 66 -12.994 9.679 -7.576 514 HD12 ILE 66 HD12 ILE 66 -11.571 9.063 -6.731 515 HD13 ILE 66 HD13 ILE 66 -12.461 10.437 -6.068 516 H ARG 67 H ARG 67 -6.740 11.430 -8.589 517 HA ARG 67 HA ARG 67 -5.833 9.549 -10.722 518 HB2 ARG 67 HB2 ARG 67 -4.642 12.248 -9.921 519 HB3 ARG 67 HB3 ARG 67 -3.659 10.939 -10.578 520 HG2 ARG 67 HG2 ARG 67 -4.110 12.055 -12.463 521 HG3 ARG 67 HG3 ARG 67 -5.343 10.792 -12.488 522 HD2 ARG 67 HD2 ARG 67 -6.929 12.619 -11.552 523 HD3 ARG 67 HD3 ARG 67 -5.664 13.762 -11.958 524 HE ARG 67 HE ARG 67 -7.333 12.133 -13.810 525 HH11 ARG 67 HH11 ARG 67 -4.652 14.402 -13.642 526 HH12 ARG 67 HH12 ARG 67 -4.721 14.734 -15.353 527 HH21 ARG 67 HH21 ARG 67 -7.336 12.616 -16.028 528 HH22 ARG 67 HH22 ARG 67 -6.191 13.766 -16.624 529 H ALA 68 H ALA 68 -4.999 7.825 -9.941 530 HA ALA 68 HA ALA 68 -3.378 7.775 -7.476 531 HB1 ALA 68 HB1 ALA 68 -5.725 7.501 -6.695 532 HB2 ALA 68 HB2 ALA 68 -5.946 6.146 -7.824 533 HB3 ALA 68 HB3 ALA 68 -4.798 6.002 -6.477 534 H THR 69 H THR 69 -2.385 5.607 -7.148 535 HA THR 69 HA THR 69 -1.458 4.421 -9.665 536 HB THR 69 HB THR 69 -0.287 2.813 -8.066 537 HG1 THR 69 HG1 THR 69 -1.965 3.379 -6.419 538 HG21 THR 69 HG21 THR 69 0.154 5.787 -7.599 539 HG22 THR 69 HG22 THR 69 1.276 4.467 -7.171 540 HG23 THR 69 HG23 THR 69 0.891 4.785 -8.876 541 H LYS 70 H LYS 70 -1.691 2.222 -10.276 542 HA LYS 70 HA LYS 70 -4.298 1.114 -9.853 543 HB2 LYS 70 HB2 LYS 70 -1.982 0.487 -11.523 544 HB3 LYS 70 HB3 LYS 70 -2.589 -0.984 -10.771 545 HG2 LYS 70 HG2 LYS 70 -4.951 -0.161 -11.509 546 HG3 LYS 70 HG3 LYS 70 -4.090 0.944 -12.581 547 HD2 LYS 70 HD2 LYS 70 -3.696 -2.086 -12.507 548 HD3 LYS 70 HD3 LYS 70 -4.837 -1.260 -13.576 549 HE2 LYS 70 HE2 LYS 70 -3.059 -0.161 -14.755 550 HE3 LYS 70 HE3 LYS 70 -1.848 -0.706 -13.583 551 HZ1 LYS 70 HZ1 LYS 70 -2.225 -2.981 -14.295 552 HZ2 LYS 70 HZ2 LYS 70 -3.427 -2.552 -15.311 553 HZ3 LYS 70 HZ3 LYS 70 -1.890 -2.088 -15.619 554 H ASP 71 H ASP 71 -1.517 0.781 -7.919 555 HA ASP 71 HA ASP 71 -2.286 -1.726 -6.593 556 HB2 ASP 71 HB2 ASP 71 -0.067 0.303 -6.072 557 HB3 ASP 71 HB3 ASP 71 -0.243 -1.239 -5.239 558 H HIS 72 H HIS 72 -3.305 1.510 -6.267 559 HA HIS 72 HA HIS 72 -3.450 1.600 -3.340 560 HB2 HIS 72 HB2 HIS 72 -3.075 3.634 -4.729 561 HB3 HIS 72 HB3 HIS 72 -4.660 3.412 -5.477 562 HD1 HIS 72 HD1 HIS 72 -6.795 3.626 -3.634 563 HD2 HIS 72 HD2 HIS 72 -2.976 4.819 -2.357 564 HE1 HIS 72 HE1 HIS 72 -7.085 4.668 -1.363 565 H LYS 73 H LYS 73 -5.284 1.041 -2.141 566 HA LYS 73 HA LYS 73 -7.529 -0.253 -3.606 567 HB2 LYS 73 HB2 LYS 73 -6.749 -0.500 -0.666 568 HB3 LYS 73 HB3 LYS 73 -8.085 -1.303 -1.471 569 HG2 LYS 73 HG2 LYS 73 -6.581 -3.000 -1.543 570 HG3 LYS 73 HG3 LYS 73 -6.208 -2.239 -3.092 571 HD2 LYS 73 HD2 LYS 73 -4.287 -1.051 -2.003 572 HD3 LYS 73 HD3 LYS 73 -4.691 -1.843 -0.466 573 HE2 LYS 73 HE2 LYS 73 -4.315 -4.049 -1.460 574 HE3 LYS 73 HE3 LYS 73 -4.067 -3.322 -3.059 575 HZ1 LYS 73 HZ1 LYS 73 -2.086 -2.234 -2.228 576 HZ2 LYS 73 HZ2 LYS 73 -2.312 -2.826 -0.710 577 HZ3 LYS 73 HZ3 LYS 73 -1.957 -3.840 -1.941 578 H PHE 74 H PHE 74 -9.671 0.143 -3.107 579 HA PHE 74 HA PHE 74 -10.268 2.629 -1.535 580 HB2 PHE 74 HB2 PHE 74 -11.137 1.988 -4.372 581 HB3 PHE 74 HB3 PHE 74 -11.839 3.234 -3.347 582 HD1 PHE 74 HD1 PHE 74 -8.786 2.304 -5.291 583 HD2 PHE 74 HD2 PHE 74 -10.777 5.345 -2.942 584 HE1 PHE 74 HE1 PHE 74 -7.239 4.017 -6.179 585 HE2 PHE 74 HE2 PHE 74 -9.182 7.039 -3.801 586 HZ PHE 74 HZ PHE 74 -7.425 6.382 -5.424 587 H MET 75 H MET 75 -12.041 2.506 -0.292 588 HA MET 75 HA MET 75 -13.067 -0.154 0.160 589 HB2 MET 75 HB2 MET 75 -12.549 1.479 1.957 590 HB3 MET 75 HB3 MET 75 -13.961 2.437 1.459 591 HG2 MET 75 HG2 MET 75 -15.467 0.619 1.953 592 HG3 MET 75 HG3 MET 75 -14.131 -0.514 2.144 593 HE1 MET 75 HE1 MET 75 -14.024 3.114 3.875 594 HE2 MET 75 HE2 MET 75 -15.742 2.746 3.628 595 HE3 MET 75 HE3 MET 75 -15.068 2.795 5.276 596 H THR 76 H THR 76 -14.518 -1.080 -1.132 597 HA THR 76 HA THR 76 -16.393 0.367 -2.789 598 HB THR 76 HB THR 76 -17.326 -1.803 -3.362 599 HG1 THR 76 HG1 THR 76 -16.396 -3.647 -2.388 600 HG21 THR 76 HG21 THR 76 -15.225 -1.048 -4.422 601 HG22 THR 76 HG22 THR 76 -14.300 -1.969 -3.212 602 HG23 THR 76 HG23 THR 76 -15.378 -2.811 -4.354 603 H VAL 77 H VAL 77 -18.776 -0.198 -2.786 604 HA VAL 77 HA VAL 77 -20.085 0.543 -0.427 605 HB VAL 77 HB VAL 77 -22.166 -0.308 -1.480 606 HG11 VAL 77 HG11 VAL 77 -21.286 1.933 -1.982 607 HG12 VAL 77 HG12 VAL 77 -20.379 1.280 -3.363 608 HG13 VAL 77 HG13 VAL 77 -22.149 1.228 -3.362 609 HG21 VAL 77 HG21 VAL 77 -20.348 -1.249 -3.741 610 HG22 VAL 77 HG22 VAL 77 -21.243 -2.309 -2.631 611 HG23 VAL 77 HG23 VAL 77 -22.119 -1.241 -3.736 612 H ASP 78 H ASP 78 -18.902 -2.641 -1.190 613 HA ASP 78 HA ASP 78 -20.470 -3.945 0.962 614 HB2 ASP 78 HB2 ASP 78 -18.351 -4.924 -0.988 615 HB3 ASP 78 HB3 ASP 78 -19.021 -5.929 0.292 616 H GLY 79 H GLY 79 -17.722 -1.986 0.896 617 HA2 GLY 79 HA2 GLY 79 -16.399 -1.388 2.713 618 HA3 GLY 79 HA3 GLY 79 -16.889 -2.829 3.598 619 H GLN 80 H GLN 80 -15.844 -3.536 0.386 620 HA GLN 80 HA GLN 80 -13.493 -4.974 1.412 621 HB2 GLN 80 HB2 GLN 80 -14.656 -4.714 -1.392 622 HB3 GLN 80 HB3 GLN 80 -13.348 -5.793 -0.928 623 HG2 GLN 80 HG2 GLN 80 -16.043 -6.036 0.448 624 HG3 GLN 80 HG3 GLN 80 -15.771 -6.718 -1.151 625 HE21 GLN 80 HE22 GLN 80 -14.600 -6.877 2.254 626 HE22 GLN 80 HE21 GLN 80 -13.871 -8.467 2.049 627 H MET 81 H MET 81 -11.451 -4.269 1.344 628 HA MET 81 HA MET 81 -10.670 -1.855 -0.172 629 HB2 MET 81 HB2 MET 81 -8.448 -2.226 0.884 630 HB3 MET 81 HB3 MET 81 -9.758 -1.849 1.980 631 HG2 MET 81 HG2 MET 81 -8.801 -4.703 1.520 632 HG3 MET 81 HG3 MET 81 -8.049 -3.631 2.678 633 HE1 MET 81 HE1 MET 81 -8.965 -2.857 4.870 634 HE2 MET 81 HE2 MET 81 -10.398 -2.076 4.160 635 HE3 MET 81 HE3 MET 81 -10.583 -3.210 5.514 636 H LEU 82 H LEU 82 -10.947 -2.533 -2.300 637 HA LEU 82 HA LEU 82 -9.064 -4.653 -3.277 638 HB2 LEU 82 HB2 LEU 82 -11.514 -3.587 -4.703 639 HB3 LEU 82 HB3 LEU 82 -10.550 -4.984 -5.141 640 HG LEU 82 HG LEU 82 -12.291 -4.756 -2.653 641 HD11 LEU 82 HD11 LEU 82 -13.608 -4.914 -4.703 642 HD12 LEU 82 HD12 LEU 82 -12.686 -6.354 -5.204 643 HD13 LEU 82 HD13 LEU 82 -13.724 -6.409 -3.757 644 HD21 LEU 82 HD21 LEU 82 -10.772 -7.163 -3.747 645 HD22 LEU 82 HD22 LEU 82 -10.399 -6.295 -2.241 646 HD23 LEU 82 HD23 LEU 82 -11.914 -7.187 -2.382 647 HA PRO 83 HA PRO 83 -6.865 -1.401 -5.403 648 HB2 PRO 83 HB2 PRO 83 -5.756 -2.753 -7.524 649 HB3 PRO 83 HB3 PRO 83 -5.149 -2.880 -5.852 650 HG2 PRO 83 HG2 PRO 83 -7.099 -4.710 -7.313 651 HG3 PRO 83 HG3 PRO 83 -5.660 -5.189 -6.351 652 HD2 PRO 83 HD2 PRO 83 -8.177 -5.264 -5.335 653 HD3 PRO 83 HD3 PRO 83 -6.802 -4.740 -4.315 654 H ILE 84 H ILE 84 -7.214 0.042 -7.093 655 HA ILE 84 HA ILE 84 -9.744 0.042 -8.301 656 HB ILE 84 HB ILE 84 -8.424 2.018 -7.804 657 HG12 ILE 84 HG12 ILE 84 -9.039 2.065 -10.773 658 HG13 ILE 84 HG13 ILE 84 -10.303 1.809 -9.563 659 HG21 ILE 84 HG21 ILE 84 -6.195 1.274 -8.546 660 HG22 ILE 84 HG22 ILE 84 -6.739 1.280 -10.240 661 HG23 ILE 84 HG23 ILE 84 -6.633 2.798 -9.324 662 HD11 ILE 84 HD11 ILE 84 -9.824 3.901 -8.477 663 HD12 ILE 84 HD12 ILE 84 -8.497 4.237 -9.623 664 HD13 ILE 84 HD13 ILE 84 -10.175 4.131 -10.201 665 H ASP 85 H ASP 85 -6.825 -1.389 -9.584 666 HA ASP 85 HA ASP 85 -7.507 -1.873 -12.283 667 HB2 ASP 85 HB2 ASP 85 -5.356 -2.448 -11.098 668 HB3 ASP 85 HB3 ASP 85 -6.191 -3.729 -10.251 669 H GLU 86 H GLU 86 -8.686 -3.433 -9.327 670 HA GLU 86 HA GLU 86 -10.099 -5.587 -10.781 671 HB2 GLU 86 HB2 GLU 86 -8.966 -5.811 -8.457 672 HB3 GLU 86 HB3 GLU 86 -10.299 -4.845 -7.840 673 HG2 GLU 86 HG2 GLU 86 -10.980 -6.998 -7.399 674 HG3 GLU 86 HG3 GLU 86 -11.861 -6.646 -8.874 675 H ILE 87 H ILE 87 -10.845 -2.492 -9.107 676 HA ILE 87 HA ILE 87 -13.671 -2.792 -9.050 677 HB ILE 87 HB ILE 87 -11.951 -0.280 -9.130 678 HG12 ILE 87 HG12 ILE 87 -13.073 -1.897 -6.785 679 HG13 ILE 87 HG13 ILE 87 -11.386 -1.839 -7.287 680 HG21 ILE 87 HG21 ILE 87 -14.371 0.166 -9.657 681 HG22 ILE 87 HG22 ILE 87 -14.808 -0.616 -8.129 682 HG23 ILE 87 HG23 ILE 87 -13.863 0.888 -8.140 683 HD11 ILE 87 HD11 ILE 87 -11.338 0.614 -6.780 684 HD12 ILE 87 HD12 ILE 87 -12.974 0.437 -6.093 685 HD13 ILE 87 HD13 ILE 87 -11.617 -0.439 -5.378 686 H PHE 88 H PHE 88 -11.525 -1.444 -11.571 687 HA PHE 88 HA PHE 88 -13.620 -0.532 -13.308 688 HB2 PHE 88 HB2 PHE 88 -11.236 0.153 -13.455 689 HB3 PHE 88 HB3 PHE 88 -10.813 -1.455 -14.015 690 HD1 PHE 88 HD2 PHE 88 -12.656 1.690 -14.906 691 HD2 PHE 88 HD1 PHE 88 -11.257 -2.148 -16.305 692 HE1 PHE 88 HE2 PHE 88 -13.137 2.363 -17.237 693 HE2 PHE 88 HE1 PHE 88 -11.718 -1.453 -18.646 694 HZ PHE 88 HZ PHE 88 -12.660 0.801 -19.115 695 H GLU 89 H GLU 89 -12.112 -3.777 -13.048 696 HA GLU 89 HA GLU 89 -13.542 -4.807 -15.410 697 HB2 GLU 89 HB2 GLU 89 -11.931 -6.160 -13.195 698 HB3 GLU 89 HB3 GLU 89 -12.803 -7.054 -14.441 699 HG2 GLU 89 HG2 GLU 89 -11.507 -5.613 -16.160 700 HG3 GLU 89 HG3 GLU 89 -10.461 -5.147 -14.817 701 H ARG 90 H ARG 90 -13.991 -4.951 -11.871 702 HA ARG 90 HA ARG 90 -16.403 -6.599 -12.078 703 HB2 ARG 90 HB2 ARG 90 -15.295 -4.958 -9.763 704 HB3 ARG 90 HB3 ARG 90 -16.628 -6.108 -9.661 705 HG2 ARG 90 HG2 ARG 90 -13.715 -6.735 -10.203 706 HG3 ARG 90 HG3 ARG 90 -14.659 -7.133 -8.777 707 HD2 ARG 90 HD2 ARG 90 -14.816 -8.292 -11.565 708 HD3 ARG 90 HD3 ARG 90 -14.378 -9.129 -10.078 709 HE ARG 90 HE ARG 90 -17.013 -8.725 -11.178 710 HH11 ARG 90 HH11 ARG 90 -15.449 -9.154 -8.060 711 HH12 ARG 90 HH12 ARG 90 -16.946 -9.584 -7.271 712 HH21 ARG 90 HH21 ARG 90 -18.881 -9.247 -10.094 713 HH22 ARG 90 HH22 ARG 90 -18.828 -9.645 -8.399 714 H GLU 91 H GLU 91 -15.865 -3.232 -12.549 715 HA GLU 91 HA GLU 91 -17.193 -1.484 -12.916 716 HB2 GLU 91 HB2 GLU 91 -19.487 -3.433 -13.352 717 HB3 GLU 91 HB3 GLU 91 -19.394 -1.749 -13.862 718 HG2 GLU 91 HG2 GLU 91 -17.426 -2.333 -15.319 719 HG3 GLU 91 HG3 GLU 91 -17.624 -4.024 -14.861 720 H LEU 92 H LEU 92 -16.686 -2.323 -10.280 721 HA LEU 92 HA LEU 92 -19.147 -1.882 -8.699 722 HB2 LEU 92 HB2 LEU 92 -16.265 -2.545 -7.992 723 HB3 LEU 92 HB3 LEU 92 -17.460 -2.146 -6.764 724 HG LEU 92 HG LEU 92 -17.770 -4.444 -8.729 725 HD11 LEU 92 HD11 LEU 92 -15.859 -4.779 -7.175 726 HD12 LEU 92 HD12 LEU 92 -16.939 -4.480 -5.797 727 HD13 LEU 92 HD13 LEU 92 -17.190 -5.900 -6.838 728 HD21 LEU 92 HD21 LEU 92 -19.330 -3.712 -6.216 729 HD22 LEU 92 HD22 LEU 92 -19.945 -3.720 -7.887 730 HD23 LEU 92 HD23 LEU 92 -19.492 -5.236 -7.115 731 H ASP 93 H ASP 93 -19.335 -0.354 -7.108 732 HA ASP 93 HA ASP 93 -18.007 2.255 -7.587 733 HB2 ASP 93 HB2 ASP 93 -20.167 3.111 -6.563 734 HB3 ASP 93 HB3 ASP 93 -20.211 2.469 -8.198 735 H LEU 94 H LEU 94 -17.751 3.701 -5.819 736 HA LEU 94 HA LEU 94 -16.712 2.319 -3.422 737 HB2 LEU 94 HB2 LEU 94 -16.493 5.201 -4.355 738 HB3 LEU 94 HB3 LEU 94 -15.772 4.540 -2.882 739 HG LEU 94 HG LEU 94 -15.049 3.998 -5.766 740 HD11 LEU 94 HD11 LEU 94 -14.084 5.971 -4.575 741 HD12 LEU 94 HD12 LEU 94 -13.480 4.903 -3.303 742 HD13 LEU 94 HD13 LEU 94 -12.826 4.758 -4.943 743 HD21 LEU 94 HD21 LEU 94 -14.101 2.406 -3.356 744 HD22 LEU 94 HD22 LEU 94 -14.996 1.785 -4.766 745 HD23 LEU 94 HD23 LEU 94 -13.362 2.390 -4.979 746 H MET 95 H MET 95 -17.161 2.853 -1.320 747 HA MET 95 HA MET 95 -19.899 3.700 -0.711 748 HB2 MET 95 HB2 MET 95 -18.664 1.912 0.496 749 HB3 MET 95 HB3 MET 95 -17.549 3.112 1.146 750 HG2 MET 95 HG2 MET 95 -19.172 3.993 2.580 751 HG3 MET 95 HG3 MET 95 -20.509 3.525 1.530 752 HE1 MET 95 HE1 MET 95 -17.654 0.999 2.577 753 HE2 MET 95 HE2 MET 95 -17.773 2.052 4.013 754 HE3 MET 95 HE3 MET 95 -18.296 0.356 4.100 755 H ARG 96 H ARG 96 -20.448 5.541 0.575 756 HA ARG 96 HA ARG 96 -18.538 7.817 0.484 757 HB2 ARG 96 HB2 ARG 96 -20.857 7.490 -1.041 758 HB3 ARG 96 HB3 ARG 96 -21.458 8.362 0.360 759 HG2 ARG 96 HG2 ARG 96 -20.924 10.067 -1.007 760 HG3 ARG 96 HG3 ARG 96 -19.454 9.979 -0.068 761 HD2 ARG 96 HD2 ARG 96 -18.248 8.943 -1.841 762 HD3 ARG 96 HD3 ARG 96 -19.716 8.479 -2.699 763 HE ARG 96 HE ARG 96 -18.682 11.287 -2.429 764 HH11 ARG 96 HH11 ARG 96 -20.630 9.056 -4.347 765 HH12 ARG 96 HH12 ARG 96 -20.840 10.232 -5.607 766 HH21 ARG 96 HH21 ARG 96 -18.977 12.664 -4.030 767 HH22 ARG 96 HH22 ARG 96 -19.854 12.214 -5.473 768 H VAL 97 H VAL 97 -19.055 9.566 1.986 769 HA VAL 97 HA VAL 97 -20.316 8.673 4.555 770 HB VAL 97 HB VAL 97 -19.072 10.468 5.624 771 HG11 VAL 97 HG11 VAL 97 -18.166 8.144 5.522 772 HG12 VAL 97 HG12 VAL 97 -17.258 8.587 4.061 773 HG13 VAL 97 HG13 VAL 97 -16.888 9.373 5.608 774 HG21 VAL 97 HG21 VAL 97 -17.269 10.823 3.269 775 HG22 VAL 97 HG22 VAL 97 -18.718 11.845 3.438 776 HG23 VAL 97 HG23 VAL 97 -17.481 11.825 4.703 777 H ASP 98 H ASP 98 -20.944 10.774 1.939 778 HA ASP 98 HA ASP 98 -22.739 12.531 3.552 779 HB2 ASP 98 HB2 ASP 98 -21.506 12.756 0.785 780 HB3 ASP 98 HB3 ASP 98 -22.759 13.854 1.361 781 H ASN 99 H ASN 99 -23.166 9.637 2.338 782 HA ASN 99 HA ASN 99 -24.736 8.404 1.251 783 HB2 ASN 99 HB2 ASN 99 -26.433 10.335 2.854 784 HB3 ASN 99 HB3 ASN 99 -27.160 9.031 1.898 785 HD21 ASN 99 HD22 ASN 99 -24.545 9.565 4.243 786 HD22 ASN 99 HD21 ASN 99 -24.238 7.879 4.358 787 H LEU 100 H LEU 100 -23.487 10.114 -0.306 788 HA LEU 100 HA LEU 100 -25.354 11.073 -2.423 789 HB2 LEU 100 HB2 LEU 100 -22.342 10.726 -2.380 790 HB3 LEU 100 HB3 LEU 100 -23.178 11.326 -3.766 791 HG LEU 100 HG LEU 100 -23.342 12.704 -1.052 792 HD11 LEU 100 HD11 LEU 100 -21.020 12.712 -1.893 793 HD12 LEU 100 HD12 LEU 100 -21.591 13.381 -3.443 794 HD13 LEU 100 HD13 LEU 100 -21.744 14.324 -1.946 795 HD21 LEU 100 HD21 LEU 100 -24.059 13.612 -3.880 796 HD22 LEU 100 HD22 LEU 100 -25.209 13.265 -2.568 797 HD23 LEU 100 HD23 LEU 100 -24.102 14.634 -2.427 798 HA PRO 101 HA PRO 101 -25.880 7.268 -4.576 799 HB2 PRO 101 HB2 PRO 101 -25.725 7.964 -7.250 800 HB3 PRO 101 HB3 PRO 101 -27.121 8.312 -6.185 801 HG2 PRO 101 HG2 PRO 101 -24.834 10.155 -6.923 802 HG3 PRO 101 HG3 PRO 101 -26.591 10.515 -6.905 803 HD2 PRO 101 HD2 PRO 101 -24.984 11.229 -4.841 804 HD3 PRO 101 HD3 PRO 101 -26.624 10.624 -4.526 805 H ASN 102 H ASN 102 -24.576 5.586 -4.878 806 HA ASN 102 HA ASN 102 -21.705 5.922 -5.150 807 HB2 ASN 102 HB2 ASN 102 -23.354 3.362 -5.209 808 HB3 ASN 102 HB3 ASN 102 -21.634 3.515 -4.841 809 HD21 ASN 102 HD22 ASN 102 -21.027 4.689 -2.824 810 HD22 ASN 102 HD21 ASN 102 -22.221 4.777 -1.520 811 H ILE 103 H ILE 103 -20.438 5.643 -6.914 812 HA ILE 103 HA ILE 103 -21.588 4.970 -9.586 813 HB ILE 103 HB ILE 103 -20.457 7.082 -10.423 814 HG12 ILE 103 HG12 ILE 103 -20.843 8.014 -7.541 815 HG13 ILE 103 HG13 ILE 103 -19.290 7.728 -8.318 816 HG21 ILE 103 HG21 ILE 103 -22.932 6.590 -10.315 817 HG22 ILE 103 HG22 ILE 103 -22.984 7.447 -8.762 818 HG23 ILE 103 HG23 ILE 103 -22.539 8.304 -10.249 819 HD11 ILE 103 HD11 ILE 103 -19.853 9.510 -9.999 820 HD12 ILE 103 HD12 ILE 103 -21.353 9.830 -9.088 821 HD13 ILE 103 HD13 ILE 103 -19.791 10.106 -8.324 822 H LYS 104 H LYS 104 -20.306 3.904 -10.854 823 HA LYS 104 HA LYS 104 -17.618 3.185 -9.892 824 HB2 LYS 104 HB2 LYS 104 -17.695 1.369 -11.458 825 HB3 LYS 104 HB3 LYS 104 -19.158 1.442 -10.504 826 HG2 LYS 104 HG2 LYS 104 -19.890 0.810 -12.582 827 HG3 LYS 104 HG3 LYS 104 -20.295 2.527 -12.525 828 HD2 LYS 104 HD2 LYS 104 -18.232 3.009 -13.843 829 HD3 LYS 104 HD3 LYS 104 -17.862 1.275 -13.925 830 HE2 LYS 104 HE2 LYS 104 -20.522 2.378 -14.921 831 HE3 LYS 104 HE3 LYS 104 -19.064 2.633 -15.884 832 HZ1 LYS 104 HZ1 LYS 104 -18.726 0.227 -15.951 833 HZ2 LYS 104 HZ2 LYS 104 -20.106 -0.035 -15.097 834 HZ3 LYS 104 HZ3 LYS 104 -20.169 0.619 -16.583 835 H ILE 105 H ILE 105 -15.945 2.789 -11.605 836 HA ILE 105 HA ILE 105 -14.994 5.317 -12.571 837 HB ILE 105 HB ILE 105 -14.110 2.500 -13.344 838 HG12 ILE 105 HG12 ILE 105 -12.631 4.052 -11.247 839 HG13 ILE 105 HG13 ILE 105 -14.077 3.184 -10.748 840 HG21 ILE 105 HG21 ILE 105 -12.713 5.213 -13.488 841 HG22 ILE 105 HG22 ILE 105 -11.867 3.670 -13.698 842 HG23 ILE 105 HG23 ILE 105 -13.131 4.143 -14.839 843 HD11 ILE 105 HD11 ILE 105 -13.080 1.124 -11.808 844 HD12 ILE 105 HD12 ILE 105 -11.558 2.050 -11.978 845 HD13 ILE 105 HD13 ILE 105 -12.271 1.751 -10.375 846 H ALA 106 H ALA 106 -15.697 6.376 -14.305 847 HA ALA 106 HA ALA 106 -17.410 5.060 -16.313 848 HB1 ALA 106 HB1 ALA 106 -18.079 7.189 -15.356 849 HB2 ALA 106 HB2 ALA 106 -16.578 7.968 -15.923 850 HB3 ALA 106 HB3 ALA 106 -17.782 7.380 -17.092 851 H THR 107 H THR 107 -14.205 6.572 -16.185 852 HA THR 107 HA THR 107 -13.363 5.084 -18.583 853 HB THR 107 HB THR 107 -12.078 7.105 -19.414 854 HG1 THR 107 HG1 THR 107 -12.828 9.101 -18.873 855 HG21 THR 107 HG21 THR 107 -14.117 6.249 -20.570 856 HG22 THR 107 HG22 THR 107 -15.102 7.389 -19.625 857 HG23 THR 107 HG23 THR 107 -13.880 7.993 -20.763 858 H ARG 108 H ARG 108 -11.192 4.682 -18.672 859 HA ARG 108 HA ARG 108 -9.385 5.598 -16.503 860 HB2 ARG 108 HB2 ARG 108 -10.383 3.595 -15.617 861 HB3 ARG 108 HB3 ARG 108 -10.111 2.696 -17.100 862 HG2 ARG 108 HG2 ARG 108 -7.802 3.808 -15.441 863 HG3 ARG 108 HG3 ARG 108 -8.585 2.290 -15.066 864 HD2 ARG 108 HD2 ARG 108 -8.054 1.993 -17.796 865 HD3 ARG 108 HD3 ARG 108 -6.672 2.913 -17.227 866 HE ARG 108 HE ARG 108 -5.956 1.115 -15.917 867 HH11 ARG 108 HH11 ARG 108 -9.100 0.274 -17.270 868 HH12 ARG 108 HH12 ARG 108 -8.857 -1.423 -16.965 869 HH21 ARG 108 HH21 ARG 108 -5.766 -1.063 -15.544 870 HH22 ARG 108 HH22 ARG 108 -7.068 -2.142 -15.939 871 H LYS 109 H LYS 109 -7.308 5.650 -17.052 872 HA LYS 109 HA LYS 109 -6.165 4.559 -19.512 873 HB2 LYS 109 HB2 LYS 109 -7.450 6.542 -20.366 874 HB3 LYS 109 HB3 LYS 109 -6.606 7.577 -19.229 875 HG2 LYS 109 HG2 LYS 109 -5.711 7.839 -21.471 876 HG3 LYS 109 HG3 LYS 109 -4.488 7.218 -20.386 877 HD2 LYS 109 HD2 LYS 109 -4.311 6.110 -22.543 878 HD3 LYS 109 HD3 LYS 109 -4.767 4.943 -21.319 879 HE2 LYS 109 HE2 LYS 109 -6.057 4.443 -23.247 880 HE3 LYS 109 HE3 LYS 109 -7.171 5.143 -22.072 881 HZ1 LYS 109 HZ1 LYS 109 -7.009 7.259 -23.303 882 HZ2 LYS 109 HZ2 LYS 109 -5.943 6.606 -24.360 883 HZ3 LYS 109 HZ3 LYS 109 -7.480 6.065 -24.312 884 H TYR 110 H TYR 110 -3.930 4.419 -19.321 885 HA TYR 110 HA TYR 110 -2.591 5.183 -16.880 886 HB2 TYR 110 HB2 TYR 110 -1.841 3.290 -18.295 887 HB3 TYR 110 HB3 TYR 110 -1.470 4.402 -19.600 888 HD1 TYR 110 HD2 TYR 110 -0.775 4.389 -15.876 889 HD2 TYR 110 HD1 TYR 110 0.863 4.668 -19.864 890 HE1 TYR 110 HE2 TYR 110 1.453 4.810 -14.927 891 HE2 TYR 110 HE1 TYR 110 3.133 5.011 -18.892 892 HH TYR 110 HH TYR 110 3.681 5.141 -15.367 893 H LEU 111 H LEU 111 -1.844 7.143 -16.297 894 HA LEU 111 HA LEU 111 -1.755 9.348 -18.306 895 HB2 LEU 111 HB2 LEU 111 -1.509 9.265 -15.266 896 HB3 LEU 111 HB3 LEU 111 -1.390 10.735 -16.232 897 HG LEU 111 HG LEU 111 -3.836 8.929 -16.208 898 HD11 LEU 111 HD11 LEU 111 -3.440 9.922 -13.995 899 HD12 LEU 111 HD12 LEU 111 -3.299 11.538 -14.730 900 HD13 LEU 111 HD13 LEU 111 -4.846 10.658 -14.782 901 HD21 LEU 111 HD21 LEU 111 -3.331 11.755 -17.253 902 HD22 LEU 111 HD22 LEU 111 -3.728 10.320 -18.231 903 HD23 LEU 111 HD23 LEU 111 -4.939 11.002 -17.142 904 H GLY 112 H GLY 112 0.351 7.706 -15.954 905 HA2 GLY 112 HA2 GLY 112 2.761 7.635 -17.152 906 HA3 GLY 112 HA3 GLY 112 2.674 9.352 -16.762 907 H LYS 113 H LYS 113 4.181 9.514 -15.255 908 HA LYS 113 HA LYS 113 4.098 7.766 -12.827 909 HB2 LYS 113 HB2 LYS 113 5.855 7.283 -14.748 910 HB3 LYS 113 HB3 LYS 113 6.710 8.633 -13.995 911 HG2 LYS 113 HG2 LYS 113 6.389 7.384 -11.755 912 HG3 LYS 113 HG3 LYS 113 5.869 6.001 -12.730 913 HD2 LYS 113 HD2 LYS 113 8.090 6.197 -14.001 914 HD3 LYS 113 HD3 LYS 113 8.552 7.450 -12.845 915 HE2 LYS 113 HE2 LYS 113 9.570 5.510 -12.017 916 HE3 LYS 113 HE3 LYS 113 8.161 5.745 -10.985 917 HZ1 LYS 113 HZ1 LYS 113 7.008 4.034 -12.343 918 HZ2 LYS 113 HZ2 LYS 113 8.341 3.845 -13.273 919 HZ3 LYS 113 HZ3 LYS 113 8.382 3.430 -11.698 920 H GLN 114 H GLN 114 3.040 9.363 -11.771 921 HA GLN 114 HA GLN 114 4.252 12.007 -11.405 922 HB2 GLN 114 HB2 GLN 114 1.574 11.152 -10.358 923 HB3 GLN 114 HB3 GLN 114 2.180 12.766 -10.779 924 HG2 GLN 114 HG2 GLN 114 2.546 11.867 -13.157 925 HG3 GLN 114 HG3 GLN 114 1.610 10.446 -12.660 926 HE21 GLN 114 HE22 GLN 114 0.545 11.160 -14.628 927 HE22 GLN 114 HE21 GLN 114 -0.563 12.475 -14.479 928 H ASN 115 H ASN 115 4.502 12.973 -9.259 929 HA ASN 115 HA ASN 115 5.329 11.332 -7.132 930 HB2 ASN 115 HB2 ASN 115 5.614 13.978 -7.774 931 HB3 ASN 115 HB3 ASN 115 4.335 14.111 -6.557 932 HD21 ASN 115 HD22 ASN 115 5.027 12.087 -4.722 933 HD22 ASN 115 HD21 ASN 115 6.715 12.235 -4.321 934 H VAL 116 H VAL 116 4.108 10.010 -5.941 935 HA VAL 116 HA VAL 116 1.397 10.959 -5.119 936 HB VAL 116 HB VAL 116 0.718 8.573 -5.045 937 HG11 VAL 116 HG11 VAL 116 0.074 10.092 -6.896 938 HG12 VAL 116 HG12 VAL 116 1.491 9.549 -7.811 939 HG13 VAL 116 HG13 VAL 116 0.198 8.401 -7.389 940 HG21 VAL 116 HG21 VAL 116 3.172 8.075 -6.800 941 HG22 VAL 116 HG22 VAL 116 2.986 7.509 -5.128 942 HG23 VAL 116 HG23 VAL 116 1.895 6.920 -6.387 943 H TYR 117 H TYR 117 0.628 10.359 -3.128 944 HA TYR 117 HA TYR 117 2.680 9.849 -1.013 945 HB2 TYR 117 HB2 TYR 117 0.634 12.086 -0.950 946 HB3 TYR 117 HB3 TYR 117 2.015 11.848 0.095 947 HD1 TYR 117 HD2 TYR 117 0.866 13.038 -3.198 948 HD2 TYR 117 HD1 TYR 117 4.264 12.599 -0.580 949 HE1 TYR 117 HE2 TYR 117 2.154 14.674 -4.574 950 HE2 TYR 117 HE1 TYR 117 5.510 14.296 -1.896 951 HH TYR 117 HH TYR 117 5.440 15.741 -3.662 952 H ASP 118 H ASP 118 1.783 9.350 1.082 953 HA ASP 118 HA ASP 118 -1.078 9.061 1.439 954 HB2 ASP 118 HB2 ASP 118 -1.161 6.732 1.903 955 HB3 ASP 118 HB3 ASP 118 -0.657 6.973 0.244 956 H ILE 119 H ILE 119 -1.559 9.508 3.505 957 HA ILE 119 HA ILE 119 0.609 9.722 5.496 958 HB ILE 119 HB ILE 119 -1.170 10.607 6.970 959 HG12 ILE 119 HG12 ILE 119 -2.952 10.549 4.490 960 HG13 ILE 119 HG13 ILE 119 -3.127 9.475 5.883 961 HG21 ILE 119 HG21 ILE 119 0.326 12.016 5.600 962 HG22 ILE 119 HG22 ILE 119 -0.852 11.999 4.271 963 HG23 ILE 119 HG23 ILE 119 -1.243 12.786 5.820 964 HD11 ILE 119 HD11 ILE 119 -3.492 11.473 7.339 965 HD12 ILE 119 HD12 ILE 119 -3.478 12.493 5.877 966 HD13 ILE 119 HD13 ILE 119 -4.721 11.250 6.070 967 H GLY 120 H GLY 120 0.708 8.624 7.442 968 HA2 GLY 120 HA2 GLY 120 -0.664 5.960 7.527 969 HA3 GLY 120 HA3 GLY 120 0.863 6.354 8.302 970 H VAL 121 H VAL 121 -1.416 5.213 9.582 971 HA VAL 121 HA VAL 121 -2.241 7.302 11.551 972 HB VAL 121 HB VAL 121 -4.176 5.386 10.243 973 HG11 VAL 121 HG11 VAL 121 -4.975 6.235 12.378 974 HG12 VAL 121 HG12 VAL 121 -4.560 7.908 11.913 975 HG13 VAL 121 HG13 VAL 121 -5.860 7.031 11.086 976 HG21 VAL 121 HG21 VAL 121 -3.716 8.290 9.451 977 HG22 VAL 121 HG22 VAL 121 -3.512 6.853 8.415 978 HG23 VAL 121 HG23 VAL 121 -5.115 7.309 8.961 979 H GLU 122 H GLU 122 -3.005 6.396 13.595 980 HA GLU 122 HA GLU 122 -1.519 4.131 14.512 981 HB2 GLU 122 HB2 GLU 122 -3.821 5.730 15.680 982 HB3 GLU 122 HB3 GLU 122 -3.138 4.342 16.524 983 HG2 GLU 122 HG2 GLU 122 -1.507 6.761 15.645 984 HG3 GLU 122 HG3 GLU 122 -2.205 6.549 17.246 985 H ARG 123 H ARG 123 -1.812 2.076 14.125 986 HA ARG 123 HA ARG 123 -2.669 0.075 13.448 987 HB2 ARG 123 HB2 ARG 123 -4.872 0.997 15.339 988 HB3 ARG 123 HB3 ARG 123 -4.808 -0.631 14.692 989 HG2 ARG 123 HG2 ARG 123 -2.524 0.567 16.308 990 HG3 ARG 123 HG3 ARG 123 -3.872 -0.338 17.000 991 HD2 ARG 123 HD2 ARG 123 -3.297 -2.279 15.483 992 HD3 ARG 123 HD3 ARG 123 -1.879 -1.383 14.945 993 HE ARG 123 HE ARG 123 -0.784 -1.893 16.911 994 HH11 ARG 123 HH11 ARG 123 -4.174 -2.668 17.451 995 HH12 ARG 123 HH12 ARG 123 -3.833 -3.457 18.970 996 HH21 ARG 123 HH21 ARG 123 -0.438 -2.925 18.835 997 HH22 ARG 123 HH22 ARG 123 -1.779 -3.600 19.723 998 H ASP 124 H ASP 124 -3.389 2.395 11.698 999 HA ASP 124 HA ASP 124 -5.544 1.113 10.112 1000 HB2 ASP 124 HB2 ASP 124 -6.490 2.635 11.953 1001 HB3 ASP 124 HB3 ASP 124 -5.769 3.985 11.093 1002 H HIS 125 H HIS 125 -5.961 2.309 8.047 1003 HA HIS 125 HA HIS 125 -3.751 3.912 6.951 1004 HB2 HIS 125 HB2 HIS 125 -3.369 2.172 5.125 1005 HB3 HIS 125 HB3 HIS 125 -2.742 1.806 6.698 1006 HD1 HIS 125 HD1 HIS 125 -2.848 -0.772 6.753 1007 HD2 HIS 125 HD2 HIS 125 -6.373 1.059 5.362 1008 HE1 HIS 125 HE1 HIS 125 -4.563 -2.637 6.485 1009 H ASN 126 H ASN 126 -6.776 4.197 7.328 1010 HA ASN 126 HA ASN 126 -7.275 4.999 4.523 1011 HB2 ASN 126 HB2 ASN 126 -9.482 4.116 4.462 1012 HB3 ASN 126 HB3 ASN 126 -8.407 2.815 4.927 1013 HD21 ASN 126 HD22 ASN 126 -10.659 5.267 6.323 1014 HD22 ASN 126 HD21 ASN 126 -11.108 4.264 7.679 1015 H PHE 127 H PHE 127 -9.049 6.492 4.211 1016 HA PHE 127 HA PHE 127 -9.891 8.255 6.370 1017 HB2 PHE 127 HB2 PHE 127 -8.596 10.259 5.457 1018 HB3 PHE 127 HB3 PHE 127 -7.718 9.112 6.433 1019 HD1 PHE 127 HD2 PHE 127 -8.413 9.910 2.805 1020 HD2 PHE 127 HD1 PHE 127 -5.659 8.268 5.691 1021 HE1 PHE 127 HE2 PHE 127 -6.706 9.628 1.025 1022 HE2 PHE 127 HE1 PHE 127 -3.956 7.997 3.906 1023 HZ PHE 127 HZ PHE 127 -4.476 8.681 1.575 1024 H ALA 128 H ALA 128 -11.147 10.083 5.647 1025 HA ALA 128 HA ALA 128 -12.688 9.523 3.233 1026 HB1 ALA 128 HB1 ALA 128 -13.759 10.169 5.368 1027 HB2 ALA 128 HB2 ALA 128 -12.929 11.744 5.301 1028 HB3 ALA 128 HB3 ALA 128 -14.132 11.318 4.067 1029 H LEU 129 H LEU 129 -12.645 10.589 1.336 1030 HA LEU 129 HA LEU 129 -10.666 12.750 0.822 1031 HB2 LEU 129 HB2 LEU 129 -12.612 11.426 -1.106 1032 HB3 LEU 129 HB3 LEU 129 -11.230 12.455 -1.493 1033 HG LEU 129 HG LEU 129 -11.122 9.618 -0.388 1034 HD11 LEU 129 HD11 LEU 129 -11.681 9.880 -2.827 1035 HD12 LEU 129 HD12 LEU 129 -10.182 10.798 -3.040 1036 HD13 LEU 129 HD13 LEU 129 -10.120 9.091 -2.555 1037 HD21 LEU 129 HD21 LEU 129 -8.867 11.541 -1.024 1038 HD22 LEU 129 HD22 LEU 129 -9.262 10.810 0.556 1039 HD23 LEU 129 HD23 LEU 129 -8.665 9.796 -0.760 1040 H LYS 130 H LYS 130 -11.367 14.667 -0.439 1041 HA LYS 130 HA LYS 130 -13.343 16.199 0.780 1042 HB2 LYS 130 HB2 LYS 130 -13.164 17.738 -1.074 1043 HB3 LYS 130 HB3 LYS 130 -11.575 17.154 -0.600 1044 HG2 LYS 130 HG2 LYS 130 -11.300 15.881 -2.576 1045 HG3 LYS 130 HG3 LYS 130 -13.029 15.881 -2.945 1046 HD2 LYS 130 HD2 LYS 130 -13.024 18.275 -3.386 1047 HD3 LYS 130 HD3 LYS 130 -11.308 18.366 -2.973 1048 HE2 LYS 130 HE2 LYS 130 -10.800 16.790 -4.852 1049 HE3 LYS 130 HE3 LYS 130 -12.522 16.758 -5.268 1050 HZ1 LYS 130 HZ1 LYS 130 -12.403 19.151 -5.688 1051 HZ2 LYS 130 HZ2 LYS 130 -10.824 19.205 -5.237 1052 HZ3 LYS 130 HZ3 LYS 130 -11.275 18.399 -6.602 1053 H ASN 131 H ASN 131 -13.904 14.021 -1.908 1054 HA ASN 131 HA ASN 131 -16.605 15.075 -2.430 1055 HB2 ASN 131 HB2 ASN 131 -14.835 12.921 -3.668 1056 HB3 ASN 131 HB3 ASN 131 -16.525 13.081 -4.122 1057 HD21 ASN 131 HD22 ASN 131 -17.258 15.316 -4.875 1058 HD22 ASN 131 HD21 ASN 131 -16.089 16.205 -5.838 1059 H GLY 132 H GLY 132 -15.463 12.956 -0.076 1060 HA2 GLY 132 HA2 GLY 132 -17.021 12.010 1.468 1061 HA3 GLY 132 HA3 GLY 132 -18.150 11.674 0.177 1062 H PHE 133 H PHE 133 -15.357 10.609 -1.188 1063 HA PHE 133 HA PHE 133 -15.971 7.809 -0.663 1064 HB2 PHE 133 HB2 PHE 133 -13.687 9.128 -2.171 1065 HB3 PHE 133 HB3 PHE 133 -14.080 7.415 -2.229 1066 HD1 PHE 133 HD2 PHE 133 -16.644 6.897 -2.812 1067 HD2 PHE 133 HD1 PHE 133 -14.506 10.462 -3.944 1068 HE1 PHE 133 HE2 PHE 133 -18.222 7.236 -4.703 1069 HE2 PHE 133 HE1 PHE 133 -16.117 10.834 -5.803 1070 HZ PHE 133 HZ PHE 133 -17.977 9.226 -6.172 1071 H ILE 134 H ILE 134 -14.219 6.197 -0.137 1072 HA ILE 134 HA ILE 134 -12.267 7.249 1.863 1073 HB ILE 134 HB ILE 134 -13.707 4.596 2.084 1074 HG12 ILE 134 HG12 ILE 134 -14.416 5.653 4.345 1075 HG13 ILE 134 HG13 ILE 134 -14.053 7.210 3.613 1076 HG21 ILE 134 HG21 ILE 134 -11.449 4.389 2.945 1077 HG22 ILE 134 HG22 ILE 134 -11.562 5.960 3.774 1078 HG23 ILE 134 HG23 ILE 134 -12.495 4.580 4.346 1079 HD11 ILE 134 HD11 ILE 134 -15.876 6.911 2.028 1080 HD12 ILE 134 HD12 ILE 134 -16.005 5.180 2.421 1081 HD13 ILE 134 HD13 ILE 134 -16.479 6.406 3.607 1082 H ALA 135 H ALA 135 -10.317 6.976 1.371 1083 HA ALA 135 HA ALA 135 -9.357 5.024 -0.668 1084 HB1 ALA 135 HB1 ALA 135 -8.796 7.341 -1.115 1085 HB2 ALA 135 HB2 ALA 135 -8.289 7.608 0.568 1086 HB3 ALA 135 HB3 ALA 135 -7.316 6.591 -0.488 1087 H SER 136 H SER 136 -7.892 3.406 -0.054 1088 HA SER 136 HA SER 136 -6.960 3.290 2.777 1089 HB2 SER 136 HB2 SER 136 -8.136 0.945 1.257 1090 HB3 SER 136 HB3 SER 136 -7.619 1.002 2.954 1091 HG SER 136 HG SER 136 -9.869 1.172 2.789 1092 H ASN 137 H ASN 137 -4.941 2.552 3.085 1093 HA ASN 137 HA ASN 137 -3.346 1.623 0.740 1094 HB2 ASN 137 HB2 ASN 137 -2.647 3.112 3.297 1095 HB3 ASN 137 HB3 ASN 137 -1.429 2.468 2.211 1096 HD21 ASN 137 HD22 ASN 137 -1.290 3.324 0.025 1097 HD22 ASN 137 HD21 ASN 137 -1.943 4.912 -0.290 Start of MODEL 9 1 H1 GLY -1 H GLY -1 1.439 -1.196 -0.073 2 HA2 GLY -1 HA2 GLY -1 2.291 0.997 -0.581 3 HA3 GLY -1 HA3 GLY -1 3.052 -0.242 -1.582 4 H GLY 0 H GLY 0 0.617 2.276 -1.516 5 HA2 GLY 0 HA2 GLY 0 0.704 2.904 -4.356 6 HA3 GLY 0 HA3 GLY 0 -0.834 2.315 -3.726 7 H ALA 1 H ALA 1 -0.524 4.969 -4.677 8 HA ALA 1 HA ALA 1 -0.946 6.622 -2.255 9 HB1 ALA 1 HB1 ALA 1 1.417 6.497 -2.290 10 HB2 ALA 1 HB2 ALA 1 1.477 6.766 -4.047 11 HB3 ALA 1 HB3 ALA 1 0.981 8.064 -2.946 12 H LEU 2 H LEU 2 -1.089 8.989 -2.934 13 HA LEU 2 HA LEU 2 -2.920 9.231 -5.300 14 HB2 LEU 2 HB2 LEU 2 -3.011 10.632 -2.608 15 HB3 LEU 2 HB3 LEU 2 -4.204 10.761 -3.897 16 HG LEU 2 HG LEU 2 -3.593 8.255 -2.277 17 HD11 LEU 2 HD11 LEU 2 -4.661 9.997 -0.935 18 HD12 LEU 2 HD12 LEU 2 -5.990 10.095 -2.109 19 HD13 LEU 2 HD13 LEU 2 -5.711 8.600 -1.197 20 HD21 LEU 2 HD21 LEU 2 -5.793 8.815 -4.315 21 HD22 LEU 2 HD22 LEU 2 -4.456 7.649 -4.478 22 HD23 LEU 2 HD23 LEU 2 -5.709 7.383 -3.266 23 H SER 3 H SER 3 -2.898 11.238 -6.433 24 HA SER 3 HA SER 3 -0.247 12.426 -6.646 25 HB2 SER 3 HB2 SER 3 -1.856 12.097 -8.536 26 HB3 SER 3 HB3 SER 3 -2.838 13.419 -7.866 27 HG SER 3 HG SER 3 -1.164 13.934 -9.539 28 H TYR 4 H TYR 4 0.193 14.776 -6.557 29 HA TYR 4 HA TYR 4 -0.161 15.871 -3.979 30 HB2 TYR 4 HB2 TYR 4 1.583 16.585 -5.559 31 HB3 TYR 4 HB3 TYR 4 0.381 17.296 -6.617 32 HD1 TYR 4 HD2 TYR 4 -0.824 19.370 -5.979 33 HD2 TYR 4 HD1 TYR 4 2.296 17.717 -3.506 34 HE1 TYR 4 HE2 TYR 4 -0.752 21.482 -4.666 35 HE2 TYR 4 HE1 TYR 4 2.363 19.833 -2.179 36 HH TYR 4 HH TYR 4 0.224 22.603 -2.940 37 H GLU 5 H GLU 5 -2.001 16.524 -6.950 38 HA GLU 5 HA GLU 5 -3.696 18.569 -5.964 39 HB2 GLU 5 HB2 GLU 5 -4.985 18.241 -7.955 40 HB3 GLU 5 HB3 GLU 5 -3.290 18.023 -8.339 41 HG2 GLU 5 HG2 GLU 5 -4.311 16.333 -9.535 42 HG3 GLU 5 HG3 GLU 5 -3.698 15.485 -8.130 43 H THR 6 H THR 6 -3.797 15.249 -5.086 44 HA THR 6 HA THR 6 -6.681 14.984 -4.890 45 HB THR 6 HB THR 6 -4.460 13.262 -3.751 46 HG1 THR 6 HG1 THR 6 -5.584 13.598 -6.197 47 HG21 THR 6 HG21 THR 6 -6.306 12.673 -2.443 48 HG22 THR 6 HG22 THR 6 -7.478 12.968 -3.753 49 HG23 THR 6 HG23 THR 6 -6.420 11.548 -3.804 50 H GLU 7 H GLU 7 -7.615 16.502 -3.646 51 HA GLU 7 HA GLU 7 -6.518 17.346 -1.126 52 HB2 GLU 7 HB2 GLU 7 -9.383 17.809 -1.991 53 HB3 GLU 7 HB3 GLU 7 -8.412 18.728 -0.849 54 HG2 GLU 7 HG2 GLU 7 -6.868 19.317 -2.802 55 HG3 GLU 7 HG3 GLU 7 -8.079 18.597 -3.873 56 H ILE 8 H ILE 8 -6.852 16.657 0.870 57 HA ILE 8 HA ILE 8 -8.776 14.425 1.423 58 HB ILE 8 HB ILE 8 -6.308 15.283 2.985 59 HG12 ILE 8 HG12 ILE 8 -5.477 14.451 0.931 60 HG13 ILE 8 HG13 ILE 8 -5.215 13.222 2.158 61 HG21 ILE 8 HG21 ILE 8 -7.989 14.141 4.373 62 HG22 ILE 8 HG22 ILE 8 -8.024 12.779 3.245 63 HG23 ILE 8 HG23 ILE 8 -6.555 13.141 4.163 64 HD11 ILE 8 HD11 ILE 8 -7.231 11.982 1.258 65 HD12 ILE 8 HD12 ILE 8 -7.326 13.177 -0.049 66 HD13 ILE 8 HD13 ILE 8 -5.901 12.144 0.099 67 H LEU 9 H LEU 9 -10.488 14.969 2.636 68 HA LEU 9 HA LEU 9 -10.790 17.574 3.869 69 HB2 LEU 9 HB2 LEU 9 -12.670 16.088 2.998 70 HB3 LEU 9 HB3 LEU 9 -12.368 15.014 4.363 71 HG LEU 9 HG LEU 9 -12.782 17.078 5.877 72 HD11 LEU 9 HD11 LEU 9 -12.586 18.844 4.168 73 HD12 LEU 9 HD12 LEU 9 -13.985 18.166 3.301 74 HD13 LEU 9 HD13 LEU 9 -14.182 18.858 4.926 75 HD21 LEU 9 HD21 LEU 9 -15.076 16.059 4.142 76 HD22 LEU 9 HD22 LEU 9 -14.425 15.246 5.579 77 HD23 LEU 9 HD23 LEU 9 -15.225 16.814 5.747 78 H THR 10 H THR 10 -9.897 18.229 5.719 79 HA THR 10 HA THR 10 -9.188 16.253 7.840 80 HB THR 10 HB THR 10 -7.307 17.655 8.456 81 HG1 THR 10 HG1 THR 10 -7.875 19.119 6.105 82 HG21 THR 10 HG21 THR 10 -6.895 15.843 6.827 83 HG22 THR 10 HG22 THR 10 -7.168 16.982 5.492 84 HG23 THR 10 HG23 THR 10 -5.804 17.222 6.600 85 H VAL 11 H VAL 11 -9.385 16.839 9.997 86 HA VAL 11 HA VAL 11 -11.527 18.751 10.568 87 HB VAL 11 HB VAL 11 -9.778 17.313 12.584 88 HG11 VAL 11 HG11 VAL 11 -11.129 19.047 13.632 89 HG12 VAL 11 HG12 VAL 11 -12.584 18.476 12.782 90 HG13 VAL 11 HG13 VAL 11 -11.812 17.470 14.028 91 HG21 VAL 11 HG21 VAL 11 -10.851 15.641 11.023 92 HG22 VAL 11 HG22 VAL 11 -11.423 15.551 12.684 93 HG23 VAL 11 HG23 VAL 11 -12.421 16.338 11.450 94 H GLU 12 H GLU 12 -8.019 18.776 10.893 95 HA GLU 12 HA GLU 12 -7.816 21.082 12.599 96 HB2 GLU 12 HB2 GLU 12 -5.991 19.547 10.768 97 HB3 GLU 12 HB3 GLU 12 -5.439 21.118 11.353 98 HG2 GLU 12 HG2 GLU 12 -6.315 18.801 13.127 99 HG3 GLU 12 HG3 GLU 12 -4.650 19.251 12.775 100 H TYR 13 H TYR 13 -8.293 20.860 9.121 101 HA TYR 13 HA TYR 13 -8.438 23.838 8.972 102 HB2 TYR 13 HB2 TYR 13 -6.664 22.031 7.298 103 HB3 TYR 13 HB3 TYR 13 -7.157 23.622 6.750 104 HD1 TYR 13 HD2 TYR 13 -6.819 25.581 8.575 105 HD2 TYR 13 HD1 TYR 13 -4.519 21.936 8.315 106 HE1 TYR 13 HE2 TYR 13 -4.941 26.687 9.769 107 HE2 TYR 13 HE1 TYR 13 -2.629 23.052 9.503 108 HH TYR 13 HH TYR 13 -2.835 26.456 10.597 109 H GLY 14 H GLY 14 -8.851 20.832 6.991 110 HA2 GLY 14 HA2 GLY 14 -11.319 20.762 6.075 111 HA3 GLY 14 HA3 GLY 14 -10.838 22.281 5.317 112 H LEU 15 H LEU 15 -11.016 21.532 3.258 113 HA LEU 15 HA LEU 15 -9.748 19.144 2.176 114 HB2 LEU 15 HB2 LEU 15 -10.908 21.678 0.924 115 HB3 LEU 15 HB3 LEU 15 -10.355 20.290 -0.003 116 HG LEU 15 HG LEU 15 -12.609 20.167 2.055 117 HD11 LEU 15 HD11 LEU 15 -13.233 21.614 0.177 118 HD12 LEU 15 HD12 LEU 15 -12.727 20.361 -0.977 119 HD13 LEU 15 HD13 LEU 15 -14.111 20.077 0.106 120 HD21 LEU 15 HD21 LEU 15 -11.623 18.232 -0.084 121 HD22 LEU 15 HD22 LEU 15 -11.555 17.982 1.671 122 HD23 LEU 15 HD23 LEU 15 -13.124 18.030 0.864 123 H LEU 16 H LEU 16 -7.546 19.043 2.362 124 HA LEU 16 HA LEU 16 -5.963 21.166 0.975 125 HB2 LEU 16 HB2 LEU 16 -5.506 19.767 3.627 126 HB3 LEU 16 HB3 LEU 16 -4.149 20.445 2.741 127 HG LEU 16 HG LEU 16 -6.572 22.118 3.530 128 HD11 LEU 16 HD11 LEU 16 -5.516 21.200 5.513 129 HD12 LEU 16 HD12 LEU 16 -3.916 21.743 4.958 130 HD13 LEU 16 HD13 LEU 16 -5.169 22.937 5.369 131 HD21 LEU 16 HD21 LEU 16 -3.732 22.860 2.682 132 HD22 LEU 16 HD22 LEU 16 -5.200 23.081 1.701 133 HD23 LEU 16 HD23 LEU 16 -4.998 23.999 3.194 134 HA PRO 17 HA PRO 17 -4.227 17.958 -1.505 135 HB2 PRO 17 HB2 PRO 17 -1.712 18.957 -2.056 136 HB3 PRO 17 HB3 PRO 17 -3.229 19.578 -2.780 137 HG2 PRO 17 HG2 PRO 17 -1.691 20.663 -0.418 138 HG3 PRO 17 HG3 PRO 17 -2.367 21.564 -1.812 139 HD2 PRO 17 HD2 PRO 17 -3.650 21.425 0.572 140 HD3 PRO 17 HD3 PRO 17 -4.565 21.385 -0.964 141 H ILE 18 H ILE 18 -3.562 15.993 -0.911 142 HA ILE 18 HA ILE 18 -2.326 15.350 1.520 143 HB ILE 18 HB ILE 18 -3.600 13.795 0.103 144 HG12 ILE 18 HG12 ILE 18 -0.860 12.660 0.770 145 HG13 ILE 18 HG13 ILE 18 -2.065 13.093 1.989 146 HG21 ILE 18 HG21 ILE 18 -2.532 14.373 -2.094 147 HG22 ILE 18 HG22 ILE 18 -1.114 13.422 -1.600 148 HG23 ILE 18 HG23 ILE 18 -2.696 12.654 -1.782 149 HD11 ILE 18 HD11 ILE 18 -3.679 11.495 0.938 150 HD12 ILE 18 HD12 ILE 18 -2.392 10.981 -0.176 151 HD13 ILE 18 HD13 ILE 18 -2.210 10.727 1.571 152 H GLY 19 H GLY 19 -0.720 16.084 -1.579 153 HA2 GLY 19 HA2 GLY 19 1.854 15.096 -0.844 154 HA3 GLY 19 HA3 GLY 19 1.528 16.310 -2.084 155 H LYS 20 H LYS 20 0.314 18.250 -0.177 156 HA LYS 20 HA LYS 20 2.757 19.507 0.795 157 HB2 LYS 20 HB2 LYS 20 0.721 20.724 -0.081 158 HB3 LYS 20 HB3 LYS 20 -0.171 20.186 1.351 159 HG2 LYS 20 HG2 LYS 20 1.497 21.417 2.785 160 HG3 LYS 20 HG3 LYS 20 2.282 22.003 1.303 161 HD2 LYS 20 HD2 LYS 20 0.159 23.111 0.628 162 HD3 LYS 20 HD3 LYS 20 -0.632 22.484 2.093 163 HE2 LYS 20 HE2 LYS 20 1.075 23.705 3.481 164 HE3 LYS 20 HE3 LYS 20 1.744 24.400 1.997 165 HZ1 LYS 20 HZ1 LYS 20 -0.431 25.447 1.596 166 HZ2 LYS 20 HZ2 LYS 20 -1.036 24.812 2.978 167 HZ3 LYS 20 HZ3 LYS 20 0.164 25.916 3.042 168 H ILE 21 H ILE 21 0.156 17.588 2.224 169 HA ILE 21 HA ILE 21 0.871 18.081 4.982 170 HB ILE 21 HB ILE 21 -0.768 15.890 3.698 171 HG12 ILE 21 HG12 ILE 21 -1.771 18.203 5.412 172 HG13 ILE 21 HG13 ILE 21 -1.589 18.385 3.674 173 HG21 ILE 21 HG21 ILE 21 0.047 14.997 5.785 174 HG22 ILE 21 HG22 ILE 21 -0.434 16.471 6.656 175 HG23 ILE 21 HG23 ILE 21 -1.649 15.385 5.965 176 HD11 ILE 21 HD11 ILE 21 -3.192 16.609 3.232 177 HD12 ILE 21 HD12 ILE 21 -3.393 16.307 4.970 178 HD13 ILE 21 HD13 ILE 21 -3.900 17.852 4.275 179 H VAL 22 H VAL 22 1.719 15.605 2.570 180 HA VAL 22 HA VAL 22 3.369 14.100 4.439 181 HB VAL 22 HB VAL 22 2.924 13.956 1.447 182 HG11 VAL 22 HG11 VAL 22 5.144 13.000 1.892 183 HG12 VAL 22 HG12 VAL 22 4.476 11.994 3.198 184 HG13 VAL 22 HG13 VAL 22 3.984 11.728 1.518 185 HG21 VAL 22 HG21 VAL 22 1.994 12.217 3.794 186 HG22 VAL 22 HG22 VAL 22 0.980 13.353 2.885 187 HG23 VAL 22 HG23 VAL 22 1.620 11.911 2.100 188 H GLU 23 H GLU 23 4.155 16.474 1.836 189 HA GLU 23 HA GLU 23 7.020 16.119 2.126 190 HB2 GLU 23 HB2 GLU 23 5.368 18.414 0.989 191 HB3 GLU 23 HB3 GLU 23 7.131 18.406 1.042 192 HG2 GLU 23 HG2 GLU 23 7.075 16.193 -0.226 193 HG3 GLU 23 HG3 GLU 23 5.367 16.507 -0.531 194 H LYS 24 H LYS 24 4.676 17.974 3.929 195 HA LYS 24 HA LYS 24 6.864 19.356 5.469 196 HB2 LYS 24 HB2 LYS 24 3.959 20.184 5.192 197 HB3 LYS 24 HB3 LYS 24 5.236 21.085 5.994 198 HG2 LYS 24 HG2 LYS 24 4.981 20.539 3.010 199 HG3 LYS 24 HG3 LYS 24 4.691 22.059 3.855 200 HD2 LYS 24 HD2 LYS 24 7.188 21.925 4.595 201 HD3 LYS 24 HD3 LYS 24 7.335 20.632 3.399 202 HE2 LYS 24 HE2 LYS 24 8.022 22.563 2.248 203 HE3 LYS 24 HE3 LYS 24 6.381 22.255 1.672 204 HZ1 LYS 24 HZ1 LYS 24 5.603 23.986 3.234 205 HZ2 LYS 24 HZ2 LYS 24 7.131 24.241 3.764 206 HZ3 LYS 24 HZ3 LYS 24 6.729 24.604 2.226 207 H ARG 25 H ARG 25 4.919 16.772 5.718 208 HA ARG 25 HA ARG 25 4.022 15.472 7.335 209 HB2 ARG 25 HB2 ARG 25 6.419 16.413 8.934 210 HB3 ARG 25 HB3 ARG 25 5.477 14.952 9.183 211 HG2 ARG 25 HG2 ARG 25 7.121 13.995 7.929 212 HG3 ARG 25 HG3 ARG 25 6.063 14.506 6.608 213 HD2 ARG 25 HD2 ARG 25 8.422 14.988 6.139 214 HD3 ARG 25 HD3 ARG 25 7.451 16.457 6.180 215 HE ARG 25 HE ARG 25 8.768 15.767 8.721 216 HH11 ARG 25 HH11 ARG 25 9.197 17.588 5.736 217 HH12 ARG 25 HH12 ARG 25 10.338 18.679 6.482 218 HH21 ARG 25 HH21 ARG 25 10.190 17.215 9.592 219 HH22 ARG 25 HH22 ARG 25 10.880 18.472 8.603 220 H ILE 26 H ILE 26 2.380 17.326 7.174 221 HA ILE 26 HA ILE 26 2.151 19.068 9.519 222 HB ILE 26 HB ILE 26 0.209 18.581 7.226 223 HG12 ILE 26 HG12 ILE 26 2.093 20.923 7.771 224 HG13 ILE 26 HG13 ILE 26 2.464 19.599 6.674 225 HG21 ILE 26 HG21 ILE 26 -1.022 19.389 9.189 226 HG22 ILE 26 HG22 ILE 26 0.182 20.659 9.464 227 HG23 ILE 26 HG23 ILE 26 -0.872 20.704 8.044 228 HD11 ILE 26 HD11 ILE 26 0.529 20.188 5.246 229 HD12 ILE 26 HD12 ILE 26 0.211 21.594 6.295 230 HD13 ILE 26 HD13 ILE 26 1.729 21.481 5.387 231 H GLU 27 H GLU 27 1.276 18.574 11.394 232 HA GLU 27 HA GLU 27 0.025 15.996 11.924 233 HB2 GLU 27 HB2 GLU 27 0.335 18.436 13.714 234 HB3 GLU 27 HB3 GLU 27 -0.222 16.827 14.209 235 HG2 GLU 27 HG2 GLU 27 1.979 15.895 13.352 236 HG3 GLU 27 HG3 GLU 27 2.539 17.558 13.148 237 H CYS 28 H CYS 28 -1.876 15.667 10.963 238 HA CYS 28 HA CYS 28 -4.135 17.519 11.540 239 HB2 CYS 28 HB2 CYS 28 -4.897 17.332 9.246 240 HB3 CYS 28 HB3 CYS 28 -3.214 17.857 9.248 241 HG CYS 28 HG CYS 28 -4.513 14.851 8.666 242 H THR 29 H THR 29 -6.210 16.355 10.617 243 HA THR 29 HA THR 29 -6.431 13.629 11.835 244 HB THR 29 HB THR 29 -8.613 15.660 12.126 245 HG1 THR 29 HG1 THR 29 -7.771 16.372 14.083 246 HG21 THR 29 HG21 THR 29 -8.979 13.323 12.891 247 HG22 THR 29 HG22 THR 29 -7.645 13.530 14.062 248 HG23 THR 29 HG23 THR 29 -9.127 14.501 14.201 249 H VAL 30 H VAL 30 -8.103 12.346 10.886 250 HA VAL 30 HA VAL 30 -9.328 13.384 8.354 251 HB VAL 30 HB VAL 30 -8.712 11.335 7.190 252 HG11 VAL 30 HG11 VAL 30 -7.274 13.378 7.053 253 HG12 VAL 30 HG12 VAL 30 -6.198 12.650 8.275 254 HG13 VAL 30 HG13 VAL 30 -6.440 11.859 6.702 255 HG21 VAL 30 HG21 VAL 30 -7.020 10.643 9.629 256 HG22 VAL 30 HG22 VAL 30 -8.407 9.730 9.002 257 HG23 VAL 30 HG23 VAL 30 -6.922 9.840 8.061 258 H TYR 31 H TYR 31 -11.050 12.054 7.512 259 HA TYR 31 HA TYR 31 -12.730 10.960 9.701 260 HB2 TYR 31 HB2 TYR 31 -13.452 11.755 6.856 261 HB3 TYR 31 HB3 TYR 31 -14.565 11.210 8.089 262 HD1 TYR 31 HD1 TYR 31 -12.239 13.987 7.154 263 HD2 TYR 31 HD2 TYR 31 -15.405 12.672 9.774 264 HE1 TYR 31 HE1 TYR 31 -12.526 16.318 7.968 265 HE2 TYR 31 HE2 TYR 31 -15.747 15.035 10.531 266 HH TYR 31 HH TYR 31 -13.778 17.733 9.241 267 H SER 32 H SER 32 -13.448 8.892 9.730 268 HA SER 32 HA SER 32 -12.903 6.969 7.529 269 HB2 SER 32 HB2 SER 32 -10.775 6.935 8.536 270 HB3 SER 32 HB3 SER 32 -11.422 7.198 10.153 271 HG SER 32 HG SER 32 -11.906 5.102 10.335 272 H VAL 33 H VAL 33 -13.967 4.910 7.889 273 HA VAL 33 HA VAL 33 -16.231 5.071 9.805 274 HB VAL 33 HB VAL 33 -15.964 2.753 7.920 275 HG11 VAL 33 HG11 VAL 33 -17.714 2.972 9.622 276 HG12 VAL 33 HG12 VAL 33 -18.313 4.439 8.814 277 HG13 VAL 33 HG13 VAL 33 -18.340 2.873 7.962 278 HG21 VAL 33 HG21 VAL 33 -16.840 5.555 7.054 279 HG22 VAL 33 HG22 VAL 33 -15.538 4.579 6.339 280 HG23 VAL 33 HG23 VAL 33 -17.211 4.061 6.175 281 H ASP 34 H ASP 34 -16.207 4.015 11.682 282 HA ASP 34 HA ASP 34 -13.998 2.370 12.560 283 HB2 ASP 34 HB2 ASP 34 -15.601 3.920 13.933 284 HB3 ASP 34 HB3 ASP 34 -16.700 2.539 13.886 285 H ASN 35 H ASN 35 -14.671 0.318 13.827 286 HA ASN 35 HA ASN 35 -15.227 -1.783 11.899 287 HB2 ASN 35 HB2 ASN 35 -14.924 -1.802 14.938 288 HB3 ASN 35 HB3 ASN 35 -15.061 -3.251 13.947 289 HD21 ASN 35 HD22 ASN 35 -12.790 -1.418 15.481 290 HD22 ASN 35 HD21 ASN 35 -11.426 -1.769 14.429 291 H ASN 36 H ASN 36 -17.232 -0.024 14.170 292 HA ASN 36 HA ASN 36 -19.565 -1.810 13.878 293 HB2 ASN 36 HB2 ASN 36 -19.086 0.855 15.297 294 HB3 ASN 36 HB3 ASN 36 -20.633 0.013 15.288 295 HD21 ASN 36 HD22 ASN 36 -17.462 0.083 16.756 296 HD22 ASN 36 HD21 ASN 36 -17.772 -1.268 17.837 297 H GLY 37 H GLY 37 -18.209 0.462 11.810 298 HA2 GLY 37 HA2 GLY 37 -19.032 1.304 9.845 299 HA3 GLY 37 HA3 GLY 37 -20.650 0.786 10.237 300 H ASN 38 H ASN 38 -18.962 2.776 12.575 301 HA ASN 38 HA ASN 38 -20.732 5.119 12.002 302 HB2 ASN 38 HB2 ASN 38 -18.932 4.454 14.377 303 HB3 ASN 38 HB3 ASN 38 -19.957 5.878 14.247 304 HD21 ASN 38 HD22 ASN 38 -19.914 3.388 16.093 305 HD22 ASN 38 HD21 ASN 38 -21.596 2.876 16.062 306 H ILE 39 H ILE 39 -19.886 6.950 11.045 307 HA ILE 39 HA ILE 39 -17.071 7.051 10.320 308 HB ILE 39 HB ILE 39 -19.176 9.211 9.977 309 HG12 ILE 39 HG12 ILE 39 -18.371 6.868 8.187 310 HG13 ILE 39 HG13 ILE 39 -19.967 7.188 8.867 311 HG21 ILE 39 HG21 ILE 39 -17.653 10.141 8.357 312 HG22 ILE 39 HG22 ILE 39 -16.699 9.851 9.795 313 HG23 ILE 39 HG23 ILE 39 -16.587 8.725 8.436 314 HD11 ILE 39 HD11 ILE 39 -20.101 9.265 7.461 315 HD12 ILE 39 HD12 ILE 39 -18.584 8.745 6.664 316 HD13 ILE 39 HD13 ILE 39 -20.037 7.742 6.549 317 H TYR 40 H TYR 40 -15.528 7.826 11.496 318 HA TYR 40 HA TYR 40 -15.963 9.817 13.662 319 HB2 TYR 40 HB2 TYR 40 -14.856 8.566 15.263 320 HB3 TYR 40 HB3 TYR 40 -15.931 7.408 14.521 321 HD1 TYR 40 HD1 TYR 40 -14.850 5.854 12.624 322 HD2 TYR 40 HD2 TYR 40 -12.598 8.039 15.593 323 HE1 TYR 40 HE1 TYR 40 -12.938 4.302 12.325 324 HE2 TYR 40 HE2 TYR 40 -10.730 6.422 15.352 325 HH TYR 40 HH TYR 40 -10.845 3.661 13.056 326 H THR 41 H THR 41 -13.718 10.522 14.541 327 HA THR 41 HA THR 41 -11.940 11.094 12.208 328 HB THR 41 HB THR 41 -11.349 13.194 13.497 329 HG1 THR 41 HG1 THR 41 -12.318 12.664 15.475 330 HG21 THR 41 HG21 THR 41 -12.657 13.343 11.503 331 HG22 THR 41 HG22 THR 41 -14.131 12.787 12.333 332 HG23 THR 41 HG23 THR 41 -13.441 14.372 12.717 333 H GLN 42 H GLN 42 -9.807 10.897 12.353 334 HA GLN 42 HA GLN 42 -8.589 9.990 14.919 335 HB2 GLN 42 HB2 GLN 42 -7.593 8.076 13.752 336 HB3 GLN 42 HB3 GLN 42 -9.358 8.044 13.714 337 HG2 GLN 42 HG2 GLN 42 -9.266 8.983 11.356 338 HG3 GLN 42 HG3 GLN 42 -7.501 8.847 11.422 339 HE21 GLN 42 HE22 GLN 42 -10.198 6.610 12.408 340 HE22 GLN 42 HE21 GLN 42 -9.592 5.303 11.405 341 HA PRO 43 HA PRO 43 -5.303 12.651 13.477 342 HB2 PRO 43 HB2 PRO 43 -3.300 12.030 15.210 343 HB3 PRO 43 HB3 PRO 43 -4.788 12.885 15.722 344 HG2 PRO 43 HG2 PRO 43 -4.175 9.921 15.943 345 HG3 PRO 43 HG3 PRO 43 -4.814 11.019 17.210 346 HD2 PRO 43 HD2 PRO 43 -6.435 9.412 15.702 347 HD3 PRO 43 HD3 PRO 43 -6.954 11.037 16.250 348 H VAL 44 H VAL 44 -3.436 12.619 12.227 349 HA VAL 44 HA VAL 44 -2.648 10.210 10.830 350 HB VAL 44 HB VAL 44 -2.506 12.476 9.879 351 HG11 VAL 44 HG11 VAL 44 -1.624 13.707 11.893 352 HG12 VAL 44 HG12 VAL 44 -0.055 12.938 11.624 353 HG13 VAL 44 HG13 VAL 44 -0.734 14.018 10.390 354 HG21 VAL 44 HG21 VAL 44 0.233 11.176 9.976 355 HG22 VAL 44 HG22 VAL 44 -1.131 10.576 9.013 356 HG23 VAL 44 HG23 VAL 44 -0.449 12.177 8.685 357 H ALA 45 H ALA 45 -0.961 8.814 11.134 358 HA ALA 45 HA ALA 45 0.513 8.929 13.737 359 HB1 ALA 45 HB1 ALA 45 -0.661 6.837 13.135 360 HB2 ALA 45 HB2 ALA 45 0.298 6.718 11.648 361 HB3 ALA 45 HB3 ALA 45 1.105 6.614 13.219 362 H GLN 46 H GLN 46 1.122 8.561 10.225 363 HA GLN 46 HA GLN 46 3.848 9.710 10.477 364 HB2 GLN 46 HB2 GLN 46 3.403 7.009 9.152 365 HB3 GLN 46 HB3 GLN 46 4.918 7.895 9.379 366 HG2 GLN 46 HG2 GLN 46 4.303 7.757 11.929 367 HG3 GLN 46 HG3 GLN 46 3.272 6.408 11.435 368 HE21 GLN 46 HE22 GLN 46 5.378 6.284 13.261 369 HE22 GLN 46 HE21 GLN 46 6.731 5.390 12.561 370 H TRP 47 H TRP 47 4.831 9.557 8.048 371 HA TRP 47 HA TRP 47 2.752 10.226 6.015 372 HB2 TRP 47 HB2 TRP 47 5.173 11.944 6.678 373 HB3 TRP 47 HB3 TRP 47 4.029 12.215 5.379 374 HD1 TRP 47 HD1 TRP 47 1.845 13.534 5.942 375 HE1 TRP 47 HE1 TRP 47 0.936 14.732 8.016 376 HE3 TRP 47 HE3 TRP 47 5.175 11.762 9.411 377 HZ2 TRP 47 HZ2 TRP 47 1.538 14.838 10.835 378 HZ3 TRP 47 HZ3 TRP 47 4.949 12.400 11.802 379 HH2 TRP 47 HH2 TRP 47 3.127 13.932 12.523 380 H HIS 48 H HIS 48 3.163 9.142 4.153 381 HA HIS 48 HA HIS 48 5.940 8.132 3.671 382 HB2 HIS 48 HB2 HIS 48 3.389 6.739 2.824 383 HB3 HIS 48 HB3 HIS 48 5.031 6.138 2.752 384 HD1 HIS 48 HD1 HIS 48 6.168 5.625 5.321 385 HD2 HIS 48 HD2 HIS 48 2.000 6.087 4.927 386 HE1 HIS 48 HE1 HIS 48 5.135 4.594 7.412 387 H ASP 49 H ASP 49 6.829 8.483 1.776 388 HA ASP 49 HA ASP 49 5.246 9.687 -0.446 389 HB2 ASP 49 HB2 ASP 49 7.113 11.163 -0.899 390 HB3 ASP 49 HB3 ASP 49 6.422 11.451 0.686 391 H ARG 50 H ARG 50 5.340 8.637 -2.236 392 HA ARG 50 HA ARG 50 7.108 6.268 -2.527 393 HB2 ARG 50 HB2 ARG 50 4.870 7.387 -4.229 394 HB3 ARG 50 HB3 ARG 50 5.619 5.811 -4.433 395 HG2 ARG 50 HG2 ARG 50 3.977 6.728 -2.015 396 HG3 ARG 50 HG3 ARG 50 3.435 5.638 -3.265 397 HD2 ARG 50 HD2 ARG 50 5.635 5.097 -1.246 398 HD3 ARG 50 HD3 ARG 50 4.013 4.391 -1.278 399 HE ARG 50 HE ARG 50 5.302 3.804 -3.771 400 HH11 ARG 50 HH11 ARG 50 5.717 2.855 -0.423 401 HH12 ARG 50 HH12 ARG 50 6.412 1.318 -0.879 402 HH21 ARG 50 HH21 ARG 50 6.051 1.874 -4.273 403 HH22 ARG 50 HH22 ARG 50 6.623 0.778 -3.030 404 H GLY 51 H GLY 51 6.593 9.382 -4.052 405 HA2 GLY 51 HA2 GLY 51 8.323 10.671 -5.020 406 HA3 GLY 51 HA3 GLY 51 9.243 9.199 -5.318 407 H GLU 52 H GLU 52 7.333 7.675 -6.788 408 HA GLU 52 HA GLU 52 6.515 9.029 -9.207 409 HB2 GLU 52 HB2 GLU 52 8.392 8.283 -10.631 410 HB3 GLU 52 HB3 GLU 52 8.663 9.708 -9.655 411 HG2 GLU 52 HG2 GLU 52 9.971 8.333 -8.015 412 HG3 GLU 52 HG3 GLU 52 9.730 6.919 -9.031 413 H GLN 53 H GLN 53 4.908 7.526 -8.817 414 HA GLN 53 HA GLN 53 5.393 4.875 -10.143 415 HB2 GLN 53 HB2 GLN 53 3.261 5.703 -8.158 416 HB3 GLN 53 HB3 GLN 53 3.536 4.056 -8.790 417 HG2 GLN 53 HG2 GLN 53 5.896 4.198 -7.816 418 HG3 GLN 53 HG3 GLN 53 5.403 5.719 -7.029 419 HE21 GLN 53 HE22 GLN 53 2.872 5.212 -5.963 420 HE22 GLN 53 HE21 GLN 53 3.324 4.200 -4.664 421 H GLU 54 H GLU 54 3.668 3.982 -11.414 422 HA GLU 54 HA GLU 54 2.649 5.797 -13.383 423 HB2 GLU 54 HB2 GLU 54 1.462 3.781 -14.259 424 HB3 GLU 54 HB3 GLU 54 3.206 3.707 -14.193 425 HG2 GLU 54 HG2 GLU 54 1.618 2.479 -11.925 426 HG3 GLU 54 HG3 GLU 54 1.705 1.659 -13.475 427 H VAL 55 H VAL 55 1.146 7.228 -13.024 428 HA VAL 55 HA VAL 55 -1.210 6.640 -11.298 429 HB VAL 55 HB VAL 55 -0.441 9.323 -12.506 430 HG11 VAL 55 HG11 VAL 55 -2.791 9.046 -11.618 431 HG12 VAL 55 HG12 VAL 55 -2.093 8.627 -10.042 432 HG13 VAL 55 HG13 VAL 55 -1.839 10.241 -10.740 433 HG21 VAL 55 HG21 VAL 55 0.426 8.062 -9.884 434 HG22 VAL 55 HG22 VAL 55 1.436 8.805 -11.142 435 HG23 VAL 55 HG23 VAL 55 0.395 9.820 -10.139 436 H PHE 56 H PHE 56 -3.235 6.608 -12.033 437 HA PHE 56 HA PHE 56 -3.808 7.177 -14.918 438 HB2 PHE 56 HB2 PHE 56 -4.853 4.958 -13.149 439 HB3 PHE 56 HB3 PHE 56 -5.483 5.351 -14.738 440 HD1 PHE 56 HD1 PHE 56 -2.365 4.232 -12.947 441 HD2 PHE 56 HD2 PHE 56 -4.500 4.408 -16.692 442 HE1 PHE 56 HE1 PHE 56 -0.664 2.763 -13.982 443 HE2 PHE 56 HE2 PHE 56 -2.808 2.890 -17.712 444 HZ PHE 56 HZ PHE 56 -0.880 2.090 -16.370 445 H GLU 57 H GLU 57 -5.601 8.329 -15.338 446 HA GLU 57 HA GLU 57 -7.106 9.629 -13.158 447 HB2 GLU 57 HB2 GLU 57 -6.417 10.912 -15.121 448 HB3 GLU 57 HB3 GLU 57 -7.210 9.784 -16.196 449 HG2 GLU 57 HG2 GLU 57 -9.148 10.806 -14.273 450 HG3 GLU 57 HG3 GLU 57 -8.235 12.142 -14.948 451 H TYR 58 H TYR 58 -9.014 8.872 -12.459 452 HA TYR 58 HA TYR 58 -10.559 6.880 -14.058 453 HB2 TYR 58 HB2 TYR 58 -10.545 7.248 -11.050 454 HB3 TYR 58 HB3 TYR 58 -11.278 5.959 -11.967 455 HD1 TYR 58 HD1 TYR 58 -9.722 4.294 -13.211 456 HD2 TYR 58 HD2 TYR 58 -8.303 7.157 -10.315 457 HE1 TYR 58 HE1 TYR 58 -7.687 2.904 -12.826 458 HE2 TYR 58 HE2 TYR 58 -6.254 5.799 -9.981 459 HH TYR 58 HH TYR 58 -5.105 3.981 -10.597 460 H CYS 59 H CYS 59 -11.990 8.172 -15.130 461 HA CYS 59 HA CYS 59 -13.359 10.435 -13.851 462 HB2 CYS 59 HB2 CYS 59 -12.734 10.371 -16.279 463 HB3 CYS 59 HB3 CYS 59 -13.883 9.040 -16.509 464 HG CYS 59 HG CYS 59 -14.861 11.351 -17.400 465 H LEU 60 H LEU 60 -15.315 10.365 -12.806 466 HA LEU 60 HA LEU 60 -16.667 7.714 -12.546 467 HB2 LEU 60 HB2 LEU 60 -16.263 10.110 -10.912 468 HB3 LEU 60 HB3 LEU 60 -17.937 9.640 -10.934 469 HG LEU 60 HG LEU 60 -17.513 7.505 -10.011 470 HD11 LEU 60 HD11 LEU 60 -15.437 6.787 -11.080 471 HD12 LEU 60 HD12 LEU 60 -14.522 8.058 -10.245 472 HD13 LEU 60 HD13 LEU 60 -15.258 6.712 -9.335 473 HD21 LEU 60 HD21 LEU 60 -15.646 9.421 -8.562 474 HD22 LEU 60 HD22 LEU 60 -17.407 9.531 -8.508 475 HD23 LEU 60 HD23 LEU 60 -16.597 8.090 -7.862 476 H GLU 61 H GLU 61 -18.985 7.584 -12.503 477 HA GLU 61 HA GLU 61 -20.087 8.449 -15.014 478 HB2 GLU 61 HB2 GLU 61 -21.464 7.235 -12.580 479 HB3 GLU 61 HB3 GLU 61 -22.215 7.484 -14.161 480 HG2 GLU 61 HG2 GLU 61 -20.362 6.064 -15.169 481 HG3 GLU 61 HG3 GLU 61 -19.875 5.657 -13.520 482 H ASP 62 H ASP 62 -20.124 9.973 -11.926 483 HA ASP 62 HA ASP 62 -22.359 11.820 -12.497 484 HB2 ASP 62 HB2 ASP 62 -21.815 11.101 -10.211 485 HB3 ASP 62 HB3 ASP 62 -20.218 11.856 -10.338 486 H GLY 63 H GLY 63 -18.976 11.683 -13.241 487 HA2 GLY 63 HA2 GLY 63 -18.113 13.121 -14.972 488 HA3 GLY 63 HA3 GLY 63 -18.996 14.487 -14.293 489 H SER 64 H SER 64 -17.700 12.863 -11.669 490 HA SER 64 HA SER 64 -15.622 14.847 -11.252 491 HB2 SER 64 HB2 SER 64 -15.435 14.036 -9.109 492 HB3 SER 64 HB3 SER 64 -17.139 13.733 -9.496 493 HG SER 64 HG SER 64 -16.003 11.982 -8.464 494 H LEU 65 H LEU 65 -13.444 14.070 -10.355 495 HA LEU 65 HA LEU 65 -12.206 11.957 -12.069 496 HB2 LEU 65 HB2 LEU 65 -11.255 14.806 -11.579 497 HB3 LEU 65 HB3 LEU 65 -10.272 13.550 -12.327 498 HG LEU 65 HG LEU 65 -12.895 14.561 -13.519 499 HD11 LEU 65 HD11 LEU 65 -11.241 16.374 -13.427 500 HD12 LEU 65 HD12 LEU 65 -10.016 15.323 -14.174 501 HD13 LEU 65 HD13 LEU 65 -11.460 15.812 -15.092 502 HD21 LEU 65 HD21 LEU 65 -10.598 12.943 -14.700 503 HD22 LEU 65 HD22 LEU 65 -12.204 12.303 -14.296 504 HD23 LEU 65 HD23 LEU 65 -12.030 13.503 -15.580 505 H ILE 66 H ILE 66 -10.562 10.858 -11.182 506 HA ILE 66 HA ILE 66 -9.468 11.533 -8.496 507 HB ILE 66 HB ILE 66 -10.394 8.749 -9.325 508 HG12 ILE 66 HG12 ILE 66 -11.761 10.692 -7.416 509 HG13 ILE 66 HG13 ILE 66 -12.391 10.110 -8.957 510 HG21 ILE 66 HG21 ILE 66 -8.452 8.813 -7.752 511 HG22 ILE 66 HG22 ILE 66 -9.424 9.784 -6.625 512 HG23 ILE 66 HG23 ILE 66 -9.870 8.112 -7.015 513 HD11 ILE 66 HD11 ILE 66 -12.440 7.780 -8.032 514 HD12 ILE 66 HD12 ILE 66 -12.044 8.471 -6.433 515 HD13 ILE 66 HD13 ILE 66 -13.539 8.935 -7.250 516 H ARG 67 H ARG 67 -7.246 11.069 -8.373 517 HA ARG 67 HA ARG 67 -5.915 9.865 -10.788 518 HB2 ARG 67 HB2 ARG 67 -4.962 12.353 -9.327 519 HB3 ARG 67 HB3 ARG 67 -4.245 11.597 -10.756 520 HG2 ARG 67 HG2 ARG 67 -6.292 12.223 -12.077 521 HG3 ARG 67 HG3 ARG 67 -6.980 12.943 -10.617 522 HD2 ARG 67 HD2 ARG 67 -6.117 14.832 -11.534 523 HD3 ARG 67 HD3 ARG 67 -4.752 14.321 -10.532 524 HE ARG 67 HE ARG 67 -4.764 13.418 -13.351 525 HH11 ARG 67 HH11 ARG 67 -3.525 15.890 -11.166 526 HH12 ARG 67 HH12 ARG 67 -2.291 16.375 -12.296 527 HH21 ARG 67 HH21 ARG 67 -3.236 14.215 -14.769 528 HH22 ARG 67 HH22 ARG 67 -2.151 15.476 -14.255 529 H ALA 68 H ALA 68 -5.243 7.976 -9.967 530 HA ALA 68 HA ALA 68 -3.380 7.974 -7.657 531 HB1 ALA 68 HB1 ALA 68 -5.638 7.735 -6.676 532 HB2 ALA 68 HB2 ALA 68 -5.938 6.308 -7.690 533 HB3 ALA 68 HB3 ALA 68 -4.670 6.267 -6.456 534 H THR 69 H THR 69 -2.448 5.858 -7.213 535 HA THR 69 HA THR 69 -1.619 4.409 -9.654 536 HB THR 69 HB THR 69 -0.230 3.114 -7.981 537 HG1 THR 69 HG1 THR 69 -1.817 3.851 -6.246 538 HG21 THR 69 HG21 THR 69 0.807 4.961 -9.088 539 HG22 THR 69 HG22 THR 69 0.046 6.141 -8.002 540 HG23 THR 69 HG23 THR 69 1.253 5.004 -7.374 541 H LYS 70 H LYS 70 -1.779 2.138 -9.841 542 HA LYS 70 HA LYS 70 -4.332 0.996 -9.216 543 HB2 LYS 70 HB2 LYS 70 -1.742 -0.040 -10.407 544 HB3 LYS 70 HB3 LYS 70 -2.911 -1.206 -9.834 545 HG2 LYS 70 HG2 LYS 70 -3.468 -1.030 -12.018 546 HG3 LYS 70 HG3 LYS 70 -4.683 -0.010 -11.251 547 HD2 LYS 70 HD2 LYS 70 -3.586 2.003 -11.974 548 HD3 LYS 70 HD3 LYS 70 -2.144 1.122 -12.503 549 HE2 LYS 70 HE2 LYS 70 -4.937 0.719 -13.679 550 HE3 LYS 70 HE3 LYS 70 -3.725 1.801 -14.366 551 HZ1 LYS 70 HZ1 LYS 70 -2.924 0.023 -15.454 552 HZ2 LYS 70 HZ2 LYS 70 -2.437 -0.634 -14.042 553 HZ3 LYS 70 HZ3 LYS 70 -3.900 -1.026 -14.646 554 H ASP 71 H ASP 71 -1.471 1.073 -7.296 555 HA ASP 71 HA ASP 71 -2.082 -1.392 -5.792 556 HB2 ASP 71 HB2 ASP 71 0.107 0.715 -5.607 557 HB3 ASP 71 HB3 ASP 71 -0.027 -0.667 -4.514 558 H HIS 72 H HIS 72 -3.165 1.841 -5.610 559 HA HIS 72 HA HIS 72 -3.247 1.932 -2.659 560 HB2 HIS 72 HB2 HIS 72 -2.952 3.985 -4.140 561 HB3 HIS 72 HB3 HIS 72 -4.591 3.768 -4.703 562 HD1 HIS 72 HD1 HIS 72 -6.118 3.426 -1.841 563 HD2 HIS 72 HD2 HIS 72 -2.853 5.941 -2.565 564 HE1 HIS 72 HE1 HIS 72 -6.031 5.055 0.081 565 H LYS 73 H LYS 73 -5.084 1.236 -1.511 566 HA LYS 73 HA LYS 73 -7.259 -0.092 -3.035 567 HB2 LYS 73 HB2 LYS 73 -6.503 -0.111 -0.092 568 HB3 LYS 73 HB3 LYS 73 -7.900 -0.959 -0.752 569 HG2 LYS 73 HG2 LYS 73 -6.636 -2.558 -1.839 570 HG3 LYS 73 HG3 LYS 73 -5.252 -1.495 -2.074 571 HD2 LYS 73 HD2 LYS 73 -4.749 -1.631 0.360 572 HD3 LYS 73 HD3 LYS 73 -6.043 -2.830 0.554 573 HE2 LYS 73 HE2 LYS 73 -3.947 -3.167 -1.606 574 HE3 LYS 73 HE3 LYS 73 -3.493 -3.519 0.068 575 HZ1 LYS 73 HZ1 LYS 73 -5.264 -5.161 0.178 576 HZ2 LYS 73 HZ2 LYS 73 -5.752 -4.842 -1.349 577 HZ3 LYS 73 HZ3 LYS 73 -4.283 -5.514 -1.076 578 H PHE 74 H PHE 74 -9.486 0.170 -2.312 579 HA PHE 74 HA PHE 74 -10.116 2.784 -1.067 580 HB2 PHE 74 HB2 PHE 74 -11.183 1.901 -3.770 581 HB3 PHE 74 HB3 PHE 74 -11.901 3.156 -2.784 582 HD1 PHE 74 HD2 PHE 74 -8.632 2.294 -4.515 583 HD2 PHE 74 HD1 PHE 74 -11.274 5.386 -3.046 584 HE1 PHE 74 HE2 PHE 74 -7.195 4.017 -5.543 585 HE2 PHE 74 HE1 PHE 74 -9.863 7.095 -4.156 586 HZ PHE 74 HZ PHE 74 -7.801 6.424 -5.372 587 H MET 75 H MET 75 -11.991 2.787 0.106 588 HA MET 75 HA MET 75 -12.929 0.187 1.010 589 HB2 MET 75 HB2 MET 75 -12.645 2.073 2.552 590 HB3 MET 75 HB3 MET 75 -13.883 2.967 1.652 591 HG2 MET 75 HG2 MET 75 -15.540 1.231 2.196 592 HG3 MET 75 HG3 MET 75 -14.331 0.343 3.125 593 HE1 MET 75 HE1 MET 75 -14.026 0.619 5.605 594 HE2 MET 75 HE2 MET 75 -12.916 1.957 5.209 595 HE3 MET 75 HE3 MET 75 -14.155 2.161 6.473 596 H THR 76 H THR 76 -14.219 -0.975 -0.337 597 HA THR 76 HA THR 76 -15.983 0.215 -2.324 598 HB THR 76 HB THR 76 -16.915 -2.061 -2.566 599 HG1 THR 76 HG1 THR 76 -15.935 -3.711 -1.384 600 HG21 THR 76 HG21 THR 76 -14.951 -1.455 -3.836 601 HG22 THR 76 HG22 THR 76 -13.880 -1.930 -2.501 602 HG23 THR 76 HG23 THR 76 -14.852 -3.156 -3.347 603 H VAL 77 H VAL 77 -18.356 -0.188 -2.367 604 HA VAL 77 HA VAL 77 -19.688 0.761 -0.065 605 HB VAL 77 HB VAL 77 -21.801 -0.082 -1.162 606 HG11 VAL 77 HG11 VAL 77 -20.886 2.154 -1.564 607 HG12 VAL 77 HG12 VAL 77 -19.893 1.527 -2.892 608 HG13 VAL 77 HG13 VAL 77 -21.666 1.496 -3.018 609 HG21 VAL 77 HG21 VAL 77 -19.932 -0.967 -3.409 610 HG22 VAL 77 HG22 VAL 77 -20.824 -2.061 -2.336 611 HG23 VAL 77 HG23 VAL 77 -21.701 -0.975 -3.422 612 H ASP 78 H ASP 78 -18.729 -2.512 -0.764 613 HA ASP 78 HA ASP 78 -20.421 -3.774 1.260 614 HB2 ASP 78 HB2 ASP 78 -17.905 -4.762 -0.139 615 HB3 ASP 78 HB3 ASP 78 -19.021 -5.747 0.805 616 H GLY 79 H GLY 79 -17.547 -1.885 1.426 617 HA2 GLY 79 HA2 GLY 79 -16.443 -1.205 3.371 618 HA3 GLY 79 HA3 GLY 79 -17.093 -2.580 4.267 619 H GLN 80 H GLN 80 -15.664 -3.430 1.223 620 HA GLN 80 HA GLN 80 -13.399 -4.772 2.582 621 HB2 GLN 80 HB2 GLN 80 -14.261 -4.820 -0.338 622 HB3 GLN 80 HB3 GLN 80 -13.010 -5.820 0.407 623 HG2 GLN 80 HG2 GLN 80 -14.781 -6.762 1.958 624 HG3 GLN 80 HG3 GLN 80 -15.997 -5.919 0.994 625 HE21 GLN 80 HE22 GLN 80 -16.191 -6.560 -1.364 626 HE22 GLN 80 HE21 GLN 80 -15.669 -8.175 -1.812 627 H MET 81 H MET 81 -11.206 -4.630 1.549 628 HA MET 81 HA MET 81 -10.580 -1.872 0.580 629 HB2 MET 81 HB2 MET 81 -8.559 -1.870 1.878 630 HB3 MET 81 HB3 MET 81 -9.983 -1.962 2.893 631 HG2 MET 81 HG2 MET 81 -8.829 -4.628 2.331 632 HG3 MET 81 HG3 MET 81 -7.676 -3.510 3.026 633 HE1 MET 81 HE1 MET 81 -11.621 -4.483 3.919 634 HE2 MET 81 HE2 MET 81 -10.549 -5.840 3.476 635 HE3 MET 81 HE3 MET 81 -11.095 -5.642 5.152 636 H LEU 82 H LEU 82 -10.689 -2.527 -1.535 637 HA LEU 82 HA LEU 82 -8.636 -4.505 -2.460 638 HB2 LEU 82 HB2 LEU 82 -11.143 -3.614 -3.937 639 HB3 LEU 82 HB3 LEU 82 -10.122 -4.987 -4.312 640 HG LEU 82 HG LEU 82 -11.954 -4.748 -1.883 641 HD11 LEU 82 HD11 LEU 82 -13.147 -5.014 -4.023 642 HD12 LEU 82 HD12 LEU 82 -12.172 -6.454 -4.394 643 HD13 LEU 82 HD13 LEU 82 -13.289 -6.461 -3.008 644 HD21 LEU 82 HD21 LEU 82 -10.311 -7.129 -2.842 645 HD22 LEU 82 HD22 LEU 82 -9.989 -6.180 -1.378 646 HD23 LEU 82 HD23 LEU 82 -11.473 -7.125 -1.501 647 HA PRO 83 HA PRO 83 -6.611 -1.240 -4.671 648 HB2 PRO 83 HB2 PRO 83 -5.561 -2.589 -6.837 649 HB3 PRO 83 HB3 PRO 83 -4.894 -2.668 -5.176 650 HG2 PRO 83 HG2 PRO 83 -6.743 -4.589 -6.594 651 HG3 PRO 83 HG3 PRO 83 -5.313 -4.968 -5.586 652 HD2 PRO 83 HD2 PRO 83 -7.869 -5.122 -4.642 653 HD3 PRO 83 HD3 PRO 83 -6.516 -4.594 -3.600 654 H ILE 84 H ILE 84 -7.023 0.240 -6.306 655 HA ILE 84 HA ILE 84 -9.556 0.211 -7.538 656 HB ILE 84 HB ILE 84 -8.331 2.205 -6.974 657 HG12 ILE 84 HG12 ILE 84 -8.766 2.387 -9.957 658 HG13 ILE 84 HG13 ILE 84 -10.100 1.946 -8.889 659 HG21 ILE 84 HG21 ILE 84 -6.048 1.557 -7.631 660 HG22 ILE 84 HG22 ILE 84 -6.528 1.573 -9.344 661 HG23 ILE 84 HG23 ILE 84 -6.509 3.076 -8.400 662 HD11 ILE 84 HD11 ILE 84 -9.929 3.969 -7.636 663 HD12 ILE 84 HD12 ILE 84 -8.454 4.464 -8.502 664 HD13 ILE 84 HD13 ILE 84 -10.005 4.387 -9.362 665 H ASP 85 H ASP 85 -6.592 -1.142 -8.755 666 HA ASP 85 HA ASP 85 -7.219 -1.544 -11.502 667 HB2 ASP 85 HB2 ASP 85 -5.042 -2.045 -10.278 668 HB3 ASP 85 HB3 ASP 85 -5.808 -3.469 -9.609 669 H GLU 86 H GLU 86 -8.348 -3.210 -8.600 670 HA GLU 86 HA GLU 86 -9.657 -5.414 -10.063 671 HB2 GLU 86 HB2 GLU 86 -8.581 -5.272 -7.558 672 HB3 GLU 86 HB3 GLU 86 -10.227 -4.810 -7.169 673 HG2 GLU 86 HG2 GLU 86 -10.326 -7.080 -6.879 674 HG3 GLU 86 HG3 GLU 86 -10.846 -6.981 -8.556 675 H ILE 87 H ILE 87 -10.522 -2.364 -8.407 676 HA ILE 87 HA ILE 87 -13.348 -2.753 -8.345 677 HB ILE 87 HB ILE 87 -11.694 -0.191 -8.343 678 HG12 ILE 87 HG12 ILE 87 -12.851 -1.749 -5.983 679 HG13 ILE 87 HG13 ILE 87 -11.192 -1.935 -6.525 680 HG21 ILE 87 HG21 ILE 87 -14.043 0.316 -8.852 681 HG22 ILE 87 HG22 ILE 87 -14.581 -0.715 -7.522 682 HG23 ILE 87 HG23 ILE 87 -13.715 0.791 -7.194 683 HD11 ILE 87 HD11 ILE 87 -10.482 -0.147 -5.431 684 HD12 ILE 87 HD12 ILE 87 -11.753 0.890 -6.077 685 HD13 ILE 87 HD13 ILE 87 -12.064 -0.118 -4.635 686 H PHE 88 H PHE 88 -11.220 -1.236 -10.761 687 HA PHE 88 HA PHE 88 -13.274 -0.333 -12.542 688 HB2 PHE 88 HB2 PHE 88 -10.975 0.476 -12.621 689 HB3 PHE 88 HB3 PHE 88 -10.385 -1.130 -13.018 690 HD1 PHE 88 HD1 PHE 88 -12.925 1.364 -14.336 691 HD2 PHE 88 HD2 PHE 88 -9.909 -1.577 -15.261 692 HE1 PHE 88 HE1 PHE 88 -13.133 1.916 -16.740 693 HE2 PHE 88 HE2 PHE 88 -10.123 -1.025 -17.677 694 HZ PHE 88 HZ PHE 88 -11.729 0.728 -18.418 695 H GLU 89 H GLU 89 -11.753 -3.562 -12.220 696 HA GLU 89 HA GLU 89 -12.955 -4.553 -14.710 697 HB2 GLU 89 HB2 GLU 89 -11.458 -5.907 -12.428 698 HB3 GLU 89 HB3 GLU 89 -12.250 -6.817 -13.712 699 HG2 GLU 89 HG2 GLU 89 -10.918 -5.324 -15.368 700 HG3 GLU 89 HG3 GLU 89 -9.923 -4.893 -13.976 701 H ARG 90 H ARG 90 -13.667 -5.196 -11.194 702 HA ARG 90 HA ARG 90 -16.110 -6.619 -11.822 703 HB2 ARG 90 HB2 ARG 90 -14.947 -5.454 -9.252 704 HB3 ARG 90 HB3 ARG 90 -16.481 -6.327 -9.338 705 HG2 ARG 90 HG2 ARG 90 -14.908 -7.885 -8.633 706 HG3 ARG 90 HG3 ARG 90 -15.339 -8.284 -10.306 707 HD2 ARG 90 HD2 ARG 90 -13.228 -7.484 -11.119 708 HD3 ARG 90 HD3 ARG 90 -12.815 -6.830 -9.514 709 HE ARG 90 HE ARG 90 -13.198 -9.456 -8.952 710 HH11 ARG 90 HH11 ARG 90 -11.207 -7.971 -11.429 711 HH12 ARG 90 HH12 ARG 90 -9.996 -9.211 -11.324 712 HH21 ARG 90 HH21 ARG 90 -11.621 -11.017 -8.888 713 HH22 ARG 90 HH22 ARG 90 -10.255 -10.920 -9.967 714 H GLU 91 H GLU 91 -15.443 -3.265 -11.770 715 HA GLU 91 HA GLU 91 -16.689 -1.412 -11.955 716 HB2 GLU 91 HB2 GLU 91 -18.979 -3.205 -12.843 717 HB3 GLU 91 HB3 GLU 91 -18.823 -1.471 -13.090 718 HG2 GLU 91 HG2 GLU 91 -16.713 -1.914 -14.424 719 HG3 GLU 91 HG3 GLU 91 -17.073 -3.638 -14.311 720 H LEU 92 H LEU 92 -16.402 -2.490 -9.425 721 HA LEU 92 HA LEU 92 -18.937 -2.339 -7.947 722 HB2 LEU 92 HB2 LEU 92 -16.022 -2.596 -7.110 723 HB3 LEU 92 HB3 LEU 92 -17.340 -2.494 -5.947 724 HG LEU 92 HG LEU 92 -17.233 -4.628 -8.109 725 HD11 LEU 92 HD11 LEU 92 -15.246 -4.831 -6.667 726 HD12 LEU 92 HD12 LEU 92 -16.286 -4.820 -5.224 727 HD13 LEU 92 HD13 LEU 92 -16.382 -6.159 -6.390 728 HD21 LEU 92 HD21 LEU 92 -18.783 -4.475 -5.490 729 HD22 LEU 92 HD22 LEU 92 -19.471 -4.297 -7.121 730 HD23 LEU 92 HD23 LEU 92 -18.781 -5.843 -6.623 731 H ASP 93 H ASP 93 -19.581 -0.780 -6.515 732 HA ASP 93 HA ASP 93 -18.666 1.974 -7.040 733 HB2 ASP 93 HB2 ASP 93 -20.809 0.904 -5.173 734 HB3 ASP 93 HB3 ASP 93 -20.544 2.597 -5.606 735 H LEU 94 H LEU 94 -18.310 3.471 -5.204 736 HA LEU 94 HA LEU 94 -16.626 2.244 -3.051 737 HB2 LEU 94 HB2 LEU 94 -16.474 4.985 -4.359 738 HB3 LEU 94 HB3 LEU 94 -15.432 4.407 -3.058 739 HG LEU 94 HG LEU 94 -15.573 3.259 -5.884 740 HD11 LEU 94 HD11 LEU 94 -14.447 5.448 -5.717 741 HD12 LEU 94 HD12 LEU 94 -13.371 4.801 -4.462 742 HD13 LEU 94 HD13 LEU 94 -13.313 4.152 -6.115 743 HD21 LEU 94 HD21 LEU 94 -13.963 2.411 -3.447 744 HD22 LEU 94 HD22 LEU 94 -15.030 1.414 -4.460 745 HD23 LEU 94 HD23 LEU 94 -13.501 2.000 -5.112 746 H MET 95 H MET 95 -16.721 2.999 -0.948 747 HA MET 95 HA MET 95 -19.338 4.012 -0.117 748 HB2 MET 95 HB2 MET 95 -17.867 2.282 1.114 749 HB3 MET 95 HB3 MET 95 -16.940 3.668 1.712 750 HG2 MET 95 HG2 MET 95 -19.153 4.645 2.521 751 HG3 MET 95 HG3 MET 95 -19.935 3.146 2.027 752 HE1 MET 95 HE1 MET 95 -19.329 0.731 3.204 753 HE2 MET 95 HE2 MET 95 -17.582 1.021 3.027 754 HE3 MET 95 HE3 MET 95 -18.248 0.604 4.613 755 H ARG 96 H ARG 96 -19.814 6.049 0.717 756 HA ARG 96 HA ARG 96 -17.688 8.143 0.572 757 HB2 ARG 96 HB2 ARG 96 -20.567 8.732 -0.129 758 HB3 ARG 96 HB3 ARG 96 -19.136 9.686 -0.451 759 HG2 ARG 96 HG2 ARG 96 -19.176 8.924 -2.523 760 HG3 ARG 96 HG3 ARG 96 -18.638 7.358 -1.928 761 HD2 ARG 96 HD2 ARG 96 -21.516 8.286 -2.252 762 HD3 ARG 96 HD3 ARG 96 -20.661 7.220 -3.365 763 HE ARG 96 HE ARG 96 -20.544 5.505 -1.677 764 HH11 ARG 96 HH11 ARG 96 -23.087 7.869 -1.087 765 HH12 ARG 96 HH12 ARG 96 -23.644 7.049 0.345 766 HH21 ARG 96 HH21 ARG 96 -21.558 4.369 0.049 767 HH22 ARG 96 HH22 ARG 96 -22.838 5.148 0.920 768 H VAL 97 H VAL 97 -18.359 10.198 1.613 769 HA VAL 97 HA VAL 97 -19.845 9.811 4.195 770 HB VAL 97 HB VAL 97 -17.487 9.942 4.540 771 HG11 VAL 97 HG11 VAL 97 -17.563 12.437 2.880 772 HG12 VAL 97 HG12 VAL 97 -16.439 12.385 4.240 773 HG13 VAL 97 HG13 VAL 97 -16.335 11.157 3.009 774 HG21 VAL 97 HG21 VAL 97 -18.605 12.577 5.519 775 HG22 VAL 97 HG22 VAL 97 -19.031 11.006 6.224 776 HG23 VAL 97 HG23 VAL 97 -17.340 11.559 6.246 777 H ASP 98 H ASP 98 -19.669 11.796 1.346 778 HA ASP 98 HA ASP 98 -21.188 14.030 2.468 779 HB2 ASP 98 HB2 ASP 98 -20.014 13.298 -0.212 780 HB3 ASP 98 HB3 ASP 98 -21.224 14.564 -0.131 781 H ASN 99 H ASN 99 -22.259 11.021 1.878 782 HA ASN 99 HA ASN 99 -24.195 9.992 1.287 783 HB2 ASN 99 HB2 ASN 99 -25.321 12.608 2.337 784 HB3 ASN 99 HB3 ASN 99 -26.358 11.274 1.805 785 HD21 ASN 99 HD22 ASN 99 -23.494 11.852 3.822 786 HD22 ASN 99 HD21 ASN 99 -23.532 10.258 4.434 787 H LEU 100 H LEU 100 -22.702 11.058 -0.639 788 HA LEU 100 HA LEU 100 -24.340 11.907 -2.938 789 HB2 LEU 100 HB2 LEU 100 -21.500 10.891 -2.589 790 HB3 LEU 100 HB3 LEU 100 -22.152 11.103 -4.189 791 HG LEU 100 HG LEU 100 -21.923 13.332 -2.129 792 HD11 LEU 100 HD11 LEU 100 -19.758 12.466 -3.008 793 HD12 LEU 100 HD12 LEU 100 -20.310 12.785 -4.661 794 HD13 LEU 100 HD13 LEU 100 -20.082 14.130 -3.518 795 HD21 LEU 100 HD21 LEU 100 -22.660 13.430 -5.093 796 HD22 LEU 100 HD22 LEU 100 -23.751 13.801 -3.739 797 HD23 LEU 100 HD23 LEU 100 -22.361 14.838 -4.055 798 HA PRO 101 HA PRO 101 -25.746 7.929 -4.347 799 HB2 PRO 101 HB2 PRO 101 -25.606 8.123 -7.084 800 HB3 PRO 101 HB3 PRO 101 -26.813 8.996 -6.090 801 HG2 PRO 101 HG2 PRO 101 -24.195 10.045 -7.192 802 HG3 PRO 101 HG3 PRO 101 -25.808 10.827 -7.229 803 HD2 PRO 101 HD2 PRO 101 -23.923 11.439 -5.356 804 HD3 PRO 101 HD3 PRO 101 -25.650 11.441 -4.944 805 H ASN 102 H ASN 102 -24.989 5.910 -5.043 806 HA ASN 102 HA ASN 102 -22.120 5.493 -4.895 807 HB2 ASN 102 HB2 ASN 102 -24.391 3.577 -5.605 808 HB3 ASN 102 HB3 ASN 102 -22.742 3.111 -5.202 809 HD21 ASN 102 HD22 ASN 102 -21.951 4.114 -2.945 810 HD22 ASN 102 HD21 ASN 102 -23.168 3.972 -1.683 811 H ILE 103 H ILE 103 -20.686 5.573 -6.489 812 HA ILE 103 HA ILE 103 -21.412 5.040 -9.313 813 HB ILE 103 HB ILE 103 -20.080 7.074 -9.982 814 HG12 ILE 103 HG12 ILE 103 -20.601 7.913 -7.092 815 HG13 ILE 103 HG13 ILE 103 -19.045 7.711 -7.884 816 HG21 ILE 103 HG21 ILE 103 -22.562 6.769 -10.186 817 HG22 ILE 103 HG22 ILE 103 -22.748 7.655 -8.657 818 HG23 ILE 103 HG23 ILE 103 -22.041 8.445 -10.082 819 HD11 ILE 103 HD11 ILE 103 -19.725 9.601 -9.456 820 HD12 ILE 103 HD12 ILE 103 -21.151 9.841 -8.410 821 HD13 ILE 103 HD13 ILE 103 -19.539 10.068 -7.748 822 H LYS 104 H LYS 104 -19.993 4.099 -10.482 823 HA LYS 104 HA LYS 104 -17.327 3.427 -9.332 824 HB2 LYS 104 HB2 LYS 104 -17.389 1.398 -10.596 825 HB3 LYS 104 HB3 LYS 104 -18.866 1.564 -9.685 826 HG2 LYS 104 HG2 LYS 104 -19.574 0.683 -11.690 827 HG3 LYS 104 HG3 LYS 104 -19.988 2.385 -11.852 828 HD2 LYS 104 HD2 LYS 104 -18.095 2.738 -13.362 829 HD3 LYS 104 HD3 LYS 104 -17.438 1.139 -12.973 830 HE2 LYS 104 HE2 LYS 104 -18.397 0.769 -15.041 831 HE3 LYS 104 HE3 LYS 104 -19.649 0.198 -13.933 832 HZ1 LYS 104 HZ1 LYS 104 -20.705 2.459 -14.209 833 HZ2 LYS 104 HZ2 LYS 104 -19.608 2.781 -15.389 834 HZ3 LYS 104 HZ3 LYS 104 -20.667 1.560 -15.587 835 H ILE 105 H ILE 105 -15.775 2.803 -11.156 836 HA ILE 105 HA ILE 105 -14.969 5.249 -12.467 837 HB ILE 105 HB ILE 105 -13.904 2.423 -12.662 838 HG12 ILE 105 HG12 ILE 105 -12.776 4.688 -10.962 839 HG13 ILE 105 HG13 ILE 105 -13.965 3.582 -10.320 840 HG21 ILE 105 HG21 ILE 105 -13.118 3.776 -14.560 841 HG22 ILE 105 HG22 ILE 105 -12.687 5.107 -13.481 842 HG23 ILE 105 HG23 ILE 105 -11.797 3.563 -13.423 843 HD11 ILE 105 HD11 ILE 105 -12.503 1.644 -10.898 844 HD12 ILE 105 HD12 ILE 105 -11.211 2.815 -11.279 845 HD13 ILE 105 HD13 ILE 105 -11.926 2.747 -9.647 846 H ALA 106 H ALA 106 -16.063 5.991 -14.124 847 HA ALA 106 HA ALA 106 -17.659 4.408 -15.940 848 HB1 ALA 106 HB1 ALA 106 -18.141 6.772 -15.161 849 HB2 ALA 106 HB2 ALA 106 -16.782 7.331 -16.144 850 HB3 ALA 106 HB3 ALA 106 -18.181 6.569 -16.925 851 H THR 107 H THR 107 -14.523 6.068 -16.147 852 HA THR 107 HA THR 107 -13.543 4.312 -18.277 853 HB THR 107 HB THR 107 -12.660 6.358 -19.571 854 HG1 THR 107 HG1 THR 107 -14.935 7.561 -18.423 855 HG21 THR 107 HG21 THR 107 -14.407 4.837 -20.483 856 HG22 THR 107 HG22 THR 107 -15.656 5.905 -19.803 857 HG23 THR 107 HG23 THR 107 -14.544 6.511 -21.043 858 H ARG 108 H ARG 108 -11.246 4.652 -18.693 859 HA ARG 108 HA ARG 108 -9.716 5.911 -16.454 860 HB2 ARG 108 HB2 ARG 108 -9.817 3.546 -16.010 861 HB3 ARG 108 HB3 ARG 108 -9.409 3.142 -17.684 862 HG2 ARG 108 HG2 ARG 108 -7.145 4.042 -17.402 863 HG3 ARG 108 HG3 ARG 108 -7.532 4.578 -15.761 864 HD2 ARG 108 HD2 ARG 108 -6.971 2.585 -14.935 865 HD3 ARG 108 HD3 ARG 108 -8.187 1.789 -15.950 866 HE ARG 108 HE ARG 108 -5.643 2.455 -17.293 867 HH11 ARG 108 HH11 ARG 108 -7.371 -0.098 -15.612 868 HH12 ARG 108 HH12 ARG 108 -6.353 -1.343 -16.284 869 HH21 ARG 108 HH21 ARG 108 -4.388 0.820 -18.100 870 HH22 ARG 108 HH22 ARG 108 -4.723 -0.831 -17.667 871 H LYS 109 H LYS 109 -7.821 6.932 -16.997 872 HA LYS 109 HA LYS 109 -6.773 6.765 -19.794 873 HB2 LYS 109 HB2 LYS 109 -8.544 8.550 -19.569 874 HB3 LYS 109 HB3 LYS 109 -7.514 9.392 -18.422 875 HG2 LYS 109 HG2 LYS 109 -5.798 9.732 -20.115 876 HG3 LYS 109 HG3 LYS 109 -6.663 8.706 -21.271 877 HD2 LYS 109 HD2 LYS 109 -7.760 11.318 -20.129 878 HD3 LYS 109 HD3 LYS 109 -6.926 11.168 -21.685 879 HE2 LYS 109 HE2 LYS 109 -8.662 9.552 -22.459 880 HE3 LYS 109 HE3 LYS 109 -9.524 9.751 -20.928 881 HZ1 LYS 109 HZ1 LYS 109 -9.827 12.103 -21.469 882 HZ2 LYS 109 HZ2 LYS 109 -9.028 11.929 -22.885 883 HZ3 LYS 109 HZ3 LYS 109 -10.452 11.173 -22.653 884 H TYR 110 H TYR 110 -4.641 6.328 -19.620 885 HA TYR 110 HA TYR 110 -3.188 6.566 -17.160 886 HB2 TYR 110 HB2 TYR 110 -2.621 4.923 -18.911 887 HB3 TYR 110 HB3 TYR 110 -2.189 6.221 -20.009 888 HD1 TYR 110 HD2 TYR 110 -1.315 5.765 -16.344 889 HD2 TYR 110 HD1 TYR 110 0.128 5.971 -20.408 890 HE1 TYR 110 HE2 TYR 110 1.008 5.752 -15.517 891 HE2 TYR 110 HE1 TYR 110 2.464 5.861 -19.573 892 HH TYR 110 HH TYR 110 3.814 5.708 -17.740 893 H LEU 111 H LEU 111 -2.101 8.250 -16.239 894 HA LEU 111 HA LEU 111 -2.021 10.827 -17.728 895 HB2 LEU 111 HB2 LEU 111 -1.524 10.069 -14.816 896 HB3 LEU 111 HB3 LEU 111 -1.481 11.705 -15.461 897 HG LEU 111 HG LEU 111 -3.939 9.963 -15.632 898 HD11 LEU 111 HD11 LEU 111 -3.438 10.181 -13.344 899 HD12 LEU 111 HD12 LEU 111 -3.080 11.911 -13.479 900 HD13 LEU 111 HD13 LEU 111 -4.755 11.287 -13.680 901 HD21 LEU 111 HD21 LEU 111 -3.300 12.856 -16.250 902 HD22 LEU 111 HD22 LEU 111 -4.196 11.665 -17.205 903 HD23 LEU 111 HD23 LEU 111 -4.950 12.393 -15.786 904 H GLY 112 H GLY 112 0.152 8.590 -16.003 905 HA2 GLY 112 HA2 GLY 112 2.429 8.492 -17.280 906 HA3 GLY 112 HA3 GLY 112 2.548 10.184 -16.793 907 H LYS 113 H LYS 113 4.277 9.954 -15.456 908 HA LYS 113 HA LYS 113 4.131 8.058 -13.134 909 HB2 LYS 113 HB2 LYS 113 5.747 7.546 -15.047 910 HB3 LYS 113 HB3 LYS 113 6.640 8.978 -14.501 911 HG2 LYS 113 HG2 LYS 113 6.647 7.893 -12.147 912 HG3 LYS 113 HG3 LYS 113 6.024 6.442 -12.920 913 HD2 LYS 113 HD2 LYS 113 8.405 6.217 -12.642 914 HD3 LYS 113 HD3 LYS 113 8.075 6.384 -14.377 915 HE2 LYS 113 HE2 LYS 113 8.720 8.788 -14.272 916 HE3 LYS 113 HE3 LYS 113 8.947 8.660 -12.527 917 HZ1 LYS 113 HZ1 LYS 113 10.699 6.970 -13.007 918 HZ2 LYS 113 HZ2 LYS 113 10.581 7.322 -14.609 919 HZ3 LYS 113 HZ3 LYS 113 11.069 8.454 -13.535 920 H GLN 114 H GLN 114 3.050 9.854 -12.183 921 HA GLN 114 HA GLN 114 4.460 12.299 -11.570 922 HB2 GLN 114 HB2 GLN 114 1.732 11.569 -10.533 923 HB3 GLN 114 HB3 GLN 114 2.430 13.160 -10.905 924 HG2 GLN 114 HG2 GLN 114 2.748 12.248 -13.313 925 HG3 GLN 114 HG3 GLN 114 1.632 10.954 -12.839 926 HE21 GLN 114 HE22 GLN 114 1.081 12.202 -14.960 927 HE22 GLN 114 HE21 GLN 114 -0.163 13.380 -14.711 928 H ASN 115 H ASN 115 4.754 13.155 -9.389 929 HA ASN 115 HA ASN 115 5.574 11.364 -7.369 930 HB2 ASN 115 HB2 ASN 115 6.131 13.934 -7.952 931 HB3 ASN 115 HB3 ASN 115 4.826 14.241 -6.799 932 HD21 ASN 115 HD22 ASN 115 5.207 12.193 -4.898 933 HD22 ASN 115 HD21 ASN 115 6.873 12.196 -4.393 934 H VAL 116 H VAL 116 4.288 10.126 -6.147 935 HA VAL 116 HA VAL 116 1.646 11.224 -5.271 936 HB VAL 116 HB VAL 116 0.854 8.874 -5.234 937 HG11 VAL 116 HG11 VAL 116 0.294 10.392 -7.107 938 HG12 VAL 116 HG12 VAL 116 1.708 9.804 -7.991 939 HG13 VAL 116 HG13 VAL 116 0.374 8.700 -7.586 940 HG21 VAL 116 HG21 VAL 116 3.296 8.252 -6.962 941 HG22 VAL 116 HG22 VAL 116 3.064 7.713 -5.286 942 HG23 VAL 116 HG23 VAL 116 1.955 7.166 -6.552 943 H TYR 117 H TYR 117 0.864 10.693 -3.279 944 HA TYR 117 HA TYR 117 2.880 10.001 -1.177 945 HB2 TYR 117 HB2 TYR 117 0.940 12.325 -1.061 946 HB3 TYR 117 HB3 TYR 117 2.287 11.987 -0.003 947 HD1 TYR 117 HD2 TYR 117 1.265 13.304 -3.289 948 HD2 TYR 117 HD1 TYR 117 4.588 12.623 -0.624 949 HE1 TYR 117 HE2 TYR 117 2.659 14.874 -4.622 950 HE2 TYR 117 HE1 TYR 117 5.965 14.239 -1.928 951 HH TYR 117 HH TYR 117 4.651 15.995 -4.756 952 H ASP 118 H ASP 118 1.946 9.495 0.935 953 HA ASP 118 HA ASP 118 -0.920 8.857 1.158 954 HB2 ASP 118 HB2 ASP 118 -0.197 6.954 -0.101 955 HB3 ASP 118 HB3 ASP 118 1.261 6.760 0.881 956 H ILE 119 H ILE 119 -1.435 9.395 3.226 957 HA ILE 119 HA ILE 119 0.638 9.710 5.268 958 HB ILE 119 HB ILE 119 -1.292 10.242 6.759 959 HG12 ILE 119 HG12 ILE 119 -3.006 10.384 4.251 960 HG13 ILE 119 HG13 ILE 119 -3.001 8.955 5.290 961 HG21 ILE 119 HG21 ILE 119 0.023 11.963 5.797 962 HG22 ILE 119 HG22 ILE 119 -0.719 11.792 4.202 963 HG23 ILE 119 HG23 ILE 119 -1.652 12.475 5.552 964 HD11 ILE 119 HD11 ILE 119 -3.679 10.319 7.231 965 HD12 ILE 119 HD12 ILE 119 -3.758 11.759 6.186 966 HD13 ILE 119 HD13 ILE 119 -4.845 10.385 5.897 967 H GLY 120 H GLY 120 0.816 8.628 7.207 968 HA2 GLY 120 HA2 GLY 120 0.018 5.753 7.129 969 HA3 GLY 120 HA3 GLY 120 1.362 6.437 8.042 970 H VAL 121 H VAL 121 -0.791 4.759 8.985 971 HA VAL 121 HA VAL 121 -1.996 6.410 11.158 972 HB VAL 121 HB VAL 121 -3.545 4.553 9.353 973 HG11 VAL 121 HG11 VAL 121 -4.455 4.758 11.680 974 HG12 VAL 121 HG12 VAL 121 -4.561 6.523 11.460 975 HG13 VAL 121 HG13 VAL 121 -5.530 5.404 10.465 976 HG21 VAL 121 HG21 VAL 121 -3.647 7.586 9.348 977 HG22 VAL 121 HG22 VAL 121 -3.136 6.527 8.009 978 HG23 VAL 121 HG23 VAL 121 -4.813 6.514 8.535 979 H GLU 122 H GLU 122 -2.398 5.184 13.040 980 HA GLU 122 HA GLU 122 -1.256 2.421 13.067 981 HB2 GLU 122 HB2 GLU 122 -0.277 4.261 14.499 982 HB3 GLU 122 HB3 GLU 122 -1.811 4.332 15.355 983 HG2 GLU 122 HG2 GLU 122 -0.433 3.052 16.722 984 HG3 GLU 122 HG3 GLU 122 -1.476 1.866 15.962 985 H ARG 123 H ARG 123 -4.162 4.205 14.264 986 HA ARG 123 HA ARG 123 -5.404 1.869 15.428 987 HB2 ARG 123 HB2 ARG 123 -5.958 4.091 16.224 988 HB3 ARG 123 HB3 ARG 123 -6.533 4.591 14.621 989 HG2 ARG 123 HG2 ARG 123 -8.389 3.040 14.714 990 HG3 ARG 123 HG3 ARG 123 -7.758 2.282 16.183 991 HD2 ARG 123 HD2 ARG 123 -8.234 4.333 17.463 992 HD3 ARG 123 HD3 ARG 123 -8.726 5.158 15.978 993 HE ARG 123 HE ARG 123 -10.743 4.008 15.938 994 HH11 ARG 123 HH11 ARG 123 -8.764 2.453 18.385 995 HH12 ARG 123 HH12 ARG 123 -10.042 1.360 18.847 996 HH21 ARG 123 HH21 ARG 123 -12.342 2.572 16.575 997 HH22 ARG 123 HH22 ARG 123 -12.010 1.480 17.890 998 H ASP 124 H ASP 124 -5.857 3.463 12.321 999 HA ASP 124 HA ASP 124 -7.331 1.129 11.228 1000 HB2 ASP 124 HB2 ASP 124 -8.459 3.735 11.849 1001 HB3 ASP 124 HB3 ASP 124 -8.465 3.539 10.112 1002 H HIS 125 H HIS 125 -7.702 1.965 8.632 1003 HA HIS 125 HA HIS 125 -5.017 2.787 7.645 1004 HB2 HIS 125 HB2 HIS 125 -6.351 0.135 6.925 1005 HB3 HIS 125 HB3 HIS 125 -4.827 0.743 6.287 1006 HD1 HIS 125 HD1 HIS 125 -2.718 0.801 8.102 1007 HD2 HIS 125 HD2 HIS 125 -6.255 -1.184 9.229 1008 HE1 HIS 125 HE1 HIS 125 -2.118 -0.630 10.127 1009 H ASN 126 H ASN 126 -7.381 4.306 7.459 1010 HA ASN 126 HA ASN 126 -7.721 4.629 4.580 1011 HB2 ASN 126 HB2 ASN 126 -10.149 4.112 4.580 1012 HB3 ASN 126 HB3 ASN 126 -9.212 2.693 4.998 1013 HD21 ASN 126 HD22 ASN 126 -11.602 4.962 6.119 1014 HD22 ASN 126 HD21 ASN 126 -11.669 4.336 7.768 1015 H PHE 127 H PHE 127 -9.182 6.394 3.983 1016 HA PHE 127 HA PHE 127 -9.974 8.346 6.001 1017 HB2 PHE 127 HB2 PHE 127 -8.452 10.135 5.124 1018 HB3 PHE 127 HB3 PHE 127 -7.676 8.884 6.069 1019 HD1 PHE 127 HD1 PHE 127 -8.235 10.065 2.561 1020 HD2 PHE 127 HD2 PHE 127 -5.854 7.615 5.195 1021 HE1 PHE 127 HE1 PHE 127 -6.611 9.672 0.736 1022 HE2 PHE 127 HE2 PHE 127 -4.214 7.247 3.359 1023 HZ PHE 127 HZ PHE 127 -4.601 8.256 1.126 1024 H ALA 128 H ALA 128 -11.204 10.106 5.154 1025 HA ALA 128 HA ALA 128 -12.556 9.605 2.632 1026 HB1 ALA 128 HB1 ALA 128 -13.748 10.411 4.648 1027 HB2 ALA 128 HB2 ALA 128 -12.782 11.909 4.614 1028 HB3 ALA 128 HB3 ALA 128 -13.915 11.549 3.301 1029 H LEU 129 H LEU 129 -12.432 10.645 0.734 1030 HA LEU 129 HA LEU 129 -10.351 12.690 0.196 1031 HB2 LEU 129 HB2 LEU 129 -12.248 11.190 -1.654 1032 HB3 LEU 129 HB3 LEU 129 -10.927 12.244 -2.156 1033 HG LEU 129 HG LEU 129 -10.620 9.575 -0.713 1034 HD11 LEU 129 HD11 LEU 129 -11.256 9.460 -3.126 1035 HD12 LEU 129 HD12 LEU 129 -9.852 10.465 -3.524 1036 HD13 LEU 129 HD13 LEU 129 -9.623 8.858 -2.817 1037 HD21 LEU 129 HD21 LEU 129 -8.505 11.533 -1.637 1038 HD22 LEU 129 HD22 LEU 129 -8.843 10.982 0.028 1039 HD23 LEU 129 HD23 LEU 129 -8.213 9.840 -1.159 1040 H LYS 130 H LYS 130 -11.040 14.326 -1.542 1041 HA LYS 130 HA LYS 130 -12.559 16.366 -0.586 1042 HB2 LYS 130 HB2 LYS 130 -10.993 16.477 -2.490 1043 HB3 LYS 130 HB3 LYS 130 -12.116 15.579 -3.493 1044 HG2 LYS 130 HG2 LYS 130 -13.779 17.474 -3.253 1045 HG3 LYS 130 HG3 LYS 130 -12.533 18.378 -2.371 1046 HD2 LYS 130 HD2 LYS 130 -11.058 18.252 -4.379 1047 HD3 LYS 130 HD3 LYS 130 -12.271 17.268 -5.205 1048 HE2 LYS 130 HE2 LYS 130 -12.472 19.485 -6.051 1049 HE3 LYS 130 HE3 LYS 130 -13.903 19.152 -5.072 1050 HZ1 LYS 130 HZ1 LYS 130 -12.975 20.495 -3.310 1051 HZ2 LYS 130 HZ2 LYS 130 -11.521 20.631 -4.066 1052 HZ3 LYS 130 HZ3 LYS 130 -12.856 21.375 -4.681 1053 H ASN 131 H ASN 131 -13.860 14.217 -3.117 1054 HA ASN 131 HA ASN 131 -16.553 15.307 -2.915 1055 HB2 ASN 131 HB2 ASN 131 -15.321 12.885 -4.283 1056 HB3 ASN 131 HB3 ASN 131 -17.048 13.224 -4.361 1057 HD21 ASN 131 HD22 ASN 131 -14.152 13.764 -6.002 1058 HD22 ASN 131 HD21 ASN 131 -14.681 15.166 -6.916 1059 H GLY 132 H GLY 132 -14.843 12.895 -1.133 1060 HA2 GLY 132 HA2 GLY 132 -15.809 12.416 1.035 1061 HA3 GLY 132 HA3 GLY 132 -17.351 12.047 0.261 1062 H PHE 133 H PHE 133 -15.114 10.642 -1.792 1063 HA PHE 133 HA PHE 133 -15.828 7.998 -1.021 1064 HB2 PHE 133 HB2 PHE 133 -13.403 8.805 -2.652 1065 HB3 PHE 133 HB3 PHE 133 -14.233 7.256 -2.684 1066 HD1 PHE 133 HD1 PHE 133 -16.820 7.368 -3.314 1067 HD2 PHE 133 HD2 PHE 133 -13.907 10.383 -4.322 1068 HE1 PHE 133 HE1 PHE 133 -18.382 8.314 -5.006 1069 HE2 PHE 133 HE2 PHE 133 -15.449 11.288 -6.046 1070 HZ PHE 133 HZ PHE 133 -17.714 10.312 -6.324 1071 H ILE 134 H ILE 134 -14.865 6.476 0.353 1072 HA ILE 134 HA ILE 134 -12.546 7.400 1.960 1073 HB ILE 134 HB ILE 134 -14.263 4.932 2.257 1074 HG12 ILE 134 HG12 ILE 134 -14.732 6.005 4.531 1075 HG13 ILE 134 HG13 ILE 134 -14.102 7.510 3.858 1076 HG21 ILE 134 HG21 ILE 134 -11.932 4.458 2.972 1077 HG22 ILE 134 HG22 ILE 134 -11.936 5.941 3.954 1078 HG23 ILE 134 HG23 ILE 134 -12.997 4.568 4.361 1079 HD11 ILE 134 HD11 ILE 134 -15.960 7.495 2.207 1080 HD12 ILE 134 HD12 ILE 134 -16.491 5.912 2.820 1081 HD13 ILE 134 HD13 ILE 134 -16.580 7.353 3.850 1082 H ALA 135 H ALA 135 -10.546 6.996 1.380 1083 HA ALA 135 HA ALA 135 -9.875 4.816 -0.539 1084 HB1 ALA 135 HB1 ALA 135 -9.225 7.160 -1.128 1085 HB2 ALA 135 HB2 ALA 135 -8.235 7.220 0.348 1086 HB3 ALA 135 HB3 ALA 135 -7.853 6.067 -0.954 1087 H SER 136 H SER 136 -8.078 3.404 0.080 1088 HA SER 136 HA SER 136 -7.465 3.286 2.986 1089 HB2 SER 136 HB2 SER 136 -7.992 0.851 2.956 1090 HB3 SER 136 HB3 SER 136 -9.377 1.930 2.783 1091 HG SER 136 HG SER 136 -9.574 0.287 1.325 1092 H ASN 137 H ASN 137 -5.637 2.152 3.617 1093 HA ASN 137 HA ASN 137 -3.544 1.975 1.487 1094 HB2 ASN 137 HB2 ASN 137 -2.064 3.224 2.949 1095 HB3 ASN 137 HB3 ASN 137 -3.515 4.138 2.615 1096 HD21 ASN 137 HD22 ASN 137 -4.418 5.127 4.367 1097 HD22 ASN 137 HD21 ASN 137 -4.078 4.686 6.031 Start of MODEL 10 1 H1 GLY -1 H GLY -1 4.359 -1.166 -1.677 2 HA2 GLY -1 HA2 GLY -1 2.060 -0.508 -1.591 3 HA3 GLY -1 HA3 GLY -1 3.132 0.830 -1.139 4 H GLY 0 H GLY 0 0.756 1.645 -1.792 5 HA2 GLY 0 HA2 GLY 0 0.838 2.798 -4.532 6 HA3 GLY 0 HA3 GLY 0 -0.637 2.249 -3.754 7 H ALA 1 H ALA 1 -0.724 4.716 -4.491 8 HA ALA 1 HA ALA 1 -0.926 6.424 -2.184 9 HB1 ALA 1 HB1 ALA 1 1.454 6.539 -2.242 10 HB2 ALA 1 HB2 ALA 1 1.487 6.667 -4.020 11 HB3 ALA 1 HB3 ALA 1 0.901 8.005 -3.020 12 H LEU 2 H LEU 2 -1.209 8.741 -2.887 13 HA LEU 2 HA LEU 2 -3.070 8.916 -5.229 14 HB2 LEU 2 HB2 LEU 2 -3.082 10.280 -2.501 15 HB3 LEU 2 HB3 LEU 2 -4.292 10.498 -3.754 16 HG LEU 2 HG LEU 2 -3.749 7.812 -2.414 17 HD11 LEU 2 HD11 LEU 2 -4.506 9.439 -0.752 18 HD12 LEU 2 HD12 LEU 2 -5.936 9.803 -1.739 19 HD13 LEU 2 HD13 LEU 2 -5.703 8.181 -1.067 20 HD21 LEU 2 HD21 LEU 2 -6.018 8.849 -4.169 21 HD22 LEU 2 HD22 LEU 2 -4.845 7.558 -4.538 22 HD23 LEU 2 HD23 LEU 2 -6.051 7.319 -3.273 23 H SER 3 H SER 3 -3.189 10.980 -6.353 24 HA SER 3 HA SER 3 -0.578 12.260 -6.649 25 HB2 SER 3 HB2 SER 3 -2.257 11.725 -8.498 26 HB3 SER 3 HB3 SER 3 -3.225 13.080 -7.881 27 HG SER 3 HG SER 3 -2.039 14.141 -9.206 28 H TYR 4 H TYR 4 -0.336 14.663 -6.674 29 HA TYR 4 HA TYR 4 -0.539 15.663 -4.059 30 HB2 TYR 4 HB2 TYR 4 1.031 16.519 -5.730 31 HB3 TYR 4 HB3 TYR 4 -0.280 17.146 -6.705 32 HD1 TYR 4 HD2 TYR 4 -1.502 19.183 -6.059 33 HD2 TYR 4 HD1 TYR 4 1.789 17.692 -3.709 34 HE1 TYR 4 HE2 TYR 4 -1.397 21.350 -4.842 35 HE2 TYR 4 HE1 TYR 4 1.888 19.864 -2.475 36 HH TYR 4 HH TYR 4 -0.334 22.564 -3.240 37 H GLU 5 H GLU 5 -2.590 16.484 -6.824 38 HA GLU 5 HA GLU 5 -4.324 18.314 -5.528 39 HB2 GLU 5 HB2 GLU 5 -5.672 18.098 -7.561 40 HB3 GLU 5 HB3 GLU 5 -3.976 18.341 -7.911 41 HG2 GLU 5 HG2 GLU 5 -5.168 15.541 -7.905 42 HG3 GLU 5 HG3 GLU 5 -5.396 16.616 -9.279 43 H THR 6 H THR 6 -4.221 15.092 -4.748 44 HA THR 6 HA THR 6 -7.080 14.533 -4.550 45 HB THR 6 HB THR 6 -4.823 13.118 -3.102 46 HG1 THR 6 HG1 THR 6 -4.329 12.952 -5.134 47 HG21 THR 6 HG21 THR 6 -6.966 12.497 -2.214 48 HG22 THR 6 HG22 THR 6 -7.683 12.372 -3.845 49 HG23 THR 6 HG23 THR 6 -6.449 11.216 -3.317 50 H GLU 7 H GLU 7 -8.241 15.879 -3.247 51 HA GLU 7 HA GLU 7 -7.019 17.082 -0.886 52 HB2 GLU 7 HB2 GLU 7 -9.880 17.358 -1.835 53 HB3 GLU 7 HB3 GLU 7 -9.022 18.387 -0.686 54 HG2 GLU 7 HG2 GLU 7 -7.349 18.919 -2.540 55 HG3 GLU 7 HG3 GLU 7 -8.432 18.097 -3.660 56 H ILE 8 H ILE 8 -7.220 16.551 1.136 57 HA ILE 8 HA ILE 8 -8.993 14.286 1.969 58 HB ILE 8 HB ILE 8 -6.402 15.230 3.261 59 HG12 ILE 8 HG12 ILE 8 -5.699 14.424 1.147 60 HG13 ILE 8 HG13 ILE 8 -5.300 13.218 2.356 61 HG21 ILE 8 HG21 ILE 8 -7.865 14.065 4.811 62 HG22 ILE 8 HG22 ILE 8 -8.092 12.725 3.670 63 HG23 ILE 8 HG23 ILE 8 -6.502 13.016 4.403 64 HD11 ILE 8 HD11 ILE 8 -6.120 12.112 0.352 65 HD12 ILE 8 HD12 ILE 8 -7.329 11.892 1.630 66 HD13 ILE 8 HD13 ILE 8 -7.591 13.090 0.354 67 H LEU 9 H LEU 9 -10.646 14.969 3.165 68 HA LEU 9 HA LEU 9 -10.879 17.504 4.468 69 HB2 LEU 9 HB2 LEU 9 -12.760 15.963 3.784 70 HB3 LEU 9 HB3 LEU 9 -12.274 14.863 5.070 71 HG LEU 9 HG LEU 9 -12.694 16.788 6.711 72 HD11 LEU 9 HD11 LEU 9 -12.695 18.672 5.096 73 HD12 LEU 9 HD12 LEU 9 -14.156 17.994 4.335 74 HD13 LEU 9 HD13 LEU 9 -14.205 18.573 6.008 75 HD21 LEU 9 HD21 LEU 9 -15.043 15.773 5.040 76 HD22 LEU 9 HD22 LEU 9 -14.277 14.902 6.385 77 HD23 LEU 9 HD23 LEU 9 -15.142 16.411 6.698 78 H THR 10 H THR 10 -9.962 18.229 6.326 79 HA THR 10 HA THR 10 -9.168 16.297 8.457 80 HB THR 10 HB THR 10 -7.258 17.629 8.991 81 HG1 THR 10 HG1 THR 10 -6.783 19.386 7.425 82 HG21 THR 10 HG21 THR 10 -5.908 17.573 6.896 83 HG22 THR 10 HG22 THR 10 -6.830 16.081 7.207 84 HG23 THR 10 HG23 THR 10 -7.402 17.260 6.006 85 H VAL 11 H VAL 11 -9.343 16.947 10.618 86 HA VAL 11 HA VAL 11 -11.419 18.907 11.218 87 HB VAL 11 HB VAL 11 -9.564 17.464 13.141 88 HG11 VAL 11 HG11 VAL 11 -10.696 19.329 14.252 89 HG12 VAL 11 HG12 VAL 11 -12.264 18.811 13.588 90 HG13 VAL 11 HG13 VAL 11 -11.409 17.811 14.785 91 HG21 VAL 11 HG21 VAL 11 -12.356 16.678 12.198 92 HG22 VAL 11 HG22 VAL 11 -10.862 15.818 11.786 93 HG23 VAL 11 HG23 VAL 11 -11.418 15.862 13.462 94 H GLU 12 H GLU 12 -7.890 18.974 11.270 95 HA GLU 12 HA GLU 12 -7.571 21.364 12.815 96 HB2 GLU 12 HB2 GLU 12 -5.907 19.827 10.824 97 HB3 GLU 12 HB3 GLU 12 -5.336 21.406 11.377 98 HG2 GLU 12 HG2 GLU 12 -5.964 19.043 13.190 99 HG3 GLU 12 HG3 GLU 12 -4.361 19.579 12.689 100 H TYR 13 H TYR 13 -8.183 20.971 9.322 101 HA TYR 13 HA TYR 13 -8.501 23.937 9.125 102 HB2 TYR 13 HB2 TYR 13 -6.810 22.227 7.265 103 HB3 TYR 13 HB3 TYR 13 -7.300 23.889 6.955 104 HD1 TYR 13 HD1 TYR 13 -6.680 25.673 8.777 105 HD2 TYR 13 HD2 TYR 13 -4.676 21.886 8.245 106 HE1 TYR 13 HE1 TYR 13 -4.643 26.600 9.866 107 HE2 TYR 13 HE2 TYR 13 -2.633 22.817 9.330 108 HH TYR 13 HH TYR 13 -2.501 26.193 10.517 109 H GLY 14 H GLY 14 -8.936 20.835 7.266 110 HA2 GLY 14 HA2 GLY 14 -11.435 20.650 6.546 111 HA3 GLY 14 HA3 GLY 14 -11.125 22.180 5.732 112 H LEU 15 H LEU 15 -11.142 21.695 3.653 113 HA LEU 15 HA LEU 15 -10.179 19.161 2.523 114 HB2 LEU 15 HB2 LEU 15 -11.323 21.705 1.280 115 HB3 LEU 15 HB3 LEU 15 -11.087 20.177 0.439 116 HG LEU 15 HG LEU 15 -12.968 20.550 2.835 117 HD11 LEU 15 HD11 LEU 15 -13.688 21.890 0.930 118 HD12 LEU 15 HD12 LEU 15 -13.543 20.481 -0.136 119 HD13 LEU 15 HD13 LEU 15 -14.762 20.495 1.165 120 HD21 LEU 15 HD21 LEU 15 -12.525 18.296 0.851 121 HD22 LEU 15 HD22 LEU 15 -12.267 18.232 2.598 122 HD23 LEU 15 HD23 LEU 15 -13.913 18.386 1.960 123 H LEU 16 H LEU 16 -7.963 19.068 2.665 124 HA LEU 16 HA LEU 16 -6.370 21.123 1.170 125 HB2 LEU 16 HB2 LEU 16 -5.862 19.780 3.843 126 HB3 LEU 16 HB3 LEU 16 -4.524 20.340 2.871 127 HG LEU 16 HG LEU 16 -4.966 21.920 4.567 128 HD11 LEU 16 HD11 LEU 16 -4.198 22.807 2.392 129 HD12 LEU 16 HD12 LEU 16 -5.891 23.130 1.933 130 HD13 LEU 16 HD13 LEU 16 -5.154 23.980 3.299 131 HD21 LEU 16 HD21 LEU 16 -7.730 22.478 3.474 132 HD22 LEU 16 HD22 LEU 16 -7.382 21.522 4.933 133 HD23 LEU 16 HD23 LEU 16 -6.925 23.237 4.835 134 HA PRO 17 HA PRO 17 -4.785 17.804 -1.309 135 HB2 PRO 17 HB2 PRO 17 -2.328 18.797 -2.070 136 HB3 PRO 17 HB3 PRO 17 -3.896 19.378 -2.709 137 HG2 PRO 17 HG2 PRO 17 -2.195 20.572 -0.514 138 HG3 PRO 17 HG3 PRO 17 -2.992 21.410 -1.881 139 HD2 PRO 17 HD2 PRO 17 -4.070 21.338 0.613 140 HD3 PRO 17 HD3 PRO 17 -5.105 21.266 -0.845 141 H ILE 18 H ILE 18 -3.973 15.863 -0.817 142 HA ILE 18 HA ILE 18 -2.594 15.250 1.546 143 HB ILE 18 HB ILE 18 -3.875 13.660 0.140 144 HG12 ILE 18 HG12 ILE 18 -1.075 12.652 0.780 145 HG13 ILE 18 HG13 ILE 18 -2.301 13.015 2.002 146 HG21 ILE 18 HG21 ILE 18 -2.876 14.260 -2.083 147 HG22 ILE 18 HG22 ILE 18 -1.398 13.401 -1.607 148 HG23 ILE 18 HG23 ILE 18 -2.927 12.529 -1.756 149 HD11 ILE 18 HD11 ILE 18 -3.821 11.330 0.969 150 HD12 ILE 18 HD12 ILE 18 -2.520 10.886 -0.161 151 HD13 ILE 18 HD13 ILE 18 -2.304 10.644 1.580 152 H GLY 19 H GLY 19 -1.179 16.109 -1.613 153 HA2 GLY 19 HA2 GLY 19 1.452 15.164 -0.999 154 HA3 GLY 19 HA3 GLY 19 1.037 16.337 -2.250 155 H LYS 20 H LYS 20 -0.121 18.281 -0.306 156 HA LYS 20 HA LYS 20 2.361 19.592 0.536 157 HB2 LYS 20 HB2 LYS 20 0.285 20.728 -0.384 158 HB3 LYS 20 HB3 LYS 20 -0.516 20.391 1.159 159 HG2 LYS 20 HG2 LYS 20 1.146 21.756 2.348 160 HG3 LYS 20 HG3 LYS 20 2.096 21.951 0.861 161 HD2 LYS 20 HD2 LYS 20 0.198 23.147 -0.200 162 HD3 LYS 20 HD3 LYS 20 -0.744 22.982 1.298 163 HE2 LYS 20 HE2 LYS 20 0.948 24.289 2.531 164 HE3 LYS 20 HE3 LYS 20 1.960 24.386 1.081 165 HZ1 LYS 20 HZ1 LYS 20 0.191 25.662 0.000 166 HZ2 LYS 20 HZ2 LYS 20 -0.758 25.569 1.330 167 HZ3 LYS 20 HZ3 LYS 20 0.642 26.405 1.380 168 H ILE 21 H ILE 21 -0.113 17.609 2.065 169 HA ILE 21 HA ILE 21 0.672 18.193 4.800 170 HB ILE 21 HB ILE 21 -0.941 15.950 3.585 171 HG12 ILE 21 HG12 ILE 21 -1.905 18.253 5.340 172 HG13 ILE 21 HG13 ILE 21 -1.836 18.397 3.589 173 HG21 ILE 21 HG21 ILE 21 -0.005 15.065 5.624 174 HG22 ILE 21 HG22 ILE 21 -0.548 16.485 6.539 175 HG23 ILE 21 HG23 ILE 21 -1.720 15.359 5.838 176 HD11 ILE 21 HD11 ILE 21 -3.387 16.492 3.330 177 HD12 ILE 21 HD12 ILE 21 -3.547 16.395 5.099 178 HD13 ILE 21 HD13 ILE 21 -4.086 17.846 4.237 179 H VAL 22 H VAL 22 1.533 15.722 2.382 180 HA VAL 22 HA VAL 22 3.336 14.336 4.206 181 HB VAL 22 HB VAL 22 2.734 14.101 1.245 182 HG11 VAL 22 HG11 VAL 22 5.020 13.268 1.565 183 HG12 VAL 22 HG12 VAL 22 4.489 12.246 2.910 184 HG13 VAL 22 HG13 VAL 22 3.905 11.930 1.272 185 HG21 VAL 22 HG21 VAL 22 2.049 12.393 3.698 186 HG22 VAL 22 HG22 VAL 22 0.917 13.429 2.799 187 HG23 VAL 22 HG23 VAL 22 1.597 11.985 2.044 188 H GLU 23 H GLU 23 3.854 16.682 1.555 189 HA GLU 23 HA GLU 23 6.747 16.539 1.670 190 HB2 GLU 23 HB2 GLU 23 4.791 18.600 0.588 191 HB3 GLU 23 HB3 GLU 23 6.530 18.841 0.505 192 HG2 GLU 23 HG2 GLU 23 5.290 16.315 -0.622 193 HG3 GLU 23 HG3 GLU 23 5.332 17.812 -1.547 194 H LYS 24 H LYS 24 4.409 18.211 3.629 195 HA LYS 24 HA LYS 24 6.596 19.718 5.038 196 HB2 LYS 24 HB2 LYS 24 3.668 20.490 4.875 197 HB3 LYS 24 HB3 LYS 24 4.956 21.436 5.572 198 HG2 LYS 24 HG2 LYS 24 4.593 20.740 2.629 199 HG3 LYS 24 HG3 LYS 24 4.220 22.281 3.359 200 HD2 LYS 24 HD2 LYS 24 7.069 21.175 3.319 201 HD3 LYS 24 HD3 LYS 24 6.357 22.056 1.985 202 HE2 LYS 24 HE2 LYS 24 7.536 23.691 3.111 203 HE3 LYS 24 HE3 LYS 24 5.858 23.973 3.570 204 HZ1 LYS 24 HZ1 LYS 24 6.339 22.896 5.710 205 HZ2 LYS 24 HZ2 LYS 24 7.880 22.557 5.245 206 HZ3 LYS 24 HZ3 LYS 24 7.403 24.100 5.458 207 H ARG 25 H ARG 25 4.867 17.039 5.376 208 HA ARG 25 HA ARG 25 4.102 15.701 7.025 209 HB2 ARG 25 HB2 ARG 25 6.434 16.817 8.608 210 HB3 ARG 25 HB3 ARG 25 5.647 15.254 8.778 211 HG2 ARG 25 HG2 ARG 25 7.427 14.587 7.541 212 HG3 ARG 25 HG3 ARG 25 6.320 14.967 6.204 213 HD2 ARG 25 HD2 ARG 25 7.464 16.944 5.651 214 HD3 ARG 25 HD3 ARG 25 8.194 17.097 7.262 215 HE ARG 25 HE ARG 25 9.209 14.720 6.157 216 HH11 ARG 25 HH11 ARG 25 9.398 18.118 5.304 217 HH12 ARG 25 HH12 ARG 25 11.063 17.991 4.801 218 HH21 ARG 25 HH21 ARG 25 11.325 14.628 5.477 219 HH22 ARG 25 HH22 ARG 25 12.110 16.061 4.874 220 H ILE 26 H ILE 26 2.320 17.447 6.934 221 HA ILE 26 HA ILE 26 2.100 19.225 9.232 222 HB ILE 26 HB ILE 26 0.005 18.538 7.135 223 HG12 ILE 26 HG12 ILE 26 2.050 20.807 7.256 224 HG13 ILE 26 HG13 ILE 26 2.071 19.451 6.134 225 HG21 ILE 26 HG21 ILE 26 -0.947 19.531 9.216 226 HG22 ILE 26 HG22 ILE 26 0.182 20.897 9.067 227 HG23 ILE 26 HG23 ILE 26 -1.083 20.626 7.850 228 HD11 ILE 26 HD11 ILE 26 -0.133 20.245 5.199 229 HD12 ILE 26 HD12 ILE 26 0.073 21.721 6.175 230 HD13 ILE 26 HD13 ILE 26 1.260 21.306 4.925 231 H GLU 27 H GLU 27 1.445 18.693 11.177 232 HA GLU 27 HA GLU 27 0.290 16.084 11.831 233 HB2 GLU 27 HB2 GLU 27 1.000 18.526 13.496 234 HB3 GLU 27 HB3 GLU 27 0.246 17.067 14.159 235 HG2 GLU 27 HG2 GLU 27 2.120 15.690 13.364 236 HG3 GLU 27 HG3 GLU 27 2.911 17.118 12.683 237 H CYS 28 H CYS 28 -1.726 15.825 11.017 238 HA CYS 28 HA CYS 28 -3.874 17.528 12.147 239 HB2 CYS 28 HB2 CYS 28 -4.981 17.629 9.903 240 HB3 CYS 28 HB3 CYS 28 -3.450 18.500 9.982 241 HG CYS 28 HG CYS 28 -3.944 15.400 8.846 242 H THR 29 H THR 29 -5.989 16.746 11.928 243 HA THR 29 HA THR 29 -6.234 13.838 12.421 244 HB THR 29 HB THR 29 -8.599 15.646 12.488 245 HG1 THR 29 HG1 THR 29 -6.652 15.780 14.530 246 HG21 THR 29 HG21 THR 29 -8.785 13.327 13.283 247 HG22 THR 29 HG22 THR 29 -7.536 13.640 14.519 248 HG23 THR 29 HG23 THR 29 -9.100 14.481 14.585 249 H VAL 30 H VAL 30 -7.817 12.541 11.357 250 HA VAL 30 HA VAL 30 -8.898 13.522 8.743 251 HB VAL 30 HB VAL 30 -8.316 11.418 7.674 252 HG11 VAL 30 HG11 VAL 30 -6.744 13.306 7.503 253 HG12 VAL 30 HG12 VAL 30 -5.833 12.673 8.899 254 HG13 VAL 30 HG13 VAL 30 -5.949 11.726 7.409 255 HG21 VAL 30 HG21 VAL 30 -6.725 10.679 10.167 256 HG22 VAL 30 HG22 VAL 30 -8.237 9.900 9.648 257 HG23 VAL 30 HG23 VAL 30 -6.792 9.783 8.642 258 H TYR 31 H TYR 31 -10.424 11.661 7.855 259 HA TYR 31 HA TYR 31 -12.310 10.873 10.029 260 HB2 TYR 31 HB2 TYR 31 -13.001 11.910 7.245 261 HB3 TYR 31 HB3 TYR 31 -14.124 11.233 8.387 262 HD1 TYR 31 HD1 TYR 31 -11.677 14.082 8.046 263 HD2 TYR 31 HD2 TYR 31 -15.307 12.602 9.841 264 HE1 TYR 31 HE1 TYR 31 -12.161 16.352 8.935 265 HE2 TYR 31 HE2 TYR 31 -15.827 14.900 10.673 266 HH TYR 31 HH TYR 31 -13.672 17.679 10.011 267 H SER 32 H SER 32 -13.206 8.877 9.860 268 HA SER 32 HA SER 32 -12.828 7.113 7.531 269 HB2 SER 32 HB2 SER 32 -10.597 7.142 8.631 270 HB3 SER 32 HB3 SER 32 -11.346 6.670 10.158 271 HG SER 32 HG SER 32 -10.473 4.892 9.042 272 H VAL 33 H VAL 33 -13.692 4.842 8.122 273 HA VAL 33 HA VAL 33 -16.027 5.104 9.985 274 HB VAL 33 HB VAL 33 -17.109 5.067 8.020 275 HG11 VAL 33 HG11 VAL 33 -15.266 4.695 6.410 276 HG12 VAL 33 HG12 VAL 33 -15.183 2.984 6.896 277 HG13 VAL 33 HG13 VAL 33 -16.618 3.616 6.064 278 HG21 VAL 33 HG21 VAL 33 -16.950 2.117 8.513 279 HG22 VAL 33 HG22 VAL 33 -17.856 3.305 9.498 280 HG23 VAL 33 HG23 VAL 33 -18.267 3.062 7.789 281 H ASP 34 H ASP 34 -16.249 3.813 11.565 282 HA ASP 34 HA ASP 34 -14.266 1.740 12.135 283 HB2 ASP 34 HB2 ASP 34 -15.431 3.419 13.782 284 HB3 ASP 34 HB3 ASP 34 -16.771 2.274 13.721 285 H ASN 35 H ASN 35 -15.309 -0.261 13.280 286 HA ASN 35 HA ASN 35 -16.431 -2.008 11.268 287 HB2 ASN 35 HB2 ASN 35 -16.037 -2.322 14.282 288 HB3 ASN 35 HB3 ASN 35 -16.594 -3.612 13.219 289 HD21 ASN 35 HD22 ASN 35 -15.087 -4.772 11.987 290 HD22 ASN 35 HD21 ASN 35 -13.369 -4.412 12.036 291 H ASN 36 H ASN 36 -17.932 0.060 13.641 292 HA ASN 36 HA ASN 36 -20.604 -1.191 13.354 293 HB2 ASN 36 HB2 ASN 36 -19.422 1.017 15.069 294 HB3 ASN 36 HB3 ASN 36 -21.164 0.789 14.946 295 HD21 ASN 36 HD22 ASN 36 -18.160 -0.671 16.166 296 HD22 ASN 36 HD21 ASN 36 -18.990 -1.882 17.129 297 H GLY 37 H GLY 37 -18.847 0.942 11.395 298 HA2 GLY 37 HA2 GLY 37 -19.582 1.983 9.499 299 HA3 GLY 37 HA3 GLY 37 -21.249 1.768 9.942 300 H ASN 38 H ASN 38 -19.481 3.227 12.493 301 HA ASN 38 HA ASN 38 -20.754 5.842 11.936 302 HB2 ASN 38 HB2 ASN 38 -20.240 6.463 14.152 303 HB3 ASN 38 HB3 ASN 38 -20.899 4.838 14.218 304 HD21 ASN 38 HD22 ASN 38 -19.631 3.218 15.183 305 HD22 ASN 38 HD21 ASN 38 -18.021 3.535 15.814 306 H ILE 39 H ILE 39 -19.681 7.579 11.206 307 HA ILE 39 HA ILE 39 -16.908 7.429 10.396 308 HB ILE 39 HB ILE 39 -18.703 9.862 10.556 309 HG12 ILE 39 HG12 ILE 39 -18.055 8.216 8.062 310 HG13 ILE 39 HG13 ILE 39 -19.519 7.943 9.003 311 HG21 ILE 39 HG21 ILE 39 -16.253 10.355 10.475 312 HG22 ILE 39 HG22 ILE 39 -16.092 9.319 9.042 313 HG23 ILE 39 HG23 ILE 39 -17.026 10.827 8.973 314 HD11 ILE 39 HD11 ILE 39 -20.225 10.270 8.695 315 HD12 ILE 39 HD12 ILE 39 -18.784 10.577 7.701 316 HD13 ILE 39 HD13 ILE 39 -20.018 9.413 7.157 317 H TYR 40 H TYR 40 -15.254 7.736 11.716 318 HA TYR 40 HA TYR 40 -15.490 9.424 14.163 319 HB2 TYR 40 HB2 TYR 40 -14.162 7.958 15.407 320 HB3 TYR 40 HB3 TYR 40 -15.390 6.959 14.673 321 HD1 TYR 40 HD1 TYR 40 -14.767 5.370 12.780 322 HD2 TYR 40 HD2 TYR 40 -11.823 7.636 14.988 323 HE1 TYR 40 HE1 TYR 40 -12.971 3.867 11.946 324 HE2 TYR 40 HE2 TYR 40 -10.047 6.095 14.183 325 HH TYR 40 HH TYR 40 -10.740 3.374 11.959 326 H THR 41 H THR 41 -13.259 10.187 14.895 327 HA THR 41 HA THR 41 -11.534 10.786 12.545 328 HB THR 41 HB THR 41 -11.100 13.053 13.550 329 HG1 THR 41 HG1 THR 41 -11.975 12.696 15.611 330 HG21 THR 41 HG21 THR 41 -12.525 12.847 11.603 331 HG22 THR 41 HG22 THR 41 -13.939 12.512 12.634 332 HG23 THR 41 HG23 THR 41 -13.140 14.096 12.692 333 H GLN 42 H GLN 42 -9.381 10.967 12.811 334 HA GLN 42 HA GLN 42 -8.168 10.351 15.439 335 HB2 GLN 42 HB2 GLN 42 -7.080 8.332 14.569 336 HB3 GLN 42 HB3 GLN 42 -8.835 8.186 14.545 337 HG2 GLN 42 HG2 GLN 42 -8.773 8.786 12.057 338 HG3 GLN 42 HG3 GLN 42 -7.015 8.695 12.149 339 HE21 GLN 42 HE22 GLN 42 -8.741 7.017 10.489 340 HE22 GLN 42 HE21 GLN 42 -8.525 5.379 11.072 341 HA PRO 43 HA PRO 43 -4.928 12.837 13.638 342 HB2 PRO 43 HB2 PRO 43 -2.821 12.329 15.277 343 HB3 PRO 43 HB3 PRO 43 -4.271 13.233 15.804 344 HG2 PRO 43 HG2 PRO 43 -3.649 10.295 16.239 345 HG3 PRO 43 HG3 PRO 43 -4.234 11.502 17.433 346 HD2 PRO 43 HD2 PRO 43 -5.910 9.765 16.149 347 HD3 PRO 43 HD3 PRO 43 -6.414 11.426 16.590 348 H VAL 44 H VAL 44 -3.280 12.749 12.167 349 HA VAL 44 HA VAL 44 -2.467 10.364 10.848 350 HB VAL 44 HB VAL 44 -2.368 12.635 9.894 351 HG11 VAL 44 HG11 VAL 44 -1.403 13.855 11.870 352 HG12 VAL 44 HG12 VAL 44 0.152 13.074 11.551 353 HG13 VAL 44 HG13 VAL 44 -0.556 14.166 10.345 354 HG21 VAL 44 HG21 VAL 44 0.380 11.338 9.820 355 HG22 VAL 44 HG22 VAL 44 -1.037 10.766 8.913 356 HG23 VAL 44 HG23 VAL 44 -0.366 12.370 8.597 357 H ALA 45 H ALA 45 -0.632 9.104 10.951 358 HA ALA 45 HA ALA 45 0.918 9.168 13.513 359 HB1 ALA 45 HB1 ALA 45 -0.555 7.202 13.027 360 HB2 ALA 45 HB2 ALA 45 0.421 6.857 11.587 361 HB3 ALA 45 HB3 ALA 45 1.158 6.774 13.200 362 H GLN 46 H GLN 46 1.236 9.106 9.982 363 HA GLN 46 HA GLN 46 3.998 9.929 10.023 364 HB2 GLN 46 HB2 GLN 46 4.887 7.948 8.794 365 HB3 GLN 46 HB3 GLN 46 4.592 7.787 10.509 366 HG2 GLN 46 HG2 GLN 46 2.309 6.651 9.742 367 HG3 GLN 46 HG3 GLN 46 3.163 6.491 8.201 368 HE21 GLN 46 HE22 GLN 46 3.486 5.896 11.747 369 HE22 GLN 46 HE21 GLN 46 4.590 4.551 11.583 370 H TRP 47 H TRP 47 4.920 9.803 7.668 371 HA TRP 47 HA TRP 47 2.817 10.475 5.648 372 HB2 TRP 47 HB2 TRP 47 5.251 12.151 6.377 373 HB3 TRP 47 HB3 TRP 47 4.122 12.484 5.084 374 HD1 TRP 47 HD1 TRP 47 1.872 13.711 5.720 375 HE1 TRP 47 HE1 TRP 47 1.011 14.870 7.832 376 HE3 TRP 47 HE3 TRP 47 5.364 11.986 9.041 377 HZ2 TRP 47 HZ2 TRP 47 1.719 14.976 10.626 378 HZ3 TRP 47 HZ3 TRP 47 5.227 12.620 11.444 379 HH2 TRP 47 HH2 TRP 47 3.395 14.105 12.244 380 H HIS 48 H HIS 48 3.153 9.030 4.039 381 HA HIS 48 HA HIS 48 5.924 8.171 3.376 382 HB2 HIS 48 HB2 HIS 48 3.338 7.008 2.317 383 HB3 HIS 48 HB3 HIS 48 4.963 6.373 2.175 384 HD1 HIS 48 HD1 HIS 48 6.068 5.529 4.672 385 HD2 HIS 48 HD2 HIS 48 1.915 6.124 4.321 386 HE1 HIS 48 HE1 HIS 48 4.998 4.270 6.610 387 H ASP 49 H ASP 49 6.936 9.259 1.884 388 HA ASP 49 HA ASP 49 5.501 10.427 -0.482 389 HB2 ASP 49 HB2 ASP 49 6.806 12.122 0.609 390 HB3 ASP 49 HB3 ASP 49 8.181 11.036 0.821 391 H ARG 50 H ARG 50 5.339 8.975 -1.993 392 HA ARG 50 HA ARG 50 7.215 6.733 -2.341 393 HB2 ARG 50 HB2 ARG 50 4.869 7.678 -4.016 394 HB3 ARG 50 HB3 ARG 50 5.681 6.126 -4.107 395 HG2 ARG 50 HG2 ARG 50 4.020 7.202 -1.784 396 HG3 ARG 50 HG3 ARG 50 3.566 5.914 -2.884 397 HD2 ARG 50 HD2 ARG 50 5.816 5.817 -0.829 398 HD3 ARG 50 HD3 ARG 50 4.254 5.012 -0.721 399 HE ARG 50 HE ARG 50 5.603 4.219 -3.158 400 HH11 ARG 50 HH11 ARG 50 5.920 3.605 0.278 401 HH12 ARG 50 HH12 ARG 50 6.749 2.093 -0.004 402 HH21 ARG 50 HH21 ARG 50 6.581 2.356 -3.447 403 HH22 ARG 50 HH22 ARG 50 7.182 1.428 -2.085 404 H GLY 51 H GLY 51 6.774 9.866 -3.702 405 HA2 GLY 51 HA2 GLY 51 8.361 11.111 -4.864 406 HA3 GLY 51 HA3 GLY 51 9.298 9.647 -5.150 407 H GLU 52 H GLU 52 7.422 8.053 -6.535 408 HA GLU 52 HA GLU 52 6.268 9.208 -8.846 409 HB2 GLU 52 HB2 GLU 52 8.030 8.724 -10.512 410 HB3 GLU 52 HB3 GLU 52 8.208 10.180 -9.580 411 HG2 GLU 52 HG2 GLU 52 9.945 9.131 -8.170 412 HG3 GLU 52 HG3 GLU 52 9.705 7.597 -8.985 413 H GLN 53 H GLN 53 4.862 7.600 -8.591 414 HA GLN 53 HA GLN 53 5.673 4.928 -9.694 415 HB2 GLN 53 HB2 GLN 53 3.478 5.592 -7.745 416 HB3 GLN 53 HB3 GLN 53 3.918 3.954 -8.281 417 HG2 GLN 53 HG2 GLN 53 6.228 4.314 -7.331 418 HG3 GLN 53 HG3 GLN 53 5.683 5.869 -6.660 419 HE21 GLN 53 HE22 GLN 53 3.061 5.106 -5.717 420 HE22 GLN 53 HE21 GLN 53 3.626 4.466 -4.216 421 H GLU 54 H GLU 54 3.839 3.704 -10.674 422 HA GLU 54 HA GLU 54 2.840 5.116 -12.914 423 HB2 GLU 54 HB2 GLU 54 1.649 2.918 -13.382 424 HB3 GLU 54 HB3 GLU 54 3.404 2.925 -13.297 425 HG2 GLU 54 HG2 GLU 54 3.377 1.879 -11.100 426 HG3 GLU 54 HG3 GLU 54 1.625 2.024 -10.994 427 H VAL 55 H VAL 55 1.379 6.683 -12.709 428 HA VAL 55 HA VAL 55 -1.063 6.327 -11.085 429 HB VAL 55 HB VAL 55 -0.195 8.768 -12.675 430 HG11 VAL 55 HG11 VAL 55 -2.620 8.740 -11.986 431 HG12 VAL 55 HG12 VAL 55 -2.097 8.520 -10.302 432 HG13 VAL 55 HG13 VAL 55 -1.687 10.000 -11.194 433 HG21 VAL 55 HG21 VAL 55 0.412 9.612 -10.313 434 HG22 VAL 55 HG22 VAL 55 0.378 7.917 -9.812 435 HG23 VAL 55 HG23 VAL 55 1.524 8.453 -11.054 436 H PHE 56 H PHE 56 -3.081 6.293 -11.832 437 HA PHE 56 HA PHE 56 -3.644 6.104 -14.757 438 HB2 PHE 56 HB2 PHE 56 -4.751 4.457 -12.442 439 HB3 PHE 56 HB3 PHE 56 -5.326 4.383 -14.097 440 HD1 PHE 56 HD1 PHE 56 -2.326 3.770 -11.939 441 HD2 PHE 56 HD2 PHE 56 -4.259 2.967 -15.706 442 HE1 PHE 56 HE1 PHE 56 -0.569 2.105 -12.486 443 HE2 PHE 56 HE2 PHE 56 -2.493 1.295 -16.245 444 HZ PHE 56 HZ PHE 56 -0.631 0.892 -14.647 445 H GLU 57 H GLU 57 -5.479 7.111 -15.474 446 HA GLU 57 HA GLU 57 -6.710 9.182 -13.918 447 HB2 GLU 57 HB2 GLU 57 -6.475 8.959 -16.477 448 HB3 GLU 57 HB3 GLU 57 -7.847 7.858 -16.421 449 HG2 GLU 57 HG2 GLU 57 -9.251 9.654 -15.421 450 HG3 GLU 57 HG3 GLU 57 -7.851 10.725 -15.354 451 H TYR 58 H TYR 58 -8.432 9.134 -12.530 452 HA TYR 58 HA TYR 58 -10.294 6.813 -12.602 453 HB2 TYR 58 HB2 TYR 58 -8.820 6.516 -10.765 454 HB3 TYR 58 HB3 TYR 58 -8.980 8.176 -10.249 455 HD1 TYR 58 HD2 TYR 58 -12.091 6.449 -11.254 456 HD2 TYR 58 HD1 TYR 58 -9.388 7.198 -7.962 457 HE1 TYR 58 HE2 TYR 58 -13.818 5.740 -9.667 458 HE2 TYR 58 HE1 TYR 58 -11.180 6.525 -6.361 459 HH TYR 58 HH TYR 58 -14.442 5.570 -7.544 460 H CYS 59 H CYS 59 -11.409 8.082 -14.138 461 HA CYS 59 HA CYS 59 -12.854 10.499 -13.244 462 HB2 CYS 59 HB2 CYS 59 -11.994 10.131 -15.611 463 HB3 CYS 59 HB3 CYS 59 -13.162 8.813 -15.769 464 HG CYS 59 HG CYS 59 -15.306 10.323 -15.211 465 H LEU 60 H LEU 60 -15.028 10.571 -12.744 466 HA LEU 60 HA LEU 60 -16.489 7.971 -12.451 467 HB2 LEU 60 HB2 LEU 60 -15.987 10.216 -10.663 468 HB3 LEU 60 HB3 LEU 60 -17.693 10.091 -10.955 469 HG LEU 60 HG LEU 60 -17.846 7.873 -10.112 470 HD11 LEU 60 HD11 LEU 60 -15.707 6.884 -10.827 471 HD12 LEU 60 HD12 LEU 60 -14.842 7.943 -9.691 472 HD13 LEU 60 HD13 LEU 60 -15.970 6.682 -9.102 473 HD21 LEU 60 HD21 LEU 60 -16.088 9.651 -8.353 474 HD22 LEU 60 HD22 LEU 60 -17.861 9.685 -8.447 475 HD23 LEU 60 HD23 LEU 60 -17.015 8.268 -7.773 476 H GLU 61 H GLU 61 -18.770 8.028 -12.542 477 HA GLU 61 HA GLU 61 -19.680 8.842 -15.112 478 HB2 GLU 61 HB2 GLU 61 -21.187 7.901 -12.652 479 HB3 GLU 61 HB3 GLU 61 -21.879 7.953 -14.269 480 HG2 GLU 61 HG2 GLU 61 -19.336 6.385 -14.044 481 HG3 GLU 61 HG3 GLU 61 -20.676 5.769 -13.100 482 H ASP 62 H ASP 62 -19.882 10.517 -12.061 483 HA ASP 62 HA ASP 62 -21.978 12.419 -12.880 484 HB2 ASP 62 HB2 ASP 62 -21.766 11.719 -10.552 485 HB3 ASP 62 HB3 ASP 62 -20.107 12.328 -10.482 486 H GLY 63 H GLY 63 -18.449 12.283 -12.962 487 HA2 GLY 63 HA2 GLY 63 -17.381 13.823 -14.586 488 HA3 GLY 63 HA3 GLY 63 -18.307 15.147 -13.881 489 H SER 64 H SER 64 -17.419 13.283 -11.253 490 HA SER 64 HA SER 64 -15.249 14.943 -10.367 491 HB2 SER 64 HB2 SER 64 -15.908 12.111 -9.460 492 HB3 SER 64 HB3 SER 64 -14.981 13.326 -8.574 493 HG SER 64 HG SER 64 -16.907 14.603 -8.505 494 H LEU 65 H LEU 65 -13.056 14.689 -10.469 495 HA LEU 65 HA LEU 65 -11.907 12.399 -12.019 496 HB2 LEU 65 HB2 LEU 65 -11.537 15.374 -12.282 497 HB3 LEU 65 HB3 LEU 65 -10.110 14.375 -12.435 498 HG LEU 65 HG LEU 65 -10.960 14.962 -14.587 499 HD11 LEU 65 HD11 LEU 65 -9.807 12.803 -14.341 500 HD12 LEU 65 HD12 LEU 65 -11.367 11.993 -14.095 501 HD13 LEU 65 HD13 LEU 65 -11.009 12.774 -15.642 502 HD21 LEU 65 HD21 LEU 65 -13.480 13.394 -13.978 503 HD22 LEU 65 HD22 LEU 65 -13.357 15.165 -14.051 504 HD23 LEU 65 HD23 LEU 65 -13.054 14.192 -15.500 505 H ILE 66 H ILE 66 -10.347 11.345 -11.102 506 HA ILE 66 HA ILE 66 -8.855 12.373 -8.738 507 HB ILE 66 HB ILE 66 -10.102 9.606 -9.006 508 HG12 ILE 66 HG12 ILE 66 -11.093 11.756 -7.096 509 HG13 ILE 66 HG13 ILE 66 -11.857 11.421 -8.648 510 HG21 ILE 66 HG21 ILE 66 -8.100 9.560 -7.621 511 HG22 ILE 66 HG22 ILE 66 -8.668 10.969 -6.683 512 HG23 ILE 66 HG23 ILE 66 -9.489 9.402 -6.575 513 HD11 ILE 66 HD11 ILE 66 -12.250 9.075 -8.009 514 HD12 ILE 66 HD12 ILE 66 -11.695 9.457 -6.355 515 HD13 ILE 66 HD13 ILE 66 -13.113 10.259 -7.045 516 H ARG 67 H ARG 67 -6.765 11.368 -8.496 517 HA ARG 67 HA ARG 67 -5.769 9.672 -10.736 518 HB2 ARG 67 HB2 ARG 67 -4.660 12.382 -9.901 519 HB3 ARG 67 HB3 ARG 67 -3.720 11.168 -10.778 520 HG2 ARG 67 HG2 ARG 67 -5.542 11.080 -12.540 521 HG3 ARG 67 HG3 ARG 67 -6.339 12.451 -11.758 522 HD2 ARG 67 HD2 ARG 67 -4.433 13.882 -12.183 523 HD3 ARG 67 HD3 ARG 67 -3.496 12.498 -12.768 524 HE ARG 67 HE ARG 67 -5.819 12.583 -14.361 525 HH11 ARG 67 HH11 ARG 67 -3.012 14.634 -13.925 526 HH12 ARG 67 HH12 ARG 67 -2.988 15.113 -15.604 527 HH21 ARG 67 HH21 ARG 67 -5.754 13.252 -16.488 528 HH22 ARG 67 HH22 ARG 67 -4.506 14.340 -17.013 529 H ALA 68 H ALA 68 -4.957 7.945 -9.943 530 HA ALA 68 HA ALA 68 -3.308 7.915 -7.481 531 HB1 ALA 68 HB1 ALA 68 -5.687 7.676 -6.761 532 HB2 ALA 68 HB2 ALA 68 -5.862 6.271 -7.833 533 HB3 ALA 68 HB3 ALA 68 -4.741 6.201 -6.453 534 H THR 69 H THR 69 -2.669 5.563 -7.024 535 HA THR 69 HA THR 69 -1.534 4.379 -9.523 536 HB THR 69 HB THR 69 -0.198 3.022 -7.745 537 HG1 THR 69 HG1 THR 69 -1.083 5.200 -6.190 538 HG21 THR 69 HG21 THR 69 0.203 6.020 -8.012 539 HG22 THR 69 HG22 THR 69 1.335 4.906 -7.189 540 HG23 THR 69 HG23 THR 69 1.002 4.695 -8.895 541 H LYS 70 H LYS 70 -1.671 2.150 -9.971 542 HA LYS 70 HA LYS 70 -4.124 0.809 -9.307 543 HB2 LYS 70 HB2 LYS 70 -1.624 0.107 -10.811 544 HB3 LYS 70 HB3 LYS 70 -2.621 -1.230 -10.238 545 HG2 LYS 70 HG2 LYS 70 -4.631 -0.209 -11.311 546 HG3 LYS 70 HG3 LYS 70 -3.603 1.053 -11.993 547 HD2 LYS 70 HD2 LYS 70 -2.258 -0.694 -13.166 548 HD3 LYS 70 HD3 LYS 70 -3.273 -1.948 -12.442 549 HE2 LYS 70 HE2 LYS 70 -5.277 -0.899 -13.547 550 HE3 LYS 70 HE3 LYS 70 -4.189 0.229 -14.371 551 HZ1 LYS 70 HZ1 LYS 70 -3.081 -1.763 -15.362 552 HZ2 LYS 70 HZ2 LYS 70 -4.180 -2.737 -14.626 553 HZ3 LYS 70 HZ3 LYS 70 -4.656 -1.692 -15.789 554 H ASP 71 H ASP 71 -1.296 0.999 -7.426 555 HA ASP 71 HA ASP 71 -1.795 -1.530 -5.955 556 HB2 ASP 71 HB2 ASP 71 0.314 0.651 -5.762 557 HB3 ASP 71 HB3 ASP 71 0.169 -0.648 -4.579 558 H HIS 72 H HIS 72 -2.908 1.770 -5.812 559 HA HIS 72 HA HIS 72 -3.105 1.831 -2.888 560 HB2 HIS 72 HB2 HIS 72 -2.740 3.878 -4.400 561 HB3 HIS 72 HB3 HIS 72 -4.406 3.703 -4.904 562 HD1 HIS 72 HD1 HIS 72 -6.221 4.454 -2.903 563 HD2 HIS 72 HD2 HIS 72 -2.165 4.435 -1.812 564 HE1 HIS 72 HE1 HIS 72 -6.031 5.641 -0.645 565 H LYS 73 H LYS 73 -5.058 1.400 -1.777 566 HA LYS 73 HA LYS 73 -7.158 -0.062 -3.303 567 HB2 LYS 73 HB2 LYS 73 -6.432 -0.005 -0.350 568 HB3 LYS 73 HB3 LYS 73 -7.803 -0.899 -1.011 569 HG2 LYS 73 HG2 LYS 73 -6.393 -2.386 -2.244 570 HG3 LYS 73 HG3 LYS 73 -4.969 -1.362 -2.016 571 HD2 LYS 73 HD2 LYS 73 -5.167 -1.799 0.482 572 HD3 LYS 73 HD3 LYS 73 -6.359 -3.054 0.093 573 HE2 LYS 73 HE2 LYS 73 -4.704 -4.228 -1.307 574 HE3 LYS 73 HE3 LYS 73 -3.561 -2.885 -1.119 575 HZ1 LYS 73 HZ1 LYS 73 -3.449 -3.399 1.259 576 HZ2 LYS 73 HZ2 LYS 73 -4.484 -4.659 1.089 577 HZ3 LYS 73 HZ3 LYS 73 -3.011 -4.704 0.384 578 H PHE 74 H PHE 74 -9.384 0.275 -2.743 579 HA PHE 74 HA PHE 74 -10.043 2.868 -1.419 580 HB2 PHE 74 HB2 PHE 74 -10.881 2.074 -4.227 581 HB3 PHE 74 HB3 PHE 74 -11.608 3.357 -3.272 582 HD1 PHE 74 HD1 PHE 74 -8.426 2.357 -5.006 583 HD2 PHE 74 HD2 PHE 74 -10.663 5.518 -3.094 584 HE1 PHE 74 HE1 PHE 74 -6.821 4.034 -5.873 585 HE2 PHE 74 HE2 PHE 74 -9.031 7.177 -3.920 586 HZ PHE 74 HZ PHE 74 -7.127 6.445 -5.333 587 H MET 75 H MET 75 -11.865 2.792 -0.200 588 HA MET 75 HA MET 75 -12.887 0.108 0.300 589 HB2 MET 75 HB2 MET 75 -12.379 1.934 2.069 590 HB3 MET 75 HB3 MET 75 -13.996 2.550 1.641 591 HG2 MET 75 HG2 MET 75 -14.909 0.247 1.967 592 HG3 MET 75 HG3 MET 75 -13.384 -0.196 2.730 593 HE1 MET 75 HE1 MET 75 -13.106 -0.066 5.239 594 HE2 MET 75 HE2 MET 75 -12.447 1.548 4.862 595 HE3 MET 75 HE3 MET 75 -13.594 1.345 6.211 596 H THR 76 H THR 76 -14.377 -0.764 -0.876 597 HA THR 76 HA THR 76 -16.267 0.580 -2.583 598 HB THR 76 HB THR 76 -17.293 -1.705 -2.790 599 HG1 THR 76 HG1 THR 76 -15.053 -2.510 -1.263 600 HG21 THR 76 HG21 THR 76 -15.586 -0.928 -4.311 601 HG22 THR 76 HG22 THR 76 -14.304 -1.451 -3.202 602 HG23 THR 76 HG23 THR 76 -15.374 -2.659 -3.964 603 H VAL 77 H VAL 77 -18.634 0.234 -2.490 604 HA VAL 77 HA VAL 77 -19.913 1.155 -0.188 605 HB VAL 77 HB VAL 77 -22.020 0.268 -1.155 606 HG11 VAL 77 HG11 VAL 77 -21.067 2.437 -1.811 607 HG12 VAL 77 HG12 VAL 77 -20.235 1.669 -3.173 608 HG13 VAL 77 HG13 VAL 77 -22.004 1.679 -3.114 609 HG21 VAL 77 HG21 VAL 77 -20.245 -0.884 -3.355 610 HG22 VAL 77 HG22 VAL 77 -21.197 -1.826 -2.189 611 HG23 VAL 77 HG23 VAL 77 -22.013 -0.794 -3.365 612 H ASP 78 H ASP 78 -19.026 -2.188 -0.851 613 HA ASP 78 HA ASP 78 -20.613 -3.257 1.381 614 HB2 ASP 78 HB2 ASP 78 -18.538 -4.486 -0.473 615 HB3 ASP 78 HB3 ASP 78 -19.388 -5.377 0.788 616 H GLY 79 H GLY 79 -17.570 -1.639 1.197 617 HA2 GLY 79 HA2 GLY 79 -16.325 -1.073 3.088 618 HA3 GLY 79 HA3 GLY 79 -16.902 -2.490 3.954 619 H GLN 80 H GLN 80 -15.928 -3.558 0.854 620 HA GLN 80 HA GLN 80 -13.440 -4.688 1.928 621 HB2 GLN 80 HB2 GLN 80 -14.777 -4.873 -0.811 622 HB3 GLN 80 HB3 GLN 80 -13.273 -5.679 -0.354 623 HG2 GLN 80 HG2 GLN 80 -14.583 -6.782 1.552 624 HG3 GLN 80 HG3 GLN 80 -16.050 -6.162 0.795 625 HE21 GLN 80 HE22 GLN 80 -16.933 -7.393 -0.940 626 HE22 GLN 80 HE21 GLN 80 -16.080 -8.742 -1.672 627 H MET 81 H MET 81 -11.452 -4.052 1.444 628 HA MET 81 HA MET 81 -11.029 -1.548 -0.127 629 HB2 MET 81 HB2 MET 81 -9.053 -1.181 1.247 630 HB3 MET 81 HB3 MET 81 -10.533 -1.261 2.189 631 HG2 MET 81 HG2 MET 81 -9.698 -3.869 2.410 632 HG3 MET 81 HG3 MET 81 -8.157 -3.062 2.194 633 HE1 MET 81 HE1 MET 81 -11.557 -2.072 4.108 634 HE2 MET 81 HE2 MET 81 -11.231 -3.791 4.418 635 HE3 MET 81 HE3 MET 81 -11.090 -2.611 5.736 636 H LEU 82 H LEU 82 -10.677 -2.191 -2.129 637 HA LEU 82 HA LEU 82 -8.670 -4.329 -2.671 638 HB2 LEU 82 HB2 LEU 82 -10.741 -3.872 -4.747 639 HB3 LEU 82 HB3 LEU 82 -9.940 -5.323 -4.229 640 HG LEU 82 HG LEU 82 -11.589 -5.091 -2.084 641 HD11 LEU 82 HD11 LEU 82 -12.511 -2.900 -2.851 642 HD12 LEU 82 HD12 LEU 82 -13.074 -3.683 -4.341 643 HD13 LEU 82 HD13 LEU 82 -13.746 -4.169 -2.774 644 HD21 LEU 82 HD21 LEU 82 -12.504 -6.005 -4.850 645 HD22 LEU 82 HD22 LEU 82 -11.570 -6.975 -3.691 646 HD23 LEU 82 HD23 LEU 82 -13.223 -6.479 -3.293 647 HA PRO 83 HA PRO 83 -6.575 -1.233 -5.045 648 HB2 PRO 83 HB2 PRO 83 -5.474 -2.632 -7.138 649 HB3 PRO 83 HB3 PRO 83 -4.863 -2.702 -5.459 650 HG2 PRO 83 HG2 PRO 83 -6.730 -4.631 -6.873 651 HG3 PRO 83 HG3 PRO 83 -5.305 -5.016 -5.856 652 HD2 PRO 83 HD2 PRO 83 -7.841 -5.108 -4.884 653 HD3 PRO 83 HD3 PRO 83 -6.483 -4.537 -3.867 654 H ILE 84 H ILE 84 -6.945 0.176 -6.757 655 HA ILE 84 HA ILE 84 -9.474 0.120 -8.006 656 HB ILE 84 HB ILE 84 -8.163 2.130 -7.504 657 HG12 ILE 84 HG12 ILE 84 -8.910 2.039 -10.454 658 HG13 ILE 84 HG13 ILE 84 -10.093 1.949 -9.144 659 HG21 ILE 84 HG21 ILE 84 -5.953 1.403 -8.247 660 HG22 ILE 84 HG22 ILE 84 -6.491 1.382 -9.943 661 HG23 ILE 84 HG23 ILE 84 -6.400 2.912 -9.041 662 HD11 ILE 84 HD11 ILE 84 -9.357 4.119 -8.278 663 HD12 ILE 84 HD12 ILE 84 -8.205 4.274 -9.632 664 HD13 ILE 84 HD13 ILE 84 -9.951 4.204 -9.948 665 H ASP 85 H ASP 85 -6.540 -1.345 -9.112 666 HA ASP 85 HA ASP 85 -7.097 -1.878 -11.839 667 HB2 ASP 85 HB2 ASP 85 -4.963 -2.398 -10.651 668 HB3 ASP 85 HB3 ASP 85 -5.793 -3.639 -9.723 669 H GLU 86 H GLU 86 -8.436 -3.326 -8.903 670 HA GLU 86 HA GLU 86 -9.888 -5.419 -10.431 671 HB2 GLU 86 HB2 GLU 86 -8.859 -5.993 -8.284 672 HB3 GLU 86 HB3 GLU 86 -9.854 -4.786 -7.446 673 HG2 GLU 86 HG2 GLU 86 -11.879 -5.974 -7.949 674 HG3 GLU 86 HG3 GLU 86 -11.053 -7.042 -9.090 675 H ILE 87 H ILE 87 -10.599 -2.344 -8.646 676 HA ILE 87 HA ILE 87 -13.409 -2.595 -8.694 677 HB ILE 87 HB ILE 87 -11.703 -0.078 -8.756 678 HG12 ILE 87 HG12 ILE 87 -12.805 -1.713 -6.413 679 HG13 ILE 87 HG13 ILE 87 -11.119 -1.647 -6.923 680 HG21 ILE 87 HG21 ILE 87 -14.129 0.357 -9.271 681 HG22 ILE 87 HG22 ILE 87 -14.564 -0.456 -7.763 682 HG23 ILE 87 HG23 ILE 87 -13.636 1.057 -7.740 683 HD11 ILE 87 HD11 ILE 87 -11.078 0.798 -6.419 684 HD12 ILE 87 HD12 ILE 87 -12.709 0.615 -5.705 685 HD13 ILE 87 HD13 ILE 87 -11.342 -0.260 -5.015 686 H PHE 88 H PHE 88 -11.201 -1.367 -11.222 687 HA PHE 88 HA PHE 88 -13.316 -0.393 -12.947 688 HB2 PHE 88 HB2 PHE 88 -10.943 0.317 -13.064 689 HB3 PHE 88 HB3 PHE 88 -10.503 -1.293 -13.601 690 HD1 PHE 88 HD2 PHE 88 -12.698 1.661 -14.540 691 HD2 PHE 88 HD1 PHE 88 -10.546 -1.819 -15.927 692 HE1 PHE 88 HE2 PHE 88 -13.093 2.340 -16.880 693 HE2 PHE 88 HE1 PHE 88 -10.916 -1.104 -18.270 694 HZ PHE 88 HZ PHE 88 -12.199 0.971 -18.757 695 H GLU 89 H GLU 89 -11.890 -3.642 -12.591 696 HA GLU 89 HA GLU 89 -13.251 -4.696 -15.004 697 HB2 GLU 89 HB2 GLU 89 -11.667 -6.001 -12.750 698 HB3 GLU 89 HB3 GLU 89 -12.550 -6.926 -13.967 699 HG2 GLU 89 HG2 GLU 89 -11.251 -5.593 -15.739 700 HG3 GLU 89 HG3 GLU 89 -10.220 -5.017 -14.428 701 H ARG 90 H ARG 90 -13.716 -4.773 -11.471 702 HA ARG 90 HA ARG 90 -16.134 -6.408 -11.627 703 HB2 ARG 90 HB2 ARG 90 -15.024 -4.702 -9.362 704 HB3 ARG 90 HB3 ARG 90 -16.342 -5.865 -9.226 705 HG2 ARG 90 HG2 ARG 90 -13.425 -6.474 -9.766 706 HG3 ARG 90 HG3 ARG 90 -14.355 -6.843 -8.325 707 HD2 ARG 90 HD2 ARG 90 -14.550 -8.072 -11.087 708 HD3 ARG 90 HD3 ARG 90 -14.055 -8.873 -9.599 709 HE ARG 90 HE ARG 90 -16.726 -8.528 -10.620 710 HH11 ARG 90 HH11 ARG 90 -15.042 -8.863 -7.551 711 HH12 ARG 90 HH12 ARG 90 -16.500 -9.305 -6.699 712 HH21 ARG 90 HH21 ARG 90 -18.546 -9.070 -9.451 713 HH22 ARG 90 HH22 ARG 90 -18.420 -9.430 -7.751 714 H GLU 91 H GLU 91 -15.579 -3.052 -12.166 715 HA GLU 91 HA GLU 91 -16.896 -1.281 -12.509 716 HB2 GLU 91 HB2 GLU 91 -19.130 -3.260 -13.102 717 HB3 GLU 91 HB3 GLU 91 -19.058 -1.557 -13.561 718 HG2 GLU 91 HG2 GLU 91 -16.993 -2.044 -14.911 719 HG3 GLU 91 HG3 GLU 91 -17.198 -3.759 -14.554 720 H LEU 92 H LEU 92 -16.450 -1.982 -9.912 721 HA LEU 92 HA LEU 92 -18.995 -1.604 -8.416 722 HB2 LEU 92 HB2 LEU 92 -16.168 -2.327 -7.564 723 HB3 LEU 92 HB3 LEU 92 -17.445 -1.960 -6.411 724 HG LEU 92 HG LEU 92 -17.598 -4.208 -8.451 725 HD11 LEU 92 HD11 LEU 92 -15.835 -4.579 -6.738 726 HD12 LEU 92 HD12 LEU 92 -17.027 -4.293 -5.453 727 HD13 LEU 92 HD13 LEU 92 -17.192 -5.696 -6.533 728 HD21 LEU 92 HD21 LEU 92 -19.381 -3.546 -6.071 729 HD22 LEU 92 HD22 LEU 92 -19.845 -3.490 -7.788 730 HD23 LEU 92 HD23 LEU 92 -19.458 -5.035 -7.032 731 H ASP 93 H ASP 93 -19.183 -0.141 -6.764 732 HA ASP 93 HA ASP 93 -17.842 2.470 -7.175 733 HB2 ASP 93 HB2 ASP 93 -20.046 3.308 -6.164 734 HB3 ASP 93 HB3 ASP 93 -20.000 2.727 -7.823 735 H LEU 94 H LEU 94 -17.496 3.850 -5.471 736 HA LEU 94 HA LEU 94 -16.578 2.576 -2.993 737 HB2 LEU 94 HB2 LEU 94 -16.387 5.443 -4.010 738 HB3 LEU 94 HB3 LEU 94 -15.643 4.835 -2.535 739 HG LEU 94 HG LEU 94 -14.973 4.166 -5.413 740 HD11 LEU 94 HD11 LEU 94 -13.915 6.132 -4.398 741 HD12 LEU 94 HD12 LEU 94 -13.328 5.149 -3.037 742 HD13 LEU 94 HD13 LEU 94 -12.715 4.876 -4.681 743 HD21 LEU 94 HD21 LEU 94 -13.932 2.654 -2.994 744 HD22 LEU 94 HD22 LEU 94 -14.913 1.979 -4.322 745 HD23 LEU 94 HD23 LEU 94 -13.293 2.560 -4.650 746 H MET 95 H MET 95 -17.000 3.298 -0.885 747 HA MET 95 HA MET 95 -19.811 3.921 -0.359 748 HB2 MET 95 HB2 MET 95 -18.481 2.395 1.021 749 HB3 MET 95 HB3 MET 95 -17.397 3.702 1.496 750 HG2 MET 95 HG2 MET 95 -18.951 4.646 2.918 751 HG3 MET 95 HG3 MET 95 -20.334 4.105 1.971 752 HE1 MET 95 HE1 MET 95 -17.621 1.370 2.901 753 HE2 MET 95 HE2 MET 95 -17.360 2.638 4.122 754 HE3 MET 95 HE3 MET 95 -18.028 1.061 4.600 755 H ARG 96 H ARG 96 -20.608 5.804 0.619 756 HA ARG 96 HA ARG 96 -18.990 8.304 0.270 757 HB2 ARG 96 HB2 ARG 96 -21.872 7.628 -0.362 758 HB3 ARG 96 HB3 ARG 96 -21.476 9.255 0.157 759 HG2 ARG 96 HG2 ARG 96 -21.499 9.265 -2.199 760 HG3 ARG 96 HG3 ARG 96 -19.828 9.484 -1.679 761 HD2 ARG 96 HD2 ARG 96 -19.370 7.125 -2.280 762 HD3 ARG 96 HD3 ARG 96 -21.085 6.936 -2.768 763 HE ARG 96 HE ARG 96 -20.309 9.077 -4.219 764 HH11 ARG 96 HH11 ARG 96 -19.128 5.758 -4.111 765 HH12 ARG 96 HH12 ARG 96 -18.446 5.907 -5.726 766 HH21 ARG 96 HH21 ARG 96 -19.342 9.161 -6.178 767 HH22 ARG 96 HH22 ARG 96 -18.532 7.756 -6.812 768 H VAL 97 H VAL 97 -19.266 9.952 1.777 769 HA VAL 97 HA VAL 97 -20.539 9.225 4.398 770 HB VAL 97 HB VAL 97 -18.822 10.530 5.517 771 HG11 VAL 97 HG11 VAL 97 -18.606 8.077 5.253 772 HG12 VAL 97 HG12 VAL 97 -17.660 8.339 3.773 773 HG13 VAL 97 HG13 VAL 97 -17.028 8.888 5.339 774 HG21 VAL 97 HG21 VAL 97 -17.194 10.591 3.007 775 HG22 VAL 97 HG22 VAL 97 -18.152 11.988 3.556 776 HG23 VAL 97 HG23 VAL 97 -16.845 11.333 4.564 777 H ASP 98 H ASP 98 -21.124 11.155 1.920 778 HA ASP 98 HA ASP 98 -22.313 13.357 3.581 779 HB2 ASP 98 HB2 ASP 98 -21.027 13.401 0.835 780 HB3 ASP 98 HB3 ASP 98 -22.049 14.714 1.425 781 H ASN 99 H ASN 99 -23.408 10.687 2.678 782 HA ASN 99 HA ASN 99 -25.359 9.746 2.070 783 HB2 ASN 99 HB2 ASN 99 -26.721 12.443 2.292 784 HB3 ASN 99 HB3 ASN 99 -27.369 10.839 2.678 785 HD21 ASN 99 HD22 ASN 99 -25.611 9.666 4.270 786 HD22 ASN 99 HD21 ASN 99 -24.647 10.740 5.206 787 H LEU 100 H LEU 100 -23.694 11.064 0.117 788 HA LEU 100 HA LEU 100 -25.286 11.659 -2.255 789 HB2 LEU 100 HB2 LEU 100 -22.357 11.202 -1.651 790 HB3 LEU 100 HB3 LEU 100 -22.870 11.315 -3.323 791 HG LEU 100 HG LEU 100 -23.388 13.481 -1.238 792 HD11 LEU 100 HD11 LEU 100 -20.972 13.120 -1.632 793 HD12 LEU 100 HD12 LEU 100 -21.227 13.296 -3.377 794 HD13 LEU 100 HD13 LEU 100 -21.515 14.674 -2.290 795 HD21 LEU 100 HD21 LEU 100 -23.548 13.509 -4.293 796 HD22 LEU 100 HD22 LEU 100 -24.932 13.602 -3.180 797 HD23 LEU 100 HD23 LEU 100 -23.760 14.920 -3.234 798 HA PRO 101 HA PRO 101 -25.875 7.580 -3.922 799 HB2 PRO 101 HB2 PRO 101 -25.898 8.001 -6.618 800 HB3 PRO 101 HB3 PRO 101 -27.161 8.657 -5.533 801 HG2 PRO 101 HG2 PRO 101 -24.697 10.077 -6.593 802 HG3 PRO 101 HG3 PRO 101 -26.397 10.652 -6.610 803 HD2 PRO 101 HD2 PRO 101 -24.619 11.391 -4.670 804 HD3 PRO 101 HD3 PRO 101 -26.342 11.139 -4.293 805 H ASN 102 H ASN 102 -24.921 5.916 -5.373 806 HA ASN 102 HA ASN 102 -21.948 5.998 -5.171 807 HB2 ASN 102 HB2 ASN 102 -23.798 3.588 -5.275 808 HB3 ASN 102 HB3 ASN 102 -22.083 3.605 -4.868 809 HD21 ASN 102 HD22 ASN 102 -21.425 4.602 -2.771 810 HD22 ASN 102 HD21 ASN 102 -22.649 4.763 -1.516 811 H ILE 103 H ILE 103 -20.687 5.718 -6.906 812 HA ILE 103 HA ILE 103 -21.712 4.808 -9.525 813 HB ILE 103 HB ILE 103 -20.635 6.885 -10.582 814 HG12 ILE 103 HG12 ILE 103 -21.189 8.019 -7.807 815 HG13 ILE 103 HG13 ILE 103 -19.601 7.748 -8.549 816 HG21 ILE 103 HG21 ILE 103 -23.073 6.334 -10.611 817 HG22 ILE 103 HG22 ILE 103 -23.277 7.307 -9.136 818 HG23 ILE 103 HG23 ILE 103 -22.739 8.063 -10.646 819 HD11 ILE 103 HD11 ILE 103 -20.090 9.470 -10.222 820 HD12 ILE 103 HD12 ILE 103 -21.686 9.736 -9.446 821 HD13 ILE 103 HD13 ILE 103 -20.202 10.073 -8.549 822 H LYS 104 H LYS 104 -20.295 3.858 -10.745 823 HA LYS 104 HA LYS 104 -17.645 3.258 -9.607 824 HB2 LYS 104 HB2 LYS 104 -17.604 1.415 -11.202 825 HB3 LYS 104 HB3 LYS 104 -19.067 1.443 -10.245 826 HG2 LYS 104 HG2 LYS 104 -19.805 0.794 -12.309 827 HG3 LYS 104 HG3 LYS 104 -20.252 2.494 -12.254 828 HD2 LYS 104 HD2 LYS 104 -18.175 3.007 -13.578 829 HD3 LYS 104 HD3 LYS 104 -17.847 1.271 -13.715 830 HE2 LYS 104 HE2 LYS 104 -20.433 2.616 -14.658 831 HE3 LYS 104 HE3 LYS 104 -18.988 2.558 -15.665 832 HZ1 LYS 104 HZ1 LYS 104 -19.086 0.130 -15.634 833 HZ2 LYS 104 HZ2 LYS 104 -20.403 0.143 -14.651 834 HZ3 LYS 104 HZ3 LYS 104 -20.493 0.716 -16.167 835 H ILE 105 H ILE 105 -15.913 2.832 -11.319 836 HA ILE 105 HA ILE 105 -14.957 5.351 -12.307 837 HB ILE 105 HB ILE 105 -14.079 2.515 -13.020 838 HG12 ILE 105 HG12 ILE 105 -12.624 4.173 -10.989 839 HG13 ILE 105 HG13 ILE 105 -14.028 3.252 -10.461 840 HG21 ILE 105 HG21 ILE 105 -12.660 5.210 -13.255 841 HG22 ILE 105 HG22 ILE 105 -11.846 3.651 -13.445 842 HG23 ILE 105 HG23 ILE 105 -13.119 4.123 -14.579 843 HD11 ILE 105 HD11 ILE 105 -12.954 1.203 -11.392 844 HD12 ILE 105 HD12 ILE 105 -11.482 2.172 -11.698 845 HD13 ILE 105 HD13 ILE 105 -12.094 1.963 -10.047 846 H ALA 106 H ALA 106 -15.731 6.392 -14.013 847 HA ALA 106 HA ALA 106 -17.444 5.230 -16.050 848 HB1 ALA 106 HB1 ALA 106 -17.726 7.533 -15.309 849 HB2 ALA 106 HB2 ALA 106 -16.080 7.958 -15.828 850 HB3 ALA 106 HB3 ALA 106 -17.317 7.519 -17.027 851 H THR 107 H THR 107 -14.078 6.382 -16.001 852 HA THR 107 HA THR 107 -13.297 4.599 -18.220 853 HB THR 107 HB THR 107 -11.970 6.515 -19.261 854 HG1 THR 107 HG1 THR 107 -12.809 8.571 -18.970 855 HG21 THR 107 HG21 THR 107 -13.996 5.553 -20.352 856 HG22 THR 107 HG22 THR 107 -14.986 6.795 -19.550 857 HG23 THR 107 HG23 THR 107 -13.736 7.266 -20.718 858 H ARG 108 H ARG 108 -11.141 4.071 -18.205 859 HA ARG 108 HA ARG 108 -9.296 5.355 -16.275 860 HB2 ARG 108 HB2 ARG 108 -10.346 3.412 -15.117 861 HB3 ARG 108 HB3 ARG 108 -9.730 2.327 -16.355 862 HG2 ARG 108 HG2 ARG 108 -7.739 4.133 -14.998 863 HG3 ARG 108 HG3 ARG 108 -8.465 2.925 -13.990 864 HD2 ARG 108 HD2 ARG 108 -6.913 2.390 -16.550 865 HD3 ARG 108 HD3 ARG 108 -6.302 2.207 -14.904 866 HE ARG 108 HE ARG 108 -7.788 0.301 -16.418 867 HH11 ARG 108 HH11 ARG 108 -7.618 1.343 -13.068 868 HH12 ARG 108 HH12 ARG 108 -8.167 -0.199 -12.482 869 HH21 ARG 108 HH21 ARG 108 -8.082 -1.708 -15.595 870 HH22 ARG 108 HH22 ARG 108 -8.202 -1.961 -13.882 871 H LYS 109 H LYS 109 -7.270 5.447 -16.934 872 HA LYS 109 HA LYS 109 -6.101 3.671 -18.911 873 HB2 LYS 109 HB2 LYS 109 -7.460 5.468 -20.211 874 HB3 LYS 109 HB3 LYS 109 -6.229 6.617 -19.712 875 HG2 LYS 109 HG2 LYS 109 -4.524 5.485 -20.941 876 HG3 LYS 109 HG3 LYS 109 -5.473 4.003 -21.088 877 HD2 LYS 109 HD2 LYS 109 -6.214 6.628 -22.448 878 HD3 LYS 109 HD3 LYS 109 -5.292 5.321 -23.206 879 HE2 LYS 109 HE2 LYS 109 -7.194 3.747 -22.768 880 HE3 LYS 109 HE3 LYS 109 -8.136 5.092 -22.116 881 HZ1 LYS 109 HZ1 LYS 109 -7.979 6.173 -24.301 882 HZ2 LYS 109 HZ2 LYS 109 -7.128 4.913 -24.905 883 HZ3 LYS 109 HZ3 LYS 109 -8.675 4.704 -24.439 884 H TYR 110 H TYR 110 -3.827 3.858 -19.004 885 HA TYR 110 HA TYR 110 -2.553 4.839 -16.616 886 HB2 TYR 110 HB2 TYR 110 -1.764 2.862 -17.877 887 HB3 TYR 110 HB3 TYR 110 -1.392 3.878 -19.260 888 HD1 TYR 110 HD2 TYR 110 -0.727 4.322 -15.558 889 HD2 TYR 110 HD1 TYR 110 0.967 3.898 -19.511 890 HE1 TYR 110 HE2 TYR 110 1.494 4.826 -14.663 891 HE2 TYR 110 HE1 TYR 110 3.236 4.265 -18.567 892 HH TYR 110 HH TYR 110 4.459 4.688 -16.681 893 H LEU 111 H LEU 111 -1.773 6.837 -16.160 894 HA LEU 111 HA LEU 111 -1.808 8.930 -18.277 895 HB2 LEU 111 HB2 LEU 111 -1.383 9.000 -15.256 896 HB3 LEU 111 HB3 LEU 111 -1.376 10.420 -16.297 897 HG LEU 111 HG LEU 111 -3.761 8.558 -16.031 898 HD11 LEU 111 HD11 LEU 111 -3.286 9.597 -13.885 899 HD12 LEU 111 HD12 LEU 111 -3.138 11.188 -14.652 900 HD13 LEU 111 HD13 LEU 111 -4.712 10.347 -14.605 901 HD21 LEU 111 HD21 LEU 111 -3.375 11.336 -17.229 902 HD22 LEU 111 HD22 LEU 111 -3.833 9.852 -18.101 903 HD23 LEU 111 HD23 LEU 111 -4.964 10.587 -16.964 904 H GLY 112 H GLY 112 0.430 7.397 -15.988 905 HA2 GLY 112 HA2 GLY 112 2.812 7.270 -17.137 906 HA3 GLY 112 HA3 GLY 112 2.713 9.028 -16.983 907 H LYS 113 H LYS 113 4.359 9.249 -15.503 908 HA LYS 113 HA LYS 113 4.122 7.824 -12.878 909 HB2 LYS 113 HB2 LYS 113 5.931 7.070 -14.606 910 HB3 LYS 113 HB3 LYS 113 6.767 8.542 -14.088 911 HG2 LYS 113 HG2 LYS 113 6.342 7.692 -11.666 912 HG3 LYS 113 HG3 LYS 113 6.018 6.127 -12.410 913 HD2 LYS 113 HD2 LYS 113 8.589 7.753 -12.657 914 HD3 LYS 113 HD3 LYS 113 8.359 6.336 -11.631 915 HE2 LYS 113 HE2 LYS 113 7.944 4.935 -13.641 916 HE3 LYS 113 HE3 LYS 113 8.170 6.352 -14.677 917 HZ1 LYS 113 HZ1 LYS 113 10.458 6.519 -13.860 918 HZ2 LYS 113 HZ2 LYS 113 10.256 5.251 -12.858 919 HZ3 LYS 113 HZ3 LYS 113 10.214 5.029 -14.476 920 H GLN 114 H GLN 114 3.205 9.405 -11.787 921 HA GLN 114 HA GLN 114 4.419 12.095 -11.619 922 HB2 GLN 114 HB2 GLN 114 1.684 11.345 -10.631 923 HB3 GLN 114 HB3 GLN 114 2.317 12.928 -11.086 924 HG2 GLN 114 HG2 GLN 114 2.763 11.959 -13.422 925 HG3 GLN 114 HG3 GLN 114 1.838 10.539 -12.905 926 HE21 GLN 114 HE22 GLN 114 0.459 10.740 -14.539 927 HE22 GLN 114 HE21 GLN 114 -0.352 12.222 -14.828 928 H ASN 115 H ASN 115 4.635 13.129 -9.474 929 HA ASN 115 HA ASN 115 5.459 11.492 -7.345 930 HB2 ASN 115 HB2 ASN 115 5.933 14.038 -8.029 931 HB3 ASN 115 HB3 ASN 115 4.571 14.357 -6.946 932 HD21 ASN 115 HD22 ASN 115 5.018 12.327 -4.952 933 HD22 ASN 115 HD21 ASN 115 6.616 12.547 -4.331 934 H VAL 116 H VAL 116 4.218 10.233 -6.120 935 HA VAL 116 HA VAL 116 1.504 11.204 -5.318 936 HB VAL 116 HB VAL 116 0.842 8.810 -5.235 937 HG11 VAL 116 HG11 VAL 116 0.210 10.325 -7.101 938 HG12 VAL 116 HG12 VAL 116 1.615 9.747 -8.007 939 HG13 VAL 116 HG13 VAL 116 0.311 8.624 -7.566 940 HG21 VAL 116 HG21 VAL 116 3.311 8.316 -6.964 941 HG22 VAL 116 HG22 VAL 116 3.095 7.734 -5.299 942 HG23 VAL 116 HG23 VAL 116 2.019 7.165 -6.581 943 H TYR 117 H TYR 117 0.726 10.605 -3.323 944 HA TYR 117 HA TYR 117 2.769 10.109 -1.205 945 HB2 TYR 117 HB2 TYR 117 0.629 12.252 -1.152 946 HB3 TYR 117 HB3 TYR 117 2.006 12.075 -0.091 947 HD1 TYR 117 HD2 TYR 117 4.289 12.765 -0.810 948 HD2 TYR 117 HD1 TYR 117 0.856 13.278 -3.375 949 HE1 TYR 117 HE2 TYR 117 5.542 14.440 -2.150 950 HE2 TYR 117 HE1 TYR 117 2.141 14.905 -4.746 951 HH TYR 117 HH TYR 117 4.070 16.119 -4.953 952 H ASP 118 H ASP 118 1.914 9.506 0.839 953 HA ASP 118 HA ASP 118 -0.932 8.757 1.126 954 HB2 ASP 118 HB2 ASP 118 -0.055 6.829 -0.042 955 HB3 ASP 118 HB3 ASP 118 1.346 6.743 1.030 956 H ILE 119 H ILE 119 -1.449 9.496 3.131 957 HA ILE 119 HA ILE 119 0.601 9.708 5.243 958 HB ILE 119 HB ILE 119 -1.259 10.541 6.636 959 HG12 ILE 119 HG12 ILE 119 -2.915 10.530 4.070 960 HG13 ILE 119 HG13 ILE 119 -3.146 9.421 5.431 961 HG21 ILE 119 HG21 ILE 119 0.311 11.973 5.358 962 HG22 ILE 119 HG22 ILE 119 -0.838 12.024 4.003 963 HG23 ILE 119 HG23 ILE 119 -1.256 12.743 5.578 964 HD11 ILE 119 HD11 ILE 119 -3.580 11.342 6.923 965 HD12 ILE 119 HD12 ILE 119 -3.493 12.434 5.514 966 HD13 ILE 119 HD13 ILE 119 -4.747 11.189 5.581 967 H GLY 120 H GLY 120 0.708 8.548 7.112 968 HA2 GLY 120 HA2 GLY 120 -0.696 5.894 7.152 969 HA3 GLY 120 HA3 GLY 120 0.851 6.242 7.909 970 H VAL 121 H VAL 121 -1.360 5.094 9.268 971 HA VAL 121 HA VAL 121 -2.158 7.184 11.245 972 HB VAL 121 HB VAL 121 -4.162 5.276 10.035 973 HG11 VAL 121 HG11 VAL 121 -4.883 6.212 12.151 974 HG12 VAL 121 HG12 VAL 121 -4.449 7.859 11.610 975 HG13 VAL 121 HG13 VAL 121 -5.782 6.973 10.849 976 HG21 VAL 121 HG21 VAL 121 -3.690 8.146 9.136 977 HG22 VAL 121 HG22 VAL 121 -3.504 6.682 8.136 978 HG23 VAL 121 HG23 VAL 121 -5.096 7.149 8.700 979 H GLU 122 H GLU 122 -3.056 6.198 13.277 980 HA GLU 122 HA GLU 122 -1.486 3.834 14.042 981 HB2 GLU 122 HB2 GLU 122 -3.409 5.566 15.647 982 HB3 GLU 122 HB3 GLU 122 -2.420 4.245 16.285 983 HG2 GLU 122 HG2 GLU 122 -0.371 5.488 15.402 984 HG3 GLU 122 HG3 GLU 122 -1.439 6.858 15.080 985 H ARG 123 H ARG 123 -2.150 1.800 14.044 986 HA ARG 123 HA ARG 123 -3.360 -0.069 13.639 987 HB2 ARG 123 HB2 ARG 123 -4.008 0.736 16.053 988 HB3 ARG 123 HB3 ARG 123 -5.572 1.098 15.342 989 HG2 ARG 123 HG2 ARG 123 -5.868 -1.043 16.232 990 HG3 ARG 123 HG3 ARG 123 -5.574 -1.390 14.540 991 HD2 ARG 123 HD2 ARG 123 -4.239 -2.967 15.604 992 HD3 ARG 123 HD3 ARG 123 -3.083 -1.706 15.205 993 HE ARG 123 HE ARG 123 -2.785 -1.253 17.476 994 HH11 ARG 123 HH11 ARG 123 -5.606 -3.343 17.208 995 HH12 ARG 123 HH12 ARG 123 -5.671 -3.612 18.931 996 HH21 ARG 123 HH21 ARG 123 -2.942 -1.650 19.655 997 HH22 ARG 123 HH22 ARG 123 -4.208 -2.683 20.267 998 H ASP 124 H ASP 124 -3.825 2.118 11.727 999 HA ASP 124 HA ASP 124 -6.089 1.044 10.203 1000 HB2 ASP 124 HB2 ASP 124 -7.103 2.645 11.882 1001 HB3 ASP 124 HB3 ASP 124 -6.091 3.924 11.219 1002 H HIS 125 H HIS 125 -6.146 2.071 7.988 1003 HA HIS 125 HA HIS 125 -3.688 3.532 7.193 1004 HB2 HIS 125 HB2 HIS 125 -4.505 0.849 6.007 1005 HB3 HIS 125 HB3 HIS 125 -3.181 1.880 5.475 1006 HD1 HIS 125 HD1 HIS 125 -1.035 2.105 7.229 1007 HD2 HIS 125 HD2 HIS 125 -3.914 -0.891 7.911 1008 HE1 HIS 125 HE1 HIS 125 0.036 0.441 8.832 1009 H ASN 126 H ASN 126 -6.665 4.120 7.237 1010 HA ASN 126 HA ASN 126 -7.071 4.849 4.395 1011 HB2 ASN 126 HB2 ASN 126 -9.446 3.832 4.699 1012 HB3 ASN 126 HB3 ASN 126 -8.101 2.760 4.431 1013 HD21 ASN 126 HD22 ASN 126 -10.294 3.901 7.027 1014 HD22 ASN 126 HD21 ASN 126 -9.708 2.698 8.156 1015 H PHE 127 H PHE 127 -8.915 6.233 3.974 1016 HA PHE 127 HA PHE 127 -9.980 7.937 6.087 1017 HB2 PHE 127 HB2 PHE 127 -8.701 9.987 5.256 1018 HB3 PHE 127 HB3 PHE 127 -7.818 8.856 6.250 1019 HD1 PHE 127 HD1 PHE 127 -8.390 9.811 2.657 1020 HD2 PHE 127 HD2 PHE 127 -5.775 7.909 5.515 1021 HE1 PHE 127 HE1 PHE 127 -6.645 9.573 0.912 1022 HE2 PHE 127 HE2 PHE 127 -4.034 7.674 3.761 1023 HZ PHE 127 HZ PHE 127 -4.464 8.501 1.460 1024 H ALA 128 H ALA 128 -11.146 9.846 5.217 1025 HA ALA 128 HA ALA 128 -12.468 9.190 2.666 1026 HB1 ALA 128 HB1 ALA 128 -13.816 9.557 4.682 1027 HB2 ALA 128 HB2 ALA 128 -13.158 11.205 4.834 1028 HB3 ALA 128 HB3 ALA 128 -14.173 10.769 3.442 1029 H LEU 129 H LEU 129 -12.911 10.718 1.061 1030 HA LEU 129 HA LEU 129 -10.914 12.911 0.659 1031 HB2 LEU 129 HB2 LEU 129 -12.621 11.406 -1.372 1032 HB3 LEU 129 HB3 LEU 129 -11.384 12.606 -1.722 1033 HG LEU 129 HG LEU 129 -10.936 9.804 -0.585 1034 HD11 LEU 129 HD11 LEU 129 -11.392 9.863 -3.001 1035 HD12 LEU 129 HD12 LEU 129 -10.168 11.134 -3.215 1036 HD13 LEU 129 HD13 LEU 129 -9.688 9.496 -2.722 1037 HD21 LEU 129 HD21 LEU 129 -8.920 11.980 -1.163 1038 HD22 LEU 129 HD22 LEU 129 -9.296 11.259 0.421 1039 HD23 LEU 129 HD23 LEU 129 -8.522 10.275 -0.821 1040 H LYS 130 H LYS 130 -11.685 14.757 -0.646 1041 HA LYS 130 HA LYS 130 -13.575 16.330 0.520 1042 HB2 LYS 130 HB2 LYS 130 -11.994 17.193 -1.060 1043 HB3 LYS 130 HB3 LYS 130 -12.671 16.249 -2.391 1044 HG2 LYS 130 HG2 LYS 130 -14.680 17.566 -2.437 1045 HG3 LYS 130 HG3 LYS 130 -14.256 18.389 -0.925 1046 HD2 LYS 130 HD2 LYS 130 -12.320 19.442 -2.038 1047 HD3 LYS 130 HD3 LYS 130 -12.722 18.633 -3.558 1048 HE2 LYS 130 HE2 LYS 130 -14.604 20.540 -2.083 1049 HE3 LYS 130 HE3 LYS 130 -13.463 21.065 -3.322 1050 HZ1 LYS 130 HZ1 LYS 130 -14.592 19.624 -4.919 1051 HZ2 LYS 130 HZ2 LYS 130 -15.660 19.108 -3.790 1052 HZ3 LYS 130 HZ3 LYS 130 -15.657 20.665 -4.267 1053 H ASN 131 H ASN 131 -14.376 14.328 -2.312 1054 HA ASN 131 HA ASN 131 -17.182 15.204 -2.262 1055 HB2 ASN 131 HB2 ASN 131 -15.643 13.248 -3.994 1056 HB3 ASN 131 HB3 ASN 131 -17.312 13.718 -4.293 1057 HD21 ASN 131 HD22 ASN 131 -14.392 14.252 -5.534 1058 HD22 ASN 131 HD21 ASN 131 -14.564 15.936 -5.998 1059 H GLY 132 H GLY 132 -15.706 13.106 -0.250 1060 HA2 GLY 132 HA2 GLY 132 -16.859 11.969 1.371 1061 HA3 GLY 132 HA3 GLY 132 -18.206 11.638 0.281 1062 H PHE 133 H PHE 133 -15.522 10.797 -1.481 1063 HA PHE 133 HA PHE 133 -15.996 7.967 -1.236 1064 HB2 PHE 133 HB2 PHE 133 -13.549 9.198 -2.492 1065 HB3 PHE 133 HB3 PHE 133 -14.406 7.739 -2.961 1066 HD1 PHE 133 HD2 PHE 133 -17.254 8.953 -3.019 1067 HD2 PHE 133 HD1 PHE 133 -13.477 10.324 -4.570 1068 HE1 PHE 133 HE2 PHE 133 -18.438 10.474 -4.598 1069 HE2 PHE 133 HE1 PHE 133 -14.673 11.709 -6.258 1070 HZ PHE 133 HZ PHE 133 -17.153 11.782 -6.274 1071 H ILE 134 H ILE 134 -14.239 6.318 -0.782 1072 HA ILE 134 HA ILE 134 -12.448 7.206 1.468 1073 HB ILE 134 HB ILE 134 -13.308 4.395 1.081 1074 HG12 ILE 134 HG12 ILE 134 -15.440 5.421 1.205 1075 HG13 ILE 134 HG13 ILE 134 -15.104 4.505 2.662 1076 HG21 ILE 134 HG21 ILE 134 -11.485 4.652 2.641 1077 HG22 ILE 134 HG22 ILE 134 -12.371 5.910 3.535 1078 HG23 ILE 134 HG23 ILE 134 -12.927 4.226 3.549 1079 HD11 ILE 134 HD11 ILE 134 -14.679 6.593 3.912 1080 HD12 ILE 134 HD12 ILE 134 -15.000 7.539 2.437 1081 HD13 ILE 134 HD13 ILE 134 -16.289 6.562 3.159 1082 H ALA 135 H ALA 135 -10.416 6.551 1.477 1083 HA ALA 135 HA ALA 135 -9.337 4.846 -0.727 1084 HB1 ALA 135 HB1 ALA 135 -9.230 7.402 -1.105 1085 HB2 ALA 135 HB2 ALA 135 -8.013 7.410 0.193 1086 HB3 ALA 135 HB3 ALA 135 -7.758 6.484 -1.311 1087 H SER 136 H SER 136 -7.631 3.528 -0.165 1088 HA SER 136 HA SER 136 -6.621 3.477 2.644 1089 HB2 SER 136 HB2 SER 136 -8.597 2.025 2.430 1090 HB3 SER 136 HB3 SER 136 -7.858 1.197 1.057 1091 HG SER 136 HG SER 136 -7.584 0.106 3.108 1092 H ASN 137 H ASN 137 -4.612 2.587 2.966 1093 HA ASN 137 HA ASN 137 -2.690 3.214 1.154 1094 HB2 ASN 137 HB2 ASN 137 -1.064 2.310 2.504 1095 HB3 ASN 137 HB3 ASN 137 -2.352 2.718 3.610 1096 HD21 ASN 137 HD22 ASN 137 -0.002 0.583 3.330 1097 HD22 ASN 137 HD21 ASN 137 -0.796 -0.866 3.927 Start of MODEL 11 1 H1 GLY -1 H GLY -1 -1.419 -1.542 0.315 2 HA2 GLY -1 HA2 GLY -1 -0.098 0.436 0.391 3 HA3 GLY -1 HA3 GLY -1 0.297 -0.518 -1.055 4 H GLY 0 H GLY 0 0.657 0.895 -2.741 5 HA2 GLY 0 HA2 GLY 0 0.348 2.470 -4.279 6 HA3 GLY 0 HA3 GLY 0 -1.335 2.613 -3.780 7 H ALA 1 H ALA 1 -0.832 4.818 -4.456 8 HA ALA 1 HA ALA 1 -0.835 6.459 -2.111 9 HB1 ALA 1 HB1 ALA 1 1.536 6.449 -2.215 10 HB2 ALA 1 HB2 ALA 1 1.539 6.629 -3.986 11 HB3 ALA 1 HB3 ALA 1 1.043 7.970 -2.935 12 H LEU 2 H LEU 2 -1.087 8.838 -2.816 13 HA LEU 2 HA LEU 2 -2.981 8.976 -5.137 14 HB2 LEU 2 HB2 LEU 2 -2.920 10.563 -2.544 15 HB3 LEU 2 HB3 LEU 2 -4.110 10.670 -3.817 16 HG LEU 2 HG LEU 2 -5.184 9.600 -2.088 17 HD11 LEU 2 HD11 LEU 2 -5.587 8.479 -4.236 18 HD12 LEU 2 HD12 LEU 2 -4.294 7.313 -3.875 19 HD13 LEU 2 HD13 LEU 2 -5.744 7.372 -2.863 20 HD21 LEU 2 HD21 LEU 2 -2.898 7.658 -1.702 21 HD22 LEU 2 HD22 LEU 2 -3.254 9.068 -0.693 22 HD23 LEU 2 HD23 LEU 2 -4.397 7.735 -0.807 23 H SER 3 H SER 3 -2.962 10.922 -6.421 24 HA SER 3 HA SER 3 -0.319 12.202 -6.536 25 HB2 SER 3 HB2 SER 3 -1.841 11.532 -8.518 26 HB3 SER 3 HB3 SER 3 -2.694 13.059 -8.192 27 HG SER 3 HG SER 3 -0.631 12.879 -9.639 28 H TYR 4 H TYR 4 -0.137 14.616 -6.718 29 HA TYR 4 HA TYR 4 -0.352 15.649 -4.155 30 HB2 TYR 4 HB2 TYR 4 1.187 16.517 -5.810 31 HB3 TYR 4 HB3 TYR 4 -0.117 17.050 -6.844 32 HD1 TYR 4 HD1 TYR 4 1.804 17.801 -3.776 33 HD2 TYR 4 HD2 TYR 4 -1.364 19.099 -6.403 34 HE1 TYR 4 HE1 TYR 4 1.789 20.025 -2.655 35 HE2 TYR 4 HE2 TYR 4 -1.372 21.329 -5.288 36 HH TYR 4 HH TYR 4 0.872 22.114 -2.618 37 H GLU 5 H GLU 5 -2.442 16.425 -6.891 38 HA GLU 5 HA GLU 5 -4.167 18.277 -5.596 39 HB2 GLU 5 HB2 GLU 5 -5.493 18.048 -7.654 40 HB3 GLU 5 HB3 GLU 5 -3.787 18.287 -7.974 41 HG2 GLU 5 HG2 GLU 5 -4.744 15.433 -7.912 42 HG3 GLU 5 HG3 GLU 5 -5.330 16.447 -9.219 43 H THR 6 H THR 6 -4.077 15.035 -4.856 44 HA THR 6 HA THR 6 -6.936 14.484 -4.671 45 HB THR 6 HB THR 6 -4.656 13.058 -3.273 46 HG1 THR 6 HG1 THR 6 -4.299 12.908 -5.357 47 HG21 THR 6 HG21 THR 6 -6.744 12.466 -2.251 48 HG22 THR 6 HG22 THR 6 -7.566 12.351 -3.839 49 HG23 THR 6 HG23 THR 6 -6.338 11.162 -3.365 50 H GLU 7 H GLU 7 -8.095 15.861 -3.348 51 HA GLU 7 HA GLU 7 -6.808 16.998 -0.993 52 HB2 GLU 7 HB2 GLU 7 -9.658 17.412 -1.866 53 HB3 GLU 7 HB3 GLU 7 -8.722 18.391 -0.744 54 HG2 GLU 7 HG2 GLU 7 -7.082 18.855 -2.655 55 HG3 GLU 7 HG3 GLU 7 -8.264 18.119 -3.739 56 H ILE 8 H ILE 8 -7.023 16.486 1.048 57 HA ILE 8 HA ILE 8 -8.888 14.295 1.870 58 HB ILE 8 HB ILE 8 -6.371 15.255 3.283 59 HG12 ILE 8 HG12 ILE 8 -5.575 14.406 1.217 60 HG13 ILE 8 HG13 ILE 8 -5.234 13.223 2.468 61 HG21 ILE 8 HG21 ILE 8 -7.937 14.125 4.764 62 HG22 ILE 8 HG22 ILE 8 -8.100 12.767 3.637 63 HG23 ILE 8 HG23 ILE 8 -6.559 13.068 4.462 64 HD11 ILE 8 HD11 ILE 8 -7.198 11.869 1.678 65 HD12 ILE 8 HD12 ILE 8 -7.448 13.047 0.374 66 HD13 ILE 8 HD13 ILE 8 -5.961 12.095 0.424 67 H LEU 9 H LEU 9 -10.565 14.927 3.080 68 HA LEU 9 HA LEU 9 -10.813 17.577 4.198 69 HB2 LEU 9 HB2 LEU 9 -12.635 15.844 3.484 70 HB3 LEU 9 HB3 LEU 9 -12.458 15.175 5.088 71 HG LEU 9 HG LEU 9 -12.873 18.167 4.776 72 HD11 LEU 9 HD11 LEU 9 -14.597 17.131 3.323 73 HD12 LEU 9 HD12 LEU 9 -15.111 16.100 4.678 74 HD13 LEU 9 HD13 LEU 9 -15.305 17.870 4.764 75 HD21 LEU 9 HD21 LEU 9 -13.850 16.193 6.828 76 HD22 LEU 9 HD22 LEU 9 -12.481 17.330 7.013 77 HD23 LEU 9 HD23 LEU 9 -14.127 17.948 6.847 78 H THR 10 H THR 10 -9.904 18.343 5.983 79 HA THR 10 HA THR 10 -9.063 16.499 8.181 80 HB THR 10 HB THR 10 -7.207 18.041 8.647 81 HG1 THR 10 HG1 THR 10 -7.889 19.216 6.162 82 HG21 THR 10 HG21 THR 10 -6.740 16.075 7.273 83 HG22 THR 10 HG22 THR 10 -7.135 16.979 5.795 84 HG23 THR 10 HG23 THR 10 -5.737 17.450 6.787 85 H VAL 11 H VAL 11 -9.205 17.198 10.297 86 HA VAL 11 HA VAL 11 -11.328 19.105 10.871 87 HB VAL 11 HB VAL 11 -9.385 17.850 12.834 88 HG11 VAL 11 HG11 VAL 11 -10.676 19.660 13.864 89 HG12 VAL 11 HG12 VAL 11 -12.189 18.982 13.218 90 HG13 VAL 11 HG13 VAL 11 -11.261 18.108 14.456 91 HG21 VAL 11 HG21 VAL 11 -12.081 16.798 11.878 92 HG22 VAL 11 HG22 VAL 11 -10.505 16.039 11.562 93 HG23 VAL 11 HG23 VAL 11 -11.120 16.122 13.215 94 H GLU 12 H GLU 12 -7.809 19.287 10.927 95 HA GLU 12 HA GLU 12 -7.582 21.716 12.445 96 HB2 GLU 12 HB2 GLU 12 -5.828 20.131 10.581 97 HB3 GLU 12 HB3 GLU 12 -5.288 21.740 11.074 98 HG2 GLU 12 HG2 GLU 12 -5.980 19.476 12.990 99 HG3 GLU 12 HG3 GLU 12 -4.355 19.956 12.499 100 H TYR 13 H TYR 13 -8.164 21.226 8.990 101 HA TYR 13 HA TYR 13 -8.307 24.199 8.622 102 HB2 TYR 13 HB2 TYR 13 -6.763 22.237 6.881 103 HB3 TYR 13 HB3 TYR 13 -7.092 23.906 6.455 104 HD1 TYR 13 HD2 TYR 13 -6.392 25.692 8.371 105 HD2 TYR 13 HD1 TYR 13 -4.615 21.805 7.758 106 HE1 TYR 13 HE2 TYR 13 -4.312 26.470 9.488 107 HE2 TYR 13 HE1 TYR 13 -2.523 22.594 8.864 108 HH TYR 13 HH TYR 13 -2.200 25.922 10.142 109 H GLY 14 H GLY 14 -8.902 21.050 6.983 110 HA2 GLY 14 HA2 GLY 14 -11.401 20.845 6.266 111 HA3 GLY 14 HA3 GLY 14 -11.063 22.322 5.360 112 H LEU 15 H LEU 15 -11.419 21.367 3.393 113 HA LEU 15 HA LEU 15 -10.079 19.070 2.283 114 HB2 LEU 15 HB2 LEU 15 -10.889 21.454 0.605 115 HB3 LEU 15 HB3 LEU 15 -10.992 19.748 0.235 116 HG LEU 15 HG LEU 15 -12.822 21.377 2.051 117 HD11 LEU 15 HD11 LEU 15 -13.116 21.853 -0.298 118 HD12 LEU 15 HD12 LEU 15 -13.279 20.129 -0.667 119 HD13 LEU 15 HD13 LEU 15 -14.507 20.953 0.325 120 HD21 LEU 15 HD21 LEU 15 -12.484 18.455 1.891 121 HD22 LEU 15 HD22 LEU 15 -13.345 19.473 3.061 122 HD23 LEU 15 HD23 LEU 15 -14.151 18.992 1.571 123 H LEU 16 H LEU 16 -7.833 18.969 2.298 124 HA LEU 16 HA LEU 16 -6.397 21.087 0.776 125 HB2 LEU 16 HB2 LEU 16 -5.600 19.805 3.424 126 HB3 LEU 16 HB3 LEU 16 -4.441 20.633 2.396 127 HG LEU 16 HG LEU 16 -6.874 21.939 3.689 128 HD11 LEU 16 HD11 LEU 16 -5.117 21.316 5.265 129 HD12 LEU 16 HD12 LEU 16 -3.887 22.109 4.256 130 HD13 LEU 16 HD13 LEU 16 -5.148 23.077 5.042 131 HD21 LEU 16 HD21 LEU 16 -4.595 23.143 2.043 132 HD22 LEU 16 HD22 LEU 16 -6.309 23.085 1.575 133 HD23 LEU 16 HD23 LEU 16 -5.817 24.065 2.953 134 HA PRO 17 HA PRO 17 -4.641 17.801 -1.606 135 HB2 PRO 17 HB2 PRO 17 -2.181 18.865 -2.298 136 HB3 PRO 17 HB3 PRO 17 -3.743 19.363 -3.018 137 HG2 PRO 17 HG2 PRO 17 -2.200 20.671 -0.769 138 HG3 PRO 17 HG3 PRO 17 -2.943 21.450 -2.205 139 HD2 PRO 17 HD2 PRO 17 -4.182 21.436 0.196 140 HD3 PRO 17 HD3 PRO 17 -5.122 21.204 -1.308 141 H ILE 18 H ILE 18 -3.854 15.899 -0.961 142 HA ILE 18 HA ILE 18 -2.501 15.438 1.457 143 HB ILE 18 HB ILE 18 -3.771 13.754 0.179 144 HG12 ILE 18 HG12 ILE 18 -0.942 12.828 0.823 145 HG13 ILE 18 HG13 ILE 18 -2.162 13.228 2.043 146 HG21 ILE 18 HG21 ILE 18 -2.778 14.247 -2.099 147 HG22 ILE 18 HG22 ILE 18 -1.330 13.349 -1.589 148 HG23 ILE 18 HG23 ILE 18 -2.905 12.551 -1.669 149 HD11 ILE 18 HD11 ILE 18 -3.665 11.462 1.020 150 HD12 ILE 18 HD12 ILE 18 -2.294 10.993 -0.004 151 HD13 ILE 18 HD13 ILE 18 -2.165 10.859 1.764 152 H GLY 19 H GLY 19 -1.077 16.054 -1.747 153 HA2 GLY 19 HA2 GLY 19 1.561 15.179 -1.100 154 HA3 GLY 19 HA3 GLY 19 1.136 16.318 -2.384 155 H LYS 20 H LYS 20 -0.081 18.253 -0.419 156 HA LYS 20 HA LYS 20 2.369 19.649 0.366 157 HB2 LYS 20 HB2 LYS 20 0.197 20.694 -0.491 158 HB3 LYS 20 HB3 LYS 20 -0.505 20.349 1.100 159 HG2 LYS 20 HG2 LYS 20 1.280 21.742 2.158 160 HG3 LYS 20 HG3 LYS 20 1.989 22.027 0.556 161 HD2 LYS 20 HD2 LYS 20 -0.187 23.103 -0.158 162 HD3 LYS 20 HD3 LYS 20 -0.799 22.853 1.479 163 HE2 LYS 20 HE2 LYS 20 -0.085 25.112 1.388 164 HE3 LYS 20 HE3 LYS 20 1.115 24.252 2.355 165 HZ1 LYS 20 HZ1 LYS 20 2.563 24.211 0.375 166 HZ2 LYS 20 HZ2 LYS 20 1.424 24.981 -0.519 167 HZ3 LYS 20 HZ3 LYS 20 2.142 25.747 0.726 168 H ILE 21 H ILE 21 -0.133 17.718 2.015 169 HA ILE 21 HA ILE 21 0.761 18.307 4.691 170 HB ILE 21 HB ILE 21 -0.832 15.998 3.582 171 HG12 ILE 21 HG12 ILE 21 -1.818 18.292 5.336 172 HG13 ILE 21 HG13 ILE 21 -1.755 18.458 3.585 173 HG21 ILE 21 HG21 ILE 21 0.146 15.148 5.591 174 HG22 ILE 21 HG22 ILE 21 -0.298 16.609 6.494 175 HG23 ILE 21 HG23 ILE 21 -1.538 15.490 5.909 176 HD11 ILE 21 HD11 ILE 21 -3.237 16.482 3.329 177 HD12 ILE 21 HD12 ILE 21 -3.422 16.422 5.099 178 HD13 ILE 21 HD13 ILE 21 -3.984 17.839 4.192 179 H VAL 22 H VAL 22 1.625 15.785 2.345 180 HA VAL 22 HA VAL 22 3.442 14.448 4.206 181 HB VAL 22 HB VAL 22 2.863 14.091 1.252 182 HG11 VAL 22 HG11 VAL 22 5.108 13.184 1.760 183 HG12 VAL 22 HG12 VAL 22 4.438 12.250 3.112 184 HG13 VAL 22 HG13 VAL 22 3.952 11.891 1.451 185 HG21 VAL 22 HG21 VAL 22 2.012 12.504 3.729 186 HG22 VAL 22 HG22 VAL 22 0.955 13.586 2.795 187 HG23 VAL 22 HG23 VAL 22 1.583 12.116 2.056 188 H GLU 23 H GLU 23 3.916 16.692 1.422 189 HA GLU 23 HA GLU 23 6.815 16.577 1.588 190 HB2 GLU 23 HB2 GLU 23 4.896 18.570 0.329 191 HB3 GLU 23 HB3 GLU 23 6.639 18.758 0.249 192 HG2 GLU 23 HG2 GLU 23 5.285 16.223 -0.733 193 HG3 GLU 23 HG3 GLU 23 5.503 17.642 -1.755 194 H LYS 24 H LYS 24 4.407 18.435 3.314 195 HA LYS 24 HA LYS 24 6.553 20.001 4.706 196 HB2 LYS 24 HB2 LYS 24 3.598 20.636 4.533 197 HB3 LYS 24 HB3 LYS 24 4.851 21.668 5.173 198 HG2 LYS 24 HG2 LYS 24 4.612 20.803 2.253 199 HG3 LYS 24 HG3 LYS 24 4.018 22.321 2.892 200 HD2 LYS 24 HD2 LYS 24 6.952 21.513 3.045 201 HD3 LYS 24 HD3 LYS 24 6.260 22.415 1.696 202 HE2 LYS 24 HE2 LYS 24 5.608 24.252 3.117 203 HE3 LYS 24 HE3 LYS 24 6.026 23.358 4.581 204 HZ1 LYS 24 HZ1 LYS 24 8.353 23.416 3.898 205 HZ2 LYS 24 HZ2 LYS 24 7.986 24.213 2.517 206 HZ3 LYS 24 HZ3 LYS 24 7.767 24.936 3.965 207 H ARG 25 H ARG 25 4.968 17.256 5.224 208 HA ARG 25 HA ARG 25 4.387 15.955 7.018 209 HB2 ARG 25 HB2 ARG 25 6.762 17.549 8.056 210 HB3 ARG 25 HB3 ARG 25 6.100 16.177 8.937 211 HG2 ARG 25 HG2 ARG 25 6.761 15.718 6.026 212 HG3 ARG 25 HG3 ARG 25 8.105 15.919 7.141 213 HD2 ARG 25 HD2 ARG 25 7.276 14.166 8.593 214 HD3 ARG 25 HD3 ARG 25 5.855 13.963 7.556 215 HE ARG 25 HE ARG 25 7.823 13.534 5.757 216 HH11 ARG 25 HH11 ARG 25 7.559 12.174 8.990 217 HH12 ARG 25 HH12 ARG 25 8.286 10.666 8.506 218 HH21 ARG 25 HH21 ARG 25 8.742 11.577 5.222 219 HH22 ARG 25 HH22 ARG 25 8.933 10.348 6.438 220 H ILE 26 H ILE 26 2.450 17.637 6.824 221 HA ILE 26 HA ILE 26 2.181 19.456 9.091 222 HB ILE 26 HB ILE 26 0.107 18.757 6.984 223 HG12 ILE 26 HG12 ILE 26 2.182 20.998 7.049 224 HG13 ILE 26 HG13 ILE 26 2.193 19.608 5.964 225 HG21 ILE 26 HG21 ILE 26 -0.811 19.827 9.047 226 HG22 ILE 26 HG22 ILE 26 0.348 21.160 8.853 227 HG23 ILE 26 HG23 ILE 26 -0.934 20.885 7.653 228 HD11 ILE 26 HD11 ILE 26 0.006 20.384 4.995 229 HD12 ILE 26 HD12 ILE 26 0.200 21.884 5.937 230 HD13 ILE 26 HD13 ILE 26 1.395 21.444 4.703 231 H GLU 27 H GLU 27 1.524 18.928 11.022 232 HA GLU 27 HA GLU 27 0.254 16.386 11.697 233 HB2 GLU 27 HB2 GLU 27 0.929 18.851 13.350 234 HB3 GLU 27 HB3 GLU 27 0.133 17.404 13.989 235 HG2 GLU 27 HG2 GLU 27 2.057 16.022 13.192 236 HG3 GLU 27 HG3 GLU 27 2.895 17.500 12.708 237 H CYS 28 H CYS 28 -1.772 15.985 11.260 238 HA CYS 28 HA CYS 28 -3.902 17.877 11.988 239 HB2 CYS 28 HB2 CYS 28 -4.902 17.743 9.685 240 HB3 CYS 28 HB3 CYS 28 -3.367 18.603 9.743 241 HG CYS 28 HG CYS 28 -1.853 16.631 8.936 242 H THR 29 H THR 29 -6.073 16.960 11.496 243 HA THR 29 HA THR 29 -6.198 14.069 12.291 244 HB THR 29 HB THR 29 -8.337 16.109 12.834 245 HG1 THR 29 HG1 THR 29 -7.430 16.511 14.838 246 HG21 THR 29 HG21 THR 29 -8.786 13.672 13.272 247 HG22 THR 29 HG22 THR 29 -7.512 13.735 14.520 248 HG23 THR 29 HG23 THR 29 -8.974 14.723 14.679 249 H VAL 30 H VAL 30 -7.742 12.785 11.303 250 HA VAL 30 HA VAL 30 -9.120 13.855 8.861 251 HB VAL 30 HB VAL 30 -8.558 11.771 7.692 252 HG11 VAL 30 HG11 VAL 30 -7.167 13.774 7.375 253 HG12 VAL 30 HG12 VAL 30 -6.062 13.213 8.654 254 HG13 VAL 30 HG13 VAL 30 -6.257 12.274 7.160 255 HG21 VAL 30 HG21 VAL 30 -6.661 11.139 9.990 256 HG22 VAL 30 HG22 VAL 30 -8.164 10.259 9.620 257 HG23 VAL 30 HG23 VAL 30 -6.823 10.249 8.465 258 H TYR 31 H TYR 31 -10.762 12.275 8.018 259 HA TYR 31 HA TYR 31 -12.426 11.244 10.264 260 HB2 TYR 31 HB2 TYR 31 -13.203 12.207 7.477 261 HB3 TYR 31 HB3 TYR 31 -14.288 11.415 8.590 262 HD1 TYR 31 HD1 TYR 31 -12.226 14.508 8.107 263 HD2 TYR 31 HD2 TYR 31 -15.418 12.589 10.296 264 HE1 TYR 31 HE1 TYR 31 -12.805 16.678 9.192 265 HE2 TYR 31 HE2 TYR 31 -16.043 14.770 11.310 266 HH TYR 31 HH TYR 31 -15.561 16.992 11.450 267 H SER 32 H SER 32 -13.232 9.210 10.184 268 HA SER 32 HA SER 32 -12.717 7.375 7.918 269 HB2 SER 32 HB2 SER 32 -10.608 7.268 9.010 270 HB3 SER 32 HB3 SER 32 -11.335 7.337 10.614 271 HG SER 32 HG SER 32 -10.633 5.242 10.059 272 H VAL 33 H VAL 33 -13.939 5.412 8.119 273 HA VAL 33 HA VAL 33 -16.184 5.555 10.071 274 HB VAL 33 HB VAL 33 -16.135 3.397 7.987 275 HG11 VAL 33 HG11 VAL 33 -17.819 3.605 9.799 276 HG12 VAL 33 HG12 VAL 33 -18.330 5.166 9.124 277 HG13 VAL 33 HG13 VAL 33 -18.520 3.677 8.168 278 HG21 VAL 33 HG21 VAL 33 -16.930 6.279 7.360 279 HG22 VAL 33 HG22 VAL 33 -15.658 5.334 6.548 280 HG23 VAL 33 HG23 VAL 33 -17.348 4.854 6.382 281 H ASP 34 H ASP 34 -16.166 4.318 11.826 282 HA ASP 34 HA ASP 34 -13.990 2.517 12.446 283 HB2 ASP 34 HB2 ASP 34 -15.668 4.015 13.959 284 HB3 ASP 34 HB3 ASP 34 -16.529 2.488 14.039 285 H ASN 35 H ASN 35 -14.609 0.415 13.491 286 HA ASN 35 HA ASN 35 -15.385 -1.551 11.557 287 HB2 ASN 35 HB2 ASN 35 -15.148 -1.740 14.600 288 HB3 ASN 35 HB3 ASN 35 -15.224 -3.107 13.494 289 HD21 ASN 35 HD22 ASN 35 -13.164 -0.408 14.601 290 HD22 ASN 35 HD21 ASN 35 -11.696 -1.107 13.937 291 H ASN 36 H ASN 36 -17.290 0.172 13.957 292 HA ASN 36 HA ASN 36 -19.666 -1.538 13.733 293 HB2 ASN 36 HB2 ASN 36 -19.408 1.252 14.931 294 HB3 ASN 36 HB3 ASN 36 -20.653 0.063 15.272 295 HD21 ASN 36 HD22 ASN 36 -18.050 1.443 16.679 296 HD22 ASN 36 HD21 ASN 36 -17.499 0.093 17.661 297 H GLY 37 H GLY 37 -18.343 0.829 11.686 298 HA2 GLY 37 HA2 GLY 37 -19.190 1.908 9.854 299 HA3 GLY 37 HA3 GLY 37 -20.814 1.361 10.212 300 H ASN 38 H ASN 38 -18.939 3.059 12.678 301 HA ASN 38 HA ASN 38 -20.691 5.480 12.470 302 HB2 ASN 38 HB2 ASN 38 -18.684 4.763 14.650 303 HB3 ASN 38 HB3 ASN 38 -19.931 6.003 14.701 304 HD21 ASN 38 HD22 ASN 38 -22.098 4.196 13.656 305 HD22 ASN 38 HD21 ASN 38 -22.436 3.145 15.021 306 H ILE 39 H ILE 39 -19.796 7.448 11.727 307 HA ILE 39 HA ILE 39 -17.000 7.524 10.880 308 HB ILE 39 HB ILE 39 -19.026 9.780 10.990 309 HG12 ILE 39 HG12 ILE 39 -18.217 8.001 8.633 310 HG13 ILE 39 HG13 ILE 39 -19.756 7.898 9.490 311 HG21 ILE 39 HG21 ILE 39 -16.651 10.528 10.938 312 HG22 ILE 39 HG22 ILE 39 -16.351 9.488 9.529 313 HG23 ILE 39 HG23 ILE 39 -17.438 10.890 9.421 314 HD11 ILE 39 HD11 ILE 39 -20.220 10.295 8.863 315 HD12 ILE 39 HD12 ILE 39 -18.784 10.223 7.813 316 HD13 ILE 39 HD13 ILE 39 -20.167 9.145 7.517 317 H TYR 40 H TYR 40 -15.374 8.280 11.986 318 HA TYR 40 HA TYR 40 -15.693 10.057 14.335 319 HB2 TYR 40 HB2 TYR 40 -14.407 8.736 15.791 320 HB3 TYR 40 HB3 TYR 40 -15.602 7.645 15.124 321 HD1 TYR 40 HD2 TYR 40 -14.858 6.061 13.161 322 HD2 TYR 40 HD1 TYR 40 -12.103 8.232 15.693 323 HE1 TYR 40 HE2 TYR 40 -12.991 4.620 12.387 324 HE2 TYR 40 HE1 TYR 40 -10.266 6.715 14.970 325 HH TYR 40 HH TYR 40 -9.634 5.158 13.396 326 H THR 41 H THR 41 -13.373 10.757 15.090 327 HA THR 41 HA THR 41 -11.686 11.281 12.689 328 HB THR 41 HB THR 41 -11.042 13.440 13.894 329 HG1 THR 41 HG1 THR 41 -12.803 14.247 15.167 330 HG21 THR 41 HG21 THR 41 -12.344 13.496 11.873 331 HG22 THR 41 HG22 THR 41 -13.835 13.081 12.758 332 HG23 THR 41 HG23 THR 41 -13.040 14.648 13.019 333 H GLN 42 H GLN 42 -9.513 11.279 12.838 334 HA GLN 42 HA GLN 42 -8.223 10.440 15.372 335 HB2 GLN 42 HB2 GLN 42 -7.213 8.485 14.262 336 HB3 GLN 42 HB3 GLN 42 -8.964 8.388 14.395 337 HG2 GLN 42 HG2 GLN 42 -9.167 9.056 11.966 338 HG3 GLN 42 HG3 GLN 42 -7.405 9.069 11.867 339 HE21 GLN 42 HE22 GLN 42 -8.372 7.478 10.053 340 HE22 GLN 42 HE21 GLN 42 -8.084 5.827 10.520 341 HA PRO 43 HA PRO 43 -4.994 13.008 13.688 342 HB2 PRO 43 HB2 PRO 43 -2.901 12.422 15.326 343 HB3 PRO 43 HB3 PRO 43 -4.356 13.298 15.890 344 HG2 PRO 43 HG2 PRO 43 -3.742 10.339 16.168 345 HG3 PRO 43 HG3 PRO 43 -4.311 11.478 17.432 346 HD2 PRO 43 HD2 PRO 43 -6.019 9.838 16.065 347 HD3 PRO 43 HD3 PRO 43 -6.498 11.483 16.579 348 H VAL 44 H VAL 44 -3.267 12.943 12.254 349 HA VAL 44 HA VAL 44 -2.518 10.525 10.904 350 HB VAL 44 HB VAL 44 -2.352 12.766 9.911 351 HG11 VAL 44 HG11 VAL 44 -1.381 14.005 11.884 352 HG12 VAL 44 HG12 VAL 44 0.165 13.205 11.565 353 HG13 VAL 44 HG13 VAL 44 -0.537 14.283 10.346 354 HG21 VAL 44 HG21 VAL 44 0.352 11.378 9.952 355 HG22 VAL 44 HG22 VAL 44 -1.052 10.841 9.005 356 HG23 VAL 44 HG23 VAL 44 -0.306 12.412 8.676 357 H ALA 45 H ALA 45 -0.904 9.069 11.221 358 HA ALA 45 HA ALA 45 0.629 9.205 13.769 359 HB1 ALA 45 HB1 ALA 45 -0.666 7.156 13.249 360 HB2 ALA 45 HB2 ALA 45 0.286 6.929 11.768 361 HB3 ALA 45 HB3 ALA 45 1.083 6.842 13.347 362 H GLN 46 H GLN 46 1.165 8.812 10.246 363 HA GLN 46 HA GLN 46 3.863 9.971 10.386 364 HB2 GLN 46 HB2 GLN 46 3.343 7.110 9.457 365 HB3 GLN 46 HB3 GLN 46 4.813 7.995 9.086 366 HG2 GLN 46 HG2 GLN 46 3.895 7.165 11.852 367 HG3 GLN 46 HG3 GLN 46 5.200 6.470 10.914 368 HE21 GLN 46 HE22 GLN 46 5.239 7.803 13.622 369 HE22 GLN 46 HE21 GLN 46 6.473 9.043 13.457 370 H TRP 47 H TRP 47 4.822 9.808 8.027 371 HA TRP 47 HA TRP 47 2.756 10.462 5.957 372 HB2 TRP 47 HB2 TRP 47 5.236 12.034 6.692 373 HB3 TRP 47 HB3 TRP 47 4.224 12.427 5.340 374 HD1 TRP 47 HD1 TRP 47 2.063 13.885 5.824 375 HE1 TRP 47 HE1 TRP 47 1.194 15.148 7.871 376 HE3 TRP 47 HE3 TRP 47 5.156 11.854 9.363 377 HZ2 TRP 47 HZ2 TRP 47 1.805 15.271 10.705 378 HZ3 TRP 47 HZ3 TRP 47 4.974 12.544 11.739 379 HH2 TRP 47 HH2 TRP 47 3.303 14.243 12.424 380 H HIS 48 H HIS 48 3.281 9.691 3.935 381 HA HIS 48 HA HIS 48 5.917 8.290 3.608 382 HB2 HIS 48 HB2 HIS 48 3.179 7.222 2.854 383 HB3 HIS 48 HB3 HIS 48 4.728 6.414 2.633 384 HD1 HIS 48 HD1 HIS 48 5.904 5.462 4.964 385 HD2 HIS 48 HD2 HIS 48 2.017 7.053 5.226 386 HE1 HIS 48 HE1 HIS 48 4.975 4.708 7.215 387 H ASP 49 H ASP 49 6.977 8.976 1.916 388 HA ASP 49 HA ASP 49 5.541 10.167 -0.410 389 HB2 ASP 49 HB2 ASP 49 7.486 11.589 -0.726 390 HB3 ASP 49 HB3 ASP 49 6.693 11.859 0.812 391 H ARG 50 H ARG 50 5.451 8.859 -2.015 392 HA ARG 50 HA ARG 50 7.274 6.586 -2.393 393 HB2 ARG 50 HB2 ARG 50 4.987 7.631 -4.063 394 HB3 ARG 50 HB3 ARG 50 5.758 6.059 -4.218 395 HG2 ARG 50 HG2 ARG 50 4.119 7.060 -1.849 396 HG3 ARG 50 HG3 ARG 50 3.643 5.832 -3.002 397 HD2 ARG 50 HD2 ARG 50 5.874 5.585 -0.950 398 HD3 ARG 50 HD3 ARG 50 4.291 4.807 -0.902 399 HE ARG 50 HE ARG 50 5.680 4.112 -3.352 400 HH11 ARG 50 HH11 ARG 50 5.835 3.288 0.054 401 HH12 ARG 50 HH12 ARG 50 6.499 1.709 -0.297 402 HH21 ARG 50 HH21 ARG 50 6.396 2.148 -3.725 403 HH22 ARG 50 HH22 ARG 50 6.835 1.080 -2.407 404 H GLY 51 H GLY 51 6.837 9.714 -3.863 405 HA2 GLY 51 HA2 GLY 51 8.536 10.931 -4.959 406 HA3 GLY 51 HA3 GLY 51 9.427 9.450 -5.251 407 H GLU 52 H GLU 52 7.663 7.868 -6.708 408 HA GLU 52 HA GLU 52 6.441 9.179 -8.962 409 HB2 GLU 52 HB2 GLU 52 9.314 8.265 -9.384 410 HB3 GLU 52 HB3 GLU 52 8.096 8.325 -10.659 411 HG2 GLU 52 HG2 GLU 52 7.814 10.795 -10.150 412 HG3 GLU 52 HG3 GLU 52 9.336 10.668 -9.238 413 H GLN 53 H GLN 53 4.867 7.563 -8.787 414 HA GLN 53 HA GLN 53 5.703 4.886 -9.851 415 HB2 GLN 53 HB2 GLN 53 3.497 5.590 -7.905 416 HB3 GLN 53 HB3 GLN 53 3.884 3.947 -8.478 417 HG2 GLN 53 HG2 GLN 53 6.214 4.220 -7.538 418 HG3 GLN 53 HG3 GLN 53 5.709 5.778 -6.844 419 HE21 GLN 53 HE22 GLN 53 3.103 5.067 -5.848 420 HE22 GLN 53 HE21 GLN 53 3.699 4.469 -4.360 421 H GLU 54 H GLU 54 3.832 3.691 -10.876 422 HA GLU 54 HA GLU 54 2.889 5.229 -13.121 423 HB2 GLU 54 HB2 GLU 54 1.679 3.084 -13.695 424 HB3 GLU 54 HB3 GLU 54 3.435 3.056 -13.645 425 HG2 GLU 54 HG2 GLU 54 3.483 1.840 -11.584 426 HG3 GLU 54 HG3 GLU 54 1.766 2.095 -11.288 427 H VAL 55 H VAL 55 1.386 6.722 -12.931 428 HA VAL 55 HA VAL 55 -1.008 6.299 -11.210 429 HB VAL 55 HB VAL 55 0.012 8.846 -12.527 430 HG11 VAL 55 HG11 VAL 55 -2.434 8.926 -12.069 431 HG12 VAL 55 HG12 VAL 55 -2.120 8.444 -10.387 432 HG13 VAL 55 HG13 VAL 55 -1.532 10.002 -11.009 433 HG21 VAL 55 HG21 VAL 55 0.293 7.709 -9.716 434 HG22 VAL 55 HG22 VAL 55 1.576 8.271 -10.810 435 HG23 VAL 55 HG23 VAL 55 0.486 9.438 -10.069 436 H PHE 56 H PHE 56 -3.040 6.305 -11.927 437 HA PHE 56 HA PHE 56 -3.566 6.528 -14.871 438 HB2 PHE 56 HB2 PHE 56 -4.686 4.564 -12.839 439 HB3 PHE 56 HB3 PHE 56 -5.353 4.821 -14.441 440 HD1 PHE 56 HD2 PHE 56 -2.126 3.830 -12.737 441 HD2 PHE 56 HD1 PHE 56 -4.640 3.496 -16.230 442 HE1 PHE 56 HE2 PHE 56 -0.632 2.083 -13.648 443 HE2 PHE 56 HE1 PHE 56 -3.163 1.697 -17.105 444 HZ PHE 56 HZ PHE 56 -1.152 1.002 -15.824 445 H GLU 57 H GLU 57 -5.433 7.488 -15.489 446 HA GLU 57 HA GLU 57 -6.692 9.440 -13.779 447 HB2 GLU 57 HB2 GLU 57 -6.375 9.509 -16.329 448 HB3 GLU 57 HB3 GLU 57 -7.626 8.283 -16.451 449 HG2 GLU 57 HG2 GLU 57 -8.770 10.272 -16.852 450 HG3 GLU 57 HG3 GLU 57 -9.143 9.959 -15.160 451 H TYR 58 H TYR 58 -8.329 9.135 -12.337 452 HA TYR 58 HA TYR 58 -10.228 6.878 -12.715 453 HB2 TYR 58 HB2 TYR 58 -8.839 6.375 -10.888 454 HB3 TYR 58 HB3 TYR 58 -8.881 8.011 -10.259 455 HD1 TYR 58 HD1 TYR 58 -12.020 6.353 -11.356 456 HD2 TYR 58 HD2 TYR 58 -9.392 7.182 -8.030 457 HE1 TYR 58 HE1 TYR 58 -13.752 5.575 -9.775 458 HE2 TYR 58 HE2 TYR 58 -11.182 6.493 -6.446 459 HH TYR 58 HH TYR 58 -13.339 5.704 -6.266 460 H CYS 59 H CYS 59 -11.445 8.186 -14.079 461 HA CYS 59 HA CYS 59 -12.782 10.594 -12.970 462 HB2 CYS 59 HB2 CYS 59 -11.951 10.484 -15.358 463 HB3 CYS 59 HB3 CYS 59 -13.115 9.184 -15.651 464 HG CYS 59 HG CYS 59 -15.258 10.637 -14.873 465 H LEU 60 H LEU 60 -14.877 10.626 -12.338 466 HA LEU 60 HA LEU 60 -16.369 8.027 -12.202 467 HB2 LEU 60 HB2 LEU 60 -15.890 10.212 -10.336 468 HB3 LEU 60 HB3 LEU 60 -17.596 10.068 -10.646 469 HG LEU 60 HG LEU 60 -17.655 7.746 -10.003 470 HD11 LEU 60 HD11 LEU 60 -15.394 6.990 -10.613 471 HD12 LEU 60 HD12 LEU 60 -14.709 8.015 -9.332 472 HD13 LEU 60 HD13 LEU 60 -15.774 6.640 -8.927 473 HD21 LEU 60 HD21 LEU 60 -16.148 9.399 -7.953 474 HD22 LEU 60 HD22 LEU 60 -17.890 9.533 -8.282 475 HD23 LEU 60 HD23 LEU 60 -17.223 8.020 -7.632 476 H GLU 61 H GLU 61 -18.706 8.100 -12.251 477 HA GLU 61 HA GLU 61 -19.620 9.115 -14.774 478 HB2 GLU 61 HB2 GLU 61 -21.065 7.894 -12.405 479 HB3 GLU 61 HB3 GLU 61 -21.839 8.188 -13.958 480 HG2 GLU 61 HG2 GLU 61 -19.399 6.388 -13.623 481 HG3 GLU 61 HG3 GLU 61 -21.052 5.828 -13.463 482 H ASP 62 H ASP 62 -19.705 10.598 -11.633 483 HA ASP 62 HA ASP 62 -21.782 12.581 -12.281 484 HB2 ASP 62 HB2 ASP 62 -21.420 11.805 -9.977 485 HB3 ASP 62 HB3 ASP 62 -19.756 12.399 -10.015 486 H GLY 63 H GLY 63 -18.289 12.316 -12.627 487 HA2 GLY 63 HA2 GLY 63 -17.218 13.795 -14.259 488 HA3 GLY 63 HA3 GLY 63 -18.099 15.163 -13.576 489 H SER 64 H SER 64 -17.194 13.371 -10.903 490 HA SER 64 HA SER 64 -14.992 15.043 -10.116 491 HB2 SER 64 HB2 SER 64 -14.724 13.047 -8.407 492 HB3 SER 64 HB3 SER 64 -16.051 14.204 -8.282 493 HG SER 64 HG SER 64 -16.764 12.048 -8.094 494 H LEU 65 H LEU 65 -12.828 14.546 -9.897 495 HA LEU 65 HA LEU 65 -11.702 12.401 -11.653 496 HB2 LEU 65 HB2 LEU 65 -11.172 15.387 -11.604 497 HB3 LEU 65 HB3 LEU 65 -9.983 14.251 -12.232 498 HG LEU 65 HG LEU 65 -12.801 14.429 -13.364 499 HD11 LEU 65 HD11 LEU 65 -11.731 16.607 -13.645 500 HD12 LEU 65 HD12 LEU 65 -10.240 15.840 -14.239 501 HD13 LEU 65 HD13 LEU 65 -11.738 15.755 -15.198 502 HD21 LEU 65 HD21 LEU 65 -10.182 13.329 -14.493 503 HD22 LEU 65 HD22 LEU 65 -11.516 12.348 -13.864 504 HD23 LEU 65 HD23 LEU 65 -11.760 13.335 -15.308 505 H ILE 66 H ILE 66 -10.212 11.268 -10.746 506 HA ILE 66 HA ILE 66 -8.630 12.211 -8.400 507 HB ILE 66 HB ILE 66 -10.014 9.517 -8.725 508 HG12 ILE 66 HG12 ILE 66 -10.739 11.645 -6.678 509 HG13 ILE 66 HG13 ILE 66 -11.603 11.426 -8.196 510 HG21 ILE 66 HG21 ILE 66 -7.931 9.294 -7.456 511 HG22 ILE 66 HG22 ILE 66 -8.378 10.668 -6.417 512 HG23 ILE 66 HG23 ILE 66 -9.279 9.143 -6.347 513 HD11 ILE 66 HD11 ILE 66 -12.094 9.044 -7.536 514 HD12 ILE 66 HD12 ILE 66 -11.545 9.478 -5.892 515 HD13 ILE 66 HD13 ILE 66 -12.924 10.305 -6.638 516 H ARG 67 H ARG 67 -6.542 11.236 -8.276 517 HA ARG 67 HA ARG 67 -5.647 9.574 -10.595 518 HB2 ARG 67 HB2 ARG 67 -4.487 12.252 -9.721 519 HB3 ARG 67 HB3 ARG 67 -3.609 11.083 -10.722 520 HG2 ARG 67 HG2 ARG 67 -5.459 11.100 -12.374 521 HG3 ARG 67 HG3 ARG 67 -6.300 12.343 -11.433 522 HD2 ARG 67 HD2 ARG 67 -4.584 13.954 -11.817 523 HD3 ARG 67 HD3 ARG 67 -3.509 12.733 -12.532 524 HE ARG 67 HE ARG 67 -5.990 12.781 -13.973 525 HH11 ARG 67 HH11 ARG 67 -3.135 14.794 -13.632 526 HH12 ARG 67 HH12 ARG 67 -3.241 15.384 -15.272 527 HH21 ARG 67 HH21 ARG 67 -6.093 13.548 -16.008 528 HH22 ARG 67 HH22 ARG 67 -4.910 14.708 -16.590 529 H ALA 68 H ALA 68 -4.887 7.802 -9.821 530 HA ALA 68 HA ALA 68 -3.159 7.712 -7.404 531 HB1 ALA 68 HB1 ALA 68 -5.502 7.492 -6.597 532 HB2 ALA 68 HB2 ALA 68 -5.769 6.142 -7.728 533 HB3 ALA 68 HB3 ALA 68 -4.613 5.971 -6.394 534 H THR 69 H THR 69 -2.362 5.434 -7.026 535 HA THR 69 HA THR 69 -1.519 4.195 -9.587 536 HB THR 69 HB THR 69 -0.049 2.808 -8.215 537 HG1 THR 69 HG1 THR 69 0.133 3.173 -6.068 538 HG21 THR 69 HG21 THR 69 0.740 5.046 -8.934 539 HG22 THR 69 HG22 THR 69 0.171 5.730 -7.393 540 HG23 THR 69 HG23 THR 69 1.468 4.507 -7.413 541 H LYS 70 H LYS 70 -1.519 1.884 -9.851 542 HA LYS 70 HA LYS 70 -4.096 0.648 -9.207 543 HB2 LYS 70 HB2 LYS 70 -1.612 -0.511 -10.550 544 HB3 LYS 70 HB3 LYS 70 -3.139 -1.349 -10.390 545 HG2 LYS 70 HG2 LYS 70 -2.466 0.982 -12.137 546 HG3 LYS 70 HG3 LYS 70 -3.172 -0.586 -12.551 547 HD2 LYS 70 HD2 LYS 70 -5.292 0.198 -11.323 548 HD3 LYS 70 HD3 LYS 70 -4.528 1.793 -11.248 549 HE2 LYS 70 HE2 LYS 70 -5.798 1.977 -13.184 550 HE3 LYS 70 HE3 LYS 70 -4.188 1.561 -13.793 551 HZ1 LYS 70 HZ1 LYS 70 -5.014 -0.818 -13.908 552 HZ2 LYS 70 HZ2 LYS 70 -6.502 -0.279 -13.528 553 HZ3 LYS 70 HZ3 LYS 70 -5.802 0.210 -14.913 554 H ASP 71 H ASP 71 -1.358 0.870 -7.307 555 HA ASP 71 HA ASP 71 -1.838 -1.736 -5.927 556 HB2 ASP 71 HB2 ASP 71 0.287 0.421 -5.630 557 HB3 ASP 71 HB3 ASP 71 0.096 -0.894 -4.476 558 H HIS 72 H HIS 72 -3.096 1.432 -5.859 559 HA HIS 72 HA HIS 72 -3.407 1.504 -2.960 560 HB2 HIS 72 HB2 HIS 72 -3.155 3.546 -4.576 561 HB3 HIS 72 HB3 HIS 72 -4.829 3.281 -4.993 562 HD1 HIS 72 HD1 HIS 72 -6.312 3.028 -2.245 563 HD2 HIS 72 HD2 HIS 72 -2.746 5.195 -2.709 564 HE1 HIS 72 HE1 HIS 72 -6.002 4.402 -0.137 565 H LYS 73 H LYS 73 -5.202 0.812 -1.864 566 HA LYS 73 HA LYS 73 -7.388 -0.526 -3.380 567 HB2 LYS 73 HB2 LYS 73 -6.536 -0.638 -0.457 568 HB3 LYS 73 HB3 LYS 73 -7.909 -1.530 -1.130 569 HG2 LYS 73 HG2 LYS 73 -6.486 -2.820 -2.586 570 HG3 LYS 73 HG3 LYS 73 -5.089 -1.796 -2.263 571 HD2 LYS 73 HD2 LYS 73 -5.125 -2.552 0.132 572 HD3 LYS 73 HD3 LYS 73 -6.392 -3.721 -0.311 573 HE2 LYS 73 HE2 LYS 73 -4.885 -4.625 -2.094 574 HE3 LYS 73 HE3 LYS 73 -3.644 -3.459 -1.618 575 HZ1 LYS 73 HZ1 LYS 73 -3.565 -4.571 0.578 576 HZ2 LYS 73 HZ2 LYS 73 -4.719 -5.637 0.120 577 HZ3 LYS 73 HZ3 LYS 73 -3.259 -5.653 -0.609 578 H PHE 74 H PHE 74 -9.584 -0.122 -2.931 579 HA PHE 74 HA PHE 74 -10.208 2.373 -1.396 580 HB2 PHE 74 HB2 PHE 74 -11.034 1.790 -4.256 581 HB3 PHE 74 HB3 PHE 74 -11.780 3.000 -3.230 582 HD1 PHE 74 HD1 PHE 74 -8.591 2.118 -4.998 583 HD2 PHE 74 HD2 PHE 74 -10.820 5.148 -2.864 584 HE1 PHE 74 HE1 PHE 74 -7.002 3.847 -5.775 585 HE2 PHE 74 HE2 PHE 74 -9.201 6.864 -3.627 586 HZ PHE 74 HZ PHE 74 -7.290 6.218 -5.081 587 H MET 75 H MET 75 -12.058 2.353 -0.282 588 HA MET 75 HA MET 75 -13.163 -0.280 0.236 589 HB2 MET 75 HB2 MET 75 -12.657 1.408 2.003 590 HB3 MET 75 HB3 MET 75 -14.029 2.373 1.425 591 HG2 MET 75 HG2 MET 75 -15.584 0.565 1.874 592 HG3 MET 75 HG3 MET 75 -14.264 -0.543 2.223 593 HE1 MET 75 HE1 MET 75 -14.550 3.236 4.082 594 HE2 MET 75 HE2 MET 75 -15.992 2.699 3.202 595 HE3 MET 75 HE3 MET 75 -15.974 2.706 4.985 596 H THR 76 H THR 76 -14.483 -1.133 -1.225 597 HA THR 76 HA THR 76 -16.347 0.290 -2.894 598 HB THR 76 HB THR 76 -17.207 -1.896 -3.513 599 HG1 THR 76 HG1 THR 76 -16.350 -3.723 -2.490 600 HG21 THR 76 HG21 THR 76 -15.058 -1.129 -4.468 601 HG22 THR 76 HG22 THR 76 -14.186 -2.021 -3.200 602 HG23 THR 76 HG23 THR 76 -15.181 -2.895 -4.383 603 H VAL 77 H VAL 77 -18.725 -0.313 -2.949 604 HA VAL 77 HA VAL 77 -20.048 0.544 -0.654 605 HB VAL 77 HB VAL 77 -22.152 -0.318 -1.715 606 HG11 VAL 77 HG11 VAL 77 -21.363 1.914 -2.193 607 HG12 VAL 77 HG12 VAL 77 -20.280 1.315 -3.465 608 HG13 VAL 77 HG13 VAL 77 -22.043 1.187 -3.660 609 HG21 VAL 77 HG21 VAL 77 -20.307 -1.279 -3.950 610 HG22 VAL 77 HG22 VAL 77 -21.223 -2.321 -2.839 611 HG23 VAL 77 HG23 VAL 77 -22.080 -1.258 -3.962 612 H ASP 78 H ASP 78 -18.999 -2.715 -1.271 613 HA ASP 78 HA ASP 78 -20.644 -3.819 0.954 614 HB2 ASP 78 HB2 ASP 78 -18.700 -5.087 -1.006 615 HB3 ASP 78 HB3 ASP 78 -19.509 -5.965 0.290 616 H GLY 79 H GLY 79 -17.701 -2.182 0.680 617 HA2 GLY 79 HA2 GLY 79 -16.279 -1.644 2.433 618 HA3 GLY 79 HA3 GLY 79 -16.900 -2.975 3.403 619 H GLN 80 H GLN 80 -15.672 -3.456 0.083 620 HA GLN 80 HA GLN 80 -13.664 -5.356 1.131 621 HB2 GLN 80 HB2 GLN 80 -14.456 -4.697 -1.733 622 HB3 GLN 80 HB3 GLN 80 -13.424 -6.025 -1.199 623 HG2 GLN 80 HG2 GLN 80 -15.345 -6.981 0.087 624 HG3 GLN 80 HG3 GLN 80 -16.382 -5.697 -0.531 625 HE21 GLN 80 HE22 GLN 80 -17.586 -6.290 -2.359 626 HE22 GLN 80 HE21 GLN 80 -17.062 -7.515 -3.500 627 H MET 81 H MET 81 -11.496 -5.154 0.954 628 HA MET 81 HA MET 81 -10.288 -2.593 0.058 629 HB2 MET 81 HB2 MET 81 -9.029 -4.911 1.585 630 HB3 MET 81 HB3 MET 81 -8.308 -3.325 1.274 631 HG2 MET 81 HG2 MET 81 -10.735 -3.932 2.983 632 HG3 MET 81 HG3 MET 81 -9.137 -3.492 3.560 633 HE1 MET 81 HE1 MET 81 -12.575 -2.340 2.942 634 HE2 MET 81 HE2 MET 81 -11.787 -2.253 4.532 635 HE3 MET 81 HE3 MET 81 -12.347 -0.762 3.742 636 H LEU 82 H LEU 82 -10.673 -3.092 -2.237 637 HA LEU 82 HA LEU 82 -8.668 -5.019 -3.355 638 HB2 LEU 82 HB2 LEU 82 -11.255 -4.090 -4.637 639 HB3 LEU 82 HB3 LEU 82 -10.116 -5.226 -5.322 640 HG LEU 82 HG LEU 82 -11.720 -5.723 -2.774 641 HD11 LEU 82 HD11 LEU 82 -13.118 -5.695 -4.797 642 HD12 LEU 82 HD12 LEU 82 -12.023 -6.861 -5.581 643 HD13 LEU 82 HD13 LEU 82 -12.959 -7.336 -4.149 644 HD21 LEU 82 HD21 LEU 82 -9.901 -7.577 -4.383 645 HD22 LEU 82 HD22 LEU 82 -9.588 -6.972 -2.740 646 HD23 LEU 82 HD23 LEU 82 -10.939 -8.067 -3.026 647 HA PRO 83 HA PRO 83 -6.666 -1.575 -5.283 648 HB2 PRO 83 HB2 PRO 83 -5.531 -2.751 -7.496 649 HB3 PRO 83 HB3 PRO 83 -4.935 -3.025 -5.828 650 HG2 PRO 83 HG2 PRO 83 -6.871 -4.733 -7.441 651 HG3 PRO 83 HG3 PRO 83 -5.401 -5.270 -6.556 652 HD2 PRO 83 HD2 PRO 83 -7.859 -5.482 -5.470 653 HD3 PRO 83 HD3 PRO 83 -6.477 -4.965 -4.460 654 H ILE 84 H ILE 84 -7.007 -0.017 -6.924 655 HA ILE 84 HA ILE 84 -9.567 -0.038 -8.091 656 HB ILE 84 HB ILE 84 -8.323 1.974 -7.501 657 HG12 ILE 84 HG12 ILE 84 -9.206 1.987 -10.420 658 HG13 ILE 84 HG13 ILE 84 -10.302 1.874 -9.033 659 HG21 ILE 84 HG21 ILE 84 -6.102 1.345 -8.427 660 HG22 ILE 84 HG22 ILE 84 -6.754 1.543 -10.073 661 HG23 ILE 84 HG23 ILE 84 -6.629 2.935 -8.978 662 HD11 ILE 84 HD11 ILE 84 -9.493 4.044 -8.204 663 HD12 ILE 84 HD12 ILE 84 -8.466 4.210 -9.659 664 HD13 ILE 84 HD13 ILE 84 -10.228 4.122 -9.821 665 H ASP 85 H ASP 85 -6.582 -1.199 -9.554 666 HA ASP 85 HA ASP 85 -7.375 -1.586 -12.218 667 HB2 ASP 85 HB2 ASP 85 -5.128 -2.060 -11.102 668 HB3 ASP 85 HB3 ASP 85 -5.817 -3.562 -10.500 669 H GLU 86 H GLU 86 -8.481 -3.323 -9.357 670 HA GLU 86 HA GLU 86 -9.863 -5.365 -11.032 671 HB2 GLU 86 HB2 GLU 86 -8.523 -5.989 -8.995 672 HB3 GLU 86 HB3 GLU 86 -9.747 -5.191 -7.997 673 HG2 GLU 86 HG2 GLU 86 -11.458 -6.717 -8.746 674 HG3 GLU 86 HG3 GLU 86 -10.426 -7.367 -10.023 675 H ILE 87 H ILE 87 -10.552 -2.474 -9.032 676 HA ILE 87 HA ILE 87 -13.379 -2.833 -8.838 677 HB ILE 87 HB ILE 87 -11.710 -0.283 -8.915 678 HG12 ILE 87 HG12 ILE 87 -12.734 -2.004 -6.596 679 HG13 ILE 87 HG13 ILE 87 -11.064 -1.875 -7.132 680 HG21 ILE 87 HG21 ILE 87 -14.105 0.186 -9.374 681 HG22 ILE 87 HG22 ILE 87 -14.545 -0.759 -7.936 682 HG23 ILE 87 HG23 ILE 87 -13.651 0.773 -7.779 683 HD11 ILE 87 HD11 ILE 87 -11.131 0.588 -6.552 684 HD12 ILE 87 HD12 ILE 87 -12.697 0.261 -5.766 685 HD13 ILE 87 HD13 ILE 87 -11.237 -0.547 -5.195 686 H PHE 88 H PHE 88 -11.362 -1.377 -11.398 687 HA PHE 88 HA PHE 88 -13.524 -0.464 -13.056 688 HB2 PHE 88 HB2 PHE 88 -11.144 0.226 -13.301 689 HB3 PHE 88 HB3 PHE 88 -10.736 -1.386 -13.843 690 HD1 PHE 88 HD1 PHE 88 -12.724 1.695 -14.735 691 HD2 PHE 88 HD2 PHE 88 -11.181 -2.103 -16.099 692 HE1 PHE 88 HE1 PHE 88 -13.214 2.333 -17.075 693 HE2 PHE 88 HE2 PHE 88 -11.703 -1.462 -18.445 694 HZ PHE 88 HZ PHE 88 -12.704 0.763 -18.935 695 H GLU 89 H GLU 89 -12.006 -3.678 -12.839 696 HA GLU 89 HA GLU 89 -13.419 -4.693 -15.223 697 HB2 GLU 89 HB2 GLU 89 -11.577 -5.918 -13.125 698 HB3 GLU 89 HB3 GLU 89 -12.515 -6.939 -14.201 699 HG2 GLU 89 HG2 GLU 89 -11.525 -5.516 -16.141 700 HG3 GLU 89 HG3 GLU 89 -10.376 -4.906 -14.954 701 H ARG 90 H ARG 90 -13.783 -4.929 -11.690 702 HA ARG 90 HA ARG 90 -16.126 -6.708 -11.927 703 HB2 ARG 90 HB2 ARG 90 -14.937 -5.307 -9.504 704 HB3 ARG 90 HB3 ARG 90 -16.169 -6.565 -9.479 705 HG2 ARG 90 HG2 ARG 90 -13.261 -6.907 -10.331 706 HG3 ARG 90 HG3 ARG 90 -14.032 -7.486 -8.868 707 HD2 ARG 90 HD2 ARG 90 -13.870 -9.380 -10.189 708 HD3 ARG 90 HD3 ARG 90 -15.559 -8.879 -10.404 709 HE ARG 90 HE ARG 90 -13.696 -7.863 -12.427 710 HH11 ARG 90 HH11 ARG 90 -15.696 -10.633 -11.637 711 HH12 ARG 90 HH12 ARG 90 -15.767 -11.171 -13.297 712 HH21 ARG 90 HH21 ARG 90 -13.856 -8.608 -14.544 713 HH22 ARG 90 HH22 ARG 90 -14.740 -10.068 -14.874 714 H GLU 91 H GLU 91 -15.713 -3.325 -12.193 715 HA GLU 91 HA GLU 91 -17.139 -1.620 -12.389 716 HB2 GLU 91 HB2 GLU 91 -19.288 -3.716 -12.885 717 HB3 GLU 91 HB3 GLU 91 -19.370 -2.003 -13.285 718 HG2 GLU 91 HG2 GLU 91 -17.348 -2.323 -14.785 719 HG3 GLU 91 HG3 GLU 91 -17.486 -4.058 -14.498 720 H LEU 92 H LEU 92 -16.515 -2.428 -9.797 721 HA LEU 92 HA LEU 92 -18.983 -2.225 -8.171 722 HB2 LEU 92 HB2 LEU 92 -16.052 -2.550 -7.439 723 HB3 LEU 92 HB3 LEU 92 -17.339 -2.363 -6.251 724 HG LEU 92 HG LEU 92 -17.167 -4.638 -8.275 725 HD11 LEU 92 HD11 LEU 92 -15.390 -4.723 -6.548 726 HD12 LEU 92 HD12 LEU 92 -16.632 -4.624 -5.277 727 HD13 LEU 92 HD13 LEU 92 -16.566 -6.032 -6.355 728 HD21 LEU 92 HD21 LEU 92 -19.050 -4.188 -5.913 729 HD22 LEU 92 HD22 LEU 92 -19.502 -4.260 -7.634 730 HD23 LEU 92 HD23 LEU 92 -18.901 -5.706 -6.827 731 H ASP 93 H ASP 93 -19.864 -0.392 -7.637 732 HA ASP 93 HA ASP 93 -18.730 2.210 -7.705 733 HB2 ASP 93 HB2 ASP 93 -20.917 1.264 -5.835 734 HB3 ASP 93 HB3 ASP 93 -20.699 2.875 -6.502 735 H LEU 94 H LEU 94 -18.043 3.641 -5.965 736 HA LEU 94 HA LEU 94 -16.877 2.267 -3.586 737 HB2 LEU 94 HB2 LEU 94 -16.555 5.132 -4.579 738 HB3 LEU 94 HB3 LEU 94 -15.963 4.522 -3.042 739 HG LEU 94 HG LEU 94 -14.991 3.853 -5.813 740 HD11 LEU 94 HD11 LEU 94 -14.080 5.809 -4.505 741 HD12 LEU 94 HD12 LEU 94 -13.614 4.698 -3.210 742 HD13 LEU 94 HD13 LEU 94 -12.841 4.558 -4.797 743 HD21 LEU 94 HD21 LEU 94 -14.321 2.289 -3.289 744 HD22 LEU 94 HD22 LEU 94 -15.096 1.655 -4.768 745 HD23 LEU 94 HD23 LEU 94 -13.430 2.217 -4.826 746 H MET 95 H MET 95 -17.261 2.859 -1.494 747 HA MET 95 HA MET 95 -19.959 3.774 -0.842 748 HB2 MET 95 HB2 MET 95 -18.666 1.984 0.355 749 HB3 MET 95 HB3 MET 95 -17.624 3.232 1.035 750 HG2 MET 95 HG2 MET 95 -19.301 4.005 2.450 751 HG3 MET 95 HG3 MET 95 -20.591 3.614 1.314 752 HE1 MET 95 HE1 MET 95 -17.821 1.038 2.472 753 HE2 MET 95 HE2 MET 95 -18.080 2.037 3.934 754 HE3 MET 95 HE3 MET 95 -18.592 0.339 3.911 755 H ARG 96 H ARG 96 -20.358 5.628 0.583 756 HA ARG 96 HA ARG 96 -18.382 7.838 0.547 757 HB2 ARG 96 HB2 ARG 96 -21.244 8.076 -0.478 758 HB3 ARG 96 HB3 ARG 96 -20.166 9.430 -0.159 759 HG2 ARG 96 HG2 ARG 96 -18.585 8.507 -1.926 760 HG3 ARG 96 HG3 ARG 96 -19.870 7.345 -2.350 761 HD2 ARG 96 HD2 ARG 96 -21.450 9.306 -2.575 762 HD3 ARG 96 HD3 ARG 96 -20.066 10.385 -2.311 763 HE ARG 96 HE ARG 96 -20.146 8.455 -4.591 764 HH11 ARG 96 HH11 ARG 96 -19.925 11.831 -3.605 765 HH12 ARG 96 HH12 ARG 96 -19.952 12.385 -5.259 766 HH21 ARG 96 HH21 ARG 96 -20.149 9.270 -6.632 767 HH22 ARG 96 HH22 ARG 96 -20.024 10.988 -6.905 768 H VAL 97 H VAL 97 -19.124 9.679 1.916 769 HA VAL 97 HA VAL 97 -20.849 8.844 4.227 770 HB VAL 97 HB VAL 97 -19.389 10.213 5.671 771 HG11 VAL 97 HG11 VAL 97 -19.172 7.782 5.587 772 HG12 VAL 97 HG12 VAL 97 -18.046 7.917 4.227 773 HG13 VAL 97 HG13 VAL 97 -17.581 8.535 5.828 774 HG21 VAL 97 HG21 VAL 97 -17.345 10.199 3.453 775 HG22 VAL 97 HG22 VAL 97 -18.295 11.634 3.922 776 HG23 VAL 97 HG23 VAL 97 -17.184 10.874 5.074 777 H ASP 98 H ASP 98 -20.808 11.024 1.742 778 HA ASP 98 HA ASP 98 -21.911 13.275 3.340 779 HB2 ASP 98 HB2 ASP 98 -20.006 13.510 1.658 780 HB3 ASP 98 HB3 ASP 98 -21.197 13.255 0.399 781 H ASN 99 H ASN 99 -23.369 10.697 2.486 782 HA ASN 99 HA ASN 99 -25.322 9.932 1.638 783 HB2 ASN 99 HB2 ASN 99 -26.276 12.656 2.591 784 HB3 ASN 99 HB3 ASN 99 -27.361 11.376 2.027 785 HD21 ASN 99 HD22 ASN 99 -24.758 12.016 4.309 786 HD22 ASN 99 HD21 ASN 99 -24.772 10.419 4.908 787 H LEU 100 H LEU 100 -23.489 10.999 -0.098 788 HA LEU 100 HA LEU 100 -25.031 11.877 -2.497 789 HB2 LEU 100 HB2 LEU 100 -22.092 11.450 -1.903 790 HB3 LEU 100 HB3 LEU 100 -22.649 11.775 -3.534 791 HG LEU 100 HG LEU 100 -23.028 13.625 -1.140 792 HD11 LEU 100 HD11 LEU 100 -20.681 13.389 -1.955 793 HD12 LEU 100 HD12 LEU 100 -21.217 13.907 -3.573 794 HD13 LEU 100 HD13 LEU 100 -21.335 15.009 -2.190 795 HD21 LEU 100 HD21 LEU 100 -23.647 14.056 -4.095 796 HD22 LEU 100 HD22 LEU 100 -24.826 14.017 -2.759 797 HD23 LEU 100 HD23 LEU 100 -23.646 15.324 -2.846 798 HA PRO 101 HA PRO 101 -25.672 7.916 -4.201 799 HB2 PRO 101 HB2 PRO 101 -25.459 8.294 -6.921 800 HB3 PRO 101 HB3 PRO 101 -26.792 8.945 -5.920 801 HG2 PRO 101 HG2 PRO 101 -24.274 10.372 -6.826 802 HG3 PRO 101 HG3 PRO 101 -25.970 10.951 -6.912 803 HD2 PRO 101 HD2 PRO 101 -24.320 11.700 -4.887 804 HD3 PRO 101 HD3 PRO 101 -26.041 11.362 -4.577 805 H ASN 102 H ASN 102 -24.604 6.047 -4.491 806 HA ASN 102 HA ASN 102 -21.701 6.016 -4.738 807 HB2 ASN 102 HB2 ASN 102 -23.721 3.726 -4.660 808 HB3 ASN 102 HB3 ASN 102 -21.971 3.586 -4.460 809 HD21 ASN 102 HD22 ASN 102 -20.996 4.859 -2.626 810 HD22 ASN 102 HD21 ASN 102 -22.009 5.137 -1.193 811 H ILE 103 H ILE 103 -20.522 5.810 -6.519 812 HA ILE 103 HA ILE 103 -21.543 4.577 -8.996 813 HB ILE 103 HB ILE 103 -20.636 6.475 -10.355 814 HG12 ILE 103 HG12 ILE 103 -21.032 8.041 -7.774 815 HG13 ILE 103 HG13 ILE 103 -19.473 7.653 -8.505 816 HG21 ILE 103 HG21 ILE 103 -23.065 5.900 -10.068 817 HG22 ILE 103 HG22 ILE 103 -23.151 7.108 -8.766 818 HG23 ILE 103 HG23 ILE 103 -22.778 7.590 -10.430 819 HD11 ILE 103 HD11 ILE 103 -19.960 9.002 -10.438 820 HD12 ILE 103 HD12 ILE 103 -21.625 9.310 -9.895 821 HD13 ILE 103 HD13 ILE 103 -20.277 9.972 -8.986 822 H LYS 104 H LYS 104 -20.048 3.892 -10.405 823 HA LYS 104 HA LYS 104 -17.371 3.295 -9.300 824 HB2 LYS 104 HB2 LYS 104 -17.328 1.458 -10.788 825 HB3 LYS 104 HB3 LYS 104 -18.908 1.520 -10.043 826 HG2 LYS 104 HG2 LYS 104 -19.347 3.043 -12.315 827 HG3 LYS 104 HG3 LYS 104 -18.107 1.887 -12.882 828 HD2 LYS 104 HD2 LYS 104 -19.448 0.051 -12.281 829 HD3 LYS 104 HD3 LYS 104 -20.605 1.076 -11.401 830 HE2 LYS 104 HE2 LYS 104 -21.163 2.229 -13.566 831 HE3 LYS 104 HE3 LYS 104 -20.115 1.092 -14.421 832 HZ1 LYS 104 HZ1 LYS 104 -21.580 -0.711 -13.668 833 HZ2 LYS 104 HZ2 LYS 104 -22.536 0.346 -12.855 834 HZ3 LYS 104 HZ3 LYS 104 -22.449 0.405 -14.485 835 H ILE 105 H ILE 105 -15.916 2.794 -11.421 836 HA ILE 105 HA ILE 105 -14.935 5.409 -12.287 837 HB ILE 105 HB ILE 105 -14.178 2.598 -13.201 838 HG12 ILE 105 HG12 ILE 105 -12.460 4.108 -11.255 839 HG13 ILE 105 HG13 ILE 105 -13.868 3.279 -10.607 840 HG21 ILE 105 HG21 ILE 105 -12.624 5.231 -13.382 841 HG22 ILE 105 HG22 ILE 105 -12.004 3.647 -13.861 842 HG23 ILE 105 HG23 ILE 105 -13.358 4.357 -14.742 843 HD11 ILE 105 HD11 ILE 105 -12.025 1.833 -10.400 844 HD12 ILE 105 HD12 ILE 105 -13.044 1.188 -11.682 845 HD13 ILE 105 HD13 ILE 105 -11.535 2.066 -12.089 846 H ALA 106 H ALA 106 -15.632 6.490 -13.999 847 HA ALA 106 HA ALA 106 -17.525 5.363 -15.958 848 HB1 ALA 106 HB1 ALA 106 -17.867 7.603 -15.055 849 HB2 ALA 106 HB2 ALA 106 -16.281 8.140 -15.646 850 HB3 ALA 106 HB3 ALA 106 -17.569 7.700 -16.793 851 H THR 107 H THR 107 -14.210 6.692 -15.962 852 HA THR 107 HA THR 107 -13.502 5.189 -18.404 853 HB THR 107 HB THR 107 -12.315 7.256 -19.309 854 HG1 THR 107 HG1 THR 107 -14.301 8.664 -17.905 855 HG21 THR 107 HG21 THR 107 -14.322 6.349 -20.425 856 HG22 THR 107 HG22 THR 107 -15.363 7.352 -19.389 857 HG23 THR 107 HG23 THR 107 -14.243 8.115 -20.536 858 H ARG 108 H ARG 108 -11.306 4.931 -18.711 859 HA ARG 108 HA ARG 108 -9.421 5.723 -16.542 860 HB2 ARG 108 HB2 ARG 108 -10.215 3.584 -15.862 861 HB3 ARG 108 HB3 ARG 108 -10.111 2.909 -17.475 862 HG2 ARG 108 HG2 ARG 108 -7.635 3.788 -15.920 863 HG3 ARG 108 HG3 ARG 108 -8.365 2.210 -15.741 864 HD2 ARG 108 HD2 ARG 108 -8.137 2.390 -18.514 865 HD3 ARG 108 HD3 ARG 108 -6.716 3.261 -17.962 866 HE ARG 108 HE ARG 108 -5.737 1.284 -17.389 867 HH11 ARG 108 HH11 ARG 108 -9.182 0.604 -17.625 868 HH12 ARG 108 HH12 ARG 108 -8.921 -1.116 -17.625 869 HH21 ARG 108 HH21 ARG 108 -5.497 -0.931 -17.432 870 HH22 ARG 108 HH22 ARG 108 -6.907 -1.949 -17.461 871 H LYS 109 H LYS 109 -7.385 5.944 -17.137 872 HA LYS 109 HA LYS 109 -6.269 5.155 -19.726 873 HB2 LYS 109 HB2 LYS 109 -7.526 7.259 -20.295 874 HB3 LYS 109 HB3 LYS 109 -6.639 8.118 -19.052 875 HG2 LYS 109 HG2 LYS 109 -5.739 8.654 -21.227 876 HG3 LYS 109 HG3 LYS 109 -4.533 7.801 -20.284 877 HD2 LYS 109 HD2 LYS 109 -4.447 7.033 -22.564 878 HD3 LYS 109 HD3 LYS 109 -5.037 5.705 -21.571 879 HE2 LYS 109 HE2 LYS 109 -7.382 6.258 -22.265 880 HE3 LYS 109 HE3 LYS 109 -6.760 7.586 -23.252 881 HZ1 LYS 109 HZ1 LYS 109 -5.528 5.936 -24.569 882 HZ2 LYS 109 HZ2 LYS 109 -6.130 4.709 -23.668 883 HZ3 LYS 109 HZ3 LYS 109 -7.126 5.608 -24.596 884 H TYR 110 H TYR 110 -4.067 4.812 -19.472 885 HA TYR 110 HA TYR 110 -2.738 5.401 -16.956 886 HB2 TYR 110 HB2 TYR 110 -2.070 3.472 -18.347 887 HB3 TYR 110 HB3 TYR 110 -1.611 4.552 -19.651 888 HD1 TYR 110 HD2 TYR 110 -0.933 4.772 -15.924 889 HD2 TYR 110 HD1 TYR 110 0.735 4.353 -19.888 890 HE1 TYR 110 HE2 TYR 110 1.345 5.059 -15.005 891 HE2 TYR 110 HE1 TYR 110 3.026 4.537 -18.930 892 HH TYR 110 HH TYR 110 4.272 4.789 -17.031 893 H LEU 111 H LEU 111 -1.899 7.323 -16.337 894 HA LEU 111 HA LEU 111 -1.786 9.544 -18.304 895 HB2 LEU 111 HB2 LEU 111 -1.385 9.387 -15.285 896 HB3 LEU 111 HB3 LEU 111 -1.329 10.875 -16.229 897 HG LEU 111 HG LEU 111 -3.781 9.081 -16.214 898 HD11 LEU 111 HD11 LEU 111 -3.345 9.727 -13.926 899 HD12 LEU 111 HD12 LEU 111 -3.075 11.414 -14.404 900 HD13 LEU 111 HD13 LEU 111 -4.694 10.680 -14.552 901 HD21 LEU 111 HD21 LEU 111 -3.315 12.024 -16.887 902 HD22 LEU 111 HD22 LEU 111 -3.663 10.731 -18.057 903 HD23 LEU 111 HD23 LEU 111 -4.897 11.214 -16.888 904 H GLY 112 H GLY 112 0.368 7.753 -16.128 905 HA2 GLY 112 HA2 GLY 112 2.710 7.516 -17.310 906 HA3 GLY 112 HA3 GLY 112 2.740 9.266 -17.113 907 H LYS 113 H LYS 113 4.290 9.506 -15.685 908 HA LYS 113 HA LYS 113 4.314 7.924 -13.140 909 HB2 LYS 113 HB2 LYS 113 6.121 7.715 -15.179 910 HB3 LYS 113 HB3 LYS 113 6.878 8.979 -14.218 911 HG2 LYS 113 HG2 LYS 113 6.583 7.405 -12.191 912 HG3 LYS 113 HG3 LYS 113 6.138 6.161 -13.378 913 HD2 LYS 113 HD2 LYS 113 8.330 6.736 -14.600 914 HD3 LYS 113 HD3 LYS 113 8.764 7.702 -13.175 915 HE2 LYS 113 HE2 LYS 113 8.531 5.648 -11.756 916 HE3 LYS 113 HE3 LYS 113 8.123 4.718 -13.208 917 HZ1 LYS 113 HZ1 LYS 113 10.330 5.337 -14.110 918 HZ2 LYS 113 HZ2 LYS 113 10.712 6.090 -12.709 919 HZ3 LYS 113 HZ3 LYS 113 10.465 4.476 -12.731 920 H GLN 114 H GLN 114 3.279 9.420 -11.909 921 HA GLN 114 HA GLN 114 4.393 12.130 -11.602 922 HB2 GLN 114 HB2 GLN 114 1.729 11.217 -10.588 923 HB3 GLN 114 HB3 GLN 114 2.299 12.839 -11.026 924 HG2 GLN 114 HG2 GLN 114 2.705 11.927 -13.382 925 HG3 GLN 114 HG3 GLN 114 1.809 10.480 -12.882 926 HE21 GLN 114 HE22 GLN 114 0.925 11.344 -14.958 927 HE22 GLN 114 HE21 GLN 114 -0.370 12.473 -14.763 928 H ASN 115 H ASN 115 4.646 13.088 -9.494 929 HA ASN 115 HA ASN 115 5.505 11.479 -7.361 930 HB2 ASN 115 HB2 ASN 115 5.760 14.118 -8.058 931 HB3 ASN 115 HB3 ASN 115 4.508 14.262 -6.815 932 HD21 ASN 115 HD22 ASN 115 5.244 12.284 -4.962 933 HD22 ASN 115 HD21 ASN 115 6.933 12.446 -4.582 934 H VAL 116 H VAL 116 4.310 10.168 -6.131 935 HA VAL 116 HA VAL 116 1.601 11.122 -5.296 936 HB VAL 116 HB VAL 116 0.921 8.749 -5.169 937 HG11 VAL 116 HG11 VAL 116 0.288 10.196 -7.078 938 HG12 VAL 116 HG12 VAL 116 1.706 9.619 -7.963 939 HG13 VAL 116 HG13 VAL 116 0.408 8.490 -7.500 940 HG21 VAL 116 HG21 VAL 116 3.387 8.178 -6.886 941 HG22 VAL 116 HG22 VAL 116 3.160 7.651 -5.206 942 HG23 VAL 116 HG23 VAL 116 2.083 7.050 -6.475 943 H TYR 117 H TYR 117 0.857 10.598 -3.298 944 HA TYR 117 HA TYR 117 2.927 10.115 -1.194 945 HB2 TYR 117 HB2 TYR 117 0.841 12.316 -1.144 946 HB3 TYR 117 HB3 TYR 117 2.224 12.108 -0.094 947 HD1 TYR 117 HD2 TYR 117 4.505 12.752 -0.850 948 HD2 TYR 117 HD1 TYR 117 1.032 13.303 -3.344 949 HE1 TYR 117 HE2 TYR 117 5.773 14.370 -2.258 950 HE2 TYR 117 HE1 TYR 117 2.305 14.903 -4.765 951 HH TYR 117 HH TYR 117 4.248 16.096 -4.998 952 H ASP 118 H ASP 118 2.049 9.640 0.909 953 HA ASP 118 HA ASP 118 -0.838 9.182 1.147 954 HB2 ASP 118 HB2 ASP 118 0.634 7.052 0.314 955 HB3 ASP 118 HB3 ASP 118 0.828 6.875 2.055 956 H ILE 119 H ILE 119 -1.350 8.401 3.431 957 HA ILE 119 HA ILE 119 0.496 9.579 5.455 958 HB ILE 119 HB ILE 119 -1.438 10.466 6.715 959 HG12 ILE 119 HG12 ILE 119 -3.000 10.385 4.102 960 HG13 ILE 119 HG13 ILE 119 -3.245 9.241 5.423 961 HG21 ILE 119 HG21 ILE 119 0.159 11.881 5.479 962 HG22 ILE 119 HG22 ILE 119 -0.890 11.825 4.046 963 HG23 ILE 119 HG23 ILE 119 -1.442 12.610 5.540 964 HD11 ILE 119 HD11 ILE 119 -3.804 11.121 6.956 965 HD12 ILE 119 HD12 ILE 119 -3.688 12.247 5.582 966 HD13 ILE 119 HD13 ILE 119 -4.911 10.969 5.578 967 H GLY 120 H GLY 120 0.590 8.624 7.358 968 HA2 GLY 120 HA2 GLY 120 -0.432 5.822 7.458 969 HA3 GLY 120 HA3 GLY 120 0.970 6.465 8.318 970 H VAL 121 H VAL 121 -1.223 4.985 9.436 971 HA VAL 121 HA VAL 121 -2.226 6.880 11.494 972 HB VAL 121 HB VAL 121 -4.121 4.958 10.164 973 HG11 VAL 121 HG11 VAL 121 -4.879 5.782 12.326 974 HG12 VAL 121 HG12 VAL 121 -4.487 7.465 11.867 975 HG13 VAL 121 HG13 VAL 121 -5.799 6.583 11.074 976 HG21 VAL 121 HG21 VAL 121 -3.813 7.891 9.387 977 HG22 VAL 121 HG22 VAL 121 -3.537 6.487 8.325 978 HG23 VAL 121 HG23 VAL 121 -5.155 6.832 8.906 979 H GLU 122 H GLU 122 -2.993 5.773 13.419 980 HA GLU 122 HA GLU 122 -1.223 3.817 14.338 981 HB2 GLU 122 HB2 GLU 122 -3.951 4.667 15.380 982 HB3 GLU 122 HB3 GLU 122 -2.834 3.624 16.273 983 HG2 GLU 122 HG2 GLU 122 -1.114 5.393 16.238 984 HG3 GLU 122 HG3 GLU 122 -2.206 6.457 15.350 985 H ARG 123 H ARG 123 -4.426 3.231 12.947 986 HA ARG 123 HA ARG 123 -3.960 0.336 12.774 987 HB2 ARG 123 HB2 ARG 123 -5.998 -0.281 14.097 988 HB3 ARG 123 HB3 ARG 123 -4.641 0.308 15.048 989 HG2 ARG 123 HG2 ARG 123 -5.720 2.503 15.331 990 HG3 ARG 123 HG3 ARG 123 -7.075 1.991 14.311 991 HD2 ARG 123 HD2 ARG 123 -7.616 0.199 15.924 992 HD3 ARG 123 HD3 ARG 123 -6.252 0.713 16.939 993 HE ARG 123 HE ARG 123 -8.096 2.890 16.366 994 HH11 ARG 123 HH11 ARG 123 -7.710 0.146 18.517 995 HH12 ARG 123 HH12 ARG 123 -8.706 0.868 19.758 996 HH21 ARG 123 HH21 ARG 123 -9.346 3.749 17.988 997 HH22 ARG 123 HH22 ARG 123 -9.608 2.847 19.457 998 H ASP 124 H ASP 124 -6.405 2.904 12.423 999 HA ASP 124 HA ASP 124 -7.637 1.453 10.131 1000 HB2 ASP 124 HB2 ASP 124 -8.522 3.712 11.913 1001 HB3 ASP 124 HB3 ASP 124 -9.305 3.402 10.366 1002 H HIS 125 H HIS 125 -5.792 1.712 8.880 1003 HA HIS 125 HA HIS 125 -4.435 3.992 8.027 1004 HB2 HIS 125 HB2 HIS 125 -4.144 2.484 5.909 1005 HB3 HIS 125 HB3 HIS 125 -3.498 1.962 7.446 1006 HD1 HIS 125 HD1 HIS 125 -4.196 -0.445 8.181 1007 HD2 HIS 125 HD2 HIS 125 -6.739 1.305 5.321 1008 HE1 HIS 125 HE1 HIS 125 -5.909 -2.226 7.566 1009 H ASN 126 H ASN 126 -7.690 3.144 7.178 1010 HA ASN 126 HA ASN 126 -7.796 4.564 4.651 1011 HB2 ASN 126 HB2 ASN 126 -10.152 3.950 4.735 1012 HB3 ASN 126 HB3 ASN 126 -9.189 2.566 5.204 1013 HD21 ASN 126 HD22 ASN 126 -11.619 4.852 6.287 1014 HD22 ASN 126 HD21 ASN 126 -11.680 4.272 7.948 1015 H PHE 127 H PHE 127 -9.439 6.287 4.262 1016 HA PHE 127 HA PHE 127 -10.095 8.167 6.398 1017 HB2 PHE 127 HB2 PHE 127 -8.768 10.048 5.440 1018 HB3 PHE 127 HB3 PHE 127 -7.772 8.794 6.145 1019 HD1 PHE 127 HD1 PHE 127 -9.138 9.942 2.811 1020 HD2 PHE 127 HD2 PHE 127 -5.977 7.869 4.900 1021 HE1 PHE 127 HE1 PHE 127 -7.976 9.536 0.669 1022 HE2 PHE 127 HE2 PHE 127 -4.763 7.586 2.750 1023 HZ PHE 127 HZ PHE 127 -5.789 8.400 0.635 1024 H ALA 128 H ALA 128 -11.362 10.025 5.583 1025 HA ALA 128 HA ALA 128 -12.824 9.417 3.095 1026 HB1 ALA 128 HB1 ALA 128 -14.079 9.906 5.135 1027 HB2 ALA 128 HB2 ALA 128 -13.286 11.496 5.261 1028 HB3 ALA 128 HB3 ALA 128 -14.372 11.149 3.901 1029 H LEU 129 H LEU 129 -12.581 10.448 1.221 1030 HA LEU 129 HA LEU 129 -10.793 12.763 0.821 1031 HB2 LEU 129 HB2 LEU 129 -12.762 11.350 -1.037 1032 HB3 LEU 129 HB3 LEU 129 -11.699 12.663 -1.522 1033 HG LEU 129 HG LEU 129 -10.816 9.888 -0.641 1034 HD11 LEU 129 HD11 LEU 129 -11.666 10.105 -3.006 1035 HD12 LEU 129 HD12 LEU 129 -10.484 11.394 -3.280 1036 HD13 LEU 129 HD13 LEU 129 -9.942 9.733 -2.925 1037 HD21 LEU 129 HD21 LEU 129 -9.153 12.319 -1.383 1038 HD22 LEU 129 HD22 LEU 129 -9.161 11.438 0.164 1039 HD23 LEU 129 HD23 LEU 129 -8.535 10.652 -1.290 1040 H LYS 130 H LYS 130 -11.579 14.753 -0.254 1041 HA LYS 130 HA LYS 130 -13.431 16.193 1.247 1042 HB2 LYS 130 HB2 LYS 130 -13.397 17.871 -0.515 1043 HB3 LYS 130 HB3 LYS 130 -11.781 17.285 -0.126 1044 HG2 LYS 130 HG2 LYS 130 -11.623 16.047 -2.165 1045 HG3 LYS 130 HG3 LYS 130 -13.335 16.238 -2.530 1046 HD2 LYS 130 HD2 LYS 130 -11.534 18.656 -2.247 1047 HD3 LYS 130 HD3 LYS 130 -11.601 17.765 -3.765 1048 HE2 LYS 130 HE2 LYS 130 -14.131 18.800 -2.427 1049 HE3 LYS 130 HE3 LYS 130 -13.118 19.858 -3.413 1050 HZ1 LYS 130 HZ1 LYS 130 -13.424 18.384 -5.290 1051 HZ2 LYS 130 HZ2 LYS 130 -14.311 17.320 -4.412 1052 HZ3 LYS 130 HZ3 LYS 130 -14.887 18.826 -4.722 1053 H ASN 131 H ASN 131 -14.261 14.252 -1.564 1054 HA ASN 131 HA ASN 131 -17.058 15.232 -1.621 1055 HB2 ASN 131 HB2 ASN 131 -15.381 13.314 -3.275 1056 HB3 ASN 131 HB3 ASN 131 -17.127 13.380 -3.470 1057 HD21 ASN 131 HD22 ASN 131 -18.120 15.268 -4.376 1058 HD22 ASN 131 HD21 ASN 131 -17.137 16.418 -5.263 1059 H GLY 132 H GLY 132 -15.426 12.816 0.167 1060 HA2 GLY 132 HA2 GLY 132 -16.687 11.694 1.856 1061 HA3 GLY 132 HA3 GLY 132 -18.005 11.395 0.720 1062 H PHE 133 H PHE 133 -15.471 10.602 -1.192 1063 HA PHE 133 HA PHE 133 -15.842 7.781 -0.993 1064 HB2 PHE 133 HB2 PHE 133 -13.399 9.193 -2.087 1065 HB3 PHE 133 HB3 PHE 133 -13.982 7.602 -2.537 1066 HD1 PHE 133 HD1 PHE 133 -16.401 7.492 -3.554 1067 HD2 PHE 133 HD2 PHE 133 -13.946 11.040 -3.453 1068 HE1 PHE 133 HE1 PHE 133 -17.755 8.489 -5.372 1069 HE2 PHE 133 HE2 PHE 133 -15.311 12.036 -5.273 1070 HZ PHE 133 HZ PHE 133 -17.247 10.788 -6.190 1071 H ILE 134 H ILE 134 -14.279 6.095 -0.415 1072 HA ILE 134 HA ILE 134 -12.260 6.957 1.602 1073 HB ILE 134 HB ILE 134 -14.020 4.508 1.840 1074 HG12 ILE 134 HG12 ILE 134 -14.403 5.814 4.162 1075 HG13 ILE 134 HG13 ILE 134 -14.037 7.219 3.171 1076 HG21 ILE 134 HG21 ILE 134 -11.754 3.985 2.617 1077 HG22 ILE 134 HG22 ILE 134 -11.672 5.524 3.507 1078 HG23 ILE 134 HG23 ILE 134 -12.755 4.244 4.038 1079 HD11 ILE 134 HD11 ILE 134 -15.915 6.533 1.622 1080 HD12 ILE 134 HD12 ILE 134 -16.236 5.151 2.686 1081 HD13 ILE 134 HD13 ILE 134 -16.441 6.808 3.281 1082 H ALA 135 H ALA 135 -10.351 6.428 1.272 1083 HA ALA 135 HA ALA 135 -9.595 4.242 -0.614 1084 HB1 ALA 135 HB1 ALA 135 -8.998 6.712 -1.130 1085 HB2 ALA 135 HB2 ALA 135 -7.880 6.593 0.242 1086 HB3 ALA 135 HB3 ALA 135 -7.696 5.523 -1.171 1087 H SER 136 H SER 136 -7.809 2.902 0.066 1088 HA SER 136 HA SER 136 -7.241 2.798 3.009 1089 HB2 SER 136 HB2 SER 136 -9.021 1.257 2.401 1090 HB3 SER 136 HB3 SER 136 -8.019 0.554 1.129 1091 HG SER 136 HG SER 136 -8.047 -0.587 3.200 1092 H ASN 137 H ASN 137 -5.216 2.547 3.571 1093 HA ASN 137 HA ASN 137 -3.095 2.178 1.509 1094 HB2 ASN 137 HB2 ASN 137 -2.877 4.273 2.623 1095 HB3 ASN 137 HB3 ASN 137 -3.102 3.557 4.211 1096 HD21 ASN 137 HD22 ASN 137 -0.805 4.167 1.661 1097 HD22 ASN 137 HD21 ASN 137 0.595 3.495 2.506 Start of MODEL 12 1 H1 GLY -1 H GLY -1 0.379 -0.986 1.125 2 HA2 GLY -1 HA2 GLY -1 -0.714 -1.050 -1.077 3 HA3 GLY -1 HA3 GLY -1 -1.694 -0.383 0.219 4 H GLY 0 H GLY 0 0.493 0.635 -2.401 5 HA2 GLY 0 HA2 GLY 0 0.454 2.329 -3.883 6 HA3 GLY 0 HA3 GLY 0 -1.275 2.365 -3.627 7 H ALA 1 H ALA 1 -0.573 4.577 -4.383 8 HA ALA 1 HA ALA 1 -0.728 6.397 -2.073 9 HB1 ALA 1 HB1 ALA 1 1.655 6.173 -2.305 10 HB2 ALA 1 HB2 ALA 1 1.555 6.386 -4.067 11 HB3 ALA 1 HB3 ALA 1 1.202 7.743 -2.969 12 H LEU 2 H LEU 2 -0.928 8.686 -2.864 13 HA LEU 2 HA LEU 2 -2.866 8.829 -5.141 14 HB2 LEU 2 HB2 LEU 2 -2.945 10.150 -2.400 15 HB3 LEU 2 HB3 LEU 2 -4.183 10.258 -3.642 16 HG LEU 2 HG LEU 2 -3.405 7.683 -2.197 17 HD11 LEU 2 HD11 LEU 2 -4.427 9.294 -0.661 18 HD12 LEU 2 HD12 LEU 2 -5.831 9.437 -1.741 19 HD13 LEU 2 HD13 LEU 2 -5.454 7.890 -0.967 20 HD21 LEU 2 HD21 LEU 2 -5.754 8.320 -4.028 21 HD22 LEU 2 HD22 LEU 2 -4.385 7.255 -4.402 22 HD23 LEU 2 HD23 LEU 2 -5.517 6.811 -3.130 23 H SER 3 H SER 3 -3.017 10.792 -6.272 24 HA SER 3 HA SER 3 -0.639 12.250 -6.738 25 HB2 SER 3 HB2 SER 3 -2.052 13.504 -8.236 26 HB3 SER 3 HB3 SER 3 -2.559 11.821 -8.285 27 HG SER 3 HG SER 3 -4.136 12.594 -6.530 28 H TYR 4 H TYR 4 -0.290 14.637 -6.569 29 HA TYR 4 HA TYR 4 -0.631 15.774 -3.998 30 HB2 TYR 4 HB2 TYR 4 1.001 16.652 -5.513 31 HB3 TYR 4 HB3 TYR 4 -0.203 17.018 -6.735 32 HD1 TYR 4 HD1 TYR 4 1.338 18.165 -3.582 33 HD2 TYR 4 HD2 TYR 4 -1.674 18.979 -6.554 34 HE1 TYR 4 HE1 TYR 4 1.033 20.440 -2.642 35 HE2 TYR 4 HE2 TYR 4 -1.981 21.264 -5.616 36 HH TYR 4 HH TYR 4 -0.084 22.437 -2.821 37 H GLU 5 H GLU 5 -2.668 16.181 -6.907 38 HA GLU 5 HA GLU 5 -4.518 18.036 -5.744 39 HB2 GLU 5 HB2 GLU 5 -5.848 17.644 -7.742 40 HB3 GLU 5 HB3 GLU 5 -4.144 17.840 -8.160 41 HG2 GLU 5 HG2 GLU 5 -3.865 15.474 -8.526 42 HG3 GLU 5 HG3 GLU 5 -5.458 15.114 -7.832 43 H THR 6 H THR 6 -4.188 14.770 -4.928 44 HA THR 6 HA THR 6 -7.003 14.166 -4.496 45 HB THR 6 HB THR 6 -4.544 12.834 -3.313 46 HG1 THR 6 HG1 THR 6 -6.180 11.809 -5.347 47 HG21 THR 6 HG21 THR 6 -7.506 12.308 -3.144 48 HG22 THR 6 HG22 THR 6 -6.431 10.914 -3.349 49 HG23 THR 6 HG23 THR 6 -6.209 12.006 -1.971 50 H GLU 7 H GLU 7 -7.997 15.714 -3.357 51 HA GLU 7 HA GLU 7 -6.910 16.915 -0.985 52 HB2 GLU 7 HB2 GLU 7 -9.840 16.894 -1.734 53 HB3 GLU 7 HB3 GLU 7 -8.959 18.065 -0.760 54 HG2 GLU 7 HG2 GLU 7 -7.626 18.663 -2.840 55 HG3 GLU 7 HG3 GLU 7 -8.719 17.627 -3.763 56 H ILE 8 H ILE 8 -7.136 16.409 1.092 57 HA ILE 8 HA ILE 8 -8.681 13.985 1.912 58 HB ILE 8 HB ILE 8 -6.352 15.242 3.399 59 HG12 ILE 8 HG12 ILE 8 -5.387 14.692 1.261 60 HG13 ILE 8 HG13 ILE 8 -4.819 13.580 2.488 61 HG21 ILE 8 HG21 ILE 8 -7.757 13.731 4.708 62 HG22 ILE 8 HG22 ILE 8 -7.623 12.475 3.472 63 HG23 ILE 8 HG23 ILE 8 -6.197 12.962 4.396 64 HD11 ILE 8 HD11 ILE 8 -6.316 11.818 1.658 65 HD12 ILE 8 HD12 ILE 8 -7.025 12.962 0.489 66 HD13 ILE 8 HD13 ILE 8 -5.363 12.440 0.314 67 H LEU 9 H LEU 9 -10.455 14.463 3.104 68 HA LEU 9 HA LEU 9 -10.995 17.137 4.067 69 HB2 LEU 9 HB2 LEU 9 -12.737 15.476 3.294 70 HB3 LEU 9 HB3 LEU 9 -12.376 14.499 4.717 71 HG LEU 9 HG LEU 9 -12.996 16.569 6.132 72 HD11 LEU 9 HD11 LEU 9 -12.881 18.288 4.349 73 HD12 LEU 9 HD12 LEU 9 -14.192 17.470 3.474 74 HD13 LEU 9 HD13 LEU 9 -14.494 18.209 5.059 75 HD21 LEU 9 HD21 LEU 9 -15.139 15.318 4.370 76 HD22 LEU 9 HD22 LEU 9 -14.476 14.620 5.862 77 HD23 LEU 9 HD23 LEU 9 -15.402 16.125 5.932 78 H THR 10 H THR 10 -10.128 18.029 5.846 79 HA THR 10 HA THR 10 -9.387 16.304 8.166 80 HB THR 10 HB THR 10 -7.582 17.736 8.683 81 HG1 THR 10 HG1 THR 10 -7.133 19.403 6.985 82 HG21 THR 10 HG21 THR 10 -6.070 17.299 6.941 83 HG22 THR 10 HG22 THR 10 -7.305 16.044 6.753 84 HG23 THR 10 HG23 THR 10 -7.314 17.463 5.683 85 H VAL 11 H VAL 11 -9.591 17.075 10.247 86 HA VAL 11 HA VAL 11 -11.888 18.818 10.714 87 HB VAL 11 HB VAL 11 -9.952 17.690 12.761 88 HG11 VAL 11 HG11 VAL 11 -11.373 19.396 13.751 89 HG12 VAL 11 HG12 VAL 11 -12.822 18.678 13.010 90 HG13 VAL 11 HG13 VAL 11 -11.938 17.814 14.287 91 HG21 VAL 11 HG21 VAL 11 -10.946 15.824 11.399 92 HG22 VAL 11 HG22 VAL 11 -11.481 15.837 13.076 93 HG23 VAL 11 HG23 VAL 11 -12.554 16.455 11.800 94 H GLU 12 H GLU 12 -8.391 19.186 10.931 95 HA GLU 12 HA GLU 12 -8.463 21.699 12.382 96 HB2 GLU 12 HB2 GLU 12 -6.395 20.051 10.947 97 HB3 GLU 12 HB3 GLU 12 -6.015 21.739 11.344 98 HG2 GLU 12 HG2 GLU 12 -6.840 21.161 13.751 99 HG3 GLU 12 HG3 GLU 12 -6.721 19.476 13.248 100 H TYR 13 H TYR 13 -8.684 20.969 8.940 101 HA TYR 13 HA TYR 13 -8.836 23.909 8.389 102 HB2 TYR 13 HB2 TYR 13 -7.159 21.868 6.889 103 HB3 TYR 13 HB3 TYR 13 -7.496 23.493 6.322 104 HD1 TYR 13 HD1 TYR 13 -6.980 25.416 8.150 105 HD2 TYR 13 HD2 TYR 13 -4.997 21.579 7.880 106 HE1 TYR 13 HE1 TYR 13 -4.991 26.358 9.302 107 HE2 TYR 13 HE2 TYR 13 -3.017 22.532 9.028 108 HH TYR 13 HH TYR 13 -2.894 25.947 10.088 109 H GLY 14 H GLY 14 -9.353 20.671 6.825 110 HA2 GLY 14 HA2 GLY 14 -11.788 20.476 5.923 111 HA3 GLY 14 HA3 GLY 14 -11.382 21.946 5.035 112 H LEU 15 H LEU 15 -11.633 20.897 3.030 113 HA LEU 15 HA LEU 15 -10.102 18.592 2.151 114 HB2 LEU 15 HB2 LEU 15 -11.455 20.909 0.701 115 HB3 LEU 15 HB3 LEU 15 -10.715 19.557 -0.137 116 HG LEU 15 HG LEU 15 -12.985 19.215 1.868 117 HD11 LEU 15 HD11 LEU 15 -13.739 20.614 0.000 118 HD12 LEU 15 HD12 LEU 15 -13.110 19.430 -1.165 119 HD13 LEU 15 HD13 LEU 15 -14.461 19.003 -0.092 120 HD21 LEU 15 HD21 LEU 15 -11.911 17.379 -0.319 121 HD22 LEU 15 HD22 LEU 15 -11.648 17.160 1.422 122 HD23 LEU 15 HD23 LEU 15 -13.278 17.039 0.760 123 H LEU 16 H LEU 16 -7.895 18.659 2.344 124 HA LEU 16 HA LEU 16 -6.440 20.832 0.897 125 HB2 LEU 16 HB2 LEU 16 -5.820 19.532 3.579 126 HB3 LEU 16 HB3 LEU 16 -4.595 20.374 2.647 127 HG LEU 16 HG LEU 16 -7.105 21.625 3.833 128 HD11 LEU 16 HD11 LEU 16 -5.320 21.080 5.427 129 HD12 LEU 16 HD12 LEU 16 -4.118 21.904 4.409 130 HD13 LEU 16 HD13 LEU 16 -5.405 22.838 5.187 131 HD21 LEU 16 HD21 LEU 16 -4.872 22.895 2.178 132 HD22 LEU 16 HD22 LEU 16 -6.598 22.811 1.749 133 HD23 LEU 16 HD23 LEU 16 -6.086 23.792 3.118 134 HA PRO 17 HA PRO 17 -4.529 17.666 -1.437 135 HB2 PRO 17 HB2 PRO 17 -2.106 18.787 -2.122 136 HB3 PRO 17 HB3 PRO 17 -3.680 19.331 -2.775 137 HG2 PRO 17 HG2 PRO 17 -2.105 20.512 -0.479 138 HG3 PRO 17 HG3 PRO 17 -2.856 21.366 -1.864 139 HD2 PRO 17 HD2 PRO 17 -4.075 21.210 0.546 140 HD3 PRO 17 HD3 PRO 17 -5.020 21.095 -0.968 141 H ILE 18 H ILE 18 -3.720 15.754 -0.823 142 HA ILE 18 HA ILE 18 -2.286 15.246 1.540 143 HB ILE 18 HB ILE 18 -3.577 13.623 0.232 144 HG12 ILE 18 HG12 ILE 18 -0.767 12.627 0.837 145 HG13 ILE 18 HG13 ILE 18 -1.988 12.992 2.061 146 HG21 ILE 18 HG21 ILE 18 -2.669 14.159 -2.019 147 HG22 ILE 18 HG22 ILE 18 -1.171 13.306 -1.592 148 HG23 ILE 18 HG23 ILE 18 -2.710 12.437 -1.666 149 HD11 ILE 18 HD11 ILE 18 -3.492 11.269 1.042 150 HD12 ILE 18 HD12 ILE 18 -2.180 10.832 -0.074 151 HD13 ILE 18 HD13 ILE 18 -1.975 10.617 1.672 152 H GLY 19 H GLY 19 -0.954 15.994 -1.677 153 HA2 GLY 19 HA2 GLY 19 1.725 15.182 -1.137 154 HA3 GLY 19 HA3 GLY 19 1.239 16.377 -2.344 155 H LYS 20 H LYS 20 0.041 18.256 -0.396 156 HA LYS 20 HA LYS 20 2.509 19.587 0.442 157 HB2 LYS 20 HB2 LYS 20 0.322 20.678 -0.413 158 HB3 LYS 20 HB3 LYS 20 -0.363 20.335 1.179 159 HG2 LYS 20 HG2 LYS 20 1.451 21.724 2.213 160 HG3 LYS 20 HG3 LYS 20 2.101 22.038 0.593 161 HD2 LYS 20 HD2 LYS 20 -0.100 23.092 -0.041 162 HD3 LYS 20 HD3 LYS 20 -0.686 22.784 1.596 163 HE2 LYS 20 HE2 LYS 20 -0.036 25.064 1.540 164 HE3 LYS 20 HE3 LYS 20 1.180 24.214 2.496 165 HZ1 LYS 20 HZ1 LYS 20 2.632 24.243 0.514 166 HZ2 LYS 20 HZ2 LYS 20 1.481 25.012 -0.362 167 HZ3 LYS 20 HZ3 LYS 20 2.181 25.763 0.902 168 H ILE 21 H ILE 21 0.018 17.636 1.986 169 HA ILE 21 HA ILE 21 0.750 18.220 4.717 170 HB ILE 21 HB ILE 21 -0.785 15.954 3.466 171 HG12 ILE 21 HG12 ILE 21 -1.830 18.253 5.177 172 HG13 ILE 21 HG13 ILE 21 -1.744 18.356 3.426 173 HG21 ILE 21 HG21 ILE 21 0.106 15.083 5.536 174 HG22 ILE 21 HG22 ILE 21 -0.482 16.500 6.426 175 HG23 ILE 21 HG23 ILE 21 -1.609 15.344 5.711 176 HD11 ILE 21 HD11 ILE 21 -3.247 16.393 3.217 177 HD12 ILE 21 HD12 ILE 21 -3.444 16.382 4.986 178 HD13 ILE 21 HD13 ILE 21 -3.985 17.775 4.039 179 H VAL 22 H VAL 22 1.685 15.725 2.359 180 HA VAL 22 HA VAL 22 3.465 14.373 4.236 181 HB VAL 22 HB VAL 22 2.901 14.087 1.278 182 HG11 VAL 22 HG11 VAL 22 5.166 13.251 1.614 183 HG12 VAL 22 HG12 VAL 22 4.649 12.299 3.023 184 HG13 VAL 22 HG13 VAL 22 4.058 11.901 1.401 185 HG21 VAL 22 HG21 VAL 22 2.133 12.482 3.766 186 HG22 VAL 22 HG22 VAL 22 1.042 13.441 2.745 187 HG23 VAL 22 HG23 VAL 22 1.779 11.961 2.121 188 H GLU 23 H GLU 23 4.020 16.678 1.524 189 HA GLU 23 HA GLU 23 6.904 16.500 1.745 190 HB2 GLU 23 HB2 GLU 23 5.094 18.622 0.534 191 HB3 GLU 23 HB3 GLU 23 6.859 18.686 0.487 192 HG2 GLU 23 HG2 GLU 23 6.900 16.451 -0.610 193 HG3 GLU 23 HG3 GLU 23 5.155 16.473 -0.685 194 H LYS 24 H LYS 24 4.520 18.406 3.470 195 HA LYS 24 HA LYS 24 6.719 19.837 4.934 196 HB2 LYS 24 HB2 LYS 24 3.798 20.619 4.771 197 HB3 LYS 24 HB3 LYS 24 5.113 21.574 5.424 198 HG2 LYS 24 HG2 LYS 24 4.705 20.801 2.503 199 HG3 LYS 24 HG3 LYS 24 4.360 22.366 3.207 200 HD2 LYS 24 HD2 LYS 24 7.136 21.108 3.025 201 HD3 LYS 24 HD3 LYS 24 6.495 22.281 1.889 202 HE2 LYS 24 HE2 LYS 24 6.836 22.829 4.874 203 HE3 LYS 24 HE3 LYS 24 8.065 23.187 3.660 204 HZ1 LYS 24 HZ1 LYS 24 6.499 24.678 2.561 205 HZ2 LYS 24 HZ2 LYS 24 5.336 24.368 3.674 206 HZ3 LYS 24 HZ3 LYS 24 6.708 25.135 4.111 207 H ARG 25 H ARG 25 4.938 17.168 5.371 208 HA ARG 25 HA ARG 25 4.156 15.907 7.098 209 HB2 ARG 25 HB2 ARG 25 6.472 17.194 8.564 210 HB3 ARG 25 HB3 ARG 25 5.645 15.717 9.052 211 HG2 ARG 25 HG2 ARG 25 6.784 14.419 7.578 212 HG3 ARG 25 HG3 ARG 25 6.535 15.537 6.249 213 HD2 ARG 25 HD2 ARG 25 8.845 15.519 6.510 214 HD3 ARG 25 HD3 ARG 25 8.313 17.029 7.263 215 HE ARG 25 HE ARG 25 8.526 14.775 9.134 216 HH11 ARG 25 HH11 ARG 25 10.432 17.348 7.687 217 HH12 ARG 25 HH12 ARG 25 11.678 17.217 8.902 218 HH21 ARG 25 HH21 ARG 25 10.168 14.646 10.615 219 HH22 ARG 25 HH22 ARG 25 11.532 15.726 10.503 220 H ILE 26 H ILE 26 2.442 17.716 6.764 221 HA ILE 26 HA ILE 26 2.017 19.584 8.963 222 HB ILE 26 HB ILE 26 0.052 18.694 6.822 223 HG12 ILE 26 HG12 ILE 26 1.953 21.080 6.938 224 HG13 ILE 26 HG13 ILE 26 2.092 19.685 5.873 225 HG21 ILE 26 HG21 ILE 26 -1.095 19.680 8.765 226 HG22 ILE 26 HG22 ILE 26 -0.013 21.082 8.712 227 HG23 ILE 26 HG23 ILE 26 -1.177 20.774 7.411 228 HD11 ILE 26 HD11 ILE 26 -0.104 20.317 4.816 229 HD12 ILE 26 HD12 ILE 26 -0.030 21.836 5.747 230 HD13 ILE 26 HD13 ILE 26 1.235 21.452 4.565 231 H GLU 27 H GLU 27 1.326 19.063 10.918 232 HA GLU 27 HA GLU 27 0.026 16.498 11.526 233 HB2 GLU 27 HB2 GLU 27 0.712 18.927 13.215 234 HB3 GLU 27 HB3 GLU 27 -0.272 17.578 13.808 235 HG2 GLU 27 HG2 GLU 27 1.547 15.987 13.220 236 HG3 GLU 27 HG3 GLU 27 2.570 17.342 12.735 237 H CYS 28 H CYS 28 -1.966 16.120 11.106 238 HA CYS 28 HA CYS 28 -4.106 18.025 11.736 239 HB2 CYS 28 HB2 CYS 28 -5.172 17.775 9.474 240 HB3 CYS 28 HB3 CYS 28 -3.663 18.688 9.464 241 HG CYS 28 HG CYS 28 -4.096 15.463 8.734 242 H THR 29 H THR 29 -6.245 17.091 11.471 243 HA THR 29 HA THR 29 -6.342 14.219 12.258 244 HB THR 29 HB THR 29 -8.724 16.025 12.334 245 HG1 THR 29 HG1 THR 29 -8.082 16.785 14.387 246 HG21 THR 29 HG21 THR 29 -8.913 13.681 13.127 247 HG22 THR 29 HG22 THR 29 -7.669 14.022 14.363 248 HG23 THR 29 HG23 THR 29 -9.238 14.848 14.415 249 H VAL 30 H VAL 30 -7.916 12.804 11.262 250 HA VAL 30 HA VAL 30 -9.171 13.724 8.712 251 HB VAL 30 HB VAL 30 -8.548 11.710 7.547 252 HG11 VAL 30 HG11 VAL 30 -7.056 13.688 7.391 253 HG12 VAL 30 HG12 VAL 30 -6.022 12.980 8.647 254 HG13 VAL 30 HG13 VAL 30 -6.237 12.155 7.097 255 HG21 VAL 30 HG21 VAL 30 -6.833 10.949 9.934 256 HG22 VAL 30 HG22 VAL 30 -8.295 10.110 9.387 257 HG23 VAL 30 HG23 VAL 30 -6.864 10.134 8.370 258 H TYR 31 H TYR 31 -10.759 12.044 7.899 259 HA TYR 31 HA TYR 31 -12.382 11.027 10.185 260 HB2 TYR 31 HB2 TYR 31 -13.189 12.037 7.431 261 HB3 TYR 31 HB3 TYR 31 -14.277 11.241 8.536 262 HD1 TYR 31 HD2 TYR 31 -14.936 12.302 10.687 263 HD2 TYR 31 HD1 TYR 31 -12.640 14.407 7.713 264 HE1 TYR 31 HE2 TYR 31 -15.734 14.462 11.617 265 HE2 TYR 31 HE1 TYR 31 -13.415 16.584 8.664 266 HH TYR 31 HH TYR 31 -15.694 16.730 11.421 267 H SER 32 H SER 32 -13.338 9.007 10.038 268 HA SER 32 HA SER 32 -13.096 7.202 7.741 269 HB2 SER 32 HB2 SER 32 -10.798 7.075 8.493 270 HB3 SER 32 HB3 SER 32 -11.306 6.971 10.186 271 HG SER 32 HG SER 32 -10.710 4.935 9.026 272 H VAL 33 H VAL 33 -14.298 5.173 8.162 273 HA VAL 33 HA VAL 33 -16.169 5.355 10.446 274 HB VAL 33 HB VAL 33 -17.252 3.331 9.566 275 HG11 VAL 33 HG11 VAL 33 -18.137 5.509 9.086 276 HG12 VAL 33 HG12 VAL 33 -17.092 5.668 7.646 277 HG13 VAL 33 HG13 VAL 33 -18.369 4.431 7.702 278 HG21 VAL 33 HG21 VAL 33 -15.438 3.704 7.168 279 HG22 VAL 33 HG22 VAL 33 -15.437 2.320 8.292 280 HG23 VAL 33 HG23 VAL 33 -16.842 2.617 7.267 281 H ASP 34 H ASP 34 -16.348 3.974 12.101 282 HA ASP 34 HA ASP 34 -14.123 2.158 12.715 283 HB2 ASP 34 HB2 ASP 34 -14.891 2.061 14.872 284 HB3 ASP 34 HB3 ASP 34 -15.212 3.717 14.392 285 H ASN 35 H ASN 35 -14.876 0.020 13.886 286 HA ASN 35 HA ASN 35 -15.866 -1.797 11.910 287 HB2 ASN 35 HB2 ASN 35 -15.401 -2.055 14.914 288 HB3 ASN 35 HB3 ASN 35 -15.918 -3.404 13.911 289 HD21 ASN 35 HD22 ASN 35 -14.495 -4.190 12.203 290 HD22 ASN 35 HD21 ASN 35 -12.770 -3.880 12.334 291 H ASN 36 H ASN 36 -17.706 0.303 13.849 292 HA ASN 36 HA ASN 36 -20.179 -1.353 13.621 293 HB2 ASN 36 HB2 ASN 36 -19.496 1.028 15.383 294 HB3 ASN 36 HB3 ASN 36 -21.058 0.216 15.347 295 HD21 ASN 36 HD22 ASN 36 -18.152 0.406 16.985 296 HD22 ASN 36 HD21 ASN 36 -18.235 -1.156 17.797 297 H GLY 37 H GLY 37 -18.530 0.980 11.861 298 HA2 GLY 37 HA2 GLY 37 -19.261 1.888 9.870 299 HA3 GLY 37 HA3 GLY 37 -20.944 1.621 10.314 300 H ASN 38 H ASN 38 -18.783 3.382 12.530 301 HA ASN 38 HA ASN 38 -20.446 5.838 12.079 302 HB2 ASN 38 HB2 ASN 38 -18.800 5.020 14.511 303 HB3 ASN 38 HB3 ASN 38 -19.879 6.404 14.381 304 HD21 ASN 38 HD22 ASN 38 -19.663 2.943 14.666 305 HD22 ASN 38 HD21 ASN 38 -21.361 2.685 15.121 306 H ILE 39 H ILE 39 -19.493 7.559 11.190 307 HA ILE 39 HA ILE 39 -16.700 7.661 10.530 308 HB ILE 39 HB ILE 39 -18.800 9.838 10.413 309 HG12 ILE 39 HG12 ILE 39 -17.689 8.161 8.115 310 HG13 ILE 39 HG13 ILE 39 -19.140 7.677 8.984 311 HG21 ILE 39 HG21 ILE 39 -16.499 10.750 10.431 312 HG22 ILE 39 HG22 ILE 39 -16.019 9.621 9.149 313 HG23 ILE 39 HG23 ILE 39 -17.183 10.921 8.827 314 HD11 ILE 39 HD11 ILE 39 -20.301 9.713 8.384 315 HD12 ILE 39 HD12 ILE 39 -18.865 10.329 7.546 316 HD13 ILE 39 HD13 ILE 39 -19.696 8.885 6.935 317 H TYR 40 H TYR 40 -15.280 7.705 12.132 318 HA TYR 40 HA TYR 40 -15.528 9.637 14.399 319 HB2 TYR 40 HB2 TYR 40 -14.098 8.270 15.645 320 HB3 TYR 40 HB3 TYR 40 -15.271 7.200 14.924 321 HD1 TYR 40 HD1 TYR 40 -14.572 5.565 13.164 322 HD2 TYR 40 HD2 TYR 40 -11.726 8.129 15.118 323 HE1 TYR 40 HE1 TYR 40 -12.717 4.123 12.351 324 HE2 TYR 40 HE2 TYR 40 -9.872 6.690 14.295 325 HH TYR 40 HH TYR 40 -10.395 3.733 12.400 326 H THR 41 H THR 41 -13.117 10.283 15.140 327 HA THR 41 HA THR 41 -11.610 11.231 12.747 328 HB THR 41 HB THR 41 -11.057 13.298 14.099 329 HG1 THR 41 HG1 THR 41 -13.472 12.725 15.424 330 HG21 THR 41 HG21 THR 41 -12.471 13.494 12.199 331 HG22 THR 41 HG22 THR 41 -13.880 12.844 13.078 332 HG23 THR 41 HG23 THR 41 -13.218 14.433 13.510 333 H GLN 42 H GLN 42 -9.432 11.320 12.832 334 HA GLN 42 HA GLN 42 -8.025 10.440 15.300 335 HB2 GLN 42 HB2 GLN 42 -6.902 8.640 14.115 336 HB3 GLN 42 HB3 GLN 42 -8.650 8.440 14.054 337 HG2 GLN 42 HG2 GLN 42 -8.517 9.572 11.710 338 HG3 GLN 42 HG3 GLN 42 -6.781 9.261 11.808 339 HE21 GLN 42 HE22 GLN 42 -6.573 6.683 12.808 340 HE22 GLN 42 HE21 GLN 42 -7.496 5.591 11.778 341 HA PRO 43 HA PRO 43 -4.993 13.372 13.597 342 HB2 PRO 43 HB2 PRO 43 -2.985 13.078 15.390 343 HB3 PRO 43 HB3 PRO 43 -4.534 13.864 15.823 344 HG2 PRO 43 HG2 PRO 43 -3.697 10.995 16.344 345 HG3 PRO 43 HG3 PRO 43 -4.431 12.160 17.489 346 HD2 PRO 43 HD2 PRO 43 -5.892 10.279 16.125 347 HD3 PRO 43 HD3 PRO 43 -6.560 11.882 16.554 348 H VAL 44 H VAL 44 -3.327 13.158 12.089 349 HA VAL 44 HA VAL 44 -2.399 10.663 11.090 350 HB VAL 44 HB VAL 44 -2.298 12.823 9.891 351 HG11 VAL 44 HG11 VAL 44 -1.397 14.242 11.757 352 HG12 VAL 44 HG12 VAL 44 0.175 13.454 11.550 353 HG13 VAL 44 HG13 VAL 44 -0.516 14.411 10.227 354 HG21 VAL 44 HG21 VAL 44 0.461 11.547 10.023 355 HG22 VAL 44 HG22 VAL 44 -0.922 10.868 9.139 356 HG23 VAL 44 HG23 VAL 44 -0.251 12.437 8.679 357 H ALA 45 H ALA 45 -0.476 9.482 11.342 358 HA ALA 45 HA ALA 45 1.072 10.005 13.863 359 HB1 ALA 45 HB1 ALA 45 -0.252 7.895 13.823 360 HB2 ALA 45 HB2 ALA 45 0.683 7.370 12.397 361 HB3 ALA 45 HB3 ALA 45 1.498 7.627 13.946 362 H GLN 46 H GLN 46 1.371 9.013 10.417 363 HA GLN 46 HA GLN 46 4.116 10.115 10.327 364 HB2 GLN 46 HB2 GLN 46 3.458 7.290 9.398 365 HB3 GLN 46 HB3 GLN 46 5.004 8.102 9.211 366 HG2 GLN 46 HG2 GLN 46 3.764 7.208 11.826 367 HG3 GLN 46 HG3 GLN 46 5.089 6.446 10.961 368 HE21 GLN 46 HE22 GLN 46 5.221 7.317 13.712 369 HE22 GLN 46 HE21 GLN 46 6.450 8.573 13.776 370 H TRP 47 H TRP 47 4.967 9.901 8.049 371 HA TRP 47 HA TRP 47 2.888 10.424 5.961 372 HB2 TRP 47 HB2 TRP 47 5.296 12.189 6.557 373 HB3 TRP 47 HB3 TRP 47 4.152 12.402 5.250 374 HD1 TRP 47 HD1 TRP 47 1.998 13.773 5.739 375 HE1 TRP 47 HE1 TRP 47 1.094 15.086 7.745 376 HE3 TRP 47 HE3 TRP 47 5.308 12.171 9.316 377 HZ2 TRP 47 HZ2 TRP 47 1.705 15.380 10.530 378 HZ3 TRP 47 HZ3 TRP 47 5.095 12.981 11.657 379 HH2 TRP 47 HH2 TRP 47 3.271 14.576 12.273 380 H HIS 48 H HIS 48 3.357 9.435 4.076 381 HA HIS 48 HA HIS 48 6.118 8.359 3.623 382 HB2 HIS 48 HB2 HIS 48 3.531 7.003 2.814 383 HB3 HIS 48 HB3 HIS 48 5.158 6.351 2.776 384 HD1 HIS 48 HD1 HIS 48 6.202 5.642 5.257 385 HD2 HIS 48 HD2 HIS 48 2.153 6.780 5.063 386 HE1 HIS 48 HE1 HIS 48 5.135 4.865 7.437 387 H ASP 49 H ASP 49 7.044 8.726 1.735 388 HA ASP 49 HA ASP 49 5.521 10.027 -0.497 389 HB2 ASP 49 HB2 ASP 49 6.738 11.710 0.718 390 HB3 ASP 49 HB3 ASP 49 8.190 10.713 0.767 391 H ARG 50 H ARG 50 5.595 8.941 -2.296 392 HA ARG 50 HA ARG 50 7.473 6.665 -2.685 393 HB2 ARG 50 HB2 ARG 50 5.187 7.568 -4.425 394 HB3 ARG 50 HB3 ARG 50 5.986 6.006 -4.394 395 HG2 ARG 50 HG2 ARG 50 4.124 7.184 -2.281 396 HG3 ARG 50 HG3 ARG 50 3.855 5.774 -3.292 397 HD2 ARG 50 HD2 ARG 50 5.949 4.764 -2.083 398 HD3 ARG 50 HD3 ARG 50 5.718 6.061 -0.918 399 HE ARG 50 HE ARG 50 3.617 5.160 -0.261 400 HH11 ARG 50 HH11 ARG 50 5.242 2.971 -2.502 401 HH12 ARG 50 HH12 ARG 50 4.075 1.714 -2.237 402 HH21 ARG 50 HH21 ARG 50 2.157 3.516 -0.033 403 HH22 ARG 50 HH22 ARG 50 2.461 1.982 -0.804 404 H GLY 51 H GLY 51 6.999 9.843 -3.870 405 HA2 GLY 51 HA2 GLY 51 8.441 11.216 -5.054 406 HA3 GLY 51 HA3 GLY 51 9.478 9.836 -5.381 407 H GLU 52 H GLU 52 7.847 8.144 -6.839 408 HA GLU 52 HA GLU 52 6.299 9.358 -8.957 409 HB2 GLU 52 HB2 GLU 52 7.843 8.986 -10.816 410 HB3 GLU 52 HB3 GLU 52 8.309 10.308 -9.768 411 HG2 GLU 52 HG2 GLU 52 9.927 8.616 -8.636 412 HG3 GLU 52 HG3 GLU 52 9.609 7.590 -10.033 413 H GLN 53 H GLN 53 4.858 7.783 -8.854 414 HA GLN 53 HA GLN 53 5.658 5.140 -10.012 415 HB2 GLN 53 HB2 GLN 53 3.404 5.673 -8.048 416 HB3 GLN 53 HB3 GLN 53 3.826 4.104 -8.777 417 HG2 GLN 53 HG2 GLN 53 6.190 4.511 -7.744 418 HG3 GLN 53 HG3 GLN 53 5.389 5.739 -6.754 419 HE21 GLN 53 HE21 GLN 53 4.446 4.434 -4.602 420 HE22 GLN 53 HE22 GLN 53 3.155 4.533 -5.593 421 H GLU 54 H GLU 54 4.033 4.120 -11.318 422 HA GLU 54 HA GLU 54 2.888 5.773 -13.321 423 HB2 GLU 54 HB2 GLU 54 1.726 3.616 -13.992 424 HB3 GLU 54 HB3 GLU 54 3.478 3.653 -14.017 425 HG2 GLU 54 HG2 GLU 54 2.180 2.610 -11.508 426 HG3 GLU 54 HG3 GLU 54 2.044 1.630 -12.967 427 H VAL 55 H VAL 55 1.371 7.217 -12.955 428 HA VAL 55 HA VAL 55 -0.998 6.616 -11.254 429 HB VAL 55 HB VAL 55 -0.101 9.245 -12.505 430 HG11 VAL 55 HG11 VAL 55 -2.562 9.217 -12.142 431 HG12 VAL 55 HG12 VAL 55 -2.304 8.664 -10.473 432 HG13 VAL 55 HG13 VAL 55 -1.758 10.277 -10.990 433 HG21 VAL 55 HG21 VAL 55 0.092 8.099 -9.693 434 HG22 VAL 55 HG22 VAL 55 1.421 8.659 -10.728 435 HG23 VAL 55 HG23 VAL 55 0.287 9.825 -10.049 436 H PHE 56 H PHE 56 -2.949 6.383 -11.966 437 HA PHE 56 HA PHE 56 -3.592 6.774 -14.880 438 HB2 PHE 56 HB2 PHE 56 -4.542 4.702 -12.891 439 HB3 PHE 56 HB3 PHE 56 -5.282 4.969 -14.467 440 HD1 PHE 56 HD1 PHE 56 -2.094 3.949 -12.766 441 HD2 PHE 56 HD2 PHE 56 -4.348 4.005 -16.437 442 HE1 PHE 56 HE1 PHE 56 -0.443 2.418 -13.799 443 HE2 PHE 56 HE2 PHE 56 -2.735 2.384 -17.441 444 HZ PHE 56 HZ PHE 56 -0.764 1.627 -16.137 445 H GLU 57 H GLU 57 -5.351 7.899 -15.380 446 HA GLU 57 HA GLU 57 -6.848 9.445 -13.366 447 HB2 GLU 57 HB2 GLU 57 -6.277 10.381 -15.607 448 HB3 GLU 57 HB3 GLU 57 -7.141 9.074 -16.398 449 HG2 GLU 57 HG2 GLU 57 -9.271 9.883 -15.532 450 HG3 GLU 57 HG3 GLU 57 -8.446 11.073 -14.510 451 H TYR 58 H TYR 58 -8.685 8.692 -12.454 452 HA TYR 58 HA TYR 58 -10.408 6.741 -13.939 453 HB2 TYR 58 HB2 TYR 58 -9.992 6.901 -10.943 454 HB3 TYR 58 HB3 TYR 58 -11.056 5.802 -11.780 455 HD1 TYR 58 HD1 TYR 58 -10.060 3.935 -13.198 456 HD2 TYR 58 HD2 TYR 58 -7.637 6.487 -10.713 457 HE1 TYR 58 HE1 TYR 58 -8.277 2.219 -13.194 458 HE2 TYR 58 HE2 TYR 58 -5.820 4.782 -10.749 459 HH TYR 58 HH TYR 58 -6.173 1.700 -12.538 460 H CYS 59 H CYS 59 -11.690 8.297 -14.873 461 HA CYS 59 HA CYS 59 -12.889 10.514 -13.353 462 HB2 CYS 59 HB2 CYS 59 -12.245 10.709 -15.758 463 HB3 CYS 59 HB3 CYS 59 -13.424 9.450 -16.167 464 HG CYS 59 HG CYS 59 -15.535 10.787 -15.133 465 H LEU 60 H LEU 60 -14.975 10.606 -12.566 466 HA LEU 60 HA LEU 60 -16.521 8.097 -12.397 467 HB2 LEU 60 HB2 LEU 60 -15.903 10.228 -10.652 468 HB3 LEU 60 HB3 LEU 60 -17.551 10.547 -11.111 469 HG LEU 60 HG LEU 60 -18.193 8.235 -10.379 470 HD11 LEU 60 HD11 LEU 60 -15.313 8.096 -9.390 471 HD12 LEU 60 HD12 LEU 60 -16.628 6.965 -8.950 472 HD13 LEU 60 HD13 LEU 60 -16.056 7.051 -10.614 473 HD21 LEU 60 HD21 LEU 60 -16.743 10.024 -8.378 474 HD22 LEU 60 HD22 LEU 60 -18.403 10.193 -8.907 475 HD23 LEU 60 HD23 LEU 60 -17.949 8.762 -7.967 476 H GLU 61 H GLU 61 -18.925 8.273 -12.423 477 HA GLU 61 HA GLU 61 -19.929 9.141 -14.961 478 HB2 GLU 61 HB2 GLU 61 -21.271 8.311 -12.371 479 HB3 GLU 61 HB3 GLU 61 -22.185 8.665 -13.825 480 HG2 GLU 61 HG2 GLU 61 -19.981 6.566 -13.835 481 HG3 GLU 61 HG3 GLU 61 -21.611 6.204 -13.291 482 H ASP 62 H ASP 62 -19.742 10.888 -11.900 483 HA ASP 62 HA ASP 62 -21.620 12.968 -12.824 484 HB2 ASP 62 HB2 ASP 62 -21.646 13.792 -10.712 485 HB3 ASP 62 HB3 ASP 62 -21.390 12.088 -10.395 486 H GLY 63 H GLY 63 -18.223 12.399 -12.994 487 HA2 GLY 63 HA2 GLY 63 -16.888 13.786 -14.491 488 HA3 GLY 63 HA3 GLY 63 -17.692 15.225 -13.869 489 H SER 64 H SER 64 -17.185 13.378 -11.125 490 HA SER 64 HA SER 64 -14.920 14.817 -10.118 491 HB2 SER 64 HB2 SER 64 -15.917 12.063 -9.280 492 HB3 SER 64 HB3 SER 64 -14.884 13.152 -8.351 493 HG SER 64 HG SER 64 -17.587 13.452 -9.103 494 H LEU 65 H LEU 65 -12.757 14.130 -9.767 495 HA LEU 65 HA LEU 65 -11.767 12.015 -11.650 496 HB2 LEU 65 HB2 LEU 65 -10.512 14.712 -11.041 497 HB3 LEU 65 HB3 LEU 65 -9.874 13.485 -12.132 498 HG LEU 65 HG LEU 65 -12.482 15.006 -12.553 499 HD11 LEU 65 HD11 LEU 65 -10.462 16.433 -12.743 500 HD12 LEU 65 HD12 LEU 65 -9.824 15.319 -13.977 501 HD13 LEU 65 HD13 LEU 65 -11.316 16.229 -14.281 502 HD21 LEU 65 HD21 LEU 65 -10.942 13.102 -14.375 503 HD22 LEU 65 HD22 LEU 65 -12.543 12.823 -13.663 504 HD23 LEU 65 HD23 LEU 65 -12.334 14.091 -14.864 505 H ILE 66 H ILE 66 -10.338 10.625 -10.915 506 HA ILE 66 HA ILE 66 -9.068 11.005 -8.230 507 HB ILE 66 HB ILE 66 -9.972 8.340 -9.339 508 HG12 ILE 66 HG12 ILE 66 -11.614 10.004 -7.395 509 HG13 ILE 66 HG13 ILE 66 -12.020 9.725 -9.089 510 HG21 ILE 66 HG21 ILE 66 -8.227 8.290 -7.606 511 HG22 ILE 66 HG22 ILE 66 -9.250 9.261 -6.529 512 HG23 ILE 66 HG23 ILE 66 -9.717 7.619 -6.980 513 HD11 ILE 66 HD11 ILE 66 -11.960 7.213 -8.592 514 HD12 ILE 66 HD12 ILE 66 -12.025 7.685 -6.870 515 HD13 ILE 66 HD13 ILE 66 -13.316 8.163 -7.987 516 H ARG 67 H ARG 67 -6.892 10.881 -8.347 517 HA ARG 67 HA ARG 67 -5.583 9.417 -10.608 518 HB2 ARG 67 HB2 ARG 67 -5.010 12.169 -9.462 519 HB3 ARG 67 HB3 ARG 67 -3.749 11.186 -10.203 520 HG2 ARG 67 HG2 ARG 67 -4.401 12.490 -11.943 521 HG3 ARG 67 HG3 ARG 67 -5.245 10.964 -12.238 522 HD2 ARG 67 HD2 ARG 67 -7.343 11.951 -11.470 523 HD3 ARG 67 HD3 ARG 67 -6.499 13.424 -10.980 524 HE ARG 67 HE ARG 67 -6.588 12.500 -13.840 525 HH11 ARG 67 HH11 ARG 67 -6.992 15.242 -11.615 526 HH12 ARG 67 HH12 ARG 67 -7.421 16.284 -12.935 527 HH21 ARG 67 HH21 ARG 67 -7.356 13.920 -15.369 528 HH22 ARG 67 HH22 ARG 67 -7.400 15.615 -14.979 529 H ALA 68 H ALA 68 -4.982 7.619 -9.766 530 HA ALA 68 HA ALA 68 -3.208 7.582 -7.377 531 HB1 ALA 68 HB1 ALA 68 -5.547 7.236 -6.582 532 HB2 ALA 68 HB2 ALA 68 -5.708 5.853 -7.689 533 HB3 ALA 68 HB3 ALA 68 -4.544 5.796 -6.347 534 H THR 69 H THR 69 -2.323 5.391 -6.988 535 HA THR 69 HA THR 69 -1.358 4.097 -9.474 536 HB THR 69 HB THR 69 -0.008 2.738 -7.818 537 HG1 THR 69 HG1 THR 69 -1.614 3.344 -6.087 538 HG21 THR 69 HG21 THR 69 0.907 4.730 -8.900 539 HG22 THR 69 HG22 THR 69 0.255 5.762 -7.613 540 HG23 THR 69 HG23 THR 69 1.508 4.555 -7.237 541 H LYS 70 H LYS 70 -1.602 1.932 -9.905 542 HA LYS 70 HA LYS 70 -4.108 0.667 -9.309 543 HB2 LYS 70 HB2 LYS 70 -1.542 -0.269 -10.656 544 HB3 LYS 70 HB3 LYS 70 -2.975 -1.299 -10.535 545 HG2 LYS 70 HG2 LYS 70 -4.306 0.151 -11.864 546 HG3 LYS 70 HG3 LYS 70 -3.168 1.484 -11.714 547 HD2 LYS 70 HD2 LYS 70 -3.004 0.693 -13.897 548 HD3 LYS 70 HD3 LYS 70 -1.505 0.239 -13.093 549 HE2 LYS 70 HE2 LYS 70 -3.853 -1.649 -13.532 550 HE3 LYS 70 HE3 LYS 70 -2.596 -1.396 -14.737 551 HZ1 LYS 70 HZ1 LYS 70 -0.942 -2.180 -13.120 552 HZ2 LYS 70 HZ2 LYS 70 -2.119 -2.523 -12.026 553 HZ3 LYS 70 HZ3 LYS 70 -2.057 -3.324 -13.444 554 H ASP 71 H ASP 71 -1.460 0.793 -7.327 555 HA ASP 71 HA ASP 71 -1.838 -1.839 -5.999 556 HB2 ASP 71 HB2 ASP 71 0.221 0.401 -5.805 557 HB3 ASP 71 HB3 ASP 71 0.097 -0.842 -4.571 558 H HIS 72 H HIS 72 -3.136 1.345 -5.799 559 HA HIS 72 HA HIS 72 -3.424 1.287 -2.865 560 HB2 HIS 72 HB2 HIS 72 -3.092 3.408 -4.340 561 HB3 HIS 72 HB3 HIS 72 -4.772 3.229 -4.769 562 HD1 HIS 72 HD1 HIS 72 -6.093 2.712 -1.854 563 HD2 HIS 72 HD2 HIS 72 -2.751 5.154 -2.575 564 HE1 HIS 72 HE1 HIS 72 -5.740 4.080 0.235 565 H LYS 73 H LYS 73 -5.174 0.488 -1.836 566 HA LYS 73 HA LYS 73 -7.418 -0.636 -3.418 567 HB2 LYS 73 HB2 LYS 73 -6.726 -0.958 -0.471 568 HB3 LYS 73 HB3 LYS 73 -8.005 -1.831 -1.325 569 HG2 LYS 73 HG2 LYS 73 -6.340 -2.932 -2.768 570 HG3 LYS 73 HG3 LYS 73 -5.037 -1.986 -2.039 571 HD2 LYS 73 HD2 LYS 73 -5.810 -3.044 0.206 572 HD3 LYS 73 HD3 LYS 73 -6.623 -4.238 -0.810 573 HE2 LYS 73 HE2 LYS 73 -4.524 -4.845 -1.889 574 HE3 LYS 73 HE3 LYS 73 -3.688 -3.488 -1.115 575 HZ1 LYS 73 HZ1 LYS 73 -4.054 -4.531 1.032 576 HZ2 LYS 73 HZ2 LYS 73 -4.833 -5.805 0.353 577 HZ3 LYS 73 HZ3 LYS 73 -3.244 -5.563 0.058 578 H PHE 74 H PHE 74 -9.618 -0.262 -2.806 579 HA PHE 74 HA PHE 74 -10.146 2.232 -1.246 580 HB2 PHE 74 HB2 PHE 74 -11.031 1.740 -4.101 581 HB3 PHE 74 HB3 PHE 74 -11.793 2.896 -3.024 582 HD1 PHE 74 HD1 PHE 74 -8.559 2.125 -4.765 583 HD2 PHE 74 HD2 PHE 74 -10.933 5.063 -2.673 584 HE1 PHE 74 HE1 PHE 74 -7.015 3.913 -5.514 585 HE2 PHE 74 HE2 PHE 74 -9.378 6.846 -3.425 586 HZ PHE 74 HZ PHE 74 -7.422 6.276 -4.848 587 H MET 75 H MET 75 -12.034 2.231 -0.139 588 HA MET 75 HA MET 75 -13.027 -0.457 0.392 589 HB2 MET 75 HB2 MET 75 -12.367 1.264 2.116 590 HB3 MET 75 HB3 MET 75 -13.886 2.099 1.754 591 HG2 MET 75 HG2 MET 75 -15.178 0.198 2.486 592 HG3 MET 75 HG3 MET 75 -13.736 -0.831 2.528 593 HE1 MET 75 HE1 MET 75 -14.902 2.608 3.718 594 HE2 MET 75 HE2 MET 75 -15.878 1.752 4.933 595 HE3 MET 75 HE3 MET 75 -14.440 2.675 5.427 596 H THR 76 H THR 76 -14.512 -1.290 -0.940 597 HA THR 76 HA THR 76 -16.342 0.242 -2.544 598 HB THR 76 HB THR 76 -17.357 -1.863 -3.172 599 HG1 THR 76 HG1 THR 76 -16.649 -3.758 -2.198 600 HG21 THR 76 HG21 THR 76 -15.198 -1.219 -4.173 601 HG22 THR 76 HG22 THR 76 -14.343 -2.180 -2.945 602 HG23 THR 76 HG23 THR 76 -15.427 -2.976 -4.110 603 H VAL 77 H VAL 77 -18.741 -0.251 -2.609 604 HA VAL 77 HA VAL 77 -20.010 0.674 -0.279 605 HB VAL 77 HB VAL 77 -22.154 -0.148 -1.338 606 HG11 VAL 77 HG11 VAL 77 -21.249 2.093 -1.737 607 HG12 VAL 77 HG12 VAL 77 -20.285 1.484 -3.098 608 HG13 VAL 77 HG13 VAL 77 -22.060 1.456 -3.178 609 HG21 VAL 77 HG21 VAL 77 -20.341 -1.008 -3.642 610 HG22 VAL 77 HG22 VAL 77 -21.210 -2.115 -2.560 611 HG23 VAL 77 HG23 VAL 77 -22.111 -1.012 -3.609 612 H ASP 78 H ASP 78 -19.110 -2.621 -1.003 613 HA ASP 78 HA ASP 78 -20.715 -3.741 1.228 614 HB2 ASP 78 HB2 ASP 78 -18.784 -4.946 -0.790 615 HB3 ASP 78 HB3 ASP 78 -19.525 -5.868 0.516 616 H GLY 79 H GLY 79 -17.732 -2.150 0.961 617 HA2 GLY 79 HA2 GLY 79 -16.297 -1.662 2.733 618 HA3 GLY 79 HA3 GLY 79 -16.863 -3.060 3.635 619 H GLN 80 H GLN 80 -15.995 -3.813 0.363 620 HA GLN 80 HA GLN 80 -13.852 -5.555 1.253 621 HB2 GLN 80 HB2 GLN 80 -14.660 -4.742 -1.565 622 HB3 GLN 80 HB3 GLN 80 -13.613 -6.089 -1.146 623 HG2 GLN 80 HG2 GLN 80 -16.530 -5.947 -0.257 624 HG3 GLN 80 HG3 GLN 80 -15.994 -6.652 -1.768 625 HE21 GLN 80 HE22 GLN 80 -16.998 -8.670 -0.961 626 HE22 GLN 80 HE21 GLN 80 -16.058 -9.677 0.135 627 H MET 81 H MET 81 -11.674 -5.478 0.737 628 HA MET 81 HA MET 81 -10.477 -2.793 0.187 629 HB2 MET 81 HB2 MET 81 -9.496 -5.181 1.806 630 HB3 MET 81 HB3 MET 81 -8.545 -3.722 1.486 631 HG2 MET 81 HG2 MET 81 -9.991 -2.354 2.774 632 HG3 MET 81 HG3 MET 81 -11.271 -3.559 2.808 633 HE1 MET 81 HE1 MET 81 -11.873 -4.079 5.197 634 HE2 MET 81 HE2 MET 81 -11.475 -5.549 4.286 635 HE3 MET 81 HE3 MET 81 -10.911 -5.361 5.962 636 H LEU 82 H LEU 82 -10.613 -3.095 -2.091 637 HA LEU 82 HA LEU 82 -8.825 -5.186 -3.268 638 HB2 LEU 82 HB2 LEU 82 -11.294 -4.011 -4.578 639 HB3 LEU 82 HB3 LEU 82 -10.311 -5.338 -5.160 640 HG LEU 82 HG LEU 82 -12.167 -5.375 -2.762 641 HD11 LEU 82 HD11 LEU 82 -13.249 -5.428 -5.003 642 HD12 LEU 82 HD12 LEU 82 -12.296 -6.868 -5.407 643 HD13 LEU 82 HD13 LEU 82 -13.491 -6.928 -4.096 644 HD21 LEU 82 HD21 LEU 82 -10.461 -7.639 -3.876 645 HD22 LEU 82 HD22 LEU 82 -10.297 -6.898 -2.280 646 HD23 LEU 82 HD23 LEU 82 -11.746 -7.817 -2.661 647 HA PRO 83 HA PRO 83 -6.698 -1.723 -5.103 648 HB2 PRO 83 HB2 PRO 83 -5.651 -2.822 -7.393 649 HB3 PRO 83 HB3 PRO 83 -5.015 -3.141 -5.757 650 HG2 PRO 83 HG2 PRO 83 -6.965 -4.810 -7.385 651 HG3 PRO 83 HG3 PRO 83 -5.522 -5.372 -6.479 652 HD2 PRO 83 HD2 PRO 83 -8.036 -5.560 -5.462 653 HD3 PRO 83 HD3 PRO 83 -6.647 -5.162 -4.407 654 H ILE 84 H ILE 84 -7.037 -0.085 -6.618 655 HA ILE 84 HA ILE 84 -9.591 0.083 -7.802 656 HB ILE 84 HB ILE 84 -8.260 1.982 -7.095 657 HG12 ILE 84 HG12 ILE 84 -8.903 2.381 -10.030 658 HG13 ILE 84 HG13 ILE 84 -10.172 2.008 -8.862 659 HG21 ILE 84 HG21 ILE 84 -6.034 1.345 -7.895 660 HG22 ILE 84 HG22 ILE 84 -6.572 1.475 -9.582 661 HG23 ILE 84 HG23 ILE 84 -6.475 2.919 -8.558 662 HD11 ILE 84 HD11 ILE 84 -9.630 3.948 -7.523 663 HD12 ILE 84 HD12 ILE 84 -8.296 4.382 -8.623 664 HD13 ILE 84 HD13 ILE 84 -9.976 4.417 -9.200 665 H ASP 85 H ASP 85 -6.696 -1.248 -9.202 666 HA ASP 85 HA ASP 85 -7.401 -1.375 -11.961 667 HB2 ASP 85 HB2 ASP 85 -5.195 -1.976 -11.051 668 HB3 ASP 85 HB3 ASP 85 -5.900 -3.344 -10.189 669 H GLU 86 H GLU 86 -8.587 -3.240 -9.187 670 HA GLU 86 HA GLU 86 -10.080 -5.131 -10.929 671 HB2 GLU 86 HB2 GLU 86 -8.944 -5.982 -8.927 672 HB3 GLU 86 HB3 GLU 86 -9.934 -4.934 -7.893 673 HG2 GLU 86 HG2 GLU 86 -11.942 -6.117 -8.462 674 HG3 GLU 86 HG3 GLU 86 -11.158 -6.934 -9.819 675 H ILE 87 H ILE 87 -10.704 -2.299 -8.774 676 HA ILE 87 HA ILE 87 -13.545 -2.498 -8.808 677 HB ILE 87 HB ILE 87 -11.752 -0.057 -8.541 678 HG12 ILE 87 HG12 ILE 87 -12.982 -1.930 -6.455 679 HG13 ILE 87 HG13 ILE 87 -11.281 -1.883 -6.918 680 HG21 ILE 87 HG21 ILE 87 -14.128 0.567 -9.068 681 HG22 ILE 87 HG22 ILE 87 -14.656 -0.389 -7.687 682 HG23 ILE 87 HG23 ILE 87 -13.652 1.050 -7.453 683 HD11 ILE 87 HD11 ILE 87 -11.127 0.461 -6.105 684 HD12 ILE 87 HD12 ILE 87 -12.786 0.274 -5.466 685 HD13 ILE 87 HD13 ILE 87 -11.481 -0.752 -4.853 686 H PHE 88 H PHE 88 -11.310 -0.861 -11.075 687 HA PHE 88 HA PHE 88 -13.336 0.254 -12.772 688 HB2 PHE 88 HB2 PHE 88 -11.027 1.009 -12.839 689 HB3 PHE 88 HB3 PHE 88 -10.471 -0.592 -13.323 690 HD1 PHE 88 HD1 PHE 88 -12.842 2.123 -14.444 691 HD2 PHE 88 HD2 PHE 88 -10.209 -1.078 -15.622 692 HE1 PHE 88 HE1 PHE 88 -13.204 2.709 -16.826 693 HE2 PHE 88 HE2 PHE 88 -10.553 -0.475 -18.011 694 HZ PHE 88 HZ PHE 88 -12.054 1.414 -18.616 695 H GLU 89 H GLU 89 -11.848 -3.003 -12.773 696 HA GLU 89 HA GLU 89 -13.083 -3.779 -15.324 697 HB2 GLU 89 HB2 GLU 89 -11.594 -5.300 -13.141 698 HB3 GLU 89 HB3 GLU 89 -12.352 -6.113 -14.515 699 HG2 GLU 89 HG2 GLU 89 -11.014 -4.679 -16.070 700 HG3 GLU 89 HG3 GLU 89 -10.172 -3.984 -14.686 701 H ARG 90 H ARG 90 -13.735 -4.465 -11.878 702 HA ARG 90 HA ARG 90 -16.117 -6.071 -12.475 703 HB2 ARG 90 HB2 ARG 90 -15.097 -4.901 -9.857 704 HB3 ARG 90 HB3 ARG 90 -16.387 -6.097 -10.022 705 HG2 ARG 90 HG2 ARG 90 -13.427 -6.475 -10.559 706 HG3 ARG 90 HG3 ARG 90 -14.400 -7.212 -9.297 707 HD2 ARG 90 HD2 ARG 90 -14.506 -7.737 -12.286 708 HD3 ARG 90 HD3 ARG 90 -13.888 -8.825 -11.048 709 HE ARG 90 HE ARG 90 -16.661 -8.400 -11.836 710 HH11 ARG 90 HH11 ARG 90 -14.685 -9.630 -9.202 711 HH12 ARG 90 HH12 ARG 90 -16.005 -10.549 -8.527 712 HH21 ARG 90 HH21 ARG 90 -18.300 -9.569 -10.893 713 HH22 ARG 90 HH22 ARG 90 -17.988 -10.515 -9.462 714 H GLU 91 H GLU 91 -15.555 -2.692 -12.248 715 HA GLU 91 HA GLU 91 -16.865 -0.884 -12.284 716 HB2 GLU 91 HB2 GLU 91 -19.093 -2.689 -13.292 717 HB3 GLU 91 HB3 GLU 91 -19.003 -0.934 -13.418 718 HG2 GLU 91 HG2 GLU 91 -16.875 -1.209 -14.777 719 HG3 GLU 91 HG3 GLU 91 -17.183 -2.947 -14.797 720 H LEU 92 H LEU 92 -16.475 -2.094 -9.866 721 HA LEU 92 HA LEU 92 -18.955 -2.265 -8.314 722 HB2 LEU 92 HB2 LEU 92 -16.006 -2.272 -7.571 723 HB3 LEU 92 HB3 LEU 92 -17.286 -2.388 -6.371 724 HG LEU 92 HG LEU 92 -17.062 -4.341 -8.682 725 HD11 LEU 92 HD11 LEU 92 -14.971 -4.417 -7.348 726 HD12 LEU 92 HD12 LEU 92 -15.932 -4.689 -5.881 727 HD13 LEU 92 HD13 LEU 92 -15.925 -5.894 -7.187 728 HD21 LEU 92 HD21 LEU 92 -18.427 -4.585 -5.978 729 HD22 LEU 92 HD22 LEU 92 -19.248 -4.307 -7.522 730 HD23 LEU 92 HD23 LEU 92 -18.385 -5.816 -7.251 731 H ASP 93 H ASP 93 -19.875 -0.784 -7.032 732 HA ASP 93 HA ASP 93 -19.143 2.028 -7.258 733 HB2 ASP 93 HB2 ASP 93 -21.141 0.642 -5.431 734 HB3 ASP 93 HB3 ASP 93 -21.008 2.379 -5.702 735 H LEU 94 H LEU 94 -18.655 3.423 -5.498 736 HA LEU 94 HA LEU 94 -17.091 2.195 -3.256 737 HB2 LEU 94 HB2 LEU 94 -16.703 4.757 -4.834 738 HB3 LEU 94 HB3 LEU 94 -15.909 4.466 -3.291 739 HG LEU 94 HG LEU 94 -15.583 2.641 -5.719 740 HD11 LEU 94 HD11 LEU 94 -14.605 4.850 -6.181 741 HD12 LEU 94 HD12 LEU 94 -13.695 4.779 -4.650 742 HD13 LEU 94 HD13 LEU 94 -13.353 3.632 -5.961 743 HD21 LEU 94 HD21 LEU 94 -14.253 2.790 -2.980 744 HD22 LEU 94 HD22 LEU 94 -15.060 1.401 -3.753 745 HD23 LEU 94 HD23 LEU 94 -13.517 1.965 -4.361 746 H MET 95 H MET 95 -17.306 2.911 -1.233 747 HA MET 95 HA MET 95 -19.866 3.817 -0.337 748 HB2 MET 95 HB2 MET 95 -18.131 2.306 0.800 749 HB3 MET 95 HB3 MET 95 -17.257 3.772 1.233 750 HG2 MET 95 HG2 MET 95 -19.373 4.552 2.413 751 HG3 MET 95 HG3 MET 95 -20.077 2.975 2.064 752 HE1 MET 95 HE1 MET 95 -19.174 0.699 3.082 753 HE2 MET 95 HE2 MET 95 -17.470 0.985 2.647 754 HE3 MET 95 HE3 MET 95 -17.905 0.593 4.324 755 H ARG 96 H ARG 96 -20.330 5.739 0.974 756 HA ARG 96 HA ARG 96 -18.775 8.191 0.254 757 HB2 ARG 96 HB2 ARG 96 -21.808 7.919 0.161 758 HB3 ARG 96 HB3 ARG 96 -20.875 9.352 -0.260 759 HG2 ARG 96 HG2 ARG 96 -20.813 6.700 -1.758 760 HG3 ARG 96 HG3 ARG 96 -21.736 8.109 -2.238 761 HD2 ARG 96 HD2 ARG 96 -19.886 9.331 -2.893 762 HD3 ARG 96 HD3 ARG 96 -18.751 8.417 -1.882 763 HE ARG 96 HE ARG 96 -19.453 6.448 -3.483 764 HH11 ARG 96 HH11 ARG 96 -18.463 9.685 -4.334 765 HH12 ARG 96 HH12 ARG 96 -17.989 9.231 -5.943 766 HH21 ARG 96 HH21 ARG 96 -18.897 5.910 -5.519 767 HH22 ARG 96 HH22 ARG 96 -18.308 7.091 -6.644 768 H VAL 97 H VAL 97 -19.077 10.003 1.575 769 HA VAL 97 HA VAL 97 -20.252 9.514 4.295 770 HB VAL 97 HB VAL 97 -18.496 10.560 5.373 771 HG11 VAL 97 HG11 VAL 97 -17.972 8.246 4.598 772 HG12 VAL 97 HG12 VAL 97 -17.082 8.945 3.227 773 HG13 VAL 97 HG13 VAL 97 -16.540 9.246 4.884 774 HG21 VAL 97 HG21 VAL 97 -17.567 11.613 2.724 775 HG22 VAL 97 HG22 VAL 97 -17.953 12.493 4.200 776 HG23 VAL 97 HG23 VAL 97 -16.479 11.526 4.126 777 H ASP 98 H ASP 98 -20.390 11.563 1.613 778 HA ASP 98 HA ASP 98 -21.456 13.888 3.153 779 HB2 ASP 98 HB2 ASP 98 -20.319 13.610 0.351 780 HB3 ASP 98 HB3 ASP 98 -21.071 15.085 0.946 781 H ASN 99 H ASN 99 -22.877 11.282 2.303 782 HA ASN 99 HA ASN 99 -24.825 10.524 1.457 783 HB2 ASN 99 HB2 ASN 99 -25.706 13.258 2.420 784 HB3 ASN 99 HB3 ASN 99 -26.843 12.077 1.747 785 HD21 ASN 99 HD22 ASN 99 -24.182 12.276 4.090 786 HD22 ASN 99 HD21 ASN 99 -24.504 10.703 4.705 787 H LEU 100 H LEU 100 -23.027 11.178 -0.237 788 HA LEU 100 HA LEU 100 -24.217 12.259 -2.729 789 HB2 LEU 100 HB2 LEU 100 -21.515 11.138 -1.925 790 HB3 LEU 100 HB3 LEU 100 -21.886 11.346 -3.616 791 HG LEU 100 HG LEU 100 -22.044 13.620 -1.590 792 HD11 LEU 100 HD11 LEU 100 -19.747 12.786 -1.800 793 HD12 LEU 100 HD12 LEU 100 -19.841 12.916 -3.570 794 HD13 LEU 100 HD13 LEU 100 -19.912 14.378 -2.555 795 HD21 LEU 100 HD21 LEU 100 -22.001 13.626 -4.643 796 HD22 LEU 100 HD22 LEU 100 -23.398 14.042 -3.625 797 HD23 LEU 100 HD23 LEU 100 -21.962 15.063 -3.605 798 HA PRO 101 HA PRO 101 -25.667 8.402 -4.335 799 HB2 PRO 101 HB2 PRO 101 -25.282 8.618 -7.034 800 HB3 PRO 101 HB3 PRO 101 -26.453 9.631 -6.136 801 HG2 PRO 101 HG2 PRO 101 -23.619 10.345 -6.956 802 HG3 PRO 101 HG3 PRO 101 -25.113 11.312 -7.180 803 HD2 PRO 101 HD2 PRO 101 -23.417 11.726 -5.086 804 HD3 PRO 101 HD3 PRO 101 -25.178 11.905 -4.890 805 H ASN 102 H ASN 102 -25.065 6.362 -5.190 806 HA ASN 102 HA ASN 102 -22.163 5.751 -5.073 807 HB2 ASN 102 HB2 ASN 102 -24.609 3.940 -5.200 808 HB3 ASN 102 HB3 ASN 102 -22.938 3.405 -5.031 809 HD21 ASN 102 HD22 ASN 102 -21.710 4.354 -3.041 810 HD22 ASN 102 HD21 ASN 102 -22.696 4.537 -1.599 811 H ILE 103 H ILE 103 -21.057 5.912 -6.868 812 HA ILE 103 HA ILE 103 -22.025 4.801 -9.436 813 HB ILE 103 HB ILE 103 -20.926 6.841 -10.563 814 HG12 ILE 103 HG12 ILE 103 -21.788 8.241 -7.994 815 HG13 ILE 103 HG13 ILE 103 -20.112 7.867 -8.381 816 HG21 ILE 103 HG21 ILE 103 -23.322 6.178 -10.691 817 HG22 ILE 103 HG22 ILE 103 -23.658 7.179 -9.264 818 HG23 ILE 103 HG23 ILE 103 -23.100 7.921 -10.773 819 HD11 ILE 103 HD11 ILE 103 -20.214 9.322 -10.374 820 HD12 ILE 103 HD12 ILE 103 -21.920 9.689 -10.021 821 HD13 ILE 103 HD13 ILE 103 -20.660 10.189 -8.891 822 H LYS 104 H LYS 104 -20.623 3.631 -10.403 823 HA LYS 104 HA LYS 104 -17.884 3.267 -9.487 824 HB2 LYS 104 HB2 LYS 104 -17.834 1.466 -11.088 825 HB3 LYS 104 HB3 LYS 104 -19.318 1.438 -10.173 826 HG2 LYS 104 HG2 LYS 104 -19.993 0.867 -12.306 827 HG3 LYS 104 HG3 LYS 104 -20.472 2.555 -12.198 828 HD2 LYS 104 HD2 LYS 104 -18.631 3.249 -13.588 829 HD3 LYS 104 HD3 LYS 104 -17.831 1.660 -13.425 830 HE2 LYS 104 HE2 LYS 104 -19.709 0.630 -14.674 831 HE3 LYS 104 HE3 LYS 104 -20.444 2.219 -14.906 832 HZ1 LYS 104 HZ1 LYS 104 -18.838 2.766 -16.456 833 HZ2 LYS 104 HZ2 LYS 104 -17.643 1.915 -15.723 834 HZ3 LYS 104 HZ3 LYS 104 -18.741 1.123 -16.626 835 H ILE 105 H ILE 105 -16.151 3.035 -11.202 836 HA ILE 105 HA ILE 105 -15.447 5.633 -12.227 837 HB ILE 105 HB ILE 105 -14.207 2.909 -12.721 838 HG12 ILE 105 HG12 ILE 105 -13.262 5.060 -10.770 839 HG13 ILE 105 HG13 ILE 105 -14.341 3.767 -10.270 840 HG21 ILE 105 HG21 ILE 105 -13.507 4.562 -14.437 841 HG22 ILE 105 HG22 ILE 105 -13.106 5.733 -13.165 842 HG23 ILE 105 HG23 ILE 105 -12.183 4.230 -13.346 843 HD11 ILE 105 HD11 ILE 105 -12.685 2.060 -10.974 844 HD12 ILE 105 HD12 ILE 105 -11.531 3.365 -11.334 845 HD13 ILE 105 HD13 ILE 105 -12.123 3.136 -9.682 846 H ALA 106 H ALA 106 -16.130 6.575 -14.023 847 HA ALA 106 HA ALA 106 -17.794 5.251 -15.999 848 HB1 ALA 106 HB1 ALA 106 -18.203 7.549 -15.260 849 HB2 ALA 106 HB2 ALA 106 -16.611 8.065 -15.848 850 HB3 ALA 106 HB3 ALA 106 -17.853 7.522 -16.992 851 H THR 107 H THR 107 -14.460 6.550 -15.950 852 HA THR 107 HA THR 107 -13.660 4.778 -18.131 853 HB THR 107 HB THR 107 -12.660 7.399 -18.908 854 HG1 THR 107 HG1 THR 107 -14.705 8.146 -18.226 855 HG21 THR 107 HG21 THR 107 -12.588 5.421 -20.341 856 HG22 THR 107 HG22 THR 107 -14.362 5.342 -20.361 857 HG23 THR 107 HG23 THR 107 -13.516 6.707 -21.117 858 H ARG 108 H ARG 108 -11.356 4.910 -18.625 859 HA ARG 108 HA ARG 108 -9.651 6.008 -16.458 860 HB2 ARG 108 HB2 ARG 108 -10.165 3.820 -15.709 861 HB3 ARG 108 HB3 ARG 108 -9.940 3.108 -17.293 862 HG2 ARG 108 HG2 ARG 108 -7.564 4.356 -15.862 863 HG3 ARG 108 HG3 ARG 108 -8.185 2.790 -15.399 864 HD2 ARG 108 HD2 ARG 108 -8.013 2.197 -17.967 865 HD3 ARG 108 HD3 ARG 108 -6.899 3.563 -18.007 866 HE ARG 108 HE ARG 108 -5.299 2.246 -17.008 867 HH11 ARG 108 HH11 ARG 108 -8.351 0.620 -16.389 868 HH12 ARG 108 HH12 ARG 108 -7.545 -0.774 -15.712 869 HH21 ARG 108 HH21 ARG 108 -4.373 0.450 -16.142 870 HH22 ARG 108 HH22 ARG 108 -5.379 -0.869 -15.594 871 H LYS 109 H LYS 109 -7.565 6.494 -17.004 872 HA LYS 109 HA LYS 109 -6.470 5.787 -19.661 873 HB2 LYS 109 HB2 LYS 109 -7.974 7.893 -19.888 874 HB3 LYS 109 HB3 LYS 109 -6.812 8.715 -18.871 875 HG2 LYS 109 HG2 LYS 109 -6.315 9.328 -21.063 876 HG3 LYS 109 HG3 LYS 109 -5.034 8.209 -20.632 877 HD2 LYS 109 HD2 LYS 109 -7.500 7.158 -22.056 878 HD3 LYS 109 HD3 LYS 109 -6.378 8.137 -22.979 879 HE2 LYS 109 HE2 LYS 109 -5.545 5.614 -21.484 880 HE3 LYS 109 HE3 LYS 109 -6.063 5.649 -23.165 881 HZ1 LYS 109 HZ1 LYS 109 -4.233 7.139 -23.683 882 HZ2 LYS 109 HZ2 LYS 109 -3.716 7.162 -22.132 883 HZ3 LYS 109 HZ3 LYS 109 -3.652 5.778 -23.005 884 H TYR 110 H TYR 110 -4.239 5.536 -19.502 885 HA TYR 110 HA TYR 110 -2.831 6.154 -17.050 886 HB2 TYR 110 HB2 TYR 110 -2.125 4.355 -18.610 887 HB3 TYR 110 HB3 TYR 110 -1.748 5.559 -19.828 888 HD1 TYR 110 HD2 TYR 110 -1.009 5.272 -16.114 889 HD2 TYR 110 HD1 TYR 110 0.588 5.793 -20.092 890 HE1 TYR 110 HE2 TYR 110 1.267 5.526 -15.180 891 HE2 TYR 110 HE1 TYR 110 2.876 5.941 -19.147 892 HH TYR 110 HH TYR 110 4.143 5.849 -17.280 893 H LEU 111 H LEU 111 -1.754 7.961 -16.433 894 HA LEU 111 HA LEU 111 -1.798 10.341 -18.261 895 HB2 LEU 111 HB2 LEU 111 -1.433 10.079 -15.244 896 HB3 LEU 111 HB3 LEU 111 -1.400 11.591 -16.143 897 HG LEU 111 HG LEU 111 -3.816 9.757 -16.040 898 HD11 LEU 111 HD11 LEU 111 -3.317 10.615 -13.821 899 HD12 LEU 111 HD12 LEU 111 -3.194 12.274 -14.451 900 HD13 LEU 111 HD13 LEU 111 -4.746 11.413 -14.465 901 HD21 LEU 111 HD21 LEU 111 -3.384 12.620 -17.001 902 HD22 LEU 111 HD22 LEU 111 -3.830 11.220 -18.005 903 HD23 LEU 111 HD23 LEU 111 -4.981 11.857 -16.831 904 H GLY 112 H GLY 112 0.339 8.524 -16.058 905 HA2 GLY 112 HA2 GLY 112 2.720 8.513 -17.290 906 HA3 GLY 112 HA3 GLY 112 2.664 10.200 -16.758 907 H LYS 113 H LYS 113 4.264 10.113 -15.268 908 HA LYS 113 HA LYS 113 4.120 8.118 -13.035 909 HB2 LYS 113 HB2 LYS 113 5.810 7.768 -14.985 910 HB3 LYS 113 HB3 LYS 113 6.711 9.070 -14.209 911 HG2 LYS 113 HG2 LYS 113 7.624 7.473 -12.859 912 HG3 LYS 113 HG3 LYS 113 6.068 7.446 -12.044 913 HD2 LYS 113 HD2 LYS 113 6.354 5.228 -12.450 914 HD3 LYS 113 HD3 LYS 113 5.397 5.658 -13.863 915 HE2 LYS 113 HE2 LYS 113 8.453 5.445 -13.760 916 HE3 LYS 113 HE3 LYS 113 7.383 4.135 -14.263 917 HZ1 LYS 113 HZ1 LYS 113 6.632 5.532 -16.115 918 HZ2 LYS 113 HZ2 LYS 113 7.666 6.737 -15.675 919 HZ3 LYS 113 HZ3 LYS 113 8.244 5.302 -16.178 920 H GLN 114 H GLN 114 2.951 9.994 -12.225 921 HA GLN 114 HA GLN 114 4.273 12.449 -11.556 922 HB2 GLN 114 HB2 GLN 114 1.549 11.622 -10.567 923 HB3 GLN 114 HB3 GLN 114 2.199 13.238 -10.916 924 HG2 GLN 114 HG2 GLN 114 2.591 12.367 -13.324 925 HG3 GLN 114 HG3 GLN 114 1.525 11.021 -12.882 926 HE21 GLN 114 HE22 GLN 114 0.863 12.194 -15.002 927 HE22 GLN 114 HE21 GLN 114 -0.364 13.383 -14.750 928 H ASN 115 H ASN 115 4.516 13.302 -9.356 929 HA ASN 115 HA ASN 115 5.444 11.556 -7.365 930 HB2 ASN 115 HB2 ASN 115 5.773 14.175 -7.885 931 HB3 ASN 115 HB3 ASN 115 4.432 14.341 -6.743 932 HD21 ASN 115 HD22 ASN 115 5.037 12.229 -4.901 933 HD22 ASN 115 HD21 ASN 115 6.640 12.500 -4.309 934 H VAL 116 H VAL 116 4.284 10.185 -6.153 935 HA VAL 116 HA VAL 116 1.568 11.040 -5.251 936 HB VAL 116 HB VAL 116 0.926 8.688 -5.190 937 HG11 VAL 116 HG11 VAL 116 0.125 8.698 -7.299 938 HG12 VAL 116 HG12 VAL 116 0.755 10.355 -7.299 939 HG13 VAL 116 HG13 VAL 116 1.704 9.057 -8.037 940 HG21 VAL 116 HG21 VAL 116 3.483 8.137 -6.766 941 HG22 VAL 116 HG22 VAL 116 3.139 7.606 -5.108 942 HG23 VAL 116 HG23 VAL 116 2.163 6.990 -6.450 943 H TYR 117 H TYR 117 0.863 10.480 -3.270 944 HA TYR 117 HA TYR 117 2.956 9.997 -1.188 945 HB2 TYR 117 HB2 TYR 117 0.828 12.147 -1.106 946 HB3 TYR 117 HB3 TYR 117 2.228 11.982 -0.081 947 HD1 TYR 117 HD1 TYR 117 0.999 13.002 -3.414 948 HD2 TYR 117 HD2 TYR 117 4.426 12.873 -0.796 949 HE1 TYR 117 HE1 TYR 117 2.139 14.716 -4.814 950 HE2 TYR 117 HE2 TYR 117 5.536 14.625 -2.165 951 HH TYR 117 HH TYR 117 5.244 16.199 -3.836 952 H ASP 118 H ASP 118 2.099 9.487 0.921 953 HA ASP 118 HA ASP 118 -0.745 8.705 1.206 954 HB2 ASP 118 HB2 ASP 118 0.201 6.794 0.085 955 HB3 ASP 118 HB3 ASP 118 1.610 6.780 1.149 956 H ILE 119 H ILE 119 -1.399 9.024 3.305 957 HA ILE 119 HA ILE 119 0.669 9.577 5.390 958 HB ILE 119 HB ILE 119 -1.185 10.447 6.739 959 HG12 ILE 119 HG12 ILE 119 -2.901 10.152 4.227 960 HG13 ILE 119 HG13 ILE 119 -3.053 9.177 5.689 961 HG21 ILE 119 HG21 ILE 119 0.288 11.870 5.339 962 HG22 ILE 119 HG22 ILE 119 -0.902 11.801 4.022 963 HG23 ILE 119 HG23 ILE 119 -1.308 12.580 5.569 964 HD11 ILE 119 HD11 ILE 119 -3.583 11.243 6.989 965 HD12 ILE 119 HD12 ILE 119 -3.570 12.164 5.463 966 HD13 ILE 119 HD13 ILE 119 -4.752 10.870 5.706 967 H GLY 120 H GLY 120 0.481 8.664 7.498 968 HA2 GLY 120 HA2 GLY 120 -0.902 5.993 7.607 969 HA3 GLY 120 HA3 GLY 120 0.768 6.219 8.118 970 H VAL 121 H VAL 121 -1.464 5.225 9.660 971 HA VAL 121 HA VAL 121 -1.438 7.133 11.921 972 HB VAL 121 HB VAL 121 -4.038 5.753 11.404 973 HG11 VAL 121 HG11 VAL 121 -3.936 6.823 13.476 974 HG12 VAL 121 HG12 VAL 121 -3.089 8.228 12.798 975 HG13 VAL 121 HG13 VAL 121 -4.802 7.974 12.454 976 HG21 VAL 121 HG21 VAL 121 -3.299 8.357 10.018 977 HG22 VAL 121 HG22 VAL 121 -3.741 6.813 9.227 978 HG23 VAL 121 HG23 VAL 121 -4.939 7.689 10.170 979 H GLU 122 H GLU 122 -1.810 6.191 13.989 980 HA GLU 122 HA GLU 122 -0.648 3.571 14.284 981 HB2 GLU 122 HB2 GLU 122 -0.776 5.823 15.793 982 HB3 GLU 122 HB3 GLU 122 -2.057 4.921 16.578 983 HG2 GLU 122 HG2 GLU 122 0.815 3.969 16.129 984 HG3 GLU 122 HG3 GLU 122 0.234 4.732 17.601 985 H ARG 123 H ARG 123 -3.963 4.771 14.441 986 HA ARG 123 HA ARG 123 -5.201 2.419 15.592 987 HB2 ARG 123 HB2 ARG 123 -6.085 4.739 15.782 988 HB3 ARG 123 HB3 ARG 123 -6.314 4.797 14.045 989 HG2 ARG 123 HG2 ARG 123 -8.447 4.399 14.833 990 HG3 ARG 123 HG3 ARG 123 -7.939 2.805 14.318 991 HD2 ARG 123 HD2 ARG 123 -8.996 2.458 16.402 992 HD3 ARG 123 HD3 ARG 123 -7.277 2.373 16.768 993 HE ARG 123 HE ARG 123 -7.455 4.314 18.048 994 HH11 ARG 123 HH11 ARG 123 -10.414 4.071 16.166 995 HH12 ARG 123 HH12 ARG 123 -11.134 5.442 16.962 996 HH21 ARG 123 HH21 ARG 123 -8.436 6.057 19.006 997 HH22 ARG 123 HH22 ARG 123 -10.049 6.522 18.535 998 H ASP 124 H ASP 124 -5.295 3.727 12.292 999 HA ASP 124 HA ASP 124 -5.805 1.124 10.993 1000 HB2 ASP 124 HB2 ASP 124 -7.803 3.432 11.118 1001 HB3 ASP 124 HB3 ASP 124 -7.787 2.307 9.772 1002 H HIS 125 H HIS 125 -6.100 1.686 8.466 1003 HA HIS 125 HA HIS 125 -4.196 3.921 7.764 1004 HB2 HIS 125 HB2 HIS 125 -4.561 1.220 6.426 1005 HB3 HIS 125 HB3 HIS 125 -3.506 2.523 5.873 1006 HD1 HIS 125 HD1 HIS 125 -3.735 0.192 8.990 1007 HD2 HIS 125 HD2 HIS 125 -1.052 2.390 6.606 1008 HE1 HIS 125 HE1 HIS 125 -1.402 -0.367 9.844 1009 H ASN 126 H ASN 126 -7.436 2.978 7.419 1010 HA ASN 126 HA ASN 126 -7.792 4.110 4.746 1011 HB2 ASN 126 HB2 ASN 126 -10.115 3.632 5.024 1012 HB3 ASN 126 HB3 ASN 126 -9.203 2.222 5.528 1013 HD21 ASN 126 HD22 ASN 126 -11.942 2.730 6.221 1014 HD22 ASN 126 HD21 ASN 126 -11.996 3.045 7.953 1015 H PHE 127 H PHE 127 -9.277 5.968 4.397 1016 HA PHE 127 HA PHE 127 -9.820 7.921 6.465 1017 HB2 PHE 127 HB2 PHE 127 -8.325 9.709 5.376 1018 HB3 PHE 127 HB3 PHE 127 -7.581 8.565 6.461 1019 HD1 PHE 127 HD1 PHE 127 -8.170 9.106 2.761 1020 HD2 PHE 127 HD2 PHE 127 -5.625 7.445 5.825 1021 HE1 PHE 127 HE1 PHE 127 -6.521 8.417 1.042 1022 HE2 PHE 127 HE2 PHE 127 -3.966 6.806 4.096 1023 HZ PHE 127 HZ PHE 127 -4.423 7.273 1.697 1024 H ALA 128 H ALA 128 -11.010 9.696 5.708 1025 HA ALA 128 HA ALA 128 -12.495 9.339 3.247 1026 HB1 ALA 128 HB1 ALA 128 -13.501 10.179 5.358 1027 HB2 ALA 128 HB2 ALA 128 -12.475 11.633 5.247 1028 HB3 ALA 128 HB3 ALA 128 -13.713 11.320 4.014 1029 H LEU 129 H LEU 129 -12.540 10.623 1.473 1030 HA LEU 129 HA LEU 129 -10.332 12.585 0.902 1031 HB2 LEU 129 HB2 LEU 129 -11.761 10.532 -0.819 1032 HB3 LEU 129 HB3 LEU 129 -10.546 11.639 -1.424 1033 HG LEU 129 HG LEU 129 -10.020 9.359 0.529 1034 HD11 LEU 129 HD11 LEU 129 -9.517 9.819 -2.446 1035 HD12 LEU 129 HD12 LEU 129 -8.636 8.619 -1.513 1036 HD13 LEU 129 HD13 LEU 129 -10.395 8.484 -1.670 1037 HD21 LEU 129 HD21 LEU 129 -8.232 11.452 -0.754 1038 HD22 LEU 129 HD22 LEU 129 -8.522 11.198 0.983 1039 HD23 LEU 129 HD23 LEU 129 -7.630 9.997 0.050 1040 H LYS 130 H LYS 130 -10.943 13.766 -1.283 1041 HA LYS 130 HA LYS 130 -13.319 15.312 -1.168 1042 HB2 LYS 130 HB2 LYS 130 -13.044 15.743 -3.544 1043 HB3 LYS 130 HB3 LYS 130 -11.526 15.940 -2.697 1044 HG2 LYS 130 HG2 LYS 130 -10.581 13.962 -3.656 1045 HG3 LYS 130 HG3 LYS 130 -12.152 13.341 -4.144 1046 HD2 LYS 130 HD2 LYS 130 -11.855 14.191 -6.182 1047 HD3 LYS 130 HD3 LYS 130 -12.027 15.793 -5.497 1048 HE2 LYS 130 HE2 LYS 130 -10.057 16.032 -6.616 1049 HE3 LYS 130 HE3 LYS 130 -9.455 15.635 -5.009 1050 HZ1 LYS 130 HZ1 LYS 130 -9.232 13.287 -5.820 1051 HZ2 LYS 130 HZ2 LYS 130 -9.778 13.741 -7.301 1052 HZ3 LYS 130 HZ3 LYS 130 -8.352 14.329 -6.760 1053 H ASN 131 H ASN 131 -15.315 15.184 -2.254 1054 HA ASN 131 HA ASN 131 -17.305 14.174 -2.663 1055 HB2 ASN 131 HB2 ASN 131 -15.786 12.210 -4.400 1056 HB3 ASN 131 HB3 ASN 131 -17.422 12.817 -4.626 1057 HD21 ASN 131 HD22 ASN 131 -14.255 13.158 -5.655 1058 HD22 ASN 131 HD21 ASN 131 -14.402 14.767 -6.358 1059 H GLY 132 H GLY 132 -15.591 12.948 -0.427 1060 HA2 GLY 132 HA2 GLY 132 -15.981 11.503 1.242 1061 HA3 GLY 132 HA3 GLY 132 -17.555 11.131 0.504 1062 H PHE 133 H PHE 133 -14.609 10.442 -1.357 1063 HA PHE 133 HA PHE 133 -15.077 7.577 -1.304 1064 HB2 PHE 133 HB2 PHE 133 -12.677 9.232 -2.177 1065 HB3 PHE 133 HB3 PHE 133 -12.770 7.496 -2.341 1066 HD1 PHE 133 HD2 PHE 133 -14.911 6.578 -3.566 1067 HD2 PHE 133 HD1 PHE 133 -13.300 10.548 -4.019 1068 HE1 PHE 133 HE2 PHE 133 -15.892 6.722 -5.847 1069 HE2 PHE 133 HE1 PHE 133 -14.305 10.695 -6.290 1070 HZ PHE 133 HZ PHE 133 -15.551 8.750 -7.199 1071 H ILE 134 H ILE 134 -13.675 5.942 -0.445 1072 HA ILE 134 HA ILE 134 -11.989 6.729 1.894 1073 HB ILE 134 HB ILE 134 -13.744 4.265 1.675 1074 HG12 ILE 134 HG12 ILE 134 -14.712 4.980 3.848 1075 HG13 ILE 134 HG13 ILE 134 -13.874 6.524 3.718 1076 HG21 ILE 134 HG21 ILE 134 -11.587 3.688 2.737 1077 HG22 ILE 134 HG22 ILE 134 -11.713 5.114 3.798 1078 HG23 ILE 134 HG23 ILE 134 -12.820 3.747 3.974 1079 HD11 ILE 134 HD11 ILE 134 -15.834 5.588 1.592 1080 HD12 ILE 134 HD12 ILE 134 -16.378 6.378 3.086 1081 HD13 ILE 134 HD13 ILE 134 -15.297 7.236 1.995 1082 H ALA 135 H ALA 135 -9.935 6.293 1.506 1083 HA ALA 135 HA ALA 135 -9.197 4.114 -0.413 1084 HB1 ALA 135 HB1 ALA 135 -8.519 6.720 -0.518 1085 HB2 ALA 135 HB2 ALA 135 -7.162 6.109 0.432 1086 HB3 ALA 135 HB3 ALA 135 -7.525 5.416 -1.161 1087 H SER 136 H SER 136 -8.898 2.234 0.698 1088 HA SER 136 HA SER 136 -7.681 2.241 3.411 1089 HB2 SER 136 HB2 SER 136 -9.775 0.889 2.762 1090 HB3 SER 136 HB3 SER 136 -8.658 -0.194 1.903 1091 HG SER 136 HG SER 136 -9.022 -0.813 4.109 1092 H ASN 137 H ASN 137 -5.928 0.781 3.912 1093 HA ASN 137 HA ASN 137 -3.761 0.694 1.935 1094 HB2 ASN 137 HB2 ASN 137 -3.161 1.075 4.225 1095 HB3 ASN 137 HB3 ASN 137 -4.015 -0.380 4.769 1096 HD21 ASN 137 HD22 ASN 137 -2.894 -2.325 4.777 1097 HD22 ASN 137 HD21 ASN 137 -1.243 -2.476 4.197 Start of MODEL 13 1 H1 GLY -1 H GLY -1 3.252 -1.545 -1.147 2 HA2 GLY -1 HA2 GLY -1 1.081 -1.096 -1.988 3 HA3 GLY -1 HA3 GLY -1 1.550 0.153 -0.819 4 H GLY 0 H GLY 0 0.284 1.783 -1.653 5 HA2 GLY 0 HA2 GLY 0 0.643 2.778 -4.426 6 HA3 GLY 0 HA3 GLY 0 -0.951 2.425 -3.771 7 H ALA 1 H ALA 1 -1.011 4.838 -4.475 8 HA ALA 1 HA ALA 1 -1.055 6.518 -2.135 9 HB1 ALA 1 HB1 ALA 1 1.288 6.632 -2.235 10 HB2 ALA 1 HB2 ALA 1 1.294 6.682 -4.013 11 HB3 ALA 1 HB3 ALA 1 0.762 8.078 -3.055 12 H LEU 2 H LEU 2 -1.269 8.891 -2.808 13 HA LEU 2 HA LEU 2 -3.121 9.175 -5.146 14 HB2 LEU 2 HB2 LEU 2 -3.151 10.413 -2.358 15 HB3 LEU 2 HB3 LEU 2 -4.278 10.821 -3.645 16 HG LEU 2 HG LEU 2 -4.005 8.051 -2.449 17 HD11 LEU 2 HD11 LEU 2 -4.838 9.714 -0.806 18 HD12 LEU 2 HD12 LEU 2 -6.200 10.060 -1.895 19 HD13 LEU 2 HD13 LEU 2 -5.993 8.433 -1.227 20 HD21 LEU 2 HD21 LEU 2 -6.155 9.250 -4.247 21 HD22 LEU 2 HD22 LEU 2 -4.956 8.020 -4.698 22 HD23 LEU 2 HD23 LEU 2 -6.197 7.634 -3.507 23 H SER 3 H SER 3 -3.091 11.165 -6.271 24 HA SER 3 HA SER 3 -0.437 12.376 -6.445 25 HB2 SER 3 HB2 SER 3 -2.216 11.885 -8.321 26 HB3 SER 3 HB3 SER 3 -2.903 13.444 -7.825 27 HG SER 3 HG SER 3 -0.390 12.832 -8.962 28 H TYR 4 H TYR 4 -0.155 14.832 -6.487 29 HA TYR 4 HA TYR 4 -0.464 15.809 -3.872 30 HB2 TYR 4 HB2 TYR 4 1.225 16.623 -5.462 31 HB3 TYR 4 HB3 TYR 4 -0.021 17.319 -6.479 32 HD1 TYR 4 HD2 TYR 4 -1.298 19.338 -5.744 33 HD2 TYR 4 HD1 TYR 4 2.012 17.770 -3.470 34 HE1 TYR 4 HE2 TYR 4 -1.162 21.474 -4.467 35 HE2 TYR 4 HE1 TYR 4 2.154 19.907 -2.199 36 HH TYR 4 HH TYR 4 1.325 22.014 -1.956 37 H GLU 5 H GLU 5 -2.375 16.634 -6.759 38 HA GLU 5 HA GLU 5 -4.146 18.524 -5.611 39 HB2 GLU 5 HB2 GLU 5 -5.523 18.044 -7.628 40 HB3 GLU 5 HB3 GLU 5 -3.841 18.391 -7.977 41 HG2 GLU 5 HG2 GLU 5 -4.467 15.478 -7.668 42 HG3 GLU 5 HG3 GLU 5 -5.280 16.282 -9.000 43 H THR 6 H THR 6 -4.073 15.240 -4.804 44 HA THR 6 HA THR 6 -6.928 14.770 -4.534 45 HB THR 6 HB THR 6 -4.659 13.337 -3.113 46 HG1 THR 6 HG1 THR 6 -4.217 13.108 -5.125 47 HG21 THR 6 HG21 THR 6 -6.428 12.385 -2.091 48 HG22 THR 6 HG22 THR 6 -7.607 12.959 -3.284 49 HG23 THR 6 HG23 THR 6 -6.652 11.513 -3.623 50 H GLU 7 H GLU 7 -8.080 16.048 -3.233 51 HA GLU 7 HA GLU 7 -6.834 17.221 -0.861 52 HB2 GLU 7 HB2 GLU 7 -9.634 17.582 -1.941 53 HB3 GLU 7 HB3 GLU 7 -8.880 18.511 -0.636 54 HG2 GLU 7 HG2 GLU 7 -7.024 19.098 -2.341 55 HG3 GLU 7 HG3 GLU 7 -8.097 18.436 -3.572 56 H ILE 8 H ILE 8 -7.150 16.743 1.172 57 HA ILE 8 HA ILE 8 -8.967 14.470 1.916 58 HB ILE 8 HB ILE 8 -6.284 15.231 3.138 59 HG12 ILE 8 HG12 ILE 8 -5.778 14.341 1.001 60 HG13 ILE 8 HG13 ILE 8 -5.386 13.141 2.223 61 HG21 ILE 8 HG21 ILE 8 -7.729 14.197 4.792 62 HG22 ILE 8 HG22 ILE 8 -8.125 12.865 3.691 63 HG23 ILE 8 HG23 ILE 8 -6.477 13.046 4.321 64 HD11 ILE 8 HD11 ILE 8 -6.364 11.823 0.586 65 HD12 ILE 8 HD12 ILE 8 -7.804 12.175 1.562 66 HD13 ILE 8 HD13 ILE 8 -7.485 13.092 0.079 67 H LEU 9 H LEU 9 -10.639 15.303 3.034 68 HA LEU 9 HA LEU 9 -10.717 17.773 4.414 69 HB2 LEU 9 HB2 LEU 9 -12.655 16.309 3.718 70 HB3 LEU 9 HB3 LEU 9 -12.222 15.194 5.015 71 HG LEU 9 HG LEU 9 -12.535 17.239 6.608 72 HD11 LEU 9 HD11 LEU 9 -12.641 18.997 4.865 73 HD12 LEU 9 HD12 LEU 9 -14.100 18.232 4.193 74 HD13 LEU 9 HD13 LEU 9 -14.128 18.936 5.821 75 HD21 LEU 9 HD21 LEU 9 -14.953 16.093 5.147 76 HD22 LEU 9 HD22 LEU 9 -14.084 15.308 6.482 77 HD23 LEU 9 HD23 LEU 9 -14.943 16.824 6.772 78 H THR 10 H THR 10 -9.704 18.443 6.250 79 HA THR 10 HA THR 10 -9.019 16.474 8.380 80 HB THR 10 HB THR 10 -7.059 17.748 8.944 81 HG1 THR 10 HG1 THR 10 -6.348 19.344 7.429 82 HG21 THR 10 HG21 THR 10 -6.844 15.923 7.282 83 HG22 THR 10 HG22 THR 10 -7.013 17.113 5.981 84 HG23 THR 10 HG23 THR 10 -5.625 17.190 7.085 85 H VAL 11 H VAL 11 -8.937 17.186 10.530 86 HA VAL 11 HA VAL 11 -11.020 19.159 11.186 87 HB VAL 11 HB VAL 11 -9.198 17.607 13.046 88 HG11 VAL 11 HG11 VAL 11 -10.167 19.472 14.259 89 HG12 VAL 11 HG12 VAL 11 -11.779 19.118 13.595 90 HG13 VAL 11 HG13 VAL 11 -11.005 17.996 14.735 91 HG21 VAL 11 HG21 VAL 11 -12.069 16.986 12.246 92 HG22 VAL 11 HG22 VAL 11 -10.653 16.100 11.642 93 HG23 VAL 11 HG23 VAL 11 -11.053 16.058 13.362 94 H GLU 12 H GLU 12 -7.501 19.136 11.171 95 HA GLU 12 HA GLU 12 -7.110 21.521 12.752 96 HB2 GLU 12 HB2 GLU 12 -5.495 19.915 10.793 97 HB3 GLU 12 HB3 GLU 12 -4.918 21.531 11.185 98 HG2 GLU 12 HG2 GLU 12 -5.401 19.288 13.176 99 HG3 GLU 12 HG3 GLU 12 -3.841 19.876 12.597 100 H TYR 13 H TYR 13 -7.885 21.100 9.322 101 HA TYR 13 HA TYR 13 -8.130 24.063 9.049 102 HB2 TYR 13 HB2 TYR 13 -6.536 22.231 7.209 103 HB3 TYR 13 HB3 TYR 13 -7.057 23.845 6.765 104 HD1 TYR 13 HD1 TYR 13 -6.478 25.748 8.591 105 HD2 TYR 13 HD2 TYR 13 -4.315 22.051 8.030 106 HE1 TYR 13 HE1 TYR 13 -4.456 26.770 9.630 107 HE2 TYR 13 HE2 TYR 13 -2.292 23.081 9.046 108 HH TYR 13 HH TYR 13 -1.395 24.955 9.994 109 H GLY 14 H GLY 14 -8.576 21.031 7.109 110 HA2 GLY 14 HA2 GLY 14 -11.154 20.757 6.603 111 HA3 GLY 14 HA3 GLY 14 -10.931 22.318 5.814 112 H LEU 15 H LEU 15 -10.909 21.991 3.715 113 HA LEU 15 HA LEU 15 -9.998 19.501 2.435 114 HB2 LEU 15 HB2 LEU 15 -11.076 22.146 1.325 115 HB3 LEU 15 HB3 LEU 15 -10.824 20.674 0.392 116 HG LEU 15 HG LEU 15 -12.798 20.958 2.717 117 HD11 LEU 15 HD11 LEU 15 -13.482 22.316 0.827 118 HD12 LEU 15 HD12 LEU 15 -13.227 20.964 -0.291 119 HD13 LEU 15 HD13 LEU 15 -14.515 20.881 0.938 120 HD21 LEU 15 HD21 LEU 15 -12.207 18.721 0.756 121 HD22 LEU 15 HD22 LEU 15 -12.087 18.654 2.517 122 HD23 LEU 15 HD23 LEU 15 -13.680 18.792 1.761 123 H LEU 16 H LEU 16 -7.785 19.309 2.363 124 HA LEU 16 HA LEU 16 -6.286 21.336 0.833 125 HB2 LEU 16 HB2 LEU 16 -4.411 21.144 2.545 126 HB3 LEU 16 HB3 LEU 16 -5.794 22.175 2.875 127 HG LEU 16 HG LEU 16 -6.649 20.680 4.532 128 HD11 LEU 16 HD11 LEU 16 -6.241 18.538 3.511 129 HD12 LEU 16 HD12 LEU 16 -4.491 18.782 3.551 130 HD13 LEU 16 HD13 LEU 16 -5.427 18.565 5.066 131 HD21 LEU 16 HD21 LEU 16 -3.616 20.775 4.763 132 HD22 LEU 16 HD22 LEU 16 -4.707 22.138 5.107 133 HD23 LEU 16 HD23 LEU 16 -4.791 20.662 6.099 134 HA PRO 17 HA PRO 17 -4.457 18.049 -1.322 135 HB2 PRO 17 HB2 PRO 17 -1.922 18.949 -1.932 136 HB3 PRO 17 HB3 PRO 17 -3.425 19.600 -2.656 137 HG2 PRO 17 HG2 PRO 17 -1.821 20.707 -0.352 138 HG3 PRO 17 HG3 PRO 17 -2.489 21.587 -1.760 139 HD2 PRO 17 HD2 PRO 17 -3.725 21.551 0.649 140 HD3 PRO 17 HD3 PRO 17 -4.670 21.521 -0.866 141 H ILE 18 H ILE 18 -3.776 16.067 -0.733 142 HA ILE 18 HA ILE 18 -2.462 15.470 1.689 143 HB ILE 18 HB ILE 18 -3.791 13.864 0.377 144 HG12 ILE 18 HG12 ILE 18 -1.002 12.837 1.014 145 HG13 ILE 18 HG13 ILE 18 -2.237 13.218 2.226 146 HG21 ILE 18 HG21 ILE 18 -2.805 14.344 -1.893 147 HG22 ILE 18 HG22 ILE 18 -1.372 13.410 -1.403 148 HG23 ILE 18 HG23 ILE 18 -2.960 12.636 -1.490 149 HD11 ILE 18 HD11 ILE 18 -3.727 11.486 1.117 150 HD12 ILE 18 HD12 ILE 18 -2.316 11.016 0.135 151 HD13 ILE 18 HD13 ILE 18 -2.260 10.861 1.897 152 H GLY 19 H GLY 19 -0.996 16.101 -1.501 153 HA2 GLY 19 HA2 GLY 19 1.586 15.080 -0.854 154 HA3 GLY 19 HA3 GLY 19 1.232 16.261 -2.122 155 H LYS 20 H LYS 20 0.105 18.194 -0.096 156 HA LYS 20 HA LYS 20 2.599 19.485 0.714 157 HB2 LYS 20 HB2 LYS 20 0.593 20.716 -0.097 158 HB3 LYS 20 HB3 LYS 20 -0.301 20.180 1.337 159 HG2 LYS 20 HG2 LYS 20 1.225 21.424 2.797 160 HG3 LYS 20 HG3 LYS 20 2.236 21.879 1.411 161 HD2 LYS 20 HD2 LYS 20 0.413 23.174 0.438 162 HD3 LYS 20 HD3 LYS 20 -0.723 22.596 1.675 163 HE2 LYS 20 HE2 LYS 20 0.715 23.700 3.431 164 HE3 LYS 20 HE3 LYS 20 1.736 24.339 2.136 165 HZ1 LYS 20 HZ1 LYS 20 0.264 26.067 2.403 166 HZ2 LYS 20 HZ2 LYS 20 -0.601 25.232 1.298 167 HZ3 LYS 20 HZ3 LYS 20 -0.985 25.133 2.885 168 H ILE 21 H ILE 21 0.082 17.531 2.266 169 HA ILE 21 HA ILE 21 0.958 18.004 4.989 170 HB ILE 21 HB ILE 21 -0.651 15.733 3.795 171 HG12 ILE 21 HG12 ILE 21 -1.670 17.923 5.630 172 HG13 ILE 21 HG13 ILE 21 -1.647 18.159 3.885 173 HG21 ILE 21 HG21 ILE 21 0.253 14.787 5.745 174 HG22 ILE 21 HG22 ILE 21 0.156 16.309 6.659 175 HG23 ILE 21 HG23 ILE 21 -1.299 15.383 6.303 176 HD11 ILE 21 HD11 ILE 21 -3.310 16.651 3.472 177 HD12 ILE 21 HD12 ILE 21 -2.910 15.598 4.838 178 HD13 ILE 21 HD13 ILE 21 -3.763 17.106 5.136 179 H VAL 22 H VAL 22 1.668 15.493 2.528 180 HA VAL 22 HA VAL 22 3.474 14.072 4.294 181 HB VAL 22 HB VAL 22 3.140 13.924 1.286 182 HG11 VAL 22 HG11 VAL 22 5.294 12.912 2.074 183 HG12 VAL 22 HG12 VAL 22 4.363 11.848 3.149 184 HG13 VAL 22 HG13 VAL 22 4.166 11.748 1.400 185 HG21 VAL 22 HG21 VAL 22 1.958 11.666 2.410 186 HG22 VAL 22 HG22 VAL 22 1.566 12.918 3.599 187 HG23 VAL 22 HG23 VAL 22 1.108 13.138 1.911 188 H GLU 23 H GLU 23 4.105 16.482 1.678 189 HA GLU 23 HA GLU 23 6.960 16.139 1.958 190 HB2 GLU 23 HB2 GLU 23 7.181 17.709 0.294 191 HB3 GLU 23 HB3 GLU 23 5.649 16.896 -0.078 192 HG2 GLU 23 HG2 GLU 23 4.526 18.851 1.145 193 HG3 GLU 23 HG3 GLU 23 6.087 19.650 1.101 194 H LYS 24 H LYS 24 4.661 18.107 3.672 195 HA LYS 24 HA LYS 24 6.873 19.587 5.072 196 HB2 LYS 24 HB2 LYS 24 3.927 20.299 5.062 197 HB3 LYS 24 HB3 LYS 24 5.252 21.257 5.699 198 HG2 LYS 24 HG2 LYS 24 4.606 20.690 2.792 199 HG3 LYS 24 HG3 LYS 24 4.441 22.214 3.654 200 HD2 LYS 24 HD2 LYS 24 6.952 22.248 3.975 201 HD3 LYS 24 HD3 LYS 24 7.053 20.813 2.934 202 HE2 LYS 24 HE2 LYS 24 5.809 22.119 1.146 203 HE3 LYS 24 HE3 LYS 24 5.919 23.543 2.188 204 HZ1 LYS 24 HZ1 LYS 24 8.383 23.265 2.099 205 HZ2 LYS 24 HZ2 LYS 24 8.208 22.061 1.003 206 HZ3 LYS 24 HZ3 LYS 24 7.732 23.578 0.634 207 H ARG 25 H ARG 25 5.102 16.898 5.425 208 HA ARG 25 HA ARG 25 4.330 15.566 7.101 209 HB2 ARG 25 HB2 ARG 25 6.618 16.669 8.747 210 HB3 ARG 25 HB3 ARG 25 5.827 15.103 8.877 211 HG2 ARG 25 HG2 ARG 25 7.586 14.369 7.652 212 HG3 ARG 25 HG3 ARG 25 6.601 14.918 6.293 213 HD2 ARG 25 HD2 ARG 25 8.904 15.666 6.033 214 HD3 ARG 25 HD3 ARG 25 7.845 17.058 6.253 215 HE ARG 25 HE ARG 25 9.040 16.069 8.740 216 HH11 ARG 25 HH11 ARG 25 9.674 18.227 6.042 217 HH12 ARG 25 HH12 ARG 25 10.734 19.236 6.995 218 HH21 ARG 25 HH21 ARG 25 10.397 17.394 9.879 219 HH22 ARG 25 HH22 ARG 25 11.140 18.763 9.100 220 H ILE 26 H ILE 26 2.593 17.466 6.975 221 HA ILE 26 HA ILE 26 2.357 19.152 9.331 222 HB ILE 26 HB ILE 26 0.234 18.498 7.246 223 HG12 ILE 26 HG12 ILE 26 1.991 20.977 7.509 224 HG13 ILE 26 HG13 ILE 26 2.382 19.647 6.432 225 HG21 ILE 26 HG21 ILE 26 -0.755 19.330 9.363 226 HG22 ILE 26 HG22 ILE 26 0.389 20.689 9.378 227 HG23 ILE 26 HG23 ILE 26 -0.868 20.574 8.136 228 HD11 ILE 26 HD11 ILE 26 0.752 20.155 4.903 229 HD12 ILE 26 HD12 ILE 26 -0.317 20.930 6.078 230 HD13 ILE 26 HD13 ILE 26 1.144 21.762 5.512 231 H GLU 27 H GLU 27 1.604 18.656 11.275 232 HA GLU 27 HA GLU 27 0.420 16.006 11.794 233 HB2 GLU 27 HB2 GLU 27 1.032 18.181 13.806 234 HB3 GLU 27 HB3 GLU 27 0.587 16.479 14.080 235 HG2 GLU 27 HG2 GLU 27 2.688 15.795 12.903 236 HG3 GLU 27 HG3 GLU 27 3.141 17.495 12.766 237 H CYS 28 H CYS 28 -1.491 16.147 10.703 238 HA CYS 28 HA CYS 28 -3.611 17.825 11.979 239 HB2 CYS 28 HB2 CYS 28 -4.756 17.815 9.747 240 HB3 CYS 28 HB3 CYS 28 -3.205 18.657 9.770 241 HG CYS 28 HG CYS 28 -3.836 15.557 8.726 242 H THR 29 H THR 29 -5.844 16.840 11.246 243 HA THR 29 HA THR 29 -5.928 14.008 12.216 244 HB THR 29 HB THR 29 -8.223 15.881 12.564 245 HG1 THR 29 HG1 THR 29 -7.388 16.615 14.545 246 HG21 THR 29 HG21 THR 29 -8.389 13.533 13.308 247 HG22 THR 29 HG22 THR 29 -7.070 13.833 14.476 248 HG23 THR 29 HG23 THR 29 -8.623 14.684 14.627 249 H VAL 30 H VAL 30 -7.468 12.675 11.217 250 HA VAL 30 HA VAL 30 -8.752 13.689 8.695 251 HB VAL 30 HB VAL 30 -8.287 11.545 7.640 252 HG11 VAL 30 HG11 VAL 30 -6.716 13.510 7.448 253 HG12 VAL 30 HG12 VAL 30 -5.660 12.688 8.624 254 HG13 VAL 30 HG13 VAL 30 -6.055 11.925 7.067 255 HG21 VAL 30 HG21 VAL 30 -6.485 10.846 9.994 256 HG22 VAL 30 HG22 VAL 30 -8.076 10.115 9.697 257 HG23 VAL 30 HG23 VAL 30 -6.772 9.892 8.527 258 H TYR 31 H TYR 31 -10.353 11.898 7.881 259 HA TYR 31 HA TYR 31 -12.200 11.234 10.143 260 HB2 TYR 31 HB2 TYR 31 -12.815 12.165 7.310 261 HB3 TYR 31 HB3 TYR 31 -14.004 11.593 8.455 262 HD1 TYR 31 HD2 TYR 31 -11.474 14.289 7.890 263 HD2 TYR 31 HD1 TYR 31 -15.001 13.048 10.029 264 HE1 TYR 31 HE2 TYR 31 -11.782 16.612 8.717 265 HE2 TYR 31 HE1 TYR 31 -15.347 15.397 10.812 266 HH TYR 31 HH TYR 31 -13.132 18.047 9.866 267 H SER 32 H SER 32 -13.115 9.237 10.156 268 HA SER 32 HA SER 32 -12.895 7.345 7.892 269 HB2 SER 32 HB2 SER 32 -10.699 7.103 8.827 270 HB3 SER 32 HB3 SER 32 -11.323 7.111 10.485 271 HG SER 32 HG SER 32 -10.758 5.026 9.540 272 H VAL 33 H VAL 33 -14.148 5.428 8.236 273 HA VAL 33 HA VAL 33 -16.216 5.653 10.366 274 HB VAL 33 HB VAL 33 -17.419 5.660 8.452 275 HG11 VAL 33 HG11 VAL 33 -15.718 5.229 6.741 276 HG12 VAL 33 HG12 VAL 33 -15.589 3.530 7.263 277 HG13 VAL 33 HG13 VAL 33 -17.076 4.130 6.495 278 HG21 VAL 33 HG21 VAL 33 -17.334 2.696 8.932 279 HG22 VAL 33 HG22 VAL 33 -18.124 3.891 9.992 280 HG23 VAL 33 HG23 VAL 33 -18.669 3.690 8.313 281 H ASP 34 H ASP 34 -16.397 4.238 11.923 282 HA ASP 34 HA ASP 34 -14.506 1.995 12.141 283 HB2 ASP 34 HB2 ASP 34 -14.856 2.086 14.375 284 HB3 ASP 34 HB3 ASP 34 -15.254 3.751 13.984 285 H ASN 35 H ASN 35 -15.627 0.101 13.508 286 HA ASN 35 HA ASN 35 -17.188 -1.471 11.662 287 HB2 ASN 35 HB2 ASN 35 -16.549 -1.818 14.621 288 HB3 ASN 35 HB3 ASN 35 -17.484 -2.991 13.701 289 HD21 ASN 35 HD22 ASN 35 -15.206 -3.833 14.935 290 HD22 ASN 35 HD21 ASN 35 -14.003 -4.200 13.703 291 H ASN 36 H ASN 36 -18.262 0.707 14.262 292 HA ASN 36 HA ASN 36 -21.037 -0.254 14.177 293 HB2 ASN 36 HB2 ASN 36 -19.773 2.188 15.493 294 HB3 ASN 36 HB3 ASN 36 -21.430 1.659 15.717 295 HD21 ASN 36 HD22 ASN 36 -18.789 1.819 17.436 296 HD22 ASN 36 HD21 ASN 36 -18.924 0.329 18.360 297 H GLY 37 H GLY 37 -19.176 1.823 12.130 298 HA2 GLY 37 HA2 GLY 37 -19.986 2.807 10.178 299 HA3 GLY 37 HA3 GLY 37 -21.620 2.819 10.784 300 H ASN 38 H ASN 38 -19.132 4.073 12.966 301 HA ASN 38 HA ASN 38 -20.404 6.771 12.746 302 HB2 ASN 38 HB2 ASN 38 -18.717 5.401 14.884 303 HB3 ASN 38 HB3 ASN 38 -19.034 7.128 14.881 304 HD21 ASN 38 HD22 ASN 38 -20.880 4.043 14.638 305 HD22 ASN 38 HD21 ASN 38 -22.216 4.624 15.630 306 H ILE 39 H ILE 39 -19.380 8.346 11.701 307 HA ILE 39 HA ILE 39 -16.681 8.117 10.685 308 HB ILE 39 HB ILE 39 -18.462 10.555 10.774 309 HG12 ILE 39 HG12 ILE 39 -18.093 8.541 8.503 310 HG13 ILE 39 HG13 ILE 39 -19.521 8.621 9.537 311 HG21 ILE 39 HG21 ILE 39 -16.955 11.580 9.313 312 HG22 ILE 39 HG22 ILE 39 -15.820 10.671 10.310 313 HG23 ILE 39 HG23 ILE 39 -16.283 10.042 8.727 314 HD11 ILE 39 HD11 ILE 39 -19.979 10.919 8.819 315 HD12 ILE 39 HD12 ILE 39 -18.561 10.874 7.750 316 HD13 ILE 39 HD13 ILE 39 -19.938 9.786 7.451 317 H TYR 40 H TYR 40 -15.361 7.825 12.417 318 HA TYR 40 HA TYR 40 -15.171 9.840 14.596 319 HB2 TYR 40 HB2 TYR 40 -13.604 8.407 15.633 320 HB3 TYR 40 HB3 TYR 40 -14.966 7.428 15.146 321 HD1 TYR 40 HD2 TYR 40 -14.721 5.704 13.343 322 HD2 TYR 40 HD1 TYR 40 -11.379 8.095 14.685 323 HE1 TYR 40 HE2 TYR 40 -13.150 4.139 12.241 324 HE2 TYR 40 HE1 TYR 40 -9.814 6.498 13.584 325 HH TYR 40 HH TYR 40 -11.003 3.643 11.791 326 H THR 41 H THR 41 -12.860 10.590 15.066 327 HA THR 41 HA THR 41 -11.329 11.095 12.577 328 HB THR 41 HB THR 41 -10.692 13.359 13.545 329 HG1 THR 41 HG1 THR 41 -13.114 13.122 14.949 330 HG21 THR 41 HG21 THR 41 -12.074 13.469 11.668 331 HG22 THR 41 HG22 THR 41 -13.482 12.793 12.513 332 HG23 THR 41 HG23 THR 41 -12.927 14.443 12.869 333 H GLN 42 H GLN 42 -9.113 11.207 12.723 334 HA GLN 42 HA GLN 42 -7.840 10.518 15.312 335 HB2 GLN 42 HB2 GLN 42 -6.757 8.545 14.396 336 HB3 GLN 42 HB3 GLN 42 -8.509 8.374 14.354 337 HG2 GLN 42 HG2 GLN 42 -8.487 8.922 11.906 338 HG3 GLN 42 HG3 GLN 42 -6.727 9.051 11.959 339 HE21 GLN 42 HE22 GLN 42 -8.670 7.079 10.562 340 HE22 GLN 42 HE21 GLN 42 -8.035 5.516 11.039 341 HA PRO 43 HA PRO 43 -4.610 13.061 13.618 342 HB2 PRO 43 HB2 PRO 43 -2.468 12.416 15.176 343 HB3 PRO 43 HB3 PRO 43 -3.887 13.315 15.792 344 HG2 PRO 43 HG2 PRO 43 -3.336 10.337 16.002 345 HG3 PRO 43 HG3 PRO 43 -3.828 11.466 17.309 346 HD2 PRO 43 HD2 PRO 43 -5.635 9.905 16.005 347 HD3 PRO 43 HD3 PRO 43 -6.041 11.572 16.511 348 H VAL 44 H VAL 44 -2.757 13.027 12.300 349 HA VAL 44 HA VAL 44 -2.189 10.648 10.754 350 HB VAL 44 HB VAL 44 -0.541 13.198 10.966 351 HG11 VAL 44 HG11 VAL 44 0.758 11.510 9.906 352 HG12 VAL 44 HG12 VAL 44 -0.639 10.889 9.000 353 HG13 VAL 44 HG13 VAL 44 0.074 12.454 8.583 354 HG21 VAL 44 HG21 VAL 44 -2.152 12.994 8.535 355 HG22 VAL 44 HG22 VAL 44 -3.182 13.051 9.964 356 HG23 VAL 44 HG23 VAL 44 -1.964 14.310 9.708 357 H ALA 45 H ALA 45 -0.940 8.962 11.325 358 HA ALA 45 HA ALA 45 0.766 9.076 13.721 359 HB1 ALA 45 HB1 ALA 45 -0.702 7.136 13.221 360 HB2 ALA 45 HB2 ALA 45 0.239 6.817 11.742 361 HB3 ALA 45 HB3 ALA 45 1.007 6.676 13.333 362 H GLN 46 H GLN 46 1.180 8.926 10.191 363 HA GLN 46 HA GLN 46 3.942 9.788 10.315 364 HB2 GLN 46 HB2 GLN 46 4.915 7.835 9.168 365 HB3 GLN 46 HB3 GLN 46 4.455 7.605 10.837 366 HG2 GLN 46 HG2 GLN 46 2.245 6.551 9.784 367 HG3 GLN 46 HG3 GLN 46 3.269 6.413 8.345 368 HE21 GLN 46 HE22 GLN 46 3.161 5.724 11.881 369 HE22 GLN 46 HE21 GLN 46 4.256 4.360 11.812 370 H TRP 47 H TRP 47 4.941 9.625 7.982 371 HA TRP 47 HA TRP 47 2.906 10.287 5.890 372 HB2 TRP 47 HB2 TRP 47 5.389 11.904 6.592 373 HB3 TRP 47 HB3 TRP 47 4.262 12.236 5.294 374 HD1 TRP 47 HD1 TRP 47 2.127 13.603 5.861 375 HE1 TRP 47 HE1 TRP 47 1.221 14.786 7.960 376 HE3 TRP 47 HE3 TRP 47 5.395 11.729 9.331 377 HZ2 TRP 47 HZ2 TRP 47 1.614 14.614 10.782 378 HZ3 TRP 47 HZ3 TRP 47 5.033 12.187 11.749 379 HH2 TRP 47 HH2 TRP 47 3.111 13.591 12.486 380 H HIS 48 H HIS 48 3.261 8.916 4.191 381 HA HIS 48 HA HIS 48 6.055 8.016 3.633 382 HB2 HIS 48 HB2 HIS 48 3.499 6.756 2.644 383 HB3 HIS 48 HB3 HIS 48 5.126 6.132 2.503 384 HD1 HIS 48 HD1 HIS 48 6.244 5.369 5.027 385 HD2 HIS 48 HD2 HIS 48 2.082 5.852 4.600 386 HE1 HIS 48 HE1 HIS 48 5.172 4.062 6.935 387 H ASP 49 H ASP 49 7.006 8.652 1.874 388 HA ASP 49 HA ASP 49 5.495 10.012 -0.313 389 HB2 ASP 49 HB2 ASP 49 7.457 11.401 -0.664 390 HB3 ASP 49 HB3 ASP 49 6.770 11.632 0.932 391 H ARG 50 H ARG 50 5.255 8.594 -1.819 392 HA ARG 50 HA ARG 50 7.052 6.388 -2.417 393 HB2 ARG 50 HB2 ARG 50 4.855 7.598 -4.100 394 HB3 ARG 50 HB3 ARG 50 5.537 5.984 -4.250 395 HG2 ARG 50 HG2 ARG 50 3.867 7.051 -1.921 396 HG3 ARG 50 HG3 ARG 50 3.348 5.901 -3.115 397 HD2 ARG 50 HD2 ARG 50 5.479 5.437 -1.000 398 HD3 ARG 50 HD3 ARG 50 3.837 4.788 -1.025 399 HE ARG 50 HE ARG 50 5.307 4.020 -3.416 400 HH11 ARG 50 HH11 ARG 50 5.101 3.134 -0.038 401 HH12 ARG 50 HH12 ARG 50 5.734 1.535 -0.345 402 HH21 ARG 50 HH21 ARG 50 5.836 1.992 -3.778 403 HH22 ARG 50 HH22 ARG 50 6.220 0.914 -2.450 404 H GLY 51 H GLY 51 6.603 9.633 -3.736 405 HA2 GLY 51 HA2 GLY 51 8.310 10.930 -4.721 406 HA3 GLY 51 HA3 GLY 51 9.227 9.464 -5.064 407 H GLU 52 H GLU 52 7.222 7.955 -6.400 408 HA GLU 52 HA GLU 52 6.034 9.193 -8.647 409 HB2 GLU 52 HB2 GLU 52 7.632 8.643 -10.418 410 HB3 GLU 52 HB3 GLU 52 8.120 9.978 -9.412 411 HG2 GLU 52 HG2 GLU 52 9.638 8.359 -8.140 412 HG3 GLU 52 HG3 GLU 52 9.240 7.159 -9.367 413 H GLN 53 H GLN 53 4.472 7.649 -8.574 414 HA GLN 53 HA GLN 53 5.275 4.981 -9.671 415 HB2 GLN 53 HB2 GLN 53 3.067 5.635 -7.703 416 HB3 GLN 53 HB3 GLN 53 3.402 4.018 -8.377 417 HG2 GLN 53 HG2 GLN 53 5.734 4.172 -7.420 418 HG3 GLN 53 HG3 GLN 53 5.246 5.704 -6.638 419 HE21 GLN 53 HE22 GLN 53 2.682 5.115 -5.660 420 HE22 GLN 53 HE21 GLN 53 3.276 4.402 -4.232 421 H GLU 54 H GLU 54 3.536 3.839 -10.761 422 HA GLU 54 HA GLU 54 2.586 5.360 -12.969 423 HB2 GLU 54 HB2 GLU 54 1.601 3.176 -13.688 424 HB3 GLU 54 HB3 GLU 54 3.312 3.149 -13.301 425 HG2 GLU 54 HG2 GLU 54 2.723 2.143 -11.040 426 HG3 GLU 54 HG3 GLU 54 1.056 2.015 -11.597 427 H VAL 55 H VAL 55 1.111 6.880 -12.713 428 HA VAL 55 HA VAL 55 -1.318 6.445 -11.071 429 HB VAL 55 HB VAL 55 -0.552 8.975 -12.572 430 HG11 VAL 55 HG11 VAL 55 -2.920 8.778 -11.722 431 HG12 VAL 55 HG12 VAL 55 -2.263 8.534 -10.090 432 HG13 VAL 55 HG13 VAL 55 -1.996 10.065 -10.945 433 HG21 VAL 55 HG21 VAL 55 0.269 8.048 -9.797 434 HG22 VAL 55 HG22 VAL 55 1.291 8.674 -11.105 435 HG23 VAL 55 HG23 VAL 55 0.194 9.758 -10.239 436 H PHE 56 H PHE 56 -3.324 6.267 -11.838 437 HA PHE 56 HA PHE 56 -3.831 6.377 -14.791 438 HB2 PHE 56 HB2 PHE 56 -4.818 4.427 -12.695 439 HB3 PHE 56 HB3 PHE 56 -5.603 4.675 -14.250 440 HD1 PHE 56 HD1 PHE 56 -2.191 3.854 -12.829 441 HD2 PHE 56 HD2 PHE 56 -4.971 3.373 -16.094 442 HE1 PHE 56 HE1 PHE 56 -0.601 2.337 -13.963 443 HE2 PHE 56 HE2 PHE 56 -3.407 1.782 -17.179 444 HZ PHE 56 HZ PHE 56 -1.200 1.300 -16.141 445 H GLU 57 H GLU 57 -5.478 7.595 -15.446 446 HA GLU 57 HA GLU 57 -6.848 9.474 -13.818 447 HB2 GLU 57 HB2 GLU 57 -6.506 9.491 -16.338 448 HB3 GLU 57 HB3 GLU 57 -7.754 8.256 -16.466 449 HG2 GLU 57 HG2 GLU 57 -9.386 9.812 -15.396 450 HG3 GLU 57 HG3 GLU 57 -8.115 11.033 -15.260 451 H TYR 58 H TYR 58 -8.473 9.203 -12.376 452 HA TYR 58 HA TYR 58 -10.296 6.865 -12.646 453 HB2 TYR 58 HB2 TYR 58 -8.917 6.514 -10.767 454 HB3 TYR 58 HB3 TYR 58 -9.077 8.175 -10.212 455 HD1 TYR 58 HD1 TYR 58 -12.055 6.290 -11.404 456 HD2 TYR 58 HD2 TYR 58 -9.683 7.363 -7.953 457 HE1 TYR 58 HE1 TYR 58 -13.851 5.516 -9.927 458 HE2 TYR 58 HE2 TYR 58 -11.547 6.623 -6.466 459 HH TYR 58 HH TYR 58 -14.608 5.338 -7.844 460 H CYS 59 H CYS 59 -11.590 8.023 -14.073 461 HA CYS 59 HA CYS 59 -13.028 10.417 -13.034 462 HB2 CYS 59 HB2 CYS 59 -12.083 10.362 -15.381 463 HB3 CYS 59 HB3 CYS 59 -13.202 9.037 -15.745 464 HG CYS 59 HG CYS 59 -15.398 10.436 -14.946 465 H LEU 60 H LEU 60 -15.100 10.336 -12.375 466 HA LEU 60 HA LEU 60 -16.567 7.727 -12.433 467 HB2 LEU 60 HB2 LEU 60 -16.301 9.976 -10.571 468 HB3 LEU 60 HB3 LEU 60 -17.975 9.687 -10.956 469 HG LEU 60 HG LEU 60 -17.955 7.476 -10.124 470 HD11 LEU 60 HD11 LEU 60 -15.805 6.589 -10.814 471 HD12 LEU 60 HD12 LEU 60 -14.959 7.765 -9.777 472 HD13 LEU 60 HD13 LEU 60 -15.959 6.465 -9.064 473 HD21 LEU 60 HD21 LEU 60 -16.251 9.158 -8.250 474 HD22 LEU 60 HD22 LEU 60 -17.991 9.400 -8.482 475 HD23 LEU 60 HD23 LEU 60 -17.390 7.864 -7.815 476 H GLU 61 H GLU 61 -18.834 7.733 -12.802 477 HA GLU 61 HA GLU 61 -19.460 8.990 -15.328 478 HB2 GLU 61 HB2 GLU 61 -21.556 7.787 -15.222 479 HB3 GLU 61 HB3 GLU 61 -20.213 6.729 -14.831 480 HG2 GLU 61 HG2 GLU 61 -20.967 6.236 -12.821 481 HG3 GLU 61 HG3 GLU 61 -21.333 7.904 -12.405 482 H ASP 62 H ASP 62 -20.018 10.054 -12.093 483 HA ASP 62 HA ASP 62 -22.206 11.913 -12.717 484 HB2 ASP 62 HB2 ASP 62 -21.983 10.982 -10.500 485 HB3 ASP 62 HB3 ASP 62 -20.337 11.614 -10.336 486 H GLY 63 H GLY 63 -18.709 11.969 -12.903 487 HA2 GLY 63 HA2 GLY 63 -17.677 13.692 -14.279 488 HA3 GLY 63 HA3 GLY 63 -18.718 14.903 -13.533 489 H SER 64 H SER 64 -17.688 12.854 -11.038 490 HA SER 64 HA SER 64 -15.667 14.655 -10.004 491 HB2 SER 64 HB2 SER 64 -16.202 11.756 -9.244 492 HB3 SER 64 HB3 SER 64 -15.287 12.937 -8.303 493 HG SER 64 HG SER 64 -17.151 14.029 -7.852 494 H LEU 65 H LEU 65 -13.509 14.678 -10.350 495 HA LEU 65 HA LEU 65 -12.212 12.482 -11.934 496 HB2 LEU 65 HB2 LEU 65 -11.934 15.489 -11.940 497 HB3 LEU 65 HB3 LEU 65 -10.530 14.505 -12.297 498 HG LEU 65 HG LEU 65 -11.578 15.359 -14.299 499 HD11 LEU 65 HD11 LEU 65 -10.291 13.303 -14.446 500 HD12 LEU 65 HD12 LEU 65 -11.735 12.335 -14.080 501 HD13 LEU 65 HD13 LEU 65 -11.647 13.270 -15.585 502 HD21 LEU 65 HD21 LEU 65 -13.961 13.590 -13.679 503 HD22 LEU 65 HD22 LEU 65 -13.923 15.367 -13.592 504 HD23 LEU 65 HD23 LEU 65 -13.694 14.550 -15.145 505 H ILE 66 H ILE 66 -10.593 11.444 -11.040 506 HA ILE 66 HA ILE 66 -9.112 12.492 -8.685 507 HB ILE 66 HB ILE 66 -10.252 9.669 -8.894 508 HG12 ILE 66 HG12 ILE 66 -11.310 11.850 -7.053 509 HG13 ILE 66 HG13 ILE 66 -12.091 11.400 -8.568 510 HG21 ILE 66 HG21 ILE 66 -8.257 9.726 -7.510 511 HG22 ILE 66 HG22 ILE 66 -8.821 11.189 -6.660 512 HG23 ILE 66 HG23 ILE 66 -9.614 9.628 -6.420 513 HD11 ILE 66 HD11 ILE 66 -12.567 9.175 -7.830 514 HD12 ILE 66 HD12 ILE 66 -11.771 9.465 -6.259 515 HD13 ILE 66 HD13 ILE 66 -13.224 10.364 -6.710 516 H ARG 67 H ARG 67 -7.022 11.464 -8.413 517 HA ARG 67 HA ARG 67 -5.951 9.878 -10.713 518 HB2 ARG 67 HB2 ARG 67 -4.809 12.506 -9.658 519 HB3 ARG 67 HB3 ARG 67 -3.910 11.353 -10.653 520 HG2 ARG 67 HG2 ARG 67 -5.689 11.540 -12.412 521 HG3 ARG 67 HG3 ARG 67 -6.445 12.840 -11.480 522 HD2 ARG 67 HD2 ARG 67 -4.609 14.290 -11.746 523 HD3 ARG 67 HD3 ARG 67 -3.511 12.984 -12.225 524 HE ARG 67 HE ARG 67 -5.502 13.027 -14.192 525 HH11 ARG 67 HH11 ARG 67 -3.040 15.236 -13.040 526 HH12 ARG 67 HH12 ARG 67 -2.766 15.920 -14.625 527 HH21 ARG 67 HH21 ARG 67 -5.157 13.995 -16.189 528 HH22 ARG 67 HH22 ARG 67 -3.938 15.227 -16.355 529 H ALA 68 H ALA 68 -5.282 8.060 -9.866 530 HA ALA 68 HA ALA 68 -3.574 8.018 -7.441 531 HB1 ALA 68 HB1 ALA 68 -5.983 7.798 -6.729 532 HB2 ALA 68 HB2 ALA 68 -6.113 6.344 -7.741 533 HB3 ALA 68 HB3 ALA 68 -4.992 6.367 -6.357 534 H THR 69 H THR 69 -2.697 5.737 -7.070 535 HA THR 69 HA THR 69 -1.940 4.575 -9.698 536 HB THR 69 HB THR 69 -0.321 3.248 -8.463 537 HG1 THR 69 HG1 THR 69 0.027 3.621 -6.321 538 HG21 THR 69 HG21 THR 69 -0.238 6.034 -8.887 539 HG22 THR 69 HG22 THR 69 0.455 5.781 -7.277 540 HG23 THR 69 HG23 THR 69 1.102 4.915 -8.700 541 H LYS 70 H LYS 70 -1.871 2.333 -10.018 542 HA LYS 70 HA LYS 70 -4.329 0.944 -9.372 543 HB2 LYS 70 HB2 LYS 70 -1.783 0.194 -10.842 544 HB3 LYS 70 HB3 LYS 70 -3.054 -0.997 -10.529 545 HG2 LYS 70 HG2 LYS 70 -4.711 0.283 -11.736 546 HG3 LYS 70 HG3 LYS 70 -3.616 1.652 -11.884 547 HD2 LYS 70 HD2 LYS 70 -3.661 0.603 -13.973 548 HD3 LYS 70 HD3 LYS 70 -2.077 0.251 -13.285 549 HE2 LYS 70 HE2 LYS 70 -4.400 -1.705 -13.241 550 HE3 LYS 70 HE3 LYS 70 -3.288 -1.576 -14.596 551 HZ1 LYS 70 HZ1 LYS 70 -1.441 -2.090 -13.073 552 HZ2 LYS 70 HZ2 LYS 70 -2.495 -2.382 -11.850 553 HZ3 LYS 70 HZ3 LYS 70 -2.516 -3.310 -13.189 554 H ASP 71 H ASP 71 -1.702 1.373 -7.405 555 HA ASP 71 HA ASP 71 -2.046 -1.258 -6.019 556 HB2 ASP 71 HB2 ASP 71 0.077 0.895 -5.776 557 HB3 ASP 71 HB3 ASP 71 -0.005 -0.581 -4.802 558 H HIS 72 H HIS 72 -3.139 2.030 -5.814 559 HA HIS 72 HA HIS 72 -3.397 1.972 -2.883 560 HB2 HIS 72 HB2 HIS 72 -3.168 4.099 -4.295 561 HB3 HIS 72 HB3 HIS 72 -4.830 3.854 -4.793 562 HD1 HIS 72 HD1 HIS 72 -6.298 3.278 -2.006 563 HD2 HIS 72 HD2 HIS 72 -3.075 5.909 -2.512 564 HE1 HIS 72 HE1 HIS 72 -6.291 4.812 0.000 565 H LYS 73 H LYS 73 -4.937 0.790 -1.916 566 HA LYS 73 HA LYS 73 -7.233 -0.309 -3.412 567 HB2 LYS 73 HB2 LYS 73 -6.320 -0.553 -0.537 568 HB3 LYS 73 HB3 LYS 73 -7.716 -1.406 -1.187 569 HG2 LYS 73 HG2 LYS 73 -6.375 -2.843 -2.498 570 HG3 LYS 73 HG3 LYS 73 -5.015 -1.720 -2.527 571 HD2 LYS 73 HD2 LYS 73 -4.811 -2.114 0.012 572 HD3 LYS 73 HD3 LYS 73 -5.896 -3.502 -0.231 573 HE2 LYS 73 HE2 LYS 73 -4.317 -4.445 -1.882 574 HE3 LYS 73 HE3 LYS 73 -3.313 -2.986 -1.778 575 HZ1 LYS 73 HZ1 LYS 73 -2.866 -3.534 0.555 576 HZ2 LYS 73 HZ2 LYS 73 -3.775 -4.893 0.460 577 HZ3 LYS 73 HZ3 LYS 73 -2.397 -4.766 -0.408 578 H PHE 74 H PHE 74 -9.413 0.120 -2.929 579 HA PHE 74 HA PHE 74 -9.965 2.576 -1.285 580 HB2 PHE 74 HB2 PHE 74 -10.914 1.955 -4.088 581 HB3 PHE 74 HB3 PHE 74 -11.661 3.141 -3.019 582 HD1 PHE 74 HD1 PHE 74 -8.490 2.342 -4.826 583 HD2 PHE 74 HD2 PHE 74 -10.910 5.388 -2.955 584 HE1 PHE 74 HE1 PHE 74 -7.010 4.100 -5.758 585 HE2 PHE 74 HE2 PHE 74 -9.430 7.135 -3.893 586 HZ PHE 74 HZ PHE 74 -7.482 6.499 -5.288 587 H MET 75 H MET 75 -11.946 2.619 -0.227 588 HA MET 75 HA MET 75 -12.873 -0.033 0.473 589 HB2 MET 75 HB2 MET 75 -12.490 1.986 2.006 590 HB3 MET 75 HB3 MET 75 -14.060 2.571 1.465 591 HG2 MET 75 HG2 MET 75 -15.177 0.666 2.406 592 HG3 MET 75 HG3 MET 75 -13.682 -0.260 2.492 593 HE1 MET 75 HE1 MET 75 -14.375 3.463 5.013 594 HE2 MET 75 HE2 MET 75 -15.102 3.071 3.435 595 HE3 MET 75 HE3 MET 75 -15.818 2.443 4.938 596 H THR 76 H THR 76 -14.156 -1.077 -0.906 597 HA THR 76 HA THR 76 -15.990 0.199 -2.746 598 HB THR 76 HB THR 76 -16.844 -2.043 -3.214 599 HG1 THR 76 HG1 THR 76 -15.800 -3.775 -2.152 600 HG21 THR 76 HG21 THR 76 -14.749 -1.176 -4.250 601 HG22 THR 76 HG22 THR 76 -13.816 -2.064 -3.022 602 HG23 THR 76 HG23 THR 76 -14.852 -2.944 -4.177 603 H VAL 77 H VAL 77 -18.354 -0.331 -2.832 604 HA VAL 77 HA VAL 77 -19.730 0.579 -0.580 605 HB VAL 77 HB VAL 77 -21.805 -0.326 -1.632 606 HG11 VAL 77 HG11 VAL 77 -20.888 1.866 -2.214 607 HG12 VAL 77 HG12 VAL 77 -19.907 1.136 -3.488 608 HG13 VAL 77 HG13 VAL 77 -21.677 1.091 -3.606 609 HG21 VAL 77 HG21 VAL 77 -19.909 -1.447 -3.750 610 HG22 VAL 77 HG22 VAL 77 -20.930 -2.395 -2.648 611 HG23 VAL 77 HG23 VAL 77 -21.674 -1.353 -3.867 612 H ASP 78 H ASP 78 -18.703 -2.700 -1.163 613 HA ASP 78 HA ASP 78 -20.397 -3.858 0.953 614 HB2 ASP 78 HB2 ASP 78 -18.103 -4.986 -0.693 615 HB3 ASP 78 HB3 ASP 78 -19.099 -5.918 0.425 616 H GLY 79 H GLY 79 -17.424 -2.140 0.902 617 HA2 GLY 79 HA2 GLY 79 -16.147 -1.526 2.757 618 HA3 GLY 79 HA3 GLY 79 -16.846 -2.828 3.720 619 H GLN 80 H GLN 80 -15.366 -3.309 0.497 620 HA GLN 80 HA GLN 80 -13.231 -4.997 1.740 621 HB2 GLN 80 HB2 GLN 80 -14.083 -4.830 -1.176 622 HB3 GLN 80 HB3 GLN 80 -12.973 -5.987 -0.440 623 HG2 GLN 80 HG2 GLN 80 -14.928 -6.788 0.997 624 HG3 GLN 80 HG3 GLN 80 -15.981 -5.788 -0.008 625 HE21 GLN 80 HE22 GLN 80 -16.542 -6.569 -2.143 626 HE22 GLN 80 HE21 GLN 80 -15.966 -8.125 -2.717 627 H MET 81 H MET 81 -11.058 -4.640 1.276 628 HA MET 81 HA MET 81 -10.313 -2.010 0.065 629 HB2 MET 81 HB2 MET 81 -8.682 -3.863 1.861 630 HB3 MET 81 HB3 MET 81 -8.145 -2.332 1.160 631 HG2 MET 81 HG2 MET 81 -8.751 -1.649 3.256 632 HG3 MET 81 HG3 MET 81 -10.221 -1.303 2.347 633 HE1 MET 81 HE1 MET 81 -11.598 -1.050 4.501 634 HE2 MET 81 HE2 MET 81 -12.483 -1.945 3.239 635 HE3 MET 81 HE3 MET 81 -12.585 -2.464 4.934 636 H LEU 82 H LEU 82 -10.470 -2.536 -2.105 637 HA LEU 82 HA LEU 82 -8.532 -4.575 -3.134 638 HB2 LEU 82 HB2 LEU 82 -11.097 -3.729 -4.501 639 HB3 LEU 82 HB3 LEU 82 -10.045 -5.064 -4.932 640 HG LEU 82 HG LEU 82 -11.758 -4.913 -2.415 641 HD11 LEU 82 HD11 LEU 82 -13.105 -5.141 -4.437 642 HD12 LEU 82 HD12 LEU 82 -12.104 -6.501 -4.982 643 HD13 LEU 82 HD13 LEU 82 -13.106 -6.662 -3.521 644 HD21 LEU 82 HD21 LEU 82 -10.324 -7.362 -3.513 645 HD22 LEU 82 HD22 LEU 82 -9.649 -6.357 -2.219 646 HD23 LEU 82 HD23 LEU 82 -11.186 -7.183 -1.967 647 HA PRO 83 HA PRO 83 -6.633 -1.197 -5.304 648 HB2 PRO 83 HB2 PRO 83 -5.524 -2.474 -7.467 649 HB3 PRO 83 HB3 PRO 83 -4.879 -2.609 -5.798 650 HG2 PRO 83 HG2 PRO 83 -6.736 -4.502 -7.274 651 HG3 PRO 83 HG3 PRO 83 -5.256 -4.904 -6.335 652 HD2 PRO 83 HD2 PRO 83 -7.744 -5.132 -5.275 653 HD3 PRO 83 HD3 PRO 83 -6.375 -4.548 -4.281 654 H ILE 84 H ILE 84 -7.087 0.256 -6.948 655 HA ILE 84 HA ILE 84 -9.609 0.154 -8.160 656 HB ILE 84 HB ILE 84 -8.368 2.187 -7.627 657 HG12 ILE 84 HG12 ILE 84 -9.060 2.235 -10.584 658 HG13 ILE 84 HG13 ILE 84 -10.279 1.925 -9.338 659 HG21 ILE 84 HG21 ILE 84 -6.142 1.584 -8.408 660 HG22 ILE 84 HG22 ILE 84 -6.696 1.556 -10.101 661 HG23 ILE 84 HG23 ILE 84 -6.662 3.079 -9.186 662 HD11 ILE 84 HD11 ILE 84 -9.944 4.023 -8.295 663 HD12 ILE 84 HD12 ILE 84 -8.569 4.421 -9.364 664 HD13 ILE 84 HD13 ILE 84 -10.203 4.264 -10.034 665 H ASP 85 H ASP 85 -6.627 -1.115 -9.461 666 HA ASP 85 HA ASP 85 -7.314 -1.608 -12.170 667 HB2 ASP 85 HB2 ASP 85 -5.106 -2.019 -11.174 668 HB3 ASP 85 HB3 ASP 85 -5.777 -3.257 -10.122 669 H GLU 86 H GLU 86 -8.330 -3.282 -9.198 670 HA GLU 86 HA GLU 86 -9.698 -5.444 -10.706 671 HB2 GLU 86 HB2 GLU 86 -8.456 -5.934 -8.628 672 HB3 GLU 86 HB3 GLU 86 -9.597 -4.945 -7.706 673 HG2 GLU 86 HG2 GLU 86 -11.411 -6.422 -8.154 674 HG3 GLU 86 HG3 GLU 86 -10.560 -7.221 -9.478 675 H ILE 87 H ILE 87 -10.505 -2.426 -8.950 676 HA ILE 87 HA ILE 87 -13.340 -2.877 -8.832 677 HB ILE 87 HB ILE 87 -11.759 -0.282 -8.932 678 HG12 ILE 87 HG12 ILE 87 -12.755 -1.920 -6.545 679 HG13 ILE 87 HG13 ILE 87 -11.083 -1.820 -7.071 680 HG21 ILE 87 HG21 ILE 87 -13.646 0.874 -8.132 681 HG22 ILE 87 HG22 ILE 87 -14.355 -0.186 -9.345 682 HG23 ILE 87 HG23 ILE 87 -14.480 -0.614 -7.633 683 HD11 ILE 87 HD11 ILE 87 -11.026 0.594 -6.573 684 HD12 ILE 87 HD12 ILE 87 -12.712 0.491 -6.027 685 HD13 ILE 87 HD13 ILE 87 -11.447 -0.384 -5.153 686 H PHE 88 H PHE 88 -11.243 -1.405 -11.333 687 HA PHE 88 HA PHE 88 -13.342 -0.658 -13.133 688 HB2 PHE 88 HB2 PHE 88 -10.972 0.141 -13.224 689 HB3 PHE 88 HB3 PHE 88 -10.476 -1.451 -13.769 690 HD1 PHE 88 HD1 PHE 88 -12.629 1.509 -14.679 691 HD2 PHE 88 HD2 PHE 88 -10.667 -2.071 -16.070 692 HE1 PHE 88 HE1 PHE 88 -13.084 2.174 -17.018 693 HE2 PHE 88 HE2 PHE 88 -11.116 -1.394 -18.423 694 HZ PHE 88 HZ PHE 88 -12.324 0.730 -18.897 695 H GLU 89 H GLU 89 -11.743 -3.820 -12.682 696 HA GLU 89 HA GLU 89 -12.973 -4.995 -15.086 697 HB2 GLU 89 HB2 GLU 89 -11.440 -6.133 -12.706 698 HB3 GLU 89 HB3 GLU 89 -12.315 -7.176 -13.820 699 HG2 GLU 89 HG2 GLU 89 -11.003 -5.944 -15.711 700 HG3 GLU 89 HG3 GLU 89 -9.944 -5.373 -14.418 701 H ARG 90 H ARG 90 -13.626 -5.127 -11.561 702 HA ARG 90 HA ARG 90 -15.967 -6.847 -11.949 703 HB2 ARG 90 HB2 ARG 90 -15.148 -5.253 -9.489 704 HB3 ARG 90 HB3 ARG 90 -16.313 -6.576 -9.558 705 HG2 ARG 90 HG2 ARG 90 -13.309 -6.707 -9.728 706 HG3 ARG 90 HG3 ARG 90 -14.387 -7.514 -8.611 707 HD2 ARG 90 HD2 ARG 90 -13.985 -8.161 -11.561 708 HD3 ARG 90 HD3 ARG 90 -13.387 -9.075 -10.169 709 HE ARG 90 HE ARG 90 -16.294 -8.731 -10.220 710 HH11 ARG 90 HH11 ARG 90 -13.744 -10.809 -11.433 711 HH12 ARG 90 HH12 ARG 90 -14.801 -12.197 -11.532 712 HH21 ARG 90 HH21 ARG 90 -17.567 -10.554 -10.314 713 HH22 ARG 90 HH22 ARG 90 -16.904 -12.047 -10.924 714 H GLU 91 H GLU 91 -15.505 -3.492 -12.301 715 HA GLU 91 HA GLU 91 -16.858 -1.721 -12.567 716 HB2 GLU 91 HB2 GLU 91 -19.153 -3.623 -13.158 717 HB3 GLU 91 HB3 GLU 91 -18.974 -1.940 -13.651 718 HG2 GLU 91 HG2 GLU 91 -16.935 -2.634 -15.007 719 HG3 GLU 91 HG3 GLU 91 -17.321 -4.310 -14.618 720 H LEU 92 H LEU 92 -16.444 -2.720 -9.960 721 HA LEU 92 HA LEU 92 -18.943 -2.430 -8.419 722 HB2 LEU 92 HB2 LEU 92 -16.020 -2.851 -7.682 723 HB3 LEU 92 HB3 LEU 92 -17.259 -2.569 -6.463 724 HG LEU 92 HG LEU 92 -17.420 -4.850 -8.469 725 HD11 LEU 92 HD11 LEU 92 -15.415 -5.095 -7.032 726 HD12 LEU 92 HD12 LEU 92 -16.433 -4.905 -5.587 727 HD13 LEU 92 HD13 LEU 92 -16.643 -6.311 -6.658 728 HD21 LEU 92 HD21 LEU 92 -18.886 -4.334 -5.846 729 HD22 LEU 92 HD22 LEU 92 -19.596 -4.276 -7.474 730 HD23 LEU 92 HD23 LEU 92 -19.013 -5.807 -6.827 731 H ASP 93 H ASP 93 -19.403 -0.811 -6.961 732 HA ASP 93 HA ASP 93 -18.267 1.852 -7.601 733 HB2 ASP 93 HB2 ASP 93 -20.501 1.319 -5.659 734 HB3 ASP 93 HB3 ASP 93 -20.185 2.754 -6.611 735 H LEU 94 H LEU 94 -17.505 3.295 -5.953 736 HA LEU 94 HA LEU 94 -16.428 2.062 -3.479 737 HB2 LEU 94 HB2 LEU 94 -16.275 4.900 -4.578 738 HB3 LEU 94 HB3 LEU 94 -15.592 4.385 -3.038 739 HG LEU 94 HG LEU 94 -14.705 3.570 -5.812 740 HD11 LEU 94 HD11 LEU 94 -13.848 5.677 -4.740 741 HD12 LEU 94 HD12 LEU 94 -13.263 4.725 -3.372 742 HD13 LEU 94 HD13 LEU 94 -12.574 4.476 -4.999 743 HD21 LEU 94 HD21 LEU 94 -13.933 2.274 -3.169 744 HD22 LEU 94 HD22 LEU 94 -14.648 1.476 -4.598 745 HD23 LEU 94 HD23 LEU 94 -13.025 2.133 -4.686 746 H MET 95 H MET 95 -16.745 2.925 -1.396 747 HA MET 95 HA MET 95 -19.516 3.793 -0.813 748 HB2 MET 95 HB2 MET 95 -18.304 1.948 0.404 749 HB3 MET 95 HB3 MET 95 -17.207 3.147 1.081 750 HG2 MET 95 HG2 MET 95 -18.838 4.002 2.497 751 HG3 MET 95 HG3 MET 95 -20.157 3.624 1.389 752 HE1 MET 95 HE1 MET 95 -17.457 0.906 2.487 753 HE2 MET 95 HE2 MET 95 -17.571 2.007 3.882 754 HE3 MET 95 HE3 MET 95 -18.177 0.341 4.007 755 H ARG 96 H ARG 96 -19.916 5.671 0.536 756 HA ARG 96 HA ARG 96 -17.815 7.774 0.615 757 HB2 ARG 96 HB2 ARG 96 -20.652 8.408 -0.264 758 HB3 ARG 96 HB3 ARG 96 -19.256 9.477 -0.228 759 HG2 ARG 96 HG2 ARG 96 -19.228 9.063 -2.462 760 HG3 ARG 96 HG3 ARG 96 -18.275 7.672 -1.969 761 HD2 ARG 96 HD2 ARG 96 -20.670 6.504 -1.747 762 HD3 ARG 96 HD3 ARG 96 -21.209 7.809 -2.790 763 HE ARG 96 HE ARG 96 -19.606 5.494 -3.471 764 HH11 ARG 96 HH11 ARG 96 -20.290 8.734 -4.611 765 HH12 ARG 96 HH12 ARG 96 -19.706 8.395 -6.207 766 HH21 ARG 96 HH21 ARG 96 -18.855 5.116 -5.413 767 HH22 ARG 96 HH22 ARG 96 -18.808 6.335 -6.654 768 H VAL 97 H VAL 97 -18.362 9.579 2.042 769 HA VAL 97 HA VAL 97 -19.780 8.674 4.491 770 HB VAL 97 HB VAL 97 -18.823 10.658 5.560 771 HG11 VAL 97 HG11 VAL 97 -17.678 8.415 5.548 772 HG12 VAL 97 HG12 VAL 97 -16.661 9.014 4.216 773 HG13 VAL 97 HG13 VAL 97 -16.602 9.802 5.801 774 HG21 VAL 97 HG21 VAL 97 -17.021 11.094 3.192 775 HG22 VAL 97 HG22 VAL 97 -18.497 12.054 3.440 776 HG23 VAL 97 HG23 VAL 97 -17.206 12.069 4.649 777 H ASP 98 H ASP 98 -20.449 10.848 1.875 778 HA ASP 98 HA ASP 98 -22.391 12.426 3.475 779 HB2 ASP 98 HB2 ASP 98 -20.905 12.802 0.883 780 HB3 ASP 98 HB3 ASP 98 -22.424 13.650 1.097 781 H ASN 99 H ASN 99 -22.826 9.556 2.425 782 HA ASN 99 HA ASN 99 -24.402 8.247 1.467 783 HB2 ASN 99 HB2 ASN 99 -26.196 10.459 2.528 784 HB3 ASN 99 HB3 ASN 99 -26.826 8.985 1.776 785 HD21 ASN 99 HD22 ASN 99 -24.483 10.007 4.219 786 HD22 ASN 99 HD21 ASN 99 -24.200 8.398 4.715 787 H LEU 100 H LEU 100 -22.911 9.784 -0.125 788 HA LEU 100 HA LEU 100 -24.339 10.801 -2.442 789 HB2 LEU 100 HB2 LEU 100 -21.515 9.870 -1.928 790 HB3 LEU 100 HB3 LEU 100 -22.001 10.223 -3.569 791 HG LEU 100 HG LEU 100 -22.087 12.210 -1.259 792 HD11 LEU 100 HD11 LEU 100 -19.792 11.610 -1.894 793 HD12 LEU 100 HD12 LEU 100 -20.166 11.877 -3.613 794 HD13 LEU 100 HD13 LEU 100 -20.172 13.237 -2.475 795 HD21 LEU 100 HD21 LEU 100 -22.501 12.626 -4.258 796 HD22 LEU 100 HD22 LEU 100 -23.752 12.793 -3.002 797 HD23 LEU 100 HD23 LEU 100 -22.389 13.908 -3.037 798 HA PRO 101 HA PRO 101 -25.717 7.181 -4.493 799 HB2 PRO 101 HB2 PRO 101 -25.462 7.791 -7.164 800 HB3 PRO 101 HB3 PRO 101 -26.655 8.572 -6.081 801 HG2 PRO 101 HG2 PRO 101 -23.930 9.612 -6.911 802 HG3 PRO 101 HG3 PRO 101 -25.494 10.489 -6.895 803 HD2 PRO 101 HD2 PRO 101 -23.691 10.704 -4.868 804 HD3 PRO 101 HD3 PRO 101 -25.440 10.713 -4.535 805 H ASN 102 H ASN 102 -24.992 5.205 -5.318 806 HA ASN 102 HA ASN 102 -22.091 4.820 -5.278 807 HB2 ASN 102 HB2 ASN 102 -24.320 2.805 -5.771 808 HB3 ASN 102 HB3 ASN 102 -22.643 2.447 -5.371 809 HD21 ASN 102 HD22 ASN 102 -21.962 3.900 -3.197 810 HD22 ASN 102 HD21 ASN 102 -23.132 3.674 -1.910 811 H ILE 103 H ILE 103 -20.839 5.083 -6.971 812 HA ILE 103 HA ILE 103 -21.649 4.333 -9.737 813 HB ILE 103 HB ILE 103 -20.631 6.489 -10.526 814 HG12 ILE 103 HG12 ILE 103 -21.177 7.410 -7.675 815 HG13 ILE 103 HG13 ILE 103 -19.590 7.238 -8.423 816 HG21 ILE 103 HG21 ILE 103 -23.081 5.891 -10.535 817 HG22 ILE 103 HG22 ILE 103 -23.254 6.763 -8.996 818 HG23 ILE 103 HG23 ILE 103 -22.775 7.626 -10.467 819 HD11 ILE 103 HD11 ILE 103 -20.234 8.994 -10.084 820 HD12 ILE 103 HD12 ILE 103 -21.769 9.198 -9.189 821 HD13 ILE 103 HD13 ILE 103 -20.243 9.570 -8.400 822 H LYS 104 H LYS 104 -20.175 3.348 -10.812 823 HA LYS 104 HA LYS 104 -17.465 2.973 -9.722 824 HB2 LYS 104 HB2 LYS 104 -17.341 1.070 -11.181 825 HB3 LYS 104 HB3 LYS 104 -18.850 1.069 -10.309 826 HG2 LYS 104 HG2 LYS 104 -19.486 0.339 -12.371 827 HG3 LYS 104 HG3 LYS 104 -19.944 2.036 -12.458 828 HD2 LYS 104 HD2 LYS 104 -18.081 2.546 -13.884 829 HD3 LYS 104 HD3 LYS 104 -17.269 1.009 -13.495 830 HE2 LYS 104 HE2 LYS 104 -19.432 -0.066 -14.560 831 HE3 LYS 104 HE3 LYS 104 -19.653 1.524 -15.293 832 HZ1 LYS 104 HZ1 LYS 104 -17.440 1.291 -16.303 833 HZ2 LYS 104 HZ2 LYS 104 -17.207 -0.158 -15.574 834 HZ3 LYS 104 HZ3 LYS 104 -18.366 -0.010 -16.702 835 H ILE 105 H ILE 105 -15.754 2.610 -11.489 836 HA ILE 105 HA ILE 105 -14.984 5.188 -12.475 837 HB ILE 105 HB ILE 105 -13.935 2.456 -13.281 838 HG12 ILE 105 HG12 ILE 105 -12.530 4.015 -11.148 839 HG13 ILE 105 HG13 ILE 105 -13.925 3.047 -10.678 840 HG21 ILE 105 HG21 ILE 105 -12.791 5.268 -13.488 841 HG22 ILE 105 HG22 ILE 105 -11.732 3.849 -13.524 842 HG23 ILE 105 HG23 ILE 105 -12.974 4.049 -14.763 843 HD11 ILE 105 HD11 ILE 105 -12.799 1.111 -11.883 844 HD12 ILE 105 HD12 ILE 105 -11.328 2.129 -11.906 845 HD13 ILE 105 HD13 ILE 105 -12.100 1.656 -10.370 846 H ALA 106 H ALA 106 -15.757 6.183 -14.198 847 HA ALA 106 HA ALA 106 -17.472 4.864 -16.185 848 HB1 ALA 106 HB1 ALA 106 -18.057 7.051 -15.409 849 HB2 ALA 106 HB2 ALA 106 -16.463 7.725 -15.824 850 HB3 ALA 106 HB3 ALA 106 -17.583 7.214 -17.106 851 H THR 107 H THR 107 -14.300 6.440 -16.144 852 HA THR 107 HA THR 107 -13.357 4.934 -18.497 853 HB THR 107 HB THR 107 -12.325 7.161 -19.343 854 HG1 THR 107 HG1 THR 107 -13.700 8.948 -18.975 855 HG21 THR 107 HG21 THR 107 -14.071 5.872 -20.561 856 HG22 THR 107 HG22 THR 107 -15.323 6.814 -19.720 857 HG23 THR 107 HG23 THR 107 -14.178 7.620 -20.816 858 H ARG 108 H ARG 108 -11.184 4.733 -18.612 859 HA ARG 108 HA ARG 108 -9.446 5.903 -16.511 860 HB2 ARG 108 HB2 ARG 108 -10.235 3.806 -15.558 861 HB3 ARG 108 HB3 ARG 108 -9.829 2.921 -17.036 862 HG2 ARG 108 HG2 ARG 108 -7.452 3.307 -16.688 863 HG3 ARG 108 HG3 ARG 108 -7.769 4.370 -15.313 864 HD2 ARG 108 HD2 ARG 108 -7.962 2.673 -13.878 865 HD3 ARG 108 HD3 ARG 108 -9.028 1.739 -14.932 866 HE ARG 108 HE ARG 108 -6.145 1.459 -14.612 867 HH11 ARG 108 HH11 ARG 108 -8.762 0.766 -16.867 868 HH12 ARG 108 HH12 ARG 108 -7.807 -0.401 -17.738 869 HH21 ARG 108 HH21 ARG 108 -5.000 -0.036 -15.806 870 HH22 ARG 108 HH22 ARG 108 -5.774 -0.881 -17.115 871 H LYS 109 H LYS 109 -7.411 6.204 -17.106 872 HA LYS 109 HA LYS 109 -6.253 5.167 -19.615 873 HB2 LYS 109 HB2 LYS 109 -7.612 7.191 -20.268 874 HB3 LYS 109 HB3 LYS 109 -6.732 8.148 -19.091 875 HG2 LYS 109 HG2 LYS 109 -5.874 8.606 -21.294 876 HG3 LYS 109 HG3 LYS 109 -4.633 7.817 -20.345 877 HD2 LYS 109 HD2 LYS 109 -4.607 6.953 -22.618 878 HD3 LYS 109 HD3 LYS 109 -5.058 5.676 -21.507 879 HE2 LYS 109 HE2 LYS 109 -6.443 5.476 -23.445 880 HE3 LYS 109 HE3 LYS 109 -7.472 6.015 -22.120 881 HZ1 LYS 109 HZ1 LYS 109 -7.346 8.278 -23.039 882 HZ2 LYS 109 HZ2 LYS 109 -6.336 7.787 -24.232 883 HZ3 LYS 109 HZ3 LYS 109 -7.876 7.252 -24.191 884 H TYR 110 H TYR 110 -4.101 4.802 -19.253 885 HA TYR 110 HA TYR 110 -2.785 5.516 -16.816 886 HB2 TYR 110 HB2 TYR 110 -2.063 3.628 -18.244 887 HB3 TYR 110 HB3 TYR 110 -1.608 4.748 -19.516 888 HD1 TYR 110 HD1 TYR 110 -1.014 4.904 -15.783 889 HD2 TYR 110 HD2 TYR 110 0.757 4.610 -19.708 890 HE1 TYR 110 HE1 TYR 110 1.225 5.179 -14.799 891 HE2 TYR 110 HE2 TYR 110 3.019 4.783 -18.687 892 HH TYR 110 HH TYR 110 4.214 4.972 -16.742 893 H LEU 111 H LEU 111 -1.974 7.449 -16.161 894 HA LEU 111 HA LEU 111 -1.899 9.706 -18.094 895 HB2 LEU 111 HB2 LEU 111 -1.438 9.521 -15.086 896 HB3 LEU 111 HB3 LEU 111 -1.480 11.015 -16.020 897 HG LEU 111 HG LEU 111 -3.849 9.121 -15.894 898 HD11 LEU 111 HD11 LEU 111 -3.306 9.808 -13.649 899 HD12 LEU 111 HD12 LEU 111 -3.168 11.503 -14.152 900 HD13 LEU 111 HD13 LEU 111 -4.749 10.662 -14.206 901 HD21 LEU 111 HD21 LEU 111 -3.503 12.035 -16.721 902 HD22 LEU 111 HD22 LEU 111 -3.979 10.673 -17.761 903 HD23 LEU 111 HD23 LEU 111 -5.077 11.246 -16.500 904 H GLY 112 H GLY 112 0.274 7.854 -15.992 905 HA2 GLY 112 HA2 GLY 112 2.652 7.766 -17.075 906 HA3 GLY 112 HA3 GLY 112 2.620 9.509 -16.770 907 H LYS 113 H LYS 113 4.127 9.659 -15.219 908 HA LYS 113 HA LYS 113 3.925 7.960 -12.763 909 HB2 LYS 113 HB2 LYS 113 5.693 7.371 -14.637 910 HB3 LYS 113 HB3 LYS 113 6.601 8.678 -13.873 911 HG2 LYS 113 HG2 LYS 113 6.086 7.442 -11.624 912 HG3 LYS 113 HG3 LYS 113 5.595 6.087 -12.650 913 HD2 LYS 113 HD2 LYS 113 7.925 6.299 -13.771 914 HD3 LYS 113 HD3 LYS 113 8.322 7.442 -12.484 915 HE2 LYS 113 HE2 LYS 113 9.186 5.387 -11.734 916 HE3 LYS 113 HE3 LYS 113 7.704 5.614 -10.807 917 HZ1 LYS 113 HZ1 LYS 113 6.589 4.078 -12.373 918 HZ2 LYS 113 HZ2 LYS 113 7.969 3.906 -13.232 919 HZ3 LYS 113 HZ3 LYS 113 7.890 3.350 -11.702 920 H GLN 114 H GLN 114 2.838 9.727 -11.950 921 HA GLN 114 HA GLN 114 4.163 12.284 -11.525 922 HB2 GLN 114 HB2 GLN 114 1.463 11.556 -10.409 923 HB3 GLN 114 HB3 GLN 114 2.114 13.135 -10.899 924 HG2 GLN 114 HG2 GLN 114 2.434 12.104 -13.237 925 HG3 GLN 114 HG3 GLN 114 1.392 10.783 -12.671 926 HE21 GLN 114 HE22 GLN 114 0.557 11.543 -14.721 927 HE22 GLN 114 HE21 GLN 114 -0.521 12.895 -14.707 928 H ASN 115 H ASN 115 4.504 13.222 -9.377 929 HA ASN 115 HA ASN 115 5.404 11.516 -7.325 930 HB2 ASN 115 HB2 ASN 115 5.847 14.090 -7.941 931 HB3 ASN 115 HB3 ASN 115 4.535 14.359 -6.776 932 HD21 ASN 115 HD22 ASN 115 5.051 12.310 -4.877 933 HD22 ASN 115 HD21 ASN 115 6.718 12.430 -4.393 934 H VAL 116 H VAL 116 4.159 10.218 -6.102 935 HA VAL 116 HA VAL 116 1.503 11.253 -5.181 936 HB VAL 116 HB VAL 116 0.735 8.928 -5.136 937 HG11 VAL 116 HG11 VAL 116 0.262 10.382 -7.108 938 HG12 VAL 116 HG12 VAL 116 1.650 9.642 -7.927 939 HG13 VAL 116 HG13 VAL 116 0.264 8.646 -7.444 940 HG21 VAL 116 HG21 VAL 116 3.269 8.261 -6.709 941 HG22 VAL 116 HG22 VAL 116 2.938 7.781 -5.032 942 HG23 VAL 116 HG23 VAL 116 1.919 7.174 -6.339 943 H TYR 117 H TYR 117 0.771 10.605 -3.170 944 HA TYR 117 HA TYR 117 2.848 9.946 -1.133 945 HB2 TYR 117 HB2 TYR 117 0.874 12.225 -0.869 946 HB3 TYR 117 HB3 TYR 117 2.309 11.895 0.070 947 HD1 TYR 117 HD1 TYR 117 1.004 13.204 -3.123 948 HD2 TYR 117 HD2 TYR 117 4.514 12.721 -0.663 949 HE1 TYR 117 HE1 TYR 117 2.231 14.854 -4.534 950 HE2 TYR 117 HE2 TYR 117 5.703 14.435 -2.013 951 HH TYR 117 HH TYR 117 5.548 15.920 -3.746 952 H ASP 118 H ASP 118 1.962 9.354 0.948 953 HA ASP 118 HA ASP 118 -0.896 8.932 1.285 954 HB2 ASP 118 HB2 ASP 118 -0.813 6.556 1.617 955 HB3 ASP 118 HB3 ASP 118 -0.395 6.960 -0.033 956 H ILE 119 H ILE 119 -1.253 9.578 3.312 957 HA ILE 119 HA ILE 119 0.859 9.551 5.339 958 HB ILE 119 HB ILE 119 -0.853 10.348 6.861 959 HG12 ILE 119 HG12 ILE 119 -2.824 10.369 4.536 960 HG13 ILE 119 HG13 ILE 119 -2.803 9.117 5.780 961 HG21 ILE 119 HG21 ILE 119 0.483 11.861 5.421 962 HG22 ILE 119 HG22 ILE 119 -0.821 11.877 4.219 963 HG23 ILE 119 HG23 ILE 119 -1.086 12.556 5.843 964 HD11 ILE 119 HD11 ILE 119 -3.126 10.871 7.530 965 HD12 ILE 119 HD12 ILE 119 -3.355 12.064 6.224 966 HD13 ILE 119 HD13 ILE 119 -4.456 10.678 6.376 967 H GLY 120 H GLY 120 0.792 8.399 7.321 968 HA2 GLY 120 HA2 GLY 120 -0.651 5.772 7.250 969 HA3 GLY 120 HA3 GLY 120 0.858 6.069 8.102 970 H VAL 121 H VAL 121 -1.617 5.058 9.159 971 HA VAL 121 HA VAL 121 -2.230 6.965 11.359 972 HB VAL 121 HB VAL 121 -4.666 6.263 11.138 973 HG11 VAL 121 HG11 VAL 121 -4.172 8.527 10.716 974 HG12 VAL 121 HG12 VAL 121 -3.408 8.175 9.150 975 HG13 VAL 121 HG13 VAL 121 -5.158 7.997 9.348 976 HG21 VAL 121 HG21 VAL 121 -3.945 5.693 8.241 977 HG22 VAL 121 HG22 VAL 121 -4.345 4.453 9.459 978 HG23 VAL 121 HG23 VAL 121 -5.554 5.655 8.990 979 H GLU 122 H GLU 122 -3.234 5.870 13.237 980 HA GLU 122 HA GLU 122 -1.844 3.385 13.769 981 HB2 GLU 122 HB2 GLU 122 -3.892 4.983 15.356 982 HB3 GLU 122 HB3 GLU 122 -3.195 3.463 15.923 983 HG2 GLU 122 HG2 GLU 122 -0.889 4.489 15.600 984 HG3 GLU 122 HG3 GLU 122 -1.697 6.041 15.342 985 H ARG 123 H ARG 123 -5.270 4.081 13.074 986 HA ARG 123 HA ARG 123 -6.115 1.294 13.485 987 HB2 ARG 123 HB2 ARG 123 -7.432 3.810 13.378 988 HB3 ARG 123 HB3 ARG 123 -7.935 3.012 11.905 989 HG2 ARG 123 HG2 ARG 123 -9.540 2.254 13.441 990 HG3 ARG 123 HG3 ARG 123 -8.378 0.930 13.497 991 HD2 ARG 123 HD2 ARG 123 -7.288 2.148 15.481 992 HD3 ARG 123 HD3 ARG 123 -8.662 3.269 15.425 993 HE ARG 123 HE ARG 123 -9.411 0.433 15.584 994 HH11 ARG 123 HH11 ARG 123 -8.684 3.254 17.552 995 HH12 ARG 123 HH12 ARG 123 -9.459 2.571 18.960 996 HH21 ARG 123 HH21 ARG 123 -10.348 -0.373 17.419 997 HH22 ARG 123 HH22 ARG 123 -10.365 0.574 18.883 998 H ASP 124 H ASP 124 -7.745 0.755 11.323 999 HA ASP 124 HA ASP 124 -6.087 -0.280 9.244 1000 HB2 ASP 124 HB2 ASP 124 -9.000 0.623 9.221 1001 HB3 ASP 124 HB3 ASP 124 -8.214 -0.194 7.874 1002 H HIS 125 H HIS 125 -5.098 0.662 7.508 1003 HA HIS 125 HA HIS 125 -4.750 3.496 7.397 1004 HB2 HIS 125 HB2 HIS 125 -4.048 1.273 5.456 1005 HB3 HIS 125 HB3 HIS 125 -3.638 2.960 5.189 1006 HD1 HIS 125 HD1 HIS 125 -2.725 0.122 7.688 1007 HD2 HIS 125 HD2 HIS 125 -1.532 3.937 6.371 1008 HE1 HIS 125 HE1 HIS 125 -0.483 0.586 8.795 1009 H ASN 126 H ASN 126 -6.545 4.742 7.034 1010 HA ASN 126 HA ASN 126 -7.535 4.927 4.335 1011 HB2 ASN 126 HB2 ASN 126 -9.817 4.430 4.689 1012 HB3 ASN 126 HB3 ASN 126 -8.970 3.075 5.399 1013 HD21 ASN 126 HD22 ASN 126 -11.669 3.782 5.984 1014 HD22 ASN 126 HD21 ASN 126 -11.707 4.315 7.671 1015 H PHE 127 H PHE 127 -9.266 6.644 4.136 1016 HA PHE 127 HA PHE 127 -9.765 8.585 6.144 1017 HB2 PHE 127 HB2 PHE 127 -8.510 10.510 4.972 1018 HB3 PHE 127 HB3 PHE 127 -7.597 9.457 6.023 1019 HD1 PHE 127 HD1 PHE 127 -8.482 9.940 2.403 1020 HD2 PHE 127 HD2 PHE 127 -5.621 8.396 5.239 1021 HE1 PHE 127 HE1 PHE 127 -7.008 9.285 0.557 1022 HE2 PHE 127 HE2 PHE 127 -4.120 7.750 3.367 1023 HZ PHE 127 HZ PHE 127 -4.822 8.155 1.018 1024 H ALA 128 H ALA 128 -11.148 10.321 5.368 1025 HA ALA 128 HA ALA 128 -12.651 9.692 2.940 1026 HB1 ALA 128 HB1 ALA 128 -13.767 10.383 5.033 1027 HB2 ALA 128 HB2 ALA 128 -12.957 11.969 4.929 1028 HB3 ALA 128 HB3 ALA 128 -14.125 11.481 3.686 1029 H LEU 129 H LEU 129 -12.750 10.919 1.065 1030 HA LEU 129 HA LEU 129 -10.726 13.047 0.563 1031 HB2 LEU 129 HB2 LEU 129 -12.742 11.788 -1.335 1032 HB3 LEU 129 HB3 LEU 129 -11.425 12.873 -1.767 1033 HG LEU 129 HG LEU 129 -11.191 10.001 -0.810 1034 HD11 LEU 129 HD11 LEU 129 -11.707 10.546 -3.269 1035 HD12 LEU 129 HD12 LEU 129 -10.139 11.357 -3.333 1036 HD13 LEU 129 HD13 LEU 129 -10.226 9.616 -2.988 1037 HD21 LEU 129 HD21 LEU 129 -8.981 12.017 -1.252 1038 HD22 LEU 129 HD22 LEU 129 -9.372 11.136 0.248 1039 HD23 LEU 129 HD23 LEU 129 -8.740 10.256 -1.145 1040 H LYS 130 H LYS 130 -11.497 14.951 -0.781 1041 HA LYS 130 HA LYS 130 -13.204 16.697 0.523 1042 HB2 LYS 130 HB2 LYS 130 -11.647 17.437 -1.133 1043 HB3 LYS 130 HB3 LYS 130 -12.427 16.496 -2.416 1044 HG2 LYS 130 HG2 LYS 130 -14.379 17.976 -2.385 1045 HG3 LYS 130 HG3 LYS 130 -13.774 18.796 -0.958 1046 HD2 LYS 130 HD2 LYS 130 -13.359 20.270 -2.699 1047 HD3 LYS 130 HD3 LYS 130 -11.779 19.575 -2.387 1048 HE2 LYS 130 HE2 LYS 130 -13.630 18.414 -4.515 1049 HE3 LYS 130 HE3 LYS 130 -12.747 19.898 -4.847 1050 HZ1 LYS 130 HZ1 LYS 130 -10.699 18.829 -4.666 1051 HZ2 LYS 130 HZ2 LYS 130 -11.305 17.452 -3.998 1052 HZ3 LYS 130 HZ3 LYS 130 -11.607 17.804 -5.566 1053 H ASN 131 H ASN 131 -14.197 14.642 -2.204 1054 HA ASN 131 HA ASN 131 -16.956 15.639 -2.200 1055 HB2 ASN 131 HB2 ASN 131 -15.393 13.486 -3.636 1056 HB3 ASN 131 HB3 ASN 131 -17.153 13.410 -3.654 1057 HD21 ASN 131 HD22 ASN 131 -14.711 16.068 -4.076 1058 HD22 ASN 131 HD21 ASN 131 -15.484 16.664 -5.540 1059 H GLY 132 H GLY 132 -15.282 12.882 -0.757 1060 HA2 GLY 132 HA2 GLY 132 -16.402 12.294 1.428 1061 HA3 GLY 132 HA3 GLY 132 -17.831 11.877 0.471 1062 H PHE 133 H PHE 133 -15.370 10.827 -1.467 1063 HA PHE 133 HA PHE 133 -15.768 8.062 -1.079 1064 HB2 PHE 133 HB2 PHE 133 -13.280 9.435 -2.156 1065 HB3 PHE 133 HB3 PHE 133 -13.794 7.795 -2.512 1066 HD1 PHE 133 HD1 PHE 133 -15.989 7.435 -3.746 1067 HD2 PHE 133 HD2 PHE 133 -14.026 11.270 -3.524 1068 HE1 PHE 133 HE1 PHE 133 -17.321 8.247 -5.656 1069 HE2 PHE 133 HE2 PHE 133 -15.391 12.075 -5.444 1070 HZ PHE 133 HZ PHE 133 -17.087 10.592 -6.462 1071 H ILE 134 H ILE 134 -14.371 6.375 -0.225 1072 HA ILE 134 HA ILE 134 -12.359 7.318 1.778 1073 HB ILE 134 HB ILE 134 -14.041 4.824 2.098 1074 HG12 ILE 134 HG12 ILE 134 -14.740 6.139 4.257 1075 HG13 ILE 134 HG13 ILE 134 -14.263 7.584 3.365 1076 HG21 ILE 134 HG21 ILE 134 -11.826 4.524 3.032 1077 HG22 ILE 134 HG22 ILE 134 -11.852 6.151 3.764 1078 HG23 ILE 134 HG23 ILE 134 -12.901 4.878 4.380 1079 HD11 ILE 134 HD11 ILE 134 -15.968 7.129 1.686 1080 HD12 ILE 134 HD12 ILE 134 -16.292 5.520 2.375 1081 HD13 ILE 134 HD13 ILE 134 -16.719 6.985 3.273 1082 H ALA 135 H ALA 135 -10.456 7.017 1.094 1083 HA ALA 135 HA ALA 135 -9.754 4.737 -0.691 1084 HB1 ALA 135 HB1 ALA 135 -9.243 7.161 -1.309 1085 HB2 ALA 135 HB2 ALA 135 -8.074 7.164 0.027 1086 HB3 ALA 135 HB3 ALA 135 -7.880 6.045 -1.343 1087 H SER 136 H SER 136 -8.947 2.953 0.328 1088 HA SER 136 HA SER 136 -7.870 3.236 3.083 1089 HB2 SER 136 HB2 SER 136 -9.203 0.847 1.839 1090 HB3 SER 136 HB3 SER 136 -8.521 0.948 3.480 1091 HG SER 136 HG SER 136 -10.720 1.374 3.588 1092 H ASN 137 H ASN 137 -5.818 3.672 2.433 1093 HA ASN 137 HA ASN 137 -4.317 2.720 0.333 1094 HB2 ASN 137 HB2 ASN 137 -3.833 4.712 1.696 1095 HB3 ASN 137 HB3 ASN 137 -3.333 3.687 3.037 1096 HD21 ASN 137 HD22 ASN 137 -1.199 2.965 3.063 1097 HD22 ASN 137 HD21 ASN 137 -0.070 3.528 1.841 Start of MODEL 14 1 H1 GLY -1 H GLY -1 2.372 -1.997 -3.299 2 HA2 GLY -1 HA2 GLY -1 2.017 -0.272 -1.739 3 HA3 GLY -1 HA3 GLY -1 3.523 0.504 -2.255 4 H GLY 0 H GLY 0 0.673 1.494 -2.215 5 HA2 GLY 0 HA2 GLY 0 0.692 2.761 -4.875 6 HA3 GLY 0 HA3 GLY 0 -0.791 1.987 -4.325 7 H ALA 1 H ALA 1 -0.581 4.746 -4.853 8 HA ALA 1 HA ALA 1 -1.178 6.048 -2.268 9 HB1 ALA 1 HB1 ALA 1 1.210 6.081 -2.203 10 HB2 ALA 1 HB2 ALA 1 1.317 6.575 -3.904 11 HB3 ALA 1 HB3 ALA 1 0.705 7.696 -2.682 12 H LEU 2 H LEU 2 -1.316 8.549 -2.717 13 HA LEU 2 HA LEU 2 -3.195 8.892 -5.022 14 HB2 LEU 2 HB2 LEU 2 -3.059 10.340 -2.347 15 HB3 LEU 2 HB3 LEU 2 -4.249 10.571 -3.606 16 HG LEU 2 HG LEU 2 -5.326 9.384 -1.919 17 HD11 LEU 2 HD11 LEU 2 -5.813 8.553 -4.182 18 HD12 LEU 2 HD12 LEU 2 -4.611 7.258 -3.948 19 HD13 LEU 2 HD13 LEU 2 -6.052 7.331 -2.922 20 HD21 LEU 2 HD21 LEU 2 -3.270 7.207 -1.799 21 HD22 LEU 2 HD22 LEU 2 -3.282 8.617 -0.721 22 HD23 LEU 2 HD23 LEU 2 -4.657 7.503 -0.753 23 H SER 3 H SER 3 -3.173 10.857 -6.184 24 HA SER 3 HA SER 3 -0.622 12.118 -6.633 25 HB2 SER 3 HB2 SER 3 -2.420 11.876 -8.318 26 HB3 SER 3 HB3 SER 3 -3.402 13.054 -7.414 27 HG SER 3 HG SER 3 -2.116 13.913 -9.203 28 H TYR 4 H TYR 4 -0.204 14.420 -6.494 29 HA TYR 4 HA TYR 4 -0.338 15.554 -3.892 30 HB2 TYR 4 HB2 TYR 4 1.268 16.193 -5.629 31 HB3 TYR 4 HB3 TYR 4 -0.007 16.860 -6.626 32 HD1 TYR 4 HD1 TYR 4 2.050 17.361 -3.604 33 HD2 TYR 4 HD2 TYR 4 -1.079 19.006 -6.073 34 HE1 TYR 4 HE1 TYR 4 2.302 19.551 -2.455 35 HE2 TYR 4 HE2 TYR 4 -0.808 21.215 -4.941 36 HH TYR 4 HH TYR 4 1.634 21.721 -2.374 37 H GLU 5 H GLU 5 -2.398 16.166 -6.774 38 HA GLU 5 HA GLU 5 -3.953 18.289 -5.747 39 HB2 GLU 5 HB2 GLU 5 -3.674 17.966 -8.077 40 HB3 GLU 5 HB3 GLU 5 -4.043 16.252 -7.979 41 HG2 GLU 5 HG2 GLU 5 -5.773 17.313 -9.111 42 HG3 GLU 5 HG3 GLU 5 -6.367 16.668 -7.600 43 H THR 6 H THR 6 -4.149 14.885 -5.065 44 HA THR 6 HA THR 6 -6.962 14.572 -4.626 45 HB THR 6 HB THR 6 -4.690 13.129 -3.236 46 HG1 THR 6 HG1 THR 6 -6.126 12.509 -5.607 47 HG21 THR 6 HG21 THR 6 -7.325 12.904 -2.560 48 HG22 THR 6 HG22 THR 6 -7.263 11.743 -3.894 49 HG23 THR 6 HG23 THR 6 -6.175 11.572 -2.499 50 H GLU 7 H GLU 7 -8.072 16.005 -3.380 51 HA GLU 7 HA GLU 7 -6.877 17.106 -0.950 52 HB2 GLU 7 HB2 GLU 7 -9.709 17.533 -1.886 53 HB3 GLU 7 HB3 GLU 7 -8.775 18.507 -0.757 54 HG2 GLU 7 HG2 GLU 7 -7.147 18.968 -2.680 55 HG3 GLU 7 HG3 GLU 7 -8.367 18.269 -3.756 56 H ILE 8 H ILE 8 -7.177 16.474 1.054 57 HA ILE 8 HA ILE 8 -9.186 14.340 1.687 58 HB ILE 8 HB ILE 8 -6.579 14.961 3.121 59 HG12 ILE 8 HG12 ILE 8 -5.883 14.196 0.983 60 HG13 ILE 8 HG13 ILE 8 -5.666 12.882 2.127 61 HG21 ILE 8 HG21 ILE 8 -8.218 13.852 4.547 62 HG22 ILE 8 HG22 ILE 8 -8.497 12.598 3.328 63 HG23 ILE 8 HG23 ILE 8 -6.926 12.719 4.141 64 HD11 ILE 8 HD11 ILE 8 -7.861 11.898 1.247 65 HD12 ILE 8 HD12 ILE 8 -7.813 13.125 -0.022 66 HD13 ILE 8 HD13 ILE 8 -6.513 11.941 0.088 67 H LEU 9 H LEU 9 -10.786 14.978 2.965 68 HA LEU 9 HA LEU 9 -11.005 17.524 4.231 69 HB2 LEU 9 HB2 LEU 9 -12.915 16.059 3.660 70 HB3 LEU 9 HB3 LEU 9 -12.372 14.877 4.852 71 HG LEU 9 HG LEU 9 -12.687 16.681 6.631 72 HD11 LEU 9 HD11 LEU 9 -12.718 18.685 5.223 73 HD12 LEU 9 HD12 LEU 9 -14.208 18.105 4.428 74 HD13 LEU 9 HD13 LEU 9 -14.211 18.525 6.152 75 HD21 LEU 9 HD21 LEU 9 -15.148 15.856 5.023 76 HD22 LEU 9 HD22 LEU 9 -14.327 14.855 6.239 77 HD23 LEU 9 HD23 LEU 9 -15.129 16.352 6.733 78 H THR 10 H THR 10 -10.183 18.314 6.038 79 HA THR 10 HA THR 10 -9.155 16.531 8.200 80 HB THR 10 HB THR 10 -7.325 18.169 8.562 81 HG1 THR 10 HG1 THR 10 -8.121 19.171 6.037 82 HG21 THR 10 HG21 THR 10 -6.829 16.141 7.276 83 HG22 THR 10 HG22 THR 10 -7.284 16.960 5.771 84 HG23 THR 10 HG23 THR 10 -5.881 17.524 6.699 85 H VAL 11 H VAL 11 -9.299 17.287 10.312 86 HA VAL 11 HA VAL 11 -11.463 19.181 10.808 87 HB VAL 11 HB VAL 11 -9.563 17.909 12.800 88 HG11 VAL 11 HG11 VAL 11 -10.762 19.766 13.842 89 HG12 VAL 11 HG12 VAL 11 -12.309 19.166 13.194 90 HG13 VAL 11 HG13 VAL 11 -11.422 18.241 14.427 91 HG21 VAL 11 HG21 VAL 11 -12.328 16.986 11.903 92 HG22 VAL 11 HG22 VAL 11 -10.808 16.167 11.495 93 HG23 VAL 11 HG23 VAL 11 -11.344 16.238 13.175 94 H GLU 12 H GLU 12 -7.949 19.401 10.878 95 HA GLU 12 HA GLU 12 -7.720 21.871 12.317 96 HB2 GLU 12 HB2 GLU 12 -6.009 20.317 10.382 97 HB3 GLU 12 HB3 GLU 12 -5.511 21.952 10.822 98 HG2 GLU 12 HG2 GLU 12 -6.011 19.706 12.816 99 HG3 GLU 12 HG3 GLU 12 -4.434 20.214 12.214 100 H TYR 13 H TYR 13 -8.285 21.281 8.842 101 HA TYR 13 HA TYR 13 -8.611 24.237 8.453 102 HB2 TYR 13 HB2 TYR 13 -6.923 22.389 6.730 103 HB3 TYR 13 HB3 TYR 13 -7.300 24.071 6.378 104 HD1 TYR 13 HD2 TYR 13 -6.725 25.749 8.449 105 HD2 TYR 13 HD1 TYR 13 -4.740 22.025 7.518 106 HE1 TYR 13 HE2 TYR 13 -4.671 26.561 9.590 107 HE2 TYR 13 HE1 TYR 13 -2.680 22.848 8.652 108 HH TYR 13 HH TYR 13 -2.517 26.091 10.159 109 H GLY 14 H GLY 14 -9.179 20.996 6.919 110 HA2 GLY 14 HA2 GLY 14 -11.562 20.822 6.005 111 HA3 GLY 14 HA3 GLY 14 -11.197 22.303 5.126 112 H LEU 15 H LEU 15 -11.081 21.725 3.069 113 HA LEU 15 HA LEU 15 -10.177 19.093 2.176 114 HB2 LEU 15 HB2 LEU 15 -11.093 21.492 0.534 115 HB3 LEU 15 HB3 LEU 15 -11.037 19.798 0.051 116 HG LEU 15 HG LEU 15 -12.911 21.073 2.104 117 HD11 LEU 15 HD11 LEU 15 -13.449 21.643 -0.176 118 HD12 LEU 15 HD12 LEU 15 -13.367 19.945 -0.673 119 HD13 LEU 15 HD13 LEU 15 -14.643 20.488 0.447 120 HD21 LEU 15 HD21 LEU 15 -12.548 18.190 1.264 121 HD22 LEU 15 HD22 LEU 15 -12.490 18.864 2.887 122 HD23 LEU 15 HD23 LEU 15 -14.040 18.794 2.031 123 H LEU 16 H LEU 16 -7.930 19.018 2.482 124 HA LEU 16 HA LEU 16 -6.266 21.011 0.977 125 HB2 LEU 16 HB2 LEU 16 -5.943 19.813 3.729 126 HB3 LEU 16 HB3 LEU 16 -4.520 20.265 2.824 127 HG LEU 16 HG LEU 16 -5.113 21.973 4.402 128 HD11 LEU 16 HD11 LEU 16 -3.984 22.677 2.333 129 HD12 LEU 16 HD12 LEU 16 -5.564 23.004 1.573 130 HD13 LEU 16 HD13 LEU 16 -5.037 23.941 2.979 131 HD21 LEU 16 HD21 LEU 16 -7.655 22.517 2.842 132 HD22 LEU 16 HD22 LEU 16 -7.573 21.702 4.424 133 HD23 LEU 16 HD23 LEU 16 -7.047 23.388 4.239 134 HA PRO 17 HA PRO 17 -4.505 17.735 -1.378 135 HB2 PRO 17 HB2 PRO 17 -2.027 18.777 -2.017 136 HB3 PRO 17 HB3 PRO 17 -3.576 19.321 -2.736 137 HG2 PRO 17 HG2 PRO 17 -2.023 20.546 -0.454 138 HG3 PRO 17 HG3 PRO 17 -2.754 21.371 -1.865 139 HD2 PRO 17 HD2 PRO 17 -3.970 21.282 0.555 140 HD3 PRO 17 HD3 PRO 17 -4.923 21.169 -0.955 141 H ILE 18 H ILE 18 -3.803 15.819 -0.733 142 HA ILE 18 HA ILE 18 -2.443 15.276 1.669 143 HB ILE 18 HB ILE 18 -3.794 13.665 0.456 144 HG12 ILE 18 HG12 ILE 18 -0.984 12.572 0.852 145 HG13 ILE 18 HG13 ILE 18 -2.072 13.003 2.182 146 HG21 ILE 18 HG21 ILE 18 -2.945 14.160 -1.868 147 HG22 ILE 18 HG22 ILE 18 -1.495 13.211 -1.481 148 HG23 ILE 18 HG23 ILE 18 -3.096 12.457 -1.478 149 HD11 ILE 18 HD11 ILE 18 -3.733 11.337 1.311 150 HD12 ILE 18 HD12 ILE 18 -2.531 10.835 0.095 151 HD13 ILE 18 HD13 ILE 18 -2.186 10.626 1.819 152 H GLY 19 H GLY 19 -0.995 15.857 -1.551 153 HA2 GLY 19 HA2 GLY 19 1.606 14.875 -0.842 154 HA3 GLY 19 HA3 GLY 19 1.236 15.960 -2.183 155 H LYS 20 H LYS 20 0.087 18.046 -0.375 156 HA LYS 20 HA LYS 20 2.550 19.391 0.431 157 HB2 LYS 20 HB2 LYS 20 0.455 20.486 -0.527 158 HB3 LYS 20 HB3 LYS 20 -0.315 20.202 1.044 159 HG2 LYS 20 HG2 LYS 20 1.423 21.576 2.149 160 HG3 LYS 20 HG3 LYS 20 2.254 21.790 0.595 161 HD2 LYS 20 HD2 LYS 20 0.288 22.996 -0.312 162 HD3 LYS 20 HD3 LYS 20 -0.604 22.683 1.180 163 HE2 LYS 20 HE2 LYS 20 0.156 24.936 1.290 164 HE3 LYS 20 HE3 LYS 20 1.088 24.002 2.462 165 HZ1 LYS 20 HZ1 LYS 20 2.935 23.972 0.850 166 HZ2 LYS 20 HZ2 LYS 20 2.047 24.817 -0.240 167 HZ3 LYS 20 HZ3 LYS 20 2.493 25.511 1.166 168 H ILE 21 H ILE 21 0.002 17.532 2.037 169 HA ILE 21 HA ILE 21 0.765 18.252 4.741 170 HB ILE 21 HB ILE 21 -0.900 15.994 3.639 171 HG12 ILE 21 HG12 ILE 21 -1.818 18.355 5.332 172 HG13 ILE 21 HG13 ILE 21 -1.700 18.496 3.583 173 HG21 ILE 21 HG21 ILE 21 -0.063 15.082 5.643 174 HG22 ILE 21 HG22 ILE 21 -0.306 16.595 6.537 175 HG23 ILE 21 HG23 ILE 21 -1.688 15.627 6.008 176 HD11 ILE 21 HD11 ILE 21 -3.307 16.665 3.272 177 HD12 ILE 21 HD12 ILE 21 -3.487 16.508 5.036 178 HD13 ILE 21 HD13 ILE 21 -3.985 18.000 4.222 179 H VAL 22 H VAL 22 1.546 15.589 2.506 180 HA VAL 22 HA VAL 22 3.272 14.233 4.389 181 HB VAL 22 HB VAL 22 2.942 14.024 1.388 182 HG11 VAL 22 HG11 VAL 22 5.148 13.111 1.976 183 HG12 VAL 22 HG12 VAL 22 4.421 12.124 3.258 184 HG13 VAL 22 HG13 VAL 22 4.023 11.825 1.561 185 HG21 VAL 22 HG21 VAL 22 2.015 11.769 3.041 186 HG22 VAL 22 HG22 VAL 22 1.203 13.282 3.483 187 HG23 VAL 22 HG23 VAL 22 1.154 12.733 1.821 188 H GLU 23 H GLU 23 3.999 16.560 1.706 189 HA GLU 23 HA GLU 23 6.842 16.189 2.110 190 HB2 GLU 23 HB2 GLU 23 7.182 17.657 0.385 191 HB3 GLU 23 HB3 GLU 23 5.656 16.859 -0.031 192 HG2 GLU 23 HG2 GLU 23 4.495 18.894 0.993 193 HG3 GLU 23 HG3 GLU 23 6.073 19.662 1.065 194 H LYS 24 H LYS 24 4.501 18.352 3.543 195 HA LYS 24 HA LYS 24 6.675 19.805 5.021 196 HB2 LYS 24 HB2 LYS 24 3.715 20.452 4.851 197 HB3 LYS 24 HB3 LYS 24 4.948 21.442 5.599 198 HG2 LYS 24 HG2 LYS 24 4.624 20.815 2.642 199 HG3 LYS 24 HG3 LYS 24 4.274 22.341 3.438 200 HD2 LYS 24 HD2 LYS 24 7.033 21.101 3.045 201 HD3 LYS 24 HD3 LYS 24 6.352 22.491 2.192 202 HE2 LYS 24 HE2 LYS 24 6.180 23.705 4.394 203 HE3 LYS 24 HE3 LYS 24 6.991 22.338 5.173 204 HZ1 LYS 24 HZ1 LYS 24 8.910 22.747 3.705 205 HZ2 LYS 24 HZ2 LYS 24 8.159 24.032 3.026 206 HZ3 LYS 24 HZ3 LYS 24 8.578 24.070 4.602 207 H ARG 25 H ARG 25 4.871 17.098 5.429 208 HA ARG 25 HA ARG 25 4.112 15.822 7.169 209 HB2 ARG 25 HB2 ARG 25 6.411 17.098 8.681 210 HB3 ARG 25 HB3 ARG 25 5.604 15.589 9.093 211 HG2 ARG 25 HG2 ARG 25 6.864 14.385 7.651 212 HG3 ARG 25 HG3 ARG 25 6.515 15.472 6.320 213 HD2 ARG 25 HD2 ARG 25 8.819 15.617 6.513 214 HD3 ARG 25 HD3 ARG 25 8.226 17.084 7.305 215 HE ARG 25 HE ARG 25 8.603 14.858 9.162 216 HH11 ARG 25 HH11 ARG 25 10.396 17.435 7.587 217 HH12 ARG 25 HH12 ARG 25 11.713 17.326 8.729 218 HH21 ARG 25 HH21 ARG 25 10.330 14.754 10.545 219 HH22 ARG 25 HH22 ARG 25 11.674 15.847 10.348 220 H ILE 26 H ILE 26 2.381 17.665 6.876 221 HA ILE 26 HA ILE 26 2.038 19.524 9.089 222 HB ILE 26 HB ILE 26 -0.004 18.714 6.988 223 HG12 ILE 26 HG12 ILE 26 1.994 21.020 7.018 224 HG13 ILE 26 HG13 ILE 26 2.058 19.602 5.977 225 HG21 ILE 26 HG21 ILE 26 -0.997 19.798 9.002 226 HG22 ILE 26 HG22 ILE 26 0.113 21.171 8.789 227 HG23 ILE 26 HG23 ILE 26 -1.135 20.810 7.577 228 HD11 ILE 26 HD11 ILE 26 -0.130 20.295 4.948 229 HD12 ILE 26 HD12 ILE 26 0.001 21.821 5.854 230 HD13 ILE 26 HD13 ILE 26 1.235 21.387 4.657 231 H GLU 27 H GLU 27 1.296 19.088 11.030 232 HA GLU 27 HA GLU 27 0.120 16.491 11.741 233 HB2 GLU 27 HB2 GLU 27 0.940 18.965 13.297 234 HB3 GLU 27 HB3 GLU 27 0.055 17.621 14.044 235 HG2 GLU 27 HG2 GLU 27 1.794 16.046 13.507 236 HG3 GLU 27 HG3 GLU 27 2.664 17.230 12.526 237 H CYS 28 H CYS 28 -1.923 16.115 11.184 238 HA CYS 28 HA CYS 28 -4.023 17.949 12.146 239 HB2 CYS 28 HB2 CYS 28 -5.134 18.001 9.914 240 HB3 CYS 28 HB3 CYS 28 -3.571 18.807 9.926 241 HG CYS 28 HG CYS 28 -4.284 15.721 8.886 242 H THR 29 H THR 29 -6.186 17.120 11.827 243 HA THR 29 HA THR 29 -6.371 14.210 12.445 244 HB THR 29 HB THR 29 -8.727 16.019 12.579 245 HG1 THR 29 HG1 THR 29 -6.717 16.133 14.560 246 HG21 THR 29 HG21 THR 29 -8.932 13.709 13.337 247 HG22 THR 29 HG22 THR 29 -7.667 13.991 14.569 248 HG23 THR 29 HG23 THR 29 -9.219 14.849 14.657 249 H VAL 30 H VAL 30 -7.836 12.871 11.356 250 HA VAL 30 HA VAL 30 -8.972 13.829 8.753 251 HB VAL 30 HB VAL 30 -8.245 11.866 7.622 252 HG11 VAL 30 HG11 VAL 30 -6.628 13.745 7.787 253 HG12 VAL 30 HG12 VAL 30 -5.823 12.898 9.134 254 HG13 VAL 30 HG13 VAL 30 -5.882 12.165 7.521 255 HG21 VAL 30 HG21 VAL 30 -7.071 10.881 10.251 256 HG22 VAL 30 HG22 VAL 30 -8.348 10.118 9.280 257 HG23 VAL 30 HG23 VAL 30 -6.698 10.187 8.666 258 H TYR 31 H TYR 31 -10.454 12.002 7.834 259 HA TYR 31 HA TYR 31 -12.337 11.156 9.997 260 HB2 TYR 31 HB2 TYR 31 -12.968 12.129 7.175 261 HB3 TYR 31 HB3 TYR 31 -14.114 11.428 8.280 262 HD1 TYR 31 HD1 TYR 31 -11.729 14.342 8.009 263 HD2 TYR 31 HD2 TYR 31 -15.388 12.768 9.670 264 HE1 TYR 31 HE1 TYR 31 -12.269 16.584 8.964 265 HE2 TYR 31 HE2 TYR 31 -15.974 15.032 10.524 266 HH TYR 31 HH TYR 31 -15.334 17.218 10.683 267 H SER 32 H SER 32 -13.162 9.145 9.907 268 HA SER 32 HA SER 32 -12.664 7.296 7.644 269 HB2 SER 32 HB2 SER 32 -10.541 7.223 8.782 270 HB3 SER 32 HB3 SER 32 -11.320 7.138 10.367 271 HG SER 32 HG SER 32 -11.752 5.049 10.060 272 H VAL 33 H VAL 33 -13.867 5.330 7.852 273 HA VAL 33 HA VAL 33 -16.113 5.442 9.795 274 HB VAL 33 HB VAL 33 -15.940 3.206 7.800 275 HG11 VAL 33 HG11 VAL 33 -17.689 3.430 9.532 276 HG12 VAL 33 HG12 VAL 33 -18.217 4.956 8.787 277 HG13 VAL 33 HG13 VAL 33 -18.330 3.431 7.875 278 HG21 VAL 33 HG21 VAL 33 -16.775 6.045 7.034 279 HG22 VAL 33 HG22 VAL 33 -15.462 5.097 6.294 280 HG23 VAL 33 HG23 VAL 33 -17.135 4.579 6.097 281 H ASP 34 H ASP 34 -16.149 4.220 11.584 282 HA ASP 34 HA ASP 34 -13.984 2.439 12.319 283 HB2 ASP 34 HB2 ASP 34 -15.718 3.948 13.743 284 HB3 ASP 34 HB3 ASP 34 -16.601 2.429 13.779 285 H ASN 35 H ASN 35 -14.696 0.294 13.359 286 HA ASN 35 HA ASN 35 -15.418 -1.591 11.265 287 HB2 ASN 35 HB2 ASN 35 -14.953 -1.852 14.270 288 HB3 ASN 35 HB3 ASN 35 -15.337 -3.225 13.239 289 HD21 ASN 35 HD22 ASN 35 -12.752 -1.394 14.464 290 HD22 ASN 35 HD21 ASN 35 -11.531 -2.012 13.360 291 H ASN 36 H ASN 36 -17.287 0.048 13.729 292 HA ASN 36 HA ASN 36 -19.695 -1.622 13.335 293 HB2 ASN 36 HB2 ASN 36 -19.069 0.839 15.030 294 HB3 ASN 36 HB3 ASN 36 -20.659 0.082 14.960 295 HD21 ASN 36 HD22 ASN 36 -17.531 -0.114 16.444 296 HD22 ASN 36 HD21 ASN 36 -17.855 -1.606 17.313 297 H GLY 37 H GLY 37 -18.298 0.739 11.434 298 HA2 GLY 37 HA2 GLY 37 -19.111 1.795 9.582 299 HA3 GLY 37 HA3 GLY 37 -20.732 1.260 9.931 300 H ASN 38 H ASN 38 -18.928 3.068 12.353 301 HA ASN 38 HA ASN 38 -20.632 5.507 11.943 302 HB2 ASN 38 HB2 ASN 38 -19.052 4.453 14.340 303 HB3 ASN 38 HB3 ASN 38 -19.751 6.065 14.263 304 HD21 ASN 38 HD22 ASN 38 -20.479 2.685 14.764 305 HD22 ASN 38 HD21 ASN 38 -22.189 2.933 15.088 306 H ILE 39 H ILE 39 -19.667 7.349 11.171 307 HA ILE 39 HA ILE 39 -16.847 7.417 10.503 308 HB ILE 39 HB ILE 39 -18.836 9.703 10.536 309 HG12 ILE 39 HG12 ILE 39 -18.078 7.853 8.219 310 HG13 ILE 39 HG13 ILE 39 -19.626 7.819 9.070 311 HG21 ILE 39 HG21 ILE 39 -17.260 10.827 9.067 312 HG22 ILE 39 HG22 ILE 39 -16.342 10.278 10.445 313 HG23 ILE 39 HG23 ILE 39 -16.258 9.367 8.928 314 HD11 ILE 39 HD11 ILE 39 -20.047 10.179 8.401 315 HD12 ILE 39 HD12 ILE 39 -18.560 10.122 7.420 316 HD13 ILE 39 HD13 ILE 39 -19.925 9.041 7.045 317 H TYR 40 H TYR 40 -15.266 8.098 11.730 318 HA TYR 40 HA TYR 40 -15.722 9.911 14.042 319 HB2 TYR 40 HB2 TYR 40 -14.426 8.643 15.527 320 HB3 TYR 40 HB3 TYR 40 -15.584 7.528 14.841 321 HD1 TYR 40 HD1 TYR 40 -14.762 5.931 12.921 322 HD2 TYR 40 HD2 TYR 40 -12.120 8.164 15.516 323 HE1 TYR 40 HE1 TYR 40 -12.885 4.424 12.323 324 HE2 TYR 40 HE2 TYR 40 -10.277 6.592 14.972 325 HH TYR 40 HH TYR 40 -9.598 4.897 13.617 326 H THR 41 H THR 41 -13.554 10.780 14.855 327 HA THR 41 HA THR 41 -11.756 11.335 12.542 328 HB THR 41 HB THR 41 -11.314 13.580 13.662 329 HG1 THR 41 HG1 THR 41 -13.916 13.267 14.665 330 HG21 THR 41 HG21 THR 41 -12.468 13.480 11.562 331 HG22 THR 41 HG22 THR 41 -13.997 13.025 12.346 332 HG23 THR 41 HG23 THR 41 -13.301 14.643 12.597 333 H GLN 42 H GLN 42 -9.616 11.392 12.833 334 HA GLN 42 HA GLN 42 -8.462 10.814 15.497 335 HB2 GLN 42 HB2 GLN 42 -7.455 8.720 14.724 336 HB3 GLN 42 HB3 GLN 42 -9.214 8.662 14.668 337 HG2 GLN 42 HG2 GLN 42 -9.066 9.155 12.156 338 HG3 GLN 42 HG3 GLN 42 -7.320 8.964 12.297 339 HE21 GLN 42 HE22 GLN 42 -8.982 7.313 10.631 340 HE22 GLN 42 HE21 GLN 42 -8.958 5.693 11.305 341 HA PRO 43 HA PRO 43 -5.124 13.159 13.760 342 HB2 PRO 43 HB2 PRO 43 -3.037 12.539 15.401 343 HB3 PRO 43 HB3 PRO 43 -4.452 13.495 15.933 344 HG2 PRO 43 HG2 PRO 43 -3.960 10.527 16.321 345 HG3 PRO 43 HG3 PRO 43 -4.486 11.736 17.540 346 HD2 PRO 43 HD2 PRO 43 -6.254 10.114 16.247 347 HD3 PRO 43 HD3 PRO 43 -6.666 11.802 16.674 348 H VAL 44 H VAL 44 -3.415 13.040 12.324 349 HA VAL 44 HA VAL 44 -2.715 10.625 10.971 350 HB VAL 44 HB VAL 44 -2.474 12.878 10.020 351 HG11 VAL 44 HG11 VAL 44 -1.487 14.050 12.020 352 HG12 VAL 44 HG12 VAL 44 0.038 13.206 11.706 353 HG13 VAL 44 HG13 VAL 44 -0.617 14.327 10.500 354 HG21 VAL 44 HG21 VAL 44 0.179 11.390 10.042 355 HG22 VAL 44 HG22 VAL 44 -1.242 10.937 9.077 356 HG23 VAL 44 HG23 VAL 44 -0.430 12.484 8.792 357 H ALA 45 H ALA 45 -1.110 9.125 11.253 358 HA ALA 45 HA ALA 45 0.358 9.162 13.848 359 HB1 ALA 45 HB1 ALA 45 -0.900 7.147 13.244 360 HB2 ALA 45 HB2 ALA 45 0.036 6.979 11.745 361 HB3 ALA 45 HB3 ALA 45 0.847 6.818 13.313 362 H GLN 46 H GLN 46 1.014 8.772 10.345 363 HA GLN 46 HA GLN 46 3.661 10.037 10.559 364 HB2 GLN 46 HB2 GLN 46 3.263 7.160 9.610 365 HB3 GLN 46 HB3 GLN 46 4.720 8.091 9.309 366 HG2 GLN 46 HG2 GLN 46 3.703 7.207 12.023 367 HG3 GLN 46 HG3 GLN 46 5.071 6.558 11.136 368 HE21 GLN 46 HE22 GLN 46 4.949 7.851 13.858 369 HE22 GLN 46 HE21 GLN 46 6.155 9.129 13.767 370 H TRP 47 H TRP 47 4.693 10.010 8.318 371 HA TRP 47 HA TRP 47 2.691 10.432 6.132 372 HB2 TRP 47 HB2 TRP 47 5.095 12.194 6.731 373 HB3 TRP 47 HB3 TRP 47 3.928 12.402 5.443 374 HD1 TRP 47 HD1 TRP 47 1.831 13.834 5.965 375 HE1 TRP 47 HE1 TRP 47 0.974 15.143 7.996 376 HE3 TRP 47 HE3 TRP 47 5.107 12.060 9.483 377 HZ2 TRP 47 HZ2 TRP 47 1.611 15.331 10.806 378 HZ3 TRP 47 HZ3 TRP 47 4.923 12.791 11.848 379 HH2 TRP 47 HH2 TRP 47 3.169 14.419 12.522 380 H HIS 48 H HIS 48 3.245 9.385 4.281 381 HA HIS 48 HA HIS 48 6.058 8.431 3.941 382 HB2 HIS 48 HB2 HIS 48 3.602 6.911 3.127 383 HB3 HIS 48 HB3 HIS 48 5.247 6.328 3.185 384 HD1 HIS 48 HD1 HIS 48 6.130 5.593 5.706 385 HD2 HIS 48 HD2 HIS 48 2.108 6.768 5.302 386 HE1 HIS 48 HE1 HIS 48 4.941 4.817 7.825 387 H ASP 49 H ASP 49 6.904 8.534 1.955 388 HA ASP 49 HA ASP 49 5.301 9.708 -0.268 389 HB2 ASP 49 HB2 ASP 49 7.461 11.016 -0.784 390 HB3 ASP 49 HB3 ASP 49 6.329 11.592 0.418 391 H ARG 50 H ARG 50 5.327 8.612 -2.018 392 HA ARG 50 HA ARG 50 7.091 6.261 -2.340 393 HB2 ARG 50 HB2 ARG 50 4.880 7.366 -4.086 394 HB3 ARG 50 HB3 ARG 50 5.614 5.778 -4.205 395 HG2 ARG 50 HG2 ARG 50 3.903 6.817 -1.894 396 HG3 ARG 50 HG3 ARG 50 3.409 5.655 -3.099 397 HD2 ARG 50 HD2 ARG 50 5.528 5.237 -0.963 398 HD3 ARG 50 HD3 ARG 50 3.911 4.522 -1.026 399 HE ARG 50 HE ARG 50 5.379 3.832 -3.415 400 HH11 ARG 50 HH11 ARG 50 5.345 2.953 -0.025 401 HH12 ARG 50 HH12 ARG 50 6.018 1.375 -0.355 402 HH21 ARG 50 HH21 ARG 50 6.118 1.868 -3.781 403 HH22 ARG 50 HH22 ARG 50 6.518 0.792 -2.453 404 H GLY 51 H GLY 51 6.606 9.379 -3.865 405 HA2 GLY 51 HA2 GLY 51 8.283 10.664 -4.890 406 HA3 GLY 51 HA3 GLY 51 9.260 9.216 -5.102 407 H GLU 52 H GLU 52 7.484 7.570 -6.578 408 HA GLU 52 HA GLU 52 6.691 8.843 -9.055 409 HB2 GLU 52 HB2 GLU 52 8.565 8.152 -10.448 410 HB3 GLU 52 HB3 GLU 52 8.909 9.498 -9.382 411 HG2 GLU 52 HG2 GLU 52 10.051 7.833 -7.800 412 HG3 GLU 52 HG3 GLU 52 9.906 6.637 -9.077 413 H GLN 53 H GLN 53 5.057 7.374 -8.708 414 HA GLN 53 HA GLN 53 5.606 4.659 -9.877 415 HB2 GLN 53 HB2 GLN 53 3.440 5.496 -7.940 416 HB3 GLN 53 HB3 GLN 53 3.767 3.841 -8.512 417 HG2 GLN 53 HG2 GLN 53 6.095 4.050 -7.506 418 HG3 GLN 53 HG3 GLN 53 5.588 5.607 -6.805 419 HE21 GLN 53 HE22 GLN 53 3.003 5.081 -5.918 420 HE22 GLN 53 HE21 GLN 53 3.385 4.244 -4.466 421 H GLU 54 H GLU 54 3.810 3.636 -10.981 422 HA GLU 54 HA GLU 54 2.865 5.273 -13.141 423 HB2 GLU 54 HB2 GLU 54 1.765 3.134 -13.887 424 HB3 GLU 54 HB3 GLU 54 3.515 3.126 -13.679 425 HG2 GLU 54 HG2 GLU 54 3.253 1.926 -11.510 426 HG3 GLU 54 HG3 GLU 54 1.505 1.914 -11.738 427 H VAL 55 H VAL 55 1.368 6.760 -12.866 428 HA VAL 55 HA VAL 55 -0.994 6.299 -11.124 429 HB VAL 55 HB VAL 55 -0.103 8.869 -12.490 430 HG11 VAL 55 HG11 VAL 55 -2.515 8.790 -11.747 431 HG12 VAL 55 HG12 VAL 55 -1.945 8.444 -10.102 432 HG13 VAL 55 HG13 VAL 55 -1.545 9.984 -10.889 433 HG21 VAL 55 HG21 VAL 55 0.539 7.712 -9.754 434 HG22 VAL 55 HG22 VAL 55 1.645 8.398 -10.963 435 HG23 VAL 55 HG23 VAL 55 0.563 9.458 -10.059 436 H PHE 56 H PHE 56 -3.036 6.270 -11.826 437 HA PHE 56 HA PHE 56 -3.606 6.442 -14.757 438 HB2 PHE 56 HB2 PHE 56 -4.691 4.508 -12.673 439 HB3 PHE 56 HB3 PHE 56 -5.296 4.671 -14.315 440 HD1 PHE 56 HD1 PHE 56 -2.288 3.715 -12.305 441 HD2 PHE 56 HD2 PHE 56 -4.197 3.580 -16.165 442 HE1 PHE 56 HE1 PHE 56 -0.533 2.164 -13.118 443 HE2 PHE 56 HE2 PHE 56 -2.448 1.999 -16.964 444 HZ PHE 56 HZ PHE 56 -0.604 1.310 -15.452 445 H GLU 57 H GLU 57 -5.440 7.453 -15.363 446 HA GLU 57 HA GLU 57 -6.653 9.400 -13.617 447 HB2 GLU 57 HB2 GLU 57 -6.334 9.487 -16.164 448 HB3 GLU 57 HB3 GLU 57 -7.699 8.382 -16.294 449 HG2 GLU 57 HG2 GLU 57 -9.163 10.021 -15.178 450 HG3 GLU 57 HG3 GLU 57 -7.780 11.073 -14.858 451 H TYR 58 H TYR 58 -8.359 9.209 -12.285 452 HA TYR 58 HA TYR 58 -10.211 6.895 -12.565 453 HB2 TYR 58 HB2 TYR 58 -8.803 6.420 -10.747 454 HB3 TYR 58 HB3 TYR 58 -8.854 8.069 -10.136 455 HD1 TYR 58 HD1 TYR 58 -11.967 6.352 -11.231 456 HD2 TYR 58 HD2 TYR 58 -9.381 7.231 -7.881 457 HE1 TYR 58 HE1 TYR 58 -13.735 5.666 -9.681 458 HE2 TYR 58 HE2 TYR 58 -11.221 6.600 -6.317 459 HH TYR 58 HH TYR 58 -14.438 5.597 -7.572 460 H CYS 59 H CYS 59 -11.592 8.042 -13.842 461 HA CYS 59 HA CYS 59 -12.909 10.477 -12.738 462 HB2 CYS 59 HB2 CYS 59 -12.083 10.386 -15.127 463 HB3 CYS 59 HB3 CYS 59 -13.262 9.103 -15.438 464 HG CYS 59 HG CYS 59 -15.389 10.542 -14.659 465 H LEU 60 H LEU 60 -15.071 10.491 -12.215 466 HA LEU 60 HA LEU 60 -16.526 7.873 -12.102 467 HB2 LEU 60 HB2 LEU 60 -16.041 10.002 -10.171 468 HB3 LEU 60 HB3 LEU 60 -17.748 9.900 -10.489 469 HG LEU 60 HG LEU 60 -17.831 7.550 -9.878 470 HD11 LEU 60 HD11 LEU 60 -15.561 6.818 -10.507 471 HD12 LEU 60 HD12 LEU 60 -14.886 7.832 -9.213 472 HD13 LEU 60 HD13 LEU 60 -15.936 6.436 -8.825 473 HD21 LEU 60 HD21 LEU 60 -16.304 9.172 -7.813 474 HD22 LEU 60 HD22 LEU 60 -18.042 9.328 -8.132 475 HD23 LEU 60 HD23 LEU 60 -17.395 7.804 -7.501 476 H GLU 61 H GLU 61 -18.834 7.959 -12.203 477 HA GLU 61 HA GLU 61 -19.717 9.021 -14.700 478 HB2 GLU 61 HB2 GLU 61 -21.221 7.824 -12.355 479 HB3 GLU 61 HB3 GLU 61 -21.951 8.094 -13.932 480 HG2 GLU 61 HG2 GLU 61 -19.489 6.326 -13.574 481 HG3 GLU 61 HG3 GLU 61 -21.119 5.737 -13.321 482 H ASP 62 H ASP 62 -19.911 10.396 -11.513 483 HA ASP 62 HA ASP 62 -21.873 12.491 -12.164 484 HB2 ASP 62 HB2 ASP 62 -21.694 11.663 -9.894 485 HB3 ASP 62 HB3 ASP 62 -19.967 12.034 -9.839 486 H GLY 63 H GLY 63 -18.423 12.052 -12.573 487 HA2 GLY 63 HA2 GLY 63 -17.187 13.512 -14.014 488 HA3 GLY 63 HA3 GLY 63 -18.093 14.904 -13.424 489 H SER 64 H SER 64 -17.350 13.056 -10.729 490 HA SER 64 HA SER 64 -15.254 14.725 -9.681 491 HB2 SER 64 HB2 SER 64 -16.125 11.898 -8.951 492 HB3 SER 64 HB3 SER 64 -14.905 12.821 -8.064 493 HG SER 64 HG SER 64 -17.566 13.734 -8.523 494 H LEU 65 H LEU 65 -13.070 14.606 -9.795 495 HA LEU 65 HA LEU 65 -11.853 12.567 -11.617 496 HB2 LEU 65 HB2 LEU 65 -12.283 15.127 -12.305 497 HB3 LEU 65 HB3 LEU 65 -10.802 15.381 -11.417 498 HG LEU 65 HG LEU 65 -10.277 15.194 -13.710 499 HD11 LEU 65 HD11 LEU 65 -8.695 13.975 -12.206 500 HD12 LEU 65 HD12 LEU 65 -9.528 12.457 -12.622 501 HD13 LEU 65 HD13 LEU 65 -8.710 13.391 -13.880 502 HD21 LEU 65 HD21 LEU 65 -11.094 12.461 -14.361 503 HD22 LEU 65 HD22 LEU 65 -12.480 13.474 -13.934 504 HD23 LEU 65 HD23 LEU 65 -11.377 13.986 -15.216 505 H ILE 66 H ILE 66 -10.354 11.421 -10.743 506 HA ILE 66 HA ILE 66 -8.752 12.329 -8.398 507 HB ILE 66 HB ILE 66 -10.048 9.591 -8.743 508 HG12 ILE 66 HG12 ILE 66 -10.954 11.746 -6.786 509 HG13 ILE 66 HG13 ILE 66 -11.771 11.426 -8.313 510 HG21 ILE 66 HG21 ILE 66 -8.005 9.519 -7.386 511 HG22 ILE 66 HG22 ILE 66 -8.584 10.881 -6.391 512 HG23 ILE 66 HG23 ILE 66 -9.387 9.304 -6.337 513 HD11 ILE 66 HD11 ILE 66 -12.345 9.168 -7.662 514 HD12 ILE 66 HD12 ILE 66 -11.576 9.410 -6.067 515 HD13 ILE 66 HD13 ILE 66 -12.985 10.371 -6.542 516 H ARG 67 H ARG 67 -6.678 11.342 -8.253 517 HA ARG 67 HA ARG 67 -5.720 9.750 -10.595 518 HB2 ARG 67 HB2 ARG 67 -4.482 12.337 -9.546 519 HB3 ARG 67 HB3 ARG 67 -3.669 11.195 -10.631 520 HG2 ARG 67 HG2 ARG 67 -5.612 11.470 -12.232 521 HG3 ARG 67 HG3 ARG 67 -6.205 12.789 -11.220 522 HD2 ARG 67 HD2 ARG 67 -4.292 14.154 -11.677 523 HD3 ARG 67 HD3 ARG 67 -3.376 12.796 -12.304 524 HE ARG 67 HE ARG 67 -4.574 12.818 -14.332 525 HH11 ARG 67 HH11 ARG 67 -5.712 15.463 -12.317 526 HH12 ARG 67 HH12 ARG 67 -6.573 16.200 -13.645 527 HH21 ARG 67 HH21 ARG 67 -5.766 13.774 -15.938 528 HH22 ARG 67 HH22 ARG 67 -6.577 15.277 -15.629 529 H ALA 68 H ALA 68 -4.877 7.957 -9.884 530 HA ALA 68 HA ALA 68 -3.191 7.849 -7.454 531 HB1 ALA 68 HB1 ALA 68 -5.496 7.589 -6.604 532 HB2 ALA 68 HB2 ALA 68 -5.794 6.276 -7.771 533 HB3 ALA 68 HB3 ALA 68 -4.607 6.060 -6.467 534 H THR 69 H THR 69 -2.214 5.680 -7.171 535 HA THR 69 HA THR 69 -1.326 4.522 -9.716 536 HB THR 69 HB THR 69 -0.151 2.883 -8.149 537 HG1 THR 69 HG1 THR 69 -1.840 3.487 -6.492 538 HG21 THR 69 HG21 THR 69 1.018 4.864 -8.945 539 HG22 THR 69 HG22 THR 69 0.293 5.849 -7.651 540 HG23 THR 69 HG23 THR 69 1.418 4.524 -7.248 541 H LYS 70 H LYS 70 -1.612 2.371 -10.401 542 HA LYS 70 HA LYS 70 -4.216 1.269 -9.914 543 HB2 LYS 70 HB2 LYS 70 -2.048 0.709 -11.771 544 HB3 LYS 70 HB3 LYS 70 -2.577 -0.792 -11.029 545 HG2 LYS 70 HG2 LYS 70 -5.002 0.075 -11.528 546 HG3 LYS 70 HG3 LYS 70 -4.230 1.174 -12.664 547 HD2 LYS 70 HD2 LYS 70 -3.665 -1.815 -12.721 548 HD3 LYS 70 HD3 LYS 70 -5.176 -1.195 -13.367 549 HE2 LYS 70 HE2 LYS 70 -2.561 -0.066 -14.357 550 HE3 LYS 70 HE3 LYS 70 -3.138 -1.645 -14.921 551 HZ1 LYS 70 HZ1 LYS 70 -5.192 -0.622 -15.632 552 HZ2 LYS 70 HZ2 LYS 70 -4.666 0.875 -15.165 553 HZ3 LYS 70 HZ3 LYS 70 -3.918 0.068 -16.387 554 H ASP 71 H ASP 71 -1.403 0.894 -8.059 555 HA ASP 71 HA ASP 71 -2.111 -1.690 -6.849 556 HB2 ASP 71 HB2 ASP 71 -0.002 0.414 -6.210 557 HB3 ASP 71 HB3 ASP 71 -0.116 -1.169 -5.437 558 H HIS 72 H HIS 72 -3.101 1.585 -6.329 559 HA HIS 72 HA HIS 72 -3.185 1.502 -3.401 560 HB2 HIS 72 HB2 HIS 72 -2.846 3.609 -4.657 561 HB3 HIS 72 HB3 HIS 72 -4.420 3.423 -5.431 562 HD1 HIS 72 HD1 HIS 72 -6.595 3.670 -3.785 563 HD2 HIS 72 HD2 HIS 72 -2.858 4.644 -2.127 564 HE1 HIS 72 HE1 HIS 72 -7.048 4.681 -1.531 565 H LYS 73 H LYS 73 -5.032 0.928 -2.166 566 HA LYS 73 HA LYS 73 -7.299 -0.308 -3.646 567 HB2 LYS 73 HB2 LYS 73 -6.358 -0.655 -0.770 568 HB3 LYS 73 HB3 LYS 73 -7.813 -1.379 -1.437 569 HG2 LYS 73 HG2 LYS 73 -6.653 -3.122 -2.182 570 HG3 LYS 73 HG3 LYS 73 -5.768 -2.071 -3.279 571 HD2 LYS 73 HD2 LYS 73 -4.130 -1.596 -1.445 572 HD3 LYS 73 HD3 LYS 73 -4.956 -2.784 -0.421 573 HE2 LYS 73 HE2 LYS 73 -4.012 -3.483 -3.224 574 HE3 LYS 73 HE3 LYS 73 -2.864 -3.480 -1.876 575 HZ1 LYS 73 HZ1 LYS 73 -4.227 -5.143 -0.759 576 HZ2 LYS 73 HZ2 LYS 73 -5.320 -5.158 -1.980 577 HZ3 LYS 73 HZ3 LYS 73 -3.793 -5.686 -2.232 578 H PHE 74 H PHE 74 -9.457 0.090 -3.157 579 HA PHE 74 HA PHE 74 -9.998 2.604 -1.590 580 HB2 PHE 74 HB2 PHE 74 -10.931 1.957 -4.399 581 HB3 PHE 74 HB3 PHE 74 -11.565 3.234 -3.379 582 HD1 PHE 74 HD2 PHE 74 -8.604 2.185 -5.392 583 HD2 PHE 74 HD1 PHE 74 -10.401 5.292 -2.988 584 HE1 PHE 74 HE2 PHE 74 -7.010 3.842 -6.317 585 HE2 PHE 74 HE1 PHE 74 -8.746 6.915 -3.840 586 HZ PHE 74 HZ PHE 74 -7.074 6.206 -5.530 587 H MET 75 H MET 75 -11.651 2.454 -0.210 588 HA MET 75 HA MET 75 -12.750 -0.164 0.176 589 HB2 MET 75 HB2 MET 75 -12.133 1.640 1.959 590 HB3 MET 75 HB3 MET 75 -13.799 2.186 1.720 591 HG2 MET 75 HG2 MET 75 -14.714 0.083 2.333 592 HG3 MET 75 HG3 MET 75 -13.143 -0.709 2.265 593 HE1 MET 75 HE1 MET 75 -13.823 2.746 4.991 594 HE2 MET 75 HE2 MET 75 -14.994 2.207 3.761 595 HE3 MET 75 HE3 MET 75 -15.162 1.677 5.448 596 H THR 76 H THR 76 -14.371 -1.013 -0.949 597 HA THR 76 HA THR 76 -16.179 0.592 -2.532 598 HB THR 76 HB THR 76 -17.257 -1.478 -3.173 599 HG1 THR 76 HG1 THR 76 -16.455 -3.415 -2.308 600 HG21 THR 76 HG21 THR 76 -15.135 -0.765 -4.220 601 HG22 THR 76 HG22 THR 76 -14.237 -1.799 -3.089 602 HG23 THR 76 HG23 THR 76 -15.368 -2.524 -4.258 603 H VAL 77 H VAL 77 -18.604 0.159 -2.496 604 HA VAL 77 HA VAL 77 -19.786 1.042 -0.125 605 HB VAL 77 HB VAL 77 -21.952 0.325 -1.037 606 HG11 VAL 77 HG11 VAL 77 -20.903 2.410 -1.804 607 HG12 VAL 77 HG12 VAL 77 -20.150 1.542 -3.160 608 HG13 VAL 77 HG13 VAL 77 -21.911 1.643 -3.052 609 HG21 VAL 77 HG21 VAL 77 -20.333 -1.034 -3.235 610 HG22 VAL 77 HG22 VAL 77 -21.378 -1.843 -2.044 611 HG23 VAL 77 HG23 VAL 77 -22.084 -0.767 -3.248 612 H ASP 78 H ASP 78 -18.930 -2.238 -0.928 613 HA ASP 78 HA ASP 78 -20.542 -3.429 1.229 614 HB2 ASP 78 HB2 ASP 78 -20.193 -4.421 -1.078 615 HB3 ASP 78 HB3 ASP 78 -18.508 -4.701 -0.638 616 H GLY 79 H GLY 79 -17.525 -1.885 1.101 617 HA2 GLY 79 HA2 GLY 79 -16.128 -1.533 2.949 618 HA3 GLY 79 HA3 GLY 79 -16.682 -3.023 3.704 619 H GLN 80 H GLN 80 -15.929 -3.750 0.483 620 HA GLN 80 HA GLN 80 -13.578 -5.269 1.212 621 HB2 GLN 80 HB2 GLN 80 -14.695 -4.595 -1.542 622 HB3 GLN 80 HB3 GLN 80 -13.512 -5.841 -1.183 623 HG2 GLN 80 HG2 GLN 80 -16.370 -5.842 -0.101 624 HG3 GLN 80 HG3 GLN 80 -15.826 -6.708 -1.525 625 HE21 GLN 80 HE22 GLN 80 -14.196 -8.470 -1.229 626 HE22 GLN 80 HE21 GLN 80 -14.090 -9.253 0.341 627 H MET 81 H MET 81 -11.453 -4.983 0.583 628 HA MET 81 HA MET 81 -10.607 -2.182 -0.090 629 HB2 MET 81 HB2 MET 81 -9.439 -4.243 1.809 630 HB3 MET 81 HB3 MET 81 -8.589 -2.772 1.319 631 HG2 MET 81 HG2 MET 81 -10.208 -1.347 2.321 632 HG3 MET 81 HG3 MET 81 -11.346 -2.669 2.594 633 HE1 MET 81 HE1 MET 81 -11.315 -4.051 5.199 634 HE2 MET 81 HE2 MET 81 -10.633 -4.809 3.746 635 HE3 MET 81 HE3 MET 81 -9.724 -4.842 5.273 636 H LEU 82 H LEU 82 -10.749 -2.798 -2.311 637 HA LEU 82 HA LEU 82 -8.678 -4.730 -3.288 638 HB2 LEU 82 HB2 LEU 82 -11.164 -3.764 -4.749 639 HB3 LEU 82 HB3 LEU 82 -10.124 -5.107 -5.190 640 HG LEU 82 HG LEU 82 -12.081 -4.973 -2.873 641 HD11 LEU 82 HD11 LEU 82 -13.017 -5.335 -5.149 642 HD12 LEU 82 HD12 LEU 82 -11.979 -6.765 -5.326 643 HD13 LEU 82 HD13 LEU 82 -13.251 -6.734 -4.086 644 HD21 LEU 82 HD21 LEU 82 -10.177 -7.236 -3.605 645 HD22 LEU 82 HD22 LEU 82 -10.187 -6.310 -2.091 646 HD23 LEU 82 HD23 LEU 82 -11.540 -7.372 -2.472 647 HA PRO 83 HA PRO 83 -6.688 -1.360 -5.415 648 HB2 PRO 83 HB2 PRO 83 -5.602 -2.606 -7.611 649 HB3 PRO 83 HB3 PRO 83 -4.951 -2.767 -5.953 650 HG2 PRO 83 HG2 PRO 83 -6.816 -4.627 -7.459 651 HG3 PRO 83 HG3 PRO 83 -5.373 -5.060 -6.490 652 HD2 PRO 83 HD2 PRO 83 -7.909 -5.250 -5.505 653 HD3 PRO 83 HD3 PRO 83 -6.542 -4.761 -4.463 654 H ILE 84 H ILE 84 -7.069 0.134 -7.065 655 HA ILE 84 HA ILE 84 -9.596 0.205 -8.264 656 HB ILE 84 HB ILE 84 -8.255 2.145 -7.807 657 HG12 ILE 84 HG12 ILE 84 -8.606 2.366 -10.787 658 HG13 ILE 84 HG13 ILE 84 -9.993 1.853 -9.833 659 HG21 ILE 84 HG21 ILE 84 -6.015 1.357 -8.454 660 HG22 ILE 84 HG22 ILE 84 -6.509 1.331 -10.164 661 HG23 ILE 84 HG23 ILE 84 -6.410 2.868 -9.282 662 HD11 ILE 84 HD11 ILE 84 -9.900 3.798 -8.431 663 HD12 ILE 84 HD12 ILE 84 -8.449 4.396 -9.286 664 HD13 ILE 84 HD13 ILE 84 -10.001 4.251 -10.144 665 H ASP 85 H ASP 85 -6.702 -1.280 -9.580 666 HA ASP 85 HA ASP 85 -7.419 -1.739 -12.277 667 HB2 ASP 85 HB2 ASP 85 -5.245 -2.324 -11.144 668 HB3 ASP 85 HB3 ASP 85 -6.067 -3.592 -10.263 669 H GLU 86 H GLU 86 -8.544 -3.323 -9.329 670 HA GLU 86 HA GLU 86 -9.999 -5.425 -10.829 671 HB2 GLU 86 HB2 GLU 86 -8.532 -5.851 -8.812 672 HB3 GLU 86 HB3 GLU 86 -9.750 -5.048 -7.815 673 HG2 GLU 86 HG2 GLU 86 -11.370 -6.714 -8.280 674 HG3 GLU 86 HG3 GLU 86 -10.471 -7.349 -9.667 675 H ILE 87 H ILE 87 -10.663 -2.487 -8.867 676 HA ILE 87 HA ILE 87 -13.498 -2.780 -8.719 677 HB ILE 87 HB ILE 87 -11.789 -0.264 -8.873 678 HG12 ILE 87 HG12 ILE 87 -12.799 -1.818 -6.439 679 HG13 ILE 87 HG13 ILE 87 -11.145 -1.810 -7.034 680 HG21 ILE 87 HG21 ILE 87 -14.135 0.279 -9.308 681 HG22 ILE 87 HG22 ILE 87 -14.646 -0.699 -7.931 682 HG23 ILE 87 HG23 ILE 87 -13.745 0.800 -7.674 683 HD11 ILE 87 HD11 ILE 87 -11.498 0.873 -6.737 684 HD12 ILE 87 HD12 ILE 87 -12.542 0.233 -5.442 685 HD13 ILE 87 HD13 ILE 87 -10.826 -0.204 -5.509 686 H PHE 88 H PHE 88 -11.395 -1.455 -11.298 687 HA PHE 88 HA PHE 88 -13.535 -0.538 -12.983 688 HB2 PHE 88 HB2 PHE 88 -11.133 0.147 -13.134 689 HB3 PHE 88 HB3 PHE 88 -10.743 -1.444 -13.767 690 HD1 PHE 88 HD1 PHE 88 -12.798 1.652 -14.453 691 HD2 PHE 88 HD2 PHE 88 -10.988 -1.905 -16.105 692 HE1 PHE 88 HE1 PHE 88 -13.267 2.475 -16.734 693 HE2 PHE 88 HE2 PHE 88 -11.460 -1.065 -18.396 694 HZ PHE 88 HZ PHE 88 -12.593 1.126 -18.715 695 H GLU 89 H GLU 89 -12.023 -3.769 -12.693 696 HA GLU 89 HA GLU 89 -13.364 -4.846 -15.052 697 HB2 GLU 89 HB2 GLU 89 -11.888 -6.120 -12.710 698 HB3 GLU 89 HB3 GLU 89 -12.709 -7.077 -13.943 699 HG2 GLU 89 HG2 GLU 89 -11.361 -5.784 -15.692 700 HG3 GLU 89 HG3 GLU 89 -10.383 -5.164 -14.361 701 H ARG 90 H ARG 90 -14.040 -5.165 -11.498 702 HA ARG 90 HA ARG 90 -16.565 -6.529 -12.023 703 HB2 ARG 90 HB2 ARG 90 -15.345 -5.365 -9.477 704 HB3 ARG 90 HB3 ARG 90 -16.876 -6.243 -9.564 705 HG2 ARG 90 HG2 ARG 90 -15.486 -7.923 -8.953 706 HG3 ARG 90 HG3 ARG 90 -15.540 -8.140 -10.708 707 HD2 ARG 90 HD2 ARG 90 -13.318 -7.057 -10.898 708 HD3 ARG 90 HD3 ARG 90 -13.356 -6.713 -9.167 709 HE ARG 90 HE ARG 90 -12.744 -8.886 -8.700 710 HH11 ARG 90 HH11 ARG 90 -13.666 -8.855 -12.091 711 HH12 ARG 90 HH12 ARG 90 -12.926 -10.408 -12.385 712 HH21 ARG 90 HH21 ARG 90 -11.857 -10.854 -9.148 713 HH22 ARG 90 HH22 ARG 90 -11.948 -11.511 -10.760 714 H GLU 91 H GLU 91 -15.762 -3.203 -12.203 715 HA GLU 91 HA GLU 91 -16.978 -1.349 -12.436 716 HB2 GLU 91 HB2 GLU 91 -19.414 -3.082 -12.985 717 HB3 GLU 91 HB3 GLU 91 -19.117 -1.420 -13.491 718 HG2 GLU 91 HG2 GLU 91 -17.166 -2.249 -14.876 719 HG3 GLU 91 HG3 GLU 91 -17.625 -3.901 -14.458 720 H LEU 92 H LEU 92 -16.488 -2.200 -9.880 721 HA LEU 92 HA LEU 92 -18.924 -1.807 -8.243 722 HB2 LEU 92 HB2 LEU 92 -16.022 -2.388 -7.538 723 HB3 LEU 92 HB3 LEU 92 -17.259 -2.056 -6.331 724 HG LEU 92 HG LEU 92 -17.313 -4.373 -8.297 725 HD11 LEU 92 HD11 LEU 92 -15.538 -4.549 -6.565 726 HD12 LEU 92 HD12 LEU 92 -16.766 -4.316 -5.298 727 HD13 LEU 92 HD13 LEU 92 -16.810 -5.759 -6.336 728 HD21 LEU 92 HD21 LEU 92 -19.150 -3.687 -5.962 729 HD22 LEU 92 HD22 LEU 92 -19.601 -3.803 -7.681 730 HD23 LEU 92 HD23 LEU 92 -19.122 -5.254 -6.803 731 H ASP 93 H ASP 93 -19.145 -0.276 -6.709 732 HA ASP 93 HA ASP 93 -17.917 2.371 -7.202 733 HB2 ASP 93 HB2 ASP 93 -20.106 3.091 -6.059 734 HB3 ASP 93 HB3 ASP 93 -20.135 2.496 -7.714 735 H LEU 94 H LEU 94 -17.611 3.825 -5.455 736 HA LEU 94 HA LEU 94 -16.535 2.494 -3.037 737 HB2 LEU 94 HB2 LEU 94 -16.282 5.363 -3.965 738 HB3 LEU 94 HB3 LEU 94 -15.494 4.639 -2.563 739 HG LEU 94 HG LEU 94 -14.954 4.117 -5.496 740 HD11 LEU 94 HD11 LEU 94 -13.831 6.020 -4.408 741 HD12 LEU 94 HD12 LEU 94 -13.213 4.954 -3.129 742 HD13 LEU 94 HD13 LEU 94 -12.662 4.762 -4.806 743 HD21 LEU 94 HD21 LEU 94 -13.883 2.474 -3.173 744 HD22 LEU 94 HD22 LEU 94 -14.917 1.885 -4.498 745 HD23 LEU 94 HD23 LEU 94 -13.289 2.434 -4.853 746 H MET 95 H MET 95 -16.867 3.305 -0.913 747 HA MET 95 HA MET 95 -19.683 3.968 -0.372 748 HB2 MET 95 HB2 MET 95 -18.407 2.344 0.965 749 HB3 MET 95 HB3 MET 95 -17.280 3.594 1.477 750 HG2 MET 95 HG2 MET 95 -18.807 4.563 2.917 751 HG3 MET 95 HG3 MET 95 -20.201 4.096 1.944 752 HE1 MET 95 HE1 MET 95 -17.547 1.265 2.860 753 HE2 MET 95 HE2 MET 95 -17.307 2.475 4.148 754 HE3 MET 95 HE3 MET 95 -18.030 0.894 4.525 755 H ARG 96 H ARG 96 -20.437 5.950 0.286 756 HA ARG 96 HA ARG 96 -18.540 8.270 0.318 757 HB2 ARG 96 HB2 ARG 96 -21.366 8.120 -0.804 758 HB3 ARG 96 HB3 ARG 96 -20.459 9.624 -0.594 759 HG2 ARG 96 HG2 ARG 96 -18.722 8.853 -2.161 760 HG3 ARG 96 HG3 ARG 96 -19.545 7.301 -2.331 761 HD2 ARG 96 HD2 ARG 96 -20.491 8.203 -4.129 762 HD3 ARG 96 HD3 ARG 96 -21.608 8.939 -2.973 763 HE ARG 96 HE ARG 96 -19.467 10.744 -3.225 764 HH11 ARG 96 HH11 ARG 96 -21.846 9.406 -5.445 765 HH12 ARG 96 HH12 ARG 96 -21.659 10.729 -6.572 766 HH21 ARG 96 HH21 ARG 96 -19.287 12.394 -4.744 767 HH22 ARG 96 HH22 ARG 96 -20.276 12.362 -6.173 768 H VAL 97 H VAL 97 -19.113 10.028 1.627 769 HA VAL 97 HA VAL 97 -20.776 9.316 4.021 770 HB VAL 97 HB VAL 97 -19.305 10.599 5.382 771 HG11 VAL 97 HG11 VAL 97 -18.844 8.171 5.032 772 HG12 VAL 97 HG12 VAL 97 -17.707 8.586 3.738 773 HG13 VAL 97 HG13 VAL 97 -17.375 9.094 5.402 774 HG21 VAL 97 HG21 VAL 97 -17.138 10.838 3.362 775 HG22 VAL 97 HG22 VAL 97 -18.407 12.091 3.388 776 HG23 VAL 97 HG23 VAL 97 -17.439 11.758 4.831 777 H ASP 98 H ASP 98 -20.818 11.412 1.462 778 HA ASP 98 HA ASP 98 -22.038 13.698 2.902 779 HB2 ASP 98 HB2 ASP 98 -20.810 13.190 0.211 780 HB3 ASP 98 HB3 ASP 98 -22.036 14.445 0.313 781 H ASN 99 H ASN 99 -23.299 10.891 2.332 782 HA ASN 99 HA ASN 99 -25.252 9.922 1.783 783 HB2 ASN 99 HB2 ASN 99 -26.329 12.657 2.545 784 HB3 ASN 99 HB3 ASN 99 -27.374 11.291 2.127 785 HD21 ASN 99 HD22 ASN 99 -24.600 12.085 4.169 786 HD22 ASN 99 HD21 ASN 99 -24.622 10.550 4.911 787 H LEU 100 H LEU 100 -23.618 10.816 -0.164 788 HA LEU 100 HA LEU 100 -25.313 11.483 -2.515 789 HB2 LEU 100 HB2 LEU 100 -22.334 11.212 -2.023 790 HB3 LEU 100 HB3 LEU 100 -22.958 11.318 -3.657 791 HG LEU 100 HG LEU 100 -23.551 13.425 -1.541 792 HD11 LEU 100 HD11 LEU 100 -21.098 13.225 -2.077 793 HD12 LEU 100 HD12 LEU 100 -21.498 13.547 -3.778 794 HD13 LEU 100 HD13 LEU 100 -21.820 14.776 -2.538 795 HD21 LEU 100 HD21 LEU 100 -23.786 13.449 -4.591 796 HD22 LEU 100 HD22 LEU 100 -25.147 13.421 -3.451 797 HD23 LEU 100 HD23 LEU 100 -24.088 14.832 -3.518 798 HA PRO 101 HA PRO 101 -25.854 7.371 -3.936 799 HB2 PRO 101 HB2 PRO 101 -25.912 7.621 -6.663 800 HB3 PRO 101 HB3 PRO 101 -27.177 8.301 -5.594 801 HG2 PRO 101 HG2 PRO 101 -24.774 9.731 -6.778 802 HG3 PRO 101 HG3 PRO 101 -26.490 10.260 -6.783 803 HD2 PRO 101 HD2 PRO 101 -24.712 11.163 -4.930 804 HD3 PRO 101 HD3 PRO 101 -26.408 10.839 -4.488 805 H ASN 102 H ASN 102 -24.856 5.534 -4.890 806 HA ASN 102 HA ASN 102 -21.907 5.725 -4.923 807 HB2 ASN 102 HB2 ASN 102 -23.658 3.244 -5.062 808 HB3 ASN 102 HB3 ASN 102 -21.957 3.357 -4.600 809 HD21 ASN 102 HD22 ASN 102 -21.551 4.851 -2.585 810 HD22 ASN 102 HD21 ASN 102 -22.776 4.739 -1.323 811 H ILE 103 H ILE 103 -20.656 5.494 -6.689 812 HA ILE 103 HA ILE 103 -21.718 4.504 -9.264 813 HB ILE 103 HB ILE 103 -20.599 6.609 -10.321 814 HG12 ILE 103 HG12 ILE 103 -21.513 7.888 -7.706 815 HG13 ILE 103 HG13 ILE 103 -19.825 7.519 -8.070 816 HG21 ILE 103 HG21 ILE 103 -22.972 5.943 -10.548 817 HG22 ILE 103 HG22 ILE 103 -23.359 6.841 -9.064 818 HG23 ILE 103 HG23 ILE 103 -22.775 7.691 -10.502 819 HD11 ILE 103 HD11 ILE 103 -19.994 8.952 -10.115 820 HD12 ILE 103 HD12 ILE 103 -21.636 9.414 -9.606 821 HD13 ILE 103 HD13 ILE 103 -20.247 9.836 -8.595 822 H LYS 104 H LYS 104 -20.297 3.599 -10.540 823 HA LYS 104 HA LYS 104 -17.622 3.037 -9.473 824 HB2 LYS 104 HB2 LYS 104 -17.549 1.274 -11.143 825 HB3 LYS 104 HB3 LYS 104 -19.017 1.238 -10.195 826 HG2 LYS 104 HG2 LYS 104 -19.713 0.663 -12.310 827 HG3 LYS 104 HG3 LYS 104 -20.220 2.339 -12.153 828 HD2 LYS 104 HD2 LYS 104 -18.191 3.031 -13.419 829 HD3 LYS 104 HD3 LYS 104 -17.715 1.330 -13.614 830 HE2 LYS 104 HE2 LYS 104 -20.458 2.227 -14.546 831 HE3 LYS 104 HE3 LYS 104 -19.064 2.849 -15.428 832 HZ1 LYS 104 HZ1 LYS 104 -18.334 0.550 -15.810 833 HZ2 LYS 104 HZ2 LYS 104 -19.682 -0.029 -15.073 834 HZ3 LYS 104 HZ3 LYS 104 -19.803 0.824 -16.450 835 H ILE 105 H ILE 105 -15.875 2.730 -11.205 836 HA ILE 105 HA ILE 105 -14.969 5.301 -12.109 837 HB ILE 105 HB ILE 105 -14.101 2.512 -12.959 838 HG12 ILE 105 HG12 ILE 105 -12.545 4.072 -10.926 839 HG13 ILE 105 HG13 ILE 105 -13.964 3.185 -10.376 840 HG21 ILE 105 HG21 ILE 105 -13.179 4.158 -14.498 841 HG22 ILE 105 HG22 ILE 105 -12.696 5.221 -13.167 842 HG23 ILE 105 HG23 ILE 105 -11.871 3.676 -13.422 843 HD11 ILE 105 HD11 ILE 105 -12.987 1.137 -11.467 844 HD12 ILE 105 HD12 ILE 105 -11.489 2.085 -11.717 845 HD13 ILE 105 HD13 ILE 105 -12.112 1.786 -10.077 846 H ALA 106 H ALA 106 -15.788 6.399 -13.751 847 HA ALA 106 HA ALA 106 -17.587 5.316 -15.753 848 HB1 ALA 106 HB1 ALA 106 -17.818 7.593 -14.935 849 HB2 ALA 106 HB2 ALA 106 -16.184 8.022 -15.488 850 HB3 ALA 106 HB3 ALA 106 -17.462 7.642 -16.663 851 H THR 107 H THR 107 -14.237 6.491 -15.810 852 HA THR 107 HA THR 107 -13.516 4.826 -18.136 853 HB THR 107 HB THR 107 -12.321 6.883 -19.135 854 HG1 THR 107 HG1 THR 107 -13.460 8.837 -18.764 855 HG21 THR 107 HG21 THR 107 -14.279 5.795 -20.213 856 HG22 THR 107 HG22 THR 107 -15.354 6.909 -19.336 857 HG23 THR 107 HG23 THR 107 -14.184 7.535 -20.515 858 H ARG 108 H ARG 108 -11.326 4.472 -18.335 859 HA ARG 108 HA ARG 108 -9.469 5.558 -16.269 860 HB2 ARG 108 HB2 ARG 108 -10.219 3.409 -15.443 861 HB3 ARG 108 HB3 ARG 108 -9.888 2.613 -16.976 862 HG2 ARG 108 HG2 ARG 108 -7.630 4.018 -15.535 863 HG3 ARG 108 HG3 ARG 108 -8.199 2.495 -14.895 864 HD2 ARG 108 HD2 ARG 108 -7.489 2.683 -17.833 865 HD3 ARG 108 HD3 ARG 108 -6.216 2.536 -16.623 866 HE ARG 108 HE ARG 108 -7.756 0.490 -15.858 867 HH11 ARG 108 HH11 ARG 108 -6.637 1.265 -19.109 868 HH12 ARG 108 HH12 ARG 108 -6.699 -0.405 -19.606 869 HH21 ARG 108 HH21 ARG 108 -7.909 -1.596 -16.624 870 HH22 ARG 108 HH22 ARG 108 -7.373 -1.963 -18.239 871 H LYS 109 H LYS 109 -7.441 5.908 -16.932 872 HA LYS 109 HA LYS 109 -6.335 4.895 -19.446 873 HB2 LYS 109 HB2 LYS 109 -7.767 6.913 -20.119 874 HB3 LYS 109 HB3 LYS 109 -6.764 7.906 -19.074 875 HG2 LYS 109 HG2 LYS 109 -5.975 8.235 -21.294 876 HG3 LYS 109 HG3 LYS 109 -4.764 7.263 -20.482 877 HD2 LYS 109 HD2 LYS 109 -4.971 6.299 -22.619 878 HD3 LYS 109 HD3 LYS 109 -5.884 5.198 -21.583 879 HE2 LYS 109 HE2 LYS 109 -7.998 6.438 -22.267 880 HE3 LYS 109 HE3 LYS 109 -7.009 7.411 -23.364 881 HZ1 LYS 109 HZ1 LYS 109 -6.379 5.311 -24.492 882 HZ2 LYS 109 HZ2 LYS 109 -7.389 4.466 -23.524 883 HZ3 LYS 109 HZ3 LYS 109 -7.985 5.572 -24.562 884 H TYR 110 H TYR 110 -4.071 4.882 -19.349 885 HA TYR 110 HA TYR 110 -2.764 5.528 -16.843 886 HB2 TYR 110 HB2 TYR 110 -1.992 3.717 -18.361 887 HB3 TYR 110 HB3 TYR 110 -1.603 4.908 -19.586 888 HD1 TYR 110 HD2 TYR 110 -0.947 4.826 -15.850 889 HD2 TYR 110 HD1 TYR 110 0.747 4.981 -19.822 890 HE1 TYR 110 HE2 TYR 110 1.297 5.150 -14.890 891 HE2 TYR 110 HE1 TYR 110 3.018 5.199 -18.833 892 HH TYR 110 HH TYR 110 4.245 5.298 -16.905 893 H LEU 111 H LEU 111 -1.848 7.422 -16.169 894 HA LEU 111 HA LEU 111 -1.920 9.759 -18.023 895 HB2 LEU 111 HB2 LEU 111 -1.388 9.462 -15.037 896 HB3 LEU 111 HB3 LEU 111 -1.402 10.992 -15.904 897 HG LEU 111 HG LEU 111 -3.822 9.170 -15.923 898 HD11 LEU 111 HD11 LEU 111 -3.317 9.529 -13.624 899 HD12 LEU 111 HD12 LEU 111 -3.016 11.255 -13.882 900 HD13 LEU 111 HD13 LEU 111 -4.669 10.574 -14.053 901 HD21 LEU 111 HD21 LEU 111 -3.420 12.169 -16.326 902 HD22 LEU 111 HD22 LEU 111 -3.842 10.978 -17.579 903 HD23 LEU 111 HD23 LEU 111 -5.000 11.340 -16.298 904 H GLY 112 H GLY 112 0.350 7.995 -15.910 905 HA2 GLY 112 HA2 GLY 112 2.703 7.958 -17.177 906 HA3 GLY 112 HA3 GLY 112 2.621 9.678 -16.784 907 H LYS 113 H LYS 113 4.341 9.649 -15.406 908 HA LYS 113 HA LYS 113 4.240 7.900 -12.976 909 HB2 LYS 113 HB2 LYS 113 5.894 7.319 -14.838 910 HB3 LYS 113 HB3 LYS 113 6.760 8.780 -14.336 911 HG2 LYS 113 HG2 LYS 113 6.795 7.858 -11.964 912 HG3 LYS 113 HG3 LYS 113 6.053 6.382 -12.577 913 HD2 LYS 113 HD2 LYS 113 8.430 6.050 -12.292 914 HD3 LYS 113 HD3 LYS 113 8.034 5.980 -14.018 915 HE2 LYS 113 HE2 LYS 113 8.866 8.257 -14.355 916 HE3 LYS 113 HE3 LYS 113 9.089 8.482 -12.615 917 HZ1 LYS 113 HZ1 LYS 113 10.814 6.819 -12.637 918 HZ2 LYS 113 HZ2 LYS 113 10.578 6.479 -14.231 919 HZ3 LYS 113 HZ3 LYS 113 11.171 7.930 -13.763 920 H GLN 114 H GLN 114 3.160 9.549 -11.986 921 HA GLN 114 HA GLN 114 4.413 12.127 -11.480 922 HB2 GLN 114 HB2 GLN 114 1.717 11.265 -10.467 923 HB3 GLN 114 HB3 GLN 114 2.332 12.884 -10.853 924 HG2 GLN 114 HG2 GLN 114 2.715 12.032 -13.235 925 HG3 GLN 114 HG3 GLN 114 1.755 10.608 -12.786 926 HE21 GLN 114 HE22 GLN 114 0.977 11.654 -14.865 927 HE22 GLN 114 HE21 GLN 114 -0.338 12.754 -14.630 928 H ASN 115 H ASN 115 4.638 13.007 -9.277 929 HA ASN 115 HA ASN 115 5.499 11.263 -7.230 930 HB2 ASN 115 HB2 ASN 115 5.868 13.892 -7.813 931 HB3 ASN 115 HB3 ASN 115 4.549 14.074 -6.647 932 HD21 ASN 115 HD22 ASN 115 5.102 12.028 -4.786 933 HD22 ASN 115 HD21 ASN 115 6.756 12.196 -4.265 934 H VAL 116 H VAL 116 4.244 9.975 -5.991 935 HA VAL 116 HA VAL 116 1.539 10.968 -5.178 936 HB VAL 116 HB VAL 116 0.803 8.610 -5.107 937 HG11 VAL 116 HG11 VAL 116 0.233 10.130 -6.981 938 HG12 VAL 116 HG12 VAL 116 1.647 9.538 -7.870 939 HG13 VAL 116 HG13 VAL 116 0.312 8.434 -7.461 940 HG21 VAL 116 HG21 VAL 116 3.281 8.015 -6.803 941 HG22 VAL 116 HG22 VAL 116 3.014 7.467 -5.134 942 HG23 VAL 116 HG23 VAL 116 1.947 6.914 -6.425 943 H TYR 117 H TYR 117 0.754 10.351 -3.175 944 HA TYR 117 HA TYR 117 2.825 9.799 -1.089 945 HB2 TYR 117 HB2 TYR 117 0.816 12.064 -0.971 946 HB3 TYR 117 HB3 TYR 117 2.203 11.776 0.057 947 HD1 TYR 117 HD1 TYR 117 1.100 12.918 -3.300 948 HD2 TYR 117 HD2 TYR 117 4.391 12.664 -0.528 949 HE1 TYR 117 HE1 TYR 117 2.401 14.538 -4.679 950 HE2 TYR 117 HE2 TYR 117 5.646 14.352 -1.847 951 HH TYR 117 HH TYR 117 5.607 15.744 -3.660 952 H ASP 118 H ASP 118 1.976 9.276 0.999 953 HA ASP 118 HA ASP 118 -0.889 8.741 1.320 954 HB2 ASP 118 HB2 ASP 118 -0.583 6.391 1.855 955 HB3 ASP 118 HB3 ASP 118 -0.198 6.726 0.180 956 H ILE 119 H ILE 119 -1.500 9.075 3.377 957 HA ILE 119 HA ILE 119 0.596 9.418 5.472 958 HB ILE 119 HB ILE 119 -1.200 10.364 6.843 959 HG12 ILE 119 HG12 ILE 119 -2.923 10.300 4.326 960 HG13 ILE 119 HG13 ILE 119 -3.135 9.231 5.718 961 HG21 ILE 119 HG21 ILE 119 0.369 11.719 5.457 962 HG22 ILE 119 HG22 ILE 119 -0.841 11.766 4.160 963 HG23 ILE 119 HG23 ILE 119 -1.174 12.529 5.732 964 HD11 ILE 119 HD11 ILE 119 -3.540 11.220 7.163 965 HD12 ILE 119 HD12 ILE 119 -3.463 12.253 5.712 966 HD13 ILE 119 HD13 ILE 119 -4.725 11.021 5.853 967 H GLY 120 H GLY 120 0.397 8.451 7.500 968 HA2 GLY 120 HA2 GLY 120 -0.979 5.780 7.531 969 HA3 GLY 120 HA3 GLY 120 0.514 6.162 8.386 970 H VAL 121 H VAL 121 -1.774 5.082 9.617 971 HA VAL 121 HA VAL 121 -2.628 7.231 11.504 972 HB VAL 121 HB VAL 121 -4.546 5.249 10.267 973 HG11 VAL 121 HG11 VAL 121 -5.354 6.107 12.379 974 HG12 VAL 121 HG12 VAL 121 -4.944 7.782 11.907 975 HG13 VAL 121 HG13 VAL 121 -6.235 6.896 11.082 976 HG21 VAL 121 HG21 VAL 121 -4.167 8.156 9.432 977 HG22 VAL 121 HG22 VAL 121 -3.908 6.720 8.408 978 HG23 VAL 121 HG23 VAL 121 -5.529 7.120 8.948 979 H GLU 122 H GLU 122 -3.404 6.356 13.572 980 HA GLU 122 HA GLU 122 -1.773 4.249 14.553 981 HB2 GLU 122 HB2 GLU 122 -2.597 6.097 15.917 982 HB3 GLU 122 HB3 GLU 122 -4.256 5.494 15.796 983 HG2 GLU 122 HG2 GLU 122 -3.644 3.447 17.001 984 HG3 GLU 122 HG3 GLU 122 -1.935 3.882 16.951 985 H ARG 123 H ARG 123 -1.901 2.231 13.894 986 HA ARG 123 HA ARG 123 -2.600 0.187 13.216 987 HB2 ARG 123 HB2 ARG 123 -4.777 0.595 15.302 988 HB3 ARG 123 HB3 ARG 123 -4.289 -0.950 14.598 989 HG2 ARG 123 HG2 ARG 123 -2.005 -0.683 15.531 990 HG3 ARG 123 HG3 ARG 123 -2.470 0.873 16.231 991 HD2 ARG 123 HD2 ARG 123 -2.569 -0.713 17.977 992 HD3 ARG 123 HD3 ARG 123 -4.237 -0.278 17.571 993 HE ARG 123 HE ARG 123 -3.589 -2.586 16.060 994 HH11 ARG 123 HH11 ARG 123 -3.935 -1.813 19.464 995 HH12 ARG 123 HH12 ARG 123 -4.358 -3.453 19.888 996 HH21 ARG 123 HH21 ARG 123 -4.145 -4.654 16.669 997 HH22 ARG 123 HH22 ARG 123 -4.475 -5.011 18.344 998 H ASP 124 H ASP 124 -3.645 2.446 11.701 999 HA ASP 124 HA ASP 124 -5.660 1.002 10.085 1000 HB2 ASP 124 HB2 ASP 124 -6.129 3.673 11.449 1001 HB3 ASP 124 HB3 ASP 124 -6.912 3.298 9.922 1002 H HIS 125 H HIS 125 -6.065 2.117 7.993 1003 HA HIS 125 HA HIS 125 -3.883 3.808 6.959 1004 HB2 HIS 125 HB2 HIS 125 -3.379 2.054 5.165 1005 HB3 HIS 125 HB3 HIS 125 -2.724 1.808 6.728 1006 HD1 HIS 125 HD1 HIS 125 -3.769 -0.312 8.164 1007 HD2 HIS 125 HD2 HIS 125 -4.987 0.201 4.171 1008 HE1 HIS 125 HE1 HIS 125 -4.850 -2.511 7.465 1009 H ASN 126 H ASN 126 -6.661 4.394 7.203 1010 HA ASN 126 HA ASN 126 -7.293 4.858 4.372 1011 HB2 ASN 126 HB2 ASN 126 -9.544 3.888 4.561 1012 HB3 ASN 126 HB3 ASN 126 -8.329 2.665 4.908 1013 HD21 ASN 126 HD22 ASN 126 -11.067 4.386 6.161 1014 HD22 ASN 126 HD21 ASN 126 -10.959 3.793 7.804 1015 H PHE 127 H PHE 127 -9.131 6.305 4.017 1016 HA PHE 127 HA PHE 127 -10.063 8.068 6.118 1017 HB2 PHE 127 HB2 PHE 127 -8.883 10.124 5.215 1018 HB3 PHE 127 HB3 PHE 127 -7.903 9.020 6.138 1019 HD1 PHE 127 HD2 PHE 127 -8.799 9.785 2.535 1020 HD2 PHE 127 HD1 PHE 127 -5.814 8.369 5.313 1021 HE1 PHE 127 HE2 PHE 127 -7.141 9.648 0.697 1022 HE2 PHE 127 HE1 PHE 127 -4.156 8.272 3.469 1023 HZ PHE 127 HZ PHE 127 -4.815 8.933 1.166 1024 H ALA 128 H ALA 128 -11.255 9.968 5.224 1025 HA ALA 128 HA ALA 128 -12.685 9.263 2.732 1026 HB1 ALA 128 HB1 ALA 128 -13.993 9.686 4.764 1027 HB2 ALA 128 HB2 ALA 128 -13.293 11.319 4.888 1028 HB3 ALA 128 HB3 ALA 128 -14.337 10.900 3.514 1029 H LEU 129 H LEU 129 -12.491 10.338 0.879 1030 HA LEU 129 HA LEU 129 -10.703 12.611 0.442 1031 HB2 LEU 129 HB2 LEU 129 -12.801 11.371 -1.389 1032 HB3 LEU 129 HB3 LEU 129 -11.541 12.505 -1.860 1033 HG LEU 129 HG LEU 129 -11.175 9.607 -1.026 1034 HD11 LEU 129 HD11 LEU 129 -11.881 10.132 -3.400 1035 HD12 LEU 129 HD12 LEU 129 -10.429 11.122 -3.571 1036 HD13 LEU 129 HD13 LEU 129 -10.289 9.373 -3.293 1037 HD21 LEU 129 HD21 LEU 129 -9.063 11.711 -1.522 1038 HD22 LEU 129 HD22 LEU 129 -9.321 10.738 -0.051 1039 HD23 LEU 129 HD23 LEU 129 -8.756 9.958 -1.529 1040 H LYS 130 H LYS 130 -11.476 14.603 -0.642 1041 HA LYS 130 HA LYS 130 -13.148 16.146 0.876 1042 HB2 LYS 130 HB2 LYS 130 -13.173 17.760 -0.915 1043 HB3 LYS 130 HB3 LYS 130 -11.579 17.025 -0.802 1044 HG2 LYS 130 HG2 LYS 130 -12.052 15.671 -2.826 1045 HG3 LYS 130 HG3 LYS 130 -13.723 16.259 -2.844 1046 HD2 LYS 130 HD2 LYS 130 -12.761 18.626 -3.046 1047 HD3 LYS 130 HD3 LYS 130 -11.229 17.833 -3.471 1048 HE2 LYS 130 HE2 LYS 130 -12.393 16.628 -5.322 1049 HE3 LYS 130 HE3 LYS 130 -13.907 17.421 -4.860 1050 HZ1 LYS 130 HZ1 LYS 130 -12.581 19.584 -5.233 1051 HZ2 LYS 130 HZ2 LYS 130 -11.518 18.666 -6.073 1052 HZ3 LYS 130 HZ3 LYS 130 -13.075 18.765 -6.558 1053 H ASN 131 H ASN 131 -14.318 14.159 -1.764 1054 HA ASN 131 HA ASN 131 -17.008 15.400 -1.623 1055 HB2 ASN 131 HB2 ASN 131 -15.443 14.782 -3.744 1056 HB3 ASN 131 HB3 ASN 131 -16.279 13.240 -3.579 1057 HD21 ASN 131 HD22 ASN 131 -18.878 13.967 -2.943 1058 HD22 ASN 131 HD21 ASN 131 -19.515 14.981 -4.237 1059 H GLY 132 H GLY 132 -15.489 12.831 -0.122 1060 HA2 GLY 132 HA2 GLY 132 -16.800 11.823 1.565 1061 HA3 GLY 132 HA3 GLY 132 -18.083 11.432 0.403 1062 H PHE 133 H PHE 133 -15.546 10.618 -1.405 1063 HA PHE 133 HA PHE 133 -15.977 7.816 -1.145 1064 HB2 PHE 133 HB2 PHE 133 -13.598 9.151 -2.440 1065 HB3 PHE 133 HB3 PHE 133 -14.289 7.591 -2.836 1066 HD1 PHE 133 HD2 PHE 133 -16.862 7.660 -3.583 1067 HD2 PHE 133 HD1 PHE 133 -14.120 10.984 -3.815 1068 HE1 PHE 133 HE2 PHE 133 -18.289 8.728 -5.309 1069 HE2 PHE 133 HE1 PHE 133 -15.546 12.037 -5.552 1070 HZ PHE 133 HZ PHE 133 -17.638 10.926 -6.280 1071 H ILE 134 H ILE 134 -14.465 6.060 -0.498 1072 HA ILE 134 HA ILE 134 -12.482 6.965 1.545 1073 HB ILE 134 HB ILE 134 -13.359 4.149 1.123 1074 HG12 ILE 134 HG12 ILE 134 -15.445 5.086 1.536 1075 HG13 ILE 134 HG13 ILE 134 -14.911 4.386 3.053 1076 HG21 ILE 134 HG21 ILE 134 -11.362 4.391 2.492 1077 HG22 ILE 134 HG22 ILE 134 -12.168 5.598 3.521 1078 HG23 ILE 134 HG23 ILE 134 -12.692 3.906 3.517 1079 HD11 ILE 134 HD11 ILE 134 -14.288 6.712 3.835 1080 HD12 ILE 134 HD12 ILE 134 -15.042 7.329 2.346 1081 HD13 ILE 134 HD13 ILE 134 -16.020 6.448 3.514 1082 H ALA 135 H ALA 135 -10.452 6.467 1.454 1083 HA ALA 135 HA ALA 135 -9.286 4.856 -0.794 1084 HB1 ALA 135 HB1 ALA 135 -8.969 7.233 -1.236 1085 HB2 ALA 135 HB2 ALA 135 -8.406 7.511 0.423 1086 HB3 ALA 135 HB3 ALA 135 -7.408 6.583 -0.696 1087 H SER 136 H SER 136 -7.665 3.370 -0.171 1088 HA SER 136 HA SER 136 -6.832 3.293 2.664 1089 HB2 SER 136 HB2 SER 136 -8.738 1.912 2.633 1090 HB3 SER 136 HB3 SER 136 -8.221 1.087 1.139 1091 HG SER 136 HG SER 136 -7.800 -0.138 3.046 1092 H ASN 137 H ASN 137 -4.784 2.848 2.966 1093 HA ASN 137 HA ASN 137 -3.031 2.753 0.619 1094 HB2 ASN 137 HB2 ASN 137 -2.790 4.526 2.258 1095 HB3 ASN 137 HB3 ASN 137 -2.666 3.366 3.571 1096 HD21 ASN 137 HD22 ASN 137 -0.656 4.061 4.295 1097 HD22 ASN 137 HD21 ASN 137 0.723 4.188 3.217 Start of MODEL 15 1 H1 GLY -1 H GLY -1 1.814 -1.829 -0.604 2 HA2 GLY -1 HA2 GLY -1 2.495 0.423 -1.126 3 HA3 GLY -1 HA3 GLY -1 3.136 -0.751 -2.276 4 H GLY 0 H GLY 0 0.548 1.579 -1.760 5 HA2 GLY 0 HA2 GLY 0 0.558 2.495 -4.539 6 HA3 GLY 0 HA3 GLY 0 -0.980 1.947 -3.863 7 H ALA 1 H ALA 1 -0.679 4.616 -4.593 8 HA ALA 1 HA ALA 1 -1.031 6.080 -2.049 9 HB1 ALA 1 HB1 ALA 1 1.351 6.055 -2.093 10 HB2 ALA 1 HB2 ALA 1 1.388 6.484 -3.817 11 HB3 ALA 1 HB3 ALA 1 0.857 7.663 -2.604 12 H LEU 2 H LEU 2 -1.249 8.545 -2.542 13 HA LEU 2 HA LEU 2 -3.068 8.837 -4.914 14 HB2 LEU 2 HB2 LEU 2 -3.152 10.337 -2.268 15 HB3 LEU 2 HB3 LEU 2 -4.264 10.442 -3.609 16 HG LEU 2 HG LEU 2 -5.457 9.337 -2.020 17 HD11 LEU 2 HD11 LEU 2 -5.663 8.238 -4.181 18 HD12 LEU 2 HD12 LEU 2 -4.375 7.093 -3.744 19 HD13 LEU 2 HD13 LEU 2 -5.902 7.103 -2.844 20 HD21 LEU 2 HD21 LEU 2 -3.177 7.456 -1.426 21 HD22 LEU 2 HD22 LEU 2 -3.644 8.870 -0.466 22 HD23 LEU 2 HD23 LEU 2 -4.767 7.517 -0.653 23 H SER 3 H SER 3 -2.987 10.774 -6.131 24 HA SER 3 HA SER 3 -0.461 12.078 -6.398 25 HB2 SER 3 HB2 SER 3 -1.525 13.225 -8.145 26 HB3 SER 3 HB3 SER 3 -2.394 11.712 -8.082 27 HG SER 3 HG SER 3 -4.084 12.763 -7.049 28 H TYR 4 H TYR 4 -0.035 14.428 -6.276 29 HA TYR 4 HA TYR 4 -0.586 15.787 -3.875 30 HB2 TYR 4 HB2 TYR 4 1.152 16.502 -5.359 31 HB3 TYR 4 HB3 TYR 4 0.029 16.772 -6.682 32 HD1 TYR 4 HD1 TYR 4 1.347 18.154 -3.512 33 HD2 TYR 4 HD2 TYR 4 -1.406 18.757 -6.784 34 HE1 TYR 4 HE1 TYR 4 0.996 20.499 -2.788 35 HE2 TYR 4 HE2 TYR 4 -1.774 21.100 -6.042 36 HH TYR 4 HH TYR 4 -0.116 22.476 -3.195 37 H GLU 5 H GLU 5 -2.455 15.882 -6.918 38 HA GLU 5 HA GLU 5 -4.211 18.046 -6.255 39 HB2 GLU 5 HB2 GLU 5 -4.641 15.654 -8.095 40 HB3 GLU 5 HB3 GLU 5 -5.621 17.112 -8.109 41 HG2 GLU 5 HG2 GLU 5 -2.623 17.257 -8.596 42 HG3 GLU 5 HG3 GLU 5 -3.747 16.771 -9.848 43 H THR 6 H THR 6 -4.167 14.806 -5.237 44 HA THR 6 HA THR 6 -6.933 14.340 -4.579 45 HB THR 6 HB THR 6 -4.624 13.179 -3.012 46 HG1 THR 6 HG1 THR 6 -3.952 12.731 -4.865 47 HG21 THR 6 HG21 THR 6 -7.162 12.774 -2.496 48 HG22 THR 6 HG22 THR 6 -7.129 11.768 -3.961 49 HG23 THR 6 HG23 THR 6 -6.062 11.410 -2.578 50 H GLU 7 H GLU 7 -8.055 15.741 -3.324 51 HA GLU 7 HA GLU 7 -6.759 17.041 -1.039 52 HB2 GLU 7 HB2 GLU 7 -9.675 17.267 -1.766 53 HB3 GLU 7 HB3 GLU 7 -8.681 18.343 -0.787 54 HG2 GLU 7 HG2 GLU 7 -7.309 18.831 -2.863 55 HG3 GLU 7 HG3 GLU 7 -8.488 17.900 -3.793 56 H ILE 8 H ILE 8 -6.818 16.365 0.987 57 HA ILE 8 HA ILE 8 -8.550 14.072 1.801 58 HB ILE 8 HB ILE 8 -6.259 15.268 3.402 59 HG12 ILE 8 HG12 ILE 8 -5.216 14.709 1.313 60 HG13 ILE 8 HG13 ILE 8 -4.734 13.551 2.536 61 HG21 ILE 8 HG21 ILE 8 -7.810 13.754 4.592 62 HG22 ILE 8 HG22 ILE 8 -7.532 12.491 3.379 63 HG23 ILE 8 HG23 ILE 8 -6.207 13.021 4.430 64 HD11 ILE 8 HD11 ILE 8 -5.748 11.779 1.460 65 HD12 ILE 8 HD12 ILE 8 -7.094 12.759 0.886 66 HD13 ILE 8 HD13 ILE 8 -5.555 12.830 0.034 67 H LEU 9 H LEU 9 -10.317 14.533 2.956 68 HA LEU 9 HA LEU 9 -10.880 17.219 3.909 69 HB2 LEU 9 HB2 LEU 9 -12.613 15.565 3.075 70 HB3 LEU 9 HB3 LEU 9 -12.281 14.571 4.490 71 HG LEU 9 HG LEU 9 -12.922 16.636 5.915 72 HD11 LEU 9 HD11 LEU 9 -12.793 18.357 4.140 73 HD12 LEU 9 HD12 LEU 9 -14.082 17.529 3.240 74 HD13 LEU 9 HD13 LEU 9 -14.422 18.265 4.819 75 HD21 LEU 9 HD21 LEU 9 -15.045 15.373 4.134 76 HD22 LEU 9 HD22 LEU 9 -14.383 14.673 5.628 77 HD23 LEU 9 HD23 LEU 9 -15.318 16.172 5.703 78 H THR 10 H THR 10 -10.082 18.073 5.759 79 HA THR 10 HA THR 10 -9.474 16.267 8.041 80 HB THR 10 HB THR 10 -7.639 17.744 8.662 81 HG1 THR 10 HG1 THR 10 -7.128 19.210 6.696 82 HG21 THR 10 HG21 THR 10 -6.862 15.986 7.292 83 HG22 THR 10 HG22 THR 10 -7.467 16.734 5.806 84 HG23 THR 10 HG23 THR 10 -6.097 17.453 6.666 85 H VAL 11 H VAL 11 -9.756 16.990 10.150 86 HA VAL 11 HA VAL 11 -11.911 18.890 10.586 87 HB VAL 11 HB VAL 11 -10.019 17.761 12.672 88 HG11 VAL 11 HG11 VAL 11 -11.328 19.574 13.601 89 HG12 VAL 11 HG12 VAL 11 -12.823 18.918 12.893 90 HG13 VAL 11 HG13 VAL 11 -11.983 18.054 14.200 91 HG21 VAL 11 HG21 VAL 11 -12.671 16.612 11.728 92 HG22 VAL 11 HG22 VAL 11 -11.084 15.878 11.435 93 HG23 VAL 11 HG23 VAL 11 -11.699 16.011 13.082 94 H GLU 12 H GLU 12 -8.400 19.137 10.746 95 HA GLU 12 HA GLU 12 -8.271 21.613 12.201 96 HB2 GLU 12 HB2 GLU 12 -6.416 19.987 10.476 97 HB3 GLU 12 HB3 GLU 12 -5.921 21.624 10.920 98 HG2 GLU 12 HG2 GLU 12 -6.633 19.411 12.886 99 HG3 GLU 12 HG3 GLU 12 -5.008 19.950 12.468 100 H TYR 13 H TYR 13 -8.622 20.997 8.719 101 HA TYR 13 HA TYR 13 -8.905 23.947 8.283 102 HB2 TYR 13 HB2 TYR 13 -7.093 22.052 6.748 103 HB3 TYR 13 HB3 TYR 13 -7.535 23.657 6.189 104 HD1 TYR 13 HD1 TYR 13 -7.132 25.621 7.974 105 HD2 TYR 13 HD2 TYR 13 -4.990 21.871 7.832 106 HE1 TYR 13 HE1 TYR 13 -5.196 26.676 9.142 107 HE2 TYR 13 HE2 TYR 13 -3.058 22.931 8.979 108 HH TYR 13 HH TYR 13 -2.211 24.850 9.885 109 H GLY 14 H GLY 14 -9.272 20.713 6.686 110 HA2 GLY 14 HA2 GLY 14 -11.673 20.427 5.746 111 HA3 GLY 14 HA3 GLY 14 -11.318 21.915 4.864 112 H LEU 15 H LEU 15 -11.472 20.907 2.855 113 HA LEU 15 HA LEU 15 -9.907 18.628 1.985 114 HB2 LEU 15 HB2 LEU 15 -11.278 20.939 0.546 115 HB3 LEU 15 HB3 LEU 15 -10.513 19.611 -0.304 116 HG LEU 15 HG LEU 15 -12.773 19.196 1.695 117 HD11 LEU 15 HD11 LEU 15 -13.557 20.606 -0.146 118 HD12 LEU 15 HD12 LEU 15 -12.903 19.459 -1.334 119 HD13 LEU 15 HD13 LEU 15 -14.246 18.981 -0.268 120 HD21 LEU 15 HD21 LEU 15 -11.686 17.408 -0.527 121 HD22 LEU 15 HD22 LEU 15 -11.385 17.173 1.210 122 HD23 LEU 15 HD23 LEU 15 -13.026 17.028 0.573 123 H LEU 16 H LEU 16 -7.715 18.705 2.231 124 HA LEU 16 HA LEU 16 -6.243 20.892 0.818 125 HB2 LEU 16 HB2 LEU 16 -5.627 19.547 3.478 126 HB3 LEU 16 HB3 LEU 16 -4.415 20.430 2.567 127 HG LEU 16 HG LEU 16 -6.956 21.620 3.756 128 HD11 LEU 16 HD11 LEU 16 -5.194 21.073 5.376 129 HD12 LEU 16 HD12 LEU 16 -3.984 21.921 4.389 130 HD13 LEU 16 HD13 LEU 16 -5.294 22.832 5.156 131 HD21 LEU 16 HD21 LEU 16 -4.718 22.936 2.144 132 HD22 LEU 16 HD22 LEU 16 -6.441 22.860 1.711 133 HD23 LEU 16 HD23 LEU 16 -5.932 23.815 3.101 134 HA PRO 17 HA PRO 17 -4.313 17.761 -1.568 135 HB2 PRO 17 HB2 PRO 17 -1.886 18.886 -2.195 136 HB3 PRO 17 HB3 PRO 17 -3.447 19.436 -2.876 137 HG2 PRO 17 HG2 PRO 17 -1.930 20.600 -0.530 138 HG3 PRO 17 HG3 PRO 17 -2.643 21.466 -1.929 139 HD2 PRO 17 HD2 PRO 17 -3.928 21.293 0.444 140 HD3 PRO 17 HD3 PRO 17 -4.837 21.170 -1.092 141 H ILE 18 H ILE 18 -3.580 15.855 -0.891 142 HA ILE 18 HA ILE 18 -2.248 15.369 1.526 143 HB ILE 18 HB ILE 18 -3.507 13.718 0.194 144 HG12 ILE 18 HG12 ILE 18 -0.734 12.720 0.944 145 HG13 ILE 18 HG13 ILE 18 -2.001 13.125 2.105 146 HG21 ILE 18 HG21 ILE 18 -2.459 14.213 -2.020 147 HG22 ILE 18 HG22 ILE 18 -1.026 13.298 -1.502 148 HG23 ILE 18 HG23 ILE 18 -2.599 12.502 -1.642 149 HD11 ILE 18 HD11 ILE 18 -3.478 11.391 1.035 150 HD12 ILE 18 HD12 ILE 18 -2.108 10.918 0.013 151 HD13 ILE 18 HD13 ILE 18 -2.004 10.743 1.775 152 H GLY 19 H GLY 19 -0.754 15.992 -1.653 153 HA2 GLY 19 HA2 GLY 19 1.873 15.102 -0.958 154 HA3 GLY 19 HA3 GLY 19 1.478 16.245 -2.250 155 H LYS 20 H LYS 20 0.244 18.201 -0.380 156 HA LYS 20 HA LYS 20 2.703 19.570 0.447 157 HB2 LYS 20 HB2 LYS 20 0.430 20.491 -0.603 158 HB3 LYS 20 HB3 LYS 20 -0.065 20.603 1.089 159 HG2 LYS 20 HG2 LYS 20 1.886 22.042 1.570 160 HG3 LYS 20 HG3 LYS 20 2.509 21.767 -0.069 161 HD2 LYS 20 HD2 LYS 20 0.373 22.832 -0.972 162 HD3 LYS 20 HD3 LYS 20 -0.049 23.237 0.693 163 HE2 LYS 20 HE2 LYS 20 0.936 25.180 -0.307 164 HE3 LYS 20 HE3 LYS 20 2.081 24.550 0.883 165 HZ1 LYS 20 HZ1 LYS 20 3.352 23.566 -0.959 166 HZ2 LYS 20 HZ2 LYS 20 2.256 24.090 -2.059 167 HZ3 LYS 20 HZ3 LYS 20 3.155 25.163 -1.230 168 H ILE 21 H ILE 21 0.079 17.817 1.989 169 HA ILE 21 HA ILE 21 0.728 18.509 4.729 170 HB ILE 21 HB ILE 21 -0.787 16.207 3.504 171 HG12 ILE 21 HG12 ILE 21 -1.870 18.581 5.085 172 HG13 ILE 21 HG13 ILE 21 -1.710 18.624 3.339 173 HG21 ILE 21 HG21 ILE 21 -0.061 15.336 5.584 174 HG22 ILE 21 HG22 ILE 21 -0.463 16.834 6.442 175 HG23 ILE 21 HG23 ILE 21 -1.742 15.803 5.795 176 HD11 ILE 21 HD11 ILE 21 -3.143 16.229 3.854 177 HD12 ILE 21 HD12 ILE 21 -3.846 17.488 4.897 178 HD13 ILE 21 HD13 ILE 21 -3.730 17.738 3.143 179 H VAL 22 H VAL 22 1.680 15.921 2.482 180 HA VAL 22 HA VAL 22 3.364 14.565 4.406 181 HB VAL 22 HB VAL 22 2.995 14.367 1.412 182 HG11 VAL 22 HG11 VAL 22 5.236 13.502 1.836 183 HG12 VAL 22 HG12 VAL 22 4.656 12.541 3.209 184 HG13 VAL 22 HG13 VAL 22 4.138 12.151 1.566 185 HG21 VAL 22 HG21 VAL 22 2.216 12.362 3.582 186 HG22 VAL 22 HG22 VAL 22 1.136 13.696 3.125 187 HG23 VAL 22 HG23 VAL 22 1.587 12.498 1.934 188 H GLU 23 H GLU 23 4.108 16.940 1.798 189 HA GLU 23 HA GLU 23 6.957 16.636 2.298 190 HB2 GLU 23 HB2 GLU 23 7.333 18.139 0.595 191 HB3 GLU 23 HB3 GLU 23 5.940 17.208 0.113 192 HG2 GLU 23 HG2 GLU 23 4.950 19.119 -0.414 193 HG3 GLU 23 HG3 GLU 23 4.709 19.366 1.306 194 H LYS 24 H LYS 24 4.507 18.745 3.629 195 HA LYS 24 HA LYS 24 6.566 20.242 5.219 196 HB2 LYS 24 HB2 LYS 24 3.574 20.675 4.956 197 HB3 LYS 24 HB3 LYS 24 4.674 21.703 5.859 198 HG2 LYS 24 HG2 LYS 24 4.685 21.256 2.850 199 HG3 LYS 24 HG3 LYS 24 4.021 22.651 3.705 200 HD2 LYS 24 HD2 LYS 24 6.466 22.922 4.685 201 HD3 LYS 24 HD3 LYS 24 6.920 21.835 3.366 202 HE2 LYS 24 HE2 LYS 24 7.219 23.979 2.430 203 HE3 LYS 24 HE3 LYS 24 5.661 23.439 1.800 204 HZ1 LYS 24 HZ1 LYS 24 4.866 24.730 4.000 205 HZ2 LYS 24 HZ2 LYS 24 6.238 25.567 3.721 206 HZ3 LYS 24 HZ3 LYS 24 5.077 25.508 2.578 207 H ARG 25 H ARG 25 4.833 17.442 5.521 208 HA ARG 25 HA ARG 25 4.118 16.088 7.222 209 HB2 ARG 25 HB2 ARG 25 6.332 17.429 8.805 210 HB3 ARG 25 HB3 ARG 25 5.595 15.873 9.161 211 HG2 ARG 25 HG2 ARG 25 6.938 14.774 7.705 212 HG3 ARG 25 HG3 ARG 25 6.563 15.883 6.401 213 HD2 ARG 25 HD2 ARG 25 8.849 16.138 6.644 214 HD3 ARG 25 HD3 ARG 25 8.176 17.547 7.478 215 HE ARG 25 HE ARG 25 8.559 15.374 9.337 216 HH11 ARG 25 HH11 ARG 25 10.490 17.740 7.607 217 HH12 ARG 25 HH12 ARG 25 11.833 17.578 8.712 218 HH21 ARG 25 HH21 ARG 25 10.318 15.199 10.680 219 HH22 ARG 25 HH22 ARG 25 11.733 16.178 10.399 220 H ILE 26 H ILE 26 2.317 17.874 6.937 221 HA ILE 26 HA ILE 26 1.880 19.662 9.205 222 HB ILE 26 HB ILE 26 -0.085 18.890 7.011 223 HG12 ILE 26 HG12 ILE 26 1.874 21.221 7.176 224 HG13 ILE 26 HG13 ILE 26 1.981 19.830 6.096 225 HG21 ILE 26 HG21 ILE 26 -1.166 19.882 9.017 226 HG22 ILE 26 HG22 ILE 26 -0.062 21.271 8.916 227 HG23 ILE 26 HG23 ILE 26 -1.260 20.961 7.640 228 HD11 ILE 26 HD11 ILE 26 -0.184 20.523 5.027 229 HD12 ILE 26 HD12 ILE 26 -0.093 22.030 5.973 230 HD13 ILE 26 HD13 ILE 26 1.173 21.635 4.794 231 H GLU 27 H GLU 27 1.057 19.130 11.110 232 HA GLU 27 HA GLU 27 -0.239 16.537 11.601 233 HB2 GLU 27 HB2 GLU 27 0.447 18.891 13.382 234 HB3 GLU 27 HB3 GLU 27 -0.601 17.566 13.918 235 HG2 GLU 27 HG2 GLU 27 1.163 15.921 13.328 236 HG3 GLU 27 HG3 GLU 27 2.253 17.249 12.907 237 H CYS 28 H CYS 28 -2.187 16.169 11.007 238 HA CYS 28 HA CYS 28 -4.371 18.037 11.682 239 HB2 CYS 28 HB2 CYS 28 -5.352 17.815 9.398 240 HB3 CYS 28 HB3 CYS 28 -3.800 18.643 9.405 241 HG CYS 28 HG CYS 28 -4.406 15.441 8.693 242 H THR 29 H THR 29 -6.535 16.991 11.131 243 HA THR 29 HA THR 29 -6.552 14.166 12.171 244 HB THR 29 HB THR 29 -8.794 16.153 12.440 245 HG1 THR 29 HG1 THR 29 -7.128 17.120 13.530 246 HG21 THR 29 HG21 THR 29 -9.288 13.747 12.974 247 HG22 THR 29 HG22 THR 29 -8.066 13.854 14.274 248 HG23 THR 29 HG23 THR 29 -9.520 14.859 14.331 249 H VAL 30 H VAL 30 -8.148 12.757 11.270 250 HA VAL 30 HA VAL 30 -9.249 13.598 8.598 251 HB VAL 30 HB VAL 30 -8.647 11.507 7.636 252 HG11 VAL 30 HG11 VAL 30 -6.897 13.286 7.677 253 HG12 VAL 30 HG12 VAL 30 -6.169 12.489 9.095 254 HG13 VAL 30 HG13 VAL 30 -6.268 11.634 7.546 255 HG21 VAL 30 HG21 VAL 30 -7.392 10.662 10.277 256 HG22 VAL 30 HG22 VAL 30 -8.878 9.982 9.577 257 HG23 VAL 30 HG23 VAL 30 -7.337 9.767 8.750 258 H TYR 31 H TYR 31 -10.773 11.704 7.795 259 HA TYR 31 HA TYR 31 -12.535 10.797 10.027 260 HB2 TYR 31 HB2 TYR 31 -13.405 11.693 7.258 261 HB3 TYR 31 HB3 TYR 31 -14.441 11.007 8.482 262 HD1 TYR 31 HD1 TYR 31 -12.435 14.008 7.553 263 HD2 TYR 31 HD2 TYR 31 -15.337 12.335 10.276 264 HE1 TYR 31 HE1 TYR 31 -13.007 16.300 8.362 265 HE2 TYR 31 HE2 TYR 31 -15.921 14.621 11.062 266 HH TYR 31 HH TYR 31 -15.546 16.858 10.818 267 H SER 32 H SER 32 -13.209 8.716 9.980 268 HA SER 32 HA SER 32 -12.847 6.883 7.717 269 HB2 SER 32 HB2 SER 32 -10.621 6.662 8.294 270 HB3 SER 32 HB3 SER 32 -10.880 7.215 9.944 271 HG SER 32 HG SER 32 -10.373 5.173 10.144 272 H VAL 33 H VAL 33 -13.835 4.757 8.248 273 HA VAL 33 HA VAL 33 -15.769 4.971 10.500 274 HB VAL 33 HB VAL 33 -16.924 3.047 9.677 275 HG11 VAL 33 HG11 VAL 33 -17.616 5.178 8.836 276 HG12 VAL 33 HG12 VAL 33 -16.418 5.095 7.500 277 HG13 VAL 33 HG13 VAL 33 -17.773 3.956 7.557 278 HG21 VAL 33 HG21 VAL 33 -14.850 2.987 7.484 279 HG22 VAL 33 HG22 VAL 33 -15.174 1.727 8.707 280 HG23 VAL 33 HG23 VAL 33 -16.379 2.066 7.461 281 H ASP 34 H ASP 34 -15.881 3.636 12.157 282 HA ASP 34 HA ASP 34 -13.541 2.051 12.952 283 HB2 ASP 34 HB2 ASP 34 -15.063 3.500 14.451 284 HB3 ASP 34 HB3 ASP 34 -16.250 2.203 14.261 285 H ASN 35 H ASN 35 -14.197 -0.086 14.081 286 HA ASN 35 HA ASN 35 -14.923 -2.072 12.085 287 HB2 ASN 35 HB2 ASN 35 -14.612 -2.333 15.114 288 HB3 ASN 35 HB3 ASN 35 -14.667 -3.667 13.962 289 HD21 ASN 35 HD22 ASN 35 -12.922 -3.426 12.090 290 HD22 ASN 35 HD21 ASN 35 -11.338 -2.922 12.660 291 H ASN 36 H ASN 36 -16.779 -0.159 14.250 292 HA ASN 36 HA ASN 36 -19.165 -1.916 14.206 293 HB2 ASN 36 HB2 ASN 36 -18.486 0.707 15.628 294 HB3 ASN 36 HB3 ASN 36 -20.018 -0.152 15.788 295 HD21 ASN 36 HD22 ASN 36 -16.663 -0.082 16.851 296 HD22 ASN 36 HD21 ASN 36 -16.869 -1.422 17.973 297 H GLY 37 H GLY 37 -17.913 0.238 11.987 298 HA2 GLY 37 HA2 GLY 37 -18.864 1.235 10.149 299 HA3 GLY 37 HA3 GLY 37 -20.456 0.650 10.649 300 H ASN 38 H ASN 38 -18.257 2.769 12.465 301 HA ASN 38 HA ASN 38 -20.216 5.049 12.315 302 HB2 ASN 38 HB2 ASN 38 -18.563 4.014 14.665 303 HB3 ASN 38 HB3 ASN 38 -19.275 5.622 14.621 304 HD21 ASN 38 HD22 ASN 38 -20.047 2.170 14.725 305 HD22 ASN 38 HD21 ASN 38 -21.711 2.400 15.214 306 H ILE 39 H ILE 39 -19.386 6.800 11.365 307 HA ILE 39 HA ILE 39 -16.624 7.120 10.624 308 HB ILE 39 HB ILE 39 -18.844 9.175 10.759 309 HG12 ILE 39 HG12 ILE 39 -17.865 7.611 8.322 310 HG13 ILE 39 HG13 ILE 39 -19.290 7.141 9.240 311 HG21 ILE 39 HG21 ILE 39 -17.494 10.599 9.434 312 HG22 ILE 39 HG22 ILE 39 -16.331 9.967 10.588 313 HG23 ILE 39 HG23 ILE 39 -16.392 9.292 8.955 314 HD11 ILE 39 HD11 ILE 39 -20.443 9.180 8.725 315 HD12 ILE 39 HD12 ILE 39 -19.014 9.858 7.925 316 HD13 ILE 39 HD13 ILE 39 -19.838 8.454 7.219 317 H TYR 40 H TYR 40 -15.053 7.529 12.005 318 HA TYR 40 HA TYR 40 -15.474 9.390 14.316 319 HB2 TYR 40 HB2 TYR 40 -13.992 8.171 15.658 320 HB3 TYR 40 HB3 TYR 40 -15.135 7.017 15.017 321 HD1 TYR 40 HD1 TYR 40 -14.397 5.446 13.141 322 HD2 TYR 40 HD2 TYR 40 -11.620 7.918 15.329 323 HE1 TYR 40 HE1 TYR 40 -12.522 3.960 12.460 324 HE2 TYR 40 HE2 TYR 40 -9.766 6.370 14.693 325 HH TYR 40 HH TYR 40 -10.346 3.392 12.774 326 H THR 41 H THR 41 -13.436 10.443 15.051 327 HA THR 41 HA THR 41 -11.735 11.224 12.733 328 HB THR 41 HB THR 41 -11.370 13.379 14.024 329 HG1 THR 41 HG1 THR 41 -12.281 12.695 16.001 330 HG21 THR 41 HG21 THR 41 -12.715 13.418 12.040 331 HG22 THR 41 HG22 THR 41 -14.126 12.760 12.904 332 HG23 THR 41 HG23 THR 41 -13.523 14.390 13.274 333 H GLN 42 H GLN 42 -9.588 11.246 12.892 334 HA GLN 42 HA GLN 42 -8.268 10.675 15.482 335 HB2 GLN 42 HB2 GLN 42 -7.133 8.716 14.604 336 HB3 GLN 42 HB3 GLN 42 -8.881 8.502 14.531 337 HG2 GLN 42 HG2 GLN 42 -8.727 9.220 12.049 338 HG3 GLN 42 HG3 GLN 42 -6.978 9.058 12.227 339 HE21 GLN 42 HE22 GLN 42 -6.652 6.640 13.658 340 HE22 GLN 42 HE21 GLN 42 -7.375 5.366 12.695 341 HA PRO 43 HA PRO 43 -5.258 13.376 13.513 342 HB2 PRO 43 HB2 PRO 43 -3.175 13.218 15.246 343 HB3 PRO 43 HB3 PRO 43 -4.705 14.067 15.628 344 HG2 PRO 43 HG2 PRO 43 -3.881 11.259 16.421 345 HG3 PRO 43 HG3 PRO 43 -4.604 12.541 17.448 346 HD2 PRO 43 HD2 PRO 43 -6.087 10.530 16.320 347 HD3 PRO 43 HD3 PRO 43 -6.741 12.179 16.563 348 H VAL 44 H VAL 44 -3.520 13.246 12.145 349 HA VAL 44 HA VAL 44 -2.564 10.758 11.093 350 HB VAL 44 HB VAL 44 -2.591 12.913 9.885 351 HG11 VAL 44 HG11 VAL 44 -1.725 14.383 11.743 352 HG12 VAL 44 HG12 VAL 44 -0.123 13.683 11.491 353 HG13 VAL 44 HG13 VAL 44 -0.899 14.599 10.183 354 HG21 VAL 44 HG21 VAL 44 0.233 11.802 10.009 355 HG22 VAL 44 HG22 VAL 44 -1.120 11.018 9.163 356 HG23 VAL 44 HG23 VAL 44 -0.555 12.620 8.654 357 H ALA 45 H ALA 45 -0.573 9.686 11.335 358 HA ALA 45 HA ALA 45 0.845 10.174 13.930 359 HB1 ALA 45 HB1 ALA 45 -0.516 8.081 13.722 360 HB2 ALA 45 HB2 ALA 45 0.529 7.581 12.369 361 HB3 ALA 45 HB3 ALA 45 1.211 7.791 13.993 362 H GLN 46 H GLN 46 1.348 9.278 10.495 363 HA GLN 46 HA GLN 46 4.076 10.435 10.548 364 HB2 GLN 46 HB2 GLN 46 3.449 7.624 9.521 365 HB3 GLN 46 HB3 GLN 46 4.942 8.495 9.252 366 HG2 GLN 46 HG2 GLN 46 5.571 7.146 10.927 367 HG3 GLN 46 HG3 GLN 46 5.205 8.631 11.800 368 HE21 GLN 46 HE22 GLN 46 3.247 5.758 10.651 369 HE22 GLN 46 HE21 GLN 46 2.577 5.437 12.245 370 H TRP 47 H TRP 47 4.967 10.277 8.168 371 HA TRP 47 HA TRP 47 2.858 10.754 6.116 372 HB2 TRP 47 HB2 TRP 47 5.224 12.587 6.672 373 HB3 TRP 47 HB3 TRP 47 4.066 12.744 5.368 374 HD1 TRP 47 HD1 TRP 47 1.879 14.059 5.857 375 HE1 TRP 47 HE1 TRP 47 0.895 15.297 7.878 376 HE3 TRP 47 HE3 TRP 47 5.225 12.546 9.432 377 HZ2 TRP 47 HZ2 TRP 47 1.416 15.477 10.697 378 HZ3 TRP 47 HZ3 TRP 47 4.914 13.232 11.802 379 HH2 TRP 47 HH2 TRP 47 2.987 14.683 12.442 380 H HIS 48 H HIS 48 3.305 9.526 4.349 381 HA HIS 48 HA HIS 48 6.110 8.594 3.903 382 HB2 HIS 48 HB2 HIS 48 3.571 7.144 3.099 383 HB3 HIS 48 HB3 HIS 48 5.217 6.557 3.028 384 HD1 HIS 48 HD1 HIS 48 6.318 5.786 5.435 385 HD2 HIS 48 HD2 HIS 48 2.248 6.859 5.385 386 HE1 HIS 48 HE1 HIS 48 5.316 4.896 7.604 387 H ASP 49 H ASP 49 6.972 8.768 1.940 388 HA ASP 49 HA ASP 49 5.392 9.964 -0.291 389 HB2 ASP 49 HB2 ASP 49 7.551 11.245 -0.810 390 HB3 ASP 49 HB3 ASP 49 6.472 11.827 0.438 391 H ARG 50 H ARG 50 5.435 8.886 -2.065 392 HA ARG 50 HA ARG 50 7.169 6.491 -2.382 393 HB2 ARG 50 HB2 ARG 50 4.945 7.546 -4.114 394 HB3 ARG 50 HB3 ARG 50 5.670 5.953 -4.169 395 HG2 ARG 50 HG2 ARG 50 3.977 7.101 -1.890 396 HG3 ARG 50 HG3 ARG 50 3.495 5.871 -3.035 397 HD2 ARG 50 HD2 ARG 50 5.654 5.553 -0.920 398 HD3 ARG 50 HD3 ARG 50 4.012 4.898 -0.875 399 HE ARG 50 HE ARG 50 5.685 4.103 -3.198 400 HH11 ARG 50 HH11 ARG 50 4.769 3.101 0.036 401 HH12 ARG 50 HH12 ARG 50 5.168 1.437 -0.301 402 HH21 ARG 50 HH21 ARG 50 5.923 2.017 -3.622 403 HH22 ARG 50 HH22 ARG 50 5.864 0.837 -2.330 404 H GLY 51 H GLY 51 6.765 9.643 -3.811 405 HA2 GLY 51 HA2 GLY 51 8.321 10.884 -5.032 406 HA3 GLY 51 HA3 GLY 51 9.304 9.447 -5.257 407 H GLU 52 H GLU 52 7.890 7.685 -6.670 408 HA GLU 52 HA GLU 52 6.730 8.917 -9.122 409 HB2 GLU 52 HB2 GLU 52 9.434 7.483 -9.141 410 HB3 GLU 52 HB3 GLU 52 8.479 8.021 -10.507 411 HG2 GLU 52 HG2 GLU 52 10.019 9.625 -10.419 412 HG3 GLU 52 HG3 GLU 52 8.702 10.386 -9.550 413 H GLN 53 H GLN 53 5.017 7.533 -8.833 414 HA GLN 53 HA GLN 53 5.533 4.763 -9.877 415 HB2 GLN 53 HB2 GLN 53 3.367 5.571 -7.912 416 HB3 GLN 53 HB3 GLN 53 3.715 3.925 -8.498 417 HG2 GLN 53 HG2 GLN 53 6.056 4.160 -7.532 418 HG3 GLN 53 HG3 GLN 53 5.532 5.700 -6.804 419 HE21 GLN 53 HE22 GLN 53 2.932 4.922 -5.773 420 HE22 GLN 53 HE21 GLN 53 3.739 4.565 -4.320 421 H GLU 54 H GLU 54 3.691 3.774 -11.024 422 HA GLU 54 HA GLU 54 2.768 5.471 -13.135 423 HB2 GLU 54 HB2 GLU 54 1.448 3.413 -13.809 424 HB3 GLU 54 HB3 GLU 54 3.200 3.300 -13.781 425 HG2 GLU 54 HG2 GLU 54 3.218 1.966 -11.806 426 HG3 GLU 54 HG3 GLU 54 1.538 2.322 -11.429 427 H VAL 55 H VAL 55 1.319 7.020 -12.858 428 HA VAL 55 HA VAL 55 -1.087 6.543 -11.148 429 HB VAL 55 HB VAL 55 -0.082 9.181 -12.277 430 HG11 VAL 55 HG11 VAL 55 -2.499 9.158 -11.644 431 HG12 VAL 55 HG12 VAL 55 -2.052 8.551 -10.033 432 HG13 VAL 55 HG13 VAL 55 -1.533 10.167 -10.569 433 HG21 VAL 55 HG21 VAL 55 0.427 7.791 -9.622 434 HG22 VAL 55 HG22 VAL 55 1.605 8.500 -10.746 435 HG23 VAL 55 HG23 VAL 55 0.547 9.552 -9.813 436 H PHE 56 H PHE 56 -3.080 6.520 -11.881 437 HA PHE 56 HA PHE 56 -3.644 7.201 -14.757 438 HB2 PHE 56 HB2 PHE 56 -4.848 5.029 -13.032 439 HB3 PHE 56 HB3 PHE 56 -5.433 5.481 -14.616 440 HD1 PHE 56 HD1 PHE 56 -2.368 4.172 -12.847 441 HD2 PHE 56 HD2 PHE 56 -4.626 4.360 -16.520 442 HE1 PHE 56 HE1 PHE 56 -0.787 2.585 -13.898 443 HE2 PHE 56 HE2 PHE 56 -3.066 2.719 -17.548 444 HZ PHE 56 HZ PHE 56 -1.109 1.883 -16.263 445 H GLU 57 H GLU 57 -5.372 8.433 -15.193 446 HA GLU 57 HA GLU 57 -6.827 9.786 -13.044 447 HB2 GLU 57 HB2 GLU 57 -5.835 10.878 -15.065 448 HB3 GLU 57 HB3 GLU 57 -7.030 10.108 -16.069 449 HG2 GLU 57 HG2 GLU 57 -8.776 11.389 -15.162 450 HG3 GLU 57 HG3 GLU 57 -7.895 11.738 -13.665 451 H TYR 58 H TYR 58 -8.244 8.329 -12.151 452 HA TYR 58 HA TYR 58 -10.135 6.784 -13.807 453 HB2 TYR 58 HB2 TYR 58 -10.254 7.214 -10.812 454 HB3 TYR 58 HB3 TYR 58 -10.980 5.926 -11.751 455 HD1 TYR 58 HD2 TYR 58 -9.338 4.274 -12.997 456 HD2 TYR 58 HD1 TYR 58 -8.133 6.990 -9.866 457 HE1 TYR 58 HE2 TYR 58 -7.219 2.976 -12.663 458 HE2 TYR 58 HE1 TYR 58 -6.037 5.714 -9.575 459 HH TYR 58 HH TYR 58 -4.701 4.139 -10.413 460 H CYS 59 H CYS 59 -11.656 7.869 -14.849 461 HA CYS 59 HA CYS 59 -12.857 10.351 -13.755 462 HB2 CYS 59 HB2 CYS 59 -12.108 10.253 -16.128 463 HB3 CYS 59 HB3 CYS 59 -13.214 8.899 -16.409 464 HG CYS 59 HG CYS 59 -15.426 10.232 -15.699 465 H LEU 60 H LEU 60 -14.804 10.394 -12.821 466 HA LEU 60 HA LEU 60 -16.349 7.911 -12.475 467 HB2 LEU 60 HB2 LEU 60 -15.672 10.132 -10.897 468 HB3 LEU 60 HB3 LEU 60 -17.327 10.463 -11.325 469 HG LEU 60 HG LEU 60 -17.986 8.261 -10.357 470 HD11 LEU 60 HD11 LEU 60 -15.867 6.989 -10.650 471 HD12 LEU 60 HD12 LEU 60 -15.063 8.067 -9.499 472 HD13 LEU 60 HD13 LEU 60 -16.395 6.996 -8.980 473 HD21 LEU 60 HD21 LEU 60 -16.271 10.009 -8.524 474 HD22 LEU 60 HD22 LEU 60 -17.897 10.431 -9.061 475 HD23 LEU 60 HD23 LEU 60 -17.662 9.011 -8.036 476 H GLU 61 H GLU 61 -18.758 8.058 -12.492 477 HA GLU 61 HA GLU 61 -19.745 8.805 -15.094 478 HB2 GLU 61 HB2 GLU 61 -21.338 8.136 -12.585 479 HB3 GLU 61 HB3 GLU 61 -21.946 8.165 -14.243 480 HG2 GLU 61 HG2 GLU 61 -20.207 6.377 -14.796 481 HG3 GLU 61 HG3 GLU 61 -19.931 6.227 -13.058 482 H ASP 62 H ASP 62 -19.606 10.570 -12.119 483 HA ASP 62 HA ASP 62 -21.525 12.680 -12.847 484 HB2 ASP 62 HB2 ASP 62 -21.257 12.065 -10.530 485 HB3 ASP 62 HB3 ASP 62 -19.508 12.300 -10.602 486 H GLY 63 H GLY 63 -18.083 12.108 -13.298 487 HA2 GLY 63 HA2 GLY 63 -16.799 13.456 -14.846 488 HA3 GLY 63 HA3 GLY 63 -17.682 14.895 -14.335 489 H SER 64 H SER 64 -17.029 13.182 -11.527 490 HA SER 64 HA SER 64 -14.793 14.834 -10.669 491 HB2 SER 64 HB2 SER 64 -16.034 12.301 -9.519 492 HB3 SER 64 HB3 SER 64 -14.674 13.157 -8.774 493 HG SER 64 HG SER 64 -17.236 14.278 -9.333 494 H LEU 65 H LEU 65 -12.647 14.384 -10.595 495 HA LEU 65 HA LEU 65 -11.625 11.929 -11.987 496 HB2 LEU 65 HB2 LEU 65 -11.025 14.851 -12.285 497 HB3 LEU 65 HB3 LEU 65 -9.638 13.774 -12.261 498 HG LEU 65 HG LEU 65 -10.422 12.523 -14.149 499 HD11 LEU 65 HD11 LEU 65 -12.823 12.560 -13.933 500 HD12 LEU 65 HD12 LEU 65 -12.859 14.323 -14.157 501 HD13 LEU 65 HD13 LEU 65 -12.380 13.248 -15.491 502 HD21 LEU 65 HD21 LEU 65 -10.741 15.501 -14.718 503 HD22 LEU 65 HD22 LEU 65 -9.182 14.700 -14.460 504 HD23 LEU 65 HD23 LEU 65 -10.188 14.242 -15.846 505 H ILE 66 H ILE 66 -10.024 10.851 -11.122 506 HA ILE 66 HA ILE 66 -8.855 11.639 -8.477 507 HB ILE 66 HB ILE 66 -10.087 8.959 -9.247 508 HG12 ILE 66 HG12 ILE 66 -11.002 10.916 -7.090 509 HG13 ILE 66 HG13 ILE 66 -11.750 10.787 -8.683 510 HG21 ILE 66 HG21 ILE 66 -8.100 8.639 -7.794 511 HG22 ILE 66 HG22 ILE 66 -8.759 9.808 -6.627 512 HG23 ILE 66 HG23 ILE 66 -9.562 8.254 -6.921 513 HD11 ILE 66 HD11 ILE 66 -12.277 8.399 -8.262 514 HD12 ILE 66 HD12 ILE 66 -11.730 8.627 -6.579 515 HD13 ILE 66 HD13 ILE 66 -13.090 9.571 -7.208 516 H ARG 67 H ARG 67 -6.714 11.156 -8.267 517 HA ARG 67 HA ARG 67 -5.373 9.643 -10.485 518 HB2 ARG 67 HB2 ARG 67 -4.562 12.150 -9.021 519 HB3 ARG 67 HB3 ARG 67 -3.503 11.238 -10.111 520 HG2 ARG 67 HG2 ARG 67 -5.277 11.631 -11.899 521 HG3 ARG 67 HG3 ARG 67 -6.055 12.762 -10.780 522 HD2 ARG 67 HD2 ARG 67 -4.079 14.151 -10.649 523 HD3 ARG 67 HD3 ARG 67 -3.109 12.962 -11.538 524 HE ARG 67 HE ARG 67 -5.283 13.668 -13.220 525 HH11 ARG 67 HH11 ARG 67 -2.307 15.145 -12.049 526 HH12 ARG 67 HH12 ARG 67 -2.282 16.287 -13.370 527 HH21 ARG 67 HH21 ARG 67 -5.200 15.018 -14.764 528 HH22 ARG 67 HH22 ARG 67 -3.906 16.217 -14.942 529 H ALA 68 H ALA 68 -4.946 7.750 -9.652 530 HA ALA 68 HA ALA 68 -3.140 7.578 -7.322 531 HB1 ALA 68 HB1 ALA 68 -5.448 7.381 -6.381 532 HB2 ALA 68 HB2 ALA 68 -5.750 5.980 -7.425 533 HB3 ALA 68 HB3 ALA 68 -4.500 5.897 -6.177 534 H THR 69 H THR 69 -2.278 5.399 -7.038 535 HA THR 69 HA THR 69 -1.463 4.161 -9.573 536 HB THR 69 HB THR 69 -0.217 2.627 -7.939 537 HG1 THR 69 HG1 THR 69 -1.785 3.249 -6.225 538 HG21 THR 69 HG21 THR 69 0.963 4.457 -8.914 539 HG22 THR 69 HG22 THR 69 0.185 5.644 -7.852 540 HG23 THR 69 HG23 THR 69 1.332 4.455 -7.176 541 H LYS 70 H LYS 70 -1.844 2.053 -10.162 542 HA LYS 70 HA LYS 70 -4.427 0.932 -9.630 543 HB2 LYS 70 HB2 LYS 70 -1.920 -0.076 -11.036 544 HB3 LYS 70 HB3 LYS 70 -3.339 -1.103 -10.869 545 HG2 LYS 70 HG2 LYS 70 -4.744 0.542 -12.031 546 HG3 LYS 70 HG3 LYS 70 -3.352 1.631 -12.216 547 HD2 LYS 70 HD2 LYS 70 -2.179 0.003 -13.591 548 HD3 LYS 70 HD3 LYS 70 -3.420 -1.229 -13.282 549 HE2 LYS 70 HE2 LYS 70 -5.108 0.152 -14.428 550 HE3 LYS 70 HE3 LYS 70 -3.899 1.412 -14.725 551 HZ1 LYS 70 HZ1 LYS 70 -2.640 -0.242 -16.042 552 HZ2 LYS 70 HZ2 LYS 70 -3.801 -1.368 -15.796 553 HZ3 LYS 70 HZ3 LYS 70 -4.132 -0.024 -16.674 554 H ASP 71 H ASP 71 -1.671 0.726 -7.723 555 HA ASP 71 HA ASP 71 -2.181 -1.946 -6.573 556 HB2 ASP 71 HB2 ASP 71 -0.073 0.214 -6.102 557 HB3 ASP 71 HB3 ASP 71 -0.113 -1.342 -5.266 558 H HIS 72 H HIS 72 -3.196 1.318 -5.989 559 HA HIS 72 HA HIS 72 -3.287 1.078 -3.059 560 HB2 HIS 72 HB2 HIS 72 -2.995 3.236 -4.384 561 HB3 HIS 72 HB3 HIS 72 -4.683 3.123 -4.843 562 HD1 HIS 72 HD1 HIS 72 -5.850 2.349 -1.813 563 HD2 HIS 72 HD2 HIS 72 -2.989 5.244 -2.809 564 HE1 HIS 72 HE1 HIS 72 -5.571 3.806 0.224 565 H LYS 73 H LYS 73 -5.129 0.307 -1.932 566 HA LYS 73 HA LYS 73 -7.435 -0.715 -3.485 567 HB2 LYS 73 HB2 LYS 73 -6.751 -0.978 -0.537 568 HB3 LYS 73 HB3 LYS 73 -8.100 -1.754 -1.334 569 HG2 LYS 73 HG2 LYS 73 -6.786 -3.317 -2.416 570 HG3 LYS 73 HG3 LYS 73 -5.381 -2.257 -2.529 571 HD2 LYS 73 HD2 LYS 73 -5.053 -2.481 -0.041 572 HD3 LYS 73 HD3 LYS 73 -6.334 -3.714 -0.034 573 HE2 LYS 73 HE2 LYS 73 -5.035 -5.045 -1.690 574 HE3 LYS 73 HE3 LYS 73 -3.785 -3.788 -1.718 575 HZ1 LYS 73 HZ1 LYS 73 -3.338 -4.247 0.624 576 HZ2 LYS 73 HZ2 LYS 73 -4.525 -5.374 0.692 577 HZ3 LYS 73 HZ3 LYS 73 -3.199 -5.632 -0.226 578 H PHE 74 H PHE 74 -9.643 -0.306 -2.837 579 HA PHE 74 HA PHE 74 -10.110 2.209 -1.301 580 HB2 PHE 74 HB2 PHE 74 -11.132 1.654 -4.105 581 HB3 PHE 74 HB3 PHE 74 -11.769 2.887 -3.035 582 HD1 PHE 74 HD1 PHE 74 -8.617 1.869 -4.836 583 HD2 PHE 74 HD2 PHE 74 -10.878 5.058 -3.004 584 HE1 PHE 74 HE1 PHE 74 -7.020 3.527 -5.744 585 HE2 PHE 74 HE2 PHE 74 -9.296 6.715 -3.956 586 HZ PHE 74 HZ PHE 74 -7.357 5.954 -5.310 587 H MET 75 H MET 75 -12.005 2.289 -0.178 588 HA MET 75 HA MET 75 -13.098 -0.296 0.544 589 HB2 MET 75 HB2 MET 75 -12.593 1.551 2.162 590 HB3 MET 75 HB3 MET 75 -13.949 2.455 1.473 591 HG2 MET 75 HG2 MET 75 -15.436 0.482 2.000 592 HG3 MET 75 HG3 MET 75 -14.081 -0.247 2.862 593 HE1 MET 75 HE1 MET 75 -13.532 0.237 5.304 594 HE2 MET 75 HE2 MET 75 -12.717 1.681 4.650 595 HE3 MET 75 HE3 MET 75 -13.785 1.829 6.063 596 H THR 76 H THR 76 -14.555 -1.273 -0.763 597 HA THR 76 HA THR 76 -16.467 0.130 -2.424 598 HB THR 76 HB THR 76 -17.468 -1.971 -2.913 599 HG1 THR 76 HG1 THR 76 -16.809 -3.824 -1.834 600 HG21 THR 76 HG21 THR 76 -15.316 -1.400 -3.957 601 HG22 THR 76 HG22 THR 76 -14.465 -2.342 -2.713 602 HG23 THR 76 HG23 THR 76 -15.589 -3.148 -3.838 603 H VAL 77 H VAL 77 -18.861 -0.416 -2.329 604 HA VAL 77 HA VAL 77 -20.014 0.781 -0.086 605 HB VAL 77 HB VAL 77 -22.193 0.027 -0.937 606 HG11 VAL 77 HG11 VAL 77 -20.982 1.931 -1.993 607 HG12 VAL 77 HG12 VAL 77 -20.345 0.814 -3.216 608 HG13 VAL 77 HG13 VAL 77 -22.092 1.099 -3.098 609 HG21 VAL 77 HG21 VAL 77 -20.593 -1.702 -2.886 610 HG22 VAL 77 HG22 VAL 77 -21.693 -2.279 -1.617 611 HG23 VAL 77 HG23 VAL 77 -22.332 -1.365 -2.988 612 H ASP 78 H ASP 78 -19.101 -2.541 -0.413 613 HA ASP 78 HA ASP 78 -20.654 -3.401 1.970 614 HB2 ASP 78 HB2 ASP 78 -20.617 -4.711 -0.177 615 HB3 ASP 78 HB3 ASP 78 -18.891 -4.978 0.061 616 H GLY 79 H GLY 79 -17.619 -2.036 1.362 617 HA2 GLY 79 HA2 GLY 79 -16.143 -1.479 3.112 618 HA3 GLY 79 HA3 GLY 79 -16.560 -2.943 3.989 619 H GLN 80 H GLN 80 -15.960 -3.798 0.746 620 HA GLN 80 HA GLN 80 -13.613 -5.309 1.457 621 HB2 GLN 80 HB2 GLN 80 -14.691 -4.623 -1.311 622 HB3 GLN 80 HB3 GLN 80 -13.541 -5.891 -0.930 623 HG2 GLN 80 HG2 GLN 80 -16.393 -5.865 0.158 624 HG3 GLN 80 HG3 GLN 80 -15.904 -6.661 -1.330 625 HE21 GLN 80 HE22 GLN 80 -14.361 -8.472 -1.212 626 HE22 GLN 80 HE21 GLN 80 -14.194 -9.355 0.301 627 H MET 81 H MET 81 -11.473 -4.918 1.145 628 HA MET 81 HA MET 81 -10.619 -2.314 -0.015 629 HB2 MET 81 HB2 MET 81 -8.488 -2.688 1.116 630 HB3 MET 81 HB3 MET 81 -9.853 -2.524 2.200 631 HG2 MET 81 HG2 MET 81 -8.641 -5.214 1.450 632 HG3 MET 81 HG3 MET 81 -8.085 -4.235 2.790 633 HE1 MET 81 HE1 MET 81 -9.213 -3.903 5.010 634 HE2 MET 81 HE2 MET 81 -10.634 -3.125 4.272 635 HE3 MET 81 HE3 MET 81 -10.850 -4.445 5.439 636 H LEU 82 H LEU 82 -11.071 -3.031 -2.152 637 HA LEU 82 HA LEU 82 -9.138 -5.011 -3.292 638 HB2 LEU 82 HB2 LEU 82 -11.563 -3.794 -4.647 639 HB3 LEU 82 HB3 LEU 82 -10.602 -5.159 -5.192 640 HG LEU 82 HG LEU 82 -12.459 -5.078 -2.794 641 HD11 LEU 82 HD11 LEU 82 -13.554 -5.215 -5.008 642 HD12 LEU 82 HD12 LEU 82 -12.607 -6.675 -5.375 643 HD13 LEU 82 HD13 LEU 82 -13.793 -6.685 -4.049 644 HD21 LEU 82 HD21 LEU 82 -10.767 -7.405 -3.791 645 HD22 LEU 82 HD22 LEU 82 -10.583 -6.567 -2.235 646 HD23 LEU 82 HD23 LEU 82 -12.040 -7.511 -2.556 647 HA PRO 83 HA PRO 83 -6.927 -1.609 -5.233 648 HB2 PRO 83 HB2 PRO 83 -5.935 -2.798 -7.493 649 HB3 PRO 83 HB3 PRO 83 -5.262 -3.045 -5.858 650 HG2 PRO 83 HG2 PRO 83 -7.231 -4.783 -7.381 651 HG3 PRO 83 HG3 PRO 83 -5.779 -5.300 -6.465 652 HD2 PRO 83 HD2 PRO 83 -8.296 -5.443 -5.422 653 HD3 PRO 83 HD3 PRO 83 -6.892 -5.026 -4.396 654 H ILE 84 H ILE 84 -7.345 -0.011 -6.754 655 HA ILE 84 HA ILE 84 -9.910 0.145 -7.914 656 HB ILE 84 HB ILE 84 -8.523 2.018 -7.283 657 HG12 ILE 84 HG12 ILE 84 -8.891 2.800 -10.088 658 HG13 ILE 84 HG13 ILE 84 -10.268 1.891 -9.492 659 HG21 ILE 84 HG21 ILE 84 -6.323 1.249 -8.086 660 HG22 ILE 84 HG22 ILE 84 -6.853 1.493 -9.766 661 HG23 ILE 84 HG23 ILE 84 -6.713 2.870 -8.651 662 HD11 ILE 84 HD11 ILE 84 -10.596 3.391 -7.645 663 HD12 ILE 84 HD12 ILE 84 -9.120 4.306 -8.061 664 HD13 ILE 84 HD13 ILE 84 -10.518 4.326 -9.156 665 H ASP 85 H ASP 85 -7.030 -1.235 -9.273 666 HA ASP 85 HA ASP 85 -7.769 -1.457 -12.031 667 HB2 ASP 85 HB2 ASP 85 -5.506 -1.851 -11.141 668 HB3 ASP 85 HB3 ASP 85 -6.079 -3.271 -10.263 669 H GLU 86 H GLU 86 -8.809 -3.275 -9.192 670 HA GLU 86 HA GLU 86 -10.158 -5.370 -10.812 671 HB2 GLU 86 HB2 GLU 86 -8.861 -5.998 -8.816 672 HB3 GLU 86 HB3 GLU 86 -9.900 -4.991 -7.795 673 HG2 GLU 86 HG2 GLU 86 -11.782 -6.403 -8.149 674 HG3 GLU 86 HG3 GLU 86 -11.002 -7.217 -9.521 675 H ILE 87 H ILE 87 -10.944 -2.644 -8.598 676 HA ILE 87 HA ILE 87 -13.756 -2.895 -8.592 677 HB ILE 87 HB ILE 87 -12.084 -0.348 -8.474 678 HG12 ILE 87 HG12 ILE 87 -13.152 -2.042 -6.181 679 HG13 ILE 87 HG13 ILE 87 -11.506 -2.208 -6.781 680 HG21 ILE 87 HG21 ILE 87 -14.520 0.103 -8.835 681 HG22 ILE 87 HG22 ILE 87 -14.907 -0.919 -7.445 682 HG23 ILE 87 HG23 ILE 87 -14.033 0.602 -7.232 683 HD11 ILE 87 HD11 ILE 87 -10.742 -0.304 -5.849 684 HD12 ILE 87 HD12 ILE 87 -12.262 0.564 -6.004 685 HD13 ILE 87 HD13 ILE 87 -12.062 -0.644 -4.715 686 H PHE 88 H PHE 88 -11.665 -1.190 -10.931 687 HA PHE 88 HA PHE 88 -13.695 -0.085 -12.592 688 HB2 PHE 88 HB2 PHE 88 -11.374 0.596 -12.702 689 HB3 PHE 88 HB3 PHE 88 -10.863 -1.026 -13.146 690 HD1 PHE 88 HD2 PHE 88 -13.268 1.612 -14.410 691 HD2 PHE 88 HD1 PHE 88 -10.351 -1.403 -15.390 692 HE1 PHE 88 HE2 PHE 88 -13.423 2.252 -16.799 693 HE2 PHE 88 HE1 PHE 88 -10.501 -0.759 -17.788 694 HZ PHE 88 HZ PHE 88 -12.033 1.072 -18.495 695 H GLU 89 H GLU 89 -12.410 -3.399 -12.493 696 HA GLU 89 HA GLU 89 -13.749 -4.227 -14.982 697 HB2 GLU 89 HB2 GLU 89 -12.203 -5.674 -12.808 698 HB3 GLU 89 HB3 GLU 89 -13.140 -6.551 -14.011 699 HG2 GLU 89 HG2 GLU 89 -11.859 -5.231 -15.793 700 HG3 GLU 89 HG3 GLU 89 -10.774 -4.705 -14.501 701 H ARG 90 H ARG 90 -14.348 -4.910 -11.439 702 HA ARG 90 HA ARG 90 -16.860 -6.238 -11.987 703 HB2 ARG 90 HB2 ARG 90 -15.704 -5.012 -9.437 704 HB3 ARG 90 HB3 ARG 90 -17.239 -5.873 -9.539 705 HG2 ARG 90 HG2 ARG 90 -15.980 -7.569 -8.878 706 HG3 ARG 90 HG3 ARG 90 -15.875 -7.817 -10.616 707 HD2 ARG 90 HD2 ARG 90 -13.741 -6.165 -9.320 708 HD3 ARG 90 HD3 ARG 90 -13.785 -7.848 -8.853 709 HE ARG 90 HE ARG 90 -12.818 -6.801 -11.345 710 HH11 ARG 90 HH11 ARG 90 -14.326 -9.661 -9.984 711 HH12 ARG 90 HH12 ARG 90 -13.546 -10.731 -11.119 712 HH21 ARG 90 HH21 ARG 90 -11.788 -8.285 -12.771 713 HH22 ARG 90 HH22 ARG 90 -12.221 -9.961 -12.645 714 H GLU 91 H GLU 91 -16.082 -2.908 -12.044 715 HA GLU 91 HA GLU 91 -17.243 -1.010 -12.185 716 HB2 GLU 91 HB2 GLU 91 -19.675 -2.632 -13.003 717 HB3 GLU 91 HB3 GLU 91 -19.325 -0.933 -13.336 718 HG2 GLU 91 HG2 GLU 91 -17.278 -1.720 -14.636 719 HG3 GLU 91 HG3 GLU 91 -17.917 -3.365 -14.495 720 H LEU 92 H LEU 92 -16.966 -2.130 -9.642 721 HA LEU 92 HA LEU 92 -19.513 -1.780 -8.187 722 HB2 LEU 92 HB2 LEU 92 -16.663 -2.439 -7.362 723 HB3 LEU 92 HB3 LEU 92 -17.914 -2.081 -6.175 724 HG LEU 92 HG LEU 92 -18.148 -4.280 -8.261 725 HD11 LEU 92 HD11 LEU 92 -16.297 -4.723 -6.697 726 HD12 LEU 92 HD12 LEU 92 -17.399 -4.486 -5.319 727 HD13 LEU 92 HD13 LEU 92 -17.645 -5.843 -6.445 728 HD21 LEU 92 HD21 LEU 92 -19.800 -4.887 -6.068 729 HD22 LEU 92 HD22 LEU 92 -20.044 -3.154 -6.306 730 HD23 LEU 92 HD23 LEU 92 -20.314 -4.281 -7.647 731 H ASP 93 H ASP 93 -19.983 -0.183 -6.761 732 HA ASP 93 HA ASP 93 -18.662 2.430 -7.130 733 HB2 ASP 93 HB2 ASP 93 -20.858 1.930 -5.148 734 HB3 ASP 93 HB3 ASP 93 -20.485 3.376 -6.068 735 H LEU 94 H LEU 94 -18.346 3.720 -5.014 736 HA LEU 94 HA LEU 94 -16.969 2.057 -2.935 737 HB2 LEU 94 HB2 LEU 94 -16.248 4.762 -4.092 738 HB3 LEU 94 HB3 LEU 94 -15.489 4.071 -2.651 739 HG LEU 94 HG LEU 94 -15.403 2.824 -5.446 740 HD11 LEU 94 HD11 LEU 94 -14.097 4.798 -5.395 741 HD12 LEU 94 HD12 LEU 94 -13.360 4.394 -3.833 742 HD13 LEU 94 HD13 LEU 94 -12.973 3.454 -5.299 743 HD21 LEU 94 HD21 LEU 94 -14.004 2.036 -2.863 744 HD22 LEU 94 HD22 LEU 94 -15.178 1.066 -3.793 745 HD23 LEU 94 HD23 LEU 94 -13.602 1.405 -4.465 746 H MET 95 H MET 95 -16.930 2.878 -0.801 747 HA MET 95 HA MET 95 -19.499 3.692 0.151 748 HB2 MET 95 HB2 MET 95 -17.739 2.352 1.359 749 HB3 MET 95 HB3 MET 95 -16.860 3.849 1.673 750 HG2 MET 95 HG2 MET 95 -18.714 4.733 2.965 751 HG3 MET 95 HG3 MET 95 -19.775 3.416 2.458 752 HE1 MET 95 HE1 MET 95 -19.640 0.951 3.326 753 HE2 MET 95 HE2 MET 95 -17.911 0.776 2.937 754 HE3 MET 95 HE3 MET 95 -18.495 0.384 4.562 755 H ARG 96 H ARG 96 -20.021 5.635 1.439 756 HA ARG 96 HA ARG 96 -18.800 8.174 0.399 757 HB2 ARG 96 HB2 ARG 96 -21.753 7.600 0.842 758 HB3 ARG 96 HB3 ARG 96 -21.073 9.093 0.208 759 HG2 ARG 96 HG2 ARG 96 -20.895 6.418 -1.240 760 HG3 ARG 96 HG3 ARG 96 -22.215 7.547 -1.430 761 HD2 ARG 96 HD2 ARG 96 -20.851 7.957 -3.259 762 HD3 ARG 96 HD3 ARG 96 -20.475 9.290 -2.156 763 HE ARG 96 HE ARG 96 -18.597 7.393 -1.494 764 HH11 ARG 96 HH11 ARG 96 -19.353 8.821 -4.615 765 HH12 ARG 96 HH12 ARG 96 -17.774 8.414 -5.239 766 HH21 ARG 96 HH21 ARG 96 -16.744 6.918 -2.303 767 HH22 ARG 96 HH22 ARG 96 -16.268 7.425 -3.928 768 H VAL 97 H VAL 97 -19.238 10.044 1.642 769 HA VAL 97 HA VAL 97 -19.733 9.594 4.567 770 HB VAL 97 HB VAL 97 -17.321 9.797 3.718 771 HG11 VAL 97 HG11 VAL 97 -17.761 11.859 2.303 772 HG12 VAL 97 HG12 VAL 97 -17.867 12.782 3.810 773 HG13 VAL 97 HG13 VAL 97 -16.360 11.948 3.389 774 HG21 VAL 97 HG21 VAL 97 -18.291 11.552 5.994 775 HG22 VAL 97 HG22 VAL 97 -17.804 9.836 6.055 776 HG23 VAL 97 HG23 VAL 97 -16.600 11.082 5.711 777 H ASP 98 H ASP 98 -20.196 11.763 1.854 778 HA ASP 98 HA ASP 98 -21.617 13.763 3.548 779 HB2 ASP 98 HB2 ASP 98 -20.370 13.860 0.781 780 HB3 ASP 98 HB3 ASP 98 -21.387 15.153 1.405 781 H ASN 99 H ASN 99 -22.601 11.050 2.399 782 HA ASN 99 HA ASN 99 -24.452 10.116 1.471 783 HB2 ASN 99 HB2 ASN 99 -25.705 12.597 2.688 784 HB3 ASN 99 HB3 ASN 99 -26.660 11.318 1.919 785 HD21 ASN 99 HD22 ASN 99 -24.041 11.730 4.273 786 HD22 ASN 99 HD21 ASN 99 -24.104 10.082 4.749 787 H LEU 100 H LEU 100 -22.777 11.287 -0.115 788 HA LEU 100 HA LEU 100 -24.041 12.464 -2.501 789 HB2 LEU 100 HB2 LEU 100 -21.328 11.300 -1.813 790 HB3 LEU 100 HB3 LEU 100 -21.698 11.679 -3.476 791 HG LEU 100 HG LEU 100 -21.929 13.748 -1.247 792 HD11 LEU 100 HD11 LEU 100 -19.610 12.914 -1.389 793 HD12 LEU 100 HD12 LEU 100 -19.611 13.210 -3.140 794 HD13 LEU 100 HD13 LEU 100 -19.734 14.573 -2.001 795 HD21 LEU 100 HD21 LEU 100 -21.680 14.007 -4.283 796 HD22 LEU 100 HD22 LEU 100 -23.152 14.315 -3.337 797 HD23 LEU 100 HD23 LEU 100 -21.737 15.353 -3.127 798 HA PRO 101 HA PRO 101 -25.409 8.704 -4.423 799 HB2 PRO 101 HB2 PRO 101 -24.925 9.114 -7.100 800 HB3 PRO 101 HB3 PRO 101 -26.202 9.958 -6.173 801 HG2 PRO 101 HG2 PRO 101 -23.440 10.968 -6.886 802 HG3 PRO 101 HG3 PRO 101 -25.006 11.831 -7.003 803 HD2 PRO 101 HD2 PRO 101 -23.292 12.159 -4.896 804 HD3 PRO 101 HD3 PRO 101 -25.056 12.233 -4.675 805 H ASN 102 H ASN 102 -24.584 6.695 -4.616 806 HA ASN 102 HA ASN 102 -21.714 6.168 -4.792 807 HB2 ASN 102 HB2 ASN 102 -24.146 4.319 -4.919 808 HB3 ASN 102 HB3 ASN 102 -22.477 3.789 -4.791 809 HD21 ASN 102 HD22 ASN 102 -21.274 4.245 -2.758 810 HD22 ASN 102 HD21 ASN 102 -22.248 4.448 -1.312 811 H ILE 103 H ILE 103 -20.568 6.040 -6.654 812 HA ILE 103 HA ILE 103 -21.757 4.930 -9.109 813 HB ILE 103 HB ILE 103 -20.700 6.831 -10.455 814 HG12 ILE 103 HG12 ILE 103 -21.129 8.391 -7.866 815 HG13 ILE 103 HG13 ILE 103 -19.562 7.942 -8.528 816 HG21 ILE 103 HG21 ILE 103 -23.166 6.328 -10.200 817 HG22 ILE 103 HG22 ILE 103 -23.224 7.571 -8.931 818 HG23 ILE 103 HG23 ILE 103 -22.782 7.998 -10.595 819 HD11 ILE 103 HD11 ILE 103 -20.041 9.304 -10.554 820 HD12 ILE 103 HD12 ILE 103 -21.613 9.769 -9.860 821 HD13 ILE 103 HD13 ILE 103 -20.126 10.267 -9.062 822 H LYS 104 H LYS 104 -20.398 3.934 -10.405 823 HA LYS 104 HA LYS 104 -17.733 3.246 -9.417 824 HB2 LYS 104 HB2 LYS 104 -17.808 1.513 -11.164 825 HB3 LYS 104 HB3 LYS 104 -19.212 1.525 -10.125 826 HG2 LYS 104 HG2 LYS 104 -20.170 1.106 -12.150 827 HG3 LYS 104 HG3 LYS 104 -20.420 2.841 -12.019 828 HD2 LYS 104 HD2 LYS 104 -18.380 3.168 -13.457 829 HD3 LYS 104 HD3 LYS 104 -18.268 1.411 -13.660 830 HE2 LYS 104 HE2 LYS 104 -20.687 3.143 -14.401 831 HE3 LYS 104 HE3 LYS 104 -19.395 2.742 -15.534 832 HZ1 LYS 104 HZ1 LYS 104 -19.976 0.409 -15.334 833 HZ2 LYS 104 HZ2 LYS 104 -21.148 0.726 -14.222 834 HZ3 LYS 104 HZ3 LYS 104 -21.299 1.253 -15.756 835 H ILE 105 H ILE 105 -15.964 2.911 -11.071 836 HA ILE 105 HA ILE 105 -15.159 5.451 -12.241 837 HB ILE 105 HB ILE 105 -13.935 2.686 -12.611 838 HG12 ILE 105 HG12 ILE 105 -12.208 4.033 -10.948 839 HG13 ILE 105 HG13 ILE 105 -13.749 4.638 -10.356 840 HG21 ILE 105 HG21 ILE 105 -13.220 4.254 -14.354 841 HG22 ILE 105 HG22 ILE 105 -12.850 5.488 -13.136 842 HG23 ILE 105 HG23 ILE 105 -11.897 3.986 -13.229 843 HD11 ILE 105 HD11 ILE 105 -14.491 2.231 -10.058 844 HD12 ILE 105 HD12 ILE 105 -12.884 1.713 -10.615 845 HD13 ILE 105 HD13 ILE 105 -13.048 2.642 -9.112 846 H ALA 106 H ALA 106 -16.075 6.232 -14.031 847 HA ALA 106 HA ALA 106 -17.620 4.648 -15.903 848 HB1 ALA 106 HB1 ALA 106 -18.106 7.016 -15.240 849 HB2 ALA 106 HB2 ALA 106 -16.637 7.542 -16.069 850 HB3 ALA 106 HB3 ALA 106 -17.965 6.809 -16.994 851 H THR 107 H THR 107 -14.450 6.292 -16.010 852 HA THR 107 HA THR 107 -13.413 4.504 -18.101 853 HB THR 107 HB THR 107 -12.549 6.542 -19.422 854 HG1 THR 107 HG1 THR 107 -14.863 7.737 -18.350 855 HG21 THR 107 HG21 THR 107 -14.256 4.971 -20.324 856 HG22 THR 107 HG22 THR 107 -15.533 6.024 -19.677 857 HG23 THR 107 HG23 THR 107 -14.420 6.632 -20.918 858 H ARG 108 H ARG 108 -11.097 5.033 -18.593 859 HA ARG 108 HA ARG 108 -9.622 6.295 -16.322 860 HB2 ARG 108 HB2 ARG 108 -9.911 3.863 -15.898 861 HB3 ARG 108 HB3 ARG 108 -9.203 3.501 -17.474 862 HG2 ARG 108 HG2 ARG 108 -7.043 4.534 -16.711 863 HG3 ARG 108 HG3 ARG 108 -7.794 4.885 -15.145 864 HD2 ARG 108 HD2 ARG 108 -6.478 2.874 -14.942 865 HD3 ARG 108 HD3 ARG 108 -8.198 2.442 -14.838 866 HE ARG 108 HE ARG 108 -7.024 2.257 -17.535 867 HH11 ARG 108 HH11 ARG 108 -7.695 0.397 -14.631 868 HH12 ARG 108 HH12 ARG 108 -7.482 -1.122 -15.459 869 HH21 ARG 108 HH21 ARG 108 -6.892 0.294 -18.538 870 HH22 ARG 108 HH22 ARG 108 -7.105 -1.171 -17.625 871 H LYS 109 H LYS 109 -7.676 7.239 -16.883 872 HA LYS 109 HA LYS 109 -6.569 6.806 -19.623 873 HB2 LYS 109 HB2 LYS 109 -8.076 8.896 -19.458 874 HB3 LYS 109 HB3 LYS 109 -6.912 9.546 -18.325 875 HG2 LYS 109 HG2 LYS 109 -6.382 10.499 -20.427 876 HG3 LYS 109 HG3 LYS 109 -5.123 9.315 -20.104 877 HD2 LYS 109 HD2 LYS 109 -5.758 9.193 -22.431 878 HD3 LYS 109 HD3 LYS 109 -6.290 7.702 -21.648 879 HE2 LYS 109 HE2 LYS 109 -8.604 8.642 -21.469 880 HE3 LYS 109 HE3 LYS 109 -8.045 10.135 -22.235 881 HZ1 LYS 109 HZ1 LYS 109 -7.499 8.808 -24.222 882 HZ2 LYS 109 HZ2 LYS 109 -8.062 7.446 -23.508 883 HZ3 LYS 109 HZ3 LYS 109 -9.080 8.673 -23.854 884 H TYR 110 H TYR 110 -4.485 6.181 -19.423 885 HA TYR 110 HA TYR 110 -2.991 6.433 -16.966 886 HB2 TYR 110 HB2 TYR 110 -2.541 4.670 -18.650 887 HB3 TYR 110 HB3 TYR 110 -2.042 5.889 -19.801 888 HD1 TYR 110 HD2 TYR 110 -1.167 5.594 -16.113 889 HD2 TYR 110 HD1 TYR 110 0.238 5.434 -20.194 890 HE1 TYR 110 HE2 TYR 110 1.164 5.537 -15.305 891 HE2 TYR 110 HE1 TYR 110 2.585 5.321 -19.363 892 HH TYR 110 HH TYR 110 3.359 5.434 -15.877 893 H LEU 111 H LEU 111 -1.951 8.182 -16.156 894 HA LEU 111 HA LEU 111 -1.683 10.609 -17.854 895 HB2 LEU 111 HB2 LEU 111 -1.166 10.065 -14.900 896 HB3 LEU 111 HB3 LEU 111 -1.052 11.634 -15.694 897 HG LEU 111 HG LEU 111 -3.634 10.058 -15.721 898 HD11 LEU 111 HD11 LEU 111 -3.062 10.284 -13.427 899 HD12 LEU 111 HD12 LEU 111 -2.581 11.989 -13.636 900 HD13 LEU 111 HD13 LEU 111 -4.280 11.494 -13.793 901 HD21 LEU 111 HD21 LEU 111 -2.957 13.017 -16.063 902 HD22 LEU 111 HD22 LEU 111 -3.484 11.895 -17.347 903 HD23 LEU 111 HD23 LEU 111 -4.591 12.340 -16.057 904 H GLY 112 H GLY 112 0.333 8.364 -15.965 905 HA2 GLY 112 HA2 GLY 112 2.631 8.074 -17.225 906 HA3 GLY 112 HA3 GLY 112 2.810 9.774 -16.824 907 H LYS 113 H LYS 113 4.172 9.930 -15.293 908 HA LYS 113 HA LYS 113 4.261 8.035 -12.971 909 HB2 LYS 113 HB2 LYS 113 5.879 7.644 -14.932 910 HB3 LYS 113 HB3 LYS 113 6.674 9.122 -14.390 911 HG2 LYS 113 HG2 LYS 113 6.790 8.029 -12.044 912 HG3 LYS 113 HG3 LYS 113 6.236 6.544 -12.810 913 HD2 LYS 113 HD2 LYS 113 8.635 6.455 -12.570 914 HD3 LYS 113 HD3 LYS 113 8.259 6.590 -14.297 915 HE2 LYS 113 HE2 LYS 113 8.789 8.997 -14.257 916 HE3 LYS 113 HE3 LYS 113 9.017 8.952 -12.505 917 HZ1 LYS 113 HZ1 LYS 113 10.914 7.451 -12.864 918 HZ2 LYS 113 HZ2 LYS 113 10.697 7.500 -14.485 919 HZ3 LYS 113 HZ3 LYS 113 11.138 8.848 -13.678 920 H GLN 114 H GLN 114 3.053 9.760 -12.032 921 HA GLN 114 HA GLN 114 4.330 12.295 -11.408 922 HB2 GLN 114 HB2 GLN 114 1.605 11.372 -10.492 923 HB3 GLN 114 HB3 GLN 114 2.230 13.017 -10.720 924 HG2 GLN 114 HG2 GLN 114 2.679 12.327 -13.163 925 HG3 GLN 114 HG3 GLN 114 1.657 10.914 -12.853 926 HE21 GLN 114 HE22 GLN 114 1.225 12.582 -14.848 927 HE22 GLN 114 HE21 GLN 114 -0.297 13.339 -14.526 928 H ASN 115 H ASN 115 4.454 13.149 -9.210 929 HA ASN 115 HA ASN 115 5.269 11.410 -7.172 930 HB2 ASN 115 HB2 ASN 115 5.493 14.097 -7.711 931 HB3 ASN 115 HB3 ASN 115 4.241 14.136 -6.465 932 HD21 ASN 115 HD22 ASN 115 5.098 11.935 -4.808 933 HD22 ASN 115 HD21 ASN 115 6.741 12.276 -4.340 934 H VAL 116 H VAL 116 4.127 10.064 -5.986 935 HA VAL 116 HA VAL 116 1.416 10.924 -5.075 936 HB VAL 116 HB VAL 116 0.783 8.542 -4.951 937 HG11 VAL 116 HG11 VAL 116 0.078 9.980 -6.842 938 HG12 VAL 116 HG12 VAL 116 1.508 9.450 -7.745 939 HG13 VAL 116 HG13 VAL 116 0.243 8.281 -7.288 940 HG21 VAL 116 HG21 VAL 116 3.221 8.029 -6.723 941 HG22 VAL 116 HG22 VAL 116 3.027 7.482 -5.041 942 HG23 VAL 116 HG23 VAL 116 1.943 6.872 -6.299 943 H TYR 117 H TYR 117 0.763 10.320 -3.041 944 HA TYR 117 HA TYR 117 2.913 9.829 -1.032 945 HB2 TYR 117 HB2 TYR 117 0.927 12.106 -0.860 946 HB3 TYR 117 HB3 TYR 117 2.378 11.823 0.076 947 HD1 TYR 117 HD1 TYR 117 1.095 12.902 -3.250 948 HD2 TYR 117 HD2 TYR 117 4.488 12.770 -0.590 949 HE1 TYR 117 HE1 TYR 117 2.269 14.600 -4.646 950 HE2 TYR 117 HE2 TYR 117 5.626 14.511 -1.940 951 HH TYR 117 HH TYR 117 5.472 15.909 -3.737 952 H ASP 118 H ASP 118 2.040 9.530 1.165 953 HA ASP 118 HA ASP 118 -0.796 8.746 1.447 954 HB2 ASP 118 HB2 ASP 118 0.439 6.858 0.305 955 HB3 ASP 118 HB3 ASP 118 1.470 6.724 1.717 956 H ILE 119 H ILE 119 -1.388 9.463 3.475 957 HA ILE 119 HA ILE 119 0.704 10.062 5.468 958 HB ILE 119 HB ILE 119 -1.138 10.894 6.855 959 HG12 ILE 119 HG12 ILE 119 -2.936 10.561 4.411 960 HG13 ILE 119 HG13 ILE 119 -2.989 9.498 5.820 961 HG21 ILE 119 HG21 ILE 119 0.245 12.303 5.347 962 HG22 ILE 119 HG22 ILE 119 -0.969 12.119 4.069 963 HG23 ILE 119 HG23 ILE 119 -1.371 12.967 5.581 964 HD11 ILE 119 HD11 ILE 119 -3.491 11.425 7.281 965 HD12 ILE 119 HD12 ILE 119 -3.579 12.473 5.840 966 HD13 ILE 119 HD13 ILE 119 -4.717 11.129 6.022 967 H GLY 120 H GLY 120 1.050 9.078 7.391 968 HA2 GLY 120 HA2 GLY 120 0.176 6.243 7.564 969 HA3 GLY 120 HA3 GLY 120 1.515 6.997 8.426 970 H VAL 121 H VAL 121 -1.165 5.519 9.132 971 HA VAL 121 HA VAL 121 -1.625 6.981 11.623 972 HB VAL 121 HB VAL 121 -3.051 8.186 10.015 973 HG11 VAL 121 HG11 VAL 121 -3.644 6.304 8.473 974 HG12 VAL 121 HG12 VAL 121 -4.724 5.668 9.737 975 HG13 VAL 121 HG13 VAL 121 -5.027 7.258 9.022 976 HG21 VAL 121 HG21 VAL 121 -4.693 6.625 12.020 977 HG22 VAL 121 HG22 VAL 121 -3.637 7.999 12.414 978 HG23 VAL 121 HG23 VAL 121 -5.030 8.233 11.346 979 H GLU 122 H GLU 122 -2.147 5.619 13.243 980 HA GLU 122 HA GLU 122 -2.392 2.736 12.694 981 HB2 GLU 122 HB2 GLU 122 -0.960 3.761 14.533 982 HB3 GLU 122 HB3 GLU 122 -2.447 4.254 15.338 983 HG2 GLU 122 HG2 GLU 122 -1.588 2.237 16.358 984 HG3 GLU 122 HG3 GLU 122 -3.110 1.865 15.571 985 H ARG 123 H ARG 123 -4.131 1.453 13.407 986 HA ARG 123 HA ARG 123 -6.299 0.785 13.517 987 HB2 ARG 123 HB2 ARG 123 -7.105 3.475 14.666 988 HB3 ARG 123 HB3 ARG 123 -7.986 1.961 14.730 989 HG2 ARG 123 HG2 ARG 123 -5.365 2.586 16.151 990 HG3 ARG 123 HG3 ARG 123 -6.969 2.501 16.879 991 HD2 ARG 123 HD2 ARG 123 -7.129 0.103 16.317 992 HD3 ARG 123 HD3 ARG 123 -5.521 0.167 15.561 993 HE ARG 123 HE ARG 123 -5.341 1.150 18.239 994 HH11 ARG 123 HH11 ARG 123 -5.781 -1.918 16.594 995 HH12 ARG 123 HH12 ARG 123 -5.021 -2.817 17.883 996 HH21 ARG 123 HH21 ARG 123 -4.381 -0.051 19.833 997 HH22 ARG 123 HH22 ARG 123 -4.254 -1.783 19.669 998 H ASP 124 H ASP 124 -6.809 0.434 11.535 999 HA ASP 124 HA ASP 124 -7.574 0.596 9.430 1000 HB2 ASP 124 HB2 ASP 124 -9.441 2.814 10.265 1001 HB3 ASP 124 HB3 ASP 124 -9.665 1.550 9.062 1002 H HIS 125 H HIS 125 -5.617 1.274 8.486 1003 HA HIS 125 HA HIS 125 -4.580 3.840 8.338 1004 HB2 HIS 125 HB2 HIS 125 -4.454 1.775 6.122 1005 HB3 HIS 125 HB3 HIS 125 -3.323 3.091 6.408 1006 HD1 HIS 125 HD1 HIS 125 -2.351 2.785 9.278 1007 HD2 HIS 125 HD2 HIS 125 -3.415 -0.485 6.851 1008 HE1 HIS 125 HE1 HIS 125 -1.084 0.777 10.192 1009 H ASN 126 H ASN 126 -7.320 2.670 6.546 1010 HA ASN 126 HA ASN 126 -7.423 4.450 4.380 1011 HB2 ASN 126 HB2 ASN 126 -9.842 3.897 4.361 1012 HB3 ASN 126 HB3 ASN 126 -8.820 2.488 4.525 1013 HD21 ASN 126 HD22 ASN 126 -9.633 4.580 7.330 1014 HD22 ASN 126 HD21 ASN 126 -10.725 3.414 8.034 1015 H PHE 127 H PHE 127 -8.979 6.235 3.963 1016 HA PHE 127 HA PHE 127 -9.846 7.930 6.193 1017 HB2 PHE 127 HB2 PHE 127 -8.377 9.876 5.347 1018 HB3 PHE 127 HB3 PHE 127 -7.655 8.669 6.381 1019 HD1 PHE 127 HD2 PHE 127 -8.081 9.360 2.669 1020 HD2 PHE 127 HD1 PHE 127 -5.572 7.810 5.818 1021 HE1 PHE 127 HE2 PHE 127 -6.316 8.819 1.010 1022 HE2 PHE 127 HE1 PHE 127 -3.798 7.321 4.162 1023 HZ PHE 127 HZ PHE 127 -4.173 7.803 1.754 1024 H ALA 128 H ALA 128 -11.040 9.752 5.545 1025 HA ALA 128 HA ALA 128 -12.500 9.525 3.088 1026 HB1 ALA 128 HB1 ALA 128 -13.471 10.349 5.196 1027 HB2 ALA 128 HB2 ALA 128 -12.399 11.775 5.132 1028 HB3 ALA 128 HB3 ALA 128 -13.649 11.537 3.892 1029 H LEU 129 H LEU 129 -12.582 10.826 1.345 1030 HA LEU 129 HA LEU 129 -10.335 12.695 0.680 1031 HB2 LEU 129 HB2 LEU 129 -11.719 10.442 -0.804 1032 HB3 LEU 129 HB3 LEU 129 -10.614 11.532 -1.616 1033 HG LEU 129 HG LEU 129 -9.705 9.894 0.785 1034 HD11 LEU 129 HD11 LEU 129 -10.543 8.241 -0.760 1035 HD12 LEU 129 HD12 LEU 129 -9.783 9.065 -2.143 1036 HD13 LEU 129 HD13 LEU 129 -8.774 8.313 -0.891 1037 HD21 LEU 129 HD21 LEU 129 -8.062 10.626 -1.615 1038 HD22 LEU 129 HD22 LEU 129 -8.465 11.909 -0.474 1039 HD23 LEU 129 HD23 LEU 129 -7.582 10.467 0.085 1040 H LYS 130 H LYS 130 -10.838 13.911 -1.380 1041 HA LYS 130 HA LYS 130 -13.178 15.450 -1.426 1042 HB2 LYS 130 HB2 LYS 130 -12.478 16.229 -3.545 1043 HB3 LYS 130 HB3 LYS 130 -11.021 15.823 -2.663 1044 HG2 LYS 130 HG2 LYS 130 -10.397 14.770 -4.558 1045 HG3 LYS 130 HG3 LYS 130 -11.384 13.454 -3.955 1046 HD2 LYS 130 HD2 LYS 130 -12.175 13.698 -6.167 1047 HD3 LYS 130 HD3 LYS 130 -13.353 14.629 -5.250 1048 HE2 LYS 130 HE2 LYS 130 -12.858 16.106 -6.982 1049 HE3 LYS 130 HE3 LYS 130 -11.796 16.679 -5.695 1050 HZ1 LYS 130 HZ1 LYS 130 -10.023 15.233 -6.773 1051 HZ2 LYS 130 HZ2 LYS 130 -11.027 15.005 -8.040 1052 HZ3 LYS 130 HZ3 LYS 130 -10.496 16.512 -7.673 1053 H ASN 131 H ASN 131 -15.091 15.435 -2.602 1054 HA ASN 131 HA ASN 131 -17.096 14.506 -3.032 1055 HB2 ASN 131 HB2 ASN 131 -15.803 14.431 -5.240 1056 HB3 ASN 131 HB3 ASN 131 -15.620 12.696 -4.979 1057 HD21 ASN 131 HD22 ASN 131 -18.122 15.298 -5.142 1058 HD22 ASN 131 HD21 ASN 131 -19.316 14.274 -5.918 1059 H GLY 132 H GLY 132 -15.496 13.125 -0.833 1060 HA2 GLY 132 HA2 GLY 132 -16.187 11.719 0.794 1061 HA3 GLY 132 HA3 GLY 132 -17.634 11.331 -0.148 1062 H PHE 133 H PHE 133 -14.377 10.736 -1.434 1063 HA PHE 133 HA PHE 133 -14.883 7.847 -1.571 1064 HB2 PHE 133 HB2 PHE 133 -12.680 9.700 -2.512 1065 HB3 PHE 133 HB3 PHE 133 -12.416 7.962 -2.452 1066 HD1 PHE 133 HD2 PHE 133 -14.980 10.460 -3.669 1067 HD2 PHE 133 HD1 PHE 133 -12.855 6.779 -4.400 1068 HE1 PHE 133 HE2 PHE 133 -16.218 10.178 -5.792 1069 HE2 PHE 133 HE1 PHE 133 -14.070 6.542 -6.571 1070 HZ PHE 133 HZ PHE 133 -15.794 8.159 -7.192 1071 H ILE 134 H ILE 134 -13.579 6.191 -0.660 1072 HA ILE 134 HA ILE 134 -11.860 6.936 1.653 1073 HB ILE 134 HB ILE 134 -13.801 4.616 1.631 1074 HG12 ILE 134 HG12 ILE 134 -14.687 5.602 3.757 1075 HG13 ILE 134 HG13 ILE 134 -13.797 7.087 3.409 1076 HG21 ILE 134 HG21 ILE 134 -11.686 3.995 2.722 1077 HG22 ILE 134 HG22 ILE 134 -11.775 5.455 3.740 1078 HG23 ILE 134 HG23 ILE 134 -12.970 4.149 3.908 1079 HD11 ILE 134 HD11 ILE 134 -15.733 6.005 1.357 1080 HD12 ILE 134 HD12 ILE 134 -16.374 6.785 2.817 1081 HD13 ILE 134 HD13 ILE 134 -15.311 7.692 1.746 1082 H ALA 135 H ALA 135 -9.907 6.554 0.797 1083 HA ALA 135 HA ALA 135 -9.397 4.089 -0.792 1084 HB1 ALA 135 HB1 ALA 135 -8.453 6.252 -1.553 1085 HB2 ALA 135 HB2 ALA 135 -7.472 6.320 -0.065 1086 HB3 ALA 135 HB3 ALA 135 -7.259 5.015 -1.261 1087 H SER 136 H SER 136 -7.940 2.511 -0.026 1088 HA SER 136 HA SER 136 -7.219 2.508 2.868 1089 HB2 SER 136 HB2 SER 136 -9.387 1.230 2.474 1090 HB3 SER 136 HB3 SER 136 -8.452 0.090 1.482 1091 HG SER 136 HG SER 136 -8.626 -0.521 3.725 1092 H ASN 137 H ASN 137 -5.406 1.283 3.395 1093 HA ASN 137 HA ASN 137 -3.712 0.227 1.185 1094 HB2 ASN 137 HB2 ASN 137 -1.923 1.830 1.725 1095 HB3 ASN 137 HB3 ASN 137 -3.361 2.652 1.168 1096 HD21 ASN 137 HD22 ASN 137 -0.998 2.635 3.578 1097 HD22 ASN 137 HD21 ASN 137 -1.804 3.776 4.631 Start of MODEL 16 1 H1 GLY -1 H GLY -1 3.678 -1.375 -1.632 2 HA2 GLY -1 HA2 GLY -1 1.388 -1.211 -2.277 3 HA3 GLY -1 HA3 GLY -1 1.830 0.100 -1.169 4 H GLY 0 H GLY 0 0.454 1.708 -1.852 5 HA2 GLY 0 HA2 GLY 0 0.584 2.796 -4.565 6 HA3 GLY 0 HA3 GLY 0 -0.966 2.192 -3.999 7 H ALA 1 H ALA 1 -0.607 4.851 -4.717 8 HA ALA 1 HA ALA 1 -0.990 6.372 -2.205 9 HB1 ALA 1 HB1 ALA 1 1.388 6.254 -2.284 10 HB2 ALA 1 HB2 ALA 1 1.418 6.655 -4.016 11 HB3 ALA 1 HB3 ALA 1 0.928 7.868 -2.816 12 H LEU 2 H LEU 2 -1.260 8.767 -2.737 13 HA LEU 2 HA LEU 2 -3.034 9.043 -5.142 14 HB2 LEU 2 HB2 LEU 2 -3.111 10.542 -2.496 15 HB3 LEU 2 HB3 LEU 2 -4.210 10.694 -3.842 16 HG LEU 2 HG LEU 2 -5.443 9.598 -2.279 17 HD11 LEU 2 HD11 LEU 2 -5.640 8.519 -4.456 18 HD12 LEU 2 HD12 LEU 2 -4.389 7.335 -4.000 19 HD13 LEU 2 HD13 LEU 2 -5.931 7.384 -3.127 20 HD21 LEU 2 HD21 LEU 2 -3.217 7.645 -1.695 21 HD22 LEU 2 HD22 LEU 2 -3.643 9.062 -0.725 22 HD23 LEU 2 HD23 LEU 2 -4.809 7.749 -0.927 23 H SER 3 H SER 3 -2.884 10.950 -6.391 24 HA SER 3 HA SER 3 -0.233 12.145 -6.521 25 HB2 SER 3 HB2 SER 3 -1.749 11.741 -8.478 26 HB3 SER 3 HB3 SER 3 -2.762 13.087 -7.902 27 HG SER 3 HG SER 3 -1.074 13.608 -9.504 28 H TYR 4 H TYR 4 0.216 14.470 -6.471 29 HA TYR 4 HA TYR 4 -0.217 15.677 -3.982 30 HB2 TYR 4 HB2 TYR 4 1.545 16.335 -5.564 31 HB3 TYR 4 HB3 TYR 4 0.357 16.993 -6.669 32 HD1 TYR 4 HD2 TYR 4 -0.839 19.098 -6.171 33 HD2 TYR 4 HD1 TYR 4 2.207 17.558 -3.537 34 HE1 TYR 4 HE2 TYR 4 -0.778 21.278 -4.977 35 HE2 TYR 4 HE1 TYR 4 2.260 19.745 -2.323 36 HH TYR 4 HH TYR 4 0.162 22.478 -3.306 37 H GLU 5 H GLU 5 -2.029 16.237 -6.982 38 HA GLU 5 HA GLU 5 -3.724 18.318 -6.066 39 HB2 GLU 5 HB2 GLU 5 -4.923 18.024 -8.086 40 HB3 GLU 5 HB3 GLU 5 -3.242 17.681 -8.423 41 HG2 GLU 5 HG2 GLU 5 -4.233 15.976 -9.589 42 HG3 GLU 5 HG3 GLU 5 -3.903 15.157 -8.071 43 H THR 6 H THR 6 -3.840 15.070 -5.071 44 HA THR 6 HA THR 6 -6.698 14.692 -4.808 45 HB THR 6 HB THR 6 -4.537 13.319 -3.195 46 HG1 THR 6 HG1 THR 6 -3.956 13.021 -5.190 47 HG21 THR 6 HG21 THR 6 -7.152 13.075 -2.746 48 HG22 THR 6 HG22 THR 6 -7.085 12.039 -4.185 49 HG23 THR 6 HG23 THR 6 -6.093 11.674 -2.751 50 H GLU 7 H GLU 7 -7.916 15.978 -3.460 51 HA GLU 7 HA GLU 7 -6.637 17.120 -1.061 52 HB2 GLU 7 HB2 GLU 7 -9.449 17.587 -1.987 53 HB3 GLU 7 HB3 GLU 7 -8.518 18.538 -0.833 54 HG2 GLU 7 HG2 GLU 7 -6.890 19.042 -2.729 55 HG3 GLU 7 HG3 GLU 7 -8.057 18.312 -3.835 56 H ILE 8 H ILE 8 -7.045 16.618 0.969 57 HA ILE 8 HA ILE 8 -8.920 14.381 1.625 58 HB ILE 8 HB ILE 8 -6.423 15.258 3.128 59 HG12 ILE 8 HG12 ILE 8 -5.600 14.451 1.047 60 HG13 ILE 8 HG13 ILE 8 -5.294 13.242 2.277 61 HG21 ILE 8 HG21 ILE 8 -7.980 14.107 4.567 62 HG22 ILE 8 HG22 ILE 8 -8.220 12.812 3.391 63 HG23 ILE 8 HG23 ILE 8 -6.663 13.003 4.207 64 HD11 ILE 8 HD11 ILE 8 -7.302 11.959 1.425 65 HD12 ILE 8 HD12 ILE 8 -7.429 13.130 0.112 66 HD13 ILE 8 HD13 ILE 8 -5.990 12.121 0.251 67 H LEU 9 H LEU 9 -10.619 14.991 2.802 68 HA LEU 9 HA LEU 9 -10.966 17.574 4.004 69 HB2 LEU 9 HB2 LEU 9 -12.795 16.009 3.252 70 HB3 LEU 9 HB3 LEU 9 -12.371 14.934 4.583 71 HG LEU 9 HG LEU 9 -12.868 16.908 6.161 72 HD11 LEU 9 HD11 LEU 9 -12.821 18.735 4.483 73 HD12 LEU 9 HD12 LEU 9 -14.243 18.019 3.691 74 HD13 LEU 9 HD13 LEU 9 -14.363 18.652 5.343 75 HD21 LEU 9 HD21 LEU 9 -15.147 15.824 4.446 76 HD22 LEU 9 HD22 LEU 9 -14.415 14.999 5.836 77 HD23 LEU 9 HD23 LEU 9 -15.298 16.510 6.081 78 H THR 10 H THR 10 -10.282 18.338 5.907 79 HA THR 10 HA THR 10 -9.355 16.494 8.063 80 HB THR 10 HB THR 10 -7.526 18.072 8.556 81 HG1 THR 10 HG1 THR 10 -8.205 19.281 6.096 82 HG21 THR 10 HG21 THR 10 -6.818 16.236 7.173 83 HG22 THR 10 HG22 THR 10 -7.468 16.988 5.710 84 HG23 THR 10 HG23 THR 10 -6.076 17.709 6.534 85 H VAL 11 H VAL 11 -9.712 17.143 10.203 86 HA VAL 11 HA VAL 11 -11.862 19.085 10.575 87 HB VAL 11 HB VAL 11 -10.240 17.803 12.786 88 HG11 VAL 11 HG11 VAL 11 -11.668 19.606 13.588 89 HG12 VAL 11 HG12 VAL 11 -13.065 18.925 12.722 90 HG13 VAL 11 HG13 VAL 11 -12.337 18.055 14.090 91 HG21 VAL 11 HG21 VAL 11 -12.796 16.730 11.529 92 HG22 VAL 11 HG22 VAL 11 -11.200 15.992 11.308 93 HG23 VAL 11 HG23 VAL 11 -11.927 16.045 12.914 94 H GLU 12 H GLU 12 -8.365 19.134 11.053 95 HA GLU 12 HA GLU 12 -8.153 21.549 12.550 96 HB2 GLU 12 HB2 GLU 12 -6.360 19.920 10.776 97 HB3 GLU 12 HB3 GLU 12 -5.838 21.563 11.131 98 HG2 GLU 12 HG2 GLU 12 -6.497 19.465 13.231 99 HG3 GLU 12 HG3 GLU 12 -4.880 19.922 12.700 100 H TYR 13 H TYR 13 -8.612 21.125 9.062 101 HA TYR 13 HA TYR 13 -8.787 24.095 8.741 102 HB2 TYR 13 HB2 TYR 13 -7.077 22.189 7.100 103 HB3 TYR 13 HB3 TYR 13 -7.450 23.835 6.618 104 HD1 TYR 13 HD2 TYR 13 -6.961 25.677 8.545 105 HD2 TYR 13 HD1 TYR 13 -4.948 21.880 8.093 106 HE1 TYR 13 HE2 TYR 13 -4.987 26.570 9.778 107 HE2 TYR 13 HE1 TYR 13 -2.982 22.778 9.315 108 HH TYR 13 HH TYR 13 -2.076 24.584 10.382 109 H GLY 14 H GLY 14 -9.182 20.980 6.939 110 HA2 GLY 14 HA2 GLY 14 -11.602 20.785 6.001 111 HA3 GLY 14 HA3 GLY 14 -11.215 22.311 5.205 112 H LEU 15 H LEU 15 -11.227 21.659 3.160 113 HA LEU 15 HA LEU 15 -10.095 19.197 2.104 114 HB2 LEU 15 HB2 LEU 15 -11.017 21.760 0.713 115 HB3 LEU 15 HB3 LEU 15 -10.814 20.184 -0.039 116 HG LEU 15 HG LEU 15 -12.888 20.832 2.122 117 HD11 LEU 15 HD11 LEU 15 -13.298 22.073 0.050 118 HD12 LEU 15 HD12 LEU 15 -13.178 20.569 -0.888 119 HD13 LEU 15 HD13 LEU 15 -14.503 20.795 0.281 120 HD21 LEU 15 HD21 LEU 15 -12.578 18.464 0.267 121 HD22 LEU 15 HD22 LEU 15 -12.274 18.423 2.013 122 HD23 LEU 15 HD23 LEU 15 -13.916 18.710 1.402 123 H LEU 16 H LEU 16 -7.848 19.067 2.307 124 HA LEU 16 HA LEU 16 -6.212 21.135 0.886 125 HB2 LEU 16 HB2 LEU 16 -5.834 19.801 3.577 126 HB3 LEU 16 HB3 LEU 16 -4.439 20.412 2.703 127 HG LEU 16 HG LEU 16 -6.828 22.177 3.395 128 HD11 LEU 16 HD11 LEU 16 -5.797 21.280 5.422 129 HD12 LEU 16 HD12 LEU 16 -4.188 21.786 4.864 130 HD13 LEU 16 HD13 LEU 16 -5.426 23.007 5.238 131 HD21 LEU 16 HD21 LEU 16 -3.952 22.809 2.567 132 HD22 LEU 16 HD22 LEU 16 -5.399 23.050 1.562 133 HD23 LEU 16 HD23 LEU 16 -5.184 24.002 3.031 134 HA PRO 17 HA PRO 17 -4.451 17.870 -1.499 135 HB2 PRO 17 HB2 PRO 17 -1.960 18.880 -2.106 136 HB3 PRO 17 HB3 PRO 17 -3.492 19.444 -2.840 137 HG2 PRO 17 HG2 PRO 17 -1.945 20.659 -0.549 138 HG3 PRO 17 HG3 PRO 17 -2.673 21.486 -1.960 139 HD2 PRO 17 HD2 PRO 17 -3.894 21.397 0.468 140 HD3 PRO 17 HD3 PRO 17 -4.840 21.315 -1.049 141 H ILE 18 H ILE 18 -3.718 15.942 -0.912 142 HA ILE 18 HA ILE 18 -2.473 15.348 1.535 143 HB ILE 18 HB ILE 18 -3.718 13.736 0.150 144 HG12 ILE 18 HG12 ILE 18 -0.928 12.714 0.814 145 HG13 ILE 18 HG13 ILE 18 -2.138 13.119 2.038 146 HG21 ILE 18 HG21 ILE 18 -2.644 14.301 -2.072 147 HG22 ILE 18 HG22 ILE 18 -1.222 13.373 -1.552 148 HG23 ILE 18 HG23 ILE 18 -2.792 12.586 -1.720 149 HD11 ILE 18 HD11 ILE 18 -3.681 11.421 1.049 150 HD12 ILE 18 HD12 ILE 18 -2.389 10.959 -0.085 151 HD13 ILE 18 HD13 ILE 18 -2.157 10.739 1.657 152 H GLY 19 H GLY 19 -0.896 16.055 -1.592 153 HA2 GLY 19 HA2 GLY 19 1.677 15.066 -0.851 154 HA3 GLY 19 HA3 GLY 19 1.350 16.256 -2.114 155 H LYS 20 H LYS 20 0.133 18.225 -0.236 156 HA LYS 20 HA LYS 20 2.584 19.483 0.756 157 HB2 LYS 20 HB2 LYS 20 0.721 20.727 -0.273 158 HB3 LYS 20 HB3 LYS 20 -0.353 20.250 1.046 159 HG2 LYS 20 HG2 LYS 20 0.724 21.597 2.615 160 HG3 LYS 20 HG3 LYS 20 2.220 21.724 1.681 161 HD2 LYS 20 HD2 LYS 20 -0.416 22.884 0.693 162 HD3 LYS 20 HD3 LYS 20 0.636 23.798 1.769 163 HE2 LYS 20 HE2 LYS 20 1.691 22.596 -0.820 164 HE3 LYS 20 HE3 LYS 20 0.850 24.148 -0.810 165 HZ1 LYS 20 HZ1 LYS 20 2.509 25.013 0.710 166 HZ2 LYS 20 HZ2 LYS 20 3.288 23.571 0.783 167 HZ3 LYS 20 HZ3 LYS 20 3.257 24.420 -0.613 168 H ILE 21 H ILE 21 -0.032 17.571 2.149 169 HA ILE 21 HA ILE 21 0.636 18.110 4.912 170 HB ILE 21 HB ILE 21 -0.947 15.881 3.648 171 HG12 ILE 21 HG12 ILE 21 -1.985 18.176 5.364 172 HG13 ILE 21 HG13 ILE 21 -1.807 18.360 3.626 173 HG21 ILE 21 HG21 ILE 21 -0.143 14.965 5.696 174 HG22 ILE 21 HG22 ILE 21 -0.561 16.436 6.596 175 HG23 ILE 21 HG23 ILE 21 -1.823 15.388 5.940 176 HD11 ILE 21 HD11 ILE 21 -3.360 16.518 3.204 177 HD12 ILE 21 HD12 ILE 21 -3.592 16.285 4.951 178 HD13 ILE 21 HD13 ILE 21 -4.103 17.795 4.177 179 H VAL 22 H VAL 22 1.528 15.535 2.583 180 HA VAL 22 HA VAL 22 3.223 14.179 4.522 181 HB VAL 22 HB VAL 22 3.027 13.883 1.504 182 HG11 VAL 22 HG11 VAL 22 5.158 12.915 2.658 183 HG12 VAL 22 HG12 VAL 22 4.057 11.778 3.434 184 HG13 VAL 22 HG13 VAL 22 4.188 11.845 1.672 185 HG21 VAL 22 HG21 VAL 22 1.727 12.419 3.850 186 HG22 VAL 22 HG22 VAL 22 0.895 13.347 2.596 187 HG23 VAL 22 HG23 VAL 22 1.679 11.817 2.193 188 H GLU 23 H GLU 23 3.957 16.448 1.815 189 HA GLU 23 HA GLU 23 6.807 16.222 2.052 190 HB2 GLU 23 HB2 GLU 23 5.014 18.408 0.945 191 HB3 GLU 23 HB3 GLU 23 6.758 18.495 0.848 192 HG2 GLU 23 HG2 GLU 23 5.331 16.051 -0.240 193 HG3 GLU 23 HG3 GLU 23 5.339 17.554 -1.154 194 H LYS 24 H LYS 24 4.459 18.168 3.792 195 HA LYS 24 HA LYS 24 6.664 19.503 5.327 196 HB2 LYS 24 HB2 LYS 24 3.795 20.446 5.073 197 HB3 LYS 24 HB3 LYS 24 5.145 21.318 5.774 198 HG2 LYS 24 HG2 LYS 24 4.759 20.621 2.841 199 HG3 LYS 24 HG3 LYS 24 4.568 22.210 3.586 200 HD2 LYS 24 HD2 LYS 24 7.032 22.165 4.192 201 HD3 LYS 24 HD3 LYS 24 7.167 20.638 3.323 202 HE2 LYS 24 HE2 LYS 24 7.864 22.112 1.705 203 HE3 LYS 24 HE3 LYS 24 6.166 21.883 1.286 204 HZ1 LYS 24 HZ1 LYS 24 5.718 24.006 2.509 205 HZ2 LYS 24 HZ2 LYS 24 7.316 24.184 2.789 206 HZ3 LYS 24 HZ3 LYS 24 6.756 24.233 1.262 207 H ARG 25 H ARG 25 4.756 16.929 5.689 208 HA ARG 25 HA ARG 25 3.922 15.676 7.414 209 HB2 ARG 25 HB2 ARG 25 6.196 17.026 8.881 210 HB3 ARG 25 HB3 ARG 25 5.359 15.583 9.446 211 HG2 ARG 25 HG2 ARG 25 6.408 14.181 8.009 212 HG3 ARG 25 HG3 ARG 25 6.445 15.339 6.667 213 HD2 ARG 25 HD2 ARG 25 8.292 16.490 7.481 214 HD3 ARG 25 HD3 ARG 25 8.123 15.876 9.120 215 HE ARG 25 HE ARG 25 9.490 14.563 6.882 216 HH11 ARG 25 HH11 ARG 25 8.056 13.969 10.038 217 HH12 ARG 25 HH12 ARG 25 9.054 12.566 10.322 218 HH21 ARG 25 HH21 ARG 25 10.733 12.773 7.328 219 HH22 ARG 25 HH22 ARG 25 10.517 11.912 8.829 220 H ILE 26 H ILE 26 2.235 17.519 7.030 221 HA ILE 26 HA ILE 26 1.828 19.410 9.207 222 HB ILE 26 HB ILE 26 -0.136 18.597 7.041 223 HG12 ILE 26 HG12 ILE 26 1.884 20.882 7.179 224 HG13 ILE 26 HG13 ILE 26 1.982 19.486 6.119 225 HG21 ILE 26 HG21 ILE 26 -1.184 19.696 9.038 226 HG22 ILE 26 HG22 ILE 26 -0.087 21.067 8.822 227 HG23 ILE 26 HG23 ILE 26 -1.302 20.676 7.596 228 HD11 ILE 26 HD11 ILE 26 -0.137 20.220 4.999 229 HD12 ILE 26 HD12 ILE 26 -0.051 21.723 5.952 230 HD13 ILE 26 HD13 ILE 26 1.247 21.313 4.819 231 H GLU 27 H GLU 27 1.117 18.948 11.141 232 HA GLU 27 HA GLU 27 -0.147 16.405 11.850 233 HB2 GLU 27 HB2 GLU 27 0.583 18.901 13.420 234 HB3 GLU 27 HB3 GLU 27 -0.271 17.522 14.133 235 HG2 GLU 27 HG2 GLU 27 1.547 16.013 13.583 236 HG3 GLU 27 HG3 GLU 27 2.427 17.288 12.731 237 H CYS 28 H CYS 28 -2.101 16.177 10.903 238 HA CYS 28 HA CYS 28 -4.259 18.021 11.780 239 HB2 CYS 28 HB2 CYS 28 -5.220 18.030 9.498 240 HB3 CYS 28 HB3 CYS 28 -3.626 18.784 9.566 241 HG CYS 28 HG CYS 28 -3.869 17.460 7.314 242 H THR 29 H THR 29 -6.399 17.234 11.372 243 HA THR 29 HA THR 29 -6.685 14.409 12.233 244 HB THR 29 HB THR 29 -9.039 16.189 11.980 245 HG1 THR 29 HG1 THR 29 -7.187 16.664 14.050 246 HG21 THR 29 HG21 THR 29 -9.292 14.045 13.117 247 HG22 THR 29 HG22 THR 29 -8.026 14.497 14.299 248 HG23 THR 29 HG23 THR 29 -9.572 15.373 14.247 249 H VAL 30 H VAL 30 -8.269 12.998 11.244 250 HA VAL 30 HA VAL 30 -9.193 13.674 8.488 251 HB VAL 30 HB VAL 30 -8.435 11.595 7.598 252 HG11 VAL 30 HG11 VAL 30 -6.808 13.480 7.619 253 HG12 VAL 30 HG12 VAL 30 -6.067 12.786 9.077 254 HG13 VAL 30 HG13 VAL 30 -6.061 11.879 7.563 255 HG21 VAL 30 HG21 VAL 30 -7.298 10.910 10.337 256 HG22 VAL 30 HG22 VAL 30 -8.611 10.070 9.493 257 HG23 VAL 30 HG23 VAL 30 -6.979 10.019 8.844 258 H TYR 31 H TYR 31 -10.574 11.579 7.733 259 HA TYR 31 HA TYR 31 -12.554 10.981 9.894 260 HB2 TYR 31 HB2 TYR 31 -13.055 11.787 7.005 261 HB3 TYR 31 HB3 TYR 31 -14.275 11.160 8.086 262 HD1 TYR 31 HD2 TYR 31 -11.952 14.052 7.545 263 HD2 TYR 31 HD1 TYR 31 -15.441 12.538 9.580 264 HE1 TYR 31 HE2 TYR 31 -12.506 16.360 8.319 265 HE2 TYR 31 HE1 TYR 31 -16.064 14.868 10.244 266 HH TYR 31 HH TYR 31 -15.494 17.081 10.135 267 H SER 32 H SER 32 -13.237 8.870 9.961 268 HA SER 32 HA SER 32 -12.924 6.999 7.704 269 HB2 SER 32 HB2 SER 32 -10.597 7.164 8.655 270 HB3 SER 32 HB3 SER 32 -11.222 6.642 10.214 271 HG SER 32 HG SER 32 -10.335 5.003 8.596 272 H VAL 33 H VAL 33 -13.843 4.822 8.219 273 HA VAL 33 HA VAL 33 -15.890 4.929 10.343 274 HB VAL 33 HB VAL 33 -16.587 2.688 9.626 275 HG11 VAL 33 HG11 VAL 33 -17.711 4.630 8.807 276 HG12 VAL 33 HG12 VAL 33 -16.570 4.761 7.429 277 HG13 VAL 33 HG13 VAL 33 -17.670 3.370 7.569 278 HG21 VAL 33 HG21 VAL 33 -14.500 3.029 7.458 279 HG22 VAL 33 HG22 VAL 33 -14.599 1.752 8.690 280 HG23 VAL 33 HG23 VAL 33 -15.825 1.835 7.420 281 H ASP 34 H ASP 34 -16.047 3.630 12.093 282 HA ASP 34 HA ASP 34 -13.636 2.211 13.032 283 HB2 ASP 34 HB2 ASP 34 -14.718 2.046 15.136 284 HB3 ASP 34 HB3 ASP 34 -14.920 3.686 14.544 285 H ASN 35 H ASN 35 -14.283 0.106 14.318 286 HA ASN 35 HA ASN 35 -14.767 -2.037 12.508 287 HB2 ASN 35 HB2 ASN 35 -13.623 -2.397 14.578 288 HB3 ASN 35 HB3 ASN 35 -14.959 -1.782 15.541 289 HD21 ASN 35 HD22 ASN 35 -14.118 -4.488 13.284 290 HD22 ASN 35 HD21 ASN 35 -15.180 -5.631 14.093 291 H ASN 36 H ASN 36 -17.087 -0.063 14.269 292 HA ASN 36 HA ASN 36 -19.252 -2.004 13.870 293 HB2 ASN 36 HB2 ASN 36 -18.906 0.556 15.446 294 HB3 ASN 36 HB3 ASN 36 -20.530 0.014 15.038 295 HD21 ASN 36 HD22 ASN 36 -17.492 -1.313 16.499 296 HD22 ASN 36 HD21 ASN 36 -18.363 -2.275 17.678 297 H GLY 37 H GLY 37 -17.832 0.551 12.109 298 HA2 GLY 37 HA2 GLY 37 -18.390 1.067 9.880 299 HA3 GLY 37 HA3 GLY 37 -20.072 0.620 10.156 300 H ASN 38 H ASN 38 -18.411 2.775 12.461 301 HA ASN 38 HA ASN 38 -20.332 4.949 11.701 302 HB2 ASN 38 HB2 ASN 38 -18.669 4.700 14.234 303 HB3 ASN 38 HB3 ASN 38 -20.022 5.771 13.946 304 HD21 ASN 38 HD22 ASN 38 -19.090 2.998 15.451 305 HD22 ASN 38 HD21 ASN 38 -20.701 2.318 15.724 306 H ILE 39 H ILE 39 -19.492 6.727 10.653 307 HA ILE 39 HA ILE 39 -16.640 7.032 10.282 308 HB ILE 39 HB ILE 39 -18.906 8.907 9.546 309 HG12 ILE 39 HG12 ILE 39 -17.277 6.908 7.909 310 HG13 ILE 39 HG13 ILE 39 -18.933 6.637 8.451 311 HG21 ILE 39 HG21 ILE 39 -16.782 10.141 9.747 312 HG22 ILE 39 HG22 ILE 39 -15.938 8.899 8.802 313 HG23 ILE 39 HG23 ILE 39 -17.159 9.932 8.052 314 HD11 ILE 39 HD11 ILE 39 -19.649 8.612 7.084 315 HD12 ILE 39 HD12 ILE 39 -18.001 8.622 6.381 316 HD13 ILE 39 HD13 ILE 39 -19.048 7.216 6.173 317 H TYR 40 H TYR 40 -15.325 7.666 11.749 318 HA TYR 40 HA TYR 40 -16.043 9.764 13.763 319 HB2 TYR 40 HB2 TYR 40 -14.711 8.671 15.365 320 HB3 TYR 40 HB3 TYR 40 -15.744 7.445 14.674 321 HD1 TYR 40 HD1 TYR 40 -14.764 5.633 13.215 322 HD2 TYR 40 HD2 TYR 40 -12.285 8.586 15.159 323 HE1 TYR 40 HE1 TYR 40 -12.740 4.262 12.766 324 HE2 TYR 40 HE2 TYR 40 -10.295 7.128 14.784 325 HH TYR 40 HH TYR 40 -10.527 4.000 13.080 326 H THR 41 H THR 41 -13.835 10.688 14.722 327 HA THR 41 HA THR 41 -12.036 11.399 12.451 328 HB THR 41 HB THR 41 -11.772 13.663 13.558 329 HG1 THR 41 HG1 THR 41 -14.320 13.122 14.625 330 HG21 THR 41 HG21 THR 41 -12.936 13.510 11.484 331 HG22 THR 41 HG22 THR 41 -14.423 12.920 12.266 332 HG23 THR 41 HG23 THR 41 -13.863 14.584 12.541 333 H GLN 42 H GLN 42 -9.891 11.623 12.807 334 HA GLN 42 HA GLN 42 -8.758 11.349 15.517 335 HB2 GLN 42 HB2 GLN 42 -7.591 9.284 15.027 336 HB3 GLN 42 HB3 GLN 42 -9.316 9.048 14.787 337 HG2 GLN 42 HG2 GLN 42 -8.910 9.427 12.278 338 HG3 GLN 42 HG3 GLN 42 -7.180 9.387 12.635 339 HE21 GLN 42 HE22 GLN 42 -6.994 7.243 14.488 340 HE22 GLN 42 HE21 GLN 42 -7.553 5.791 13.674 341 HA PRO 43 HA PRO 43 -5.384 13.566 13.511 342 HB2 PRO 43 HB2 PRO 43 -3.271 13.023 15.139 343 HB3 PRO 43 HB3 PRO 43 -4.621 14.108 15.594 344 HG2 PRO 43 HG2 PRO 43 -4.250 11.188 16.318 345 HG3 PRO 43 HG3 PRO 43 -4.706 12.556 17.390 346 HD2 PRO 43 HD2 PRO 43 -6.548 10.851 16.335 347 HD3 PRO 43 HD3 PRO 43 -6.902 12.586 16.577 348 H VAL 44 H VAL 44 -3.652 13.258 12.118 349 HA VAL 44 HA VAL 44 -3.072 10.706 10.946 350 HB VAL 44 HB VAL 44 -2.790 12.864 9.800 351 HG11 VAL 44 HG11 VAL 44 -1.777 14.186 11.687 352 HG12 VAL 44 HG12 VAL 44 -0.271 13.285 11.458 353 HG13 VAL 44 HG13 VAL 44 -0.898 14.312 10.155 354 HG21 VAL 44 HG21 VAL 44 -0.146 11.367 9.931 355 HG22 VAL 44 HG22 VAL 44 -1.575 10.831 9.023 356 HG23 VAL 44 HG23 VAL 44 -0.762 12.344 8.595 357 H ALA 45 H ALA 45 -1.386 9.244 11.265 358 HA ALA 45 HA ALA 45 -0.015 9.395 13.896 359 HB1 ALA 45 HB1 ALA 45 -1.201 7.325 13.209 360 HB2 ALA 45 HB2 ALA 45 -0.092 7.145 11.839 361 HB3 ALA 45 HB3 ALA 45 0.530 7.064 13.496 362 H GLN 46 H GLN 46 0.797 8.922 10.437 363 HA GLN 46 HA GLN 46 3.437 10.198 10.709 364 HB2 GLN 46 HB2 GLN 46 3.082 7.271 9.910 365 HB3 GLN 46 HB3 GLN 46 4.563 8.181 9.663 366 HG2 GLN 46 HG2 GLN 46 3.353 7.463 12.347 367 HG3 GLN 46 HG3 GLN 46 4.764 6.745 11.593 368 HE21 GLN 46 HE22 GLN 46 4.582 8.125 14.233 369 HE22 GLN 46 HE21 GLN 46 5.766 9.420 14.133 370 H TRP 47 H TRP 47 4.591 9.890 8.445 371 HA TRP 47 HA TRP 47 2.645 10.358 6.218 372 HB2 TRP 47 HB2 TRP 47 5.031 12.110 6.914 373 HB3 TRP 47 HB3 TRP 47 3.929 12.335 5.574 374 HD1 TRP 47 HD1 TRP 47 1.713 13.652 6.028 375 HE1 TRP 47 HE1 TRP 47 0.769 14.954 8.020 376 HE3 TRP 47 HE3 TRP 47 5.012 12.096 9.630 377 HZ2 TRP 47 HZ2 TRP 47 1.339 15.223 10.833 378 HZ3 TRP 47 HZ3 TRP 47 4.755 12.870 11.976 379 HH2 TRP 47 HH2 TRP 47 2.903 14.424 12.588 380 H HIS 48 H HIS 48 3.264 9.479 4.289 381 HA HIS 48 HA HIS 48 6.067 8.488 3.977 382 HB2 HIS 48 HB2 HIS 48 3.622 6.959 3.082 383 HB3 HIS 48 HB3 HIS 48 5.284 6.403 3.159 384 HD1 HIS 48 HD1 HIS 48 6.202 5.885 5.772 385 HD2 HIS 48 HD2 HIS 48 2.101 6.651 5.200 386 HE1 HIS 48 HE1 HIS 48 5.025 5.109 7.897 387 H ASP 49 H ASP 49 7.012 8.827 2.078 388 HA ASP 49 HA ASP 49 5.501 10.176 -0.149 389 HB2 ASP 49 HB2 ASP 49 8.487 10.271 0.485 390 HB3 ASP 49 HB3 ASP 49 7.609 11.206 -0.717 391 H ARG 50 H ARG 50 5.664 9.272 -2.161 392 HA ARG 50 HA ARG 50 7.238 6.727 -2.435 393 HB2 ARG 50 HB2 ARG 50 5.021 7.825 -4.160 394 HB3 ARG 50 HB3 ARG 50 5.747 6.239 -4.262 395 HG2 ARG 50 HG2 ARG 50 4.046 7.322 -1.964 396 HG3 ARG 50 HG3 ARG 50 3.585 6.101 -3.126 397 HD2 ARG 50 HD2 ARG 50 5.683 5.828 -0.947 398 HD3 ARG 50 HD3 ARG 50 4.100 5.046 -1.029 399 HE ARG 50 HE ARG 50 5.841 4.409 -3.309 400 HH11 ARG 50 HH11 ARG 50 5.225 3.434 -0.004 401 HH12 ARG 50 HH12 ARG 50 5.891 1.843 -0.274 402 HH21 ARG 50 HH21 ARG 50 6.456 2.389 -3.645 403 HH22 ARG 50 HH22 ARG 50 6.668 1.285 -2.298 404 H GLY 51 H GLY 51 6.769 9.839 -4.010 405 HA2 GLY 51 HA2 GLY 51 8.490 11.058 -5.081 406 HA3 GLY 51 HA3 GLY 51 9.384 9.576 -5.371 407 H GLU 52 H GLU 52 7.640 7.960 -6.785 408 HA GLU 52 HA GLU 52 6.324 9.261 -8.993 409 HB2 GLU 52 HB2 GLU 52 9.169 8.335 -9.542 410 HB3 GLU 52 HB3 GLU 52 7.897 8.453 -10.759 411 HG2 GLU 52 HG2 GLU 52 7.682 10.905 -10.181 412 HG3 GLU 52 HG3 GLU 52 9.224 10.731 -9.314 413 H GLN 53 H GLN 53 4.752 7.635 -8.768 414 HA GLN 53 HA GLN 53 5.563 4.946 -9.835 415 HB2 GLN 53 HB2 GLN 53 3.421 5.604 -7.795 416 HB3 GLN 53 HB3 GLN 53 3.849 3.974 -8.385 417 HG2 GLN 53 HG2 GLN 53 6.209 4.380 -7.523 418 HG3 GLN 53 HG3 GLN 53 5.588 5.899 -6.808 419 HE21 GLN 53 HE22 GLN 53 3.071 5.015 -5.740 420 HE22 GLN 53 HE21 GLN 53 3.809 4.537 -4.274 421 H GLU 54 H GLU 54 3.934 3.731 -10.921 422 HA GLU 54 HA GLU 54 2.799 5.151 -13.062 423 HB2 GLU 54 HB2 GLU 54 1.709 2.965 -13.641 424 HB3 GLU 54 HB3 GLU 54 3.453 2.950 -13.490 425 HG2 GLU 54 HG2 GLU 54 1.926 2.165 -11.018 426 HG3 GLU 54 HG3 GLU 54 1.803 1.086 -12.401 427 H VAL 55 H VAL 55 1.385 6.668 -12.804 428 HA VAL 55 HA VAL 55 -1.023 6.264 -11.164 429 HB VAL 55 HB VAL 55 0.683 8.456 -11.642 430 HG11 VAL 55 HG11 VAL 55 -0.319 9.163 -13.603 431 HG12 VAL 55 HG12 VAL 55 -1.961 9.111 -12.883 432 HG13 VAL 55 HG13 VAL 55 -0.779 10.262 -12.297 433 HG21 VAL 55 HG21 VAL 55 -0.634 7.870 -9.581 434 HG22 VAL 55 HG22 VAL 55 -0.768 9.577 -10.024 435 HG23 VAL 55 HG23 VAL 55 -2.096 8.461 -10.397 436 H PHE 56 H PHE 56 -3.021 6.345 -11.830 437 HA PHE 56 HA PHE 56 -3.649 6.327 -14.755 438 HB2 PHE 56 HB2 PHE 56 -4.593 4.457 -12.547 439 HB3 PHE 56 HB3 PHE 56 -5.384 4.606 -14.109 440 HD1 PHE 56 HD2 PHE 56 -2.055 3.752 -12.554 441 HD2 PHE 56 HD1 PHE 56 -4.676 3.323 -15.942 442 HE1 PHE 56 HE2 PHE 56 -0.472 2.142 -13.577 443 HE2 PHE 56 HE1 PHE 56 -3.136 1.638 -16.921 444 HZ PHE 56 HZ PHE 56 -0.990 1.107 -15.781 445 H GLU 57 H GLU 57 -5.361 7.509 -15.370 446 HA GLU 57 HA GLU 57 -6.611 9.417 -13.630 447 HB2 GLU 57 HB2 GLU 57 -6.320 9.504 -16.186 448 HB3 GLU 57 HB3 GLU 57 -7.674 8.382 -16.297 449 HG2 GLU 57 HG2 GLU 57 -9.125 10.019 -15.116 450 HG3 GLU 57 HG3 GLU 57 -7.741 11.098 -14.908 451 H TYR 58 H TYR 58 -8.383 9.252 -12.333 452 HA TYR 58 HA TYR 58 -10.244 6.948 -12.675 453 HB2 TYR 58 HB2 TYR 58 -8.900 6.462 -10.811 454 HB3 TYR 58 HB3 TYR 58 -8.945 8.112 -10.210 455 HD1 TYR 58 HD1 TYR 58 -12.077 6.455 -11.345 456 HD2 TYR 58 HD2 TYR 58 -9.506 7.279 -7.973 457 HE1 TYR 58 HE1 TYR 58 -13.874 5.791 -9.796 458 HE2 TYR 58 HE2 TYR 58 -11.350 6.662 -6.423 459 HH TYR 58 HH TYR 58 -13.548 6.003 -6.279 460 H CYS 59 H CYS 59 -11.776 7.948 -13.832 461 HA CYS 59 HA CYS 59 -12.988 10.468 -12.778 462 HB2 CYS 59 HB2 CYS 59 -12.100 10.429 -15.137 463 HB3 CYS 59 HB3 CYS 59 -13.283 9.166 -15.510 464 HG CYS 59 HG CYS 59 -15.419 10.602 -14.776 465 H LEU 60 H LEU 60 -15.139 10.536 -12.296 466 HA LEU 60 HA LEU 60 -16.634 7.939 -12.157 467 HB2 LEU 60 HB2 LEU 60 -16.157 10.105 -10.289 468 HB3 LEU 60 HB3 LEU 60 -17.865 10.029 -10.630 469 HG LEU 60 HG LEU 60 -17.970 7.673 -9.969 470 HD11 LEU 60 HD11 LEU 60 -15.701 6.918 -10.521 471 HD12 LEU 60 HD12 LEU 60 -15.028 8.005 -9.287 472 HD13 LEU 60 HD13 LEU 60 -16.054 6.630 -8.817 473 HD21 LEU 60 HD21 LEU 60 -16.496 9.377 -7.942 474 HD22 LEU 60 HD22 LEU 60 -18.231 9.520 -8.281 475 HD23 LEU 60 HD23 LEU 60 -17.586 8.022 -7.583 476 H GLU 61 H GLU 61 -18.961 8.008 -12.282 477 HA GLU 61 HA GLU 61 -19.812 9.087 -14.808 478 HB2 GLU 61 HB2 GLU 61 -21.329 7.815 -12.507 479 HB3 GLU 61 HB3 GLU 61 -22.054 8.149 -14.075 480 HG2 GLU 61 HG2 GLU 61 -19.630 6.334 -13.686 481 HG3 GLU 61 HG3 GLU 61 -21.292 5.775 -13.641 482 H ASP 62 H ASP 62 -19.978 10.453 -11.621 483 HA ASP 62 HA ASP 62 -21.976 12.518 -12.267 484 HB2 ASP 62 HB2 ASP 62 -21.727 11.638 -9.986 485 HB3 ASP 62 HB3 ASP 62 -20.049 12.190 -9.933 486 H GLY 63 H GLY 63 -18.532 12.124 -12.668 487 HA2 GLY 63 HA2 GLY 63 -17.385 13.611 -14.188 488 HA3 GLY 63 HA3 GLY 63 -18.210 14.993 -13.472 489 H SER 64 H SER 64 -17.405 13.164 -10.827 490 HA SER 64 HA SER 64 -15.272 14.770 -9.894 491 HB2 SER 64 HB2 SER 64 -15.701 11.884 -9.058 492 HB3 SER 64 HB3 SER 64 -15.047 13.213 -8.099 493 HG SER 64 HG SER 64 -17.156 14.182 -8.218 494 H LEU 65 H LEU 65 -13.054 14.612 -9.956 495 HA LEU 65 HA LEU 65 -11.835 12.511 -11.698 496 HB2 LEU 65 HB2 LEU 65 -12.250 15.011 -12.549 497 HB3 LEU 65 HB3 LEU 65 -10.816 15.348 -11.612 498 HG LEU 65 HG LEU 65 -10.128 15.060 -13.842 499 HD11 LEU 65 HD11 LEU 65 -8.690 13.779 -12.209 500 HD12 LEU 65 HD12 LEU 65 -9.539 12.299 -12.729 501 HD13 LEU 65 HD13 LEU 65 -8.602 13.240 -13.889 502 HD21 LEU 65 HD21 LEU 65 -11.714 12.472 -13.947 503 HD22 LEU 65 HD22 LEU 65 -12.124 13.997 -14.741 504 HD23 LEU 65 HD23 LEU 65 -10.684 13.110 -15.243 505 H ILE 66 H ILE 66 -10.284 11.436 -10.816 506 HA ILE 66 HA ILE 66 -8.754 12.381 -8.436 507 HB ILE 66 HB ILE 66 -10.050 9.648 -8.826 508 HG12 ILE 66 HG12 ILE 66 -10.994 11.738 -6.820 509 HG13 ILE 66 HG13 ILE 66 -11.759 11.523 -8.386 510 HG21 ILE 66 HG21 ILE 66 -8.058 9.515 -7.423 511 HG22 ILE 66 HG22 ILE 66 -8.603 10.900 -6.445 512 HG23 ILE 66 HG23 ILE 66 -9.461 9.353 -6.389 513 HD11 ILE 66 HD11 ILE 66 -12.352 9.213 -7.891 514 HD12 ILE 66 HD12 ILE 66 -11.689 9.389 -6.243 515 HD13 ILE 66 HD13 ILE 66 -13.061 10.366 -6.778 516 H ARG 67 H ARG 67 -6.655 11.440 -8.237 517 HA ARG 67 HA ARG 67 -5.656 9.771 -10.513 518 HB2 ARG 67 HB2 ARG 67 -4.433 12.372 -9.497 519 HB3 ARG 67 HB3 ARG 67 -3.577 11.188 -10.502 520 HG2 ARG 67 HG2 ARG 67 -5.410 11.379 -12.210 521 HG3 ARG 67 HG3 ARG 67 -6.114 12.707 -11.267 522 HD2 ARG 67 HD2 ARG 67 -4.218 14.109 -11.638 523 HD3 ARG 67 HD3 ARG 67 -3.247 12.754 -12.252 524 HE ARG 67 HE ARG 67 -5.502 12.911 -13.920 525 HH11 ARG 67 HH11 ARG 67 -2.682 14.896 -13.274 526 HH12 ARG 67 HH12 ARG 67 -2.648 15.531 -14.899 527 HH21 ARG 67 HH21 ARG 67 -5.418 13.785 -15.961 528 HH22 ARG 67 HH22 ARG 67 -4.150 14.901 -16.376 529 H ALA 68 H ALA 68 -4.998 7.964 -9.738 530 HA ALA 68 HA ALA 68 -3.297 7.787 -7.313 531 HB1 ALA 68 HB1 ALA 68 -5.699 7.551 -6.606 532 HB2 ALA 68 HB2 ALA 68 -5.877 6.197 -7.740 533 HB3 ALA 68 HB3 ALA 68 -4.769 6.060 -6.359 534 H THR 69 H THR 69 -2.463 5.470 -7.061 535 HA THR 69 HA THR 69 -1.724 4.364 -9.718 536 HB THR 69 HB THR 69 -0.259 2.855 -8.531 537 HG1 THR 69 HG1 THR 69 -0.041 2.887 -6.393 538 HG21 THR 69 HG21 THR 69 0.497 5.209 -9.036 539 HG22 THR 69 HG22 THR 69 0.132 5.632 -7.351 540 HG23 THR 69 HG23 THR 69 1.374 4.410 -7.725 541 H LYS 70 H LYS 70 -1.837 2.087 -10.105 542 HA LYS 70 HA LYS 70 -4.441 0.912 -9.564 543 HB2 LYS 70 HB2 LYS 70 -1.964 0.034 -11.052 544 HB3 LYS 70 HB3 LYS 70 -3.222 -1.151 -10.678 545 HG2 LYS 70 HG2 LYS 70 -4.920 0.099 -11.846 546 HG3 LYS 70 HG3 LYS 70 -3.840 1.478 -12.046 547 HD2 LYS 70 HD2 LYS 70 -3.939 0.415 -14.125 548 HD3 LYS 70 HD3 LYS 70 -2.339 0.040 -13.476 549 HE2 LYS 70 HE2 LYS 70 -4.670 -1.869 -13.285 550 HE3 LYS 70 HE3 LYS 70 -3.690 -1.756 -14.738 551 HZ1 LYS 70 HZ1 LYS 70 -1.719 -2.319 -13.421 552 HZ2 LYS 70 HZ2 LYS 70 -2.627 -2.539 -12.074 553 HZ3 LYS 70 HZ3 LYS 70 -2.832 -3.506 -13.370 554 H ASP 71 H ASP 71 -1.796 1.035 -7.591 555 HA ASP 71 HA ASP 71 -2.221 -1.623 -6.308 556 HB2 ASP 71 HB2 ASP 71 -0.051 0.488 -6.037 557 HB3 ASP 71 HB3 ASP 71 -0.118 -1.012 -5.103 558 H HIS 72 H HIS 72 -3.212 1.676 -5.943 559 HA HIS 72 HA HIS 72 -3.373 1.542 -3.013 560 HB2 HIS 72 HB2 HIS 72 -3.124 3.687 -4.415 561 HB3 HIS 72 HB3 HIS 72 -4.828 3.516 -4.811 562 HD1 HIS 72 HD1 HIS 72 -6.146 2.922 -1.968 563 HD2 HIS 72 HD2 HIS 72 -2.794 5.363 -2.561 564 HE1 HIS 72 HE1 HIS 72 -5.795 4.226 0.188 565 H LYS 73 H LYS 73 -5.259 0.679 -1.959 566 HA LYS 73 HA LYS 73 -7.454 -0.339 -3.690 567 HB2 LYS 73 HB2 LYS 73 -7.144 -0.848 -0.707 568 HB3 LYS 73 HB3 LYS 73 -8.242 -1.579 -1.829 569 HG2 LYS 73 HG2 LYS 73 -6.733 -3.250 -1.749 570 HG3 LYS 73 HG3 LYS 73 -6.017 -2.348 -3.088 571 HD2 LYS 73 HD2 LYS 73 -4.421 -1.274 -1.504 572 HD3 LYS 73 HD3 LYS 73 -5.214 -2.097 -0.146 573 HE2 LYS 73 HE2 LYS 73 -4.614 -4.293 -1.138 574 HE3 LYS 73 HE3 LYS 73 -3.800 -3.466 -2.476 575 HZ1 LYS 73 HZ1 LYS 73 -2.277 -2.472 -0.860 576 HZ2 LYS 73 HZ2 LYS 73 -3.041 -3.171 0.387 577 HZ3 LYS 73 HZ3 LYS 73 -2.236 -4.103 -0.696 578 H PHE 74 H PHE 74 -9.671 -0.066 -2.992 579 HA PHE 74 HA PHE 74 -10.194 2.429 -1.436 580 HB2 PHE 74 HB2 PHE 74 -11.231 1.807 -4.218 581 HB3 PHE 74 HB3 PHE 74 -11.919 3.003 -3.141 582 HD1 PHE 74 HD2 PHE 74 -8.729 2.152 -4.996 583 HD2 PHE 74 HD1 PHE 74 -11.093 5.219 -3.063 584 HE1 PHE 74 HE2 PHE 74 -7.207 3.887 -5.865 585 HE2 PHE 74 HE1 PHE 74 -9.567 6.946 -3.964 586 HZ PHE 74 HZ PHE 74 -7.614 6.288 -5.354 587 H MET 75 H MET 75 -11.908 2.326 -0.149 588 HA MET 75 HA MET 75 -13.036 -0.289 0.434 589 HB2 MET 75 HB2 MET 75 -12.284 1.414 2.120 590 HB3 MET 75 HB3 MET 75 -13.669 2.409 1.664 591 HG2 MET 75 HG2 MET 75 -15.213 0.668 2.416 592 HG3 MET 75 HG3 MET 75 -13.867 -0.458 2.649 593 HE1 MET 75 HE1 MET 75 -14.695 3.222 3.499 594 HE2 MET 75 HE2 MET 75 -15.985 2.443 4.431 595 HE3 MET 75 HE3 MET 75 -14.653 3.282 5.261 596 H THR 76 H THR 76 -14.427 -1.014 -0.982 597 HA THR 76 HA THR 76 -16.240 0.499 -2.617 598 HB THR 76 HB THR 76 -17.273 -1.729 -3.104 599 HG1 THR 76 HG1 THR 76 -15.215 -2.774 -1.502 600 HG21 THR 76 HG21 THR 76 -15.351 -0.956 -4.387 601 HG22 THR 76 HG22 THR 76 -14.231 -1.654 -3.194 602 HG23 THR 76 HG23 THR 76 -15.291 -2.714 -4.150 603 H VAL 77 H VAL 77 -18.660 0.000 -2.669 604 HA VAL 77 HA VAL 77 -19.964 0.900 -0.355 605 HB VAL 77 HB VAL 77 -22.070 -0.100 -1.387 606 HG11 VAL 77 HG11 VAL 77 -21.354 2.197 -1.747 607 HG12 VAL 77 HG12 VAL 77 -20.313 1.696 -3.094 608 HG13 VAL 77 HG13 VAL 77 -22.081 1.517 -3.212 609 HG21 VAL 77 HG21 VAL 77 -20.218 -0.796 -3.714 610 HG22 VAL 77 HG22 VAL 77 -21.013 -1.978 -2.650 611 HG23 VAL 77 HG23 VAL 77 -21.982 -0.912 -3.674 612 H ASP 78 H ASP 78 -19.066 -2.436 -1.091 613 HA ASP 78 HA ASP 78 -20.630 -3.567 1.138 614 HB2 ASP 78 HB2 ASP 78 -18.563 -4.713 -0.780 615 HB3 ASP 78 HB3 ASP 78 -19.321 -5.650 0.503 616 H GLY 79 H GLY 79 -17.688 -1.861 0.974 617 HA2 GLY 79 HA2 GLY 79 -16.256 -1.371 2.750 618 HA3 GLY 79 HA3 GLY 79 -16.843 -2.762 3.661 619 H GLN 80 H GLN 80 -16.149 -3.869 0.553 620 HA GLN 80 HA GLN 80 -13.702 -5.240 1.351 621 HB2 GLN 80 HB2 GLN 80 -15.053 -4.942 -1.373 622 HB3 GLN 80 HB3 GLN 80 -13.691 -5.991 -1.036 623 HG2 GLN 80 HG2 GLN 80 -16.306 -6.311 0.488 624 HG3 GLN 80 HG3 GLN 80 -16.064 -7.003 -1.110 625 HE21 GLN 80 HE22 GLN 80 -14.738 -7.060 2.244 626 HE22 GLN 80 HE21 GLN 80 -13.956 -8.623 2.033 627 H MET 81 H MET 81 -11.677 -4.561 1.136 628 HA MET 81 HA MET 81 -11.104 -1.958 -0.169 629 HB2 MET 81 HB2 MET 81 -9.100 -1.898 1.156 630 HB3 MET 81 HB3 MET 81 -10.517 -2.127 2.164 631 HG2 MET 81 HG2 MET 81 -9.496 -4.748 1.618 632 HG3 MET 81 HG3 MET 81 -8.114 -3.714 1.941 633 HE1 MET 81 HE1 MET 81 -11.826 -4.196 3.441 634 HE2 MET 81 HE2 MET 81 -11.006 -5.773 3.307 635 HE3 MET 81 HE3 MET 81 -11.363 -5.087 4.905 636 H LEU 82 H LEU 82 -11.080 -2.509 -2.310 637 HA LEU 82 HA LEU 82 -9.130 -4.603 -3.208 638 HB2 LEU 82 HB2 LEU 82 -11.605 -3.628 -4.674 639 HB3 LEU 82 HB3 LEU 82 -10.591 -4.994 -5.101 640 HG LEU 82 HG LEU 82 -12.402 -4.811 -2.655 641 HD11 LEU 82 HD11 LEU 82 -13.619 -5.057 -4.772 642 HD12 LEU 82 HD12 LEU 82 -12.637 -6.482 -5.182 643 HD13 LEU 82 HD13 LEU 82 -13.735 -6.522 -3.782 644 HD21 LEU 82 HD21 LEU 82 -10.744 -7.170 -3.648 645 HD22 LEU 82 HD22 LEU 82 -10.455 -6.253 -2.153 646 HD23 LEU 82 HD23 LEU 82 -11.927 -7.209 -2.317 647 HA PRO 83 HA PRO 83 -6.923 -1.377 -5.355 648 HB2 PRO 83 HB2 PRO 83 -5.851 -2.718 -7.486 649 HB3 PRO 83 HB3 PRO 83 -5.250 -2.872 -5.810 650 HG2 PRO 83 HG2 PRO 83 -7.199 -4.669 -7.291 651 HG3 PRO 83 HG3 PRO 83 -5.765 -5.157 -6.327 652 HD2 PRO 83 HD2 PRO 83 -8.273 -5.231 -5.301 653 HD3 PRO 83 HD3 PRO 83 -6.896 -4.702 -4.289 654 H ILE 84 H ILE 84 -7.249 0.112 -7.010 655 HA ILE 84 HA ILE 84 -9.764 0.165 -8.272 656 HB ILE 84 HB ILE 84 -8.437 2.124 -7.722 657 HG12 ILE 84 HG12 ILE 84 -8.961 2.213 -10.712 658 HG13 ILE 84 HG13 ILE 84 -10.271 1.936 -9.560 659 HG21 ILE 84 HG21 ILE 84 -6.214 1.397 -8.386 660 HG22 ILE 84 HG22 ILE 84 -6.695 1.357 -10.102 661 HG23 ILE 84 HG23 ILE 84 -6.619 2.898 -9.221 662 HD11 ILE 84 HD11 ILE 84 -9.837 4.004 -8.413 663 HD12 ILE 84 HD12 ILE 84 -8.464 4.365 -9.497 664 HD13 ILE 84 HD13 ILE 84 -10.117 4.277 -10.145 665 H ASP 85 H ASP 85 -6.852 -1.314 -9.449 666 HA ASP 85 HA ASP 85 -7.499 -1.772 -12.192 667 HB2 ASP 85 HB2 ASP 85 -5.314 -2.284 -11.217 668 HB3 ASP 85 HB3 ASP 85 -6.037 -3.438 -10.101 669 H GLU 86 H GLU 86 -8.648 -3.355 -9.225 670 HA GLU 86 HA GLU 86 -10.107 -5.456 -10.721 671 HB2 GLU 86 HB2 GLU 86 -8.960 -5.743 -8.389 672 HB3 GLU 86 HB3 GLU 86 -10.337 -4.844 -7.760 673 HG2 GLU 86 HG2 GLU 86 -11.008 -7.039 -7.464 674 HG3 GLU 86 HG3 GLU 86 -11.784 -6.670 -8.990 675 H ILE 87 H ILE 87 -10.773 -2.381 -8.932 676 HA ILE 87 HA ILE 87 -13.596 -2.670 -8.857 677 HB ILE 87 HB ILE 87 -11.900 -0.141 -8.892 678 HG12 ILE 87 HG12 ILE 87 -13.078 -1.715 -6.555 679 HG13 ILE 87 HG13 ILE 87 -11.420 -1.875 -7.089 680 HG21 ILE 87 HG21 ILE 87 -14.285 0.363 -9.399 681 HG22 ILE 87 HG22 ILE 87 -14.781 -0.581 -7.993 682 HG23 ILE 87 HG23 ILE 87 -13.882 0.929 -7.796 683 HD11 ILE 87 HD11 ILE 87 -10.797 0.275 -6.371 684 HD12 ILE 87 HD12 ILE 87 -12.471 0.807 -6.182 685 HD13 ILE 87 HD13 ILE 87 -11.795 -0.400 -5.080 686 H PHE 88 H PHE 88 -11.500 -1.330 -11.393 687 HA PHE 88 HA PHE 88 -13.629 -0.387 -13.094 688 HB2 PHE 88 HB2 PHE 88 -11.220 0.274 -13.242 689 HB3 PHE 88 HB3 PHE 88 -10.845 -1.322 -13.871 690 HD1 PHE 88 HD1 PHE 88 -12.707 1.855 -14.560 691 HD2 PHE 88 HD2 PHE 88 -11.337 -1.899 -16.178 692 HE1 PHE 88 HE1 PHE 88 -13.211 2.663 -16.847 693 HE2 PHE 88 HE2 PHE 88 -11.836 -1.083 -18.477 694 HZ PHE 88 HZ PHE 88 -12.766 1.200 -18.812 695 H GLU 89 H GLU 89 -12.171 -3.626 -12.785 696 HA GLU 89 HA GLU 89 -13.584 -4.664 -15.167 697 HB2 GLU 89 HB2 GLU 89 -11.743 -5.889 -13.069 698 HB3 GLU 89 HB3 GLU 89 -12.669 -6.888 -14.185 699 HG2 GLU 89 HG2 GLU 89 -11.661 -5.450 -16.083 700 HG3 GLU 89 HG3 GLU 89 -10.537 -4.830 -14.875 701 H ARG 90 H ARG 90 -13.931 -4.847 -11.632 702 HA ARG 90 HA ARG 90 -16.278 -6.599 -11.704 703 HB2 ARG 90 HB2 ARG 90 -15.247 -4.754 -9.509 704 HB3 ARG 90 HB3 ARG 90 -16.444 -6.040 -9.318 705 HG2 ARG 90 HG2 ARG 90 -13.573 -6.543 -10.131 706 HG3 ARG 90 HG3 ARG 90 -14.179 -6.581 -8.472 707 HD2 ARG 90 HD2 ARG 90 -15.888 -8.347 -9.526 708 HD3 ARG 90 HD3 ARG 90 -14.643 -8.435 -10.786 709 HE ARG 90 HE ARG 90 -13.235 -9.555 -9.350 710 HH11 ARG 90 HH11 ARG 90 -15.838 -8.234 -7.387 711 HH12 ARG 90 HH12 ARG 90 -15.282 -9.036 -5.943 712 HH21 ARG 90 HH21 ARG 90 -12.593 -10.556 -7.452 713 HH22 ARG 90 HH22 ARG 90 -13.510 -10.320 -5.987 714 H GLU 91 H GLU 91 -15.811 -3.209 -12.180 715 HA GLU 91 HA GLU 91 -17.148 -1.413 -12.334 716 HB2 GLU 91 HB2 GLU 91 -19.414 -3.347 -12.955 717 HB3 GLU 91 HB3 GLU 91 -19.351 -1.621 -13.317 718 HG2 GLU 91 HG2 GLU 91 -17.347 -2.047 -14.789 719 HG3 GLU 91 HG3 GLU 91 -17.554 -3.775 -14.508 720 H LEU 92 H LEU 92 -16.617 -2.260 -9.760 721 HA LEU 92 HA LEU 92 -19.100 -2.112 -8.155 722 HB2 LEU 92 HB2 LEU 92 -16.159 -2.407 -7.447 723 HB3 LEU 92 HB3 LEU 92 -17.395 -2.157 -6.222 724 HG LEU 92 HG LEU 92 -17.423 -4.470 -8.183 725 HD11 LEU 92 HD11 LEU 92 -15.471 -4.565 -6.640 726 HD12 LEU 92 HD12 LEU 92 -16.578 -4.417 -5.256 727 HD13 LEU 92 HD13 LEU 92 -16.645 -5.848 -6.302 728 HD21 LEU 92 HD21 LEU 92 -19.045 -3.950 -5.661 729 HD22 LEU 92 HD22 LEU 92 -19.664 -4.033 -7.328 730 HD23 LEU 92 HD23 LEU 92 -19.017 -5.482 -6.563 731 H ASP 93 H ASP 93 -19.684 -0.554 -6.749 732 HA ASP 93 HA ASP 93 -18.778 2.196 -7.314 733 HB2 ASP 93 HB2 ASP 93 -20.906 1.288 -5.362 734 HB3 ASP 93 HB3 ASP 93 -20.719 2.863 -6.121 735 H LEU 94 H LEU 94 -18.240 3.723 -5.557 736 HA LEU 94 HA LEU 94 -16.923 2.438 -3.195 737 HB2 LEU 94 HB2 LEU 94 -16.491 5.193 -4.424 738 HB3 LEU 94 HB3 LEU 94 -15.780 4.615 -2.922 739 HG LEU 94 HG LEU 94 -15.164 3.722 -5.742 740 HD11 LEU 94 HD11 LEU 94 -14.044 5.702 -4.628 741 HD12 LEU 94 HD12 LEU 94 -13.465 4.621 -3.367 742 HD13 LEU 94 HD13 LEU 94 -12.909 4.384 -5.042 743 HD21 LEU 94 HD21 LEU 94 -14.376 2.287 -3.168 744 HD22 LEU 94 HD22 LEU 94 -15.286 1.608 -4.545 745 HD23 LEU 94 HD23 LEU 94 -13.598 2.055 -4.745 746 H MET 95 H MET 95 -17.135 3.178 -1.160 747 HA MET 95 HA MET 95 -19.684 4.312 -0.322 748 HB2 MET 95 HB2 MET 95 -18.306 2.531 0.834 749 HB3 MET 95 HB3 MET 95 -17.149 3.783 1.289 750 HG2 MET 95 HG2 MET 95 -19.031 4.980 2.477 751 HG3 MET 95 HG3 MET 95 -20.101 3.647 2.044 752 HE1 MET 95 HE1 MET 95 -19.447 1.063 2.779 753 HE2 MET 95 HE2 MET 95 -17.676 1.201 2.623 754 HE3 MET 95 HE3 MET 95 -18.392 0.697 4.164 755 H ARG 96 H ARG 96 -19.930 6.288 0.870 756 HA ARG 96 HA ARG 96 -17.859 8.424 0.642 757 HB2 ARG 96 HB2 ARG 96 -20.608 8.380 -0.644 758 HB3 ARG 96 HB3 ARG 96 -19.902 9.922 -0.169 759 HG2 ARG 96 HG2 ARG 96 -18.087 9.740 -1.674 760 HG3 ARG 96 HG3 ARG 96 -18.349 8.023 -1.948 761 HD2 ARG 96 HD2 ARG 96 -19.642 8.398 -3.686 762 HD3 ARG 96 HD3 ARG 96 -20.781 9.322 -2.712 763 HE ARG 96 HE ARG 96 -18.688 11.095 -3.262 764 HH11 ARG 96 HH11 ARG 96 -21.051 9.368 -5.259 765 HH12 ARG 96 HH12 ARG 96 -20.837 10.485 -6.574 766 HH21 ARG 96 HH21 ARG 96 -18.535 12.468 -5.036 767 HH22 ARG 96 HH22 ARG 96 -19.497 12.170 -6.447 768 H VAL 97 H VAL 97 -18.312 10.318 1.915 769 HA VAL 97 HA VAL 97 -19.807 9.766 4.440 770 HB VAL 97 HB VAL 97 -17.373 10.286 4.529 771 HG11 VAL 97 HG11 VAL 97 -17.531 12.204 2.769 772 HG12 VAL 97 HG12 VAL 97 -18.070 13.213 4.089 773 HG13 VAL 97 HG13 VAL 97 -16.478 12.440 4.178 774 HG21 VAL 97 HG21 VAL 97 -18.995 12.402 6.007 775 HG22 VAL 97 HG22 VAL 97 -18.903 10.720 6.507 776 HG23 VAL 97 HG23 VAL 97 -17.426 11.704 6.455 777 H ASP 98 H ASP 98 -19.813 11.991 1.737 778 HA ASP 98 HA ASP 98 -21.515 13.999 2.951 779 HB2 ASP 98 HB2 ASP 98 -20.334 13.446 0.233 780 HB3 ASP 98 HB3 ASP 98 -21.652 14.599 0.352 781 H ASN 99 H ASN 99 -22.388 10.952 2.341 782 HA ASN 99 HA ASN 99 -24.205 9.760 1.749 783 HB2 ASN 99 HB2 ASN 99 -25.657 12.265 2.687 784 HB3 ASN 99 HB3 ASN 99 -26.469 10.746 2.274 785 HD21 ASN 99 HD22 ASN 99 -23.890 12.060 4.279 786 HD22 ASN 99 HD21 ASN 99 -23.523 10.553 4.954 787 H LEU 100 H LEU 100 -22.783 11.137 -0.154 788 HA LEU 100 HA LEU 100 -24.537 11.810 -2.418 789 HB2 LEU 100 HB2 LEU 100 -21.575 11.325 -2.047 790 HB3 LEU 100 HB3 LEU 100 -22.227 11.455 -3.668 791 HG LEU 100 HG LEU 100 -22.627 13.612 -1.558 792 HD11 LEU 100 HD11 LEU 100 -20.206 13.248 -2.098 793 HD12 LEU 100 HD12 LEU 100 -20.578 13.548 -3.810 794 HD13 LEU 100 HD13 LEU 100 -20.813 14.833 -2.604 795 HD21 LEU 100 HD21 LEU 100 -22.900 13.644 -4.601 796 HD22 LEU 100 HD22 LEU 100 -24.242 13.715 -3.438 797 HD23 LEU 100 HD23 LEU 100 -23.087 15.048 -3.529 798 HA PRO 101 HA PRO 101 -25.449 7.783 -3.918 799 HB2 PRO 101 HB2 PRO 101 -25.434 8.067 -6.655 800 HB3 PRO 101 HB3 PRO 101 -26.691 8.762 -5.588 801 HG2 PRO 101 HG2 PRO 101 -24.257 10.141 -6.748 802 HG3 PRO 101 HG3 PRO 101 -25.948 10.735 -6.688 803 HD2 PRO 101 HD2 PRO 101 -24.059 11.495 -4.866 804 HD3 PRO 101 HD3 PRO 101 -25.760 11.282 -4.389 805 H ASN 102 H ASN 102 -24.490 5.869 -4.627 806 HA ASN 102 HA ASN 102 -21.536 5.977 -4.826 807 HB2 ASN 102 HB2 ASN 102 -23.335 3.546 -4.519 808 HB3 ASN 102 HB3 ASN 102 -21.600 3.677 -4.206 809 HD21 ASN 102 HD22 ASN 102 -20.914 5.120 -2.396 810 HD22 ASN 102 HD21 ASN 102 -22.045 5.351 -1.051 811 H ILE 103 H ILE 103 -20.481 5.718 -6.685 812 HA ILE 103 HA ILE 103 -21.690 4.371 -9.040 813 HB ILE 103 HB ILE 103 -20.717 6.368 -10.395 814 HG12 ILE 103 HG12 ILE 103 -21.579 7.897 -7.901 815 HG13 ILE 103 HG13 ILE 103 -19.894 7.561 -8.294 816 HG21 ILE 103 HG21 ILE 103 -23.058 5.553 -10.394 817 HG22 ILE 103 HG22 ILE 103 -23.412 6.599 -9.003 818 HG23 ILE 103 HG23 ILE 103 -22.958 7.302 -10.568 819 HD11 ILE 103 HD11 ILE 103 -20.161 8.764 -10.444 820 HD12 ILE 103 HD12 ILE 103 -21.830 9.179 -9.994 821 HD13 ILE 103 HD13 ILE 103 -20.474 9.789 -9.032 822 H LYS 104 H LYS 104 -20.359 3.327 -10.273 823 HA LYS 104 HA LYS 104 -17.578 2.974 -9.528 824 HB2 LYS 104 HB2 LYS 104 -17.585 1.167 -11.100 825 HB3 LYS 104 HB3 LYS 104 -19.046 1.143 -10.148 826 HG2 LYS 104 HG2 LYS 104 -19.801 0.548 -12.210 827 HG3 LYS 104 HG3 LYS 104 -20.246 2.248 -12.150 828 HD2 LYS 104 HD2 LYS 104 -18.473 2.847 -13.653 829 HD3 LYS 104 HD3 LYS 104 -17.657 1.277 -13.437 830 HE2 LYS 104 HE2 LYS 104 -19.705 0.194 -14.476 831 HE3 LYS 104 HE3 LYS 104 -20.295 1.813 -14.865 832 HZ1 LYS 104 HZ1 LYS 104 -18.299 2.148 -16.216 833 HZ2 LYS 104 HZ2 LYS 104 -17.706 0.677 -15.803 834 HZ3 LYS 104 HZ3 LYS 104 -19.057 0.775 -16.703 835 H ILE 105 H ILE 105 -15.970 2.727 -11.360 836 HA ILE 105 HA ILE 105 -15.217 5.349 -12.210 837 HB ILE 105 HB ILE 105 -14.214 2.629 -13.136 838 HG12 ILE 105 HG12 ILE 105 -12.699 4.189 -11.076 839 HG13 ILE 105 HG13 ILE 105 -14.118 3.319 -10.515 840 HG21 ILE 105 HG21 ILE 105 -13.349 4.335 -14.622 841 HG22 ILE 105 HG22 ILE 105 -12.942 5.404 -13.267 842 HG23 ILE 105 HG23 ILE 105 -12.035 3.907 -13.525 843 HD11 ILE 105 HD11 ILE 105 -13.155 1.259 -11.605 844 HD12 ILE 105 HD12 ILE 105 -11.646 2.194 -11.842 845 HD13 ILE 105 HD13 ILE 105 -12.293 1.897 -10.210 846 H ALA 106 H ALA 106 -15.875 6.469 -13.898 847 HA ALA 106 HA ALA 106 -17.603 5.403 -16.006 848 HB1 ALA 106 HB1 ALA 106 -17.958 7.642 -15.109 849 HB2 ALA 106 HB2 ALA 106 -16.316 8.145 -15.568 850 HB3 ALA 106 HB3 ALA 106 -17.520 7.760 -16.816 851 H THR 107 H THR 107 -14.272 6.673 -15.813 852 HA THR 107 HA THR 107 -13.419 5.097 -18.156 853 HB THR 107 HB THR 107 -12.145 7.201 -18.977 854 HG1 THR 107 HG1 THR 107 -13.294 9.122 -18.650 855 HG21 THR 107 HG21 THR 107 -13.960 6.105 -20.262 856 HG22 THR 107 HG22 THR 107 -15.145 7.152 -19.449 857 HG23 THR 107 HG23 THR 107 -13.897 7.858 -20.497 858 H ARG 108 H ARG 108 -11.293 4.660 -18.233 859 HA ARG 108 HA ARG 108 -9.404 5.763 -16.236 860 HB2 ARG 108 HB2 ARG 108 -10.234 3.815 -15.119 861 HB3 ARG 108 HB3 ARG 108 -10.116 2.811 -16.560 862 HG2 ARG 108 HG2 ARG 108 -7.602 4.076 -15.454 863 HG3 ARG 108 HG3 ARG 108 -8.295 2.722 -14.594 864 HD2 ARG 108 HD2 ARG 108 -7.920 2.403 -17.575 865 HD3 ARG 108 HD3 ARG 108 -6.491 2.381 -16.541 866 HE ARG 108 HE ARG 108 -8.422 0.645 -15.407 867 HH11 ARG 108 HH11 ARG 108 -6.399 0.727 -18.280 868 HH12 ARG 108 HH12 ARG 108 -6.200 -1.005 -18.299 869 HH21 ARG 108 HH21 ARG 108 -8.086 -1.571 -15.485 870 HH22 ARG 108 HH22 ARG 108 -7.130 -2.257 -16.767 871 H LYS 109 H LYS 109 -7.391 5.888 -16.925 872 HA LYS 109 HA LYS 109 -6.264 4.415 -19.175 873 HB2 LYS 109 HB2 LYS 109 -6.783 7.423 -19.379 874 HB3 LYS 109 HB3 LYS 109 -5.376 6.694 -20.130 875 HG2 LYS 109 HG2 LYS 109 -7.125 5.019 -21.208 876 HG3 LYS 109 HG3 LYS 109 -8.287 6.288 -20.807 877 HD2 LYS 109 HD2 LYS 109 -7.563 6.580 -23.084 878 HD3 LYS 109 HD3 LYS 109 -6.887 7.912 -22.132 879 HE2 LYS 109 HE2 LYS 109 -4.702 6.795 -22.048 880 HE3 LYS 109 HE3 LYS 109 -5.371 5.344 -22.801 881 HZ1 LYS 109 HZ1 LYS 109 -5.753 6.636 -24.824 882 HZ2 LYS 109 HZ2 LYS 109 -5.170 7.999 -24.129 883 HZ3 LYS 109 HZ3 LYS 109 -4.180 6.732 -24.405 884 H TYR 110 H TYR 110 -4.039 4.398 -19.133 885 HA TYR 110 HA TYR 110 -2.627 5.220 -16.746 886 HB2 TYR 110 HB2 TYR 110 -1.891 3.334 -18.209 887 HB3 TYR 110 HB3 TYR 110 -1.590 4.467 -19.513 888 HD1 TYR 110 HD1 TYR 110 -0.794 4.483 -15.822 889 HD2 TYR 110 HD2 TYR 110 0.748 4.749 -19.842 890 HE1 TYR 110 HE1 TYR 110 1.435 4.918 -14.923 891 HE2 TYR 110 HE2 TYR 110 3.038 5.092 -18.926 892 HH TYR 110 HH TYR 110 3.658 5.256 -15.415 893 H LEU 111 H LEU 111 -1.688 7.124 -16.273 894 HA LEU 111 HA LEU 111 -1.745 9.330 -18.313 895 HB2 LEU 111 HB2 LEU 111 -1.663 9.250 -15.284 896 HB3 LEU 111 HB3 LEU 111 -1.407 10.735 -16.201 897 HG LEU 111 HG LEU 111 -3.913 9.034 -16.358 898 HD11 LEU 111 HD11 LEU 111 -3.725 9.866 -14.102 899 HD12 LEU 111 HD12 LEU 111 -3.219 11.467 -14.671 900 HD13 LEU 111 HD13 LEU 111 -4.888 10.900 -14.935 901 HD21 LEU 111 HD21 LEU 111 -3.248 11.877 -17.258 902 HD22 LEU 111 HD22 LEU 111 -3.599 10.492 -18.318 903 HD23 LEU 111 HD23 LEU 111 -4.878 11.162 -17.303 904 H GLY 112 H GLY 112 0.303 8.035 -15.643 905 HA2 GLY 112 HA2 GLY 112 2.661 7.782 -17.073 906 HA3 GLY 112 HA3 GLY 112 2.653 9.485 -16.592 907 H LYS 113 H LYS 113 4.212 9.526 -15.095 908 HA LYS 113 HA LYS 113 4.131 7.610 -12.792 909 HB2 LYS 113 HB2 LYS 113 5.765 7.168 -14.811 910 HB3 LYS 113 HB3 LYS 113 6.731 8.420 -14.032 911 HG2 LYS 113 HG2 LYS 113 6.551 7.053 -11.869 912 HG3 LYS 113 HG3 LYS 113 5.690 5.823 -12.791 913 HD2 LYS 113 HD2 LYS 113 7.961 5.096 -12.615 914 HD3 LYS 113 HD3 LYS 113 7.691 5.597 -14.293 915 HE2 LYS 113 HE2 LYS 113 8.697 7.870 -13.646 916 HE3 LYS 113 HE3 LYS 113 9.112 7.157 -12.083 917 HZ1 LYS 113 HZ1 LYS 113 10.454 5.504 -13.297 918 HZ2 LYS 113 HZ2 LYS 113 10.087 6.210 -14.726 919 HZ3 LYS 113 HZ3 LYS 113 10.967 7.022 -13.616 920 H GLN 114 H GLN 114 2.999 9.469 -12.040 921 HA GLN 114 HA GLN 114 4.289 12.000 -11.586 922 HB2 GLN 114 HB2 GLN 114 1.577 11.122 -10.634 923 HB3 GLN 114 HB3 GLN 114 2.186 12.769 -10.914 924 HG2 GLN 114 HG2 GLN 114 2.683 12.047 -13.340 925 HG3 GLN 114 HG3 GLN 114 1.752 10.594 -12.999 926 HE21 GLN 114 HE22 GLN 114 0.813 11.525 -14.977 927 HE22 GLN 114 HE21 GLN 114 -0.613 12.432 -14.594 928 H ASN 115 H ASN 115 4.450 13.068 -9.466 929 HA ASN 115 HA ASN 115 5.351 11.511 -7.308 930 HB2 ASN 115 HB2 ASN 115 5.658 14.110 -8.064 931 HB3 ASN 115 HB3 ASN 115 4.407 14.330 -6.832 932 HD21 ASN 115 HD22 ASN 115 5.148 12.300 -4.922 933 HD22 ASN 115 HD21 ASN 115 6.838 12.511 -4.571 934 H VAL 116 H VAL 116 4.183 10.232 -6.096 935 HA VAL 116 HA VAL 116 1.476 11.123 -5.202 936 HB VAL 116 HB VAL 116 0.857 8.720 -5.143 937 HG11 VAL 116 HG11 VAL 116 0.036 9.995 -7.003 938 HG12 VAL 116 HG12 VAL 116 1.571 9.847 -7.871 939 HG13 VAL 116 HG13 VAL 116 0.548 8.426 -7.597 940 HG21 VAL 116 HG21 VAL 116 3.333 8.259 -6.863 941 HG22 VAL 116 HG22 VAL 116 3.132 7.712 -5.183 942 HG23 VAL 116 HG23 VAL 116 2.079 7.079 -6.450 943 H TYR 117 H TYR 117 0.803 10.485 -3.152 944 HA TYR 117 HA TYR 117 2.916 9.871 -1.141 945 HB2 TYR 117 HB2 TYR 117 0.956 12.186 -0.965 946 HB3 TYR 117 HB3 TYR 117 2.309 11.829 0.087 947 HD1 TYR 117 HD2 TYR 117 1.316 13.207 -3.195 948 HD2 TYR 117 HD1 TYR 117 4.587 12.467 -0.487 949 HE1 TYR 117 HE2 TYR 117 2.722 14.866 -4.429 950 HE2 TYR 117 HE1 TYR 117 5.970 14.127 -1.688 951 HH TYR 117 HH TYR 117 5.995 15.782 -3.225 952 H ASP 118 H ASP 118 2.031 9.352 0.980 953 HA ASP 118 HA ASP 118 -0.845 8.915 1.260 954 HB2 ASP 118 HB2 ASP 118 -0.760 6.568 1.686 955 HB3 ASP 118 HB3 ASP 118 -0.183 6.885 0.064 956 H ILE 119 H ILE 119 -1.497 9.110 3.329 957 HA ILE 119 HA ILE 119 0.571 9.526 5.424 958 HB ILE 119 HB ILE 119 -1.279 10.365 6.794 959 HG12 ILE 119 HG12 ILE 119 -3.018 10.238 4.294 960 HG13 ILE 119 HG13 ILE 119 -3.132 9.089 5.634 961 HG21 ILE 119 HG21 ILE 119 0.172 11.832 5.473 962 HG22 ILE 119 HG22 ILE 119 -0.930 11.728 4.085 963 HG23 ILE 119 HG23 ILE 119 -1.446 12.518 5.594 964 HD11 ILE 119 HD11 ILE 119 -3.671 10.939 7.191 965 HD12 ILE 119 HD12 ILE 119 -3.658 12.079 5.820 966 HD13 ILE 119 HD13 ILE 119 -4.844 10.768 5.869 967 H GLY 120 H GLY 120 0.402 8.568 7.484 968 HA2 GLY 120 HA2 GLY 120 -0.798 5.816 7.518 969 HA3 GLY 120 HA3 GLY 120 0.668 6.294 8.375 970 H VAL 121 H VAL 121 -1.745 5.122 9.473 971 HA VAL 121 HA VAL 121 -2.588 7.163 11.473 972 HB VAL 121 HB VAL 121 -4.542 5.387 9.998 973 HG11 VAL 121 HG11 VAL 121 -5.340 6.084 12.170 974 HG12 VAL 121 HG12 VAL 121 -4.928 7.784 11.819 975 HG13 VAL 121 HG13 VAL 121 -6.214 6.952 10.916 976 HG21 VAL 121 HG21 VAL 121 -3.990 8.332 9.453 977 HG22 VAL 121 HG22 VAL 121 -3.763 6.987 8.310 978 HG23 VAL 121 HG23 VAL 121 -5.382 7.419 8.831 979 H GLU 122 H GLU 122 -3.390 6.126 13.503 980 HA GLU 122 HA GLU 122 -1.969 3.806 14.284 981 HB2 GLU 122 HB2 GLU 122 -4.436 5.115 15.504 982 HB3 GLU 122 HB3 GLU 122 -3.602 3.736 16.203 983 HG2 GLU 122 HG2 GLU 122 -2.739 5.558 17.357 984 HG3 GLU 122 HG3 GLU 122 -1.470 5.053 16.251 985 H ARG 123 H ARG 123 -2.150 1.841 13.518 986 HA ARG 123 HA ARG 123 -2.883 -0.060 12.519 987 HB2 ARG 123 HB2 ARG 123 -5.098 0.312 14.568 988 HB3 ARG 123 HB3 ARG 123 -4.878 -1.163 13.625 989 HG2 ARG 123 HG2 ARG 123 -2.600 -1.448 14.496 990 HG3 ARG 123 HG3 ARG 123 -2.784 -0.005 15.504 991 HD2 ARG 123 HD2 ARG 123 -4.572 -2.475 15.651 992 HD3 ARG 123 HD3 ARG 123 -3.186 -2.206 16.697 993 HE ARG 123 HE ARG 123 -5.816 -0.925 16.859 994 HH11 ARG 123 HH11 ARG 123 -2.478 -0.590 17.904 995 HH12 ARG 123 HH12 ARG 123 -2.909 0.472 19.220 996 HH21 ARG 123 HH21 ARG 123 -6.282 0.438 18.544 997 HH22 ARG 123 HH22 ARG 123 -5.003 1.033 19.566 998 H ASP 124 H ASP 124 -3.742 2.412 11.165 999 HA ASP 124 HA ASP 124 -5.614 1.143 9.260 1000 HB2 ASP 124 HB2 ASP 124 -6.224 3.658 10.847 1001 HB3 ASP 124 HB3 ASP 124 -6.843 3.469 9.216 1002 H HIS 125 H HIS 125 -5.754 2.220 7.229 1003 HA HIS 125 HA HIS 125 -3.708 4.281 6.618 1004 HB2 HIS 125 HB2 HIS 125 -3.916 1.770 4.950 1005 HB3 HIS 125 HB3 HIS 125 -2.704 3.052 4.877 1006 HD1 HIS 125 HD1 HIS 125 -3.282 -0.285 6.453 1007 HD2 HIS 125 HD2 HIS 125 -0.828 3.100 6.922 1008 HE1 HIS 125 HE1 HIS 125 -1.347 -1.012 7.950 1009 H ASN 126 H ASN 126 -6.567 4.437 6.864 1010 HA ASN 126 HA ASN 126 -7.355 5.142 4.100 1011 HB2 ASN 126 HB2 ASN 126 -9.462 4.101 4.330 1012 HB3 ASN 126 HB3 ASN 126 -8.299 2.898 4.871 1013 HD21 ASN 126 HD22 ASN 126 -11.180 3.057 5.448 1014 HD22 ASN 126 HD21 ASN 126 -11.303 3.240 7.191 1015 H PHE 127 H PHE 127 -9.249 6.555 3.961 1016 HA PHE 127 HA PHE 127 -9.957 8.381 6.041 1017 HB2 PHE 127 HB2 PHE 127 -8.644 10.367 5.039 1018 HB3 PHE 127 HB3 PHE 127 -7.807 9.277 6.112 1019 HD1 PHE 127 HD2 PHE 127 -8.334 10.001 2.460 1020 HD2 PHE 127 HD1 PHE 127 -5.820 8.166 5.446 1021 HE1 PHE 127 HE2 PHE 127 -6.606 9.549 0.734 1022 HE2 PHE 127 HE1 PHE 127 -4.102 7.708 3.714 1023 HZ PHE 127 HZ PHE 127 -4.486 8.408 1.367 1024 H ALA 128 H ALA 128 -11.359 10.095 5.277 1025 HA ALA 128 HA ALA 128 -12.663 9.572 2.724 1026 HB1 ALA 128 HB1 ALA 128 -13.916 10.170 4.791 1027 HB2 ALA 128 HB2 ALA 128 -13.168 11.787 4.742 1028 HB3 ALA 128 HB3 ALA 128 -14.242 11.264 3.436 1029 H LEU 129 H LEU 129 -12.128 10.437 0.832 1030 HA LEU 129 HA LEU 129 -10.334 12.718 0.439 1031 HB2 LEU 129 HB2 LEU 129 -12.244 11.367 -1.517 1032 HB3 LEU 129 HB3 LEU 129 -10.952 12.485 -1.930 1033 HG LEU 129 HG LEU 129 -10.640 9.643 -0.906 1034 HD11 LEU 129 HD11 LEU 129 -11.139 9.994 -3.351 1035 HD12 LEU 129 HD12 LEU 129 -9.699 11.017 -3.461 1036 HD13 LEU 129 HD13 LEU 129 -9.542 9.296 -3.061 1037 HD21 LEU 129 HD21 LEU 129 -8.490 11.707 -1.368 1038 HD22 LEU 129 HD22 LEU 129 -8.896 10.883 0.160 1039 HD23 LEU 129 HD23 LEU 129 -8.209 9.963 -1.179 1040 H LYS 130 H LYS 130 -11.104 14.601 -0.970 1041 HA LYS 130 HA LYS 130 -12.825 16.304 0.267 1042 HB2 LYS 130 HB2 LYS 130 -13.034 17.514 -1.955 1043 HB3 LYS 130 HB3 LYS 130 -11.418 17.178 -1.369 1044 HG2 LYS 130 HG2 LYS 130 -11.146 15.332 -2.948 1045 HG3 LYS 130 HG3 LYS 130 -12.817 15.480 -3.494 1046 HD2 LYS 130 HD2 LYS 130 -10.764 17.707 -3.755 1047 HD3 LYS 130 HD3 LYS 130 -10.991 16.488 -4.991 1048 HE2 LYS 130 HE2 LYS 130 -13.300 18.215 -4.005 1049 HE3 LYS 130 HE3 LYS 130 -12.165 18.786 -5.229 1050 HZ1 LYS 130 HZ1 LYS 130 -12.746 16.841 -6.595 1051 HZ2 LYS 130 HZ2 LYS 130 -13.879 16.368 -5.499 1052 HZ3 LYS 130 HZ3 LYS 130 -14.051 17.776 -6.298 1053 H ASN 131 H ASN 131 -13.985 14.101 -2.252 1054 HA ASN 131 HA ASN 131 -16.782 15.072 -1.944 1055 HB2 ASN 131 HB2 ASN 131 -15.282 13.200 -3.793 1056 HB3 ASN 131 HB3 ASN 131 -17.037 13.121 -3.718 1057 HD21 ASN 131 HD22 ASN 131 -18.245 15.237 -4.094 1058 HD22 ASN 131 HD21 ASN 131 -17.537 16.285 -5.309 1059 H GLY 132 H GLY 132 -14.873 12.891 -0.278 1060 HA2 GLY 132 HA2 GLY 132 -15.809 11.881 1.607 1061 HA3 GLY 132 HA3 GLY 132 -17.269 11.428 0.685 1062 H PHE 133 H PHE 133 -15.023 10.512 -1.435 1063 HA PHE 133 HA PHE 133 -15.350 7.769 -1.071 1064 HB2 PHE 133 HB2 PHE 133 -12.914 9.010 -2.359 1065 HB3 PHE 133 HB3 PHE 133 -13.639 7.455 -2.728 1066 HD1 PHE 133 HD2 PHE 133 -16.207 7.579 -3.497 1067 HD2 PHE 133 HD1 PHE 133 -13.359 10.809 -3.791 1068 HE1 PHE 133 HE2 PHE 133 -17.597 8.657 -5.249 1069 HE2 PHE 133 HE1 PHE 133 -14.739 11.862 -5.562 1070 HZ PHE 133 HZ PHE 133 -16.872 10.819 -6.257 1071 H ILE 134 H ILE 134 -14.171 6.069 -0.131 1072 HA ILE 134 HA ILE 134 -12.035 6.934 1.769 1073 HB ILE 134 HB ILE 134 -13.856 4.554 2.025 1074 HG12 ILE 134 HG12 ILE 134 -14.429 5.882 4.229 1075 HG13 ILE 134 HG13 ILE 134 -13.854 7.290 3.339 1076 HG21 ILE 134 HG21 ILE 134 -11.625 4.102 2.975 1077 HG22 ILE 134 HG22 ILE 134 -11.627 5.683 3.795 1078 HG23 ILE 134 HG23 ILE 134 -12.739 4.406 4.300 1079 HD11 ILE 134 HD11 ILE 134 -15.627 6.800 1.609 1080 HD12 ILE 134 HD12 ILE 134 -16.147 5.420 2.594 1081 HD13 ILE 134 HD13 ILE 134 -16.289 7.074 3.222 1082 H ALA 135 H ALA 135 -10.263 6.841 0.602 1083 HA ALA 135 HA ALA 135 -9.446 4.501 -0.980 1084 HB1 ALA 135 HB1 ALA 135 -8.739 6.863 -1.517 1085 HB2 ALA 135 HB2 ALA 135 -7.856 6.906 0.021 1086 HB3 ALA 135 HB3 ALA 135 -7.386 5.759 -1.254 1087 H SER 136 H SER 136 -8.073 2.898 -0.152 1088 HA SER 136 HA SER 136 -7.130 3.045 2.664 1089 HB2 SER 136 HB2 SER 136 -9.320 1.870 2.693 1090 HB3 SER 136 HB3 SER 136 -8.663 0.662 1.565 1091 HG SER 136 HG SER 136 -8.484 0.009 3.765 1092 H ASN 137 H ASN 137 -5.123 2.240 2.918 1093 HA ASN 137 HA ASN 137 -3.775 1.160 0.483 1094 HB2 ASN 137 HB2 ASN 137 -2.883 3.241 1.036 1095 HB3 ASN 137 HB3 ASN 137 -2.947 2.947 2.756 1096 HD21 ASN 137 HD22 ASN 137 -1.266 1.916 -0.203 1097 HD22 ASN 137 HD21 ASN 137 0.237 1.513 0.632 Start of MODEL 17 1 H1 GLY -1 H GLY -1 1.063 -1.261 -0.378 2 HA2 GLY -1 HA2 GLY -1 2.676 0.448 -1.131 3 HA3 GLY -1 HA3 GLY -1 2.374 -0.877 -2.250 4 H GLY 0 H GLY 0 0.471 2.087 -1.674 5 HA2 GLY 0 HA2 GLY 0 0.711 2.976 -4.492 6 HA3 GLY 0 HA3 GLY 0 -0.870 2.507 -3.879 7 H ALA 1 H ALA 1 -0.724 5.034 -4.725 8 HA ALA 1 HA ALA 1 -1.114 6.684 -2.350 9 HB1 ALA 1 HB1 ALA 1 1.266 6.745 -2.334 10 HB2 ALA 1 HB2 ALA 1 1.338 6.944 -4.104 11 HB3 ALA 1 HB3 ALA 1 0.750 8.249 -3.061 12 H LEU 2 H LEU 2 -1.252 9.089 -3.085 13 HA LEU 2 HA LEU 2 -3.129 9.268 -5.419 14 HB2 LEU 2 HB2 LEU 2 -3.174 10.627 -2.693 15 HB3 LEU 2 HB3 LEU 2 -4.363 10.854 -3.965 16 HG LEU 2 HG LEU 2 -3.887 8.139 -2.714 17 HD11 LEU 2 HD11 LEU 2 -4.478 9.711 -0.919 18 HD12 LEU 2 HD12 LEU 2 -5.963 10.143 -1.802 19 HD13 LEU 2 HD13 LEU 2 -5.713 8.483 -1.225 20 HD21 LEU 2 HD21 LEU 2 -6.328 9.324 -4.099 21 HD22 LEU 2 HD22 LEU 2 -5.152 8.223 -4.843 22 HD23 LEU 2 HD23 LEU 2 -6.148 7.665 -3.493 23 H SER 3 H SER 3 -3.209 11.327 -6.522 24 HA SER 3 HA SER 3 -0.619 12.574 -6.883 25 HB2 SER 3 HB2 SER 3 -2.411 12.342 -8.633 26 HB3 SER 3 HB3 SER 3 -3.317 13.624 -7.795 27 HG SER 3 HG SER 3 -1.946 14.379 -9.528 28 H TYR 4 H TYR 4 -0.172 14.927 -6.685 29 HA TYR 4 HA TYR 4 -0.327 15.899 -4.049 30 HB2 TYR 4 HB2 TYR 4 1.298 16.696 -5.697 31 HB3 TYR 4 HB3 TYR 4 0.027 17.425 -6.661 32 HD1 TYR 4 HD1 TYR 4 -1.111 19.495 -5.919 33 HD2 TYR 4 HD2 TYR 4 2.116 17.760 -3.652 34 HE1 TYR 4 HE1 TYR 4 -0.939 21.584 -4.578 35 HE2 TYR 4 HE2 TYR 4 2.283 19.852 -2.291 36 HH TYR 4 HH TYR 4 0.151 22.663 -2.893 37 H GLU 5 H GLU 5 -2.424 16.735 -6.804 38 HA GLU 5 HA GLU 5 -3.969 18.773 -5.556 39 HB2 GLU 5 HB2 GLU 5 -4.831 16.891 -7.794 40 HB3 GLU 5 HB3 GLU 5 -5.507 18.482 -7.418 41 HG2 GLU 5 HG2 GLU 5 -3.164 19.419 -7.816 42 HG3 GLU 5 HG3 GLU 5 -2.745 17.845 -8.501 43 H THR 6 H THR 6 -4.015 15.486 -4.879 44 HA THR 6 HA THR 6 -6.800 15.017 -4.377 45 HB THR 6 HB THR 6 -4.437 13.570 -3.151 46 HG1 THR 6 HG1 THR 6 -4.166 13.310 -5.159 47 HG21 THR 6 HG21 THR 6 -5.994 12.437 -2.036 48 HG22 THR 6 HG22 THR 6 -7.334 13.205 -2.885 49 HG23 THR 6 HG23 THR 6 -6.551 11.781 -3.590 50 H GLU 7 H GLU 7 -7.661 16.697 -3.157 51 HA GLU 7 HA GLU 7 -6.562 17.507 -0.655 52 HB2 GLU 7 HB2 GLU 7 -9.447 17.835 -1.494 53 HB3 GLU 7 HB3 GLU 7 -8.541 18.788 -0.316 54 HG2 GLU 7 HG2 GLU 7 -6.967 19.391 -2.282 55 HG3 GLU 7 HG3 GLU 7 -8.219 18.734 -3.336 56 H ILE 8 H ILE 8 -6.852 16.893 1.373 57 HA ILE 8 HA ILE 8 -8.696 14.626 2.047 58 HB ILE 8 HB ILE 8 -6.053 15.388 3.359 59 HG12 ILE 8 HG12 ILE 8 -5.471 14.557 1.217 60 HG13 ILE 8 HG13 ILE 8 -5.111 13.323 2.409 61 HG21 ILE 8 HG21 ILE 8 -7.554 14.287 4.933 62 HG22 ILE 8 HG22 ILE 8 -7.868 12.973 3.786 63 HG23 ILE 8 HG23 ILE 8 -6.252 13.181 4.486 64 HD11 ILE 8 HD11 ILE 8 -6.130 11.928 0.923 65 HD12 ILE 8 HD12 ILE 8 -7.650 12.553 1.577 66 HD13 ILE 8 HD13 ILE 8 -6.965 13.254 0.104 67 H LEU 9 H LEU 9 -10.293 15.241 3.338 68 HA LEU 9 HA LEU 9 -10.479 17.802 4.631 69 HB2 LEU 9 HB2 LEU 9 -12.392 16.301 3.860 70 HB3 LEU 9 HB3 LEU 9 -11.998 15.218 5.192 71 HG LEU 9 HG LEU 9 -12.384 17.257 6.752 72 HD11 LEU 9 HD11 LEU 9 -12.358 19.029 5.004 73 HD12 LEU 9 HD12 LEU 9 -13.793 18.294 4.255 74 HD13 LEU 9 HD13 LEU 9 -13.894 18.994 5.881 75 HD21 LEU 9 HD21 LEU 9 -14.732 16.172 5.136 76 HD22 LEU 9 HD22 LEU 9 -13.967 15.364 6.518 77 HD23 LEU 9 HD23 LEU 9 -14.811 16.898 6.760 78 H THR 10 H THR 10 -9.471 18.465 6.433 79 HA THR 10 HA THR 10 -8.812 16.503 8.574 80 HB THR 10 HB THR 10 -6.866 17.843 9.150 81 HG1 THR 10 HG1 THR 10 -6.339 19.378 7.282 82 HG21 THR 10 HG21 THR 10 -6.391 16.078 7.595 83 HG22 THR 10 HG22 THR 10 -6.871 17.072 6.208 84 HG23 THR 10 HG23 THR 10 -5.428 17.489 7.152 85 H VAL 11 H VAL 11 -8.785 17.234 10.733 86 HA VAL 11 HA VAL 11 -10.869 19.225 11.353 87 HB VAL 11 HB VAL 11 -9.086 17.632 13.214 88 HG11 VAL 11 HG11 VAL 11 -9.969 19.530 14.440 89 HG12 VAL 11 HG12 VAL 11 -11.602 19.240 13.796 90 HG13 VAL 11 HG13 VAL 11 -10.855 18.087 14.924 91 HG21 VAL 11 HG21 VAL 11 -11.986 17.144 12.414 92 HG22 VAL 11 HG22 VAL 11 -10.614 16.191 11.820 93 HG23 VAL 11 HG23 VAL 11 -11.019 16.169 13.537 94 H GLU 12 H GLU 12 -7.347 19.111 11.399 95 HA GLU 12 HA GLU 12 -6.891 21.469 12.963 96 HB2 GLU 12 HB2 GLU 12 -5.335 19.837 10.976 97 HB3 GLU 12 HB3 GLU 12 -4.704 21.431 11.389 98 HG2 GLU 12 HG2 GLU 12 -5.310 19.228 13.399 99 HG3 GLU 12 HG3 GLU 12 -3.718 19.657 12.777 100 H TYR 13 H TYR 13 -7.586 21.115 9.487 101 HA TYR 13 HA TYR 13 -7.780 24.095 9.285 102 HB2 TYR 13 HB2 TYR 13 -6.242 22.275 7.405 103 HB3 TYR 13 HB3 TYR 13 -6.586 23.970 7.105 104 HD1 TYR 13 HD1 TYR 13 -5.880 25.593 9.174 105 HD2 TYR 13 HD2 TYR 13 -4.067 21.804 8.181 106 HE1 TYR 13 HE1 TYR 13 -3.798 26.286 10.344 107 HE2 TYR 13 HE2 TYR 13 -1.972 22.510 9.332 108 HH TYR 13 HH TYR 13 -1.678 25.698 10.933 109 H GLY 14 H GLY 14 -8.406 21.025 7.444 110 HA2 GLY 14 HA2 GLY 14 -10.920 20.935 6.746 111 HA3 GLY 14 HA3 GLY 14 -10.553 22.463 5.940 112 H LEU 15 H LEU 15 -10.803 21.798 3.857 113 HA LEU 15 HA LEU 15 -9.599 19.390 2.722 114 HB2 LEU 15 HB2 LEU 15 -10.830 21.888 1.466 115 HB3 LEU 15 HB3 LEU 15 -10.362 20.442 0.576 116 HG LEU 15 HG LEU 15 -12.509 20.546 2.748 117 HD11 LEU 15 HD11 LEU 15 -13.181 21.738 0.717 118 HD12 LEU 15 HD12 LEU 15 -12.740 20.333 -0.278 119 HD13 LEU 15 HD13 LEU 15 -14.082 20.225 0.888 120 HD21 LEU 15 HD21 LEU 15 -11.548 18.314 0.921 121 HD22 LEU 15 HD22 LEU 15 -11.542 18.331 2.687 122 HD23 LEU 15 HD23 LEU 15 -13.084 18.268 1.832 123 H LEU 16 H LEU 16 -7.396 19.297 2.804 124 HA LEU 16 HA LEU 16 -5.881 21.386 1.304 125 HB2 LEU 16 HB2 LEU 16 -5.218 20.002 3.930 126 HB3 LEU 16 HB3 LEU 16 -3.965 20.732 2.939 127 HG LEU 16 HG LEU 16 -6.316 22.237 4.167 128 HD11 LEU 16 HD11 LEU 16 -4.650 21.439 5.785 129 HD12 LEU 16 HD12 LEU 16 -3.339 22.161 4.826 130 HD13 LEU 16 HD13 LEU 16 -4.553 23.203 5.600 131 HD21 LEU 16 HD21 LEU 16 -3.895 23.230 2.585 132 HD22 LEU 16 HD22 LEU 16 -5.604 23.358 2.101 133 HD23 LEU 16 HD23 LEU 16 -5.019 24.265 3.493 134 HA PRO 17 HA PRO 17 -4.347 18.145 -1.228 135 HB2 PRO 17 HB2 PRO 17 -1.841 19.072 -1.929 136 HB3 PRO 17 HB3 PRO 17 -3.379 19.739 -2.560 137 HG2 PRO 17 HG2 PRO 17 -1.680 20.766 -0.280 138 HG3 PRO 17 HG3 PRO 17 -2.395 21.697 -1.636 139 HD2 PRO 17 HD2 PRO 17 -3.559 21.598 0.805 140 HD3 PRO 17 HD3 PRO 17 -4.555 21.573 -0.679 141 H ILE 18 H ILE 18 -3.675 16.153 -0.709 142 HA ILE 18 HA ILE 18 -2.310 15.452 1.626 143 HB ILE 18 HB ILE 18 -3.671 13.932 0.216 144 HG12 ILE 18 HG12 ILE 18 -0.927 12.767 0.811 145 HG13 ILE 18 HG13 ILE 18 -2.087 13.218 2.067 146 HG21 ILE 18 HG21 ILE 18 -2.650 14.496 -2.003 147 HG22 ILE 18 HG22 ILE 18 -1.218 13.560 -1.541 148 HG23 ILE 18 HG23 ILE 18 -2.788 12.765 -1.686 149 HD11 ILE 18 HD11 ILE 18 -3.750 11.634 1.081 150 HD12 ILE 18 HD12 ILE 18 -2.505 11.096 -0.071 151 HD13 ILE 18 HD13 ILE 18 -2.275 10.858 1.671 152 H GLY 19 H GLY 19 -0.868 16.252 -1.545 153 HA2 GLY 19 HA2 GLY 19 1.727 15.230 -0.951 154 HA3 GLY 19 HA3 GLY 19 1.345 16.458 -2.162 155 H LYS 20 H LYS 20 0.246 18.382 -0.160 156 HA LYS 20 HA LYS 20 2.764 19.566 0.739 157 HB2 LYS 20 HB2 LYS 20 0.666 20.780 -0.079 158 HB3 LYS 20 HB3 LYS 20 -0.058 20.420 1.497 159 HG2 LYS 20 HG2 LYS 20 1.821 21.678 2.598 160 HG3 LYS 20 HG3 LYS 20 2.541 21.950 1.008 161 HD2 LYS 20 HD2 LYS 20 1.411 23.971 1.455 162 HD3 LYS 20 HD3 LYS 20 0.365 23.112 0.337 163 HE2 LYS 20 HE2 LYS 20 -1.162 23.881 1.902 164 HE3 LYS 20 HE3 LYS 20 -0.870 22.238 2.480 165 HZ1 LYS 20 HZ1 LYS 20 0.746 23.223 4.087 166 HZ2 LYS 20 HZ2 LYS 20 0.394 24.722 3.539 167 HZ3 LYS 20 HZ3 LYS 20 -0.753 23.850 4.299 168 H ILE 21 H ILE 21 0.208 17.638 2.200 169 HA ILE 21 HA ILE 21 1.028 18.070 4.948 170 HB ILE 21 HB ILE 21 -0.736 15.959 3.695 171 HG12 ILE 21 HG12 ILE 21 -1.578 18.282 5.480 172 HG13 ILE 21 HG13 ILE 21 -1.473 18.473 3.736 173 HG21 ILE 21 HG21 ILE 21 0.029 14.920 5.652 174 HG22 ILE 21 HG22 ILE 21 -0.083 16.409 6.609 175 HG23 ILE 21 HG23 ILE 21 -1.544 15.563 6.082 176 HD11 ILE 21 HD11 ILE 21 -3.146 16.713 3.377 177 HD12 ILE 21 HD12 ILE 21 -3.311 16.490 5.134 178 HD13 ILE 21 HD13 ILE 21 -3.766 18.027 4.388 179 H VAL 22 H VAL 22 1.707 15.607 2.464 180 HA VAL 22 HA VAL 22 3.392 14.049 4.268 181 HB VAL 22 HB VAL 22 2.784 13.903 1.307 182 HG11 VAL 22 HG11 VAL 22 4.927 12.860 1.518 183 HG12 VAL 22 HG12 VAL 22 4.465 11.997 2.993 184 HG13 VAL 22 HG13 VAL 22 3.735 11.563 1.441 185 HG21 VAL 22 HG21 VAL 22 1.889 12.203 3.692 186 HG22 VAL 22 HG22 VAL 22 0.886 13.379 2.823 187 HG23 VAL 22 HG23 VAL 22 1.433 11.913 2.012 188 H GLU 23 H GLU 23 4.077 16.396 1.648 189 HA GLU 23 HA GLU 23 6.941 16.021 1.682 190 HB2 GLU 23 HB2 GLU 23 5.161 18.326 0.808 191 HB3 GLU 23 HB3 GLU 23 6.907 18.410 0.694 192 HG2 GLU 23 HG2 GLU 23 5.415 16.105 -0.587 193 HG3 GLU 23 HG3 GLU 23 5.581 17.662 -1.396 194 H LYS 24 H LYS 24 4.784 17.841 3.749 195 HA LYS 24 HA LYS 24 7.129 19.014 5.218 196 HB2 LYS 24 HB2 LYS 24 4.266 20.015 5.167 197 HB3 LYS 24 HB3 LYS 24 5.637 20.805 5.929 198 HG2 LYS 24 HG2 LYS 24 5.236 20.387 2.939 199 HG3 LYS 24 HG3 LYS 24 4.992 21.887 3.836 200 HD2 LYS 24 HD2 LYS 24 7.432 21.846 4.487 201 HD3 LYS 24 HD3 LYS 24 7.650 20.451 3.409 202 HE2 LYS 24 HE2 LYS 24 6.831 21.789 1.492 203 HE3 LYS 24 HE3 LYS 24 6.583 23.178 2.562 204 HZ1 LYS 24 HZ1 LYS 24 8.985 23.183 3.001 205 HZ2 LYS 24 HZ2 LYS 24 9.216 21.910 1.998 206 HZ3 LYS 24 HZ3 LYS 24 8.704 23.341 1.401 207 H ARG 25 H ARG 25 5.089 16.506 5.501 208 HA ARG 25 HA ARG 25 4.230 15.192 7.149 209 HB2 ARG 25 HB2 ARG 25 6.659 16.149 8.683 210 HB3 ARG 25 HB3 ARG 25 5.715 14.715 9.040 211 HG2 ARG 25 HG2 ARG 25 6.896 13.471 7.622 212 HG3 ARG 25 HG3 ARG 25 6.531 14.540 6.258 213 HD2 ARG 25 HD2 ARG 25 8.426 15.925 6.687 214 HD3 ARG 25 HD3 ARG 25 8.658 15.242 8.311 215 HE ARG 25 HE ARG 25 8.937 13.133 6.426 216 HH11 ARG 25 HH11 ARG 25 10.692 16.008 7.410 217 HH12 ARG 25 HH12 ARG 25 12.249 15.267 7.133 218 HH21 ARG 25 HH21 ARG 25 10.963 12.238 6.127 219 HH22 ARG 25 HH22 ARG 25 12.390 13.195 6.425 220 H ILE 26 H ILE 26 2.621 17.130 7.047 221 HA ILE 26 HA ILE 26 2.544 18.866 9.389 222 HB ILE 26 HB ILE 26 0.380 18.440 7.299 223 HG12 ILE 26 HG12 ILE 26 2.641 20.490 7.442 224 HG13 ILE 26 HG13 ILE 26 2.518 19.162 6.290 225 HG21 ILE 26 HG21 ILE 26 -0.428 19.466 9.423 226 HG22 ILE 26 HG22 ILE 26 0.838 20.708 9.291 227 HG23 ILE 26 HG23 ILE 26 -0.472 20.611 8.093 228 HD11 ILE 26 HD11 ILE 26 0.380 20.174 5.420 229 HD12 ILE 26 HD12 ILE 26 0.746 21.604 6.418 230 HD13 ILE 26 HD13 ILE 26 1.865 21.103 5.132 231 H GLU 27 H GLU 27 1.968 18.243 11.306 232 HA GLU 27 HA GLU 27 0.530 15.788 11.925 233 HB2 GLU 27 HB2 GLU 27 1.505 18.129 13.591 234 HB3 GLU 27 HB3 GLU 27 0.513 16.821 14.261 235 HG2 GLU 27 HG2 GLU 27 2.152 15.143 13.579 236 HG3 GLU 27 HG3 GLU 27 3.145 16.377 12.799 237 H CYS 28 H CYS 28 -1.506 15.550 11.408 238 HA CYS 28 HA CYS 28 -3.511 17.502 12.317 239 HB2 CYS 28 HB2 CYS 28 -4.575 17.554 10.052 240 HB3 CYS 28 HB3 CYS 28 -2.987 18.314 10.095 241 HG CYS 28 HG CYS 28 -1.630 16.349 9.097 242 H THR 29 H THR 29 -5.710 16.756 11.921 243 HA THR 29 HA THR 29 -6.033 13.846 12.535 244 HB THR 29 HB THR 29 -8.311 15.742 12.776 245 HG1 THR 29 HG1 THR 29 -6.208 15.811 14.664 246 HG21 THR 29 HG21 THR 29 -8.570 13.455 13.528 247 HG22 THR 29 HG22 THR 29 -7.228 13.651 14.692 248 HG23 THR 29 HG23 THR 29 -8.736 14.577 14.883 249 H VAL 30 H VAL 30 -7.635 12.655 11.382 250 HA VAL 30 HA VAL 30 -8.753 13.886 8.889 251 HB VAL 30 HB VAL 30 -8.229 11.922 7.613 252 HG11 VAL 30 HG11 VAL 30 -6.557 13.769 7.767 253 HG12 VAL 30 HG12 VAL 30 -5.671 12.816 8.985 254 HG13 VAL 30 HG13 VAL 30 -5.885 12.198 7.339 255 HG21 VAL 30 HG21 VAL 30 -6.817 10.799 10.067 256 HG22 VAL 30 HG22 VAL 30 -8.274 10.140 9.285 257 HG23 VAL 30 HG23 VAL 30 -6.727 10.130 8.432 258 H TYR 31 H TYR 31 -10.509 12.553 7.940 259 HA TYR 31 HA TYR 31 -12.272 11.520 10.099 260 HB2 TYR 31 HB2 TYR 31 -12.868 12.657 7.348 261 HB3 TYR 31 HB3 TYR 31 -14.066 11.913 8.369 262 HD1 TYR 31 HD1 TYR 31 -11.602 14.761 8.298 263 HD2 TYR 31 HD2 TYR 31 -15.296 13.206 9.899 264 HE1 TYR 31 HE1 TYR 31 -12.100 16.977 9.310 265 HE2 TYR 31 HE2 TYR 31 -15.799 15.428 10.893 266 HH TYR 31 HH TYR 31 -13.606 18.225 10.492 267 H SER 32 H SER 32 -13.435 9.579 9.776 268 HA SER 32 HA SER 32 -13.121 7.892 7.401 269 HB2 SER 32 HB2 SER 32 -10.960 7.456 8.304 270 HB3 SER 32 HB3 SER 32 -11.569 7.440 9.962 271 HG SER 32 HG SER 32 -11.078 5.376 8.716 272 H VAL 33 H VAL 33 -14.591 6.145 7.426 273 HA VAL 33 HA VAL 33 -16.698 6.048 9.460 274 HB VAL 33 HB VAL 33 -17.521 5.729 7.299 275 HG11 VAL 33 HG11 VAL 33 -15.446 5.188 6.116 276 HG12 VAL 33 HG12 VAL 33 -15.455 3.567 6.833 277 HG13 VAL 33 HG13 VAL 33 -16.740 4.056 5.703 278 HG21 VAL 33 HG21 VAL 33 -17.377 2.908 8.252 279 HG22 VAL 33 HG22 VAL 33 -18.370 4.187 9.020 280 HG23 VAL 33 HG23 VAL 33 -18.646 3.725 7.322 281 H ASP 34 H ASP 34 -16.849 4.755 11.168 282 HA ASP 34 HA ASP 34 -14.801 2.666 11.653 283 HB2 ASP 34 HB2 ASP 34 -16.033 4.402 13.378 284 HB3 ASP 34 HB3 ASP 34 -17.085 3.027 13.551 285 H ASN 35 H ASN 35 -15.866 0.662 12.835 286 HA ASN 35 HA ASN 35 -17.222 -0.954 10.906 287 HB2 ASN 35 HB2 ASN 35 -15.817 -1.459 13.183 288 HB3 ASN 35 HB3 ASN 35 -17.424 -1.600 13.847 289 HD21 ASN 35 HD22 ASN 35 -17.296 -3.866 14.214 290 HD22 ASN 35 HD21 ASN 35 -17.168 -5.013 12.885 291 H ASN 36 H ASN 36 -18.484 1.305 13.191 292 HA ASN 36 HA ASN 36 -21.181 0.229 13.302 293 HB2 ASN 36 HB2 ASN 36 -20.099 2.953 14.182 294 HB3 ASN 36 HB3 ASN 36 -21.633 2.234 14.662 295 HD21 ASN 36 HD22 ASN 36 -18.495 2.729 15.722 296 HD22 ASN 36 HD21 ASN 36 -18.423 1.408 16.877 297 H GLY 37 H GLY 37 -19.482 2.093 10.972 298 HA2 GLY 37 HA2 GLY 37 -20.219 3.073 9.018 299 HA3 GLY 37 HA3 GLY 37 -21.883 2.922 9.494 300 H ASN 38 H ASN 38 -20.114 4.426 11.985 301 HA ASN 38 HA ASN 38 -21.136 7.129 11.226 302 HB2 ASN 38 HB2 ASN 38 -20.112 5.956 13.853 303 HB3 ASN 38 HB3 ASN 38 -20.422 7.671 13.603 304 HD21 ASN 38 HD22 ASN 38 -21.988 4.508 13.902 305 HD22 ASN 38 HD21 ASN 38 -23.601 5.168 14.093 306 H ILE 39 H ILE 39 -19.804 8.660 10.503 307 HA ILE 39 HA ILE 39 -16.984 8.245 10.151 308 HB ILE 39 HB ILE 39 -18.427 10.903 9.979 309 HG12 ILE 39 HG12 ILE 39 -19.708 9.470 8.545 310 HG13 ILE 39 HG13 ILE 39 -18.662 10.477 7.565 311 HG21 ILE 39 HG21 ILE 39 -15.964 11.005 9.949 312 HG22 ILE 39 HG22 ILE 39 -15.905 9.820 8.637 313 HG23 ILE 39 HG23 ILE 39 -16.626 11.417 8.360 314 HD11 ILE 39 HD11 ILE 39 -17.139 8.550 7.186 315 HD12 ILE 39 HD12 ILE 39 -18.153 7.558 8.264 316 HD13 ILE 39 HD13 ILE 39 -18.810 8.136 6.735 317 H TYR 40 H TYR 40 -15.467 8.495 11.525 318 HA TYR 40 HA TYR 40 -15.717 10.330 13.892 319 HB2 TYR 40 HB2 TYR 40 -14.512 8.800 15.233 320 HB3 TYR 40 HB3 TYR 40 -15.804 7.887 14.484 321 HD1 TYR 40 HD2 TYR 40 -15.281 6.274 12.599 322 HD2 TYR 40 HD1 TYR 40 -12.176 8.281 14.829 323 HE1 TYR 40 HE2 TYR 40 -13.578 4.729 11.645 324 HE2 TYR 40 HE1 TYR 40 -10.504 6.681 13.900 325 HH TYR 40 HH TYR 40 -10.127 5.165 12.248 326 H THR 41 H THR 41 -13.457 10.904 14.762 327 HA THR 41 HA THR 41 -11.617 11.480 12.488 328 HB THR 41 HB THR 41 -10.983 13.565 13.804 329 HG1 THR 41 HG1 THR 41 -12.054 13.086 15.737 330 HG21 THR 41 HG21 THR 41 -12.183 13.765 11.757 331 HG22 THR 41 HG22 THR 41 -13.718 13.278 12.517 332 HG23 THR 41 HG23 THR 41 -12.974 14.829 12.935 333 H GLN 42 H GLN 42 -9.485 11.221 12.707 334 HA GLN 42 HA GLN 42 -8.362 10.313 15.309 335 HB2 GLN 42 HB2 GLN 42 -7.494 8.286 14.293 336 HB3 GLN 42 HB3 GLN 42 -9.243 8.369 14.129 337 HG2 GLN 42 HG2 GLN 42 -8.849 9.267 11.736 338 HG3 GLN 42 HG3 GLN 42 -7.151 8.826 11.960 339 HE21 GLN 42 HE22 GLN 42 -7.280 6.330 13.192 340 HE22 GLN 42 HE21 GLN 42 -8.011 5.245 12.018 341 HA PRO 43 HA PRO 43 -4.822 12.615 13.874 342 HB2 PRO 43 HB2 PRO 43 -2.820 11.625 15.451 343 HB3 PRO 43 HB3 PRO 43 -4.147 12.652 16.075 344 HG2 PRO 43 HG2 PRO 43 -3.943 9.628 16.149 345 HG3 PRO 43 HG3 PRO 43 -4.378 10.749 17.483 346 HD2 PRO 43 HD2 PRO 43 -6.259 9.438 16.014 347 HD3 PRO 43 HD3 PRO 43 -6.527 11.102 16.614 348 H VAL 44 H VAL 44 -3.099 12.494 12.457 349 HA VAL 44 HA VAL 44 -2.611 10.157 10.866 350 HB VAL 44 HB VAL 44 -2.280 12.491 10.129 351 HG11 VAL 44 HG11 VAL 44 -1.096 13.374 12.174 352 HG12 VAL 44 HG12 VAL 44 0.346 12.473 11.669 353 HG13 VAL 44 HG13 VAL 44 -0.306 13.755 10.632 354 HG21 VAL 44 HG21 VAL 44 0.267 10.869 9.829 355 HG22 VAL 44 HG22 VAL 44 -1.239 10.554 8.943 356 HG23 VAL 44 HG23 VAL 44 -0.378 12.084 8.722 357 H ALA 45 H ALA 45 -0.982 8.607 10.906 358 HA ALA 45 HA ALA 45 0.567 8.365 13.452 359 HB1 ALA 45 HB1 ALA 45 -0.911 6.498 12.764 360 HB2 ALA 45 HB2 ALA 45 0.031 6.311 11.269 361 HB3 ALA 45 HB3 ALA 45 0.794 6.022 12.839 362 H GLN 46 H GLN 46 0.985 8.696 9.951 363 HA GLN 46 HA GLN 46 3.709 9.565 10.101 364 HB2 GLN 46 HB2 GLN 46 4.737 7.689 8.828 365 HB3 GLN 46 HB3 GLN 46 4.360 7.385 10.501 366 HG2 GLN 46 HG2 GLN 46 2.113 6.323 9.420 367 HG3 GLN 46 HG3 GLN 46 3.174 6.218 8.012 368 HE21 GLN 46 HE22 GLN 46 3.138 5.574 11.570 369 HE22 GLN 46 HE21 GLN 46 4.125 4.133 11.474 370 H TRP 47 H TRP 47 4.682 9.440 7.702 371 HA TRP 47 HA TRP 47 2.576 10.070 5.679 372 HB2 TRP 47 HB2 TRP 47 5.046 11.753 6.230 373 HB3 TRP 47 HB3 TRP 47 3.788 12.053 5.049 374 HD1 TRP 47 HD1 TRP 47 1.785 13.495 5.791 375 HE1 TRP 47 HE1 TRP 47 1.069 14.668 7.956 376 HE3 TRP 47 HE3 TRP 47 5.246 11.456 8.956 377 HZ2 TRP 47 HZ2 TRP 47 1.906 14.681 10.726 378 HZ3 TRP 47 HZ3 TRP 47 5.259 12.059 11.364 379 HH2 TRP 47 HH2 TRP 47 3.592 13.668 12.260 380 H HIS 48 H HIS 48 2.924 8.895 3.890 381 HA HIS 48 HA HIS 48 5.642 7.781 3.347 382 HB2 HIS 48 HB2 HIS 48 2.986 6.761 2.298 383 HB3 HIS 48 HB3 HIS 48 4.564 6.020 2.146 384 HD1 HIS 48 HD1 HIS 48 5.618 5.029 4.569 385 HD2 HIS 48 HD2 HIS 48 1.535 6.029 4.338 386 HE1 HIS 48 HE1 HIS 48 4.472 3.806 6.489 387 H ASP 49 H ASP 49 6.729 8.720 1.802 388 HA ASP 49 HA ASP 49 5.340 9.982 -0.520 389 HB2 ASP 49 HB2 ASP 49 7.258 11.398 -0.771 390 HB3 ASP 49 HB3 ASP 49 6.644 11.551 0.866 391 H ARG 50 H ARG 50 5.313 8.829 -2.247 392 HA ARG 50 HA ARG 50 7.094 6.501 -2.590 393 HB2 ARG 50 HB2 ARG 50 5.055 7.585 -4.547 394 HB3 ARG 50 HB3 ARG 50 5.670 5.943 -4.405 395 HG2 ARG 50 HG2 ARG 50 3.764 7.356 -2.476 396 HG3 ARG 50 HG3 ARG 50 3.402 6.027 -3.554 397 HD2 ARG 50 HD2 ARG 50 5.180 4.684 -2.256 398 HD3 ARG 50 HD3 ARG 50 5.115 5.985 -1.059 399 HE ARG 50 HE ARG 50 2.444 5.091 -1.641 400 HH11 ARG 50 HH11 ARG 50 5.277 3.921 0.063 401 HH12 ARG 50 HH12 ARG 50 4.315 3.025 1.210 402 HH21 ARG 50 HH21 ARG 50 1.298 4.033 -0.145 403 HH22 ARG 50 HH22 ARG 50 2.109 3.187 1.156 404 H GLY 51 H GLY 51 6.749 9.702 -3.921 405 HA2 GLY 51 HA2 GLY 51 8.466 10.976 -4.912 406 HA3 GLY 51 HA3 GLY 51 9.354 9.501 -5.288 407 H GLU 52 H GLU 52 7.400 8.017 -6.682 408 HA GLU 52 HA GLU 52 6.254 9.342 -8.937 409 HB2 GLU 52 HB2 GLU 52 7.932 8.893 -10.633 410 HB3 GLU 52 HB3 GLU 52 8.334 10.195 -9.563 411 HG2 GLU 52 HG2 GLU 52 9.837 8.587 -8.274 412 HG3 GLU 52 HG3 GLU 52 9.546 7.410 -9.546 413 H GLN 53 H GLN 53 4.727 7.786 -8.735 414 HA GLN 53 HA GLN 53 5.427 5.159 -10.005 415 HB2 GLN 53 HB2 GLN 53 3.252 5.802 -7.994 416 HB3 GLN 53 HB3 GLN 53 3.593 4.190 -8.694 417 HG2 GLN 53 HG2 GLN 53 5.978 4.452 -7.772 418 HG3 GLN 53 HG3 GLN 53 5.371 5.875 -6.883 419 HE21 GLN 53 HE22 GLN 53 2.906 5.064 -5.875 420 HE22 GLN 53 HE21 GLN 53 3.659 4.299 -4.545 421 H GLU 54 H GLU 54 3.684 4.073 -11.096 422 HA GLU 54 HA GLU 54 2.692 5.614 -13.268 423 HB2 GLU 54 HB2 GLU 54 1.723 3.482 -14.022 424 HB3 GLU 54 HB3 GLU 54 3.423 3.401 -13.595 425 HG2 GLU 54 HG2 GLU 54 2.716 2.390 -11.358 426 HG3 GLU 54 HG3 GLU 54 1.086 2.256 -12.017 427 H VAL 55 H VAL 55 1.224 7.148 -12.961 428 HA VAL 55 HA VAL 55 -1.179 6.708 -11.287 429 HB VAL 55 HB VAL 55 -0.335 9.218 -12.793 430 HG11 VAL 55 HG11 VAL 55 -2.755 9.137 -12.163 431 HG12 VAL 55 HG12 VAL 55 -2.284 8.827 -10.478 432 HG13 VAL 55 HG13 VAL 55 -1.864 10.366 -11.269 433 HG21 VAL 55 HG21 VAL 55 0.251 8.242 -9.982 434 HG22 VAL 55 HG22 VAL 55 1.375 8.890 -11.189 435 HG23 VAL 55 HG23 VAL 55 0.235 9.968 -10.377 436 H PHE 56 H PHE 56 -3.186 6.512 -12.007 437 HA PHE 56 HA PHE 56 -3.764 6.603 -14.948 438 HB2 PHE 56 HB2 PHE 56 -4.714 4.662 -12.814 439 HB3 PHE 56 HB3 PHE 56 -5.481 4.854 -14.387 440 HD1 PHE 56 HD2 PHE 56 -2.127 4.072 -12.837 441 HD2 PHE 56 HD1 PHE 56 -4.741 3.600 -16.229 442 HE1 PHE 56 HE2 PHE 56 -0.485 2.548 -13.891 443 HE2 PHE 56 HE1 PHE 56 -3.131 1.999 -17.237 444 HZ PHE 56 HZ PHE 56 -0.975 1.518 -16.098 445 H GLU 57 H GLU 57 -5.478 7.749 -15.558 446 HA GLU 57 HA GLU 57 -6.794 9.607 -13.805 447 HB2 GLU 57 HB2 GLU 57 -6.359 9.776 -16.325 448 HB3 GLU 57 HB3 GLU 57 -7.704 8.667 -16.562 449 HG2 GLU 57 HG2 GLU 57 -9.253 10.244 -15.526 450 HG3 GLU 57 HG3 GLU 57 -7.916 11.270 -14.990 451 H TYR 58 H TYR 58 -8.458 9.252 -12.456 452 HA TYR 58 HA TYR 58 -10.274 6.935 -12.907 453 HB2 TYR 58 HB2 TYR 58 -8.985 6.487 -11.002 454 HB3 TYR 58 HB3 TYR 58 -9.085 8.142 -10.406 455 HD1 TYR 58 HD1 TYR 58 -12.160 6.483 -11.659 456 HD2 TYR 58 HD2 TYR 58 -9.693 7.226 -8.187 457 HE1 TYR 58 HE1 TYR 58 -13.976 5.723 -10.210 458 HE2 TYR 58 HE2 TYR 58 -11.546 6.416 -6.725 459 HH TYR 58 HH TYR 58 -14.672 5.333 -8.152 460 H CYS 59 H CYS 59 -11.852 7.847 -14.059 461 HA CYS 59 HA CYS 59 -13.165 10.314 -12.997 462 HB2 CYS 59 HB2 CYS 59 -12.170 10.440 -15.294 463 HB3 CYS 59 HB3 CYS 59 -13.268 9.146 -15.802 464 HG CYS 59 HG CYS 59 -14.159 12.006 -14.339 465 H LEU 60 H LEU 60 -15.353 10.348 -12.717 466 HA LEU 60 HA LEU 60 -16.689 7.697 -12.408 467 HB2 LEU 60 HB2 LEU 60 -16.239 9.988 -10.719 468 HB3 LEU 60 HB3 LEU 60 -17.944 9.921 -11.068 469 HG LEU 60 HG LEU 60 -18.114 7.671 -10.162 470 HD11 LEU 60 HD11 LEU 60 -15.896 6.778 -10.642 471 HD12 LEU 60 HD12 LEU 60 -15.159 7.960 -9.531 472 HD13 LEU 60 HD13 LEU 60 -16.244 6.686 -8.909 473 HD21 LEU 60 HD21 LEU 60 -16.627 9.612 -8.345 474 HD22 LEU 60 HD22 LEU 60 -18.339 9.733 -8.750 475 HD23 LEU 60 HD23 LEU 60 -17.761 8.331 -7.839 476 H GLU 61 H GLU 61 -18.998 7.657 -12.533 477 HA GLU 61 HA GLU 61 -19.931 8.507 -15.112 478 HB2 GLU 61 HB2 GLU 61 -21.402 7.376 -12.711 479 HB3 GLU 61 HB3 GLU 61 -22.106 7.506 -14.320 480 HG2 GLU 61 HG2 GLU 61 -19.596 5.869 -13.732 481 HG3 GLU 61 HG3 GLU 61 -21.224 5.237 -13.577 482 H ASP 62 H ASP 62 -20.192 10.039 -11.991 483 HA ASP 62 HA ASP 62 -22.299 11.945 -12.759 484 HB2 ASP 62 HB2 ASP 62 -22.030 11.149 -10.445 485 HB3 ASP 62 HB3 ASP 62 -20.405 11.834 -10.378 486 H GLY 63 H GLY 63 -18.815 11.792 -13.022 487 HA2 GLY 63 HA2 GLY 63 -17.773 13.350 -14.599 488 HA3 GLY 63 HA3 GLY 63 -18.659 14.674 -13.847 489 H SER 64 H SER 64 -17.799 12.955 -11.197 490 HA SER 64 HA SER 64 -15.730 14.632 -10.289 491 HB2 SER 64 HB2 SER 64 -16.105 11.746 -9.422 492 HB3 SER 64 HB3 SER 64 -15.427 13.074 -8.480 493 HG SER 64 HG SER 64 -17.498 14.041 -8.478 494 H LEU 65 H LEU 65 -13.501 14.492 -10.181 495 HA LEU 65 HA LEU 65 -12.160 12.504 -11.961 496 HB2 LEU 65 HB2 LEU 65 -12.670 14.989 -12.790 497 HB3 LEU 65 HB3 LEU 65 -11.287 15.394 -11.799 498 HG LEU 65 HG LEU 65 -10.511 15.175 -14.012 499 HD11 LEU 65 HD11 LEU 65 -9.061 13.951 -12.340 500 HD12 LEU 65 HD12 LEU 65 -9.808 12.432 -12.915 501 HD13 LEU 65 HD13 LEU 65 -8.881 13.446 -14.027 502 HD21 LEU 65 HD21 LEU 65 -11.994 12.528 -14.177 503 HD22 LEU 65 HD22 LEU 65 -12.391 14.039 -15.019 504 HD23 LEU 65 HD23 LEU 65 -10.905 13.167 -15.427 505 H ILE 66 H ILE 66 -10.613 11.462 -11.050 506 HA ILE 66 HA ILE 66 -9.109 12.461 -8.681 507 HB ILE 66 HB ILE 66 -10.298 9.675 -9.042 508 HG12 ILE 66 HG12 ILE 66 -11.296 11.809 -7.114 509 HG13 ILE 66 HG13 ILE 66 -12.090 11.412 -8.636 510 HG21 ILE 66 HG21 ILE 66 -8.274 9.636 -7.665 511 HG22 ILE 66 HG22 ILE 66 -8.873 10.998 -6.683 512 HG23 ILE 66 HG23 ILE 66 -9.650 9.408 -6.617 513 HD11 ILE 66 HD11 ILE 66 -12.553 9.139 -7.924 514 HD12 ILE 66 HD12 ILE 66 -11.814 9.463 -6.332 515 HD13 ILE 66 HD13 ILE 66 -13.259 10.342 -6.847 516 H ARG 67 H ARG 67 -6.997 11.542 -8.476 517 HA ARG 67 HA ARG 67 -5.932 9.951 -10.775 518 HB2 ARG 67 HB2 ARG 67 -4.878 12.622 -9.761 519 HB3 ARG 67 HB3 ARG 67 -3.891 11.473 -10.677 520 HG2 ARG 67 HG2 ARG 67 -5.560 11.516 -12.523 521 HG3 ARG 67 HG3 ARG 67 -6.473 12.769 -11.664 522 HD2 ARG 67 HD2 ARG 67 -4.660 14.333 -11.812 523 HD3 ARG 67 HD3 ARG 67 -3.537 13.074 -12.366 524 HE ARG 67 HE ARG 67 -5.635 13.151 -14.246 525 HH11 ARG 67 HH11 ARG 67 -3.059 15.298 -13.217 526 HH12 ARG 67 HH12 ARG 67 -2.871 15.985 -14.809 527 HH21 ARG 67 HH21 ARG 67 -5.358 14.087 -16.249 528 HH22 ARG 67 HH22 ARG 67 -4.130 15.304 -16.475 529 H ALA 68 H ALA 68 -5.198 8.170 -9.983 530 HA ALA 68 HA ALA 68 -3.488 8.125 -7.560 531 HB1 ALA 68 HB1 ALA 68 -5.911 7.770 -6.890 532 HB2 ALA 68 HB2 ALA 68 -5.925 6.320 -7.910 533 HB3 ALA 68 HB3 ALA 68 -4.832 6.405 -6.507 534 H THR 69 H THR 69 -2.501 5.966 -7.231 535 HA THR 69 HA THR 69 -1.624 4.722 -9.775 536 HB THR 69 HB THR 69 -0.237 3.309 -8.175 537 HG1 THR 69 HG1 THR 69 -1.800 3.926 -6.410 538 HG21 THR 69 HG21 THR 69 0.990 5.019 -9.092 539 HG22 THR 69 HG22 THR 69 0.004 6.310 -8.377 540 HG23 THR 69 HG23 THR 69 1.121 5.377 -7.356 541 H LYS 70 H LYS 70 -1.837 2.535 -10.225 542 HA LYS 70 HA LYS 70 -4.324 1.251 -9.597 543 HB2 LYS 70 HB2 LYS 70 -1.762 0.371 -10.961 544 HB3 LYS 70 HB3 LYS 70 -3.054 -0.794 -10.642 545 HG2 LYS 70 HG2 LYS 70 -4.658 0.446 -11.946 546 HG3 LYS 70 HG3 LYS 70 -3.561 1.816 -12.087 547 HD2 LYS 70 HD2 LYS 70 -3.528 0.732 -14.154 548 HD3 LYS 70 HD3 LYS 70 -1.972 0.376 -13.409 549 HE2 LYS 70 HE2 LYS 70 -4.320 -1.549 -13.378 550 HE3 LYS 70 HE3 LYS 70 -3.190 -1.464 -14.724 551 HZ1 LYS 70 HZ1 LYS 70 -1.371 -2.008 -13.214 552 HZ2 LYS 70 HZ2 LYS 70 -2.409 -2.206 -11.960 553 HZ3 LYS 70 HZ3 LYS 70 -2.492 -3.189 -13.257 554 H ASP 71 H ASP 71 -1.528 1.385 -7.743 555 HA ASP 71 HA ASP 71 -1.802 -1.222 -6.408 556 HB2 ASP 71 HB2 ASP 71 0.055 1.133 -5.894 557 HB3 ASP 71 HB3 ASP 71 0.196 -0.496 -5.219 558 H HIS 72 H HIS 72 -3.107 1.973 -6.002 559 HA HIS 72 HA HIS 72 -3.222 1.828 -3.051 560 HB2 HIS 72 HB2 HIS 72 -2.978 3.990 -4.407 561 HB3 HIS 72 HB3 HIS 72 -4.639 3.785 -4.908 562 HD1 HIS 72 HD1 HIS 72 -5.778 3.024 -1.797 563 HD2 HIS 72 HD2 HIS 72 -3.140 6.056 -2.966 564 HE1 HIS 72 HE1 HIS 72 -5.605 4.609 0.157 565 H LYS 73 H LYS 73 -4.923 0.969 -1.953 566 HA LYS 73 HA LYS 73 -7.202 -0.124 -3.493 567 HB2 LYS 73 HB2 LYS 73 -6.453 -0.513 -0.560 568 HB3 LYS 73 HB3 LYS 73 -7.773 -1.278 -1.420 569 HG2 LYS 73 HG2 LYS 73 -6.267 -2.964 -1.653 570 HG3 LYS 73 HG3 LYS 73 -5.817 -2.045 -3.089 571 HD2 LYS 73 HD2 LYS 73 -3.955 -0.970 -1.757 572 HD3 LYS 73 HD3 LYS 73 -4.471 -1.913 -0.361 573 HE2 LYS 73 HE2 LYS 73 -2.626 -3.045 -1.276 574 HE3 LYS 73 HE3 LYS 73 -4.057 -4.015 -1.688 575 HZ1 LYS 73 HZ1 LYS 73 -3.934 -3.176 -3.931 576 HZ2 LYS 73 HZ2 LYS 73 -2.737 -2.102 -3.552 577 HZ3 LYS 73 HZ3 LYS 73 -2.447 -3.719 -3.540 578 H PHE 74 H PHE 74 -9.373 0.175 -2.860 579 HA PHE 74 HA PHE 74 -9.956 2.639 -1.260 580 HB2 PHE 74 HB2 PHE 74 -11.044 1.975 -4.022 581 HB3 PHE 74 HB3 PHE 74 -11.705 3.180 -2.934 582 HD1 PHE 74 HD1 PHE 74 -8.579 2.312 -4.860 583 HD2 PHE 74 HD2 PHE 74 -10.928 5.417 -2.984 584 HE1 PHE 74 HE1 PHE 74 -7.065 4.030 -5.791 585 HE2 PHE 74 HE2 PHE 74 -9.400 7.127 -3.915 586 HZ PHE 74 HZ PHE 74 -7.467 6.439 -5.317 587 H MET 75 H MET 75 -11.808 2.554 -0.072 588 HA MET 75 HA MET 75 -12.823 -0.071 0.632 589 HB2 MET 75 HB2 MET 75 -12.485 1.778 2.243 590 HB3 MET 75 HB3 MET 75 -13.706 2.730 1.389 591 HG2 MET 75 HG2 MET 75 -15.395 0.986 1.908 592 HG3 MET 75 HG3 MET 75 -14.187 0.112 2.855 593 HE1 MET 75 HE1 MET 75 -13.766 0.524 5.316 594 HE2 MET 75 HE2 MET 75 -12.702 1.838 4.769 595 HE3 MET 75 HE3 MET 75 -13.865 2.121 6.100 596 H THR 76 H THR 76 -14.108 -1.135 -0.790 597 HA THR 76 HA THR 76 -16.035 0.172 -2.548 598 HB THR 76 HB THR 76 -16.849 -2.042 -3.075 599 HG1 THR 76 HG1 THR 76 -15.786 -3.816 -2.082 600 HG21 THR 76 HG21 THR 76 -14.803 -1.152 -4.130 601 HG22 THR 76 HG22 THR 76 -13.819 -2.004 -2.915 602 HG23 THR 76 HG23 THR 76 -14.831 -2.923 -4.053 603 H VAL 77 H VAL 77 -18.393 -0.432 -2.522 604 HA VAL 77 HA VAL 77 -19.689 0.359 -0.194 605 HB VAL 77 HB VAL 77 -21.760 -0.747 -1.175 606 HG11 VAL 77 HG11 VAL 77 -21.214 1.571 -1.599 607 HG12 VAL 77 HG12 VAL 77 -20.158 1.120 -2.950 608 HG13 VAL 77 HG13 VAL 77 -21.903 0.812 -3.045 609 HG21 VAL 77 HG21 VAL 77 -19.924 -1.388 -3.526 610 HG22 VAL 77 HG22 VAL 77 -20.600 -2.589 -2.406 611 HG23 VAL 77 HG23 VAL 77 -21.677 -1.625 -3.429 612 H ASP 78 H ASP 78 -18.483 -2.849 -0.821 613 HA ASP 78 HA ASP 78 -20.008 -4.072 1.407 614 HB2 ASP 78 HB2 ASP 78 -17.939 -5.101 -0.566 615 HB3 ASP 78 HB3 ASP 78 -18.553 -6.073 0.768 616 H GLY 79 H GLY 79 -17.247 -2.146 1.190 617 HA2 GLY 79 HA2 GLY 79 -15.942 -1.428 2.986 618 HA3 GLY 79 HA3 GLY 79 -16.365 -2.862 3.922 619 H GLN 80 H GLN 80 -15.365 -3.663 0.732 620 HA GLN 80 HA GLN 80 -12.927 -4.943 1.766 621 HB2 GLN 80 HB2 GLN 80 -14.092 -4.897 -1.051 622 HB3 GLN 80 HB3 GLN 80 -12.782 -5.924 -0.460 623 HG2 GLN 80 HG2 GLN 80 -14.390 -6.962 1.175 624 HG3 GLN 80 HG3 GLN 80 -15.688 -6.006 0.457 625 HE21 GLN 80 HE22 GLN 80 -16.854 -7.082 -1.158 626 HE22 GLN 80 HE21 GLN 80 -16.200 -8.413 -2.098 627 H MET 81 H MET 81 -10.938 -4.049 1.682 628 HA MET 81 HA MET 81 -10.360 -1.668 0.048 629 HB2 MET 81 HB2 MET 81 -8.096 -1.841 1.040 630 HB3 MET 81 HB3 MET 81 -9.393 -1.550 2.176 631 HG2 MET 81 HG2 MET 81 -8.257 -4.338 1.743 632 HG3 MET 81 HG3 MET 81 -7.498 -3.180 2.809 633 HE1 MET 81 HE1 MET 81 -8.303 -2.344 4.973 634 HE2 MET 81 HE2 MET 81 -9.865 -1.724 4.392 635 HE3 MET 81 HE3 MET 81 -9.806 -2.803 5.803 636 H LEU 82 H LEU 82 -10.565 -2.326 -2.055 637 HA LEU 82 HA LEU 82 -8.601 -4.378 -3.035 638 HB2 LEU 82 HB2 LEU 82 -11.165 -3.491 -4.394 639 HB3 LEU 82 HB3 LEU 82 -10.115 -4.807 -4.880 640 HG LEU 82 HG LEU 82 -11.755 -4.751 -2.309 641 HD11 LEU 82 HD11 LEU 82 -13.138 -4.951 -4.311 642 HD12 LEU 82 HD12 LEU 82 -12.155 -6.323 -4.874 643 HD13 LEU 82 HD13 LEU 82 -13.120 -6.458 -3.382 644 HD21 LEU 82 HD21 LEU 82 -10.076 -6.976 -3.544 645 HD22 LEU 82 HD22 LEU 82 -9.738 -6.133 -2.018 646 HD23 LEU 82 HD23 LEU 82 -11.168 -7.158 -2.152 647 HA PRO 83 HA PRO 83 -6.572 -1.120 -5.269 648 HB2 PRO 83 HB2 PRO 83 -5.533 -2.462 -7.435 649 HB3 PRO 83 HB3 PRO 83 -4.860 -2.557 -5.790 650 HG2 PRO 83 HG2 PRO 83 -6.797 -4.462 -7.154 651 HG3 PRO 83 HG3 PRO 83 -5.319 -4.872 -6.211 652 HD2 PRO 83 HD2 PRO 83 -7.812 -5.007 -5.152 653 HD3 PRO 83 HD3 PRO 83 -6.428 -4.444 -4.170 654 H ILE 84 H ILE 84 -7.013 0.332 -6.921 655 HA ILE 84 HA ILE 84 -9.555 0.230 -8.118 656 HB ILE 84 HB ILE 84 -8.340 2.271 -7.617 657 HG12 ILE 84 HG12 ILE 84 -9.036 2.242 -10.575 658 HG13 ILE 84 HG13 ILE 84 -10.239 1.989 -9.298 659 HG21 ILE 84 HG21 ILE 84 -6.090 1.682 -8.370 660 HG22 ILE 84 HG22 ILE 84 -6.639 1.625 -10.066 661 HG23 ILE 84 HG23 ILE 84 -6.624 3.160 -9.171 662 HD11 ILE 84 HD11 ILE 84 -9.741 4.125 -8.295 663 HD12 ILE 84 HD12 ILE 84 -8.527 4.470 -9.559 664 HD13 ILE 84 HD13 ILE 84 -10.239 4.280 -9.991 665 H ASP 85 H ASP 85 -6.559 -1.038 -9.398 666 HA ASP 85 HA ASP 85 -7.277 -1.582 -12.096 667 HB2 ASP 85 HB2 ASP 85 -5.038 -1.908 -11.195 668 HB3 ASP 85 HB3 ASP 85 -5.621 -3.120 -10.059 669 H GLU 86 H GLU 86 -8.290 -3.187 -9.084 670 HA GLU 86 HA GLU 86 -9.646 -5.373 -10.590 671 HB2 GLU 86 HB2 GLU 86 -8.437 -5.995 -8.567 672 HB3 GLU 86 HB3 GLU 86 -9.442 -4.903 -7.593 673 HG2 GLU 86 HG2 GLU 86 -11.420 -6.196 -8.010 674 HG3 GLU 86 HG3 GLU 86 -10.649 -7.108 -9.312 675 H ILE 87 H ILE 87 -10.415 -2.349 -8.794 676 HA ILE 87 HA ILE 87 -13.240 -2.794 -8.642 677 HB ILE 87 HB ILE 87 -11.670 -0.197 -8.823 678 HG12 ILE 87 HG12 ILE 87 -12.688 -1.781 -6.406 679 HG13 ILE 87 HG13 ILE 87 -11.016 -1.686 -6.933 680 HG21 ILE 87 HG21 ILE 87 -14.185 0.013 -9.297 681 HG22 ILE 87 HG22 ILE 87 -14.442 -0.588 -7.653 682 HG23 ILE 87 HG23 ILE 87 -13.581 0.938 -7.938 683 HD11 ILE 87 HD11 ILE 87 -11.070 0.801 -6.539 684 HD12 ILE 87 HD12 ILE 87 -12.663 0.560 -5.771 685 HD13 ILE 87 HD13 ILE 87 -11.233 -0.219 -5.096 686 H PHE 88 H PHE 88 -11.215 -1.382 -11.221 687 HA PHE 88 HA PHE 88 -13.365 -0.661 -12.974 688 HB2 PHE 88 HB2 PHE 88 -10.981 0.118 -13.124 689 HB3 PHE 88 HB3 PHE 88 -10.529 -1.471 -13.708 690 HD1 PHE 88 HD2 PHE 88 -12.514 1.609 -14.498 691 HD2 PHE 88 HD1 PHE 88 -11.002 -2.144 -15.994 692 HE1 PHE 88 HE2 PHE 88 -13.057 2.315 -16.805 693 HE2 PHE 88 HE1 PHE 88 -11.543 -1.427 -18.316 694 HZ PHE 88 HZ PHE 88 -12.563 0.806 -18.722 695 H GLU 89 H GLU 89 -11.628 -3.781 -12.632 696 HA GLU 89 HA GLU 89 -12.989 -4.979 -14.950 697 HB2 GLU 89 HB2 GLU 89 -11.144 -6.042 -12.765 698 HB3 GLU 89 HB3 GLU 89 -12.021 -7.130 -13.835 699 HG2 GLU 89 HG2 GLU 89 -11.035 -5.785 -15.802 700 HG3 GLU 89 HG3 GLU 89 -9.945 -5.056 -14.622 701 H ARG 90 H ARG 90 -13.399 -5.115 -11.404 702 HA ARG 90 HA ARG 90 -15.668 -6.972 -11.597 703 HB2 ARG 90 HB2 ARG 90 -14.682 -5.284 -9.254 704 HB3 ARG 90 HB3 ARG 90 -15.872 -6.589 -9.183 705 HG2 ARG 90 HG2 ARG 90 -12.913 -6.870 -9.721 706 HG3 ARG 90 HG3 ARG 90 -13.844 -7.443 -8.333 707 HD2 ARG 90 HD2 ARG 90 -15.162 -8.794 -10.177 708 HD3 ARG 90 HD3 ARG 90 -13.700 -8.486 -11.155 709 HE ARG 90 HE ARG 90 -12.633 -9.481 -8.857 710 HH11 ARG 90 HH11 ARG 90 -15.109 -10.765 -10.996 711 HH12 ARG 90 HH12 ARG 90 -14.878 -12.400 -10.431 712 HH21 ARG 90 HH21 ARG 90 -12.431 -11.581 -8.153 713 HH22 ARG 90 HH22 ARG 90 -13.395 -12.846 -8.873 714 H GLU 91 H GLU 91 -15.394 -3.570 -12.026 715 HA GLU 91 HA GLU 91 -16.865 -1.902 -12.239 716 HB2 GLU 91 HB2 GLU 91 -19.089 -3.940 -12.589 717 HB3 GLU 91 HB3 GLU 91 -19.042 -2.272 -13.148 718 HG2 GLU 91 HG2 GLU 91 -17.086 -2.905 -14.642 719 HG3 GLU 91 HG3 GLU 91 -17.352 -4.588 -14.183 720 H LEU 92 H LEU 92 -16.196 -2.850 -9.637 721 HA LEU 92 HA LEU 92 -18.562 -2.768 -7.910 722 HB2 LEU 92 HB2 LEU 92 -15.564 -2.728 -7.392 723 HB3 LEU 92 HB3 LEU 92 -16.738 -2.559 -6.091 724 HG LEU 92 HG LEU 92 -16.705 -4.931 -7.983 725 HD11 LEU 92 HD11 LEU 92 -14.591 -4.766 -6.643 726 HD12 LEU 92 HD12 LEU 92 -15.578 -4.776 -5.162 727 HD13 LEU 92 HD13 LEU 92 -15.571 -6.185 -6.237 728 HD21 LEU 92 HD21 LEU 92 -18.071 -4.494 -5.296 729 HD22 LEU 92 HD22 LEU 92 -18.868 -4.665 -6.879 730 HD23 LEU 92 HD23 LEU 92 -18.009 -6.036 -6.178 731 H ASP 93 H ASP 93 -19.292 -1.139 -6.650 732 HA ASP 93 HA ASP 93 -18.440 1.610 -7.362 733 HB2 ASP 93 HB2 ASP 93 -20.683 0.765 -5.512 734 HB3 ASP 93 HB3 ASP 93 -20.435 2.317 -6.311 735 H LEU 94 H LEU 94 -17.176 2.875 -5.984 736 HA LEU 94 HA LEU 94 -16.229 1.945 -3.441 737 HB2 LEU 94 HB2 LEU 94 -16.154 4.593 -4.904 738 HB3 LEU 94 HB3 LEU 94 -15.650 4.461 -3.215 739 HG LEU 94 HG LEU 94 -14.065 2.636 -3.892 740 HD11 LEU 94 HD11 LEU 94 -14.799 1.821 -5.976 741 HD12 LEU 94 HD12 LEU 94 -14.920 3.444 -6.675 742 HD13 LEU 94 HD13 LEU 94 -13.327 2.743 -6.331 743 HD21 LEU 94 HD21 LEU 94 -13.817 5.419 -5.080 744 HD22 LEU 94 HD22 LEU 94 -13.300 4.903 -3.471 745 HD23 LEU 94 HD23 LEU 94 -12.455 4.311 -4.921 746 H MET 95 H MET 95 -16.732 2.661 -1.331 747 HA MET 95 HA MET 95 -19.541 3.292 -0.833 748 HB2 MET 95 HB2 MET 95 -18.064 1.788 0.561 749 HB3 MET 95 HB3 MET 95 -17.262 3.220 1.190 750 HG2 MET 95 HG2 MET 95 -19.079 3.772 2.502 751 HG3 MET 95 HG3 MET 95 -20.247 3.247 1.292 752 HE1 MET 95 HE1 MET 95 -17.407 0.890 2.853 753 HE2 MET 95 HE2 MET 95 -17.839 2.062 4.126 754 HE3 MET 95 HE3 MET 95 -18.272 0.346 4.304 755 H ARG 96 H ARG 96 -19.972 5.093 0.873 756 HA ARG 96 HA ARG 96 -18.530 7.618 0.274 757 HB2 ARG 96 HB2 ARG 96 -21.549 7.224 0.148 758 HB3 ARG 96 HB3 ARG 96 -20.710 8.763 -0.011 759 HG2 ARG 96 HG2 ARG 96 -20.368 6.437 -1.957 760 HG3 ARG 96 HG3 ARG 96 -21.542 7.714 -2.155 761 HD2 ARG 96 HD2 ARG 96 -19.801 9.412 -2.341 762 HD3 ARG 96 HD3 ARG 96 -18.543 8.208 -2.044 763 HE ARG 96 HE ARG 96 -20.259 8.514 -4.454 764 HH11 ARG 96 HH11 ARG 96 -17.820 6.510 -2.898 765 HH12 ARG 96 HH12 ARG 96 -17.367 5.788 -4.417 766 HH21 ARG 96 HH21 ARG 96 -19.601 7.569 -6.295 767 HH22 ARG 96 HH22 ARG 96 -18.337 6.359 -6.308 768 H VAL 97 H VAL 97 -19.010 9.332 1.819 769 HA VAL 97 HA VAL 97 -19.760 8.317 4.532 770 HB VAL 97 HB VAL 97 -18.548 10.087 5.478 771 HG11 VAL 97 HG11 VAL 97 -17.228 8.152 4.619 772 HG12 VAL 97 HG12 VAL 97 -16.807 9.145 3.203 773 HG13 VAL 97 HG13 VAL 97 -16.305 9.649 4.821 774 HG21 VAL 97 HG21 VAL 97 -18.455 11.330 2.764 775 HG22 VAL 97 HG22 VAL 97 -18.969 12.021 4.305 776 HG23 VAL 97 HG23 VAL 97 -17.252 11.739 4.019 777 H ASP 98 H ASP 98 -20.944 10.563 2.150 778 HA ASP 98 HA ASP 98 -22.707 11.925 4.141 779 HB2 ASP 98 HB2 ASP 98 -21.688 12.704 1.388 780 HB3 ASP 98 HB3 ASP 98 -22.940 13.610 2.235 781 H ASN 99 H ASN 99 -23.191 9.226 2.916 782 HA ASN 99 HA ASN 99 -24.763 7.959 1.889 783 HB2 ASN 99 HB2 ASN 99 -26.580 10.116 3.030 784 HB3 ASN 99 HB3 ASN 99 -27.186 8.654 2.238 785 HD21 ASN 99 HD22 ASN 99 -24.910 9.672 4.734 786 HD22 ASN 99 HD21 ASN 99 -24.544 8.063 5.150 787 H LEU 100 H LEU 100 -23.297 9.731 0.382 788 HA LEU 100 HA LEU 100 -24.785 10.646 -1.950 789 HB2 LEU 100 HB2 LEU 100 -21.893 10.009 -1.361 790 HB3 LEU 100 HB3 LEU 100 -22.355 10.336 -3.007 791 HG LEU 100 HG LEU 100 -22.832 12.263 -0.692 792 HD11 LEU 100 HD11 LEU 100 -20.426 11.902 -1.085 793 HD12 LEU 100 HD12 LEU 100 -20.645 12.208 -2.818 794 HD13 LEU 100 HD13 LEU 100 -20.910 13.510 -1.640 795 HD21 LEU 100 HD21 LEU 100 -22.959 12.668 -3.717 796 HD22 LEU 100 HD22 LEU 100 -24.353 12.666 -2.610 797 HD23 LEU 100 HD23 LEU 100 -23.137 13.939 -2.490 798 HA PRO 101 HA PRO 101 -25.534 6.888 -4.139 799 HB2 PRO 101 HB2 PRO 101 -25.193 7.552 -6.777 800 HB3 PRO 101 HB3 PRO 101 -26.551 8.151 -5.777 801 HG2 PRO 101 HG2 PRO 101 -23.948 9.564 -6.421 802 HG3 PRO 101 HG3 PRO 101 -25.616 10.216 -6.512 803 HD2 PRO 101 HD2 PRO 101 -23.996 10.658 -4.367 804 HD3 PRO 101 HD3 PRO 101 -25.749 10.434 -4.156 805 H ASN 102 H ASN 102 -24.517 5.077 -4.871 806 HA ASN 102 HA ASN 102 -21.556 5.105 -4.876 807 HB2 ASN 102 HB2 ASN 102 -23.391 2.684 -5.018 808 HB3 ASN 102 HB3 ASN 102 -21.706 2.769 -4.494 809 HD21 ASN 102 HD22 ASN 102 -21.373 4.382 -2.546 810 HD22 ASN 102 HD21 ASN 102 -22.604 4.253 -1.287 811 H ILE 103 H ILE 103 -20.456 5.174 -6.713 812 HA ILE 103 HA ILE 103 -21.502 4.026 -9.237 813 HB ILE 103 HB ILE 103 -20.650 6.159 -10.416 814 HG12 ILE 103 HG12 ILE 103 -21.372 7.386 -7.718 815 HG13 ILE 103 HG13 ILE 103 -19.739 7.237 -8.376 816 HG21 ILE 103 HG21 ILE 103 -22.998 5.298 -10.363 817 HG22 ILE 103 HG22 ILE 103 -23.301 6.304 -8.930 818 HG23 ILE 103 HG23 ILE 103 -22.892 7.050 -10.489 819 HD11 ILE 103 HD11 ILE 103 -20.311 8.770 -10.208 820 HD12 ILE 103 HD12 ILE 103 -21.972 8.914 -9.564 821 HD13 ILE 103 HD13 ILE 103 -20.606 9.492 -8.607 822 H LYS 104 H LYS 104 -20.112 2.760 -10.003 823 HA LYS 104 HA LYS 104 -17.309 2.691 -9.449 824 HB2 LYS 104 HB2 LYS 104 -17.249 0.826 -10.956 825 HB3 LYS 104 HB3 LYS 104 -18.687 0.757 -9.972 826 HG2 LYS 104 HG2 LYS 104 -19.418 0.017 -12.008 827 HG3 LYS 104 HG3 LYS 104 -20.001 1.680 -11.969 828 HD2 LYS 104 HD2 LYS 104 -18.355 2.376 -13.555 829 HD3 LYS 104 HD3 LYS 104 -17.364 0.924 -13.289 830 HE2 LYS 104 HE2 LYS 104 -18.453 0.849 -15.459 831 HE3 LYS 104 HE3 LYS 104 -18.979 -0.477 -14.422 832 HZ1 LYS 104 HZ1 LYS 104 -21.045 0.745 -14.002 833 HZ2 LYS 104 HZ2 LYS 104 -20.540 2.010 -14.928 834 HZ3 LYS 104 HZ3 LYS 104 -20.834 0.556 -15.606 835 H ILE 105 H ILE 105 -15.697 2.517 -11.252 836 HA ILE 105 HA ILE 105 -15.143 5.134 -12.266 837 HB ILE 105 HB ILE 105 -14.029 2.424 -13.123 838 HG12 ILE 105 HG12 ILE 105 -12.428 4.034 -11.199 839 HG13 ILE 105 HG13 ILE 105 -13.856 3.264 -10.520 840 HG21 ILE 105 HG21 ILE 105 -13.282 4.079 -14.697 841 HG22 ILE 105 HG22 ILE 105 -12.885 5.233 -13.411 842 HG23 ILE 105 HG23 ILE 105 -11.915 3.766 -13.626 843 HD11 ILE 105 HD11 ILE 105 -13.008 1.105 -11.588 844 HD12 ILE 105 HD12 ILE 105 -11.470 1.993 -11.848 845 HD13 ILE 105 HD13 ILE 105 -12.126 1.752 -10.213 846 H ALA 106 H ALA 106 -15.884 6.120 -14.015 847 HA ALA 106 HA ALA 106 -17.666 4.853 -15.953 848 HB1 ALA 106 HB1 ALA 106 -18.029 7.150 -15.283 849 HB2 ALA 106 HB2 ALA 106 -16.397 7.631 -15.794 850 HB3 ALA 106 HB3 ALA 106 -17.606 7.134 -16.996 851 H THR 107 H THR 107 -14.382 6.213 -16.030 852 HA THR 107 HA THR 107 -13.539 4.421 -18.210 853 HB THR 107 HB THR 107 -12.490 6.437 -19.438 854 HG1 THR 107 HG1 THR 107 -12.986 8.108 -18.094 855 HG21 THR 107 HG21 THR 107 -14.344 5.043 -20.361 856 HG22 THR 107 HG22 THR 107 -15.504 6.209 -19.682 857 HG23 THR 107 HG23 THR 107 -14.340 6.725 -20.916 858 H ARG 108 H ARG 108 -11.338 4.258 -18.453 859 HA ARG 108 HA ARG 108 -9.555 5.561 -16.443 860 HB2 ARG 108 HB2 ARG 108 -10.091 3.471 -15.476 861 HB3 ARG 108 HB3 ARG 108 -9.985 2.605 -16.996 862 HG2 ARG 108 HG2 ARG 108 -7.514 3.897 -15.759 863 HG3 ARG 108 HG3 ARG 108 -8.121 2.343 -15.233 864 HD2 ARG 108 HD2 ARG 108 -8.106 1.771 -17.833 865 HD3 ARG 108 HD3 ARG 108 -6.886 3.061 -17.880 866 HE ARG 108 HE ARG 108 -6.070 1.408 -15.806 867 HH11 ARG 108 HH11 ARG 108 -6.689 0.857 -19.230 868 HH12 ARG 108 HH12 ARG 108 -5.566 -0.476 -19.299 869 HH21 ARG 108 HH21 ARG 108 -4.673 -0.302 -15.997 870 HH22 ARG 108 HH22 ARG 108 -4.457 -1.105 -17.529 871 H LYS 109 H LYS 109 -7.578 5.993 -17.097 872 HA LYS 109 HA LYS 109 -6.415 5.100 -19.653 873 HB2 LYS 109 HB2 LYS 109 -7.546 7.858 -19.221 874 HB3 LYS 109 HB3 LYS 109 -5.957 7.809 -19.953 875 HG2 LYS 109 HG2 LYS 109 -8.134 6.080 -21.125 876 HG3 LYS 109 HG3 LYS 109 -8.148 7.815 -21.407 877 HD2 LYS 109 HD2 LYS 109 -7.109 6.779 -23.268 878 HD3 LYS 109 HD3 LYS 109 -5.868 7.681 -22.394 879 HE2 LYS 109 HE2 LYS 109 -4.929 5.657 -21.471 880 HE3 LYS 109 HE3 LYS 109 -6.323 4.693 -22.004 881 HZ1 LYS 109 HZ1 LYS 109 -5.655 5.093 -24.300 882 HZ2 LYS 109 HZ2 LYS 109 -4.381 6.007 -23.834 883 HZ3 LYS 109 HZ3 LYS 109 -4.417 4.411 -23.489 884 H TYR 110 H TYR 110 -4.263 4.940 -19.443 885 HA TYR 110 HA TYR 110 -2.895 5.696 -17.010 886 HB2 TYR 110 HB2 TYR 110 -2.151 3.824 -18.487 887 HB3 TYR 110 HB3 TYR 110 -1.759 4.984 -19.743 888 HD1 TYR 110 HD2 TYR 110 -1.107 5.078 -16.016 889 HD2 TYR 110 HD1 TYR 110 0.605 4.950 -19.976 890 HE1 TYR 110 HE2 TYR 110 1.136 5.404 -15.060 891 HE2 TYR 110 HE1 TYR 110 2.876 5.157 -18.990 892 HH TYR 110 HH TYR 110 4.098 5.333 -17.061 893 H LEU 111 H LEU 111 -1.831 7.569 -16.469 894 HA LEU 111 HA LEU 111 -1.893 9.824 -18.441 895 HB2 LEU 111 HB2 LEU 111 -1.487 9.684 -15.424 896 HB3 LEU 111 HB3 LEU 111 -1.458 11.170 -16.371 897 HG LEU 111 HG LEU 111 -3.874 9.322 -16.299 898 HD11 LEU 111 HD11 LEU 111 -3.434 10.049 -14.049 899 HD12 LEU 111 HD12 LEU 111 -3.204 11.727 -14.579 900 HD13 LEU 111 HD13 LEU 111 -4.811 10.951 -14.685 901 HD21 LEU 111 HD21 LEU 111 -3.444 12.223 -17.144 902 HD22 LEU 111 HD22 LEU 111 -3.875 10.855 -18.204 903 HD23 LEU 111 HD23 LEU 111 -5.035 11.444 -17.013 904 H GLY 112 H GLY 112 0.289 8.087 -16.245 905 HA2 GLY 112 HA2 GLY 112 2.674 7.958 -17.381 906 HA3 GLY 112 HA3 GLY 112 2.620 9.705 -17.121 907 H LYS 113 H LYS 113 4.267 9.764 -15.635 908 HA LYS 113 HA LYS 113 3.941 8.248 -13.070 909 HB2 LYS 113 HB2 LYS 113 5.757 7.501 -14.777 910 HB3 LYS 113 HB3 LYS 113 6.612 8.954 -14.234 911 HG2 LYS 113 HG2 LYS 113 6.207 8.098 -11.833 912 HG3 LYS 113 HG3 LYS 113 5.796 6.549 -12.566 913 HD2 LYS 113 HD2 LYS 113 8.414 8.039 -13.055 914 HD3 LYS 113 HD3 LYS 113 8.228 6.835 -11.792 915 HE2 LYS 113 HE2 LYS 113 7.579 6.135 -14.670 916 HE3 LYS 113 HE3 LYS 113 9.252 6.170 -14.107 917 HZ1 LYS 113 HZ1 LYS 113 8.685 4.555 -12.397 918 HZ2 LYS 113 HZ2 LYS 113 7.123 4.492 -12.887 919 HZ3 LYS 113 HZ3 LYS 113 8.315 3.955 -13.866 920 H GLN 114 H GLN 114 3.105 9.769 -11.860 921 HA GLN 114 HA GLN 114 4.359 12.436 -11.606 922 HB2 GLN 114 HB2 GLN 114 1.632 11.673 -10.606 923 HB3 GLN 114 HB3 GLN 114 2.291 13.271 -11.003 924 HG2 GLN 114 HG2 GLN 114 2.637 12.451 -13.380 925 HG3 GLN 114 HG3 GLN 114 1.733 10.995 -12.934 926 HE21 GLN 114 HE22 GLN 114 0.297 11.266 -14.461 927 HE22 GLN 114 HE21 GLN 114 -0.410 12.791 -14.743 928 H ASN 115 H ASN 115 4.643 13.359 -9.438 929 HA ASN 115 HA ASN 115 5.461 11.605 -7.394 930 HB2 ASN 115 HB2 ASN 115 5.986 14.174 -8.002 931 HB3 ASN 115 HB3 ASN 115 4.683 14.474 -6.837 932 HD21 ASN 115 HD22 ASN 115 5.171 12.337 -4.976 933 HD22 ASN 115 HD21 ASN 115 6.835 12.444 -4.480 934 H VAL 116 H VAL 116 4.171 10.343 -6.198 935 HA VAL 116 HA VAL 116 1.473 11.377 -5.390 936 HB VAL 116 HB VAL 116 0.788 8.991 -5.310 937 HG11 VAL 116 HG11 VAL 116 0.068 10.325 -7.178 938 HG12 VAL 116 HG12 VAL 116 1.605 10.055 -8.027 939 HG13 VAL 116 HG13 VAL 116 0.492 8.703 -7.733 940 HG21 VAL 116 HG21 VAL 116 3.304 8.447 -6.951 941 HG22 VAL 116 HG22 VAL 116 3.059 7.967 -5.254 942 HG23 VAL 116 HG23 VAL 116 2.023 7.299 -6.517 943 H TYR 117 H TYR 117 0.682 10.853 -3.394 944 HA TYR 117 HA TYR 117 2.662 10.147 -1.273 945 HB2 TYR 117 HB2 TYR 117 0.766 12.497 -1.122 946 HB3 TYR 117 HB3 TYR 117 2.140 12.133 -0.108 947 HD1 TYR 117 HD2 TYR 117 4.449 12.675 -0.845 948 HD2 TYR 117 HD1 TYR 117 1.021 13.525 -3.322 949 HE1 TYR 117 HE2 TYR 117 5.809 14.278 -2.182 950 HE2 TYR 117 HE1 TYR 117 2.393 15.094 -4.678 951 HH TYR 117 HH TYR 117 4.399 16.179 -4.868 952 H ASP 118 H ASP 118 1.730 9.589 0.768 953 HA ASP 118 HA ASP 118 -1.155 8.975 0.988 954 HB2 ASP 118 HB2 ASP 118 -0.382 7.098 -0.302 955 HB3 ASP 118 HB3 ASP 118 1.062 6.913 0.688 956 H ILE 119 H ILE 119 -1.669 9.443 3.107 957 HA ILE 119 HA ILE 119 0.472 9.519 5.149 958 HB ILE 119 HB ILE 119 -1.344 10.238 6.672 959 HG12 ILE 119 HG12 ILE 119 -3.059 10.522 4.160 960 HG13 ILE 119 HG13 ILE 119 -3.250 9.221 5.342 961 HG21 ILE 119 HG21 ILE 119 0.214 11.756 5.492 962 HG22 ILE 119 HG22 ILE 119 -0.942 11.923 4.157 963 HG23 ILE 119 HG23 ILE 119 -1.345 12.526 5.784 964 HD11 ILE 119 HD11 ILE 119 -3.705 10.864 7.116 965 HD12 ILE 119 HD12 ILE 119 -3.595 12.180 5.918 966 HD13 ILE 119 HD13 ILE 119 -4.860 10.947 5.766 967 H GLY 120 H GLY 120 0.636 8.232 6.943 968 HA2 GLY 120 HA2 GLY 120 -0.710 5.568 6.794 969 HA3 GLY 120 HA3 GLY 120 0.769 5.938 7.663 970 H VAL 121 H VAL 121 -1.576 4.645 8.687 971 HA VAL 121 HA VAL 121 -2.368 6.414 10.950 972 HB VAL 121 HB VAL 121 -4.364 4.865 9.307 973 HG11 VAL 121 HG11 VAL 121 -5.088 5.246 11.610 974 HG12 VAL 121 HG12 VAL 121 -4.673 6.979 11.493 975 HG13 VAL 121 HG13 VAL 121 -6.008 6.295 10.541 976 HG21 VAL 121 HG21 VAL 121 -3.850 7.855 9.149 977 HG22 VAL 121 HG22 VAL 121 -3.701 6.657 7.831 978 HG23 VAL 121 HG23 VAL 121 -5.282 7.025 8.496 979 H GLU 122 H GLU 122 -2.806 5.227 12.850 980 HA GLU 122 HA GLU 122 -1.900 2.410 12.822 981 HB2 GLU 122 HB2 GLU 122 -1.015 4.129 14.396 982 HB3 GLU 122 HB3 GLU 122 -2.615 4.250 15.137 983 HG2 GLU 122 HG2 GLU 122 -2.479 1.813 15.735 984 HG3 GLU 122 HG3 GLU 122 -0.867 1.751 15.018 985 H ARG 123 H ARG 123 -4.798 4.199 13.963 986 HA ARG 123 HA ARG 123 -6.178 1.921 15.008 987 HB2 ARG 123 HB2 ARG 123 -6.738 4.796 14.492 988 HB3 ARG 123 HB3 ARG 123 -8.173 3.794 14.414 989 HG2 ARG 123 HG2 ARG 123 -6.223 3.816 16.756 990 HG3 ARG 123 HG3 ARG 123 -7.674 4.816 16.664 991 HD2 ARG 123 HD2 ARG 123 -7.638 1.770 16.637 992 HD3 ARG 123 HD3 ARG 123 -8.023 2.789 18.031 993 HE ARG 123 HE ARG 123 -9.816 3.662 16.128 994 HH11 ARG 123 HH11 ARG 123 -9.180 0.501 17.510 995 HH12 ARG 123 HH12 ARG 123 -10.810 -0.053 17.216 996 HH21 ARG 123 HH21 ARG 123 -11.883 2.879 15.775 997 HH22 ARG 123 HH22 ARG 123 -12.281 1.261 16.252 998 H ASP 124 H ASP 124 -6.390 3.408 11.828 999 HA ASP 124 HA ASP 124 -7.434 0.987 10.612 1000 HB2 ASP 124 HB2 ASP 124 -9.491 2.207 11.593 1001 HB3 ASP 124 HB3 ASP 124 -9.193 3.469 10.405 1002 H HIS 125 H HIS 125 -6.410 0.907 8.662 1003 HA HIS 125 HA HIS 125 -4.794 3.132 7.711 1004 HB2 HIS 125 HB2 HIS 125 -5.269 0.275 6.763 1005 HB3 HIS 125 HB3 HIS 125 -4.246 1.401 5.888 1006 HD1 HIS 125 HD1 HIS 125 -1.820 1.828 6.781 1007 HD2 HIS 125 HD2 HIS 125 -4.282 -0.563 9.220 1008 HE1 HIS 125 HE1 HIS 125 -0.297 0.816 8.552 1009 H ASN 126 H ASN 126 -7.030 4.367 7.535 1010 HA ASN 126 HA ASN 126 -7.496 4.785 4.668 1011 HB2 ASN 126 HB2 ASN 126 -9.849 4.454 4.748 1012 HB3 ASN 126 HB3 ASN 126 -9.124 2.985 5.358 1013 HD21 ASN 126 HD22 ASN 126 -11.771 3.426 5.836 1014 HD22 ASN 126 HD21 ASN 126 -12.017 3.877 7.520 1015 H PHE 127 H PHE 127 -9.066 6.634 4.323 1016 HA PHE 127 HA PHE 127 -9.488 8.614 6.395 1017 HB2 PHE 127 HB2 PHE 127 -8.040 10.380 5.262 1018 HB3 PHE 127 HB3 PHE 127 -7.205 9.191 6.231 1019 HD1 PHE 127 HD1 PHE 127 -7.972 10.176 2.713 1020 HD2 PHE 127 HD2 PHE 127 -5.540 7.735 5.301 1021 HE1 PHE 127 HE1 PHE 127 -6.543 9.546 0.787 1022 HE2 PHE 127 HE2 PHE 127 -4.109 7.114 3.371 1023 HZ PHE 127 HZ PHE 127 -4.619 8.002 1.108 1024 H ALA 128 H ALA 128 -10.827 10.298 5.701 1025 HA ALA 128 HA ALA 128 -12.354 9.735 3.321 1026 HB1 ALA 128 HB1 ALA 128 -13.354 10.383 5.516 1027 HB2 ALA 128 HB2 ALA 128 -12.699 12.025 5.260 1028 HB3 ALA 128 HB3 ALA 128 -13.906 11.359 4.144 1029 H LEU 129 H LEU 129 -12.562 10.970 1.460 1030 HA LEU 129 HA LEU 129 -10.584 13.168 0.971 1031 HB2 LEU 129 HB2 LEU 129 -12.298 11.795 -1.095 1032 HB3 LEU 129 HB3 LEU 129 -10.846 12.733 -1.341 1033 HG LEU 129 HG LEU 129 -10.969 9.933 -0.160 1034 HD11 LEU 129 HD11 LEU 129 -11.302 10.229 -2.696 1035 HD12 LEU 129 HD12 LEU 129 -9.664 10.896 -2.743 1036 HD13 LEU 129 HD13 LEU 129 -9.930 9.226 -2.208 1037 HD21 LEU 129 HD21 LEU 129 -8.580 11.707 -0.700 1038 HD22 LEU 129 HD22 LEU 129 -9.144 11.081 0.875 1039 HD23 LEU 129 HD23 LEU 129 -8.512 9.964 -0.342 1040 H LYS 130 H LYS 130 -11.329 14.906 -0.513 1041 HA LYS 130 HA LYS 130 -13.440 16.435 0.439 1042 HB2 LYS 130 HB2 LYS 130 -12.876 18.002 -1.108 1043 HB3 LYS 130 HB3 LYS 130 -11.403 17.064 -0.989 1044 HG2 LYS 130 HG2 LYS 130 -13.476 16.998 -3.206 1045 HG3 LYS 130 HG3 LYS 130 -11.891 17.738 -3.287 1046 HD2 LYS 130 HD2 LYS 130 -12.325 14.734 -2.978 1047 HD3 LYS 130 HD3 LYS 130 -12.155 15.581 -4.512 1048 HE2 LYS 130 HE2 LYS 130 -9.941 16.319 -4.003 1049 HE3 LYS 130 HE3 LYS 130 -10.000 15.621 -2.376 1050 HZ1 LYS 130 HZ1 LYS 130 -9.848 13.470 -3.247 1051 HZ2 LYS 130 HZ2 LYS 130 -10.548 13.856 -4.680 1052 HZ3 LYS 130 HZ3 LYS 130 -8.995 14.259 -4.414 1053 H ASN 131 H ASN 131 -13.923 13.833 -1.735 1054 HA ASN 131 HA ASN 131 -16.641 14.806 -2.519 1055 HB2 ASN 131 HB2 ASN 131 -14.725 12.740 -3.697 1056 HB3 ASN 131 HB3 ASN 131 -16.422 12.792 -4.152 1057 HD21 ASN 131 HD22 ASN 131 -17.197 15.230 -4.672 1058 HD22 ASN 131 HD21 ASN 131 -16.116 16.017 -5.810 1059 H GLY 132 H GLY 132 -15.625 13.364 0.125 1060 HA2 GLY 132 HA2 GLY 132 -16.677 12.035 1.655 1061 HA3 GLY 132 HA3 GLY 132 -18.053 11.788 0.546 1062 H PHE 133 H PHE 133 -14.787 11.027 -0.478 1063 HA PHE 133 HA PHE 133 -15.430 8.141 -0.796 1064 HB2 PHE 133 HB2 PHE 133 -13.373 10.104 -1.791 1065 HB3 PHE 133 HB3 PHE 133 -12.924 8.418 -1.736 1066 HD1 PHE 133 HD2 PHE 133 -16.261 9.949 -2.703 1067 HD2 PHE 133 HD1 PHE 133 -12.703 7.819 -3.918 1068 HE1 PHE 133 HE2 PHE 133 -17.216 9.632 -4.964 1069 HE2 PHE 133 HE1 PHE 133 -13.659 7.538 -6.164 1070 HZ PHE 133 HZ PHE 133 -15.906 8.368 -6.682 1071 H ILE 134 H ILE 134 -13.796 6.525 -0.197 1072 HA ILE 134 HA ILE 134 -12.034 7.249 2.094 1073 HB ILE 134 HB ILE 134 -13.770 4.770 2.059 1074 HG12 ILE 134 HG12 ILE 134 -14.784 5.760 4.147 1075 HG13 ILE 134 HG13 ILE 134 -14.145 7.327 3.658 1076 HG21 ILE 134 HG21 ILE 134 -11.624 4.452 3.193 1077 HG22 ILE 134 HG22 ILE 134 -11.897 5.926 4.163 1078 HG23 ILE 134 HG23 ILE 134 -12.937 4.499 4.366 1079 HD11 ILE 134 HD11 ILE 134 -15.739 7.522 1.981 1080 HD12 ILE 134 HD12 ILE 134 -15.828 5.769 1.682 1081 HD13 ILE 134 HD13 ILE 134 -16.636 6.482 3.088 1082 H ALA 135 H ALA 135 -10.121 7.036 1.195 1083 HA ALA 135 HA ALA 135 -9.437 4.758 -0.589 1084 HB1 ALA 135 HB1 ALA 135 -8.707 7.126 -1.134 1085 HB2 ALA 135 HB2 ALA 135 -7.701 7.083 0.333 1086 HB3 ALA 135 HB3 ALA 135 -7.403 5.948 -1.006 1087 H SER 136 H SER 136 -7.809 3.247 0.115 1088 HA SER 136 HA SER 136 -7.084 3.287 2.991 1089 HB2 SER 136 HB2 SER 136 -9.191 2.082 2.912 1090 HB3 SER 136 HB3 SER 136 -8.571 0.999 1.648 1091 HG SER 136 HG SER 136 -7.362 1.291 4.211 1092 H ASN 137 H ASN 137 -5.264 2.233 3.559 1093 HA ASN 137 HA ASN 137 -3.369 1.752 1.327 1094 HB2 ASN 137 HB2 ASN 137 -2.740 3.487 2.891 1095 HB3 ASN 137 HB3 ASN 137 -2.997 2.421 4.273 1096 HD21 ASN 137 HD22 ASN 137 -1.070 2.567 1.249 1097 HD22 ASN 137 HD21 ASN 137 0.350 1.812 1.974 Start of MODEL 18 1 H1 GLY -1 H GLY -1 3.766 -2.082 -2.828 2 HA2 GLY -1 HA2 GLY -1 1.976 -0.718 -1.966 3 HA3 GLY -1 HA3 GLY -1 3.509 0.169 -2.046 4 H GLY 0 H GLY 0 0.677 1.153 -2.121 5 HA2 GLY 0 HA2 GLY 0 0.675 2.619 -4.710 6 HA3 GLY 0 HA3 GLY 0 -0.777 1.964 -3.974 7 H ALA 1 H ALA 1 -0.541 4.618 -4.627 8 HA ALA 1 HA ALA 1 -0.934 6.059 -2.107 9 HB1 ALA 1 HB1 ALA 1 1.430 6.104 -2.074 10 HB2 ALA 1 HB2 ALA 1 1.531 6.442 -3.818 11 HB3 ALA 1 HB3 ALA 1 0.953 7.681 -2.691 12 H LEU 2 H LEU 2 -1.075 8.521 -2.679 13 HA LEU 2 HA LEU 2 -2.968 8.811 -4.984 14 HB2 LEU 2 HB2 LEU 2 -2.900 10.247 -2.299 15 HB3 LEU 2 HB3 LEU 2 -4.080 10.440 -3.562 16 HG LEU 2 HG LEU 2 -5.154 9.226 -1.916 17 HD11 LEU 2 HD11 LEU 2 -5.532 8.293 -4.151 18 HD12 LEU 2 HD12 LEU 2 -4.267 7.077 -3.852 19 HD13 LEU 2 HD13 LEU 2 -5.734 7.092 -2.862 20 HD21 LEU 2 HD21 LEU 2 -2.965 7.186 -1.658 21 HD22 LEU 2 HD22 LEU 2 -3.156 8.598 -0.604 22 HD23 LEU 2 HD23 LEU 2 -4.431 7.378 -0.699 23 H SER 3 H SER 3 -2.903 10.747 -6.198 24 HA SER 3 HA SER 3 -0.287 12.023 -6.416 25 HB2 SER 3 HB2 SER 3 -1.859 11.544 -8.318 26 HB3 SER 3 HB3 SER 3 -2.898 12.857 -7.711 27 HG SER 3 HG SER 3 -1.245 13.395 -9.379 28 H TYR 4 H TYR 4 0.004 14.396 -6.455 29 HA TYR 4 HA TYR 4 -0.536 15.676 -3.987 30 HB2 TYR 4 HB2 TYR 4 1.211 16.363 -5.564 31 HB3 TYR 4 HB3 TYR 4 0.006 16.882 -6.730 32 HD1 TYR 4 HD1 TYR 4 -1.352 18.918 -6.346 33 HD2 TYR 4 HD2 TYR 4 1.752 17.727 -3.601 34 HE1 TYR 4 HE1 TYR 4 -1.478 21.141 -5.249 35 HE2 TYR 4 HE2 TYR 4 1.631 19.962 -2.499 36 HH TYR 4 HH TYR 4 -0.646 22.493 -3.604 37 H GLU 5 H GLU 5 -2.325 15.878 -7.055 38 HA GLU 5 HA GLU 5 -4.197 17.879 -6.297 39 HB2 GLU 5 HB2 GLU 5 -4.636 15.662 -8.335 40 HB3 GLU 5 HB3 GLU 5 -5.419 17.249 -8.272 41 HG2 GLU 5 HG2 GLU 5 -3.031 18.223 -8.476 42 HG3 GLU 5 HG3 GLU 5 -2.542 16.596 -8.963 43 H THR 6 H THR 6 -4.084 14.639 -5.206 44 HA THR 6 HA THR 6 -6.957 14.229 -4.811 45 HB THR 6 HB THR 6 -4.618 12.865 -3.422 46 HG1 THR 6 HG1 THR 6 -6.222 11.911 -5.538 47 HG21 THR 6 HG21 THR 6 -6.677 12.502 -2.178 48 HG22 THR 6 HG22 THR 6 -7.575 12.147 -3.669 49 HG23 THR 6 HG23 THR 6 -6.309 11.038 -3.083 50 H GLU 7 H GLU 7 -8.186 15.252 -3.358 51 HA GLU 7 HA GLU 7 -6.858 16.696 -1.126 52 HB2 GLU 7 HB2 GLU 7 -9.662 17.017 -2.190 53 HB3 GLU 7 HB3 GLU 7 -8.848 18.039 -1.004 54 HG2 GLU 7 HG2 GLU 7 -7.113 18.594 -2.768 55 HG3 GLU 7 HG3 GLU 7 -8.089 17.703 -3.937 56 H ILE 8 H ILE 8 -7.322 16.425 0.939 57 HA ILE 8 HA ILE 8 -9.056 14.130 1.786 58 HB ILE 8 HB ILE 8 -6.406 15.054 2.969 59 HG12 ILE 8 HG12 ILE 8 -5.925 14.079 0.815 60 HG13 ILE 8 HG13 ILE 8 -5.372 13.036 2.115 61 HG21 ILE 8 HG21 ILE 8 -7.830 14.032 4.656 62 HG22 ILE 8 HG22 ILE 8 -8.162 12.645 3.606 63 HG23 ILE 8 HG23 ILE 8 -6.529 12.913 4.244 64 HD11 ILE 8 HD11 ILE 8 -7.355 11.554 1.743 65 HD12 ILE 8 HD12 ILE 8 -7.856 12.600 0.405 66 HD13 ILE 8 HD13 ILE 8 -6.335 11.708 0.304 67 H LEU 9 H LEU 9 -10.721 14.892 2.907 68 HA LEU 9 HA LEU 9 -10.869 17.509 4.047 69 HB2 LEU 9 HB2 LEU 9 -12.725 15.831 3.334 70 HB3 LEU 9 HB3 LEU 9 -12.596 15.171 4.953 71 HG LEU 9 HG LEU 9 -12.982 18.165 4.537 72 HD11 LEU 9 HD11 LEU 9 -14.723 16.985 3.189 73 HD12 LEU 9 HD12 LEU 9 -15.211 16.097 4.642 74 HD13 LEU 9 HD13 LEU 9 -15.397 17.868 4.566 75 HD21 LEU 9 HD21 LEU 9 -13.980 16.325 6.703 76 HD22 LEU 9 HD22 LEU 9 -12.556 17.391 6.831 77 HD23 LEU 9 HD23 LEU 9 -14.161 18.091 6.638 78 H THR 10 H THR 10 -9.971 18.314 5.826 79 HA THR 10 HA THR 10 -9.266 16.515 8.096 80 HB THR 10 HB THR 10 -7.450 17.935 8.675 81 HG1 THR 10 HG1 THR 10 -6.976 19.641 7.017 82 HG21 THR 10 HG21 THR 10 -7.039 16.302 6.797 83 HG22 THR 10 HG22 THR 10 -7.239 17.652 5.662 84 HG23 THR 10 HG23 THR 10 -5.924 17.676 6.856 85 H VAL 11 H VAL 11 -9.410 17.304 10.209 86 HA VAL 11 HA VAL 11 -11.670 19.111 10.759 87 HB VAL 11 HB VAL 11 -9.668 17.854 12.665 88 HG11 VAL 11 HG11 VAL 11 -10.809 19.667 13.799 89 HG12 VAL 11 HG12 VAL 11 -12.398 19.087 13.205 90 HG13 VAL 11 HG13 VAL 11 -11.460 18.129 14.379 91 HG21 VAL 11 HG21 VAL 11 -10.936 16.089 11.436 92 HG22 VAL 11 HG22 VAL 11 -11.397 16.152 13.121 93 HG23 VAL 11 HG23 VAL 11 -12.452 16.858 11.902 94 H GLU 12 H GLU 12 -8.149 19.289 10.864 95 HA GLU 12 HA GLU 12 -7.922 21.742 12.327 96 HB2 GLU 12 HB2 GLU 12 -6.173 19.945 10.699 97 HB3 GLU 12 HB3 GLU 12 -5.580 21.585 10.876 98 HG2 GLU 12 HG2 GLU 12 -6.315 19.706 13.156 99 HG3 GLU 12 HG3 GLU 12 -4.684 20.112 12.621 100 H TYR 13 H TYR 13 -8.327 21.185 8.848 101 HA TYR 13 HA TYR 13 -8.598 24.142 8.480 102 HB2 TYR 13 HB2 TYR 13 -6.904 22.300 6.752 103 HB3 TYR 13 HB3 TYR 13 -7.345 23.958 6.357 104 HD1 TYR 13 HD1 TYR 13 -6.779 25.760 8.257 105 HD2 TYR 13 HD2 TYR 13 -4.726 22.008 7.624 106 HE1 TYR 13 HE1 TYR 13 -4.731 26.695 9.324 107 HE2 TYR 13 HE2 TYR 13 -2.685 22.951 8.678 108 HH TYR 13 HH TYR 13 -1.725 24.784 9.649 109 H GLY 14 H GLY 14 -9.012 20.958 6.800 110 HA2 GLY 14 HA2 GLY 14 -11.495 20.648 6.109 111 HA3 GLY 14 HA3 GLY 14 -11.259 22.153 5.228 112 H LEU 15 H LEU 15 -11.522 21.379 3.237 113 HA LEU 15 HA LEU 15 -10.332 19.032 2.063 114 HB2 LEU 15 HB2 LEU 15 -11.511 21.569 0.839 115 HB3 LEU 15 HB3 LEU 15 -11.207 20.058 -0.020 116 HG LEU 15 HG LEU 15 -13.174 20.363 2.318 117 HD11 LEU 15 HD11 LEU 15 -13.894 21.640 0.367 118 HD12 LEU 15 HD12 LEU 15 -13.631 20.222 -0.670 119 HD13 LEU 15 HD13 LEU 15 -14.902 20.196 0.579 120 HD21 LEU 15 HD21 LEU 15 -12.504 18.122 0.399 121 HD22 LEU 15 HD22 LEU 15 -12.404 18.081 2.164 122 HD23 LEU 15 HD23 LEU 15 -13.991 18.151 1.373 123 H LEU 16 H LEU 16 -8.105 18.991 2.264 124 HA LEU 16 HA LEU 16 -6.547 21.018 0.706 125 HB2 LEU 16 HB2 LEU 16 -6.033 19.856 3.463 126 HB3 LEU 16 HB3 LEU 16 -4.691 20.349 2.466 127 HG LEU 16 HG LEU 16 -5.120 22.041 4.037 128 HD11 LEU 16 HD11 LEU 16 -4.379 22.813 1.824 129 HD12 LEU 16 HD12 LEU 16 -6.075 23.071 1.340 130 HD13 LEU 16 HD13 LEU 16 -5.363 24.020 2.654 131 HD21 LEU 16 HD21 LEU 16 -7.905 22.501 2.957 132 HD22 LEU 16 HD22 LEU 16 -7.518 21.658 4.473 133 HD23 LEU 16 HD23 LEU 16 -7.086 23.366 4.239 134 HA PRO 17 HA PRO 17 -4.765 17.645 -1.549 135 HB2 PRO 17 HB2 PRO 17 -2.290 18.664 -2.224 136 HB3 PRO 17 HB3 PRO 17 -3.838 19.163 -2.976 137 HG2 PRO 17 HG2 PRO 17 -2.309 20.518 -0.750 138 HG3 PRO 17 HG3 PRO 17 -3.042 21.261 -2.206 139 HD2 PRO 17 HD2 PRO 17 -4.272 21.289 0.206 140 HD3 PRO 17 HD3 PRO 17 -5.215 21.077 -1.301 141 H ILE 18 H ILE 18 -3.924 15.744 -0.948 142 HA ILE 18 HA ILE 18 -2.598 15.287 1.513 143 HB ILE 18 HB ILE 18 -3.853 13.590 0.247 144 HG12 ILE 18 HG12 ILE 18 -1.017 12.673 0.863 145 HG13 ILE 18 HG13 ILE 18 -2.226 13.065 2.096 146 HG21 ILE 18 HG21 ILE 18 -2.861 14.086 -2.034 147 HG22 ILE 18 HG22 ILE 18 -1.421 13.181 -1.527 148 HG23 ILE 18 HG23 ILE 18 -3.000 12.388 -1.611 149 HD11 ILE 18 HD11 ILE 18 -3.723 11.284 1.129 150 HD12 ILE 18 HD12 ILE 18 -2.388 10.824 0.047 151 HD13 ILE 18 HD13 ILE 18 -2.195 10.683 1.802 152 H GLY 19 H GLY 19 -1.184 15.899 -1.701 153 HA2 GLY 19 HA2 GLY 19 1.460 15.039 -1.019 154 HA3 GLY 19 HA3 GLY 19 1.035 16.116 -2.353 155 H LYS 20 H LYS 20 -0.190 18.134 -0.472 156 HA LYS 20 HA LYS 20 2.236 19.579 0.271 157 HB2 LYS 20 HB2 LYS 20 0.036 20.581 -0.585 158 HB3 LYS 20 HB3 LYS 20 -0.637 20.252 1.022 159 HG2 LYS 20 HG2 LYS 20 1.250 21.662 1.991 160 HG3 LYS 20 HG3 LYS 20 1.744 22.034 0.327 161 HD2 LYS 20 HD2 LYS 20 -0.561 22.981 -0.081 162 HD3 LYS 20 HD3 LYS 20 -0.938 22.689 1.633 163 HE2 LYS 20 HE2 LYS 20 1.030 24.131 2.256 164 HE3 LYS 20 HE3 LYS 20 1.287 24.471 0.539 165 HZ1 LYS 20 HZ1 LYS 20 -0.954 25.465 0.485 166 HZ2 LYS 20 HZ2 LYS 20 -1.150 25.186 2.088 167 HZ3 LYS 20 HZ3 LYS 20 -0.007 26.230 1.571 168 H ILE 21 H ILE 21 -0.247 17.684 1.951 169 HA ILE 21 HA ILE 21 0.559 18.382 4.629 170 HB ILE 21 HB ILE 21 -0.990 16.011 3.589 171 HG12 ILE 21 HG12 ILE 21 -2.040 18.428 5.130 172 HG13 ILE 21 HG13 ILE 21 -1.954 18.435 3.374 173 HG21 ILE 21 HG21 ILE 21 -0.058 15.336 5.703 174 HG22 ILE 21 HG22 ILE 21 -0.555 16.862 6.468 175 HG23 ILE 21 HG23 ILE 21 -1.757 15.673 5.943 176 HD11 ILE 21 HD11 ILE 21 -3.436 16.472 3.247 177 HD12 ILE 21 HD12 ILE 21 -3.605 16.483 5.018 178 HD13 ILE 21 HD13 ILE 21 -4.193 17.853 4.060 179 H VAL 22 H VAL 22 1.433 15.774 2.371 180 HA VAL 22 HA VAL 22 3.243 14.508 4.266 181 HB VAL 22 HB VAL 22 2.711 14.092 1.318 182 HG11 VAL 22 HG11 VAL 22 4.965 13.241 1.775 183 HG12 VAL 22 HG12 VAL 22 4.386 12.370 3.206 184 HG13 VAL 22 HG13 VAL 22 3.845 11.889 1.601 185 HG21 VAL 22 HG21 VAL 22 1.908 12.553 3.845 186 HG22 VAL 22 HG22 VAL 22 0.821 13.548 2.853 187 HG23 VAL 22 HG23 VAL 22 1.501 12.057 2.197 188 H GLU 23 H GLU 23 3.797 16.720 1.454 189 HA GLU 23 HA GLU 23 6.670 16.444 1.756 190 HB2 GLU 23 HB2 GLU 23 6.906 17.871 0.000 191 HB3 GLU 23 HB3 GLU 23 5.365 17.072 -0.350 192 HG2 GLU 23 HG2 GLU 23 4.230 19.102 0.666 193 HG3 GLU 23 HG3 GLU 23 5.806 19.871 0.730 194 H LYS 24 H LYS 24 4.317 18.490 3.295 195 HA LYS 24 HA LYS 24 6.475 20.120 4.611 196 HB2 LYS 24 HB2 LYS 24 3.507 20.726 4.526 197 HB3 LYS 24 HB3 LYS 24 4.781 21.774 5.109 198 HG2 LYS 24 HG2 LYS 24 4.269 20.946 2.229 199 HG3 LYS 24 HG3 LYS 24 3.928 22.506 2.944 200 HD2 LYS 24 HD2 LYS 24 6.717 21.334 2.538 201 HD3 LYS 24 HD3 LYS 24 5.927 22.539 1.516 202 HE2 LYS 24 HE2 LYS 24 5.754 24.059 3.519 203 HE3 LYS 24 HE3 LYS 24 6.698 22.883 4.446 204 HZ1 LYS 24 HZ1 LYS 24 8.513 23.190 2.827 205 HZ2 LYS 24 HZ2 LYS 24 7.635 24.294 1.999 206 HZ3 LYS 24 HZ3 LYS 24 8.122 24.614 3.523 207 H ARG 25 H ARG 25 4.797 17.397 5.143 208 HA ARG 25 HA ARG 25 4.113 16.143 6.916 209 HB2 ARG 25 HB2 ARG 25 6.434 17.445 8.369 210 HB3 ARG 25 HB3 ARG 25 5.703 15.875 8.672 211 HG2 ARG 25 HG2 ARG 25 7.428 15.100 7.420 212 HG3 ARG 25 HG3 ARG 25 6.336 15.476 6.086 213 HD2 ARG 25 HD2 ARG 25 8.600 16.257 5.611 214 HD3 ARG 25 HD3 ARG 25 7.487 17.621 5.720 215 HE ARG 25 HE ARG 25 8.888 16.971 8.224 216 HH11 ARG 25 HH11 ARG 25 9.171 18.888 5.293 217 HH12 ARG 25 HH12 ARG 25 10.192 20.072 6.074 218 HH21 ARG 25 HH21 ARG 25 10.185 18.512 9.139 219 HH22 ARG 25 HH22 ARG 25 10.758 19.853 8.185 220 H ILE 26 H ILE 26 2.260 17.841 6.766 221 HA ILE 26 HA ILE 26 2.094 19.744 8.975 222 HB ILE 26 HB ILE 26 -0.135 19.008 7.046 223 HG12 ILE 26 HG12 ILE 26 2.065 21.106 6.753 224 HG13 ILE 26 HG13 ILE 26 1.901 19.643 5.778 225 HG21 ILE 26 HG21 ILE 26 -0.734 20.338 9.111 226 HG22 ILE 26 HG22 ILE 26 0.428 21.578 8.604 227 HG23 ILE 26 HG23 ILE 26 -1.009 21.222 7.619 228 HD11 ILE 26 HD11 ILE 26 1.024 21.331 4.406 229 HD12 ILE 26 HD12 ILE 26 -0.406 20.519 5.036 230 HD13 ILE 26 HD13 ILE 26 0.105 22.078 5.710 231 H GLU 27 H GLU 27 1.379 19.361 10.914 232 HA GLU 27 HA GLU 27 0.217 16.804 11.745 233 HB2 GLU 27 HB2 GLU 27 0.910 19.351 13.244 234 HB3 GLU 27 HB3 GLU 27 0.146 17.944 14.001 235 HG2 GLU 27 HG2 GLU 27 2.010 16.507 13.326 236 HG3 GLU 27 HG3 GLU 27 2.814 17.865 12.532 237 H CYS 28 H CYS 28 -1.757 16.477 10.899 238 HA CYS 28 HA CYS 28 -3.988 18.242 11.803 239 HB2 CYS 28 HB2 CYS 28 -3.424 17.290 8.967 240 HB3 CYS 28 HB3 CYS 28 -5.022 17.831 9.478 241 HG CYS 28 HG CYS 28 -3.764 19.699 8.095 242 H THR 29 H THR 29 -6.140 17.206 11.300 243 HA THR 29 HA THR 29 -6.153 14.327 12.149 244 HB THR 29 HB THR 29 -8.269 16.382 12.765 245 HG1 THR 29 HG1 THR 29 -7.323 16.714 14.744 246 HG21 THR 29 HG21 THR 29 -8.772 13.921 13.137 247 HG22 THR 29 HG22 THR 29 -7.501 13.945 14.390 248 HG23 THR 29 HG23 THR 29 -8.947 14.959 14.558 249 H VAL 30 H VAL 30 -7.641 12.976 11.130 250 HA VAL 30 HA VAL 30 -9.086 14.067 8.734 251 HB VAL 30 HB VAL 30 -8.438 12.102 7.477 252 HG11 VAL 30 HG11 VAL 30 -6.997 14.117 7.400 253 HG12 VAL 30 HG12 VAL 30 -5.943 13.394 8.638 254 HG13 VAL 30 HG13 VAL 30 -6.127 12.619 7.052 255 HG21 VAL 30 HG21 VAL 30 -6.682 11.288 9.831 256 HG22 VAL 30 HG22 VAL 30 -8.134 10.429 9.260 257 HG23 VAL 30 HG23 VAL 30 -6.705 10.533 8.226 258 H TYR 31 H TYR 31 -10.723 12.510 7.867 259 HA TYR 31 HA TYR 31 -12.299 11.315 10.092 260 HB2 TYR 31 HB2 TYR 31 -13.170 12.227 7.316 261 HB3 TYR 31 HB3 TYR 31 -14.180 11.380 8.458 262 HD1 TYR 31 HD1 TYR 31 -12.290 14.579 7.949 263 HD2 TYR 31 HD2 TYR 31 -15.364 12.500 10.161 264 HE1 TYR 31 HE1 TYR 31 -12.993 16.723 8.994 265 HE2 TYR 31 HE2 TYR 31 -16.096 14.657 11.169 266 HH TYR 31 HH TYR 31 -14.487 17.753 10.394 267 H SER 32 H SER 32 -13.116 9.280 9.926 268 HA SER 32 HA SER 32 -12.378 7.422 7.753 269 HB2 SER 32 HB2 SER 32 -10.305 7.430 8.921 270 HB3 SER 32 HB3 SER 32 -11.091 7.556 10.492 271 HG SER 32 HG SER 32 -10.421 5.448 10.237 272 H VAL 33 H VAL 33 -13.403 5.318 8.097 273 HA VAL 33 HA VAL 33 -15.761 5.417 9.938 274 HB VAL 33 HB VAL 33 -15.584 3.328 7.789 275 HG11 VAL 33 HG11 VAL 33 -17.254 3.274 9.567 276 HG12 VAL 33 HG12 VAL 33 -17.913 4.826 8.994 277 HG13 VAL 33 HG13 VAL 33 -17.943 3.387 7.936 278 HG21 VAL 33 HG21 VAL 33 -16.622 6.164 7.318 279 HG22 VAL 33 HG22 VAL 33 -15.237 5.411 6.504 280 HG23 VAL 33 HG23 VAL 33 -16.860 4.771 6.234 281 H ASP 34 H ASP 34 -15.767 4.119 11.638 282 HA ASP 34 HA ASP 34 -13.575 2.373 12.307 283 HB2 ASP 34 HB2 ASP 34 -15.080 3.731 13.887 284 HB3 ASP 34 HB3 ASP 34 -16.313 2.501 13.570 285 H ASN 35 H ASN 35 -14.192 0.229 13.301 286 HA ASN 35 HA ASN 35 -14.884 -1.703 11.245 287 HB2 ASN 35 HB2 ASN 35 -14.459 -1.949 14.255 288 HB3 ASN 35 HB3 ASN 35 -14.772 -3.332 13.212 289 HD21 ASN 35 HD22 ASN 35 -12.324 -2.484 14.834 290 HD22 ASN 35 HD21 ASN 35 -11.027 -2.618 13.653 291 H ASN 36 H ASN 36 -16.805 -0.115 13.721 292 HA ASN 36 HA ASN 36 -19.169 -1.833 13.272 293 HB2 ASN 36 HB2 ASN 36 -18.603 0.586 15.047 294 HB3 ASN 36 HB3 ASN 36 -20.167 -0.220 14.961 295 HD21 ASN 36 HD22 ASN 36 -17.044 -0.336 16.438 296 HD22 ASN 36 HD21 ASN 36 -17.308 -1.870 17.262 297 H GLY 37 H GLY 37 -17.828 0.533 11.394 298 HA2 GLY 37 HA2 GLY 37 -18.654 1.659 9.592 299 HA3 GLY 37 HA3 GLY 37 -20.264 1.097 9.929 300 H ASN 38 H ASN 38 -18.559 2.809 12.462 301 HA ASN 38 HA ASN 38 -20.345 5.193 12.209 302 HB2 ASN 38 HB2 ASN 38 -18.474 4.235 14.428 303 HB3 ASN 38 HB3 ASN 38 -19.414 5.721 14.486 304 HD21 ASN 38 HD22 ASN 38 -19.447 2.910 15.938 305 HD22 ASN 38 HD21 ASN 38 -21.172 2.571 15.968 306 H ILE 39 H ILE 39 -19.533 7.167 11.547 307 HA ILE 39 HA ILE 39 -16.760 7.375 10.675 308 HB ILE 39 HB ILE 39 -18.918 9.509 10.805 309 HG12 ILE 39 HG12 ILE 39 -17.976 7.781 8.462 310 HG13 ILE 39 HG13 ILE 39 -19.521 7.598 9.294 311 HG21 ILE 39 HG21 ILE 39 -16.580 10.402 10.777 312 HG22 ILE 39 HG22 ILE 39 -16.235 9.428 9.332 313 HG23 ILE 39 HG23 ILE 39 -17.410 10.761 9.283 314 HD11 ILE 39 HD11 ILE 39 -20.183 9.890 8.584 315 HD12 ILE 39 HD12 ILE 39 -18.662 10.006 7.671 316 HD13 ILE 39 HD13 ILE 39 -19.879 8.798 7.218 317 H TYR 40 H TYR 40 -15.151 8.149 11.773 318 HA TYR 40 HA TYR 40 -15.477 9.827 14.200 319 HB2 TYR 40 HB2 TYR 40 -14.075 8.496 15.546 320 HB3 TYR 40 HB3 TYR 40 -15.261 7.395 14.880 321 HD1 TYR 40 HD2 TYR 40 -14.564 5.853 12.916 322 HD2 TYR 40 HD1 TYR 40 -11.742 8.158 15.240 323 HE1 TYR 40 HE2 TYR 40 -12.680 4.549 11.951 324 HE2 TYR 40 HE1 TYR 40 -9.882 6.795 14.307 325 HH TYR 40 HH TYR 40 -9.282 5.369 12.608 326 H THR 41 H THR 41 -13.125 10.543 14.910 327 HA THR 41 HA THR 41 -11.534 11.228 12.482 328 HB THR 41 HB THR 41 -11.008 13.423 13.696 329 HG1 THR 41 HG1 THR 41 -11.978 12.957 15.684 330 HG21 THR 41 HG21 THR 41 -12.295 13.419 11.679 331 HG22 THR 41 HG22 THR 41 -13.762 12.888 12.540 332 HG23 THR 41 HG23 THR 41 -13.091 14.501 12.834 333 H GLN 42 H GLN 42 -9.360 11.344 12.617 334 HA GLN 42 HA GLN 42 -8.043 10.516 15.151 335 HB2 GLN 42 HB2 GLN 42 -6.880 8.694 13.990 336 HB3 GLN 42 HB3 GLN 42 -8.624 8.487 14.016 337 HG2 GLN 42 HG2 GLN 42 -8.711 9.329 11.616 338 HG3 GLN 42 HG3 GLN 42 -6.946 9.377 11.632 339 HE21 GLN 42 HE22 GLN 42 -7.489 7.875 9.670 340 HE22 GLN 42 HE21 GLN 42 -7.538 6.171 10.061 341 HA PRO 43 HA PRO 43 -4.923 13.356 13.622 342 HB2 PRO 43 HB2 PRO 43 -2.846 12.805 15.290 343 HB3 PRO 43 HB3 PRO 43 -4.335 13.628 15.843 344 HG2 PRO 43 HG2 PRO 43 -3.635 10.687 16.085 345 HG3 PRO 43 HG3 PRO 43 -4.271 11.784 17.354 346 HD2 PRO 43 HD2 PRO 43 -5.879 10.104 15.913 347 HD3 PRO 43 HD3 PRO 43 -6.438 11.717 16.457 348 H VAL 44 H VAL 44 -3.157 13.343 12.225 349 HA VAL 44 HA VAL 44 -2.375 10.966 10.839 350 HB VAL 44 HB VAL 44 -2.230 13.206 9.888 351 HG11 VAL 44 HG11 VAL 44 -1.318 14.446 11.886 352 HG12 VAL 44 HG12 VAL 44 0.249 13.680 11.588 353 HG13 VAL 44 HG13 VAL 44 -0.459 14.753 10.366 354 HG21 VAL 44 HG21 VAL 44 0.519 11.918 9.941 355 HG22 VAL 44 HG22 VAL 44 -0.865 11.278 9.037 356 HG23 VAL 44 HG23 VAL 44 -0.214 12.878 8.647 357 H ALA 45 H ALA 45 -0.716 9.501 11.135 358 HA ALA 45 HA ALA 45 0.752 9.644 13.722 359 HB1 ALA 45 HB1 ALA 45 -0.693 7.662 13.153 360 HB2 ALA 45 HB2 ALA 45 0.425 7.286 11.827 361 HB3 ALA 45 HB3 ALA 45 1.005 7.270 13.497 362 H GLN 46 H GLN 46 1.373 9.084 10.232 363 HA GLN 46 HA GLN 46 4.047 10.321 10.437 364 HB2 GLN 46 HB2 GLN 46 3.629 7.540 9.233 365 HB3 GLN 46 HB3 GLN 46 5.093 8.497 9.139 366 HG2 GLN 46 HG2 GLN 46 5.647 7.035 10.780 367 HG3 GLN 46 HG3 GLN 46 5.171 8.449 11.700 368 HE21 GLN 46 HE22 GLN 46 4.643 7.243 13.619 369 HE22 GLN 46 HE21 GLN 46 3.333 6.070 13.654 370 H TRP 47 H TRP 47 5.015 10.292 8.059 371 HA TRP 47 HA TRP 47 2.917 10.803 5.991 372 HB2 TRP 47 HB2 TRP 47 5.295 12.593 6.626 373 HB3 TRP 47 HB3 TRP 47 4.156 12.815 5.320 374 HD1 TRP 47 HD1 TRP 47 1.892 14.044 5.862 375 HE1 TRP 47 HE1 TRP 47 1.027 15.357 7.880 376 HE3 TRP 47 HE3 TRP 47 5.380 12.579 9.319 377 HZ2 TRP 47 HZ2 TRP 47 1.740 15.691 10.652 378 HZ3 TRP 47 HZ3 TRP 47 5.232 13.391 11.665 379 HH2 TRP 47 HH2 TRP 47 3.397 14.939 12.339 380 H HIS 48 H HIS 48 3.364 9.500 4.256 381 HA HIS 48 HA HIS 48 6.188 8.605 3.819 382 HB2 HIS 48 HB2 HIS 48 3.648 7.132 3.061 383 HB3 HIS 48 HB3 HIS 48 5.302 6.564 2.930 384 HD1 HIS 48 HD1 HIS 48 6.489 5.775 5.278 385 HD2 HIS 48 HD2 HIS 48 2.442 6.924 5.427 386 HE1 HIS 48 HE1 HIS 48 5.593 4.948 7.517 387 H ASP 49 H ASP 49 7.132 9.372 2.094 388 HA ASP 49 HA ASP 49 5.544 10.356 -0.225 389 HB2 ASP 49 HB2 ASP 49 7.317 11.849 -0.706 390 HB3 ASP 49 HB3 ASP 49 6.832 12.069 0.966 391 H ARG 50 H ARG 50 5.465 9.038 -1.867 392 HA ARG 50 HA ARG 50 7.260 6.710 -2.088 393 HB2 ARG 50 HB2 ARG 50 5.020 7.663 -3.869 394 HB3 ARG 50 HB3 ARG 50 5.774 6.080 -3.893 395 HG2 ARG 50 HG2 ARG 50 4.090 7.250 -1.623 396 HG3 ARG 50 HG3 ARG 50 3.616 5.982 -2.733 397 HD2 ARG 50 HD2 ARG 50 5.801 5.761 -0.634 398 HD3 ARG 50 HD3 ARG 50 4.177 5.065 -0.558 399 HE ARG 50 HE ARG 50 5.762 4.230 -2.906 400 HH11 ARG 50 HH11 ARG 50 5.127 3.358 0.434 401 HH12 ARG 50 HH12 ARG 50 5.584 1.698 0.154 402 HH21 ARG 50 HH21 ARG 50 6.174 2.165 -3.220 403 HH22 ARG 50 HH22 ARG 50 6.265 1.051 -1.867 404 H GLY 51 H GLY 51 6.827 9.748 -3.730 405 HA2 GLY 51 HA2 GLY 51 8.527 10.925 -4.841 406 HA3 GLY 51 HA3 GLY 51 9.421 9.435 -5.094 407 H GLU 52 H GLU 52 7.694 7.802 -6.500 408 HA GLU 52 HA GLU 52 6.458 9.038 -8.810 409 HB2 GLU 52 HB2 GLU 52 9.314 8.048 -9.214 410 HB3 GLU 52 HB3 GLU 52 8.090 8.209 -10.476 411 HG2 GLU 52 HG2 GLU 52 7.945 10.671 -9.897 412 HG3 GLU 52 HG3 GLU 52 9.441 10.428 -8.964 413 H GLN 53 H GLN 53 4.884 7.451 -8.557 414 HA GLN 53 HA GLN 53 5.675 4.720 -9.543 415 HB2 GLN 53 HB2 GLN 53 3.529 5.441 -7.527 416 HB3 GLN 53 HB3 GLN 53 3.936 3.800 -8.079 417 HG2 GLN 53 HG2 GLN 53 6.276 4.128 -7.175 418 HG3 GLN 53 HG3 GLN 53 5.745 5.708 -6.535 419 HE21 GLN 53 HE22 GLN 53 3.147 4.986 -5.521 420 HE22 GLN 53 HE21 GLN 53 3.769 4.494 -3.994 421 H GLU 54 H GLU 54 3.850 3.529 -10.513 422 HA GLU 54 HA GLU 54 2.846 4.965 -12.753 423 HB2 GLU 54 HB2 GLU 54 1.613 2.821 -13.238 424 HB3 GLU 54 HB3 GLU 54 3.359 2.744 -13.170 425 HG2 GLU 54 HG2 GLU 54 1.775 1.993 -10.697 426 HG3 GLU 54 HG3 GLU 54 1.824 0.895 -12.066 427 H VAL 55 H VAL 55 1.412 6.560 -12.499 428 HA VAL 55 HA VAL 55 -1.015 6.204 -10.822 429 HB VAL 55 HB VAL 55 -0.066 8.717 -12.250 430 HG11 VAL 55 HG11 VAL 55 -2.481 8.750 -11.596 431 HG12 VAL 55 HG12 VAL 55 -2.013 8.346 -9.930 432 HG13 VAL 55 HG13 VAL 55 -1.519 9.888 -10.664 433 HG21 VAL 55 HG21 VAL 55 0.523 7.614 -9.489 434 HG22 VAL 55 HG22 VAL 55 1.637 8.320 -10.679 435 HG23 VAL 55 HG23 VAL 55 0.526 9.362 -9.798 436 H PHE 56 H PHE 56 -3.013 6.223 -11.546 437 HA PHE 56 HA PHE 56 -3.591 6.339 -14.472 438 HB2 PHE 56 HB2 PHE 56 -4.808 4.554 -12.338 439 HB3 PHE 56 HB3 PHE 56 -5.298 4.626 -14.025 440 HD1 PHE 56 HD1 PHE 56 -2.524 3.665 -11.725 441 HD2 PHE 56 HD2 PHE 56 -4.017 3.489 -15.755 442 HE1 PHE 56 HE1 PHE 56 -0.754 2.015 -12.310 443 HE2 PHE 56 HE2 PHE 56 -2.299 1.770 -16.311 444 HZ PHE 56 HZ PHE 56 -0.645 1.068 -14.599 445 H GLU 57 H GLU 57 -5.278 7.579 -15.092 446 HA GLU 57 HA GLU 57 -6.536 9.505 -13.370 447 HB2 GLU 57 HB2 GLU 57 -6.209 9.712 -15.840 448 HB3 GLU 57 HB3 GLU 57 -7.393 8.430 -16.099 449 HG2 GLU 57 HG2 GLU 57 -9.161 9.813 -15.102 450 HG3 GLU 57 HG3 GLU 57 -7.978 11.042 -14.638 451 H TYR 58 H TYR 58 -8.315 9.358 -12.101 452 HA TYR 58 HA TYR 58 -10.189 7.064 -12.429 453 HB2 TYR 58 HB2 TYR 58 -8.832 6.539 -10.589 454 HB3 TYR 58 HB3 TYR 58 -8.866 8.174 -9.954 455 HD1 TYR 58 HD2 TYR 58 -12.061 6.658 -11.089 456 HD2 TYR 58 HD1 TYR 58 -9.376 7.185 -7.744 457 HE1 TYR 58 HE2 TYR 58 -13.838 5.973 -9.547 458 HE2 TYR 58 HE1 TYR 58 -11.215 6.547 -6.185 459 HH TYR 58 HH TYR 58 -14.498 5.776 -7.423 460 H CYS 59 H CYS 59 -11.554 8.212 -13.686 461 HA CYS 59 HA CYS 59 -12.790 10.708 -12.621 462 HB2 CYS 59 HB2 CYS 59 -11.861 10.584 -14.971 463 HB3 CYS 59 HB3 CYS 59 -13.088 9.359 -15.340 464 HG CYS 59 HG CYS 59 -13.787 11.729 -16.313 465 H LEU 60 H LEU 60 -15.009 10.846 -12.295 466 HA LEU 60 HA LEU 60 -16.527 8.271 -12.058 467 HB2 LEU 60 HB2 LEU 60 -15.944 10.430 -10.178 468 HB3 LEU 60 HB3 LEU 60 -17.647 10.365 -10.469 469 HG LEU 60 HG LEU 60 -17.881 8.128 -9.723 470 HD11 LEU 60 HD11 LEU 60 -15.795 7.083 -10.458 471 HD12 LEU 60 HD12 LEU 60 -14.886 8.082 -9.299 472 HD13 LEU 60 HD13 LEU 60 -16.049 6.845 -8.731 473 HD21 LEU 60 HD21 LEU 60 -16.028 9.594 -7.795 474 HD22 LEU 60 HD22 LEU 60 -17.737 9.987 -8.020 475 HD23 LEU 60 HD23 LEU 60 -17.279 8.401 -7.382 476 H GLU 61 H GLU 61 -18.838 8.426 -12.141 477 HA GLU 61 HA GLU 61 -19.637 9.542 -14.657 478 HB2 GLU 61 HB2 GLU 61 -21.331 8.303 -12.460 479 HB3 GLU 61 HB3 GLU 61 -21.839 8.588 -14.132 480 HG2 GLU 61 HG2 GLU 61 -19.955 7.092 -14.892 481 HG3 GLU 61 HG3 GLU 61 -19.644 6.698 -13.199 482 H ASP 62 H ASP 62 -19.833 10.897 -11.475 483 HA ASP 62 HA ASP 62 -21.726 13.053 -12.229 484 HB2 ASP 62 HB2 ASP 62 -20.155 12.334 -9.744 485 HB3 ASP 62 HB3 ASP 62 -20.717 13.978 -9.958 486 H GLY 63 H GLY 63 -18.331 12.472 -12.601 487 HA2 GLY 63 HA2 GLY 63 -17.062 13.882 -14.054 488 HA3 GLY 63 HA3 GLY 63 -17.891 15.312 -13.440 489 H SER 64 H SER 64 -17.267 13.562 -10.706 490 HA SER 64 HA SER 64 -15.120 15.120 -9.707 491 HB2 SER 64 HB2 SER 64 -15.944 12.316 -8.850 492 HB3 SER 64 HB3 SER 64 -15.025 13.489 -7.897 493 HG SER 64 HG SER 64 -16.877 14.262 -7.273 494 H LEU 65 H LEU 65 -12.910 14.777 -9.533 495 HA LEU 65 HA LEU 65 -11.750 12.669 -11.301 496 HB2 LEU 65 HB2 LEU 65 -12.050 15.097 -12.235 497 HB3 LEU 65 HB3 LEU 65 -10.748 15.522 -11.131 498 HG LEU 65 HG LEU 65 -9.364 13.660 -12.277 499 HD11 LEU 65 HD11 LEU 65 -11.241 12.470 -13.395 500 HD12 LEU 65 HD12 LEU 65 -11.614 13.929 -14.328 501 HD13 LEU 65 HD13 LEU 65 -10.078 13.075 -14.583 502 HD21 LEU 65 HD21 LEU 65 -10.290 16.055 -13.923 503 HD22 LEU 65 HD22 LEU 65 -8.982 16.042 -12.718 504 HD23 LEU 65 HD23 LEU 65 -8.813 15.106 -14.212 505 H ILE 66 H ILE 66 -10.245 11.510 -10.482 506 HA ILE 66 HA ILE 66 -8.661 12.325 -8.090 507 HB ILE 66 HB ILE 66 -10.049 9.649 -8.552 508 HG12 ILE 66 HG12 ILE 66 -10.885 11.782 -6.544 509 HG13 ILE 66 HG13 ILE 66 -11.715 11.480 -8.066 510 HG21 ILE 66 HG21 ILE 66 -8.020 9.429 -7.185 511 HG22 ILE 66 HG22 ILE 66 -8.561 10.759 -6.125 512 HG23 ILE 66 HG23 ILE 66 -9.420 9.211 -6.167 513 HD11 ILE 66 HD11 ILE 66 -12.319 9.213 -7.389 514 HD12 ILE 66 HD12 ILE 66 -11.572 9.480 -5.793 515 HD13 ILE 66 HD13 ILE 66 -12.959 10.446 -6.302 516 H ARG 67 H ARG 67 -6.606 11.268 -7.947 517 HA ARG 67 HA ARG 67 -5.677 9.661 -10.290 518 HB2 ARG 67 HB2 ARG 67 -4.445 12.233 -9.222 519 HB3 ARG 67 HB3 ARG 67 -3.531 11.040 -10.159 520 HG2 ARG 67 HG2 ARG 67 -5.238 11.240 -11.988 521 HG3 ARG 67 HG3 ARG 67 -5.991 12.579 -11.095 522 HD2 ARG 67 HD2 ARG 67 -3.982 13.908 -11.235 523 HD3 ARG 67 HD3 ARG 67 -3.058 12.537 -11.883 524 HE ARG 67 HE ARG 67 -5.235 12.994 -13.640 525 HH11 ARG 67 HH11 ARG 67 -2.174 14.483 -12.793 526 HH12 ARG 67 HH12 ARG 67 -2.059 15.333 -14.312 527 HH21 ARG 67 HH21 ARG 67 -5.044 14.147 -15.545 528 HH22 ARG 67 HH22 ARG 67 -3.620 15.105 -15.839 529 H ALA 68 H ALA 68 -4.979 7.827 -9.552 530 HA ALA 68 HA ALA 68 -3.306 7.658 -7.107 531 HB1 ALA 68 HB1 ALA 68 -5.680 7.402 -6.391 532 HB2 ALA 68 HB2 ALA 68 -5.874 6.064 -7.543 533 HB3 ALA 68 HB3 ALA 68 -4.752 5.902 -6.172 534 H THR 69 H THR 69 -2.340 5.478 -6.859 535 HA THR 69 HA THR 69 -1.438 4.397 -9.438 536 HB THR 69 HB THR 69 -0.147 2.806 -7.939 537 HG1 THR 69 HG1 THR 69 -1.818 3.252 -6.232 538 HG21 THR 69 HG21 THR 69 0.922 4.885 -8.670 539 HG22 THR 69 HG22 THR 69 0.214 5.756 -7.287 540 HG23 THR 69 HG23 THR 69 1.400 4.451 -7.018 541 H LYS 70 H LYS 70 -1.656 2.237 -10.079 542 HA LYS 70 HA LYS 70 -4.203 0.965 -9.645 543 HB2 LYS 70 HB2 LYS 70 -3.131 0.691 -11.667 544 HB3 LYS 70 HB3 LYS 70 -1.648 0.019 -10.931 545 HG2 LYS 70 HG2 LYS 70 -2.877 -2.002 -10.312 546 HG3 LYS 70 HG3 LYS 70 -4.382 -1.295 -10.898 547 HD2 LYS 70 HD2 LYS 70 -1.891 -1.824 -12.561 548 HD3 LYS 70 HD3 LYS 70 -3.240 -2.956 -12.445 549 HE2 LYS 70 HE2 LYS 70 -4.691 -1.592 -13.723 550 HE3 LYS 70 HE3 LYS 70 -3.725 -0.141 -13.519 551 HZ1 LYS 70 HZ1 LYS 70 -1.988 -1.215 -14.891 552 HZ2 LYS 70 HZ2 LYS 70 -2.915 -2.550 -15.073 553 HZ3 LYS 70 HZ3 LYS 70 -3.399 -1.130 -15.714 554 H ASP 71 H ASP 71 -1.309 0.751 -7.774 555 HA ASP 71 HA ASP 71 -2.025 -1.785 -6.441 556 HB2 ASP 71 HB2 ASP 71 0.241 0.227 -6.131 557 HB3 ASP 71 HB3 ASP 71 0.024 -1.134 -5.035 558 H HIS 72 H HIS 72 -3.115 1.420 -6.087 559 HA HIS 72 HA HIS 72 -3.214 1.361 -3.140 560 HB2 HIS 72 HB2 HIS 72 -2.765 3.471 -4.398 561 HB3 HIS 72 HB3 HIS 72 -4.369 3.378 -5.114 562 HD1 HIS 72 HD1 HIS 72 -6.412 3.323 -2.968 563 HD2 HIS 72 HD2 HIS 72 -2.516 4.600 -2.058 564 HE1 HIS 72 HE1 HIS 72 -6.486 4.305 -0.651 565 H LYS 73 H LYS 73 -5.088 0.705 -2.068 566 HA LYS 73 HA LYS 73 -7.323 -0.437 -3.662 567 HB2 LYS 73 HB2 LYS 73 -6.454 -0.782 -0.769 568 HB3 LYS 73 HB3 LYS 73 -7.861 -1.575 -1.473 569 HG2 LYS 73 HG2 LYS 73 -6.585 -2.971 -2.858 570 HG3 LYS 73 HG3 LYS 73 -5.156 -1.932 -2.794 571 HD2 LYS 73 HD2 LYS 73 -4.900 -2.488 -0.355 572 HD3 LYS 73 HD3 LYS 73 -6.208 -3.682 -0.536 573 HE2 LYS 73 HE2 LYS 73 -4.889 -4.808 -2.330 574 HE3 LYS 73 HE3 LYS 73 -3.622 -3.583 -2.148 575 HZ1 LYS 73 HZ1 LYS 73 -3.283 -4.368 0.141 576 HZ2 LYS 73 HZ2 LYS 73 -4.453 -5.501 -0.026 577 HZ3 LYS 73 HZ3 LYS 73 -3.082 -5.608 -0.903 578 H PHE 74 H PHE 74 -9.519 -0.125 -3.046 579 HA PHE 74 HA PHE 74 -10.051 2.358 -1.442 580 HB2 PHE 74 HB2 PHE 74 -11.026 1.739 -4.240 581 HB3 PHE 74 HB3 PHE 74 -11.760 2.933 -3.183 582 HD1 PHE 74 HD2 PHE 74 -8.576 2.110 -5.026 583 HD2 PHE 74 HD1 PHE 74 -10.849 5.105 -2.884 584 HE1 PHE 74 HE2 PHE 74 -7.007 3.861 -5.792 585 HE2 PHE 74 HE1 PHE 74 -9.259 6.843 -3.657 586 HZ PHE 74 HZ PHE 74 -7.343 6.231 -5.103 587 H MET 75 H MET 75 -11.929 2.448 -0.313 588 HA MET 75 HA MET 75 -13.026 -0.139 0.490 589 HB2 MET 75 HB2 MET 75 -12.539 1.629 2.136 590 HB3 MET 75 HB3 MET 75 -13.688 2.701 1.323 591 HG2 MET 75 HG2 MET 75 -15.502 1.027 1.803 592 HG3 MET 75 HG3 MET 75 -14.339 0.087 2.737 593 HE1 MET 75 HE1 MET 75 -14.372 0.186 5.168 594 HE2 MET 75 HE2 MET 75 -13.017 1.314 4.935 595 HE3 MET 75 HE3 MET 75 -14.305 1.690 6.121 596 H THR 76 H THR 76 -14.255 -1.043 -1.027 597 HA THR 76 HA THR 76 -16.178 0.347 -2.723 598 HB THR 76 HB THR 76 -17.052 -1.954 -3.202 599 HG1 THR 76 HG1 THR 76 -14.831 -2.909 -1.807 600 HG21 THR 76 HG21 THR 76 -15.258 -0.977 -4.545 601 HG22 THR 76 HG22 THR 76 -14.035 -1.630 -3.431 602 HG23 THR 76 HG23 THR 76 -15.066 -2.734 -4.378 603 H VAL 77 H VAL 77 -18.544 -0.286 -2.720 604 HA VAL 77 HA VAL 77 -19.851 0.504 -0.383 605 HB VAL 77 HB VAL 77 -21.936 -0.443 -1.439 606 HG11 VAL 77 HG11 VAL 77 -21.182 1.855 -1.799 607 HG12 VAL 77 HG12 VAL 77 -20.167 1.334 -3.155 608 HG13 VAL 77 HG13 VAL 77 -21.935 1.188 -3.259 609 HG21 VAL 77 HG21 VAL 77 -20.080 -1.138 -3.763 610 HG22 VAL 77 HG22 VAL 77 -20.838 -2.326 -2.682 611 HG23 VAL 77 HG23 VAL 77 -21.843 -1.287 -3.706 612 H ASP 78 H ASP 78 -18.692 -2.712 -1.000 613 HA ASP 78 HA ASP 78 -20.203 -3.781 1.355 614 HB2 ASP 78 HB2 ASP 78 -18.699 -5.062 -0.943 615 HB3 ASP 78 HB3 ASP 78 -19.067 -5.961 0.522 616 H GLY 79 H GLY 79 -17.320 -2.204 0.801 617 HA2 GLY 79 HA2 GLY 79 -15.719 -1.678 2.402 618 HA3 GLY 79 HA3 GLY 79 -16.196 -3.059 3.392 619 H GLN 80 H GLN 80 -15.748 -4.083 0.204 620 HA GLN 80 HA GLN 80 -13.413 -5.645 0.807 621 HB2 GLN 80 HB2 GLN 80 -14.563 -5.016 -1.937 622 HB3 GLN 80 HB3 GLN 80 -13.504 -6.354 -1.503 623 HG2 GLN 80 HG2 GLN 80 -15.311 -7.296 -0.062 624 HG3 GLN 80 HG3 GLN 80 -16.381 -5.980 -0.567 625 HE21 GLN 80 HE22 GLN 80 -16.635 -5.738 -3.072 626 HE22 GLN 80 HE21 GLN 80 -16.742 -7.255 -3.955 627 H MET 81 H MET 81 -11.382 -5.050 0.805 628 HA MET 81 HA MET 81 -10.424 -2.464 -0.177 629 HB2 MET 81 HB2 MET 81 -9.029 -4.786 1.218 630 HB3 MET 81 HB3 MET 81 -8.318 -3.190 0.949 631 HG2 MET 81 HG2 MET 81 -9.753 -2.162 2.534 632 HG3 MET 81 HG3 MET 81 -10.886 -3.512 2.520 633 HE1 MET 81 HE1 MET 81 -10.847 -3.433 5.312 634 HE2 MET 81 HE2 MET 81 -11.185 -4.890 4.354 635 HE3 MET 81 HE3 MET 81 -10.117 -4.984 5.771 636 H LEU 82 H LEU 82 -10.873 -3.003 -2.505 637 HA LEU 82 HA LEU 82 -8.899 -4.905 -3.708 638 HB2 LEU 82 HB2 LEU 82 -11.390 -3.767 -5.007 639 HB3 LEU 82 HB3 LEU 82 -10.363 -5.059 -5.606 640 HG LEU 82 HG LEU 82 -12.167 -5.198 -3.160 641 HD11 LEU 82 HD11 LEU 82 -13.332 -5.291 -5.336 642 HD12 LEU 82 HD12 LEU 82 -12.296 -6.648 -5.830 643 HD13 LEU 82 HD13 LEU 82 -13.421 -6.834 -4.469 644 HD21 LEU 82 HD21 LEU 82 -10.349 -7.342 -4.347 645 HD22 LEU 82 HD22 LEU 82 -10.187 -6.593 -2.743 646 HD23 LEU 82 HD23 LEU 82 -11.583 -7.613 -3.095 647 HA PRO 83 HA PRO 83 -6.758 -1.458 -5.624 648 HB2 PRO 83 HB2 PRO 83 -5.705 -2.650 -7.853 649 HB3 PRO 83 HB3 PRO 83 -5.078 -2.940 -6.203 650 HG2 PRO 83 HG2 PRO 83 -7.043 -4.605 -7.796 651 HG3 PRO 83 HG3 PRO 83 -5.597 -5.175 -6.904 652 HD2 PRO 83 HD2 PRO 83 -8.092 -5.322 -5.848 653 HD3 PRO 83 HD3 PRO 83 -6.688 -4.911 -4.819 654 H ILE 84 H ILE 84 -7.129 0.086 -7.186 655 HA ILE 84 HA ILE 84 -9.702 0.330 -8.205 656 HB ILE 84 HB ILE 84 -8.288 2.199 -7.815 657 HG12 ILE 84 HG12 ILE 84 -8.754 2.405 -10.792 658 HG13 ILE 84 HG13 ILE 84 -10.118 2.023 -9.741 659 HG21 ILE 84 HG21 ILE 84 -6.094 1.389 -8.498 660 HG22 ILE 84 HG22 ILE 84 -6.603 1.321 -10.204 661 HG23 ILE 84 HG23 ILE 84 -6.465 2.879 -9.366 662 HD11 ILE 84 HD11 ILE 84 -9.816 3.982 -8.420 663 HD12 ILE 84 HD12 ILE 84 -8.375 4.454 -9.365 664 HD13 ILE 84 HD13 ILE 84 -9.982 4.391 -10.137 665 H ASP 85 H ASP 85 -6.985 -1.123 -9.952 666 HA ASP 85 HA ASP 85 -8.229 -1.377 -12.520 667 HB2 ASP 85 HB2 ASP 85 -5.944 -1.759 -12.218 668 HB3 ASP 85 HB3 ASP 85 -6.182 -3.011 -10.995 669 H GLU 86 H GLU 86 -8.762 -3.230 -9.553 670 HA GLU 86 HA GLU 86 -10.288 -5.368 -10.899 671 HB2 GLU 86 HB2 GLU 86 -8.845 -5.543 -8.729 672 HB3 GLU 86 HB3 GLU 86 -10.197 -4.741 -7.930 673 HG2 GLU 86 HG2 GLU 86 -10.495 -7.036 -7.550 674 HG3 GLU 86 HG3 GLU 86 -11.660 -6.648 -8.806 675 H ILE 87 H ILE 87 -10.891 -2.299 -9.177 676 HA ILE 87 HA ILE 87 -13.742 -2.668 -8.838 677 HB ILE 87 HB ILE 87 -12.037 -0.143 -8.893 678 HG12 ILE 87 HG12 ILE 87 -12.976 -1.896 -6.572 679 HG13 ILE 87 HG13 ILE 87 -11.319 -1.788 -7.176 680 HG21 ILE 87 HG21 ILE 87 -14.494 0.294 -9.242 681 HG22 ILE 87 HG22 ILE 87 -14.819 -0.552 -7.722 682 HG23 ILE 87 HG23 ILE 87 -13.885 0.958 -7.735 683 HD11 ILE 87 HD11 ILE 87 -11.253 0.619 -6.563 684 HD12 ILE 87 HD12 ILE 87 -12.841 0.408 -5.776 685 HD13 ILE 87 HD13 ILE 87 -11.439 -0.498 -5.197 686 H PHE 88 H PHE 88 -11.714 -1.149 -11.357 687 HA PHE 88 HA PHE 88 -13.843 -0.204 -13.014 688 HB2 PHE 88 HB2 PHE 88 -11.481 0.514 -13.152 689 HB3 PHE 88 HB3 PHE 88 -11.019 -1.082 -13.721 690 HD1 PHE 88 HD1 PHE 88 -13.055 1.963 -14.595 691 HD2 PHE 88 HD2 PHE 88 -11.197 -1.658 -16.035 692 HE1 PHE 88 HE1 PHE 88 -13.406 2.711 -16.924 693 HE2 PHE 88 HE2 PHE 88 -11.558 -0.903 -18.376 694 HZ PHE 88 HZ PHE 88 -12.665 1.283 -18.825 695 H GLU 89 H GLU 89 -12.346 -3.452 -12.808 696 HA GLU 89 HA GLU 89 -13.678 -4.448 -15.206 697 HB2 GLU 89 HB2 GLU 89 -12.095 -5.741 -12.960 698 HB3 GLU 89 HB3 GLU 89 -13.030 -6.719 -14.089 699 HG2 GLU 89 HG2 GLU 89 -11.841 -5.469 -15.989 700 HG3 GLU 89 HG3 GLU 89 -10.751 -4.821 -14.768 701 H ARG 90 H ARG 90 -14.365 -4.961 -11.664 702 HA ARG 90 HA ARG 90 -16.910 -6.239 -12.278 703 HB2 ARG 90 HB2 ARG 90 -15.688 -5.213 -9.674 704 HB3 ARG 90 HB3 ARG 90 -17.249 -6.032 -9.809 705 HG2 ARG 90 HG2 ARG 90 -15.952 -7.789 -9.270 706 HG3 ARG 90 HG3 ARG 90 -15.963 -7.917 -11.033 707 HD2 ARG 90 HD2 ARG 90 -13.691 -6.911 -11.097 708 HD3 ARG 90 HD3 ARG 90 -13.765 -6.687 -9.346 709 HE ARG 90 HE ARG 90 -13.278 -8.922 -9.022 710 HH11 ARG 90 HH11 ARG 90 -14.090 -8.588 -12.424 711 HH12 ARG 90 HH12 ARG 90 -13.521 -10.193 -12.798 712 HH21 ARG 90 HH21 ARG 90 -12.590 -10.949 -9.578 713 HH22 ARG 90 HH22 ARG 90 -12.708 -11.489 -11.230 714 H GLU 91 H GLU 91 -16.051 -2.919 -12.293 715 HA GLU 91 HA GLU 91 -17.236 -1.037 -12.480 716 HB2 GLU 91 HB2 GLU 91 -19.695 -2.706 -13.102 717 HB3 GLU 91 HB3 GLU 91 -19.381 -1.022 -13.525 718 HG2 GLU 91 HG2 GLU 91 -17.427 -1.823 -14.929 719 HG3 GLU 91 HG3 GLU 91 -17.965 -3.482 -14.633 720 H LEU 92 H LEU 92 -16.845 -2.077 -9.910 721 HA LEU 92 HA LEU 92 -19.326 -1.774 -8.353 722 HB2 LEU 92 HB2 LEU 92 -16.421 -2.212 -7.562 723 HB3 LEU 92 HB3 LEU 92 -17.728 -2.041 -6.394 724 HG LEU 92 HG LEU 92 -17.611 -4.204 -8.526 725 HD11 LEU 92 HD11 LEU 92 -15.802 -4.439 -6.858 726 HD12 LEU 92 HD12 LEU 92 -17.001 -4.357 -5.546 727 HD13 LEU 92 HD13 LEU 92 -17.011 -5.722 -6.689 728 HD21 LEU 92 HD21 LEU 92 -19.442 -3.868 -6.112 729 HD22 LEU 92 HD22 LEU 92 -19.923 -3.801 -7.824 730 HD23 LEU 92 HD23 LEU 92 -19.350 -5.318 -7.136 731 H ASP 93 H ASP 93 -19.904 -0.176 -7.048 732 HA ASP 93 HA ASP 93 -18.756 2.500 -7.383 733 HB2 ASP 93 HB2 ASP 93 -20.899 1.665 -5.421 734 HB3 ASP 93 HB3 ASP 93 -20.650 3.239 -6.163 735 H LEU 94 H LEU 94 -18.091 3.846 -5.534 736 HA LEU 94 HA LEU 94 -16.796 2.334 -3.307 737 HB2 LEU 94 HB2 LEU 94 -16.560 5.247 -4.172 738 HB3 LEU 94 HB3 LEU 94 -15.870 4.573 -2.696 739 HG LEU 94 HG LEU 94 -15.064 4.068 -5.557 740 HD11 LEU 94 HD11 LEU 94 -14.049 5.918 -4.226 741 HD12 LEU 94 HD12 LEU 94 -13.517 4.744 -3.002 742 HD13 LEU 94 HD13 LEU 94 -12.857 4.684 -4.652 743 HD21 LEU 94 HD21 LEU 94 -14.239 2.338 -3.195 744 HD22 LEU 94 HD22 LEU 94 -15.112 1.803 -4.657 745 HD23 LEU 94 HD23 LEU 94 -13.454 2.370 -4.789 746 H MET 95 H MET 95 -17.101 2.855 -1.148 747 HA MET 95 HA MET 95 -19.826 3.683 -0.416 748 HB2 MET 95 HB2 MET 95 -18.542 1.840 0.713 749 HB3 MET 95 HB3 MET 95 -17.445 3.043 1.388 750 HG2 MET 95 HG2 MET 95 -19.045 3.836 2.870 751 HG3 MET 95 HG3 MET 95 -20.387 3.498 1.779 752 HE1 MET 95 HE1 MET 95 -17.690 0.746 2.723 753 HE2 MET 95 HE2 MET 95 -17.768 1.758 4.191 754 HE3 MET 95 HE3 MET 95 -18.389 0.094 4.219 755 H ARG 96 H ARG 96 -20.330 5.604 0.741 756 HA ARG 96 HA ARG 96 -18.241 7.704 0.940 757 HB2 ARG 96 HB2 ARG 96 -19.734 9.379 -0.025 758 HB3 ARG 96 HB3 ARG 96 -19.301 8.152 -1.171 759 HG2 ARG 96 HG2 ARG 96 -21.943 8.055 0.304 760 HG3 ARG 96 HG3 ARG 96 -21.683 9.014 -1.143 761 HD2 ARG 96 HD2 ARG 96 -22.256 7.244 -2.372 762 HD3 ARG 96 HD3 ARG 96 -20.692 6.587 -1.978 763 HE ARG 96 HE ARG 96 -21.736 4.976 -0.673 764 HH11 ARG 96 HH11 ARG 96 -24.216 7.341 -1.392 765 HH12 ARG 96 HH12 ARG 96 -25.397 6.504 -0.413 766 HH21 ARG 96 HH21 ARG 96 -23.288 4.020 0.637 767 HH22 ARG 96 HH22 ARG 96 -24.900 4.661 0.615 768 H VAL 97 H VAL 97 -18.878 9.607 2.078 769 HA VAL 97 HA VAL 97 -20.414 8.959 4.564 770 HB VAL 97 HB VAL 97 -19.188 10.660 5.687 771 HG11 VAL 97 HG11 VAL 97 -18.158 8.368 5.431 772 HG12 VAL 97 HG12 VAL 97 -17.180 9.015 4.096 773 HG13 VAL 97 HG13 VAL 97 -16.983 9.661 5.733 774 HG21 VAL 97 HG21 VAL 97 -17.715 11.291 3.133 775 HG22 VAL 97 HG22 VAL 97 -18.816 12.369 4.013 776 HG23 VAL 97 HG23 VAL 97 -17.288 11.878 4.744 777 H ASP 98 H ASP 98 -20.281 11.301 1.952 778 HA ASP 98 HA ASP 98 -22.174 13.137 3.186 779 HB2 ASP 98 HB2 ASP 98 -20.246 13.661 1.567 780 HB3 ASP 98 HB3 ASP 98 -21.254 13.004 0.291 781 H ASN 99 H ASN 99 -22.646 10.159 1.804 782 HA ASN 99 HA ASN 99 -24.370 9.034 0.854 783 HB2 ASN 99 HB2 ASN 99 -25.922 11.043 2.499 784 HB3 ASN 99 HB3 ASN 99 -26.742 9.813 1.519 785 HD21 ASN 99 HD22 ASN 99 -24.056 10.147 3.809 786 HD22 ASN 99 HD21 ASN 99 -23.879 8.441 3.985 787 H LEU 100 H LEU 100 -22.998 10.649 -0.656 788 HA LEU 100 HA LEU 100 -24.612 11.771 -2.844 789 HB2 LEU 100 HB2 LEU 100 -21.790 10.648 -2.697 790 HB3 LEU 100 HB3 LEU 100 -22.463 11.134 -4.217 791 HG LEU 100 HG LEU 100 -22.076 12.987 -1.841 792 HD11 LEU 100 HD11 LEU 100 -19.980 12.202 -2.933 793 HD12 LEU 100 HD12 LEU 100 -20.591 12.771 -4.499 794 HD13 LEU 100 HD13 LEU 100 -20.260 13.933 -3.193 795 HD21 LEU 100 HD21 LEU 100 -22.941 13.592 -4.707 796 HD22 LEU 100 HD22 LEU 100 -23.938 13.796 -3.247 797 HD23 LEU 100 HD23 LEU 100 -22.511 14.804 -3.482 798 HA PRO 101 HA PRO 101 -26.139 8.024 -4.702 799 HB2 PRO 101 HB2 PRO 101 -25.868 8.470 -7.412 800 HB3 PRO 101 HB3 PRO 101 -27.111 9.251 -6.389 801 HG2 PRO 101 HG2 PRO 101 -24.444 10.375 -7.273 802 HG3 PRO 101 HG3 PRO 101 -26.044 11.180 -7.284 803 HD2 PRO 101 HD2 PRO 101 -24.227 11.583 -5.298 804 HD3 PRO 101 HD3 PRO 101 -25.963 11.540 -4.934 805 H ASN 102 H ASN 102 -25.315 6.009 -5.244 806 HA ASN 102 HA ASN 102 -22.449 5.623 -5.178 807 HB2 ASN 102 HB2 ASN 102 -24.734 3.722 -5.874 808 HB3 ASN 102 HB3 ASN 102 -23.064 3.235 -5.632 809 HD21 ASN 102 HD22 ASN 102 -22.077 4.058 -3.345 810 HD22 ASN 102 HD21 ASN 102 -23.213 3.689 -2.060 811 H ILE 103 H ILE 103 -21.010 5.666 -6.791 812 HA ILE 103 HA ILE 103 -21.783 5.200 -9.609 813 HB ILE 103 HB ILE 103 -20.424 7.264 -10.233 814 HG12 ILE 103 HG12 ILE 103 -21.077 8.060 -7.357 815 HG13 ILE 103 HG13 ILE 103 -19.483 7.818 -8.033 816 HG21 ILE 103 HG21 ILE 103 -22.897 6.950 -10.510 817 HG22 ILE 103 HG22 ILE 103 -23.134 7.768 -8.950 818 HG23 ILE 103 HG23 ILE 103 -22.409 8.630 -10.319 819 HD11 ILE 103 HD11 ILE 103 -19.895 9.765 -9.567 820 HD12 ILE 103 HD12 ILE 103 -21.474 10.002 -8.766 821 HD13 ILE 103 HD13 ILE 103 -19.993 10.186 -7.838 822 H LYS 104 H LYS 104 -20.379 4.140 -10.726 823 HA LYS 104 HA LYS 104 -17.793 3.351 -9.534 824 HB2 LYS 104 HB2 LYS 104 -17.743 1.608 -11.209 825 HB3 LYS 104 HB3 LYS 104 -19.254 1.630 -10.338 826 HG2 LYS 104 HG2 LYS 104 -19.895 1.132 -12.496 827 HG3 LYS 104 HG3 LYS 104 -20.291 2.840 -12.351 828 HD2 LYS 104 HD2 LYS 104 -18.180 3.399 -13.527 829 HD3 LYS 104 HD3 LYS 104 -17.791 1.677 -13.700 830 HE2 LYS 104 HE2 LYS 104 -20.362 2.931 -14.785 831 HE3 LYS 104 HE3 LYS 104 -18.839 3.073 -15.664 832 HZ1 LYS 104 HZ1 LYS 104 -18.699 0.654 -15.752 833 HZ2 LYS 104 HZ2 LYS 104 -20.151 0.500 -14.975 834 HZ3 LYS 104 HZ3 LYS 104 -20.069 1.180 -16.454 835 H ILE 105 H ILE 105 -16.009 3.014 -11.254 836 HA ILE 105 HA ILE 105 -15.015 5.600 -12.033 837 HB ILE 105 HB ILE 105 -14.164 2.789 -12.869 838 HG12 ILE 105 HG12 ILE 105 -12.630 4.329 -10.813 839 HG13 ILE 105 HG13 ILE 105 -14.111 3.538 -10.282 840 HG21 ILE 105 HG21 ILE 105 -13.151 4.412 -14.387 841 HG22 ILE 105 HG22 ILE 105 -12.664 5.448 -13.034 842 HG23 ILE 105 HG23 ILE 105 -11.901 3.865 -13.270 843 HD11 ILE 105 HD11 ILE 105 -13.213 1.397 -11.224 844 HD12 ILE 105 HD12 ILE 105 -11.673 2.255 -11.535 845 HD13 ILE 105 HD13 ILE 105 -12.294 2.084 -9.876 846 H ALA 106 H ALA 106 -15.825 6.759 -13.646 847 HA ALA 106 HA ALA 106 -17.500 5.763 -15.770 848 HB1 ALA 106 HB1 ALA 106 -17.730 8.011 -14.854 849 HB2 ALA 106 HB2 ALA 106 -16.089 8.448 -15.373 850 HB3 ALA 106 HB3 ALA 106 -17.356 8.117 -16.577 851 H THR 107 H THR 107 -14.098 6.815 -15.655 852 HA THR 107 HA THR 107 -13.378 5.094 -17.915 853 HB THR 107 HB THR 107 -12.002 7.006 -18.952 854 HG1 THR 107 HG1 THR 107 -14.050 8.586 -17.839 855 HG21 THR 107 HG21 THR 107 -13.962 5.976 -20.083 856 HG22 THR 107 HG22 THR 107 -15.004 7.221 -19.361 857 HG23 THR 107 HG23 THR 107 -13.712 7.684 -20.488 858 H ARG 108 H ARG 108 -11.173 4.672 -18.058 859 HA ARG 108 HA ARG 108 -9.331 5.776 -16.000 860 HB2 ARG 108 HB2 ARG 108 -10.333 3.578 -15.196 861 HB3 ARG 108 HB3 ARG 108 -9.619 2.806 -16.611 862 HG2 ARG 108 HG2 ARG 108 -7.332 3.701 -15.738 863 HG3 ARG 108 HG3 ARG 108 -8.196 4.148 -14.266 864 HD2 ARG 108 HD2 ARG 108 -7.085 2.020 -13.945 865 HD3 ARG 108 HD3 ARG 108 -8.836 1.771 -13.952 866 HE ARG 108 HE ARG 108 -8.687 0.533 -15.878 867 HH11 ARG 108 HH11 ARG 108 -5.509 1.899 -15.453 868 HH12 ARG 108 HH12 ARG 108 -4.915 1.180 -16.935 869 HH21 ARG 108 HH21 ARG 108 -7.862 -0.409 -17.686 870 HH22 ARG 108 HH22 ARG 108 -6.196 -0.153 -18.112 871 H LYS 109 H LYS 109 -7.270 5.918 -16.644 872 HA LYS 109 HA LYS 109 -6.139 4.712 -19.064 873 HB2 LYS 109 HB2 LYS 109 -6.644 7.717 -18.777 874 HB3 LYS 109 HB3 LYS 109 -5.266 7.104 -19.667 875 HG2 LYS 109 HG2 LYS 109 -7.008 5.676 -21.013 876 HG3 LYS 109 HG3 LYS 109 -8.209 6.765 -20.306 877 HD2 LYS 109 HD2 LYS 109 -7.615 7.675 -22.460 878 HD3 LYS 109 HD3 LYS 109 -6.904 8.713 -21.223 879 HE2 LYS 109 HE2 LYS 109 -5.180 8.471 -22.801 880 HE3 LYS 109 HE3 LYS 109 -4.738 7.359 -21.503 881 HZ1 LYS 109 HZ1 LYS 109 -5.680 5.538 -22.871 882 HZ2 LYS 109 HZ2 LYS 109 -6.046 6.594 -24.066 883 HZ3 LYS 109 HZ3 LYS 109 -4.489 6.312 -23.675 884 H TYR 110 H TYR 110 -3.897 4.671 -18.998 885 HA TYR 110 HA TYR 110 -2.554 5.267 -16.469 886 HB2 TYR 110 HB2 TYR 110 -1.901 3.347 -17.913 887 HB3 TYR 110 HB3 TYR 110 -1.454 4.461 -19.192 888 HD1 TYR 110 HD1 TYR 110 -0.769 4.601 -15.467 889 HD2 TYR 110 HD2 TYR 110 0.893 4.256 -19.438 890 HE1 TYR 110 HE1 TYR 110 1.489 4.808 -14.539 891 HE2 TYR 110 HE2 TYR 110 3.183 4.353 -18.475 892 HH TYR 110 HH TYR 110 4.431 4.520 -16.568 893 H LEU 111 H LEU 111 -1.697 7.186 -15.890 894 HA LEU 111 HA LEU 111 -1.597 9.407 -17.881 895 HB2 LEU 111 HB2 LEU 111 -1.211 9.279 -14.856 896 HB3 LEU 111 HB3 LEU 111 -1.110 10.750 -15.824 897 HG LEU 111 HG LEU 111 -3.600 9.041 -15.766 898 HD11 LEU 111 HD11 LEU 111 -3.150 9.719 -13.502 899 HD12 LEU 111 HD12 LEU 111 -2.798 11.378 -14.021 900 HD13 LEU 111 HD13 LEU 111 -4.457 10.723 -14.144 901 HD21 LEU 111 HD21 LEU 111 -3.039 11.930 -16.574 902 HD22 LEU 111 HD22 LEU 111 -3.502 10.599 -17.659 903 HD23 LEU 111 HD23 LEU 111 -4.657 11.219 -16.475 904 H GLY 112 H GLY 112 0.506 7.663 -15.598 905 HA2 GLY 112 HA2 GLY 112 2.861 7.456 -16.848 906 HA3 GLY 112 HA3 GLY 112 2.894 9.183 -16.458 907 H LYS 113 H LYS 113 4.464 9.215 -14.968 908 HA LYS 113 HA LYS 113 4.356 7.314 -12.654 909 HB2 LYS 113 HB2 LYS 113 6.063 6.942 -14.629 910 HB3 LYS 113 HB3 LYS 113 6.989 8.186 -13.775 911 HG2 LYS 113 HG2 LYS 113 6.652 6.767 -11.650 912 HG3 LYS 113 HG3 LYS 113 5.881 5.559 -12.675 913 HD2 LYS 113 HD2 LYS 113 8.103 4.792 -12.420 914 HD3 LYS 113 HD3 LYS 113 8.039 5.482 -14.052 915 HE2 LYS 113 HE2 LYS 113 8.999 7.630 -13.092 916 HE3 LYS 113 HE3 LYS 113 9.136 6.812 -11.531 917 HZ1 LYS 113 HZ1 LYS 113 10.646 5.208 -12.578 918 HZ2 LYS 113 HZ2 LYS 113 10.548 5.997 -14.010 919 HZ3 LYS 113 HZ3 LYS 113 11.220 6.732 -12.714 920 H GLN 114 H GLN 114 3.154 9.354 -12.135 921 HA GLN 114 HA GLN 114 4.465 11.807 -11.527 922 HB2 GLN 114 HB2 GLN 114 1.714 11.071 -10.526 923 HB3 GLN 114 HB3 GLN 114 2.376 12.654 -10.963 924 HG2 GLN 114 HG2 GLN 114 2.790 11.626 -13.312 925 HG3 GLN 114 HG3 GLN 114 1.703 10.323 -12.814 926 HE21 GLN 114 HE22 GLN 114 1.261 11.578 -15.017 927 HE22 GLN 114 HE21 GLN 114 -0.066 12.674 -14.850 928 H ASN 115 H ASN 115 4.607 12.869 -9.442 929 HA ASN 115 HA ASN 115 5.466 11.362 -7.250 930 HB2 ASN 115 HB2 ASN 115 5.644 13.984 -8.035 931 HB3 ASN 115 HB3 ASN 115 4.395 14.133 -6.793 932 HD21 ASN 115 HD22 ASN 115 5.208 12.228 -4.876 933 HD22 ASN 115 HD21 ASN 115 6.897 12.474 -4.517 934 H VAL 116 H VAL 116 4.330 10.083 -5.947 935 HA VAL 116 HA VAL 116 1.606 10.976 -5.106 936 HB VAL 116 HB VAL 116 0.963 8.596 -4.943 937 HG11 VAL 116 HG11 VAL 116 0.311 10.008 -6.878 938 HG12 VAL 116 HG12 VAL 116 1.729 9.415 -7.754 939 HG13 VAL 116 HG13 VAL 116 0.436 8.294 -7.260 940 HG21 VAL 116 HG21 VAL 116 3.438 8.045 -6.646 941 HG22 VAL 116 HG22 VAL 116 3.194 7.521 -4.963 942 HG23 VAL 116 HG23 VAL 116 2.142 6.904 -6.242 943 H TYR 117 H TYR 117 0.862 10.292 -3.103 944 HA TYR 117 HA TYR 117 2.939 9.917 -0.991 945 HB2 TYR 117 HB2 TYR 117 0.808 12.081 -1.013 946 HB3 TYR 117 HB3 TYR 117 2.150 11.906 0.090 947 HD1 TYR 117 HD1 TYR 117 1.097 12.998 -3.254 948 HD2 TYR 117 HD2 TYR 117 4.423 12.656 -0.539 949 HE1 TYR 117 HE1 TYR 117 2.377 14.655 -4.611 950 HE2 TYR 117 HE2 TYR 117 5.678 14.363 -1.851 951 HH TYR 117 HH TYR 117 4.273 15.947 -4.732 952 H ASP 118 H ASP 118 2.035 9.462 1.127 953 HA ASP 118 HA ASP 118 -0.815 8.813 1.410 954 HB2 ASP 118 HB2 ASP 118 0.036 6.785 0.327 955 HB3 ASP 118 HB3 ASP 118 1.363 6.685 1.488 956 H ILE 119 H ILE 119 -1.402 9.282 3.490 957 HA ILE 119 HA ILE 119 0.714 9.887 5.464 958 HB ILE 119 HB ILE 119 -1.120 10.602 6.916 959 HG12 ILE 119 HG12 ILE 119 -2.982 10.215 4.531 960 HG13 ILE 119 HG13 ILE 119 -2.939 9.157 5.944 961 HG21 ILE 119 HG21 ILE 119 0.153 12.111 5.443 962 HG22 ILE 119 HG22 ILE 119 -1.035 11.885 4.148 963 HG23 ILE 119 HG23 ILE 119 -1.496 12.696 5.667 964 HD11 ILE 119 HD11 ILE 119 -3.498 11.091 7.407 965 HD12 ILE 119 HD12 ILE 119 -3.695 12.097 5.948 966 HD13 ILE 119 HD13 ILE 119 -4.751 10.698 6.211 967 H GLY 120 H GLY 120 1.050 8.871 7.372 968 HA2 GLY 120 HA2 GLY 120 0.326 6.005 7.522 969 HA3 GLY 120 HA3 GLY 120 1.478 6.865 8.545 970 H VAL 121 H VAL 121 -1.081 5.177 8.945 971 HA VAL 121 HA VAL 121 -2.107 6.607 11.301 972 HB VAL 121 HB VAL 121 -4.501 6.020 10.534 973 HG11 VAL 121 HG11 VAL 121 -3.682 8.301 11.007 974 HG12 VAL 121 HG12 VAL 121 -3.204 8.465 9.300 975 HG13 VAL 121 HG13 VAL 121 -4.906 8.242 9.730 976 HG21 VAL 121 HG21 VAL 121 -3.320 6.547 7.761 977 HG22 VAL 121 HG22 VAL 121 -3.884 4.962 8.319 978 HG23 VAL 121 HG23 VAL 121 -5.025 6.301 8.175 979 H GLU 122 H GLU 122 -1.239 4.993 12.556 980 HA GLU 122 HA GLU 122 -1.546 2.178 12.090 981 HB2 GLU 122 HB2 GLU 122 -1.016 3.759 14.640 982 HB3 GLU 122 HB3 GLU 122 -0.966 1.996 14.537 983 HG2 GLU 122 HG2 GLU 122 0.809 2.130 12.811 984 HG3 GLU 122 HG3 GLU 122 0.809 3.893 12.949 985 H ARG 123 H ARG 123 -3.723 4.494 13.560 986 HA ARG 123 HA ARG 123 -5.338 2.788 15.144 987 HB2 ARG 123 HB2 ARG 123 -5.321 5.242 15.277 988 HB3 ARG 123 HB3 ARG 123 -5.984 5.359 13.656 989 HG2 ARG 123 HG2 ARG 123 -7.702 5.839 15.237 990 HG3 ARG 123 HG3 ARG 123 -8.120 4.316 14.465 991 HD2 ARG 123 HD2 ARG 123 -6.705 4.485 17.161 992 HD3 ARG 123 HD3 ARG 123 -8.467 4.541 16.998 993 HE ARG 123 HE ARG 123 -7.598 2.240 15.599 994 HH11 ARG 123 HH11 ARG 123 -7.734 3.333 18.935 995 HH12 ARG 123 HH12 ARG 123 -7.867 1.704 19.556 996 HH21 ARG 123 HH21 ARG 123 -7.753 0.203 16.457 997 HH22 ARG 123 HH22 ARG 123 -7.878 -0.015 18.184 998 H ASP 124 H ASP 124 -5.746 3.695 11.729 999 HA ASP 124 HA ASP 124 -6.692 1.119 10.993 1000 HB2 ASP 124 HB2 ASP 124 -8.817 2.364 11.994 1001 HB3 ASP 124 HB3 ASP 124 -8.807 3.229 10.469 1002 H HIS 125 H HIS 125 -6.289 0.829 8.807 1003 HA HIS 125 HA HIS 125 -4.558 2.690 7.542 1004 HB2 HIS 125 HB2 HIS 125 -4.525 0.922 5.709 1005 HB3 HIS 125 HB3 HIS 125 -4.008 0.473 7.296 1006 HD1 HIS 125 HD1 HIS 125 -7.791 0.282 7.040 1007 HD2 HIS 125 HD2 HIS 125 -4.364 -2.065 6.362 1008 HE1 HIS 125 HE1 HIS 125 -8.601 -2.115 6.851 1009 H ASN 126 H ASN 126 -7.527 3.582 7.619 1010 HA ASN 126 HA ASN 126 -7.777 4.335 4.753 1011 HB2 ASN 126 HB2 ASN 126 -10.108 3.753 4.783 1012 HB3 ASN 126 HB3 ASN 126 -9.202 2.350 5.302 1013 HD21 ASN 126 HD22 ASN 126 -12.087 3.527 5.899 1014 HD22 ASN 126 HD21 ASN 126 -12.157 3.279 7.645 1015 H PHE 127 H PHE 127 -9.352 6.054 4.314 1016 HA PHE 127 HA PHE 127 -10.109 7.949 6.380 1017 HB2 PHE 127 HB2 PHE 127 -8.686 9.828 5.459 1018 HB3 PHE 127 HB3 PHE 127 -7.851 8.631 6.413 1019 HD1 PHE 127 HD1 PHE 127 -8.622 9.402 2.776 1020 HD2 PHE 127 HD2 PHE 127 -5.827 7.772 5.635 1021 HE1 PHE 127 HE1 PHE 127 -6.962 9.069 0.968 1022 HE2 PHE 127 HE2 PHE 127 -4.158 7.477 3.822 1023 HZ PHE 127 HZ PHE 127 -4.721 8.123 1.495 1024 H ALA 128 H ALA 128 -11.090 9.953 5.441 1025 HA ALA 128 HA ALA 128 -12.669 9.261 3.046 1026 HB1 ALA 128 HB1 ALA 128 -13.788 9.911 5.152 1027 HB2 ALA 128 HB2 ALA 128 -12.982 11.497 5.081 1028 HB3 ALA 128 HB3 ALA 128 -14.152 11.035 3.830 1029 H LEU 129 H LEU 129 -12.766 10.399 1.220 1030 HA LEU 129 HA LEU 129 -10.732 12.453 0.560 1031 HB2 LEU 129 HB2 LEU 129 -12.768 10.978 -1.163 1032 HB3 LEU 129 HB3 LEU 129 -11.468 12.017 -1.747 1033 HG LEU 129 HG LEU 129 -11.105 9.334 -0.336 1034 HD11 LEU 129 HD11 LEU 129 -11.923 9.215 -2.687 1035 HD12 LEU 129 HD12 LEU 129 -10.546 10.211 -3.202 1036 HD13 LEU 129 HD13 LEU 129 -10.276 8.597 -2.515 1037 HD21 LEU 129 HD21 LEU 129 -9.056 11.285 -1.426 1038 HD22 LEU 129 HD22 LEU 129 -9.240 10.710 0.254 1039 HD23 LEU 129 HD23 LEU 129 -8.716 9.589 -1.006 1040 H LYS 130 H LYS 130 -11.466 14.235 -0.924 1041 HA LYS 130 HA LYS 130 -13.172 16.072 0.249 1042 HB2 LYS 130 HB2 LYS 130 -11.610 16.806 -1.324 1043 HB3 LYS 130 HB3 LYS 130 -12.148 15.682 -2.575 1044 HG2 LYS 130 HG2 LYS 130 -14.171 17.011 -2.973 1045 HG3 LYS 130 HG3 LYS 130 -13.737 18.116 -1.657 1046 HD2 LYS 130 HD2 LYS 130 -11.695 18.781 -2.880 1047 HD3 LYS 130 HD3 LYS 130 -12.027 17.568 -4.120 1048 HE2 LYS 130 HE2 LYS 130 -12.681 19.573 -5.105 1049 HE3 LYS 130 HE3 LYS 130 -14.193 18.791 -4.640 1050 HZ1 LYS 130 HZ1 LYS 130 -14.324 20.294 -2.742 1051 HZ2 LYS 130 HZ2 LYS 130 -12.843 20.941 -3.080 1052 HZ3 LYS 130 HZ3 LYS 130 -14.099 21.184 -4.088 1053 H ASN 131 H ASN 131 -14.146 13.996 -2.468 1054 HA ASN 131 HA ASN 131 -16.862 14.997 -2.585 1055 HB2 ASN 131 HB2 ASN 131 -15.562 12.428 -3.606 1056 HB3 ASN 131 HB3 ASN 131 -17.227 12.895 -3.952 1057 HD21 ASN 131 HD22 ASN 131 -13.846 13.541 -4.749 1058 HD22 ASN 131 HD21 ASN 131 -14.209 14.736 -5.979 1059 H GLY 132 H GLY 132 -15.295 12.642 -0.571 1060 HA2 GLY 132 HA2 GLY 132 -16.328 12.165 1.548 1061 HA3 GLY 132 HA3 GLY 132 -17.876 11.893 0.738 1062 H PHE 133 H PHE 133 -15.585 10.454 -1.247 1063 HA PHE 133 HA PHE 133 -16.343 7.788 -0.441 1064 HB2 PHE 133 HB2 PHE 133 -14.136 8.630 -2.343 1065 HB3 PHE 133 HB3 PHE 133 -14.894 7.045 -2.245 1066 HD1 PHE 133 HD1 PHE 133 -17.560 7.056 -2.507 1067 HD2 PHE 133 HD2 PHE 133 -14.898 10.103 -3.997 1068 HE1 PHE 133 HE1 PHE 133 -19.340 7.846 -4.055 1069 HE2 PHE 133 HE2 PHE 133 -16.685 10.892 -5.547 1070 HZ PHE 133 HZ PHE 133 -18.910 9.783 -5.553 1071 H ILE 134 H ILE 134 -14.728 6.027 0.037 1072 HA ILE 134 HA ILE 134 -12.558 7.043 1.832 1073 HB ILE 134 HB ILE 134 -14.274 4.583 2.191 1074 HG12 ILE 134 HG12 ILE 134 -14.635 5.882 4.472 1075 HG13 ILE 134 HG13 ILE 134 -14.250 7.303 3.520 1076 HG21 ILE 134 HG21 ILE 134 -11.984 4.112 2.958 1077 HG22 ILE 134 HG22 ILE 134 -11.990 5.614 3.918 1078 HG23 ILE 134 HG23 ILE 134 -13.083 4.280 4.320 1079 HD11 ILE 134 HD11 ILE 134 -16.201 6.888 2.098 1080 HD12 ILE 134 HD12 ILE 134 -16.444 5.281 2.831 1081 HD13 ILE 134 HD13 ILE 134 -16.706 6.747 3.785 1082 H ALA 135 H ALA 135 -10.604 6.280 1.715 1083 HA ALA 135 HA ALA 135 -9.885 4.276 -0.385 1084 HB1 ALA 135 HB1 ALA 135 -9.466 6.698 -0.976 1085 HB2 ALA 135 HB2 ALA 135 -8.355 6.789 0.410 1086 HB3 ALA 135 HB3 ALA 135 -8.017 5.701 -0.962 1087 H SER 136 H SER 136 -7.970 2.953 0.138 1088 HA SER 136 HA SER 136 -7.261 2.843 3.036 1089 HB2 SER 136 HB2 SER 136 -9.276 1.513 2.739 1090 HB3 SER 136 HB3 SER 136 -8.516 0.596 1.421 1091 HG SER 136 HG SER 136 -7.204 -0.394 2.877 1092 H ASN 137 H ASN 137 -5.271 2.096 3.504 1093 HA ASN 137 HA ASN 137 -3.374 1.815 1.272 1094 HB2 ASN 137 HB2 ASN 137 -2.845 3.312 3.120 1095 HB3 ASN 137 HB3 ASN 137 -3.036 2.003 4.282 1096 HD21 ASN 137 HD22 ASN 137 -0.951 2.057 5.123 1097 HD22 ASN 137 HD21 ASN 137 0.465 1.672 4.156 Start of MODEL 19 1 H1 GLY -1 H GLY -1 4.391 -1.169 -1.669 2 HA2 GLY -1 HA2 GLY -1 2.073 -1.155 -2.238 3 HA3 GLY -1 HA3 GLY -1 2.485 0.244 -1.229 4 H GLY 0 H GLY 0 0.872 1.623 -1.978 5 HA2 GLY 0 HA2 GLY 0 1.046 2.743 -4.685 6 HA3 GLY 0 HA3 GLY 0 -0.488 2.068 -4.145 7 H ALA 1 H ALA 1 -0.446 4.704 -4.805 8 HA ALA 1 HA ALA 1 -0.861 6.191 -2.300 9 HB1 ALA 1 HB1 ALA 1 1.518 6.207 -2.325 10 HB2 ALA 1 HB2 ALA 1 1.558 6.621 -4.051 11 HB3 ALA 1 HB3 ALA 1 0.967 7.785 -2.849 12 H LEU 2 H LEU 2 -1.095 8.621 -2.885 13 HA LEU 2 HA LEU 2 -2.968 8.882 -5.212 14 HB2 LEU 2 HB2 LEU 2 -2.915 10.226 -2.483 15 HB3 LEU 2 HB3 LEU 2 -4.110 10.514 -3.733 16 HG LEU 2 HG LEU 2 -3.682 7.797 -2.426 17 HD11 LEU 2 HD11 LEU 2 -4.372 9.373 -0.723 18 HD12 LEU 2 HD12 LEU 2 -5.749 9.896 -1.717 19 HD13 LEU 2 HD13 LEU 2 -5.661 8.228 -1.105 20 HD21 LEU 2 HD21 LEU 2 -5.981 8.910 -4.096 21 HD22 LEU 2 HD22 LEU 2 -4.806 7.670 -4.591 22 HD23 LEU 2 HD23 LEU 2 -5.954 7.324 -3.297 23 H SER 3 H SER 3 -2.975 10.876 -6.360 24 HA SER 3 HA SER 3 -0.374 12.118 -6.690 25 HB2 SER 3 HB2 SER 3 -2.142 11.880 -8.459 26 HB3 SER 3 HB3 SER 3 -3.041 13.190 -7.657 27 HG SER 3 HG SER 3 -1.425 13.693 -9.445 28 H TYR 4 H TYR 4 0.088 14.461 -6.536 29 HA TYR 4 HA TYR 4 -0.311 15.627 -3.955 30 HB2 TYR 4 HB2 TYR 4 1.460 16.318 -5.502 31 HB3 TYR 4 HB3 TYR 4 0.282 16.931 -6.648 32 HD1 TYR 4 HD2 TYR 4 -1.000 18.999 -6.195 33 HD2 TYR 4 HD1 TYR 4 2.025 17.583 -3.467 34 HE1 TYR 4 HE2 TYR 4 -1.059 21.182 -5.000 35 HE2 TYR 4 HE1 TYR 4 1.959 19.767 -2.262 36 HH TYR 4 HH TYR 4 -0.221 22.419 -3.277 37 H GLU 5 H GLU 5 -2.010 16.086 -7.016 38 HA GLU 5 HA GLU 5 -3.829 18.142 -6.389 39 HB2 GLU 5 HB2 GLU 5 -4.193 15.687 -8.161 40 HB3 GLU 5 HB3 GLU 5 -5.217 17.120 -8.222 41 HG2 GLU 5 HG2 GLU 5 -2.222 17.098 -8.787 42 HG3 GLU 5 HG3 GLU 5 -3.495 16.988 -9.985 43 H THR 6 H THR 6 -3.935 14.820 -5.419 44 HA THR 6 HA THR 6 -6.749 14.558 -4.876 45 HB THR 6 HB THR 6 -4.419 13.042 -3.628 46 HG1 THR 6 HG1 THR 6 -6.000 12.001 -5.653 47 HG21 THR 6 HG21 THR 6 -6.355 12.546 -2.356 48 HG22 THR 6 HG22 THR 6 -7.397 12.532 -3.803 49 HG23 THR 6 HG23 THR 6 -6.231 11.228 -3.520 50 H GLU 7 H GLU 7 -7.746 16.033 -3.612 51 HA GLU 7 HA GLU 7 -6.491 16.969 -1.144 52 HB2 GLU 7 HB2 GLU 7 -9.323 17.557 -1.975 53 HB3 GLU 7 HB3 GLU 7 -8.286 18.467 -0.890 54 HG2 GLU 7 HG2 GLU 7 -6.767 18.943 -2.875 55 HG3 GLU 7 HG3 GLU 7 -8.006 18.227 -3.911 56 H ILE 8 H ILE 8 -6.935 16.415 0.890 57 HA ILE 8 HA ILE 8 -8.972 14.291 1.468 58 HB ILE 8 HB ILE 8 -6.581 15.076 3.176 59 HG12 ILE 8 HG12 ILE 8 -5.521 14.266 1.241 60 HG13 ILE 8 HG13 ILE 8 -5.452 12.992 2.446 61 HG21 ILE 8 HG21 ILE 8 -8.355 13.960 4.410 62 HG22 ILE 8 HG22 ILE 8 -8.422 12.647 3.222 63 HG23 ILE 8 HG23 ILE 8 -6.985 12.866 4.240 64 HD11 ILE 8 HD11 ILE 8 -7.401 11.871 1.252 65 HD12 ILE 8 HD12 ILE 8 -7.239 13.107 -0.010 66 HD13 ILE 8 HD13 ILE 8 -5.909 11.993 0.293 67 H LEU 9 H LEU 9 -10.660 14.917 2.748 68 HA LEU 9 HA LEU 9 -10.797 17.597 3.869 69 HB2 LEU 9 HB2 LEU 9 -12.719 16.013 3.110 70 HB3 LEU 9 HB3 LEU 9 -12.604 15.292 4.694 71 HG LEU 9 HG LEU 9 -12.824 18.316 4.471 72 HD11 LEU 9 HD11 LEU 9 -14.587 17.428 2.966 73 HD12 LEU 9 HD12 LEU 9 -15.200 16.424 4.298 74 HD13 LEU 9 HD13 LEU 9 -15.252 18.201 4.407 75 HD21 LEU 9 HD21 LEU 9 -13.930 16.306 6.433 76 HD22 LEU 9 HD22 LEU 9 -12.539 17.395 6.701 77 HD23 LEU 9 HD23 LEU 9 -14.165 18.063 6.522 78 H THR 10 H THR 10 -9.839 18.331 5.654 79 HA THR 10 HA THR 10 -9.261 16.467 7.908 80 HB THR 10 HB THR 10 -7.325 17.673 8.464 81 HG1 THR 10 HG1 THR 10 -6.806 19.376 6.717 82 HG21 THR 10 HG21 THR 10 -7.066 16.075 6.545 83 HG22 THR 10 HG22 THR 10 -7.220 17.450 5.430 84 HG23 THR 10 HG23 THR 10 -5.863 17.375 6.574 85 H VAL 11 H VAL 11 -9.509 17.146 10.024 86 HA VAL 11 HA VAL 11 -11.523 19.205 10.524 87 HB VAL 11 HB VAL 11 -9.806 17.734 12.552 88 HG11 VAL 11 HG11 VAL 11 -10.898 19.652 13.572 89 HG12 VAL 11 HG12 VAL 11 -12.459 19.190 12.852 90 HG13 VAL 11 HG13 VAL 11 -11.703 18.179 14.100 91 HG21 VAL 11 HG21 VAL 11 -12.532 17.013 11.403 92 HG22 VAL 11 HG22 VAL 11 -11.040 16.062 11.238 93 HG23 VAL 11 HG23 VAL 11 -11.790 16.244 12.824 94 H GLU 12 H GLU 12 -8.012 18.996 10.912 95 HA GLU 12 HA GLU 12 -7.667 21.413 12.397 96 HB2 GLU 12 HB2 GLU 12 -5.944 19.566 10.781 97 HB3 GLU 12 HB3 GLU 12 -5.264 21.145 11.189 98 HG2 GLU 12 HG2 GLU 12 -6.394 19.192 13.231 99 HG3 GLU 12 HG3 GLU 12 -4.687 19.349 12.831 100 H TYR 13 H TYR 13 -8.037 20.962 8.908 101 HA TYR 13 HA TYR 13 -7.930 23.934 8.580 102 HB2 TYR 13 HB2 TYR 13 -6.395 21.887 6.945 103 HB3 TYR 13 HB3 TYR 13 -6.654 23.548 6.443 104 HD1 TYR 13 HD2 TYR 13 -5.986 25.402 8.247 105 HD2 TYR 13 HD1 TYR 13 -4.327 21.417 8.016 106 HE1 TYR 13 HE2 TYR 13 -3.932 26.182 9.426 107 HE2 TYR 13 HE1 TYR 13 -2.279 22.203 9.186 108 HH TYR 13 HH TYR 13 -1.201 23.983 10.132 109 H GLY 14 H GLY 14 -8.714 20.872 6.795 110 HA2 GLY 14 HA2 GLY 14 -11.190 20.984 5.947 111 HA3 GLY 14 HA3 GLY 14 -10.623 22.424 5.100 112 H LEU 15 H LEU 15 -11.180 21.378 3.126 113 HA LEU 15 HA LEU 15 -9.877 19.048 2.035 114 HB2 LEU 15 HB2 LEU 15 -10.941 21.571 0.680 115 HB3 LEU 15 HB3 LEU 15 -10.520 20.073 -0.139 116 HG LEU 15 HG LEU 15 -12.792 20.439 1.868 117 HD11 LEU 15 HD11 LEU 15 -13.174 21.500 -0.334 118 HD12 LEU 15 HD12 LEU 15 -12.824 19.952 -1.138 119 HD13 LEU 15 HD13 LEU 15 -14.241 20.110 -0.072 120 HD21 LEU 15 HD21 LEU 15 -11.839 18.024 0.292 121 HD22 LEU 15 HD22 LEU 15 -11.999 18.175 2.049 122 HD23 LEU 15 HD23 LEU 15 -13.452 18.140 1.040 123 H LEU 16 H LEU 16 -7.646 18.931 2.214 124 HA LEU 16 HA LEU 16 -6.077 20.977 0.714 125 HB2 LEU 16 HB2 LEU 16 -5.447 19.695 3.406 126 HB3 LEU 16 HB3 LEU 16 -4.215 20.457 2.418 127 HG LEU 16 HG LEU 16 -6.615 21.864 3.661 128 HD11 LEU 16 HD11 LEU 16 -4.801 21.234 5.209 129 HD12 LEU 16 HD12 LEU 16 -3.605 22.013 4.153 130 HD13 LEU 16 HD13 LEU 16 -4.839 22.992 4.967 131 HD21 LEU 16 HD21 LEU 16 -4.354 22.975 1.929 132 HD22 LEU 16 HD22 LEU 16 -6.089 22.977 1.537 133 HD23 LEU 16 HD23 LEU 16 -5.497 23.955 2.875 134 HA PRO 17 HA PRO 17 -4.367 17.639 -1.581 135 HB2 PRO 17 HB2 PRO 17 -1.833 18.573 -2.163 136 HB3 PRO 17 HB3 PRO 17 -3.340 19.175 -2.926 137 HG2 PRO 17 HG2 PRO 17 -1.810 20.363 -0.610 138 HG3 PRO 17 HG3 PRO 17 -2.453 21.195 -2.064 139 HD2 PRO 17 HD2 PRO 17 -3.788 21.224 0.283 140 HD3 PRO 17 HD3 PRO 17 -4.674 21.059 -1.262 141 H ILE 18 H ILE 18 -3.674 15.681 -0.944 142 HA ILE 18 HA ILE 18 -2.417 15.129 1.523 143 HB ILE 18 HB ILE 18 -3.716 13.507 0.239 144 HG12 ILE 18 HG12 ILE 18 -0.914 12.422 0.745 145 HG13 ILE 18 HG13 ILE 18 -2.026 12.890 2.044 146 HG21 ILE 18 HG21 ILE 18 -2.740 14.020 -2.038 147 HG22 ILE 18 HG22 ILE 18 -1.316 13.069 -1.577 148 HG23 ILE 18 HG23 ILE 18 -2.917 12.316 -1.656 149 HD11 ILE 18 HD11 ILE 18 -3.711 11.254 1.114 150 HD12 ILE 18 HD12 ILE 18 -2.447 10.687 -0.005 151 HD13 ILE 18 HD13 ILE 18 -2.221 10.531 1.749 152 H GLY 19 H GLY 19 -0.900 15.734 -1.633 153 HA2 GLY 19 HA2 GLY 19 1.679 14.755 -0.943 154 HA3 GLY 19 HA3 GLY 19 1.335 15.934 -2.219 155 H LYS 20 H LYS 20 0.191 17.913 -0.296 156 HA LYS 20 HA LYS 20 2.658 19.179 0.580 157 HB2 LYS 20 HB2 LYS 20 0.682 20.426 -0.263 158 HB3 LYS 20 HB3 LYS 20 -0.249 19.906 1.149 159 HG2 LYS 20 HG2 LYS 20 1.230 21.141 2.643 160 HG3 LYS 20 HG3 LYS 20 2.332 21.520 1.304 161 HD2 LYS 20 HD2 LYS 20 0.604 22.887 0.217 162 HD3 LYS 20 HD3 LYS 20 -0.589 22.388 1.421 163 HE2 LYS 20 HE2 LYS 20 0.132 24.615 1.954 164 HE3 LYS 20 HE3 LYS 20 0.708 23.515 3.208 165 HZ1 LYS 20 HZ1 LYS 20 2.915 23.602 2.201 166 HZ2 LYS 20 HZ2 LYS 20 2.379 24.525 0.957 167 HZ3 LYS 20 HZ3 LYS 20 2.407 25.128 2.473 168 H ILE 21 H ILE 21 0.156 17.218 2.113 169 HA ILE 21 HA ILE 21 0.986 17.775 4.836 170 HB ILE 21 HB ILE 21 -0.719 15.581 3.644 171 HG12 ILE 21 HG12 ILE 21 -1.655 17.831 5.468 172 HG13 ILE 21 HG13 ILE 21 -1.525 18.097 3.734 173 HG21 ILE 21 HG21 ILE 21 0.215 14.664 5.680 174 HG22 ILE 21 HG22 ILE 21 -0.261 16.123 6.583 175 HG23 ILE 21 HG23 ILE 21 -1.480 15.020 5.931 176 HD11 ILE 21 HD11 ILE 21 -3.114 16.313 3.262 177 HD12 ILE 21 HD12 ILE 21 -3.250 15.925 4.987 178 HD13 ILE 21 HD13 ILE 21 -3.817 17.493 4.381 179 H VAL 22 H VAL 22 1.686 15.176 2.471 180 HA VAL 22 HA VAL 22 3.430 13.768 4.344 181 HB VAL 22 HB VAL 22 3.021 13.480 1.358 182 HG11 VAL 22 HG11 VAL 22 5.200 12.470 2.069 183 HG12 VAL 22 HG12 VAL 22 4.347 11.524 3.300 184 HG13 VAL 22 HG13 VAL 22 4.020 11.255 1.590 185 HG21 VAL 22 HG21 VAL 22 1.947 11.891 3.744 186 HG22 VAL 22 HG22 VAL 22 0.987 13.007 2.746 187 HG23 VAL 22 HG23 VAL 22 1.635 11.519 2.051 188 H GLU 23 H GLU 23 4.083 16.064 1.620 189 HA GLU 23 HA GLU 23 6.926 15.641 1.819 190 HB2 GLU 23 HB2 GLU 23 7.169 17.186 0.156 191 HB3 GLU 23 HB3 GLU 23 5.584 16.478 -0.188 192 HG2 GLU 23 HG2 GLU 23 4.597 18.492 1.048 193 HG3 GLU 23 HG3 GLU 23 6.218 19.171 1.051 194 H LYS 24 H LYS 24 4.736 17.732 3.540 195 HA LYS 24 HA LYS 24 7.041 19.022 4.969 196 HB2 LYS 24 HB2 LYS 24 4.147 19.933 4.837 197 HB3 LYS 24 HB3 LYS 24 5.452 20.800 5.617 198 HG2 LYS 24 HG2 LYS 24 5.066 20.271 2.666 199 HG3 LYS 24 HG3 LYS 24 4.835 21.802 3.484 200 HD2 LYS 24 HD2 LYS 24 7.531 20.408 3.091 201 HD3 LYS 24 HD3 LYS 24 6.886 21.738 2.150 202 HE2 LYS 24 HE2 LYS 24 8.232 22.920 3.540 203 HE3 LYS 24 HE3 LYS 24 6.714 23.021 4.431 204 HZ1 LYS 24 HZ1 LYS 24 7.543 21.232 5.886 205 HZ2 LYS 24 HZ2 LYS 24 8.916 21.089 4.993 206 HZ3 LYS 24 HZ3 LYS 24 8.626 22.444 5.844 207 H ARG 25 H ARG 25 5.152 16.430 5.332 208 HA ARG 25 HA ARG 25 4.429 15.114 7.096 209 HB2 ARG 25 HB2 ARG 25 6.870 16.467 8.312 210 HB3 ARG 25 HB3 ARG 25 6.058 15.107 9.071 211 HG2 ARG 25 HG2 ARG 25 6.880 14.758 6.187 212 HG3 ARG 25 HG3 ARG 25 8.153 14.791 7.408 213 HD2 ARG 25 HD2 ARG 25 7.094 13.033 8.688 214 HD3 ARG 25 HD3 ARG 25 5.724 13.010 7.568 215 HE ARG 25 HE ARG 25 7.720 12.486 5.845 216 HH11 ARG 25 HH11 ARG 25 7.269 11.032 9.019 217 HH12 ARG 25 HH12 ARG 25 7.919 9.500 8.496 218 HH21 ARG 25 HH21 ARG 25 8.497 10.485 5.257 219 HH22 ARG 25 HH22 ARG 25 8.592 9.212 6.437 220 H ILE 26 H ILE 26 2.685 17.074 6.877 221 HA ILE 26 HA ILE 26 2.488 18.801 9.240 222 HB ILE 26 HB ILE 26 0.526 18.312 6.966 223 HG12 ILE 26 HG12 ILE 26 2.456 20.629 7.471 224 HG13 ILE 26 HG13 ILE 26 2.738 19.312 6.339 225 HG21 ILE 26 HG21 ILE 26 -0.649 19.165 8.989 226 HG22 ILE 26 HG22 ILE 26 0.509 20.512 9.086 227 HG23 ILE 26 HG23 ILE 26 -0.615 20.369 7.716 228 HD11 ILE 26 HD11 ILE 26 0.703 19.994 5.049 229 HD12 ILE 26 HD12 ILE 26 0.583 21.430 6.097 230 HD13 ILE 26 HD13 ILE 26 2.009 21.189 5.077 231 H GLU 27 H GLU 27 1.510 18.341 11.129 232 HA GLU 27 HA GLU 27 -0.008 15.834 11.469 233 HB2 GLU 27 HB2 GLU 27 0.490 18.037 13.493 234 HB3 GLU 27 HB3 GLU 27 -0.210 16.426 13.764 235 HG2 GLU 27 HG2 GLU 27 1.944 15.412 12.978 236 HG3 GLU 27 HG3 GLU 27 2.647 17.029 12.881 237 H CYS 28 H CYS 28 -1.963 15.734 10.727 238 HA CYS 28 HA CYS 28 -3.945 17.848 11.392 239 HB2 CYS 28 HB2 CYS 28 -4.930 17.726 9.145 240 HB3 CYS 28 HB3 CYS 28 -3.238 18.221 9.069 241 HG CYS 28 HG CYS 28 -4.601 15.248 8.469 242 H THR 29 H THR 29 -6.209 16.766 10.491 243 HA THR 29 HA THR 29 -6.476 14.089 11.808 244 HB THR 29 HB THR 29 -8.770 15.986 11.746 245 HG1 THR 29 HG1 THR 29 -6.768 16.305 13.702 246 HG21 THR 29 HG21 THR 29 -9.050 13.818 12.852 247 HG22 THR 29 HG22 THR 29 -7.718 14.208 13.980 248 HG23 THR 29 HG23 THR 29 -9.227 15.146 14.004 249 H VAL 30 H VAL 30 -8.249 12.759 10.928 250 HA VAL 30 HA VAL 30 -9.396 13.626 8.311 251 HB VAL 30 HB VAL 30 -8.860 11.521 7.242 252 HG11 VAL 30 HG11 VAL 30 -7.275 13.427 7.002 253 HG12 VAL 30 HG12 VAL 30 -6.276 12.721 8.294 254 HG13 VAL 30 HG13 VAL 30 -6.530 11.835 6.783 255 HG21 VAL 30 HG21 VAL 30 -7.232 10.829 9.725 256 HG22 VAL 30 HG22 VAL 30 -8.687 9.987 9.130 257 HG23 VAL 30 HG23 VAL 30 -7.190 9.945 8.189 258 H TYR 31 H TYR 31 -11.118 12.119 7.568 259 HA TYR 31 HA TYR 31 -12.771 11.157 9.858 260 HB2 TYR 31 HB2 TYR 31 -13.562 12.142 7.086 261 HB3 TYR 31 HB3 TYR 31 -14.650 11.344 8.191 262 HD1 TYR 31 HD2 TYR 31 -12.670 14.471 7.673 263 HD2 TYR 31 HD1 TYR 31 -15.645 12.434 10.052 264 HE1 TYR 31 HE2 TYR 31 -13.273 16.618 8.780 265 HE2 TYR 31 HE1 TYR 31 -16.305 14.597 11.087 266 HH TYR 31 HH TYR 31 -14.704 17.674 10.225 267 H SER 32 H SER 32 -13.525 9.096 9.871 268 HA SER 32 HA SER 32 -13.255 7.226 7.593 269 HB2 SER 32 HB2 SER 32 -11.001 7.175 8.431 270 HB3 SER 32 HB3 SER 32 -11.547 7.190 10.112 271 HG SER 32 HG SER 32 -11.507 5.106 9.996 272 H VAL 33 H VAL 33 -14.447 5.219 8.013 273 HA VAL 33 HA VAL 33 -16.375 5.382 10.262 274 HB VAL 33 HB VAL 33 -17.360 3.304 9.377 275 HG11 VAL 33 HG11 VAL 33 -18.237 5.494 8.795 276 HG12 VAL 33 HG12 VAL 33 -17.191 5.534 7.336 277 HG13 VAL 33 HG13 VAL 33 -18.472 4.310 7.496 278 HG21 VAL 33 HG21 VAL 33 -15.506 3.709 7.006 279 HG22 VAL 33 HG22 VAL 33 -15.422 2.371 8.183 280 HG23 VAL 33 HG23 VAL 33 -16.838 2.530 7.137 281 H ASP 34 H ASP 34 -16.581 3.959 11.890 282 HA ASP 34 HA ASP 34 -14.296 2.202 12.564 283 HB2 ASP 34 HB2 ASP 34 -15.762 3.720 14.173 284 HB3 ASP 34 HB3 ASP 34 -16.855 2.344 14.151 285 H ASN 35 H ASN 35 -15.200 0.059 13.680 286 HA ASN 35 HA ASN 35 -15.986 -1.763 11.563 287 HB2 ASN 35 HB2 ASN 35 -15.780 -2.058 14.594 288 HB3 ASN 35 HB3 ASN 35 -16.157 -3.393 13.512 289 HD21 ASN 35 HD22 ASN 35 -14.020 -3.661 15.159 290 HD22 ASN 35 HD21 ASN 35 -12.543 -3.588 14.205 291 H ASN 36 H ASN 36 -17.806 0.183 13.759 292 HA ASN 36 HA ASN 36 -20.320 -1.350 13.464 293 HB2 ASN 36 HB2 ASN 36 -19.592 1.185 15.011 294 HB3 ASN 36 HB3 ASN 36 -21.158 0.377 15.075 295 HD21 ASN 36 HD22 ASN 36 -18.293 0.642 16.751 296 HD22 ASN 36 HD21 ASN 36 -18.366 -0.899 17.588 297 H GLY 37 H GLY 37 -18.778 0.772 11.404 298 HA2 GLY 37 HA2 GLY 37 -19.561 1.907 9.555 299 HA3 GLY 37 HA3 GLY 37 -21.217 1.446 9.968 300 H ASN 38 H ASN 38 -19.124 3.210 12.186 301 HA ASN 38 HA ASN 38 -20.864 5.656 12.008 302 HB2 ASN 38 HB2 ASN 38 -19.337 4.350 14.307 303 HB3 ASN 38 HB3 ASN 38 -19.823 6.040 14.346 304 HD21 ASN 38 HD22 ASN 38 -21.239 2.757 13.892 305 HD22 ASN 38 HD21 ASN 38 -22.757 3.190 14.651 306 H ILE 39 H ILE 39 -19.886 7.340 11.020 307 HA ILE 39 HA ILE 39 -17.067 7.489 10.470 308 HB ILE 39 HB ILE 39 -19.235 9.604 10.336 309 HG12 ILE 39 HG12 ILE 39 -17.881 8.128 8.035 310 HG13 ILE 39 HG13 ILE 39 -19.345 7.494 8.778 311 HG21 ILE 39 HG21 ILE 39 -16.981 10.632 10.557 312 HG22 ILE 39 HG22 ILE 39 -16.372 9.613 9.232 313 HG23 ILE 39 HG23 ILE 39 -17.589 10.871 8.932 314 HD11 ILE 39 HD11 ILE 39 -20.679 9.296 8.107 315 HD12 ILE 39 HD12 ILE 39 -19.284 10.307 7.716 316 HD13 ILE 39 HD13 ILE 39 -19.674 8.914 6.688 317 H TYR 40 H TYR 40 -15.529 8.046 11.743 318 HA TYR 40 HA TYR 40 -15.922 9.983 13.993 319 HB2 TYR 40 HB2 TYR 40 -14.510 8.712 15.423 320 HB3 TYR 40 HB3 TYR 40 -15.750 7.630 14.828 321 HD1 TYR 40 HD2 TYR 40 -12.155 8.491 14.730 322 HD2 TYR 40 HD1 TYR 40 -15.163 5.702 13.365 323 HE1 TYR 40 HE2 TYR 40 -10.382 6.956 13.875 324 HE2 TYR 40 HE1 TYR 40 -13.358 4.197 12.559 325 HH TYR 40 HH TYR 40 -11.117 3.836 12.370 326 H THR 41 H THR 41 -13.694 10.838 14.749 327 HA THR 41 HA THR 41 -11.990 11.468 12.379 328 HB THR 41 HB THR 41 -11.423 13.592 13.659 329 HG1 THR 41 HG1 THR 41 -13.075 14.278 15.075 330 HG21 THR 41 HG21 THR 41 -12.776 13.698 11.683 331 HG22 THR 41 HG22 THR 41 -14.225 13.151 12.567 332 HG23 THR 41 HG23 THR 41 -13.520 14.744 12.902 333 H GLN 42 H GLN 42 -9.812 11.431 12.528 334 HA GLN 42 HA GLN 42 -8.518 10.732 15.110 335 HB2 GLN 42 HB2 GLN 42 -7.400 8.800 14.099 336 HB3 GLN 42 HB3 GLN 42 -9.146 8.628 14.141 337 HG2 GLN 42 HG2 GLN 42 -9.210 9.295 11.676 338 HG3 GLN 42 HG3 GLN 42 -7.445 9.299 11.692 339 HE21 GLN 42 HE22 GLN 42 -8.817 7.639 9.887 340 HE22 GLN 42 HE21 GLN 42 -8.607 5.984 10.419 341 HA PRO 43 HA PRO 43 -5.281 13.287 13.325 342 HB2 PRO 43 HB2 PRO 43 -3.221 12.811 15.036 343 HB3 PRO 43 HB3 PRO 43 -4.674 13.744 15.511 344 HG2 PRO 43 HG2 PRO 43 -4.096 10.811 16.019 345 HG3 PRO 43 HG3 PRO 43 -4.681 12.045 17.182 346 HD2 PRO 43 HD2 PRO 43 -6.362 10.307 15.901 347 HD3 PRO 43 HD3 PRO 43 -6.853 11.981 16.304 348 H VAL 44 H VAL 44 -3.371 13.063 12.035 349 HA VAL 44 HA VAL 44 -2.734 10.481 10.861 350 HB VAL 44 HB VAL 44 -1.041 13.029 10.921 351 HG11 VAL 44 HG11 VAL 44 0.344 11.177 10.229 352 HG12 VAL 44 HG12 VAL 44 -0.935 10.539 9.163 353 HG13 VAL 44 HG13 VAL 44 -0.107 12.055 8.779 354 HG21 VAL 44 HG21 VAL 44 -3.092 12.076 8.880 355 HG22 VAL 44 HG22 VAL 44 -3.179 13.539 9.890 356 HG23 VAL 44 HG23 VAL 44 -1.948 13.421 8.636 357 H ALA 45 H ALA 45 -1.153 9.000 11.334 358 HA ALA 45 HA ALA 45 0.533 9.494 13.773 359 HB1 ALA 45 HB1 ALA 45 -1.088 7.583 13.871 360 HB2 ALA 45 HB2 ALA 45 -0.182 6.826 12.526 361 HB3 ALA 45 HB3 ALA 45 0.617 7.120 14.076 362 H GLN 46 H GLN 46 0.576 8.242 10.402 363 HA GLN 46 HA GLN 46 3.479 8.863 10.255 364 HB2 GLN 46 HB2 GLN 46 2.272 6.299 9.168 365 HB3 GLN 46 HB3 GLN 46 3.956 6.792 9.078 366 HG2 GLN 46 HG2 GLN 46 2.431 5.971 11.558 367 HG3 GLN 46 HG3 GLN 46 3.676 5.061 10.709 368 HE21 GLN 46 HE22 GLN 46 3.650 5.830 13.560 369 HE22 GLN 46 HE21 GLN 46 5.089 6.812 13.787 370 H TRP 47 H TRP 47 4.283 8.765 8.090 371 HA TRP 47 HA TRP 47 2.415 9.772 5.971 372 HB2 TRP 47 HB2 TRP 47 4.986 11.036 6.938 373 HB3 TRP 47 HB3 TRP 47 4.135 11.578 5.521 374 HD1 TRP 47 HD1 TRP 47 2.065 13.213 5.874 375 HE1 TRP 47 HE1 TRP 47 1.211 14.551 7.881 376 HE3 TRP 47 HE3 TRP 47 4.708 10.873 9.605 377 HZ2 TRP 47 HZ2 TRP 47 1.497 14.498 10.731 378 HZ3 TRP 47 HZ3 TRP 47 4.337 11.513 11.977 379 HH2 TRP 47 HH2 TRP 47 2.700 13.302 12.552 380 H HIS 48 H HIS 48 2.826 8.869 4.074 381 HA HIS 48 HA HIS 48 5.315 7.246 3.675 382 HB2 HIS 48 HB2 HIS 48 2.457 6.669 2.819 383 HB3 HIS 48 HB3 HIS 48 3.827 5.596 2.612 384 HD1 HIS 48 HD1 HIS 48 4.939 4.821 5.217 385 HD2 HIS 48 HD2 HIS 48 0.977 6.190 4.853 386 HE1 HIS 48 HE1 HIS 48 3.712 4.027 7.304 387 H ASP 49 H ASP 49 6.432 7.562 1.779 388 HA ASP 49 HA ASP 49 5.153 9.044 -0.445 389 HB2 ASP 49 HB2 ASP 49 7.135 10.503 -0.558 390 HB3 ASP 49 HB3 ASP 49 6.205 10.739 0.905 391 H ARG 50 H ARG 50 5.646 8.583 -2.337 392 HA ARG 50 HA ARG 50 7.392 6.189 -2.801 393 HB2 ARG 50 HB2 ARG 50 5.149 7.353 -4.474 394 HB3 ARG 50 HB3 ARG 50 5.869 5.758 -4.637 395 HG2 ARG 50 HG2 ARG 50 4.155 6.724 -2.273 396 HG3 ARG 50 HG3 ARG 50 3.663 5.648 -3.562 397 HD2 ARG 50 HD2 ARG 50 4.272 3.943 -2.273 398 HD3 ARG 50 HD3 ARG 50 5.949 4.407 -2.645 399 HE ARG 50 HE ARG 50 4.783 5.740 -0.316 400 HH11 ARG 50 HH11 ARG 50 6.569 2.898 -1.395 401 HH12 ARG 50 HH12 ARG 50 7.145 2.541 0.209 402 HH21 ARG 50 HH21 ARG 50 5.624 5.204 1.715 403 HH22 ARG 50 HH22 ARG 50 6.628 3.794 1.893 404 H GLY 51 H GLY 51 6.877 9.410 -4.080 405 HA2 GLY 51 HA2 GLY 51 8.551 10.749 -5.090 406 HA3 GLY 51 HA3 GLY 51 9.489 9.314 -5.464 407 H GLU 52 H GLU 52 8.182 7.787 -7.101 408 HA GLU 52 HA GLU 52 6.936 9.264 -9.389 409 HB2 GLU 52 HB2 GLU 52 9.639 7.848 -9.565 410 HB3 GLU 52 HB3 GLU 52 8.659 8.498 -10.866 411 HG2 GLU 52 HG2 GLU 52 10.208 10.103 -10.640 412 HG3 GLU 52 HG3 GLU 52 8.861 10.770 -9.730 413 H GLN 53 H GLN 53 5.213 7.878 -9.157 414 HA GLN 53 HA GLN 53 5.660 5.241 -10.522 415 HB2 GLN 53 HB2 GLN 53 3.505 5.841 -8.473 416 HB3 GLN 53 HB3 GLN 53 3.809 4.287 -9.282 417 HG2 GLN 53 HG2 GLN 53 6.198 4.458 -8.286 418 HG3 GLN 53 HG3 GLN 53 5.536 5.736 -7.248 419 HE21 GLN 53 HE22 GLN 53 3.224 4.813 -6.131 420 HE22 GLN 53 HE21 GLN 53 4.373 4.268 -5.059 421 H GLU 54 H GLU 54 3.852 4.399 -11.725 422 HA GLU 54 HA GLU 54 2.836 6.308 -13.627 423 HB2 GLU 54 HB2 GLU 54 1.837 4.319 -14.699 424 HB3 GLU 54 HB3 GLU 54 3.561 4.210 -14.391 425 HG2 GLU 54 HG2 GLU 54 3.014 2.789 -12.335 426 HG3 GLU 54 HG3 GLU 54 1.346 2.751 -12.900 427 H VAL 55 H VAL 55 1.284 7.684 -13.161 428 HA VAL 55 HA VAL 55 -0.991 6.908 -11.393 429 HB VAL 55 HB VAL 55 -0.287 9.691 -12.397 430 HG11 VAL 55 HG11 VAL 55 -2.629 9.369 -11.518 431 HG12 VAL 55 HG12 VAL 55 -1.938 8.777 -9.995 432 HG13 VAL 55 HG13 VAL 55 -1.656 10.451 -10.526 433 HG21 VAL 55 HG21 VAL 55 0.597 8.195 -9.910 434 HG22 VAL 55 HG22 VAL 55 1.602 9.044 -11.102 435 HG23 VAL 55 HG23 VAL 55 0.575 9.971 -10.007 436 H PHE 56 H PHE 56 -3.058 6.911 -12.007 437 HA PHE 56 HA PHE 56 -3.762 7.612 -14.835 438 HB2 PHE 56 HB2 PHE 56 -4.618 5.256 -13.136 439 HB3 PHE 56 HB3 PHE 56 -5.413 5.722 -14.630 440 HD1 PHE 56 HD2 PHE 56 -2.044 4.693 -13.259 441 HD2 PHE 56 HD1 PHE 56 -4.679 4.800 -16.675 442 HE1 PHE 56 HE2 PHE 56 -0.430 3.332 -14.551 443 HE2 PHE 56 HE1 PHE 56 -3.086 3.380 -17.938 444 HZ PHE 56 HZ PHE 56 -0.941 2.676 -16.894 445 H GLU 57 H GLU 57 -5.590 8.701 -15.143 446 HA GLU 57 HA GLU 57 -7.107 9.804 -12.866 447 HB2 GLU 57 HB2 GLU 57 -6.370 11.250 -14.705 448 HB3 GLU 57 HB3 GLU 57 -7.246 10.282 -15.883 449 HG2 GLU 57 HG2 GLU 57 -9.356 10.964 -14.965 450 HG3 GLU 57 HG3 GLU 57 -8.590 11.612 -13.504 451 H TYR 58 H TYR 58 -8.859 8.784 -12.171 452 HA TYR 58 HA TYR 58 -10.342 6.864 -13.933 453 HB2 TYR 58 HB2 TYR 58 -10.138 6.942 -10.907 454 HB3 TYR 58 HB3 TYR 58 -11.034 5.780 -11.860 455 HD1 TYR 58 HD2 TYR 58 -9.833 4.039 -13.207 456 HD2 TYR 58 HD1 TYR 58 -7.723 6.800 -10.654 457 HE1 TYR 58 HE2 TYR 58 -7.868 2.512 -13.176 458 HE2 TYR 58 HE1 TYR 58 -5.738 5.309 -10.685 459 HH TYR 58 HH TYR 58 -4.876 3.342 -11.424 460 H CYS 59 H CYS 59 -11.954 7.985 -14.832 461 HA CYS 59 HA CYS 59 -13.280 10.226 -13.439 462 HB2 CYS 59 HB2 CYS 59 -12.510 10.308 -15.843 463 HB3 CYS 59 HB3 CYS 59 -13.717 9.063 -16.215 464 HG CYS 59 HG CYS 59 -14.530 11.472 -16.996 465 H LEU 60 H LEU 60 -15.416 10.296 -12.887 466 HA LEU 60 HA LEU 60 -16.889 7.698 -12.640 467 HB2 LEU 60 HB2 LEU 60 -16.497 10.124 -10.981 468 HB3 LEU 60 HB3 LEU 60 -18.157 9.607 -11.060 469 HG LEU 60 HG LEU 60 -17.737 7.521 -10.100 470 HD11 LEU 60 HD11 LEU 60 -15.594 6.852 -11.154 471 HD12 LEU 60 HD12 LEU 60 -14.728 8.074 -10.211 472 HD13 LEU 60 HD13 LEU 60 -15.514 6.689 -9.405 473 HD21 LEU 60 HD21 LEU 60 -15.901 9.490 -8.656 474 HD22 LEU 60 HD22 LEU 60 -17.668 9.530 -8.589 475 HD23 LEU 60 HD23 LEU 60 -16.795 8.132 -7.939 476 H GLU 61 H GLU 61 -19.144 7.667 -12.828 477 HA GLU 61 HA GLU 61 -19.986 8.752 -15.365 478 HB2 GLU 61 HB2 GLU 61 -22.138 7.652 -14.902 479 HB3 GLU 61 HB3 GLU 61 -20.768 6.566 -14.704 480 HG2 GLU 61 HG2 GLU 61 -21.016 6.385 -12.415 481 HG3 GLU 61 HG3 GLU 61 -21.757 7.966 -12.258 482 H ASP 62 H ASP 62 -20.287 10.029 -12.164 483 HA ASP 62 HA ASP 62 -22.506 11.868 -12.851 484 HB2 ASP 62 HB2 ASP 62 -22.201 10.868 -10.583 485 HB3 ASP 62 HB3 ASP 62 -20.712 11.808 -10.401 486 H GLY 63 H GLY 63 -19.106 11.860 -13.276 487 HA2 GLY 63 HA2 GLY 63 -18.116 13.567 -14.679 488 HA3 GLY 63 HA3 GLY 63 -19.039 14.808 -13.833 489 H SER 64 H SER 64 -18.021 12.808 -11.409 490 HA SER 64 HA SER 64 -15.906 14.527 -10.463 491 HB2 SER 64 HB2 SER 64 -16.793 11.766 -9.531 492 HB3 SER 64 HB3 SER 64 -15.704 12.847 -8.650 493 HG SER 64 HG SER 64 -17.937 12.990 -7.996 494 H LEU 65 H LEU 65 -13.734 13.907 -9.927 495 HA LEU 65 HA LEU 65 -12.448 11.879 -11.721 496 HB2 LEU 65 HB2 LEU 65 -11.677 14.763 -11.115 497 HB3 LEU 65 HB3 LEU 65 -10.511 13.582 -11.666 498 HG LEU 65 HG LEU 65 -11.068 14.926 -13.486 499 HD11 LEU 65 HD11 LEU 65 -10.827 12.440 -13.837 500 HD12 LEU 65 HD12 LEU 65 -12.587 12.349 -13.975 501 HD13 LEU 65 HD13 LEU 65 -11.657 13.317 -15.136 502 HD21 LEU 65 HD21 LEU 65 -13.985 14.145 -13.373 503 HD22 LEU 65 HD22 LEU 65 -13.354 15.685 -12.742 504 HD23 LEU 65 HD23 LEU 65 -13.197 15.284 -14.465 505 H ILE 66 H ILE 66 -10.681 10.829 -10.933 506 HA ILE 66 HA ILE 66 -9.707 11.249 -8.144 507 HB ILE 66 HB ILE 66 -10.541 8.572 -9.347 508 HG12 ILE 66 HG12 ILE 66 -11.911 10.096 -7.086 509 HG13 ILE 66 HG13 ILE 66 -12.542 9.925 -8.724 510 HG21 ILE 66 HG21 ILE 66 -8.593 8.483 -7.704 511 HG22 ILE 66 HG22 ILE 66 -9.701 9.119 -6.467 512 HG23 ILE 66 HG23 ILE 66 -9.992 7.548 -7.245 513 HD11 ILE 66 HD11 ILE 66 -12.619 7.452 -8.436 514 HD12 ILE 66 HD12 ILE 66 -12.207 7.683 -6.717 515 HD13 ILE 66 HD13 ILE 66 -13.700 8.366 -7.369 516 H ARG 67 H ARG 67 -7.473 10.719 -7.941 517 HA ARG 67 HA ARG 67 -6.014 9.728 -10.364 518 HB2 ARG 67 HB2 ARG 67 -5.405 12.273 -8.802 519 HB3 ARG 67 HB3 ARG 67 -4.295 11.495 -9.942 520 HG2 ARG 67 HG2 ARG 67 -6.061 11.707 -11.725 521 HG3 ARG 67 HG3 ARG 67 -7.033 12.670 -10.603 522 HD2 ARG 67 HD2 ARG 67 -5.336 14.378 -10.457 523 HD3 ARG 67 HD3 ARG 67 -4.163 13.367 -11.321 524 HE ARG 67 HE ARG 67 -6.453 13.753 -13.006 525 HH11 ARG 67 HH11 ARG 67 -3.670 15.596 -11.875 526 HH12 ARG 67 HH12 ARG 67 -3.751 16.670 -13.248 527 HH21 ARG 67 HH21 ARG 67 -6.505 15.083 -14.608 528 HH22 ARG 67 HH22 ARG 67 -5.342 16.401 -14.798 529 H ALA 68 H ALA 68 -4.983 7.961 -9.814 530 HA ALA 68 HA ALA 68 -3.299 7.809 -7.391 531 HB1 ALA 68 HB1 ALA 68 -5.640 7.252 -6.670 532 HB2 ALA 68 HB2 ALA 68 -5.659 5.921 -7.848 533 HB3 ALA 68 HB3 ALA 68 -4.518 5.893 -6.484 534 H THR 69 H THR 69 -2.286 5.545 -7.223 535 HA THR 69 HA THR 69 -1.473 4.518 -9.901 536 HB THR 69 HB THR 69 0.062 3.065 -8.640 537 HG1 THR 69 HG1 THR 69 0.355 3.300 -6.527 538 HG21 THR 69 HG21 THR 69 0.876 5.229 -9.402 539 HG22 THR 69 HG22 THR 69 0.303 6.005 -7.906 540 HG23 THR 69 HG23 THR 69 1.603 4.788 -7.848 541 H LYS 70 H LYS 70 -1.490 2.185 -10.240 542 HA LYS 70 HA LYS 70 -4.049 0.946 -9.769 543 HB2 LYS 70 HB2 LYS 70 -1.381 -0.017 -10.863 544 HB3 LYS 70 HB3 LYS 70 -2.596 -1.198 -10.417 545 HG2 LYS 70 HG2 LYS 70 -2.950 -0.905 -12.666 546 HG3 LYS 70 HG3 LYS 70 -4.258 -0.004 -11.899 547 HD2 LYS 70 HD2 LYS 70 -3.035 2.115 -12.303 548 HD3 LYS 70 HD3 LYS 70 -1.716 1.224 -13.072 549 HE2 LYS 70 HE2 LYS 70 -4.626 1.081 -14.002 550 HE3 LYS 70 HE3 LYS 70 -3.487 2.274 -14.617 551 HZ1 LYS 70 HZ1 LYS 70 -2.056 0.433 -15.371 552 HZ2 LYS 70 HZ2 LYS 70 -3.168 -0.669 -14.881 553 HZ3 LYS 70 HZ3 LYS 70 -3.521 0.379 -16.087 554 H ASP 71 H ASP 71 -1.221 1.003 -7.796 555 HA ASP 71 HA ASP 71 -1.807 -1.479 -6.333 556 HB2 ASP 71 HB2 ASP 71 0.310 0.691 -6.075 557 HB3 ASP 71 HB3 ASP 71 0.209 -0.714 -5.010 558 H HIS 72 H HIS 72 -2.833 1.818 -6.061 559 HA HIS 72 HA HIS 72 -2.973 1.931 -3.156 560 HB2 HIS 72 HB2 HIS 72 -2.811 3.944 -4.667 561 HB3 HIS 72 HB3 HIS 72 -4.405 3.571 -5.309 562 HD1 HIS 72 HD1 HIS 72 -6.403 3.591 -3.163 563 HD2 HIS 72 HD2 HIS 72 -2.624 5.219 -2.422 564 HE1 HIS 72 HE1 HIS 72 -6.534 4.733 -0.926 565 H LYS 73 H LYS 73 -4.781 1.165 -1.894 566 HA LYS 73 HA LYS 73 -7.043 -0.082 -3.389 567 HB2 LYS 73 HB2 LYS 73 -6.362 -0.472 -0.455 568 HB3 LYS 73 HB3 LYS 73 -7.622 -1.252 -1.367 569 HG2 LYS 73 HG2 LYS 73 -6.132 -2.923 -1.466 570 HG3 LYS 73 HG3 LYS 73 -5.596 -2.065 -2.914 571 HD2 LYS 73 HD2 LYS 73 -3.740 -1.080 -1.749 572 HD3 LYS 73 HD3 LYS 73 -4.348 -1.601 -0.173 573 HE2 LYS 73 HE2 LYS 73 -3.767 -3.652 -2.314 574 HE3 LYS 73 HE3 LYS 73 -2.430 -2.943 -1.393 575 HZ1 LYS 73 HZ1 LYS 73 -3.470 -3.719 0.654 576 HZ2 LYS 73 HZ2 LYS 73 -4.740 -4.364 -0.162 577 HZ3 LYS 73 HZ3 LYS 73 -3.239 -4.980 -0.348 578 H PHE 74 H PHE 74 -9.191 0.188 -2.799 579 HA PHE 74 HA PHE 74 -9.830 2.695 -1.271 580 HB2 PHE 74 HB2 PHE 74 -10.784 1.883 -4.029 581 HB3 PHE 74 HB3 PHE 74 -11.594 3.072 -3.039 582 HD1 PHE 74 HD2 PHE 74 -8.262 2.361 -4.720 583 HD2 PHE 74 HD1 PHE 74 -10.943 5.321 -3.057 584 HE1 PHE 74 HE2 PHE 74 -6.886 4.169 -5.688 585 HE2 PHE 74 HE1 PHE 74 -9.552 7.116 -4.036 586 HZ PHE 74 HZ PHE 74 -7.522 6.551 -5.350 587 H MET 75 H MET 75 -11.668 2.590 -0.014 588 HA MET 75 HA MET 75 -12.444 -0.169 0.576 589 HB2 MET 75 HB2 MET 75 -11.878 1.723 2.301 590 HB3 MET 75 HB3 MET 75 -13.606 2.096 2.144 591 HG2 MET 75 HG2 MET 75 -14.287 -0.007 2.908 592 HG3 MET 75 HG3 MET 75 -12.694 -0.718 2.679 593 HE1 MET 75 HE1 MET 75 -14.161 2.490 4.425 594 HE2 MET 75 HE2 MET 75 -14.986 1.249 5.388 595 HE3 MET 75 HE3 MET 75 -13.714 2.248 6.119 596 H THR 76 H THR 76 -14.064 -1.125 -0.416 597 HA THR 76 HA THR 76 -15.972 0.322 -2.047 598 HB THR 76 HB THR 76 -16.929 -1.856 -2.553 599 HG1 THR 76 HG1 THR 76 -15.982 -3.689 -1.595 600 HG21 THR 76 HG21 THR 76 -14.894 -1.085 -3.685 601 HG22 THR 76 HG22 THR 76 -13.897 -1.953 -2.497 602 HG23 THR 76 HG23 THR 76 -14.981 -2.857 -3.589 603 H VAL 77 H VAL 77 -18.355 -0.229 -1.932 604 HA VAL 77 HA VAL 77 -19.493 0.733 0.454 605 HB VAL 77 HB VAL 77 -21.676 -0.062 -0.441 606 HG11 VAL 77 HG11 VAL 77 -20.726 2.101 -1.112 607 HG12 VAL 77 HG12 VAL 77 -19.889 1.329 -2.477 608 HG13 VAL 77 HG13 VAL 77 -21.661 1.359 -2.429 609 HG21 VAL 77 HG21 VAL 77 -20.041 -1.194 -2.761 610 HG22 VAL 77 HG22 VAL 77 -20.910 -2.158 -1.548 611 HG23 VAL 77 HG23 VAL 77 -21.808 -1.100 -2.646 612 H ASP 78 H ASP 78 -18.531 -2.529 -0.276 613 HA ASP 78 HA ASP 78 -20.067 -3.784 1.894 614 HB2 ASP 78 HB2 ASP 78 -17.786 -4.808 0.154 615 HB3 ASP 78 HB3 ASP 78 -18.738 -5.785 1.268 616 H GLY 79 H GLY 79 -17.152 -1.950 1.764 617 HA2 GLY 79 HA2 GLY 79 -15.834 -1.363 3.620 618 HA3 GLY 79 HA3 GLY 79 -16.405 -2.764 4.519 619 H GLN 80 H GLN 80 -15.481 -3.761 1.409 620 HA GLN 80 HA GLN 80 -12.995 -5.016 2.376 621 HB2 GLN 80 HB2 GLN 80 -14.314 -5.055 -0.378 622 HB3 GLN 80 HB3 GLN 80 -12.929 -6.025 0.136 623 HG2 GLN 80 HG2 GLN 80 -14.446 -6.958 1.998 624 HG3 GLN 80 HG3 GLN 80 -15.798 -6.224 1.128 625 HE21 GLN 80 HE22 GLN 80 -16.096 -6.964 -1.230 626 HE22 GLN 80 HE21 GLN 80 -15.589 -8.605 -1.608 627 H MET 81 H MET 81 -10.927 -4.677 1.398 628 HA MET 81 HA MET 81 -10.551 -1.958 0.199 629 HB2 MET 81 HB2 MET 81 -8.536 -1.697 1.484 630 HB3 MET 81 HB3 MET 81 -9.940 -1.920 2.515 631 HG2 MET 81 HG2 MET 81 -8.849 -4.527 2.175 632 HG3 MET 81 HG3 MET 81 -7.471 -3.450 2.344 633 HE1 MET 81 HE1 MET 81 -11.125 -3.406 3.991 634 HE2 MET 81 HE2 MET 81 -10.581 -5.101 3.965 635 HE3 MET 81 HE3 MET 81 -10.761 -4.246 5.512 636 H LEU 82 H LEU 82 -10.410 -2.447 -1.869 637 HA LEU 82 HA LEU 82 -8.440 -4.512 -2.785 638 HB2 LEU 82 HB2 LEU 82 -10.962 -3.594 -4.213 639 HB3 LEU 82 HB3 LEU 82 -9.968 -4.979 -4.612 640 HG LEU 82 HG LEU 82 -11.704 -4.734 -2.112 641 HD11 LEU 82 HD11 LEU 82 -13.022 -4.878 -4.175 642 HD12 LEU 82 HD12 LEU 82 -12.134 -6.345 -4.648 643 HD13 LEU 82 HD13 LEU 82 -13.166 -6.348 -3.201 644 HD21 LEU 82 HD21 LEU 82 -10.111 -7.085 -3.217 645 HD22 LEU 82 HD22 LEU 82 -9.840 -6.240 -1.673 646 HD23 LEU 82 HD23 LEU 82 -11.313 -7.188 -1.909 647 HA PRO 83 HA PRO 83 -6.434 -1.230 -4.987 648 HB2 PRO 83 HB2 PRO 83 -5.471 -2.499 -7.236 649 HB3 PRO 83 HB3 PRO 83 -4.743 -2.611 -5.608 650 HG2 PRO 83 HG2 PRO 83 -6.634 -4.525 -6.982 651 HG3 PRO 83 HG3 PRO 83 -5.162 -4.908 -6.032 652 HD2 PRO 83 HD2 PRO 83 -7.679 -5.104 -4.989 653 HD3 PRO 83 HD3 PRO 83 -6.295 -4.563 -3.991 654 H ILE 84 H ILE 84 -6.890 0.315 -6.521 655 HA ILE 84 HA ILE 84 -9.425 0.448 -7.734 656 HB ILE 84 HB ILE 84 -7.955 2.328 -7.173 657 HG12 ILE 84 HG12 ILE 84 -8.445 3.043 -9.971 658 HG13 ILE 84 HG13 ILE 84 -9.780 2.117 -9.312 659 HG21 ILE 84 HG21 ILE 84 -5.817 1.513 -8.056 660 HG22 ILE 84 HG22 ILE 84 -6.434 1.644 -9.716 661 HG23 ILE 84 HG23 ILE 84 -6.221 3.100 -8.724 662 HD11 ILE 84 HD11 ILE 84 -10.018 3.663 -7.447 663 HD12 ILE 84 HD12 ILE 84 -8.613 4.607 -8.018 664 HD13 ILE 84 HD13 ILE 84 -10.095 4.542 -8.993 665 H ASP 85 H ASP 85 -6.531 -0.997 -8.981 666 HA ASP 85 HA ASP 85 -7.181 -1.418 -11.725 667 HB2 ASP 85 HB2 ASP 85 -4.970 -1.815 -10.652 668 HB3 ASP 85 HB3 ASP 85 -5.650 -3.165 -9.752 669 H GLU 86 H GLU 86 -8.226 -3.136 -8.790 670 HA GLU 86 HA GLU 86 -9.552 -5.319 -10.276 671 HB2 GLU 86 HB2 GLU 86 -8.379 -5.512 -7.970 672 HB3 GLU 86 HB3 GLU 86 -9.764 -4.649 -7.312 673 HG2 GLU 86 HG2 GLU 86 -10.136 -6.963 -6.953 674 HG3 GLU 86 HG3 GLU 86 -11.243 -6.488 -8.233 675 H ILE 87 H ILE 87 -10.426 -2.410 -8.344 676 HA ILE 87 HA ILE 87 -13.226 -2.711 -8.368 677 HB ILE 87 HB ILE 87 -11.560 -0.158 -8.339 678 HG12 ILE 87 HG12 ILE 87 -12.700 -1.797 -6.024 679 HG13 ILE 87 HG13 ILE 87 -11.038 -1.943 -6.568 680 HG21 ILE 87 HG21 ILE 87 -13.987 0.266 -8.830 681 HG22 ILE 87 HG22 ILE 87 -14.420 -0.657 -7.380 682 HG23 ILE 87 HG23 ILE 87 -13.535 0.876 -7.252 683 HD11 ILE 87 HD11 ILE 87 -10.369 0.087 -5.759 684 HD12 ILE 87 HD12 ILE 87 -11.992 0.772 -5.738 685 HD13 ILE 87 HD13 ILE 87 -11.533 -0.450 -4.539 686 H PHE 88 H PHE 88 -11.125 -1.116 -10.782 687 HA PHE 88 HA PHE 88 -13.193 -0.172 -12.517 688 HB2 PHE 88 HB2 PHE 88 -10.898 0.635 -12.593 689 HB3 PHE 88 HB3 PHE 88 -10.305 -0.963 -13.017 690 HD1 PHE 88 HD1 PHE 88 -12.947 1.423 -14.334 691 HD2 PHE 88 HD2 PHE 88 -9.680 -1.237 -15.233 692 HE1 PHE 88 HE1 PHE 88 -13.090 2.070 -16.724 693 HE2 PHE 88 HE2 PHE 88 -9.825 -0.593 -17.635 694 HZ PHE 88 HZ PHE 88 -11.521 1.070 -18.379 695 H GLU 89 H GLU 89 -11.659 -3.382 -12.326 696 HA GLU 89 HA GLU 89 -12.942 -4.351 -14.810 697 HB2 GLU 89 HB2 GLU 89 -11.217 -5.670 -12.672 698 HB3 GLU 89 HB3 GLU 89 -12.070 -6.598 -13.904 699 HG2 GLU 89 HG2 GLU 89 -10.942 -5.070 -15.649 700 HG3 GLU 89 HG3 GLU 89 -9.908 -4.495 -14.341 701 H ARG 90 H ARG 90 -13.401 -4.797 -11.293 702 HA ARG 90 HA ARG 90 -15.697 -6.585 -11.632 703 HB2 ARG 90 HB2 ARG 90 -14.698 -5.087 -9.176 704 HB3 ARG 90 HB3 ARG 90 -15.894 -6.383 -9.185 705 HG2 ARG 90 HG2 ARG 90 -12.936 -6.614 -9.808 706 HG3 ARG 90 HG3 ARG 90 -13.797 -7.258 -8.421 707 HD2 ARG 90 HD2 ARG 90 -13.970 -8.132 -11.322 708 HD3 ARG 90 HD3 ARG 90 -13.253 -9.029 -9.987 709 HE ARG 90 HE ARG 90 -16.042 -8.925 -10.763 710 HH11 ARG 90 HH11 ARG 90 -14.007 -9.526 -7.963 711 HH12 ARG 90 HH12 ARG 90 -15.278 -10.361 -7.106 712 HH21 ARG 90 HH21 ARG 90 -17.619 -9.985 -9.596 713 HH22 ARG 90 HH22 ARG 90 -17.255 -10.619 -8.013 714 H GLU 91 H GLU 91 -15.362 -3.190 -11.755 715 HA GLU 91 HA GLU 91 -16.788 -1.467 -11.937 716 HB2 GLU 91 HB2 GLU 91 -18.938 -3.499 -12.645 717 HB3 GLU 91 HB3 GLU 91 -18.946 -1.765 -12.980 718 HG2 GLU 91 HG2 GLU 91 -16.839 -2.101 -14.350 719 HG3 GLU 91 HG3 GLU 91 -17.071 -3.845 -14.172 720 H LEU 92 H LEU 92 -16.299 -2.396 -9.376 721 HA LEU 92 HA LEU 92 -18.847 -2.378 -7.862 722 HB2 LEU 92 HB2 LEU 92 -15.934 -2.696 -7.047 723 HB3 LEU 92 HB3 LEU 92 -17.259 -2.660 -5.887 724 HG LEU 92 HG LEU 92 -17.094 -4.685 -8.156 725 HD11 LEU 92 HD11 LEU 92 -15.185 -4.963 -6.624 726 HD12 LEU 92 HD12 LEU 92 -16.299 -5.017 -5.237 727 HD13 LEU 92 HD13 LEU 92 -16.334 -6.297 -6.474 728 HD21 LEU 92 HD21 LEU 92 -18.796 -4.596 -5.629 729 HD22 LEU 92 HD22 LEU 92 -19.375 -4.427 -7.302 730 HD23 LEU 92 HD23 LEU 92 -18.704 -5.963 -6.761 731 H ASP 93 H ASP 93 -19.465 -0.908 -6.336 732 HA ASP 93 HA ASP 93 -18.615 1.873 -6.779 733 HB2 ASP 93 HB2 ASP 93 -20.767 0.741 -4.954 734 HB3 ASP 93 HB3 ASP 93 -20.544 2.428 -5.419 735 H LEU 94 H LEU 94 -18.338 3.374 -4.947 736 HA LEU 94 HA LEU 94 -16.769 2.188 -2.690 737 HB2 LEU 94 HB2 LEU 94 -16.450 4.882 -4.059 738 HB3 LEU 94 HB3 LEU 94 -15.516 4.315 -2.678 739 HG LEU 94 HG LEU 94 -15.476 3.133 -5.488 740 HD11 LEU 94 HD11 LEU 94 -14.272 5.271 -5.244 741 HD12 LEU 94 HD12 LEU 94 -13.367 4.619 -3.862 742 HD13 LEU 94 HD13 LEU 94 -13.141 3.929 -5.484 743 HD21 LEU 94 HD21 LEU 94 -13.903 2.285 -3.012 744 HD22 LEU 94 HD22 LEU 94 -15.135 1.320 -3.868 745 HD23 LEU 94 HD23 LEU 94 -13.633 1.715 -4.675 746 H MET 95 H MET 95 -16.773 3.191 -0.669 747 HA MET 95 HA MET 95 -19.437 4.182 0.089 748 HB2 MET 95 HB2 MET 95 -18.272 2.401 1.311 749 HB3 MET 95 HB3 MET 95 -17.009 3.524 1.797 750 HG2 MET 95 HG2 MET 95 -18.475 4.717 3.220 751 HG3 MET 95 HG3 MET 95 -19.915 4.140 2.372 752 HE1 MET 95 HE1 MET 95 -17.149 1.455 3.252 753 HE2 MET 95 HE2 MET 95 -16.830 2.698 4.493 754 HE3 MET 95 HE3 MET 95 -17.505 1.119 4.956 755 H ARG 96 H ARG 96 -19.891 6.205 1.006 756 HA ARG 96 HA ARG 96 -17.802 8.341 0.713 757 HB2 ARG 96 HB2 ARG 96 -20.696 8.801 -0.050 758 HB3 ARG 96 HB3 ARG 96 -19.306 9.802 -0.386 759 HG2 ARG 96 HG2 ARG 96 -19.244 8.956 -2.417 760 HG3 ARG 96 HG3 ARG 96 -18.656 7.445 -1.744 761 HD2 ARG 96 HD2 ARG 96 -21.561 8.218 -2.258 762 HD3 ARG 96 HD3 ARG 96 -20.597 7.114 -3.229 763 HE ARG 96 HE ARG 96 -20.558 5.510 -1.470 764 HH11 ARG 96 HH11 ARG 96 -23.129 7.869 -1.048 765 HH12 ARG 96 HH12 ARG 96 -23.709 7.117 0.412 766 HH21 ARG 96 HH21 ARG 96 -21.566 4.473 0.332 767 HH22 ARG 96 HH22 ARG 96 -22.878 5.282 1.123 768 H VAL 97 H VAL 97 -18.688 10.525 1.537 769 HA VAL 97 HA VAL 97 -19.896 10.211 4.255 770 HB VAL 97 HB VAL 97 -17.425 10.685 4.118 771 HG11 VAL 97 HG11 VAL 97 -17.619 12.473 2.276 772 HG12 VAL 97 HG12 VAL 97 -18.214 13.566 3.506 773 HG13 VAL 97 HG13 VAL 97 -16.588 12.874 3.665 774 HG21 VAL 97 HG21 VAL 97 -18.497 13.005 5.647 775 HG22 VAL 97 HG22 VAL 97 -19.262 11.469 5.978 776 HG23 VAL 97 HG23 VAL 97 -17.500 11.632 6.165 777 H ASP 98 H ASP 98 -19.984 12.116 1.322 778 HA ASP 98 HA ASP 98 -21.703 14.216 2.437 779 HB2 ASP 98 HB2 ASP 98 -20.532 13.609 -0.296 780 HB3 ASP 98 HB3 ASP 98 -21.725 14.884 -0.073 781 H ASN 99 H ASN 99 -22.466 11.141 1.901 782 HA ASN 99 HA ASN 99 -24.246 9.893 1.290 783 HB2 ASN 99 HB2 ASN 99 -25.726 12.384 2.205 784 HB3 ASN 99 HB3 ASN 99 -26.531 10.862 1.790 785 HD21 ASN 99 HD22 ASN 99 -23.931 12.172 3.796 786 HD22 ASN 99 HD21 ASN 99 -23.589 10.653 4.486 787 H LEU 100 H LEU 100 -22.827 11.106 -0.642 788 HA LEU 100 HA LEU 100 -24.494 11.800 -2.953 789 HB2 LEU 100 HB2 LEU 100 -21.617 10.899 -2.594 790 HB3 LEU 100 HB3 LEU 100 -22.271 11.118 -4.195 791 HG LEU 100 HG LEU 100 -22.180 13.317 -2.088 792 HD11 LEU 100 HD11 LEU 100 -19.954 12.591 -2.897 793 HD12 LEU 100 HD12 LEU 100 -20.461 12.885 -4.569 794 HD13 LEU 100 HD13 LEU 100 -20.344 14.237 -3.414 795 HD21 LEU 100 HD21 LEU 100 -22.852 13.417 -5.065 796 HD22 LEU 100 HD22 LEU 100 -23.979 13.736 -3.725 797 HD23 LEU 100 HD23 LEU 100 -22.626 14.828 -4.012 798 HA PRO 101 HA PRO 101 -25.777 7.785 -4.329 799 HB2 PRO 101 HB2 PRO 101 -25.589 7.934 -7.072 800 HB3 PRO 101 HB3 PRO 101 -26.843 8.773 -6.110 801 HG2 PRO 101 HG2 PRO 101 -24.253 9.905 -7.191 802 HG3 PRO 101 HG3 PRO 101 -25.893 10.627 -7.250 803 HD2 PRO 101 HD2 PRO 101 -24.050 11.334 -5.369 804 HD3 PRO 101 HD3 PRO 101 -25.780 11.269 -4.969 805 H ASN 102 H ASN 102 -24.943 5.765 -4.879 806 HA ASN 102 HA ASN 102 -22.054 5.441 -4.743 807 HB2 ASN 102 HB2 ASN 102 -24.287 3.423 -5.266 808 HB3 ASN 102 HB3 ASN 102 -22.624 3.028 -4.859 809 HD21 ASN 102 HD22 ASN 102 -21.805 3.936 -2.640 810 HD22 ASN 102 HD21 ASN 102 -23.033 3.928 -1.383 811 H ILE 103 H ILE 103 -20.693 5.616 -6.430 812 HA ILE 103 HA ILE 103 -21.521 4.888 -9.201 813 HB ILE 103 HB ILE 103 -20.451 6.972 -10.027 814 HG12 ILE 103 HG12 ILE 103 -20.753 7.945 -7.148 815 HG13 ILE 103 HG13 ILE 103 -19.248 7.727 -8.023 816 HG21 ILE 103 HG21 ILE 103 -22.927 6.503 -9.896 817 HG22 ILE 103 HG22 ILE 103 -22.969 7.437 -8.387 818 HG23 ILE 103 HG23 ILE 103 -22.509 8.213 -9.914 819 HD11 ILE 103 HD11 ILE 103 -20.042 9.467 -9.685 820 HD12 ILE 103 HD12 ILE 103 -21.432 9.763 -8.607 821 HD13 ILE 103 HD13 ILE 103 -19.800 10.075 -8.026 822 H LYS 104 H LYS 104 -20.193 3.684 -10.190 823 HA LYS 104 HA LYS 104 -17.433 3.281 -9.234 824 HB2 LYS 104 HB2 LYS 104 -17.437 1.264 -10.485 825 HB3 LYS 104 HB3 LYS 104 -18.942 1.385 -9.621 826 HG2 LYS 104 HG2 LYS 104 -19.554 0.482 -11.651 827 HG3 LYS 104 HG3 LYS 104 -20.027 2.170 -11.830 828 HD2 LYS 104 HD2 LYS 104 -18.121 2.620 -13.236 829 HD3 LYS 104 HD3 LYS 104 -17.365 1.059 -12.830 830 HE2 LYS 104 HE2 LYS 104 -19.371 -0.029 -14.002 831 HE3 LYS 104 HE3 LYS 104 -19.816 1.591 -14.551 832 HZ1 LYS 104 HZ1 LYS 104 -17.560 1.734 -15.582 833 HZ2 LYS 104 HZ2 LYS 104 -17.251 0.194 -15.162 834 HZ3 LYS 104 HZ3 LYS 104 -18.449 0.515 -16.225 835 H ILE 105 H ILE 105 -15.833 2.757 -11.049 836 HA ILE 105 HA ILE 105 -15.118 5.222 -12.367 837 HB ILE 105 HB ILE 105 -13.956 2.448 -12.618 838 HG12 ILE 105 HG12 ILE 105 -12.921 4.753 -10.904 839 HG13 ILE 105 HG13 ILE 105 -14.008 3.538 -10.257 840 HG21 ILE 105 HG21 ILE 105 -13.281 3.927 -14.505 841 HG22 ILE 105 HG22 ILE 105 -12.780 5.176 -13.355 842 HG23 ILE 105 HG23 ILE 105 -11.932 3.614 -13.440 843 HD11 ILE 105 HD11 ILE 105 -12.416 1.737 -10.869 844 HD12 ILE 105 HD12 ILE 105 -11.233 2.992 -11.327 845 HD13 ILE 105 HD13 ILE 105 -11.840 2.887 -9.658 846 H ALA 106 H ALA 106 -16.142 5.974 -14.068 847 HA ALA 106 HA ALA 106 -17.618 4.301 -15.955 848 HB1 ALA 106 HB1 ALA 106 -18.476 6.467 -15.169 849 HB2 ALA 106 HB2 ALA 106 -17.067 7.304 -15.861 850 HB3 ALA 106 HB3 ALA 106 -18.232 6.486 -16.925 851 H THR 107 H THR 107 -14.588 6.205 -16.010 852 HA THR 107 HA THR 107 -13.510 4.637 -18.252 853 HB THR 107 HB THR 107 -12.763 6.747 -19.446 854 HG1 THR 107 HG1 THR 107 -14.163 8.531 -19.191 855 HG21 THR 107 HG21 THR 107 -14.589 5.324 -20.367 856 HG22 THR 107 HG22 THR 107 -15.777 6.331 -19.508 857 HG23 THR 107 HG23 THR 107 -14.763 7.037 -20.779 858 H ARG 108 H ARG 108 -11.226 5.213 -18.711 859 HA ARG 108 HA ARG 108 -9.739 6.378 -16.400 860 HB2 ARG 108 HB2 ARG 108 -9.897 3.918 -16.144 861 HB3 ARG 108 HB3 ARG 108 -9.235 3.705 -17.767 862 HG2 ARG 108 HG2 ARG 108 -7.099 4.838 -16.978 863 HG3 ARG 108 HG3 ARG 108 -7.810 4.926 -15.359 864 HD2 ARG 108 HD2 ARG 108 -6.384 3.013 -15.422 865 HD3 ARG 108 HD3 ARG 108 -8.062 2.427 -15.430 866 HE ARG 108 HE ARG 108 -6.986 2.721 -18.116 867 HH11 ARG 108 HH11 ARG 108 -7.012 0.451 -15.435 868 HH12 ARG 108 HH12 ARG 108 -6.665 -0.904 -16.477 869 HH21 ARG 108 HH21 ARG 108 -6.585 0.946 -19.372 870 HH22 ARG 108 HH22 ARG 108 -6.429 -0.625 -18.638 871 H LYS 109 H LYS 109 -7.855 7.491 -16.939 872 HA LYS 109 HA LYS 109 -6.674 7.148 -19.663 873 HB2 LYS 109 HB2 LYS 109 -7.385 9.855 -18.435 874 HB3 LYS 109 HB3 LYS 109 -6.331 9.608 -19.829 875 HG2 LYS 109 HG2 LYS 109 -8.311 8.401 -20.950 876 HG3 LYS 109 HG3 LYS 109 -9.304 9.006 -19.619 877 HD2 LYS 109 HD2 LYS 109 -9.599 10.497 -21.450 878 HD3 LYS 109 HD3 LYS 109 -8.608 11.357 -20.260 879 HE2 LYS 109 HE2 LYS 109 -6.569 10.825 -21.558 880 HE3 LYS 109 HE3 LYS 109 -7.517 9.851 -22.687 881 HZ1 LYS 109 HZ1 LYS 109 -8.691 11.870 -23.361 882 HZ2 LYS 109 HZ2 LYS 109 -7.841 12.782 -22.300 883 HZ3 LYS 109 HZ3 LYS 109 -7.086 12.077 -23.563 884 H TYR 110 H TYR 110 -4.515 6.941 -19.582 885 HA TYR 110 HA TYR 110 -3.073 7.098 -17.070 886 HB2 TYR 110 HB2 TYR 110 -2.442 5.537 -18.895 887 HB3 TYR 110 HB3 TYR 110 -2.057 6.898 -19.933 888 HD1 TYR 110 HD1 TYR 110 -1.228 6.285 -16.289 889 HD2 TYR 110 HD2 TYR 110 0.286 6.801 -20.300 890 HE1 TYR 110 HE1 TYR 110 1.076 6.365 -15.415 891 HE2 TYR 110 HE2 TYR 110 2.609 6.758 -19.417 892 HH TYR 110 HH TYR 110 3.929 6.575 -17.558 893 H LEU 111 H LEU 111 -1.972 8.804 -16.159 894 HA LEU 111 HA LEU 111 -2.053 11.422 -17.592 895 HB2 LEU 111 HB2 LEU 111 -1.418 10.633 -14.721 896 HB3 LEU 111 HB3 LEU 111 -1.463 12.283 -15.331 897 HG LEU 111 HG LEU 111 -3.868 10.465 -15.473 898 HD11 LEU 111 HD11 LEU 111 -3.062 10.760 -13.143 899 HD12 LEU 111 HD12 LEU 111 -3.249 12.515 -13.330 900 HD13 LEU 111 HD13 LEU 111 -4.662 11.415 -13.437 901 HD21 LEU 111 HD21 LEU 111 -3.470 13.487 -15.650 902 HD22 LEU 111 HD22 LEU 111 -3.970 12.402 -16.972 903 HD23 LEU 111 HD23 LEU 111 -5.054 12.691 -15.615 904 H GLY 112 H GLY 112 0.249 9.230 -15.990 905 HA2 GLY 112 HA2 GLY 112 2.516 9.332 -17.327 906 HA3 GLY 112 HA3 GLY 112 2.541 10.987 -16.707 907 H LYS 113 H LYS 113 4.334 10.704 -15.475 908 HA LYS 113 HA LYS 113 4.339 8.628 -13.316 909 HB2 LYS 113 HB2 LYS 113 5.865 8.323 -15.331 910 HB3 LYS 113 HB3 LYS 113 6.785 9.698 -14.683 911 HG2 LYS 113 HG2 LYS 113 7.197 8.495 -12.587 912 HG3 LYS 113 HG3 LYS 113 6.114 7.193 -13.082 913 HD2 LYS 113 HD2 LYS 113 8.403 6.443 -13.372 914 HD3 LYS 113 HD3 LYS 113 7.614 6.600 -14.936 915 HE2 LYS 113 HE2 LYS 113 9.770 7.455 -15.280 916 HE3 LYS 113 HE3 LYS 113 8.743 8.883 -15.183 917 HZ1 LYS 113 HZ1 LYS 113 9.499 9.172 -12.872 918 HZ2 LYS 113 HZ2 LYS 113 10.433 7.818 -12.973 919 HZ3 LYS 113 HZ3 LYS 113 10.780 9.127 -13.878 920 H GLN 114 H GLN 114 3.236 10.266 -12.212 921 HA GLN 114 HA GLN 114 4.516 12.731 -11.400 922 HB2 GLN 114 HB2 GLN 114 1.819 11.746 -10.488 923 HB3 GLN 114 HB3 GLN 114 2.427 13.401 -10.682 924 HG2 GLN 114 HG2 GLN 114 2.789 12.802 -13.163 925 HG3 GLN 114 HG3 GLN 114 1.794 11.367 -12.860 926 HE21 GLN 114 HE22 GLN 114 1.100 12.880 -14.820 927 HE22 GLN 114 HE21 GLN 114 -0.212 13.904 -14.371 928 H ASN 115 H ASN 115 4.685 13.393 -9.121 929 HA ASN 115 HA ASN 115 5.483 11.438 -7.251 930 HB2 ASN 115 HB2 ASN 115 5.874 14.132 -7.555 931 HB3 ASN 115 HB3 ASN 115 4.601 14.160 -6.330 932 HD21 ASN 115 HD22 ASN 115 5.295 11.778 -4.839 933 HD22 ASN 115 HD21 ASN 115 6.935 12.015 -4.300 934 H VAL 116 H VAL 116 4.276 10.066 -6.149 935 HA VAL 116 HA VAL 116 1.574 10.966 -5.256 936 HB VAL 116 HB VAL 116 0.904 8.589 -5.246 937 HG11 VAL 116 HG11 VAL 116 0.277 10.117 -7.082 938 HG12 VAL 116 HG12 VAL 116 1.718 9.605 -7.977 939 HG13 VAL 116 HG13 VAL 116 0.422 8.440 -7.596 940 HG21 VAL 116 HG21 VAL 116 3.366 8.100 -6.986 941 HG22 VAL 116 HG22 VAL 116 3.174 7.539 -5.311 942 HG23 VAL 116 HG23 VAL 116 2.087 6.942 -6.570 943 H TYR 117 H TYR 117 0.833 10.404 -3.294 944 HA TYR 117 HA TYR 117 2.829 9.702 -1.190 945 HB2 TYR 117 HB2 TYR 117 0.944 12.076 -1.103 946 HB3 TYR 117 HB3 TYR 117 2.250 11.694 -0.012 947 HD1 TYR 117 HD2 TYR 117 1.347 13.115 -3.271 948 HD2 TYR 117 HD1 TYR 117 4.591 12.244 -0.563 949 HE1 TYR 117 HE2 TYR 117 2.765 14.785 -4.450 950 HE2 TYR 117 HE1 TYR 117 6.003 13.952 -1.713 951 HH TYR 117 HH TYR 117 4.769 15.936 -4.417 952 H ASP 118 H ASP 118 1.908 9.172 0.821 953 HA ASP 118 HA ASP 118 -1.028 8.772 1.107 954 HB2 ASP 118 HB2 ASP 118 -0.370 6.769 0.017 955 HB3 ASP 118 HB3 ASP 118 1.059 6.577 1.029 956 H ILE 119 H ILE 119 -1.552 7.888 3.356 957 HA ILE 119 HA ILE 119 0.309 8.697 5.497 958 HB ILE 119 HB ILE 119 -1.468 9.896 6.732 959 HG12 ILE 119 HG12 ILE 119 -2.994 9.929 4.090 960 HG13 ILE 119 HG13 ILE 119 -3.437 8.989 5.513 961 HG21 ILE 119 HG21 ILE 119 0.342 11.051 5.444 962 HG22 ILE 119 HG22 ILE 119 -0.808 11.280 4.108 963 HG23 ILE 119 HG23 ILE 119 -1.101 12.029 5.695 964 HD11 ILE 119 HD11 ILE 119 -3.875 10.998 6.801 965 HD12 ILE 119 HD12 ILE 119 -3.348 12.028 5.444 966 HD13 ILE 119 HD13 ILE 119 -4.787 11.017 5.279 967 H GLY 120 H GLY 120 -0.131 7.784 7.492 968 HA2 GLY 120 HA2 GLY 120 -2.258 5.658 7.609 969 HA3 GLY 120 HA3 GLY 120 -0.592 5.274 8.015 970 H VAL 121 H VAL 121 -2.563 4.734 9.775 971 HA VAL 121 HA VAL 121 -2.228 6.723 11.953 972 HB VAL 121 HB VAL 121 -4.876 5.323 11.658 973 HG11 VAL 121 HG11 VAL 121 -4.565 6.380 13.767 974 HG12 VAL 121 HG12 VAL 121 -3.819 7.806 13.027 975 HG13 VAL 121 HG13 VAL 121 -5.547 7.497 12.832 976 HG21 VAL 121 HG21 VAL 121 -4.115 7.942 10.300 977 HG22 VAL 121 HG22 VAL 121 -4.684 6.446 9.504 978 HG23 VAL 121 HG23 VAL 121 -5.772 7.360 10.540 979 H GLU 122 H GLU 122 -2.524 5.837 14.130 980 HA GLU 122 HA GLU 122 -1.101 3.361 14.437 981 HB2 GLU 122 HB2 GLU 122 -1.088 5.519 15.854 982 HB3 GLU 122 HB3 GLU 122 -2.550 4.891 16.623 983 HG2 GLU 122 HG2 GLU 122 -1.278 2.907 17.396 984 HG3 GLU 122 HG3 GLU 122 0.130 3.436 16.470 985 H ARG 123 H ARG 123 -4.407 3.890 14.010 986 HA ARG 123 HA ARG 123 -5.229 1.286 15.265 987 HB2 ARG 123 HB2 ARG 123 -7.411 2.321 15.694 988 HB3 ARG 123 HB3 ARG 123 -6.099 3.178 16.501 989 HG2 ARG 123 HG2 ARG 123 -6.127 4.903 14.694 990 HG3 ARG 123 HG3 ARG 123 -7.487 4.081 13.928 991 HD2 ARG 123 HD2 ARG 123 -7.535 5.132 16.784 992 HD3 ARG 123 HD3 ARG 123 -7.988 6.110 15.380 993 HE ARG 123 HE ARG 123 -9.531 3.807 15.139 994 HH11 ARG 123 HH11 ARG 123 -9.271 6.422 17.465 995 HH12 ARG 123 HH12 ARG 123 -10.952 6.313 17.916 996 HH21 ARG 123 HH21 ARG 123 -11.689 3.706 15.805 997 HH22 ARG 123 HH22 ARG 123 -12.266 4.828 16.991 998 H ASP 124 H ASP 124 -5.380 3.176 12.349 999 HA ASP 124 HA ASP 124 -6.639 1.034 10.782 1000 HB2 ASP 124 HB2 ASP 124 -7.955 3.715 11.381 1001 HB3 ASP 124 HB3 ASP 124 -8.288 2.856 9.890 1002 H HIS 125 H HIS 125 -6.799 1.917 8.362 1003 HA HIS 125 HA HIS 125 -4.450 3.687 7.799 1004 HB2 HIS 125 HB2 HIS 125 -4.167 1.026 7.705 1005 HB3 HIS 125 HB3 HIS 125 -4.905 1.205 6.134 1006 HD1 HIS 125 HD1 HIS 125 -3.219 4.030 5.459 1007 HD2 HIS 125 HD2 HIS 125 -1.804 0.308 6.817 1008 HE1 HIS 125 HE1 HIS 125 -0.747 3.952 4.865 1009 H ASN 126 H ASN 126 -7.400 4.159 7.612 1010 HA ASN 126 HA ASN 126 -7.550 4.857 4.731 1011 HB2 ASN 126 HB2 ASN 126 -9.747 3.894 4.551 1012 HB3 ASN 126 HB3 ASN 126 -8.725 2.673 5.289 1013 HD21 ASN 126 HD22 ASN 126 -11.458 4.821 5.763 1014 HD22 ASN 126 HD21 ASN 126 -11.739 4.370 7.440 1015 H PHE 127 H PHE 127 -9.200 6.371 4.137 1016 HA PHE 127 HA PHE 127 -10.263 8.251 6.114 1017 HB2 PHE 127 HB2 PHE 127 -8.907 10.173 5.135 1018 HB3 PHE 127 HB3 PHE 127 -8.059 9.074 6.199 1019 HD1 PHE 127 HD2 PHE 127 -8.502 10.023 2.611 1020 HD2 PHE 127 HD1 PHE 127 -6.179 7.775 5.470 1021 HE1 PHE 127 HE2 PHE 127 -6.772 9.591 0.881 1022 HE2 PHE 127 HE1 PHE 127 -4.465 7.338 3.730 1023 HZ PHE 127 HZ PHE 127 -4.757 8.245 1.439 1024 H ALA 128 H ALA 128 -11.504 9.988 5.160 1025 HA ALA 128 HA ALA 128 -12.776 9.261 2.607 1026 HB1 ALA 128 HB1 ALA 128 -14.059 9.824 4.707 1027 HB2 ALA 128 HB2 ALA 128 -13.454 11.492 4.567 1028 HB3 ALA 128 HB3 ALA 128 -14.487 10.810 3.296 1029 H LEU 129 H LEU 129 -12.349 10.198 0.734 1030 HA LEU 129 HA LEU 129 -10.550 12.439 0.360 1031 HB2 LEU 129 HB2 LEU 129 -12.369 10.776 -1.430 1032 HB3 LEU 129 HB3 LEU 129 -11.402 12.110 -2.054 1033 HG LEU 129 HG LEU 129 -10.031 9.936 -0.427 1034 HD11 LEU 129 HD11 LEU 129 -11.100 8.635 -2.154 1035 HD12 LEU 129 HD12 LEU 129 -10.669 9.827 -3.405 1036 HD13 LEU 129 HD13 LEU 129 -9.412 8.864 -2.593 1037 HD21 LEU 129 HD21 LEU 129 -9.152 11.677 -2.755 1038 HD22 LEU 129 HD22 LEU 129 -8.902 12.108 -1.059 1039 HD23 LEU 129 HD23 LEU 129 -8.113 10.663 -1.717 1040 H LYS 130 H LYS 130 -11.197 14.260 -1.174 1041 HA LYS 130 HA LYS 130 -12.983 16.066 -0.077 1042 HB2 LYS 130 HB2 LYS 130 -12.854 17.273 -2.261 1043 HB3 LYS 130 HB3 LYS 130 -11.310 16.803 -1.570 1044 HG2 LYS 130 HG2 LYS 130 -11.033 14.982 -3.132 1045 HG3 LYS 130 HG3 LYS 130 -12.660 15.190 -3.776 1046 HD2 LYS 130 HD2 LYS 130 -10.502 17.332 -3.924 1047 HD3 LYS 130 HD3 LYS 130 -10.727 16.123 -5.177 1048 HE2 LYS 130 HE2 LYS 130 -12.939 18.030 -4.280 1049 HE3 LYS 130 HE3 LYS 130 -11.792 18.410 -5.566 1050 HZ1 LYS 130 HZ1 LYS 130 -12.565 16.469 -6.793 1051 HZ2 LYS 130 HZ2 LYS 130 -13.639 16.079 -5.612 1052 HZ3 LYS 130 HZ3 LYS 130 -13.821 17.462 -6.471 1053 H ASN 131 H ASN 131 -13.902 13.682 -2.520 1054 HA ASN 131 HA ASN 131 -16.724 14.675 -2.517 1055 HB2 ASN 131 HB2 ASN 131 -15.162 12.621 -4.126 1056 HB3 ASN 131 HB3 ASN 131 -16.916 12.693 -4.193 1057 HD21 ASN 131 HD22 ASN 131 -14.587 13.395 -6.153 1058 HD22 ASN 131 HD21 ASN 131 -15.298 14.828 -6.884 1059 H GLY 132 H GLY 132 -14.910 12.700 -0.549 1060 HA2 GLY 132 HA2 GLY 132 -15.865 11.692 1.334 1061 HA3 GLY 132 HA3 GLY 132 -17.304 11.219 0.388 1062 H PHE 133 H PHE 133 -15.204 10.277 -1.743 1063 HA PHE 133 HA PHE 133 -15.537 7.551 -1.312 1064 HB2 PHE 133 HB2 PHE 133 -13.247 8.786 -2.854 1065 HB3 PHE 133 HB3 PHE 133 -13.955 7.197 -3.105 1066 HD1 PHE 133 HD2 PHE 133 -16.824 7.623 -3.240 1067 HD2 PHE 133 HD1 PHE 133 -13.634 10.122 -4.714 1068 HE1 PHE 133 HE2 PHE 133 -18.395 8.682 -4.847 1069 HE2 PHE 133 HE1 PHE 133 -15.193 11.122 -6.369 1070 HZ PHE 133 HZ PHE 133 -17.589 10.457 -6.383 1071 H ILE 134 H ILE 134 -14.515 5.942 -0.135 1072 HA ILE 134 HA ILE 134 -12.380 6.812 1.648 1073 HB ILE 134 HB ILE 134 -13.261 3.979 1.325 1074 HG12 ILE 134 HG12 ILE 134 -15.306 5.015 1.658 1075 HG13 ILE 134 HG13 ILE 134 -14.848 4.285 3.177 1076 HG21 ILE 134 HG21 ILE 134 -11.265 4.304 2.705 1077 HG22 ILE 134 HG22 ILE 134 -12.074 5.584 3.640 1078 HG23 ILE 134 HG23 ILE 134 -12.602 3.896 3.771 1079 HD11 ILE 134 HD11 ILE 134 -14.011 7.050 3.257 1080 HD12 ILE 134 HD12 ILE 134 -15.684 6.957 2.664 1081 HD13 ILE 134 HD13 ILE 134 -15.258 6.227 4.220 1082 H ALA 135 H ALA 135 -10.385 6.562 1.475 1083 HA ALA 135 HA ALA 135 -9.041 4.814 -0.571 1084 HB1 ALA 135 HB1 ALA 135 -8.495 7.087 -1.033 1085 HB2 ALA 135 HB2 ALA 135 -8.394 7.504 0.690 1086 HB3 ALA 135 HB3 ALA 135 -7.127 6.529 -0.042 1087 H SER 136 H SER 136 -7.494 3.316 0.245 1088 HA SER 136 HA SER 136 -6.924 3.266 3.162 1089 HB2 SER 136 HB2 SER 136 -9.061 2.012 2.729 1090 HB3 SER 136 HB3 SER 136 -8.156 0.894 1.693 1091 HG SER 136 HG SER 136 -6.996 0.216 3.475 1092 H ASN 137 H ASN 137 -5.004 2.392 3.690 1093 HA ASN 137 HA ASN 137 -2.838 1.760 3.494 1094 HB2 ASN 137 HB2 ASN 137 -3.547 -0.216 1.351 1095 HB3 ASN 137 HB3 ASN 137 -2.290 -0.324 2.559 1096 HD21 ASN 137 HD22 ASN 137 -5.611 -0.976 1.824 1097 HD22 ASN 137 HD21 ASN 137 -5.908 -1.922 3.285 Start of MODEL 20 1 H1 GLY -1 H GLY -1 0.814 -0.498 1.015 2 HA2 GLY -1 HA2 GLY -1 0.809 -0.788 -1.365 3 HA3 GLY -1 HA3 GLY -1 -0.842 -0.867 -0.704 4 H GLY 0 H GLY 0 1.074 0.584 -3.124 5 HA2 GLY 0 HA2 GLY 0 0.836 2.267 -4.579 6 HA3 GLY 0 HA3 GLY 0 -0.875 2.287 -4.202 7 H ALA 1 H ALA 1 -0.502 4.527 -4.677 8 HA ALA 1 HA ALA 1 -0.565 6.131 -2.289 9 HB1 ALA 1 HB1 ALA 1 1.827 6.084 -2.426 10 HB2 ALA 1 HB2 ALA 1 1.800 6.379 -4.181 11 HB3 ALA 1 HB3 ALA 1 1.327 7.649 -3.034 12 H LEU 2 H LEU 2 -0.813 8.467 -2.890 13 HA LEU 2 HA LEU 2 -2.778 8.719 -5.137 14 HB2 LEU 2 HB2 LEU 2 -2.632 9.933 -2.339 15 HB3 LEU 2 HB3 LEU 2 -3.919 10.204 -3.484 16 HG LEU 2 HG LEU 2 -3.277 7.429 -2.400 17 HD11 LEU 2 HD11 LEU 2 -3.819 8.918 -0.534 18 HD12 LEU 2 HD12 LEU 2 -5.348 9.366 -1.323 19 HD13 LEU 2 HD13 LEU 2 -5.049 7.691 -0.814 20 HD21 LEU 2 HD21 LEU 2 -5.723 8.609 -3.790 21 HD22 LEU 2 HD22 LEU 2 -4.597 7.393 -4.438 22 HD23 LEU 2 HD23 LEU 2 -5.641 6.996 -3.068 23 H SER 3 H SER 3 -2.765 10.664 -6.359 24 HA SER 3 HA SER 3 -0.200 12.098 -6.412 25 HB2 SER 3 HB2 SER 3 -1.514 11.488 -8.450 26 HB3 SER 3 HB3 SER 3 -2.750 12.662 -7.950 27 HG SER 3 HG SER 3 -1.070 13.416 -9.470 28 H TYR 4 H TYR 4 -0.101 14.487 -6.440 29 HA TYR 4 HA TYR 4 -0.786 15.665 -3.988 30 HB2 TYR 4 HB2 TYR 4 0.936 16.587 -5.378 31 HB3 TYR 4 HB3 TYR 4 -0.179 16.872 -6.707 32 HD1 TYR 4 HD2 TYR 4 -1.760 18.754 -6.692 33 HD2 TYR 4 HD1 TYR 4 1.031 18.139 -3.458 34 HE1 TYR 4 HE2 TYR 4 -2.237 21.048 -5.835 35 HE2 TYR 4 HE1 TYR 4 0.544 20.410 -2.599 36 HH TYR 4 HH TYR 4 -0.605 22.371 -2.949 37 H GLU 5 H GLU 5 -2.589 15.871 -7.060 38 HA GLU 5 HA GLU 5 -4.610 17.671 -6.227 39 HB2 GLU 5 HB2 GLU 5 -5.771 17.002 -8.231 40 HB3 GLU 5 HB3 GLU 5 -4.047 17.111 -8.544 41 HG2 GLU 5 HG2 GLU 5 -4.449 15.162 -9.625 42 HG3 GLU 5 HG3 GLU 5 -4.085 14.486 -8.051 43 H THR 6 H THR 6 -4.188 14.528 -5.030 44 HA THR 6 HA THR 6 -6.990 13.838 -4.598 45 HB THR 6 HB THR 6 -4.604 12.732 -3.082 46 HG1 THR 6 HG1 THR 6 -4.080 12.469 -5.121 47 HG21 THR 6 HG21 THR 6 -6.904 12.145 -2.298 48 HG22 THR 6 HG22 THR 6 -7.253 11.515 -3.933 49 HG23 THR 6 HG23 THR 6 -6.019 10.754 -2.913 50 H GLU 7 H GLU 7 -8.170 15.202 -3.251 51 HA GLU 7 HA GLU 7 -6.759 16.380 -0.916 52 HB2 GLU 7 HB2 GLU 7 -9.493 17.094 -1.912 53 HB3 GLU 7 HB3 GLU 7 -8.506 17.971 -0.750 54 HG2 GLU 7 HG2 GLU 7 -6.753 18.227 -2.633 55 HG3 GLU 7 HG3 GLU 7 -8.016 17.681 -3.737 56 H ILE 8 H ILE 8 -7.346 16.172 1.133 57 HA ILE 8 HA ILE 8 -9.153 13.882 1.801 58 HB ILE 8 HB ILE 8 -6.567 14.664 3.203 59 HG12 ILE 8 HG12 ILE 8 -5.818 13.913 1.088 60 HG13 ILE 8 HG13 ILE 8 -5.520 12.648 2.267 61 HG21 ILE 8 HG21 ILE 8 -8.147 13.506 4.649 62 HG22 ILE 8 HG22 ILE 8 -8.348 12.208 3.460 63 HG23 ILE 8 HG23 ILE 8 -6.789 12.443 4.274 64 HD11 ILE 8 HD11 ILE 8 -7.598 11.459 1.385 65 HD12 ILE 8 HD12 ILE 8 -7.650 12.682 0.099 66 HD13 ILE 8 HD13 ILE 8 -6.253 11.612 0.235 67 H LEU 9 H LEU 9 -10.845 14.689 2.966 68 HA LEU 9 HA LEU 9 -10.946 17.275 4.154 69 HB2 LEU 9 HB2 LEU 9 -12.814 15.631 3.401 70 HB3 LEU 9 HB3 LEU 9 -12.692 14.918 4.992 71 HG LEU 9 HG LEU 9 -13.077 17.924 4.705 72 HD11 LEU 9 HD11 LEU 9 -14.799 16.829 3.258 73 HD12 LEU 9 HD12 LEU 9 -15.301 15.836 4.640 74 HD13 LEU 9 HD13 LEU 9 -15.508 17.606 4.680 75 HD21 LEU 9 HD21 LEU 9 -14.116 15.987 6.757 76 HD22 LEU 9 HD22 LEU 9 -12.697 17.055 6.949 77 HD23 LEU 9 HD23 LEU 9 -14.306 17.754 6.762 78 H THR 10 H THR 10 -10.109 18.046 6.011 79 HA THR 10 HA THR 10 -9.419 16.156 8.216 80 HB THR 10 HB THR 10 -7.584 17.559 8.847 81 HG1 THR 10 HG1 THR 10 -7.111 19.205 7.048 82 HG21 THR 10 HG21 THR 10 -7.186 15.879 7.021 83 HG22 THR 10 HG22 THR 10 -7.335 17.203 5.846 84 HG23 THR 10 HG23 THR 10 -6.038 17.228 7.060 85 H VAL 11 H VAL 11 -9.495 16.906 10.350 86 HA VAL 11 HA VAL 11 -11.747 18.708 10.949 87 HB VAL 11 HB VAL 11 -9.772 17.446 12.882 88 HG11 VAL 11 HG11 VAL 11 -11.094 19.216 13.951 89 HG12 VAL 11 HG12 VAL 11 -12.596 18.527 13.290 90 HG13 VAL 11 HG13 VAL 11 -11.657 17.641 14.510 91 HG21 VAL 11 HG21 VAL 11 -10.877 15.657 11.563 92 HG22 VAL 11 HG22 VAL 11 -11.439 15.680 13.236 93 HG23 VAL 11 HG23 VAL 11 -12.460 16.368 11.952 94 H GLU 12 H GLU 12 -8.233 18.894 11.034 95 HA GLU 12 HA GLU 12 -8.056 21.316 12.596 96 HB2 GLU 12 HB2 GLU 12 -6.247 19.510 11.062 97 HB3 GLU 12 HB3 GLU 12 -5.648 21.147 11.250 98 HG2 GLU 12 HG2 GLU 12 -6.539 19.323 13.520 99 HG3 GLU 12 HG3 GLU 12 -4.870 19.627 13.044 100 H TYR 13 H TYR 13 -8.341 20.782 9.109 101 HA TYR 13 HA TYR 13 -8.499 23.756 8.731 102 HB2 TYR 13 HB2 TYR 13 -6.966 21.799 6.986 103 HB3 TYR 13 HB3 TYR 13 -7.260 23.485 6.602 104 HD1 TYR 13 HD2 TYR 13 -6.601 25.082 8.859 105 HD2 TYR 13 HD1 TYR 13 -4.712 21.442 7.513 106 HE1 TYR 13 HE2 TYR 13 -4.479 25.780 9.950 107 HE2 TYR 13 HE1 TYR 13 -2.586 22.154 8.596 108 HH TYR 13 HH TYR 13 -2.303 25.246 10.367 109 H GLY 14 H GLY 14 -9.123 20.581 7.118 110 HA2 GLY 14 HA2 GLY 14 -11.558 20.349 6.327 111 HA3 GLY 14 HA3 GLY 14 -11.295 21.893 5.528 112 H LEU 15 H LEU 15 -11.603 21.147 3.523 113 HA LEU 15 HA LEU 15 -10.414 18.858 2.241 114 HB2 LEU 15 HB2 LEU 15 -11.301 21.350 0.762 115 HB3 LEU 15 HB3 LEU 15 -11.491 19.671 0.304 116 HG LEU 15 HG LEU 15 -13.055 21.155 2.475 117 HD11 LEU 15 HD11 LEU 15 -13.535 21.968 0.227 118 HD12 LEU 15 HD12 LEU 15 -13.918 20.307 -0.289 119 HD13 LEU 15 HD13 LEU 15 -14.919 21.115 0.941 120 HD21 LEU 15 HD21 LEU 15 -14.003 18.553 1.297 121 HD22 LEU 15 HD22 LEU 15 -12.790 18.518 2.587 122 HD23 LEU 15 HD23 LEU 15 -14.364 19.307 2.847 123 H LEU 16 H LEU 16 -8.197 18.738 2.299 124 HA LEU 16 HA LEU 16 -6.679 20.764 0.741 125 HB2 LEU 16 HB2 LEU 16 -5.985 19.585 3.463 126 HB3 LEU 16 HB3 LEU 16 -4.777 20.340 2.440 127 HG LEU 16 HG LEU 16 -7.215 21.753 3.602 128 HD11 LEU 16 HD11 LEU 16 -5.473 21.144 5.223 129 HD12 LEU 16 HD12 LEU 16 -4.235 21.927 4.218 130 HD13 LEU 16 HD13 LEU 16 -5.518 22.902 4.963 131 HD21 LEU 16 HD21 LEU 16 -4.872 22.840 1.963 132 HD22 LEU 16 HD22 LEU 16 -6.574 22.792 1.453 133 HD23 LEU 16 HD23 LEU 16 -6.097 23.823 2.799 134 HA PRO 17 HA PRO 17 -4.872 17.387 -1.445 135 HB2 PRO 17 HB2 PRO 17 -2.438 18.436 -2.200 136 HB3 PRO 17 HB3 PRO 17 -4.019 18.927 -2.892 137 HG2 PRO 17 HG2 PRO 17 -2.434 20.285 -0.708 138 HG3 PRO 17 HG3 PRO 17 -3.201 21.019 -2.156 139 HD2 PRO 17 HD2 PRO 17 -4.400 21.065 0.265 140 HD3 PRO 17 HD3 PRO 17 -5.355 20.814 -1.225 141 H ILE 18 H ILE 18 -3.942 15.499 -0.911 142 HA ILE 18 HA ILE 18 -2.522 15.046 1.497 143 HB ILE 18 HB ILE 18 -3.794 13.343 0.215 144 HG12 ILE 18 HG12 ILE 18 -0.938 12.520 0.895 145 HG13 ILE 18 HG13 ILE 18 -2.212 12.829 2.082 146 HG21 ILE 18 HG21 ILE 18 -2.791 13.857 -2.060 147 HG22 ILE 18 HG22 ILE 18 -1.323 13.007 -1.536 148 HG23 ILE 18 HG23 ILE 18 -2.867 12.148 -1.637 149 HD11 ILE 18 HD11 ILE 18 -3.566 10.985 1.041 150 HD12 ILE 18 HD12 ILE 18 -2.168 10.617 -0.002 151 HD13 ILE 18 HD13 ILE 18 -2.023 10.459 1.754 152 H GLY 19 H GLY 19 -1.247 15.833 -1.720 153 HA2 GLY 19 HA2 GLY 19 1.448 15.020 -1.206 154 HA3 GLY 19 HA3 GLY 19 0.947 16.207 -2.417 155 H LYS 20 H LYS 20 -0.280 18.025 -0.404 156 HA LYS 20 HA LYS 20 2.153 19.425 0.430 157 HB2 LYS 20 HB2 LYS 20 -0.186 20.336 -0.400 158 HB3 LYS 20 HB3 LYS 20 -0.635 20.235 1.305 159 HG2 LYS 20 HG2 LYS 20 1.224 21.759 1.885 160 HG3 LYS 20 HG3 LYS 20 1.828 21.688 0.217 161 HD2 LYS 20 HD2 LYS 20 -0.395 22.642 -0.550 162 HD3 LYS 20 HD3 LYS 20 -0.802 22.939 1.141 163 HE2 LYS 20 HE2 LYS 20 1.701 24.014 -0.255 164 HE3 LYS 20 HE3 LYS 20 0.169 24.886 -0.212 165 HZ1 LYS 20 HZ1 LYS 20 0.303 24.938 2.206 166 HZ2 LYS 20 HZ2 LYS 20 1.727 24.122 2.201 167 HZ3 LYS 20 HZ3 LYS 20 1.634 25.621 1.559 168 H ILE 21 H ILE 21 -0.233 17.323 1.970 169 HA ILE 21 HA ILE 21 0.569 17.882 4.683 170 HB ILE 21 HB ILE 21 -0.829 15.483 3.515 171 HG12 ILE 21 HG12 ILE 21 -1.997 17.635 5.333 172 HG13 ILE 21 HG13 ILE 21 -1.961 17.875 3.590 173 HG21 ILE 21 HG21 ILE 21 0.207 14.667 5.483 174 HG22 ILE 21 HG22 ILE 21 -0.284 16.100 6.411 175 HG23 ILE 21 HG23 ILE 21 -1.485 14.920 5.862 176 HD11 ILE 21 HD11 ILE 21 -3.386 15.970 3.194 177 HD12 ILE 21 HD12 ILE 21 -3.375 15.528 4.919 178 HD13 ILE 21 HD13 ILE 21 -4.138 17.038 4.384 179 H VAL 22 H VAL 22 1.683 15.536 2.232 180 HA VAL 22 HA VAL 22 3.604 14.375 4.133 181 HB VAL 22 HB VAL 22 3.132 13.895 1.180 182 HG11 VAL 22 HG11 VAL 22 5.432 13.205 1.851 183 HG12 VAL 22 HG12 VAL 22 4.743 12.236 3.175 184 HG13 VAL 22 HG13 VAL 22 4.398 11.832 1.482 185 HG21 VAL 22 HG21 VAL 22 2.235 12.454 3.731 186 HG22 VAL 22 HG22 VAL 22 1.193 13.246 2.530 187 HG23 VAL 22 HG23 VAL 22 2.062 11.762 2.118 188 H GLU 23 H GLU 23 3.862 16.603 1.320 189 HA GLU 23 HA GLU 23 6.733 16.774 1.392 190 HB2 GLU 23 HB2 GLU 23 4.592 18.645 0.309 191 HB3 GLU 23 HB3 GLU 23 6.309 18.961 0.122 192 HG2 GLU 23 HG2 GLU 23 5.103 16.348 -0.849 193 HG3 GLU 23 HG3 GLU 23 5.068 17.814 -1.824 194 H LYS 24 H LYS 24 4.247 18.436 3.232 195 HA LYS 24 HA LYS 24 6.346 20.071 4.618 196 HB2 LYS 24 HB2 LYS 24 3.369 20.623 4.507 197 HB3 LYS 24 HB3 LYS 24 4.608 21.673 5.146 198 HG2 LYS 24 HG2 LYS 24 4.236 20.879 2.226 199 HG3 LYS 24 HG3 LYS 24 3.773 22.412 2.950 200 HD2 LYS 24 HD2 LYS 24 6.625 21.391 2.607 201 HD3 LYS 24 HD3 LYS 24 5.825 22.645 1.658 202 HE2 LYS 24 HE2 LYS 24 5.558 24.020 3.738 203 HE3 LYS 24 HE3 LYS 24 6.445 22.786 4.643 204 HZ1 LYS 24 HZ1 LYS 24 8.362 23.198 3.184 205 HZ2 LYS 24 HZ2 LYS 24 7.540 24.353 2.366 206 HZ3 LYS 24 HZ3 LYS 24 7.917 24.574 3.939 207 H ARG 25 H ARG 25 4.886 17.273 5.104 208 HA ARG 25 HA ARG 25 4.311 15.914 6.872 209 HB2 ARG 25 HB2 ARG 25 6.373 17.636 8.270 210 HB3 ARG 25 HB3 ARG 25 5.852 16.042 8.803 211 HG2 ARG 25 HG2 ARG 25 7.138 14.926 7.316 212 HG3 ARG 25 HG3 ARG 25 6.859 16.066 5.988 213 HD2 ARG 25 HD2 ARG 25 8.417 17.642 6.845 214 HD3 ARG 25 HD3 ARG 25 8.551 16.792 8.398 215 HE ARG 25 HE ARG 25 9.373 14.987 6.367 216 HH11 ARG 25 HH11 ARG 25 10.557 17.971 7.788 217 HH12 ARG 25 HH12 ARG 25 12.229 17.511 7.588 218 HH21 ARG 25 HH21 ARG 25 11.528 14.454 6.174 219 HH22 ARG 25 HH22 ARG 25 12.755 15.576 6.700 220 H ILE 26 H ILE 26 2.366 17.628 6.552 221 HA ILE 26 HA ILE 26 1.814 19.381 8.799 222 HB ILE 26 HB ILE 26 -0.162 18.400 6.702 223 HG12 ILE 26 HG12 ILE 26 1.633 20.879 6.667 224 HG13 ILE 26 HG13 ILE 26 1.812 19.464 5.630 225 HG21 ILE 26 HG21 ILE 26 -1.417 20.441 7.311 226 HG22 ILE 26 HG22 ILE 26 -1.169 19.438 8.732 227 HG23 ILE 26 HG23 ILE 26 -0.158 20.883 8.500 228 HD11 ILE 26 HD11 ILE 26 -0.469 19.939 4.652 229 HD12 ILE 26 HD12 ILE 26 -0.466 21.477 5.545 230 HD13 ILE 26 HD13 ILE 26 0.772 21.167 4.325 231 H GLU 27 H GLU 27 0.906 18.935 10.688 232 HA GLU 27 HA GLU 27 -0.080 16.181 11.236 233 HB2 GLU 27 HB2 GLU 27 0.204 16.961 13.665 234 HB3 GLU 27 HB3 GLU 27 1.613 16.518 12.708 235 HG2 GLU 27 HG2 GLU 27 2.274 18.776 12.374 236 HG3 GLU 27 HG3 GLU 27 0.738 19.407 12.978 237 H CYS 28 H CYS 28 -2.094 15.912 10.895 238 HA CYS 28 HA CYS 28 -4.124 17.789 12.010 239 HB2 CYS 28 HB2 CYS 28 -3.828 16.801 9.141 240 HB3 CYS 28 HB3 CYS 28 -5.365 17.402 9.761 241 HG CYS 28 HG CYS 28 -4.133 19.216 8.287 242 H THR 29 H THR 29 -6.370 16.725 11.436 243 HA THR 29 HA THR 29 -6.374 13.837 12.262 244 HB THR 29 HB THR 29 -8.650 15.742 12.757 245 HG1 THR 29 HG1 THR 29 -6.938 16.666 13.848 246 HG21 THR 29 HG21 THR 29 -9.003 13.291 13.070 247 HG22 THR 29 HG22 THR 29 -7.760 13.330 14.356 248 HG23 THR 29 HG23 THR 29 -9.267 14.251 14.536 249 H VAL 30 H VAL 30 -7.860 12.523 11.157 250 HA VAL 30 HA VAL 30 -9.053 13.635 8.638 251 HB VAL 30 HB VAL 30 -8.424 11.652 7.433 252 HG11 VAL 30 HG11 VAL 30 -6.823 13.551 7.479 253 HG12 VAL 30 HG12 VAL 30 -5.931 12.743 8.792 254 HG13 VAL 30 HG13 VAL 30 -6.051 11.986 7.193 255 HG21 VAL 30 HG21 VAL 30 -6.917 10.695 9.897 256 HG22 VAL 30 HG22 VAL 30 -8.376 9.946 9.198 257 HG23 VAL 30 HG23 VAL 30 -6.861 9.961 8.288 258 H TYR 31 H TYR 31 -10.765 12.218 7.734 259 HA TYR 31 HA TYR 31 -12.477 11.105 9.905 260 HB2 TYR 31 HB2 TYR 31 -13.122 12.212 7.149 261 HB3 TYR 31 HB3 TYR 31 -14.270 11.325 8.128 262 HD1 TYR 31 HD1 TYR 31 -12.227 14.453 8.017 263 HD2 TYR 31 HD2 TYR 31 -15.490 12.343 9.890 264 HE1 TYR 31 HE1 TYR 31 -12.926 16.549 9.162 265 HE2 TYR 31 HE2 TYR 31 -16.214 14.450 11.003 266 HH TYR 31 HH TYR 31 -14.483 17.538 10.511 267 H SER 32 H SER 32 -13.407 9.099 9.690 268 HA SER 32 HA SER 32 -12.949 7.352 7.377 269 HB2 SER 32 HB2 SER 32 -10.812 7.032 8.323 270 HB3 SER 32 HB3 SER 32 -11.417 7.125 9.977 271 HG SER 32 HG SER 32 -10.888 4.943 8.840 272 H VAL 33 H VAL 33 -14.046 5.234 7.725 273 HA VAL 33 HA VAL 33 -16.374 5.499 9.576 274 HB VAL 33 HB VAL 33 -16.382 3.372 7.468 275 HG11 VAL 33 HG11 VAL 33 -18.115 3.640 9.217 276 HG12 VAL 33 HG12 VAL 33 -18.513 5.242 8.563 277 HG13 VAL 33 HG13 VAL 33 -18.752 3.786 7.568 278 HG21 VAL 33 HG21 VAL 33 -16.872 6.323 6.873 279 HG22 VAL 33 HG22 VAL 33 -15.760 5.221 6.031 280 HG23 VAL 33 HG23 VAL 33 -17.506 4.994 5.892 281 H ASP 34 H ASP 34 -16.467 4.270 11.309 282 HA ASP 34 HA ASP 34 -14.368 2.454 12.043 283 HB2 ASP 34 HB2 ASP 34 -15.903 3.999 13.501 284 HB3 ASP 34 HB3 ASP 34 -17.050 2.666 13.393 285 H ASN 35 H ASN 35 -15.164 0.358 13.225 286 HA ASN 35 HA ASN 35 -15.787 -1.598 11.177 287 HB2 ASN 35 HB2 ASN 35 -15.598 -1.873 14.215 288 HB3 ASN 35 HB3 ASN 35 -15.601 -3.203 13.057 289 HD21 ASN 35 HD22 ASN 35 -13.737 -3.334 11.504 290 HD22 ASN 35 HD21 ASN 35 -12.200 -2.660 12.032 291 H ASN 36 H ASN 36 -17.728 0.108 13.555 292 HA ASN 36 HA ASN 36 -20.135 -1.548 13.125 293 HB2 ASN 36 HB2 ASN 36 -19.651 1.042 14.667 294 HB3 ASN 36 HB3 ASN 36 -21.155 0.121 14.686 295 HD21 ASN 36 HD22 ASN 36 -18.772 0.754 16.678 296 HD22 ASN 36 HD21 ASN 36 -18.607 -0.804 17.481 297 H GLY 37 H GLY 37 -18.664 0.830 11.254 298 HA2 GLY 37 HA2 GLY 37 -19.429 1.875 9.345 299 HA3 GLY 37 HA3 GLY 37 -21.067 1.347 9.670 300 H ASN 38 H ASN 38 -19.307 3.139 12.127 301 HA ASN 38 HA ASN 38 -20.996 5.587 11.700 302 HB2 ASN 38 HB2 ASN 38 -19.484 4.447 14.095 303 HB3 ASN 38 HB3 ASN 38 -19.956 6.140 14.014 304 HD21 ASN 38 HD22 ASN 38 -21.409 2.844 13.771 305 HD22 ASN 38 HD21 ASN 38 -22.932 3.350 14.489 306 H ILE 39 H ILE 39 -20.019 7.474 11.002 307 HA ILE 39 HA ILE 39 -17.195 7.446 10.283 308 HB ILE 39 HB ILE 39 -19.218 9.707 10.130 309 HG12 ILE 39 HG12 ILE 39 -18.212 7.702 8.056 310 HG13 ILE 39 HG13 ILE 39 -19.848 7.790 8.701 311 HG21 ILE 39 HG21 ILE 39 -16.843 10.474 10.235 312 HG22 ILE 39 HG22 ILE 39 -16.445 9.404 8.872 313 HG23 ILE 39 HG23 ILE 39 -17.548 10.785 8.663 314 HD11 ILE 39 HD11 ILE 39 -20.116 10.046 7.648 315 HD12 ILE 39 HD12 ILE 39 -18.518 9.829 6.890 316 HD13 ILE 39 HD13 ILE 39 -19.840 8.727 6.490 317 H TYR 40 H TYR 40 -15.595 8.132 11.420 318 HA TYR 40 HA TYR 40 -15.884 9.844 13.839 319 HB2 TYR 40 HB2 TYR 40 -14.693 8.375 15.226 320 HB3 TYR 40 HB3 TYR 40 -15.895 7.369 14.454 321 HD1 TYR 40 HD1 TYR 40 -15.156 5.932 12.421 322 HD2 TYR 40 HD2 TYR 40 -12.361 7.849 15.086 323 HE1 TYR 40 HE1 TYR 40 -13.338 4.447 11.597 324 HE2 TYR 40 HE2 TYR 40 -10.553 6.357 14.251 325 HH TYR 40 HH TYR 40 -9.958 4.911 12.560 326 H THR 41 H THR 41 -13.473 10.237 14.690 327 HA THR 41 HA THR 41 -11.765 10.956 12.359 328 HB THR 41 HB THR 41 -11.211 13.070 13.664 329 HG1 THR 41 HG1 THR 41 -12.871 13.760 15.054 330 HG21 THR 41 HG21 THR 41 -12.509 13.201 11.665 331 HG22 THR 41 HG22 THR 41 -13.984 12.649 12.497 332 HG23 THR 41 HG23 THR 41 -13.296 14.233 12.875 333 H GLN 42 H GLN 42 -9.600 10.991 12.570 334 HA GLN 42 HA GLN 42 -8.329 10.036 15.074 335 HB2 GLN 42 HB2 GLN 42 -7.327 8.117 13.894 336 HB3 GLN 42 HB3 GLN 42 -9.085 8.044 13.953 337 HG2 GLN 42 HG2 GLN 42 -9.113 8.969 11.556 338 HG3 GLN 42 HG3 GLN 42 -7.362 8.753 11.539 339 HE21 GLN 42 HE22 GLN 42 -8.398 7.390 9.559 340 HE22 GLN 42 HE21 GLN 42 -8.561 5.706 9.966 341 HA PRO 43 HA PRO 43 -5.107 12.701 13.475 342 HB2 PRO 43 HB2 PRO 43 -3.017 12.103 15.116 343 HB3 PRO 43 HB3 PRO 43 -4.480 12.971 15.672 344 HG2 PRO 43 HG2 PRO 43 -3.853 10.015 15.934 345 HG3 PRO 43 HG3 PRO 43 -4.453 11.143 17.196 346 HD2 PRO 43 HD2 PRO 43 -6.122 9.490 15.794 347 HD3 PRO 43 HD3 PRO 43 -6.625 11.127 16.316 348 H VAL 44 H VAL 44 -3.215 12.723 12.198 349 HA VAL 44 HA VAL 44 -2.486 10.370 10.680 350 HB VAL 44 HB VAL 44 -0.949 12.978 11.057 351 HG11 VAL 44 HG11 VAL 44 0.582 11.301 10.207 352 HG12 VAL 44 HG12 VAL 44 -0.633 10.688 9.062 353 HG13 VAL 44 HG13 VAL 44 0.087 12.289 8.839 354 HG21 VAL 44 HG21 VAL 44 -2.827 12.074 8.827 355 HG22 VAL 44 HG22 VAL 44 -3.174 13.344 10.013 356 HG23 VAL 44 HG23 VAL 44 -1.874 13.576 8.843 357 H ALA 45 H ALA 45 -1.009 8.793 11.070 358 HA ALA 45 HA ALA 45 0.493 8.817 13.632 359 HB1 ALA 45 HB1 ALA 45 -0.820 6.830 12.932 360 HB2 ALA 45 HB2 ALA 45 0.212 6.650 11.503 361 HB3 ALA 45 HB3 ALA 45 0.918 6.472 13.114 362 H GLN 46 H GLN 46 1.142 8.532 10.115 363 HA GLN 46 HA GLN 46 3.863 9.628 10.398 364 HB2 GLN 46 HB2 GLN 46 3.288 6.833 9.320 365 HB3 GLN 46 HB3 GLN 46 4.799 7.688 9.049 366 HG2 GLN 46 HG2 GLN 46 3.736 6.751 11.728 367 HG3 GLN 46 HG3 GLN 46 5.060 6.059 10.804 368 HE21 GLN 46 HE22 GLN 46 5.101 7.158 13.578 369 HE22 GLN 46 HE21 GLN 46 6.350 8.397 13.535 370 H TRP 47 H TRP 47 4.919 9.681 8.170 371 HA TRP 47 HA TRP 47 2.988 10.348 5.978 372 HB2 TRP 47 HB2 TRP 47 5.375 12.018 6.867 373 HB3 TRP 47 HB3 TRP 47 4.345 12.354 5.490 374 HD1 TRP 47 HD1 TRP 47 2.248 13.794 5.891 375 HE1 TRP 47 HE1 TRP 47 1.196 14.984 7.916 376 HE3 TRP 47 HE3 TRP 47 5.060 11.678 9.623 377 HZ2 TRP 47 HZ2 TRP 47 1.347 14.768 10.778 378 HZ3 TRP 47 HZ3 TRP 47 4.521 12.133 12.004 379 HH2 TRP 47 HH2 TRP 47 2.649 13.666 12.595 380 H HIS 48 H HIS 48 3.574 9.375 4.079 381 HA HIS 48 HA HIS 48 6.407 8.500 3.708 382 HB2 HIS 48 HB2 HIS 48 3.993 6.869 2.909 383 HB3 HIS 48 HB3 HIS 48 5.675 6.375 2.927 384 HD1 HIS 48 HD1 HIS 48 6.702 5.887 5.497 385 HD2 HIS 48 HD2 HIS 48 2.557 6.487 5.063 386 HE1 HIS 48 HE1 HIS 48 5.625 5.013 7.637 387 H ASP 49 H ASP 49 7.255 8.707 1.753 388 HA ASP 49 HA ASP 49 5.616 9.864 -0.456 389 HB2 ASP 49 HB2 ASP 49 7.461 11.382 -0.934 390 HB3 ASP 49 HB3 ASP 49 6.735 11.667 0.634 391 H ARG 50 H ARG 50 5.650 8.735 -2.198 392 HA ARG 50 HA ARG 50 7.519 6.491 -2.633 393 HB2 ARG 50 HB2 ARG 50 5.215 7.556 -4.261 394 HB3 ARG 50 HB3 ARG 50 6.043 6.020 -4.501 395 HG2 ARG 50 HG2 ARG 50 4.357 6.830 -2.085 396 HG3 ARG 50 HG3 ARG 50 3.927 5.664 -3.312 397 HD2 ARG 50 HD2 ARG 50 6.144 5.359 -1.256 398 HD3 ARG 50 HD3 ARG 50 4.579 4.536 -1.277 399 HE ARG 50 HE ARG 50 6.053 4.022 -3.730 400 HH11 ARG 50 HH11 ARG 50 6.065 2.993 -0.379 401 HH12 ARG 50 HH12 ARG 50 6.718 1.426 -0.796 402 HH21 ARG 50 HH21 ARG 50 6.738 2.056 -4.194 403 HH22 ARG 50 HH22 ARG 50 7.120 0.910 -2.922 404 H GLY 51 H GLY 51 6.889 9.646 -4.039 405 HA2 GLY 51 HA2 GLY 51 8.575 11.006 -4.996 406 HA3 GLY 51 HA3 GLY 51 9.520 9.584 -5.402 407 H GLU 52 H GLU 52 7.756 8.031 -6.894 408 HA GLU 52 HA GLU 52 6.439 9.410 -9.063 409 HB2 GLU 52 HB2 GLU 52 9.334 8.606 -9.561 410 HB3 GLU 52 HB3 GLU 52 8.095 8.686 -10.816 411 HG2 GLU 52 HG2 GLU 52 7.736 11.113 -10.188 412 HG3 GLU 52 HG3 GLU 52 9.281 10.999 -9.311 413 H GLN 53 H GLN 53 4.912 7.735 -8.945 414 HA GLN 53 HA GLN 53 5.812 5.147 -10.166 415 HB2 GLN 53 HB2 GLN 53 3.650 5.634 -8.104 416 HB3 GLN 53 HB3 GLN 53 4.084 4.049 -8.797 417 HG2 GLN 53 HG2 GLN 53 6.426 4.363 -7.912 418 HG3 GLN 53 HG3 GLN 53 5.877 5.857 -7.111 419 HE21 GLN 53 HE22 GLN 53 3.333 4.953 -6.089 420 HE22 GLN 53 HE21 GLN 53 4.019 4.334 -4.653 421 H GLU 54 H GLU 54 3.946 3.929 -11.198 422 HA GLU 54 HA GLU 54 2.956 5.568 -13.332 423 HB2 GLU 54 HB2 GLU 54 1.806 3.422 -14.061 424 HB3 GLU 54 HB3 GLU 54 3.564 3.450 -13.991 425 HG2 GLU 54 HG2 GLU 54 3.632 2.097 -12.020 426 HG3 GLU 54 HG3 GLU 54 1.904 2.295 -11.718 427 H VAL 55 H VAL 55 1.466 7.039 -13.006 428 HA VAL 55 HA VAL 55 -0.938 6.477 -11.357 429 HB VAL 55 HB VAL 55 -0.101 9.102 -12.646 430 HG11 VAL 55 HG11 VAL 55 -2.508 8.966 -11.940 431 HG12 VAL 55 HG12 VAL 55 -1.959 8.547 -10.302 432 HG13 VAL 55 HG13 VAL 55 -1.564 10.128 -11.008 433 HG21 VAL 55 HG21 VAL 55 0.537 7.887 -9.932 434 HG22 VAL 55 HG22 VAL 55 1.645 8.628 -11.108 435 HG23 VAL 55 HG23 VAL 55 0.531 9.641 -10.188 436 H PHE 56 H PHE 56 -2.965 6.430 -12.079 437 HA PHE 56 HA PHE 56 -3.546 6.749 -15.002 438 HB2 PHE 56 HB2 PHE 56 -4.618 4.735 -12.991 439 HB3 PHE 56 HB3 PHE 56 -5.313 5.023 -14.580 440 HD1 PHE 56 HD1 PHE 56 -2.096 3.961 -12.924 441 HD2 PHE 56 HD2 PHE 56 -4.593 3.786 -16.442 442 HE1 PHE 56 HE1 PHE 56 -0.570 2.288 -13.928 443 HE2 PHE 56 HE2 PHE 56 -3.075 2.087 -17.425 444 HZ PHE 56 HZ PHE 56 -1.051 1.350 -16.181 445 H GLU 57 H GLU 57 -5.295 7.906 -15.551 446 HA GLU 57 HA GLU 57 -6.688 9.680 -13.804 447 HB2 GLU 57 HB2 GLU 57 -6.352 9.854 -16.323 448 HB3 GLU 57 HB3 GLU 57 -7.504 8.547 -16.513 449 HG2 GLU 57 HG2 GLU 57 -8.872 10.408 -14.886 450 HG3 GLU 57 HG3 GLU 57 -7.941 11.414 -15.988 451 H TYR 58 H TYR 58 -8.233 9.222 -12.369 452 HA TYR 58 HA TYR 58 -10.119 6.966 -12.787 453 HB2 TYR 58 HB2 TYR 58 -8.687 6.397 -11.027 454 HB3 TYR 58 HB3 TYR 58 -8.624 8.036 -10.394 455 HD1 TYR 58 HD1 TYR 58 -11.863 6.411 -11.252 456 HD2 TYR 58 HD2 TYR 58 -8.998 7.287 -8.138 457 HE1 TYR 58 HE1 TYR 58 -13.514 5.776 -9.541 458 HE2 TYR 58 HE2 TYR 58 -10.717 6.741 -6.417 459 HH TYR 58 HH TYR 58 -14.042 5.823 -7.358 460 H CYS 59 H CYS 59 -11.429 8.325 -14.058 461 HA CYS 59 HA CYS 59 -12.811 10.601 -12.758 462 HB2 CYS 59 HB2 CYS 59 -12.151 10.582 -15.208 463 HB3 CYS 59 HB3 CYS 59 -13.332 9.290 -15.460 464 HG CYS 59 HG CYS 59 -15.413 10.675 -14.509 465 H LEU 60 H LEU 60 -14.947 10.558 -12.149 466 HA LEU 60 HA LEU 60 -16.345 7.909 -12.008 467 HB2 LEU 60 HB2 LEU 60 -15.877 10.045 -10.066 468 HB3 LEU 60 HB3 LEU 60 -17.573 9.918 -10.371 469 HG LEU 60 HG LEU 60 -17.701 7.613 -9.726 470 HD11 LEU 60 HD11 LEU 60 -15.455 6.807 -10.425 471 HD12 LEU 60 HD12 LEU 60 -14.728 7.787 -9.141 472 HD13 LEU 60 HD13 LEU 60 -15.805 6.422 -8.735 473 HD21 LEU 60 HD21 LEU 60 -16.026 9.142 -7.694 474 HD22 LEU 60 HD22 LEU 60 -17.754 9.418 -7.967 475 HD23 LEU 60 HD23 LEU 60 -17.202 7.850 -7.349 476 H GLU 61 H GLU 61 -18.680 7.950 -12.012 477 HA GLU 61 HA GLU 61 -19.676 8.986 -14.474 478 HB2 GLU 61 HB2 GLU 61 -20.906 7.641 -12.065 479 HB3 GLU 61 HB3 GLU 61 -21.927 8.146 -13.406 480 HG2 GLU 61 HG2 GLU 61 -19.514 6.356 -13.864 481 HG3 GLU 61 HG3 GLU 61 -21.051 5.717 -13.302 482 H ASP 62 H ASP 62 -19.752 10.480 -11.303 483 HA ASP 62 HA ASP 62 -21.809 12.439 -12.095 484 HB2 ASP 62 HB2 ASP 62 -21.731 13.272 -9.967 485 HB3 ASP 62 HB3 ASP 62 -21.462 11.566 -9.703 486 H GLY 63 H GLY 63 -18.365 12.120 -12.360 487 HA2 GLY 63 HA2 GLY 63 -17.230 13.557 -13.947 488 HA3 GLY 63 HA3 GLY 63 -18.114 14.949 -13.325 489 H SER 64 H SER 64 -17.253 13.170 -10.583 490 HA SER 64 HA SER 64 -15.082 14.865 -9.769 491 HB2 SER 64 HB2 SER 64 -16.084 12.156 -8.832 492 HB3 SER 64 HB3 SER 64 -14.617 12.887 -8.162 493 HG SER 64 HG SER 64 -17.087 13.407 -7.490 494 H LEU 65 H LEU 65 -12.899 14.642 -9.854 495 HA LEU 65 HA LEU 65 -11.784 12.518 -11.635 496 HB2 LEU 65 HB2 LEU 65 -12.153 14.954 -12.571 497 HB3 LEU 65 HB3 LEU 65 -10.795 15.382 -11.535 498 HG LEU 65 HG LEU 65 -9.515 13.442 -12.734 499 HD11 LEU 65 HD11 LEU 65 -11.499 12.381 -13.791 500 HD12 LEU 65 HD12 LEU 65 -11.835 13.871 -14.687 501 HD13 LEU 65 HD13 LEU 65 -10.357 12.947 -15.030 502 HD21 LEU 65 HD21 LEU 65 -10.360 15.920 -14.294 503 HD22 LEU 65 HD22 LEU 65 -9.014 15.804 -13.133 504 HD23 LEU 65 HD23 LEU 65 -8.949 14.894 -14.653 505 H ILE 66 H ILE 66 -10.120 11.459 -10.889 506 HA ILE 66 HA ILE 66 -8.573 12.378 -8.522 507 HB ILE 66 HB ILE 66 -9.850 9.642 -8.875 508 HG12 ILE 66 HG12 ILE 66 -10.739 11.742 -6.852 509 HG13 ILE 66 HG13 ILE 66 -11.568 11.482 -8.383 510 HG21 ILE 66 HG21 ILE 66 -7.812 9.520 -7.544 511 HG22 ILE 66 HG22 ILE 66 -8.336 10.892 -6.541 512 HG23 ILE 66 HG23 ILE 66 -9.176 9.334 -6.468 513 HD11 ILE 66 HD11 ILE 66 -12.058 9.159 -7.814 514 HD12 ILE 66 HD12 ILE 66 -11.380 9.423 -6.181 515 HD13 ILE 66 HD13 ILE 66 -12.792 10.335 -6.732 516 H ARG 67 H ARG 67 -6.474 11.527 -8.428 517 HA ARG 67 HA ARG 67 -5.511 9.843 -10.728 518 HB2 ARG 67 HB2 ARG 67 -4.257 12.379 -9.594 519 HB3 ARG 67 HB3 ARG 67 -3.479 11.279 -10.737 520 HG2 ARG 67 HG2 ARG 67 -5.416 11.650 -12.306 521 HG3 ARG 67 HG3 ARG 67 -5.996 12.924 -11.232 522 HD2 ARG 67 HD2 ARG 67 -4.082 14.284 -11.600 523 HD3 ARG 67 HD3 ARG 67 -3.155 12.948 -12.294 524 HE ARG 67 HE ARG 67 -5.388 13.271 -13.966 525 HH11 ARG 67 HH11 ARG 67 -2.517 15.106 -13.128 526 HH12 ARG 67 HH12 ARG 67 -2.514 15.972 -14.643 527 HH21 ARG 67 HH21 ARG 67 -5.354 14.464 -15.862 528 HH22 ARG 67 HH22 ARG 67 -4.058 15.590 -16.153 529 H ALA 68 H ALA 68 -4.907 7.978 -9.951 530 HA ALA 68 HA ALA 68 -3.112 7.820 -7.587 531 HB1 ALA 68 HB1 ALA 68 -5.437 7.565 -6.760 532 HB2 ALA 68 HB2 ALA 68 -5.688 6.212 -7.887 533 HB3 ALA 68 HB3 ALA 68 -4.499 6.071 -6.571 534 H THR 69 H THR 69 -2.398 5.538 -7.256 535 HA THR 69 HA THR 69 -1.351 4.390 -9.803 536 HB THR 69 HB THR 69 -0.082 2.893 -8.089 537 HG1 THR 69 HG1 THR 69 -0.794 5.066 -6.427 538 HG21 THR 69 HG21 THR 69 1.133 4.606 -9.259 539 HG22 THR 69 HG22 THR 69 0.444 5.890 -8.237 540 HG23 THR 69 HG23 THR 69 1.563 4.682 -7.547 541 H LYS 70 H LYS 70 -1.646 2.230 -10.405 542 HA LYS 70 HA LYS 70 -4.162 0.989 -9.777 543 HB2 LYS 70 HB2 LYS 70 -1.721 0.192 -11.361 544 HB3 LYS 70 HB3 LYS 70 -2.893 -1.057 -10.932 545 HG2 LYS 70 HG2 LYS 70 -4.725 0.304 -11.896 546 HG3 LYS 70 HG3 LYS 70 -3.538 1.502 -12.446 547 HD2 LYS 70 HD2 LYS 70 -2.480 -0.180 -13.897 548 HD3 LYS 70 HD3 LYS 70 -3.522 -1.450 -13.227 549 HE2 LYS 70 HE2 LYS 70 -5.532 -0.168 -14.067 550 HE3 LYS 70 HE3 LYS 70 -4.430 0.951 -14.884 551 HZ1 LYS 70 HZ1 LYS 70 -3.564 -1.009 -16.126 552 HZ2 LYS 70 HZ2 LYS 70 -4.660 -1.975 -15.371 553 HZ3 LYS 70 HZ3 LYS 70 -5.167 -0.804 -16.389 554 H ASP 71 H ASP 71 -1.275 0.829 -7.979 555 HA ASP 71 HA ASP 71 -1.912 -1.729 -6.641 556 HB2 ASP 71 HB2 ASP 71 0.271 0.362 -6.228 557 HB3 ASP 71 HB3 ASP 71 0.122 -1.113 -5.282 558 H HIS 72 H HIS 72 -2.903 1.574 -6.272 559 HA HIS 72 HA HIS 72 -2.914 1.537 -3.360 560 HB2 HIS 72 HB2 HIS 72 -2.571 3.631 -4.723 561 HB3 HIS 72 HB3 HIS 72 -4.223 3.499 -5.300 562 HD1 HIS 72 HD1 HIS 72 -6.143 4.005 -3.354 563 HD2 HIS 72 HD2 HIS 72 -2.142 4.230 -2.108 564 HE1 HIS 72 HE1 HIS 72 -6.161 4.851 -0.969 565 H LYS 73 H LYS 73 -4.706 1.057 -2.048 566 HA LYS 73 HA LYS 73 -7.068 -0.132 -3.397 567 HB2 LYS 73 HB2 LYS 73 -6.162 -0.298 -0.492 568 HB3 LYS 73 HB3 LYS 73 -7.591 -1.060 -1.176 569 HG2 LYS 73 HG2 LYS 73 -6.300 -2.846 -1.486 570 HG3 LYS 73 HG3 LYS 73 -5.715 -2.019 -2.922 571 HD2 LYS 73 HD2 LYS 73 -3.745 -1.204 -1.661 572 HD3 LYS 73 HD3 LYS 73 -4.402 -1.927 -0.168 573 HE2 LYS 73 HE2 LYS 73 -4.454 -4.155 -1.366 574 HE3 LYS 73 HE3 LYS 73 -3.605 -3.397 -2.721 575 HZ1 LYS 73 HZ1 LYS 73 -1.720 -3.000 -1.269 576 HZ2 LYS 73 HZ2 LYS 73 -2.534 -3.544 0.058 577 HZ3 LYS 73 HZ3 LYS 73 -2.121 -4.573 -1.140 578 H PHE 74 H PHE 74 -9.182 0.267 -2.832 579 HA PHE 74 HA PHE 74 -9.764 2.838 -1.400 580 HB2 PHE 74 HB2 PHE 74 -10.686 1.993 -4.166 581 HB3 PHE 74 HB3 PHE 74 -11.474 3.229 -3.210 582 HD1 PHE 74 HD2 PHE 74 -8.261 2.358 -4.941 583 HD2 PHE 74 HD1 PHE 74 -10.634 5.452 -3.099 584 HE1 PHE 74 HE2 PHE 74 -6.716 4.079 -5.836 585 HE2 PHE 74 HE1 PHE 74 -9.063 7.171 -3.963 586 HZ PHE 74 HZ PHE 74 -7.107 6.487 -5.335 587 H MET 75 H MET 75 -11.465 2.714 -0.022 588 HA MET 75 HA MET 75 -12.458 0.025 0.507 589 HB2 MET 75 HB2 MET 75 -11.842 1.918 2.234 590 HB3 MET 75 HB3 MET 75 -13.528 2.408 2.001 591 HG2 MET 75 HG2 MET 75 -14.334 0.225 2.592 592 HG3 MET 75 HG3 MET 75 -12.691 -0.410 2.695 593 HE1 MET 75 HE1 MET 75 -15.453 1.778 4.301 594 HE2 MET 75 HE2 MET 75 -14.777 2.244 5.875 595 HE3 MET 75 HE3 MET 75 -14.212 3.051 4.403 596 H THR 76 H THR 76 -14.054 -0.832 -0.644 597 HA THR 76 HA THR 76 -15.990 0.735 -2.111 598 HB THR 76 HB THR 76 -17.015 -1.377 -2.717 599 HG1 THR 76 HG1 THR 76 -16.056 -3.281 -1.874 600 HG21 THR 76 HG21 THR 76 -14.947 -0.608 -3.834 601 HG22 THR 76 HG22 THR 76 -13.984 -1.607 -2.719 602 HG23 THR 76 HG23 THR 76 -15.122 -2.373 -3.850 603 H VAL 77 H VAL 77 -18.381 0.194 -1.962 604 HA VAL 77 HA VAL 77 -19.482 1.064 0.444 605 HB VAL 77 HB VAL 77 -21.678 0.159 -0.416 606 HG11 VAL 77 HG11 VAL 77 -20.937 2.391 -1.026 607 HG12 VAL 77 HG12 VAL 77 -19.983 1.749 -2.378 608 HG13 VAL 77 HG13 VAL 77 -21.749 1.600 -2.402 609 HG21 VAL 77 HG21 VAL 77 -20.058 -0.764 -2.839 610 HG22 VAL 77 HG22 VAL 77 -20.755 -1.855 -1.619 611 HG23 VAL 77 HG23 VAL 77 -21.816 -0.850 -2.614 612 H ASP 78 H ASP 78 -18.518 -2.209 -0.288 613 HA ASP 78 HA ASP 78 -19.994 -3.358 2.021 614 HB2 ASP 78 HB2 ASP 78 -18.227 -4.528 -0.157 615 HB3 ASP 78 HB3 ASP 78 -18.831 -5.478 1.199 616 H GLY 79 H GLY 79 -17.068 -1.703 1.624 617 HA2 GLY 79 HA2 GLY 79 -15.619 -1.230 3.422 618 HA3 GLY 79 HA3 GLY 79 -16.043 -2.738 4.218 619 H GLN 80 H GLN 80 -15.383 -3.268 0.896 620 HA GLN 80 HA GLN 80 -13.052 -4.873 1.613 621 HB2 GLN 80 HB2 GLN 80 -14.242 -4.351 -1.141 622 HB3 GLN 80 HB3 GLN 80 -13.110 -5.624 -0.678 623 HG2 GLN 80 HG2 GLN 80 -14.840 -6.599 0.831 624 HG3 GLN 80 HG3 GLN 80 -15.989 -5.375 0.282 625 HE21 GLN 80 HE22 GLN 80 -17.126 -5.779 -1.686 626 HE22 GLN 80 HE21 GLN 80 -16.739 -7.141 -2.725 627 H MET 81 H MET 81 -10.987 -4.255 1.528 628 HA MET 81 HA MET 81 -10.148 -1.775 0.147 629 HB2 MET 81 HB2 MET 81 -7.958 -2.207 1.231 630 HB3 MET 81 HB3 MET 81 -9.286 -1.889 2.326 631 HG2 MET 81 HG2 MET 81 -8.344 -4.719 1.714 632 HG3 MET 81 HG3 MET 81 -7.580 -3.722 2.931 633 HE1 MET 81 HE1 MET 81 -8.517 -3.008 5.127 634 HE2 MET 81 HE2 MET 81 -9.976 -2.227 4.472 635 HE3 MET 81 HE3 MET 81 -10.119 -3.423 5.776 636 H LEU 82 H LEU 82 -10.603 -2.566 -1.988 637 HA LEU 82 HA LEU 82 -8.661 -4.602 -3.013 638 HB2 LEU 82 HB2 LEU 82 -11.080 -3.519 -4.474 639 HB3 LEU 82 HB3 LEU 82 -10.111 -4.927 -4.873 640 HG LEU 82 HG LEU 82 -11.974 -4.633 -2.481 641 HD11 LEU 82 HD11 LEU 82 -13.148 -4.963 -4.598 642 HD12 LEU 82 HD12 LEU 82 -12.128 -6.379 -4.981 643 HD13 LEU 82 HD13 LEU 82 -13.266 -6.425 -3.606 644 HD21 LEU 82 HD21 LEU 82 -10.274 -7.033 -3.302 645 HD22 LEU 82 HD22 LEU 82 -10.111 -6.078 -1.801 646 HD23 LEU 82 HD23 LEU 82 -11.564 -7.051 -2.073 647 HA PRO 83 HA PRO 83 -6.494 -1.327 -5.186 648 HB2 PRO 83 HB2 PRO 83 -5.466 -2.700 -7.344 649 HB3 PRO 83 HB3 PRO 83 -4.786 -2.782 -5.696 650 HG2 PRO 83 HG2 PRO 83 -6.688 -4.695 -7.071 651 HG3 PRO 83 HG3 PRO 83 -5.252 -5.088 -6.075 652 HD2 PRO 83 HD2 PRO 83 -7.816 -5.183 -5.112 653 HD3 PRO 83 HD3 PRO 83 -6.440 -4.703 -4.077 654 H ILE 84 H ILE 84 -6.900 0.100 -6.892 655 HA ILE 84 HA ILE 84 -9.531 0.093 -7.885 656 HB ILE 84 HB ILE 84 -8.157 2.065 -7.430 657 HG12 ILE 84 HG12 ILE 84 -9.267 2.032 -10.262 658 HG13 ILE 84 HG13 ILE 84 -10.224 2.048 -8.771 659 HG21 ILE 84 HG21 ILE 84 -6.013 1.368 -8.429 660 HG22 ILE 84 HG22 ILE 84 -6.724 1.479 -10.057 661 HG23 ILE 84 HG23 ILE 84 -6.533 2.930 -9.052 662 HD11 ILE 84 HD11 ILE 84 -9.261 4.191 -8.137 663 HD12 ILE 84 HD12 ILE 84 -8.322 4.239 -9.661 664 HD13 ILE 84 HD13 ILE 84 -10.092 4.239 -9.707 665 H ASP 85 H ASP 85 -6.734 -1.257 -9.441 666 HA ASP 85 HA ASP 85 -7.728 -1.706 -12.096 667 HB2 ASP 85 HB2 ASP 85 -5.376 -1.994 -11.293 668 HB3 ASP 85 HB3 ASP 85 -5.886 -3.426 -10.398 669 H GLU 86 H GLU 86 -8.532 -3.250 -9.036 670 HA GLU 86 HA GLU 86 -10.002 -5.475 -10.319 671 HB2 GLU 86 HB2 GLU 86 -8.760 -5.136 -7.812 672 HB3 GLU 86 HB3 GLU 86 -10.464 -4.949 -7.443 673 HG2 GLU 86 HG2 GLU 86 -10.025 -7.231 -7.154 674 HG3 GLU 86 HG3 GLU 86 -10.836 -7.148 -8.713 675 H ILE 87 H ILE 87 -10.680 -2.345 -8.651 676 HA ILE 87 HA ILE 87 -13.474 -2.722 -8.302 677 HB ILE 87 HB ILE 87 -11.805 -0.188 -8.593 678 HG12 ILE 87 HG12 ILE 87 -12.752 -1.759 -6.143 679 HG13 ILE 87 HG13 ILE 87 -11.104 -1.702 -6.764 680 HG21 ILE 87 HG21 ILE 87 -14.243 0.285 -8.953 681 HG22 ILE 87 HG22 ILE 87 -14.583 -0.471 -7.382 682 HG23 ILE 87 HG23 ILE 87 -13.620 1.018 -7.488 683 HD11 ILE 87 HD11 ILE 87 -11.035 0.757 -6.308 684 HD12 ILE 87 HD12 ILE 87 -12.611 0.596 -5.489 685 HD13 ILE 87 HD13 ILE 87 -11.202 -0.278 -4.875 686 H PHE 88 H PHE 88 -11.621 -1.394 -11.019 687 HA PHE 88 HA PHE 88 -13.830 -0.542 -12.618 688 HB2 PHE 88 HB2 PHE 88 -11.426 0.004 -13.004 689 HB3 PHE 88 HB3 PHE 88 -11.151 -1.641 -13.536 690 HD1 PHE 88 HD2 PHE 88 -12.768 1.621 -14.402 691 HD2 PHE 88 HD1 PHE 88 -12.003 -2.425 -15.704 692 HE1 PHE 88 HE2 PHE 88 -13.349 2.258 -16.718 693 HE2 PHE 88 HE1 PHE 88 -12.596 -1.777 -18.034 694 HZ PHE 88 HZ PHE 88 -13.260 0.568 -18.542 695 H GLU 89 H GLU 89 -12.495 -3.844 -12.233 696 HA GLU 89 HA GLU 89 -14.083 -4.925 -14.464 697 HB2 GLU 89 HB2 GLU 89 -12.362 -6.172 -12.288 698 HB3 GLU 89 HB3 GLU 89 -13.402 -7.141 -13.331 699 HG2 GLU 89 HG2 GLU 89 -12.234 -6.011 -15.322 700 HG3 GLU 89 HG3 GLU 89 -11.035 -5.431 -14.160 701 H ARG 90 H ARG 90 -14.307 -5.207 -10.837 702 HA ARG 90 HA ARG 90 -16.851 -6.602 -11.009 703 HB2 ARG 90 HB2 ARG 90 -15.511 -5.162 -8.676 704 HB3 ARG 90 HB3 ARG 90 -16.992 -6.118 -8.594 705 HG2 ARG 90 HG2 ARG 90 -15.587 -7.682 -7.915 706 HG3 ARG 90 HG3 ARG 90 -15.590 -8.052 -9.633 707 HD2 ARG 90 HD2 ARG 90 -13.469 -6.159 -8.735 708 HD3 ARG 90 HD3 ARG 90 -13.387 -7.720 -7.958 709 HE ARG 90 HE ARG 90 -12.627 -7.139 -10.663 710 HH11 ARG 90 HH11 ARG 90 -13.964 -9.739 -8.722 711 HH12 ARG 90 HH12 ARG 90 -13.262 -10.977 -9.730 712 HH21 ARG 90 HH21 ARG 90 -11.728 -8.818 -11.923 713 HH22 ARG 90 HH22 ARG 90 -12.075 -10.459 -11.466 714 H GLU 91 H GLU 91 -16.099 -3.279 -11.411 715 HA GLU 91 HA GLU 91 -17.285 -1.379 -11.491 716 HB2 GLU 91 HB2 GLU 91 -19.771 -3.078 -11.927 717 HB3 GLU 91 HB3 GLU 91 -19.550 -1.375 -12.324 718 HG2 GLU 91 HG2 GLU 91 -17.655 -2.089 -13.879 719 HG3 GLU 91 HG3 GLU 91 -18.187 -3.756 -13.634 720 H LEU 92 H LEU 92 -16.702 -2.468 -8.965 721 HA LEU 92 HA LEU 92 -18.953 -2.153 -7.143 722 HB2 LEU 92 HB2 LEU 92 -15.944 -2.420 -6.796 723 HB3 LEU 92 HB3 LEU 92 -16.996 -2.081 -5.424 724 HG LEU 92 HG LEU 92 -17.454 -4.455 -7.248 725 HD11 LEU 92 HD11 LEU 92 -15.196 -4.609 -6.210 726 HD12 LEU 92 HD12 LEU 92 -15.940 -4.430 -4.602 727 HD13 LEU 92 HD13 LEU 92 -16.307 -5.850 -5.604 728 HD21 LEU 92 HD21 LEU 92 -18.374 -3.834 -4.405 729 HD22 LEU 92 HD22 LEU 92 -19.395 -3.859 -5.858 730 HD23 LEU 92 HD23 LEU 92 -18.670 -5.355 -5.272 731 H ASP 93 H ASP 93 -19.535 -0.479 -5.910 732 HA ASP 93 HA ASP 93 -18.567 2.202 -6.671 733 HB2 ASP 93 HB2 ASP 93 -20.739 1.433 -4.700 734 HB3 ASP 93 HB3 ASP 93 -20.495 3.000 -5.468 735 H LEU 94 H LEU 94 -17.546 3.663 -5.247 736 HA LEU 94 HA LEU 94 -16.352 2.653 -2.774 737 HB2 LEU 94 HB2 LEU 94 -16.272 5.310 -4.262 738 HB3 LEU 94 HB3 LEU 94 -15.621 5.101 -2.636 739 HG LEU 94 HG LEU 94 -14.258 3.142 -3.519 740 HD11 LEU 94 HD11 LEU 94 -15.187 2.606 -5.638 741 HD12 LEU 94 HD12 LEU 94 -15.096 4.294 -6.187 742 HD13 LEU 94 HD13 LEU 94 -13.613 3.335 -5.950 743 HD21 LEU 94 HD21 LEU 94 -13.804 5.996 -4.437 744 HD22 LEU 94 HD22 LEU 94 -13.224 5.231 -2.939 745 HD23 LEU 94 HD23 LEU 94 -12.553 4.752 -4.508 746 H MET 95 H MET 95 -16.665 3.542 -0.677 747 HA MET 95 HA MET 95 -19.430 4.208 -0.048 748 HB2 MET 95 HB2 MET 95 -17.674 2.850 1.317 749 HB3 MET 95 HB3 MET 95 -17.092 4.425 1.870 750 HG2 MET 95 HG2 MET 95 -19.340 4.971 2.700 751 HG3 MET 95 HG3 MET 95 -19.961 3.429 2.091 752 HE1 MET 95 HE1 MET 95 -19.175 1.053 3.049 753 HE2 MET 95 HE2 MET 95 -17.430 1.405 3.041 754 HE3 MET 95 HE3 MET 95 -18.215 0.840 4.528 755 H ARG 96 H ARG 96 -20.205 6.235 0.758 756 HA ARG 96 HA ARG 96 -18.413 8.606 0.463 757 HB2 ARG 96 HB2 ARG 96 -20.335 9.894 -0.393 758 HB3 ARG 96 HB3 ARG 96 -19.766 8.662 -1.476 759 HG2 ARG 96 HG2 ARG 96 -22.141 8.172 0.339 760 HG3 ARG 96 HG3 ARG 96 -22.277 9.025 -1.192 761 HD2 ARG 96 HD2 ARG 96 -22.615 7.039 -2.166 762 HD3 ARG 96 HD3 ARG 96 -20.884 6.843 -2.049 763 HE ARG 96 HE ARG 96 -21.314 5.050 -0.664 764 HH11 ARG 96 HH11 ARG 96 -24.185 7.027 -0.504 765 HH12 ARG 96 HH12 ARG 96 -24.958 5.977 0.661 766 HH21 ARG 96 HH21 ARG 96 -22.314 3.803 0.939 767 HH22 ARG 96 HH22 ARG 96 -23.939 4.194 1.398 768 H VAL 97 H VAL 97 -19.202 10.562 1.450 769 HA VAL 97 HA VAL 97 -20.485 10.113 4.127 770 HB VAL 97 HB VAL 97 -19.076 11.623 5.172 771 HG11 VAL 97 HG11 VAL 97 -17.983 9.435 4.591 772 HG12 VAL 97 HG12 VAL 97 -17.182 10.250 3.234 773 HG13 VAL 97 HG13 VAL 97 -16.858 10.775 4.893 774 HG21 VAL 97 HG21 VAL 97 -18.215 12.622 2.446 775 HG22 VAL 97 HG22 VAL 97 -18.940 13.518 3.781 776 HG23 VAL 97 HG23 VAL 97 -17.278 12.939 3.923 777 H ASP 98 H ASP 98 -20.528 12.100 1.252 778 HA ASP 98 HA ASP 98 -22.425 14.054 2.388 779 HB2 ASP 98 HB2 ASP 98 -20.933 13.730 -0.226 780 HB3 ASP 98 HB3 ASP 98 -22.336 14.780 -0.153 781 H ASN 99 H ASN 99 -22.878 10.939 1.506 782 HA ASN 99 HA ASN 99 -24.673 9.681 0.988 783 HB2 ASN 99 HB2 ASN 99 -26.575 12.015 1.246 784 HB3 ASN 99 HB3 ASN 99 -26.844 10.311 1.608 785 HD21 ASN 99 HD22 ASN 99 -25.530 13.291 2.691 786 HD22 ASN 99 HD21 ASN 99 -24.531 12.646 3.927 787 H LEU 100 H LEU 100 -23.278 11.412 -0.945 788 HA LEU 100 HA LEU 100 -24.690 11.801 -3.361 789 HB2 LEU 100 HB2 LEU 100 -21.908 10.716 -2.792 790 HB3 LEU 100 HB3 LEU 100 -22.432 11.004 -4.424 791 HG LEU 100 HG LEU 100 -22.319 13.170 -2.286 792 HD11 LEU 100 HD11 LEU 100 -20.083 12.295 -2.865 793 HD12 LEU 100 HD12 LEU 100 -20.418 12.555 -4.590 794 HD13 LEU 100 HD13 LEU 100 -20.310 13.938 -3.477 795 HD21 LEU 100 HD21 LEU 100 -22.720 13.320 -5.311 796 HD22 LEU 100 HD22 LEU 100 -23.931 13.721 -4.071 797 HD23 LEU 100 HD23 LEU 100 -22.480 14.711 -4.232 798 HA PRO 101 HA PRO 101 -26.116 7.833 -4.747 799 HB2 PRO 101 HB2 PRO 101 -25.723 7.906 -7.473 800 HB3 PRO 101 HB3 PRO 101 -26.990 8.840 -6.621 801 HG2 PRO 101 HG2 PRO 101 -24.268 9.790 -7.534 802 HG3 PRO 101 HG3 PRO 101 -25.852 10.607 -7.728 803 HD2 PRO 101 HD2 PRO 101 -24.111 11.255 -5.735 804 HD3 PRO 101 HD3 PRO 101 -25.866 11.295 -5.456 805 H ASN 102 H ASN 102 -25.320 5.739 -5.109 806 HA ASN 102 HA ASN 102 -22.459 5.329 -4.843 807 HB2 ASN 102 HB2 ASN 102 -24.739 3.387 -5.434 808 HB3 ASN 102 HB3 ASN 102 -23.080 2.915 -5.086 809 HD21 ASN 102 HD22 ASN 102 -22.175 4.047 -2.884 810 HD22 ASN 102 HD21 ASN 102 -23.327 3.805 -1.588 811 H ILE 103 H ILE 103 -20.981 5.364 -6.396 812 HA ILE 103 HA ILE 103 -21.570 4.564 -9.173 813 HB ILE 103 HB ILE 103 -20.425 6.649 -10.003 814 HG12 ILE 103 HG12 ILE 103 -20.991 7.691 -7.197 815 HG13 ILE 103 HG13 ILE 103 -19.417 7.414 -7.917 816 HG21 ILE 103 HG21 ILE 103 -22.889 6.203 -10.150 817 HG22 ILE 103 HG22 ILE 103 -23.104 7.184 -8.683 818 HG23 ILE 103 HG23 ILE 103 -22.457 7.911 -10.166 819 HD11 ILE 103 HD11 ILE 103 -19.916 9.181 -9.612 820 HD12 ILE 103 HD12 ILE 103 -21.486 9.463 -8.805 821 HD13 ILE 103 HD13 ILE 103 -19.988 9.785 -7.939 822 H LYS 104 H LYS 104 -19.732 4.367 -10.490 823 HA LYS 104 HA LYS 104 -17.174 3.774 -9.080 824 HB2 LYS 104 HB2 LYS 104 -17.021 1.671 -10.262 825 HB3 LYS 104 HB3 LYS 104 -18.489 1.755 -9.326 826 HG2 LYS 104 HG2 LYS 104 -19.044 0.653 -11.298 827 HG3 LYS 104 HG3 LYS 104 -19.785 2.240 -11.429 828 HD2 LYS 104 HD2 LYS 104 -18.108 2.942 -13.046 829 HD3 LYS 104 HD3 LYS 104 -17.109 1.512 -12.699 830 HE2 LYS 104 HE2 LYS 104 -18.200 1.298 -14.849 831 HE3 LYS 104 HE3 LYS 104 -18.752 0.050 -13.736 832 HZ1 LYS 104 HZ1 LYS 104 -20.800 1.345 -13.402 833 HZ2 LYS 104 HZ2 LYS 104 -20.266 2.528 -14.409 834 HZ3 LYS 104 HZ3 LYS 104 -20.589 1.038 -14.989 835 H ILE 105 H ILE 105 -15.541 3.093 -10.890 836 HA ILE 105 HA ILE 105 -14.662 5.466 -12.127 837 HB ILE 105 HB ILE 105 -13.967 2.607 -12.879 838 HG12 ILE 105 HG12 ILE 105 -12.210 4.121 -10.976 839 HG13 ILE 105 HG13 ILE 105 -13.658 3.372 -10.314 840 HG21 ILE 105 HG21 ILE 105 -13.052 4.160 -14.504 841 HG22 ILE 105 HG22 ILE 105 -12.469 5.248 -13.231 842 HG23 ILE 105 HG23 ILE 105 -11.711 3.664 -13.470 843 HD11 ILE 105 HD11 ILE 105 -12.930 1.215 -11.388 844 HD12 ILE 105 HD12 ILE 105 -11.369 2.016 -11.749 845 HD13 ILE 105 HD13 ILE 105 -11.925 1.809 -10.074 846 H ALA 106 H ALA 106 -15.568 6.500 -13.756 847 HA ALA 106 HA ALA 106 -17.485 5.322 -15.613 848 HB1 ALA 106 HB1 ALA 106 -17.758 7.598 -14.764 849 HB2 ALA 106 HB2 ALA 106 -16.200 8.096 -15.453 850 HB3 ALA 106 HB3 ALA 106 -17.552 7.647 -16.517 851 H THR 107 H THR 107 -14.161 6.515 -15.818 852 HA THR 107 HA THR 107 -13.600 5.020 -18.311 853 HB THR 107 HB THR 107 -12.425 7.168 -19.195 854 HG1 THR 107 HG1 THR 107 -13.411 9.070 -18.623 855 HG21 THR 107 HG21 THR 107 -14.386 6.124 -20.299 856 HG22 THR 107 HG22 THR 107 -15.460 7.134 -19.304 857 HG23 THR 107 HG23 THR 107 -14.341 7.886 -20.461 858 H ARG 108 H ARG 108 -11.298 5.036 -18.860 859 HA ARG 108 HA ARG 108 -9.448 5.714 -16.633 860 HB2 ARG 108 HB2 ARG 108 -10.284 3.211 -16.621 861 HB3 ARG 108 HB3 ARG 108 -9.297 3.029 -18.069 862 HG2 ARG 108 HG2 ARG 108 -7.877 2.355 -16.303 863 HG3 ARG 108 HG3 ARG 108 -7.334 3.982 -16.660 864 HD2 ARG 108 HD2 ARG 108 -7.584 4.363 -14.429 865 HD3 ARG 108 HD3 ARG 108 -9.297 4.499 -14.778 866 HE ARG 108 HE ARG 108 -9.661 2.240 -14.093 867 HH11 ARG 108 HH11 ARG 108 -6.353 3.204 -13.509 868 HH12 ARG 108 HH12 ARG 108 -6.073 1.933 -12.355 869 HH21 ARG 108 HH21 ARG 108 -9.236 0.594 -12.661 870 HH22 ARG 108 HH22 ARG 108 -7.641 0.413 -12.001 871 H LYS 109 H LYS 109 -7.432 6.245 -17.214 872 HA LYS 109 HA LYS 109 -6.317 5.791 -19.894 873 HB2 LYS 109 HB2 LYS 109 -7.779 7.775 -20.203 874 HB3 LYS 109 HB3 LYS 109 -6.922 8.633 -18.929 875 HG2 LYS 109 HG2 LYS 109 -4.941 8.823 -20.209 876 HG3 LYS 109 HG3 LYS 109 -5.428 7.570 -21.358 877 HD2 LYS 109 HD2 LYS 109 -6.934 10.201 -21.027 878 HD3 LYS 109 HD3 LYS 109 -5.594 10.018 -22.161 879 HE2 LYS 109 HE2 LYS 109 -8.044 8.199 -22.231 880 HE3 LYS 109 HE3 LYS 109 -7.988 9.748 -23.076 881 HZ1 LYS 109 HZ1 LYS 109 -6.035 8.944 -24.313 882 HZ2 LYS 109 HZ2 LYS 109 -6.111 7.485 -23.561 883 HZ3 LYS 109 HZ3 LYS 109 -7.318 7.965 -24.556 884 H TYR 110 H TYR 110 -4.173 5.383 -19.619 885 HA TYR 110 HA TYR 110 -2.788 5.860 -17.125 886 HB2 TYR 110 HB2 TYR 110 -2.113 4.054 -18.628 887 HB3 TYR 110 HB3 TYR 110 -1.753 5.206 -19.905 888 HD1 TYR 110 HD2 TYR 110 -0.892 5.074 -16.214 889 HD2 TYR 110 HD1 TYR 110 0.570 5.335 -20.269 890 HE1 TYR 110 HE2 TYR 110 1.403 5.396 -15.367 891 HE2 TYR 110 HE1 TYR 110 2.896 5.559 -19.401 892 HH TYR 110 HH TYR 110 3.603 5.639 -15.905 893 H LEU 111 H LEU 111 -1.883 7.727 -16.380 894 HA LEU 111 HA LEU 111 -1.881 10.112 -18.165 895 HB2 LEU 111 HB2 LEU 111 -1.391 9.707 -15.183 896 HB3 LEU 111 HB3 LEU 111 -1.363 11.273 -15.991 897 HG LEU 111 HG LEU 111 -3.790 9.462 -16.074 898 HD11 LEU 111 HD11 LEU 111 -3.316 9.875 -13.765 899 HD12 LEU 111 HD12 LEU 111 -3.026 11.597 -14.074 900 HD13 LEU 111 HD13 LEU 111 -4.669 10.904 -14.251 901 HD21 LEU 111 HD21 LEU 111 -3.373 12.448 -16.548 902 HD22 LEU 111 HD22 LEU 111 -3.829 11.229 -17.762 903 HD23 LEU 111 HD23 LEU 111 -4.960 11.658 -16.475 904 H GLY 112 H GLY 112 0.354 8.187 -16.180 905 HA2 GLY 112 HA2 GLY 112 2.687 8.166 -17.431 906 HA3 GLY 112 HA3 GLY 112 2.657 9.876 -17.010 907 H LYS 113 H LYS 113 4.080 10.099 -15.479 908 HA LYS 113 HA LYS 113 4.174 8.238 -13.133 909 HB2 LYS 113 HB2 LYS 113 5.870 7.908 -15.140 910 HB3 LYS 113 HB3 LYS 113 6.707 9.250 -14.353 911 HG2 LYS 113 HG2 LYS 113 6.496 7.879 -12.164 912 HG3 LYS 113 HG3 LYS 113 6.012 6.527 -13.198 913 HD2 LYS 113 HD2 LYS 113 8.174 6.817 -14.492 914 HD3 LYS 113 HD3 LYS 113 8.620 8.106 -13.369 915 HE2 LYS 113 HE2 LYS 113 9.772 6.218 -12.582 916 HE3 LYS 113 HE3 LYS 113 8.414 6.428 -11.478 917 HZ1 LYS 113 HZ1 LYS 113 7.249 4.648 -12.735 918 HZ2 LYS 113 HZ2 LYS 113 8.545 4.471 -13.719 919 HZ3 LYS 113 HZ3 LYS 113 8.670 4.108 -12.134 920 H GLN 114 H GLN 114 3.003 9.884 -12.135 921 HA GLN 114 HA GLN 114 4.222 12.475 -11.586 922 HB2 GLN 114 HB2 GLN 114 1.585 11.536 -10.474 923 HB3 GLN 114 HB3 GLN 114 2.149 13.173 -10.870 924 HG2 GLN 114 HG2 GLN 114 2.455 12.325 -13.274 925 HG3 GLN 114 HG3 GLN 114 1.513 10.905 -12.794 926 HE21 GLN 114 HE22 GLN 114 0.842 12.244 -14.889 927 HE22 GLN 114 HE21 GLN 114 -0.584 13.173 -14.567 928 H ASN 115 H ASN 115 4.532 13.323 -9.408 929 HA ASN 115 HA ASN 115 5.515 11.604 -7.420 930 HB2 ASN 115 HB2 ASN 115 5.723 14.259 -7.945 931 HB3 ASN 115 HB3 ASN 115 4.448 14.336 -6.718 932 HD21 ASN 115 HD22 ASN 115 5.233 12.242 -4.957 933 HD22 ASN 115 HD21 ASN 115 6.911 12.462 -4.555 934 H VAL 116 H VAL 116 4.390 10.179 -6.224 935 HA VAL 116 HA VAL 116 1.676 10.992 -5.261 936 HB VAL 116 HB VAL 116 1.081 8.602 -5.259 937 HG11 VAL 116 HG11 VAL 116 0.407 10.123 -7.114 938 HG12 VAL 116 HG12 VAL 116 1.829 9.602 -8.026 939 HG13 VAL 116 HG13 VAL 116 0.557 8.434 -7.598 940 HG21 VAL 116 HG21 VAL 116 3.557 8.193 -7.005 941 HG22 VAL 116 HG22 VAL 116 3.353 7.582 -5.350 942 HG23 VAL 116 HG23 VAL 116 2.293 7.004 -6.639 943 H TYR 117 H TYR 117 0.991 10.324 -3.276 944 HA TYR 117 HA TYR 117 3.114 9.822 -1.229 945 HB2 TYR 117 HB2 TYR 117 0.944 11.926 -1.016 946 HB3 TYR 117 HB3 TYR 117 2.400 11.747 -0.055 947 HD1 TYR 117 HD1 TYR 117 0.991 12.951 -3.247 948 HD2 TYR 117 HD2 TYR 117 4.557 12.636 -0.838 949 HE1 TYR 117 HE1 TYR 117 2.103 14.680 -4.658 950 HE2 TYR 117 HE2 TYR 117 5.653 14.380 -2.227 951 HH TYR 117 HH TYR 117 5.408 15.856 -3.958 952 H ASP 118 H ASP 118 2.257 9.216 0.888 953 HA ASP 118 HA ASP 118 -0.579 8.636 1.188 954 HB2 ASP 118 HB2 ASP 118 -0.390 6.287 1.615 955 HB3 ASP 118 HB3 ASP 118 0.143 6.626 -0.016 956 H ILE 119 H ILE 119 -1.203 8.805 3.270 957 HA ILE 119 HA ILE 119 0.881 9.208 5.365 958 HB ILE 119 HB ILE 119 -0.953 10.040 6.761 959 HG12 ILE 119 HG12 ILE 119 -2.712 9.917 4.270 960 HG13 ILE 119 HG13 ILE 119 -2.820 8.787 5.624 961 HG21 ILE 119 HG21 ILE 119 0.501 11.512 5.390 962 HG22 ILE 119 HG22 ILE 119 -0.701 11.480 4.084 963 HG23 ILE 119 HG23 ILE 119 -1.095 12.210 5.657 964 HD11 ILE 119 HD11 ILE 119 -3.401 10.604 7.156 965 HD12 ILE 119 HD12 ILE 119 -3.331 11.778 5.813 966 HD13 ILE 119 HD13 ILE 119 -4.540 10.482 5.803 967 H GLY 120 H GLY 120 0.734 8.176 7.374 968 HA2 GLY 120 HA2 GLY 120 -0.489 5.434 7.333 969 HA3 GLY 120 HA3 GLY 120 0.909 5.919 8.289 970 H VAL 121 H VAL 121 -1.418 4.662 9.317 971 HA VAL 121 HA VAL 121 -2.411 6.652 11.301 972 HB VAL 121 HB VAL 121 -4.216 4.850 9.687 973 HG11 VAL 121 HG11 VAL 121 -5.095 5.254 11.943 974 HG12 VAL 121 HG12 VAL 121 -4.842 7.012 11.754 975 HG13 VAL 121 HG13 VAL 121 -6.035 6.144 10.770 976 HG21 VAL 121 HG21 VAL 121 -3.941 7.876 9.476 977 HG22 VAL 121 HG22 VAL 121 -3.587 6.681 8.201 978 HG23 VAL 121 HG23 VAL 121 -5.243 6.913 8.741 979 H GLU 122 H GLU 122 -2.775 5.714 13.321 980 HA GLU 122 HA GLU 122 -1.755 3.012 13.767 981 HB2 GLU 122 HB2 GLU 122 -2.883 5.199 15.551 982 HB3 GLU 122 HB3 GLU 122 -2.482 3.605 16.184 983 HG2 GLU 122 HG2 GLU 122 -0.491 5.409 14.765 984 HG3 GLU 122 HG3 GLU 122 -0.696 5.319 16.508 985 H ARG 123 H ARG 123 -5.007 4.500 14.110 986 HA ARG 123 HA ARG 123 -6.309 2.169 15.227 987 HB2 ARG 123 HB2 ARG 123 -7.220 4.728 13.899 988 HB3 ARG 123 HB3 ARG 123 -8.381 3.432 14.134 989 HG2 ARG 123 HG2 ARG 123 -8.699 4.886 15.900 990 HG3 ARG 123 HG3 ARG 123 -7.910 3.479 16.598 991 HD2 ARG 123 HD2 ARG 123 -6.357 5.978 15.793 992 HD3 ARG 123 HD3 ARG 123 -7.223 5.866 17.331 993 HE ARG 123 HE ARG 123 -5.509 3.576 16.980 994 HH11 ARG 123 HH11 ARG 123 -5.381 6.952 17.933 995 HH12 ARG 123 HH12 ARG 123 -4.023 6.694 18.997 996 HH21 ARG 123 HH21 ARG 123 -3.792 3.318 18.381 997 HH22 ARG 123 HH22 ARG 123 -3.146 4.697 19.228 998 H ASP 124 H ASP 124 -6.522 3.470 11.917 999 HA ASP 124 HA ASP 124 -6.525 0.807 10.699 1000 HB2 ASP 124 HB2 ASP 124 -8.912 1.219 11.448 1001 HB3 ASP 124 HB3 ASP 124 -8.961 2.623 10.392 1002 H HIS 125 H HIS 125 -5.492 0.960 8.854 1003 HA HIS 125 HA HIS 125 -4.442 3.287 7.614 1004 HB2 HIS 125 HB2 HIS 125 -3.733 1.606 5.880 1005 HB3 HIS 125 HB3 HIS 125 -3.231 1.278 7.501 1006 HD1 HIS 125 HD1 HIS 125 -6.752 0.033 7.291 1007 HD2 HIS 125 HD2 HIS 125 -2.877 -1.217 6.204 1008 HE1 HIS 125 HE1 HIS 125 -6.892 -2.471 6.891 1009 H ASN 126 H ASN 126 -7.068 4.024 7.625 1010 HA ASN 126 HA ASN 126 -7.564 4.375 4.741 1011 HB2 ASN 126 HB2 ASN 126 -9.776 3.641 4.748 1012 HB3 ASN 126 HB3 ASN 126 -8.918 2.357 5.574 1013 HD21 ASN 126 HD22 ASN 126 -11.803 3.209 5.688 1014 HD22 ASN 126 HD21 ASN 126 -12.093 3.507 7.400 1015 H PHE 127 H PHE 127 -9.056 6.089 4.217 1016 HA PHE 127 HA PHE 127 -9.956 7.976 6.223 1017 HB2 PHE 127 HB2 PHE 127 -8.502 9.879 5.372 1018 HB3 PHE 127 HB3 PHE 127 -7.749 8.714 6.430 1019 HD1 PHE 127 HD1 PHE 127 -8.054 9.681 2.824 1020 HD2 PHE 127 HD2 PHE 127 -5.784 7.536 5.795 1021 HE1 PHE 127 HE1 PHE 127 -6.216 9.344 1.185 1022 HE2 PHE 127 HE2 PHE 127 -3.953 7.198 4.149 1023 HZ PHE 127 HZ PHE 127 -4.172 8.095 1.843 1024 H ALA 128 H ALA 128 -11.134 9.745 5.390 1025 HA ALA 128 HA ALA 128 -12.378 9.170 2.787 1026 HB1 ALA 128 HB1 ALA 128 -13.751 9.297 4.839 1027 HB2 ALA 128 HB2 ALA 128 -13.247 10.989 5.064 1028 HB3 ALA 128 HB3 ALA 128 -14.219 10.532 3.652 1029 H LEU 129 H LEU 129 -12.457 10.482 1.098 1030 HA LEU 129 HA LEU 129 -10.673 12.783 0.864 1031 HB2 LEU 129 HB2 LEU 129 -12.431 11.226 -1.066 1032 HB3 LEU 129 HB3 LEU 129 -11.603 12.708 -1.517 1033 HG LEU 129 HG LEU 129 -9.477 11.432 -0.432 1034 HD11 LEU 129 HD11 LEU 129 -10.610 9.358 0.122 1035 HD12 LEU 129 HD12 LEU 129 -11.082 9.146 -1.589 1036 HD13 LEU 129 HD13 LEU 129 -9.372 9.123 -1.114 1037 HD21 LEU 129 HD21 LEU 129 -10.632 11.199 -3.232 1038 HD22 LEU 129 HD22 LEU 129 -9.476 12.402 -2.590 1039 HD23 LEU 129 HD23 LEU 129 -8.985 10.702 -2.794 1040 H LYS 130 H LYS 130 -11.372 14.754 -0.319 1041 HA LYS 130 HA LYS 130 -13.267 16.276 1.085 1042 HB2 LYS 130 HB2 LYS 130 -13.011 17.974 -0.591 1043 HB3 LYS 130 HB3 LYS 130 -11.450 17.204 -0.332 1044 HG2 LYS 130 HG2 LYS 130 -11.747 15.924 -2.425 1045 HG3 LYS 130 HG3 LYS 130 -13.342 16.638 -2.673 1046 HD2 LYS 130 HD2 LYS 130 -11.150 18.631 -2.351 1047 HD3 LYS 130 HD3 LYS 130 -11.014 17.561 -3.745 1048 HE2 LYS 130 HE2 LYS 130 -12.125 19.373 -4.613 1049 HE3 LYS 130 HE3 LYS 130 -13.406 18.186 -4.359 1050 HZ1 LYS 130 HZ1 LYS 130 -14.044 19.408 -2.349 1051 HZ2 LYS 130 HZ2 LYS 130 -12.787 20.468 -2.542 1052 HZ3 LYS 130 HZ3 LYS 130 -14.010 20.435 -3.616 1053 H ASN 131 H ASN 131 -13.868 14.336 -1.779 1054 HA ASN 131 HA ASN 131 -16.601 15.309 -2.192 1055 HB2 ASN 131 HB2 ASN 131 -15.070 12.926 -3.323 1056 HB3 ASN 131 HB3 ASN 131 -16.604 13.534 -3.944 1057 HD21 ASN 131 HD22 ASN 131 -16.587 15.822 -4.823 1058 HD22 ASN 131 HD21 ASN 131 -15.106 16.335 -5.607 1059 H GLY 132 H GLY 132 -15.122 12.705 -0.380 1060 HA2 GLY 132 HA2 GLY 132 -16.567 11.771 1.397 1061 HA3 GLY 132 HA3 GLY 132 -17.764 11.379 0.134 1062 H PHE 133 H PHE 133 -15.205 10.646 -1.570 1063 HA PHE 133 HA PHE 133 -15.501 7.842 -1.353 1064 HB2 PHE 133 HB2 PHE 133 -13.120 9.289 -2.526 1065 HB3 PHE 133 HB3 PHE 133 -13.765 7.732 -3.004 1066 HD1 PHE 133 HD2 PHE 133 -16.651 8.199 -3.377 1067 HD2 PHE 133 HD1 PHE 133 -13.311 10.776 -4.292 1068 HE1 PHE 133 HE2 PHE 133 -18.053 9.452 -4.997 1069 HE2 PHE 133 HE1 PHE 133 -14.705 11.994 -5.938 1070 HZ PHE 133 HZ PHE 133 -17.091 11.356 -6.267 1071 H ILE 134 H ILE 134 -13.835 6.152 -0.783 1072 HA ILE 134 HA ILE 134 -12.102 7.081 1.480 1073 HB ILE 134 HB ILE 134 -13.133 4.298 1.095 1074 HG12 ILE 134 HG12 ILE 134 -15.098 5.622 1.357 1075 HG13 ILE 134 HG13 ILE 134 -14.808 4.603 2.760 1076 HG21 ILE 134 HG21 ILE 134 -11.153 4.455 2.531 1077 HG22 ILE 134 HG22 ILE 134 -11.897 5.759 3.478 1078 HG23 ILE 134 HG23 ILE 134 -12.546 4.115 3.544 1079 HD11 ILE 134 HD11 ILE 134 -14.098 6.549 4.070 1080 HD12 ILE 134 HD12 ILE 134 -14.295 7.594 2.638 1081 HD13 ILE 134 HD13 ILE 134 -15.709 6.789 3.351 1082 H ALA 135 H ALA 135 -10.104 6.791 1.386 1083 HA ALA 135 HA ALA 135 -8.776 5.009 -0.640 1084 HB1 ALA 135 HB1 ALA 135 -7.975 7.192 -0.989 1085 HB2 ALA 135 HB2 ALA 135 -8.036 7.605 0.738 1086 HB3 ALA 135 HB3 ALA 135 -6.774 6.529 0.140 1087 H SER 136 H SER 136 -7.318 3.458 0.121 1088 HA SER 136 HA SER 136 -6.795 3.246 3.041 1089 HB2 SER 136 HB2 SER 136 -7.724 0.895 1.352 1090 HB3 SER 136 HB3 SER 136 -7.275 0.864 3.069 1091 HG SER 136 HG SER 136 -9.378 2.449 2.035 1092 H ASN 137 H ASN 137 -4.832 2.312 3.595 1093 HA ASN 137 HA ASN 137 -2.925 1.941 1.302 1094 HB2 ASN 137 HB2 ASN 137 -1.327 3.314 2.502 1095 HB3 ASN 137 HB3 ASN 137 -2.813 4.201 2.218 1096 HD21 ASN 137 HD22 ASN 137 -4.082 4.844 4.019 1097 HD22 ASN 137 HD21 ASN 137 -3.394 4.795 5.635
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