NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
457757 | 2ksh | 16662 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 1.808 0.000 0.855 2 HA MET 1 HA MET 1 1.982 0.971 -1.700 3 HB2 MET 1 HB2 MET 1 3.705 -0.382 0.109 4 HB3 MET 1 HB3 MET 1 3.883 -1.150 -1.463 5 HG2 MET 1 HG2 MET 1 5.498 0.527 -1.438 6 HG3 MET 1 HG3 MET 1 4.179 1.194 -2.398 7 HE1 MET 1 HE1 MET 1 6.533 3.307 -0.696 8 HE2 MET 1 HE2 MET 1 5.583 3.199 -2.178 9 HE3 MET 1 HE3 MET 1 5.218 4.447 -0.984 10 H SER 2 H SER 2 0.861 -2.141 -0.676 11 HA SER 2 HA SER 2 0.478 -2.893 -3.498 12 HB2 SER 2 HB2 SER 2 0.905 -4.926 -1.315 13 HB3 SER 2 HB3 SER 2 1.021 -5.148 -3.061 14 HG SER 2 HG SER 2 2.846 -3.639 -2.930 15 H LEU 3 H LEU 3 -1.500 -3.671 -4.059 16 HA LEU 3 HA LEU 3 -3.525 -3.761 -1.923 17 HB2 LEU 3 HB2 LEU 3 -3.626 -2.820 -4.759 18 HB3 LEU 3 HB3 LEU 3 -5.096 -3.369 -3.957 19 HG LEU 3 HG LEU 3 -3.448 -1.286 -2.612 20 HD11 LEU 3 HD11 LEU 3 -4.825 0.419 -3.900 21 HD12 LEU 3 HD12 LEU 3 -5.115 -0.864 -5.074 22 HD13 LEU 3 HD13 LEU 3 -3.469 -0.320 -4.751 23 HD21 LEU 3 HD21 LEU 3 -5.618 -0.540 -1.840 24 HD22 LEU 3 HD22 LEU 3 -5.437 -2.269 -1.542 25 HD23 LEU 3 HD23 LEU 3 -6.422 -1.704 -2.893 26 H LYS 4 H LYS 4 -4.986 -5.439 -1.859 27 HA LYS 4 HA LYS 4 -4.147 -7.945 -2.797 28 HB2 LYS 4 HB2 LYS 4 -6.932 -7.159 -1.923 29 HB3 LYS 4 HB3 LYS 4 -6.270 -8.788 -1.964 30 HG2 LYS 4 HG2 LYS 4 -4.657 -6.962 -0.378 31 HG3 LYS 4 HG3 LYS 4 -6.316 -7.108 0.209 32 HD2 LYS 4 HD2 LYS 4 -5.952 -9.645 -0.027 33 HD3 LYS 4 HD3 LYS 4 -4.235 -9.247 -0.114 34 HE2 LYS 4 HE2 LYS 4 -4.926 -7.811 2.047 35 HE3 LYS 4 HE3 LYS 4 -6.110 -9.111 2.168 36 HZ1 LYS 4 HZ1 LYS 4 -3.181 -9.521 1.913 37 HZ2 LYS 4 HZ2 LYS 4 -4.348 -10.720 2.161 38 HZ3 LYS 4 HZ3 LYS 4 -4.036 -9.581 3.372 39 H SER 5 H SER 5 -6.430 -5.607 -4.095 40 HA SER 5 HA SER 5 -7.745 -7.130 -5.985 41 HB2 SER 5 HB2 SER 5 -7.804 -4.933 -7.329 42 HB3 SER 5 HB3 SER 5 -8.502 -4.914 -5.709 43 HG SER 5 HG SER 5 -7.062 -3.499 -5.150 44 H ASP 6 H ASP 6 -4.478 -5.914 -6.018 45 HA ASP 6 HA ASP 6 -3.851 -6.089 -8.714 46 HB2 ASP 6 HB2 ASP 6 -2.181 -6.576 -6.250 47 HB3 ASP 6 HB3 ASP 6 -1.498 -6.618 -7.873 48 H GLU 7 H GLU 7 -4.029 -8.625 -6.277 49 HA GLU 7 HA GLU 7 -2.851 -10.697 -7.752 50 HB2 GLU 7 HB2 GLU 7 -4.148 -10.417 -5.260 51 HB3 GLU 7 HB3 GLU 7 -4.990 -11.702 -6.116 52 HG2 GLU 7 HG2 GLU 7 -2.127 -11.980 -6.356 53 HG3 GLU 7 HG3 GLU 7 -2.634 -11.916 -4.669 54 H VAL 8 H VAL 8 -6.212 -9.599 -7.561 55 HA VAL 8 HA VAL 8 -7.290 -11.636 -9.208 56 HB VAL 8 HB VAL 8 -8.311 -8.892 -8.488 57 HG11 VAL 8 HG11 VAL 8 -9.263 -9.395 -10.623 58 HG12 VAL 8 HG12 VAL 8 -9.639 -11.046 -10.125 59 HG13 VAL 8 HG13 VAL 8 -10.497 -9.688 -9.397 60 HG21 VAL 8 HG21 VAL 8 -9.690 -9.980 -6.935 61 HG22 VAL 8 HG22 VAL 8 -9.421 -11.560 -7.670 62 HG23 VAL 8 HG23 VAL 8 -8.124 -10.775 -6.770 63 H PHE 9 H PHE 9 -6.219 -8.320 -9.876 64 HA PHE 9 HA PHE 9 -6.924 -8.283 -12.599 65 HB2 PHE 9 HB2 PHE 9 -4.906 -6.728 -10.990 66 HB3 PHE 9 HB3 PHE 9 -5.131 -6.453 -12.714 67 HD1 PHE 9 HD1 PHE 9 -7.929 -6.511 -13.165 68 HD2 PHE 9 HD2 PHE 9 -5.822 -5.010 -9.785 69 HE1 PHE 9 HE1 PHE 9 -9.801 -4.990 -12.677 70 HE2 PHE 9 HE2 PHE 9 -7.690 -3.487 -9.292 71 HZ PHE 9 HZ PHE 9 -9.683 -3.476 -10.738 72 H ALA 10 H ALA 10 -4.003 -9.324 -10.927 73 HA ALA 10 HA ALA 10 -2.373 -9.682 -13.197 74 HB1 ALA 10 HB1 ALA 10 -2.231 -10.259 -10.377 75 HB2 ALA 10 HB2 ALA 10 -1.565 -11.587 -11.328 76 HB3 ALA 10 HB3 ALA 10 -0.931 -9.954 -11.529 77 H LYS 11 H LYS 11 -4.387 -11.994 -11.388 78 HA LYS 11 HA LYS 11 -3.836 -14.203 -13.067 79 HB2 LYS 11 HB2 LYS 11 -5.786 -15.250 -11.975 80 HB3 LYS 11 HB3 LYS 11 -4.684 -14.521 -10.814 81 HG2 LYS 11 HG2 LYS 11 -6.162 -12.577 -10.638 82 HG3 LYS 11 HG3 LYS 11 -7.272 -13.326 -11.788 83 HD2 LYS 11 HD2 LYS 11 -8.172 -13.806 -9.670 84 HD3 LYS 11 HD3 LYS 11 -7.363 -15.293 -10.168 85 HE2 LYS 11 HE2 LYS 11 -5.356 -13.982 -8.876 86 HE3 LYS 11 HE3 LYS 11 -6.766 -13.464 -7.952 87 HZ1 LYS 11 HZ1 LYS 11 -6.588 -15.387 -6.885 88 HZ2 LYS 11 HZ2 LYS 11 -5.461 -16.000 -7.987 89 HZ3 LYS 11 HZ3 LYS 11 -7.117 -16.153 -8.298 90 H ILE 12 H ILE 12 -6.434 -11.803 -13.027 91 HA ILE 12 HA ILE 12 -8.058 -12.931 -15.006 92 HB ILE 12 HB ILE 12 -7.660 -10.092 -14.104 93 HG12 ILE 12 HG12 ILE 12 -10.041 -11.949 -13.918 94 HG13 ILE 12 HG13 ILE 12 -8.846 -11.739 -12.643 95 HG21 ILE 12 HG21 ILE 12 -9.763 -9.627 -15.470 96 HG22 ILE 12 HG22 ILE 12 -8.242 -9.760 -16.351 97 HG23 ILE 12 HG23 ILE 12 -9.378 -11.108 -16.345 98 HD11 ILE 12 HD11 ILE 12 -10.731 -10.413 -12.094 99 HD12 ILE 12 HD12 ILE 12 -9.451 -9.313 -12.607 100 HD13 ILE 12 HD13 ILE 12 -10.776 -9.697 -13.704 101 H ALA 13 H ALA 13 -5.234 -10.838 -15.242 102 HA ALA 13 HA ALA 13 -5.432 -10.260 -17.996 103 HB1 ALA 13 HB1 ALA 13 -2.770 -10.461 -16.674 104 HB2 ALA 13 HB2 ALA 13 -3.386 -9.244 -17.793 105 HB3 ALA 13 HB3 ALA 13 -3.916 -9.245 -16.111 106 H LYS 14 H LYS 14 -3.450 -12.675 -16.278 107 HA LYS 14 HA LYS 14 -2.289 -13.879 -18.492 108 HB2 LYS 14 HB2 LYS 14 -3.111 -15.164 -15.881 109 HB3 LYS 14 HB3 LYS 14 -1.998 -15.867 -17.048 110 HG2 LYS 14 HG2 LYS 14 -1.067 -13.265 -16.456 111 HG3 LYS 14 HG3 LYS 14 -1.453 -14.057 -14.927 112 HD2 LYS 14 HD2 LYS 14 -0.094 -16.002 -15.646 113 HD3 LYS 14 HD3 LYS 14 0.358 -15.109 -17.100 114 HE2 LYS 14 HE2 LYS 14 1.089 -13.280 -15.371 115 HE3 LYS 14 HE3 LYS 14 1.143 -14.646 -14.258 116 HZ1 LYS 14 HZ1 LYS 14 3.126 -15.138 -15.072 117 HZ2 LYS 14 HZ2 LYS 14 3.023 -13.897 -16.217 118 HZ3 LYS 14 HZ3 LYS 14 2.433 -15.439 -16.586 119 H ARG 15 H ARG 15 -5.506 -14.199 -17.204 120 HA ARG 15 HA ARG 15 -6.157 -16.578 -18.670 121 HB2 ARG 15 HB2 ARG 15 -7.895 -14.556 -17.248 122 HB3 ARG 15 HB3 ARG 15 -8.498 -16.040 -17.974 123 HG2 ARG 15 HG2 ARG 15 -7.426 -17.387 -16.403 124 HG3 ARG 15 HG3 ARG 15 -6.334 -16.093 -15.905 125 HD2 ARG 15 HD2 ARG 15 -7.891 -15.110 -14.559 126 HD3 ARG 15 HD3 ARG 15 -9.245 -15.649 -15.551 127 HE ARG 15 HE ARG 15 -8.287 -17.947 -14.474 128 HH11 ARG 15 HH11 ARG 15 -9.301 -14.894 -13.144 129 HH12 ARG 15 HH12 ARG 15 -9.845 -15.578 -11.648 130 HH21 ARG 15 HH21 ARG 15 -8.999 -18.859 -12.508 131 HH22 ARG 15 HH22 ARG 15 -9.671 -17.833 -11.287 132 H LEU 16 H LEU 16 -6.359 -13.139 -19.222 133 HA LEU 16 HA LEU 16 -8.180 -13.198 -21.386 134 HB2 LEU 16 HB2 LEU 16 -6.101 -11.233 -20.482 135 HB3 LEU 16 HB3 LEU 16 -7.041 -10.970 -21.950 136 HG LEU 16 HG LEU 16 -8.595 -11.530 -19.501 137 HD11 LEU 16 HD11 LEU 16 -6.567 -9.469 -19.562 138 HD12 LEU 16 HD12 LEU 16 -7.594 -10.005 -18.233 139 HD13 LEU 16 HD13 LEU 16 -8.184 -8.791 -19.368 140 HD21 LEU 16 HD21 LEU 16 -9.201 -9.154 -21.049 141 HD22 LEU 16 HD22 LEU 16 -10.206 -10.559 -20.693 142 HD23 LEU 16 HD23 LEU 16 -9.089 -10.596 -22.058 143 H GLU 17 H GLU 17 -4.940 -14.180 -21.112 144 HA GLU 17 HA GLU 17 -4.226 -13.741 -23.872 145 HB2 GLU 17 HB2 GLU 17 -2.892 -15.243 -21.620 146 HB3 GLU 17 HB3 GLU 17 -2.229 -15.169 -23.246 147 HG2 GLU 17 HG2 GLU 17 -2.353 -12.629 -22.980 148 HG3 GLU 17 HG3 GLU 17 -2.573 -12.954 -21.262 149 H SER 18 H SER 18 -6.002 -16.058 -22.162 150 HA SER 18 HA SER 18 -5.441 -18.225 -24.023 151 HB2 SER 18 HB2 SER 18 -6.525 -18.014 -21.349 152 HB3 SER 18 HB3 SER 18 -7.591 -18.967 -22.380 153 HG SER 18 HG SER 18 -4.828 -19.454 -22.427 154 H ILE 19 H ILE 19 -7.529 -15.593 -23.791 155 HA ILE 19 HA ILE 19 -9.942 -16.537 -24.794 156 HB ILE 19 HB ILE 19 -8.682 -13.881 -25.479 157 HG12 ILE 19 HG12 ILE 19 -10.324 -14.706 -23.076 158 HG13 ILE 19 HG13 ILE 19 -8.638 -14.200 -23.069 159 HG21 ILE 19 HG21 ILE 19 -10.959 -13.103 -25.745 160 HG22 ILE 19 HG22 ILE 19 -10.671 -14.489 -26.795 161 HG23 ILE 19 HG23 ILE 19 -11.580 -14.691 -25.297 162 HD11 ILE 19 HD11 ILE 19 -10.047 -12.413 -22.286 163 HD12 ILE 19 HD12 ILE 19 -9.334 -11.972 -23.838 164 HD13 ILE 19 HD13 ILE 19 -11.017 -12.492 -23.756 165 H ASP 20 H ASP 20 -10.739 -16.969 -26.800 166 HA ASP 20 HA ASP 20 -8.818 -16.895 -29.034 167 HB2 ASP 20 HB2 ASP 20 -10.149 -19.134 -27.899 168 HB3 ASP 20 HB3 ASP 20 -10.843 -18.860 -29.495 169 HA PRO 21 HA PRO 21 -11.726 -14.517 -31.306 170 HB2 PRO 21 HB2 PRO 21 -11.162 -15.317 -33.839 171 HB3 PRO 21 HB3 PRO 21 -10.088 -14.274 -32.899 172 HG2 PRO 21 HG2 PRO 21 -9.925 -17.225 -33.371 173 HG3 PRO 21 HG3 PRO 21 -8.629 -16.015 -33.396 174 HD2 PRO 21 HD2 PRO 21 -9.067 -17.637 -31.272 175 HD3 PRO 21 HD3 PRO 21 -8.443 -15.984 -31.099 176 H ALA 22 H ALA 22 -11.739 -17.975 -31.500 177 HA ALA 22 HA ALA 22 -13.902 -18.415 -33.214 178 HB1 ALA 22 HB1 ALA 22 -13.944 -20.602 -32.414 179 HB2 ALA 22 HB2 ALA 22 -12.270 -20.102 -32.165 180 HB3 ALA 22 HB3 ALA 22 -13.395 -20.127 -30.807 181 H ASN 23 H ASN 23 -13.883 -18.135 -29.659 182 HA ASN 23 HA ASN 23 -16.796 -17.862 -29.692 183 HB2 ASN 23 HB2 ASN 23 -15.056 -19.175 -27.963 184 HB3 ASN 23 HB3 ASN 23 -15.538 -17.737 -27.068 185 HD21 ASN 23 HD21 ASN 23 -17.003 -20.222 -29.136 186 HD22 ASN 23 HD22 ASN 23 -18.407 -20.451 -28.155 187 H ARG 24 H ARG 24 -17.596 -15.882 -29.861 188 HA ARG 24 HA ARG 24 -16.501 -13.744 -28.218 189 HB2 ARG 24 HB2 ARG 24 -16.726 -13.578 -31.225 190 HB3 ARG 24 HB3 ARG 24 -16.550 -12.171 -30.184 191 HG2 ARG 24 HG2 ARG 24 -14.576 -14.431 -30.177 192 HG3 ARG 24 HG3 ARG 24 -14.448 -13.057 -31.277 193 HD2 ARG 24 HD2 ARG 24 -14.896 -11.993 -28.710 194 HD3 ARG 24 HD3 ARG 24 -13.679 -13.256 -28.523 195 HE ARG 24 HE ARG 24 -13.164 -11.463 -30.710 196 HH11 ARG 24 HH11 ARG 24 -12.759 -12.011 -27.296 197 HH12 ARG 24 HH12 ARG 24 -11.366 -10.990 -27.165 198 HH21 ARG 24 HH21 ARG 24 -11.330 -10.116 -30.551 199 HH22 ARG 24 HH22 ARG 24 -10.554 -9.912 -29.017 200 H GLN 25 H GLN 25 -17.922 -11.671 -28.653 201 HA GLN 25 HA GLN 25 -20.544 -11.889 -29.572 202 HB2 GLN 25 HB2 GLN 25 -20.244 -13.384 -27.276 203 HB3 GLN 25 HB3 GLN 25 -20.869 -11.858 -26.664 204 HG2 GLN 25 HG2 GLN 25 -22.874 -12.081 -27.753 205 HG3 GLN 25 HG3 GLN 25 -22.204 -13.135 -28.997 206 HE21 GLN 25 HE21 GLN 25 -23.661 -12.945 -25.894 207 HE22 GLN 25 HE22 GLN 25 -23.798 -14.644 -25.610 208 H VAL 26 H VAL 26 -18.534 -10.531 -26.991 209 HA VAL 26 HA VAL 26 -18.912 -7.870 -27.916 210 HB VAL 26 HB VAL 26 -21.100 -8.405 -26.679 211 HG11 VAL 26 HG11 VAL 26 -19.864 -9.517 -24.771 212 HG12 VAL 26 HG12 VAL 26 -19.415 -7.895 -24.240 213 HG13 VAL 26 HG13 VAL 26 -21.115 -8.360 -24.317 214 HG21 VAL 26 HG21 VAL 26 -21.188 -6.191 -26.861 215 HG22 VAL 26 HG22 VAL 26 -20.435 -6.081 -25.270 216 HG23 VAL 26 HG23 VAL 26 -19.435 -6.058 -26.723 217 H GLU 27 H GLU 27 -17.362 -6.523 -27.123 218 HA GLU 27 HA GLU 27 -15.972 -7.108 -24.664 219 HB2 GLU 27 HB2 GLU 27 -14.775 -7.675 -27.336 220 HB3 GLU 27 HB3 GLU 27 -13.738 -6.997 -26.089 221 HG2 GLU 27 HG2 GLU 27 -15.270 -9.580 -25.985 222 HG3 GLU 27 HG3 GLU 27 -13.521 -9.367 -26.040 223 H HIS 28 H HIS 28 -15.634 -5.210 -23.735 224 HA HIS 28 HA HIS 28 -14.799 -2.933 -25.380 225 HB2 HIS 28 HB2 HIS 28 -17.263 -3.142 -23.735 226 HB3 HIS 28 HB3 HIS 28 -16.371 -1.626 -23.636 227 HD1 HIS 28 HD1 HIS 28 -15.643 -0.887 -26.352 228 HD2 HIS 28 HD2 HIS 28 -19.204 -2.884 -25.580 229 HE1 HIS 28 HE1 HIS 28 -17.127 -0.401 -28.322 230 H VAL 29 H VAL 29 -14.123 -1.054 -23.907 231 HA VAL 29 HA VAL 29 -12.167 -2.071 -22.067 232 HB VAL 29 HB VAL 29 -12.888 0.815 -22.587 233 HG11 VAL 29 HG11 VAL 29 -10.131 0.368 -22.043 234 HG12 VAL 29 HG12 VAL 29 -11.304 1.300 -21.110 235 HG13 VAL 29 HG13 VAL 29 -11.085 -0.420 -20.786 236 HG21 VAL 29 HG21 VAL 29 -11.019 -1.036 -24.048 237 HG22 VAL 29 HG22 VAL 29 -12.364 -0.106 -24.707 238 HG23 VAL 29 HG23 VAL 29 -10.908 0.721 -24.153 239 H TYR 30 H TYR 30 -12.146 -1.976 -19.877 240 HA TYR 30 HA TYR 30 -14.440 -0.716 -18.535 241 HB2 TYR 30 HB2 TYR 30 -13.329 -3.485 -18.082 242 HB3 TYR 30 HB3 TYR 30 -14.354 -2.668 -16.907 243 HD1 TYR 30 HD1 TYR 30 -16.715 -2.216 -17.419 244 HD2 TYR 30 HD2 TYR 30 -14.242 -4.387 -20.116 245 HE1 TYR 30 HE1 TYR 30 -18.718 -3.020 -18.599 246 HE2 TYR 30 HE2 TYR 30 -16.237 -5.196 -21.304 247 HH TYR 30 HH TYR 30 -18.676 -5.564 -20.766 248 H LYS 31 H LYS 31 -13.922 0.544 -16.863 249 HA LYS 31 HA LYS 31 -11.128 0.543 -15.958 250 HB2 LYS 31 HB2 LYS 31 -11.624 2.692 -16.715 251 HB3 LYS 31 HB3 LYS 31 -13.263 2.645 -16.079 252 HG2 LYS 31 HG2 LYS 31 -12.636 3.350 -14.033 253 HG3 LYS 31 HG3 LYS 31 -11.101 2.482 -14.083 254 HD2 LYS 31 HD2 LYS 31 -10.566 4.790 -14.114 255 HD3 LYS 31 HD3 LYS 31 -10.323 4.202 -15.761 256 HE2 LYS 31 HE2 LYS 31 -12.516 5.079 -16.395 257 HE3 LYS 31 HE3 LYS 31 -12.767 5.654 -14.748 258 HZ1 LYS 31 HZ1 LYS 31 -10.526 6.880 -15.215 259 HZ2 LYS 31 HZ2 LYS 31 -11.991 7.535 -15.749 260 HZ3 LYS 31 HZ3 LYS 31 -10.992 6.703 -16.832 261 H PHE 32 H PHE 32 -10.588 0.154 -13.883 262 HA PHE 32 HA PHE 32 -12.793 -0.378 -12.002 263 HB2 PHE 32 HB2 PHE 32 -10.058 -1.661 -12.157 264 HB3 PHE 32 HB3 PHE 32 -11.239 -1.970 -10.888 265 HD1 PHE 32 HD2 PHE 32 -10.691 -2.224 -14.544 266 HD2 PHE 32 HD1 PHE 32 -12.900 -3.581 -11.169 267 HE1 PHE 32 HE2 PHE 32 -11.699 -3.997 -15.921 268 HE2 PHE 32 HE1 PHE 32 -13.911 -5.357 -12.540 269 HZ PHE 32 HZ PHE 32 -13.312 -5.566 -14.920 270 H ARG 33 H ARG 33 -12.794 0.619 -10.066 271 HA ARG 33 HA ARG 33 -10.533 2.413 -9.485 272 HB2 ARG 33 HB2 ARG 33 -13.457 2.724 -9.304 273 HB3 ARG 33 HB3 ARG 33 -12.565 3.335 -7.917 274 HG2 ARG 33 HG2 ARG 33 -11.107 4.540 -9.671 275 HG3 ARG 33 HG3 ARG 33 -12.451 4.221 -10.769 276 HD2 ARG 33 HD2 ARG 33 -13.174 5.352 -8.144 277 HD3 ARG 33 HD3 ARG 33 -12.260 6.417 -9.211 278 HE ARG 33 HE ARG 33 -14.433 5.182 -10.573 279 HH11 ARG 33 HH11 ARG 33 -13.627 7.739 -8.352 280 HH12 ARG 33 HH12 ARG 33 -14.989 8.719 -8.781 281 HH21 ARG 33 HH21 ARG 33 -16.230 6.464 -11.147 282 HH22 ARG 33 HH22 ARG 33 -16.470 7.992 -10.371 283 H ILE 34 H ILE 34 -9.290 1.833 -7.842 284 HA ILE 34 HA ILE 34 -10.347 -0.023 -5.835 285 HB ILE 34 HB ILE 34 -7.512 0.764 -6.508 286 HG12 ILE 34 HG12 ILE 34 -8.653 -0.779 -8.088 287 HG13 ILE 34 HG13 ILE 34 -7.289 -1.530 -7.267 288 HG21 ILE 34 HG21 ILE 34 -7.229 -1.356 -4.879 289 HG22 ILE 34 HG22 ILE 34 -7.158 0.316 -4.325 290 HG23 ILE 34 HG23 ILE 34 -8.652 -0.605 -4.159 291 HD11 ILE 34 HD11 ILE 34 -10.207 -1.923 -6.666 292 HD12 ILE 34 HD12 ILE 34 -9.086 -3.094 -7.362 293 HD13 ILE 34 HD13 ILE 34 -8.891 -2.573 -5.689 294 H THR 35 H THR 35 -11.046 0.790 -3.985 295 HA THR 35 HA THR 35 -9.956 3.358 -3.054 296 HB THR 35 HB THR 35 -11.967 3.592 -1.698 297 HG1 THR 35 HG1 THR 35 -13.119 1.320 -2.891 298 HG21 THR 35 HG21 THR 35 -11.930 3.471 -4.562 299 HG22 THR 35 HG22 THR 35 -12.837 4.556 -3.508 300 HG23 THR 35 HG23 THR 35 -13.523 2.999 -3.972 301 H GLN 36 H GLN 36 -9.212 3.606 -0.958 302 HA GLN 36 HA GLN 36 -8.569 1.098 0.423 303 HB2 GLN 36 HB2 GLN 36 -6.837 2.951 -0.340 304 HB3 GLN 36 HB3 GLN 36 -7.316 3.698 1.179 305 HG2 GLN 36 HG2 GLN 36 -6.823 1.339 2.169 306 HG3 GLN 36 HG3 GLN 36 -5.869 1.138 0.700 307 HE21 GLN 36 HE21 GLN 36 -3.935 1.054 1.820 308 HE22 GLN 36 HE22 GLN 36 -3.229 2.447 2.559 309 H GLY 37 H GLY 37 -10.025 0.611 1.939 310 HA2 GLY 37 HA2 GLY 37 -11.066 0.815 4.003 311 HA3 GLY 37 HA3 GLY 37 -10.478 2.467 4.103 312 H GLY 38 H GLY 38 -11.550 3.584 1.823 313 HA2 GLY 38 HA2 GLY 38 -14.229 3.041 1.283 314 HA3 GLY 38 HA3 GLY 38 -14.197 4.129 2.663 315 H LYS 39 H LYS 39 -11.520 4.646 0.722 316 HA LYS 39 HA LYS 39 -12.888 6.675 -0.902 317 HB2 LYS 39 HB2 LYS 39 -11.890 7.680 1.185 318 HB3 LYS 39 HB3 LYS 39 -10.310 7.200 0.581 319 HG2 LYS 39 HG2 LYS 39 -10.189 8.977 -0.740 320 HG3 LYS 39 HG3 LYS 39 -11.790 8.667 -1.416 321 HD2 LYS 39 HD2 LYS 39 -12.827 9.782 0.482 322 HD3 LYS 39 HD3 LYS 39 -11.242 10.045 1.213 323 HE2 LYS 39 HE2 LYS 39 -10.964 11.909 0.037 324 HE3 LYS 39 HE3 LYS 39 -11.235 11.038 -1.472 325 HZ1 LYS 39 HZ1 LYS 39 -13.669 11.497 -0.060 326 HZ2 LYS 39 HZ2 LYS 39 -13.258 11.900 -1.651 327 HZ3 LYS 39 HZ3 LYS 39 -12.863 12.949 -0.384 328 H VAL 40 H VAL 40 -12.032 7.023 -2.914 329 HA VAL 40 HA VAL 40 -10.588 4.992 -4.151 330 HB VAL 40 HB VAL 40 -12.017 6.708 -5.304 331 HG11 VAL 40 HG11 VAL 40 -9.570 8.444 -5.341 332 HG12 VAL 40 HG12 VAL 40 -11.223 8.850 -5.806 333 HG13 VAL 40 HG13 VAL 40 -10.814 8.626 -4.105 334 HG21 VAL 40 HG21 VAL 40 -11.039 5.579 -6.973 335 HG22 VAL 40 HG22 VAL 40 -10.012 7.003 -7.142 336 HG23 VAL 40 HG23 VAL 40 -9.455 5.621 -6.198 337 H VAL 41 H VAL 41 -8.474 4.604 -4.526 338 HA VAL 41 HA VAL 41 -6.519 6.620 -3.637 339 HB VAL 41 HB VAL 41 -5.083 4.598 -2.950 340 HG11 VAL 41 HG11 VAL 41 -7.388 4.846 -1.098 341 HG12 VAL 41 HG12 VAL 41 -5.657 4.968 -0.777 342 HG13 VAL 41 HG13 VAL 41 -6.514 6.317 -1.523 343 HG21 VAL 41 HG21 VAL 41 -6.630 2.938 -3.999 344 HG22 VAL 41 HG22 VAL 41 -6.222 2.593 -2.319 345 HG23 VAL 41 HG23 VAL 41 -7.790 3.293 -2.719 346 H LYS 42 H LYS 42 -7.554 4.402 -5.998 347 HA LYS 42 HA LYS 42 -5.539 5.235 -7.835 348 HB2 LYS 42 HB2 LYS 42 -4.593 3.274 -6.298 349 HB3 LYS 42 HB3 LYS 42 -5.472 2.282 -7.455 350 HG2 LYS 42 HG2 LYS 42 -4.185 3.133 -9.273 351 HG3 LYS 42 HG3 LYS 42 -3.429 4.348 -8.239 352 HD2 LYS 42 HD2 LYS 42 -3.107 1.619 -7.251 353 HD3 LYS 42 HD3 LYS 42 -2.385 1.878 -8.841 354 HE2 LYS 42 HE2 LYS 42 -1.804 4.088 -7.090 355 HE3 LYS 42 HE3 LYS 42 -1.318 2.566 -6.344 356 HZ1 LYS 42 HZ1 LYS 42 -0.154 3.962 -8.557 357 HZ2 LYS 42 HZ2 LYS 42 -0.455 2.337 -8.913 358 HZ3 LYS 42 HZ3 LYS 42 0.505 2.747 -7.582 359 H ASN 43 H ASN 43 -5.840 4.249 -9.990 360 HA ASN 43 HA ASN 43 -8.429 2.938 -10.368 361 HB2 ASN 43 HB2 ASN 43 -8.867 4.524 -12.305 362 HB3 ASN 43 HB3 ASN 43 -9.040 5.212 -10.693 363 HD21 ASN 43 HD21 ASN 43 -7.303 6.513 -9.874 364 HD22 ASN 43 HD22 ASN 43 -6.289 7.381 -10.970 365 H TRP 44 H TRP 44 -8.273 1.293 -11.741 366 HA TRP 44 HA TRP 44 -5.907 1.159 -13.483 367 HB2 TRP 44 HB2 TRP 44 -7.551 -0.921 -12.090 368 HB3 TRP 44 HB3 TRP 44 -6.682 -1.353 -13.560 369 HD1 TRP 44 HD1 TRP 44 -6.078 -0.299 -9.927 370 HE1 TRP 44 HE1 TRP 44 -3.645 -0.862 -9.303 371 HE3 TRP 44 HE3 TRP 44 -4.362 -1.692 -14.536 372 HZ2 TRP 44 HZ2 TRP 44 -1.308 -1.776 -10.595 373 HZ3 TRP 44 HZ3 TRP 44 -2.014 -2.397 -14.757 374 HH2 TRP 44 HH2 TRP 44 -0.521 -2.436 -12.826 375 H VAL 45 H VAL 45 -6.141 0.316 -15.625 376 HA VAL 45 HA VAL 45 -8.867 0.559 -16.718 377 HB VAL 45 HB VAL 45 -6.357 1.439 -18.145 378 HG11 VAL 45 HG11 VAL 45 -7.673 1.377 -19.937 379 HG12 VAL 45 HG12 VAL 45 -9.092 1.006 -18.955 380 HG13 VAL 45 HG13 VAL 45 -8.611 2.683 -19.214 381 HG21 VAL 45 HG21 VAL 45 -8.040 2.825 -16.198 382 HG22 VAL 45 HG22 VAL 45 -6.420 3.213 -16.777 383 HG23 VAL 45 HG23 VAL 45 -7.832 3.703 -17.714 384 H MET 46 H MET 46 -9.517 -1.010 -18.083 385 HA MET 46 HA MET 46 -7.648 -3.208 -18.572 386 HB2 MET 46 HB2 MET 46 -9.668 -3.941 -17.555 387 HB3 MET 46 HB3 MET 46 -10.654 -3.006 -18.671 388 HG2 MET 46 HG2 MET 46 -10.453 -4.531 -20.353 389 HG3 MET 46 HG3 MET 46 -8.886 -5.110 -19.790 390 HE1 MET 46 HE1 MET 46 -12.935 -5.539 -18.282 391 HE2 MET 46 HE2 MET 46 -12.432 -5.196 -19.937 392 HE3 MET 46 HE3 MET 46 -12.834 -6.847 -19.461 393 H ASP 47 H ASP 47 -6.610 -3.215 -20.445 394 HA ASP 47 HA ASP 47 -7.629 -1.749 -22.723 395 HB2 ASP 47 HB2 ASP 47 -5.095 -2.317 -21.811 396 HB3 ASP 47 HB3 ASP 47 -5.269 -3.430 -23.165 397 H LEU 48 H LEU 48 -9.069 -2.634 -24.040 398 HA LEU 48 HA LEU 48 -9.217 -5.536 -24.300 399 HB2 LEU 48 HB2 LEU 48 -11.126 -3.537 -24.175 400 HB3 LEU 48 HB3 LEU 48 -11.114 -3.999 -25.875 401 HG LEU 48 HG LEU 48 -12.798 -5.300 -24.891 402 HD11 LEU 48 HD11 LEU 48 -11.167 -6.537 -26.323 403 HD12 LEU 48 HD12 LEU 48 -12.052 -7.546 -25.179 404 HD13 LEU 48 HD13 LEU 48 -10.381 -7.094 -24.845 405 HD21 LEU 48 HD21 LEU 48 -11.654 -4.834 -22.529 406 HD22 LEU 48 HD22 LEU 48 -11.100 -6.490 -22.776 407 HD23 LEU 48 HD23 LEU 48 -12.827 -6.128 -22.779 408 H LYS 49 H LYS 49 -7.931 -2.860 -25.934 409 HA LYS 49 HA LYS 49 -8.133 -3.915 -28.600 410 HB2 LYS 49 HB2 LYS 49 -7.923 -1.457 -27.964 411 HB3 LYS 49 HB3 LYS 49 -6.223 -1.783 -27.650 412 HG2 LYS 49 HG2 LYS 49 -5.880 -2.426 -29.950 413 HG3 LYS 49 HG3 LYS 49 -7.602 -2.236 -30.289 414 HD2 LYS 49 HD2 LYS 49 -7.065 0.197 -29.281 415 HD3 LYS 49 HD3 LYS 49 -5.487 -0.195 -29.968 416 HE2 LYS 49 HE2 LYS 49 -6.227 0.248 -32.015 417 HE3 LYS 49 HE3 LYS 49 -7.538 -0.915 -31.827 418 HZ1 LYS 49 HZ1 LYS 49 -8.796 0.917 -32.055 419 HZ2 LYS 49 HZ2 LYS 49 -7.573 1.974 -31.558 420 HZ3 LYS 49 HZ3 LYS 49 -8.479 1.127 -30.407 421 H ASN 50 H ASN 50 -5.650 -3.785 -26.088 422 HA ASN 50 HA ASN 50 -3.901 -5.449 -27.759 423 HB2 ASN 50 HB2 ASN 50 -3.244 -3.217 -26.410 424 HB3 ASN 50 HB3 ASN 50 -2.938 -4.409 -25.151 425 HD21 ASN 50 HD21 ASN 50 -1.208 -2.654 -26.908 426 HD22 ASN 50 HD22 ASN 50 -0.022 -3.738 -27.542 427 H VAL 51 H VAL 51 -6.100 -5.654 -25.227 428 HA VAL 51 HA VAL 51 -6.760 -7.375 -23.888 429 HB VAL 51 HB VAL 51 -4.683 -9.118 -25.196 430 HG11 VAL 51 HG11 VAL 51 -7.069 -10.498 -24.818 431 HG12 VAL 51 HG12 VAL 51 -5.601 -10.632 -23.847 432 HG13 VAL 51 HG13 VAL 51 -6.881 -9.517 -23.365 433 HG21 VAL 51 HG21 VAL 51 -7.341 -8.212 -26.266 434 HG22 VAL 51 HG22 VAL 51 -5.764 -8.157 -27.055 435 HG23 VAL 51 HG23 VAL 51 -6.570 -9.706 -26.800 436 H LYS 52 H LYS 52 -5.040 -5.617 -22.761 437 HA LYS 52 HA LYS 52 -3.630 -7.312 -20.856 438 HB2 LYS 52 HB2 LYS 52 -1.988 -6.617 -22.635 439 HB3 LYS 52 HB3 LYS 52 -2.252 -4.951 -22.140 440 HG2 LYS 52 HG2 LYS 52 -0.231 -5.842 -21.141 441 HG3 LYS 52 HG3 LYS 52 -1.434 -5.482 -19.901 442 HD2 LYS 52 HD2 LYS 52 -2.027 -7.821 -19.743 443 HD3 LYS 52 HD3 LYS 52 -0.937 -8.218 -21.074 444 HE2 LYS 52 HE2 LYS 52 0.806 -7.006 -19.460 445 HE3 LYS 52 HE3 LYS 52 -0.337 -7.572 -18.243 446 HZ1 LYS 52 HZ1 LYS 52 -0.064 -9.775 -19.680 447 HZ2 LYS 52 HZ2 LYS 52 0.941 -9.409 -18.371 448 HZ3 LYS 52 HZ3 LYS 52 1.461 -9.095 -19.950 449 H LEU 53 H LEU 53 -3.167 -6.251 -18.846 450 HA LEU 53 HA LEU 53 -5.040 -4.071 -18.308 451 HB2 LEU 53 HB2 LEU 53 -3.823 -6.249 -16.727 452 HB3 LEU 53 HB3 LEU 53 -4.113 -4.733 -15.876 453 HG LEU 53 HG LEU 53 -5.956 -6.252 -15.518 454 HD11 LEU 53 HD11 LEU 53 -6.200 -3.659 -16.703 455 HD12 LEU 53 HD12 LEU 53 -7.200 -4.419 -15.466 456 HD13 LEU 53 HD13 LEU 53 -7.573 -4.661 -17.173 457 HD21 LEU 53 HD21 LEU 53 -5.483 -7.312 -17.896 458 HD22 LEU 53 HD22 LEU 53 -6.759 -6.193 -18.377 459 HD23 LEU 53 HD23 LEU 53 -7.072 -7.407 -17.136 460 H VAL 54 H VAL 54 -4.427 -2.077 -17.683 461 HA VAL 54 HA VAL 54 -1.648 -1.597 -16.912 462 HB VAL 54 HB VAL 54 -2.896 0.218 -18.948 463 HG11 VAL 54 HG11 VAL 54 -0.279 -0.135 -17.658 464 HG12 VAL 54 HG12 VAL 54 -0.224 0.190 -19.392 465 HG13 VAL 54 HG13 VAL 54 -1.040 1.317 -18.308 466 HG21 VAL 54 HG21 VAL 54 -1.501 -1.053 -20.647 467 HG22 VAL 54 HG22 VAL 54 -1.426 -2.355 -19.460 468 HG23 VAL 54 HG23 VAL 54 -2.984 -1.836 -20.103 469 H GLU 55 H GLU 55 -1.325 0.625 -16.070 470 HA GLU 55 HA GLU 55 -3.701 1.456 -14.569 471 HB2 GLU 55 HB2 GLU 55 -1.897 2.822 -13.295 472 HB3 GLU 55 HB3 GLU 55 -1.993 1.085 -13.043 473 HG2 GLU 55 HG2 GLU 55 0.011 0.699 -13.983 474 HG3 GLU 55 HG3 GLU 55 -0.200 1.952 -15.205 475 H SER 56 H SER 56 -4.833 3.059 -15.431 476 HA SER 56 HA SER 56 -3.499 5.502 -16.229 477 HB2 SER 56 HB2 SER 56 -3.530 4.125 -18.308 478 HB3 SER 56 HB3 SER 56 -5.289 4.059 -18.200 479 HG SER 56 HG SER 56 -3.618 6.253 -18.753 480 H ASP 57 H ASP 57 -5.214 7.163 -16.940 481 HA ASP 57 HA ASP 57 -7.580 6.828 -15.215 482 HB2 ASP 57 HB2 ASP 57 -5.656 8.687 -14.877 483 HB3 ASP 57 HB3 ASP 57 -6.720 9.560 -15.977 484 H ASP 58 H ASP 58 -6.765 6.660 -18.317 485 HA ASP 58 HA ASP 58 -8.353 8.422 -19.744 486 HB2 ASP 58 HB2 ASP 58 -6.711 6.771 -20.696 487 HB3 ASP 58 HB3 ASP 58 -7.925 5.517 -20.458 488 H ALA 59 H ALA 59 -10.421 8.087 -20.805 489 HA ALA 59 HA ALA 59 -12.444 7.320 -18.974 490 HB1 ALA 59 HB1 ALA 59 -13.523 8.761 -20.275 491 HB2 ALA 59 HB2 ALA 59 -12.293 8.635 -21.533 492 HB3 ALA 59 HB3 ALA 59 -13.633 7.489 -21.492 493 H ALA 60 H ALA 60 -14.323 5.880 -19.845 494 HA ALA 60 HA ALA 60 -13.563 3.620 -21.438 495 HB1 ALA 60 HB1 ALA 60 -12.550 2.547 -19.730 496 HB2 ALA 60 HB2 ALA 60 -13.399 3.478 -18.496 497 HB3 ALA 60 HB3 ALA 60 -14.208 2.131 -19.296 498 H GLU 61 H GLU 61 -15.325 2.079 -21.704 499 HA GLU 61 HA GLU 61 -17.797 3.302 -22.092 500 HB2 GLU 61 HB2 GLU 61 -17.091 0.376 -21.846 501 HB3 GLU 61 HB3 GLU 61 -18.668 0.959 -22.359 502 HG2 GLU 61 HG2 GLU 61 -16.035 1.266 -23.764 503 HG3 GLU 61 HG3 GLU 61 -17.476 0.415 -24.317 504 H ALA 62 H ALA 62 -16.450 1.816 -19.278 505 HA ALA 62 HA ALA 62 -18.659 2.710 -17.672 506 HB1 ALA 62 HB1 ALA 62 -18.457 -0.101 -18.477 507 HB2 ALA 62 HB2 ALA 62 -18.640 0.154 -16.741 508 HB3 ALA 62 HB3 ALA 62 -19.836 0.810 -17.859 509 H THR 63 H THR 63 -18.267 2.369 -15.353 510 HA THR 63 HA THR 63 -15.447 1.838 -14.711 511 HB THR 63 HB THR 63 -17.020 4.138 -13.541 512 HG1 THR 63 HG1 THR 63 -14.842 4.359 -15.346 513 HG21 THR 63 HG21 THR 63 -14.323 4.606 -13.203 514 HG22 THR 63 HG22 THR 63 -14.467 2.870 -12.926 515 HG23 THR 63 HG23 THR 63 -15.428 3.999 -11.970 516 H LEU 64 H LEU 64 -15.171 0.529 -13.018 517 HA LEU 64 HA LEU 64 -17.482 0.044 -11.256 518 HB2 LEU 64 HB2 LEU 64 -15.906 -1.746 -12.798 519 HB3 LEU 64 HB3 LEU 64 -15.594 -2.076 -11.095 520 HG LEU 64 HG LEU 64 -18.436 -1.824 -11.739 521 HD11 LEU 64 HD11 LEU 64 -16.805 -4.028 -12.988 522 HD12 LEU 64 HD12 LEU 64 -17.778 -2.822 -13.829 523 HD13 LEU 64 HD13 LEU 64 -18.561 -4.041 -12.823 524 HD21 LEU 64 HD21 LEU 64 -18.540 -3.867 -10.399 525 HD22 LEU 64 HD22 LEU 64 -17.602 -2.611 -9.589 526 HD23 LEU 64 HD23 LEU 64 -16.778 -3.951 -10.388 527 H THR 65 H THR 65 -17.161 1.082 -9.398 528 HA THR 65 HA THR 65 -14.454 1.120 -8.245 529 HB THR 65 HB THR 65 -16.782 2.855 -7.416 530 HG1 THR 65 HG1 THR 65 -16.421 3.785 -9.293 531 HG21 THR 65 HG21 THR 65 -14.067 2.472 -6.477 532 HG22 THR 65 HG22 THR 65 -15.394 3.373 -5.744 533 HG23 THR 65 HG23 THR 65 -14.363 4.145 -6.948 534 H MET 66 H MET 66 -14.037 -0.021 -6.467 535 HA MET 66 HA MET 66 -16.039 -0.528 -4.468 536 HB2 MET 66 HB2 MET 66 -16.024 -2.946 -4.605 537 HB3 MET 66 HB3 MET 66 -16.555 -2.277 -6.143 538 HG2 MET 66 HG2 MET 66 -13.671 -2.877 -5.829 539 HG3 MET 66 HG3 MET 66 -14.783 -4.236 -5.977 540 HE1 MET 66 HE1 MET 66 -16.063 -4.857 -8.356 541 HE2 MET 66 HE2 MET 66 -14.809 -4.708 -9.588 542 HE3 MET 66 HE3 MET 66 -14.402 -5.320 -7.983 543 H GLU 67 H GLU 67 -15.167 -1.405 -2.532 544 HA GLU 67 HA GLU 67 -12.579 -0.557 -1.912 545 HB2 GLU 67 HB2 GLU 67 -14.771 -1.817 -0.543 546 HB3 GLU 67 HB3 GLU 67 -13.262 -2.587 -0.073 547 HG2 GLU 67 HG2 GLU 67 -12.416 -0.164 0.263 548 HG3 GLU 67 HG3 GLU 67 -14.131 0.244 0.296 549 H ASP 68 H ASP 68 -10.683 -1.735 -1.387 550 HA ASP 68 HA ASP 68 -9.845 -3.586 -3.261 551 HB2 ASP 68 HB2 ASP 68 -8.472 -2.185 -1.571 552 HB3 ASP 68 HB3 ASP 68 -8.698 -3.550 -0.481 553 H ASP 69 H ASP 69 -11.062 -4.173 0.020 554 HA ASP 69 HA ASP 69 -10.737 -6.967 0.004 555 HB2 ASP 69 HB2 ASP 69 -11.996 -4.977 1.702 556 HB3 ASP 69 HB3 ASP 69 -12.954 -6.453 1.621 557 H ILE 70 H ILE 70 -13.279 -4.885 -1.206 558 HA ILE 70 HA ILE 70 -15.175 -6.979 -1.647 559 HB ILE 70 HB ILE 70 -15.198 -4.383 -3.149 560 HG12 ILE 70 HG12 ILE 70 -14.702 -3.755 -0.857 561 HG13 ILE 70 HG13 ILE 70 -16.383 -3.372 -1.213 562 HG21 ILE 70 HG21 ILE 70 -17.724 -4.879 -2.289 563 HG22 ILE 70 HG22 ILE 70 -17.074 -5.404 -3.841 564 HG23 ILE 70 HG23 ILE 70 -17.095 -6.516 -2.473 565 HD11 ILE 70 HD11 ILE 70 -16.897 -5.655 -0.149 566 HD12 ILE 70 HD12 ILE 70 -15.270 -5.534 0.520 567 HD13 ILE 70 HD13 ILE 70 -16.474 -4.303 0.900 568 H MET 71 H MET 71 -13.071 -5.090 -3.817 569 HA MET 71 HA MET 71 -13.708 -6.296 -6.213 570 HB2 MET 71 HB2 MET 71 -12.295 -4.403 -6.281 571 HB3 MET 71 HB3 MET 71 -11.123 -5.137 -5.196 572 HG2 MET 71 HG2 MET 71 -9.997 -5.464 -7.112 573 HG3 MET 71 HG3 MET 71 -11.012 -6.902 -7.195 574 HE1 MET 71 HE1 MET 71 -10.357 -3.282 -8.885 575 HE2 MET 71 HE2 MET 71 -12.030 -2.968 -9.346 576 HE3 MET 71 HE3 MET 71 -11.605 -3.158 -7.644 577 H PHE 72 H PHE 72 -11.523 -7.418 -3.688 578 HA PHE 72 HA PHE 72 -10.344 -9.540 -5.100 579 HB2 PHE 72 HB2 PHE 72 -9.821 -8.491 -2.734 580 HB3 PHE 72 HB3 PHE 72 -10.874 -9.783 -2.167 581 HD1 PHE 72 HD1 PHE 72 -7.787 -9.093 -4.089 582 HD2 PHE 72 HD2 PHE 72 -10.089 -11.979 -1.970 583 HE1 PHE 72 HE1 PHE 72 -5.898 -10.666 -4.188 584 HE2 PHE 72 HE2 PHE 72 -8.203 -13.557 -2.065 585 HZ PHE 72 HZ PHE 72 -6.104 -12.901 -3.174 586 H ALA 73 H ALA 73 -13.253 -9.402 -3.084 587 HA ALA 73 HA ALA 73 -13.884 -12.127 -3.108 588 HB1 ALA 73 HB1 ALA 73 -14.934 -10.054 -1.842 589 HB2 ALA 73 HB2 ALA 73 -16.097 -10.147 -3.166 590 HB3 ALA 73 HB3 ALA 73 -15.848 -11.539 -2.112 591 H ILE 74 H ILE 74 -14.999 -9.523 -5.267 592 HA ILE 74 HA ILE 74 -16.529 -11.227 -6.939 593 HB ILE 74 HB ILE 74 -15.342 -8.550 -7.669 594 HG12 ILE 74 HG12 ILE 74 -18.092 -8.354 -6.986 595 HG13 ILE 74 HG13 ILE 74 -17.288 -9.215 -5.678 596 HG21 ILE 74 HG21 ILE 74 -17.667 -10.122 -8.764 597 HG22 ILE 74 HG22 ILE 74 -17.324 -8.442 -9.174 598 HG23 ILE 74 HG23 ILE 74 -16.169 -9.706 -9.597 599 HD11 ILE 74 HD11 ILE 74 -17.012 -6.414 -6.562 600 HD12 ILE 74 HD12 ILE 74 -16.960 -7.109 -4.941 601 HD13 ILE 74 HD13 ILE 74 -15.550 -7.221 -5.995 602 H GLY 75 H GLY 75 -13.175 -10.640 -6.681 603 HA2 GLY 75 HA2 GLY 75 -12.595 -11.417 -9.427 604 HA3 GLY 75 HA3 GLY 75 -11.420 -10.972 -8.198 605 H THR 76 H THR 76 -12.405 -12.785 -6.189 606 HA THR 76 HA THR 76 -11.230 -15.242 -7.254 607 HB THR 76 HB THR 76 -10.261 -14.344 -5.186 608 HG1 THR 76 HG1 THR 76 -11.697 -16.734 -4.611 609 HG21 THR 76 HG21 THR 76 -12.163 -15.029 -3.242 610 HG22 THR 76 HG22 THR 76 -13.031 -14.078 -4.448 611 HG23 THR 76 HG23 THR 76 -11.598 -13.413 -3.664 612 H GLY 77 H GLY 77 -14.001 -14.441 -7.856 613 HA2 GLY 77 HA2 GLY 77 -16.118 -15.337 -7.902 614 HA3 GLY 77 HA3 GLY 77 -15.279 -16.876 -7.776 615 H ALA 78 H ALA 78 -15.053 -14.503 -5.241 616 HA ALA 78 HA ALA 78 -16.134 -16.365 -3.338 617 HB1 ALA 78 HB1 ALA 78 -15.577 -14.697 -1.671 618 HB2 ALA 78 HB2 ALA 78 -14.233 -14.902 -2.794 619 HB3 ALA 78 HB3 ALA 78 -15.290 -13.498 -2.932 620 H LEU 79 H LEU 79 -16.958 -12.925 -3.727 621 HA LEU 79 HA LEU 79 -19.769 -13.639 -3.228 622 HB2 LEU 79 HB2 LEU 79 -18.075 -11.324 -2.471 623 HB3 LEU 79 HB3 LEU 79 -19.778 -11.014 -2.800 624 HG LEU 79 HG LEU 79 -18.886 -13.088 -0.815 625 HD11 LEU 79 HD11 LEU 79 -18.720 -11.568 0.873 626 HD12 LEU 79 HD12 LEU 79 -19.780 -10.402 0.082 627 HD13 LEU 79 HD13 LEU 79 -18.112 -10.585 -0.459 628 HD21 LEU 79 HD21 LEU 79 -21.135 -13.405 -1.362 629 HD22 LEU 79 HD22 LEU 79 -21.454 -11.672 -1.452 630 HD23 LEU 79 HD23 LEU 79 -21.183 -12.440 0.114 631 HA PRO 80 HA PRO 80 -20.832 -12.345 -7.299 632 HB2 PRO 80 HB2 PRO 80 -23.453 -11.764 -6.895 633 HB3 PRO 80 HB3 PRO 80 -22.834 -13.419 -6.955 634 HG2 PRO 80 HG2 PRO 80 -23.484 -11.725 -4.574 635 HG3 PRO 80 HG3 PRO 80 -23.840 -13.438 -4.859 636 HD2 PRO 80 HD2 PRO 80 -21.770 -12.617 -3.319 637 HD3 PRO 80 HD3 PRO 80 -21.711 -14.106 -4.283 638 H ALA 81 H ALA 81 -20.557 -10.485 -8.358 639 HA ALA 81 HA ALA 81 -20.214 -8.021 -7.081 640 HB1 ALA 81 HB1 ALA 81 -20.785 -7.374 -9.706 641 HB2 ALA 81 HB2 ALA 81 -19.195 -7.758 -9.045 642 HB3 ALA 81 HB3 ALA 81 -20.163 -9.021 -9.805 643 H LYS 82 H LYS 82 -23.059 -9.567 -8.314 644 HA LYS 82 HA LYS 82 -24.692 -7.271 -8.604 645 HB2 LYS 82 HB2 LYS 82 -25.725 -10.002 -7.876 646 HB3 LYS 82 HB3 LYS 82 -26.504 -8.762 -8.850 647 HG2 LYS 82 HG2 LYS 82 -24.194 -9.287 -10.246 648 HG3 LYS 82 HG3 LYS 82 -24.669 -10.873 -9.634 649 HD2 LYS 82 HD2 LYS 82 -26.626 -9.042 -10.994 650 HD3 LYS 82 HD3 LYS 82 -25.602 -10.154 -11.905 651 HE2 LYS 82 HE2 LYS 82 -26.536 -11.900 -10.169 652 HE3 LYS 82 HE3 LYS 82 -27.846 -10.728 -10.030 653 HZ1 LYS 82 HZ1 LYS 82 -27.174 -11.250 -12.751 654 HZ2 LYS 82 HZ2 LYS 82 -28.672 -11.362 -11.975 655 HZ3 LYS 82 HZ3 LYS 82 -27.602 -12.671 -11.940 656 H GLU 83 H GLU 83 -24.614 -9.725 -6.012 657 HA GLU 83 HA GLU 83 -26.370 -8.461 -4.269 658 HB2 GLU 83 HB2 GLU 83 -23.986 -10.184 -3.565 659 HB3 GLU 83 HB3 GLU 83 -25.329 -9.811 -2.494 660 HG2 GLU 83 HG2 GLU 83 -26.852 -10.930 -4.099 661 HG3 GLU 83 HG3 GLU 83 -25.441 -11.401 -5.045 662 H ALA 84 H ALA 84 -22.824 -8.228 -4.409 663 HA ALA 84 HA ALA 84 -22.366 -6.562 -2.266 664 HB1 ALA 84 HB1 ALA 84 -20.870 -6.105 -4.810 665 HB2 ALA 84 HB2 ALA 84 -20.275 -6.162 -3.150 666 HB3 ALA 84 HB3 ALA 84 -20.730 -7.652 -3.974 667 H MET 85 H MET 85 -23.406 -5.695 -5.532 668 HA MET 85 HA MET 85 -23.256 -2.887 -5.151 669 HB2 MET 85 HB2 MET 85 -23.826 -4.630 -7.277 670 HB3 MET 85 HB3 MET 85 -25.270 -3.646 -7.077 671 HG2 MET 85 HG2 MET 85 -22.580 -2.356 -7.171 672 HG3 MET 85 HG3 MET 85 -23.377 -2.862 -8.659 673 HE1 MET 85 HE1 MET 85 -25.869 -0.364 -9.458 674 HE2 MET 85 HE2 MET 85 -25.031 -1.879 -9.792 675 HE3 MET 85 HE3 MET 85 -26.448 -1.868 -8.741 676 H ALA 86 H ALA 86 -25.656 -5.297 -4.420 677 HA ALA 86 HA ALA 86 -27.865 -3.535 -4.108 678 HB1 ALA 86 HB1 ALA 86 -28.019 -6.008 -4.451 679 HB2 ALA 86 HB2 ALA 86 -27.492 -6.212 -2.780 680 HB3 ALA 86 HB3 ALA 86 -29.009 -5.385 -3.131 681 H GLN 87 H GLN 87 -25.391 -4.775 -1.920 682 HA GLN 87 HA GLN 87 -26.585 -3.462 0.371 683 HB2 GLN 87 HB2 GLN 87 -24.452 -4.302 1.506 684 HB3 GLN 87 HB3 GLN 87 -25.580 -5.516 0.916 685 HG2 GLN 87 HG2 GLN 87 -24.205 -5.851 -1.063 686 HG3 GLN 87 HG3 GLN 87 -23.084 -4.612 -0.503 687 HE21 GLN 87 HE21 GLN 87 -23.128 -7.696 -0.936 688 HE22 GLN 87 HE22 GLN 87 -22.297 -8.281 0.461 689 H ASP 88 H ASP 88 -25.197 -2.173 -2.139 690 HA ASP 88 HA ASP 88 -24.145 -0.198 -2.554 691 HB2 ASP 88 HB2 ASP 88 -24.010 0.416 0.378 692 HB3 ASP 88 HB3 ASP 88 -24.269 1.511 -0.977 693 H LYS 89 H LYS 89 -22.775 -2.752 -1.387 694 HA LYS 89 HA LYS 89 -20.334 -1.813 -0.248 695 HB2 LYS 89 HB2 LYS 89 -21.317 -4.441 -1.294 696 HB3 LYS 89 HB3 LYS 89 -19.602 -4.228 -0.971 697 HG2 LYS 89 HG2 LYS 89 -21.828 -3.854 1.022 698 HG3 LYS 89 HG3 LYS 89 -20.746 -5.245 0.920 699 HD2 LYS 89 HD2 LYS 89 -19.396 -4.169 2.330 700 HD3 LYS 89 HD3 LYS 89 -19.052 -3.039 1.017 701 HE2 LYS 89 HE2 LYS 89 -20.379 -1.417 1.886 702 HE3 LYS 89 HE3 LYS 89 -21.535 -2.570 2.552 703 HZ1 LYS 89 HZ1 LYS 89 -20.147 -1.267 4.193 704 HZ2 LYS 89 HZ2 LYS 89 -18.833 -2.212 3.704 705 HZ3 LYS 89 HZ3 LYS 89 -20.184 -2.945 4.411 706 H MET 90 H MET 90 -21.536 -1.660 -3.349 707 HA MET 90 HA MET 90 -19.069 -0.732 -4.420 708 HB2 MET 90 HB2 MET 90 -18.498 -2.402 -5.933 709 HB3 MET 90 HB3 MET 90 -18.949 -3.322 -4.504 710 HG2 MET 90 HG2 MET 90 -20.274 -4.493 -5.840 711 HG3 MET 90 HG3 MET 90 -21.325 -3.078 -5.866 712 HE1 MET 90 HE1 MET 90 -20.759 -5.174 -9.152 713 HE2 MET 90 HE2 MET 90 -19.043 -5.245 -8.749 714 HE3 MET 90 HE3 MET 90 -20.253 -5.630 -7.524 715 H GLU 91 H GLU 91 -19.301 0.175 -6.541 716 HA GLU 91 HA GLU 91 -22.061 0.349 -7.527 717 HB2 GLU 91 HB2 GLU 91 -20.268 2.592 -6.691 718 HB3 GLU 91 HB3 GLU 91 -21.392 2.846 -8.018 719 HG2 GLU 91 HG2 GLU 91 -22.244 1.830 -5.323 720 HG3 GLU 91 HG3 GLU 91 -22.192 3.542 -5.739 721 H VAL 92 H VAL 92 -22.134 1.394 -9.735 722 HA VAL 92 HA VAL 92 -19.693 1.108 -11.296 723 HB VAL 92 HB VAL 92 -22.140 -0.345 -12.255 724 HG11 VAL 92 HG11 VAL 92 -20.548 0.071 -13.963 725 HG12 VAL 92 HG12 VAL 92 -19.207 -0.424 -12.928 726 HG13 VAL 92 HG13 VAL 92 -20.365 -1.622 -13.508 727 HG21 VAL 92 HG21 VAL 92 -21.680 -1.399 -10.163 728 HG22 VAL 92 HG22 VAL 92 -21.044 -2.442 -11.435 729 HG23 VAL 92 HG23 VAL 92 -19.948 -1.430 -10.495 730 H ASP 93 H ASP 93 -19.707 2.251 -13.224 731 HA ASP 93 HA ASP 93 -22.126 3.843 -13.766 732 HB2 ASP 93 HB2 ASP 93 -19.827 4.892 -12.731 733 HB3 ASP 93 HB3 ASP 93 -19.555 5.103 -14.459 734 H GLY 94 H GLY 94 -22.040 4.851 -16.009 735 HA2 GLY 94 HA2 GLY 94 -21.361 4.724 -18.282 736 HA3 GLY 94 HA3 GLY 94 -20.577 3.190 -17.934 737 H GLN 95 H GLN 95 -21.515 1.676 -19.134 738 HA GLN 95 HA GLN 95 -24.386 1.801 -19.643 739 HB2 GLN 95 HB2 GLN 95 -22.103 0.840 -21.085 740 HB3 GLN 95 HB3 GLN 95 -23.245 -0.481 -20.870 741 HG2 GLN 95 HG2 GLN 95 -23.473 0.927 -22.967 742 HG3 GLN 95 HG3 GLN 95 -24.936 0.633 -22.029 743 HE21 GLN 95 HE21 GLN 95 -26.052 2.319 -21.248 744 HE22 GLN 95 HE22 GLN 95 -25.579 3.973 -21.409 745 H VAL 96 H VAL 96 -25.491 1.037 -17.925 746 HA VAL 96 HA VAL 96 -24.669 -0.972 -16.166 747 HB VAL 96 HB VAL 96 -27.492 -0.166 -16.885 748 HG11 VAL 96 HG11 VAL 96 -26.403 -2.128 -15.007 749 HG12 VAL 96 HG12 VAL 96 -27.536 -0.986 -14.282 750 HG13 VAL 96 HG13 VAL 96 -28.032 -1.966 -15.662 751 HG21 VAL 96 HG21 VAL 96 -27.291 1.164 -14.757 752 HG22 VAL 96 HG22 VAL 96 -25.559 0.839 -14.805 753 HG23 VAL 96 HG23 VAL 96 -26.321 1.751 -16.108 754 H GLU 97 H GLU 97 -25.905 -1.185 -19.360 755 HA GLU 97 HA GLU 97 -26.948 -3.845 -19.165 756 HB2 GLU 97 HB2 GLU 97 -26.965 -3.740 -21.659 757 HB3 GLU 97 HB3 GLU 97 -27.814 -2.410 -20.884 758 HG2 GLU 97 HG2 GLU 97 -26.637 -1.051 -22.174 759 HG3 GLU 97 HG3 GLU 97 -25.236 -1.462 -21.186 760 H LEU 98 H LEU 98 -23.883 -2.404 -20.128 761 HA LEU 98 HA LEU 98 -22.756 -4.914 -20.982 762 HB2 LEU 98 HB2 LEU 98 -21.900 -2.098 -20.860 763 HB3 LEU 98 HB3 LEU 98 -20.616 -3.292 -20.693 764 HG LEU 98 HG LEU 98 -22.465 -3.700 -22.957 765 HD11 LEU 98 HD11 LEU 98 -21.191 -1.149 -22.512 766 HD12 LEU 98 HD12 LEU 98 -22.318 -1.641 -23.775 767 HD13 LEU 98 HD13 LEU 98 -20.589 -1.922 -23.978 768 HD21 LEU 98 HD21 LEU 98 -20.547 -4.513 -24.020 769 HD22 LEU 98 HD22 LEU 98 -20.360 -5.018 -22.341 770 HD23 LEU 98 HD23 LEU 98 -19.465 -3.625 -22.948 771 H ILE 99 H ILE 99 -22.449 -2.782 -18.171 772 HA ILE 99 HA ILE 99 -20.403 -4.048 -16.815 773 HB ILE 99 HB ILE 99 -21.168 -3.026 -14.828 774 HG12 ILE 99 HG12 ILE 99 -23.899 -2.801 -16.112 775 HG13 ILE 99 HG13 ILE 99 -23.455 -3.961 -14.864 776 HG21 ILE 99 HG21 ILE 99 -21.064 -1.614 -17.249 777 HG22 ILE 99 HG22 ILE 99 -22.417 -0.938 -16.345 778 HG23 ILE 99 HG23 ILE 99 -20.809 -0.985 -15.622 779 HD11 ILE 99 HD11 ILE 99 -23.449 -0.969 -14.549 780 HD12 ILE 99 HD12 ILE 99 -24.694 -2.068 -13.957 781 HD13 ILE 99 HD13 ILE 99 -23.060 -2.151 -13.299 782 H PHE 100 H PHE 100 -23.838 -4.871 -16.910 783 HA PHE 100 HA PHE 100 -23.558 -7.029 -15.029 784 HB2 PHE 100 HB2 PHE 100 -25.832 -7.149 -15.066 785 HB3 PHE 100 HB3 PHE 100 -25.675 -5.545 -15.774 786 HD1 PHE 100 HD1 PHE 100 -25.894 -9.136 -16.724 787 HD2 PHE 100 HD2 PHE 100 -26.664 -5.093 -17.812 788 HE1 PHE 100 HE1 PHE 100 -27.104 -9.908 -18.723 789 HE2 PHE 100 HE2 PHE 100 -27.876 -5.859 -19.812 790 HZ PHE 100 HZ PHE 100 -28.098 -8.268 -20.269 791 H LEU 101 H LEU 101 -23.363 -6.633 -18.467 792 HA LEU 101 HA LEU 101 -23.822 -9.302 -19.252 793 HB2 LEU 101 HB2 LEU 101 -23.354 -6.932 -20.537 794 HB3 LEU 101 HB3 LEU 101 -21.867 -7.824 -20.850 795 HG LEU 101 HG LEU 101 -23.397 -8.127 -22.685 796 HD11 LEU 101 HD11 LEU 101 -23.326 -10.637 -21.019 797 HD12 LEU 101 HD12 LEU 101 -21.979 -10.027 -21.980 798 HD13 LEU 101 HD13 LEU 101 -23.471 -10.530 -22.773 799 HD21 LEU 101 HD21 LEU 101 -25.521 -9.556 -22.028 800 HD22 LEU 101 HD22 LEU 101 -25.547 -7.792 -21.997 801 HD23 LEU 101 HD23 LEU 101 -25.328 -8.698 -20.499 802 H LEU 102 H LEU 102 -21.323 -7.961 -17.459 803 HA LEU 102 HA LEU 102 -19.297 -9.851 -18.348 804 HB2 LEU 102 HB2 LEU 102 -19.340 -7.563 -16.417 805 HB3 LEU 102 HB3 LEU 102 -18.021 -8.732 -16.393 806 HG LEU 102 HG LEU 102 -18.763 -7.209 -18.877 807 HD11 LEU 102 HD11 LEU 102 -18.252 -5.430 -17.499 808 HD12 LEU 102 HD12 LEU 102 -16.675 -5.838 -18.173 809 HD13 LEU 102 HD13 LEU 102 -17.099 -6.363 -16.544 810 HD21 LEU 102 HD21 LEU 102 -16.168 -7.667 -19.096 811 HD22 LEU 102 HD22 LEU 102 -17.365 -8.874 -19.566 812 HD23 LEU 102 HD23 LEU 102 -16.556 -8.996 -18.003 813 H GLU 103 H GLU 103 -21.546 -9.374 -15.725 814 HA GLU 103 HA GLU 103 -20.558 -10.929 -13.711 815 HB2 GLU 103 HB2 GLU 103 -23.120 -9.948 -14.485 816 HB3 GLU 103 HB3 GLU 103 -23.306 -11.627 -13.997 817 HG2 GLU 103 HG2 GLU 103 -21.701 -9.863 -12.241 818 HG3 GLU 103 HG3 GLU 103 -23.447 -9.618 -12.277 819 HA PRO 104 HA PRO 104 -22.331 -14.943 -15.728 820 HB2 PRO 104 HB2 PRO 104 -23.222 -14.767 -18.286 821 HB3 PRO 104 HB3 PRO 104 -24.263 -14.487 -16.885 822 HG2 PRO 104 HG2 PRO 104 -22.890 -12.498 -18.652 823 HG3 PRO 104 HG3 PRO 104 -24.541 -12.469 -18.007 824 HD2 PRO 104 HD2 PRO 104 -22.524 -11.026 -16.918 825 HD3 PRO 104 HD3 PRO 104 -23.856 -11.688 -15.949 826 H PHE 105 H PHE 105 -20.218 -12.711 -17.120 827 HA PHE 105 HA PHE 105 -18.936 -14.709 -18.836 828 HB2 PHE 105 HB2 PHE 105 -19.250 -11.865 -18.974 829 HB3 PHE 105 HB3 PHE 105 -17.532 -12.245 -18.925 830 HD1 PHE 105 HD1 PHE 105 -20.678 -13.145 -20.688 831 HD2 PHE 105 HD2 PHE 105 -16.432 -12.894 -20.857 832 HE1 PHE 105 HE1 PHE 105 -20.743 -13.714 -23.081 833 HE2 PHE 105 HE2 PHE 105 -16.491 -13.461 -23.251 834 HZ PHE 105 HZ PHE 105 -18.648 -13.871 -24.366 835 H ILE 106 H ILE 106 -18.776 -13.606 -15.710 836 HA ILE 106 HA ILE 106 -16.081 -13.295 -15.146 837 HB ILE 106 HB ILE 106 -18.205 -14.579 -13.426 838 HG12 ILE 106 HG12 ILE 106 -17.116 -11.770 -13.270 839 HG13 ILE 106 HG13 ILE 106 -18.522 -12.182 -14.246 840 HG21 ILE 106 HG21 ILE 106 -16.473 -13.545 -11.662 841 HG22 ILE 106 HG22 ILE 106 -16.393 -15.211 -12.231 842 HG23 ILE 106 HG23 ILE 106 -15.353 -13.983 -12.951 843 HD11 ILE 106 HD11 ILE 106 -19.580 -13.079 -12.160 844 HD12 ILE 106 HD12 ILE 106 -18.232 -12.379 -11.264 845 HD13 ILE 106 HD13 ILE 106 -19.314 -11.336 -12.186 846 H ALA 107 H ALA 107 -17.868 -16.172 -15.900 847 HA ALA 107 HA ALA 107 -15.982 -18.044 -14.864 848 HB1 ALA 107 HB1 ALA 107 -18.302 -18.670 -15.223 849 HB2 ALA 107 HB2 ALA 107 -18.123 -18.403 -16.958 850 HB3 ALA 107 HB3 ALA 107 -17.230 -19.703 -16.169 851 H SER 108 H SER 108 -16.458 -16.469 -17.976 852 HA SER 108 HA SER 108 -14.366 -18.023 -19.241 853 HB2 SER 108 HB2 SER 108 -16.453 -16.154 -20.109 854 HB3 SER 108 HB3 SER 108 -14.926 -15.952 -20.967 855 HG SER 108 HG SER 108 -16.772 -17.895 -21.220 856 H LEU 109 H LEU 109 -14.824 -14.786 -17.940 857 HA LEU 109 HA LEU 109 -12.088 -14.409 -17.408 858 HB2 LEU 109 HB2 LEU 109 -12.235 -14.165 -19.959 859 HB3 LEU 109 HB3 LEU 109 -13.050 -12.638 -19.631 860 HG LEU 109 HG LEU 109 -10.626 -12.421 -20.151 861 HD11 LEU 109 HD11 LEU 109 -11.953 -10.791 -18.761 862 HD12 LEU 109 HD12 LEU 109 -10.207 -10.764 -18.515 863 HD13 LEU 109 HD13 LEU 109 -11.251 -11.560 -17.337 864 HD21 LEU 109 HD21 LEU 109 -9.034 -13.543 -19.060 865 HD22 LEU 109 HD22 LEU 109 -10.336 -14.575 -18.465 866 HD23 LEU 109 HD23 LEU 109 -9.765 -13.222 -17.487 867 H LYS 110 H LYS 110 -12.198 -13.259 -15.609 868 HA LYS 110 HA LYS 110 -14.435 -11.481 -15.123 869 HB2 LYS 110 HB2 LYS 110 -13.127 -13.136 -13.477 870 HB3 LYS 110 HB3 LYS 110 -12.181 -11.681 -13.194 871 HG2 LYS 110 HG2 LYS 110 -15.130 -11.429 -13.086 872 HG3 LYS 110 HG3 LYS 110 -14.331 -12.285 -11.765 873 HD2 LYS 110 HD2 LYS 110 -14.153 -10.197 -10.910 874 HD3 LYS 110 HD3 LYS 110 -12.728 -10.136 -11.950 875 HE2 LYS 110 HE2 LYS 110 -14.601 -9.361 -13.707 876 HE3 LYS 110 HE3 LYS 110 -15.342 -8.781 -12.217 877 HZ1 LYS 110 HZ1 LYS 110 -13.680 -7.298 -13.550 878 HZ2 LYS 110 HZ2 LYS 110 -12.513 -8.183 -12.705 879 HZ3 LYS 110 HZ3 LYS 110 -13.672 -7.287 -11.858 Start of MODEL 2 1 H1 MET 1 H MET 1 0.989 0.586 0.544 2 HA MET 1 HA MET 1 2.067 1.055 -1.959 3 HB2 MET 1 HB2 MET 1 3.151 0.249 0.294 4 HB3 MET 1 HB3 MET 1 2.935 -1.350 -0.405 5 HG2 MET 1 HG2 MET 1 4.095 -0.104 -2.477 6 HG3 MET 1 HG3 MET 1 4.796 0.810 -1.143 7 HE1 MET 1 HE1 MET 1 5.871 -0.025 0.730 8 HE2 MET 1 HE2 MET 1 6.672 -1.582 0.942 9 HE3 MET 1 HE3 MET 1 7.376 -0.366 -0.125 10 H SER 2 H SER 2 0.636 -1.965 -0.733 11 HA SER 2 HA SER 2 0.202 -2.780 -3.530 12 HB2 SER 2 HB2 SER 2 0.410 -5.186 -2.381 13 HB3 SER 2 HB3 SER 2 1.812 -4.331 -3.025 14 HG SER 2 HG SER 2 2.083 -3.482 -0.850 15 H LEU 3 H LEU 3 -1.746 -3.714 -4.003 16 HA LEU 3 HA LEU 3 -3.708 -3.789 -1.807 17 HB2 LEU 3 HB2 LEU 3 -3.938 -2.994 -4.683 18 HB3 LEU 3 HB3 LEU 3 -5.356 -3.546 -3.794 19 HG LEU 3 HG LEU 3 -3.738 -1.348 -2.613 20 HD11 LEU 3 HD11 LEU 3 -5.383 -1.136 -5.102 21 HD12 LEU 3 HD12 LEU 3 -3.819 -0.412 -4.729 22 HD13 LEU 3 HD13 LEU 3 -5.283 0.215 -3.971 23 HD21 LEU 3 HD21 LEU 3 -5.686 -2.341 -1.462 24 HD22 LEU 3 HD22 LEU 3 -6.708 -1.836 -2.808 25 HD23 LEU 3 HD23 LEU 3 -5.898 -0.625 -1.814 26 H LYS 4 H LYS 4 -5.078 -5.528 -1.619 27 HA LYS 4 HA LYS 4 -4.161 -8.033 -2.472 28 HB2 LYS 4 HB2 LYS 4 -6.303 -7.005 -0.856 29 HB3 LYS 4 HB3 LYS 4 -6.919 -8.274 -1.907 30 HG2 LYS 4 HG2 LYS 4 -5.825 -9.893 -0.808 31 HG3 LYS 4 HG3 LYS 4 -4.383 -8.903 -0.572 32 HD2 LYS 4 HD2 LYS 4 -6.073 -7.615 1.062 33 HD3 LYS 4 HD3 LYS 4 -6.768 -9.235 1.149 34 HE2 LYS 4 HE2 LYS 4 -3.823 -8.811 1.490 35 HE3 LYS 4 HE3 LYS 4 -4.929 -8.558 2.839 36 HZ1 LYS 4 HZ1 LYS 4 -4.004 -10.809 2.789 37 HZ2 LYS 4 HZ2 LYS 4 -4.708 -11.072 1.274 38 HZ3 LYS 4 HZ3 LYS 4 -5.688 -10.820 2.630 39 H SER 5 H SER 5 -6.517 -5.829 -3.847 40 HA SER 5 HA SER 5 -7.759 -7.561 -5.657 41 HB2 SER 5 HB2 SER 5 -8.371 -5.528 -6.907 42 HB3 SER 5 HB3 SER 5 -8.609 -5.309 -5.174 43 HG SER 5 HG SER 5 -7.304 -3.683 -5.310 44 H ASP 6 H ASP 6 -4.598 -6.222 -5.644 45 HA ASP 6 HA ASP 6 -3.952 -6.115 -8.339 46 HB2 ASP 6 HB2 ASP 6 -2.550 -5.548 -6.200 47 HB3 ASP 6 HB3 ASP 6 -1.982 -7.207 -6.361 48 H GLU 7 H GLU 7 -3.914 -8.892 -6.139 49 HA GLU 7 HA GLU 7 -2.794 -10.763 -7.889 50 HB2 GLU 7 HB2 GLU 7 -4.110 -10.787 -5.327 51 HB3 GLU 7 HB3 GLU 7 -4.678 -12.134 -6.305 52 HG2 GLU 7 HG2 GLU 7 -1.758 -11.555 -5.962 53 HG3 GLU 7 HG3 GLU 7 -2.662 -12.524 -4.800 54 H VAL 8 H VAL 8 -6.190 -9.903 -7.318 55 HA VAL 8 HA VAL 8 -7.408 -11.775 -8.962 56 HB VAL 8 HB VAL 8 -8.231 -8.937 -8.350 57 HG11 VAL 8 HG11 VAL 8 -9.340 -9.500 -10.377 58 HG12 VAL 8 HG12 VAL 8 -9.730 -11.117 -9.787 59 HG13 VAL 8 HG13 VAL 8 -10.510 -9.705 -9.074 60 HG21 VAL 8 HG21 VAL 8 -8.253 -10.181 -6.364 61 HG22 VAL 8 HG22 VAL 8 -9.924 -10.220 -6.926 62 HG23 VAL 8 HG23 VAL 8 -8.879 -11.620 -7.168 63 H PHE 9 H PHE 9 -6.275 -8.507 -9.798 64 HA PHE 9 HA PHE 9 -7.033 -8.548 -12.491 65 HB2 PHE 9 HB2 PHE 9 -5.006 -7.012 -10.912 66 HB3 PHE 9 HB3 PHE 9 -5.003 -6.883 -12.668 67 HD1 PHE 9 HD1 PHE 9 -7.803 -6.892 -13.368 68 HD2 PHE 9 HD2 PHE 9 -5.847 -5.042 -10.072 69 HE1 PHE 9 HE1 PHE 9 -9.599 -5.214 -13.249 70 HE2 PHE 9 HE2 PHE 9 -7.639 -3.362 -9.947 71 HZ PHE 9 HZ PHE 9 -9.519 -3.447 -11.536 72 H ALA 10 H ALA 10 -4.070 -9.629 -10.904 73 HA ALA 10 HA ALA 10 -2.571 -10.177 -13.214 74 HB1 ALA 10 HB1 ALA 10 -2.394 -11.629 -10.579 75 HB2 ALA 10 HB2 ALA 10 -1.131 -11.472 -11.802 76 HB3 ALA 10 HB3 ALA 10 -1.666 -10.054 -10.899 77 H LYS 11 H LYS 11 -4.711 -12.252 -11.284 78 HA LYS 11 HA LYS 11 -4.308 -14.584 -12.848 79 HB2 LYS 11 HB2 LYS 11 -6.769 -13.983 -11.214 80 HB3 LYS 11 HB3 LYS 11 -6.077 -15.555 -11.591 81 HG2 LYS 11 HG2 LYS 11 -4.028 -14.274 -10.277 82 HG3 LYS 11 HG3 LYS 11 -5.470 -13.719 -9.423 83 HD2 LYS 11 HD2 LYS 11 -5.222 -15.638 -8.268 84 HD3 LYS 11 HD3 LYS 11 -6.012 -16.362 -9.671 85 HE2 LYS 11 HE2 LYS 11 -4.166 -17.472 -10.260 86 HE3 LYS 11 HE3 LYS 11 -3.145 -16.051 -10.039 87 HZ1 LYS 11 HZ1 LYS 11 -4.073 -17.196 -7.570 88 HZ2 LYS 11 HZ2 LYS 11 -2.511 -16.737 -8.029 89 HZ3 LYS 11 HZ3 LYS 11 -3.112 -18.255 -8.475 90 H ILE 12 H ILE 12 -6.838 -12.095 -12.833 91 HA ILE 12 HA ILE 12 -8.460 -13.233 -14.823 92 HB ILE 12 HB ILE 12 -8.103 -10.354 -13.999 93 HG12 ILE 12 HG12 ILE 12 -10.350 -12.302 -13.450 94 HG13 ILE 12 HG13 ILE 12 -9.039 -11.963 -12.326 95 HG21 ILE 12 HG21 ILE 12 -8.988 -10.039 -16.089 96 HG22 ILE 12 HG22 ILE 12 -9.826 -11.590 -16.087 97 HG23 ILE 12 HG23 ILE 12 -10.463 -10.243 -15.145 98 HD11 ILE 12 HD11 ILE 12 -10.924 -10.692 -11.653 99 HD12 ILE 12 HD12 ILE 12 -9.755 -9.572 -12.352 100 HD13 ILE 12 HD13 ILE 12 -11.165 -10.071 -13.286 101 H ALA 13 H ALA 13 -5.822 -10.868 -15.037 102 HA ALA 13 HA ALA 13 -5.961 -10.256 -17.732 103 HB1 ALA 13 HB1 ALA 13 -4.482 -9.008 -16.380 104 HB2 ALA 13 HB2 ALA 13 -3.599 -10.451 -15.882 105 HB3 ALA 13 HB3 ALA 13 -3.469 -9.867 -17.540 106 H LYS 14 H LYS 14 -4.159 -12.900 -16.176 107 HA LYS 14 HA LYS 14 -2.969 -13.985 -18.436 108 HB2 LYS 14 HB2 LYS 14 -3.949 -15.308 -15.907 109 HB3 LYS 14 HB3 LYS 14 -3.023 -16.159 -17.136 110 HG2 LYS 14 HG2 LYS 14 -1.867 -13.630 -16.151 111 HG3 LYS 14 HG3 LYS 14 -1.918 -14.973 -15.006 112 HD2 LYS 14 HD2 LYS 14 -0.960 -16.301 -17.088 113 HD3 LYS 14 HD3 LYS 14 -0.402 -14.692 -17.550 114 HE2 LYS 14 HE2 LYS 14 1.252 -14.782 -16.068 115 HE3 LYS 14 HE3 LYS 14 0.125 -15.162 -14.766 116 HZ1 LYS 14 HZ1 LYS 14 1.578 -17.027 -16.538 117 HZ2 LYS 14 HZ2 LYS 14 0.205 -17.518 -15.681 118 HZ3 LYS 14 HZ3 LYS 14 1.571 -16.969 -14.847 119 H ARG 15 H ARG 15 -6.217 -14.452 -17.153 120 HA ARG 15 HA ARG 15 -6.957 -16.565 -18.886 121 HB2 ARG 15 HB2 ARG 15 -8.661 -14.525 -17.445 122 HB3 ARG 15 HB3 ARG 15 -9.284 -15.955 -18.256 123 HG2 ARG 15 HG2 ARG 15 -7.251 -16.134 -16.058 124 HG3 ARG 15 HG3 ARG 15 -8.985 -16.076 -15.737 125 HD2 ARG 15 HD2 ARG 15 -8.969 -18.293 -15.982 126 HD3 ARG 15 HD3 ARG 15 -8.757 -17.994 -17.706 127 HE ARG 15 HE ARG 15 -6.238 -17.933 -16.514 128 HH11 ARG 15 HH11 ARG 15 -8.805 -20.206 -17.116 129 HH12 ARG 15 HH12 ARG 15 -7.749 -21.577 -17.197 130 HH21 ARG 15 HH21 ARG 15 -4.837 -19.730 -16.618 131 HH22 ARG 15 HH22 ARG 15 -5.492 -21.305 -16.913 132 H LEU 16 H LEU 16 -6.945 -13.086 -19.206 133 HA LEU 16 HA LEU 16 -8.660 -12.841 -21.417 134 HB2 LEU 16 HB2 LEU 16 -6.266 -11.123 -20.795 135 HB3 LEU 16 HB3 LEU 16 -7.676 -10.675 -21.753 136 HG LEU 16 HG LEU 16 -7.507 -11.059 -18.773 137 HD11 LEU 16 HD11 LEU 16 -8.031 -8.748 -20.610 138 HD12 LEU 16 HD12 LEU 16 -6.840 -8.891 -19.318 139 HD13 LEU 16 HD13 LEU 16 -8.551 -8.726 -18.924 140 HD21 LEU 16 HD21 LEU 16 -9.548 -12.096 -19.336 141 HD22 LEU 16 HD22 LEU 16 -9.920 -10.880 -20.558 142 HD23 LEU 16 HD23 LEU 16 -9.967 -10.454 -18.847 143 H GLU 17 H GLU 17 -5.451 -14.040 -21.143 144 HA GLU 17 HA GLU 17 -4.724 -13.622 -23.893 145 HB2 GLU 17 HB2 GLU 17 -3.437 -15.570 -21.988 146 HB3 GLU 17 HB3 GLU 17 -2.716 -14.784 -23.386 147 HG2 GLU 17 HG2 GLU 17 -2.869 -12.623 -22.230 148 HG3 GLU 17 HG3 GLU 17 -3.537 -13.443 -20.820 149 H SER 18 H SER 18 -6.691 -15.822 -22.260 150 HA SER 18 HA SER 18 -6.279 -17.977 -24.182 151 HB2 SER 18 HB2 SER 18 -7.404 -17.755 -21.494 152 HB3 SER 18 HB3 SER 18 -8.407 -18.722 -22.575 153 HG SER 18 HG SER 18 -5.647 -19.100 -22.027 154 H ILE 19 H ILE 19 -8.299 -15.278 -23.683 155 HA ILE 19 HA ILE 19 -10.713 -16.112 -24.810 156 HB ILE 19 HB ILE 19 -9.476 -13.370 -25.065 157 HG12 ILE 19 HG12 ILE 19 -11.230 -14.518 -22.883 158 HG13 ILE 19 HG13 ILE 19 -9.524 -14.113 -22.727 159 HG21 ILE 19 HG21 ILE 19 -11.769 -12.587 -25.264 160 HG22 ILE 19 HG22 ILE 19 -11.402 -13.759 -26.528 161 HG23 ILE 19 HG23 ILE 19 -12.361 -14.243 -25.130 162 HD11 ILE 19 HD11 ILE 19 -10.829 -12.382 -21.727 163 HD12 ILE 19 HD12 ILE 19 -10.104 -11.751 -23.207 164 HD13 ILE 19 HD13 ILE 19 -11.807 -12.211 -23.185 165 H ASP 20 H ASP 20 -11.509 -16.183 -26.877 166 HA ASP 20 HA ASP 20 -9.547 -15.818 -29.047 167 HB2 ASP 20 HB2 ASP 20 -10.943 -18.171 -28.283 168 HB3 ASP 20 HB3 ASP 20 -11.609 -17.642 -29.826 169 HA PRO 21 HA PRO 21 -12.363 -13.056 -30.975 170 HB2 PRO 21 HB2 PRO 21 -11.779 -13.484 -33.591 171 HB3 PRO 21 HB3 PRO 21 -10.695 -12.620 -32.494 172 HG2 PRO 21 HG2 PRO 21 -10.595 -15.471 -33.400 173 HG3 PRO 21 HG3 PRO 21 -9.270 -14.305 -33.228 174 HD2 PRO 21 HD2 PRO 21 -9.780 -16.213 -31.376 175 HD3 PRO 21 HD3 PRO 21 -9.119 -14.622 -30.950 176 H ALA 22 H ALA 22 -12.404 -16.439 -31.823 177 HA ALA 22 HA ALA 22 -14.611 -16.506 -33.537 178 HB1 ALA 22 HB1 ALA 22 -14.750 -18.842 -33.059 179 HB2 ALA 22 HB2 ALA 22 -13.044 -18.395 -33.082 180 HB3 ALA 22 HB3 ALA 22 -13.871 -18.639 -31.543 181 H ASN 23 H ASN 23 -14.509 -17.016 -30.007 182 HA ASN 23 HA ASN 23 -17.416 -16.626 -29.923 183 HB2 ASN 23 HB2 ASN 23 -15.665 -18.407 -28.582 184 HB3 ASN 23 HB3 ASN 23 -16.318 -17.314 -27.366 185 HD21 ASN 23 HD21 ASN 23 -17.294 -19.366 -30.075 186 HD22 ASN 23 HD22 ASN 23 -18.809 -19.843 -29.394 187 H ARG 24 H ARG 24 -18.096 -14.642 -29.488 188 HA ARG 24 HA ARG 24 -17.394 -13.201 -27.202 189 HB2 ARG 24 HB2 ARG 24 -15.619 -12.803 -29.462 190 HB3 ARG 24 HB3 ARG 24 -16.409 -11.302 -28.997 191 HG2 ARG 24 HG2 ARG 24 -15.339 -11.193 -27.001 192 HG3 ARG 24 HG3 ARG 24 -15.249 -12.947 -26.827 193 HD2 ARG 24 HD2 ARG 24 -13.039 -12.353 -27.199 194 HD3 ARG 24 HD3 ARG 24 -13.592 -12.823 -28.805 195 HE ARG 24 HE ARG 24 -14.038 -10.132 -28.687 196 HH11 ARG 24 HH11 ARG 24 -11.270 -12.194 -28.231 197 HH12 ARG 24 HH12 ARG 24 -10.132 -11.007 -28.777 198 HH21 ARG 24 HH21 ARG 24 -12.550 -8.561 -29.408 199 HH22 ARG 24 HH22 ARG 24 -10.861 -8.940 -29.445 200 H GLN 25 H GLN 25 -19.425 -12.538 -26.877 201 HA GLN 25 HA GLN 25 -21.097 -11.643 -29.050 202 HB2 GLN 25 HB2 GLN 25 -21.598 -11.670 -26.068 203 HB3 GLN 25 HB3 GLN 25 -22.805 -11.325 -27.300 204 HG2 GLN 25 HG2 GLN 25 -23.138 -13.484 -27.746 205 HG3 GLN 25 HG3 GLN 25 -21.415 -13.854 -27.712 206 HE21 GLN 25 HE21 GLN 25 -20.542 -13.501 -25.321 207 HE22 GLN 25 HE22 GLN 25 -21.433 -14.378 -24.128 208 H VAL 26 H VAL 26 -19.251 -10.201 -26.445 209 HA VAL 26 HA VAL 26 -19.308 -7.638 -27.722 210 HB VAL 26 HB VAL 26 -21.506 -7.745 -26.435 211 HG11 VAL 26 HG11 VAL 26 -19.726 -7.323 -24.043 212 HG12 VAL 26 HG12 VAL 26 -21.482 -7.489 -24.072 213 HG13 VAL 26 HG13 VAL 26 -20.457 -8.876 -24.446 214 HG21 VAL 26 HG21 VAL 26 -21.156 -5.428 -25.483 215 HG22 VAL 26 HG22 VAL 26 -19.465 -5.585 -25.958 216 HG23 VAL 26 HG23 VAL 26 -20.733 -5.637 -27.183 217 H GLU 27 H GLU 27 -17.707 -6.262 -26.968 218 HA GLU 27 HA GLU 27 -16.276 -6.814 -24.537 219 HB2 GLU 27 HB2 GLU 27 -15.197 -7.645 -27.191 220 HB3 GLU 27 HB3 GLU 27 -14.079 -6.971 -26.014 221 HG2 GLU 27 HG2 GLU 27 -15.146 -8.710 -24.404 222 HG3 GLU 27 HG3 GLU 27 -15.653 -9.500 -25.896 223 H HIS 28 H HIS 28 -15.774 -4.891 -23.746 224 HA HIS 28 HA HIS 28 -14.749 -2.815 -25.531 225 HB2 HIS 28 HB2 HIS 28 -17.299 -2.710 -24.028 226 HB3 HIS 28 HB3 HIS 28 -16.292 -1.267 -23.943 227 HD1 HIS 28 HD1 HIS 28 -15.346 -0.709 -26.623 228 HD2 HIS 28 HD2 HIS 28 -19.083 -2.422 -26.021 229 HE1 HIS 28 HE1 HIS 28 -16.656 -0.218 -28.713 230 H VAL 29 H VAL 29 -13.990 -0.874 -24.179 231 HA VAL 29 HA VAL 29 -12.170 -1.864 -22.206 232 HB VAL 29 HB VAL 29 -12.728 1.031 -22.843 233 HG11 VAL 29 HG11 VAL 29 -11.122 -0.097 -20.924 234 HG12 VAL 29 HG12 VAL 29 -9.999 0.191 -22.254 235 HG13 VAL 29 HG13 VAL 29 -10.943 1.525 -21.591 236 HG21 VAL 29 HG21 VAL 29 -11.017 -0.974 -24.290 237 HG22 VAL 29 HG22 VAL 29 -12.293 0.049 -24.948 238 HG23 VAL 29 HG23 VAL 29 -10.769 0.766 -24.428 239 H TYR 30 H TYR 30 -12.246 -1.712 -20.030 240 HA TYR 30 HA TYR 30 -14.578 -0.353 -18.847 241 HB2 TYR 30 HB2 TYR 30 -13.338 -3.009 -18.146 242 HB3 TYR 30 HB3 TYR 30 -14.376 -2.138 -17.023 243 HD1 TYR 30 HD1 TYR 30 -16.761 -1.743 -17.602 244 HD2 TYR 30 HD2 TYR 30 -14.247 -4.201 -19.998 245 HE1 TYR 30 HE1 TYR 30 -18.748 -2.724 -18.670 246 HE2 TYR 30 HE2 TYR 30 -16.226 -5.188 -21.074 247 HH TYR 30 HH TYR 30 -18.902 -5.421 -20.140 248 H LYS 31 H LYS 31 -14.286 0.378 -16.628 249 HA LYS 31 HA LYS 31 -11.471 0.993 -16.007 250 HB2 LYS 31 HB2 LYS 31 -13.744 2.757 -16.390 251 HB3 LYS 31 HB3 LYS 31 -13.024 2.976 -14.801 252 HG2 LYS 31 HG2 LYS 31 -10.889 2.844 -16.619 253 HG3 LYS 31 HG3 LYS 31 -12.106 3.894 -17.348 254 HD2 LYS 31 HD2 LYS 31 -11.195 4.203 -14.497 255 HD3 LYS 31 HD3 LYS 31 -10.391 5.012 -15.844 256 HE2 LYS 31 HE2 LYS 31 -12.374 6.214 -16.400 257 HE3 LYS 31 HE3 LYS 31 -13.339 5.256 -15.278 258 HZ1 LYS 31 HZ1 LYS 31 -11.355 7.355 -14.676 259 HZ2 LYS 31 HZ2 LYS 31 -11.764 6.196 -13.513 260 HZ3 LYS 31 HZ3 LYS 31 -12.954 7.222 -14.140 261 H PHE 32 H PHE 32 -10.782 0.600 -13.979 262 HA PHE 32 HA PHE 32 -12.799 -0.255 -12.007 263 HB2 PHE 32 HB2 PHE 32 -9.994 -1.314 -12.412 264 HB3 PHE 32 HB3 PHE 32 -11.062 -1.779 -11.091 265 HD1 PHE 32 HD2 PHE 32 -10.726 -1.809 -14.781 266 HD2 PHE 32 HD1 PHE 32 -12.630 -3.488 -11.364 267 HE1 PHE 32 HE2 PHE 32 -11.690 -3.580 -16.191 268 HE2 PHE 32 HE1 PHE 32 -13.596 -5.262 -12.769 269 HZ PHE 32 HZ PHE 32 -13.127 -5.309 -15.186 270 H ARG 33 H ARG 33 -12.739 0.653 -10.030 271 HA ARG 33 HA ARG 33 -10.484 2.453 -9.430 272 HB2 ARG 33 HB2 ARG 33 -13.432 2.806 -8.903 273 HB3 ARG 33 HB3 ARG 33 -12.203 3.769 -8.094 274 HG2 ARG 33 HG2 ARG 33 -11.497 4.743 -10.139 275 HG3 ARG 33 HG3 ARG 33 -12.464 3.608 -11.084 276 HD2 ARG 33 HD2 ARG 33 -14.443 4.669 -10.585 277 HD3 ARG 33 HD3 ARG 33 -13.820 5.354 -9.085 278 HE ARG 33 HE ARG 33 -12.362 6.594 -11.007 279 HH11 ARG 33 HH11 ARG 33 -15.774 6.169 -10.459 280 HH12 ARG 33 HH12 ARG 33 -16.214 7.666 -11.213 281 HH21 ARG 33 HH21 ARG 33 -12.929 8.567 -12.002 282 HH22 ARG 33 HH22 ARG 33 -14.595 9.028 -12.091 283 H ILE 34 H ILE 34 -9.337 1.833 -7.733 284 HA ILE 34 HA ILE 34 -10.559 0.033 -5.767 285 HB ILE 34 HB ILE 34 -7.698 0.611 -6.491 286 HG12 ILE 34 HG12 ILE 34 -8.895 -1.077 -7.814 287 HG13 ILE 34 HG13 ILE 34 -7.623 -1.817 -6.848 288 HG21 ILE 34 HG21 ILE 34 -8.800 -0.482 -3.955 289 HG22 ILE 34 HG22 ILE 34 -7.327 -1.196 -4.608 290 HG23 ILE 34 HG23 ILE 34 -7.379 0.526 -4.229 291 HD11 ILE 34 HD11 ILE 34 -9.730 -2.053 -5.175 292 HD12 ILE 34 HD12 ILE 34 -10.527 -2.178 -6.743 293 HD13 ILE 34 HD13 ILE 34 -9.223 -3.288 -6.325 294 H THR 35 H THR 35 -11.252 0.867 -3.924 295 HA THR 35 HA THR 35 -10.091 3.398 -2.980 296 HB THR 35 HB THR 35 -12.120 3.676 -1.637 297 HG1 THR 35 HG1 THR 35 -13.132 1.349 -2.921 298 HG21 THR 35 HG21 THR 35 -13.644 3.224 -3.957 299 HG22 THR 35 HG22 THR 35 -12.016 3.622 -4.506 300 HG23 THR 35 HG23 THR 35 -12.885 4.730 -3.444 301 H GLN 36 H GLN 36 -9.338 3.622 -0.895 302 HA GLN 36 HA GLN 36 -8.808 1.103 0.511 303 HB2 GLN 36 HB2 GLN 36 -7.029 2.949 -0.223 304 HB3 GLN 36 HB3 GLN 36 -7.490 3.644 1.325 305 HG2 GLN 36 HG2 GLN 36 -7.076 1.142 2.122 306 HG3 GLN 36 HG3 GLN 36 -6.003 1.160 0.723 307 HE21 GLN 36 HE21 GLN 36 -4.795 0.759 3.011 308 HE22 GLN 36 HE22 GLN 36 -3.965 2.167 3.569 309 H GLY 37 H GLY 37 -10.277 0.655 2.023 310 HA2 GLY 37 HA2 GLY 37 -11.346 0.895 4.068 311 HA3 GLY 37 HA3 GLY 37 -10.725 2.536 4.165 312 H GLY 38 H GLY 38 -11.741 3.683 1.890 313 HA2 GLY 38 HA2 GLY 38 -14.420 3.187 1.297 314 HA3 GLY 38 HA3 GLY 38 -14.392 4.270 2.681 315 H LYS 39 H LYS 39 -11.691 4.684 0.708 316 HA LYS 39 HA LYS 39 -12.990 6.770 -0.894 317 HB2 LYS 39 HB2 LYS 39 -11.830 7.590 1.299 318 HB3 LYS 39 HB3 LYS 39 -10.342 7.323 0.401 319 HG2 LYS 39 HG2 LYS 39 -11.008 8.902 -1.281 320 HG3 LYS 39 HG3 LYS 39 -12.598 9.083 -0.535 321 HD2 LYS 39 HD2 LYS 39 -11.498 9.969 1.498 322 HD3 LYS 39 HD3 LYS 39 -9.943 9.866 0.670 323 HE2 LYS 39 HE2 LYS 39 -10.556 11.519 -0.896 324 HE3 LYS 39 HE3 LYS 39 -12.259 11.421 -0.451 325 HZ1 LYS 39 HZ1 LYS 39 -11.041 12.087 1.877 326 HZ2 LYS 39 HZ2 LYS 39 -11.822 13.168 0.837 327 HZ3 LYS 39 HZ3 LYS 39 -10.147 12.960 0.737 328 H VAL 40 H VAL 40 -12.028 7.197 -2.872 329 HA VAL 40 HA VAL 40 -10.665 5.099 -4.125 330 HB VAL 40 HB VAL 40 -11.043 7.980 -4.921 331 HG11 VAL 40 HG11 VAL 40 -9.094 7.490 -6.082 332 HG12 VAL 40 HG12 VAL 40 -9.535 5.796 -6.308 333 HG13 VAL 40 HG13 VAL 40 -10.355 7.054 -7.235 334 HG21 VAL 40 HG21 VAL 40 -13.084 6.825 -5.016 335 HG22 VAL 40 HG22 VAL 40 -12.486 6.817 -6.675 336 HG23 VAL 40 HG23 VAL 40 -12.331 5.373 -5.676 337 H VAL 41 H VAL 41 -8.567 4.614 -4.401 338 HA VAL 41 HA VAL 41 -6.556 6.583 -3.534 339 HB VAL 41 HB VAL 41 -5.203 4.557 -2.747 340 HG11 VAL 41 HG11 VAL 41 -6.578 6.317 -1.380 341 HG12 VAL 41 HG12 VAL 41 -7.611 4.930 -1.027 342 HG13 VAL 41 HG13 VAL 41 -5.903 4.896 -0.584 343 HG21 VAL 41 HG21 VAL 41 -6.683 2.878 -3.814 344 HG22 VAL 41 HG22 VAL 41 -6.427 2.588 -2.093 345 HG23 VAL 41 HG23 VAL 41 -7.941 3.298 -2.652 346 H LYS 42 H LYS 42 -7.679 4.527 -5.933 347 HA LYS 42 HA LYS 42 -5.614 5.188 -7.736 348 HB2 LYS 42 HB2 LYS 42 -4.530 3.401 -6.235 349 HB3 LYS 42 HB3 LYS 42 -5.608 2.261 -7.030 350 HG2 LYS 42 HG2 LYS 42 -4.644 2.874 -9.198 351 HG3 LYS 42 HG3 LYS 42 -3.546 3.991 -8.384 352 HD2 LYS 42 HD2 LYS 42 -3.644 1.103 -7.594 353 HD3 LYS 42 HD3 LYS 42 -2.706 1.618 -8.998 354 HE2 LYS 42 HE2 LYS 42 -1.737 3.385 -7.338 355 HE3 LYS 42 HE3 LYS 42 -2.312 2.262 -6.107 356 HZ1 LYS 42 HZ1 LYS 42 -0.969 0.530 -7.066 357 HZ2 LYS 42 HZ2 LYS 42 0.009 1.869 -6.734 358 HZ3 LYS 42 HZ3 LYS 42 -0.470 1.546 -8.324 359 H ASN 43 H ASN 43 -5.953 4.270 -9.871 360 HA ASN 43 HA ASN 43 -8.486 2.858 -10.249 361 HB2 ASN 43 HB2 ASN 43 -9.042 4.476 -12.124 362 HB3 ASN 43 HB3 ASN 43 -9.209 5.112 -10.490 363 HD21 ASN 43 HD21 ASN 43 -7.885 6.736 -9.803 364 HD22 ASN 43 HD22 ASN 43 -6.795 7.578 -10.847 365 H TRP 44 H TRP 44 -8.272 1.264 -11.673 366 HA TRP 44 HA TRP 44 -5.934 1.302 -13.457 367 HB2 TRP 44 HB2 TRP 44 -7.500 -0.941 -12.201 368 HB3 TRP 44 HB3 TRP 44 -6.465 -1.222 -13.599 369 HD1 TRP 44 HD1 TRP 44 -6.277 -0.234 -9.893 370 HE1 TRP 44 HE1 TRP 44 -3.876 -0.644 -9.062 371 HE3 TRP 44 HE3 TRP 44 -4.066 -1.409 -14.350 372 HZ2 TRP 44 HZ2 TRP 44 -1.375 -1.369 -10.152 373 HZ3 TRP 44 HZ3 TRP 44 -1.665 -1.947 -14.369 374 HH2 TRP 44 HH2 TRP 44 -0.349 -1.927 -12.313 375 H VAL 45 H VAL 45 -6.195 0.328 -15.596 376 HA VAL 45 HA VAL 45 -8.929 0.643 -16.652 377 HB VAL 45 HB VAL 45 -7.621 2.548 -17.371 378 HG11 VAL 45 HG11 VAL 45 -5.390 1.692 -17.127 379 HG12 VAL 45 HG12 VAL 45 -5.660 0.503 -18.404 380 HG13 VAL 45 HG13 VAL 45 -5.610 2.223 -18.794 381 HG21 VAL 45 HG21 VAL 45 -8.364 2.509 -19.504 382 HG22 VAL 45 HG22 VAL 45 -7.567 0.979 -19.869 383 HG23 VAL 45 HG23 VAL 45 -9.097 0.988 -18.993 384 H MET 46 H MET 46 -9.682 -0.965 -17.903 385 HA MET 46 HA MET 46 -7.863 -3.201 -18.459 386 HB2 MET 46 HB2 MET 46 -9.822 -3.762 -17.121 387 HB3 MET 46 HB3 MET 46 -10.883 -3.101 -18.358 388 HG2 MET 46 HG2 MET 46 -10.555 -4.872 -19.782 389 HG3 MET 46 HG3 MET 46 -8.999 -5.293 -19.071 390 HE1 MET 46 HE1 MET 46 -12.612 -5.077 -18.898 391 HE2 MET 46 HE2 MET 46 -13.056 -6.723 -18.447 392 HE3 MET 46 HE3 MET 46 -12.983 -5.460 -17.217 393 H ASP 47 H ASP 47 -7.119 -3.397 -20.455 394 HA ASP 47 HA ASP 47 -8.447 -2.020 -22.648 395 HB2 ASP 47 HB2 ASP 47 -5.813 -2.345 -22.052 396 HB3 ASP 47 HB3 ASP 47 -6.049 -3.641 -23.222 397 H LEU 48 H LEU 48 -9.959 -3.023 -23.784 398 HA LEU 48 HA LEU 48 -9.990 -5.945 -23.885 399 HB2 LEU 48 HB2 LEU 48 -11.986 -3.853 -23.906 400 HB3 LEU 48 HB3 LEU 48 -12.220 -4.977 -25.243 401 HG LEU 48 HG LEU 48 -13.576 -5.666 -23.384 402 HD11 LEU 48 HD11 LEU 48 -11.782 -7.284 -24.698 403 HD12 LEU 48 HD12 LEU 48 -13.145 -7.826 -23.720 404 HD13 LEU 48 HD13 LEU 48 -11.539 -7.706 -23.003 405 HD21 LEU 48 HD21 LEU 48 -11.120 -6.023 -21.699 406 HD22 LEU 48 HD22 LEU 48 -12.813 -6.016 -21.205 407 HD23 LEU 48 HD23 LEU 48 -12.031 -4.512 -21.694 408 H LYS 49 H LYS 49 -9.200 -3.233 -25.799 409 HA LYS 49 HA LYS 49 -9.638 -4.483 -28.354 410 HB2 LYS 49 HB2 LYS 49 -9.788 -2.129 -28.374 411 HB3 LYS 49 HB3 LYS 49 -8.293 -1.942 -27.466 412 HG2 LYS 49 HG2 LYS 49 -7.941 -1.304 -29.759 413 HG3 LYS 49 HG3 LYS 49 -7.035 -2.778 -29.409 414 HD2 LYS 49 HD2 LYS 49 -9.321 -3.865 -30.292 415 HD3 LYS 49 HD3 LYS 49 -9.356 -2.348 -31.194 416 HE2 LYS 49 HE2 LYS 49 -6.847 -2.992 -31.694 417 HE3 LYS 49 HE3 LYS 49 -7.435 -4.619 -31.352 418 HZ1 LYS 49 HZ1 LYS 49 -8.067 -2.845 -33.581 419 HZ2 LYS 49 HZ2 LYS 49 -9.320 -3.824 -33.004 420 HZ3 LYS 49 HZ3 LYS 49 -7.883 -4.527 -33.555 421 H ASN 50 H ASN 50 -6.904 -3.952 -26.193 422 HA ASN 50 HA ASN 50 -5.172 -5.448 -28.032 423 HB2 ASN 50 HB2 ASN 50 -4.720 -3.132 -26.538 424 HB3 ASN 50 HB3 ASN 50 -3.843 -4.393 -25.677 425 HD21 ASN 50 HD21 ASN 50 -1.943 -5.049 -26.444 426 HD22 ASN 50 HD22 ASN 50 -1.265 -4.572 -27.961 427 H VAL 51 H VAL 51 -6.956 -5.766 -25.170 428 HA VAL 51 HA VAL 51 -7.235 -7.497 -23.714 429 HB VAL 51 HB VAL 51 -5.257 -9.093 -25.328 430 HG11 VAL 51 HG11 VAL 51 -6.414 -9.765 -23.033 431 HG12 VAL 51 HG12 VAL 51 -7.719 -10.229 -24.126 432 HG13 VAL 51 HG13 VAL 51 -6.115 -10.940 -24.314 433 HG21 VAL 51 HG21 VAL 51 -8.096 -8.375 -25.959 434 HG22 VAL 51 HG22 VAL 51 -6.685 -8.371 -27.017 435 HG23 VAL 51 HG23 VAL 51 -7.404 -9.900 -26.513 436 H LYS 52 H LYS 52 -5.537 -5.576 -22.890 437 HA LYS 52 HA LYS 52 -3.650 -7.094 -21.263 438 HB2 LYS 52 HB2 LYS 52 -2.270 -6.342 -23.102 439 HB3 LYS 52 HB3 LYS 52 -2.881 -4.701 -22.940 440 HG2 LYS 52 HG2 LYS 52 -1.836 -4.547 -20.723 441 HG3 LYS 52 HG3 LYS 52 -1.188 -6.176 -20.932 442 HD2 LYS 52 HD2 LYS 52 -0.159 -5.229 -23.109 443 HD3 LYS 52 HD3 LYS 52 -0.467 -3.652 -22.379 444 HE2 LYS 52 HE2 LYS 52 1.750 -4.212 -21.796 445 HE3 LYS 52 HE3 LYS 52 0.784 -4.497 -20.349 446 HZ1 LYS 52 HZ1 LYS 52 1.956 -6.479 -22.196 447 HZ2 LYS 52 HZ2 LYS 52 0.667 -6.890 -21.181 448 HZ3 LYS 52 HZ3 LYS 52 2.132 -6.364 -20.517 449 H LEU 53 H LEU 53 -3.201 -6.167 -19.263 450 HA LEU 53 HA LEU 53 -5.065 -4.054 -18.474 451 HB2 LEU 53 HB2 LEU 53 -4.030 -6.425 -17.235 452 HB3 LEU 53 HB3 LEU 53 -3.677 -5.022 -16.228 453 HG LEU 53 HG LEU 53 -6.092 -4.460 -16.245 454 HD11 LEU 53 HD11 LEU 53 -7.669 -5.657 -17.343 455 HD12 LEU 53 HD12 LEU 53 -6.778 -7.173 -17.205 456 HD13 LEU 53 HD13 LEU 53 -6.314 -5.985 -18.423 457 HD21 LEU 53 HD21 LEU 53 -5.825 -5.511 -14.290 458 HD22 LEU 53 HD22 LEU 53 -4.856 -6.799 -15.007 459 HD23 LEU 53 HD23 LEU 53 -6.617 -6.878 -15.074 460 H VAL 54 H VAL 54 -4.428 -2.079 -17.842 461 HA VAL 54 HA VAL 54 -1.621 -1.606 -17.176 462 HB VAL 54 HB VAL 54 -2.964 0.278 -19.083 463 HG11 VAL 54 HG11 VAL 54 -1.037 1.219 -18.166 464 HG12 VAL 54 HG12 VAL 54 -0.153 -0.307 -18.218 465 HG13 VAL 54 HG13 VAL 54 -0.489 0.570 -19.711 466 HG21 VAL 54 HG21 VAL 54 -1.506 -2.261 -19.774 467 HG22 VAL 54 HG22 VAL 54 -3.114 -1.754 -20.290 468 HG23 VAL 54 HG23 VAL 54 -1.687 -0.921 -20.906 469 H GLU 55 H GLU 55 -1.271 0.573 -16.253 470 HA GLU 55 HA GLU 55 -3.563 1.314 -14.595 471 HB2 GLU 55 HB2 GLU 55 -1.746 2.693 -13.393 472 HB3 GLU 55 HB3 GLU 55 -1.702 0.943 -13.236 473 HG2 GLU 55 HG2 GLU 55 0.210 0.738 -14.433 474 HG3 GLU 55 HG3 GLU 55 -0.141 2.139 -15.445 475 H SER 56 H SER 56 -4.826 2.825 -15.468 476 HA SER 56 HA SER 56 -3.657 5.371 -16.217 477 HB2 SER 56 HB2 SER 56 -3.805 3.834 -18.297 478 HB3 SER 56 HB3 SER 56 -5.545 4.100 -18.186 479 HG SER 56 HG SER 56 -5.038 5.798 -19.346 480 H ASP 57 H ASP 57 -5.464 6.963 -16.797 481 HA ASP 57 HA ASP 57 -7.771 6.433 -15.041 482 HB2 ASP 57 HB2 ASP 57 -5.976 8.323 -14.554 483 HB3 ASP 57 HB3 ASP 57 -6.946 9.222 -15.718 484 H ASP 58 H ASP 58 -7.073 6.354 -18.141 485 HA ASP 58 HA ASP 58 -8.691 8.118 -19.514 486 HB2 ASP 58 HB2 ASP 58 -7.104 6.380 -20.473 487 HB3 ASP 58 HB3 ASP 58 -8.401 5.208 -20.262 488 H ALA 59 H ALA 59 -10.790 7.731 -20.563 489 HA ALA 59 HA ALA 59 -12.685 6.643 -18.628 490 HB1 ALA 59 HB1 ALA 59 -12.827 8.972 -19.759 491 HB2 ALA 59 HB2 ALA 59 -13.490 8.075 -21.125 492 HB3 ALA 59 HB3 ALA 59 -14.296 8.017 -19.558 493 H ALA 60 H ALA 60 -14.108 5.004 -19.053 494 HA ALA 60 HA ALA 60 -13.795 3.619 -21.637 495 HB1 ALA 60 HB1 ALA 60 -13.154 1.768 -20.598 496 HB2 ALA 60 HB2 ALA 60 -13.149 2.652 -19.072 497 HB3 ALA 60 HB3 ALA 60 -14.601 1.795 -19.590 498 H GLU 61 H GLU 61 -15.684 1.891 -21.798 499 HA GLU 61 HA GLU 61 -18.049 3.304 -22.201 500 HB2 GLU 61 HB2 GLU 61 -17.365 0.394 -22.068 501 HB3 GLU 61 HB3 GLU 61 -19.054 0.875 -22.154 502 HG2 GLU 61 HG2 GLU 61 -17.269 2.146 -24.115 503 HG3 GLU 61 HG3 GLU 61 -17.503 0.409 -24.301 504 H ALA 62 H ALA 62 -16.780 1.874 -19.342 505 HA ALA 62 HA ALA 62 -18.931 2.945 -17.768 506 HB1 ALA 62 HB1 ALA 62 -19.361 0.676 -16.663 507 HB2 ALA 62 HB2 ALA 62 -20.099 0.975 -18.237 508 HB3 ALA 62 HB3 ALA 62 -18.649 -0.021 -18.118 509 H THR 63 H THR 63 -18.540 2.682 -15.436 510 HA THR 63 HA THR 63 -15.716 2.122 -14.816 511 HB THR 63 HB THR 63 -17.338 4.421 -13.706 512 HG1 THR 63 HG1 THR 63 -16.319 5.649 -15.139 513 HG21 THR 63 HG21 THR 63 -14.495 3.531 -13.219 514 HG22 THR 63 HG22 THR 63 -15.804 3.624 -12.040 515 HG23 THR 63 HG23 THR 63 -15.136 5.101 -12.734 516 H LEU 64 H LEU 64 -15.409 0.787 -13.150 517 HA LEU 64 HA LEU 64 -17.689 0.264 -11.358 518 HB2 LEU 64 HB2 LEU 64 -15.659 -1.525 -12.602 519 HB3 LEU 64 HB3 LEU 64 -16.301 -1.950 -11.016 520 HG LEU 64 HG LEU 64 -18.512 -1.367 -12.680 521 HD11 LEU 64 HD11 LEU 64 -17.410 -1.701 -14.688 522 HD12 LEU 64 HD12 LEU 64 -18.050 -3.304 -14.329 523 HD13 LEU 64 HD13 LEU 64 -16.352 -2.944 -14.019 524 HD21 LEU 64 HD21 LEU 64 -17.406 -3.983 -11.664 525 HD22 LEU 64 HD22 LEU 64 -19.044 -3.722 -12.263 526 HD23 LEU 64 HD23 LEU 64 -18.501 -2.907 -10.796 527 H THR 65 H THR 65 -17.347 1.281 -9.492 528 HA THR 65 HA THR 65 -14.624 1.325 -8.380 529 HB THR 65 HB THR 65 -16.915 3.022 -7.409 530 HG1 THR 65 HG1 THR 65 -16.157 3.200 -9.794 531 HG21 THR 65 HG21 THR 65 -15.397 3.724 -5.938 532 HG22 THR 65 HG22 THR 65 -14.391 4.297 -7.269 533 HG23 THR 65 HG23 THR 65 -14.186 2.659 -6.650 534 H MET 66 H MET 66 -14.174 0.179 -6.611 535 HA MET 66 HA MET 66 -16.141 -0.364 -4.591 536 HB2 MET 66 HB2 MET 66 -16.105 -2.784 -4.753 537 HB3 MET 66 HB3 MET 66 -16.685 -2.098 -6.265 538 HG2 MET 66 HG2 MET 66 -14.254 -2.319 -7.058 539 HG3 MET 66 HG3 MET 66 -14.054 -3.393 -5.675 540 HE1 MET 66 HE1 MET 66 -16.248 -4.222 -9.583 541 HE2 MET 66 HE2 MET 66 -16.749 -2.825 -8.631 542 HE3 MET 66 HE3 MET 66 -15.091 -2.940 -9.223 543 H GLU 67 H GLU 67 -15.235 -1.284 -2.683 544 HA GLU 67 HA GLU 67 -12.620 -0.435 -2.118 545 HB2 GLU 67 HB2 GLU 67 -14.654 -2.092 -0.693 546 HB3 GLU 67 HB3 GLU 67 -13.005 -2.087 -0.084 547 HG2 GLU 67 HG2 GLU 67 -14.070 -0.419 1.132 548 HG3 GLU 67 HG3 GLU 67 -13.186 0.457 -0.115 549 H ASP 68 H ASP 68 -10.755 -1.677 -1.544 550 HA ASP 68 HA ASP 68 -9.889 -3.483 -3.418 551 HB2 ASP 68 HB2 ASP 68 -8.553 -2.250 -1.597 552 HB3 ASP 68 HB3 ASP 68 -8.941 -3.622 -0.563 553 H ASP 69 H ASP 69 -11.313 -4.213 -0.247 554 HA ASP 69 HA ASP 69 -11.093 -6.986 -0.328 555 HB2 ASP 69 HB2 ASP 69 -11.753 -5.766 1.689 556 HB3 ASP 69 HB3 ASP 69 -13.276 -5.310 0.930 557 H ILE 70 H ILE 70 -13.478 -4.849 -1.773 558 HA ILE 70 HA ILE 70 -15.370 -6.806 -2.496 559 HB ILE 70 HB ILE 70 -14.867 -4.344 -4.141 560 HG12 ILE 70 HG12 ILE 70 -14.770 -3.496 -1.913 561 HG13 ILE 70 HG13 ILE 70 -16.397 -3.170 -2.501 562 HG21 ILE 70 HG21 ILE 70 -17.581 -5.126 -3.349 563 HG22 ILE 70 HG22 ILE 70 -16.949 -4.651 -4.924 564 HG23 ILE 70 HG23 ILE 70 -16.733 -6.304 -4.350 565 HD11 ILE 70 HD11 ILE 70 -16.663 -5.623 -1.307 566 HD12 ILE 70 HD12 ILE 70 -15.509 -4.792 -0.263 567 HD13 ILE 70 HD13 ILE 70 -17.083 -4.068 -0.590 568 H MET 71 H MET 71 -12.757 -5.304 -4.400 569 HA MET 71 HA MET 71 -13.124 -6.717 -6.760 570 HB2 MET 71 HB2 MET 71 -11.534 -4.761 -6.256 571 HB3 MET 71 HB3 MET 71 -10.398 -5.988 -5.713 572 HG2 MET 71 HG2 MET 71 -9.925 -6.668 -7.799 573 HG3 MET 71 HG3 MET 71 -11.583 -6.458 -8.358 574 HE1 MET 71 HE1 MET 71 -11.778 -2.672 -9.148 575 HE2 MET 71 HE2 MET 71 -12.655 -4.176 -8.867 576 HE3 MET 71 HE3 MET 71 -12.026 -3.254 -7.501 577 H PHE 72 H PHE 72 -11.210 -7.576 -3.904 578 HA PHE 72 HA PHE 72 -10.065 -9.924 -4.926 579 HB2 PHE 72 HB2 PHE 72 -9.752 -8.544 -2.636 580 HB3 PHE 72 HB3 PHE 72 -10.756 -9.863 -2.042 581 HD1 PHE 72 HD2 PHE 72 -7.922 -9.616 -4.462 582 HD2 PHE 72 HD1 PHE 72 -9.520 -11.464 -0.976 583 HE1 PHE 72 HE2 PHE 72 -5.935 -11.059 -4.320 584 HE2 PHE 72 HE1 PHE 72 -7.534 -12.910 -0.829 585 HZ PHE 72 HZ PHE 72 -5.739 -12.710 -2.503 586 H ALA 73 H ALA 73 -13.135 -9.335 -3.295 587 HA ALA 73 HA ALA 73 -13.881 -12.043 -2.979 588 HB1 ALA 73 HB1 ALA 73 -16.182 -10.375 -3.310 589 HB2 ALA 73 HB2 ALA 73 -15.547 -11.119 -1.842 590 HB3 ALA 73 HB3 ALA 73 -14.972 -9.529 -2.344 591 H ILE 74 H ILE 74 -14.774 -9.630 -5.443 592 HA ILE 74 HA ILE 74 -16.288 -11.458 -7.008 593 HB ILE 74 HB ILE 74 -15.038 -8.839 -7.846 594 HG12 ILE 74 HG12 ILE 74 -17.919 -9.266 -7.098 595 HG13 ILE 74 HG13 ILE 74 -16.713 -8.908 -5.866 596 HG21 ILE 74 HG21 ILE 74 -15.588 -9.874 -9.839 597 HG22 ILE 74 HG22 ILE 74 -16.987 -10.694 -9.147 598 HG23 ILE 74 HG23 ILE 74 -17.053 -8.963 -9.476 599 HD11 ILE 74 HD11 ILE 74 -18.151 -7.050 -7.193 600 HD12 ILE 74 HD12 ILE 74 -16.577 -6.753 -6.454 601 HD13 ILE 74 HD13 ILE 74 -16.689 -7.107 -8.178 602 H GLY 75 H GLY 75 -12.937 -10.898 -6.662 603 HA2 GLY 75 HA2 GLY 75 -12.232 -11.878 -9.302 604 HA3 GLY 75 HA3 GLY 75 -11.116 -11.430 -8.021 605 H THR 76 H THR 76 -12.214 -13.075 -5.980 606 HA THR 76 HA THR 76 -11.152 -15.645 -6.873 607 HB THR 76 HB THR 76 -11.195 -16.220 -4.427 608 HG1 THR 76 HG1 THR 76 -11.398 -14.258 -3.061 609 HG21 THR 76 HG21 THR 76 -9.073 -15.557 -4.539 610 HG22 THR 76 HG22 THR 76 -9.579 -13.911 -4.153 611 HG23 THR 76 HG23 THR 76 -9.474 -14.431 -5.835 612 H GLY 77 H GLY 77 -13.885 -14.676 -7.560 613 HA2 GLY 77 HA2 GLY 77 -16.029 -15.491 -7.675 614 HA3 GLY 77 HA3 GLY 77 -15.282 -17.062 -7.423 615 H ALA 78 H ALA 78 -14.888 -14.672 -4.969 616 HA ALA 78 HA ALA 78 -16.133 -16.310 -3.009 617 HB1 ALA 78 HB1 ALA 78 -15.637 -14.512 -1.454 618 HB2 ALA 78 HB2 ALA 78 -14.250 -14.820 -2.500 619 HB3 ALA 78 HB3 ALA 78 -15.285 -13.423 -2.797 620 H LEU 79 H LEU 79 -16.932 -12.905 -3.660 621 HA LEU 79 HA LEU 79 -19.770 -13.603 -3.298 622 HB2 LEU 79 HB2 LEU 79 -18.134 -11.270 -2.448 623 HB3 LEU 79 HB3 LEU 79 -19.828 -10.997 -2.848 624 HG LEU 79 HG LEU 79 -18.938 -13.024 -0.809 625 HD11 LEU 79 HD11 LEU 79 -19.279 -10.087 -0.585 626 HD12 LEU 79 HD12 LEU 79 -18.200 -11.175 0.288 627 HD13 LEU 79 HD13 LEU 79 -19.907 -11.091 0.723 628 HD21 LEU 79 HD21 LEU 79 -21.253 -12.802 -0.036 629 HD22 LEU 79 HD22 LEU 79 -21.173 -13.348 -1.711 630 HD23 LEU 79 HD23 LEU 79 -21.579 -11.670 -1.348 631 HA PRO 80 HA PRO 80 -20.551 -12.294 -7.427 632 HB2 PRO 80 HB2 PRO 80 -23.186 -11.682 -7.198 633 HB3 PRO 80 HB3 PRO 80 -22.584 -13.343 -7.216 634 HG2 PRO 80 HG2 PRO 80 -23.370 -11.639 -4.884 635 HG3 PRO 80 HG3 PRO 80 -23.727 -13.349 -5.191 636 HD2 PRO 80 HD2 PRO 80 -21.754 -12.551 -3.517 637 HD3 PRO 80 HD3 PRO 80 -21.648 -14.042 -4.475 638 H ALA 81 H ALA 81 -20.290 -10.439 -8.517 639 HA ALA 81 HA ALA 81 -19.930 -7.979 -7.230 640 HB1 ALA 81 HB1 ALA 81 -20.629 -7.975 -10.112 641 HB2 ALA 81 HB2 ALA 81 -19.309 -7.170 -9.263 642 HB3 ALA 81 HB3 ALA 81 -19.208 -8.895 -9.615 643 H LYS 82 H LYS 82 -22.769 -9.482 -8.538 644 HA LYS 82 HA LYS 82 -24.359 -7.155 -8.837 645 HB2 LYS 82 HB2 LYS 82 -25.458 -9.879 -8.191 646 HB3 LYS 82 HB3 LYS 82 -26.180 -8.612 -9.173 647 HG2 LYS 82 HG2 LYS 82 -24.177 -8.983 -10.744 648 HG3 LYS 82 HG3 LYS 82 -23.969 -10.502 -9.869 649 HD2 LYS 82 HD2 LYS 82 -26.716 -10.259 -10.511 650 HD3 LYS 82 HD3 LYS 82 -25.797 -9.880 -11.969 651 HE2 LYS 82 HE2 LYS 82 -24.547 -11.977 -11.710 652 HE3 LYS 82 HE3 LYS 82 -25.488 -12.354 -10.268 653 HZ1 LYS 82 HZ1 LYS 82 -26.349 -12.320 -13.082 654 HZ2 LYS 82 HZ2 LYS 82 -27.486 -12.080 -11.854 655 HZ3 LYS 82 HZ3 LYS 82 -26.588 -13.513 -11.907 656 H GLU 83 H GLU 83 -24.370 -9.656 -6.289 657 HA GLU 83 HA GLU 83 -26.166 -8.416 -4.571 658 HB2 GLU 83 HB2 GLU 83 -25.349 -10.749 -4.341 659 HB3 GLU 83 HB3 GLU 83 -23.801 -10.127 -3.785 660 HG2 GLU 83 HG2 GLU 83 -25.654 -10.913 -2.099 661 HG3 GLU 83 HG3 GLU 83 -24.605 -9.542 -1.742 662 H ALA 84 H ALA 84 -22.619 -8.180 -4.634 663 HA ALA 84 HA ALA 84 -22.203 -6.562 -2.445 664 HB1 ALA 84 HB1 ALA 84 -20.273 -5.612 -3.943 665 HB2 ALA 84 HB2 ALA 84 -20.246 -7.289 -3.396 666 HB3 ALA 84 HB3 ALA 84 -20.771 -6.905 -5.035 667 H MET 85 H MET 85 -23.236 -5.641 -5.691 668 HA MET 85 HA MET 85 -23.055 -2.842 -5.304 669 HB2 MET 85 HB2 MET 85 -23.722 -4.578 -7.412 670 HB3 MET 85 HB3 MET 85 -25.137 -3.562 -7.169 671 HG2 MET 85 HG2 MET 85 -23.422 -1.617 -7.178 672 HG3 MET 85 HG3 MET 85 -22.368 -2.789 -7.964 673 HE1 MET 85 HE1 MET 85 -25.241 -0.129 -9.991 674 HE2 MET 85 HE2 MET 85 -25.486 -0.486 -8.282 675 HE3 MET 85 HE3 MET 85 -23.932 0.136 -8.838 676 H ALA 86 H ALA 86 -25.539 -5.215 -4.630 677 HA ALA 86 HA ALA 86 -27.630 -3.334 -4.139 678 HB1 ALA 86 HB1 ALA 86 -28.401 -5.456 -4.682 679 HB2 ALA 86 HB2 ALA 86 -27.273 -6.255 -3.587 680 HB3 ALA 86 HB3 ALA 86 -28.655 -5.373 -2.939 681 H GLN 87 H GLN 87 -25.033 -4.660 -2.256 682 HA GLN 87 HA GLN 87 -26.178 -3.799 0.267 683 HB2 GLN 87 HB2 GLN 87 -23.470 -4.980 -0.371 684 HB3 GLN 87 HB3 GLN 87 -24.083 -4.666 1.247 685 HG2 GLN 87 HG2 GLN 87 -26.077 -6.187 0.282 686 HG3 GLN 87 HG3 GLN 87 -24.719 -6.836 -0.636 687 HE21 GLN 87 HE21 GLN 87 -24.580 -8.782 0.366 688 HE22 GLN 87 HE22 GLN 87 -24.149 -8.981 2.027 689 H ASP 88 H ASP 88 -25.042 -2.089 -2.141 690 HA ASP 88 HA ASP 88 -24.133 -0.017 -2.374 691 HB2 ASP 88 HB2 ASP 88 -25.658 0.309 -0.301 692 HB3 ASP 88 HB3 ASP 88 -24.153 0.307 0.614 693 H LYS 89 H LYS 89 -22.521 -2.504 -1.487 694 HA LYS 89 HA LYS 89 -20.165 -1.294 -0.307 695 HB2 LYS 89 HB2 LYS 89 -20.757 -4.104 -1.243 696 HB3 LYS 89 HB3 LYS 89 -19.218 -3.612 -0.547 697 HG2 LYS 89 HG2 LYS 89 -20.993 -2.725 1.326 698 HG3 LYS 89 HG3 LYS 89 -21.767 -4.203 0.750 699 HD2 LYS 89 HD2 LYS 89 -19.435 -5.271 1.047 700 HD3 LYS 89 HD3 LYS 89 -19.083 -3.856 2.043 701 HE2 LYS 89 HE2 LYS 89 -20.491 -4.507 3.704 702 HE3 LYS 89 HE3 LYS 89 -21.612 -5.293 2.594 703 HZ1 LYS 89 HZ1 LYS 89 -18.947 -6.387 3.304 704 HZ2 LYS 89 HZ2 LYS 89 -20.162 -7.159 2.418 705 HZ3 LYS 89 HZ3 LYS 89 -20.388 -6.843 4.064 706 H MET 90 H MET 90 -21.418 -1.307 -3.324 707 HA MET 90 HA MET 90 -18.985 -0.476 -4.536 708 HB2 MET 90 HB2 MET 90 -18.643 -2.212 -6.131 709 HB3 MET 90 HB3 MET 90 -18.736 -2.982 -4.553 710 HG2 MET 90 HG2 MET 90 -20.976 -3.714 -4.974 711 HG3 MET 90 HG3 MET 90 -21.038 -2.798 -6.478 712 HE1 MET 90 HE1 MET 90 -20.101 -3.955 -8.912 713 HE2 MET 90 HE2 MET 90 -18.864 -3.039 -8.051 714 HE3 MET 90 HE3 MET 90 -18.483 -4.628 -8.715 715 H GLU 91 H GLU 91 -19.311 0.530 -6.535 716 HA GLU 91 HA GLU 91 -22.098 0.636 -7.475 717 HB2 GLU 91 HB2 GLU 91 -20.247 2.889 -6.791 718 HB3 GLU 91 HB3 GLU 91 -21.455 3.110 -8.049 719 HG2 GLU 91 HG2 GLU 91 -22.226 2.086 -5.347 720 HG3 GLU 91 HG3 GLU 91 -22.019 3.812 -5.642 721 H VAL 92 H VAL 92 -22.246 1.627 -9.705 722 HA VAL 92 HA VAL 92 -19.874 1.313 -11.353 723 HB VAL 92 HB VAL 92 -22.346 -0.347 -11.866 724 HG11 VAL 92 HG11 VAL 92 -19.968 0.341 -13.491 725 HG12 VAL 92 HG12 VAL 92 -20.537 -1.328 -13.562 726 HG13 VAL 92 HG13 VAL 92 -21.623 -0.006 -13.992 727 HG21 VAL 92 HG21 VAL 92 -21.122 -1.349 -10.085 728 HG22 VAL 92 HG22 VAL 92 -20.753 -2.261 -11.549 729 HG23 VAL 92 HG23 VAL 92 -19.588 -1.098 -10.917 730 H ASP 93 H ASP 93 -19.963 2.445 -13.266 731 HA ASP 93 HA ASP 93 -22.452 3.932 -13.791 732 HB2 ASP 93 HB2 ASP 93 -20.387 5.191 -12.767 733 HB3 ASP 93 HB3 ASP 93 -19.778 5.126 -14.418 734 H GLY 94 H GLY 94 -22.320 4.975 -16.078 735 HA2 GLY 94 HA2 GLY 94 -21.764 4.774 -18.358 736 HA3 GLY 94 HA3 GLY 94 -20.908 3.283 -17.995 737 H GLN 95 H GLN 95 -21.813 1.647 -19.040 738 HA GLN 95 HA GLN 95 -24.714 1.646 -19.454 739 HB2 GLN 95 HB2 GLN 95 -22.406 0.629 -20.946 740 HB3 GLN 95 HB3 GLN 95 -23.738 -0.514 -20.846 741 HG2 GLN 95 HG2 GLN 95 -23.808 2.277 -21.960 742 HG3 GLN 95 HG3 GLN 95 -23.984 0.762 -22.843 743 HE21 GLN 95 HE21 GLN 95 -25.814 -0.650 -21.908 744 HE22 GLN 95 HE22 GLN 95 -27.305 0.173 -21.618 745 H VAL 96 H VAL 96 -25.675 0.789 -17.698 746 HA VAL 96 HA VAL 96 -24.749 -1.015 -15.877 747 HB VAL 96 HB VAL 96 -27.582 -0.953 -16.925 748 HG11 VAL 96 HG11 VAL 96 -27.767 -2.707 -15.532 749 HG12 VAL 96 HG12 VAL 96 -26.260 -2.331 -14.694 750 HG13 VAL 96 HG13 VAL 96 -27.744 -1.478 -14.268 751 HG21 VAL 96 HG21 VAL 96 -27.240 1.241 -16.310 752 HG22 VAL 96 HG22 VAL 96 -27.802 0.541 -14.792 753 HG23 VAL 96 HG23 VAL 96 -26.080 0.821 -15.050 754 H GLU 97 H GLU 97 -26.065 -1.700 -19.066 755 HA GLU 97 HA GLU 97 -26.233 -4.515 -18.747 756 HB2 GLU 97 HB2 GLU 97 -25.992 -2.843 -21.254 757 HB3 GLU 97 HB3 GLU 97 -26.383 -4.556 -21.223 758 HG2 GLU 97 HG2 GLU 97 -28.320 -3.785 -19.650 759 HG3 GLU 97 HG3 GLU 97 -28.039 -2.220 -20.411 760 H LEU 98 H LEU 98 -23.801 -2.411 -20.266 761 HA LEU 98 HA LEU 98 -22.039 -4.324 -21.182 762 HB2 LEU 98 HB2 LEU 98 -21.899 -1.502 -20.443 763 HB3 LEU 98 HB3 LEU 98 -20.364 -2.351 -20.267 764 HG LEU 98 HG LEU 98 -20.644 -1.195 -22.448 765 HD11 LEU 98 HD11 LEU 98 -20.096 -3.289 -23.828 766 HD12 LEU 98 HD12 LEU 98 -20.253 -4.163 -22.304 767 HD13 LEU 98 HD13 LEU 98 -19.046 -2.888 -22.468 768 HD21 LEU 98 HD21 LEU 98 -22.162 -2.073 -24.098 769 HD22 LEU 98 HD22 LEU 98 -23.077 -1.604 -22.664 770 HD23 LEU 98 HD23 LEU 98 -22.732 -3.307 -22.973 771 H ILE 99 H ILE 99 -21.807 -2.636 -18.045 772 HA ILE 99 HA ILE 99 -19.744 -4.230 -17.012 773 HB ILE 99 HB ILE 99 -20.433 -3.390 -14.790 774 HG12 ILE 99 HG12 ILE 99 -22.318 -1.508 -15.123 775 HG13 ILE 99 HG13 ILE 99 -22.863 -2.658 -16.339 776 HG21 ILE 99 HG21 ILE 99 -19.365 -1.990 -16.896 777 HG22 ILE 99 HG22 ILE 99 -20.648 -0.923 -16.326 778 HG23 ILE 99 HG23 ILE 99 -19.390 -1.460 -15.214 779 HD11 ILE 99 HD11 ILE 99 -22.476 -4.315 -14.258 780 HD12 ILE 99 HD12 ILE 99 -22.915 -2.833 -13.409 781 HD13 ILE 99 HD13 ILE 99 -24.007 -3.516 -14.613 782 H PHE 100 H PHE 100 -23.210 -4.672 -17.086 783 HA PHE 100 HA PHE 100 -23.319 -6.760 -15.156 784 HB2 PHE 100 HB2 PHE 100 -25.320 -5.505 -15.675 785 HB3 PHE 100 HB3 PHE 100 -25.229 -5.983 -17.367 786 HD1 PHE 100 HD1 PHE 100 -26.030 -7.086 -13.968 787 HD2 PHE 100 HD2 PHE 100 -25.941 -8.160 -18.086 788 HE1 PHE 100 HE1 PHE 100 -27.438 -9.045 -13.484 789 HE2 PHE 100 HE2 PHE 100 -27.350 -10.120 -17.608 790 HZ PHE 100 HZ PHE 100 -28.101 -10.564 -15.305 791 H LEU 101 H LEU 101 -22.814 -6.643 -18.622 792 HA LEU 101 HA LEU 101 -23.155 -9.413 -19.118 793 HB2 LEU 101 HB2 LEU 101 -22.214 -7.062 -20.580 794 HB3 LEU 101 HB3 LEU 101 -21.421 -8.562 -21.058 795 HG LEU 101 HG LEU 101 -23.418 -7.896 -22.431 796 HD11 LEU 101 HD11 LEU 101 -22.509 -10.206 -22.292 797 HD12 LEU 101 HD12 LEU 101 -24.236 -10.136 -22.640 798 HD13 LEU 101 HD13 LEU 101 -23.681 -10.543 -21.017 799 HD21 LEU 101 HD21 LEU 101 -25.631 -8.374 -21.483 800 HD22 LEU 101 HD22 LEU 101 -24.828 -7.044 -20.647 801 HD23 LEU 101 HD23 LEU 101 -24.889 -8.644 -19.906 802 H LEU 102 H LEU 102 -20.781 -7.748 -17.443 803 HA LEU 102 HA LEU 102 -18.578 -9.492 -18.135 804 HB2 LEU 102 HB2 LEU 102 -18.909 -7.288 -16.114 805 HB3 LEU 102 HB3 LEU 102 -17.439 -8.252 -16.249 806 HG LEU 102 HG LEU 102 -18.584 -6.407 -18.343 807 HD11 LEU 102 HD11 LEU 102 -16.462 -6.184 -16.294 808 HD12 LEU 102 HD12 LEU 102 -17.522 -4.949 -16.973 809 HD13 LEU 102 HD13 LEU 102 -16.118 -5.505 -17.885 810 HD21 LEU 102 HD21 LEU 102 -16.773 -8.650 -18.564 811 HD22 LEU 102 HD22 LEU 102 -16.000 -7.142 -19.054 812 HD23 LEU 102 HD23 LEU 102 -17.499 -7.658 -19.829 813 H GLU 103 H GLU 103 -20.876 -9.080 -15.501 814 HA GLU 103 HA GLU 103 -19.831 -10.634 -13.518 815 HB2 GLU 103 HB2 GLU 103 -22.586 -10.043 -14.435 816 HB3 GLU 103 HB3 GLU 103 -22.406 -11.413 -13.349 817 HG2 GLU 103 HG2 GLU 103 -22.579 -9.906 -11.721 818 HG3 GLU 103 HG3 GLU 103 -20.903 -9.514 -12.102 819 HA PRO 104 HA PRO 104 -21.588 -14.655 -15.546 820 HB2 PRO 104 HB2 PRO 104 -22.475 -14.470 -18.105 821 HB3 PRO 104 HB3 PRO 104 -23.520 -14.205 -16.704 822 HG2 PRO 104 HG2 PRO 104 -22.157 -12.197 -18.457 823 HG3 PRO 104 HG3 PRO 104 -23.810 -12.183 -17.814 824 HD2 PRO 104 HD2 PRO 104 -21.806 -10.732 -16.713 825 HD3 PRO 104 HD3 PRO 104 -23.135 -11.409 -15.750 826 H PHE 105 H PHE 105 -19.490 -12.399 -16.924 827 HA PHE 105 HA PHE 105 -18.274 -14.186 -18.843 828 HB2 PHE 105 HB2 PHE 105 -18.408 -11.503 -18.744 829 HB3 PHE 105 HB3 PHE 105 -16.846 -11.736 -17.965 830 HD1 PHE 105 HD2 PHE 105 -18.700 -13.021 -20.941 831 HD2 PHE 105 HD1 PHE 105 -15.004 -11.669 -19.319 832 HE1 PHE 105 HE2 PHE 105 -17.643 -13.273 -23.148 833 HE2 PHE 105 HE1 PHE 105 -13.942 -11.918 -21.524 834 HZ PHE 105 HZ PHE 105 -15.261 -12.722 -23.442 835 H ILE 106 H ILE 106 -17.914 -13.409 -15.514 836 HA ILE 106 HA ILE 106 -15.210 -14.010 -15.103 837 HB ILE 106 HB ILE 106 -17.533 -14.435 -13.219 838 HG12 ILE 106 HG12 ILE 106 -15.573 -12.140 -13.288 839 HG13 ILE 106 HG13 ILE 106 -17.118 -12.096 -14.131 840 HG21 ILE 106 HG21 ILE 106 -16.033 -15.488 -11.947 841 HG22 ILE 106 HG22 ILE 106 -14.690 -14.986 -12.973 842 HG23 ILE 106 HG23 ILE 106 -15.288 -13.907 -11.713 843 HD11 ILE 106 HD11 ILE 106 -16.932 -12.647 -11.192 844 HD12 ILE 106 HD12 ILE 106 -17.003 -11.010 -11.843 845 HD13 ILE 106 HD13 ILE 106 -18.332 -12.132 -12.133 846 H ALA 107 H ALA 107 -17.970 -16.064 -15.612 847 HA ALA 107 HA ALA 107 -17.070 -18.467 -14.537 848 HB1 ALA 107 HB1 ALA 107 -18.837 -17.890 -16.901 849 HB2 ALA 107 HB2 ALA 107 -18.524 -19.525 -16.318 850 HB3 ALA 107 HB3 ALA 107 -19.312 -18.349 -15.266 851 H SER 108 H SER 108 -16.298 -16.915 -17.598 852 HA SER 108 HA SER 108 -14.904 -19.155 -18.693 853 HB2 SER 108 HB2 SER 108 -15.579 -16.454 -19.516 854 HB3 SER 108 HB3 SER 108 -13.920 -16.862 -19.952 855 HG SER 108 HG SER 108 -16.140 -18.532 -20.513 856 H LEU 109 H LEU 109 -13.874 -16.129 -17.142 857 HA LEU 109 HA LEU 109 -11.128 -17.132 -17.023 858 HB2 LEU 109 HB2 LEU 109 -10.643 -14.818 -16.160 859 HB3 LEU 109 HB3 LEU 109 -11.224 -14.921 -17.821 860 HG LEU 109 HG LEU 109 -13.470 -14.526 -16.121 861 HD11 LEU 109 HD11 LEU 109 -12.970 -12.817 -14.731 862 HD12 LEU 109 HD12 LEU 109 -11.709 -12.180 -15.785 863 HD13 LEU 109 HD13 LEU 109 -11.376 -13.571 -14.754 864 HD21 LEU 109 HD21 LEU 109 -13.806 -13.674 -18.186 865 HD22 LEU 109 HD22 LEU 109 -12.115 -13.217 -18.395 866 HD23 LEU 109 HD23 LEU 109 -13.192 -12.202 -17.433 867 H LYS 110 H LYS 110 -11.085 -18.600 -15.379 868 HA LYS 110 HA LYS 110 -12.075 -17.751 -12.748 869 HB2 LYS 110 HB2 LYS 110 -11.873 -20.132 -12.123 870 HB3 LYS 110 HB3 LYS 110 -12.940 -19.890 -13.500 871 HG2 LYS 110 HG2 LYS 110 -11.722 -21.244 -14.759 872 HG3 LYS 110 HG3 LYS 110 -10.247 -20.344 -14.393 873 HD2 LYS 110 HD2 LYS 110 -10.319 -21.609 -12.137 874 HD3 LYS 110 HD3 LYS 110 -11.429 -22.702 -12.967 875 HE2 LYS 110 HE2 LYS 110 -9.489 -22.589 -14.802 876 HE3 LYS 110 HE3 LYS 110 -8.525 -22.269 -13.361 877 HZ1 LYS 110 HZ1 LYS 110 -10.409 -24.519 -13.335 878 HZ2 LYS 110 HZ2 LYS 110 -8.947 -24.333 -12.507 879 HZ3 LYS 110 HZ3 LYS 110 -8.942 -24.697 -14.159 Start of MODEL 3 1 H1 MET 1 H MET 1 1.841 1.008 -0.198 2 HA MET 1 HA MET 1 2.075 1.008 -2.647 3 HB2 MET 1 HB2 MET 1 4.230 -0.199 -2.831 4 HB3 MET 1 HB3 MET 1 4.156 0.851 -1.422 5 HG2 MET 1 HG2 MET 1 3.447 -1.254 -0.141 6 HG3 MET 1 HG3 MET 1 4.043 -2.136 -1.546 7 HE1 MET 1 HE1 MET 1 5.861 -2.019 1.864 8 HE2 MET 1 HE2 MET 1 6.019 -0.263 1.883 9 HE3 MET 1 HE3 MET 1 4.441 -1.003 1.609 10 H SER 2 H SER 2 0.892 -1.817 -1.160 11 HA SER 2 HA SER 2 0.471 -3.034 -3.804 12 HB2 SER 2 HB2 SER 2 1.946 -4.140 -1.574 13 HB3 SER 2 HB3 SER 2 0.565 -5.161 -1.975 14 HG SER 2 HG SER 2 1.326 -5.113 -4.168 15 H LEU 3 H LEU 3 -1.499 -4.016 -4.128 16 HA LEU 3 HA LEU 3 -3.447 -3.761 -1.931 17 HB2 LEU 3 HB2 LEU 3 -3.676 -3.106 -4.841 18 HB3 LEU 3 HB3 LEU 3 -5.109 -3.543 -3.914 19 HG LEU 3 HG LEU 3 -3.338 -1.339 -2.945 20 HD11 LEU 3 HD11 LEU 3 -3.613 -0.435 -5.025 21 HD12 LEU 3 HD12 LEU 3 -5.100 0.114 -4.252 22 HD13 LEU 3 HD13 LEU 3 -5.128 -1.289 -5.320 23 HD21 LEU 3 HD21 LEU 3 -5.227 -0.630 -1.791 24 HD22 LEU 3 HD22 LEU 3 -5.329 -2.388 -1.691 25 HD23 LEU 3 HD23 LEU 3 -6.328 -1.510 -2.851 26 H LYS 4 H LYS 4 -5.056 -5.350 -1.767 27 HA LYS 4 HA LYS 4 -4.247 -7.972 -2.404 28 HB2 LYS 4 HB2 LYS 4 -6.098 -6.835 -0.707 29 HB3 LYS 4 HB3 LYS 4 -7.112 -7.652 -1.890 30 HG2 LYS 4 HG2 LYS 4 -6.815 -9.271 -0.277 31 HG3 LYS 4 HG3 LYS 4 -5.569 -9.681 -1.458 32 HD2 LYS 4 HD2 LYS 4 -3.939 -8.384 -0.087 33 HD3 LYS 4 HD3 LYS 4 -5.200 -8.174 1.130 34 HE2 LYS 4 HE2 LYS 4 -5.146 -10.376 1.761 35 HE3 LYS 4 HE3 LYS 4 -4.593 -10.928 0.181 36 HZ1 LYS 4 HZ1 LYS 4 -2.961 -10.972 2.139 37 HZ2 LYS 4 HZ2 LYS 4 -2.835 -9.302 1.902 38 HZ3 LYS 4 HZ3 LYS 4 -2.414 -10.368 0.657 39 H SER 5 H SER 5 -6.502 -5.744 -3.934 40 HA SER 5 HA SER 5 -7.711 -7.550 -5.711 41 HB2 SER 5 HB2 SER 5 -7.211 -4.579 -6.005 42 HB3 SER 5 HB3 SER 5 -8.272 -5.523 -7.050 43 HG SER 5 HG SER 5 -8.589 -5.416 -4.239 44 H ASP 6 H ASP 6 -4.552 -6.278 -5.627 45 HA ASP 6 HA ASP 6 -3.828 -6.129 -8.299 46 HB2 ASP 6 HB2 ASP 6 -2.470 -5.667 -6.102 47 HB3 ASP 6 HB3 ASP 6 -1.946 -7.336 -6.305 48 H GLU 7 H GLU 7 -4.029 -8.955 -6.185 49 HA GLU 7 HA GLU 7 -2.897 -10.821 -7.955 50 HB2 GLU 7 HB2 GLU 7 -4.169 -10.859 -5.402 51 HB3 GLU 7 HB3 GLU 7 -4.912 -12.099 -6.402 52 HG2 GLU 7 HG2 GLU 7 -1.937 -11.850 -6.132 53 HG3 GLU 7 HG3 GLU 7 -2.912 -12.771 -4.988 54 H VAL 8 H VAL 8 -6.247 -9.779 -7.473 55 HA VAL 8 HA VAL 8 -7.533 -11.585 -9.144 56 HB VAL 8 HB VAL 8 -8.178 -8.727 -8.455 57 HG11 VAL 8 HG11 VAL 8 -9.762 -10.637 -10.163 58 HG12 VAL 8 HG12 VAL 8 -10.439 -9.188 -9.419 59 HG13 VAL 8 HG13 VAL 8 -9.149 -9.046 -10.613 60 HG21 VAL 8 HG21 VAL 8 -8.383 -10.291 -6.633 61 HG22 VAL 8 HG22 VAL 8 -9.995 -9.812 -7.163 62 HG23 VAL 8 HG23 VAL 8 -9.345 -11.383 -7.630 63 H PHE 9 H PHE 9 -6.368 -8.317 -9.974 64 HA PHE 9 HA PHE 9 -6.986 -8.405 -12.690 65 HB2 PHE 9 HB2 PHE 9 -4.784 -6.919 -11.247 66 HB3 PHE 9 HB3 PHE 9 -5.222 -6.636 -12.929 67 HD1 PHE 9 HD1 PHE 9 -8.185 -6.845 -12.716 68 HD2 PHE 9 HD2 PHE 9 -5.330 -4.890 -10.236 69 HE1 PHE 9 HE1 PHE 9 -9.910 -5.244 -11.997 70 HE2 PHE 9 HE2 PHE 9 -7.051 -3.287 -9.513 71 HZ PHE 9 HZ PHE 9 -9.344 -3.463 -10.393 72 H ALA 10 H ALA 10 -4.262 -9.703 -10.928 73 HA ALA 10 HA ALA 10 -2.601 -10.209 -13.180 74 HB1 ALA 10 HB1 ALA 10 -2.149 -10.210 -10.545 75 HB2 ALA 10 HB2 ALA 10 -2.346 -11.944 -10.800 76 HB3 ALA 10 HB3 ALA 10 -1.115 -11.055 -11.697 77 H LYS 11 H LYS 11 -4.869 -12.218 -11.329 78 HA LYS 11 HA LYS 11 -4.433 -14.582 -12.831 79 HB2 LYS 11 HB2 LYS 11 -6.969 -13.902 -11.350 80 HB3 LYS 11 HB3 LYS 11 -6.289 -15.494 -11.660 81 HG2 LYS 11 HG2 LYS 11 -4.292 -14.230 -10.254 82 HG3 LYS 11 HG3 LYS 11 -5.768 -13.631 -9.493 83 HD2 LYS 11 HD2 LYS 11 -5.817 -15.536 -8.335 84 HD3 LYS 11 HD3 LYS 11 -6.224 -16.350 -9.847 85 HE2 LYS 11 HE2 LYS 11 -3.498 -16.079 -10.018 86 HE3 LYS 11 HE3 LYS 11 -3.747 -16.384 -8.300 87 HZ1 LYS 11 HZ1 LYS 11 -3.703 -18.511 -8.987 88 HZ2 LYS 11 HZ2 LYS 11 -4.158 -18.143 -10.574 89 HZ3 LYS 11 HZ3 LYS 11 -5.331 -18.234 -9.358 90 H ILE 12 H ILE 12 -6.885 -12.027 -13.014 91 HA ILE 12 HA ILE 12 -8.437 -13.166 -15.057 92 HB ILE 12 HB ILE 12 -8.012 -10.251 -14.391 93 HG12 ILE 12 HG12 ILE 12 -10.303 -12.079 -13.652 94 HG13 ILE 12 HG13 ILE 12 -8.945 -11.738 -12.585 95 HG21 ILE 12 HG21 ILE 12 -10.538 -10.605 -15.517 96 HG22 ILE 12 HG22 ILE 12 -9.148 -9.802 -16.247 97 HG23 ILE 12 HG23 ILE 12 -9.438 -11.514 -16.553 98 HD11 ILE 12 HD11 ILE 12 -10.877 -9.701 -13.669 99 HD12 ILE 12 HD12 ILE 12 -10.888 -10.379 -12.040 100 HD13 ILE 12 HD13 ILE 12 -9.535 -9.381 -12.571 101 H ALA 13 H ALA 13 -5.713 -10.894 -15.200 102 HA ALA 13 HA ALA 13 -5.694 -10.395 -17.930 103 HB1 ALA 13 HB1 ALA 13 -3.222 -10.002 -17.612 104 HB2 ALA 13 HB2 ALA 13 -4.288 -9.100 -16.534 105 HB3 ALA 13 HB3 ALA 13 -3.439 -10.528 -15.942 106 H LYS 14 H LYS 14 -4.084 -13.004 -16.133 107 HA LYS 14 HA LYS 14 -2.789 -14.196 -18.313 108 HB2 LYS 14 HB2 LYS 14 -2.227 -14.744 -16.002 109 HB3 LYS 14 HB3 LYS 14 -3.817 -15.456 -15.763 110 HG2 LYS 14 HG2 LYS 14 -3.212 -17.395 -16.686 111 HG3 LYS 14 HG3 LYS 14 -2.358 -16.604 -18.013 112 HD2 LYS 14 HD2 LYS 14 -0.611 -16.042 -16.138 113 HD3 LYS 14 HD3 LYS 14 -1.359 -17.415 -15.319 114 HE2 LYS 14 HE2 LYS 14 -1.011 -18.540 -17.692 115 HE3 LYS 14 HE3 LYS 14 0.265 -17.329 -17.809 116 HZ1 LYS 14 HZ1 LYS 14 0.496 -18.470 -15.300 117 HZ2 LYS 14 HZ2 LYS 14 1.531 -18.681 -16.621 118 HZ3 LYS 14 HZ3 LYS 14 0.254 -19.760 -16.367 119 H ARG 15 H ARG 15 -6.077 -14.434 -17.153 120 HA ARG 15 HA ARG 15 -6.754 -16.718 -18.752 121 HB2 ARG 15 HB2 ARG 15 -8.487 -14.700 -17.316 122 HB3 ARG 15 HB3 ARG 15 -9.093 -16.150 -18.105 123 HG2 ARG 15 HG2 ARG 15 -7.011 -16.294 -15.955 124 HG3 ARG 15 HG3 ARG 15 -8.733 -16.215 -15.578 125 HD2 ARG 15 HD2 ARG 15 -9.171 -18.270 -16.588 126 HD3 ARG 15 HD3 ARG 15 -7.672 -18.239 -17.515 127 HE ARG 15 HE ARG 15 -7.196 -18.315 -14.703 128 HH11 ARG 15 HH11 ARG 15 -8.020 -20.269 -17.464 129 HH12 ARG 15 HH12 ARG 15 -7.373 -21.727 -16.789 130 HH21 ARG 15 HH21 ARG 15 -6.342 -20.229 -13.803 131 HH22 ARG 15 HH22 ARG 15 -6.420 -21.704 -14.706 132 H LEU 16 H LEU 16 -6.915 -13.237 -19.116 133 HA LEU 16 HA LEU 16 -8.566 -13.264 -21.445 134 HB2 LEU 16 HB2 LEU 16 -6.692 -11.129 -20.436 135 HB3 LEU 16 HB3 LEU 16 -7.935 -10.915 -21.667 136 HG LEU 16 HG LEU 16 -8.883 -11.907 -19.057 137 HD11 LEU 16 HD11 LEU 16 -7.800 -10.382 -17.844 138 HD12 LEU 16 HD12 LEU 16 -8.844 -9.194 -18.623 139 HD13 LEU 16 HD13 LEU 16 -7.237 -9.516 -19.273 140 HD21 LEU 16 HD21 LEU 16 -9.776 -10.051 -21.218 141 HD22 LEU 16 HD22 LEU 16 -10.505 -9.940 -19.616 142 HD23 LEU 16 HD23 LEU 16 -10.598 -11.449 -20.524 143 H GLU 17 H GLU 17 -5.364 -14.114 -20.912 144 HA GLU 17 HA GLU 17 -4.308 -13.257 -23.452 145 HB2 GLU 17 HB2 GLU 17 -3.265 -14.963 -21.208 146 HB3 GLU 17 HB3 GLU 17 -2.410 -14.868 -22.741 147 HG2 GLU 17 HG2 GLU 17 -2.947 -12.223 -22.023 148 HG3 GLU 17 HG3 GLU 17 -2.429 -13.025 -20.541 149 H SER 18 H SER 18 -6.228 -15.824 -22.379 150 HA SER 18 HA SER 18 -5.384 -17.605 -24.544 151 HB2 SER 18 HB2 SER 18 -6.640 -17.972 -21.936 152 HB3 SER 18 HB3 SER 18 -7.480 -18.850 -23.214 153 HG SER 18 HG SER 18 -5.860 -20.163 -22.444 154 H ILE 19 H ILE 19 -7.460 -15.093 -24.137 155 HA ILE 19 HA ILE 19 -9.887 -15.917 -25.220 156 HB ILE 19 HB ILE 19 -8.573 -13.244 -25.706 157 HG12 ILE 19 HG12 ILE 19 -8.646 -13.970 -23.285 158 HG13 ILE 19 HG13 ILE 19 -9.510 -12.480 -23.646 159 HG21 ILE 19 HG21 ILE 19 -11.348 -14.299 -25.979 160 HG22 ILE 19 HG22 ILE 19 -11.106 -12.609 -25.540 161 HG23 ILE 19 HG23 ILE 19 -10.439 -13.232 -27.049 162 HD11 ILE 19 HD11 ILE 19 -11.530 -13.381 -23.183 163 HD12 ILE 19 HD12 ILE 19 -11.064 -14.992 -23.729 164 HD13 ILE 19 HD13 ILE 19 -10.539 -14.410 -22.150 165 H ASP 20 H ASP 20 -10.648 -16.252 -27.246 166 HA ASP 20 HA ASP 20 -8.739 -15.955 -29.471 167 HB2 ASP 20 HB2 ASP 20 -9.916 -18.340 -28.475 168 HB3 ASP 20 HB3 ASP 20 -10.646 -18.010 -30.044 169 HA PRO 21 HA PRO 21 -11.806 -13.633 -31.586 170 HB2 PRO 21 HB2 PRO 21 -11.233 -14.260 -34.164 171 HB3 PRO 21 HB3 PRO 21 -10.206 -13.210 -33.180 172 HG2 PRO 21 HG2 PRO 21 -9.885 -16.118 -33.817 173 HG3 PRO 21 HG3 PRO 21 -8.659 -14.837 -33.788 174 HD2 PRO 21 HD2 PRO 21 -8.978 -16.595 -31.753 175 HD3 PRO 21 HD3 PRO 21 -8.444 -14.922 -31.494 176 H ALA 22 H ALA 22 -11.617 -17.072 -32.006 177 HA ALA 22 HA ALA 22 -13.791 -17.522 -33.702 178 HB1 ALA 22 HB1 ALA 22 -12.472 -19.387 -33.336 179 HB2 ALA 22 HB2 ALA 22 -12.455 -19.160 -31.587 180 HB3 ALA 22 HB3 ALA 22 -13.912 -19.751 -32.384 181 H ASN 23 H ASN 23 -13.706 -17.531 -30.136 182 HA ASN 23 HA ASN 23 -16.633 -17.328 -30.119 183 HB2 ASN 23 HB2 ASN 23 -14.973 -18.939 -28.654 184 HB3 ASN 23 HB3 ASN 23 -15.253 -17.607 -27.537 185 HD21 ASN 23 HD21 ASN 23 -16.828 -20.045 -29.513 186 HD22 ASN 23 HD22 ASN 23 -18.281 -20.128 -28.581 187 H ARG 24 H ARG 24 -17.440 -15.348 -29.993 188 HA ARG 24 HA ARG 24 -16.353 -13.471 -28.055 189 HB2 ARG 24 HB2 ARG 24 -16.565 -12.858 -31.005 190 HB3 ARG 24 HB3 ARG 24 -16.380 -11.626 -29.764 191 HG2 ARG 24 HG2 ARG 24 -14.424 -13.876 -30.140 192 HG3 ARG 24 HG3 ARG 24 -14.278 -12.317 -30.954 193 HD2 ARG 24 HD2 ARG 24 -14.725 -12.132 -28.066 194 HD3 ARG 24 HD3 ARG 24 -13.217 -12.928 -28.513 195 HE ARG 24 HE ARG 24 -13.565 -10.522 -29.974 196 HH11 ARG 24 HH11 ARG 24 -12.703 -11.743 -26.830 197 HH12 ARG 24 HH12 ARG 24 -11.723 -10.373 -26.423 198 HH21 ARG 24 HH21 ARG 24 -12.278 -8.714 -29.450 199 HH22 ARG 24 HH22 ARG 24 -11.483 -8.650 -27.913 200 H GLN 25 H GLN 25 -17.780 -11.279 -28.460 201 HA GLN 25 HA GLN 25 -20.440 -11.558 -29.287 202 HB2 GLN 25 HB2 GLN 25 -20.039 -13.013 -27.005 203 HB3 GLN 25 HB3 GLN 25 -20.583 -11.473 -26.353 204 HG2 GLN 25 HG2 GLN 25 -22.631 -11.594 -27.531 205 HG3 GLN 25 HG3 GLN 25 -22.067 -12.951 -28.505 206 HE21 GLN 25 HE21 GLN 25 -24.067 -13.944 -27.768 207 HE22 GLN 25 HE22 GLN 25 -24.090 -14.748 -26.240 208 H VAL 26 H VAL 26 -18.522 -10.129 -26.649 209 HA VAL 26 HA VAL 26 -18.795 -7.494 -27.679 210 HB VAL 26 HB VAL 26 -21.083 -8.017 -26.582 211 HG11 VAL 26 HG11 VAL 26 -19.813 -8.910 -24.503 212 HG12 VAL 26 HG12 VAL 26 -19.703 -7.206 -24.055 213 HG13 VAL 26 HG13 VAL 26 -21.282 -7.961 -24.277 214 HG21 VAL 26 HG21 VAL 26 -19.491 -5.662 -26.771 215 HG22 VAL 26 HG22 VAL 26 -21.246 -5.819 -26.852 216 HG23 VAL 26 HG23 VAL 26 -20.453 -5.578 -25.295 217 H GLU 27 H GLU 27 -17.219 -6.215 -26.885 218 HA GLU 27 HA GLU 27 -16.104 -6.621 -24.260 219 HB2 GLU 27 HB2 GLU 27 -14.648 -7.467 -26.737 220 HB3 GLU 27 HB3 GLU 27 -13.742 -6.825 -25.374 221 HG2 GLU 27 HG2 GLU 27 -15.483 -9.273 -25.435 222 HG3 GLU 27 HG3 GLU 27 -13.739 -9.189 -25.193 223 H HIS 28 H HIS 28 -15.752 -4.653 -23.500 224 HA HIS 28 HA HIS 28 -14.622 -2.613 -25.280 225 HB2 HIS 28 HB2 HIS 28 -17.161 -2.436 -23.699 226 HB3 HIS 28 HB3 HIS 28 -16.199 -0.984 -23.959 227 HD1 HIS 28 HD1 HIS 28 -15.524 -0.787 -26.724 228 HD2 HIS 28 HD2 HIS 28 -19.047 -2.683 -25.602 229 HE1 HIS 28 HE1 HIS 28 -16.989 -0.748 -28.767 230 H VAL 29 H VAL 29 -13.764 -0.724 -24.052 231 HA VAL 29 HA VAL 29 -12.002 -1.574 -22.032 232 HB VAL 29 HB VAL 29 -12.817 1.241 -22.768 233 HG11 VAL 29 HG11 VAL 29 -11.598 1.908 -21.036 234 HG12 VAL 29 HG12 VAL 29 -11.159 0.243 -20.651 235 HG13 VAL 29 HG13 VAL 29 -10.186 1.171 -21.793 236 HG21 VAL 29 HG21 VAL 29 -11.643 -0.504 -24.418 237 HG22 VAL 29 HG22 VAL 29 -11.270 1.219 -24.428 238 HG23 VAL 29 HG23 VAL 29 -10.212 0.093 -23.577 239 H TYR 30 H TYR 30 -12.143 -1.624 -19.871 240 HA TYR 30 HA TYR 30 -14.542 -0.447 -18.626 241 HB2 TYR 30 HB2 TYR 30 -13.189 -3.085 -18.186 242 HB3 TYR 30 HB3 TYR 30 -14.078 -2.331 -16.867 243 HD1 TYR 30 HD2 TYR 30 -16.511 -2.008 -17.035 244 HD2 TYR 30 HD1 TYR 30 -14.332 -4.038 -20.073 245 HE1 TYR 30 HE2 TYR 30 -18.614 -2.923 -17.923 246 HE2 TYR 30 HE1 TYR 30 -16.429 -4.958 -20.971 247 HH TYR 30 HH TYR 30 -18.641 -5.324 -20.474 248 H LYS 31 H LYS 31 -14.305 0.207 -16.383 249 HA LYS 31 HA LYS 31 -11.546 1.034 -15.755 250 HB2 LYS 31 HB2 LYS 31 -13.958 2.571 -16.004 251 HB3 LYS 31 HB3 LYS 31 -13.373 2.673 -14.349 252 HG2 LYS 31 HG2 LYS 31 -11.071 3.090 -15.654 253 HG3 LYS 31 HG3 LYS 31 -12.207 3.730 -16.843 254 HD2 LYS 31 HD2 LYS 31 -12.495 4.530 -13.983 255 HD3 LYS 31 HD3 LYS 31 -11.223 5.271 -14.958 256 HE2 LYS 31 HE2 LYS 31 -13.806 5.180 -16.308 257 HE3 LYS 31 HE3 LYS 31 -13.841 6.106 -14.809 258 HZ1 LYS 31 HZ1 LYS 31 -12.760 7.758 -15.783 259 HZ2 LYS 31 HZ2 LYS 31 -12.915 6.953 -17.262 260 HZ3 LYS 31 HZ3 LYS 31 -11.526 6.733 -16.322 261 H PHE 32 H PHE 32 -10.732 0.518 -13.808 262 HA PHE 32 HA PHE 32 -12.570 -0.626 -11.811 263 HB2 PHE 32 HB2 PHE 32 -9.805 -1.585 -12.571 264 HB3 PHE 32 HB3 PHE 32 -10.694 -2.158 -11.164 265 HD1 PHE 32 HD2 PHE 32 -13.326 -2.678 -11.978 266 HD2 PHE 32 HD1 PHE 32 -9.749 -3.148 -14.237 267 HE1 PHE 32 HE2 PHE 32 -14.432 -4.379 -13.370 268 HE2 PHE 32 HE1 PHE 32 -10.850 -4.849 -15.633 269 HZ PHE 32 HZ PHE 32 -13.194 -5.467 -15.199 270 H ARG 33 H ARG 33 -12.670 0.748 -10.163 271 HA ARG 33 HA ARG 33 -10.225 2.172 -9.356 272 HB2 ARG 33 HB2 ARG 33 -13.053 2.926 -9.503 273 HB3 ARG 33 HB3 ARG 33 -12.289 3.363 -7.980 274 HG2 ARG 33 HG2 ARG 33 -10.418 4.315 -9.551 275 HG3 ARG 33 HG3 ARG 33 -11.729 4.338 -10.733 276 HD2 ARG 33 HD2 ARG 33 -12.352 5.437 -8.065 277 HD3 ARG 33 HD3 ARG 33 -11.211 6.362 -9.040 278 HE ARG 33 HE ARG 33 -14.028 6.084 -9.479 279 HH11 ARG 33 HH11 ARG 33 -10.959 6.658 -11.019 280 HH12 ARG 33 HH12 ARG 33 -11.645 7.505 -12.365 281 HH21 ARG 33 HH21 ARG 33 -14.944 7.199 -11.246 282 HH22 ARG 33 HH22 ARG 33 -13.912 7.813 -12.493 283 H ILE 34 H ILE 34 -9.256 1.548 -7.550 284 HA ILE 34 HA ILE 34 -10.784 -0.065 -5.620 285 HB ILE 34 HB ILE 34 -7.841 0.004 -6.258 286 HG12 ILE 34 HG12 ILE 34 -9.586 -2.429 -6.054 287 HG13 ILE 34 HG13 ILE 34 -9.636 -1.433 -7.505 288 HG21 ILE 34 HG21 ILE 34 -7.744 -1.793 -4.416 289 HG22 ILE 34 HG22 ILE 34 -7.775 -0.097 -3.936 290 HG23 ILE 34 HG23 ILE 34 -9.244 -1.068 -3.839 291 HD11 ILE 34 HD11 ILE 34 -7.114 -2.625 -6.387 292 HD12 ILE 34 HD12 ILE 34 -8.107 -3.392 -7.628 293 HD13 ILE 34 HD13 ILE 34 -7.336 -1.839 -7.950 294 H THR 35 H THR 35 -11.335 0.912 -3.799 295 HA THR 35 HA THR 35 -9.872 3.302 -2.950 296 HB THR 35 HB THR 35 -11.775 3.729 -1.454 297 HG1 THR 35 HG1 THR 35 -13.641 2.329 -1.724 298 HG21 THR 35 HG21 THR 35 -13.438 3.341 -3.726 299 HG22 THR 35 HG22 THR 35 -11.820 3.749 -4.299 300 HG23 THR 35 HG23 THR 35 -12.657 4.824 -3.180 301 H GLN 36 H GLN 36 -8.990 3.526 -0.905 302 HA GLN 36 HA GLN 36 -8.462 1.000 0.483 303 HB2 GLN 36 HB2 GLN 36 -6.612 2.604 -0.321 304 HB3 GLN 36 HB3 GLN 36 -7.088 3.618 1.035 305 HG2 GLN 36 HG2 GLN 36 -6.800 1.281 2.310 306 HG3 GLN 36 HG3 GLN 36 -5.646 1.048 0.998 307 HE21 GLN 36 HE21 GLN 36 -3.963 1.056 2.540 308 HE22 GLN 36 HE22 GLN 36 -3.387 2.535 3.222 309 H GLY 37 H GLY 37 -9.880 0.572 2.051 310 HA2 GLY 37 HA2 GLY 37 -10.852 0.815 4.142 311 HA3 GLY 37 HA3 GLY 37 -10.181 2.437 4.231 312 H GLY 38 H GLY 38 -11.259 3.679 2.061 313 HA2 GLY 38 HA2 GLY 38 -13.989 3.247 1.594 314 HA3 GLY 38 HA3 GLY 38 -13.841 4.340 2.962 315 H LYS 39 H LYS 39 -11.216 4.708 0.927 316 HA LYS 39 HA LYS 39 -12.534 6.764 -0.699 317 HB2 LYS 39 HB2 LYS 39 -10.881 7.307 1.525 318 HB3 LYS 39 HB3 LYS 39 -9.923 7.672 0.096 319 HG2 LYS 39 HG2 LYS 39 -11.606 9.198 -0.701 320 HG3 LYS 39 HG3 LYS 39 -12.678 8.761 0.631 321 HD2 LYS 39 HD2 LYS 39 -11.252 9.771 2.230 322 HD3 LYS 39 HD3 LYS 39 -9.937 9.928 1.063 323 HE2 LYS 39 HE2 LYS 39 -12.360 11.243 0.163 324 HE3 LYS 39 HE3 LYS 39 -11.814 11.862 1.721 325 HZ1 LYS 39 HZ1 LYS 39 -9.726 12.433 0.813 326 HZ2 LYS 39 HZ2 LYS 39 -10.881 13.006 -0.282 327 HZ3 LYS 39 HZ3 LYS 39 -10.022 11.590 -0.624 328 H VAL 40 H VAL 40 -11.643 7.102 -2.710 329 HA VAL 40 HA VAL 40 -10.320 5.013 -3.965 330 HB VAL 40 HB VAL 40 -11.595 7.049 -4.972 331 HG11 VAL 40 HG11 VAL 40 -9.872 8.655 -4.032 332 HG12 VAL 40 HG12 VAL 40 -8.788 8.077 -5.299 333 HG13 VAL 40 HG13 VAL 40 -10.304 8.871 -5.728 334 HG21 VAL 40 HG21 VAL 40 -9.344 5.479 -6.117 335 HG22 VAL 40 HG22 VAL 40 -11.061 5.450 -6.519 336 HG23 VAL 40 HG23 VAL 40 -10.044 6.774 -7.089 337 H VAL 41 H VAL 41 -8.218 4.569 -4.491 338 HA VAL 41 HA VAL 41 -6.143 6.382 -3.462 339 HB VAL 41 HB VAL 41 -4.846 4.228 -2.884 340 HG11 VAL 41 HG11 VAL 41 -7.190 4.811 -1.098 341 HG12 VAL 41 HG12 VAL 41 -5.546 4.354 -0.645 342 HG13 VAL 41 HG13 VAL 41 -5.865 5.955 -1.313 343 HG21 VAL 41 HG21 VAL 41 -7.646 3.132 -2.681 344 HG22 VAL 41 HG22 VAL 41 -6.521 2.731 -3.979 345 HG23 VAL 41 HG23 VAL 41 -6.138 2.295 -2.313 346 H LYS 42 H LYS 42 -7.145 3.949 -5.749 347 HA LYS 42 HA LYS 42 -5.148 4.867 -7.629 348 HB2 LYS 42 HB2 LYS 42 -4.507 2.671 -6.077 349 HB3 LYS 42 HB3 LYS 42 -5.140 1.945 -7.549 350 HG2 LYS 42 HG2 LYS 42 -3.525 3.121 -8.886 351 HG3 LYS 42 HG3 LYS 42 -2.954 4.015 -7.475 352 HD2 LYS 42 HD2 LYS 42 -2.867 1.012 -7.627 353 HD3 LYS 42 HD3 LYS 42 -1.551 2.028 -8.219 354 HE2 LYS 42 HE2 LYS 42 -2.555 2.571 -5.486 355 HE3 LYS 42 HE3 LYS 42 -1.645 1.080 -5.723 356 HZ1 LYS 42 HZ1 LYS 42 0.044 2.510 -5.275 357 HZ2 LYS 42 HZ2 LYS 42 -0.748 3.857 -5.924 358 HZ3 LYS 42 HZ3 LYS 42 -0.027 2.723 -6.952 359 H ASN 43 H ASN 43 -5.627 4.327 -9.788 360 HA ASN 43 HA ASN 43 -8.228 3.016 -10.211 361 HB2 ASN 43 HB2 ASN 43 -8.376 4.733 -12.197 362 HB3 ASN 43 HB3 ASN 43 -8.861 5.212 -10.573 363 HD21 ASN 43 HD21 ASN 43 -7.885 6.893 -9.649 364 HD22 ASN 43 HD22 ASN 43 -6.514 7.724 -10.294 365 H TRP 44 H TRP 44 -8.176 1.417 -11.647 366 HA TRP 44 HA TRP 44 -5.855 1.249 -13.452 367 HB2 TRP 44 HB2 TRP 44 -7.516 -0.903 -12.144 368 HB3 TRP 44 HB3 TRP 44 -6.432 -1.236 -13.493 369 HD1 TRP 44 HD1 TRP 44 -6.358 -0.128 -9.810 370 HE1 TRP 44 HE1 TRP 44 -4.008 -0.596 -8.870 371 HE3 TRP 44 HE3 TRP 44 -4.027 -1.563 -14.128 372 HZ2 TRP 44 HZ2 TRP 44 -1.499 -1.458 -9.832 373 HZ3 TRP 44 HZ3 TRP 44 -1.651 -2.193 -14.032 374 HH2 TRP 44 HH2 TRP 44 -0.414 -2.141 -11.928 375 H VAL 45 H VAL 45 -6.159 0.692 -15.606 376 HA VAL 45 HA VAL 45 -8.949 0.809 -16.554 377 HB VAL 45 HB VAL 45 -6.470 1.909 -17.883 378 HG11 VAL 45 HG11 VAL 45 -7.641 1.236 -19.727 379 HG12 VAL 45 HG12 VAL 45 -9.203 1.348 -18.914 380 HG13 VAL 45 HG13 VAL 45 -8.385 2.813 -19.460 381 HG21 VAL 45 HG21 VAL 45 -7.860 3.099 -15.946 382 HG22 VAL 45 HG22 VAL 45 -7.156 3.995 -17.293 383 HG23 VAL 45 HG23 VAL 45 -8.865 3.561 -17.320 384 H MET 46 H MET 46 -9.604 -0.642 -18.080 385 HA MET 46 HA MET 46 -7.770 -2.860 -18.607 386 HB2 MET 46 HB2 MET 46 -9.950 -3.410 -17.633 387 HB3 MET 46 HB3 MET 46 -10.761 -2.650 -18.995 388 HG2 MET 46 HG2 MET 46 -9.033 -4.500 -20.142 389 HG3 MET 46 HG3 MET 46 -9.705 -5.316 -18.732 390 HE1 MET 46 HE1 MET 46 -13.138 -5.002 -18.755 391 HE2 MET 46 HE2 MET 46 -12.796 -6.552 -19.523 392 HE3 MET 46 HE3 MET 46 -11.720 -5.932 -18.270 393 H ASP 47 H ASP 47 -6.703 -2.876 -20.463 394 HA ASP 47 HA ASP 47 -7.537 -1.233 -22.684 395 HB2 ASP 47 HB2 ASP 47 -5.095 -2.071 -21.770 396 HB3 ASP 47 HB3 ASP 47 -5.349 -3.142 -23.145 397 H LEU 48 H LEU 48 -8.939 -1.873 -24.167 398 HA LEU 48 HA LEU 48 -9.525 -4.705 -24.491 399 HB2 LEU 48 HB2 LEU 48 -11.106 -2.490 -24.477 400 HB3 LEU 48 HB3 LEU 48 -10.914 -2.769 -26.206 401 HG LEU 48 HG LEU 48 -12.958 -3.792 -25.327 402 HD11 LEU 48 HD11 LEU 48 -11.283 -4.847 -27.114 403 HD12 LEU 48 HD12 LEU 48 -12.795 -5.624 -26.647 404 HD13 LEU 48 HD13 LEU 48 -11.275 -6.149 -25.924 405 HD21 LEU 48 HD21 LEU 48 -11.774 -4.259 -23.056 406 HD22 LEU 48 HD22 LEU 48 -11.313 -5.780 -23.821 407 HD23 LEU 48 HD23 LEU 48 -13.018 -5.364 -23.641 408 H LYS 49 H LYS 49 -7.727 -2.237 -26.028 409 HA LYS 49 HA LYS 49 -7.783 -3.360 -28.671 410 HB2 LYS 49 HB2 LYS 49 -7.109 -0.913 -27.671 411 HB3 LYS 49 HB3 LYS 49 -5.521 -1.614 -27.953 412 HG2 LYS 49 HG2 LYS 49 -6.700 -2.224 -30.284 413 HG3 LYS 49 HG3 LYS 49 -7.584 -0.753 -29.873 414 HD2 LYS 49 HD2 LYS 49 -4.693 -0.562 -29.456 415 HD3 LYS 49 HD3 LYS 49 -5.158 -0.840 -31.135 416 HE2 LYS 49 HE2 LYS 49 -5.062 1.516 -30.803 417 HE3 LYS 49 HE3 LYS 49 -6.764 1.068 -30.912 418 HZ1 LYS 49 HZ1 LYS 49 -7.138 1.805 -28.864 419 HZ2 LYS 49 HZ2 LYS 49 -5.612 2.532 -28.922 420 HZ3 LYS 49 HZ3 LYS 49 -5.793 1.002 -28.224 421 H ASN 50 H ASN 50 -5.570 -3.440 -25.918 422 HA ASN 50 HA ASN 50 -3.870 -5.349 -27.362 423 HB2 ASN 50 HB2 ASN 50 -3.398 -3.356 -25.233 424 HB3 ASN 50 HB3 ASN 50 -2.533 -4.879 -25.045 425 HD21 ASN 50 HD21 ASN 50 -1.907 -1.973 -25.904 426 HD22 ASN 50 HD22 ASN 50 -0.884 -2.193 -27.279 427 H VAL 51 H VAL 51 -6.296 -5.186 -25.017 428 HA VAL 51 HA VAL 51 -7.282 -6.758 -23.696 429 HB VAL 51 HB VAL 51 -5.438 -8.837 -24.846 430 HG11 VAL 51 HG11 VAL 51 -8.023 -8.792 -23.412 431 HG12 VAL 51 HG12 VAL 51 -7.852 -9.985 -24.701 432 HG13 VAL 51 HG13 VAL 51 -6.712 -9.970 -23.355 433 HG21 VAL 51 HG21 VAL 51 -7.551 -7.275 -26.201 434 HG22 VAL 51 HG22 VAL 51 -6.120 -8.063 -26.865 435 HG23 VAL 51 HG23 VAL 51 -7.552 -9.016 -26.479 436 H LYS 52 H LYS 52 -5.096 -5.278 -22.680 437 HA LYS 52 HA LYS 52 -4.145 -7.158 -20.636 438 HB2 LYS 52 HB2 LYS 52 -2.290 -6.829 -22.182 439 HB3 LYS 52 HB3 LYS 52 -2.454 -5.083 -22.042 440 HG2 LYS 52 HG2 LYS 52 -1.501 -5.019 -19.963 441 HG3 LYS 52 HG3 LYS 52 -1.976 -6.675 -19.574 442 HD2 LYS 52 HD2 LYS 52 0.233 -7.050 -19.939 443 HD3 LYS 52 HD3 LYS 52 -0.319 -7.178 -21.611 444 HE2 LYS 52 HE2 LYS 52 0.089 -4.551 -21.530 445 HE3 LYS 52 HE3 LYS 52 1.228 -5.027 -20.271 446 HZ1 LYS 52 HZ1 LYS 52 1.902 -6.768 -22.111 447 HZ2 LYS 52 HZ2 LYS 52 2.561 -5.211 -22.079 448 HZ3 LYS 52 HZ3 LYS 52 1.295 -5.571 -23.141 449 H LEU 53 H LEU 53 -3.801 -6.259 -18.578 450 HA LEU 53 HA LEU 53 -5.227 -3.737 -18.153 451 HB2 LEU 53 HB2 LEU 53 -4.964 -6.226 -16.700 452 HB3 LEU 53 HB3 LEU 53 -4.613 -4.836 -15.674 453 HG LEU 53 HG LEU 53 -6.824 -3.890 -16.284 454 HD11 LEU 53 HD11 LEU 53 -7.392 -4.801 -18.340 455 HD12 LEU 53 HD12 LEU 53 -8.444 -5.665 -17.220 456 HD13 LEU 53 HD13 LEU 53 -6.988 -6.443 -17.838 457 HD21 LEU 53 HD21 LEU 53 -7.002 -6.669 -15.132 458 HD22 LEU 53 HD22 LEU 53 -8.102 -5.321 -14.844 459 HD23 LEU 53 HD23 LEU 53 -6.446 -5.253 -14.239 460 H VAL 54 H VAL 54 -4.247 -1.941 -17.444 461 HA VAL 54 HA VAL 54 -1.600 -2.116 -16.220 462 HB VAL 54 HB VAL 54 -2.022 -0.104 -18.404 463 HG11 VAL 54 HG11 VAL 54 0.317 -1.263 -16.932 464 HG12 VAL 54 HG12 VAL 54 0.528 -0.464 -18.492 465 HG13 VAL 54 HG13 VAL 54 -0.149 0.427 -17.128 466 HG21 VAL 54 HG21 VAL 54 -0.690 -1.729 -19.854 467 HG22 VAL 54 HG22 VAL 54 -1.182 -2.974 -18.705 468 HG23 VAL 54 HG23 VAL 54 -2.401 -2.081 -19.614 469 H GLU 55 H GLU 55 -0.906 -0.028 -15.282 470 HA GLU 55 HA GLU 55 -3.082 1.184 -13.867 471 HB2 GLU 55 HB2 GLU 55 -1.245 2.602 -12.868 472 HB3 GLU 55 HB3 GLU 55 -1.074 0.867 -12.640 473 HG2 GLU 55 HG2 GLU 55 0.903 0.876 -13.626 474 HG3 GLU 55 HG3 GLU 55 0.241 1.663 -15.057 475 H SER 56 H SER 56 -4.372 2.413 -15.147 476 HA SER 56 HA SER 56 -3.217 4.889 -16.164 477 HB2 SER 56 HB2 SER 56 -3.411 3.012 -17.992 478 HB3 SER 56 HB3 SER 56 -5.123 3.434 -17.962 479 HG SER 56 HG SER 56 -4.691 5.272 -18.910 480 H ASP 57 H ASP 57 -5.004 6.400 -16.917 481 HA ASP 57 HA ASP 57 -7.400 6.019 -15.243 482 HB2 ASP 57 HB2 ASP 57 -5.437 8.017 -15.005 483 HB3 ASP 57 HB3 ASP 57 -6.829 8.805 -15.745 484 H ASP 58 H ASP 58 -6.537 5.819 -18.266 485 HA ASP 58 HA ASP 58 -7.918 7.653 -19.794 486 HB2 ASP 58 HB2 ASP 58 -6.457 5.939 -20.757 487 HB3 ASP 58 HB3 ASP 58 -7.612 4.687 -20.309 488 H ALA 59 H ALA 59 -9.982 7.503 -20.892 489 HA ALA 59 HA ALA 59 -12.114 6.969 -19.089 490 HB1 ALA 59 HB1 ALA 59 -11.813 8.120 -21.768 491 HB2 ALA 59 HB2 ALA 59 -13.351 7.305 -21.487 492 HB3 ALA 59 HB3 ALA 59 -12.843 8.617 -20.425 493 H ALA 60 H ALA 60 -14.114 5.734 -20.005 494 HA ALA 60 HA ALA 60 -13.571 3.414 -21.595 495 HB1 ALA 60 HB1 ALA 60 -14.410 2.595 -18.886 496 HB2 ALA 60 HB2 ALA 60 -13.372 1.775 -20.053 497 HB3 ALA 60 HB3 ALA 60 -12.727 3.089 -19.070 498 H GLU 61 H GLU 61 -15.480 2.048 -21.865 499 HA GLU 61 HA GLU 61 -17.811 3.514 -22.279 500 HB2 GLU 61 HB2 GLU 61 -17.201 0.583 -22.177 501 HB3 GLU 61 HB3 GLU 61 -18.870 1.118 -22.316 502 HG2 GLU 61 HG2 GLU 61 -16.903 2.292 -24.191 503 HG3 GLU 61 HG3 GLU 61 -17.353 0.604 -24.427 504 H ALA 62 H ALA 62 -16.637 1.941 -19.440 505 HA ALA 62 HA ALA 62 -18.855 2.994 -17.907 506 HB1 ALA 62 HB1 ALA 62 -19.090 0.668 -16.778 507 HB2 ALA 62 HB2 ALA 62 -19.929 0.986 -18.297 508 HB3 ALA 62 HB3 ALA 62 -18.427 0.062 -18.296 509 H THR 63 H THR 63 -18.482 2.879 -15.589 510 HA THR 63 HA THR 63 -15.634 2.522 -14.916 511 HB THR 63 HB THR 63 -17.495 4.598 -13.746 512 HG1 THR 63 HG1 THR 63 -16.595 4.797 -16.040 513 HG21 THR 63 HG21 THR 63 -14.807 3.631 -13.056 514 HG22 THR 63 HG22 THR 63 -15.991 4.489 -12.071 515 HG23 THR 63 HG23 THR 63 -14.952 5.384 -13.179 516 H LEU 64 H LEU 64 -15.230 1.135 -13.323 517 HA LEU 64 HA LEU 64 -17.447 0.382 -11.535 518 HB2 LEU 64 HB2 LEU 64 -15.807 -1.204 -13.203 519 HB3 LEU 64 HB3 LEU 64 -15.356 -1.563 -11.538 520 HG LEU 64 HG LEU 64 -18.068 -1.881 -12.812 521 HD11 LEU 64 HD11 LEU 64 -15.972 -3.764 -11.783 522 HD12 LEU 64 HD12 LEU 64 -16.754 -3.732 -13.364 523 HD13 LEU 64 HD13 LEU 64 -17.661 -4.249 -11.943 524 HD21 LEU 64 HD21 LEU 64 -17.268 -1.640 -9.981 525 HD22 LEU 64 HD22 LEU 64 -18.357 -2.970 -10.374 526 HD23 LEU 64 HD23 LEU 64 -18.816 -1.310 -10.758 527 H THR 65 H THR 65 -17.167 1.372 -9.644 528 HA THR 65 HA THR 65 -14.448 1.492 -8.514 529 HB THR 65 HB THR 65 -16.822 3.250 -7.863 530 HG1 THR 65 HG1 THR 65 -15.975 3.822 -9.859 531 HG21 THR 65 HG21 THR 65 -14.293 2.768 -6.517 532 HG22 THR 65 HG22 THR 65 -15.712 3.658 -5.965 533 HG23 THR 65 HG23 THR 65 -14.499 4.462 -6.960 534 H MET 66 H MET 66 -14.031 0.398 -6.701 535 HA MET 66 HA MET 66 -16.044 -0.128 -4.724 536 HB2 MET 66 HB2 MET 66 -16.115 -2.504 -4.867 537 HB3 MET 66 HB3 MET 66 -16.449 -1.890 -6.480 538 HG2 MET 66 HG2 MET 66 -13.734 -2.201 -6.527 539 HG3 MET 66 HG3 MET 66 -14.254 -3.547 -5.516 540 HE1 MET 66 HE1 MET 66 -15.651 -1.644 -8.658 541 HE2 MET 66 HE2 MET 66 -14.010 -2.107 -9.107 542 HE3 MET 66 HE3 MET 66 -15.389 -2.847 -9.921 543 H GLU 67 H GLU 67 -15.158 -1.269 -2.837 544 HA GLU 67 HA GLU 67 -12.596 -0.293 -2.156 545 HB2 GLU 67 HB2 GLU 67 -14.736 -1.795 -0.848 546 HB3 GLU 67 HB3 GLU 67 -13.132 -2.261 -0.297 547 HG2 GLU 67 HG2 GLU 67 -14.141 0.572 -0.363 548 HG3 GLU 67 HG3 GLU 67 -14.202 -0.476 1.053 549 H ASP 68 H ASP 68 -10.673 -1.426 -1.689 550 HA ASP 68 HA ASP 68 -9.804 -3.235 -3.582 551 HB2 ASP 68 HB2 ASP 68 -8.378 -1.865 -2.012 552 HB3 ASP 68 HB3 ASP 68 -8.710 -3.070 -0.771 553 H ASP 69 H ASP 69 -10.786 -3.951 -0.233 554 HA ASP 69 HA ASP 69 -10.502 -6.735 -0.404 555 HB2 ASP 69 HB2 ASP 69 -11.511 -6.834 1.684 556 HB3 ASP 69 HB3 ASP 69 -10.904 -5.180 1.658 557 H ILE 70 H ILE 70 -13.092 -4.600 -1.369 558 HA ILE 70 HA ILE 70 -15.071 -6.627 -1.698 559 HB ILE 70 HB ILE 70 -14.960 -3.920 -3.030 560 HG12 ILE 70 HG12 ILE 70 -14.777 -3.818 -0.541 561 HG13 ILE 70 HG13 ILE 70 -16.243 -3.073 -1.169 562 HG21 ILE 70 HG21 ILE 70 -16.889 -6.106 -3.011 563 HG22 ILE 70 HG22 ILE 70 -17.587 -4.553 -2.557 564 HG23 ILE 70 HG23 ILE 70 -16.750 -4.726 -4.099 565 HD11 ILE 70 HD11 ILE 70 -16.097 -5.851 -0.028 566 HD12 ILE 70 HD12 ILE 70 -16.609 -4.418 0.864 567 HD13 ILE 70 HD13 ILE 70 -17.547 -4.978 -0.520 568 H MET 71 H MET 71 -13.029 -4.837 -4.006 569 HA MET 71 HA MET 71 -13.856 -6.027 -6.351 570 HB2 MET 71 HB2 MET 71 -12.372 -4.195 -6.512 571 HB3 MET 71 HB3 MET 71 -11.167 -4.977 -5.498 572 HG2 MET 71 HG2 MET 71 -10.177 -5.357 -7.479 573 HG3 MET 71 HG3 MET 71 -11.259 -6.748 -7.494 574 HE1 MET 71 HE1 MET 71 -11.981 -2.812 -9.781 575 HE2 MET 71 HE2 MET 71 -12.351 -2.935 -8.061 576 HE3 MET 71 HE3 MET 71 -10.686 -3.102 -8.619 577 H PHE 72 H PHE 72 -11.684 -7.267 -3.894 578 HA PHE 72 HA PHE 72 -10.682 -9.454 -5.396 579 HB2 PHE 72 HB2 PHE 72 -9.852 -8.386 -3.141 580 HB3 PHE 72 HB3 PHE 72 -10.932 -9.571 -2.415 581 HD1 PHE 72 HD2 PHE 72 -7.932 -9.128 -4.500 582 HD2 PHE 72 HD1 PHE 72 -10.376 -11.877 -2.357 583 HE1 PHE 72 HE2 PHE 72 -6.182 -10.845 -4.713 584 HE2 PHE 72 HE1 PHE 72 -8.629 -13.597 -2.565 585 HZ PHE 72 HZ PHE 72 -6.530 -13.083 -3.745 586 H ALA 73 H ALA 73 -13.394 -9.088 -3.155 587 HA ALA 73 HA ALA 73 -14.177 -11.728 -2.892 588 HB1 ALA 73 HB1 ALA 73 -15.128 -9.723 -1.704 589 HB2 ALA 73 HB2 ALA 73 -16.104 -9.431 -3.144 590 HB3 ALA 73 HB3 ALA 73 -16.307 -10.925 -2.230 591 H ILE 74 H ILE 74 -15.108 -9.398 -5.411 592 HA ILE 74 HA ILE 74 -16.555 -11.455 -6.865 593 HB ILE 74 HB ILE 74 -16.018 -8.648 -7.813 594 HG12 ILE 74 HG12 ILE 74 -18.577 -8.624 -6.810 595 HG13 ILE 74 HG13 ILE 74 -17.719 -9.590 -5.615 596 HG21 ILE 74 HG21 ILE 74 -18.183 -10.655 -8.423 597 HG22 ILE 74 HG22 ILE 74 -18.137 -9.002 -9.032 598 HG23 ILE 74 HG23 ILE 74 -16.879 -10.148 -9.497 599 HD11 ILE 74 HD11 ILE 74 -17.177 -7.646 -4.688 600 HD12 ILE 74 HD12 ILE 74 -16.026 -7.473 -6.013 601 HD13 ILE 74 HD13 ILE 74 -17.623 -6.734 -6.130 602 H GLY 75 H GLY 75 -13.408 -10.139 -6.767 603 HA2 GLY 75 HA2 GLY 75 -12.722 -10.626 -9.516 604 HA3 GLY 75 HA3 GLY 75 -11.606 -10.249 -8.212 605 H THR 76 H THR 76 -12.294 -12.374 -6.473 606 HA THR 76 HA THR 76 -10.884 -14.528 -7.825 607 HB THR 76 HB THR 76 -10.157 -13.827 -5.570 608 HG1 THR 76 HG1 THR 76 -11.232 -16.465 -5.535 609 HG21 THR 76 HG21 THR 76 -12.312 -15.195 -4.155 610 HG22 THR 76 HG22 THR 76 -12.844 -13.732 -4.983 611 HG23 THR 76 HG23 THR 76 -11.532 -13.653 -3.808 612 H GLY 77 H GLY 77 -14.002 -13.687 -7.698 613 HA2 GLY 77 HA2 GLY 77 -15.859 -14.911 -8.361 614 HA3 GLY 77 HA3 GLY 77 -14.897 -16.377 -8.243 615 H ALA 78 H ALA 78 -14.756 -14.402 -5.479 616 HA ALA 78 HA ALA 78 -15.960 -16.379 -3.838 617 HB1 ALA 78 HB1 ALA 78 -14.690 -15.310 -2.366 618 HB2 ALA 78 HB2 ALA 78 -14.477 -13.949 -3.468 619 HB3 ALA 78 HB3 ALA 78 -15.862 -13.992 -2.377 620 H LEU 79 H LEU 79 -16.924 -12.959 -3.940 621 HA LEU 79 HA LEU 79 -19.711 -13.817 -3.607 622 HB2 LEU 79 HB2 LEU 79 -18.168 -11.395 -2.830 623 HB3 LEU 79 HB3 LEU 79 -19.894 -11.223 -3.140 624 HG LEU 79 HG LEU 79 -18.794 -13.210 -1.166 625 HD11 LEU 79 HD11 LEU 79 -19.681 -11.382 0.476 626 HD12 LEU 79 HD12 LEU 79 -19.331 -10.292 -0.865 627 HD13 LEU 79 HD13 LEU 79 -18.044 -11.279 -0.172 628 HD21 LEU 79 HD21 LEU 79 -21.031 -13.693 -1.843 629 HD22 LEU 79 HD22 LEU 79 -21.512 -12.006 -1.659 630 HD23 LEU 79 HD23 LEU 79 -21.101 -12.966 -0.237 631 HA PRO 80 HA PRO 80 -20.757 -12.541 -7.687 632 HB2 PRO 80 HB2 PRO 80 -23.404 -12.056 -7.329 633 HB3 PRO 80 HB3 PRO 80 -22.725 -13.687 -7.380 634 HG2 PRO 80 HG2 PRO 80 -23.477 -12.023 -5.008 635 HG3 PRO 80 HG3 PRO 80 -23.767 -13.747 -5.302 636 HD2 PRO 80 HD2 PRO 80 -21.755 -12.856 -3.724 637 HD3 PRO 80 HD3 PRO 80 -21.625 -14.340 -4.690 638 H ALA 81 H ALA 81 -20.776 -10.684 -8.832 639 HA ALA 81 HA ALA 81 -20.337 -8.212 -7.622 640 HB1 ALA 81 HB1 ALA 81 -21.488 -8.362 -10.373 641 HB2 ALA 81 HB2 ALA 81 -20.203 -7.329 -9.747 642 HB3 ALA 81 HB3 ALA 81 -19.890 -9.037 -10.053 643 H LYS 82 H LYS 82 -23.295 -9.822 -8.448 644 HA LYS 82 HA LYS 82 -25.007 -7.571 -8.490 645 HB2 LYS 82 HB2 LYS 82 -25.550 -9.869 -9.363 646 HB3 LYS 82 HB3 LYS 82 -25.743 -10.391 -7.695 647 HG2 LYS 82 HG2 LYS 82 -27.898 -9.920 -8.638 648 HG3 LYS 82 HG3 LYS 82 -27.526 -8.710 -7.408 649 HD2 LYS 82 HD2 LYS 82 -26.584 -7.870 -10.003 650 HD3 LYS 82 HD3 LYS 82 -28.307 -8.251 -10.051 651 HE2 LYS 82 HE2 LYS 82 -28.302 -6.843 -7.809 652 HE3 LYS 82 HE3 LYS 82 -26.860 -6.138 -8.538 653 HZ1 LYS 82 HZ1 LYS 82 -28.082 -5.007 -9.994 654 HZ2 LYS 82 HZ2 LYS 82 -29.422 -5.380 -9.031 655 HZ3 LYS 82 HZ3 LYS 82 -29.052 -6.340 -10.374 656 H GLU 83 H GLU 83 -24.487 -10.007 -5.932 657 HA GLU 83 HA GLU 83 -26.008 -8.823 -3.949 658 HB2 GLU 83 HB2 GLU 83 -23.528 -10.524 -3.807 659 HB3 GLU 83 HB3 GLU 83 -24.360 -9.978 -2.358 660 HG2 GLU 83 HG2 GLU 83 -26.370 -11.129 -3.029 661 HG3 GLU 83 HG3 GLU 83 -25.625 -11.598 -4.556 662 H ALA 84 H ALA 84 -22.495 -8.459 -4.445 663 HA ALA 84 HA ALA 84 -21.952 -6.637 -2.453 664 HB1 ALA 84 HB1 ALA 84 -20.205 -5.776 -4.240 665 HB2 ALA 84 HB2 ALA 84 -20.041 -7.355 -3.470 666 HB3 ALA 84 HB3 ALA 84 -20.724 -7.231 -5.091 667 H MET 85 H MET 85 -23.242 -6.031 -5.687 668 HA MET 85 HA MET 85 -23.168 -3.191 -5.468 669 HB2 MET 85 HB2 MET 85 -24.029 -5.166 -7.421 670 HB3 MET 85 HB3 MET 85 -25.140 -3.806 -7.331 671 HG2 MET 85 HG2 MET 85 -22.960 -2.384 -7.474 672 HG3 MET 85 HG3 MET 85 -22.276 -3.863 -8.145 673 HE1 MET 85 HE1 MET 85 -25.431 -1.558 -8.377 674 HE2 MET 85 HE2 MET 85 -24.063 -0.612 -8.964 675 HE3 MET 85 HE3 MET 85 -25.353 -1.079 -10.073 676 H ALA 86 H ALA 86 -25.420 -5.659 -4.520 677 HA ALA 86 HA ALA 86 -27.701 -3.977 -4.236 678 HB1 ALA 86 HB1 ALA 86 -27.269 -6.513 -2.694 679 HB2 ALA 86 HB2 ALA 86 -28.778 -5.820 -3.288 680 HB3 ALA 86 HB3 ALA 86 -27.628 -6.531 -4.421 681 H GLN 87 H GLN 87 -25.143 -5.050 -2.048 682 HA GLN 87 HA GLN 87 -26.317 -3.666 0.206 683 HB2 GLN 87 HB2 GLN 87 -24.160 -4.386 1.341 684 HB3 GLN 87 HB3 GLN 87 -25.213 -5.677 0.777 685 HG2 GLN 87 HG2 GLN 87 -23.817 -6.014 -1.166 686 HG3 GLN 87 HG3 GLN 87 -22.795 -4.658 -0.695 687 HE21 GLN 87 HE21 GLN 87 -22.526 -7.722 -0.986 688 HE22 GLN 87 HE22 GLN 87 -21.657 -8.171 0.437 689 H ASP 88 H ASP 88 -25.076 -2.423 -2.388 690 HA ASP 88 HA ASP 88 -24.072 -0.455 -2.931 691 HB2 ASP 88 HB2 ASP 88 -24.023 0.298 -0.020 692 HB3 ASP 88 HB3 ASP 88 -24.215 1.341 -1.426 693 H LYS 89 H LYS 89 -22.558 -2.867 -1.843 694 HA LYS 89 HA LYS 89 -20.172 -1.767 -0.677 695 HB2 LYS 89 HB2 LYS 89 -21.060 -4.478 -1.571 696 HB3 LYS 89 HB3 LYS 89 -19.343 -4.186 -1.329 697 HG2 LYS 89 HG2 LYS 89 -21.493 -3.771 0.739 698 HG3 LYS 89 HG3 LYS 89 -20.400 -5.154 0.650 699 HD2 LYS 89 HD2 LYS 89 -18.996 -4.005 1.944 700 HD3 LYS 89 HD3 LYS 89 -18.731 -2.926 0.572 701 HE2 LYS 89 HE2 LYS 89 -21.026 -1.905 1.538 702 HE3 LYS 89 HE3 LYS 89 -20.322 -2.530 3.028 703 HZ1 LYS 89 HZ1 LYS 89 -19.526 -0.273 1.429 704 HZ2 LYS 89 HZ2 LYS 89 -18.235 -1.276 1.864 705 HZ3 LYS 89 HZ3 LYS 89 -19.224 -0.603 3.060 706 H MET 90 H MET 90 -21.391 -1.728 -3.752 707 HA MET 90 HA MET 90 -18.916 -0.841 -4.871 708 HB2 MET 90 HB2 MET 90 -18.508 -2.516 -6.469 709 HB3 MET 90 HB3 MET 90 -18.814 -3.397 -4.978 710 HG2 MET 90 HG2 MET 90 -21.169 -3.709 -5.736 711 HG3 MET 90 HG3 MET 90 -20.704 -2.999 -7.280 712 HE1 MET 90 HE1 MET 90 -18.675 -3.818 -8.604 713 HE2 MET 90 HE2 MET 90 -18.506 -5.534 -8.972 714 HE3 MET 90 HE3 MET 90 -20.023 -4.703 -9.318 715 H GLU 91 H GLU 91 -19.198 0.315 -6.775 716 HA GLU 91 HA GLU 91 -21.966 0.516 -7.761 717 HB2 GLU 91 HB2 GLU 91 -20.019 2.738 -7.151 718 HB3 GLU 91 HB3 GLU 91 -21.438 2.970 -8.163 719 HG2 GLU 91 HG2 GLU 91 -22.566 3.436 -6.319 720 HG3 GLU 91 HG3 GLU 91 -22.412 1.737 -5.875 721 H VAL 92 H VAL 92 -22.142 1.398 -9.960 722 HA VAL 92 HA VAL 92 -19.747 1.230 -11.607 723 HB VAL 92 HB VAL 92 -20.628 -1.085 -11.531 724 HG11 VAL 92 HG11 VAL 92 -22.756 -1.677 -12.104 725 HG12 VAL 92 HG12 VAL 92 -23.073 -0.081 -11.421 726 HG13 VAL 92 HG13 VAL 92 -22.975 -0.290 -13.170 727 HG21 VAL 92 HG21 VAL 92 -19.909 0.441 -13.772 728 HG22 VAL 92 HG22 VAL 92 -19.804 -1.310 -13.584 729 HG23 VAL 92 HG23 VAL 92 -21.249 -0.583 -14.288 730 H ASP 93 H ASP 93 -19.878 2.384 -13.504 731 HA ASP 93 HA ASP 93 -22.411 3.813 -13.982 732 HB2 ASP 93 HB2 ASP 93 -20.056 4.967 -13.152 733 HB3 ASP 93 HB3 ASP 93 -19.983 5.178 -14.899 734 H GLY 94 H GLY 94 -22.165 4.956 -16.298 735 HA2 GLY 94 HA2 GLY 94 -21.743 4.717 -18.581 736 HA3 GLY 94 HA3 GLY 94 -20.863 3.234 -18.239 737 H GLN 95 H GLN 95 -21.778 1.496 -19.080 738 HA GLN 95 HA GLN 95 -24.675 1.508 -19.546 739 HB2 GLN 95 HB2 GLN 95 -22.397 0.542 -21.039 740 HB3 GLN 95 HB3 GLN 95 -23.556 -0.754 -20.770 741 HG2 GLN 95 HG2 GLN 95 -23.785 0.662 -22.886 742 HG3 GLN 95 HG3 GLN 95 -25.236 0.332 -21.940 743 HE21 GLN 95 HE21 GLN 95 -26.370 1.989 -21.112 744 HE22 GLN 95 HE22 GLN 95 -25.933 3.653 -21.273 745 H VAL 96 H VAL 96 -25.607 0.784 -17.702 746 HA VAL 96 HA VAL 96 -24.660 -1.012 -15.855 747 HB VAL 96 HB VAL 96 -27.523 -0.627 -16.739 748 HG11 VAL 96 HG11 VAL 96 -26.336 -2.449 -14.808 749 HG12 VAL 96 HG12 VAL 96 -27.548 -1.387 -14.088 750 HG13 VAL 96 HG13 VAL 96 -27.972 -2.404 -15.465 751 HG21 VAL 96 HG21 VAL 96 -25.799 0.679 -14.654 752 HG22 VAL 96 HG22 VAL 96 -26.716 1.437 -15.956 753 HG23 VAL 96 HG23 VAL 96 -27.561 0.730 -14.580 754 H GLU 97 H GLU 97 -26.100 -1.668 -18.975 755 HA GLU 97 HA GLU 97 -26.570 -4.435 -18.582 756 HB2 GLU 97 HB2 GLU 97 -27.575 -3.004 -20.393 757 HB3 GLU 97 HB3 GLU 97 -26.016 -3.045 -21.205 758 HG2 GLU 97 HG2 GLU 97 -26.651 -5.711 -20.641 759 HG3 GLU 97 HG3 GLU 97 -28.136 -4.972 -21.234 760 H LEU 98 H LEU 98 -23.929 -2.692 -20.218 761 HA LEU 98 HA LEU 98 -22.382 -4.846 -20.980 762 HB2 LEU 98 HB2 LEU 98 -21.956 -2.003 -20.494 763 HB3 LEU 98 HB3 LEU 98 -20.512 -2.975 -20.219 764 HG LEU 98 HG LEU 98 -21.896 -3.556 -22.739 765 HD11 LEU 98 HD11 LEU 98 -22.350 -1.292 -22.959 766 HD12 LEU 98 HD12 LEU 98 -20.782 -1.460 -23.747 767 HD13 LEU 98 HD13 LEU 98 -20.880 -0.811 -22.111 768 HD21 LEU 98 HD21 LEU 98 -19.497 -3.241 -23.531 769 HD22 LEU 98 HD22 LEU 98 -19.801 -4.560 -22.399 770 HD23 LEU 98 HD23 LEU 98 -19.078 -3.055 -21.828 771 H ILE 99 H ILE 99 -21.953 -2.941 -17.991 772 HA ILE 99 HA ILE 99 -20.009 -4.504 -16.802 773 HB ILE 99 HB ILE 99 -20.558 -2.399 -15.822 774 HG12 ILE 99 HG12 ILE 99 -20.816 -3.001 -13.460 775 HG13 ILE 99 HG13 ILE 99 -21.413 -4.592 -13.919 776 HG21 ILE 99 HG21 ILE 99 -22.909 -2.306 -16.442 777 HG22 ILE 99 HG22 ILE 99 -23.287 -3.542 -15.244 778 HG23 ILE 99 HG23 ILE 99 -22.705 -1.961 -14.725 779 HD11 ILE 99 HD11 ILE 99 -19.116 -4.744 -13.230 780 HD12 ILE 99 HD12 ILE 99 -19.234 -5.071 -14.959 781 HD13 ILE 99 HD13 ILE 99 -18.649 -3.506 -14.396 782 H PHE 100 H PHE 100 -23.502 -4.946 -16.839 783 HA PHE 100 HA PHE 100 -23.543 -7.078 -14.953 784 HB2 PHE 100 HB2 PHE 100 -25.531 -5.707 -15.452 785 HB3 PHE 100 HB3 PHE 100 -25.567 -6.363 -17.085 786 HD1 PHE 100 HD2 PHE 100 -25.149 -7.900 -13.710 787 HD2 PHE 100 HD1 PHE 100 -27.357 -7.768 -17.347 788 HE1 PHE 100 HE2 PHE 100 -26.547 -9.766 -12.925 789 HE2 PHE 100 HE1 PHE 100 -28.760 -9.633 -16.567 790 HZ PHE 100 HZ PHE 100 -28.355 -10.635 -14.354 791 H LEU 101 H LEU 101 -23.134 -6.873 -18.419 792 HA LEU 101 HA LEU 101 -23.554 -9.618 -18.993 793 HB2 LEU 101 HB2 LEU 101 -22.808 -7.242 -20.413 794 HB3 LEU 101 HB3 LEU 101 -21.743 -8.568 -20.872 795 HG LEU 101 HG LEU 101 -23.658 -8.329 -22.390 796 HD11 LEU 101 HD11 LEU 101 -23.121 -10.770 -20.817 797 HD12 LEU 101 HD12 LEU 101 -22.998 -10.483 -22.552 798 HD13 LEU 101 HD13 LEU 101 -24.574 -10.779 -21.817 799 HD21 LEU 101 HD21 LEU 101 -25.522 -9.363 -20.325 800 HD22 LEU 101 HD22 LEU 101 -25.841 -8.365 -21.745 801 HD23 LEU 101 HD23 LEU 101 -25.138 -7.641 -20.297 802 H LEU 102 H LEU 102 -21.044 -7.993 -17.419 803 HA LEU 102 HA LEU 102 -18.934 -9.810 -18.179 804 HB2 LEU 102 HB2 LEU 102 -19.169 -7.529 -16.255 805 HB3 LEU 102 HB3 LEU 102 -17.775 -8.607 -16.202 806 HG LEU 102 HG LEU 102 -18.611 -6.912 -18.555 807 HD11 LEU 102 HD11 LEU 102 -16.547 -6.588 -16.409 808 HD12 LEU 102 HD12 LEU 102 -17.723 -5.420 -17.010 809 HD13 LEU 102 HD13 LEU 102 -16.331 -5.857 -18.000 810 HD21 LEU 102 HD21 LEU 102 -16.235 -7.610 -19.287 811 HD22 LEU 102 HD22 LEU 102 -17.562 -8.750 -19.510 812 HD23 LEU 102 HD23 LEU 102 -16.449 -8.945 -18.156 813 H GLU 103 H GLU 103 -21.166 -9.391 -15.502 814 HA GLU 103 HA GLU 103 -20.089 -10.966 -13.545 815 HB2 GLU 103 HB2 GLU 103 -22.693 -9.991 -14.213 816 HB3 GLU 103 HB3 GLU 103 -22.837 -11.663 -13.688 817 HG2 GLU 103 HG2 GLU 103 -21.182 -9.815 -12.057 818 HG3 GLU 103 HG3 GLU 103 -22.936 -9.661 -11.984 819 HA PRO 104 HA PRO 104 -21.963 -14.948 -15.540 820 HB2 PRO 104 HB2 PRO 104 -22.939 -14.735 -18.064 821 HB3 PRO 104 HB3 PRO 104 -23.930 -14.465 -16.625 822 HG2 PRO 104 HG2 PRO 104 -22.604 -12.465 -18.414 823 HG3 PRO 104 HG3 PRO 104 -24.232 -12.432 -17.712 824 HD2 PRO 104 HD2 PRO 104 -22.170 -11.015 -16.676 825 HD3 PRO 104 HD3 PRO 104 -23.473 -11.680 -15.670 826 H PHE 105 H PHE 105 -19.849 -12.733 -16.917 827 HA PHE 105 HA PHE 105 -18.695 -14.628 -18.812 828 HB2 PHE 105 HB2 PHE 105 -18.971 -11.907 -18.909 829 HB3 PHE 105 HB3 PHE 105 -17.300 -12.076 -18.382 830 HD1 PHE 105 HD1 PHE 105 -19.562 -13.715 -20.862 831 HD2 PHE 105 HD2 PHE 105 -15.746 -12.012 -20.055 832 HE1 PHE 105 HE1 PHE 105 -18.880 -14.152 -23.186 833 HE2 PHE 105 HE2 PHE 105 -15.058 -12.445 -22.377 834 HZ PHE 105 HZ PHE 105 -16.626 -13.515 -23.946 835 H ILE 106 H ILE 106 -18.198 -13.392 -15.635 836 HA ILE 106 HA ILE 106 -15.450 -13.786 -15.313 837 HB ILE 106 HB ILE 106 -17.635 -14.121 -13.254 838 HG12 ILE 106 HG12 ILE 106 -15.860 -11.722 -13.501 839 HG13 ILE 106 HG13 ILE 106 -17.248 -11.877 -14.573 840 HG21 ILE 106 HG21 ILE 106 -15.858 -15.080 -12.182 841 HG22 ILE 106 HG22 ILE 106 -14.667 -14.144 -13.084 842 HG23 ILE 106 HG23 ILE 106 -15.579 -13.386 -11.778 843 HD11 ILE 106 HD11 ILE 106 -18.636 -12.201 -12.476 844 HD12 ILE 106 HD12 ILE 106 -17.217 -11.647 -11.586 845 HD13 ILE 106 HD13 ILE 106 -17.986 -10.587 -12.767 846 H ALA 107 H ALA 107 -18.078 -16.053 -15.434 847 HA ALA 107 HA ALA 107 -16.972 -18.246 -14.124 848 HB1 ALA 107 HB1 ALA 107 -19.011 -17.893 -16.254 849 HB2 ALA 107 HB2 ALA 107 -18.384 -19.517 -15.966 850 HB3 ALA 107 HB3 ALA 107 -19.156 -18.625 -14.655 851 H SER 108 H SER 108 -16.240 -16.877 -17.232 852 HA SER 108 HA SER 108 -14.569 -19.185 -17.926 853 HB2 SER 108 HB2 SER 108 -16.256 -17.628 -19.476 854 HB3 SER 108 HB3 SER 108 -14.653 -17.013 -19.878 855 HG SER 108 HG SER 108 -15.606 -19.672 -20.088 856 H LEU 109 H LEU 109 -14.430 -15.865 -16.947 857 HA LEU 109 HA LEU 109 -11.568 -15.701 -17.519 858 HB2 LEU 109 HB2 LEU 109 -13.636 -13.843 -17.572 859 HB3 LEU 109 HB3 LEU 109 -12.703 -13.425 -16.136 860 HG LEU 109 HG LEU 109 -10.689 -13.202 -17.510 861 HD11 LEU 109 HD11 LEU 109 -12.151 -14.705 -19.366 862 HD12 LEU 109 HD12 LEU 109 -10.531 -14.035 -19.558 863 HD13 LEU 109 HD13 LEU 109 -11.935 -13.113 -20.094 864 HD21 LEU 109 HD21 LEU 109 -12.734 -11.434 -17.289 865 HD22 LEU 109 HD22 LEU 109 -12.559 -11.532 -19.041 866 HD23 LEU 109 HD23 LEU 109 -11.180 -11.074 -18.041 867 H LYS 110 H LYS 110 -12.695 -17.459 -15.434 868 HA LYS 110 HA LYS 110 -12.345 -18.059 -13.262 869 HB2 LYS 110 HB2 LYS 110 -9.971 -17.733 -14.329 870 HB3 LYS 110 HB3 LYS 110 -9.884 -16.352 -13.243 871 HG2 LYS 110 HG2 LYS 110 -8.935 -17.963 -11.939 872 HG3 LYS 110 HG3 LYS 110 -10.624 -18.122 -11.450 873 HD2 LYS 110 HD2 LYS 110 -10.903 -19.968 -13.038 874 HD3 LYS 110 HD3 LYS 110 -9.212 -19.808 -13.519 875 HE2 LYS 110 HE2 LYS 110 -9.196 -21.561 -11.979 876 HE3 LYS 110 HE3 LYS 110 -8.677 -20.164 -11.037 877 HZ1 LYS 110 HZ1 LYS 110 -11.087 -21.751 -10.813 878 HZ2 LYS 110 HZ2 LYS 110 -11.327 -20.081 -10.693 879 HZ3 LYS 110 HZ3 LYS 110 -10.262 -20.860 -9.634 Start of MODEL 4 1 H1 MET 1 H MET 1 3.327 1.463 -1.302 2 HA MET 1 HA MET 1 2.558 -0.469 -0.309 3 HB2 MET 1 HB2 MET 1 0.298 1.413 -0.713 4 HB3 MET 1 HB3 MET 1 -0.109 -0.209 -0.168 5 HG2 MET 1 HG2 MET 1 2.028 1.329 1.232 6 HG3 MET 1 HG3 MET 1 0.332 1.683 1.554 7 HE1 MET 1 HE1 MET 1 -0.995 -0.898 3.660 8 HE2 MET 1 HE2 MET 1 -1.266 0.383 2.478 9 HE3 MET 1 HE3 MET 1 -1.240 -1.304 1.961 10 H SER 2 H SER 2 0.665 -2.194 -0.446 11 HA SER 2 HA SER 2 0.359 -2.966 -3.273 12 HB2 SER 2 HB2 SER 2 0.545 -5.167 -1.313 13 HB3 SER 2 HB3 SER 2 1.242 -5.029 -2.928 14 HG SER 2 HG SER 2 2.871 -3.721 -2.055 15 H LEU 3 H LEU 3 -1.585 -3.806 -3.877 16 HA LEU 3 HA LEU 3 -3.688 -3.809 -1.820 17 HB2 LEU 3 HB2 LEU 3 -3.739 -3.262 -4.770 18 HB3 LEU 3 HB3 LEU 3 -5.209 -3.629 -3.870 19 HG LEU 3 HG LEU 3 -3.571 -1.457 -2.748 20 HD11 LEU 3 HD11 LEU 3 -3.315 -1.121 -5.203 21 HD12 LEU 3 HD12 LEU 3 -4.171 0.183 -4.381 22 HD13 LEU 3 HD13 LEU 3 -5.071 -1.007 -5.322 23 HD21 LEU 3 HD21 LEU 3 -6.482 -1.956 -3.313 24 HD22 LEU 3 HD22 LEU 3 -5.881 -0.411 -2.711 25 HD23 LEU 3 HD23 LEU 3 -5.667 -1.876 -1.751 26 H LYS 4 H LYS 4 -5.031 -5.542 -1.571 27 HA LYS 4 HA LYS 4 -4.094 -8.091 -2.272 28 HB2 LYS 4 HB2 LYS 4 -6.184 -7.000 -0.685 29 HB3 LYS 4 HB3 LYS 4 -6.901 -8.203 -1.749 30 HG2 LYS 4 HG2 LYS 4 -5.159 -9.814 -0.975 31 HG3 LYS 4 HG3 LYS 4 -4.655 -8.607 0.210 32 HD2 LYS 4 HD2 LYS 4 -7.534 -9.123 0.197 33 HD3 LYS 4 HD3 LYS 4 -6.559 -10.534 0.617 34 HE2 LYS 4 HE2 LYS 4 -6.115 -7.855 1.900 35 HE3 LYS 4 HE3 LYS 4 -7.309 -8.995 2.519 36 HZ1 LYS 4 HZ1 LYS 4 -5.727 -10.334 3.344 37 HZ2 LYS 4 HZ2 LYS 4 -4.754 -8.951 3.284 38 HZ3 LYS 4 HZ3 LYS 4 -4.672 -10.097 2.042 39 H SER 5 H SER 5 -6.478 -5.983 -3.767 40 HA SER 5 HA SER 5 -7.602 -7.845 -5.546 41 HB2 SER 5 HB2 SER 5 -8.383 -5.894 -6.811 42 HB3 SER 5 HB3 SER 5 -8.608 -5.642 -5.080 43 HG SER 5 HG SER 5 -6.343 -4.634 -5.372 44 H ASP 6 H ASP 6 -4.542 -6.309 -5.507 45 HA ASP 6 HA ASP 6 -3.877 -6.156 -8.196 46 HB2 ASP 6 HB2 ASP 6 -2.539 -5.502 -6.038 47 HB3 ASP 6 HB3 ASP 6 -1.859 -7.119 -6.201 48 H GLU 7 H GLU 7 -3.707 -8.925 -5.996 49 HA GLU 7 HA GLU 7 -2.457 -10.715 -7.764 50 HB2 GLU 7 HB2 GLU 7 -4.466 -11.539 -5.677 51 HB3 GLU 7 HB3 GLU 7 -3.064 -12.431 -6.252 52 HG2 GLU 7 HG2 GLU 7 -1.701 -10.473 -5.272 53 HG3 GLU 7 HG3 GLU 7 -3.178 -10.101 -4.385 54 H VAL 8 H VAL 8 -5.905 -10.207 -7.046 55 HA VAL 8 HA VAL 8 -6.929 -12.136 -8.792 56 HB VAL 8 HB VAL 8 -8.204 -9.517 -7.985 57 HG11 VAL 8 HG11 VAL 8 -9.049 -11.355 -9.886 58 HG12 VAL 8 HG12 VAL 8 -9.984 -11.752 -8.443 59 HG13 VAL 8 HG13 VAL 8 -10.032 -10.117 -9.105 60 HG21 VAL 8 HG21 VAL 8 -7.818 -12.099 -6.601 61 HG22 VAL 8 HG22 VAL 8 -7.982 -10.472 -5.943 62 HG23 VAL 8 HG23 VAL 8 -9.414 -11.361 -6.460 63 H PHE 9 H PHE 9 -6.463 -8.642 -9.319 64 HA PHE 9 HA PHE 9 -7.336 -8.583 -11.977 65 HB2 PHE 9 HB2 PHE 9 -5.744 -6.811 -10.219 66 HB3 PHE 9 HB3 PHE 9 -5.537 -6.566 -11.950 67 HD1 PHE 9 HD2 PHE 9 -8.506 -7.412 -9.857 68 HD2 PHE 9 HD1 PHE 9 -6.704 -4.701 -12.599 69 HE1 PHE 9 HE2 PHE 9 -10.583 -6.095 -9.914 70 HE2 PHE 9 HE1 PHE 9 -8.778 -3.378 -12.659 71 HZ PHE 9 HZ PHE 9 -10.722 -4.076 -11.317 72 H ALA 10 H ALA 10 -4.207 -9.344 -10.579 73 HA ALA 10 HA ALA 10 -2.687 -9.278 -12.951 74 HB1 ALA 10 HB1 ALA 10 -2.342 -10.437 -10.243 75 HB2 ALA 10 HB2 ALA 10 -1.304 -11.047 -11.532 76 HB3 ALA 10 HB3 ALA 10 -1.308 -9.327 -11.143 77 H LYS 11 H LYS 11 -4.386 -11.935 -11.318 78 HA LYS 11 HA LYS 11 -3.616 -13.986 -13.066 79 HB2 LYS 11 HB2 LYS 11 -6.278 -13.857 -11.657 80 HB3 LYS 11 HB3 LYS 11 -5.353 -15.288 -12.093 81 HG2 LYS 11 HG2 LYS 11 -3.623 -13.899 -10.466 82 HG3 LYS 11 HG3 LYS 11 -5.199 -13.617 -9.723 83 HD2 LYS 11 HD2 LYS 11 -5.593 -16.086 -9.817 84 HD3 LYS 11 HD3 LYS 11 -3.922 -16.275 -10.355 85 HE2 LYS 11 HE2 LYS 11 -3.451 -16.456 -8.171 86 HE3 LYS 11 HE3 LYS 11 -3.625 -14.702 -8.147 87 HZ1 LYS 11 HZ1 LYS 11 -5.214 -15.021 -6.652 88 HZ2 LYS 11 HZ2 LYS 11 -5.248 -16.691 -6.913 89 HZ3 LYS 11 HZ3 LYS 11 -6.175 -15.664 -7.886 90 H ILE 12 H ILE 12 -6.140 -11.572 -13.283 91 HA ILE 12 HA ILE 12 -7.636 -12.742 -15.369 92 HB ILE 12 HB ILE 12 -7.308 -9.829 -14.642 93 HG12 ILE 12 HG12 ILE 12 -8.248 -11.209 -12.841 94 HG13 ILE 12 HG13 ILE 12 -9.462 -10.119 -13.502 95 HG21 ILE 12 HG21 ILE 12 -9.694 -9.897 -15.818 96 HG22 ILE 12 HG22 ILE 12 -8.207 -9.591 -16.714 97 HG23 ILE 12 HG23 ILE 12 -8.919 -11.204 -16.713 98 HD11 ILE 12 HD11 ILE 12 -10.437 -11.933 -14.769 99 HD12 ILE 12 HD12 ILE 12 -9.185 -13.033 -14.193 100 HD13 ILE 12 HD13 ILE 12 -10.351 -12.352 -13.059 101 H ALA 13 H ALA 13 -5.173 -10.162 -15.474 102 HA ALA 13 HA ALA 13 -5.044 -9.740 -18.181 103 HB1 ALA 13 HB1 ALA 13 -3.181 -8.542 -17.754 104 HB2 ALA 13 HB2 ALA 13 -3.646 -8.817 -16.075 105 HB3 ALA 13 HB3 ALA 13 -2.425 -9.841 -16.831 106 H LYS 14 H LYS 14 -3.158 -12.134 -16.335 107 HA LYS 14 HA LYS 14 -1.821 -13.259 -18.529 108 HB2 LYS 14 HB2 LYS 14 -2.566 -14.431 -15.847 109 HB3 LYS 14 HB3 LYS 14 -1.538 -15.255 -17.012 110 HG2 LYS 14 HG2 LYS 14 -0.133 -13.068 -16.915 111 HG3 LYS 14 HG3 LYS 14 -0.982 -12.815 -15.388 112 HD2 LYS 14 HD2 LYS 14 -0.234 -15.095 -14.686 113 HD3 LYS 14 HD3 LYS 14 0.749 -15.165 -16.151 114 HE2 LYS 14 HE2 LYS 14 1.904 -13.095 -15.401 115 HE3 LYS 14 HE3 LYS 14 0.993 -13.179 -13.894 116 HZ1 LYS 14 HZ1 LYS 14 3.334 -14.171 -13.956 117 HZ2 LYS 14 HZ2 LYS 14 2.633 -15.459 -14.799 118 HZ3 LYS 14 HZ3 LYS 14 2.106 -15.086 -13.235 119 H ARG 15 H ARG 15 -5.018 -13.789 -17.236 120 HA ARG 15 HA ARG 15 -5.497 -16.211 -18.699 121 HB2 ARG 15 HB2 ARG 15 -6.708 -14.974 -16.562 122 HB3 ARG 15 HB3 ARG 15 -7.854 -14.683 -17.864 123 HG2 ARG 15 HG2 ARG 15 -8.464 -16.696 -16.722 124 HG3 ARG 15 HG3 ARG 15 -7.873 -17.113 -18.332 125 HD2 ARG 15 HD2 ARG 15 -6.478 -18.542 -17.350 126 HD3 ARG 15 HD3 ARG 15 -5.611 -17.146 -16.712 127 HE ARG 15 HE ARG 15 -7.582 -17.494 -14.908 128 HH11 ARG 15 HH11 ARG 15 -5.249 -19.665 -16.310 129 HH12 ARG 15 HH12 ARG 15 -5.163 -20.684 -14.912 130 HH21 ARG 15 HH21 ARG 15 -7.477 -18.828 -13.061 131 HH22 ARG 15 HH22 ARG 15 -6.431 -20.208 -13.064 132 H LEU 16 H LEU 16 -6.055 -12.789 -19.208 133 HA LEU 16 HA LEU 16 -7.818 -13.032 -21.409 134 HB2 LEU 16 HB2 LEU 16 -5.933 -10.799 -20.667 135 HB3 LEU 16 HB3 LEU 16 -7.213 -10.687 -21.874 136 HG LEU 16 HG LEU 16 -7.445 -10.836 -18.889 137 HD11 LEU 16 HD11 LEU 16 -8.987 -9.071 -20.738 138 HD12 LEU 16 HD12 LEU 16 -7.312 -8.687 -20.345 139 HD13 LEU 16 HD13 LEU 16 -8.514 -8.802 -19.060 140 HD21 LEU 16 HD21 LEU 16 -9.878 -11.124 -19.188 141 HD22 LEU 16 HD22 LEU 16 -8.954 -12.538 -19.697 142 HD23 LEU 16 HD23 LEU 16 -9.608 -11.430 -20.904 143 H GLU 17 H GLU 17 -4.508 -13.658 -21.088 144 HA GLU 17 HA GLU 17 -3.737 -13.019 -23.782 145 HB2 GLU 17 HB2 GLU 17 -2.412 -14.501 -21.523 146 HB3 GLU 17 HB3 GLU 17 -1.699 -14.454 -23.129 147 HG2 GLU 17 HG2 GLU 17 -2.168 -11.830 -22.733 148 HG3 GLU 17 HG3 GLU 17 -1.885 -12.360 -21.076 149 H SER 18 H SER 18 -5.367 -15.595 -22.280 150 HA SER 18 HA SER 18 -4.624 -17.543 -24.317 151 HB2 SER 18 HB2 SER 18 -5.270 -17.815 -21.661 152 HB3 SER 18 HB3 SER 18 -6.777 -18.273 -22.455 153 HG SER 18 HG SER 18 -5.665 -19.845 -23.597 154 H ILE 19 H ILE 19 -6.836 -15.082 -23.975 155 HA ILE 19 HA ILE 19 -9.225 -16.115 -24.963 156 HB ILE 19 HB ILE 19 -8.078 -13.377 -25.520 157 HG12 ILE 19 HG12 ILE 19 -9.896 -14.281 -23.276 158 HG13 ILE 19 HG13 ILE 19 -8.173 -13.966 -23.103 159 HG21 ILE 19 HG21 ILE 19 -10.606 -14.668 -26.178 160 HG22 ILE 19 HG22 ILE 19 -10.805 -13.142 -25.318 161 HG23 ILE 19 HG23 ILE 19 -9.885 -13.193 -26.821 162 HD11 ILE 19 HD11 ILE 19 -8.485 -11.768 -22.959 163 HD12 ILE 19 HD12 ILE 19 -9.639 -11.750 -24.293 164 HD13 ILE 19 HD13 ILE 19 -10.178 -12.167 -22.667 165 H ASP 20 H ASP 20 -10.070 -16.411 -26.997 166 HA ASP 20 HA ASP 20 -8.142 -16.295 -29.224 167 HB2 ASP 20 HB2 ASP 20 -9.601 -18.515 -28.199 168 HB3 ASP 20 HB3 ASP 20 -10.244 -18.141 -29.795 169 HA PRO 21 HA PRO 21 -10.919 -13.702 -31.422 170 HB2 PRO 21 HB2 PRO 21 -10.418 -14.459 -33.980 171 HB3 PRO 21 HB3 PRO 21 -9.279 -13.509 -33.019 172 HG2 PRO 21 HG2 PRO 21 -9.293 -16.450 -33.577 173 HG3 PRO 21 HG3 PRO 21 -7.928 -15.318 -33.576 174 HD2 PRO 21 HD2 PRO 21 -8.450 -16.973 -31.497 175 HD3 PRO 21 HD3 PRO 21 -7.728 -15.366 -31.281 176 H ALA 22 H ALA 22 -11.077 -17.160 -31.899 177 HA ALA 22 HA ALA 22 -13.353 -17.327 -33.518 178 HB1 ALA 22 HB1 ALA 22 -13.613 -19.609 -32.536 179 HB2 ALA 22 HB2 ALA 22 -12.004 -19.266 -33.172 180 HB3 ALA 22 HB3 ALA 22 -12.292 -19.224 -31.433 181 H ASN 23 H ASN 23 -13.127 -17.568 -29.964 182 HA ASN 23 HA ASN 23 -16.013 -17.093 -29.795 183 HB2 ASN 23 HB2 ASN 23 -14.039 -18.514 -28.144 184 HB3 ASN 23 HB3 ASN 23 -15.187 -17.547 -27.222 185 HD21 ASN 23 HD21 ASN 23 -14.782 -20.239 -29.379 186 HD22 ASN 23 HD22 ASN 23 -16.349 -20.927 -29.139 187 H ARG 24 H ARG 24 -16.651 -15.066 -29.531 188 HA ARG 24 HA ARG 24 -15.640 -13.411 -27.455 189 HB2 ARG 24 HB2 ARG 24 -14.539 -13.085 -30.164 190 HB3 ARG 24 HB3 ARG 24 -15.142 -11.601 -29.439 191 HG2 ARG 24 HG2 ARG 24 -13.729 -12.419 -27.379 192 HG3 ARG 24 HG3 ARG 24 -12.863 -13.324 -28.623 193 HD2 ARG 24 HD2 ARG 24 -13.426 -10.406 -28.979 194 HD3 ARG 24 HD3 ARG 24 -12.066 -10.937 -27.991 195 HE ARG 24 HE ARG 24 -12.086 -12.195 -30.551 196 HH11 ARG 24 HH11 ARG 24 -11.246 -9.262 -28.874 197 HH12 ARG 24 HH12 ARG 24 -10.023 -8.806 -30.014 198 HH21 ARG 24 HH21 ARG 24 -10.479 -11.605 -32.059 199 HH22 ARG 24 HH22 ARG 24 -9.589 -10.139 -31.826 200 H GLN 25 H GLN 25 -17.943 -13.610 -27.084 201 HA GLN 25 HA GLN 25 -19.938 -12.752 -28.825 202 HB2 GLN 25 HB2 GLN 25 -19.701 -13.159 -25.907 203 HB3 GLN 25 HB3 GLN 25 -20.999 -12.091 -26.424 204 HG2 GLN 25 HG2 GLN 25 -20.821 -14.577 -27.951 205 HG3 GLN 25 HG3 GLN 25 -21.168 -14.799 -26.237 206 HE21 GLN 25 HE21 GLN 25 -23.216 -15.622 -27.020 207 HE22 GLN 25 HE22 GLN 25 -24.489 -14.512 -27.386 208 H VAL 26 H VAL 26 -18.406 -10.899 -26.188 209 HA VAL 26 HA VAL 26 -18.434 -8.491 -27.757 210 HB VAL 26 HB VAL 26 -20.792 -8.699 -26.802 211 HG11 VAL 26 HG11 VAL 26 -19.918 -9.493 -24.556 212 HG12 VAL 26 HG12 VAL 26 -19.489 -7.810 -24.242 213 HG13 VAL 26 HG13 VAL 26 -21.174 -8.255 -24.519 214 HG21 VAL 26 HG21 VAL 26 -20.045 -6.180 -25.690 215 HG22 VAL 26 HG22 VAL 26 -19.067 -6.484 -27.126 216 HG23 VAL 26 HG23 VAL 26 -20.827 -6.520 -27.234 217 H GLU 27 H GLU 27 -17.004 -6.977 -27.003 218 HA GLU 27 HA GLU 27 -15.962 -7.121 -24.313 219 HB2 GLU 27 HB2 GLU 27 -14.341 -7.962 -26.699 220 HB3 GLU 27 HB3 GLU 27 -13.566 -7.273 -25.280 221 HG2 GLU 27 HG2 GLU 27 -15.184 -9.799 -25.441 222 HG3 GLU 27 HG3 GLU 27 -13.463 -9.637 -25.092 223 H HIS 28 H HIS 28 -15.748 -5.090 -23.675 224 HA HIS 28 HA HIS 28 -14.757 -3.092 -25.588 225 HB2 HIS 28 HB2 HIS 28 -17.276 -3.024 -23.987 226 HB3 HIS 28 HB3 HIS 28 -16.403 -1.515 -24.234 227 HD1 HIS 28 HD1 HIS 28 -15.820 -1.100 -26.934 228 HD2 HIS 28 HD2 HIS 28 -19.044 -3.533 -25.960 229 HE1 HIS 28 HE1 HIS 28 -17.253 -1.177 -29.000 230 H VAL 29 H VAL 29 -14.085 -1.039 -24.432 231 HA VAL 29 HA VAL 29 -12.140 -1.652 -22.495 232 HB VAL 29 HB VAL 29 -13.278 1.088 -23.046 233 HG11 VAL 29 HG11 VAL 29 -11.382 1.965 -22.090 234 HG12 VAL 29 HG12 VAL 29 -11.621 0.528 -21.094 235 HG13 VAL 29 HG13 VAL 29 -10.427 0.514 -22.392 236 HG21 VAL 29 HG21 VAL 29 -11.290 1.194 -24.661 237 HG22 VAL 29 HG22 VAL 29 -11.308 -0.568 -24.592 238 HG23 VAL 29 HG23 VAL 29 -12.723 0.306 -25.180 239 H TYR 30 H TYR 30 -12.150 -1.640 -20.324 240 HA TYR 30 HA TYR 30 -14.504 -0.553 -18.939 241 HB2 TYR 30 HB2 TYR 30 -13.325 -3.301 -18.726 242 HB3 TYR 30 HB3 TYR 30 -14.114 -2.579 -17.328 243 HD1 TYR 30 HD1 TYR 30 -16.530 -1.833 -17.564 244 HD2 TYR 30 HD2 TYR 30 -14.588 -4.295 -20.441 245 HE1 TYR 30 HE1 TYR 30 -18.721 -2.539 -18.430 246 HE2 TYR 30 HE2 TYR 30 -16.774 -5.007 -21.315 247 HH TYR 30 HH TYR 30 -19.125 -5.171 -20.481 248 H LYS 31 H LYS 31 -14.088 0.558 -17.108 249 HA LYS 31 HA LYS 31 -11.272 0.735 -16.272 250 HB2 LYS 31 HB2 LYS 31 -13.400 2.719 -16.646 251 HB3 LYS 31 HB3 LYS 31 -12.525 2.897 -15.131 252 HG2 LYS 31 HG2 LYS 31 -10.591 2.480 -17.131 253 HG3 LYS 31 HG3 LYS 31 -11.741 3.658 -17.767 254 HD2 LYS 31 HD2 LYS 31 -10.473 3.870 -15.041 255 HD3 LYS 31 HD3 LYS 31 -9.806 4.629 -16.488 256 HE2 LYS 31 HE2 LYS 31 -11.653 6.058 -16.721 257 HE3 LYS 31 HE3 LYS 31 -12.644 5.094 -15.627 258 HZ1 LYS 31 HZ1 LYS 31 -10.895 5.741 -13.888 259 HZ2 LYS 31 HZ2 LYS 31 -12.031 6.906 -14.351 260 HZ3 LYS 31 HZ3 LYS 31 -10.459 6.963 -14.973 261 H PHE 32 H PHE 32 -10.700 0.342 -14.201 262 HA PHE 32 HA PHE 32 -12.863 -0.343 -12.320 263 HB2 PHE 32 HB2 PHE 32 -10.082 -1.529 -12.421 264 HB3 PHE 32 HB3 PHE 32 -11.379 -1.999 -11.326 265 HD1 PHE 32 HD2 PHE 32 -13.506 -2.959 -12.358 266 HD2 PHE 32 HD1 PHE 32 -9.841 -2.564 -14.486 267 HE1 PHE 32 HE2 PHE 32 -14.277 -4.631 -13.990 268 HE2 PHE 32 HE1 PHE 32 -10.606 -4.235 -16.122 269 HZ PHE 32 HZ PHE 32 -12.827 -5.272 -15.874 270 H ARG 33 H ARG 33 -12.830 0.539 -10.320 271 HA ARG 33 HA ARG 33 -10.590 2.353 -9.705 272 HB2 ARG 33 HB2 ARG 33 -13.500 2.692 -9.592 273 HB3 ARG 33 HB3 ARG 33 -12.674 3.198 -8.124 274 HG2 ARG 33 HG2 ARG 33 -11.107 4.461 -9.787 275 HG3 ARG 33 HG3 ARG 33 -12.480 4.300 -10.883 276 HD2 ARG 33 HD2 ARG 33 -13.242 5.192 -8.217 277 HD3 ARG 33 HD3 ARG 33 -12.119 6.291 -9.016 278 HE ARG 33 HE ARG 33 -14.860 5.775 -9.740 279 HH11 ARG 33 HH11 ARG 33 -11.763 6.945 -10.818 280 HH12 ARG 33 HH12 ARG 33 -12.425 7.907 -12.097 281 HH21 ARG 33 HH21 ARG 33 -15.744 7.038 -11.421 282 HH22 ARG 33 HH22 ARG 33 -14.690 7.961 -12.438 283 H ILE 34 H ILE 34 -9.345 1.666 -8.106 284 HA ILE 34 HA ILE 34 -10.433 -0.211 -6.140 285 HB ILE 34 HB ILE 34 -7.554 0.588 -6.577 286 HG12 ILE 34 HG12 ILE 34 -8.525 -0.535 -8.555 287 HG13 ILE 34 HG13 ILE 34 -7.303 -1.525 -7.766 288 HG21 ILE 34 HG21 ILE 34 -7.110 -1.513 -5.309 289 HG22 ILE 34 HG22 ILE 34 -7.890 -0.248 -4.361 290 HG23 ILE 34 HG23 ILE 34 -8.836 -1.609 -4.962 291 HD11 ILE 34 HD11 ILE 34 -9.162 -2.894 -8.424 292 HD12 ILE 34 HD12 ILE 34 -9.100 -2.799 -6.664 293 HD13 ILE 34 HD13 ILE 34 -10.286 -1.847 -7.557 294 H THR 35 H THR 35 -11.045 0.498 -4.216 295 HA THR 35 HA THR 35 -9.908 3.025 -3.215 296 HB THR 35 HB THR 35 -11.923 3.433 -2.011 297 HG1 THR 35 HG1 THR 35 -13.518 1.906 -1.771 298 HG21 THR 35 HG21 THR 35 -11.871 3.210 -4.793 299 HG22 THR 35 HG22 THR 35 -13.019 4.136 -3.825 300 HG23 THR 35 HG23 THR 35 -13.402 2.483 -4.306 301 H GLN 36 H GLN 36 -9.245 3.176 -1.074 302 HA GLN 36 HA GLN 36 -8.626 0.609 0.182 303 HB2 GLN 36 HB2 GLN 36 -7.079 2.827 -0.241 304 HB3 GLN 36 HB3 GLN 36 -7.577 3.052 1.430 305 HG2 GLN 36 HG2 GLN 36 -6.613 0.991 2.088 306 HG3 GLN 36 HG3 GLN 36 -6.354 0.505 0.413 307 HE21 GLN 36 HE21 GLN 36 -4.439 0.895 -0.457 308 HE22 GLN 36 HE22 GLN 36 -3.229 1.941 0.196 309 H GLY 37 H GLY 37 -10.357 -0.039 1.355 310 HA2 GLY 37 HA2 GLY 37 -11.626 -0.127 3.291 311 HA3 GLY 37 HA3 GLY 37 -10.952 1.425 3.763 312 H GLY 38 H GLY 38 -11.733 2.740 1.269 313 HA2 GLY 38 HA2 GLY 38 -14.390 2.578 0.592 314 HA3 GLY 38 HA3 GLY 38 -14.365 3.528 2.070 315 H LYS 39 H LYS 39 -11.502 4.233 0.791 316 HA LYS 39 HA LYS 39 -12.572 6.474 -0.796 317 HB2 LYS 39 HB2 LYS 39 -11.399 6.883 1.502 318 HB3 LYS 39 HB3 LYS 39 -9.920 6.588 0.598 319 HG2 LYS 39 HG2 LYS 39 -10.007 8.820 0.315 320 HG3 LYS 39 HG3 LYS 39 -11.066 8.378 -1.026 321 HD2 LYS 39 HD2 LYS 39 -12.928 9.149 0.016 322 HD3 LYS 39 HD3 LYS 39 -12.350 8.693 1.620 323 HE2 LYS 39 HE2 LYS 39 -11.640 10.763 2.008 324 HE3 LYS 39 HE3 LYS 39 -10.686 10.759 0.525 325 HZ1 LYS 39 HZ1 LYS 39 -13.523 11.091 0.117 326 HZ2 LYS 39 HZ2 LYS 39 -12.226 11.941 -0.557 327 HZ3 LYS 39 HZ3 LYS 39 -12.800 12.353 0.979 328 H VAL 40 H VAL 40 -11.960 6.571 -2.853 329 HA VAL 40 HA VAL 40 -10.529 4.645 -4.186 330 HB VAL 40 HB VAL 40 -11.947 6.461 -5.217 331 HG11 VAL 40 HG11 VAL 40 -10.721 8.316 -4.041 332 HG12 VAL 40 HG12 VAL 40 -9.401 8.068 -5.186 333 HG13 VAL 40 HG13 VAL 40 -10.991 8.564 -5.765 334 HG21 VAL 40 HG21 VAL 40 -10.467 6.626 -7.276 335 HG22 VAL 40 HG22 VAL 40 -9.261 5.729 -6.353 336 HG23 VAL 40 HG23 VAL 40 -10.831 5.001 -6.693 337 H VAL 41 H VAL 41 -8.432 4.240 -4.656 338 HA VAL 41 HA VAL 41 -6.419 6.126 -3.615 339 HB VAL 41 HB VAL 41 -6.456 4.213 -2.150 340 HG11 VAL 41 HG11 VAL 41 -7.432 2.443 -3.234 341 HG12 VAL 41 HG12 VAL 41 -6.495 2.687 -4.709 342 HG13 VAL 41 HG13 VAL 41 -5.737 1.960 -3.291 343 HG21 VAL 41 HG21 VAL 41 -4.081 3.494 -3.746 344 HG22 VAL 41 HG22 VAL 41 -4.236 5.195 -3.309 345 HG23 VAL 41 HG23 VAL 41 -4.211 3.960 -2.050 346 H LYS 42 H LYS 42 -7.472 4.085 -6.188 347 HA LYS 42 HA LYS 42 -5.655 5.288 -8.027 348 HB2 LYS 42 HB2 LYS 42 -4.396 3.345 -6.758 349 HB3 LYS 42 HB3 LYS 42 -5.290 2.325 -7.877 350 HG2 LYS 42 HG2 LYS 42 -4.271 3.357 -9.761 351 HG3 LYS 42 HG3 LYS 42 -3.552 4.617 -8.754 352 HD2 LYS 42 HD2 LYS 42 -2.919 1.706 -8.353 353 HD3 LYS 42 HD3 LYS 42 -2.036 2.701 -9.513 354 HE2 LYS 42 HE2 LYS 42 -2.206 4.108 -7.040 355 HE3 LYS 42 HE3 LYS 42 -1.634 2.472 -6.718 356 HZ1 LYS 42 HZ1 LYS 42 0.281 2.821 -7.840 357 HZ2 LYS 42 HZ2 LYS 42 -0.017 4.431 -7.414 358 HZ3 LYS 42 HZ3 LYS 42 -0.415 3.878 -8.963 359 H ASN 43 H ASN 43 -5.901 4.291 -10.254 360 HA ASN 43 HA ASN 43 -8.483 2.946 -10.596 361 HB2 ASN 43 HB2 ASN 43 -8.808 4.555 -12.614 362 HB3 ASN 43 HB3 ASN 43 -9.197 5.130 -10.995 363 HD21 ASN 43 HD21 ASN 43 -7.957 6.711 -10.061 364 HD22 ASN 43 HD22 ASN 43 -6.760 7.604 -10.928 365 H TRP 44 H TRP 44 -8.348 1.295 -11.966 366 HA TRP 44 HA TRP 44 -5.998 1.144 -13.728 367 HB2 TRP 44 HB2 TRP 44 -7.711 -0.987 -12.458 368 HB3 TRP 44 HB3 TRP 44 -6.602 -1.342 -13.780 369 HD1 TRP 44 HD1 TRP 44 -6.606 -0.238 -10.100 370 HE1 TRP 44 HE1 TRP 44 -4.278 -0.710 -9.108 371 HE3 TRP 44 HE3 TRP 44 -4.175 -1.654 -14.369 372 HZ2 TRP 44 HZ2 TRP 44 -1.747 -1.568 -10.015 373 HZ3 TRP 44 HZ3 TRP 44 -1.802 -2.285 -14.221 374 HH2 TRP 44 HH2 TRP 44 -0.614 -2.241 -12.088 375 H VAL 45 H VAL 45 -6.230 0.447 -15.881 376 HA VAL 45 HA VAL 45 -8.968 0.692 -16.949 377 HB VAL 45 HB VAL 45 -6.381 1.504 -18.282 378 HG11 VAL 45 HG11 VAL 45 -8.361 2.581 -19.784 379 HG12 VAL 45 HG12 VAL 45 -7.559 1.052 -20.146 380 HG13 VAL 45 HG13 VAL 45 -9.104 1.059 -19.296 381 HG21 VAL 45 HG21 VAL 45 -7.091 3.759 -18.020 382 HG22 VAL 45 HG22 VAL 45 -8.672 3.259 -17.420 383 HG23 VAL 45 HG23 VAL 45 -7.231 2.988 -16.440 384 H MET 46 H MET 46 -9.636 -0.742 -18.511 385 HA MET 46 HA MET 46 -7.968 -3.130 -18.808 386 HB2 MET 46 HB2 MET 46 -10.399 -3.189 -17.970 387 HB3 MET 46 HB3 MET 46 -10.849 -2.882 -19.642 388 HG2 MET 46 HG2 MET 46 -9.035 -4.987 -19.767 389 HG3 MET 46 HG3 MET 46 -10.051 -5.338 -18.370 390 HE1 MET 46 HE1 MET 46 -13.528 -5.809 -19.695 391 HE2 MET 46 HE2 MET 46 -12.361 -6.810 -18.831 392 HE3 MET 46 HE3 MET 46 -12.558 -5.111 -18.398 393 H ASP 47 H ASP 47 -6.677 -3.037 -20.534 394 HA ASP 47 HA ASP 47 -7.286 -1.532 -22.877 395 HB2 ASP 47 HB2 ASP 47 -4.983 -2.494 -21.796 396 HB3 ASP 47 HB3 ASP 47 -5.245 -3.653 -23.096 397 H LEU 48 H LEU 48 -8.877 -2.128 -24.200 398 HA LEU 48 HA LEU 48 -9.573 -4.910 -24.564 399 HB2 LEU 48 HB2 LEU 48 -11.037 -2.653 -24.578 400 HB3 LEU 48 HB3 LEU 48 -10.764 -2.846 -26.308 401 HG LEU 48 HG LEU 48 -12.901 -3.805 -25.618 402 HD11 LEU 48 HD11 LEU 48 -10.983 -6.010 -26.334 403 HD12 LEU 48 HD12 LEU 48 -11.535 -4.787 -27.478 404 HD13 LEU 48 HD13 LEU 48 -12.696 -5.890 -26.738 405 HD21 LEU 48 HD21 LEU 48 -11.664 -4.527 -23.326 406 HD22 LEU 48 HD22 LEU 48 -11.670 -6.064 -24.191 407 HD23 LEU 48 HD23 LEU 48 -13.187 -5.216 -23.889 408 H LYS 49 H LYS 49 -7.743 -2.477 -26.213 409 HA LYS 49 HA LYS 49 -7.746 -3.760 -28.776 410 HB2 LYS 49 HB2 LYS 49 -6.746 -1.314 -27.638 411 HB3 LYS 49 HB3 LYS 49 -5.470 -2.104 -28.556 412 HG2 LYS 49 HG2 LYS 49 -6.364 -1.037 -30.302 413 HG3 LYS 49 HG3 LYS 49 -7.568 -2.327 -30.265 414 HD2 LYS 49 HD2 LYS 49 -9.160 -0.991 -29.251 415 HD3 LYS 49 HD3 LYS 49 -7.956 0.110 -28.579 416 HE2 LYS 49 HE2 LYS 49 -8.896 1.364 -30.286 417 HE3 LYS 49 HE3 LYS 49 -7.458 0.690 -31.051 418 HZ1 LYS 49 HZ1 LYS 49 -10.232 -0.337 -31.317 419 HZ2 LYS 49 HZ2 LYS 49 -8.864 -1.062 -31.996 420 HZ3 LYS 49 HZ3 LYS 49 -9.346 0.477 -32.506 421 H ASN 50 H ASN 50 -5.572 -3.686 -25.993 422 HA ASN 50 HA ASN 50 -3.791 -5.595 -27.323 423 HB2 ASN 50 HB2 ASN 50 -3.458 -3.537 -25.275 424 HB3 ASN 50 HB3 ASN 50 -2.697 -5.064 -24.837 425 HD21 ASN 50 HD21 ASN 50 -3.064 -3.019 -27.717 426 HD22 ASN 50 HD22 ASN 50 -1.411 -3.124 -28.209 427 H VAL 51 H VAL 51 -6.354 -5.492 -25.123 428 HA VAL 51 HA VAL 51 -7.383 -7.085 -23.863 429 HB VAL 51 HB VAL 51 -5.466 -9.149 -24.907 430 HG11 VAL 51 HG11 VAL 51 -8.315 -9.742 -24.816 431 HG12 VAL 51 HG12 VAL 51 -6.949 -10.634 -24.141 432 HG13 VAL 51 HG13 VAL 51 -7.655 -9.287 -23.245 433 HG21 VAL 51 HG21 VAL 51 -7.522 -7.613 -26.407 434 HG22 VAL 51 HG22 VAL 51 -5.977 -8.265 -26.953 435 HG23 VAL 51 HG23 VAL 51 -7.361 -9.338 -26.739 436 H LYS 52 H LYS 52 -5.236 -5.595 -22.745 437 HA LYS 52 HA LYS 52 -4.393 -7.478 -20.656 438 HB2 LYS 52 HB2 LYS 52 -2.535 -6.958 -22.324 439 HB3 LYS 52 HB3 LYS 52 -2.572 -5.313 -21.702 440 HG2 LYS 52 HG2 LYS 52 -1.474 -5.864 -19.833 441 HG3 LYS 52 HG3 LYS 52 -2.369 -7.373 -19.633 442 HD2 LYS 52 HD2 LYS 52 -0.669 -8.539 -20.467 443 HD3 LYS 52 HD3 LYS 52 -0.670 -7.557 -21.934 444 HE2 LYS 52 HE2 LYS 52 0.591 -6.573 -19.397 445 HE3 LYS 52 HE3 LYS 52 1.469 -7.625 -20.505 446 HZ1 LYS 52 HZ1 LYS 52 2.032 -5.473 -21.150 447 HZ2 LYS 52 HZ2 LYS 52 0.451 -4.894 -20.990 448 HZ3 LYS 52 HZ3 LYS 52 0.848 -5.927 -22.269 449 H LEU 53 H LEU 53 -3.706 -6.353 -18.645 450 HA LEU 53 HA LEU 53 -5.325 -3.927 -18.249 451 HB2 LEU 53 HB2 LEU 53 -4.991 -6.374 -16.731 452 HB3 LEU 53 HB3 LEU 53 -4.692 -4.944 -15.745 453 HG LEU 53 HG LEU 53 -6.929 -4.090 -16.384 454 HD11 LEU 53 HD11 LEU 53 -8.484 -5.942 -17.287 455 HD12 LEU 53 HD12 LEU 53 -6.998 -6.677 -17.886 456 HD13 LEU 53 HD13 LEU 53 -7.459 -5.062 -18.421 457 HD21 LEU 53 HD21 LEU 53 -7.450 -6.793 -15.287 458 HD22 LEU 53 HD22 LEU 53 -7.955 -5.210 -14.695 459 HD23 LEU 53 HD23 LEU 53 -6.306 -5.771 -14.416 460 H VAL 54 H VAL 54 -4.388 -2.098 -17.559 461 HA VAL 54 HA VAL 54 -1.773 -2.166 -16.286 462 HB VAL 54 HB VAL 54 -0.747 -0.595 -17.818 463 HG11 VAL 54 HG11 VAL 54 -0.459 -2.046 -19.760 464 HG12 VAL 54 HG12 VAL 54 -0.460 -2.982 -18.265 465 HG13 VAL 54 HG13 VAL 54 -1.892 -2.963 -19.296 466 HG21 VAL 54 HG21 VAL 54 -3.464 -0.358 -18.810 467 HG22 VAL 54 HG22 VAL 54 -2.099 0.745 -18.983 468 HG23 VAL 54 HG23 VAL 54 -2.296 -0.598 -20.109 469 H GLU 55 H GLU 55 -1.068 0.202 -15.816 470 HA GLU 55 HA GLU 55 -3.376 1.510 -14.597 471 HB2 GLU 55 HB2 GLU 55 -1.527 2.904 -13.488 472 HB3 GLU 55 HB3 GLU 55 -1.670 1.215 -13.020 473 HG2 GLU 55 HG2 GLU 55 0.349 0.693 -13.819 474 HG3 GLU 55 HG3 GLU 55 0.140 1.676 -15.267 475 H SER 56 H SER 56 -4.378 2.881 -15.934 476 HA SER 56 HA SER 56 -2.821 5.069 -17.073 477 HB2 SER 56 HB2 SER 56 -2.911 3.535 -18.931 478 HB3 SER 56 HB3 SER 56 -4.639 3.276 -18.696 479 HG SER 56 HG SER 56 -3.320 5.601 -19.618 480 H ASP 57 H ASP 57 -4.192 6.867 -17.803 481 HA ASP 57 HA ASP 57 -6.576 7.072 -16.107 482 HB2 ASP 57 HB2 ASP 57 -4.430 8.806 -16.531 483 HB3 ASP 57 HB3 ASP 57 -5.769 9.538 -17.411 484 H ASP 58 H ASP 58 -6.367 5.780 -18.826 485 HA ASP 58 HA ASP 58 -7.785 7.447 -20.654 486 HB2 ASP 58 HB2 ASP 58 -6.391 5.643 -21.486 487 HB3 ASP 58 HB3 ASP 58 -7.356 4.454 -20.615 488 H ALA 59 H ALA 59 -9.950 7.255 -21.350 489 HA ALA 59 HA ALA 59 -11.779 6.552 -19.208 490 HB1 ALA 59 HB1 ALA 59 -13.399 7.438 -21.167 491 HB2 ALA 59 HB2 ALA 59 -12.570 8.499 -20.028 492 HB3 ALA 59 HB3 ALA 59 -11.890 8.225 -21.632 493 H ALA 60 H ALA 60 -13.418 5.038 -19.337 494 HA ALA 60 HA ALA 60 -13.232 3.146 -21.591 495 HB1 ALA 60 HB1 ALA 60 -14.119 1.480 -19.816 496 HB2 ALA 60 HB2 ALA 60 -12.410 1.919 -19.809 497 HB3 ALA 60 HB3 ALA 60 -13.516 2.662 -18.654 498 H GLU 61 H GLU 61 -15.271 1.775 -21.791 499 HA GLU 61 HA GLU 61 -17.457 3.470 -22.321 500 HB2 GLU 61 HB2 GLU 61 -17.426 0.457 -22.072 501 HB3 GLU 61 HB3 GLU 61 -18.690 1.411 -22.834 502 HG2 GLU 61 HG2 GLU 61 -15.899 0.896 -23.775 503 HG3 GLU 61 HG3 GLU 61 -17.424 0.613 -24.611 504 H ALA 62 H ALA 62 -16.422 1.994 -19.445 505 HA ALA 62 HA ALA 62 -18.664 3.054 -17.995 506 HB1 ALA 62 HB1 ALA 62 -19.927 1.226 -17.972 507 HB2 ALA 62 HB2 ALA 62 -18.671 0.274 -18.767 508 HB3 ALA 62 HB3 ALA 62 -18.668 0.448 -17.012 509 H THR 63 H THR 63 -18.399 2.803 -15.644 510 HA THR 63 HA THR 63 -15.579 2.372 -14.899 511 HB THR 63 HB THR 63 -17.292 4.284 -13.364 512 HG1 THR 63 HG1 THR 63 -16.110 4.726 -15.900 513 HG21 THR 63 HG21 THR 63 -15.282 4.104 -12.286 514 HG22 THR 63 HG22 THR 63 -14.877 5.389 -13.424 515 HG23 THR 63 HG23 THR 63 -14.399 3.727 -13.765 516 H LEU 64 H LEU 64 -15.279 0.826 -13.443 517 HA LEU 64 HA LEU 64 -17.548 0.047 -11.736 518 HB2 LEU 64 HB2 LEU 64 -15.475 -1.485 -13.175 519 HB3 LEU 64 HB3 LEU 64 -15.897 -2.069 -11.567 520 HG LEU 64 HG LEU 64 -18.351 -1.692 -12.782 521 HD11 LEU 64 HD11 LEU 64 -17.009 -1.403 -14.921 522 HD12 LEU 64 HD12 LEU 64 -18.288 -2.617 -14.940 523 HD13 LEU 64 HD13 LEU 64 -16.604 -3.113 -14.771 524 HD21 LEU 64 HD21 LEU 64 -16.608 -4.095 -12.333 525 HD22 LEU 64 HD22 LEU 64 -18.239 -4.237 -12.990 526 HD23 LEU 64 HD23 LEU 64 -17.990 -3.539 -11.389 527 H THR 65 H THR 65 -17.313 0.926 -9.784 528 HA THR 65 HA THR 65 -14.627 1.117 -8.614 529 HB THR 65 HB THR 65 -17.204 2.443 -7.746 530 HG1 THR 65 HG1 THR 65 -16.359 4.257 -8.699 531 HG21 THR 65 HG21 THR 65 -14.385 2.632 -6.692 532 HG22 THR 65 HG22 THR 65 -15.837 2.148 -5.815 533 HG23 THR 65 HG23 THR 65 -15.637 3.821 -6.334 534 H MET 66 H MET 66 -14.026 -0.342 -7.164 535 HA MET 66 HA MET 66 -15.954 -1.386 -5.253 536 HB2 MET 66 HB2 MET 66 -14.363 -3.162 -7.109 537 HB3 MET 66 HB3 MET 66 -15.217 -3.735 -5.682 538 HG2 MET 66 HG2 MET 66 -16.830 -4.160 -7.189 539 HG3 MET 66 HG3 MET 66 -17.228 -2.469 -6.894 540 HE1 MET 66 HE1 MET 66 -15.350 -4.442 -10.493 541 HE2 MET 66 HE2 MET 66 -15.786 -5.117 -8.923 542 HE3 MET 66 HE3 MET 66 -17.044 -4.741 -10.102 543 H GLU 67 H GLU 67 -15.075 -1.672 -3.286 544 HA GLU 67 HA GLU 67 -12.568 -0.686 -2.637 545 HB2 GLU 67 HB2 GLU 67 -14.719 -2.060 -1.262 546 HB3 GLU 67 HB3 GLU 67 -13.149 -2.556 -0.644 547 HG2 GLU 67 HG2 GLU 67 -12.583 -0.154 -0.338 548 HG3 GLU 67 HG3 GLU 67 -14.239 0.243 -0.793 549 H ASP 68 H ASP 68 -10.726 -1.848 -1.674 550 HA ASP 68 HA ASP 68 -9.715 -3.801 -3.456 551 HB2 ASP 68 HB2 ASP 68 -8.358 -2.129 -2.128 552 HB3 ASP 68 HB3 ASP 68 -8.622 -3.149 -0.716 553 H ASP 69 H ASP 69 -10.648 -4.020 -0.024 554 HA ASP 69 HA ASP 69 -10.264 -6.805 0.188 555 HB2 ASP 69 HB2 ASP 69 -11.164 -4.671 1.873 556 HB3 ASP 69 HB3 ASP 69 -12.290 -6.018 2.011 557 H ILE 70 H ILE 70 -12.919 -4.868 -0.959 558 HA ILE 70 HA ILE 70 -14.838 -7.014 -0.901 559 HB ILE 70 HB ILE 70 -15.092 -4.484 -2.511 560 HG12 ILE 70 HG12 ILE 70 -14.413 -3.940 -0.179 561 HG13 ILE 70 HG13 ILE 70 -16.037 -3.385 -0.569 562 HG21 ILE 70 HG21 ILE 70 -16.868 -5.868 -3.039 563 HG22 ILE 70 HG22 ILE 70 -16.969 -6.532 -1.409 564 HG23 ILE 70 HG23 ILE 70 -17.531 -4.891 -1.729 565 HD11 ILE 70 HD11 ILE 70 -15.489 -5.962 0.870 566 HD12 ILE 70 HD12 ILE 70 -15.748 -4.424 1.693 567 HD13 ILE 70 HD13 ILE 70 -17.027 -5.118 0.696 568 H MET 71 H MET 71 -13.110 -5.260 -3.478 569 HA MET 71 HA MET 71 -14.054 -6.678 -5.658 570 HB2 MET 71 HB2 MET 71 -12.658 -4.641 -5.799 571 HB3 MET 71 HB3 MET 71 -11.261 -5.579 -5.288 572 HG2 MET 71 HG2 MET 71 -10.904 -5.691 -7.505 573 HG3 MET 71 HG3 MET 71 -12.015 -7.053 -7.380 574 HE1 MET 71 HE1 MET 71 -10.963 -4.119 -8.925 575 HE2 MET 71 HE2 MET 71 -12.230 -3.643 -10.056 576 HE3 MET 71 HE3 MET 71 -12.188 -2.949 -8.435 577 H PHE 72 H PHE 72 -11.689 -7.595 -3.271 578 HA PHE 72 HA PHE 72 -10.433 -9.689 -4.659 579 HB2 PHE 72 HB2 PHE 72 -9.825 -8.580 -2.388 580 HB3 PHE 72 HB3 PHE 72 -10.909 -9.782 -1.695 581 HD1 PHE 72 HD1 PHE 72 -7.893 -9.409 -3.823 582 HD2 PHE 72 HD2 PHE 72 -10.157 -11.940 -1.257 583 HE1 PHE 72 HE1 PHE 72 -6.066 -11.057 -3.841 584 HE2 PHE 72 HE2 PHE 72 -8.333 -13.591 -1.270 585 HZ PHE 72 HZ PHE 72 -6.284 -13.150 -2.562 586 H ALA 73 H ALA 73 -13.242 -9.695 -2.487 587 HA ALA 73 HA ALA 73 -13.738 -12.446 -2.514 588 HB1 ALA 73 HB1 ALA 73 -16.029 -10.551 -2.398 589 HB2 ALA 73 HB2 ALA 73 -15.685 -11.972 -1.411 590 HB3 ALA 73 HB3 ALA 73 -14.801 -10.472 -1.134 591 H ILE 74 H ILE 74 -15.099 -9.875 -4.567 592 HA ILE 74 HA ILE 74 -16.606 -11.687 -6.179 593 HB ILE 74 HB ILE 74 -15.797 -8.830 -6.734 594 HG12 ILE 74 HG12 ILE 74 -18.392 -8.650 -6.183 595 HG13 ILE 74 HG13 ILE 74 -18.052 -10.103 -5.250 596 HG21 ILE 74 HG21 ILE 74 -16.355 -9.862 -8.804 597 HG22 ILE 74 HG22 ILE 74 -17.764 -10.654 -8.100 598 HG23 ILE 74 HG23 ILE 74 -17.749 -8.903 -8.309 599 HD11 ILE 74 HD11 ILE 74 -16.318 -7.705 -4.910 600 HD12 ILE 74 HD12 ILE 74 -17.902 -7.762 -4.137 601 HD13 ILE 74 HD13 ILE 74 -16.696 -8.994 -3.768 602 H GLY 75 H GLY 75 -13.330 -10.714 -6.126 603 HA2 GLY 75 HA2 GLY 75 -12.834 -11.238 -8.931 604 HA3 GLY 75 HA3 GLY 75 -11.630 -10.849 -7.711 605 H THR 76 H THR 76 -12.450 -12.930 -5.874 606 HA THR 76 HA THR 76 -11.143 -15.171 -7.219 607 HB THR 76 HB THR 76 -10.820 -16.112 -4.983 608 HG1 THR 76 HG1 THR 76 -11.460 -14.723 -3.176 609 HG21 THR 76 HG21 THR 76 -9.531 -13.944 -6.023 610 HG22 THR 76 HG22 THR 76 -9.024 -14.817 -4.577 611 HG23 THR 76 HG23 THR 76 -9.994 -13.352 -4.427 612 H GLY 77 H GLY 77 -14.084 -14.345 -7.423 613 HA2 GLY 77 HA2 GLY 77 -16.082 -15.442 -7.696 614 HA3 GLY 77 HA3 GLY 77 -15.158 -16.936 -7.657 615 H ALA 78 H ALA 78 -15.027 -14.749 -4.967 616 HA ALA 78 HA ALA 78 -16.119 -16.780 -3.231 617 HB1 ALA 78 HB1 ALA 78 -15.734 -14.406 -1.776 618 HB2 ALA 78 HB2 ALA 78 -14.693 -15.829 -1.822 619 HB3 ALA 78 HB3 ALA 78 -14.415 -14.497 -2.944 620 H LEU 79 H LEU 79 -16.825 -13.293 -3.260 621 HA LEU 79 HA LEU 79 -19.615 -13.917 -2.638 622 HB2 LEU 79 HB2 LEU 79 -17.825 -11.592 -2.197 623 HB3 LEU 79 HB3 LEU 79 -19.547 -11.270 -2.395 624 HG LEU 79 HG LEU 79 -18.530 -13.234 -0.360 625 HD11 LEU 79 HD11 LEU 79 -17.426 -11.075 0.033 626 HD12 LEU 79 HD12 LEU 79 -18.590 -11.469 1.298 627 HD13 LEU 79 HD13 LEU 79 -19.003 -10.286 0.057 628 HD21 LEU 79 HD21 LEU 79 -20.843 -13.466 -0.722 629 HD22 LEU 79 HD22 LEU 79 -21.089 -11.722 -0.806 630 HD23 LEU 79 HD23 LEU 79 -20.695 -12.484 0.736 631 HA PRO 80 HA PRO 80 -21.020 -12.877 -6.677 632 HB2 PRO 80 HB2 PRO 80 -23.577 -12.186 -6.084 633 HB3 PRO 80 HB3 PRO 80 -23.008 -13.859 -6.076 634 HG2 PRO 80 HG2 PRO 80 -23.394 -11.979 -3.779 635 HG3 PRO 80 HG3 PRO 80 -23.818 -13.696 -3.902 636 HD2 PRO 80 HD2 PRO 80 -21.595 -12.833 -2.619 637 HD3 PRO 80 HD3 PRO 80 -21.662 -14.389 -3.472 638 H ALA 81 H ALA 81 -20.664 -11.103 -7.842 639 HA ALA 81 HA ALA 81 -20.222 -8.565 -6.772 640 HB1 ALA 81 HB1 ALA 81 -19.559 -9.584 -9.069 641 HB2 ALA 81 HB2 ALA 81 -21.090 -8.896 -9.612 642 HB3 ALA 81 HB3 ALA 81 -19.843 -7.848 -8.934 643 H LYS 82 H LYS 82 -23.156 -10.109 -7.797 644 HA LYS 82 HA LYS 82 -24.750 -7.819 -8.200 645 HB2 LYS 82 HB2 LYS 82 -25.223 -10.308 -8.767 646 HB3 LYS 82 HB3 LYS 82 -25.840 -10.403 -7.123 647 HG2 LYS 82 HG2 LYS 82 -27.652 -9.086 -7.576 648 HG3 LYS 82 HG3 LYS 82 -26.838 -8.227 -8.886 649 HD2 LYS 82 HD2 LYS 82 -27.743 -9.599 -10.383 650 HD3 LYS 82 HD3 LYS 82 -27.037 -10.996 -9.566 651 HE2 LYS 82 HE2 LYS 82 -29.508 -9.722 -8.469 652 HE3 LYS 82 HE3 LYS 82 -29.625 -10.810 -9.852 653 HZ1 LYS 82 HZ1 LYS 82 -28.809 -12.590 -8.608 654 HZ2 LYS 82 HZ2 LYS 82 -29.882 -11.817 -7.553 655 HZ3 LYS 82 HZ3 LYS 82 -28.214 -11.596 -7.375 656 H GLU 83 H GLU 83 -24.483 -9.960 -5.359 657 HA GLU 83 HA GLU 83 -26.145 -8.473 -3.672 658 HB2 GLU 83 HB2 GLU 83 -23.804 -10.256 -2.981 659 HB3 GLU 83 HB3 GLU 83 -24.977 -9.654 -1.818 660 HG2 GLU 83 HG2 GLU 83 -25.679 -11.359 -4.193 661 HG3 GLU 83 HG3 GLU 83 -25.378 -11.984 -2.573 662 H ALA 84 H ALA 84 -22.590 -8.452 -3.915 663 HA ALA 84 HA ALA 84 -22.012 -6.540 -2.019 664 HB1 ALA 84 HB1 ALA 84 -19.942 -6.152 -3.192 665 HB2 ALA 84 HB2 ALA 84 -20.337 -7.870 -3.261 666 HB3 ALA 84 HB3 ALA 84 -20.609 -6.845 -4.670 667 H MET 85 H MET 85 -22.868 -6.032 -5.429 668 HA MET 85 HA MET 85 -22.655 -3.197 -5.309 669 HB2 MET 85 HB2 MET 85 -23.246 -5.189 -7.290 670 HB3 MET 85 HB3 MET 85 -24.449 -3.909 -7.375 671 HG2 MET 85 HG2 MET 85 -21.792 -2.822 -7.116 672 HG3 MET 85 HG3 MET 85 -21.909 -3.911 -8.497 673 HE1 MET 85 HE1 MET 85 -23.124 -2.093 -11.140 674 HE2 MET 85 HE2 MET 85 -22.799 -3.657 -10.394 675 HE3 MET 85 HE3 MET 85 -24.458 -3.075 -10.535 676 H ALA 86 H ALA 86 -25.201 -5.487 -4.652 677 HA ALA 86 HA ALA 86 -27.320 -3.553 -4.641 678 HB1 ALA 86 HB1 ALA 86 -28.721 -5.325 -3.865 679 HB2 ALA 86 HB2 ALA 86 -27.643 -5.986 -5.095 680 HB3 ALA 86 HB3 ALA 86 -27.325 -6.292 -3.387 681 H GLN 87 H GLN 87 -24.963 -4.651 -2.373 682 HA GLN 87 HA GLN 87 -26.420 -3.632 -0.074 683 HB2 GLN 87 HB2 GLN 87 -23.611 -4.738 -0.219 684 HB3 GLN 87 HB3 GLN 87 -24.543 -4.440 1.242 685 HG2 GLN 87 HG2 GLN 87 -26.008 -6.150 -0.536 686 HG3 GLN 87 HG3 GLN 87 -24.396 -6.800 -0.245 687 HE21 GLN 87 HE21 GLN 87 -24.221 -8.072 1.446 688 HE22 GLN 87 HE22 GLN 87 -25.227 -8.050 2.850 689 H ASP 88 H ASP 88 -25.199 -2.011 -2.416 690 HA ASP 88 HA ASP 88 -24.349 0.083 -2.683 691 HB2 ASP 88 HB2 ASP 88 -25.877 0.481 -0.665 692 HB3 ASP 88 HB3 ASP 88 -24.414 0.402 0.313 693 H LYS 89 H LYS 89 -22.714 -2.379 -1.641 694 HA LYS 89 HA LYS 89 -20.352 -1.066 -0.589 695 HB2 LYS 89 HB2 LYS 89 -20.776 -3.956 -1.372 696 HB3 LYS 89 HB3 LYS 89 -19.402 -3.318 -0.478 697 HG2 LYS 89 HG2 LYS 89 -20.903 -2.676 1.351 698 HG3 LYS 89 HG3 LYS 89 -22.265 -3.357 0.457 699 HD2 LYS 89 HD2 LYS 89 -21.449 -5.549 0.671 700 HD3 LYS 89 HD3 LYS 89 -19.837 -4.994 1.131 701 HE2 LYS 89 HE2 LYS 89 -21.748 -3.951 2.979 702 HE3 LYS 89 HE3 LYS 89 -22.001 -5.688 2.813 703 HZ1 LYS 89 HZ1 LYS 89 -19.662 -6.039 3.304 704 HZ2 LYS 89 HZ2 LYS 89 -20.412 -5.190 4.560 705 HZ3 LYS 89 HZ3 LYS 89 -19.418 -4.373 3.462 706 H MET 90 H MET 90 -21.651 -1.666 -3.621 707 HA MET 90 HA MET 90 -19.151 -0.931 -4.898 708 HB2 MET 90 HB2 MET 90 -20.602 -3.505 -5.510 709 HB3 MET 90 HB3 MET 90 -19.449 -2.770 -6.615 710 HG2 MET 90 HG2 MET 90 -17.667 -3.044 -5.061 711 HG3 MET 90 HG3 MET 90 -18.781 -3.537 -3.788 712 HE1 MET 90 HE1 MET 90 -20.219 -5.193 -6.867 713 HE2 MET 90 HE2 MET 90 -18.781 -4.412 -7.523 714 HE3 MET 90 HE3 MET 90 -18.896 -6.172 -7.501 715 H GLU 91 H GLU 91 -19.425 0.155 -6.823 716 HA GLU 91 HA GLU 91 -22.163 0.405 -7.855 717 HB2 GLU 91 HB2 GLU 91 -21.598 2.314 -6.318 718 HB3 GLU 91 HB3 GLU 91 -20.322 2.762 -7.441 719 HG2 GLU 91 HG2 GLU 91 -22.436 4.057 -7.681 720 HG3 GLU 91 HG3 GLU 91 -21.884 3.261 -9.154 721 H VAL 92 H VAL 92 -22.209 1.471 -10.025 722 HA VAL 92 HA VAL 92 -19.741 1.333 -11.552 723 HB VAL 92 HB VAL 92 -22.107 -0.349 -12.382 724 HG11 VAL 92 HG11 VAL 92 -20.826 0.465 -14.258 725 HG12 VAL 92 HG12 VAL 92 -19.321 -0.062 -13.502 726 HG13 VAL 92 HG13 VAL 92 -20.506 -1.255 -14.036 727 HG21 VAL 92 HG21 VAL 92 -21.141 -1.389 -10.456 728 HG22 VAL 92 HG22 VAL 92 -20.605 -2.282 -11.879 729 HG23 VAL 92 HG23 VAL 92 -19.509 -1.154 -11.082 730 H ASP 93 H ASP 93 -19.777 2.553 -13.414 731 HA ASP 93 HA ASP 93 -22.282 4.011 -13.955 732 HB2 ASP 93 HB2 ASP 93 -20.152 5.209 -12.902 733 HB3 ASP 93 HB3 ASP 93 -19.653 5.266 -14.590 734 H GLY 94 H GLY 94 -21.940 5.220 -16.222 735 HA2 GLY 94 HA2 GLY 94 -21.389 5.046 -18.492 736 HA3 GLY 94 HA3 GLY 94 -20.594 3.514 -18.159 737 H GLN 95 H GLN 95 -21.532 1.914 -19.224 738 HA GLN 95 HA GLN 95 -24.396 2.059 -19.800 739 HB2 GLN 95 HB2 GLN 95 -22.062 0.847 -21.097 740 HB3 GLN 95 HB3 GLN 95 -23.476 -0.198 -21.064 741 HG2 GLN 95 HG2 GLN 95 -23.281 2.562 -22.241 742 HG3 GLN 95 HG3 GLN 95 -23.477 1.038 -23.107 743 HE21 GLN 95 HE21 GLN 95 -25.466 -0.198 -22.568 744 HE22 GLN 95 HE22 GLN 95 -26.920 0.698 -22.305 745 H VAL 96 H VAL 96 -25.562 1.291 -18.139 746 HA VAL 96 HA VAL 96 -24.733 -0.699 -16.332 747 HB VAL 96 HB VAL 96 -27.583 0.038 -17.008 748 HG11 VAL 96 HG11 VAL 96 -27.947 -0.593 -14.609 749 HG12 VAL 96 HG12 VAL 96 -27.516 -1.935 -15.672 750 HG13 VAL 96 HG13 VAL 96 -26.305 -1.236 -14.596 751 HG21 VAL 96 HG21 VAL 96 -27.198 1.511 -14.886 752 HG22 VAL 96 HG22 VAL 96 -25.504 1.418 -15.367 753 HG23 VAL 96 HG23 VAL 96 -26.698 2.099 -16.472 754 H GLU 97 H GLU 97 -26.214 -0.875 -19.465 755 HA GLU 97 HA GLU 97 -27.185 -3.551 -19.223 756 HB2 GLU 97 HB2 GLU 97 -27.831 -1.654 -20.917 757 HB3 GLU 97 HB3 GLU 97 -26.501 -2.313 -21.861 758 HG2 GLU 97 HG2 GLU 97 -28.501 -4.233 -20.831 759 HG3 GLU 97 HG3 GLU 97 -29.011 -3.146 -22.122 760 H LEU 98 H LEU 98 -24.188 -2.071 -20.270 761 HA LEU 98 HA LEU 98 -23.098 -4.485 -21.378 762 HB2 LEU 98 HB2 LEU 98 -22.196 -1.710 -20.947 763 HB3 LEU 98 HB3 LEU 98 -20.931 -2.937 -20.964 764 HG LEU 98 HG LEU 98 -22.871 -2.982 -23.204 765 HD11 LEU 98 HD11 LEU 98 -20.974 -1.246 -24.140 766 HD12 LEU 98 HD12 LEU 98 -21.284 -0.632 -22.517 767 HD13 LEU 98 HD13 LEU 98 -22.614 -0.811 -23.660 768 HD21 LEU 98 HD21 LEU 98 -20.047 -3.009 -23.816 769 HD22 LEU 98 HD22 LEU 98 -21.280 -4.231 -24.129 770 HD23 LEU 98 HD23 LEU 98 -20.450 -4.193 -22.573 771 H ILE 99 H ILE 99 -22.384 -2.561 -18.463 772 HA ILE 99 HA ILE 99 -20.477 -4.207 -17.325 773 HB ILE 99 HB ILE 99 -20.970 -3.199 -15.210 774 HG12 ILE 99 HG12 ILE 99 -23.590 -2.310 -16.438 775 HG13 ILE 99 HG13 ILE 99 -23.401 -3.554 -15.207 776 HG21 ILE 99 HG21 ILE 99 -20.637 -1.714 -17.602 777 HG22 ILE 99 HG22 ILE 99 -21.675 -0.783 -16.524 778 HG23 ILE 99 HG23 ILE 99 -20.086 -1.314 -15.975 779 HD11 ILE 99 HD11 ILE 99 -24.150 -1.531 -14.176 780 HD12 ILE 99 HD12 ILE 99 -22.482 -1.833 -13.686 781 HD13 ILE 99 HD13 ILE 99 -22.835 -0.616 -14.913 782 H PHE 100 H PHE 100 -23.926 -4.627 -17.504 783 HA PHE 100 HA PHE 100 -24.132 -6.613 -15.470 784 HB2 PHE 100 HB2 PHE 100 -26.113 -5.407 -16.071 785 HB3 PHE 100 HB3 PHE 100 -25.944 -5.858 -17.764 786 HD1 PHE 100 HD2 PHE 100 -26.601 -7.229 -14.385 787 HD2 PHE 100 HD1 PHE 100 -26.935 -7.803 -18.590 788 HE1 PHE 100 HE2 PHE 100 -28.035 -9.191 -14.000 789 HE2 PHE 100 HE1 PHE 100 -28.370 -9.766 -18.211 790 HZ PHE 100 HZ PHE 100 -28.921 -10.463 -15.914 791 H LEU 101 H LEU 101 -23.547 -6.667 -18.931 792 HA LEU 101 HA LEU 101 -23.890 -9.450 -19.307 793 HB2 LEU 101 HB2 LEU 101 -22.826 -7.184 -20.837 794 HB3 LEU 101 HB3 LEU 101 -22.097 -8.739 -21.232 795 HG LEU 101 HG LEU 101 -23.962 -8.149 -22.725 796 HD11 LEU 101 HD11 LEU 101 -23.380 -10.504 -22.234 797 HD12 LEU 101 HD12 LEU 101 -25.080 -10.277 -22.644 798 HD13 LEU 101 HD13 LEU 101 -24.602 -10.508 -20.962 799 HD21 LEU 101 HD21 LEU 101 -26.107 -8.731 -20.893 800 HD22 LEU 101 HD22 LEU 101 -25.902 -7.360 -21.984 801 HD23 LEU 101 HD23 LEU 101 -25.198 -7.315 -20.366 802 H LEU 102 H LEU 102 -21.533 -7.720 -17.654 803 HA LEU 102 HA LEU 102 -19.353 -9.556 -18.170 804 HB2 LEU 102 HB2 LEU 102 -19.718 -7.110 -16.493 805 HB3 LEU 102 HB3 LEU 102 -18.350 -8.180 -16.196 806 HG LEU 102 HG LEU 102 -18.934 -6.781 -18.806 807 HD11 LEU 102 HD11 LEU 102 -17.207 -6.102 -16.468 808 HD12 LEU 102 HD12 LEU 102 -18.246 -5.059 -17.438 809 HD13 LEU 102 HD13 LEU 102 -16.713 -5.632 -18.094 810 HD21 LEU 102 HD21 LEU 102 -16.273 -7.594 -18.679 811 HD22 LEU 102 HD22 LEU 102 -17.550 -8.285 -19.679 812 HD23 LEU 102 HD23 LEU 102 -17.201 -8.974 -18.093 813 H GLU 103 H GLU 103 -21.734 -8.932 -15.663 814 HA GLU 103 HA GLU 103 -20.779 -10.332 -13.525 815 HB2 GLU 103 HB2 GLU 103 -23.467 -9.740 -14.581 816 HB3 GLU 103 HB3 GLU 103 -23.390 -11.100 -13.471 817 HG2 GLU 103 HG2 GLU 103 -23.589 -9.583 -11.860 818 HG3 GLU 103 HG3 GLU 103 -21.896 -9.208 -12.180 819 HA PRO 104 HA PRO 104 -22.472 -14.497 -15.292 820 HB2 PRO 104 HB2 PRO 104 -23.297 -14.511 -17.878 821 HB3 PRO 104 HB3 PRO 104 -24.376 -14.142 -16.528 822 HG2 PRO 104 HG2 PRO 104 -22.971 -12.272 -18.397 823 HG3 PRO 104 HG3 PRO 104 -24.639 -12.211 -17.798 824 HD2 PRO 104 HD2 PRO 104 -22.663 -10.677 -16.763 825 HD3 PRO 104 HD3 PRO 104 -24.015 -11.280 -15.784 826 H PHE 105 H PHE 105 -20.341 -12.349 -16.788 827 HA PHE 105 HA PHE 105 -19.045 -14.369 -18.437 828 HB2 PHE 105 HB2 PHE 105 -19.355 -11.721 -18.834 829 HB3 PHE 105 HB3 PHE 105 -17.778 -11.716 -18.053 830 HD1 PHE 105 HD1 PHE 105 -15.954 -13.180 -19.045 831 HD2 PHE 105 HD2 PHE 105 -19.568 -12.249 -21.091 832 HE1 PHE 105 HE1 PHE 105 -14.892 -13.774 -21.183 833 HE2 PHE 105 HE2 PHE 105 -18.512 -12.843 -23.233 834 HZ PHE 105 HZ PHE 105 -16.172 -13.607 -23.281 835 H ILE 106 H ILE 106 -18.856 -13.127 -15.281 836 HA ILE 106 HA ILE 106 -16.156 -13.233 -14.670 837 HB ILE 106 HB ILE 106 -18.451 -14.069 -12.893 838 HG12 ILE 106 HG12 ILE 106 -17.068 -11.387 -13.048 839 HG13 ILE 106 HG13 ILE 106 -18.560 -11.754 -13.908 840 HG21 ILE 106 HG21 ILE 106 -16.945 -14.516 -11.328 841 HG22 ILE 106 HG22 ILE 106 -15.651 -14.177 -12.476 842 HG23 ILE 106 HG23 ILE 106 -16.298 -12.882 -11.470 843 HD11 ILE 106 HD11 ILE 106 -18.102 -11.534 -10.960 844 HD12 ILE 106 HD12 ILE 106 -19.251 -10.663 -11.976 845 HD13 ILE 106 HD13 ILE 106 -19.507 -12.371 -11.618 846 H ALA 107 H ALA 107 -18.513 -15.854 -14.855 847 HA ALA 107 HA ALA 107 -17.009 -17.918 -13.758 848 HB1 ALA 107 HB1 ALA 107 -19.368 -17.684 -15.433 849 HB2 ALA 107 HB2 ALA 107 -18.428 -19.133 -15.790 850 HB3 ALA 107 HB3 ALA 107 -19.001 -18.836 -14.149 851 H SER 108 H SER 108 -16.847 -16.443 -16.928 852 HA SER 108 HA SER 108 -14.969 -18.456 -17.885 853 HB2 SER 108 HB2 SER 108 -16.566 -16.279 -19.129 854 HB3 SER 108 HB3 SER 108 -15.031 -16.681 -19.899 855 HG SER 108 HG SER 108 -16.359 -18.094 -20.819 856 H LEU 109 H LEU 109 -15.058 -15.048 -16.988 857 HA LEU 109 HA LEU 109 -12.286 -15.047 -16.322 858 HB2 LEU 109 HB2 LEU 109 -12.824 -14.550 -18.985 859 HB3 LEU 109 HB3 LEU 109 -12.667 -12.938 -18.290 860 HG LEU 109 HG LEU 109 -10.544 -13.572 -19.166 861 HD11 LEU 109 HD11 LEU 109 -9.169 -13.262 -17.286 862 HD12 LEU 109 HD12 LEU 109 -10.316 -14.059 -16.210 863 HD13 LEU 109 HD13 LEU 109 -10.694 -12.473 -16.881 864 HD21 LEU 109 HD21 LEU 109 -11.128 -16.067 -19.039 865 HD22 LEU 109 HD22 LEU 109 -10.475 -15.998 -17.402 866 HD23 LEU 109 HD23 LEU 109 -9.448 -15.595 -18.780 867 H LYS 110 H LYS 110 -11.875 -13.518 -14.829 868 HA LYS 110 HA LYS 110 -12.262 -11.875 -13.303 869 HB2 LYS 110 HB2 LYS 110 -12.240 -10.673 -15.702 870 HB3 LYS 110 HB3 LYS 110 -13.884 -10.282 -15.215 871 HG2 LYS 110 HG2 LYS 110 -11.622 -9.776 -13.335 872 HG3 LYS 110 HG3 LYS 110 -11.939 -8.654 -14.661 873 HD2 LYS 110 HD2 LYS 110 -14.415 -8.842 -13.739 874 HD3 LYS 110 HD3 LYS 110 -13.570 -9.267 -12.249 875 HE2 LYS 110 HE2 LYS 110 -12.184 -7.069 -13.220 876 HE3 LYS 110 HE3 LYS 110 -13.875 -6.689 -13.545 877 HZ1 LYS 110 HZ1 LYS 110 -12.596 -7.264 -10.942 878 HZ2 LYS 110 HZ2 LYS 110 -14.272 -7.354 -11.146 879 HZ3 LYS 110 HZ3 LYS 110 -13.467 -5.889 -11.405 Start of MODEL 5 1 H1 MET 1 H MET 1 4.332 0.944 -1.482 2 HA MET 1 HA MET 1 2.554 -0.136 -0.558 3 HB2 MET 1 HB2 MET 1 1.734 2.339 -1.072 4 HB3 MET 1 HB3 MET 1 0.644 1.495 -2.164 5 HG2 MET 1 HG2 MET 1 0.792 0.368 0.537 6 HG3 MET 1 HG3 MET 1 0.141 2.002 0.447 7 HE1 MET 1 HE1 MET 1 -1.080 -0.260 1.629 8 HE2 MET 1 HE2 MET 1 -2.745 0.142 1.207 9 HE3 MET 1 HE3 MET 1 -2.048 -1.392 0.684 10 H SER 2 H SER 2 1.042 -1.786 -0.904 11 HA SER 2 HA SER 2 0.580 -2.548 -3.706 12 HB2 SER 2 HB2 SER 2 1.191 -4.609 -1.599 13 HB3 SER 2 HB3 SER 2 1.245 -4.777 -3.353 14 HG SER 2 HG SER 2 2.987 -3.081 -3.141 15 H LEU 3 H LEU 3 -1.356 -3.571 -4.139 16 HA LEU 3 HA LEU 3 -3.280 -3.618 -1.909 17 HB2 LEU 3 HB2 LEU 3 -3.576 -2.914 -4.804 18 HB3 LEU 3 HB3 LEU 3 -4.968 -3.443 -3.862 19 HG LEU 3 HG LEU 3 -3.342 -1.201 -2.784 20 HD11 LEU 3 HD11 LEU 3 -4.974 -1.088 -5.281 21 HD12 LEU 3 HD12 LEU 3 -3.445 -0.298 -4.900 22 HD13 LEU 3 HD13 LEU 3 -4.944 0.294 -4.186 23 HD21 LEU 3 HD21 LEU 3 -5.227 -2.074 -1.524 24 HD22 LEU 3 HD22 LEU 3 -6.296 -1.808 -2.902 25 HD23 LEU 3 HD23 LEU 3 -5.563 -0.432 -2.076 26 H LYS 4 H LYS 4 -4.635 -5.366 -1.661 27 HA LYS 4 HA LYS 4 -3.692 -7.881 -2.457 28 HB2 LYS 4 HB2 LYS 4 -6.461 -7.142 -1.492 29 HB3 LYS 4 HB3 LYS 4 -5.782 -8.764 -1.520 30 HG2 LYS 4 HG2 LYS 4 -4.183 -6.776 -0.068 31 HG3 LYS 4 HG3 LYS 4 -5.765 -7.128 0.631 32 HD2 LYS 4 HD2 LYS 4 -4.792 -8.900 1.583 33 HD3 LYS 4 HD3 LYS 4 -4.784 -9.623 -0.027 34 HE2 LYS 4 HE2 LYS 4 -2.558 -8.756 -0.435 35 HE3 LYS 4 HE3 LYS 4 -2.568 -7.927 1.121 36 HZ1 LYS 4 HZ1 LYS 4 -2.426 -10.829 0.585 37 HZ2 LYS 4 HZ2 LYS 4 -2.915 -10.241 2.093 38 HZ3 LYS 4 HZ3 LYS 4 -1.374 -9.871 1.501 39 H SER 5 H SER 5 -6.180 -5.789 -3.808 40 HA SER 5 HA SER 5 -7.406 -7.561 -5.561 41 HB2 SER 5 HB2 SER 5 -7.844 -5.472 -6.962 42 HB3 SER 5 HB3 SER 5 -8.394 -5.419 -5.287 43 HG SER 5 HG SER 5 -5.813 -4.516 -5.793 44 H ASP 6 H ASP 6 -4.269 -6.121 -5.696 45 HA ASP 6 HA ASP 6 -3.699 -6.193 -8.410 46 HB2 ASP 6 HB2 ASP 6 -2.276 -5.440 -6.310 47 HB3 ASP 6 HB3 ASP 6 -1.600 -7.059 -6.468 48 H GLU 7 H GLU 7 -3.570 -8.789 -6.016 49 HA GLU 7 HA GLU 7 -2.365 -10.746 -7.616 50 HB2 GLU 7 HB2 GLU 7 -3.888 -10.676 -5.108 51 HB3 GLU 7 HB3 GLU 7 -4.053 -12.184 -5.998 52 HG2 GLU 7 HG2 GLU 7 -1.448 -12.038 -6.143 53 HG3 GLU 7 HG3 GLU 7 -1.637 -10.973 -4.751 54 H VAL 8 H VAL 8 -5.817 -10.107 -7.020 55 HA VAL 8 HA VAL 8 -6.826 -12.106 -8.706 56 HB VAL 8 HB VAL 8 -8.081 -9.459 -7.966 57 HG11 VAL 8 HG11 VAL 8 -9.872 -10.006 -9.165 58 HG12 VAL 8 HG12 VAL 8 -8.912 -11.297 -9.889 59 HG13 VAL 8 HG13 VAL 8 -9.914 -11.628 -8.475 60 HG21 VAL 8 HG21 VAL 8 -9.020 -11.942 -6.713 61 HG22 VAL 8 HG22 VAL 8 -7.379 -11.468 -6.276 62 HG23 VAL 8 HG23 VAL 8 -8.720 -10.355 -6.004 63 H PHE 9 H PHE 9 -6.194 -8.664 -9.337 64 HA PHE 9 HA PHE 9 -7.075 -8.655 -12.006 65 HB2 PHE 9 HB2 PHE 9 -5.336 -6.888 -10.345 66 HB3 PHE 9 HB3 PHE 9 -5.322 -6.664 -12.092 67 HD1 PHE 9 HD2 PHE 9 -8.013 -7.406 -9.614 68 HD2 PHE 9 HD1 PHE 9 -6.567 -4.836 -12.683 69 HE1 PHE 9 HE2 PHE 9 -10.069 -6.064 -9.454 70 HE2 PHE 9 HE1 PHE 9 -8.620 -3.489 -12.527 71 HZ PHE 9 HZ PHE 9 -10.375 -4.103 -10.912 72 H ALA 10 H ALA 10 -4.049 -9.592 -10.539 73 HA ALA 10 HA ALA 10 -2.505 -9.626 -12.929 74 HB1 ALA 10 HB1 ALA 10 -2.097 -11.025 -10.290 75 HB2 ALA 10 HB2 ALA 10 -0.913 -10.983 -11.596 76 HB3 ALA 10 HB3 ALA 10 -1.399 -9.487 -10.798 77 H LYS 11 H LYS 11 -4.216 -12.144 -11.097 78 HA LYS 11 HA LYS 11 -3.508 -14.283 -12.803 79 HB2 LYS 11 HB2 LYS 11 -6.018 -14.129 -11.138 80 HB3 LYS 11 HB3 LYS 11 -5.134 -15.569 -11.625 81 HG2 LYS 11 HG2 LYS 11 -3.681 -15.404 -9.928 82 HG3 LYS 11 HG3 LYS 11 -3.570 -13.647 -10.058 83 HD2 LYS 11 HD2 LYS 11 -4.698 -13.684 -8.106 84 HD3 LYS 11 HD3 LYS 11 -6.104 -13.924 -9.146 85 HE2 LYS 11 HE2 LYS 11 -5.901 -16.341 -8.868 86 HE3 LYS 11 HE3 LYS 11 -4.477 -16.114 -7.855 87 HZ1 LYS 11 HZ1 LYS 11 -6.308 -14.562 -6.635 88 HZ2 LYS 11 HZ2 LYS 11 -5.942 -16.151 -6.187 89 HZ3 LYS 11 HZ3 LYS 11 -7.268 -15.840 -7.190 90 H ILE 12 H ILE 12 -6.249 -12.061 -12.756 91 HA ILE 12 HA ILE 12 -7.824 -13.317 -14.703 92 HB ILE 12 HB ILE 12 -7.600 -10.393 -13.988 93 HG12 ILE 12 HG12 ILE 12 -9.882 -12.229 -13.326 94 HG13 ILE 12 HG13 ILE 12 -8.434 -12.222 -12.325 95 HG21 ILE 12 HG21 ILE 12 -8.775 -9.975 -15.831 96 HG22 ILE 12 HG22 ILE 12 -9.009 -11.692 -16.155 97 HG23 ILE 12 HG23 ILE 12 -10.112 -10.840 -15.074 98 HD11 ILE 12 HD11 ILE 12 -10.125 -9.807 -12.919 99 HD12 ILE 12 HD12 ILE 12 -10.218 -10.780 -11.451 100 HD13 ILE 12 HD13 ILE 12 -8.744 -9.888 -11.825 101 H ALA 13 H ALA 13 -5.454 -10.680 -15.052 102 HA ALA 13 HA ALA 13 -5.636 -10.279 -17.779 103 HB1 ALA 13 HB1 ALA 13 -3.367 -9.985 -15.847 104 HB2 ALA 13 HB2 ALA 13 -3.146 -9.648 -17.564 105 HB3 ALA 13 HB3 ALA 13 -4.333 -8.735 -16.633 106 H LYS 14 H LYS 14 -3.567 -12.587 -16.040 107 HA LYS 14 HA LYS 14 -2.212 -13.649 -18.226 108 HB2 LYS 14 HB2 LYS 14 -1.855 -14.064 -15.708 109 HB3 LYS 14 HB3 LYS 14 -3.072 -15.323 -15.877 110 HG2 LYS 14 HG2 LYS 14 -1.587 -16.738 -16.709 111 HG3 LYS 14 HG3 LYS 14 -1.075 -15.572 -17.931 112 HD2 LYS 14 HD2 LYS 14 0.828 -16.137 -16.589 113 HD3 LYS 14 HD3 LYS 14 0.349 -14.484 -16.197 114 HE2 LYS 14 HE2 LYS 14 -1.107 -15.995 -14.417 115 HE3 LYS 14 HE3 LYS 14 0.422 -16.867 -14.517 116 HZ1 LYS 14 HZ1 LYS 14 0.135 -14.942 -12.827 117 HZ2 LYS 14 HZ2 LYS 14 0.445 -13.949 -14.161 118 HZ3 LYS 14 HZ3 LYS 14 1.590 -15.097 -13.677 119 H ARG 15 H ARG 15 -5.441 -14.267 -17.042 120 HA ARG 15 HA ARG 15 -5.873 -16.621 -18.610 121 HB2 ARG 15 HB2 ARG 15 -7.845 -14.759 -17.274 122 HB3 ARG 15 HB3 ARG 15 -8.246 -16.319 -17.979 123 HG2 ARG 15 HG2 ARG 15 -6.102 -16.283 -15.943 124 HG3 ARG 15 HG3 ARG 15 -7.750 -15.986 -15.387 125 HD2 ARG 15 HD2 ARG 15 -8.078 -18.120 -17.066 126 HD3 ARG 15 HD3 ARG 15 -6.500 -18.449 -16.352 127 HE ARG 15 HE ARG 15 -8.482 -17.734 -14.411 128 HH11 ARG 15 HH11 ARG 15 -7.175 -20.345 -16.306 129 HH12 ARG 15 HH12 ARG 15 -7.694 -21.578 -15.204 130 HH21 ARG 15 HH21 ARG 15 -9.172 -19.347 -12.953 131 HH22 ARG 15 HH22 ARG 15 -8.831 -21.009 -13.298 132 H LEU 16 H LEU 16 -6.243 -13.195 -19.108 133 HA LEU 16 HA LEU 16 -7.976 -13.323 -21.349 134 HB2 LEU 16 HB2 LEU 16 -5.964 -11.165 -20.761 135 HB3 LEU 16 HB3 LEU 16 -7.450 -11.024 -21.698 136 HG LEU 16 HG LEU 16 -7.172 -11.315 -18.713 137 HD11 LEU 16 HD11 LEU 16 -8.198 -9.173 -18.616 138 HD12 LEU 16 HD12 LEU 16 -8.542 -9.189 -20.345 139 HD13 LEU 16 HD13 LEU 16 -6.876 -9.067 -19.779 140 HD21 LEU 16 HD21 LEU 16 -9.011 -12.681 -19.176 141 HD22 LEU 16 HD22 LEU 16 -9.568 -11.645 -20.490 142 HD23 LEU 16 HD23 LEU 16 -9.723 -11.108 -18.817 143 H GLU 17 H GLU 17 -4.626 -13.931 -20.934 144 HA GLU 17 HA GLU 17 -3.823 -13.400 -23.630 145 HB2 GLU 17 HB2 GLU 17 -2.508 -15.001 -21.430 146 HB3 GLU 17 HB3 GLU 17 -1.760 -14.651 -22.983 147 HG2 GLU 17 HG2 GLU 17 -2.455 -12.163 -22.184 148 HG3 GLU 17 HG3 GLU 17 -2.132 -12.936 -20.633 149 H SER 18 H SER 18 -5.589 -15.869 -22.166 150 HA SER 18 HA SER 18 -4.797 -17.895 -24.117 151 HB2 SER 18 HB2 SER 18 -5.907 -17.941 -21.452 152 HB3 SER 18 HB3 SER 18 -6.919 -18.878 -22.551 153 HG SER 18 HG SER 18 -4.446 -19.439 -21.568 154 H ILE 19 H ILE 19 -6.973 -15.390 -23.885 155 HA ILE 19 HA ILE 19 -9.342 -16.441 -24.939 156 HB ILE 19 HB ILE 19 -8.203 -13.684 -25.415 157 HG12 ILE 19 HG12 ILE 19 -10.098 -14.623 -23.252 158 HG13 ILE 19 HG13 ILE 19 -8.379 -14.331 -23.010 159 HG21 ILE 19 HG21 ILE 19 -9.966 -13.508 -26.780 160 HG22 ILE 19 HG22 ILE 19 -10.702 -14.988 -26.166 161 HG23 ILE 19 HG23 ILE 19 -10.932 -13.466 -25.305 162 HD11 ILE 19 HD11 ILE 19 -10.375 -12.517 -22.609 163 HD12 ILE 19 HD12 ILE 19 -8.670 -12.129 -22.847 164 HD13 ILE 19 HD13 ILE 19 -9.785 -12.079 -24.213 165 H ASP 20 H ASP 20 -10.113 -16.718 -27.004 166 HA ASP 20 HA ASP 20 -8.127 -16.505 -29.172 167 HB2 ASP 20 HB2 ASP 20 -9.480 -18.813 -28.207 168 HB3 ASP 20 HB3 ASP 20 -10.118 -18.454 -29.809 169 HA PRO 21 HA PRO 21 -10.984 -14.035 -31.409 170 HB2 PRO 21 HB2 PRO 21 -10.374 -14.727 -33.962 171 HB3 PRO 21 HB3 PRO 21 -9.315 -13.730 -32.958 172 HG2 PRO 21 HG2 PRO 21 -9.153 -16.659 -33.554 173 HG3 PRO 21 HG3 PRO 21 -7.853 -15.454 -33.502 174 HD2 PRO 21 HD2 PRO 21 -8.337 -17.164 -31.459 175 HD3 PRO 21 HD3 PRO 21 -7.710 -15.523 -31.202 176 H ALA 22 H ALA 22 -10.898 -17.486 -32.061 177 HA ALA 22 HA ALA 22 -13.227 -17.651 -33.642 178 HB1 ALA 22 HB1 ALA 22 -11.564 -19.568 -32.108 179 HB2 ALA 22 HB2 ALA 22 -13.189 -20.079 -32.568 180 HB3 ALA 22 HB3 ALA 22 -12.037 -19.582 -33.807 181 H ASN 23 H ASN 23 -12.760 -18.322 -30.168 182 HA ASN 23 HA ASN 23 -15.647 -18.300 -29.774 183 HB2 ASN 23 HB2 ASN 23 -13.488 -19.643 -28.542 184 HB3 ASN 23 HB3 ASN 23 -14.166 -18.567 -27.323 185 HD21 ASN 23 HD21 ASN 23 -15.539 -20.510 -29.958 186 HD22 ASN 23 HD22 ASN 23 -16.690 -21.340 -28.972 187 H ARG 24 H ARG 24 -16.692 -16.509 -29.240 188 HA ARG 24 HA ARG 24 -15.933 -14.747 -27.205 189 HB2 ARG 24 HB2 ARG 24 -14.698 -14.208 -29.755 190 HB3 ARG 24 HB3 ARG 24 -15.766 -12.885 -29.307 191 HG2 ARG 24 HG2 ARG 24 -14.556 -12.386 -27.391 192 HG3 ARG 24 HG3 ARG 24 -13.784 -13.973 -27.350 193 HD2 ARG 24 HD2 ARG 24 -12.313 -13.436 -29.078 194 HD3 ARG 24 HD3 ARG 24 -13.308 -12.088 -29.629 195 HE ARG 24 HE ARG 24 -12.281 -11.714 -26.980 196 HH11 ARG 24 HH11 ARG 24 -11.565 -11.409 -30.374 197 HH12 ARG 24 HH12 ARG 24 -10.380 -10.166 -30.145 198 HH21 ARG 24 HH21 ARG 24 -10.724 -10.078 -26.667 199 HH22 ARG 24 HH22 ARG 24 -9.902 -9.410 -28.036 200 H GLN 25 H GLN 25 -17.604 -13.415 -26.649 201 HA GLN 25 HA GLN 25 -19.952 -13.474 -28.427 202 HB2 GLN 25 HB2 GLN 25 -19.631 -14.060 -25.610 203 HB3 GLN 25 HB3 GLN 25 -20.821 -12.789 -25.857 204 HG2 GLN 25 HG2 GLN 25 -21.878 -14.331 -27.579 205 HG3 GLN 25 HG3 GLN 25 -20.845 -15.595 -26.913 206 HE21 GLN 25 HE21 GLN 25 -21.970 -16.856 -25.629 207 HE22 GLN 25 HE22 GLN 25 -23.158 -16.349 -24.481 208 H VAL 26 H VAL 26 -18.342 -11.488 -25.948 209 HA VAL 26 HA VAL 26 -18.641 -9.113 -27.515 210 HB VAL 26 HB VAL 26 -20.930 -9.370 -26.518 211 HG11 VAL 26 HG11 VAL 26 -19.591 -8.685 -23.910 212 HG12 VAL 26 HG12 VAL 26 -21.292 -9.064 -24.191 213 HG13 VAL 26 HG13 VAL 26 -20.067 -10.324 -24.353 214 HG21 VAL 26 HG21 VAL 26 -20.583 -7.204 -27.149 215 HG22 VAL 26 HG22 VAL 26 -20.780 -6.970 -25.412 216 HG23 VAL 26 HG23 VAL 26 -19.164 -7.013 -26.119 217 H GLU 27 H GLU 27 -17.172 -7.598 -26.933 218 HA GLU 27 HA GLU 27 -15.917 -7.787 -24.293 219 HB2 GLU 27 HB2 GLU 27 -14.594 -8.174 -26.933 220 HB3 GLU 27 HB3 GLU 27 -13.712 -7.285 -25.699 221 HG2 GLU 27 HG2 GLU 27 -14.845 -10.054 -25.367 222 HG3 GLU 27 HG3 GLU 27 -13.161 -9.673 -25.723 223 H HIS 28 H HIS 28 -15.946 -5.856 -23.373 224 HA HIS 28 HA HIS 28 -15.545 -3.474 -25.045 225 HB2 HIS 28 HB2 HIS 28 -17.240 -2.411 -23.307 226 HB3 HIS 28 HB3 HIS 28 -17.811 -3.210 -24.769 227 HD1 HIS 28 HD1 HIS 28 -18.001 -3.354 -21.110 228 HD2 HIS 28 HD2 HIS 28 -18.829 -5.876 -24.306 229 HE1 HIS 28 HE1 HIS 28 -19.444 -5.185 -20.166 230 H VAL 29 H VAL 29 -14.556 -1.713 -24.013 231 HA VAL 29 HA VAL 29 -12.630 -2.354 -22.072 232 HB VAL 29 HB VAL 29 -13.606 0.426 -22.727 233 HG11 VAL 29 HG11 VAL 29 -11.790 -0.385 -20.855 234 HG12 VAL 29 HG12 VAL 29 -10.760 -0.053 -22.249 235 HG13 VAL 29 HG13 VAL 29 -11.824 1.205 -21.616 236 HG21 VAL 29 HG21 VAL 29 -12.836 0.201 -24.796 237 HG22 VAL 29 HG22 VAL 29 -11.254 -0.264 -24.171 238 HG23 VAL 29 HG23 VAL 29 -12.477 -1.496 -24.478 239 H TYR 30 H TYR 30 -12.590 -2.219 -19.902 240 HA TYR 30 HA TYR 30 -14.905 -1.004 -18.548 241 HB2 TYR 30 HB2 TYR 30 -14.604 -3.670 -18.671 242 HB3 TYR 30 HB3 TYR 30 -13.604 -3.343 -17.261 243 HD1 TYR 30 HD2 TYR 30 -16.923 -2.198 -18.564 244 HD2 TYR 30 HD1 TYR 30 -14.673 -3.624 -15.246 245 HE1 TYR 30 HE2 TYR 30 -18.942 -2.103 -17.162 246 HE2 TYR 30 HE1 TYR 30 -16.686 -3.534 -13.835 247 HH TYR 30 HH TYR 30 -19.376 -3.654 -14.459 248 H LYS 31 H LYS 31 -14.504 0.043 -16.617 249 HA LYS 31 HA LYS 31 -11.663 0.544 -16.043 250 HB2 LYS 31 HB2 LYS 31 -14.088 2.227 -16.029 251 HB3 LYS 31 HB3 LYS 31 -12.982 2.497 -14.689 252 HG2 LYS 31 HG2 LYS 31 -11.416 2.366 -17.029 253 HG3 LYS 31 HG3 LYS 31 -12.798 3.406 -17.383 254 HD2 LYS 31 HD2 LYS 31 -11.154 3.726 -14.886 255 HD3 LYS 31 HD3 LYS 31 -10.720 4.518 -16.403 256 HE2 LYS 31 HE2 LYS 31 -13.429 5.053 -16.081 257 HE3 LYS 31 HE3 LYS 31 -12.752 5.216 -14.461 258 HZ1 LYS 31 HZ1 LYS 31 -12.010 7.199 -15.054 259 HZ2 LYS 31 HZ2 LYS 31 -12.549 6.989 -16.643 260 HZ3 LYS 31 HZ3 LYS 31 -10.998 6.478 -16.202 261 H PHE 32 H PHE 32 -10.843 0.292 -14.011 262 HA PHE 32 HA PHE 32 -12.681 -0.751 -11.958 263 HB2 PHE 32 HB2 PHE 32 -9.876 -1.677 -12.603 264 HB3 PHE 32 HB3 PHE 32 -10.778 -2.178 -11.177 265 HD1 PHE 32 HD1 PHE 32 -12.771 -3.595 -11.405 266 HD2 PHE 32 HD2 PHE 32 -10.343 -2.587 -14.753 267 HE1 PHE 32 HE1 PHE 32 -13.797 -5.421 -12.695 268 HE2 PHE 32 HE2 PHE 32 -11.366 -4.411 -16.048 269 HZ PHE 32 HZ PHE 32 -13.096 -5.831 -15.020 270 H ARG 33 H ARG 33 -12.783 0.546 -10.259 271 HA ARG 33 HA ARG 33 -10.514 2.318 -9.683 272 HB2 ARG 33 HB2 ARG 33 -13.450 2.522 -9.337 273 HB3 ARG 33 HB3 ARG 33 -12.466 3.245 -8.071 274 HG2 ARG 33 HG2 ARG 33 -11.244 4.490 -9.885 275 HG3 ARG 33 HG3 ARG 33 -12.487 3.916 -10.999 276 HD2 ARG 33 HD2 ARG 33 -14.125 5.214 -10.057 277 HD3 ARG 33 HD3 ARG 33 -13.342 5.244 -8.478 278 HE ARG 33 HE ARG 33 -11.709 6.633 -10.255 279 HH11 ARG 33 HH11 ARG 33 -14.881 6.913 -8.848 280 HH12 ARG 33 HH12 ARG 33 -14.899 8.645 -8.911 281 HH21 ARG 33 HH21 ARG 33 -11.721 8.912 -10.343 282 HH22 ARG 33 HH22 ARG 33 -13.101 9.781 -9.762 283 H ILE 34 H ILE 34 -9.202 1.755 -8.089 284 HA ILE 34 HA ILE 34 -10.124 -0.149 -6.070 285 HB ILE 34 HB ILE 34 -7.335 0.851 -6.657 286 HG12 ILE 34 HG12 ILE 34 -8.274 -0.548 -8.452 287 HG13 ILE 34 HG13 ILE 34 -6.965 -1.372 -7.612 288 HG21 ILE 34 HG21 ILE 34 -6.926 0.137 -4.576 289 HG22 ILE 34 HG22 ILE 34 -8.462 -0.723 -4.469 290 HG23 ILE 34 HG23 ILE 34 -7.079 -1.482 -5.258 291 HD11 ILE 34 HD11 ILE 34 -9.898 -1.836 -7.134 292 HD12 ILE 34 HD12 ILE 34 -8.840 -2.860 -8.105 293 HD13 ILE 34 HD13 ILE 34 -8.562 -2.698 -6.371 294 H THR 35 H THR 35 -10.920 0.649 -4.249 295 HA THR 35 HA THR 35 -9.820 3.179 -3.213 296 HB THR 35 HB THR 35 -11.902 3.663 -2.185 297 HG1 THR 35 HG1 THR 35 -12.999 1.201 -3.057 298 HG21 THR 35 HG21 THR 35 -13.192 2.590 -4.567 299 HG22 THR 35 HG22 THR 35 -11.668 3.404 -4.922 300 HG23 THR 35 HG23 THR 35 -12.950 4.264 -4.071 301 H GLN 36 H GLN 36 -9.348 3.359 -1.014 302 HA GLN 36 HA GLN 36 -8.846 0.798 0.309 303 HB2 GLN 36 HB2 GLN 36 -7.285 3.060 0.004 304 HB3 GLN 36 HB3 GLN 36 -7.860 3.192 1.660 305 HG2 GLN 36 HG2 GLN 36 -6.868 1.163 2.286 306 HG3 GLN 36 HG3 GLN 36 -6.625 0.672 0.610 307 HE21 GLN 36 HE21 GLN 36 -5.239 2.290 -0.658 308 HE22 GLN 36 HE22 GLN 36 -3.804 2.831 0.139 309 H GLY 37 H GLY 37 -10.684 0.187 1.336 310 HA2 GLY 37 HA2 GLY 37 -12.123 0.128 3.145 311 HA3 GLY 37 HA3 GLY 37 -11.430 1.646 3.697 312 H GLY 38 H GLY 38 -11.967 2.964 1.104 313 HA2 GLY 38 HA2 GLY 38 -14.562 2.935 0.242 314 HA3 GLY 38 HA3 GLY 38 -14.618 3.873 1.728 315 H LYS 39 H LYS 39 -11.632 4.449 0.651 316 HA LYS 39 HA LYS 39 -12.491 6.788 -0.923 317 HB2 LYS 39 HB2 LYS 39 -10.139 7.639 -0.109 318 HB3 LYS 39 HB3 LYS 39 -11.546 7.757 0.940 319 HG2 LYS 39 HG2 LYS 39 -10.828 6.059 2.322 320 HG3 LYS 39 HG3 LYS 39 -9.795 5.345 1.081 321 HD2 LYS 39 HD2 LYS 39 -8.143 6.991 1.356 322 HD3 LYS 39 HD3 LYS 39 -9.239 8.066 2.227 323 HE2 LYS 39 HE2 LYS 39 -9.026 5.536 3.579 324 HE3 LYS 39 HE3 LYS 39 -7.425 6.222 3.310 325 HZ1 LYS 39 HZ1 LYS 39 -9.155 8.254 4.188 326 HZ2 LYS 39 HZ2 LYS 39 -7.777 7.640 4.953 327 HZ3 LYS 39 HZ3 LYS 39 -9.289 6.943 5.249 328 H VAL 40 H VAL 40 -11.847 6.868 -2.968 329 HA VAL 40 HA VAL 40 -10.457 4.872 -4.277 330 HB VAL 40 HB VAL 40 -10.873 7.765 -4.998 331 HG11 VAL 40 HG11 VAL 40 -10.223 6.817 -7.359 332 HG12 VAL 40 HG12 VAL 40 -8.983 7.410 -6.252 333 HG13 VAL 40 HG13 VAL 40 -9.276 5.677 -6.402 334 HG21 VAL 40 HG21 VAL 40 -12.016 5.252 -6.208 335 HG22 VAL 40 HG22 VAL 40 -12.810 6.187 -4.940 336 HG23 VAL 40 HG23 VAL 40 -12.514 6.915 -6.519 337 H VAL 41 H VAL 41 -8.370 4.388 -4.626 338 HA VAL 41 HA VAL 41 -6.338 6.289 -3.649 339 HB VAL 41 HB VAL 41 -6.511 4.355 -2.153 340 HG11 VAL 41 HG11 VAL 41 -6.259 2.864 -4.714 341 HG12 VAL 41 HG12 VAL 41 -5.550 2.161 -3.259 342 HG13 VAL 41 HG13 VAL 41 -7.273 2.535 -3.309 343 HG21 VAL 41 HG21 VAL 41 -4.258 4.123 -1.876 344 HG22 VAL 41 HG22 VAL 41 -3.960 3.858 -3.594 345 HG23 VAL 41 HG23 VAL 41 -4.268 5.488 -2.994 346 H LYS 42 H LYS 42 -7.468 4.363 -6.225 347 HA LYS 42 HA LYS 42 -5.645 5.431 -8.080 348 HB2 LYS 42 HB2 LYS 42 -4.574 3.277 -6.643 349 HB3 LYS 42 HB3 LYS 42 -5.046 2.601 -8.197 350 HG2 LYS 42 HG2 LYS 42 -3.713 4.273 -9.352 351 HG3 LYS 42 HG3 LYS 42 -3.269 5.002 -7.807 352 HD2 LYS 42 HD2 LYS 42 -2.695 2.216 -7.685 353 HD3 LYS 42 HD3 LYS 42 -2.009 2.861 -9.179 354 HE2 LYS 42 HE2 LYS 42 -1.619 4.270 -6.562 355 HE3 LYS 42 HE3 LYS 42 -0.585 2.919 -7.026 356 HZ1 LYS 42 HZ1 LYS 42 -0.119 5.476 -7.677 357 HZ2 LYS 42 HZ2 LYS 42 -0.926 4.942 -9.064 358 HZ3 LYS 42 HZ3 LYS 42 0.477 4.152 -8.545 359 H ASN 43 H ASN 43 -5.978 4.595 -10.260 360 HA ASN 43 HA ASN 43 -8.433 3.000 -10.543 361 HB2 ASN 43 HB2 ASN 43 -7.930 5.193 -12.498 362 HB3 ASN 43 HB3 ASN 43 -9.456 4.522 -11.929 363 HD21 ASN 43 HD21 ASN 43 -6.917 6.798 -11.319 364 HD22 ASN 43 HD22 ASN 43 -7.725 7.677 -10.070 365 H TRP 44 H TRP 44 -8.315 1.404 -11.998 366 HA TRP 44 HA TRP 44 -5.917 1.290 -13.698 367 HB2 TRP 44 HB2 TRP 44 -7.611 -0.833 -12.415 368 HB3 TRP 44 HB3 TRP 44 -6.614 -1.213 -13.816 369 HD1 TRP 44 HD1 TRP 44 -6.323 -0.169 -10.135 370 HE1 TRP 44 HE1 TRP 44 -3.940 -0.705 -9.322 371 HE3 TRP 44 HE3 TRP 44 -4.233 -1.546 -14.593 372 HZ2 TRP 44 HZ2 TRP 44 -1.498 -1.593 -10.424 373 HZ3 TRP 44 HZ3 TRP 44 -1.868 -2.224 -14.628 374 HH2 TRP 44 HH2 TRP 44 -0.531 -2.246 -12.586 375 H VAL 45 H VAL 45 -6.114 0.471 -15.853 376 HA VAL 45 HA VAL 45 -8.822 0.738 -16.987 377 HB VAL 45 HB VAL 45 -6.225 1.739 -18.156 378 HG11 VAL 45 HG11 VAL 45 -7.166 1.187 -20.122 379 HG12 VAL 45 HG12 VAL 45 -8.778 1.027 -19.422 380 HG13 VAL 45 HG13 VAL 45 -8.153 2.622 -19.845 381 HG21 VAL 45 HG21 VAL 45 -7.098 3.906 -17.917 382 HG22 VAL 45 HG22 VAL 45 -8.729 3.308 -17.614 383 HG23 VAL 45 HG23 VAL 45 -7.473 3.098 -16.394 384 H MET 46 H MET 46 -9.469 -0.822 -18.363 385 HA MET 46 HA MET 46 -7.537 -2.954 -18.967 386 HB2 MET 46 HB2 MET 46 -9.314 -3.868 -17.716 387 HB3 MET 46 HB3 MET 46 -10.524 -2.958 -18.610 388 HG2 MET 46 HG2 MET 46 -10.437 -4.375 -20.432 389 HG3 MET 46 HG3 MET 46 -8.840 -4.986 -20.008 390 HE1 MET 46 HE1 MET 46 -12.857 -6.074 -18.163 391 HE2 MET 46 HE2 MET 46 -12.428 -4.650 -19.111 392 HE3 MET 46 HE3 MET 46 -12.652 -6.207 -19.910 393 H ASP 47 H ASP 47 -6.842 -3.117 -20.986 394 HA ASP 47 HA ASP 47 -7.755 -1.498 -23.090 395 HB2 ASP 47 HB2 ASP 47 -5.539 -3.012 -22.678 396 HB3 ASP 47 HB3 ASP 47 -6.400 -4.012 -23.845 397 H LEU 48 H LEU 48 -7.912 -3.198 -25.300 398 HA LEU 48 HA LEU 48 -10.015 -5.118 -24.918 399 HB2 LEU 48 HB2 LEU 48 -10.966 -2.649 -24.986 400 HB3 LEU 48 HB3 LEU 48 -10.788 -2.885 -26.723 401 HG LEU 48 HG LEU 48 -12.575 -4.363 -24.811 402 HD11 LEU 48 HD11 LEU 48 -12.913 -2.495 -27.098 403 HD12 LEU 48 HD12 LEU 48 -13.784 -2.581 -25.568 404 HD13 LEU 48 HD13 LEU 48 -14.131 -3.745 -26.846 405 HD21 LEU 48 HD21 LEU 48 -13.198 -5.725 -26.854 406 HD22 LEU 48 HD22 LEU 48 -11.653 -6.113 -26.097 407 HD23 LEU 48 HD23 LEU 48 -11.694 -5.152 -27.576 408 H LYS 49 H LYS 49 -8.390 -3.019 -27.280 409 HA LYS 49 HA LYS 49 -8.682 -4.893 -29.425 410 HB2 LYS 49 HB2 LYS 49 -7.585 -2.210 -29.050 411 HB3 LYS 49 HB3 LYS 49 -6.632 -3.189 -30.157 412 HG2 LYS 49 HG2 LYS 49 -8.664 -3.640 -31.470 413 HG3 LYS 49 HG3 LYS 49 -9.574 -2.588 -30.384 414 HD2 LYS 49 HD2 LYS 49 -8.032 -0.732 -30.987 415 HD3 LYS 49 HD3 LYS 49 -7.273 -1.800 -32.169 416 HE2 LYS 49 HE2 LYS 49 -8.806 -1.161 -33.644 417 HE3 LYS 49 HE3 LYS 49 -10.028 -1.957 -32.653 418 HZ1 LYS 49 HZ1 LYS 49 -9.155 0.872 -32.414 419 HZ2 LYS 49 HZ2 LYS 49 -10.286 0.116 -31.409 420 HZ3 LYS 49 HZ3 LYS 49 -10.626 0.332 -33.053 421 H ASN 50 H ASN 50 -6.296 -4.263 -26.969 422 HA ASN 50 HA ASN 50 -4.448 -6.171 -28.221 423 HB2 ASN 50 HB2 ASN 50 -4.008 -3.723 -26.938 424 HB3 ASN 50 HB3 ASN 50 -3.459 -4.940 -25.790 425 HD21 ASN 50 HD21 ASN 50 -1.921 -2.997 -27.304 426 HD22 ASN 50 HD22 ASN 50 -0.782 -3.902 -28.235 427 H VAL 51 H VAL 51 -6.639 -5.768 -25.601 428 HA VAL 51 HA VAL 51 -7.388 -7.201 -23.996 429 HB VAL 51 HB VAL 51 -5.648 -9.348 -25.192 430 HG11 VAL 51 HG11 VAL 51 -6.690 -10.683 -23.758 431 HG12 VAL 51 HG12 VAL 51 -7.503 -9.277 -23.070 432 HG13 VAL 51 HG13 VAL 51 -8.259 -10.178 -24.384 433 HG21 VAL 51 HG21 VAL 51 -7.964 -9.810 -26.412 434 HG22 VAL 51 HG22 VAL 51 -8.086 -8.055 -26.284 435 HG23 VAL 51 HG23 VAL 51 -6.717 -8.786 -27.123 436 H LYS 52 H LYS 52 -5.435 -5.555 -23.184 437 HA LYS 52 HA LYS 52 -3.896 -7.242 -21.336 438 HB2 LYS 52 HB2 LYS 52 -2.453 -6.407 -23.220 439 HB3 LYS 52 HB3 LYS 52 -2.777 -4.770 -22.665 440 HG2 LYS 52 HG2 LYS 52 -1.575 -5.072 -20.691 441 HG3 LYS 52 HG3 LYS 52 -1.613 -6.831 -20.830 442 HD2 LYS 52 HD2 LYS 52 0.583 -6.198 -21.410 443 HD3 LYS 52 HD3 LYS 52 -0.227 -6.545 -22.940 444 HE2 LYS 52 HE2 LYS 52 -0.458 -3.763 -22.051 445 HE3 LYS 52 HE3 LYS 52 1.194 -4.280 -22.387 446 HZ1 LYS 52 HZ1 LYS 52 -0.613 -5.156 -24.407 447 HZ2 LYS 52 HZ2 LYS 52 0.802 -4.241 -24.557 448 HZ3 LYS 52 HZ3 LYS 52 -0.670 -3.475 -24.227 449 H LEU 53 H LEU 53 -3.183 -6.086 -19.391 450 HA LEU 53 HA LEU 53 -5.096 -3.969 -18.668 451 HB2 LEU 53 HB2 LEU 53 -4.229 -6.387 -17.348 452 HB3 LEU 53 HB3 LEU 53 -3.962 -4.975 -16.328 453 HG LEU 53 HG LEU 53 -6.367 -4.392 -16.617 454 HD11 LEU 53 HD11 LEU 53 -6.657 -5.657 -18.744 455 HD12 LEU 53 HD12 LEU 53 -7.900 -5.978 -17.536 456 HD13 LEU 53 HD13 LEU 53 -6.610 -7.149 -17.805 457 HD21 LEU 53 HD21 LEU 53 -7.190 -6.081 -15.074 458 HD22 LEU 53 HD22 LEU 53 -5.553 -5.591 -14.640 459 HD23 LEU 53 HD23 LEU 53 -5.824 -7.127 -15.465 460 H VAL 54 H VAL 54 -4.370 -2.038 -18.001 461 HA VAL 54 HA VAL 54 -1.630 -1.730 -17.073 462 HB VAL 54 HB VAL 54 -1.052 0.014 -18.636 463 HG11 VAL 54 HG11 VAL 54 -0.589 -2.340 -19.250 464 HG12 VAL 54 HG12 VAL 54 -2.093 -2.363 -20.171 465 HG13 VAL 54 HG13 VAL 54 -0.782 -1.283 -20.648 466 HG21 VAL 54 HG21 VAL 54 -2.863 1.188 -19.327 467 HG22 VAL 54 HG22 VAL 54 -2.751 0.093 -20.705 468 HG23 VAL 54 HG23 VAL 54 -3.897 -0.240 -19.406 469 H GLU 55 H GLU 55 -1.226 0.639 -16.471 470 HA GLU 55 HA GLU 55 -3.620 1.612 -15.082 471 HB2 GLU 55 HB2 GLU 55 -0.805 1.433 -14.405 472 HB3 GLU 55 HB3 GLU 55 -1.416 3.064 -14.171 473 HG2 GLU 55 HG2 GLU 55 -3.345 1.923 -12.903 474 HG3 GLU 55 HG3 GLU 55 -2.270 0.527 -12.844 475 H SER 56 H SER 56 -4.688 3.140 -16.148 476 HA SER 56 HA SER 56 -3.230 5.468 -17.116 477 HB2 SER 56 HB2 SER 56 -3.315 4.169 -19.129 478 HB3 SER 56 HB3 SER 56 -5.011 3.765 -18.867 479 HG SER 56 HG SER 56 -4.445 5.547 -20.404 480 H ASP 57 H ASP 57 -4.769 7.234 -17.771 481 HA ASP 57 HA ASP 57 -7.036 7.240 -15.908 482 HB2 ASP 57 HB2 ASP 57 -5.016 9.112 -16.408 483 HB3 ASP 57 HB3 ASP 57 -6.465 9.803 -17.134 484 H ASP 58 H ASP 58 -6.838 6.166 -18.777 485 HA ASP 58 HA ASP 58 -8.532 7.813 -20.365 486 HB2 ASP 58 HB2 ASP 58 -6.946 6.113 -21.284 487 HB3 ASP 58 HB3 ASP 58 -8.006 4.850 -20.664 488 H ALA 59 H ALA 59 -10.684 7.188 -21.132 489 HA ALA 59 HA ALA 59 -12.306 6.189 -18.907 490 HB1 ALA 59 HB1 ALA 59 -13.456 7.449 -21.361 491 HB2 ALA 59 HB2 ALA 59 -14.068 7.452 -19.706 492 HB3 ALA 59 HB3 ALA 59 -12.678 8.449 -20.134 493 H ALA 60 H ALA 60 -13.990 4.669 -19.251 494 HA ALA 60 HA ALA 60 -13.689 3.035 -21.685 495 HB1 ALA 60 HB1 ALA 60 -14.191 1.952 -18.917 496 HB2 ALA 60 HB2 ALA 60 -13.936 1.023 -20.394 497 HB3 ALA 60 HB3 ALA 60 -12.618 1.975 -19.713 498 H GLU 61 H GLU 61 -15.625 1.410 -21.793 499 HA GLU 61 HA GLU 61 -17.950 2.882 -22.241 500 HB2 GLU 61 HB2 GLU 61 -17.496 -0.079 -21.904 501 HB3 GLU 61 HB3 GLU 61 -19.068 0.594 -22.312 502 HG2 GLU 61 HG2 GLU 61 -16.540 0.720 -23.928 503 HG3 GLU 61 HG3 GLU 61 -18.043 -0.110 -24.329 504 H ALA 62 H ALA 62 -16.727 1.469 -19.351 505 HA ALA 62 HA ALA 62 -18.849 2.636 -17.803 506 HB1 ALA 62 HB1 ALA 62 -18.794 -0.271 -18.333 507 HB2 ALA 62 HB2 ALA 62 -19.107 0.227 -16.670 508 HB3 ALA 62 HB3 ALA 62 -20.153 0.794 -17.972 509 H THR 63 H THR 63 -18.468 2.411 -15.464 510 HA THR 63 HA THR 63 -15.649 1.823 -14.840 511 HB THR 63 HB THR 63 -17.232 4.073 -13.595 512 HG1 THR 63 HG1 THR 63 -15.263 4.185 -15.657 513 HG21 THR 63 HG21 THR 63 -14.815 4.800 -13.058 514 HG22 THR 63 HG22 THR 63 -14.390 3.125 -13.413 515 HG23 THR 63 HG23 THR 63 -15.524 3.491 -12.112 516 H LEU 64 H LEU 64 -15.316 0.536 -13.134 517 HA LEU 64 HA LEU 64 -17.596 0.005 -11.343 518 HB2 LEU 64 HB2 LEU 64 -17.271 -1.957 -12.586 519 HB3 LEU 64 HB3 LEU 64 -15.516 -1.832 -12.484 520 HG LEU 64 HG LEU 64 -15.783 -2.283 -9.994 521 HD11 LEU 64 HD11 LEU 64 -18.372 -3.581 -10.638 522 HD12 LEU 64 HD12 LEU 64 -18.373 -1.846 -10.322 523 HD13 LEU 64 HD13 LEU 64 -17.762 -2.963 -9.102 524 HD21 LEU 64 HD21 LEU 64 -15.868 -4.675 -10.324 525 HD22 LEU 64 HD22 LEU 64 -14.961 -3.928 -11.639 526 HD23 LEU 64 HD23 LEU 64 -16.622 -4.461 -11.904 527 H THR 65 H THR 65 -17.245 0.886 -9.421 528 HA THR 65 HA THR 65 -14.495 1.075 -8.409 529 HB THR 65 HB THR 65 -16.976 2.464 -7.378 530 HG1 THR 65 HG1 THR 65 -16.179 4.261 -8.490 531 HG21 THR 65 HG21 THR 65 -14.049 2.907 -6.774 532 HG22 THR 65 HG22 THR 65 -15.234 2.188 -5.682 533 HG23 THR 65 HG23 THR 65 -15.386 3.879 -6.161 534 H MET 66 H MET 66 -13.831 -0.086 -6.709 535 HA MET 66 HA MET 66 -15.671 -1.084 -4.730 536 HB2 MET 66 HB2 MET 66 -14.693 -2.795 -6.910 537 HB3 MET 66 HB3 MET 66 -14.440 -3.461 -5.303 538 HG2 MET 66 HG2 MET 66 -16.926 -2.882 -4.924 539 HG3 MET 66 HG3 MET 66 -17.002 -2.787 -6.682 540 HE1 MET 66 HE1 MET 66 -16.024 -4.470 -8.164 541 HE2 MET 66 HE2 MET 66 -16.073 -6.215 -7.909 542 HE3 MET 66 HE3 MET 66 -17.574 -5.309 -8.104 543 H GLU 67 H GLU 67 -14.660 -1.685 -2.825 544 HA GLU 67 HA GLU 67 -12.106 -0.583 -2.345 545 HB2 GLU 67 HB2 GLU 67 -13.899 -2.381 -0.725 546 HB3 GLU 67 HB3 GLU 67 -12.331 -1.853 -0.131 547 HG2 GLU 67 HG2 GLU 67 -13.080 0.180 0.383 548 HG3 GLU 67 HG3 GLU 67 -13.977 0.333 -1.127 549 H ASP 68 H ASP 68 -10.324 -1.879 -1.259 550 HA ASP 68 HA ASP 68 -9.349 -3.799 -3.100 551 HB2 ASP 68 HB2 ASP 68 -8.017 -2.209 -1.574 552 HB3 ASP 68 HB3 ASP 68 -8.263 -3.420 -0.318 553 H ASP 69 H ASP 69 -10.636 -4.064 0.194 554 HA ASP 69 HA ASP 69 -10.298 -6.891 0.348 555 HB2 ASP 69 HB2 ASP 69 -11.617 -4.795 2.000 556 HB3 ASP 69 HB3 ASP 69 -12.137 -6.462 2.238 557 H ILE 70 H ILE 70 -12.777 -4.786 -0.870 558 HA ILE 70 HA ILE 70 -14.816 -6.820 -0.955 559 HB ILE 70 HB ILE 70 -14.803 -4.191 -2.433 560 HG12 ILE 70 HG12 ILE 70 -14.406 -4.071 0.105 561 HG13 ILE 70 HG13 ILE 70 -15.734 -3.122 -0.554 562 HG21 ILE 70 HG21 ILE 70 -16.503 -5.685 -3.219 563 HG22 ILE 70 HG22 ILE 70 -17.002 -6.060 -1.570 564 HG23 ILE 70 HG23 ILE 70 -17.271 -4.446 -2.226 565 HD11 ILE 70 HD11 ILE 70 -16.253 -4.319 1.562 566 HD12 ILE 70 HD12 ILE 70 -17.337 -4.701 0.224 567 HD13 ILE 70 HD13 ILE 70 -16.072 -5.839 0.686 568 H MET 71 H MET 71 -12.872 -5.098 -3.396 569 HA MET 71 HA MET 71 -13.790 -6.419 -5.654 570 HB2 MET 71 HB2 MET 71 -12.310 -4.433 -5.679 571 HB3 MET 71 HB3 MET 71 -10.973 -5.445 -5.147 572 HG2 MET 71 HG2 MET 71 -10.535 -5.523 -7.348 573 HG3 MET 71 HG3 MET 71 -11.725 -6.822 -7.311 574 HE1 MET 71 HE1 MET 71 -10.517 -3.785 -8.769 575 HE2 MET 71 HE2 MET 71 -11.848 -3.000 -9.618 576 HE3 MET 71 HE3 MET 71 -11.621 -2.728 -7.890 577 H PHE 72 H PHE 72 -11.539 -7.472 -3.207 578 HA PHE 72 HA PHE 72 -10.311 -9.582 -4.588 579 HB2 PHE 72 HB2 PHE 72 -9.816 -8.537 -2.234 580 HB3 PHE 72 HB3 PHE 72 -10.913 -9.789 -1.660 581 HD1 PHE 72 HD1 PHE 72 -7.933 -9.400 -3.868 582 HD2 PHE 72 HD2 PHE 72 -10.028 -11.822 -1.064 583 HE1 PHE 72 HE1 PHE 72 -6.084 -11.023 -3.894 584 HE2 PHE 72 HE2 PHE 72 -8.182 -13.448 -1.085 585 HZ PHE 72 HZ PHE 72 -6.207 -13.050 -2.500 586 H ALA 73 H ALA 73 -13.257 -9.494 -2.619 587 HA ALA 73 HA ALA 73 -13.837 -12.243 -2.730 588 HB1 ALA 73 HB1 ALA 73 -16.074 -11.635 -2.025 589 HB2 ALA 73 HB2 ALA 73 -14.881 -10.685 -1.138 590 HB3 ALA 73 HB3 ALA 73 -15.781 -9.953 -2.467 591 H ILE 74 H ILE 74 -15.110 -9.552 -4.692 592 HA ILE 74 HA ILE 74 -16.605 -11.221 -6.431 593 HB ILE 74 HB ILE 74 -15.586 -8.504 -7.207 594 HG12 ILE 74 HG12 ILE 74 -16.372 -8.164 -4.972 595 HG13 ILE 74 HG13 ILE 74 -17.641 -7.602 -6.054 596 HG21 ILE 74 HG21 ILE 74 -17.117 -10.235 -8.569 597 HG22 ILE 74 HG22 ILE 74 -18.368 -9.372 -7.676 598 HG23 ILE 74 HG23 ILE 74 -17.263 -8.484 -8.724 599 HD11 ILE 74 HD11 ILE 74 -18.798 -9.769 -5.726 600 HD12 ILE 74 HD12 ILE 74 -17.572 -10.192 -4.530 601 HD13 ILE 74 HD13 ILE 74 -18.636 -8.812 -4.254 602 H GLY 75 H GLY 75 -13.281 -10.508 -6.216 603 HA2 GLY 75 HA2 GLY 75 -12.752 -11.059 -9.031 604 HA3 GLY 75 HA3 GLY 75 -11.562 -10.626 -7.812 605 H THR 76 H THR 76 -12.430 -12.628 -5.903 606 HA THR 76 HA THR 76 -11.133 -14.936 -7.147 607 HB THR 76 HB THR 76 -10.887 -15.786 -4.829 608 HG1 THR 76 HG1 THR 76 -12.056 -14.892 -3.319 609 HG21 THR 76 HG21 THR 76 -9.816 -13.058 -4.561 610 HG22 THR 76 HG22 THR 76 -9.417 -13.873 -6.074 611 HG23 THR 76 HG23 THR 76 -8.983 -14.612 -4.533 612 H GLY 77 H GLY 77 -13.962 -14.244 -7.634 613 HA2 GLY 77 HA2 GLY 77 -16.009 -15.279 -7.753 614 HA3 GLY 77 HA3 GLY 77 -15.089 -16.774 -7.655 615 H ALA 78 H ALA 78 -14.869 -14.547 -5.028 616 HA ALA 78 HA ALA 78 -15.924 -16.479 -3.200 617 HB1 ALA 78 HB1 ALA 78 -14.135 -14.478 -2.946 618 HB2 ALA 78 HB2 ALA 78 -15.566 -13.713 -2.253 619 HB3 ALA 78 HB3 ALA 78 -14.967 -15.232 -1.585 620 H LEU 79 H LEU 79 -16.903 -13.095 -3.784 621 HA LEU 79 HA LEU 79 -19.668 -13.897 -3.154 622 HB2 LEU 79 HB2 LEU 79 -18.058 -11.506 -2.454 623 HB3 LEU 79 HB3 LEU 79 -19.773 -11.262 -2.780 624 HG LEU 79 HG LEU 79 -18.801 -13.265 -0.760 625 HD11 LEU 79 HD11 LEU 79 -18.094 -10.749 -0.443 626 HD12 LEU 79 HD12 LEU 79 -18.702 -11.707 0.906 627 HD13 LEU 79 HD13 LEU 79 -19.773 -10.581 0.071 628 HD21 LEU 79 HD21 LEU 79 -21.041 -13.667 -1.291 629 HD22 LEU 79 HD22 LEU 79 -21.418 -11.948 -1.408 630 HD23 LEU 79 HD23 LEU 79 -21.113 -12.680 0.169 631 HA PRO 80 HA PRO 80 -20.832 -12.720 -7.232 632 HB2 PRO 80 HB2 PRO 80 -23.462 -12.202 -6.803 633 HB3 PRO 80 HB3 PRO 80 -22.798 -13.840 -6.834 634 HG2 PRO 80 HG2 PRO 80 -23.461 -12.108 -4.484 635 HG3 PRO 80 HG3 PRO 80 -23.773 -13.837 -4.723 636 HD2 PRO 80 HD2 PRO 80 -21.706 -12.923 -3.233 637 HD3 PRO 80 HD3 PRO 80 -21.618 -14.433 -4.163 638 H ALA 81 H ALA 81 -20.569 -10.874 -8.314 639 HA ALA 81 HA ALA 81 -20.315 -8.374 -7.093 640 HB1 ALA 81 HB1 ALA 81 -21.018 -8.117 -9.876 641 HB2 ALA 81 HB2 ALA 81 -19.477 -7.811 -9.072 642 HB3 ALA 81 HB3 ALA 81 -19.872 -9.436 -9.633 643 H LYS 82 H LYS 82 -23.101 -10.026 -8.330 644 HA LYS 82 HA LYS 82 -24.799 -7.800 -8.702 645 HB2 LYS 82 HB2 LYS 82 -25.093 -10.278 -9.434 646 HB3 LYS 82 HB3 LYS 82 -25.803 -10.496 -7.840 647 HG2 LYS 82 HG2 LYS 82 -27.471 -8.783 -8.349 648 HG3 LYS 82 HG3 LYS 82 -26.760 -8.572 -9.950 649 HD2 LYS 82 HD2 LYS 82 -27.466 -10.672 -10.673 650 HD3 LYS 82 HD3 LYS 82 -27.692 -11.267 -9.027 651 HE2 LYS 82 HE2 LYS 82 -29.519 -9.470 -8.849 652 HE3 LYS 82 HE3 LYS 82 -29.423 -9.392 -10.607 653 HZ1 LYS 82 HZ1 LYS 82 -29.587 -12.070 -9.988 654 HZ2 LYS 82 HZ2 LYS 82 -30.810 -11.103 -10.645 655 HZ3 LYS 82 HZ3 LYS 82 -30.711 -11.319 -8.971 656 H GLU 83 H GLU 83 -24.598 -10.111 -5.990 657 HA GLU 83 HA GLU 83 -26.413 -8.802 -4.315 658 HB2 GLU 83 HB2 GLU 83 -24.037 -10.514 -3.566 659 HB3 GLU 83 HB3 GLU 83 -25.345 -10.071 -2.479 660 HG2 GLU 83 HG2 GLU 83 -25.658 -11.679 -5.003 661 HG3 GLU 83 HG3 GLU 83 -25.579 -12.343 -3.372 662 H ALA 84 H ALA 84 -22.868 -8.568 -4.448 663 HA ALA 84 HA ALA 84 -22.421 -6.823 -2.367 664 HB1 ALA 84 HB1 ALA 84 -20.555 -5.949 -4.065 665 HB2 ALA 84 HB2 ALA 84 -20.443 -7.503 -3.237 666 HB3 ALA 84 HB3 ALA 84 -21.022 -7.430 -4.901 667 H MET 85 H MET 85 -23.389 -6.062 -5.688 668 HA MET 85 HA MET 85 -23.260 -3.251 -5.413 669 HB2 MET 85 HB2 MET 85 -23.852 -5.082 -7.461 670 HB3 MET 85 HB3 MET 85 -25.283 -4.073 -7.299 671 HG2 MET 85 HG2 MET 85 -23.248 -2.241 -7.232 672 HG3 MET 85 HG3 MET 85 -22.655 -3.443 -8.376 673 HE1 MET 85 HE1 MET 85 -25.243 -3.531 -11.143 674 HE2 MET 85 HE2 MET 85 -24.162 -4.480 -10.124 675 HE3 MET 85 HE3 MET 85 -25.859 -4.296 -9.678 676 H ALA 86 H ALA 86 -25.673 -5.618 -4.585 677 HA ALA 86 HA ALA 86 -27.818 -3.739 -4.266 678 HB1 ALA 86 HB1 ALA 86 -28.729 -5.817 -2.899 679 HB2 ALA 86 HB2 ALA 86 -28.699 -5.801 -4.663 680 HB3 ALA 86 HB3 ALA 86 -27.432 -6.639 -3.767 681 H GLN 87 H GLN 87 -25.242 -4.946 -2.284 682 HA GLN 87 HA GLN 87 -26.449 -4.001 0.181 683 HB2 GLN 87 HB2 GLN 87 -23.767 -5.256 -0.411 684 HB3 GLN 87 HB3 GLN 87 -24.282 -4.758 1.195 685 HG2 GLN 87 HG2 GLN 87 -26.363 -6.335 0.288 686 HG3 GLN 87 HG3 GLN 87 -24.916 -7.152 -0.300 687 HE21 GLN 87 HE21 GLN 87 -24.974 -8.870 1.065 688 HE22 GLN 87 HE22 GLN 87 -24.766 -8.746 2.775 689 H ASP 88 H ASP 88 -25.262 -2.389 -2.278 690 HA ASP 88 HA ASP 88 -24.380 -0.313 -2.574 691 HB2 ASP 88 HB2 ASP 88 -25.887 -0.040 -0.388 692 HB3 ASP 88 HB3 ASP 88 -24.315 0.261 0.347 693 H LYS 89 H LYS 89 -22.771 -2.758 -1.514 694 HA LYS 89 HA LYS 89 -20.441 -1.493 -0.358 695 HB2 LYS 89 HB2 LYS 89 -20.975 -4.330 -1.252 696 HB3 LYS 89 HB3 LYS 89 -19.467 -3.801 -0.518 697 HG2 LYS 89 HG2 LYS 89 -21.633 -2.966 1.135 698 HG3 LYS 89 HG3 LYS 89 -21.820 -4.681 0.759 699 HD2 LYS 89 HD2 LYS 89 -19.355 -4.908 1.389 700 HD3 LYS 89 HD3 LYS 89 -19.508 -3.294 2.089 701 HE2 LYS 89 HE2 LYS 89 -21.315 -4.092 3.531 702 HE3 LYS 89 HE3 LYS 89 -21.172 -5.701 2.825 703 HZ1 LYS 89 HZ1 LYS 89 -19.084 -6.014 3.797 704 HZ2 LYS 89 HZ2 LYS 89 -20.012 -5.306 5.021 705 HZ3 LYS 89 HZ3 LYS 89 -18.892 -4.373 4.162 706 H MET 90 H MET 90 -21.647 -1.671 -3.415 707 HA MET 90 HA MET 90 -19.143 -0.890 -4.585 708 HB2 MET 90 HB2 MET 90 -18.938 -2.621 -6.215 709 HB3 MET 90 HB3 MET 90 -19.066 -3.401 -4.645 710 HG2 MET 90 HG2 MET 90 -21.384 -3.932 -5.054 711 HG3 MET 90 HG3 MET 90 -21.342 -3.054 -6.582 712 HE1 MET 90 HE1 MET 90 -20.003 -3.542 -8.475 713 HE2 MET 90 HE2 MET 90 -19.469 -5.142 -8.993 714 HE3 MET 90 HE3 MET 90 -21.192 -4.779 -8.883 715 H GLU 91 H GLU 91 -19.391 0.182 -6.555 716 HA GLU 91 HA GLU 91 -22.144 0.462 -7.547 717 HB2 GLU 91 HB2 GLU 91 -21.539 2.382 -6.075 718 HB3 GLU 91 HB3 GLU 91 -20.213 2.755 -7.168 719 HG2 GLU 91 HG2 GLU 91 -21.603 3.522 -8.820 720 HG3 GLU 91 HG3 GLU 91 -22.972 2.560 -8.266 721 H VAL 92 H VAL 92 -22.238 1.440 -9.738 722 HA VAL 92 HA VAL 92 -19.807 1.202 -11.325 723 HB VAL 92 HB VAL 92 -20.881 -1.073 -11.282 724 HG11 VAL 92 HG11 VAL 92 -23.032 0.303 -12.889 725 HG12 VAL 92 HG12 VAL 92 -22.911 -1.428 -12.567 726 HG13 VAL 92 HG13 VAL 92 -23.216 -0.302 -11.243 727 HG21 VAL 92 HG21 VAL 92 -19.380 -0.456 -13.069 728 HG22 VAL 92 HG22 VAL 92 -20.718 -1.397 -13.729 729 HG23 VAL 92 HG23 VAL 92 -20.687 0.355 -13.932 730 H ASP 93 H ASP 93 -19.815 2.448 -13.154 731 HA ASP 93 HA ASP 93 -22.295 3.925 -13.743 732 HB2 ASP 93 HB2 ASP 93 -19.928 4.998 -12.703 733 HB3 ASP 93 HB3 ASP 93 -19.910 5.426 -14.412 734 H GLY 94 H GLY 94 -22.243 4.954 -15.953 735 HA2 GLY 94 HA2 GLY 94 -21.347 4.928 -18.195 736 HA3 GLY 94 HA3 GLY 94 -20.687 3.334 -17.862 737 H GLN 95 H GLN 95 -21.674 1.857 -19.057 738 HA GLN 95 HA GLN 95 -24.512 2.205 -19.699 739 HB2 GLN 95 HB2 GLN 95 -22.210 1.030 -21.069 740 HB3 GLN 95 HB3 GLN 95 -23.640 0.008 -21.121 741 HG2 GLN 95 HG2 GLN 95 -23.357 2.826 -22.121 742 HG3 GLN 95 HG3 GLN 95 -23.658 1.366 -23.062 743 HE21 GLN 95 HE21 GLN 95 -25.680 0.139 -22.168 744 HE22 GLN 95 HE22 GLN 95 -27.083 1.127 -21.968 745 H VAL 96 H VAL 96 -25.722 1.369 -18.098 746 HA VAL 96 HA VAL 96 -25.073 -0.714 -16.385 747 HB VAL 96 HB VAL 96 -27.843 0.037 -17.331 748 HG11 VAL 96 HG11 VAL 96 -26.813 -1.680 -15.119 749 HG12 VAL 96 HG12 VAL 96 -28.304 -0.766 -14.883 750 HG13 VAL 96 HG13 VAL 96 -28.184 -1.936 -16.198 751 HG21 VAL 96 HG21 VAL 96 -25.924 1.333 -15.515 752 HG22 VAL 96 HG22 VAL 96 -27.271 2.020 -16.423 753 HG23 VAL 96 HG23 VAL 96 -27.569 1.184 -14.898 754 H GLU 97 H GLU 97 -26.277 -0.805 -19.648 755 HA GLU 97 HA GLU 97 -27.130 -3.533 -19.594 756 HB2 GLU 97 HB2 GLU 97 -26.431 -1.762 -21.943 757 HB3 GLU 97 HB3 GLU 97 -27.250 -3.314 -22.044 758 HG2 GLU 97 HG2 GLU 97 -28.396 -1.109 -20.388 759 HG3 GLU 97 HG3 GLU 97 -28.632 -1.136 -22.135 760 H LEU 98 H LEU 98 -24.137 -1.870 -20.299 761 HA LEU 98 HA LEU 98 -22.845 -4.154 -21.462 762 HB2 LEU 98 HB2 LEU 98 -22.088 -1.389 -20.733 763 HB3 LEU 98 HB3 LEU 98 -20.787 -2.577 -20.792 764 HG LEU 98 HG LEU 98 -20.879 -1.430 -22.892 765 HD11 LEU 98 HD11 LEU 98 -21.208 -4.224 -22.611 766 HD12 LEU 98 HD12 LEU 98 -20.392 -3.340 -23.900 767 HD13 LEU 98 HD13 LEU 98 -22.107 -3.723 -24.043 768 HD21 LEU 98 HD21 LEU 98 -22.999 -0.509 -23.071 769 HD22 LEU 98 HD22 LEU 98 -23.805 -2.040 -22.730 770 HD23 LEU 98 HD23 LEU 98 -23.026 -1.782 -24.291 771 H ILE 99 H ILE 99 -22.473 -2.413 -18.373 772 HA ILE 99 HA ILE 99 -20.597 -4.057 -17.183 773 HB ILE 99 HB ILE 99 -21.287 -3.203 -15.068 774 HG12 ILE 99 HG12 ILE 99 -23.541 -1.719 -15.279 775 HG13 ILE 99 HG13 ILE 99 -23.922 -3.017 -16.404 776 HG21 ILE 99 HG21 ILE 99 -20.434 -1.256 -15.703 777 HG22 ILE 99 HG22 ILE 99 -20.979 -1.519 -17.358 778 HG23 ILE 99 HG23 ILE 99 -22.047 -0.739 -16.192 779 HD11 ILE 99 HD11 ILE 99 -22.841 -3.895 -13.825 780 HD12 ILE 99 HD12 ILE 99 -24.412 -3.095 -13.754 781 HD13 ILE 99 HD13 ILE 99 -24.193 -4.521 -14.769 782 H PHE 100 H PHE 100 -24.000 -4.593 -17.681 783 HA PHE 100 HA PHE 100 -24.299 -6.715 -15.809 784 HB2 PHE 100 HB2 PHE 100 -26.047 -5.223 -17.242 785 HB3 PHE 100 HB3 PHE 100 -26.043 -6.701 -18.198 786 HD1 PHE 100 HD1 PHE 100 -26.574 -5.384 -14.778 787 HD2 PHE 100 HD2 PHE 100 -27.246 -8.581 -17.506 788 HE1 PHE 100 HE1 PHE 100 -28.140 -6.412 -13.182 789 HE2 PHE 100 HE2 PHE 100 -28.813 -9.614 -15.915 790 HZ PHE 100 HZ PHE 100 -29.262 -8.529 -13.751 791 H LEU 101 H LEU 101 -23.409 -6.539 -19.205 792 HA LEU 101 HA LEU 101 -23.559 -9.310 -19.752 793 HB2 LEU 101 HB2 LEU 101 -22.544 -6.907 -21.070 794 HB3 LEU 101 HB3 LEU 101 -21.630 -8.364 -21.454 795 HG LEU 101 HG LEU 101 -23.453 -7.789 -23.071 796 HD11 LEU 101 HD11 LEU 101 -23.245 -9.937 -23.566 797 HD12 LEU 101 HD12 LEU 101 -24.474 -10.319 -22.360 798 HD13 LEU 101 HD13 LEU 101 -22.770 -10.302 -21.907 799 HD21 LEU 101 HD21 LEU 101 -25.745 -8.214 -22.462 800 HD22 LEU 101 HD22 LEU 101 -25.074 -6.996 -21.378 801 HD23 LEU 101 HD23 LEU 101 -25.266 -8.660 -20.825 802 H LEU 102 H LEU 102 -21.440 -7.543 -17.827 803 HA LEU 102 HA LEU 102 -19.149 -9.279 -18.226 804 HB2 LEU 102 HB2 LEU 102 -19.720 -6.865 -16.563 805 HB3 LEU 102 HB3 LEU 102 -18.348 -7.895 -16.162 806 HG LEU 102 HG LEU 102 -18.776 -6.434 -18.768 807 HD11 LEU 102 HD11 LEU 102 -16.966 -5.027 -18.086 808 HD12 LEU 102 HD12 LEU 102 -16.707 -5.980 -16.626 809 HD13 LEU 102 HD13 LEU 102 -18.178 -5.024 -16.806 810 HD21 LEU 102 HD21 LEU 102 -16.998 -8.621 -17.982 811 HD22 LEU 102 HD22 LEU 102 -16.168 -7.238 -18.696 812 HD23 LEU 102 HD23 LEU 102 -17.457 -8.049 -19.586 813 H GLU 103 H GLU 103 -21.641 -8.686 -15.796 814 HA GLU 103 HA GLU 103 -20.853 -10.068 -13.630 815 HB2 GLU 103 HB2 GLU 103 -23.460 -9.678 -14.945 816 HB3 GLU 103 HB3 GLU 103 -23.392 -11.035 -13.829 817 HG2 GLU 103 HG2 GLU 103 -23.826 -9.568 -12.226 818 HG3 GLU 103 HG3 GLU 103 -22.167 -9.008 -12.429 819 HA PRO 104 HA PRO 104 -22.042 -14.351 -15.524 820 HB2 PRO 104 HB2 PRO 104 -22.581 -14.429 -18.183 821 HB3 PRO 104 HB3 PRO 104 -23.823 -14.140 -16.960 822 HG2 PRO 104 HG2 PRO 104 -22.368 -12.172 -18.684 823 HG3 PRO 104 HG3 PRO 104 -24.091 -12.235 -18.267 824 HD2 PRO 104 HD2 PRO 104 -22.355 -10.557 -17.041 825 HD3 PRO 104 HD3 PRO 104 -23.756 -11.258 -16.206 826 H PHE 105 H PHE 105 -20.220 -12.071 -17.471 827 HA PHE 105 HA PHE 105 -18.582 -13.845 -18.872 828 HB2 PHE 105 HB2 PHE 105 -18.822 -11.258 -19.050 829 HB3 PHE 105 HB3 PHE 105 -17.541 -11.224 -17.842 830 HD1 PHE 105 HD2 PHE 105 -18.396 -12.382 -21.247 831 HD2 PHE 105 HD1 PHE 105 -15.299 -11.583 -18.438 832 HE1 PHE 105 HE2 PHE 105 -16.718 -12.649 -23.026 833 HE2 PHE 105 HE1 PHE 105 -13.616 -11.848 -20.214 834 HZ PHE 105 HZ PHE 105 -14.324 -12.382 -22.511 835 H ILE 106 H ILE 106 -18.497 -12.792 -15.559 836 HA ILE 106 HA ILE 106 -15.851 -13.410 -14.901 837 HB ILE 106 HB ILE 106 -18.302 -13.640 -13.150 838 HG12 ILE 106 HG12 ILE 106 -16.334 -11.359 -13.267 839 HG13 ILE 106 HG13 ILE 106 -17.779 -11.397 -14.271 840 HG21 ILE 106 HG21 ILE 106 -15.367 -13.731 -12.564 841 HG22 ILE 106 HG22 ILE 106 -16.515 -13.161 -11.353 842 HG23 ILE 106 HG23 ILE 106 -16.651 -14.798 -11.995 843 HD11 ILE 106 HD11 ILE 106 -18.885 -11.860 -11.878 844 HD12 ILE 106 HD12 ILE 106 -17.486 -10.906 -11.385 845 HD13 ILE 106 HD13 ILE 106 -18.639 -10.246 -12.544 846 H ALA 107 H ALA 107 -18.598 -15.456 -15.461 847 HA ALA 107 HA ALA 107 -17.746 -17.771 -14.113 848 HB1 ALA 107 HB1 ALA 107 -19.316 -18.971 -15.541 849 HB2 ALA 107 HB2 ALA 107 -20.029 -17.476 -14.934 850 HB3 ALA 107 HB3 ALA 107 -19.445 -17.563 -16.596 851 H SER 108 H SER 108 -16.654 -16.289 -17.016 852 HA SER 108 HA SER 108 -15.631 -18.534 -18.371 853 HB2 SER 108 HB2 SER 108 -15.883 -15.988 -19.079 854 HB3 SER 108 HB3 SER 108 -14.206 -15.914 -18.541 855 HG SER 108 HG SER 108 -15.038 -16.714 -20.861 856 H LEU 109 H LEU 109 -13.904 -16.150 -16.354 857 HA LEU 109 HA LEU 109 -11.552 -17.789 -16.223 858 HB2 LEU 109 HB2 LEU 109 -12.360 -15.272 -14.782 859 HB3 LEU 109 HB3 LEU 109 -10.800 -16.062 -14.566 860 HG LEU 109 HG LEU 109 -10.558 -15.756 -17.126 861 HD11 LEU 109 HD11 LEU 109 -11.777 -13.444 -17.602 862 HD12 LEU 109 HD12 LEU 109 -12.962 -14.142 -16.499 863 HD13 LEU 109 HD13 LEU 109 -12.522 -14.999 -17.976 864 HD21 LEU 109 HD21 LEU 109 -10.478 -13.329 -15.340 865 HD22 LEU 109 HD22 LEU 109 -9.527 -13.609 -16.799 866 HD23 LEU 109 HD23 LEU 109 -9.252 -14.597 -15.363 867 H LYS 110 H LYS 110 -13.108 -19.595 -15.407 868 HA LYS 110 HA LYS 110 -12.785 -19.703 -12.494 869 HB2 LYS 110 HB2 LYS 110 -15.305 -19.993 -14.044 870 HB3 LYS 110 HB3 LYS 110 -15.059 -21.101 -12.701 871 HG2 LYS 110 HG2 LYS 110 -14.591 -18.219 -12.196 872 HG3 LYS 110 HG3 LYS 110 -16.259 -18.756 -12.412 873 HD2 LYS 110 HD2 LYS 110 -15.434 -20.645 -10.717 874 HD3 LYS 110 HD3 LYS 110 -14.329 -19.354 -10.240 875 HE2 LYS 110 HE2 LYS 110 -16.110 -18.933 -8.854 876 HE3 LYS 110 HE3 LYS 110 -16.515 -17.909 -10.231 877 HZ1 LYS 110 HZ1 LYS 110 -18.479 -19.000 -9.880 878 HZ2 LYS 110 HZ2 LYS 110 -17.740 -20.435 -9.373 879 HZ3 LYS 110 HZ3 LYS 110 -17.766 -20.033 -11.016 Start of MODEL 6 1 H1 MET 1 H MET 1 3.518 1.030 -1.387 2 HA MET 1 HA MET 1 2.455 -0.587 -0.151 3 HB2 MET 1 HB2 MET 1 0.759 1.531 -0.779 4 HB3 MET 1 HB3 MET 1 -0.217 0.096 -1.064 5 HG2 MET 1 HG2 MET 1 -0.581 -0.089 1.103 6 HG3 MET 1 HG3 MET 1 1.148 -0.278 1.381 7 HE1 MET 1 HE1 MET 1 2.396 2.884 2.754 8 HE2 MET 1 HE2 MET 1 1.950 1.363 3.528 9 HE3 MET 1 HE3 MET 1 2.724 1.353 1.942 10 H SER 2 H SER 2 0.713 -2.351 -0.175 11 HA SER 2 HA SER 2 0.695 -3.634 -2.829 12 HB2 SER 2 HB2 SER 2 0.637 -5.810 -1.475 13 HB3 SER 2 HB3 SER 2 2.164 -4.929 -1.500 14 HG SER 2 HG SER 2 1.006 -5.717 0.613 15 H LEU 3 H LEU 3 -1.266 -3.831 -3.658 16 HA LEU 3 HA LEU 3 -3.582 -3.834 -1.856 17 HB2 LEU 3 HB2 LEU 3 -3.228 -3.126 -4.749 18 HB3 LEU 3 HB3 LEU 3 -4.824 -3.433 -4.067 19 HG LEU 3 HG LEU 3 -3.268 -1.481 -2.548 20 HD11 LEU 3 HD11 LEU 3 -2.357 -0.694 -4.537 21 HD12 LEU 3 HD12 LEU 3 -3.802 0.295 -4.331 22 HD13 LEU 3 HD13 LEU 3 -3.814 -1.057 -5.463 23 HD21 LEU 3 HD21 LEU 3 -6.026 -1.933 -3.508 24 HD22 LEU 3 HD22 LEU 3 -5.544 -0.256 -3.250 25 HD23 LEU 3 HD23 LEU 3 -5.442 -1.418 -1.926 26 H LYS 4 H LYS 4 -4.768 -5.607 -1.584 27 HA LYS 4 HA LYS 4 -4.036 -8.115 -2.499 28 HB2 LYS 4 HB2 LYS 4 -6.105 -7.015 -0.892 29 HB3 LYS 4 HB3 LYS 4 -6.861 -8.097 -2.055 30 HG2 LYS 4 HG2 LYS 4 -5.540 -9.937 -1.319 31 HG3 LYS 4 HG3 LYS 4 -4.535 -8.886 -0.318 32 HD2 LYS 4 HD2 LYS 4 -6.757 -8.290 0.867 33 HD3 LYS 4 HD3 LYS 4 -7.368 -9.764 0.112 34 HE2 LYS 4 HE2 LYS 4 -6.070 -11.123 1.397 35 HE3 LYS 4 HE3 LYS 4 -4.773 -9.938 1.533 36 HZ1 LYS 4 HZ1 LYS 4 -5.841 -10.231 3.651 37 HZ2 LYS 4 HZ2 LYS 4 -7.359 -9.889 2.990 38 HZ3 LYS 4 HZ3 LYS 4 -6.182 -8.677 3.076 39 H SER 5 H SER 5 -6.209 -5.760 -3.928 40 HA SER 5 HA SER 5 -7.523 -7.327 -5.798 41 HB2 SER 5 HB2 SER 5 -7.386 -5.101 -7.206 42 HB3 SER 5 HB3 SER 5 -8.333 -5.160 -5.720 43 HG SER 5 HG SER 5 -6.942 -3.872 -4.770 44 H ASP 6 H ASP 6 -4.225 -6.271 -5.724 45 HA ASP 6 HA ASP 6 -3.503 -6.423 -8.398 46 HB2 ASP 6 HB2 ASP 6 -1.971 -7.052 -5.879 47 HB3 ASP 6 HB3 ASP 6 -1.223 -7.124 -7.472 48 H GLU 7 H GLU 7 -3.937 -8.996 -6.034 49 HA GLU 7 HA GLU 7 -2.835 -11.097 -7.547 50 HB2 GLU 7 HB2 GLU 7 -4.253 -10.799 -5.077 51 HB3 GLU 7 HB3 GLU 7 -4.966 -12.125 -5.986 52 HG2 GLU 7 HG2 GLU 7 -2.102 -12.286 -6.078 53 HG3 GLU 7 HG3 GLU 7 -2.660 -12.175 -4.409 54 H VAL 8 H VAL 8 -6.203 -10.001 -7.205 55 HA VAL 8 HA VAL 8 -7.328 -11.879 -8.973 56 HB VAL 8 HB VAL 8 -8.267 -9.161 -8.075 57 HG11 VAL 8 HG11 VAL 8 -10.473 -9.797 -9.050 58 HG12 VAL 8 HG12 VAL 8 -9.222 -9.467 -10.250 59 HG13 VAL 8 HG13 VAL 8 -9.667 -11.132 -9.874 60 HG21 VAL 8 HG21 VAL 8 -8.208 -11.585 -6.786 61 HG22 VAL 8 HG22 VAL 8 -9.265 -10.231 -6.383 62 HG23 VAL 8 HG23 VAL 8 -9.849 -11.524 -7.430 63 H PHE 9 H PHE 9 -6.256 -8.531 -9.497 64 HA PHE 9 HA PHE 9 -6.958 -8.387 -12.216 65 HB2 PHE 9 HB2 PHE 9 -5.139 -6.854 -10.414 66 HB3 PHE 9 HB3 PHE 9 -4.982 -6.615 -12.151 67 HD1 PHE 9 HD1 PHE 9 -7.650 -6.660 -13.164 68 HD2 PHE 9 HD2 PHE 9 -6.216 -5.050 -9.494 69 HE1 PHE 9 HE1 PHE 9 -9.541 -5.087 -13.119 70 HE2 PHE 9 HE2 PHE 9 -8.106 -3.475 -9.443 71 HZ PHE 9 HZ PHE 9 -9.772 -3.493 -11.257 72 H ALA 10 H ALA 10 -4.118 -9.620 -10.579 73 HA ALA 10 HA ALA 10 -2.451 -9.828 -12.863 74 HB1 ALA 10 HB1 ALA 10 -1.131 -11.401 -11.452 75 HB2 ALA 10 HB2 ALA 10 -1.457 -9.845 -10.687 76 HB3 ALA 10 HB3 ALA 10 -2.385 -11.270 -10.219 77 H LYS 11 H LYS 11 -4.530 -12.174 -11.186 78 HA LYS 11 HA LYS 11 -3.966 -14.325 -12.949 79 HB2 LYS 11 HB2 LYS 11 -5.955 -15.389 -11.916 80 HB3 LYS 11 HB3 LYS 11 -4.817 -14.765 -10.729 81 HG2 LYS 11 HG2 LYS 11 -6.230 -12.793 -10.414 82 HG3 LYS 11 HG3 LYS 11 -7.375 -13.432 -11.595 83 HD2 LYS 11 HD2 LYS 11 -8.314 -14.076 -9.573 84 HD3 LYS 11 HD3 LYS 11 -7.422 -15.519 -10.062 85 HE2 LYS 11 HE2 LYS 11 -5.758 -15.178 -8.487 86 HE3 LYS 11 HE3 LYS 11 -6.108 -13.457 -8.341 87 HZ1 LYS 11 HZ1 LYS 11 -8.036 -15.519 -7.460 88 HZ2 LYS 11 HZ2 LYS 11 -7.987 -13.881 -7.042 89 HZ3 LYS 11 HZ3 LYS 11 -6.818 -14.943 -6.436 90 H ILE 12 H ILE 12 -6.562 -11.924 -12.802 91 HA ILE 12 HA ILE 12 -8.170 -12.955 -14.848 92 HB ILE 12 HB ILE 12 -7.790 -10.143 -13.843 93 HG12 ILE 12 HG12 ILE 12 -10.123 -12.053 -13.605 94 HG13 ILE 12 HG13 ILE 12 -8.882 -11.847 -12.373 95 HG21 ILE 12 HG21 ILE 12 -9.219 -11.095 -16.226 96 HG22 ILE 12 HG22 ILE 12 -10.155 -10.049 -15.160 97 HG23 ILE 12 HG23 ILE 12 -8.623 -9.484 -15.825 98 HD11 ILE 12 HD11 ILE 12 -10.779 -10.575 -11.727 99 HD12 ILE 12 HD12 ILE 12 -9.531 -9.441 -12.246 100 HD13 ILE 12 HD13 ILE 12 -10.884 -9.814 -13.314 101 H ALA 13 H ALA 13 -5.491 -10.635 -14.968 102 HA ALA 13 HA ALA 13 -5.639 -9.976 -17.675 103 HB1 ALA 13 HB1 ALA 13 -4.241 -8.793 -16.028 104 HB2 ALA 13 HB2 ALA 13 -3.145 -10.176 -15.992 105 HB3 ALA 13 HB3 ALA 13 -3.342 -9.245 -17.477 106 H LYS 14 H LYS 14 -3.800 -12.561 -16.071 107 HA LYS 14 HA LYS 14 -2.529 -13.587 -18.336 108 HB2 LYS 14 HB2 LYS 14 -3.428 -14.984 -15.811 109 HB3 LYS 14 HB3 LYS 14 -2.378 -15.714 -17.019 110 HG2 LYS 14 HG2 LYS 14 -1.356 -13.147 -16.230 111 HG3 LYS 14 HG3 LYS 14 -1.630 -14.169 -14.817 112 HD2 LYS 14 HD2 LYS 14 -0.338 -15.474 -17.128 113 HD3 LYS 14 HD3 LYS 14 0.617 -14.239 -16.303 114 HE2 LYS 14 HE2 LYS 14 -0.787 -16.262 -14.641 115 HE3 LYS 14 HE3 LYS 14 0.637 -16.779 -15.541 116 HZ1 LYS 14 HZ1 LYS 14 0.563 -15.423 -13.122 117 HZ2 LYS 14 HZ2 LYS 14 1.166 -14.326 -14.259 118 HZ3 LYS 14 HZ3 LYS 14 1.927 -15.820 -14.039 119 H ARG 15 H ARG 15 -5.778 -14.035 -17.130 120 HA ARG 15 HA ARG 15 -6.400 -16.269 -18.805 121 HB2 ARG 15 HB2 ARG 15 -8.253 -14.340 -17.395 122 HB3 ARG 15 HB3 ARG 15 -8.716 -15.883 -18.099 123 HG2 ARG 15 HG2 ARG 15 -6.558 -15.894 -16.067 124 HG3 ARG 15 HG3 ARG 15 -8.209 -15.601 -15.518 125 HD2 ARG 15 HD2 ARG 15 -8.817 -17.677 -16.905 126 HD3 ARG 15 HD3 ARG 15 -7.086 -18.009 -16.911 127 HE ARG 15 HE ARG 15 -8.179 -17.535 -14.291 128 HH11 ARG 15 HH11 ARG 15 -7.547 -19.912 -16.755 129 HH12 ARG 15 HH12 ARG 15 -7.540 -21.246 -15.650 130 HH21 ARG 15 HH21 ARG 15 -8.172 -19.283 -12.826 131 HH22 ARG 15 HH22 ARG 15 -7.896 -20.888 -13.415 132 H LEU 16 H LEU 16 -6.394 -12.832 -19.185 133 HA LEU 16 HA LEU 16 -8.215 -12.685 -21.366 134 HB2 LEU 16 HB2 LEU 16 -6.026 -10.825 -20.458 135 HB3 LEU 16 HB3 LEU 16 -7.170 -10.450 -21.745 136 HG LEU 16 HG LEU 16 -7.781 -10.835 -18.817 137 HD11 LEU 16 HD11 LEU 16 -8.624 -8.407 -20.214 138 HD12 LEU 16 HD12 LEU 16 -6.876 -8.615 -20.115 139 HD13 LEU 16 HD13 LEU 16 -7.847 -8.605 -18.643 140 HD21 LEU 16 HD21 LEU 16 -9.620 -10.497 -21.178 141 HD22 LEU 16 HD22 LEU 16 -10.110 -10.203 -19.510 142 HD23 LEU 16 HD23 LEU 16 -9.593 -11.815 -20.006 143 H GLU 17 H GLU 17 -5.045 -13.837 -21.088 144 HA GLU 17 HA GLU 17 -4.276 -13.258 -23.821 145 HB2 GLU 17 HB2 GLU 17 -2.963 -14.826 -21.602 146 HB3 GLU 17 HB3 GLU 17 -2.288 -14.716 -23.221 147 HG2 GLU 17 HG2 GLU 17 -2.590 -12.123 -22.760 148 HG3 GLU 17 HG3 GLU 17 -2.455 -12.670 -21.089 149 H SER 18 H SER 18 -6.093 -15.608 -22.217 150 HA SER 18 HA SER 18 -5.543 -17.682 -24.204 151 HB2 SER 18 HB2 SER 18 -6.217 -17.751 -21.472 152 HB3 SER 18 HB3 SER 18 -7.624 -18.381 -22.329 153 HG SER 18 HG SER 18 -6.498 -20.069 -22.966 154 H ILE 19 H ILE 19 -7.677 -15.130 -23.662 155 HA ILE 19 HA ILE 19 -10.090 -16.160 -24.680 156 HB ILE 19 HB ILE 19 -9.075 -13.320 -24.841 157 HG12 ILE 19 HG12 ILE 19 -10.756 -14.699 -22.736 158 HG13 ILE 19 HG13 ILE 19 -9.092 -14.160 -22.540 159 HG21 ILE 19 HG21 ILE 19 -10.942 -13.742 -26.349 160 HG22 ILE 19 HG22 ILE 19 -11.876 -14.423 -25.018 161 HG23 ILE 19 HG23 ILE 19 -11.441 -12.714 -25.006 162 HD11 ILE 19 HD11 ILE 19 -10.654 -12.626 -21.491 163 HD12 ILE 19 HD12 ILE 19 -9.807 -11.849 -22.829 164 HD13 ILE 19 HD13 ILE 19 -11.473 -12.388 -23.034 165 H ASP 20 H ASP 20 -10.974 -16.182 -26.724 166 HA ASP 20 HA ASP 20 -9.098 -15.669 -28.939 167 HB2 ASP 20 HB2 ASP 20 -10.441 -18.073 -28.224 168 HB3 ASP 20 HB3 ASP 20 -11.137 -17.501 -29.738 169 HA PRO 21 HA PRO 21 -12.021 -12.905 -30.693 170 HB2 PRO 21 HB2 PRO 21 -11.542 -13.260 -33.341 171 HB3 PRO 21 HB3 PRO 21 -10.423 -12.411 -32.268 172 HG2 PRO 21 HG2 PRO 21 -10.329 -15.238 -33.250 173 HG3 PRO 21 HG3 PRO 21 -9.012 -14.060 -33.103 174 HD2 PRO 21 HD2 PRO 21 -9.423 -16.020 -31.281 175 HD3 PRO 21 HD3 PRO 21 -8.763 -14.432 -30.842 176 H ALA 22 H ALA 22 -12.076 -16.270 -31.578 177 HA ALA 22 HA ALA 22 -14.332 -16.337 -33.226 178 HB1 ALA 22 HB1 ALA 22 -14.044 -18.612 -31.393 179 HB2 ALA 22 HB2 ALA 22 -14.084 -18.568 -33.156 180 HB3 ALA 22 HB3 ALA 22 -12.588 -18.197 -32.298 181 H ASN 23 H ASN 23 -14.131 -16.895 -29.707 182 HA ASN 23 HA ASN 23 -17.031 -16.468 -29.538 183 HB2 ASN 23 HB2 ASN 23 -15.431 -18.423 -28.412 184 HB3 ASN 23 HB3 ASN 23 -15.690 -17.302 -27.079 185 HD21 ASN 23 HD21 ASN 23 -17.056 -19.711 -29.072 186 HD22 ASN 23 HD22 ASN 23 -18.628 -19.738 -28.355 187 H ARG 24 H ARG 24 -17.648 -14.480 -29.033 188 HA ARG 24 HA ARG 24 -16.883 -13.134 -26.713 189 HB2 ARG 24 HB2 ARG 24 -14.933 -12.877 -28.683 190 HB3 ARG 24 HB3 ARG 24 -15.846 -11.378 -28.783 191 HG2 ARG 24 HG2 ARG 24 -15.338 -10.786 -26.578 192 HG3 ARG 24 HG3 ARG 24 -14.824 -12.423 -26.167 193 HD2 ARG 24 HD2 ARG 24 -12.753 -11.621 -26.494 194 HD3 ARG 24 HD3 ARG 24 -13.129 -11.825 -28.205 195 HE ARG 24 HE ARG 24 -13.993 -9.289 -27.281 196 HH11 ARG 24 HH11 ARG 24 -11.137 -11.071 -28.169 197 HH12 ARG 24 HH12 ARG 24 -10.247 -9.662 -28.644 198 HH21 ARG 24 HH21 ARG 24 -12.832 -7.427 -27.903 199 HH22 ARG 24 HH22 ARG 24 -11.212 -7.590 -28.491 200 H GLN 25 H GLN 25 -19.048 -12.726 -26.510 201 HA GLN 25 HA GLN 25 -20.732 -11.740 -28.524 202 HB2 GLN 25 HB2 GLN 25 -20.915 -11.620 -25.517 203 HB3 GLN 25 HB3 GLN 25 -22.189 -11.020 -26.570 204 HG2 GLN 25 HG2 GLN 25 -22.699 -13.149 -27.368 205 HG3 GLN 25 HG3 GLN 25 -21.169 -13.824 -26.811 206 HE21 GLN 25 HE21 GLN 25 -23.000 -15.364 -26.064 207 HE22 GLN 25 HE22 GLN 25 -23.539 -15.123 -24.441 208 H VAL 26 H VAL 26 -19.192 -10.001 -25.818 209 HA VAL 26 HA VAL 26 -18.844 -7.659 -27.475 210 HB VAL 26 HB VAL 26 -21.207 -7.533 -26.513 211 HG11 VAL 26 HG11 VAL 26 -19.807 -6.726 -23.981 212 HG12 VAL 26 HG12 VAL 26 -21.528 -7.016 -24.247 213 HG13 VAL 26 HG13 VAL 26 -20.395 -8.368 -24.242 214 HG21 VAL 26 HG21 VAL 26 -19.713 -5.173 -25.534 215 HG22 VAL 26 HG22 VAL 26 -19.482 -5.619 -27.224 216 HG23 VAL 26 HG23 VAL 26 -21.100 -5.268 -26.619 217 H GLU 27 H GLU 27 -17.221 -6.334 -26.757 218 HA GLU 27 HA GLU 27 -16.202 -6.550 -24.064 219 HB2 GLU 27 HB2 GLU 27 -14.750 -7.702 -26.421 220 HB3 GLU 27 HB3 GLU 27 -13.843 -7.024 -25.077 221 HG2 GLU 27 HG2 GLU 27 -15.786 -9.316 -24.989 222 HG3 GLU 27 HG3 GLU 27 -14.040 -9.380 -24.758 223 H HIS 28 H HIS 28 -15.708 -4.554 -23.474 224 HA HIS 28 HA HIS 28 -14.421 -2.765 -25.410 225 HB2 HIS 28 HB2 HIS 28 -17.007 -2.346 -24.004 226 HB3 HIS 28 HB3 HIS 28 -15.929 -0.959 -24.129 227 HD1 HIS 28 HD1 HIS 28 -15.434 -0.059 -26.531 228 HD2 HIS 28 HD2 HIS 28 -18.255 -3.105 -26.364 229 HE1 HIS 28 HE1 HIS 28 -16.573 -0.044 -28.773 230 H VAL 29 H VAL 29 -13.608 -0.730 -24.251 231 HA VAL 29 HA VAL 29 -11.798 -1.499 -22.245 232 HB VAL 29 HB VAL 29 -12.688 1.290 -22.991 233 HG11 VAL 29 HG11 VAL 29 -10.013 1.246 -22.118 234 HG12 VAL 29 HG12 VAL 29 -11.399 2.000 -21.328 235 HG13 VAL 29 HG13 VAL 29 -10.948 0.343 -20.926 236 HG21 VAL 29 HG21 VAL 29 -11.779 -0.076 -24.862 237 HG22 VAL 29 HG22 VAL 29 -10.803 1.342 -24.478 238 HG23 VAL 29 HG23 VAL 29 -10.282 -0.256 -23.946 239 H TYR 30 H TYR 30 -11.878 -1.476 -20.076 240 HA TYR 30 HA TYR 30 -14.199 -0.211 -18.782 241 HB2 TYR 30 HB2 TYR 30 -14.092 -2.865 -19.043 242 HB3 TYR 30 HB3 TYR 30 -13.096 -2.713 -17.600 243 HD1 TYR 30 HD2 TYR 30 -14.132 -1.217 -15.693 244 HD2 TYR 30 HD1 TYR 30 -16.384 -3.058 -18.798 245 HE1 TYR 30 HE2 TYR 30 -16.157 -1.065 -14.306 246 HE2 TYR 30 HE1 TYR 30 -18.416 -2.909 -17.420 247 HH TYR 30 HH TYR 30 -18.878 -0.993 -15.025 248 H LYS 31 H LYS 31 -13.841 0.725 -16.793 249 HA LYS 31 HA LYS 31 -11.028 0.837 -15.920 250 HB2 LYS 31 HB2 LYS 31 -12.921 2.937 -16.547 251 HB3 LYS 31 HB3 LYS 31 -12.336 3.090 -14.895 252 HG2 LYS 31 HG2 LYS 31 -10.143 2.530 -16.650 253 HG3 LYS 31 HG3 LYS 31 -11.066 3.907 -17.255 254 HD2 LYS 31 HD2 LYS 31 -10.095 3.641 -14.412 255 HD3 LYS 31 HD3 LYS 31 -9.221 4.507 -15.678 256 HE2 LYS 31 HE2 LYS 31 -11.437 5.798 -15.996 257 HE3 LYS 31 HE3 LYS 31 -11.850 5.170 -14.402 258 HZ1 LYS 31 HZ1 LYS 31 -10.811 7.018 -13.711 259 HZ2 LYS 31 HZ2 LYS 31 -9.934 7.211 -15.145 260 HZ3 LYS 31 HZ3 LYS 31 -9.396 6.125 -13.965 261 H PHE 32 H PHE 32 -10.581 0.316 -13.866 262 HA PHE 32 HA PHE 32 -12.854 -0.095 -12.036 263 HB2 PHE 32 HB2 PHE 32 -10.217 -1.562 -11.928 264 HB3 PHE 32 HB3 PHE 32 -11.696 -1.941 -11.050 265 HD1 PHE 32 HD2 PHE 32 -10.014 -2.066 -14.304 266 HD2 PHE 32 HD1 PHE 32 -13.492 -3.134 -12.095 267 HE1 PHE 32 HE2 PHE 32 -10.686 -3.598 -16.109 268 HE2 PHE 32 HE1 PHE 32 -14.169 -4.668 -13.896 269 HZ PHE 32 HZ PHE 32 -12.766 -4.900 -15.907 270 H ARG 33 H ARG 33 -12.849 0.993 -10.174 271 HA ARG 33 HA ARG 33 -10.482 2.593 -9.524 272 HB2 ARG 33 HB2 ARG 33 -13.375 2.963 -9.250 273 HB3 ARG 33 HB3 ARG 33 -12.473 3.411 -7.808 274 HG2 ARG 33 HG2 ARG 33 -10.978 4.744 -9.436 275 HG3 ARG 33 HG3 ARG 33 -12.330 4.572 -10.557 276 HD2 ARG 33 HD2 ARG 33 -13.129 5.417 -7.879 277 HD3 ARG 33 HD3 ARG 33 -12.045 6.553 -8.681 278 HE ARG 33 HE ARG 33 -13.905 6.004 -10.576 279 HH11 ARG 33 HH11 ARG 33 -14.075 7.077 -7.268 280 HH12 ARG 33 HH12 ARG 33 -15.540 7.973 -7.497 281 HH21 ARG 33 HH21 ARG 33 -15.834 7.180 -10.890 282 HH22 ARG 33 HH22 ARG 33 -16.540 8.030 -9.557 283 H ILE 34 H ILE 34 -9.157 1.843 -8.019 284 HA ILE 34 HA ILE 34 -10.162 -0.069 -6.042 285 HB ILE 34 HB ILE 34 -7.331 0.683 -6.781 286 HG12 ILE 34 HG12 ILE 34 -8.458 -0.635 -8.500 287 HG13 ILE 34 HG13 ILE 34 -7.240 -1.612 -7.688 288 HG21 ILE 34 HG21 ILE 34 -8.420 -1.203 -4.712 289 HG22 ILE 34 HG22 ILE 34 -6.795 -1.370 -5.374 290 HG23 ILE 34 HG23 ILE 34 -7.247 0.097 -4.507 291 HD11 ILE 34 HD11 ILE 34 -9.397 -2.220 -6.207 292 HD12 ILE 34 HD12 ILE 34 -10.161 -1.903 -7.764 293 HD13 ILE 34 HD13 ILE 34 -8.895 -3.124 -7.635 294 H THR 35 H THR 35 -10.800 0.729 -4.160 295 HA THR 35 HA THR 35 -9.502 3.159 -3.128 296 HB THR 35 HB THR 35 -11.460 3.559 -1.795 297 HG1 THR 35 HG1 THR 35 -12.734 1.268 -2.851 298 HG21 THR 35 HG21 THR 35 -13.092 2.904 -4.045 299 HG22 THR 35 HG22 THR 35 -11.509 3.426 -4.623 300 HG23 THR 35 HG23 THR 35 -12.452 4.476 -3.565 301 H GLN 36 H GLN 36 -8.720 3.243 -1.032 302 HA GLN 36 HA GLN 36 -8.214 0.628 0.191 303 HB2 GLN 36 HB2 GLN 36 -6.284 2.108 -0.385 304 HB3 GLN 36 HB3 GLN 36 -6.883 3.274 0.787 305 HG2 GLN 36 HG2 GLN 36 -6.649 1.553 2.550 306 HG3 GLN 36 HG3 GLN 36 -5.929 0.478 1.352 307 HE21 GLN 36 HE21 GLN 36 -4.042 1.469 0.151 308 HE22 GLN 36 HE22 GLN 36 -2.906 2.358 1.101 309 H GLY 37 H GLY 37 -9.729 0.094 1.637 310 HA2 GLY 37 HA2 GLY 37 -10.815 0.176 3.682 311 HA3 GLY 37 HA3 GLY 37 -10.099 1.757 3.959 312 H GLY 38 H GLY 38 -11.051 3.093 1.679 313 HA2 GLY 38 HA2 GLY 38 -13.759 2.845 1.127 314 HA3 GLY 38 HA3 GLY 38 -13.642 3.828 2.579 315 H LYS 39 H LYS 39 -10.888 4.344 0.834 316 HA LYS 39 HA LYS 39 -12.075 6.567 -0.687 317 HB2 LYS 39 HB2 LYS 39 -10.997 7.318 1.458 318 HB3 LYS 39 HB3 LYS 39 -9.467 6.720 0.831 319 HG2 LYS 39 HG2 LYS 39 -9.576 8.295 -1.010 320 HG3 LYS 39 HG3 LYS 39 -11.151 8.864 -0.451 321 HD2 LYS 39 HD2 LYS 39 -9.690 9.181 1.799 322 HD3 LYS 39 HD3 LYS 39 -8.447 9.444 0.574 323 HE2 LYS 39 HE2 LYS 39 -9.196 11.526 0.359 324 HE3 LYS 39 HE3 LYS 39 -10.687 10.866 -0.312 325 HZ1 LYS 39 HZ1 LYS 39 -10.128 11.631 2.491 326 HZ2 LYS 39 HZ2 LYS 39 -11.437 10.643 2.077 327 HZ3 LYS 39 HZ3 LYS 39 -11.339 12.218 1.466 328 H VAL 40 H VAL 40 -11.402 6.751 -2.738 329 HA VAL 40 HA VAL 40 -10.047 4.765 -4.076 330 HB VAL 40 HB VAL 40 -11.415 6.668 -5.071 331 HG11 VAL 40 HG11 VAL 40 -10.100 8.481 -4.009 332 HG12 VAL 40 HG12 VAL 40 -8.745 8.070 -5.061 333 HG13 VAL 40 HG13 VAL 40 -10.254 8.663 -5.756 334 HG21 VAL 40 HG21 VAL 40 -9.265 6.688 -6.921 335 HG22 VAL 40 HG22 VAL 40 -9.293 5.107 -6.141 336 HG23 VAL 40 HG23 VAL 40 -10.734 5.714 -6.957 337 H VAL 41 H VAL 41 -7.959 4.362 -4.666 338 HA VAL 41 HA VAL 41 -5.889 6.169 -3.605 339 HB VAL 41 HB VAL 41 -4.491 4.135 -3.167 340 HG11 VAL 41 HG11 VAL 41 -5.349 3.797 -1.016 341 HG12 VAL 41 HG12 VAL 41 -5.905 5.413 -1.458 342 HG13 VAL 41 HG13 VAL 41 -7.013 4.043 -1.543 343 HG21 VAL 41 HG21 VAL 41 -7.054 2.576 -3.269 344 HG22 VAL 41 HG22 VAL 41 -5.984 2.689 -4.667 345 HG23 VAL 41 HG23 VAL 41 -5.398 1.976 -3.164 346 H LYS 42 H LYS 42 -6.978 4.055 -6.127 347 HA LYS 42 HA LYS 42 -5.220 5.237 -8.030 348 HB2 LYS 42 HB2 LYS 42 -3.832 3.442 -6.744 349 HB3 LYS 42 HB3 LYS 42 -4.758 2.291 -7.698 350 HG2 LYS 42 HG2 LYS 42 -3.972 3.459 -9.750 351 HG3 LYS 42 HG3 LYS 42 -2.932 4.451 -8.726 352 HD2 LYS 42 HD2 LYS 42 -2.666 1.594 -8.205 353 HD3 LYS 42 HD3 LYS 42 -2.252 2.038 -9.863 354 HE2 LYS 42 HE2 LYS 42 -1.152 3.903 -7.939 355 HE3 LYS 42 HE3 LYS 42 -0.623 2.251 -7.623 356 HZ1 LYS 42 HZ1 LYS 42 0.768 3.636 -9.207 357 HZ2 LYS 42 HZ2 LYS 42 -0.482 3.434 -10.328 358 HZ3 LYS 42 HZ3 LYS 42 0.340 2.084 -9.727 359 H ASN 43 H ASN 43 -5.656 4.539 -10.205 360 HA ASN 43 HA ASN 43 -8.090 2.909 -10.485 361 HB2 ASN 43 HB2 ASN 43 -8.556 4.565 -12.474 362 HB3 ASN 43 HB3 ASN 43 -9.022 4.998 -10.832 363 HD21 ASN 43 HD21 ASN 43 -8.914 7.182 -11.138 364 HD22 ASN 43 HD22 ASN 43 -7.432 8.030 -11.402 365 H TRP 44 H TRP 44 -7.958 1.352 -11.972 366 HA TRP 44 HA TRP 44 -5.635 1.373 -13.776 367 HB2 TRP 44 HB2 TRP 44 -7.232 -0.860 -12.543 368 HB3 TRP 44 HB3 TRP 44 -6.209 -1.137 -13.950 369 HD1 TRP 44 HD1 TRP 44 -5.986 -0.204 -10.231 370 HE1 TRP 44 HE1 TRP 44 -3.588 -0.670 -9.418 371 HE3 TRP 44 HE3 TRP 44 -3.818 -1.360 -14.715 372 HZ2 TRP 44 HZ2 TRP 44 -1.107 -1.426 -10.530 373 HZ3 TRP 44 HZ3 TRP 44 -1.428 -1.943 -14.754 374 HH2 TRP 44 HH2 TRP 44 -0.102 -1.974 -12.704 375 H VAL 45 H VAL 45 -5.888 0.694 -15.954 376 HA VAL 45 HA VAL 45 -8.641 0.985 -16.971 377 HB VAL 45 HB VAL 45 -7.105 2.862 -17.569 378 HG11 VAL 45 HG11 VAL 45 -5.411 2.398 -19.341 379 HG12 VAL 45 HG12 VAL 45 -5.015 1.710 -17.765 380 HG13 VAL 45 HG13 VAL 45 -5.649 0.676 -19.045 381 HG21 VAL 45 HG21 VAL 45 -8.871 1.395 -19.214 382 HG22 VAL 45 HG22 VAL 45 -8.451 3.105 -19.319 383 HG23 VAL 45 HG23 VAL 45 -7.522 1.912 -20.226 384 H MET 46 H MET 46 -9.360 -0.415 -18.539 385 HA MET 46 HA MET 46 -7.645 -2.755 -19.023 386 HB2 MET 46 HB2 MET 46 -9.626 -3.409 -17.878 387 HB3 MET 46 HB3 MET 46 -10.642 -2.442 -18.938 388 HG2 MET 46 HG2 MET 46 -10.612 -3.983 -20.610 389 HG3 MET 46 HG3 MET 46 -9.020 -4.596 -20.167 390 HE1 MET 46 HE1 MET 46 -12.565 -5.067 -20.342 391 HE2 MET 46 HE2 MET 46 -13.031 -6.284 -19.153 392 HE3 MET 46 HE3 MET 46 -12.871 -4.594 -18.671 393 H ASP 47 H ASP 47 -6.799 -2.925 -20.981 394 HA ASP 47 HA ASP 47 -7.363 -1.228 -23.123 395 HB2 ASP 47 HB2 ASP 47 -5.424 -3.070 -22.584 396 HB3 ASP 47 HB3 ASP 47 -6.328 -3.888 -23.856 397 H LEU 48 H LEU 48 -7.631 -2.812 -25.377 398 HA LEU 48 HA LEU 48 -10.042 -4.392 -25.135 399 HB2 LEU 48 HB2 LEU 48 -10.561 -1.828 -25.345 400 HB3 LEU 48 HB3 LEU 48 -10.196 -2.108 -27.046 401 HG LEU 48 HG LEU 48 -12.471 -3.161 -25.404 402 HD11 LEU 48 HD11 LEU 48 -13.204 -1.283 -26.471 403 HD12 LEU 48 HD12 LEU 48 -13.544 -2.485 -27.716 404 HD13 LEU 48 HD13 LEU 48 -12.097 -1.484 -27.829 405 HD21 LEU 48 HD21 LEU 48 -12.996 -4.580 -27.440 406 HD22 LEU 48 HD22 LEU 48 -11.697 -5.155 -26.394 407 HD23 LEU 48 HD23 LEU 48 -11.313 -4.345 -27.914 408 H LYS 49 H LYS 49 -7.983 -2.665 -27.474 409 HA LYS 49 HA LYS 49 -8.355 -4.618 -29.524 410 HB2 LYS 49 HB2 LYS 49 -7.260 -2.033 -29.340 411 HB3 LYS 49 HB3 LYS 49 -5.943 -3.074 -29.863 412 HG2 LYS 49 HG2 LYS 49 -7.102 -3.743 -31.799 413 HG3 LYS 49 HG3 LYS 49 -8.629 -3.090 -31.203 414 HD2 LYS 49 HD2 LYS 49 -7.887 -0.854 -31.492 415 HD3 LYS 49 HD3 LYS 49 -6.220 -1.371 -31.758 416 HE2 LYS 49 HE2 LYS 49 -6.694 -2.199 -33.889 417 HE3 LYS 49 HE3 LYS 49 -8.428 -2.264 -33.578 418 HZ1 LYS 49 HZ1 LYS 49 -8.439 0.176 -33.531 419 HZ2 LYS 49 HZ2 LYS 49 -7.929 -0.430 -35.025 420 HZ3 LYS 49 HZ3 LYS 49 -6.796 0.191 -33.933 421 H ASN 50 H ASN 50 -6.132 -4.214 -26.889 422 HA ASN 50 HA ASN 50 -4.452 -6.396 -27.910 423 HB2 ASN 50 HB2 ASN 50 -3.565 -4.082 -27.005 424 HB3 ASN 50 HB3 ASN 50 -3.773 -4.856 -25.437 425 HD21 ASN 50 HD21 ASN 50 -1.307 -4.051 -26.290 426 HD22 ASN 50 HD22 ASN 50 -0.323 -5.433 -26.617 427 H VAL 51 H VAL 51 -6.761 -5.576 -25.481 428 HA VAL 51 HA VAL 51 -7.841 -6.831 -23.915 429 HB VAL 51 HB VAL 51 -6.362 -9.268 -24.872 430 HG11 VAL 51 HG11 VAL 51 -9.220 -9.411 -24.284 431 HG12 VAL 51 HG12 VAL 51 -7.893 -10.435 -23.730 432 HG13 VAL 51 HG13 VAL 51 -8.236 -8.912 -22.909 433 HG21 VAL 51 HG21 VAL 51 -8.359 -7.627 -26.310 434 HG22 VAL 51 HG22 VAL 51 -7.087 -8.675 -26.938 435 HG23 VAL 51 HG23 VAL 51 -8.594 -9.375 -26.346 436 H LYS 52 H LYS 52 -5.488 -5.511 -23.188 437 HA LYS 52 HA LYS 52 -4.421 -7.335 -21.134 438 HB2 LYS 52 HB2 LYS 52 -2.845 -6.548 -23.053 439 HB3 LYS 52 HB3 LYS 52 -2.838 -5.014 -22.192 440 HG2 LYS 52 HG2 LYS 52 -1.381 -5.770 -20.702 441 HG3 LYS 52 HG3 LYS 52 -2.346 -7.215 -20.393 442 HD2 LYS 52 HD2 LYS 52 -1.194 -8.475 -21.915 443 HD3 LYS 52 HD3 LYS 52 -0.797 -7.085 -22.928 444 HE2 LYS 52 HE2 LYS 52 0.406 -7.587 -20.211 445 HE3 LYS 52 HE3 LYS 52 1.150 -8.101 -21.724 446 HZ1 LYS 52 HZ1 LYS 52 0.788 -5.387 -20.662 447 HZ2 LYS 52 HZ2 LYS 52 0.849 -5.609 -22.337 448 HZ3 LYS 52 HZ3 LYS 52 2.154 -6.089 -21.373 449 H LEU 53 H LEU 53 -3.458 -6.075 -19.248 450 HA LEU 53 HA LEU 53 -5.203 -3.783 -18.626 451 HB2 LEU 53 HB2 LEU 53 -4.743 -6.255 -17.231 452 HB3 LEU 53 HB3 LEU 53 -4.273 -4.888 -16.223 453 HG LEU 53 HG LEU 53 -6.551 -3.932 -16.587 454 HD11 LEU 53 HD11 LEU 53 -7.848 -4.780 -18.170 455 HD12 LEU 53 HD12 LEU 53 -7.955 -6.279 -17.247 456 HD13 LEU 53 HD13 LEU 53 -6.694 -6.082 -18.465 457 HD21 LEU 53 HD21 LEU 53 -5.735 -5.573 -14.692 458 HD22 LEU 53 HD22 LEU 53 -6.927 -6.646 -15.426 459 HD23 LEU 53 HD23 LEU 53 -7.422 -5.070 -14.806 460 H VAL 54 H VAL 54 -4.254 -1.931 -18.049 461 HA VAL 54 HA VAL 54 -1.509 -1.958 -17.040 462 HB VAL 54 HB VAL 54 -2.177 0.058 -19.143 463 HG11 VAL 54 HG11 VAL 54 0.224 -1.014 -17.790 464 HG12 VAL 54 HG12 VAL 54 0.403 -0.563 -19.487 465 HG13 VAL 54 HG13 VAL 54 -0.149 0.629 -18.310 466 HG21 VAL 54 HG21 VAL 54 -1.118 -1.481 -20.823 467 HG22 VAL 54 HG22 VAL 54 -1.312 -2.783 -19.650 468 HG23 VAL 54 HG23 VAL 54 -2.731 -1.954 -20.290 469 H GLU 55 H GLU 55 -0.856 0.122 -16.113 470 HA GLU 55 HA GLU 55 -3.076 1.334 -14.700 471 HB2 GLU 55 HB2 GLU 55 -1.209 2.585 -13.518 472 HB3 GLU 55 HB3 GLU 55 -1.219 0.838 -13.324 473 HG2 GLU 55 HG2 GLU 55 0.786 0.622 -14.255 474 HG3 GLU 55 HG3 GLU 55 0.365 1.679 -15.602 475 H SER 56 H SER 56 -4.176 2.801 -15.859 476 HA SER 56 HA SER 56 -2.763 5.186 -16.727 477 HB2 SER 56 HB2 SER 56 -3.110 3.335 -18.639 478 HB3 SER 56 HB3 SER 56 -4.684 4.125 -18.735 479 HG SER 56 HG SER 56 -2.331 5.664 -18.693 480 H ASP 57 H ASP 57 -4.359 6.886 -17.479 481 HA ASP 57 HA ASP 57 -6.721 6.762 -15.738 482 HB2 ASP 57 HB2 ASP 57 -4.760 8.765 -16.198 483 HB3 ASP 57 HB3 ASP 57 -6.295 9.382 -16.801 484 H ASP 58 H ASP 58 -6.243 5.831 -18.659 485 HA ASP 58 HA ASP 58 -7.774 7.375 -20.402 486 HB2 ASP 58 HB2 ASP 58 -6.415 5.588 -21.262 487 HB3 ASP 58 HB3 ASP 58 -7.305 4.391 -20.324 488 H ALA 59 H ALA 59 -9.934 7.131 -21.157 489 HA ALA 59 HA ALA 59 -11.798 6.535 -19.017 490 HB1 ALA 59 HB1 ALA 59 -13.444 7.335 -20.897 491 HB2 ALA 59 HB2 ALA 59 -12.435 8.491 -20.028 492 HB3 ALA 59 HB3 ALA 59 -11.963 7.943 -21.637 493 H ALA 60 H ALA 60 -13.537 5.084 -19.173 494 HA ALA 60 HA ALA 60 -13.322 3.073 -21.315 495 HB1 ALA 60 HB1 ALA 60 -12.766 1.520 -19.834 496 HB2 ALA 60 HB2 ALA 60 -12.861 2.698 -18.525 497 HB3 ALA 60 HB3 ALA 60 -14.296 1.788 -18.999 498 H GLU 61 H GLU 61 -15.305 1.783 -21.610 499 HA GLU 61 HA GLU 61 -17.563 3.415 -21.922 500 HB2 GLU 61 HB2 GLU 61 -17.370 0.398 -21.890 501 HB3 GLU 61 HB3 GLU 61 -18.761 1.312 -22.459 502 HG2 GLU 61 HG2 GLU 61 -16.037 1.090 -23.677 503 HG3 GLU 61 HG3 GLU 61 -17.606 0.732 -24.395 504 H ALA 62 H ALA 62 -16.413 1.660 -19.215 505 HA ALA 62 HA ALA 62 -18.658 2.574 -17.628 506 HB1 ALA 62 HB1 ALA 62 -18.165 -0.312 -18.206 507 HB2 ALA 62 HB2 ALA 62 -18.802 0.166 -16.632 508 HB3 ALA 62 HB3 ALA 62 -19.688 0.571 -18.103 509 H THR 63 H THR 63 -18.266 2.443 -15.343 510 HA THR 63 HA THR 63 -15.446 1.962 -14.638 511 HB THR 63 HB THR 63 -17.093 4.156 -13.390 512 HG1 THR 63 HG1 THR 63 -16.882 4.699 -15.566 513 HG21 THR 63 HG21 THR 63 -15.053 3.254 -12.225 514 HG22 THR 63 HG22 THR 63 -14.998 4.978 -12.592 515 HG23 THR 63 HG23 THR 63 -14.102 3.834 -13.591 516 H LEU 64 H LEU 64 -15.153 0.635 -12.968 517 HA LEU 64 HA LEU 64 -17.453 0.087 -11.210 518 HB2 LEU 64 HB2 LEU 64 -15.511 -1.657 -12.558 519 HB3 LEU 64 HB3 LEU 64 -15.821 -2.059 -10.870 520 HG LEU 64 HG LEU 64 -18.109 -1.694 -12.762 521 HD11 LEU 64 HD11 LEU 64 -17.878 -3.705 -13.766 522 HD12 LEU 64 HD12 LEU 64 -17.056 -4.427 -12.383 523 HD13 LEU 64 HD13 LEU 64 -16.166 -3.383 -13.491 524 HD21 LEU 64 HD21 LEU 64 -18.384 -1.926 -10.271 525 HD22 LEU 64 HD22 LEU 64 -17.755 -3.566 -10.431 526 HD23 LEU 64 HD23 LEU 64 -19.254 -3.112 -11.244 527 H THR 65 H THR 65 -17.166 1.128 -9.348 528 HA THR 65 HA THR 65 -14.466 1.357 -8.228 529 HB THR 65 HB THR 65 -17.005 2.754 -7.363 530 HG1 THR 65 HG1 THR 65 -16.090 4.545 -8.445 531 HG21 THR 65 HG21 THR 65 -14.162 2.858 -6.435 532 HG22 THR 65 HG22 THR 65 -15.648 2.820 -5.486 533 HG23 THR 65 HG23 THR 65 -15.175 4.297 -6.327 534 H MET 66 H MET 66 -13.844 0.136 -6.571 535 HA MET 66 HA MET 66 -15.686 -0.720 -4.534 536 HB2 MET 66 HB2 MET 66 -14.867 -2.532 -6.702 537 HB3 MET 66 HB3 MET 66 -14.637 -3.181 -5.084 538 HG2 MET 66 HG2 MET 66 -17.041 -2.541 -4.631 539 HG3 MET 66 HG3 MET 66 -17.188 -2.257 -6.364 540 HE1 MET 66 HE1 MET 66 -17.179 -5.375 -8.095 541 HE2 MET 66 HE2 MET 66 -16.421 -3.783 -8.041 542 HE3 MET 66 HE3 MET 66 -15.488 -5.219 -7.615 543 H GLU 67 H GLU 67 -14.645 -1.531 -2.675 544 HA GLU 67 HA GLU 67 -12.044 -0.503 -2.234 545 HB2 GLU 67 HB2 GLU 67 -13.854 -2.283 -0.613 546 HB3 GLU 67 HB3 GLU 67 -12.251 -1.828 -0.050 547 HG2 GLU 67 HG2 GLU 67 -12.914 0.212 0.545 548 HG3 GLU 67 HG3 GLU 67 -13.841 0.444 -0.936 549 H ASP 68 H ASP 68 -10.290 -1.906 -1.220 550 HA ASP 68 HA ASP 68 -9.421 -3.789 -3.147 551 HB2 ASP 68 HB2 ASP 68 -7.956 -2.341 -1.667 552 HB3 ASP 68 HB3 ASP 68 -8.308 -3.467 -0.359 553 H ASP 69 H ASP 69 -10.553 -4.161 0.203 554 HA ASP 69 HA ASP 69 -10.350 -6.984 0.242 555 HB2 ASP 69 HB2 ASP 69 -11.456 -4.884 1.985 556 HB3 ASP 69 HB3 ASP 69 -12.268 -6.443 2.110 557 H ILE 70 H ILE 70 -12.817 -4.773 -0.839 558 HA ILE 70 HA ILE 70 -14.888 -6.760 -1.006 559 HB ILE 70 HB ILE 70 -14.850 -4.096 -2.415 560 HG12 ILE 70 HG12 ILE 70 -14.348 -4.022 0.106 561 HG13 ILE 70 HG13 ILE 70 -15.676 -3.030 -0.486 562 HG21 ILE 70 HG21 ILE 70 -16.988 -6.037 -1.602 563 HG22 ILE 70 HG22 ILE 70 -17.353 -4.347 -1.943 564 HG23 ILE 70 HG23 ILE 70 -16.650 -5.367 -3.198 565 HD11 ILE 70 HD11 ILE 70 -16.174 -5.774 0.589 566 HD12 ILE 70 HD12 ILE 70 -16.009 -4.386 1.664 567 HD13 ILE 70 HD13 ILE 70 -17.285 -4.412 0.447 568 H MET 71 H MET 71 -12.923 -4.990 -3.395 569 HA MET 71 HA MET 71 -13.884 -6.197 -5.696 570 HB2 MET 71 HB2 MET 71 -12.349 -4.256 -5.656 571 HB3 MET 71 HB3 MET 71 -11.039 -5.321 -5.164 572 HG2 MET 71 HG2 MET 71 -10.607 -5.332 -7.367 573 HG3 MET 71 HG3 MET 71 -11.832 -6.599 -7.375 574 HE1 MET 71 HE1 MET 71 -11.492 -2.633 -9.067 575 HE2 MET 71 HE2 MET 71 -10.407 -4.010 -8.875 576 HE3 MET 71 HE3 MET 71 -11.472 -3.915 -10.278 577 H PHE 72 H PHE 72 -11.699 -7.429 -3.285 578 HA PHE 72 HA PHE 72 -10.657 -9.576 -4.844 579 HB2 PHE 72 HB2 PHE 72 -9.866 -8.466 -2.541 580 HB3 PHE 72 HB3 PHE 72 -10.784 -9.816 -1.883 581 HD1 PHE 72 HD2 PHE 72 -8.338 -9.263 -4.652 582 HD2 PHE 72 HD1 PHE 72 -9.550 -11.664 -1.354 583 HE1 PHE 72 HE2 PHE 72 -6.416 -10.750 -5.033 584 HE2 PHE 72 HE1 PHE 72 -7.629 -13.155 -1.728 585 HZ PHE 72 HZ PHE 72 -6.059 -12.699 -3.570 586 H ALA 73 H ALA 73 -13.361 -9.214 -2.616 587 HA ALA 73 HA ALA 73 -14.061 -11.910 -2.348 588 HB1 ALA 73 HB1 ALA 73 -16.155 -9.782 -2.424 589 HB2 ALA 73 HB2 ALA 73 -16.011 -11.179 -1.356 590 HB3 ALA 73 HB3 ALA 73 -14.951 -9.787 -1.134 591 H ILE 74 H ILE 74 -15.243 -9.472 -4.657 592 HA ILE 74 HA ILE 74 -16.726 -11.485 -6.125 593 HB ILE 74 HB ILE 74 -16.304 -8.619 -6.950 594 HG12 ILE 74 HG12 ILE 74 -18.774 -8.636 -5.816 595 HG13 ILE 74 HG13 ILE 74 -17.924 -9.756 -4.757 596 HG21 ILE 74 HG21 ILE 74 -18.499 -10.604 -7.532 597 HG22 ILE 74 HG22 ILE 74 -18.439 -8.937 -8.103 598 HG23 ILE 74 HG23 ILE 74 -17.230 -10.099 -8.648 599 HD11 ILE 74 HD11 ILE 74 -17.897 -6.951 -4.699 600 HD12 ILE 74 HD12 ILE 74 -16.971 -8.070 -3.698 601 HD13 ILE 74 HD13 ILE 74 -16.288 -7.464 -5.207 602 H GLY 75 H GLY 75 -13.606 -10.096 -6.180 603 HA2 GLY 75 HA2 GLY 75 -13.076 -10.367 -8.974 604 HA3 GLY 75 HA3 GLY 75 -11.879 -10.157 -7.704 605 H THR 76 H THR 76 -12.676 -12.474 -6.184 606 HA THR 76 HA THR 76 -11.434 -14.516 -7.877 607 HB THR 76 HB THR 76 -10.339 -14.073 -5.729 608 HG1 THR 76 HG1 THR 76 -10.600 -16.297 -6.694 609 HG21 THR 76 HG21 THR 76 -11.444 -13.827 -3.803 610 HG22 THR 76 HG22 THR 76 -12.299 -15.354 -4.024 611 HG23 THR 76 HG23 THR 76 -12.934 -13.874 -4.743 612 H GLY 77 H GLY 77 -14.457 -13.589 -7.294 613 HA2 GLY 77 HA2 GLY 77 -16.409 -14.734 -7.863 614 HA3 GLY 77 HA3 GLY 77 -15.513 -16.244 -7.801 615 H ALA 78 H ALA 78 -14.687 -14.763 -5.037 616 HA ALA 78 HA ALA 78 -15.954 -16.493 -3.316 617 HB1 ALA 78 HB1 ALA 78 -15.108 -15.234 -1.575 618 HB2 ALA 78 HB2 ALA 78 -14.050 -14.771 -2.909 619 HB3 ALA 78 HB3 ALA 78 -15.366 -13.705 -2.416 620 H LEU 79 H LEU 79 -16.839 -13.043 -3.495 621 HA LEU 79 HA LEU 79 -19.570 -13.780 -2.723 622 HB2 LEU 79 HB2 LEU 79 -17.885 -11.357 -2.407 623 HB3 LEU 79 HB3 LEU 79 -19.627 -11.129 -2.556 624 HG LEU 79 HG LEU 79 -18.421 -12.960 -0.497 625 HD11 LEU 79 HD11 LEU 79 -17.880 -10.291 -0.563 626 HD12 LEU 79 HD12 LEU 79 -17.938 -11.278 0.896 627 HD13 LEU 79 HD13 LEU 79 -19.349 -10.339 0.411 628 HD21 LEU 79 HD21 LEU 79 -20.625 -12.267 0.630 629 HD22 LEU 79 HD22 LEU 79 -20.697 -13.411 -0.711 630 HD23 LEU 79 HD23 LEU 79 -21.106 -11.715 -0.975 631 HA PRO 80 HA PRO 80 -21.139 -12.931 -6.747 632 HB2 PRO 80 HB2 PRO 80 -23.711 -12.353 -6.097 633 HB3 PRO 80 HB3 PRO 80 -23.057 -13.994 -6.060 634 HG2 PRO 80 HG2 PRO 80 -23.472 -12.070 -3.805 635 HG3 PRO 80 HG3 PRO 80 -23.812 -13.809 -3.869 636 HD2 PRO 80 HD2 PRO 80 -21.600 -12.799 -2.677 637 HD3 PRO 80 HD3 PRO 80 -21.612 -14.380 -3.484 638 H ALA 81 H ALA 81 -21.036 -11.188 -8.015 639 HA ALA 81 HA ALA 81 -20.635 -8.596 -7.031 640 HB1 ALA 81 HB1 ALA 81 -20.255 -9.797 -9.425 641 HB2 ALA 81 HB2 ALA 81 -21.656 -8.785 -9.780 642 HB3 ALA 81 HB3 ALA 81 -20.175 -8.054 -9.164 643 H LYS 82 H LYS 82 -23.534 -10.321 -7.826 644 HA LYS 82 HA LYS 82 -25.261 -8.114 -8.201 645 HB2 LYS 82 HB2 LYS 82 -25.655 -10.605 -8.743 646 HB3 LYS 82 HB3 LYS 82 -26.131 -10.757 -7.057 647 HG2 LYS 82 HG2 LYS 82 -27.855 -9.028 -7.422 648 HG3 LYS 82 HG3 LYS 82 -27.411 -8.988 -9.130 649 HD2 LYS 82 HD2 LYS 82 -29.189 -10.451 -9.163 650 HD3 LYS 82 HD3 LYS 82 -27.832 -11.567 -8.996 651 HE2 LYS 82 HE2 LYS 82 -28.481 -10.868 -6.388 652 HE3 LYS 82 HE3 LYS 82 -30.040 -11.045 -7.193 653 HZ1 LYS 82 HZ1 LYS 82 -28.372 -13.060 -6.261 654 HZ2 LYS 82 HZ2 LYS 82 -28.344 -13.164 -7.949 655 HZ3 LYS 82 HZ3 LYS 82 -29.818 -13.232 -7.121 656 H GLU 83 H GLU 83 -24.844 -10.236 -5.360 657 HA GLU 83 HA GLU 83 -26.465 -8.814 -3.609 658 HB2 GLU 83 HB2 GLU 83 -23.976 -10.414 -2.992 659 HB3 GLU 83 HB3 GLU 83 -25.158 -9.895 -1.800 660 HG2 GLU 83 HG2 GLU 83 -26.024 -11.523 -4.145 661 HG3 GLU 83 HG3 GLU 83 -25.255 -12.299 -2.762 662 H ALA 84 H ALA 84 -22.937 -8.562 -4.030 663 HA ALA 84 HA ALA 84 -22.387 -6.595 -2.186 664 HB1 ALA 84 HB1 ALA 84 -20.470 -7.397 -3.115 665 HB2 ALA 84 HB2 ALA 84 -21.141 -7.430 -4.746 666 HB3 ALA 84 HB3 ALA 84 -20.619 -5.902 -4.038 667 H MET 85 H MET 85 -23.624 -6.224 -5.478 668 HA MET 85 HA MET 85 -23.507 -3.383 -5.499 669 HB2 MET 85 HB2 MET 85 -24.294 -5.478 -7.296 670 HB3 MET 85 HB3 MET 85 -25.548 -4.245 -7.258 671 HG2 MET 85 HG2 MET 85 -23.359 -2.693 -7.467 672 HG3 MET 85 HG3 MET 85 -22.809 -4.134 -8.319 673 HE1 MET 85 HE1 MET 85 -24.394 -0.708 -9.785 674 HE2 MET 85 HE2 MET 85 -25.974 -1.145 -9.134 675 HE3 MET 85 HE3 MET 85 -24.560 -1.124 -8.079 676 H ALA 86 H ALA 86 -25.931 -5.731 -4.533 677 HA ALA 86 HA ALA 86 -28.024 -3.793 -4.207 678 HB1 ALA 86 HB1 ALA 86 -28.299 -6.304 -2.729 679 HB2 ALA 86 HB2 ALA 86 -29.369 -5.562 -3.919 680 HB3 ALA 86 HB3 ALA 86 -27.979 -6.509 -4.451 681 H GLN 87 H GLN 87 -25.386 -4.900 -2.308 682 HA GLN 87 HA GLN 87 -26.560 -4.019 0.203 683 HB2 GLN 87 HB2 GLN 87 -23.762 -5.026 -0.337 684 HB3 GLN 87 HB3 GLN 87 -24.523 -4.832 1.237 685 HG2 GLN 87 HG2 GLN 87 -26.215 -6.487 -0.289 686 HG3 GLN 87 HG3 GLN 87 -24.568 -7.073 -0.523 687 HE21 GLN 87 HE21 GLN 87 -24.586 -8.869 0.691 688 HE22 GLN 87 HE22 GLN 87 -24.899 -8.906 2.389 689 H ASP 88 H ASP 88 -25.556 -2.341 -2.265 690 HA ASP 88 HA ASP 88 -24.666 -0.275 -2.610 691 HB2 ASP 88 HB2 ASP 88 -26.143 -0.127 -0.277 692 HB3 ASP 88 HB3 ASP 88 -24.594 0.573 0.185 693 H LYS 89 H LYS 89 -22.936 -2.580 -1.747 694 HA LYS 89 HA LYS 89 -20.696 -1.184 -0.490 695 HB2 LYS 89 HB2 LYS 89 -21.092 -4.096 -1.200 696 HB3 LYS 89 HB3 LYS 89 -19.649 -3.447 -0.432 697 HG2 LYS 89 HG2 LYS 89 -20.972 -2.753 1.493 698 HG3 LYS 89 HG3 LYS 89 -22.431 -3.378 0.721 699 HD2 LYS 89 HD2 LYS 89 -21.763 -5.590 0.965 700 HD3 LYS 89 HD3 LYS 89 -20.061 -5.158 1.150 701 HE2 LYS 89 HE2 LYS 89 -21.453 -3.890 3.245 702 HE3 LYS 89 HE3 LYS 89 -22.065 -5.541 3.162 703 HZ1 LYS 89 HZ1 LYS 89 -19.428 -5.933 2.933 704 HZ2 LYS 89 HZ2 LYS 89 -20.268 -5.988 4.399 705 HZ3 LYS 89 HZ3 LYS 89 -19.453 -4.578 3.945 706 H MET 90 H MET 90 -21.849 -1.461 -3.512 707 HA MET 90 HA MET 90 -19.328 -0.788 -4.703 708 HB2 MET 90 HB2 MET 90 -19.140 -2.585 -6.257 709 HB3 MET 90 HB3 MET 90 -19.311 -3.306 -4.662 710 HG2 MET 90 HG2 MET 90 -21.632 -3.799 -5.088 711 HG3 MET 90 HG3 MET 90 -21.550 -2.973 -6.643 712 HE1 MET 90 HE1 MET 90 -18.943 -4.475 -8.417 713 HE2 MET 90 HE2 MET 90 -20.412 -5.179 -9.094 714 HE3 MET 90 HE3 MET 90 -20.424 -3.520 -8.494 715 H GLU 91 H GLU 91 -19.552 0.244 -6.687 716 HA GLU 91 HA GLU 91 -22.303 0.548 -7.687 717 HB2 GLU 91 HB2 GLU 91 -21.629 2.519 -6.336 718 HB3 GLU 91 HB3 GLU 91 -20.273 2.772 -7.426 719 HG2 GLU 91 HG2 GLU 91 -21.621 3.471 -9.160 720 HG3 GLU 91 HG3 GLU 91 -23.049 2.667 -8.511 721 H VAL 92 H VAL 92 -22.403 1.380 -9.926 722 HA VAL 92 HA VAL 92 -19.998 0.889 -11.518 723 HB VAL 92 HB VAL 92 -22.619 -0.369 -12.306 724 HG11 VAL 92 HG11 VAL 92 -19.825 -0.386 -13.344 725 HG12 VAL 92 HG12 VAL 92 -20.839 -1.811 -13.584 726 HG13 VAL 92 HG13 VAL 92 -21.351 -0.245 -14.216 727 HG21 VAL 92 HG21 VAL 92 -21.280 -2.522 -11.636 728 HG22 VAL 92 HG22 VAL 92 -20.454 -1.414 -10.540 729 HG23 VAL 92 HG23 VAL 92 -22.201 -1.627 -10.427 730 H ASP 93 H ASP 93 -19.875 2.079 -13.378 731 HA ASP 93 HA ASP 93 -22.183 3.789 -14.027 732 HB2 ASP 93 HB2 ASP 93 -19.971 4.768 -12.830 733 HB3 ASP 93 HB3 ASP 93 -19.478 4.895 -14.516 734 H GLY 94 H GLY 94 -22.058 4.719 -16.250 735 HA2 GLY 94 HA2 GLY 94 -21.226 4.603 -18.490 736 HA3 GLY 94 HA3 GLY 94 -20.518 3.040 -18.109 737 H GLN 95 H GLN 95 -21.447 1.614 -19.431 738 HA GLN 95 HA GLN 95 -24.279 1.836 -20.064 739 HB2 GLN 95 HB2 GLN 95 -21.953 0.731 -21.353 740 HB3 GLN 95 HB3 GLN 95 -23.213 -0.491 -21.239 741 HG2 GLN 95 HG2 GLN 95 -23.147 0.981 -23.324 742 HG3 GLN 95 HG3 GLN 95 -24.701 0.739 -22.527 743 HE21 GLN 95 HE21 GLN 95 -25.794 2.459 -21.788 744 HE22 GLN 95 HE22 GLN 95 -25.225 4.089 -21.854 745 H VAL 96 H VAL 96 -25.483 1.145 -18.372 746 HA VAL 96 HA VAL 96 -24.870 -0.873 -16.564 747 HB VAL 96 HB VAL 96 -27.598 0.019 -17.506 748 HG11 VAL 96 HG11 VAL 96 -28.115 -1.942 -16.434 749 HG12 VAL 96 HG12 VAL 96 -26.721 -1.848 -15.356 750 HG13 VAL 96 HG13 VAL 96 -28.126 -0.819 -15.074 751 HG21 VAL 96 HG21 VAL 96 -25.623 1.091 -15.590 752 HG22 VAL 96 HG22 VAL 96 -26.843 1.927 -16.549 753 HG23 VAL 96 HG23 VAL 96 -27.306 1.095 -15.065 754 H GLU 97 H GLU 97 -25.959 -1.093 -19.829 755 HA GLU 97 HA GLU 97 -27.043 -3.731 -19.675 756 HB2 GLU 97 HB2 GLU 97 -27.168 -3.650 -22.061 757 HB3 GLU 97 HB3 GLU 97 -27.596 -2.056 -21.456 758 HG2 GLU 97 HG2 GLU 97 -25.222 -1.365 -21.899 759 HG3 GLU 97 HG3 GLU 97 -25.011 -2.906 -22.729 760 H LEU 98 H LEU 98 -23.875 -2.375 -20.322 761 HA LEU 98 HA LEU 98 -22.726 -4.853 -21.202 762 HB2 LEU 98 HB2 LEU 98 -21.814 -2.094 -20.742 763 HB3 LEU 98 HB3 LEU 98 -20.594 -3.341 -20.491 764 HG LEU 98 HG LEU 98 -22.179 -3.289 -23.028 765 HD11 LEU 98 HD11 LEU 98 -19.837 -2.005 -23.650 766 HD12 LEU 98 HD12 LEU 98 -20.297 -1.258 -22.121 767 HD13 LEU 98 HD13 LEU 98 -21.418 -1.241 -23.481 768 HD21 LEU 98 HD21 LEU 98 -19.317 -3.909 -23.015 769 HD22 LEU 98 HD22 LEU 98 -20.666 -4.778 -23.748 770 HD23 LEU 98 HD23 LEU 98 -20.301 -4.997 -22.036 771 H ILE 99 H ILE 99 -23.053 -3.152 -18.166 772 HA ILE 99 HA ILE 99 -21.122 -4.439 -16.636 773 HB ILE 99 HB ILE 99 -23.854 -3.670 -15.616 774 HG12 ILE 99 HG12 ILE 99 -23.137 -1.738 -16.771 775 HG13 ILE 99 HG13 ILE 99 -22.674 -1.457 -15.096 776 HG21 ILE 99 HG21 ILE 99 -21.147 -3.801 -14.294 777 HG22 ILE 99 HG22 ILE 99 -22.626 -3.220 -13.531 778 HG23 ILE 99 HG23 ILE 99 -22.497 -4.906 -14.034 779 HD11 ILE 99 HD11 ILE 99 -21.018 -1.759 -17.488 780 HD12 ILE 99 HD12 ILE 99 -20.704 -0.892 -15.984 781 HD13 ILE 99 HD13 ILE 99 -20.436 -2.632 -16.071 782 H PHE 100 H PHE 100 -24.525 -5.358 -17.140 783 HA PHE 100 HA PHE 100 -24.416 -7.717 -15.600 784 HB2 PHE 100 HB2 PHE 100 -26.288 -6.546 -17.585 785 HB3 PHE 100 HB3 PHE 100 -26.415 -8.279 -17.304 786 HD1 PHE 100 HD2 PHE 100 -25.712 -5.423 -15.015 787 HD2 PHE 100 HD1 PHE 100 -28.268 -8.678 -16.006 788 HE1 PHE 100 HE2 PHE 100 -27.040 -4.992 -12.989 789 HE2 PHE 100 HE1 PHE 100 -29.601 -8.252 -13.982 790 HZ PHE 100 HZ PHE 100 -28.987 -6.408 -12.470 791 H LEU 101 H LEU 101 -23.598 -7.013 -18.920 792 HA LEU 101 HA LEU 101 -23.530 -9.664 -19.889 793 HB2 LEU 101 HB2 LEU 101 -22.323 -7.073 -20.751 794 HB3 LEU 101 HB3 LEU 101 -21.811 -8.571 -21.527 795 HG LEU 101 HG LEU 101 -24.723 -7.923 -21.380 796 HD11 LEU 101 HD11 LEU 101 -24.431 -6.012 -22.485 797 HD12 LEU 101 HD12 LEU 101 -23.913 -6.999 -23.851 798 HD13 LEU 101 HD13 LEU 101 -22.716 -6.329 -22.743 799 HD21 LEU 101 HD21 LEU 101 -24.929 -9.468 -23.027 800 HD22 LEU 101 HD22 LEU 101 -23.433 -10.066 -22.310 801 HD23 LEU 101 HD23 LEU 101 -23.377 -9.061 -23.759 802 H LEU 102 H LEU 102 -21.432 -7.911 -17.824 803 HA LEU 102 HA LEU 102 -19.129 -9.599 -18.337 804 HB2 LEU 102 HB2 LEU 102 -19.690 -7.268 -16.549 805 HB3 LEU 102 HB3 LEU 102 -18.276 -8.281 -16.265 806 HG LEU 102 HG LEU 102 -18.750 -7.032 -18.948 807 HD11 LEU 102 HD11 LEU 102 -18.306 -5.616 -16.502 808 HD12 LEU 102 HD12 LEU 102 -18.469 -4.988 -18.142 809 HD13 LEU 102 HD13 LEU 102 -16.885 -5.475 -17.538 810 HD21 LEU 102 HD21 LEU 102 -17.044 -8.689 -18.914 811 HD22 LEU 102 HD22 LEU 102 -16.345 -8.030 -17.435 812 HD23 LEU 102 HD23 LEU 102 -16.242 -7.119 -18.942 813 H GLU 103 H GLU 103 -21.631 -9.193 -15.898 814 HA GLU 103 HA GLU 103 -20.828 -10.553 -13.744 815 HB2 GLU 103 HB2 GLU 103 -23.379 -10.233 -15.095 816 HB3 GLU 103 HB3 GLU 103 -23.291 -11.763 -14.233 817 HG2 GLU 103 HG2 GLU 103 -22.822 -10.650 -12.170 818 HG3 GLU 103 HG3 GLU 103 -22.672 -9.096 -12.989 819 HA PRO 104 HA PRO 104 -21.527 -14.898 -15.743 820 HB2 PRO 104 HB2 PRO 104 -21.934 -14.980 -18.426 821 HB3 PRO 104 HB3 PRO 104 -23.253 -14.828 -17.258 822 HG2 PRO 104 HG2 PRO 104 -21.911 -12.705 -18.887 823 HG3 PRO 104 HG3 PRO 104 -23.637 -12.935 -18.553 824 HD2 PRO 104 HD2 PRO 104 -22.124 -11.123 -17.225 825 HD3 PRO 104 HD3 PRO 104 -23.490 -11.966 -16.466 826 H PHE 105 H PHE 105 -19.885 -12.457 -17.684 827 HA PHE 105 HA PHE 105 -18.000 -14.083 -18.949 828 HB2 PHE 105 HB2 PHE 105 -18.551 -11.498 -19.148 829 HB3 PHE 105 HB3 PHE 105 -17.201 -11.358 -18.026 830 HD1 PHE 105 HD2 PHE 105 -17.987 -13.281 -21.132 831 HD2 PHE 105 HD1 PHE 105 -15.183 -10.899 -18.992 832 HE1 PHE 105 HE2 PHE 105 -16.413 -13.449 -23.015 833 HE2 PHE 105 HE1 PHE 105 -13.604 -11.063 -20.872 834 HZ PHE 105 HZ PHE 105 -14.217 -12.340 -22.886 835 H ILE 106 H ILE 106 -18.137 -12.842 -15.694 836 HA ILE 106 HA ILE 106 -15.473 -13.142 -14.923 837 HB ILE 106 HB ILE 106 -17.928 -13.586 -13.220 838 HG12 ILE 106 HG12 ILE 106 -16.289 -11.067 -13.517 839 HG13 ILE 106 HG13 ILE 106 -17.758 -11.370 -14.438 840 HG21 ILE 106 HG21 ILE 106 -16.130 -12.631 -11.508 841 HG22 ILE 106 HG22 ILE 106 -16.301 -14.355 -11.834 842 HG23 ILE 106 HG23 ILE 106 -15.029 -13.429 -12.631 843 HD11 ILE 106 HD11 ILE 106 -18.557 -11.836 -11.860 844 HD12 ILE 106 HD12 ILE 106 -17.421 -10.497 -11.688 845 HD13 ILE 106 HD13 ILE 106 -18.806 -10.346 -12.769 846 H ALA 107 H ALA 107 -17.954 -15.508 -15.460 847 HA ALA 107 HA ALA 107 -16.885 -17.645 -13.971 848 HB1 ALA 107 HB1 ALA 107 -18.543 -18.897 -14.872 849 HB2 ALA 107 HB2 ALA 107 -19.169 -17.309 -15.317 850 HB3 ALA 107 HB3 ALA 107 -18.283 -18.271 -16.500 851 H SER 108 H SER 108 -15.988 -16.252 -17.010 852 HA SER 108 HA SER 108 -14.732 -18.330 -18.314 853 HB2 SER 108 HB2 SER 108 -14.872 -16.259 -19.453 854 HB3 SER 108 HB3 SER 108 -14.054 -15.396 -18.151 855 HG SER 108 HG SER 108 -12.632 -15.758 -19.873 856 H LEU 109 H LEU 109 -12.982 -15.950 -16.315 857 HA LEU 109 HA LEU 109 -10.674 -17.577 -16.079 858 HB2 LEU 109 HB2 LEU 109 -10.074 -15.931 -14.251 859 HB3 LEU 109 HB3 LEU 109 -10.338 -15.270 -15.863 860 HG LEU 109 HG LEU 109 -12.778 -15.197 -14.336 861 HD11 LEU 109 HD11 LEU 109 -11.560 -15.060 -12.335 862 HD12 LEU 109 HD12 LEU 109 -11.928 -13.390 -12.763 863 HD13 LEU 109 HD13 LEU 109 -10.317 -14.042 -13.061 864 HD21 LEU 109 HD21 LEU 109 -11.855 -13.853 -16.385 865 HD22 LEU 109 HD22 LEU 109 -11.200 -12.796 -15.134 866 HD23 LEU 109 HD23 LEU 109 -12.938 -13.086 -15.224 867 H LYS 110 H LYS 110 -11.277 -19.590 -15.286 868 HA LYS 110 HA LYS 110 -12.876 -20.115 -13.075 869 HB2 LYS 110 HB2 LYS 110 -11.805 -21.718 -14.828 870 HB3 LYS 110 HB3 LYS 110 -10.469 -21.800 -13.687 871 HG2 LYS 110 HG2 LYS 110 -12.227 -22.427 -11.945 872 HG3 LYS 110 HG3 LYS 110 -13.303 -22.702 -13.318 873 HD2 LYS 110 HD2 LYS 110 -10.639 -23.942 -13.525 874 HD3 LYS 110 HD3 LYS 110 -11.682 -24.590 -12.256 875 HE2 LYS 110 HE2 LYS 110 -13.188 -24.228 -14.670 876 HE3 LYS 110 HE3 LYS 110 -11.737 -25.170 -15.009 877 HZ1 LYS 110 HZ1 LYS 110 -13.602 -26.578 -14.377 878 HZ2 LYS 110 HZ2 LYS 110 -13.728 -25.781 -12.891 879 HZ3 LYS 110 HZ3 LYS 110 -12.349 -26.695 -13.246 Start of MODEL 7 1 H1 MET 1 H MET 1 4.195 -0.056 -1.331 2 HA MET 1 HA MET 1 1.491 -0.268 -0.406 3 HB2 MET 1 HB2 MET 1 2.828 1.675 -1.695 4 HB3 MET 1 HB3 MET 1 2.051 0.905 -3.073 5 HG2 MET 1 HG2 MET 1 0.228 1.349 -0.854 6 HG3 MET 1 HG3 MET 1 0.957 2.836 -1.456 7 HE1 MET 1 HE1 MET 1 -0.995 3.806 -1.912 8 HE2 MET 1 HE2 MET 1 -1.658 3.806 -3.546 9 HE3 MET 1 HE3 MET 1 -2.427 2.845 -2.282 10 H SER 2 H SER 2 0.690 -2.307 -0.669 11 HA SER 2 HA SER 2 0.366 -3.212 -3.448 12 HB2 SER 2 HB2 SER 2 0.392 -5.570 -2.041 13 HB3 SER 2 HB3 SER 2 1.759 -4.920 -2.946 14 HG SER 2 HG SER 2 2.496 -5.319 -0.907 15 H LEU 3 H LEU 3 -1.600 -4.102 -3.959 16 HA LEU 3 HA LEU 3 -3.625 -4.095 -1.818 17 HB2 LEU 3 HB2 LEU 3 -3.726 -3.107 -4.635 18 HB3 LEU 3 HB3 LEU 3 -5.201 -3.670 -3.853 19 HG LEU 3 HG LEU 3 -3.535 -1.598 -2.496 20 HD11 LEU 3 HD11 LEU 3 -3.657 -0.581 -4.600 21 HD12 LEU 3 HD12 LEU 3 -5.018 0.092 -3.704 22 HD13 LEU 3 HD13 LEU 3 -5.290 -1.180 -4.894 23 HD21 LEU 3 HD21 LEU 3 -5.472 -2.651 -1.378 24 HD22 LEU 3 HD22 LEU 3 -6.513 -2.044 -2.666 25 HD23 LEU 3 HD23 LEU 3 -5.669 -0.913 -1.606 26 H LYS 4 H LYS 4 -5.126 -5.743 -1.774 27 HA LYS 4 HA LYS 4 -4.327 -8.257 -2.725 28 HB2 LYS 4 HB2 LYS 4 -6.402 -7.202 -1.075 29 HB3 LYS 4 HB3 LYS 4 -7.134 -8.291 -2.246 30 HG2 LYS 4 HG2 LYS 4 -6.310 -10.101 -1.243 31 HG3 LYS 4 HG3 LYS 4 -4.714 -9.373 -1.040 32 HD2 LYS 4 HD2 LYS 4 -6.827 -8.250 0.671 33 HD3 LYS 4 HD3 LYS 4 -6.417 -9.936 0.997 34 HE2 LYS 4 HE2 LYS 4 -4.757 -9.106 2.246 35 HE3 LYS 4 HE3 LYS 4 -3.953 -8.773 0.713 36 HZ1 LYS 4 HZ1 LYS 4 -4.503 -6.926 2.585 37 HZ2 LYS 4 HZ2 LYS 4 -5.824 -6.740 1.545 38 HZ3 LYS 4 HZ3 LYS 4 -4.249 -6.583 0.948 39 H SER 5 H SER 5 -6.543 -5.864 -4.029 40 HA SER 5 HA SER 5 -7.851 -7.384 -5.948 41 HB2 SER 5 HB2 SER 5 -8.033 -5.194 -7.219 42 HB3 SER 5 HB3 SER 5 -8.603 -5.153 -5.551 43 HG SER 5 HG SER 5 -7.055 -3.809 -5.057 44 H ASP 6 H ASP 6 -4.591 -6.199 -5.883 45 HA ASP 6 HA ASP 6 -3.917 -6.224 -8.574 46 HB2 ASP 6 HB2 ASP 6 -2.541 -5.717 -6.327 47 HB3 ASP 6 HB3 ASP 6 -1.924 -7.331 -6.669 48 H GLU 7 H GLU 7 -4.226 -8.893 -6.306 49 HA GLU 7 HA GLU 7 -3.053 -10.890 -7.913 50 HB2 GLU 7 HB2 GLU 7 -4.253 -10.748 -5.377 51 HB3 GLU 7 HB3 GLU 7 -5.193 -11.930 -6.277 52 HG2 GLU 7 HG2 GLU 7 -2.473 -12.475 -6.785 53 HG3 GLU 7 HG3 GLU 7 -2.642 -12.223 -5.049 54 H VAL 8 H VAL 8 -6.453 -9.942 -7.468 55 HA VAL 8 HA VAL 8 -7.606 -11.804 -9.192 56 HB VAL 8 HB VAL 8 -8.477 -9.031 -8.402 57 HG11 VAL 8 HG11 VAL 8 -10.689 -9.611 -9.365 58 HG12 VAL 8 HG12 VAL 8 -9.425 -9.417 -10.580 59 HG13 VAL 8 HG13 VAL 8 -9.954 -11.032 -10.107 60 HG21 VAL 8 HG21 VAL 8 -9.684 -11.698 -7.700 61 HG22 VAL 8 HG22 VAL 8 -8.429 -10.925 -6.732 62 HG23 VAL 8 HG23 VAL 8 -9.990 -10.133 -6.946 63 H PHE 9 H PHE 9 -6.504 -8.490 -9.870 64 HA PHE 9 HA PHE 9 -7.198 -8.468 -12.592 65 HB2 PHE 9 HB2 PHE 9 -5.228 -6.902 -10.947 66 HB3 PHE 9 HB3 PHE 9 -5.337 -6.666 -12.688 67 HD1 PHE 9 HD1 PHE 9 -8.157 -6.788 -13.246 68 HD2 PHE 9 HD2 PHE 9 -6.143 -5.062 -9.918 69 HE1 PHE 9 HE1 PHE 9 -10.038 -5.236 -12.918 70 HE2 PHE 9 HE2 PHE 9 -8.021 -3.508 -9.583 71 HZ PHE 9 HZ PHE 9 -9.972 -3.594 -11.084 72 H ALA 10 H ALA 10 -4.385 -9.675 -10.898 73 HA ALA 10 HA ALA 10 -2.716 -9.998 -13.172 74 HB1 ALA 10 HB1 ALA 10 -2.671 -11.299 -10.456 75 HB2 ALA 10 HB2 ALA 10 -1.425 -11.536 -11.682 76 HB3 ALA 10 HB3 ALA 10 -1.707 -9.930 -11.010 77 H LYS 11 H LYS 11 -4.833 -12.233 -11.396 78 HA LYS 11 HA LYS 11 -4.293 -14.466 -13.068 79 HB2 LYS 11 HB2 LYS 11 -6.295 -15.461 -11.976 80 HB3 LYS 11 HB3 LYS 11 -5.117 -14.828 -10.833 81 HG2 LYS 11 HG2 LYS 11 -6.483 -12.803 -10.574 82 HG3 LYS 11 HG3 LYS 11 -7.677 -13.486 -11.679 83 HD2 LYS 11 HD2 LYS 11 -8.468 -13.915 -9.486 84 HD3 LYS 11 HD3 LYS 11 -7.841 -15.447 -10.098 85 HE2 LYS 11 HE2 LYS 11 -5.639 -14.314 -8.908 86 HE3 LYS 11 HE3 LYS 11 -6.954 -13.820 -7.843 87 HZ1 LYS 11 HZ1 LYS 11 -6.235 -15.869 -7.023 88 HZ2 LYS 11 HZ2 LYS 11 -6.111 -16.562 -8.561 89 HZ3 LYS 11 HZ3 LYS 11 -7.634 -16.247 -7.895 90 H ILE 12 H ILE 12 -6.910 -12.078 -12.962 91 HA ILE 12 HA ILE 12 -8.490 -13.190 -15.002 92 HB ILE 12 HB ILE 12 -8.233 -10.370 -13.980 93 HG12 ILE 12 HG12 ILE 12 -10.466 -12.400 -13.764 94 HG13 ILE 12 HG13 ILE 12 -9.262 -12.100 -12.516 95 HG21 ILE 12 HG21 ILE 12 -8.925 -9.970 -16.166 96 HG22 ILE 12 HG22 ILE 12 -9.907 -11.433 -16.225 97 HG23 ILE 12 HG23 ILE 12 -10.439 -10.052 -15.266 98 HD11 ILE 12 HD11 ILE 12 -10.070 -9.708 -12.502 99 HD12 ILE 12 HD12 ILE 12 -11.423 -10.264 -13.488 100 HD13 ILE 12 HD13 ILE 12 -11.184 -10.921 -11.869 101 H ALA 13 H ALA 13 -5.880 -10.797 -15.103 102 HA ALA 13 HA ALA 13 -6.046 -10.069 -17.781 103 HB1 ALA 13 HB1 ALA 13 -4.621 -8.808 -16.396 104 HB2 ALA 13 HB2 ALA 13 -3.704 -10.233 -15.906 105 HB3 ALA 13 HB3 ALA 13 -3.560 -9.615 -17.551 106 H LYS 14 H LYS 14 -4.233 -12.736 -16.290 107 HA LYS 14 HA LYS 14 -2.947 -13.695 -18.559 108 HB2 LYS 14 HB2 LYS 14 -4.031 -15.315 -16.247 109 HB3 LYS 14 HB3 LYS 14 -2.789 -15.836 -17.377 110 HG2 LYS 14 HG2 LYS 14 -2.007 -13.344 -16.237 111 HG3 LYS 14 HG3 LYS 14 -2.469 -14.453 -14.944 112 HD2 LYS 14 HD2 LYS 14 -0.914 -16.103 -15.716 113 HD3 LYS 14 HD3 LYS 14 -0.568 -15.168 -17.173 114 HE2 LYS 14 HE2 LYS 14 0.386 -13.383 -15.789 115 HE3 LYS 14 HE3 LYS 14 0.050 -14.330 -14.341 116 HZ1 LYS 14 HZ1 LYS 14 2.360 -14.387 -15.734 117 HZ2 LYS 14 HZ2 LYS 14 1.562 -15.752 -16.335 118 HZ3 LYS 14 HZ3 LYS 14 1.839 -15.599 -14.674 119 H ARG 15 H ARG 15 -6.213 -14.310 -17.378 120 HA ARG 15 HA ARG 15 -6.860 -16.351 -19.224 121 HB2 ARG 15 HB2 ARG 15 -8.090 -15.702 -17.073 122 HB3 ARG 15 HB3 ARG 15 -8.845 -14.430 -18.024 123 HG2 ARG 15 HG2 ARG 15 -10.354 -16.246 -17.984 124 HG3 ARG 15 HG3 ARG 15 -9.640 -16.217 -19.597 125 HD2 ARG 15 HD2 ARG 15 -9.771 -18.494 -18.712 126 HD3 ARG 15 HD3 ARG 15 -8.100 -17.991 -18.965 127 HE ARG 15 HE ARG 15 -9.075 -17.563 -16.288 128 HH11 ARG 15 HH11 ARG 15 -7.544 -19.796 -18.476 129 HH12 ARG 15 HH12 ARG 15 -6.794 -20.719 -17.217 130 HH21 ARG 15 HH21 ARG 15 -8.093 -18.770 -14.620 131 HH22 ARG 15 HH22 ARG 15 -7.107 -20.135 -15.023 132 H LEU 16 H LEU 16 -6.892 -12.866 -19.407 133 HA LEU 16 HA LEU 16 -8.561 -12.551 -21.644 134 HB2 LEU 16 HB2 LEU 16 -6.196 -10.837 -20.908 135 HB3 LEU 16 HB3 LEU 16 -7.592 -10.365 -21.875 136 HG LEU 16 HG LEU 16 -7.480 -10.866 -18.909 137 HD11 LEU 16 HD11 LEU 16 -8.726 -8.454 -20.013 138 HD12 LEU 16 HD12 LEU 16 -6.996 -8.599 -20.322 139 HD13 LEU 16 HD13 LEU 16 -7.603 -8.642 -18.666 140 HD21 LEU 16 HD21 LEU 16 -9.745 -11.032 -20.781 141 HD22 LEU 16 HD22 LEU 16 -10.009 -10.031 -19.353 142 HD23 LEU 16 HD23 LEU 16 -9.546 -11.724 -19.171 143 H GLU 17 H GLU 17 -5.429 -13.860 -21.363 144 HA GLU 17 HA GLU 17 -4.674 -13.319 -24.111 145 HB2 GLU 17 HB2 GLU 17 -3.297 -15.142 -22.138 146 HB3 GLU 17 HB3 GLU 17 -2.618 -14.448 -23.603 147 HG2 GLU 17 HG2 GLU 17 -2.891 -12.195 -22.580 148 HG3 GLU 17 HG3 GLU 17 -3.378 -12.991 -21.085 149 H SER 18 H SER 18 -6.554 -15.579 -22.483 150 HA SER 18 HA SER 18 -6.044 -17.712 -24.421 151 HB2 SER 18 HB2 SER 18 -6.625 -17.764 -21.706 152 HB3 SER 18 HB3 SER 18 -8.144 -18.236 -22.466 153 HG SER 18 HG SER 18 -5.911 -19.676 -22.151 154 H ILE 19 H ILE 19 -8.179 -15.134 -23.842 155 HA ILE 19 HA ILE 19 -10.571 -16.158 -24.925 156 HB ILE 19 HB ILE 19 -9.628 -13.292 -25.018 157 HG12 ILE 19 HG12 ILE 19 -11.170 -14.746 -22.858 158 HG13 ILE 19 HG13 ILE 19 -9.501 -14.198 -22.735 159 HG21 ILE 19 HG21 ILE 19 -11.536 -13.645 -26.427 160 HG22 ILE 19 HG22 ILE 19 -12.366 -14.542 -25.157 161 HG23 ILE 19 HG23 ILE 19 -12.070 -12.814 -24.966 162 HD11 ILE 19 HD11 ILE 19 -10.296 -11.875 -23.015 163 HD12 ILE 19 HD12 ILE 19 -11.954 -12.478 -22.991 164 HD13 ILE 19 HD13 ILE 19 -10.925 -12.668 -21.571 165 H ASP 20 H ASP 20 -11.493 -15.896 -26.987 166 HA ASP 20 HA ASP 20 -9.570 -15.339 -29.148 167 HB2 ASP 20 HB2 ASP 20 -10.827 -17.796 -28.574 168 HB3 ASP 20 HB3 ASP 20 -11.639 -17.154 -29.999 169 HA PRO 21 HA PRO 21 -12.515 -12.427 -30.631 170 HB2 PRO 21 HB2 PRO 21 -11.759 -12.327 -33.236 171 HB3 PRO 21 HB3 PRO 21 -10.815 -11.595 -31.933 172 HG2 PRO 21 HG2 PRO 21 -10.416 -14.219 -33.318 173 HG3 PRO 21 HG3 PRO 21 -9.210 -13.004 -32.854 174 HD2 PRO 21 HD2 PRO 21 -9.647 -15.251 -31.407 175 HD3 PRO 21 HD3 PRO 21 -9.152 -13.716 -30.663 176 H ALA 22 H ALA 22 -12.129 -15.511 -32.288 177 HA ALA 22 HA ALA 22 -14.339 -15.391 -33.994 178 HB1 ALA 22 HB1 ALA 22 -14.210 -17.816 -34.083 179 HB2 ALA 22 HB2 ALA 22 -12.594 -17.109 -34.142 180 HB3 ALA 22 HB3 ALA 22 -13.187 -17.831 -32.646 181 H ASN 23 H ASN 23 -14.122 -16.019 -30.572 182 HA ASN 23 HA ASN 23 -16.964 -15.736 -30.281 183 HB2 ASN 23 HB2 ASN 23 -15.980 -18.345 -30.629 184 HB3 ASN 23 HB3 ASN 23 -16.289 -18.185 -28.903 185 HD21 ASN 23 HD21 ASN 23 -17.763 -17.609 -32.064 186 HD22 ASN 23 HD22 ASN 23 -19.380 -17.963 -31.569 187 H ARG 24 H ARG 24 -17.077 -14.377 -28.628 188 HA ARG 24 HA ARG 24 -15.953 -15.041 -26.079 189 HB2 ARG 24 HB2 ARG 24 -14.775 -12.705 -26.007 190 HB3 ARG 24 HB3 ARG 24 -13.942 -14.091 -26.698 191 HG2 ARG 24 HG2 ARG 24 -13.615 -12.171 -28.104 192 HG3 ARG 24 HG3 ARG 24 -14.629 -13.345 -28.945 193 HD2 ARG 24 HD2 ARG 24 -16.619 -12.073 -28.351 194 HD3 ARG 24 HD3 ARG 24 -15.628 -10.918 -27.460 195 HE ARG 24 HE ARG 24 -14.563 -10.831 -29.934 196 HH11 ARG 24 HH11 ARG 24 -17.828 -10.577 -28.752 197 HH12 ARG 24 HH12 ARG 24 -18.348 -9.533 -30.033 198 HH21 ARG 24 HH21 ARG 24 -15.237 -9.456 -31.625 199 HH22 ARG 24 HH22 ARG 24 -16.874 -8.897 -31.667 200 H GLN 25 H GLN 25 -18.476 -14.202 -27.577 201 HA GLN 25 HA GLN 25 -20.387 -13.051 -27.135 202 HB2 GLN 25 HB2 GLN 25 -19.027 -13.104 -24.471 203 HB3 GLN 25 HB3 GLN 25 -20.483 -12.138 -24.671 204 HG2 GLN 25 HG2 GLN 25 -20.452 -15.002 -25.517 205 HG3 GLN 25 HG3 GLN 25 -20.665 -14.573 -23.821 206 HE21 GLN 25 HE21 GLN 25 -22.735 -15.692 -24.202 207 HE22 GLN 25 HE22 GLN 25 -24.063 -14.765 -24.803 208 H VAL 26 H VAL 26 -18.463 -11.090 -24.932 209 HA VAL 26 HA VAL 26 -18.059 -8.970 -26.827 210 HB VAL 26 HB VAL 26 -20.498 -8.760 -26.147 211 HG11 VAL 26 HG11 VAL 26 -19.376 -7.693 -23.569 212 HG12 VAL 26 HG12 VAL 26 -21.066 -7.961 -23.999 213 HG13 VAL 26 HG13 VAL 26 -19.994 -9.336 -23.732 214 HG21 VAL 26 HG21 VAL 26 -20.416 -6.384 -26.111 215 HG22 VAL 26 HG22 VAL 26 -18.791 -6.385 -25.426 216 HG23 VAL 26 HG23 VAL 26 -19.050 -6.929 -27.084 217 H GLU 27 H GLU 27 -16.791 -7.241 -25.984 218 HA GLU 27 HA GLU 27 -15.962 -7.160 -23.261 219 HB2 GLU 27 HB2 GLU 27 -13.518 -7.691 -23.837 220 HB3 GLU 27 HB3 GLU 27 -14.626 -9.044 -23.655 221 HG2 GLU 27 HG2 GLU 27 -14.849 -9.193 -26.080 222 HG3 GLU 27 HG3 GLU 27 -13.741 -7.835 -26.265 223 H HIS 28 H HIS 28 -15.587 -5.084 -22.900 224 HA HIS 28 HA HIS 28 -14.230 -3.502 -24.974 225 HB2 HIS 28 HB2 HIS 28 -16.831 -2.951 -23.615 226 HB3 HIS 28 HB3 HIS 28 -15.784 -1.589 -24.002 227 HD1 HIS 28 HD1 HIS 28 -15.341 -1.129 -26.544 228 HD2 HIS 28 HD2 HIS 28 -18.142 -4.098 -25.768 229 HE1 HIS 28 HE1 HIS 28 -16.538 -1.509 -28.722 230 H VAL 29 H VAL 29 -13.431 -1.369 -24.058 231 HA VAL 29 HA VAL 29 -11.690 -1.871 -21.911 232 HB VAL 29 HB VAL 29 -12.541 0.807 -23.022 233 HG11 VAL 29 HG11 VAL 29 -11.240 1.721 -21.475 234 HG12 VAL 29 HG12 VAL 29 -10.875 0.125 -20.816 235 HG13 VAL 29 HG13 VAL 29 -9.868 0.803 -22.096 236 HG21 VAL 29 HG21 VAL 29 -11.238 0.450 -24.796 237 HG22 VAL 29 HG22 VAL 29 -9.928 -0.188 -23.801 238 HG23 VAL 29 HG23 VAL 29 -11.233 -1.251 -24.330 239 H TYR 30 H TYR 30 -12.009 -1.839 -19.791 240 HA TYR 30 HA TYR 30 -14.166 -0.166 -18.700 241 HB2 TYR 30 HB2 TYR 30 -13.571 -3.023 -17.903 242 HB3 TYR 30 HB3 TYR 30 -14.737 -1.969 -17.112 243 HD1 TYR 30 HD1 TYR 30 -16.098 -0.697 -19.357 244 HD2 TYR 30 HD2 TYR 30 -14.797 -4.722 -18.902 245 HE1 TYR 30 HE1 TYR 30 -17.837 -1.431 -20.934 246 HE2 TYR 30 HE2 TYR 30 -16.531 -5.468 -20.479 247 HH TYR 30 HH TYR 30 -18.367 -3.251 -22.375 248 H LYS 31 H LYS 31 -13.448 1.166 -17.187 249 HA LYS 31 HA LYS 31 -10.810 0.737 -16.031 250 HB2 LYS 31 HB2 LYS 31 -11.120 3.049 -15.138 251 HB3 LYS 31 HB3 LYS 31 -11.214 2.943 -16.891 252 HG2 LYS 31 HG2 LYS 31 -13.469 3.384 -16.935 253 HG3 LYS 31 HG3 LYS 31 -13.722 2.813 -15.284 254 HD2 LYS 31 HD2 LYS 31 -13.932 5.244 -15.424 255 HD3 LYS 31 HD3 LYS 31 -12.557 4.779 -14.420 256 HE2 LYS 31 HE2 LYS 31 -11.048 5.184 -16.299 257 HE3 LYS 31 HE3 LYS 31 -12.420 5.632 -17.311 258 HZ1 LYS 31 HZ1 LYS 31 -12.670 7.225 -15.117 259 HZ2 LYS 31 HZ2 LYS 31 -12.043 7.695 -16.615 260 HZ3 LYS 31 HZ3 LYS 31 -10.999 7.195 -15.382 261 H PHE 32 H PHE 32 -10.411 0.278 -13.935 262 HA PHE 32 HA PHE 32 -12.751 -0.112 -12.191 263 HB2 PHE 32 HB2 PHE 32 -10.067 -1.508 -12.154 264 HB3 PHE 32 HB3 PHE 32 -11.358 -1.778 -10.988 265 HD1 PHE 32 HD1 PHE 32 -10.304 -2.254 -14.470 266 HD2 PHE 32 HD2 PHE 32 -13.278 -3.090 -11.542 267 HE1 PHE 32 HE1 PHE 32 -11.266 -3.973 -15.943 268 HE2 PHE 32 HE2 PHE 32 -14.244 -4.812 -13.010 269 HZ PHE 32 HZ PHE 32 -13.238 -5.256 -15.213 270 H ARG 33 H ARG 33 -12.790 0.771 -10.178 271 HA ARG 33 HA ARG 33 -10.557 2.566 -9.502 272 HB2 ARG 33 HB2 ARG 33 -13.478 2.844 -9.380 273 HB3 ARG 33 HB3 ARG 33 -12.648 3.375 -7.923 274 HG2 ARG 33 HG2 ARG 33 -11.130 4.682 -9.571 275 HG3 ARG 33 HG3 ARG 33 -12.464 4.449 -10.702 276 HD2 ARG 33 HD2 ARG 33 -13.931 5.717 -9.431 277 HD3 ARG 33 HD3 ARG 33 -12.990 5.507 -7.955 278 HE ARG 33 HE ARG 33 -11.348 6.922 -9.610 279 HH11 ARG 33 HH11 ARG 33 -14.582 7.359 -8.396 280 HH12 ARG 33 HH12 ARG 33 -14.498 9.089 -8.422 281 HH21 ARG 33 HH21 ARG 33 -11.225 9.199 -9.649 282 HH22 ARG 33 HH22 ARG 33 -12.588 10.135 -9.135 283 H ILE 34 H ILE 34 -9.318 1.927 -7.879 284 HA ILE 34 HA ILE 34 -10.400 0.030 -5.919 285 HB ILE 34 HB ILE 34 -7.515 0.774 -6.407 286 HG12 ILE 34 HG12 ILE 34 -8.626 -0.370 -8.340 287 HG13 ILE 34 HG13 ILE 34 -7.301 -1.287 -7.632 288 HG21 ILE 34 HG21 ILE 34 -7.251 -1.502 -5.193 289 HG22 ILE 34 HG22 ILE 34 -7.581 -0.051 -4.247 290 HG23 ILE 34 HG23 ILE 34 -8.884 -1.182 -4.608 291 HD11 ILE 34 HD11 ILE 34 -8.854 -2.723 -6.485 292 HD12 ILE 34 HD12 ILE 34 -10.215 -1.755 -7.055 293 HD13 ILE 34 HD13 ILE 34 -9.245 -2.676 -8.204 294 H THR 35 H THR 35 -11.108 0.876 -4.084 295 HA THR 35 HA THR 35 -9.925 3.378 -3.105 296 HB THR 35 HB THR 35 -11.900 3.604 -1.690 297 HG1 THR 35 HG1 THR 35 -13.517 2.052 -1.724 298 HG21 THR 35 HG21 THR 35 -13.540 3.143 -3.912 299 HG22 THR 35 HG22 THR 35 -11.949 3.519 -4.572 300 HG23 THR 35 HG23 THR 35 -12.737 4.650 -3.473 301 H GLN 36 H GLN 36 -9.124 3.577 -1.026 302 HA GLN 36 HA GLN 36 -8.466 1.037 0.285 303 HB2 GLN 36 HB2 GLN 36 -6.913 3.272 -0.359 304 HB3 GLN 36 HB3 GLN 36 -7.128 3.357 1.385 305 HG2 GLN 36 HG2 GLN 36 -6.451 0.847 1.317 306 HG3 GLN 36 HG3 GLN 36 -5.774 1.269 -0.255 307 HE21 GLN 36 HE21 GLN 36 -3.744 0.666 0.749 308 HE22 GLN 36 HE22 GLN 36 -2.893 1.832 1.699 309 H GLY 37 H GLY 37 -9.958 0.517 1.766 310 HA2 GLY 37 HA2 GLY 37 -10.962 0.652 3.857 311 HA3 GLY 37 HA3 GLY 37 -10.349 2.291 4.014 312 H GLY 38 H GLY 38 -11.426 3.541 1.828 313 HA2 GLY 38 HA2 GLY 38 -14.133 3.038 1.310 314 HA3 GLY 38 HA3 GLY 38 -14.043 4.105 2.704 315 H LYS 39 H LYS 39 -11.392 4.620 0.749 316 HA LYS 39 HA LYS 39 -12.751 6.672 -0.852 317 HB2 LYS 39 HB2 LYS 39 -11.851 7.792 1.125 318 HB3 LYS 39 HB3 LYS 39 -10.263 7.103 0.813 319 HG2 LYS 39 HG2 LYS 39 -10.155 8.353 -1.299 320 HG3 LYS 39 HG3 LYS 39 -11.724 9.074 -0.934 321 HD2 LYS 39 HD2 LYS 39 -10.874 10.311 0.851 322 HD3 LYS 39 HD3 LYS 39 -9.442 9.289 1.000 323 HE2 LYS 39 HE2 LYS 39 -8.580 11.182 -0.002 324 HE3 LYS 39 HE3 LYS 39 -8.906 10.150 -1.393 325 HZ1 LYS 39 HZ1 LYS 39 -10.279 11.669 -2.198 326 HZ2 LYS 39 HZ2 LYS 39 -9.862 12.709 -0.931 327 HZ3 LYS 39 HZ3 LYS 39 -11.196 11.681 -0.776 328 H VAL 40 H VAL 40 -11.916 7.010 -2.868 329 HA VAL 40 HA VAL 40 -10.510 5.005 -4.149 330 HB VAL 40 HB VAL 40 -11.857 6.808 -5.260 331 HG11 VAL 40 HG11 VAL 40 -10.444 8.594 -3.945 332 HG12 VAL 40 HG12 VAL 40 -9.404 8.493 -5.367 333 HG13 VAL 40 HG13 VAL 40 -11.098 8.951 -5.543 334 HG21 VAL 40 HG21 VAL 40 -10.938 6.024 -7.123 335 HG22 VAL 40 HG22 VAL 40 -9.513 7.033 -6.879 336 HG23 VAL 40 HG23 VAL 40 -9.580 5.418 -6.175 337 H VAL 41 H VAL 41 -8.417 4.511 -4.453 338 HA VAL 41 HA VAL 41 -6.393 6.410 -3.459 339 HB VAL 41 HB VAL 41 -6.627 4.559 -1.877 340 HG11 VAL 41 HG11 VAL 41 -5.768 2.279 -2.764 341 HG12 VAL 41 HG12 VAL 41 -7.446 2.740 -3.055 342 HG13 VAL 41 HG13 VAL 41 -6.250 2.905 -4.341 343 HG21 VAL 41 HG21 VAL 41 -4.414 5.594 -2.301 344 HG22 VAL 41 HG22 VAL 41 -4.307 3.921 -1.751 345 HG23 VAL 41 HG23 VAL 41 -4.070 4.306 -3.456 346 H LYS 42 H LYS 42 -7.468 4.370 -5.974 347 HA LYS 42 HA LYS 42 -5.493 5.312 -7.778 348 HB2 LYS 42 HB2 LYS 42 -4.517 3.268 -6.296 349 HB3 LYS 42 HB3 LYS 42 -5.264 2.367 -7.609 350 HG2 LYS 42 HG2 LYS 42 -3.935 3.549 -9.235 351 HG3 LYS 42 HG3 LYS 42 -3.257 4.582 -7.975 352 HD2 LYS 42 HD2 LYS 42 -2.981 1.633 -7.684 353 HD3 LYS 42 HD3 LYS 42 -1.965 2.454 -8.871 354 HE2 LYS 42 HE2 LYS 42 -2.173 3.532 -6.092 355 HE3 LYS 42 HE3 LYS 42 -1.134 2.145 -6.415 356 HZ1 LYS 42 HZ1 LYS 42 -0.956 4.821 -7.688 357 HZ2 LYS 42 HZ2 LYS 42 -0.019 3.485 -8.135 358 HZ3 LYS 42 HZ3 LYS 42 0.140 4.150 -6.587 359 H ASN 43 H ASN 43 -5.808 4.482 -9.965 360 HA ASN 43 HA ASN 43 -8.350 3.070 -10.362 361 HB2 ASN 43 HB2 ASN 43 -7.716 5.313 -12.216 362 HB3 ASN 43 HB3 ASN 43 -9.280 4.690 -11.700 363 HD21 ASN 43 HD21 ASN 43 -6.658 6.828 -10.961 364 HD22 ASN 43 HD22 ASN 43 -7.449 7.693 -9.691 365 H TRP 44 H TRP 44 -8.178 1.454 -11.769 366 HA TRP 44 HA TRP 44 -5.807 1.377 -13.507 367 HB2 TRP 44 HB2 TRP 44 -7.504 -0.807 -12.306 368 HB3 TRP 44 HB3 TRP 44 -6.376 -1.116 -13.623 369 HD1 TRP 44 HD1 TRP 44 -6.445 -0.145 -9.913 370 HE1 TRP 44 HE1 TRP 44 -4.117 -0.589 -8.909 371 HE3 TRP 44 HE3 TRP 44 -3.922 -1.314 -14.203 372 HZ2 TRP 44 HZ2 TRP 44 -1.550 -1.335 -9.817 373 HZ3 TRP 44 HZ3 TRP 44 -1.533 -1.881 -14.048 374 HH2 TRP 44 HH2 TRP 44 -0.373 -1.891 -11.900 375 H VAL 45 H VAL 45 -6.023 0.587 -15.666 376 HA VAL 45 HA VAL 45 -8.749 0.835 -16.762 377 HB VAL 45 HB VAL 45 -7.158 2.777 -17.254 378 HG11 VAL 45 HG11 VAL 45 -5.585 2.430 -19.097 379 HG12 VAL 45 HG12 VAL 45 -5.160 1.450 -17.693 380 HG13 VAL 45 HG13 VAL 45 -5.950 0.705 -19.083 381 HG21 VAL 45 HG21 VAL 45 -8.189 3.171 -19.292 382 HG22 VAL 45 HG22 VAL 45 -8.126 1.474 -19.769 383 HG23 VAL 45 HG23 VAL 45 -9.273 2.002 -18.538 384 H MET 46 H MET 46 -9.395 -0.682 -18.200 385 HA MET 46 HA MET 46 -7.548 -2.904 -18.681 386 HB2 MET 46 HB2 MET 46 -9.605 -3.590 -17.670 387 HB3 MET 46 HB3 MET 46 -10.553 -2.688 -18.845 388 HG2 MET 46 HG2 MET 46 -10.354 -4.279 -20.440 389 HG3 MET 46 HG3 MET 46 -8.751 -4.776 -19.903 390 HE1 MET 46 HE1 MET 46 -12.682 -5.956 -19.602 391 HE2 MET 46 HE2 MET 46 -12.682 -5.811 -17.845 392 HE3 MET 46 HE3 MET 46 -12.307 -4.408 -18.846 393 H ASP 47 H ASP 47 -6.521 -2.950 -20.559 394 HA ASP 47 HA ASP 47 -7.462 -1.406 -22.813 395 HB2 ASP 47 HB2 ASP 47 -4.970 -2.074 -21.927 396 HB3 ASP 47 HB3 ASP 47 -5.194 -3.241 -23.227 397 H LEU 48 H LEU 48 -8.805 -2.151 -24.303 398 HA LEU 48 HA LEU 48 -9.238 -5.033 -24.527 399 HB2 LEU 48 HB2 LEU 48 -11.168 -3.525 -24.208 400 HB3 LEU 48 HB3 LEU 48 -10.785 -2.749 -25.743 401 HG LEU 48 HG LEU 48 -12.677 -4.521 -25.630 402 HD11 LEU 48 HD11 LEU 48 -10.983 -3.597 -27.640 403 HD12 LEU 48 HD12 LEU 48 -12.545 -4.390 -27.842 404 HD13 LEU 48 HD13 LEU 48 -11.062 -5.344 -27.871 405 HD21 LEU 48 HD21 LEU 48 -12.139 -6.744 -25.619 406 HD22 LEU 48 HD22 LEU 48 -10.902 -6.123 -24.526 407 HD23 LEU 48 HD23 LEU 48 -10.500 -6.466 -26.209 408 H LYS 49 H LYS 49 -7.690 -2.462 -26.145 409 HA LYS 49 HA LYS 49 -7.815 -3.585 -28.789 410 HB2 LYS 49 HB2 LYS 49 -7.364 -1.097 -27.941 411 HB3 LYS 49 HB3 LYS 49 -5.692 -1.635 -28.042 412 HG2 LYS 49 HG2 LYS 49 -5.916 -2.119 -30.371 413 HG3 LYS 49 HG3 LYS 49 -7.657 -1.828 -30.313 414 HD2 LYS 49 HD2 LYS 49 -7.040 0.534 -29.528 415 HD3 LYS 49 HD3 LYS 49 -5.410 0.154 -30.091 416 HE2 LYS 49 HE2 LYS 49 -6.102 0.886 -32.085 417 HE3 LYS 49 HE3 LYS 49 -6.986 -0.636 -32.199 418 HZ1 LYS 49 HZ1 LYS 49 -8.894 0.458 -32.141 419 HZ2 LYS 49 HZ2 LYS 49 -8.042 1.918 -32.201 420 HZ3 LYS 49 HZ3 LYS 49 -8.473 1.252 -30.707 421 H ASN 50 H ASN 50 -5.446 -3.491 -26.165 422 HA ASN 50 HA ASN 50 -3.712 -5.300 -27.695 423 HB2 ASN 50 HB2 ASN 50 -3.217 -3.468 -25.360 424 HB3 ASN 50 HB3 ASN 50 -2.091 -4.763 -25.753 425 HD21 ASN 50 HD21 ASN 50 -3.556 -1.801 -26.887 426 HD22 ASN 50 HD22 ASN 50 -2.362 -1.442 -28.083 427 H VAL 51 H VAL 51 -6.013 -5.287 -25.236 428 HA VAL 51 HA VAL 51 -6.819 -6.918 -23.864 429 HB VAL 51 HB VAL 51 -4.825 -8.844 -25.033 430 HG11 VAL 51 HG11 VAL 51 -7.175 -10.161 -24.774 431 HG12 VAL 51 HG12 VAL 51 -5.924 -10.110 -23.530 432 HG13 VAL 51 HG13 VAL 51 -7.296 -9.005 -23.448 433 HG21 VAL 51 HG21 VAL 51 -6.788 -9.321 -26.664 434 HG22 VAL 51 HG22 VAL 51 -7.269 -7.665 -26.294 435 HG23 VAL 51 HG23 VAL 51 -5.687 -7.986 -27.004 436 H LYS 52 H LYS 52 -4.833 -5.219 -22.885 437 HA LYS 52 HA LYS 52 -3.589 -6.968 -20.882 438 HB2 LYS 52 HB2 LYS 52 -1.534 -5.644 -20.936 439 HB3 LYS 52 HB3 LYS 52 -1.848 -6.376 -22.503 440 HG2 LYS 52 HG2 LYS 52 -2.573 -4.306 -23.417 441 HG3 LYS 52 HG3 LYS 52 -2.580 -3.539 -21.828 442 HD2 LYS 52 HD2 LYS 52 -0.596 -2.778 -22.773 443 HD3 LYS 52 HD3 LYS 52 -0.067 -4.139 -21.782 444 HE2 LYS 52 HE2 LYS 52 -0.364 -5.533 -23.928 445 HE3 LYS 52 HE3 LYS 52 -0.373 -3.979 -24.761 446 HZ1 LYS 52 HZ1 LYS 52 1.806 -5.077 -23.072 447 HZ2 LYS 52 HZ2 LYS 52 1.793 -3.507 -23.702 448 HZ3 LYS 52 HZ3 LYS 52 1.841 -4.837 -24.746 449 H LEU 53 H LEU 53 -3.214 -5.981 -18.841 450 HA LEU 53 HA LEU 53 -5.017 -3.732 -18.332 451 HB2 LEU 53 HB2 LEU 53 -4.304 -6.126 -16.922 452 HB3 LEU 53 HB3 LEU 53 -3.973 -4.719 -15.913 453 HG LEU 53 HG LEU 53 -6.334 -3.996 -16.269 454 HD11 LEU 53 HD11 LEU 53 -7.932 -5.443 -17.236 455 HD12 LEU 53 HD12 LEU 53 -6.771 -6.764 -17.359 456 HD13 LEU 53 HD13 LEU 53 -6.599 -5.341 -18.387 457 HD21 LEU 53 HD21 LEU 53 -6.926 -6.524 -15.104 458 HD22 LEU 53 HD22 LEU 53 -6.670 -4.971 -14.307 459 HD23 LEU 53 HD23 LEU 53 -5.302 -6.043 -14.610 460 H VAL 54 H VAL 54 -4.340 -1.796 -17.596 461 HA VAL 54 HA VAL 54 -1.602 -1.484 -16.633 462 HB VAL 54 HB VAL 54 -1.008 0.255 -18.139 463 HG11 VAL 54 HG11 VAL 54 -0.934 -0.882 -20.259 464 HG12 VAL 54 HG12 VAL 54 -0.753 -2.070 -18.966 465 HG13 VAL 54 HG13 VAL 54 -2.297 -1.904 -19.803 466 HG21 VAL 54 HG21 VAL 54 -3.848 0.078 -19.124 467 HG22 VAL 54 HG22 VAL 54 -3.050 1.454 -18.363 468 HG23 VAL 54 HG23 VAL 54 -2.575 0.946 -19.983 469 H GLU 55 H GLU 55 -1.241 0.875 -15.946 470 HA GLU 55 HA GLU 55 -3.623 1.720 -14.462 471 HB2 GLU 55 HB2 GLU 55 -1.839 3.150 -13.235 472 HB3 GLU 55 HB3 GLU 55 -1.906 1.421 -12.927 473 HG2 GLU 55 HG2 GLU 55 0.104 1.039 -13.855 474 HG3 GLU 55 HG3 GLU 55 -0.130 2.245 -15.120 475 H SER 56 H SER 56 -4.782 3.212 -15.491 476 HA SER 56 HA SER 56 -3.508 5.686 -16.293 477 HB2 SER 56 HB2 SER 56 -3.389 4.213 -18.320 478 HB3 SER 56 HB3 SER 56 -5.152 4.143 -18.312 479 HG SER 56 HG SER 56 -3.761 6.602 -18.347 480 H ASP 57 H ASP 57 -5.261 7.240 -17.169 481 HA ASP 57 HA ASP 57 -7.673 6.884 -15.515 482 HB2 ASP 57 HB2 ASP 57 -5.840 8.890 -15.325 483 HB3 ASP 57 HB3 ASP 57 -7.008 9.607 -16.432 484 H ASP 58 H ASP 58 -6.852 6.382 -18.516 485 HA ASP 58 HA ASP 58 -8.368 7.977 -20.193 486 HB2 ASP 58 HB2 ASP 58 -6.780 6.231 -20.955 487 HB3 ASP 58 HB3 ASP 58 -7.934 4.994 -20.461 488 H ALA 59 H ALA 59 -10.420 7.491 -21.277 489 HA ALA 59 HA ALA 59 -12.442 6.779 -19.323 490 HB1 ALA 59 HB1 ALA 59 -14.037 7.645 -20.937 491 HB2 ALA 59 HB2 ALA 59 -12.715 8.789 -20.702 492 HB3 ALA 59 HB3 ALA 59 -12.762 7.782 -22.149 493 H ALA 60 H ALA 60 -13.782 5.039 -19.401 494 HA ALA 60 HA ALA 60 -13.343 3.107 -21.585 495 HB1 ALA 60 HB1 ALA 60 -12.772 1.528 -20.133 496 HB2 ALA 60 HB2 ALA 60 -12.753 2.761 -18.872 497 HB3 ALA 60 HB3 ALA 60 -14.218 1.824 -19.167 498 H GLU 61 H GLU 61 -15.164 1.512 -21.793 499 HA GLU 61 HA GLU 61 -17.563 2.819 -22.327 500 HB2 GLU 61 HB2 GLU 61 -16.789 -0.062 -22.064 501 HB3 GLU 61 HB3 GLU 61 -18.484 0.365 -22.255 502 HG2 GLU 61 HG2 GLU 61 -16.368 1.331 -24.148 503 HG3 GLU 61 HG3 GLU 61 -17.189 -0.215 -24.355 504 H ALA 62 H ALA 62 -16.395 1.366 -19.401 505 HA ALA 62 HA ALA 62 -18.630 2.452 -17.931 506 HB1 ALA 62 HB1 ALA 62 -18.486 -0.169 -16.928 507 HB2 ALA 62 HB2 ALA 62 -19.832 0.593 -17.777 508 HB3 ALA 62 HB3 ALA 62 -18.618 -0.311 -18.681 509 H THR 63 H THR 63 -18.295 2.411 -15.622 510 HA THR 63 HA THR 63 -15.483 1.945 -14.868 511 HB THR 63 HB THR 63 -17.211 4.106 -13.667 512 HG1 THR 63 HG1 THR 63 -16.790 4.395 -15.987 513 HG21 THR 63 HG21 THR 63 -15.469 3.844 -12.204 514 HG22 THR 63 HG22 THR 63 -14.727 4.972 -13.338 515 HG23 THR 63 HG23 THR 63 -14.370 3.249 -13.447 516 H LEU 64 H LEU 64 -15.187 0.597 -13.220 517 HA LEU 64 HA LEU 64 -17.481 0.019 -11.463 518 HB2 LEU 64 HB2 LEU 64 -15.738 -1.696 -12.967 519 HB3 LEU 64 HB3 LEU 64 -15.595 -2.053 -11.247 520 HG LEU 64 HG LEU 64 -18.358 -1.865 -11.854 521 HD11 LEU 64 HD11 LEU 64 -16.903 -3.749 -13.701 522 HD12 LEU 64 HD12 LEU 64 -17.654 -2.234 -14.203 523 HD13 LEU 64 HD13 LEU 64 -18.647 -3.538 -13.551 524 HD21 LEU 64 HD21 LEU 64 -17.874 -3.273 -10.130 525 HD22 LEU 64 HD22 LEU 64 -16.419 -3.903 -10.903 526 HD23 LEU 64 HD23 LEU 64 -18.008 -4.457 -11.430 527 H THR 65 H THR 65 -17.204 1.061 -9.599 528 HA THR 65 HA THR 65 -14.505 1.178 -8.431 529 HB THR 65 HB THR 65 -16.891 2.865 -7.662 530 HG1 THR 65 HG1 THR 65 -16.101 3.209 -9.862 531 HG21 THR 65 HG21 THR 65 -15.602 3.529 -5.971 532 HG22 THR 65 HG22 THR 65 -14.410 4.114 -7.131 533 HG23 THR 65 HG23 THR 65 -14.305 2.466 -6.514 534 H MET 66 H MET 66 -14.076 0.052 -6.646 535 HA MET 66 HA MET 66 -16.072 -0.492 -4.656 536 HB2 MET 66 HB2 MET 66 -16.214 -2.834 -4.837 537 HB3 MET 66 HB3 MET 66 -16.412 -2.248 -6.483 538 HG2 MET 66 HG2 MET 66 -13.693 -2.620 -6.264 539 HG3 MET 66 HG3 MET 66 -14.368 -3.963 -5.344 540 HE1 MET 66 HE1 MET 66 -14.616 -2.937 -9.705 541 HE2 MET 66 HE2 MET 66 -16.186 -2.583 -8.984 542 HE3 MET 66 HE3 MET 66 -14.727 -1.832 -8.334 543 H GLU 67 H GLU 67 -15.175 -1.582 -2.766 544 HA GLU 67 HA GLU 67 -12.553 -0.656 -2.179 545 HB2 GLU 67 HB2 GLU 67 -14.789 -1.689 -0.728 546 HB3 GLU 67 HB3 GLU 67 -13.352 -2.583 -0.251 547 HG2 GLU 67 HG2 GLU 67 -12.730 0.200 -0.357 548 HG3 GLU 67 HG3 GLU 67 -14.186 -0.039 0.608 549 H ASP 68 H ASP 68 -10.732 -1.930 -1.519 550 HA ASP 68 HA ASP 68 -9.949 -3.874 -3.324 551 HB2 ASP 68 HB2 ASP 68 -8.550 -2.499 -1.627 552 HB3 ASP 68 HB3 ASP 68 -8.867 -3.832 -0.520 553 H ASP 69 H ASP 69 -11.298 -4.293 -0.071 554 HA ASP 69 HA ASP 69 -11.116 -7.098 0.014 555 HB2 ASP 69 HB2 ASP 69 -12.004 -5.081 1.725 556 HB3 ASP 69 HB3 ASP 69 -13.431 -6.074 1.438 557 H ILE 70 H ILE 70 -13.512 -4.935 -1.348 558 HA ILE 70 HA ILE 70 -15.476 -6.967 -1.809 559 HB ILE 70 HB ILE 70 -15.167 -4.133 -2.754 560 HG12 ILE 70 HG12 ILE 70 -17.494 -4.098 -1.593 561 HG13 ILE 70 HG13 ILE 70 -16.992 -5.635 -0.898 562 HG21 ILE 70 HG21 ILE 70 -17.081 -6.216 -3.743 563 HG22 ILE 70 HG22 ILE 70 -17.506 -4.505 -3.749 564 HG23 ILE 70 HG23 ILE 70 -16.111 -5.070 -4.668 565 HD11 ILE 70 HD11 ILE 70 -14.840 -3.942 -0.465 566 HD12 ILE 70 HD12 ILE 70 -16.265 -2.951 -0.152 567 HD13 ILE 70 HD13 ILE 70 -16.037 -4.467 0.719 568 H MET 71 H MET 71 -13.230 -5.189 -3.929 569 HA MET 71 HA MET 71 -13.844 -6.422 -6.327 570 HB2 MET 71 HB2 MET 71 -12.400 -4.554 -6.399 571 HB3 MET 71 HB3 MET 71 -11.268 -5.281 -5.266 572 HG2 MET 71 HG2 MET 71 -10.098 -5.665 -7.147 573 HG3 MET 71 HG3 MET 71 -11.130 -7.091 -7.222 574 HE1 MET 71 HE1 MET 71 -12.517 -3.224 -9.009 575 HE2 MET 71 HE2 MET 71 -11.403 -3.440 -7.659 576 HE3 MET 71 HE3 MET 71 -10.782 -3.340 -9.307 577 H PHE 72 H PHE 72 -11.752 -7.529 -3.720 578 HA PHE 72 HA PHE 72 -10.630 -9.730 -5.099 579 HB2 PHE 72 HB2 PHE 72 -10.039 -8.555 -2.773 580 HB3 PHE 72 HB3 PHE 72 -11.012 -9.884 -2.151 581 HD1 PHE 72 HD1 PHE 72 -8.340 -9.419 -4.720 582 HD2 PHE 72 HD2 PHE 72 -9.830 -11.712 -1.458 583 HE1 PHE 72 HE1 PHE 72 -6.393 -10.915 -4.886 584 HE2 PHE 72 HE2 PHE 72 -7.886 -13.210 -1.619 585 HZ PHE 72 HZ PHE 72 -6.163 -12.813 -3.334 586 H ALA 73 H ALA 73 -13.480 -9.374 -3.042 587 HA ALA 73 HA ALA 73 -14.172 -12.084 -2.847 588 HB1 ALA 73 HB1 ALA 73 -15.294 -9.598 -2.081 589 HB2 ALA 73 HB2 ALA 73 -16.543 -10.518 -2.920 590 HB3 ALA 73 HB3 ALA 73 -15.723 -11.216 -1.523 591 H ILE 74 H ILE 74 -15.237 -9.605 -5.167 592 HA ILE 74 HA ILE 74 -16.764 -11.500 -6.702 593 HB ILE 74 HB ILE 74 -15.953 -8.680 -7.416 594 HG12 ILE 74 HG12 ILE 74 -18.690 -9.476 -6.500 595 HG13 ILE 74 HG13 ILE 74 -17.430 -9.205 -5.302 596 HG21 ILE 74 HG21 ILE 74 -17.943 -8.848 -8.942 597 HG22 ILE 74 HG22 ILE 74 -16.556 -9.834 -9.400 598 HG23 ILE 74 HG23 ILE 74 -17.949 -10.582 -8.620 599 HD11 ILE 74 HD11 ILE 74 -19.038 -7.279 -6.063 600 HD12 ILE 74 HD12 ILE 74 -17.340 -6.965 -5.704 601 HD13 ILE 74 HD13 ILE 74 -17.872 -7.130 -7.377 602 H GLY 75 H GLY 75 -13.498 -10.509 -6.592 603 HA2 GLY 75 HA2 GLY 75 -12.918 -11.152 -9.358 604 HA3 GLY 75 HA3 GLY 75 -11.753 -10.691 -8.125 605 H THR 76 H THR 76 -12.513 -12.665 -6.199 606 HA THR 76 HA THR 76 -11.157 -14.951 -7.389 607 HB THR 76 HB THR 76 -10.869 -15.775 -5.129 608 HG1 THR 76 HG1 THR 76 -12.055 -15.067 -3.502 609 HG21 THR 76 HG21 THR 76 -10.116 -13.219 -4.253 610 HG22 THR 76 HG22 THR 76 -9.970 -13.187 -6.010 611 HG23 THR 76 HG23 THR 76 -9.109 -14.409 -5.076 612 H GLY 77 H GLY 77 -14.316 -13.968 -6.756 613 HA2 GLY 77 HA2 GLY 77 -16.181 -15.249 -7.498 614 HA3 GLY 77 HA3 GLY 77 -15.265 -16.714 -7.177 615 H ALA 78 H ALA 78 -14.664 -14.868 -4.581 616 HA ALA 78 HA ALA 78 -16.025 -16.393 -2.740 617 HB1 ALA 78 HB1 ALA 78 -15.829 -13.773 -1.668 618 HB2 ALA 78 HB2 ALA 78 -14.788 -15.165 -1.370 619 HB3 ALA 78 HB3 ALA 78 -14.419 -14.054 -2.689 620 H LEU 79 H LEU 79 -16.934 -13.001 -3.338 621 HA LEU 79 HA LEU 79 -19.734 -13.766 -2.859 622 HB2 LEU 79 HB2 LEU 79 -18.124 -11.711 -1.788 623 HB3 LEU 79 HB3 LEU 79 -19.327 -10.935 -2.815 624 HG LEU 79 HG LEU 79 -20.575 -12.900 -1.121 625 HD11 LEU 79 HD11 LEU 79 -20.202 -11.533 0.996 626 HD12 LEU 79 HD12 LEU 79 -18.769 -10.894 0.192 627 HD13 LEU 79 HD13 LEU 79 -18.907 -12.624 0.502 628 HD21 LEU 79 HD21 LEU 79 -20.909 -9.935 -0.913 629 HD22 LEU 79 HD22 LEU 79 -22.119 -11.211 -0.773 630 HD23 LEU 79 HD23 LEU 79 -21.454 -10.794 -2.353 631 HA PRO 80 HA PRO 80 -20.748 -12.786 -7.028 632 HB2 PRO 80 HB2 PRO 80 -23.387 -12.232 -6.716 633 HB3 PRO 80 HB3 PRO 80 -22.735 -13.874 -6.644 634 HG2 PRO 80 HG2 PRO 80 -23.465 -12.025 -4.405 635 HG3 PRO 80 HG3 PRO 80 -23.782 -13.761 -4.570 636 HD2 PRO 80 HD2 PRO 80 -21.759 -12.787 -3.057 637 HD3 PRO 80 HD3 PRO 80 -21.651 -14.341 -3.908 638 H ALA 81 H ALA 81 -20.703 -11.017 -8.299 639 HA ALA 81 HA ALA 81 -20.227 -8.473 -7.288 640 HB1 ALA 81 HB1 ALA 81 -19.974 -9.586 -9.713 641 HB2 ALA 81 HB2 ALA 81 -21.419 -8.613 -9.986 642 HB3 ALA 81 HB3 ALA 81 -19.929 -7.845 -9.439 643 H LYS 82 H LYS 82 -23.224 -10.079 -7.971 644 HA LYS 82 HA LYS 82 -24.891 -7.802 -8.163 645 HB2 LYS 82 HB2 LYS 82 -25.527 -10.101 -8.890 646 HB3 LYS 82 HB3 LYS 82 -25.631 -10.570 -7.198 647 HG2 LYS 82 HG2 LYS 82 -27.834 -10.140 -7.831 648 HG3 LYS 82 HG3 LYS 82 -27.336 -8.691 -6.954 649 HD2 LYS 82 HD2 LYS 82 -26.682 -7.806 -9.307 650 HD3 LYS 82 HD3 LYS 82 -27.754 -9.080 -9.894 651 HE2 LYS 82 HE2 LYS 82 -28.797 -7.353 -7.731 652 HE3 LYS 82 HE3 LYS 82 -28.592 -6.600 -9.311 653 HZ1 LYS 82 HZ1 LYS 82 -29.841 -8.679 -10.144 654 HZ2 LYS 82 HZ2 LYS 82 -30.722 -7.432 -9.417 655 HZ3 LYS 82 HZ3 LYS 82 -30.353 -8.829 -8.538 656 H GLU 83 H GLU 83 -24.393 -10.056 -5.439 657 HA GLU 83 HA GLU 83 -25.873 -8.695 -3.537 658 HB2 GLU 83 HB2 GLU 83 -23.443 -10.454 -3.296 659 HB3 GLU 83 HB3 GLU 83 -24.232 -9.774 -1.880 660 HG2 GLU 83 HG2 GLU 83 -25.709 -11.405 -3.920 661 HG3 GLU 83 HG3 GLU 83 -24.888 -12.125 -2.537 662 H ALA 84 H ALA 84 -22.370 -8.435 -4.136 663 HA ALA 84 HA ALA 84 -21.730 -6.517 -2.267 664 HB1 ALA 84 HB1 ALA 84 -19.800 -7.117 -3.226 665 HB2 ALA 84 HB2 ALA 84 -20.568 -7.465 -4.775 666 HB3 ALA 84 HB3 ALA 84 -20.128 -5.808 -4.362 667 H MET 85 H MET 85 -23.034 -6.043 -5.528 668 HA MET 85 HA MET 85 -22.967 -3.189 -5.377 669 HB2 MET 85 HB2 MET 85 -23.424 -5.112 -7.376 670 HB3 MET 85 HB3 MET 85 -24.911 -4.180 -7.265 671 HG2 MET 85 HG2 MET 85 -22.750 -2.356 -7.209 672 HG3 MET 85 HG3 MET 85 -22.463 -3.493 -8.524 673 HE1 MET 85 HE1 MET 85 -26.288 -1.333 -7.707 674 HE2 MET 85 HE2 MET 85 -24.848 -1.416 -6.692 675 HE3 MET 85 HE3 MET 85 -25.018 -0.120 -7.877 676 H ALA 86 H ALA 86 -25.246 -5.665 -4.496 677 HA ALA 86 HA ALA 86 -27.503 -3.905 -4.270 678 HB1 ALA 86 HB1 ALA 86 -28.351 -5.973 -4.546 679 HB2 ALA 86 HB2 ALA 86 -26.959 -6.760 -3.800 680 HB3 ALA 86 HB3 ALA 86 -28.215 -6.045 -2.789 681 H GLN 87 H GLN 87 -24.900 -4.917 -2.209 682 HA GLN 87 HA GLN 87 -26.200 -3.913 0.192 683 HB2 GLN 87 HB2 GLN 87 -23.466 -5.123 -0.249 684 HB3 GLN 87 HB3 GLN 87 -24.091 -4.621 1.316 685 HG2 GLN 87 HG2 GLN 87 -26.072 -6.227 0.652 686 HG3 GLN 87 HG3 GLN 87 -24.830 -6.950 -0.368 687 HE21 GLN 87 HE21 GLN 87 -24.511 -8.820 0.701 688 HE22 GLN 87 HE22 GLN 87 -23.934 -8.930 2.325 689 H ASP 88 H ASP 88 -25.065 -2.340 -2.271 690 HA ASP 88 HA ASP 88 -24.168 -0.282 -2.638 691 HB2 ASP 88 HB2 ASP 88 -25.066 -0.150 0.198 692 HB3 ASP 88 HB3 ASP 88 -24.012 1.136 -0.382 693 H LYS 89 H LYS 89 -22.513 -2.639 -1.608 694 HA LYS 89 HA LYS 89 -20.253 -1.334 -0.350 695 HB2 LYS 89 HB2 LYS 89 -20.804 -4.163 -1.226 696 HB3 LYS 89 HB3 LYS 89 -19.219 -3.660 -0.653 697 HG2 LYS 89 HG2 LYS 89 -21.068 -2.739 1.248 698 HG3 LYS 89 HG3 LYS 89 -21.541 -4.392 0.848 699 HD2 LYS 89 HD2 LYS 89 -19.118 -5.031 1.189 700 HD3 LYS 89 HD3 LYS 89 -18.880 -3.420 1.868 701 HE2 LYS 89 HE2 LYS 89 -20.164 -3.868 3.726 702 HE3 LYS 89 HE3 LYS 89 -21.092 -5.126 2.911 703 HZ1 LYS 89 HZ1 LYS 89 -19.172 -5.637 4.666 704 HZ2 LYS 89 HZ2 LYS 89 -18.252 -5.646 3.247 705 HZ3 LYS 89 HZ3 LYS 89 -19.572 -6.693 3.406 706 H MET 90 H MET 90 -21.377 -1.480 -3.436 707 HA MET 90 HA MET 90 -18.885 -0.591 -4.534 708 HB2 MET 90 HB2 MET 90 -18.284 -2.341 -5.867 709 HB3 MET 90 HB3 MET 90 -19.030 -3.253 -4.561 710 HG2 MET 90 HG2 MET 90 -20.105 -4.243 -6.269 711 HG3 MET 90 HG3 MET 90 -21.183 -2.861 -6.086 712 HE1 MET 90 HE1 MET 90 -20.658 -4.901 -8.322 713 HE2 MET 90 HE2 MET 90 -20.405 -4.099 -9.873 714 HE3 MET 90 HE3 MET 90 -19.025 -4.719 -8.965 715 H GLU 91 H GLU 91 -19.116 0.384 -6.587 716 HA GLU 91 HA GLU 91 -21.876 0.596 -7.582 717 HB2 GLU 91 HB2 GLU 91 -21.318 2.580 -6.205 718 HB3 GLU 91 HB3 GLU 91 -19.952 2.907 -7.263 719 HG2 GLU 91 HG2 GLU 91 -21.348 3.442 -9.076 720 HG3 GLU 91 HG3 GLU 91 -22.767 2.755 -8.288 721 H VAL 92 H VAL 92 -21.985 1.492 -9.809 722 HA VAL 92 HA VAL 92 -19.575 1.286 -11.409 723 HB VAL 92 HB VAL 92 -20.433 -1.061 -11.220 724 HG11 VAL 92 HG11 VAL 92 -22.593 -0.608 -13.134 725 HG12 VAL 92 HG12 VAL 92 -22.541 -1.642 -11.706 726 HG13 VAL 92 HG13 VAL 92 -22.901 0.077 -11.539 727 HG21 VAL 92 HG21 VAL 92 -19.052 -0.394 -13.097 728 HG22 VAL 92 HG22 VAL 92 -20.292 -1.527 -13.635 729 HG23 VAL 92 HG23 VAL 92 -20.472 0.196 -13.962 730 H ASP 93 H ASP 93 -19.730 2.314 -13.389 731 HA ASP 93 HA ASP 93 -22.313 3.593 -13.995 732 HB2 ASP 93 HB2 ASP 93 -20.225 4.982 -12.995 733 HB3 ASP 93 HB3 ASP 93 -19.850 5.073 -14.713 734 H GLY 94 H GLY 94 -21.966 4.743 -16.316 735 HA2 GLY 94 HA2 GLY 94 -21.217 4.489 -18.545 736 HA3 GLY 94 HA3 GLY 94 -20.536 2.928 -18.113 737 H GLN 95 H GLN 95 -21.488 1.459 -19.365 738 HA GLN 95 HA GLN 95 -24.334 1.701 -19.971 739 HB2 GLN 95 HB2 GLN 95 -22.015 0.433 -21.243 740 HB3 GLN 95 HB3 GLN 95 -23.466 -0.560 -21.265 741 HG2 GLN 95 HG2 GLN 95 -23.145 2.216 -22.375 742 HG3 GLN 95 HG3 GLN 95 -23.375 0.720 -23.278 743 HE21 GLN 95 HE21 GLN 95 -25.417 -0.379 -23.046 744 HE22 GLN 95 HE22 GLN 95 -26.844 0.533 -22.706 745 H VAL 96 H VAL 96 -25.571 0.934 -18.365 746 HA VAL 96 HA VAL 96 -25.017 -0.885 -16.418 747 HB VAL 96 HB VAL 96 -27.676 -0.632 -17.831 748 HG11 VAL 96 HG11 VAL 96 -28.523 -1.279 -15.519 749 HG12 VAL 96 HG12 VAL 96 -27.792 -2.559 -16.489 750 HG13 VAL 96 HG13 VAL 96 -26.874 -1.806 -15.184 751 HG21 VAL 96 HG21 VAL 96 -26.419 0.938 -15.595 752 HG22 VAL 96 HG22 VAL 96 -27.052 1.537 -17.128 753 HG23 VAL 96 HG23 VAL 96 -28.157 0.930 -15.895 754 H GLU 97 H GLU 97 -26.260 -1.612 -19.663 755 HA GLU 97 HA GLU 97 -26.567 -4.373 -19.342 756 HB2 GLU 97 HB2 GLU 97 -27.432 -3.029 -21.258 757 HB3 GLU 97 HB3 GLU 97 -25.790 -2.921 -21.876 758 HG2 GLU 97 HG2 GLU 97 -26.399 -5.656 -21.375 759 HG3 GLU 97 HG3 GLU 97 -27.703 -4.942 -22.323 760 H LEU 98 H LEU 98 -23.839 -2.606 -20.814 761 HA LEU 98 HA LEU 98 -22.162 -4.749 -21.279 762 HB2 LEU 98 HB2 LEU 98 -21.729 -1.857 -20.736 763 HB3 LEU 98 HB3 LEU 98 -20.328 -2.926 -20.737 764 HG LEU 98 HG LEU 98 -22.230 -2.494 -23.040 765 HD11 LEU 98 HD11 LEU 98 -20.841 -0.935 -23.834 766 HD12 LEU 98 HD12 LEU 98 -19.403 -1.838 -23.359 767 HD13 LEU 98 HD13 LEU 98 -20.240 -0.830 -22.179 768 HD21 LEU 98 HD21 LEU 98 -20.427 -4.633 -22.454 769 HD22 LEU 98 HD22 LEU 98 -19.829 -3.728 -23.845 770 HD23 LEU 98 HD23 LEU 98 -21.459 -4.403 -23.866 771 H ILE 99 H ILE 99 -22.719 -2.974 -18.294 772 HA ILE 99 HA ILE 99 -20.589 -4.071 -16.805 773 HB ILE 99 HB ILE 99 -23.251 -3.023 -15.836 774 HG12 ILE 99 HG12 ILE 99 -20.690 -1.520 -15.577 775 HG13 ILE 99 HG13 ILE 99 -21.445 -1.583 -17.166 776 HG21 ILE 99 HG21 ILE 99 -20.701 -3.594 -14.332 777 HG22 ILE 99 HG22 ILE 99 -22.087 -2.725 -13.674 778 HG23 ILE 99 HG23 ILE 99 -22.249 -4.417 -14.142 779 HD11 ILE 99 HD11 ILE 99 -23.276 -0.902 -14.991 780 HD12 ILE 99 HD12 ILE 99 -21.981 0.265 -15.257 781 HD13 ILE 99 HD13 ILE 99 -23.066 -0.165 -16.579 782 H PHE 100 H PHE 100 -24.042 -4.955 -16.901 783 HA PHE 100 HA PHE 100 -23.836 -7.176 -15.197 784 HB2 PHE 100 HB2 PHE 100 -25.846 -6.028 -16.979 785 HB3 PHE 100 HB3 PHE 100 -25.929 -7.785 -16.904 786 HD1 PHE 100 HD1 PHE 100 -25.261 -5.083 -14.414 787 HD2 PHE 100 HD2 PHE 100 -27.561 -8.504 -15.472 788 HE1 PHE 100 HE1 PHE 100 -26.469 -4.928 -12.276 789 HE2 PHE 100 HE2 PHE 100 -28.774 -8.354 -13.337 790 HZ PHE 100 HZ PHE 100 -28.229 -6.564 -11.735 791 H LEU 101 H LEU 101 -23.133 -6.772 -18.573 792 HA LEU 101 HA LEU 101 -23.223 -9.476 -19.369 793 HB2 LEU 101 HB2 LEU 101 -22.376 -6.955 -20.474 794 HB3 LEU 101 HB3 LEU 101 -21.220 -8.224 -20.871 795 HG LEU 101 HG LEU 101 -22.937 -7.864 -22.616 796 HD11 LEU 101 HD11 LEU 101 -23.224 -10.569 -21.331 797 HD12 LEU 101 HD12 LEU 101 -21.785 -10.059 -22.215 798 HD13 LEU 101 HD13 LEU 101 -23.338 -10.162 -23.044 799 HD21 LEU 101 HD21 LEU 101 -24.830 -7.244 -21.282 800 HD22 LEU 101 HD22 LEU 101 -24.809 -8.797 -20.445 801 HD23 LEU 101 HD23 LEU 101 -25.226 -8.723 -22.158 802 H LEU 102 H LEU 102 -21.092 -7.825 -17.319 803 HA LEU 102 HA LEU 102 -18.845 -9.607 -17.810 804 HB2 LEU 102 HB2 LEU 102 -19.294 -7.222 -16.055 805 HB3 LEU 102 HB3 LEU 102 -17.907 -8.279 -15.801 806 HG LEU 102 HG LEU 102 -18.476 -6.874 -18.406 807 HD11 LEU 102 HD11 LEU 102 -17.340 -5.042 -17.743 808 HD12 LEU 102 HD12 LEU 102 -16.278 -5.952 -16.670 809 HD13 LEU 102 HD13 LEU 102 -17.910 -5.535 -16.148 810 HD21 LEU 102 HD21 LEU 102 -15.850 -7.937 -17.426 811 HD22 LEU 102 HD22 LEU 102 -16.350 -7.555 -19.074 812 HD23 LEU 102 HD23 LEU 102 -17.005 -8.977 -18.260 813 H GLU 103 H GLU 103 -21.330 -9.015 -15.391 814 HA GLU 103 HA GLU 103 -20.583 -10.361 -13.201 815 HB2 GLU 103 HB2 GLU 103 -23.149 -10.041 -14.595 816 HB3 GLU 103 HB3 GLU 103 -23.089 -11.425 -13.513 817 HG2 GLU 103 HG2 GLU 103 -22.582 -10.049 -11.645 818 HG3 GLU 103 HG3 GLU 103 -22.325 -8.642 -12.676 819 HA PRO 104 HA PRO 104 -21.557 -14.703 -15.088 820 HB2 PRO 104 HB2 PRO 104 -21.995 -14.826 -17.764 821 HB3 PRO 104 HB3 PRO 104 -23.290 -14.567 -16.590 822 HG2 PRO 104 HG2 PRO 104 -21.841 -12.568 -18.282 823 HG3 PRO 104 HG3 PRO 104 -23.574 -12.686 -17.927 824 HD2 PRO 104 HD2 PRO 104 -21.944 -10.937 -16.657 825 HD3 PRO 104 HD3 PRO 104 -23.350 -11.678 -15.867 826 H PHE 105 H PHE 105 -19.792 -12.412 -17.100 827 HA PHE 105 HA PHE 105 -18.018 -14.183 -18.335 828 HB2 PHE 105 HB2 PHE 105 -18.380 -11.690 -18.805 829 HB3 PHE 105 HB3 PHE 105 -17.264 -11.394 -17.476 830 HD1 PHE 105 HD2 PHE 105 -17.308 -13.814 -20.318 831 HD2 PHE 105 HD1 PHE 105 -15.219 -10.729 -18.260 832 HE1 PHE 105 HE2 PHE 105 -15.410 -14.075 -21.861 833 HE2 PHE 105 HE1 PHE 105 -13.317 -10.985 -19.801 834 HZ PHE 105 HZ PHE 105 -13.411 -12.661 -21.603 835 H ILE 106 H ILE 106 -18.122 -12.952 -15.099 836 HA ILE 106 HA ILE 106 -15.478 -13.254 -14.294 837 HB ILE 106 HB ILE 106 -17.953 -13.794 -12.650 838 HG12 ILE 106 HG12 ILE 106 -16.341 -11.247 -12.780 839 HG13 ILE 106 HG13 ILE 106 -17.749 -11.527 -13.799 840 HG21 ILE 106 HG21 ILE 106 -16.489 -13.216 -10.735 841 HG22 ILE 106 HG22 ILE 106 -16.007 -14.695 -11.564 842 HG23 ILE 106 HG23 ILE 106 -15.113 -13.200 -11.838 843 HD11 ILE 106 HD11 ILE 106 -17.867 -11.713 -10.808 844 HD12 ILE 106 HD12 ILE 106 -18.117 -10.202 -11.683 845 HD13 ILE 106 HD13 ILE 106 -19.200 -11.567 -11.953 846 H ALA 107 H ALA 107 -17.923 -15.647 -14.913 847 HA ALA 107 HA ALA 107 -16.799 -17.808 -13.497 848 HB1 ALA 107 HB1 ALA 107 -19.120 -17.523 -14.689 849 HB2 ALA 107 HB2 ALA 107 -18.274 -18.274 -16.042 850 HB3 ALA 107 HB3 ALA 107 -18.391 -19.118 -14.498 851 H SER 108 H SER 108 -16.023 -16.348 -16.552 852 HA SER 108 HA SER 108 -14.450 -18.570 -17.498 853 HB2 SER 108 HB2 SER 108 -15.652 -16.476 -18.757 854 HB3 SER 108 HB3 SER 108 -13.982 -15.913 -18.697 855 HG SER 108 HG SER 108 -13.344 -17.723 -19.813 856 H LEU 109 H LEU 109 -13.803 -15.370 -16.116 857 HA LEU 109 HA LEU 109 -10.949 -15.779 -16.146 858 HB2 LEU 109 HB2 LEU 109 -12.295 -13.651 -14.542 859 HB3 LEU 109 HB3 LEU 109 -10.752 -13.602 -15.392 860 HG LEU 109 HG LEU 109 -13.465 -13.553 -16.711 861 HD11 LEU 109 HD11 LEU 109 -11.792 -11.208 -17.013 862 HD12 LEU 109 HD12 LEU 109 -12.212 -11.511 -15.327 863 HD13 LEU 109 HD13 LEU 109 -13.485 -11.336 -16.534 864 HD21 LEU 109 HD21 LEU 109 -10.676 -13.697 -17.708 865 HD22 LEU 109 HD22 LEU 109 -11.800 -12.651 -18.576 866 HD23 LEU 109 HD23 LEU 109 -12.160 -14.368 -18.385 867 H LYS 110 H LYS 110 -11.631 -17.906 -14.880 868 HA LYS 110 HA LYS 110 -11.463 -19.130 -12.968 869 HB2 LYS 110 HB2 LYS 110 -9.277 -17.733 -13.014 870 HB3 LYS 110 HB3 LYS 110 -10.018 -16.817 -11.708 871 HG2 LYS 110 HG2 LYS 110 -8.991 -18.321 -10.404 872 HG3 LYS 110 HG3 LYS 110 -10.377 -19.337 -10.806 873 HD2 LYS 110 HD2 LYS 110 -8.932 -20.034 -12.854 874 HD3 LYS 110 HD3 LYS 110 -7.589 -19.412 -11.892 875 HE2 LYS 110 HE2 LYS 110 -9.293 -21.091 -10.290 876 HE3 LYS 110 HE3 LYS 110 -8.771 -21.947 -11.740 877 HZ1 LYS 110 HZ1 LYS 110 -7.136 -22.353 -10.130 878 HZ2 LYS 110 HZ2 LYS 110 -7.083 -20.738 -9.631 879 HZ3 LYS 110 HZ3 LYS 110 -6.459 -21.177 -11.141 Start of MODEL 8 1 H1 MET 1 H MET 1 1.550 0.130 2.051 2 HA MET 1 HA MET 1 1.969 1.130 -0.334 3 HB2 MET 1 HB2 MET 1 4.096 -0.116 -0.539 4 HB3 MET 1 HB3 MET 1 3.829 0.500 1.086 5 HG2 MET 1 HG2 MET 1 2.723 -2.085 1.010 6 HG3 MET 1 HG3 MET 1 4.297 -2.177 0.224 7 HE1 MET 1 HE1 MET 1 2.743 -3.193 2.796 8 HE2 MET 1 HE2 MET 1 4.297 -3.832 3.332 9 HE3 MET 1 HE3 MET 1 3.415 -2.690 4.347 10 H SER 2 H SER 2 0.840 -2.124 0.166 11 HA SER 2 HA SER 2 0.571 -2.429 -2.750 12 HB2 SER 2 HB2 SER 2 0.890 -4.889 -2.414 13 HB3 SER 2 HB3 SER 2 2.326 -3.935 -2.045 14 HG SER 2 HG SER 2 2.136 -4.414 0.022 15 H LEU 3 H LEU 3 -1.344 -3.247 -3.498 16 HA LEU 3 HA LEU 3 -3.469 -3.553 -1.489 17 HB2 LEU 3 HB2 LEU 3 -3.484 -2.650 -4.349 18 HB3 LEU 3 HB3 LEU 3 -4.961 -3.177 -3.544 19 HG LEU 3 HG LEU 3 -3.430 -1.113 -2.111 20 HD11 LEU 3 HD11 LEU 3 -4.040 0.699 -3.538 21 HD12 LEU 3 HD12 LEU 3 -4.890 -0.382 -4.642 22 HD13 LEU 3 HD13 LEU 3 -3.134 -0.467 -4.503 23 HD21 LEU 3 HD21 LEU 3 -5.433 -1.315 -1.110 24 HD22 LEU 3 HD22 LEU 3 -6.207 -1.972 -2.552 25 HD23 LEU 3 HD23 LEU 3 -5.974 -0.231 -2.391 26 H LYS 4 H LYS 4 -4.668 -5.375 -1.380 27 HA LYS 4 HA LYS 4 -3.689 -7.778 -2.420 28 HB2 LYS 4 HB2 LYS 4 -6.535 -7.306 -1.534 29 HB3 LYS 4 HB3 LYS 4 -5.637 -8.818 -1.496 30 HG2 LYS 4 HG2 LYS 4 -4.063 -7.234 0.045 31 HG3 LYS 4 HG3 LYS 4 -5.667 -6.590 0.406 32 HD2 LYS 4 HD2 LYS 4 -6.308 -9.105 0.670 33 HD3 LYS 4 HD3 LYS 4 -4.570 -9.333 0.875 34 HE2 LYS 4 HE2 LYS 4 -4.669 -7.539 2.648 35 HE3 LYS 4 HE3 LYS 4 -6.425 -7.642 2.538 36 HZ1 LYS 4 HZ1 LYS 4 -4.649 -9.932 3.182 37 HZ2 LYS 4 HZ2 LYS 4 -6.340 -9.927 3.206 38 HZ3 LYS 4 HZ3 LYS 4 -5.476 -9.009 4.334 39 H SER 5 H SER 5 -6.078 -5.535 -3.652 40 HA SER 5 HA SER 5 -7.355 -7.118 -5.541 41 HB2 SER 5 HB2 SER 5 -7.174 -4.662 -6.788 42 HB3 SER 5 HB3 SER 5 -8.412 -5.128 -5.622 43 HG SER 5 HG SER 5 -6.309 -3.386 -5.354 44 H ASP 6 H ASP 6 -4.146 -5.827 -5.529 45 HA ASP 6 HA ASP 6 -3.513 -5.760 -8.224 46 HB2 ASP 6 HB2 ASP 6 -2.104 -5.264 -6.023 47 HB3 ASP 6 HB3 ASP 6 -1.498 -6.888 -6.338 48 H GLU 7 H GLU 7 -3.678 -8.514 -6.032 49 HA GLU 7 HA GLU 7 -2.514 -10.433 -7.717 50 HB2 GLU 7 HB2 GLU 7 -3.789 -10.393 -5.186 51 HB3 GLU 7 HB3 GLU 7 -4.596 -11.623 -6.149 52 HG2 GLU 7 HG2 GLU 7 -1.887 -12.029 -6.614 53 HG3 GLU 7 HG3 GLU 7 -2.003 -11.673 -4.892 54 H VAL 8 H VAL 8 -5.936 -9.588 -7.218 55 HA VAL 8 HA VAL 8 -7.111 -11.391 -8.943 56 HB VAL 8 HB VAL 8 -7.901 -8.567 -8.256 57 HG11 VAL 8 HG11 VAL 8 -9.369 -10.579 -9.949 58 HG12 VAL 8 HG12 VAL 8 -10.146 -9.185 -9.194 59 HG13 VAL 8 HG13 VAL 8 -8.876 -8.945 -10.394 60 HG21 VAL 8 HG21 VAL 8 -8.052 -10.036 -6.393 61 HG22 VAL 8 HG22 VAL 8 -9.693 -9.801 -6.994 62 HG23 VAL 8 HG23 VAL 8 -8.825 -11.291 -7.363 63 H PHE 9 H PHE 9 -5.889 -8.139 -9.706 64 HA PHE 9 HA PHE 9 -6.571 -8.089 -12.405 65 HB2 PHE 9 HB2 PHE 9 -4.400 -6.746 -10.819 66 HB3 PHE 9 HB3 PHE 9 -4.518 -6.513 -12.560 67 HD1 PHE 9 HD2 PHE 9 -7.371 -6.348 -13.026 68 HD2 PHE 9 HD1 PHE 9 -5.050 -4.774 -9.824 69 HE1 PHE 9 HE2 PHE 9 -9.054 -4.588 -12.676 70 HE2 PHE 9 HE1 PHE 9 -6.730 -3.012 -9.467 71 HZ PHE 9 HZ PHE 9 -8.735 -2.917 -10.895 72 H ALA 10 H ALA 10 -3.734 -9.424 -10.793 73 HA ALA 10 HA ALA 10 -2.307 -10.051 -13.170 74 HB1 ALA 10 HB1 ALA 10 -1.565 -9.911 -10.624 75 HB2 ALA 10 HB2 ALA 10 -1.850 -11.650 -10.715 76 HB3 ALA 10 HB3 ALA 10 -0.692 -10.888 -11.805 77 H LYS 11 H LYS 11 -4.556 -11.839 -11.120 78 HA LYS 11 HA LYS 11 -4.226 -14.336 -12.440 79 HB2 LYS 11 HB2 LYS 11 -6.681 -13.464 -10.925 80 HB3 LYS 11 HB3 LYS 11 -6.066 -15.097 -11.141 81 HG2 LYS 11 HG2 LYS 11 -3.978 -13.803 -9.903 82 HG3 LYS 11 HG3 LYS 11 -5.405 -13.104 -9.135 83 HD2 LYS 11 HD2 LYS 11 -5.410 -14.917 -7.829 84 HD3 LYS 11 HD3 LYS 11 -5.993 -15.798 -9.243 85 HE2 LYS 11 HE2 LYS 11 -3.060 -15.376 -8.821 86 HE3 LYS 11 HE3 LYS 11 -3.906 -16.663 -7.964 87 HZ1 LYS 11 HZ1 LYS 11 -4.591 -16.685 -10.712 88 HZ2 LYS 11 HZ2 LYS 11 -3.884 -17.907 -9.781 89 HZ3 LYS 11 HZ3 LYS 11 -2.910 -16.749 -10.536 90 H ILE 12 H ILE 12 -6.706 -11.796 -12.654 91 HA ILE 12 HA ILE 12 -8.293 -13.027 -14.608 92 HB ILE 12 HB ILE 12 -7.891 -10.088 -14.048 93 HG12 ILE 12 HG12 ILE 12 -10.084 -11.990 -13.193 94 HG13 ILE 12 HG13 ILE 12 -8.770 -11.435 -12.161 95 HG21 ILE 12 HG21 ILE 12 -9.982 -11.488 -15.706 96 HG22 ILE 12 HG22 ILE 12 -10.069 -9.801 -15.202 97 HG23 ILE 12 HG23 ILE 12 -8.772 -10.337 -16.271 98 HD11 ILE 12 HD11 ILE 12 -10.783 -10.199 -11.692 99 HD12 ILE 12 HD12 ILE 12 -9.579 -9.131 -12.414 100 HD13 ILE 12 HD13 ILE 12 -10.923 -9.729 -13.386 101 H ALA 13 H ALA 13 -5.576 -10.770 -14.912 102 HA ALA 13 HA ALA 13 -5.654 -10.354 -17.659 103 HB1 ALA 13 HB1 ALA 13 -3.185 -9.925 -17.440 104 HB2 ALA 13 HB2 ALA 13 -4.214 -9.010 -16.337 105 HB3 ALA 13 HB3 ALA 13 -3.327 -10.418 -15.752 106 H LYS 14 H LYS 14 -4.266 -13.011 -15.808 107 HA LYS 14 HA LYS 14 -2.879 -14.249 -17.929 108 HB2 LYS 14 HB2 LYS 14 -2.341 -14.869 -15.683 109 HB3 LYS 14 HB3 LYS 14 -4.005 -15.331 -15.346 110 HG2 LYS 14 HG2 LYS 14 -3.839 -17.301 -16.557 111 HG3 LYS 14 HG3 LYS 14 -2.438 -16.737 -17.470 112 HD2 LYS 14 HD2 LYS 14 -2.355 -17.203 -14.499 113 HD3 LYS 14 HD3 LYS 14 -2.001 -18.476 -15.670 114 HE2 LYS 14 HE2 LYS 14 -0.234 -17.043 -16.635 115 HE3 LYS 14 HE3 LYS 14 -0.560 -15.840 -15.388 116 HZ1 LYS 14 HZ1 LYS 14 0.693 -16.951 -13.957 117 HZ2 LYS 14 HZ2 LYS 14 1.178 -17.966 -15.220 118 HZ3 LYS 14 HZ3 LYS 14 -0.131 -18.402 -14.241 119 H ARG 15 H ARG 15 -6.169 -14.643 -16.688 120 HA ARG 15 HA ARG 15 -6.891 -16.820 -18.327 121 HB2 ARG 15 HB2 ARG 15 -8.593 -14.672 -17.051 122 HB3 ARG 15 HB3 ARG 15 -9.234 -16.116 -17.824 123 HG2 ARG 15 HG2 ARG 15 -7.310 -16.208 -15.518 124 HG3 ARG 15 HG3 ARG 15 -9.063 -16.195 -15.320 125 HD2 ARG 15 HD2 ARG 15 -9.311 -18.307 -16.165 126 HD3 ARG 15 HD3 ARG 15 -7.873 -18.187 -17.177 127 HE ARG 15 HE ARG 15 -7.234 -18.201 -14.397 128 HH11 ARG 15 HH11 ARG 15 -8.078 -20.234 -17.093 129 HH12 ARG 15 HH12 ARG 15 -7.298 -21.639 -16.447 130 HH21 ARG 15 HH21 ARG 15 -6.202 -20.044 -13.535 131 HH22 ARG 15 HH22 ARG 15 -6.231 -21.530 -14.422 132 H LEU 16 H LEU 16 -6.915 -13.349 -18.837 133 HA LEU 16 HA LEU 16 -8.514 -13.266 -21.141 134 HB2 LEU 16 HB2 LEU 16 -6.241 -11.485 -20.281 135 HB3 LEU 16 HB3 LEU 16 -7.340 -11.125 -21.611 136 HG LEU 16 HG LEU 16 -8.101 -11.371 -18.701 137 HD11 LEU 16 HD11 LEU 16 -7.114 -9.321 -18.743 138 HD12 LEU 16 HD12 LEU 16 -8.721 -8.872 -19.313 139 HD13 LEU 16 HD13 LEU 16 -7.405 -9.090 -20.467 140 HD21 LEU 16 HD21 LEU 16 -9.938 -12.101 -20.034 141 HD22 LEU 16 HD22 LEU 16 -9.723 -10.766 -21.166 142 HD23 LEU 16 HD23 LEU 16 -10.278 -10.448 -19.522 143 H GLU 17 H GLU 17 -5.248 -14.283 -20.648 144 HA GLU 17 HA GLU 17 -4.366 -14.001 -23.345 145 HB2 GLU 17 HB2 GLU 17 -3.316 -15.768 -21.128 146 HB3 GLU 17 HB3 GLU 17 -2.493 -15.451 -22.648 147 HG2 GLU 17 HG2 GLU 17 -2.333 -13.087 -22.080 148 HG3 GLU 17 HG3 GLU 17 -3.177 -13.391 -20.563 149 H SER 18 H SER 18 -6.455 -16.171 -21.801 150 HA SER 18 HA SER 18 -5.940 -18.378 -23.620 151 HB2 SER 18 HB2 SER 18 -7.284 -18.036 -21.073 152 HB3 SER 18 HB3 SER 18 -8.301 -18.914 -22.215 153 HG SER 18 HG SER 18 -6.376 -19.916 -20.813 154 H ILE 19 H ILE 19 -7.799 -15.561 -23.566 155 HA ILE 19 HA ILE 19 -10.162 -16.295 -24.841 156 HB ILE 19 HB ILE 19 -8.614 -13.734 -25.252 157 HG12 ILE 19 HG12 ILE 19 -10.808 -14.335 -23.258 158 HG13 ILE 19 HG13 ILE 19 -9.093 -14.303 -22.862 159 HG21 ILE 19 HG21 ILE 19 -11.196 -14.701 -26.205 160 HG22 ILE 19 HG22 ILE 19 -11.288 -13.143 -25.384 161 HG23 ILE 19 HG23 ILE 19 -10.213 -13.349 -26.767 162 HD11 ILE 19 HD11 ILE 19 -10.248 -11.910 -24.171 163 HD12 ILE 19 HD12 ILE 19 -10.663 -12.217 -22.484 164 HD13 ILE 19 HD13 ILE 19 -8.974 -12.040 -22.959 165 H ASP 20 H ASP 20 -10.785 -16.516 -26.962 166 HA ASP 20 HA ASP 20 -8.594 -16.755 -28.918 167 HB2 ASP 20 HB2 ASP 20 -10.629 -18.607 -28.146 168 HB3 ASP 20 HB3 ASP 20 -10.901 -18.149 -29.825 169 HA PRO 21 HA PRO 21 -10.459 -13.710 -31.468 170 HB2 PRO 21 HB2 PRO 21 -9.854 -14.642 -33.945 171 HB3 PRO 21 HB3 PRO 21 -8.648 -13.936 -32.863 172 HG2 PRO 21 HG2 PRO 21 -9.256 -16.818 -33.401 173 HG3 PRO 21 HG3 PRO 21 -7.681 -16.016 -33.247 174 HD2 PRO 21 HD2 PRO 21 -8.791 -17.447 -31.234 175 HD3 PRO 21 HD3 PRO 21 -7.757 -16.033 -30.943 176 H ALA 22 H ALA 22 -11.131 -17.054 -32.478 177 HA ALA 22 HA ALA 22 -13.433 -16.448 -34.002 178 HB1 ALA 22 HB1 ALA 22 -13.396 -18.622 -34.501 179 HB2 ALA 22 HB2 ALA 22 -11.907 -18.694 -33.558 180 HB3 ALA 22 HB3 ALA 22 -13.449 -19.099 -32.804 181 H ASN 23 H ASN 23 -13.118 -17.827 -30.725 182 HA ASN 23 HA ASN 23 -15.939 -17.484 -30.221 183 HB2 ASN 23 HB2 ASN 23 -13.838 -19.044 -29.119 184 HB3 ASN 23 HB3 ASN 23 -14.473 -18.034 -27.823 185 HD21 ASN 23 HD21 ASN 23 -15.238 -20.489 -30.181 186 HD22 ASN 23 HD22 ASN 23 -16.698 -21.031 -29.432 187 H ARG 24 H ARG 24 -16.773 -15.583 -29.694 188 HA ARG 24 HA ARG 24 -15.949 -14.062 -27.497 189 HB2 ARG 24 HB2 ARG 24 -14.286 -13.607 -29.661 190 HB3 ARG 24 HB3 ARG 24 -15.440 -12.283 -29.754 191 HG2 ARG 24 HG2 ARG 24 -14.670 -11.296 -27.877 192 HG3 ARG 24 HG3 ARG 24 -14.301 -12.832 -27.090 193 HD2 ARG 24 HD2 ARG 24 -12.158 -12.497 -27.571 194 HD3 ARG 24 HD3 ARG 24 -12.564 -12.661 -29.279 195 HE ARG 24 HE ARG 24 -13.077 -10.026 -28.356 196 HH11 ARG 24 HH11 ARG 24 -10.505 -12.178 -29.294 197 HH12 ARG 24 HH12 ARG 24 -9.444 -10.903 -29.794 198 HH21 ARG 24 HH21 ARG 24 -11.689 -8.339 -29.011 199 HH22 ARG 24 HH22 ARG 24 -10.118 -8.719 -29.632 200 H GLN 25 H GLN 25 -17.975 -13.619 -26.896 201 HA GLN 25 HA GLN 25 -20.050 -13.017 -28.781 202 HB2 GLN 25 HB2 GLN 25 -20.131 -14.125 -26.365 203 HB3 GLN 25 HB3 GLN 25 -20.393 -12.457 -25.876 204 HG2 GLN 25 HG2 GLN 25 -22.483 -12.426 -26.659 205 HG3 GLN 25 HG3 GLN 25 -22.053 -13.309 -28.123 206 HE21 GLN 25 HE21 GLN 25 -24.036 -14.460 -27.838 207 HE22 GLN 25 HE22 GLN 25 -24.126 -15.776 -26.724 208 H VAL 26 H VAL 26 -18.571 -11.155 -26.120 209 HA VAL 26 HA VAL 26 -18.555 -8.752 -27.692 210 HB VAL 26 HB VAL 26 -20.931 -8.877 -26.900 211 HG11 VAL 26 HG11 VAL 26 -20.093 -8.068 -24.179 212 HG12 VAL 26 HG12 VAL 26 -21.522 -8.956 -24.711 213 HG13 VAL 26 HG13 VAL 26 -19.968 -9.781 -24.578 214 HG21 VAL 26 HG21 VAL 26 -20.878 -6.667 -27.112 215 HG22 VAL 26 HG22 VAL 26 -20.190 -6.498 -25.497 216 HG23 VAL 26 HG23 VAL 26 -19.129 -6.708 -26.890 217 H GLU 27 H GLU 27 -17.122 -7.265 -26.916 218 HA GLU 27 HA GLU 27 -16.088 -7.582 -24.200 219 HB2 GLU 27 HB2 GLU 27 -14.372 -7.624 -26.687 220 HB3 GLU 27 HB3 GLU 27 -13.748 -7.447 -25.053 221 HG2 GLU 27 HG2 GLU 27 -15.236 -9.691 -24.790 222 HG3 GLU 27 HG3 GLU 27 -14.704 -9.832 -26.464 223 H HIS 28 H HIS 28 -16.084 -5.663 -23.254 224 HA HIS 28 HA HIS 28 -15.490 -3.282 -24.877 225 HB2 HIS 28 HB2 HIS 28 -17.139 -2.125 -23.206 226 HB3 HIS 28 HB3 HIS 28 -17.773 -2.989 -24.603 227 HD1 HIS 28 HD1 HIS 28 -17.920 -2.876 -20.952 228 HD2 HIS 28 HD2 HIS 28 -18.824 -5.615 -23.942 229 HE1 HIS 28 HE1 HIS 28 -19.388 -4.602 -19.861 230 H VAL 29 H VAL 29 -14.398 -1.604 -23.827 231 HA VAL 29 HA VAL 29 -12.538 -2.375 -21.867 232 HB VAL 29 HB VAL 29 -13.344 0.431 -22.647 233 HG11 VAL 29 HG11 VAL 29 -11.856 1.148 -21.166 234 HG12 VAL 29 HG12 VAL 29 -11.582 -0.515 -20.641 235 HG13 VAL 29 HG13 VAL 29 -10.601 0.177 -21.934 236 HG21 VAL 29 HG21 VAL 29 -11.056 -1.208 -23.721 237 HG22 VAL 29 HG22 VAL 29 -12.618 -1.069 -24.528 238 HG23 VAL 29 HG23 VAL 29 -11.619 0.364 -24.289 239 H TYR 30 H TYR 30 -12.536 -2.279 -19.700 240 HA TYR 30 HA TYR 30 -14.801 -0.938 -18.376 241 HB2 TYR 30 HB2 TYR 30 -14.454 -3.647 -18.452 242 HB3 TYR 30 HB3 TYR 30 -13.626 -3.234 -16.955 243 HD1 TYR 30 HD2 TYR 30 -16.834 -2.481 -18.723 244 HD2 TYR 30 HD1 TYR 30 -14.873 -3.194 -15.015 245 HE1 TYR 30 HE2 TYR 30 -19.000 -2.371 -17.562 246 HE2 TYR 30 HE1 TYR 30 -17.033 -3.087 -13.845 247 HH TYR 30 HH TYR 30 -19.780 -1.820 -15.167 248 H LYS 31 H LYS 31 -14.400 -0.056 -16.307 249 HA LYS 31 HA LYS 31 -11.546 0.434 -15.765 250 HB2 LYS 31 HB2 LYS 31 -13.845 2.208 -15.947 251 HB3 LYS 31 HB3 LYS 31 -12.993 2.394 -14.420 252 HG2 LYS 31 HG2 LYS 31 -10.889 2.443 -16.030 253 HG3 LYS 31 HG3 LYS 31 -12.105 3.005 -17.180 254 HD2 LYS 31 HD2 LYS 31 -11.165 4.935 -16.149 255 HD3 LYS 31 HD3 LYS 31 -12.782 4.721 -15.474 256 HE2 LYS 31 HE2 LYS 31 -11.990 4.383 -13.406 257 HE3 LYS 31 HE3 LYS 31 -10.702 3.324 -13.977 258 HZ1 LYS 31 HZ1 LYS 31 -9.240 5.022 -14.114 259 HZ2 LYS 31 HZ2 LYS 31 -10.239 5.700 -12.930 260 HZ3 LYS 31 HZ3 LYS 31 -10.410 6.166 -14.547 261 H PHE 32 H PHE 32 -10.750 0.107 -13.745 262 HA PHE 32 HA PHE 32 -12.643 -0.712 -11.648 263 HB2 PHE 32 HB2 PHE 32 -9.981 -2.054 -12.146 264 HB3 PHE 32 HB3 PHE 32 -11.220 -2.539 -10.992 265 HD1 PHE 32 HD2 PHE 32 -10.346 -2.368 -14.562 266 HD2 PHE 32 HD1 PHE 32 -13.089 -3.843 -11.661 267 HE1 PHE 32 HE2 PHE 32 -11.338 -3.849 -16.257 268 HE2 PHE 32 HE1 PHE 32 -14.085 -5.328 -13.352 269 HZ PHE 32 HZ PHE 32 -13.210 -5.331 -15.654 270 H ARG 33 H ARG 33 -12.497 0.789 -10.117 271 HA ARG 33 HA ARG 33 -9.845 1.888 -9.467 272 HB2 ARG 33 HB2 ARG 33 -11.122 3.768 -8.422 273 HB3 ARG 33 HB3 ARG 33 -11.348 3.624 -10.160 274 HG2 ARG 33 HG2 ARG 33 -13.439 2.208 -9.457 275 HG3 ARG 33 HG3 ARG 33 -13.266 3.106 -7.947 276 HD2 ARG 33 HD2 ARG 33 -13.072 4.743 -10.372 277 HD3 ARG 33 HD3 ARG 33 -14.640 3.973 -10.134 278 HE ARG 33 HE ARG 33 -13.655 5.278 -7.779 279 HH11 ARG 33 HH11 ARG 33 -15.361 5.731 -10.780 280 HH12 ARG 33 HH12 ARG 33 -16.212 7.138 -10.234 281 HH21 ARG 33 HH21 ARG 33 -14.770 7.130 -7.049 282 HH22 ARG 33 HH22 ARG 33 -15.875 7.933 -8.113 283 H ILE 34 H ILE 34 -8.969 1.426 -7.557 284 HA ILE 34 HA ILE 34 -10.611 0.009 -5.583 285 HB ILE 34 HB ILE 34 -7.620 0.178 -5.935 286 HG12 ILE 34 HG12 ILE 34 -8.780 -1.343 -7.470 287 HG13 ILE 34 HG13 ILE 34 -7.810 -2.245 -6.310 288 HG21 ILE 34 HG21 ILE 34 -7.842 -1.673 -4.048 289 HG22 ILE 34 HG22 ILE 34 -7.664 0.038 -3.664 290 HG23 ILE 34 HG23 ILE 34 -9.260 -0.711 -3.628 291 HD11 ILE 34 HD11 ILE 34 -10.568 -2.494 -6.889 292 HD12 ILE 34 HD12 ILE 34 -9.592 -3.417 -5.746 293 HD13 ILE 34 HD13 ILE 34 -10.405 -1.943 -5.222 294 H THR 35 H THR 35 -11.264 1.018 -3.811 295 HA THR 35 HA THR 35 -9.968 3.545 -3.063 296 HB THR 35 HB THR 35 -12.003 4.024 -1.767 297 HG1 THR 35 HG1 THR 35 -13.689 2.594 -1.733 298 HG21 THR 35 HG21 THR 35 -11.811 3.821 -4.608 299 HG22 THR 35 HG22 THR 35 -12.723 4.982 -3.643 300 HG23 THR 35 HG23 THR 35 -13.467 3.457 -4.123 301 H GLN 36 H GLN 36 -9.209 3.917 -1.006 302 HA GLN 36 HA GLN 36 -8.813 1.520 0.632 303 HB2 GLN 36 HB2 GLN 36 -6.936 3.171 -0.211 304 HB3 GLN 36 HB3 GLN 36 -7.433 4.111 1.190 305 HG2 GLN 36 HG2 GLN 36 -7.169 1.668 2.305 306 HG3 GLN 36 HG3 GLN 36 -5.950 1.582 1.034 307 HE21 GLN 36 HE21 GLN 36 -4.032 2.005 1.841 308 HE22 GLN 36 HE22 GLN 36 -3.655 3.245 2.984 309 H GLY 37 H GLY 37 -10.242 1.236 2.210 310 HA2 GLY 37 HA2 GLY 37 -11.365 1.686 4.183 311 HA3 GLY 37 HA3 GLY 37 -10.698 3.311 4.149 312 H GLY 38 H GLY 38 -11.647 4.287 1.769 313 HA2 GLY 38 HA2 GLY 38 -14.320 3.819 1.155 314 HA3 GLY 38 HA3 GLY 38 -14.303 4.991 2.464 315 H LYS 39 H LYS 39 -11.568 5.157 0.463 316 HA LYS 39 HA LYS 39 -12.777 7.187 -1.270 317 HB2 LYS 39 HB2 LYS 39 -11.602 8.104 0.886 318 HB3 LYS 39 HB3 LYS 39 -10.123 7.753 0.000 319 HG2 LYS 39 HG2 LYS 39 -10.328 9.778 -0.884 320 HG3 LYS 39 HG3 LYS 39 -11.663 9.122 -1.835 321 HD2 LYS 39 HD2 LYS 39 -13.151 9.701 0.149 322 HD3 LYS 39 HD3 LYS 39 -11.786 10.640 0.759 323 HE2 LYS 39 HE2 LYS 39 -12.295 11.225 -2.021 324 HE3 LYS 39 HE3 LYS 39 -13.744 11.474 -1.048 325 HZ1 LYS 39 HZ1 LYS 39 -12.666 13.498 -0.925 326 HZ2 LYS 39 HZ2 LYS 39 -11.124 12.808 -0.837 327 HZ3 LYS 39 HZ3 LYS 39 -12.157 12.744 0.501 328 H VAL 40 H VAL 40 -11.730 7.501 -3.243 329 HA VAL 40 HA VAL 40 -10.448 5.269 -4.354 330 HB VAL 40 HB VAL 40 -10.716 8.111 -5.308 331 HG11 VAL 40 HG11 VAL 40 -9.981 7.018 -7.555 332 HG12 VAL 40 HG12 VAL 40 -8.759 7.563 -6.404 333 HG13 VAL 40 HG13 VAL 40 -9.173 5.851 -6.508 334 HG21 VAL 40 HG21 VAL 40 -12.334 7.232 -6.812 335 HG22 VAL 40 HG22 VAL 40 -11.887 5.571 -6.426 336 HG23 VAL 40 HG23 VAL 40 -12.701 6.568 -5.220 337 H VAL 41 H VAL 41 -8.383 4.649 -4.466 338 HA VAL 41 HA VAL 41 -6.294 6.591 -3.728 339 HB VAL 41 HB VAL 41 -5.058 4.612 -2.715 340 HG11 VAL 41 HG11 VAL 41 -5.924 5.040 -0.598 341 HG12 VAL 41 HG12 VAL 41 -6.365 6.482 -1.514 342 HG13 VAL 41 HG13 VAL 41 -7.569 5.231 -1.203 343 HG21 VAL 41 HG21 VAL 41 -6.250 2.677 -2.077 344 HG22 VAL 41 HG22 VAL 41 -7.801 3.390 -2.523 345 HG23 VAL 41 HG23 VAL 41 -6.644 2.940 -3.776 346 H LYS 42 H LYS 42 -7.451 4.332 -5.945 347 HA LYS 42 HA LYS 42 -5.267 4.739 -7.719 348 HB2 LYS 42 HB2 LYS 42 -4.761 2.746 -5.920 349 HB3 LYS 42 HB3 LYS 42 -5.492 1.843 -7.241 350 HG2 LYS 42 HG2 LYS 42 -3.833 2.603 -8.777 351 HG3 LYS 42 HG3 LYS 42 -3.181 3.737 -7.592 352 HD2 LYS 42 HD2 LYS 42 -3.273 0.804 -6.994 353 HD3 LYS 42 HD3 LYS 42 -1.974 1.474 -7.983 354 HE2 LYS 42 HE2 LYS 42 -2.655 2.722 -5.353 355 HE3 LYS 42 HE3 LYS 42 -1.667 1.263 -5.406 356 HZ1 LYS 42 HZ1 LYS 42 -0.187 3.073 -5.420 357 HZ2 LYS 42 HZ2 LYS 42 -1.067 3.906 -6.600 358 HZ3 LYS 42 HZ3 LYS 42 -0.213 2.506 -7.014 359 H ASN 43 H ASN 43 -5.689 3.973 -9.826 360 HA ASN 43 HA ASN 43 -8.252 2.626 -10.258 361 HB2 ASN 43 HB2 ASN 43 -8.532 4.353 -12.222 362 HB3 ASN 43 HB3 ASN 43 -9.057 4.768 -10.593 363 HD21 ASN 43 HD21 ASN 43 -8.481 6.701 -9.952 364 HD22 ASN 43 HD22 ASN 43 -7.078 7.573 -10.460 365 H TRP 44 H TRP 44 -8.072 1.051 -11.709 366 HA TRP 44 HA TRP 44 -5.707 1.041 -13.457 367 HB2 TRP 44 HB2 TRP 44 -7.396 -1.202 -12.348 368 HB3 TRP 44 HB3 TRP 44 -6.220 -1.445 -13.636 369 HD1 TRP 44 HD1 TRP 44 -6.412 -0.519 -9.909 370 HE1 TRP 44 HE1 TRP 44 -4.118 -0.984 -8.839 371 HE3 TRP 44 HE3 TRP 44 -3.771 -1.690 -14.127 372 HZ2 TRP 44 HZ2 TRP 44 -1.531 -1.746 -9.672 373 HZ3 TRP 44 HZ3 TRP 44 -1.392 -2.274 -13.904 374 HH2 TRP 44 HH2 TRP 44 -0.296 -2.301 -11.722 375 H VAL 45 H VAL 45 -5.943 0.219 -15.629 376 HA VAL 45 HA VAL 45 -8.660 0.587 -16.713 377 HB VAL 45 HB VAL 45 -6.032 1.437 -17.933 378 HG11 VAL 45 HG11 VAL 45 -8.795 1.354 -19.130 379 HG12 VAL 45 HG12 VAL 45 -7.456 2.280 -19.809 380 HG13 VAL 45 HG13 VAL 45 -7.349 0.523 -19.702 381 HG21 VAL 45 HG21 VAL 45 -8.351 3.257 -17.596 382 HG22 VAL 45 HG22 VAL 45 -7.445 2.812 -16.150 383 HG23 VAL 45 HG23 VAL 45 -6.622 3.594 -17.500 384 H MET 46 H MET 46 -9.411 -0.932 -18.088 385 HA MET 46 HA MET 46 -7.600 -3.162 -18.725 386 HB2 MET 46 HB2 MET 46 -9.326 -4.043 -17.412 387 HB3 MET 46 HB3 MET 46 -10.548 -3.034 -18.175 388 HG2 MET 46 HG2 MET 46 -10.547 -4.356 -20.136 389 HG3 MET 46 HG3 MET 46 -9.096 -5.220 -19.633 390 HE1 MET 46 HE1 MET 46 -12.600 -4.546 -19.528 391 HE2 MET 46 HE2 MET 46 -13.077 -6.235 -19.705 392 HE3 MET 46 HE3 MET 46 -13.310 -5.409 -18.163 393 H ASP 47 H ASP 47 -6.929 -3.202 -20.758 394 HA ASP 47 HA ASP 47 -8.011 -1.635 -22.827 395 HB2 ASP 47 HB2 ASP 47 -5.679 -2.959 -22.498 396 HB3 ASP 47 HB3 ASP 47 -6.500 -4.062 -23.599 397 H LEU 48 H LEU 48 -8.154 -3.292 -25.045 398 HA LEU 48 HA LEU 48 -10.055 -5.398 -24.629 399 HB2 LEU 48 HB2 LEU 48 -11.231 -3.027 -24.527 400 HB3 LEU 48 HB3 LEU 48 -11.148 -3.181 -26.281 401 HG LEU 48 HG LEU 48 -13.311 -3.902 -25.511 402 HD11 LEU 48 HD11 LEU 48 -12.095 -6.539 -26.039 403 HD12 LEU 48 HD12 LEU 48 -11.774 -5.274 -27.225 404 HD13 LEU 48 HD13 LEU 48 -13.436 -5.721 -26.842 405 HD21 LEU 48 HD21 LEU 48 -11.830 -5.880 -23.780 406 HD22 LEU 48 HD22 LEU 48 -13.580 -5.783 -23.981 407 HD23 LEU 48 HD23 LEU 48 -12.705 -4.459 -23.210 408 H LYS 49 H LYS 49 -8.584 -3.119 -26.893 409 HA LYS 49 HA LYS 49 -8.930 -4.848 -29.161 410 HB2 LYS 49 HB2 LYS 49 -8.094 -2.142 -28.688 411 HB3 LYS 49 HB3 LYS 49 -6.900 -2.952 -29.693 412 HG2 LYS 49 HG2 LYS 49 -8.253 -2.273 -31.354 413 HG3 LYS 49 HG3 LYS 49 -9.146 -3.737 -30.936 414 HD2 LYS 49 HD2 LYS 49 -10.617 -2.432 -29.487 415 HD3 LYS 49 HD3 LYS 49 -9.713 -0.967 -29.878 416 HE2 LYS 49 HE2 LYS 49 -10.355 -1.174 -32.214 417 HE3 LYS 49 HE3 LYS 49 -11.205 -2.679 -31.865 418 HZ1 LYS 49 HZ1 LYS 49 -12.700 -0.762 -32.004 419 HZ2 LYS 49 HZ2 LYS 49 -11.895 -0.033 -30.708 420 HZ3 LYS 49 HZ3 LYS 49 -12.740 -1.479 -30.472 421 H ASN 50 H ASN 50 -6.425 -4.222 -26.803 422 HA ASN 50 HA ASN 50 -4.610 -6.047 -28.216 423 HB2 ASN 50 HB2 ASN 50 -4.191 -3.626 -26.787 424 HB3 ASN 50 HB3 ASN 50 -3.405 -4.916 -25.882 425 HD21 ASN 50 HD21 ASN 50 -1.423 -5.411 -26.465 426 HD22 ASN 50 HD22 ASN 50 -0.698 -5.074 -27.997 427 H VAL 51 H VAL 51 -6.640 -5.766 -25.458 428 HA VAL 51 HA VAL 51 -7.244 -7.257 -23.844 429 HB VAL 51 HB VAL 51 -5.497 -9.303 -25.203 430 HG11 VAL 51 HG11 VAL 51 -7.738 -10.570 -24.333 431 HG12 VAL 51 HG12 VAL 51 -6.229 -10.461 -23.423 432 HG13 VAL 51 HG13 VAL 51 -7.541 -9.326 -23.099 433 HG21 VAL 51 HG21 VAL 51 -7.457 -9.918 -26.544 434 HG22 VAL 51 HG22 VAL 51 -8.336 -8.538 -25.885 435 HG23 VAL 51 HG23 VAL 51 -6.915 -8.277 -26.897 436 H LYS 52 H LYS 52 -5.435 -5.576 -22.981 437 HA LYS 52 HA LYS 52 -3.702 -7.221 -21.289 438 HB2 LYS 52 HB2 LYS 52 -2.317 -6.392 -23.166 439 HB3 LYS 52 HB3 LYS 52 -2.753 -4.742 -22.740 440 HG2 LYS 52 HG2 LYS 52 -1.612 -4.924 -20.637 441 HG3 LYS 52 HG3 LYS 52 -1.299 -6.639 -20.910 442 HD2 LYS 52 HD2 LYS 52 0.363 -6.235 -22.426 443 HD3 LYS 52 HD3 LYS 52 -0.347 -4.709 -22.960 444 HE2 LYS 52 HE2 LYS 52 0.808 -3.519 -21.454 445 HE3 LYS 52 HE3 LYS 52 0.507 -4.686 -20.167 446 HZ1 LYS 52 HZ1 LYS 52 2.603 -4.855 -22.262 447 HZ2 LYS 52 HZ2 LYS 52 2.263 -6.089 -21.156 448 HZ3 LYS 52 HZ3 LYS 52 2.840 -4.597 -20.606 449 H LEU 53 H LEU 53 -3.113 -6.229 -19.296 450 HA LEU 53 HA LEU 53 -4.904 -4.018 -18.540 451 HB2 LEU 53 HB2 LEU 53 -4.431 -6.565 -17.375 452 HB3 LEU 53 HB3 LEU 53 -3.846 -5.336 -16.255 453 HG LEU 53 HG LEU 53 -6.079 -4.270 -16.321 454 HD11 LEU 53 HD11 LEU 53 -7.956 -5.504 -17.283 455 HD12 LEU 53 HD12 LEU 53 -6.838 -6.701 -17.935 456 HD13 LEU 53 HD13 LEU 53 -6.788 -5.038 -18.520 457 HD21 LEU 53 HD21 LEU 53 -7.255 -6.103 -15.074 458 HD22 LEU 53 HD22 LEU 53 -5.630 -5.729 -14.498 459 HD23 LEU 53 HD23 LEU 53 -5.906 -7.160 -15.492 460 H VAL 54 H VAL 54 -4.053 -2.170 -17.810 461 HA VAL 54 HA VAL 54 -1.320 -2.131 -16.779 462 HB VAL 54 HB VAL 54 -2.096 -0.067 -18.812 463 HG11 VAL 54 HG11 VAL 54 -0.199 0.620 -17.685 464 HG12 VAL 54 HG12 VAL 54 0.426 -1.023 -17.522 465 HG13 VAL 54 HG13 VAL 54 0.484 -0.207 -19.085 466 HG21 VAL 54 HG21 VAL 54 -0.961 -2.801 -19.338 467 HG22 VAL 54 HG22 VAL 54 -2.367 -2.039 -20.081 468 HG23 VAL 54 HG23 VAL 54 -0.747 -1.453 -20.455 469 H GLU 55 H GLU 55 -0.771 -0.030 -15.774 470 HA GLU 55 HA GLU 55 -3.038 0.944 -14.262 471 HB2 GLU 55 HB2 GLU 55 -1.253 2.283 -13.063 472 HB3 GLU 55 HB3 GLU 55 -1.097 0.535 -12.967 473 HG2 GLU 55 HG2 GLU 55 0.905 0.577 -13.913 474 HG3 GLU 55 HG3 GLU 55 0.332 1.584 -15.241 475 H SER 56 H SER 56 -4.287 2.374 -15.305 476 HA SER 56 HA SER 56 -3.091 4.894 -16.117 477 HB2 SER 56 HB2 SER 56 -3.033 3.586 -18.189 478 HB3 SER 56 HB3 SER 56 -4.754 3.235 -18.028 479 HG SER 56 HG SER 56 -3.476 5.638 -18.701 480 H ASP 57 H ASP 57 -4.868 6.475 -16.783 481 HA ASP 57 HA ASP 57 -7.245 6.003 -15.106 482 HB2 ASP 57 HB2 ASP 57 -5.328 7.970 -14.778 483 HB3 ASP 57 HB3 ASP 57 -6.618 8.806 -15.637 484 H ASP 58 H ASP 58 -6.416 5.918 -18.166 485 HA ASP 58 HA ASP 58 -7.914 7.738 -19.602 486 HB2 ASP 58 HB2 ASP 58 -6.339 5.867 -20.434 487 HB3 ASP 58 HB3 ASP 58 -7.772 4.843 -20.409 488 H ALA 59 H ALA 59 -9.982 7.477 -20.706 489 HA ALA 59 HA ALA 59 -12.053 6.776 -18.879 490 HB1 ALA 59 HB1 ALA 59 -13.128 8.266 -20.120 491 HB2 ALA 59 HB2 ALA 59 -11.821 8.260 -21.304 492 HB3 ALA 59 HB3 ALA 59 -13.154 7.114 -21.455 493 H ALA 60 H ALA 60 -13.999 5.471 -19.801 494 HA ALA 60 HA ALA 60 -13.340 3.242 -21.489 495 HB1 ALA 60 HB1 ALA 60 -12.278 2.516 -19.415 496 HB2 ALA 60 HB2 ALA 60 -13.804 2.723 -18.555 497 HB3 ALA 60 HB3 ALA 60 -13.661 1.496 -19.814 498 H GLU 61 H GLU 61 -15.198 1.690 -21.640 499 HA GLU 61 HA GLU 61 -17.573 3.036 -22.184 500 HB2 GLU 61 HB2 GLU 61 -17.149 0.092 -21.641 501 HB3 GLU 61 HB3 GLU 61 -18.596 0.783 -22.362 502 HG2 GLU 61 HG2 GLU 61 -15.851 0.534 -23.513 503 HG3 GLU 61 HG3 GLU 61 -17.394 0.008 -24.182 504 H ALA 62 H ALA 62 -16.391 1.678 -19.229 505 HA ALA 62 HA ALA 62 -18.480 2.902 -17.716 506 HB1 ALA 62 HB1 ALA 62 -18.825 0.361 -16.721 507 HB2 ALA 62 HB2 ALA 62 -19.947 1.221 -17.777 508 HB3 ALA 62 HB3 ALA 62 -18.769 0.104 -18.465 509 H THR 63 H THR 63 -18.184 2.594 -15.378 510 HA THR 63 HA THR 63 -15.460 1.714 -14.682 511 HB THR 63 HB THR 63 -16.845 4.204 -13.665 512 HG1 THR 63 HG1 THR 63 -15.846 4.286 -15.805 513 HG21 THR 63 HG21 THR 63 -14.251 2.879 -12.900 514 HG22 THR 63 HG22 THR 63 -15.593 3.342 -11.853 515 HG23 THR 63 HG23 THR 63 -14.576 4.583 -12.583 516 H LEU 64 H LEU 64 -15.269 0.522 -12.864 517 HA LEU 64 HA LEU 64 -17.682 0.186 -11.206 518 HB2 LEU 64 HB2 LEU 64 -17.454 -1.828 -12.374 519 HB3 LEU 64 HB3 LEU 64 -15.699 -1.824 -12.212 520 HG LEU 64 HG LEU 64 -15.971 -2.292 -9.790 521 HD11 LEU 64 HD11 LEU 64 -18.404 -1.345 -9.894 522 HD12 LEU 64 HD12 LEU 64 -18.001 -2.650 -8.779 523 HD13 LEU 64 HD13 LEU 64 -18.820 -3.010 -10.299 524 HD21 LEU 64 HD21 LEU 64 -16.885 -4.119 -11.945 525 HD22 LEU 64 HD22 LEU 64 -17.095 -4.642 -10.274 526 HD23 LEU 64 HD23 LEU 64 -15.487 -4.236 -10.876 527 H THR 65 H THR 65 -17.325 1.204 -9.343 528 HA THR 65 HA THR 65 -14.646 1.311 -8.207 529 HB THR 65 HB THR 65 -17.143 2.510 -7.013 530 HG1 THR 65 HG1 THR 65 -17.061 3.462 -8.989 531 HG21 THR 65 HG21 THR 65 -14.892 4.133 -6.622 532 HG22 THR 65 HG22 THR 65 -14.344 2.483 -6.328 533 HG23 THR 65 HG23 THR 65 -15.710 3.134 -5.422 534 H MET 66 H MET 66 -13.949 -0.026 -6.676 535 HA MET 66 HA MET 66 -15.778 -1.140 -4.725 536 HB2 MET 66 HB2 MET 66 -14.329 -2.833 -6.750 537 HB3 MET 66 HB3 MET 66 -14.834 -3.479 -5.195 538 HG2 MET 66 HG2 MET 66 -17.160 -2.862 -5.730 539 HG3 MET 66 HG3 MET 66 -16.621 -2.315 -7.316 540 HE1 MET 66 HE1 MET 66 -15.010 -3.887 -8.726 541 HE2 MET 66 HE2 MET 66 -14.277 -4.990 -7.561 542 HE3 MET 66 HE3 MET 66 -15.263 -5.626 -8.879 543 H GLU 67 H GLU 67 -14.789 -1.660 -2.813 544 HA GLU 67 HA GLU 67 -12.255 -0.541 -2.288 545 HB2 GLU 67 HB2 GLU 67 -14.395 -1.676 -0.785 546 HB3 GLU 67 HB3 GLU 67 -12.901 -2.446 -0.270 547 HG2 GLU 67 HG2 GLU 67 -12.848 0.493 -0.533 548 HG3 GLU 67 HG3 GLU 67 -13.818 -0.171 0.780 549 H ASP 68 H ASP 68 -10.345 -1.633 -1.496 550 HA ASP 68 HA ASP 68 -9.263 -3.481 -3.199 551 HB2 ASP 68 HB2 ASP 68 -7.982 -2.150 -1.540 552 HB3 ASP 68 HB3 ASP 68 -8.580 -3.207 -0.264 553 H ASP 69 H ASP 69 -10.567 -4.218 0.039 554 HA ASP 69 HA ASP 69 -10.320 -6.996 -0.134 555 HB2 ASP 69 HB2 ASP 69 -11.798 -5.090 1.570 556 HB3 ASP 69 HB3 ASP 69 -12.477 -6.714 1.497 557 H ILE 70 H ILE 70 -12.781 -4.828 -1.340 558 HA ILE 70 HA ILE 70 -14.753 -6.802 -1.875 559 HB ILE 70 HB ILE 70 -14.479 -4.220 -3.394 560 HG12 ILE 70 HG12 ILE 70 -14.201 -3.815 -0.943 561 HG13 ILE 70 HG13 ILE 70 -15.642 -3.066 -1.623 562 HG21 ILE 70 HG21 ILE 70 -16.600 -6.214 -2.891 563 HG22 ILE 70 HG22 ILE 70 -17.094 -4.521 -2.902 564 HG23 ILE 70 HG23 ILE 70 -16.293 -5.215 -4.312 565 HD11 ILE 70 HD11 ILE 70 -17.032 -4.791 -0.698 566 HD12 ILE 70 HD12 ILE 70 -15.616 -5.679 -0.134 567 HD13 ILE 70 HD13 ILE 70 -16.016 -4.115 0.575 568 H MET 71 H MET 71 -12.417 -5.128 -3.986 569 HA MET 71 HA MET 71 -13.015 -6.370 -6.375 570 HB2 MET 71 HB2 MET 71 -11.482 -4.576 -6.434 571 HB3 MET 71 HB3 MET 71 -10.417 -5.338 -5.261 572 HG2 MET 71 HG2 MET 71 -9.429 -6.672 -6.809 573 HG3 MET 71 HG3 MET 71 -10.873 -6.760 -7.816 574 HE1 MET 71 HE1 MET 71 -11.904 -4.427 -8.353 575 HE2 MET 71 HE2 MET 71 -10.981 -2.983 -8.769 576 HE3 MET 71 HE3 MET 71 -11.191 -4.270 -9.958 577 H PHE 72 H PHE 72 -11.092 -7.560 -3.685 578 HA PHE 72 HA PHE 72 -9.965 -9.795 -4.975 579 HB2 PHE 72 HB2 PHE 72 -9.546 -8.685 -2.589 580 HB3 PHE 72 HB3 PHE 72 -10.645 -9.962 -2.080 581 HD1 PHE 72 HD1 PHE 72 -7.629 -9.530 -4.235 582 HD2 PHE 72 HD2 PHE 72 -9.720 -11.955 -1.431 583 HE1 PHE 72 HE1 PHE 72 -5.759 -11.128 -4.228 584 HE2 PHE 72 HE2 PHE 72 -7.853 -13.557 -1.419 585 HZ PHE 72 HZ PHE 72 -5.868 -13.144 -2.818 586 H ALA 73 H ALA 73 -12.996 -9.348 -3.221 587 HA ALA 73 HA ALA 73 -13.793 -12.051 -3.182 588 HB1 ALA 73 HB1 ALA 73 -15.936 -10.047 -3.376 589 HB2 ALA 73 HB2 ALA 73 -15.654 -11.299 -2.166 590 HB3 ALA 73 HB3 ALA 73 -14.764 -9.779 -2.086 591 H ILE 74 H ILE 74 -14.758 -9.405 -5.372 592 HA ILE 74 HA ILE 74 -16.217 -11.119 -7.116 593 HB ILE 74 HB ILE 74 -15.142 -8.338 -7.604 594 HG12 ILE 74 HG12 ILE 74 -17.779 -7.992 -7.329 595 HG13 ILE 74 HG13 ILE 74 -17.599 -9.423 -6.320 596 HG21 ILE 74 HG21 ILE 74 -16.997 -8.318 -9.342 597 HG22 ILE 74 HG22 ILE 74 -15.559 -9.263 -9.725 598 HG23 ILE 74 HG23 ILE 74 -17.025 -10.074 -9.175 599 HD11 ILE 74 HD11 ILE 74 -15.653 -7.281 -5.821 600 HD12 ILE 74 HD12 ILE 74 -17.331 -6.900 -5.431 601 HD13 ILE 74 HD13 ILE 74 -16.549 -8.297 -4.691 602 H GLY 75 H GLY 75 -12.896 -10.414 -6.752 603 HA2 GLY 75 HA2 GLY 75 -12.191 -11.035 -9.498 604 HA3 GLY 75 HA3 GLY 75 -11.076 -10.676 -8.188 605 H THR 76 H THR 76 -12.104 -12.624 -6.353 606 HA THR 76 HA THR 76 -10.944 -15.018 -7.584 607 HB THR 76 HB THR 76 -10.643 -15.857 -5.303 608 HG1 THR 76 HG1 THR 76 -11.319 -14.676 -3.551 609 HG21 THR 76 HG21 THR 76 -9.629 -13.061 -5.126 610 HG22 THR 76 HG22 THR 76 -9.105 -14.057 -6.484 611 HG23 THR 76 HG23 THR 76 -8.794 -14.586 -4.831 612 H GLY 77 H GLY 77 -13.728 -14.141 -8.036 613 HA2 GLY 77 HA2 GLY 77 -15.848 -15.025 -8.091 614 HA3 GLY 77 HA3 GLY 77 -15.027 -16.578 -8.037 615 H ALA 78 H ALA 78 -14.593 -14.402 -5.393 616 HA ALA 78 HA ALA 78 -15.665 -16.279 -3.538 617 HB1 ALA 78 HB1 ALA 78 -15.364 -13.679 -2.374 618 HB2 ALA 78 HB2 ALA 78 -14.405 -15.137 -2.113 619 HB3 ALA 78 HB3 ALA 78 -13.987 -14.029 -3.420 620 H LEU 79 H LEU 79 -16.587 -12.859 -3.952 621 HA LEU 79 HA LEU 79 -19.354 -13.628 -3.308 622 HB2 LEU 79 HB2 LEU 79 -17.680 -11.278 -2.649 623 HB3 LEU 79 HB3 LEU 79 -19.387 -10.976 -2.965 624 HG LEU 79 HG LEU 79 -18.321 -12.869 -0.870 625 HD11 LEU 79 HD11 LEU 79 -18.147 -10.188 -0.732 626 HD12 LEU 79 HD12 LEU 79 -18.415 -11.226 0.668 627 HD13 LEU 79 HD13 LEU 79 -19.780 -10.425 -0.110 628 HD21 LEU 79 HD21 LEU 79 -20.494 -13.547 -1.677 629 HD22 LEU 79 HD22 LEU 79 -21.111 -11.905 -1.494 630 HD23 LEU 79 HD23 LEU 79 -20.656 -12.841 -0.069 631 HA PRO 80 HA PRO 80 -20.608 -12.467 -7.365 632 HB2 PRO 80 HB2 PRO 80 -23.229 -11.955 -6.873 633 HB3 PRO 80 HB3 PRO 80 -22.562 -13.591 -6.920 634 HG2 PRO 80 HG2 PRO 80 -23.172 -11.862 -4.554 635 HG3 PRO 80 HG3 PRO 80 -23.486 -13.591 -4.786 636 HD2 PRO 80 HD2 PRO 80 -21.385 -12.673 -3.346 637 HD3 PRO 80 HD3 PRO 80 -21.317 -14.182 -4.279 638 H ALA 81 H ALA 81 -20.372 -10.620 -8.451 639 HA ALA 81 HA ALA 81 -20.171 -8.111 -7.184 640 HB1 ALA 81 HB1 ALA 81 -19.416 -9.122 -9.606 641 HB2 ALA 81 HB2 ALA 81 -20.715 -8.016 -10.055 642 HB3 ALA 81 HB3 ALA 81 -19.328 -7.423 -9.140 643 H LYS 82 H LYS 82 -22.846 -9.813 -8.581 644 HA LYS 82 HA LYS 82 -24.549 -7.595 -9.043 645 HB2 LYS 82 HB2 LYS 82 -26.371 -9.336 -8.992 646 HB3 LYS 82 HB3 LYS 82 -25.072 -9.644 -10.137 647 HG2 LYS 82 HG2 LYS 82 -24.052 -11.189 -8.488 648 HG3 LYS 82 HG3 LYS 82 -25.461 -10.947 -7.451 649 HD2 LYS 82 HD2 LYS 82 -26.916 -11.903 -9.095 650 HD3 LYS 82 HD3 LYS 82 -25.617 -11.954 -10.290 651 HE2 LYS 82 HE2 LYS 82 -24.472 -13.395 -8.352 652 HE3 LYS 82 HE3 LYS 82 -26.162 -13.735 -7.986 653 HZ1 LYS 82 HZ1 LYS 82 -24.545 -14.626 -10.200 654 HZ2 LYS 82 HZ2 LYS 82 -26.074 -14.064 -10.655 655 HZ3 LYS 82 HZ3 LYS 82 -25.935 -15.317 -9.527 656 H GLU 83 H GLU 83 -24.299 -9.894 -6.338 657 HA GLU 83 HA GLU 83 -26.328 -8.714 -4.770 658 HB2 GLU 83 HB2 GLU 83 -23.946 -10.329 -3.844 659 HB3 GLU 83 HB3 GLU 83 -25.413 -10.027 -2.923 660 HG2 GLU 83 HG2 GLU 83 -25.208 -11.597 -5.482 661 HG3 GLU 83 HG3 GLU 83 -25.434 -12.255 -3.863 662 H ALA 84 H ALA 84 -22.786 -8.392 -4.653 663 HA ALA 84 HA ALA 84 -22.522 -6.683 -2.517 664 HB1 ALA 84 HB1 ALA 84 -20.959 -7.048 -5.032 665 HB2 ALA 84 HB2 ALA 84 -20.541 -5.734 -3.932 666 HB3 ALA 84 HB3 ALA 84 -20.508 -7.403 -3.364 667 H MET 85 H MET 85 -23.499 -5.925 -5.812 668 HA MET 85 HA MET 85 -23.404 -3.095 -5.495 669 HB2 MET 85 HB2 MET 85 -23.839 -4.898 -7.607 670 HB3 MET 85 HB3 MET 85 -25.310 -3.941 -7.491 671 HG2 MET 85 HG2 MET 85 -23.300 -2.065 -7.282 672 HG3 MET 85 HG3 MET 85 -22.684 -3.210 -8.472 673 HE1 MET 85 HE1 MET 85 -25.420 -1.151 -7.212 674 HE2 MET 85 HE2 MET 85 -25.841 -0.144 -8.598 675 HE3 MET 85 HE3 MET 85 -26.750 -1.621 -8.272 676 H ALA 86 H ALA 86 -25.970 -5.522 -5.249 677 HA ALA 86 HA ALA 86 -28.052 -3.635 -4.763 678 HB1 ALA 86 HB1 ALA 86 -28.116 -6.531 -3.967 679 HB2 ALA 86 HB2 ALA 86 -29.462 -5.484 -4.420 680 HB3 ALA 86 HB3 ALA 86 -28.302 -6.008 -5.641 681 H GLN 87 H GLN 87 -25.606 -5.045 -2.816 682 HA GLN 87 HA GLN 87 -27.024 -4.511 -0.326 683 HB2 GLN 87 HB2 GLN 87 -24.276 -5.660 -0.840 684 HB3 GLN 87 HB3 GLN 87 -25.010 -5.481 0.748 685 HG2 GLN 87 HG2 GLN 87 -26.812 -6.886 -0.958 686 HG3 GLN 87 HG3 GLN 87 -25.222 -7.642 -1.040 687 HE21 GLN 87 HE21 GLN 87 -24.605 -8.931 0.569 688 HE22 GLN 87 HE22 GLN 87 -25.453 -9.141 2.060 689 H ASP 88 H ASP 88 -25.870 -2.477 -2.344 690 HA ASP 88 HA ASP 88 -24.827 -0.451 -2.306 691 HB2 ASP 88 HB2 ASP 88 -26.629 -0.403 -0.363 692 HB3 ASP 88 HB3 ASP 88 -25.195 -0.278 0.651 693 H LYS 89 H LYS 89 -23.053 -2.564 -2.193 694 HA LYS 89 HA LYS 89 -20.966 -1.553 -0.373 695 HB2 LYS 89 HB2 LYS 89 -21.374 -4.355 -1.433 696 HB3 LYS 89 HB3 LYS 89 -19.977 -3.837 -0.497 697 HG2 LYS 89 HG2 LYS 89 -21.969 -3.059 1.144 698 HG3 LYS 89 HG3 LYS 89 -22.716 -4.460 0.372 699 HD2 LYS 89 HD2 LYS 89 -21.113 -5.925 1.190 700 HD3 LYS 89 HD3 LYS 89 -19.930 -4.641 1.451 701 HE2 LYS 89 HE2 LYS 89 -22.006 -3.894 3.083 702 HE3 LYS 89 HE3 LYS 89 -22.028 -5.652 3.213 703 HZ1 LYS 89 HZ1 LYS 89 -20.308 -5.529 4.576 704 HZ2 LYS 89 HZ2 LYS 89 -20.272 -3.844 4.433 705 HZ3 LYS 89 HZ3 LYS 89 -19.370 -4.803 3.370 706 H MET 90 H MET 90 -21.905 -1.387 -3.454 707 HA MET 90 HA MET 90 -19.324 -0.643 -4.403 708 HB2 MET 90 HB2 MET 90 -19.019 -2.283 -6.128 709 HB3 MET 90 HB3 MET 90 -19.212 -3.132 -4.600 710 HG2 MET 90 HG2 MET 90 -21.521 -3.638 -5.149 711 HG3 MET 90 HG3 MET 90 -21.373 -2.740 -6.657 712 HE1 MET 90 HE1 MET 90 -19.542 -4.800 -9.037 713 HE2 MET 90 HE2 MET 90 -21.292 -4.626 -8.898 714 HE3 MET 90 HE3 MET 90 -20.237 -3.256 -8.543 715 H GLU 91 H GLU 91 -19.403 0.462 -6.395 716 HA GLU 91 HA GLU 91 -22.107 0.912 -7.469 717 HB2 GLU 91 HB2 GLU 91 -21.129 3.311 -7.921 718 HB3 GLU 91 HB3 GLU 91 -21.832 2.909 -6.361 719 HG2 GLU 91 HG2 GLU 91 -18.981 2.326 -6.540 720 HG3 GLU 91 HG3 GLU 91 -19.375 4.029 -6.763 721 H VAL 92 H VAL 92 -22.104 1.837 -9.676 722 HA VAL 92 HA VAL 92 -19.688 1.458 -11.238 723 HB VAL 92 HB VAL 92 -20.557 -0.796 -11.255 724 HG11 VAL 92 HG11 VAL 92 -22.725 -1.297 -11.226 725 HG12 VAL 92 HG12 VAL 92 -23.051 0.433 -11.106 726 HG13 VAL 92 HG13 VAL 92 -23.026 -0.354 -12.685 727 HG21 VAL 92 HG21 VAL 92 -21.123 0.645 -13.843 728 HG22 VAL 92 HG22 VAL 92 -19.570 -0.007 -13.323 729 HG23 VAL 92 HG23 VAL 92 -20.910 -1.098 -13.676 730 H ASP 93 H ASP 93 -19.699 2.565 -13.174 731 HA ASP 93 HA ASP 93 -22.133 4.115 -13.769 732 HB2 ASP 93 HB2 ASP 93 -19.783 5.182 -12.831 733 HB3 ASP 93 HB3 ASP 93 -19.598 5.357 -14.574 734 H GLY 94 H GLY 94 -22.084 5.024 -16.052 735 HA2 GLY 94 HA2 GLY 94 -21.308 4.786 -18.319 736 HA3 GLY 94 HA3 GLY 94 -20.728 3.179 -17.906 737 H GLN 95 H GLN 95 -21.890 1.592 -18.742 738 HA GLN 95 HA GLN 95 -24.751 2.073 -19.252 739 HB2 GLN 95 HB2 GLN 95 -22.620 0.848 -20.859 740 HB3 GLN 95 HB3 GLN 95 -24.107 -0.090 -20.805 741 HG2 GLN 95 HG2 GLN 95 -23.786 2.757 -21.718 742 HG3 GLN 95 HG3 GLN 95 -24.164 1.350 -22.711 743 HE21 GLN 95 HE21 GLN 95 -26.208 0.262 -22.280 744 HE22 GLN 95 HE22 GLN 95 -27.560 1.200 -21.753 745 H VAL 96 H VAL 96 -25.849 1.193 -17.608 746 HA VAL 96 HA VAL 96 -25.047 -0.898 -15.965 747 HB VAL 96 HB VAL 96 -27.878 -0.115 -16.676 748 HG11 VAL 96 HG11 VAL 96 -27.996 -1.003 -14.133 749 HG12 VAL 96 HG12 VAL 96 -28.322 -2.015 -15.542 750 HG13 VAL 96 HG13 VAL 96 -26.734 -2.054 -14.775 751 HG21 VAL 96 HG21 VAL 96 -27.553 1.011 -14.321 752 HG22 VAL 96 HG22 VAL 96 -25.854 0.994 -14.792 753 HG23 VAL 96 HG23 VAL 96 -27.038 1.829 -15.796 754 H GLU 97 H GLU 97 -26.445 -0.968 -19.137 755 HA GLU 97 HA GLU 97 -27.335 -3.682 -19.050 756 HB2 GLU 97 HB2 GLU 97 -27.428 -1.502 -20.901 757 HB3 GLU 97 HB3 GLU 97 -26.793 -2.917 -21.728 758 HG2 GLU 97 HG2 GLU 97 -29.026 -3.196 -22.081 759 HG3 GLU 97 HG3 GLU 97 -28.824 -4.114 -20.590 760 H LEU 98 H LEU 98 -24.326 -2.094 -19.728 761 HA LEU 98 HA LEU 98 -23.117 -4.326 -21.070 762 HB2 LEU 98 HB2 LEU 98 -22.233 -1.663 -20.102 763 HB3 LEU 98 HB3 LEU 98 -20.997 -2.895 -20.348 764 HG LEU 98 HG LEU 98 -22.912 -1.883 -22.450 765 HD11 LEU 98 HD11 LEU 98 -19.985 -1.487 -22.635 766 HD12 LEU 98 HD12 LEU 98 -20.866 -0.474 -21.491 767 HD13 LEU 98 HD13 LEU 98 -21.309 -0.467 -23.198 768 HD21 LEU 98 HD21 LEU 98 -20.584 -3.285 -23.400 769 HD22 LEU 98 HD22 LEU 98 -22.289 -3.586 -23.734 770 HD23 LEU 98 HD23 LEU 98 -21.528 -4.306 -22.314 771 H ILE 99 H ILE 99 -22.765 -2.866 -17.842 772 HA ILE 99 HA ILE 99 -20.895 -4.601 -16.777 773 HB ILE 99 HB ILE 99 -21.579 -2.630 -15.564 774 HG12 ILE 99 HG12 ILE 99 -22.315 -5.128 -14.021 775 HG13 ILE 99 HG13 ILE 99 -20.678 -4.531 -14.271 776 HG21 ILE 99 HG21 ILE 99 -23.915 -2.556 -16.202 777 HG22 ILE 99 HG22 ILE 99 -24.246 -4.000 -15.247 778 HG23 ILE 99 HG23 ILE 99 -23.768 -2.504 -14.445 779 HD11 ILE 99 HD11 ILE 99 -20.852 -3.240 -12.490 780 HD12 ILE 99 HD12 ILE 99 -22.274 -2.444 -13.165 781 HD13 ILE 99 HD13 ILE 99 -22.459 -3.904 -12.193 782 H PHE 100 H PHE 100 -24.344 -5.051 -17.223 783 HA PHE 100 HA PHE 100 -24.645 -7.346 -15.609 784 HB2 PHE 100 HB2 PHE 100 -26.241 -5.871 -17.549 785 HB3 PHE 100 HB3 PHE 100 -26.511 -7.608 -17.653 786 HD1 PHE 100 HD2 PHE 100 -26.600 -8.693 -15.128 787 HD2 PHE 100 HD1 PHE 100 -27.761 -4.759 -16.263 788 HE1 PHE 100 HE2 PHE 100 -28.096 -8.576 -13.178 789 HE2 PHE 100 HE1 PHE 100 -29.259 -4.635 -14.314 790 HZ PHE 100 HZ PHE 100 -29.429 -6.546 -12.770 791 H LEU 101 H LEU 101 -23.743 -6.905 -18.986 792 HA LEU 101 HA LEU 101 -23.815 -9.655 -19.686 793 HB2 LEU 101 HB2 LEU 101 -22.596 -7.205 -20.892 794 HB3 LEU 101 HB3 LEU 101 -22.211 -8.796 -21.542 795 HG LEU 101 HG LEU 101 -24.977 -7.602 -21.367 796 HD11 LEU 101 HD11 LEU 101 -24.474 -6.528 -23.239 797 HD12 LEU 101 HD12 LEU 101 -24.219 -8.087 -24.023 798 HD13 LEU 101 HD13 LEU 101 -22.864 -7.246 -23.271 799 HD21 LEU 101 HD21 LEU 101 -25.435 -9.835 -21.356 800 HD22 LEU 101 HD22 LEU 101 -23.920 -10.266 -22.150 801 HD23 LEU 101 HD23 LEU 101 -25.250 -9.591 -23.093 802 H LEU 102 H LEU 102 -21.646 -7.804 -17.841 803 HA LEU 102 HA LEU 102 -19.326 -9.450 -18.370 804 HB2 LEU 102 HB2 LEU 102 -19.921 -7.107 -16.619 805 HB3 LEU 102 HB3 LEU 102 -18.498 -8.094 -16.290 806 HG LEU 102 HG LEU 102 -19.063 -6.623 -18.864 807 HD11 LEU 102 HD11 LEU 102 -18.544 -5.122 -17.006 808 HD12 LEU 102 HD12 LEU 102 -17.236 -5.165 -18.187 809 HD13 LEU 102 HD13 LEU 102 -17.080 -6.045 -16.667 810 HD21 LEU 102 HD21 LEU 102 -17.668 -8.171 -19.695 811 HD22 LEU 102 HD22 LEU 102 -17.120 -8.682 -18.098 812 HD23 LEU 102 HD23 LEU 102 -16.417 -7.252 -18.856 813 H GLU 103 H GLU 103 -21.707 -9.022 -15.793 814 HA GLU 103 HA GLU 103 -20.773 -10.432 -13.714 815 HB2 GLU 103 HB2 GLU 103 -23.386 -9.895 -14.786 816 HB3 GLU 103 HB3 GLU 103 -23.350 -11.516 -14.106 817 HG2 GLU 103 HG2 GLU 103 -22.345 -9.135 -12.587 818 HG3 GLU 103 HG3 GLU 103 -24.042 -9.613 -12.573 819 HA PRO 104 HA PRO 104 -21.830 -14.719 -15.674 820 HB2 PRO 104 HB2 PRO 104 -22.494 -14.757 -18.306 821 HB3 PRO 104 HB3 PRO 104 -23.688 -14.564 -17.017 822 HG2 PRO 104 HG2 PRO 104 -22.420 -12.480 -18.753 823 HG3 PRO 104 HG3 PRO 104 -24.115 -12.643 -18.256 824 HD2 PRO 104 HD2 PRO 104 -22.409 -10.908 -17.067 825 HD3 PRO 104 HD3 PRO 104 -23.730 -11.703 -16.187 826 H PHE 105 H PHE 105 -20.268 -12.319 -17.723 827 HA PHE 105 HA PHE 105 -18.586 -14.004 -19.186 828 HB2 PHE 105 HB2 PHE 105 -18.984 -11.538 -19.573 829 HB3 PHE 105 HB3 PHE 105 -17.873 -11.225 -18.245 830 HD1 PHE 105 HD1 PHE 105 -18.003 -13.225 -21.393 831 HD2 PHE 105 HD2 PHE 105 -15.691 -10.785 -18.783 832 HE1 PHE 105 HE1 PHE 105 -16.108 -13.354 -22.957 833 HE2 PHE 105 HE2 PHE 105 -13.792 -10.910 -20.343 834 HZ PHE 105 HZ PHE 105 -13.999 -12.195 -22.433 835 H ILE 106 H ILE 106 -18.415 -12.905 -15.900 836 HA ILE 106 HA ILE 106 -15.708 -13.241 -15.348 837 HB ILE 106 HB ILE 106 -18.023 -13.833 -13.500 838 HG12 ILE 106 HG12 ILE 106 -16.450 -11.274 -13.859 839 HG13 ILE 106 HG13 ILE 106 -18.060 -11.556 -14.513 840 HG21 ILE 106 HG21 ILE 106 -16.325 -13.201 -11.741 841 HG22 ILE 106 HG22 ILE 106 -16.066 -14.750 -12.543 842 HG23 ILE 106 HG23 ILE 106 -15.098 -13.348 -12.999 843 HD11 ILE 106 HD11 ILE 106 -17.206 -10.981 -11.751 844 HD12 ILE 106 HD12 ILE 106 -18.660 -10.492 -12.621 845 HD13 ILE 106 HD13 ILE 106 -18.538 -12.119 -11.951 846 H ALA 107 H ALA 107 -18.225 -15.601 -15.804 847 HA ALA 107 HA ALA 107 -17.019 -17.815 -14.565 848 HB1 ALA 107 HB1 ALA 107 -18.572 -19.161 -15.754 849 HB2 ALA 107 HB2 ALA 107 -19.395 -17.649 -15.369 850 HB3 ALA 107 HB3 ALA 107 -18.785 -17.930 -17.000 851 H SER 108 H SER 108 -16.350 -16.202 -17.547 852 HA SER 108 HA SER 108 -14.903 -18.412 -18.713 853 HB2 SER 108 HB2 SER 108 -16.153 -16.534 -19.973 854 HB3 SER 108 HB3 SER 108 -14.728 -15.551 -19.637 855 HG SER 108 HG SER 108 -14.717 -16.723 -21.683 856 H LEU 109 H LEU 109 -14.109 -15.317 -17.182 857 HA LEU 109 HA LEU 109 -11.264 -15.937 -17.295 858 HB2 LEU 109 HB2 LEU 109 -12.425 -13.539 -15.938 859 HB3 LEU 109 HB3 LEU 109 -10.858 -13.723 -16.723 860 HG LEU 109 HG LEU 109 -13.516 -13.531 -18.140 861 HD11 LEU 109 HD11 LEU 109 -13.198 -11.374 -17.463 862 HD12 LEU 109 HD12 LEU 109 -12.253 -11.368 -18.951 863 HD13 LEU 109 HD13 LEU 109 -11.443 -11.534 -17.394 864 HD21 LEU 109 HD21 LEU 109 -10.743 -14.102 -19.028 865 HD22 LEU 109 HD22 LEU 109 -11.731 -13.052 -20.044 866 HD23 LEU 109 HD23 LEU 109 -12.281 -14.685 -19.665 867 H LYS 110 H LYS 110 -11.895 -17.857 -15.852 868 HA LYS 110 HA LYS 110 -11.809 -18.906 -13.833 869 HB2 LYS 110 HB2 LYS 110 -9.596 -17.884 -13.769 870 HB3 LYS 110 HB3 LYS 110 -10.275 -16.403 -13.106 871 HG2 LYS 110 HG2 LYS 110 -10.744 -18.926 -11.618 872 HG3 LYS 110 HG3 LYS 110 -9.123 -18.227 -11.581 873 HD2 LYS 110 HD2 LYS 110 -10.361 -16.021 -11.004 874 HD3 LYS 110 HD3 LYS 110 -11.704 -17.084 -10.576 875 HE2 LYS 110 HE2 LYS 110 -9.196 -18.016 -9.466 876 HE3 LYS 110 HE3 LYS 110 -9.559 -16.367 -8.960 877 HZ1 LYS 110 HZ1 LYS 110 -11.785 -18.214 -8.831 878 HZ2 LYS 110 HZ2 LYS 110 -11.288 -17.039 -7.722 879 HZ3 LYS 110 HZ3 LYS 110 -10.522 -18.547 -7.756 Start of MODEL 9 1 H1 MET 1 H MET 1 1.058 1.604 -1.479 2 HA MET 1 HA MET 1 2.744 0.938 -2.861 3 HB2 MET 1 HB2 MET 1 3.279 -0.628 -0.411 4 HB3 MET 1 HB3 MET 1 3.993 -1.258 -1.890 5 HG2 MET 1 HG2 MET 1 5.424 0.488 -2.113 6 HG3 MET 1 HG3 MET 1 4.328 1.630 -1.338 7 HE1 MET 1 HE1 MET 1 5.286 2.817 0.299 8 HE2 MET 1 HE2 MET 1 6.338 2.298 1.616 9 HE3 MET 1 HE3 MET 1 6.977 2.430 -0.023 10 H SER 2 H SER 2 1.106 -1.873 -1.413 11 HA SER 2 HA SER 2 0.563 -2.843 -4.136 12 HB2 SER 2 HB2 SER 2 2.440 -4.112 -2.990 13 HB3 SER 2 HB3 SER 2 1.238 -4.675 -1.829 14 HG SER 2 HG SER 2 0.079 -5.276 -3.946 15 H LEU 3 H LEU 3 -1.419 -3.804 -4.459 16 HA LEU 3 HA LEU 3 -3.277 -3.712 -2.174 17 HB2 LEU 3 HB2 LEU 3 -3.623 -2.927 -5.039 18 HB3 LEU 3 HB3 LEU 3 -5.016 -3.427 -4.082 19 HG LEU 3 HG LEU 3 -3.262 -1.274 -3.006 20 HD11 LEU 3 HD11 LEU 3 -3.447 -0.301 -5.081 21 HD12 LEU 3 HD12 LEU 3 -4.904 0.297 -4.287 22 HD13 LEU 3 HD13 LEU 3 -5.007 -1.054 -5.416 23 HD21 LEU 3 HD21 LEU 3 -6.249 -1.696 -3.005 24 HD22 LEU 3 HD22 LEU 3 -5.357 -0.480 -2.090 25 HD23 LEU 3 HD23 LEU 3 -5.152 -2.193 -1.717 26 H LYS 4 H LYS 4 -4.755 -5.372 -1.933 27 HA LYS 4 HA LYS 4 -3.970 -7.930 -2.768 28 HB2 LYS 4 HB2 LYS 4 -5.915 -6.817 -1.031 29 HB3 LYS 4 HB3 LYS 4 -6.759 -7.918 -2.111 30 HG2 LYS 4 HG2 LYS 4 -6.139 -9.188 -0.231 31 HG3 LYS 4 HG3 LYS 4 -5.019 -9.644 -1.517 32 HD2 LYS 4 HD2 LYS 4 -3.252 -8.447 -0.561 33 HD3 LYS 4 HD3 LYS 4 -4.331 -7.488 0.454 34 HE2 LYS 4 HE2 LYS 4 -4.732 -9.292 1.911 35 HE3 LYS 4 HE3 LYS 4 -4.069 -10.464 0.773 36 HZ1 LYS 4 HZ1 LYS 4 -2.018 -8.716 1.238 37 HZ2 LYS 4 HZ2 LYS 4 -2.180 -10.265 1.898 38 HZ3 LYS 4 HZ3 LYS 4 -2.729 -8.917 2.760 39 H SER 5 H SER 5 -6.332 -5.672 -4.068 40 HA SER 5 HA SER 5 -7.708 -7.339 -5.809 41 HB2 SER 5 HB2 SER 5 -8.024 -5.228 -7.195 42 HB3 SER 5 HB3 SER 5 -8.512 -5.117 -5.504 43 HG SER 5 HG SER 5 -7.044 -3.649 -5.203 44 H ASP 6 H ASP 6 -4.487 -6.068 -6.019 45 HA ASP 6 HA ASP 6 -3.982 -6.232 -8.742 46 HB2 ASP 6 HB2 ASP 6 -2.485 -5.549 -6.628 47 HB3 ASP 6 HB3 ASP 6 -1.844 -7.167 -6.900 48 H GLU 7 H GLU 7 -4.050 -8.769 -6.306 49 HA GLU 7 HA GLU 7 -2.900 -10.832 -7.815 50 HB2 GLU 7 HB2 GLU 7 -4.518 -10.616 -5.373 51 HB3 GLU 7 HB3 GLU 7 -4.724 -12.134 -6.236 52 HG2 GLU 7 HG2 GLU 7 -1.939 -11.296 -5.927 53 HG3 GLU 7 HG3 GLU 7 -2.778 -11.616 -4.410 54 H VAL 8 H VAL 8 -6.214 -9.646 -7.632 55 HA VAL 8 HA VAL 8 -7.354 -11.726 -9.206 56 HB VAL 8 HB VAL 8 -8.329 -8.979 -8.450 57 HG11 VAL 8 HG11 VAL 8 -9.294 -9.387 -10.594 58 HG12 VAL 8 HG12 VAL 8 -9.696 -11.050 -10.159 59 HG13 VAL 8 HG13 VAL 8 -10.533 -9.706 -9.380 60 HG21 VAL 8 HG21 VAL 8 -9.739 -11.476 -7.714 61 HG22 VAL 8 HG22 VAL 8 -8.188 -11.172 -6.932 62 HG23 VAL 8 HG23 VAL 8 -9.494 -9.996 -6.787 63 H PHE 9 H PHE 9 -6.238 -8.438 -9.924 64 HA PHE 9 HA PHE 9 -7.002 -8.416 -12.635 65 HB2 PHE 9 HB2 PHE 9 -4.718 -6.907 -11.350 66 HB3 PHE 9 HB3 PHE 9 -5.523 -6.498 -12.861 67 HD1 PHE 9 HD1 PHE 9 -8.349 -6.872 -12.126 68 HD2 PHE 9 HD2 PHE 9 -5.141 -5.100 -9.961 69 HE1 PHE 9 HE1 PHE 9 -9.957 -5.477 -10.892 70 HE2 PHE 9 HE2 PHE 9 -6.744 -3.703 -8.723 71 HZ PHE 9 HZ PHE 9 -9.156 -3.891 -9.187 72 H ALA 10 H ALA 10 -4.068 -9.479 -11.004 73 HA ALA 10 HA ALA 10 -2.483 -9.876 -13.301 74 HB1 ALA 10 HB1 ALA 10 -2.319 -10.497 -10.469 75 HB2 ALA 10 HB2 ALA 10 -1.597 -11.750 -11.479 76 HB3 ALA 10 HB3 ALA 10 -1.043 -10.081 -11.613 77 H LYS 11 H LYS 11 -4.474 -12.151 -11.420 78 HA LYS 11 HA LYS 11 -3.980 -14.386 -13.077 79 HB2 LYS 11 HB2 LYS 11 -5.907 -15.404 -11.937 80 HB3 LYS 11 HB3 LYS 11 -4.807 -14.638 -10.798 81 HG2 LYS 11 HG2 LYS 11 -6.292 -12.711 -10.647 82 HG3 LYS 11 HG3 LYS 11 -7.391 -13.463 -11.805 83 HD2 LYS 11 HD2 LYS 11 -6.627 -14.966 -9.344 84 HD3 LYS 11 HD3 LYS 11 -7.814 -13.665 -9.220 85 HE2 LYS 11 HE2 LYS 11 -9.290 -14.739 -10.716 86 HE3 LYS 11 HE3 LYS 11 -8.049 -15.870 -11.251 87 HZ1 LYS 11 HZ1 LYS 11 -9.849 -16.616 -9.558 88 HZ2 LYS 11 HZ2 LYS 11 -8.852 -15.852 -8.425 89 HZ3 LYS 11 HZ3 LYS 11 -8.248 -17.125 -9.360 90 H ILE 12 H ILE 12 -6.506 -11.919 -13.069 91 HA ILE 12 HA ILE 12 -8.163 -13.081 -15.024 92 HB ILE 12 HB ILE 12 -7.787 -10.239 -14.117 93 HG12 ILE 12 HG12 ILE 12 -10.150 -12.114 -13.904 94 HG13 ILE 12 HG13 ILE 12 -8.935 -11.911 -12.646 95 HG21 ILE 12 HG21 ILE 12 -8.510 -9.679 -16.190 96 HG22 ILE 12 HG22 ILE 12 -9.246 -11.255 -16.480 97 HG23 ILE 12 HG23 ILE 12 -10.078 -10.063 -15.481 98 HD11 ILE 12 HD11 ILE 12 -10.883 -9.862 -13.660 99 HD12 ILE 12 HD12 ILE 12 -10.816 -10.595 -12.057 100 HD13 ILE 12 HD13 ILE 12 -9.544 -9.490 -12.575 101 H ALA 13 H ALA 13 -5.584 -10.647 -15.308 102 HA ALA 13 HA ALA 13 -5.724 -10.121 -18.010 103 HB1 ALA 13 HB1 ALA 13 -3.915 -8.899 -17.590 104 HB2 ALA 13 HB2 ALA 13 -3.958 -9.531 -15.943 105 HB3 ALA 13 HB3 ALA 13 -2.970 -10.328 -17.168 106 H LYS 14 H LYS 14 -3.878 -12.705 -16.405 107 HA LYS 14 HA LYS 14 -2.688 -13.822 -18.652 108 HB2 LYS 14 HB2 LYS 14 -2.222 -14.414 -16.256 109 HB3 LYS 14 HB3 LYS 14 -3.703 -15.361 -16.258 110 HG2 LYS 14 HG2 LYS 14 -1.835 -16.822 -16.597 111 HG3 LYS 14 HG3 LYS 14 -2.773 -16.737 -18.090 112 HD2 LYS 14 HD2 LYS 14 -0.991 -16.025 -19.214 113 HD3 LYS 14 HD3 LYS 14 -0.779 -14.680 -18.091 114 HE2 LYS 14 HE2 LYS 14 0.218 -17.487 -17.618 115 HE3 LYS 14 HE3 LYS 14 1.202 -16.170 -18.254 116 HZ1 LYS 14 HZ1 LYS 14 0.047 -16.469 -15.555 117 HZ2 LYS 14 HZ2 LYS 14 0.494 -14.947 -16.141 118 HZ3 LYS 14 HZ3 LYS 14 1.654 -16.170 -15.993 119 H ARG 15 H ARG 15 -5.927 -14.267 -17.354 120 HA ARG 15 HA ARG 15 -6.645 -16.445 -19.025 121 HB2 ARG 15 HB2 ARG 15 -8.396 -14.404 -17.642 122 HB3 ARG 15 HB3 ARG 15 -8.962 -15.904 -18.364 123 HG2 ARG 15 HG2 ARG 15 -6.850 -15.985 -16.259 124 HG3 ARG 15 HG3 ARG 15 -8.541 -15.763 -15.806 125 HD2 ARG 15 HD2 ARG 15 -8.725 -17.983 -15.880 126 HD3 ARG 15 HD3 ARG 15 -8.612 -17.836 -17.634 127 HE ARG 15 HE ARG 15 -6.020 -17.893 -16.596 128 HH11 ARG 15 HH11 ARG 15 -8.787 -19.981 -16.908 129 HH12 ARG 15 HH12 ARG 15 -7.847 -21.436 -16.958 130 HH21 ARG 15 HH21 ARG 15 -4.771 -19.801 -16.661 131 HH22 ARG 15 HH22 ARG 15 -5.563 -21.332 -16.817 132 H LEU 16 H LEU 16 -6.672 -12.978 -19.418 133 HA LEU 16 HA LEU 16 -8.424 -12.788 -21.604 134 HB2 LEU 16 HB2 LEU 16 -6.024 -11.045 -21.091 135 HB3 LEU 16 HB3 LEU 16 -7.477 -10.624 -21.995 136 HG LEU 16 HG LEU 16 -7.213 -10.994 -19.016 137 HD11 LEU 16 HD11 LEU 16 -7.124 -8.774 -18.884 138 HD12 LEU 16 HD12 LEU 16 -8.441 -8.571 -20.038 139 HD13 LEU 16 HD13 LEU 16 -6.788 -8.786 -20.615 140 HD21 LEU 16 HD21 LEU 16 -9.307 -11.984 -19.731 141 HD22 LEU 16 HD22 LEU 16 -9.694 -10.543 -20.672 142 HD23 LEU 16 HD23 LEU 16 -9.610 -10.451 -18.913 143 H GLU 17 H GLU 17 -5.273 -14.073 -21.364 144 HA GLU 17 HA GLU 17 -4.615 -13.705 -24.160 145 HB2 GLU 17 HB2 GLU 17 -3.225 -15.363 -22.048 146 HB3 GLU 17 HB3 GLU 17 -2.587 -14.969 -23.638 147 HG2 GLU 17 HG2 GLU 17 -2.569 -12.598 -23.041 148 HG3 GLU 17 HG3 GLU 17 -3.195 -13.001 -21.443 149 H SER 18 H SER 18 -6.444 -15.871 -22.336 150 HA SER 18 HA SER 18 -6.041 -18.100 -24.185 151 HB2 SER 18 HB2 SER 18 -6.790 -17.875 -21.424 152 HB3 SER 18 HB3 SER 18 -8.063 -18.724 -22.302 153 HG SER 18 HG SER 18 -6.780 -20.373 -22.540 154 H ILE 19 H ILE 19 -8.091 -15.447 -23.719 155 HA ILE 19 HA ILE 19 -10.549 -16.473 -24.637 156 HB ILE 19 HB ILE 19 -9.526 -13.654 -24.987 157 HG12 ILE 19 HG12 ILE 19 -10.997 -14.919 -22.664 158 HG13 ILE 19 HG13 ILE 19 -9.334 -14.340 -22.650 159 HG21 ILE 19 HG21 ILE 19 -12.347 -14.698 -24.786 160 HG22 ILE 19 HG22 ILE 19 -11.856 -13.026 -25.051 161 HG23 ILE 19 HG23 ILE 19 -11.540 -14.243 -26.287 162 HD11 ILE 19 HD11 ILE 19 -10.517 -12.646 -21.607 163 HD12 ILE 19 HD12 ILE 19 -10.353 -12.062 -23.264 164 HD13 ILE 19 HD13 ILE 19 -11.875 -12.770 -22.725 165 H ASP 20 H ASP 20 -11.447 -16.637 -26.649 166 HA ASP 20 HA ASP 20 -9.640 -16.168 -28.930 167 HB2 ASP 20 HB2 ASP 20 -10.898 -18.574 -28.084 168 HB3 ASP 20 HB3 ASP 20 -11.653 -18.083 -29.597 169 HA PRO 21 HA PRO 21 -12.676 -13.548 -30.714 170 HB2 PRO 21 HB2 PRO 21 -12.237 -13.983 -33.358 171 HB3 PRO 21 HB3 PRO 21 -11.124 -13.065 -32.337 172 HG2 PRO 21 HG2 PRO 21 -10.965 -15.920 -33.221 173 HG3 PRO 21 HG3 PRO 21 -9.680 -14.701 -33.142 174 HD2 PRO 21 HD2 PRO 21 -9.999 -16.606 -31.244 175 HD3 PRO 21 HD3 PRO 21 -9.378 -14.985 -30.875 176 H ALA 22 H ALA 22 -12.628 -16.938 -31.550 177 HA ALA 22 HA ALA 22 -14.941 -17.103 -33.110 178 HB1 ALA 22 HB1 ALA 22 -15.018 -19.474 -32.396 179 HB2 ALA 22 HB2 ALA 22 -13.423 -18.962 -32.949 180 HB3 ALA 22 HB3 ALA 22 -13.746 -19.127 -31.224 181 H ASN 23 H ASN 23 -14.589 -17.658 -29.602 182 HA ASN 23 HA ASN 23 -17.494 -17.366 -29.320 183 HB2 ASN 23 HB2 ASN 23 -15.489 -18.985 -28.010 184 HB3 ASN 23 HB3 ASN 23 -16.386 -18.036 -26.828 185 HD21 ASN 23 HD21 ASN 23 -17.115 -19.814 -29.816 186 HD22 ASN 23 HD22 ASN 23 -18.473 -20.668 -29.174 187 H ARG 24 H ARG 24 -18.208 -15.407 -28.832 188 HA ARG 24 HA ARG 24 -17.429 -13.962 -26.575 189 HB2 ARG 24 HB2 ARG 24 -15.621 -13.616 -28.697 190 HB3 ARG 24 HB3 ARG 24 -16.601 -12.155 -28.669 191 HG2 ARG 24 HG2 ARG 24 -15.865 -11.535 -26.582 192 HG3 ARG 24 HG3 ARG 24 -15.444 -13.187 -26.124 193 HD2 ARG 24 HD2 ARG 24 -13.362 -12.268 -26.464 194 HD3 ARG 24 HD3 ARG 24 -13.695 -12.967 -28.048 195 HE ARG 24 HE ARG 24 -14.629 -10.363 -28.118 196 HH11 ARG 24 HH11 ARG 24 -11.585 -11.992 -27.670 197 HH12 ARG 24 HH12 ARG 24 -10.647 -10.702 -28.348 198 HH21 ARG 24 HH21 ARG 24 -13.405 -8.658 -29.012 199 HH22 ARG 24 HH22 ARG 24 -11.683 -8.806 -29.109 200 H GLN 25 H GLN 25 -19.077 -12.669 -26.056 201 HA GLN 25 HA GLN 25 -21.099 -12.133 -28.096 202 HB2 GLN 25 HB2 GLN 25 -21.144 -12.702 -25.270 203 HB3 GLN 25 HB3 GLN 25 -22.001 -11.203 -25.600 204 HG2 GLN 25 HG2 GLN 25 -23.679 -12.238 -26.684 205 HG3 GLN 25 HG3 GLN 25 -22.617 -13.453 -27.394 206 HE21 GLN 25 HE21 GLN 25 -21.909 -15.201 -26.015 207 HE22 GLN 25 HE22 GLN 25 -22.935 -15.742 -24.734 208 H VAL 26 H VAL 26 -19.516 -10.368 -25.430 209 HA VAL 26 HA VAL 26 -19.184 -8.038 -27.097 210 HB VAL 26 HB VAL 26 -21.568 -7.933 -26.172 211 HG11 VAL 26 HG11 VAL 26 -20.877 -8.720 -23.889 212 HG12 VAL 26 HG12 VAL 26 -20.150 -7.132 -23.639 213 HG13 VAL 26 HG13 VAL 26 -21.887 -7.275 -23.909 214 HG21 VAL 26 HG21 VAL 26 -21.397 -5.760 -26.617 215 HG22 VAL 26 HG22 VAL 26 -20.430 -5.478 -25.169 216 HG23 VAL 26 HG23 VAL 26 -19.647 -5.973 -26.670 217 H GLU 27 H GLU 27 -17.566 -6.717 -26.382 218 HA GLU 27 HA GLU 27 -16.610 -6.857 -23.662 219 HB2 GLU 27 HB2 GLU 27 -15.127 -8.105 -25.944 220 HB3 GLU 27 HB3 GLU 27 -14.227 -7.361 -24.630 221 HG2 GLU 27 HG2 GLU 27 -16.171 -9.645 -24.438 222 HG3 GLU 27 HG3 GLU 27 -14.426 -9.699 -24.196 223 H HIS 28 H HIS 28 -16.127 -4.845 -23.122 224 HA HIS 28 HA HIS 28 -14.838 -3.106 -25.110 225 HB2 HIS 28 HB2 HIS 28 -17.347 -2.615 -23.574 226 HB3 HIS 28 HB3 HIS 28 -16.267 -1.253 -23.852 227 HD1 HIS 28 HD1 HIS 28 -15.796 -0.656 -26.408 228 HD2 HIS 28 HD2 HIS 28 -18.903 -3.327 -25.716 229 HE1 HIS 28 HE1 HIS 28 -17.124 -0.710 -28.543 230 H VAL 29 H VAL 29 -13.923 -1.094 -24.029 231 HA VAL 29 HA VAL 29 -12.103 -1.878 -22.025 232 HB VAL 29 HB VAL 29 -12.849 0.914 -22.906 233 HG11 VAL 29 HG11 VAL 29 -11.116 -0.031 -20.821 234 HG12 VAL 29 HG12 VAL 29 -10.179 0.807 -22.060 235 HG13 VAL 29 HG13 VAL 29 -11.527 1.624 -21.268 236 HG21 VAL 29 HG21 VAL 29 -12.062 -0.179 -24.818 237 HG22 VAL 29 HG22 VAL 29 -10.639 0.644 -24.179 238 HG23 VAL 29 HG23 VAL 29 -10.851 -1.087 -23.912 239 H TYR 30 H TYR 30 -12.211 -1.843 -19.869 240 HA TYR 30 HA TYR 30 -14.430 -0.371 -18.609 241 HB2 TYR 30 HB2 TYR 30 -13.394 -3.135 -17.976 242 HB3 TYR 30 HB3 TYR 30 -14.423 -2.224 -16.877 243 HD1 TYR 30 HD1 TYR 30 -16.665 -1.334 -17.932 244 HD2 TYR 30 HD2 TYR 30 -14.384 -4.565 -19.502 245 HE1 TYR 30 HE1 TYR 30 -18.661 -2.166 -19.104 246 HE2 TYR 30 HE2 TYR 30 -16.373 -5.405 -20.679 247 HH TYR 30 HH TYR 30 -19.091 -5.078 -20.162 248 H LYS 31 H LYS 31 -14.015 0.639 -16.662 249 HA LYS 31 HA LYS 31 -11.170 0.801 -15.917 250 HB2 LYS 31 HB2 LYS 31 -13.107 2.822 -16.487 251 HB3 LYS 31 HB3 LYS 31 -12.643 2.961 -14.796 252 HG2 LYS 31 HG2 LYS 31 -10.216 2.757 -15.788 253 HG3 LYS 31 HG3 LYS 31 -11.013 3.339 -17.252 254 HD2 LYS 31 HD2 LYS 31 -11.415 4.726 -14.624 255 HD3 LYS 31 HD3 LYS 31 -9.997 5.064 -15.619 256 HE2 LYS 31 HE2 LYS 31 -11.811 5.339 -17.510 257 HE3 LYS 31 HE3 LYS 31 -12.873 5.646 -16.137 258 HZ1 LYS 31 HZ1 LYS 31 -10.785 7.294 -17.254 259 HZ2 LYS 31 HZ2 LYS 31 -10.745 7.187 -15.566 260 HZ3 LYS 31 HZ3 LYS 31 -12.143 7.734 -16.346 261 H PHE 32 H PHE 32 -10.556 0.416 -13.856 262 HA PHE 32 HA PHE 32 -12.686 -0.245 -11.929 263 HB2 PHE 32 HB2 PHE 32 -9.913 -1.436 -12.154 264 HB3 PHE 32 HB3 PHE 32 -11.097 -1.841 -10.915 265 HD1 PHE 32 HD1 PHE 32 -13.567 -2.034 -12.474 266 HD2 PHE 32 HD2 PHE 32 -9.632 -3.373 -13.387 267 HE1 PHE 32 HE1 PHE 32 -14.503 -3.777 -13.938 268 HE2 PHE 32 HE2 PHE 32 -10.561 -5.117 -14.852 269 HZ PHE 32 HZ PHE 32 -12.999 -5.320 -15.130 270 H ARG 33 H ARG 33 -12.675 0.742 -9.995 271 HA ARG 33 HA ARG 33 -10.426 2.554 -9.420 272 HB2 ARG 33 HB2 ARG 33 -13.373 2.761 -8.959 273 HB3 ARG 33 HB3 ARG 33 -12.279 3.598 -7.866 274 HG2 ARG 33 HG2 ARG 33 -11.287 4.769 -9.787 275 HG3 ARG 33 HG3 ARG 33 -12.442 3.962 -10.850 276 HD2 ARG 33 HD2 ARG 33 -14.052 5.415 -10.337 277 HD3 ARG 33 HD3 ARG 33 -13.761 5.228 -8.609 278 HE ARG 33 HE ARG 33 -12.508 7.148 -8.643 279 HH11 ARG 33 HH11 ARG 33 -13.025 6.049 -11.906 280 HH12 ARG 33 HH12 ARG 33 -12.371 7.480 -12.630 281 HH21 ARG 33 HH21 ARG 33 -11.644 9.037 -9.585 282 HH22 ARG 33 HH22 ARG 33 -11.585 9.179 -11.309 283 H ILE 34 H ILE 34 -9.162 2.000 -7.783 284 HA ILE 34 HA ILE 34 -10.200 0.138 -5.761 285 HB ILE 34 HB ILE 34 -7.357 0.795 -6.536 286 HG12 ILE 34 HG12 ILE 34 -8.670 -0.672 -8.085 287 HG13 ILE 34 HG13 ILE 34 -7.263 -1.459 -7.378 288 HG21 ILE 34 HG21 ILE 34 -7.198 -1.401 -4.941 289 HG22 ILE 34 HG22 ILE 34 -6.896 0.252 -4.409 290 HG23 ILE 34 HG23 ILE 34 -8.478 -0.483 -4.148 291 HD11 ILE 34 HD11 ILE 34 -9.217 -2.925 -7.446 292 HD12 ILE 34 HD12 ILE 34 -8.683 -2.616 -5.793 293 HD13 ILE 34 HD13 ILE 34 -10.101 -1.785 -6.432 294 H THR 35 H THR 35 -10.848 1.053 -3.936 295 HA THR 35 HA THR 35 -9.590 3.556 -3.058 296 HB THR 35 HB THR 35 -11.525 3.831 -1.573 297 HG1 THR 35 HG1 THR 35 -13.173 2.322 -1.570 298 HG21 THR 35 HG21 THR 35 -11.596 3.816 -4.439 299 HG22 THR 35 HG22 THR 35 -12.419 4.896 -3.313 300 HG23 THR 35 HG23 THR 35 -13.186 3.388 -3.809 301 H GLN 36 H GLN 36 -8.710 3.791 -1.021 302 HA GLN 36 HA GLN 36 -8.075 1.276 0.349 303 HB2 GLN 36 HB2 GLN 36 -6.538 3.562 -0.344 304 HB3 GLN 36 HB3 GLN 36 -6.614 3.490 1.411 305 HG2 GLN 36 HG2 GLN 36 -5.924 1.054 1.182 306 HG3 GLN 36 HG3 GLN 36 -5.533 1.443 -0.493 307 HE21 GLN 36 HE21 GLN 36 -3.415 1.584 -0.661 308 HE22 GLN 36 HE22 GLN 36 -2.365 2.437 0.412 309 H GLY 37 H GLY 37 -9.492 0.826 1.916 310 HA2 GLY 37 HA2 GLY 37 -10.422 1.053 4.033 311 HA3 GLY 37 HA3 GLY 37 -9.798 2.694 4.099 312 H GLY 38 H GLY 38 -10.946 3.872 1.920 313 HA2 GLY 38 HA2 GLY 38 -13.665 3.362 1.497 314 HA3 GLY 38 HA3 GLY 38 -13.536 4.464 2.860 315 H LYS 39 H LYS 39 -10.962 4.868 0.741 316 HA LYS 39 HA LYS 39 -12.360 6.900 -0.844 317 HB2 LYS 39 HB2 LYS 39 -10.894 7.609 1.348 318 HB3 LYS 39 HB3 LYS 39 -9.680 7.698 0.078 319 HG2 LYS 39 HG2 LYS 39 -10.437 9.770 -0.237 320 HG3 LYS 39 HG3 LYS 39 -11.788 8.996 -1.068 321 HD2 LYS 39 HD2 LYS 39 -13.240 9.437 0.607 322 HD3 LYS 39 HD3 LYS 39 -12.028 9.183 1.865 323 HE2 LYS 39 HE2 LYS 39 -11.127 11.361 1.547 324 HE3 LYS 39 HE3 LYS 39 -12.067 11.605 0.076 325 HZ1 LYS 39 HZ1 LYS 39 -13.874 11.028 2.100 326 HZ2 LYS 39 HZ2 LYS 39 -13.637 12.511 1.322 327 HZ3 LYS 39 HZ3 LYS 39 -12.792 12.158 2.744 328 H VAL 40 H VAL 40 -11.488 7.298 -2.866 329 HA VAL 40 HA VAL 40 -10.180 5.220 -4.166 330 HB VAL 40 HB VAL 40 -10.476 8.124 -4.909 331 HG11 VAL 40 HG11 VAL 40 -9.171 5.893 -6.446 332 HG12 VAL 40 HG12 VAL 40 -9.825 7.333 -7.228 333 HG13 VAL 40 HG13 VAL 40 -8.516 7.483 -6.056 334 HG21 VAL 40 HG21 VAL 40 -12.454 6.514 -4.800 335 HG22 VAL 40 HG22 VAL 40 -12.231 7.417 -6.299 336 HG23 VAL 40 HG23 VAL 40 -11.737 5.726 -6.206 337 H VAL 41 H VAL 41 -8.117 4.625 -4.386 338 HA VAL 41 HA VAL 41 -6.009 6.542 -3.649 339 HB VAL 41 HB VAL 41 -6.418 4.902 -1.807 340 HG11 VAL 41 HG11 VAL 41 -6.692 2.746 -2.253 341 HG12 VAL 41 HG12 VAL 41 -6.406 3.061 -3.965 342 HG13 VAL 41 HG13 VAL 41 -5.055 2.665 -2.903 343 HG21 VAL 41 HG21 VAL 41 -4.221 4.891 -1.254 344 HG22 VAL 41 HG22 VAL 41 -3.720 4.223 -2.807 345 HG23 VAL 41 HG23 VAL 41 -4.102 5.938 -2.667 346 H LYS 42 H LYS 42 -7.274 4.526 -5.957 347 HA LYS 42 HA LYS 42 -5.141 4.904 -7.759 348 HB2 LYS 42 HB2 LYS 42 -4.248 3.070 -6.195 349 HB3 LYS 42 HB3 LYS 42 -5.438 2.019 -6.951 350 HG2 LYS 42 HG2 LYS 42 -4.417 2.385 -9.122 351 HG3 LYS 42 HG3 LYS 42 -3.251 3.497 -8.401 352 HD2 LYS 42 HD2 LYS 42 -3.314 0.935 -7.036 353 HD3 LYS 42 HD3 LYS 42 -2.929 0.768 -8.751 354 HE2 LYS 42 HE2 LYS 42 -0.840 1.093 -7.829 355 HE3 LYS 42 HE3 LYS 42 -1.286 2.735 -8.293 356 HZ1 LYS 42 HZ1 LYS 42 -1.559 1.574 -5.572 357 HZ2 LYS 42 HZ2 LYS 42 -1.983 3.150 -6.017 358 HZ3 LYS 42 HZ3 LYS 42 -0.363 2.665 -6.063 359 H ASN 43 H ASN 43 -5.607 4.113 -9.873 360 HA ASN 43 HA ASN 43 -8.239 2.876 -10.234 361 HB2 ASN 43 HB2 ASN 43 -7.409 5.236 -11.913 362 HB3 ASN 43 HB3 ASN 43 -9.006 4.510 -11.758 363 HD21 ASN 43 HD21 ASN 43 -7.362 7.164 -11.044 364 HD22 ASN 43 HD22 ASN 43 -8.137 7.644 -9.576 365 H TRP 44 H TRP 44 -8.166 1.262 -11.650 366 HA TRP 44 HA TRP 44 -5.845 1.100 -13.451 367 HB2 TRP 44 HB2 TRP 44 -7.591 -1.042 -12.236 368 HB3 TRP 44 HB3 TRP 44 -6.453 -1.366 -13.542 369 HD1 TRP 44 HD1 TRP 44 -6.526 -0.327 -9.839 370 HE1 TRP 44 HE1 TRP 44 -4.228 -0.850 -8.806 371 HE3 TRP 44 HE3 TRP 44 -4.029 -1.722 -14.077 372 HZ2 TRP 44 HZ2 TRP 44 -1.692 -1.736 -9.672 373 HZ3 TRP 44 HZ3 TRP 44 -1.669 -2.392 -13.888 374 HH2 TRP 44 HH2 TRP 44 -0.526 -2.398 -11.730 375 H VAL 45 H VAL 45 -6.157 0.303 -15.600 376 HA VAL 45 HA VAL 45 -8.912 0.573 -16.607 377 HB VAL 45 HB VAL 45 -6.409 1.679 -17.886 378 HG11 VAL 45 HG11 VAL 45 -7.486 1.242 -19.805 379 HG12 VAL 45 HG12 VAL 45 -9.031 0.980 -18.993 380 HG13 VAL 45 HG13 VAL 45 -8.494 2.619 -19.363 381 HG21 VAL 45 HG21 VAL 45 -7.898 2.829 -15.947 382 HG22 VAL 45 HG22 VAL 45 -7.028 3.731 -17.187 383 HG23 VAL 45 HG23 VAL 45 -8.748 3.395 -17.385 384 H MET 46 H MET 46 -9.578 -0.993 -17.952 385 HA MET 46 HA MET 46 -7.648 -3.079 -18.657 386 HB2 MET 46 HB2 MET 46 -9.791 -3.617 -17.418 387 HB3 MET 46 HB3 MET 46 -10.654 -3.208 -18.895 388 HG2 MET 46 HG2 MET 46 -8.578 -5.041 -19.539 389 HG3 MET 46 HG3 MET 46 -9.482 -5.669 -18.163 390 HE1 MET 46 HE1 MET 46 -12.932 -6.408 -19.419 391 HE2 MET 46 HE2 MET 46 -11.787 -6.308 -18.082 392 HE3 MET 46 HE3 MET 46 -12.590 -4.850 -18.666 393 H ASP 47 H ASP 47 -6.829 -3.101 -20.634 394 HA ASP 47 HA ASP 47 -8.086 -1.571 -22.757 395 HB2 ASP 47 HB2 ASP 47 -5.438 -2.217 -22.091 396 HB3 ASP 47 HB3 ASP 47 -5.765 -3.080 -23.591 397 H LEU 48 H LEU 48 -9.452 -2.423 -24.168 398 HA LEU 48 HA LEU 48 -9.677 -5.326 -24.370 399 HB2 LEU 48 HB2 LEU 48 -11.559 -3.372 -24.204 400 HB3 LEU 48 HB3 LEU 48 -11.499 -3.643 -25.944 401 HG LEU 48 HG LEU 48 -13.273 -4.943 -24.860 402 HD11 LEU 48 HD11 LEU 48 -12.935 -6.861 -26.089 403 HD12 LEU 48 HD12 LEU 48 -11.215 -6.932 -25.709 404 HD13 LEU 48 HD13 LEU 48 -11.814 -5.740 -26.862 405 HD21 LEU 48 HD21 LEU 48 -11.117 -6.536 -23.502 406 HD22 LEU 48 HD22 LEU 48 -12.863 -6.612 -23.256 407 HD23 LEU 48 HD23 LEU 48 -11.954 -5.206 -22.700 408 H LYS 49 H LYS 49 -8.244 -2.756 -26.015 409 HA LYS 49 HA LYS 49 -8.495 -3.786 -28.683 410 HB2 LYS 49 HB2 LYS 49 -7.365 -1.443 -27.400 411 HB3 LYS 49 HB3 LYS 49 -6.275 -2.092 -28.619 412 HG2 LYS 49 HG2 LYS 49 -7.926 -1.878 -30.321 413 HG3 LYS 49 HG3 LYS 49 -9.175 -1.485 -29.137 414 HD2 LYS 49 HD2 LYS 49 -8.272 0.634 -28.719 415 HD3 LYS 49 HD3 LYS 49 -6.716 0.210 -29.435 416 HE2 LYS 49 HE2 LYS 49 -7.628 1.490 -31.109 417 HE3 LYS 49 HE3 LYS 49 -8.150 -0.120 -31.602 418 HZ1 LYS 49 HZ1 LYS 49 -9.724 2.085 -30.493 419 HZ2 LYS 49 HZ2 LYS 49 -10.207 0.505 -30.131 420 HZ3 LYS 49 HZ3 LYS 49 -10.106 1.010 -31.742 421 H ASN 50 H ASN 50 -6.052 -3.900 -26.136 422 HA ASN 50 HA ASN 50 -4.402 -5.657 -27.811 423 HB2 ASN 50 HB2 ASN 50 -3.846 -3.765 -25.614 424 HB3 ASN 50 HB3 ASN 50 -2.919 -5.262 -25.564 425 HD21 ASN 50 HD21 ASN 50 -2.969 -2.182 -26.714 426 HD22 ASN 50 HD22 ASN 50 -1.837 -2.341 -28.009 427 H VAL 51 H VAL 51 -6.732 -5.805 -25.428 428 HA VAL 51 HA VAL 51 -7.587 -7.538 -24.217 429 HB VAL 51 HB VAL 51 -5.448 -9.331 -25.343 430 HG11 VAL 51 HG11 VAL 51 -7.571 -10.874 -25.253 431 HG12 VAL 51 HG12 VAL 51 -6.609 -10.575 -23.804 432 HG13 VAL 51 HG13 VAL 51 -8.114 -9.691 -24.064 433 HG21 VAL 51 HG21 VAL 51 -7.845 -8.165 -26.684 434 HG22 VAL 51 HG22 VAL 51 -6.232 -8.466 -27.329 435 HG23 VAL 51 HG23 VAL 51 -7.346 -9.810 -27.078 436 H LYS 52 H LYS 52 -5.949 -5.860 -22.884 437 HA LYS 52 HA LYS 52 -5.020 -7.495 -20.734 438 HB2 LYS 52 HB2 LYS 52 -3.065 -7.717 -22.153 439 HB3 LYS 52 HB3 LYS 52 -2.980 -5.973 -22.365 440 HG2 LYS 52 HG2 LYS 52 -2.113 -5.619 -20.280 441 HG3 LYS 52 HG3 LYS 52 -2.848 -7.076 -19.607 442 HD2 LYS 52 HD2 LYS 52 -1.026 -8.287 -20.038 443 HD3 LYS 52 HD3 LYS 52 -0.967 -7.718 -21.708 444 HE2 LYS 52 HE2 LYS 52 0.127 -5.646 -20.923 445 HE3 LYS 52 HE3 LYS 52 0.132 -6.296 -19.285 446 HZ1 LYS 52 HZ1 LYS 52 1.491 -8.150 -20.096 447 HZ2 LYS 52 HZ2 LYS 52 2.257 -6.659 -20.321 448 HZ3 LYS 52 HZ3 LYS 52 1.537 -7.446 -21.634 449 H LEU 53 H LEU 53 -4.846 -6.357 -18.829 450 HA LEU 53 HA LEU 53 -5.659 -3.540 -18.978 451 HB2 LEU 53 HB2 LEU 53 -6.775 -3.798 -17.006 452 HB3 LEU 53 HB3 LEU 53 -6.908 -5.429 -17.659 453 HG LEU 53 HG LEU 53 -4.845 -4.581 -15.629 454 HD11 LEU 53 HD11 LEU 53 -6.686 -6.365 -14.498 455 HD12 LEU 53 HD12 LEU 53 -7.642 -5.121 -15.304 456 HD13 LEU 53 HD13 LEU 53 -6.442 -4.665 -14.095 457 HD21 LEU 53 HD21 LEU 53 -5.137 -7.251 -15.386 458 HD22 LEU 53 HD22 LEU 53 -3.919 -6.483 -16.404 459 HD23 LEU 53 HD23 LEU 53 -5.429 -7.056 -17.114 460 H VAL 54 H VAL 54 -4.528 -1.931 -17.958 461 HA VAL 54 HA VAL 54 -2.135 -2.636 -16.434 462 HB VAL 54 HB VAL 54 -1.890 -0.563 -18.588 463 HG11 VAL 54 HG11 VAL 54 0.529 -1.360 -18.391 464 HG12 VAL 54 HG12 VAL 54 -0.136 -0.444 -17.036 465 HG13 VAL 54 HG13 VAL 54 0.005 -2.200 -16.932 466 HG21 VAL 54 HG21 VAL 54 -1.542 -3.536 -18.879 467 HG22 VAL 54 HG22 VAL 54 -2.520 -2.449 -19.866 468 HG23 VAL 54 HG23 VAL 54 -0.760 -2.374 -19.951 469 H GLU 55 H GLU 55 -1.164 -0.732 -15.358 470 HA GLU 55 HA GLU 55 -3.153 0.798 -14.048 471 HB2 GLU 55 HB2 GLU 55 -1.161 2.020 -13.070 472 HB3 GLU 55 HB3 GLU 55 -1.202 0.282 -12.808 473 HG2 GLU 55 HG2 GLU 55 0.688 -0.052 -13.939 474 HG3 GLU 55 HG3 GLU 55 0.220 1.052 -15.232 475 H SER 56 H SER 56 -4.301 2.154 -15.334 476 HA SER 56 HA SER 56 -2.889 4.488 -16.354 477 HB2 SER 56 HB2 SER 56 -3.097 3.974 -18.523 478 HB3 SER 56 HB3 SER 56 -3.775 2.408 -18.077 479 HG SER 56 HG SER 56 -5.060 4.029 -19.423 480 H ASP 57 H ASP 57 -4.497 6.172 -17.128 481 HA ASP 57 HA ASP 57 -6.887 6.083 -15.406 482 HB2 ASP 57 HB2 ASP 57 -4.836 7.858 -15.211 483 HB3 ASP 57 HB3 ASP 57 -5.917 8.723 -16.299 484 H ASP 58 H ASP 58 -6.187 5.530 -18.425 485 HA ASP 58 HA ASP 58 -7.560 7.329 -20.035 486 HB2 ASP 58 HB2 ASP 58 -6.179 5.563 -20.976 487 HB3 ASP 58 HB3 ASP 58 -7.273 4.333 -20.346 488 H ALA 59 H ALA 59 -9.667 7.209 -21.003 489 HA ALA 59 HA ALA 59 -11.732 6.783 -19.100 490 HB1 ALA 59 HB1 ALA 59 -13.046 7.057 -21.478 491 HB2 ALA 59 HB2 ALA 59 -12.507 8.388 -20.453 492 HB3 ALA 59 HB3 ALA 59 -11.510 7.860 -21.808 493 H ALA 60 H ALA 60 -13.791 5.559 -19.863 494 HA ALA 60 HA ALA 60 -13.337 3.159 -21.381 495 HB1 ALA 60 HB1 ALA 60 -12.319 2.658 -19.143 496 HB2 ALA 60 HB2 ALA 60 -13.934 2.815 -18.450 497 HB3 ALA 60 HB3 ALA 60 -13.605 1.558 -19.643 498 H GLU 61 H GLU 61 -15.278 1.896 -21.669 499 HA GLU 61 HA GLU 61 -17.575 3.436 -22.050 500 HB2 GLU 61 HB2 GLU 61 -17.405 0.430 -21.774 501 HB3 GLU 61 HB3 GLU 61 -18.718 1.328 -22.523 502 HG2 GLU 61 HG2 GLU 61 -15.937 0.879 -23.517 503 HG3 GLU 61 HG3 GLU 61 -17.473 0.568 -24.322 504 H ALA 62 H ALA 62 -16.401 1.835 -19.245 505 HA ALA 62 HA ALA 62 -18.575 2.886 -17.671 506 HB1 ALA 62 HB1 ALA 62 -18.610 0.318 -16.704 507 HB2 ALA 62 HB2 ALA 62 -19.828 1.039 -17.758 508 HB3 ALA 62 HB3 ALA 62 -18.520 0.078 -18.450 509 H THR 63 H THR 63 -18.176 2.757 -15.383 510 HA THR 63 HA THR 63 -15.390 2.089 -14.697 511 HB THR 63 HB THR 63 -16.905 4.446 -13.566 512 HG1 THR 63 HG1 THR 63 -16.433 4.855 -15.744 513 HG21 THR 63 HG21 THR 63 -14.051 4.623 -13.420 514 HG22 THR 63 HG22 THR 63 -14.576 3.088 -12.728 515 HG23 THR 63 HG23 THR 63 -15.228 4.604 -12.108 516 H LEU 64 H LEU 64 -15.194 0.732 -13.040 517 HA LEU 64 HA LEU 64 -17.498 0.397 -11.235 518 HB2 LEU 64 HB2 LEU 64 -17.253 -1.610 -12.421 519 HB3 LEU 64 HB3 LEU 64 -15.495 -1.562 -12.306 520 HG LEU 64 HG LEU 64 -16.769 -3.293 -10.901 521 HD11 LEU 64 HD11 LEU 64 -15.070 -1.796 -9.041 522 HD12 LEU 64 HD12 LEU 64 -14.346 -2.097 -10.620 523 HD13 LEU 64 HD13 LEU 64 -14.922 -3.447 -9.643 524 HD21 LEU 64 HD21 LEU 64 -18.209 -1.165 -10.059 525 HD22 LEU 64 HD22 LEU 64 -17.007 -1.276 -8.773 526 HD23 LEU 64 HD23 LEU 64 -18.030 -2.664 -9.147 527 H THR 65 H THR 65 -17.172 1.130 -9.253 528 HA THR 65 HA THR 65 -14.417 1.251 -8.221 529 HB THR 65 HB THR 65 -16.826 2.841 -7.317 530 HG1 THR 65 HG1 THR 65 -16.046 3.481 -9.383 531 HG21 THR 65 HG21 THR 65 -14.343 2.305 -6.045 532 HG22 THR 65 HG22 THR 65 -15.629 3.393 -5.523 533 HG23 THR 65 HG23 THR 65 -14.335 3.990 -6.561 534 H MET 66 H MET 66 -13.870 0.057 -6.507 535 HA MET 66 HA MET 66 -15.790 -0.726 -4.513 536 HB2 MET 66 HB2 MET 66 -14.755 -2.676 -6.534 537 HB3 MET 66 HB3 MET 66 -15.050 -3.218 -4.888 538 HG2 MET 66 HG2 MET 66 -17.380 -2.242 -5.150 539 HG3 MET 66 HG3 MET 66 -17.017 -2.132 -6.871 540 HE1 MET 66 HE1 MET 66 -15.551 -4.193 -7.804 541 HE2 MET 66 HE2 MET 66 -16.209 -5.827 -7.741 542 HE3 MET 66 HE3 MET 66 -17.118 -4.540 -8.534 543 H GLU 67 H GLU 67 -14.833 -1.387 -2.599 544 HA GLU 67 HA GLU 67 -12.239 -0.486 -2.077 545 HB2 GLU 67 HB2 GLU 67 -14.348 -1.886 -0.606 546 HB3 GLU 67 HB3 GLU 67 -12.728 -2.300 -0.063 547 HG2 GLU 67 HG2 GLU 67 -13.855 0.483 -0.262 548 HG3 GLU 67 HG3 GLU 67 -13.669 -0.455 1.219 549 H ASP 68 H ASP 68 -10.313 -1.601 -1.585 550 HA ASP 68 HA ASP 68 -9.478 -3.517 -3.365 551 HB2 ASP 68 HB2 ASP 68 -8.070 -2.091 -1.779 552 HB3 ASP 68 HB3 ASP 68 -8.368 -3.333 -0.567 553 H ASP 69 H ASP 69 -10.590 -4.055 -0.029 554 HA ASP 69 HA ASP 69 -10.326 -6.862 -0.081 555 HB2 ASP 69 HB2 ASP 69 -10.641 -5.294 1.943 556 HB3 ASP 69 HB3 ASP 69 -12.363 -5.408 1.591 557 H ILE 70 H ILE 70 -12.847 -4.701 -1.152 558 HA ILE 70 HA ILE 70 -14.866 -6.711 -1.418 559 HB ILE 70 HB ILE 70 -14.732 -4.022 -2.784 560 HG12 ILE 70 HG12 ILE 70 -14.545 -3.937 -0.275 561 HG13 ILE 70 HG13 ILE 70 -15.957 -3.116 -0.932 562 HG21 ILE 70 HG21 ILE 70 -17.175 -4.244 -2.898 563 HG22 ILE 70 HG22 ILE 70 -16.352 -5.528 -3.780 564 HG23 ILE 70 HG23 ILE 70 -17.051 -5.856 -2.195 565 HD11 ILE 70 HD11 ILE 70 -16.481 -4.399 1.078 566 HD12 ILE 70 HD12 ILE 70 -17.355 -5.001 -0.331 567 HD13 ILE 70 HD13 ILE 70 -15.946 -5.873 0.272 568 H MET 71 H MET 71 -12.825 -4.964 -3.761 569 HA MET 71 HA MET 71 -13.674 -6.194 -6.081 570 HB2 MET 71 HB2 MET 71 -12.200 -4.356 -6.286 571 HB3 MET 71 HB3 MET 71 -10.982 -5.117 -5.270 572 HG2 MET 71 HG2 MET 71 -10.011 -5.519 -7.258 573 HG3 MET 71 HG3 MET 71 -11.078 -6.921 -7.233 574 HE1 MET 71 HE1 MET 71 -11.246 -3.272 -7.649 575 HE2 MET 71 HE2 MET 71 -10.990 -3.127 -9.388 576 HE3 MET 71 HE3 MET 71 -12.624 -3.045 -8.727 577 H PHE 72 H PHE 72 -11.456 -7.375 -3.632 578 HA PHE 72 HA PHE 72 -10.490 -9.596 -5.116 579 HB2 PHE 72 HB2 PHE 72 -9.638 -8.439 -2.876 580 HB3 PHE 72 HB3 PHE 72 -10.610 -9.708 -2.140 581 HD1 PHE 72 HD2 PHE 72 -8.410 -9.660 -5.150 582 HD2 PHE 72 HD1 PHE 72 -9.212 -11.334 -1.320 583 HE1 PHE 72 HE2 PHE 72 -6.560 -11.252 -5.462 584 HE2 PHE 72 HE1 PHE 72 -7.362 -12.928 -1.625 585 HZ PHE 72 HZ PHE 72 -6.034 -12.889 -3.699 586 H ALA 73 H ALA 73 -13.143 -9.149 -2.831 587 HA ALA 73 HA ALA 73 -13.890 -11.816 -2.497 588 HB1 ALA 73 HB1 ALA 73 -16.070 -9.828 -2.623 589 HB2 ALA 73 HB2 ALA 73 -15.676 -11.008 -1.372 590 HB3 ALA 73 HB3 ALA 73 -14.771 -9.499 -1.476 591 H ILE 74 H ILE 74 -15.067 -9.432 -4.865 592 HA ILE 74 HA ILE 74 -16.623 -11.439 -6.247 593 HB ILE 74 HB ILE 74 -16.047 -8.611 -7.132 594 HG12 ILE 74 HG12 ILE 74 -18.637 -8.691 -6.148 595 HG13 ILE 74 HG13 ILE 74 -17.730 -9.647 -4.981 596 HG21 ILE 74 HG21 ILE 74 -18.186 -10.596 -7.888 597 HG22 ILE 74 HG22 ILE 74 -18.178 -8.901 -8.374 598 HG23 ILE 74 HG23 ILE 74 -16.892 -9.979 -8.916 599 HD11 ILE 74 HD11 ILE 74 -17.965 -6.894 -5.050 600 HD12 ILE 74 HD12 ILE 74 -16.822 -7.833 -4.089 601 HD13 ILE 74 HD13 ILE 74 -16.343 -7.208 -5.667 602 H GLY 75 H GLY 75 -13.430 -10.245 -6.364 603 HA2 GLY 75 HA2 GLY 75 -12.974 -10.799 -9.159 604 HA3 GLY 75 HA3 GLY 75 -11.756 -10.377 -7.965 605 H THR 76 H THR 76 -12.364 -12.446 -6.098 606 HA THR 76 HA THR 76 -11.020 -14.642 -7.449 607 HB THR 76 HB THR 76 -10.235 -13.832 -5.222 608 HG1 THR 76 HG1 THR 76 -9.805 -15.989 -5.928 609 HG21 THR 76 HG21 THR 76 -11.622 -13.613 -3.490 610 HG22 THR 76 HG22 THR 76 -12.135 -15.294 -3.633 611 HG23 THR 76 HG23 THR 76 -12.956 -14.040 -4.560 612 H GLY 77 H GLY 77 -14.103 -13.817 -7.337 613 HA2 GLY 77 HA2 GLY 77 -15.995 -15.049 -7.838 614 HA3 GLY 77 HA3 GLY 77 -15.027 -16.511 -7.721 615 H ALA 78 H ALA 78 -14.838 -14.410 -5.032 616 HA ALA 78 HA ALA 78 -15.982 -16.366 -3.297 617 HB1 ALA 78 HB1 ALA 78 -14.696 -15.305 -1.837 618 HB2 ALA 78 HB2 ALA 78 -14.359 -14.048 -3.029 619 HB3 ALA 78 HB3 ALA 78 -15.742 -13.889 -1.946 620 H LEU 79 H LEU 79 -16.859 -12.922 -3.483 621 HA LEU 79 HA LEU 79 -19.627 -13.657 -2.882 622 HB2 LEU 79 HB2 LEU 79 -17.966 -11.225 -2.528 623 HB3 LEU 79 HB3 LEU 79 -19.696 -11.000 -2.776 624 HG LEU 79 HG LEU 79 -18.443 -12.629 -0.565 625 HD11 LEU 79 HD11 LEU 79 -19.988 -10.346 0.256 626 HD12 LEU 79 HD12 LEU 79 -18.666 -9.856 -0.803 627 HD13 LEU 79 HD13 LEU 79 -18.328 -10.783 0.659 628 HD21 LEU 79 HD21 LEU 79 -21.306 -11.904 -1.172 629 HD22 LEU 79 HD22 LEU 79 -20.753 -12.604 0.350 630 HD23 LEU 79 HD23 LEU 79 -20.595 -13.518 -1.151 631 HA PRO 80 HA PRO 80 -20.992 -12.903 -6.999 632 HB2 PRO 80 HB2 PRO 80 -23.600 -12.347 -6.491 633 HB3 PRO 80 HB3 PRO 80 -22.929 -13.979 -6.393 634 HG2 PRO 80 HG2 PRO 80 -23.483 -12.024 -4.195 635 HG3 PRO 80 HG3 PRO 80 -23.797 -13.769 -4.246 636 HD2 PRO 80 HD2 PRO 80 -21.663 -12.710 -2.960 637 HD3 PRO 80 HD3 PRO 80 -21.613 -14.304 -3.740 638 H ALA 81 H ALA 81 -20.838 -11.178 -8.286 639 HA ALA 81 HA ALA 81 -20.553 -8.560 -7.306 640 HB1 ALA 81 HB1 ALA 81 -21.325 -8.773 -10.124 641 HB2 ALA 81 HB2 ALA 81 -19.887 -8.063 -9.389 642 HB3 ALA 81 HB3 ALA 81 -19.974 -9.805 -9.655 643 H LYS 82 H LYS 82 -23.335 -10.364 -8.308 644 HA LYS 82 HA LYS 82 -25.066 -8.194 -8.866 645 HB2 LYS 82 HB2 LYS 82 -25.984 -10.848 -7.789 646 HB3 LYS 82 HB3 LYS 82 -26.810 -9.777 -8.913 647 HG2 LYS 82 HG2 LYS 82 -24.787 -10.275 -10.464 648 HG3 LYS 82 HG3 LYS 82 -24.562 -11.674 -9.412 649 HD2 LYS 82 HD2 LYS 82 -27.324 -11.258 -10.306 650 HD3 LYS 82 HD3 LYS 82 -26.182 -11.610 -11.605 651 HE2 LYS 82 HE2 LYS 82 -26.791 -13.735 -11.005 652 HE3 LYS 82 HE3 LYS 82 -25.393 -13.500 -9.958 653 HZ1 LYS 82 HZ1 LYS 82 -26.889 -12.892 -8.159 654 HZ2 LYS 82 HZ2 LYS 82 -27.254 -14.437 -8.743 655 HZ3 LYS 82 HZ3 LYS 82 -28.231 -13.122 -9.165 656 H GLU 83 H GLU 83 -24.862 -10.295 -5.987 657 HA GLU 83 HA GLU 83 -26.666 -8.912 -4.395 658 HB2 GLU 83 HB2 GLU 83 -24.186 -10.398 -3.510 659 HB3 GLU 83 HB3 GLU 83 -25.540 -9.964 -2.476 660 HG2 GLU 83 HG2 GLU 83 -25.859 -11.696 -4.905 661 HG3 GLU 83 HG3 GLU 83 -25.458 -12.347 -3.317 662 H ALA 84 H ALA 84 -23.121 -8.564 -4.483 663 HA ALA 84 HA ALA 84 -22.801 -6.567 -2.621 664 HB1 ALA 84 HB1 ALA 84 -21.234 -6.520 -5.174 665 HB2 ALA 84 HB2 ALA 84 -20.696 -6.180 -3.528 666 HB3 ALA 84 HB3 ALA 84 -21.045 -7.838 -4.017 667 H MET 85 H MET 85 -23.953 -6.310 -5.924 668 HA MET 85 HA MET 85 -23.835 -3.451 -6.022 669 HB2 MET 85 HB2 MET 85 -24.283 -5.528 -7.859 670 HB3 MET 85 HB3 MET 85 -25.763 -4.579 -7.849 671 HG2 MET 85 HG2 MET 85 -23.532 -2.809 -7.915 672 HG3 MET 85 HG3 MET 85 -23.338 -4.030 -9.171 673 HE1 MET 85 HE1 MET 85 -25.144 -2.710 -11.942 674 HE2 MET 85 HE2 MET 85 -23.783 -1.825 -11.254 675 HE3 MET 85 HE3 MET 85 -23.800 -3.589 -11.213 676 H ALA 86 H ALA 86 -26.405 -5.834 -5.479 677 HA ALA 86 HA ALA 86 -28.481 -3.911 -5.190 678 HB1 ALA 86 HB1 ALA 86 -29.857 -5.730 -4.476 679 HB2 ALA 86 HB2 ALA 86 -28.824 -6.310 -5.784 680 HB3 ALA 86 HB3 ALA 86 -28.445 -6.724 -4.112 681 H GLN 87 H GLN 87 -26.017 -5.074 -3.098 682 HA GLN 87 HA GLN 87 -27.407 -4.216 -0.686 683 HB2 GLN 87 HB2 GLN 87 -24.626 -5.354 -1.014 684 HB3 GLN 87 HB3 GLN 87 -25.462 -5.089 0.510 685 HG2 GLN 87 HG2 GLN 87 -26.775 -6.807 -1.521 686 HG3 GLN 87 HG3 GLN 87 -25.384 -7.454 -0.651 687 HE21 GLN 87 HE21 GLN 87 -27.439 -8.871 -0.172 688 HE22 GLN 87 HE22 GLN 87 -28.216 -8.503 1.326 689 H ASP 88 H ASP 88 -26.274 -2.460 -2.962 690 HA ASP 88 HA ASP 88 -25.215 -0.454 -3.199 691 HB2 ASP 88 HB2 ASP 88 -27.024 -0.170 -1.255 692 HB3 ASP 88 HB3 ASP 88 -25.576 0.163 -0.309 693 H LYS 89 H LYS 89 -23.624 -2.789 -2.268 694 HA LYS 89 HA LYS 89 -21.533 -1.518 -0.673 695 HB2 LYS 89 HB2 LYS 89 -21.871 -4.365 -1.631 696 HB3 LYS 89 HB3 LYS 89 -20.513 -3.798 -0.668 697 HG2 LYS 89 HG2 LYS 89 -22.650 -2.964 0.814 698 HG3 LYS 89 HG3 LYS 89 -23.232 -4.488 0.138 699 HD2 LYS 89 HD2 LYS 89 -20.481 -4.501 1.216 700 HD3 LYS 89 HD3 LYS 89 -21.781 -4.321 2.397 701 HE2 LYS 89 HE2 LYS 89 -22.803 -6.359 1.684 702 HE3 LYS 89 HE3 LYS 89 -21.713 -6.488 0.305 703 HZ1 LYS 89 HZ1 LYS 89 -21.173 -6.989 3.150 704 HZ2 LYS 89 HZ2 LYS 89 -19.904 -6.499 2.145 705 HZ3 LYS 89 HZ3 LYS 89 -20.757 -7.919 1.799 706 H MET 90 H MET 90 -22.292 -1.302 -3.740 707 HA MET 90 HA MET 90 -19.617 -0.752 -4.586 708 HB2 MET 90 HB2 MET 90 -19.274 -2.396 -6.194 709 HB3 MET 90 HB3 MET 90 -19.985 -3.305 -4.867 710 HG2 MET 90 HG2 MET 90 -21.516 -4.063 -6.263 711 HG3 MET 90 HG3 MET 90 -22.132 -2.421 -6.429 712 HE1 MET 90 HE1 MET 90 -20.017 -5.154 -7.472 713 HE2 MET 90 HE2 MET 90 -20.770 -5.285 -9.062 714 HE3 MET 90 HE3 MET 90 -19.130 -4.652 -8.912 715 H GLU 91 H GLU 91 -19.530 0.348 -6.615 716 HA GLU 91 HA GLU 91 -22.156 1.189 -7.649 717 HB2 GLU 91 HB2 GLU 91 -21.000 3.446 -8.064 718 HB3 GLU 91 HB3 GLU 91 -21.488 3.064 -6.419 719 HG2 GLU 91 HG2 GLU 91 -18.797 2.163 -6.976 720 HG3 GLU 91 HG3 GLU 91 -18.987 3.892 -7.260 721 H VAL 92 H VAL 92 -22.192 1.860 -9.859 722 HA VAL 92 HA VAL 92 -19.828 1.244 -11.463 723 HB VAL 92 HB VAL 92 -22.513 0.033 -12.122 724 HG11 VAL 92 HG11 VAL 92 -20.989 -1.367 -13.631 725 HG12 VAL 92 HG12 VAL 92 -21.310 0.300 -14.112 726 HG13 VAL 92 HG13 VAL 92 -19.777 -0.119 -13.346 727 HG21 VAL 92 HG21 VAL 92 -20.093 -1.273 -10.882 728 HG22 VAL 92 HG22 VAL 92 -21.654 -1.012 -10.105 729 HG23 VAL 92 HG23 VAL 92 -21.523 -2.122 -11.469 730 H ASP 93 H ASP 93 -19.654 2.446 -13.296 731 HA ASP 93 HA ASP 93 -21.892 4.265 -13.909 732 HB2 ASP 93 HB2 ASP 93 -19.117 4.832 -13.281 733 HB3 ASP 93 HB3 ASP 93 -19.560 5.479 -14.858 734 H GLY 94 H GLY 94 -21.733 5.176 -16.184 735 HA2 GLY 94 HA2 GLY 94 -21.308 4.912 -18.469 736 HA3 GLY 94 HA3 GLY 94 -20.423 3.437 -18.111 737 H GLN 95 H GLN 95 -21.340 1.760 -19.075 738 HA GLN 95 HA GLN 95 -24.232 1.742 -19.492 739 HB2 GLN 95 HB2 GLN 95 -21.911 0.369 -20.753 740 HB3 GLN 95 HB3 GLN 95 -23.461 -0.461 -20.775 741 HG2 GLN 95 HG2 GLN 95 -23.581 2.348 -21.589 742 HG3 GLN 95 HG3 GLN 95 -22.612 1.318 -22.641 743 HE21 GLN 95 HE21 GLN 95 -25.784 1.702 -21.177 744 HE22 GLN 95 HE22 GLN 95 -26.652 0.818 -22.381 745 H VAL 96 H VAL 96 -25.074 1.166 -17.518 746 HA VAL 96 HA VAL 96 -24.115 -0.756 -15.760 747 HB VAL 96 HB VAL 96 -27.032 -0.135 -16.229 748 HG11 VAL 96 HG11 VAL 96 -26.826 -0.501 -13.596 749 HG12 VAL 96 HG12 VAL 96 -27.136 -1.827 -14.718 750 HG13 VAL 96 HG13 VAL 96 -25.501 -1.540 -14.119 751 HG21 VAL 96 HG21 VAL 96 -24.892 1.376 -14.772 752 HG22 VAL 96 HG22 VAL 96 -26.084 1.974 -15.925 753 HG23 VAL 96 HG23 VAL 96 -26.586 1.510 -14.300 754 H GLU 97 H GLU 97 -25.963 -1.126 -18.697 755 HA GLU 97 HA GLU 97 -26.735 -3.838 -18.229 756 HB2 GLU 97 HB2 GLU 97 -27.337 -3.830 -20.635 757 HB3 GLU 97 HB3 GLU 97 -28.036 -2.485 -19.746 758 HG2 GLU 97 HG2 GLU 97 -26.522 -0.944 -20.684 759 HG3 GLU 97 HG3 GLU 97 -25.491 -2.228 -21.314 760 H LEU 98 H LEU 98 -23.903 -2.275 -19.429 761 HA LEU 98 HA LEU 98 -22.859 -4.555 -20.827 762 HB2 LEU 98 HB2 LEU 98 -21.961 -1.820 -20.189 763 HB3 LEU 98 HB3 LEU 98 -20.686 -3.019 -20.392 764 HG LEU 98 HG LEU 98 -22.813 -2.528 -22.466 765 HD11 LEU 98 HD11 LEU 98 -20.593 -0.851 -21.727 766 HD12 LEU 98 HD12 LEU 98 -21.852 -0.583 -22.932 767 HD13 LEU 98 HD13 LEU 98 -20.393 -1.473 -23.365 768 HD21 LEU 98 HD21 LEU 98 -21.164 -4.626 -22.232 769 HD22 LEU 98 HD22 LEU 98 -20.106 -3.523 -23.111 770 HD23 LEU 98 HD23 LEU 98 -21.673 -3.968 -23.787 771 H ILE 99 H ILE 99 -21.957 -2.895 -17.802 772 HA ILE 99 HA ILE 99 -19.987 -4.630 -16.942 773 HB ILE 99 HB ILE 99 -20.685 -2.441 -15.870 774 HG12 ILE 99 HG12 ILE 99 -20.062 -3.245 -13.556 775 HG13 ILE 99 HG13 ILE 99 -20.142 -4.888 -14.182 776 HG21 ILE 99 HG21 ILE 99 -22.429 -3.930 -14.009 777 HG22 ILE 99 HG22 ILE 99 -22.516 -2.256 -14.555 778 HG23 ILE 99 HG23 ILE 99 -23.106 -3.554 -15.594 779 HD11 ILE 99 HD11 ILE 99 -18.495 -3.321 -15.898 780 HD12 ILE 99 HD12 ILE 99 -17.966 -3.113 -14.228 781 HD13 ILE 99 HD13 ILE 99 -18.071 -4.730 -14.926 782 H PHE 100 H PHE 100 -23.437 -5.049 -16.945 783 HA PHE 100 HA PHE 100 -23.554 -7.174 -15.062 784 HB2 PHE 100 HB2 PHE 100 -25.416 -5.628 -16.354 785 HB3 PHE 100 HB3 PHE 100 -25.607 -7.180 -17.163 786 HD1 PHE 100 HD1 PHE 100 -25.841 -9.250 -15.611 787 HD2 PHE 100 HD2 PHE 100 -26.516 -5.236 -14.366 788 HE1 PHE 100 HE1 PHE 100 -27.200 -10.065 -13.728 789 HE2 PHE 100 HE2 PHE 100 -27.875 -6.045 -12.482 790 HZ PHE 100 HZ PHE 100 -28.218 -8.462 -12.160 791 H LEU 101 H LEU 101 -23.127 -7.016 -18.551 792 HA LEU 101 HA LEU 101 -23.432 -9.764 -19.092 793 HB2 LEU 101 HB2 LEU 101 -22.426 -7.396 -20.492 794 HB3 LEU 101 HB3 LEU 101 -21.672 -8.908 -20.996 795 HG LEU 101 HG LEU 101 -23.619 -8.184 -22.385 796 HD11 LEU 101 HD11 LEU 101 -24.783 -10.476 -22.179 797 HD12 LEU 101 HD12 LEU 101 -23.550 -10.819 -20.967 798 HD13 LEU 101 HD13 LEU 101 -23.076 -10.427 -22.619 799 HD21 LEU 101 HD21 LEU 101 -25.178 -8.862 -19.892 800 HD22 LEU 101 HD22 LEU 101 -25.866 -8.517 -21.480 801 HD23 LEU 101 HD23 LEU 101 -25.000 -7.256 -20.600 802 H LEU 102 H LEU 102 -20.992 -8.076 -17.463 803 HA LEU 102 HA LEU 102 -18.864 -9.936 -18.098 804 HB2 LEU 102 HB2 LEU 102 -19.112 -7.517 -16.355 805 HB3 LEU 102 HB3 LEU 102 -17.736 -8.605 -16.177 806 HG LEU 102 HG LEU 102 -18.464 -7.222 -18.755 807 HD11 LEU 102 HD11 LEU 102 -17.183 -6.193 -16.384 808 HD12 LEU 102 HD12 LEU 102 -17.659 -5.356 -17.862 809 HD13 LEU 102 HD13 LEU 102 -16.091 -6.159 -17.769 810 HD21 LEU 102 HD21 LEU 102 -16.355 -9.106 -17.888 811 HD22 LEU 102 HD22 LEU 102 -15.857 -7.779 -18.937 812 HD23 LEU 102 HD23 LEU 102 -17.115 -8.897 -19.466 813 H GLU 103 H GLU 103 -21.071 -9.264 -15.436 814 HA GLU 103 HA GLU 103 -20.115 -10.647 -13.341 815 HB2 GLU 103 HB2 GLU 103 -22.676 -9.842 -14.201 816 HB3 GLU 103 HB3 GLU 103 -22.827 -11.530 -13.732 817 HG2 GLU 103 HG2 GLU 103 -21.438 -9.600 -11.929 818 HG3 GLU 103 HG3 GLU 103 -23.199 -9.660 -11.978 819 HA PRO 104 HA PRO 104 -21.549 -14.917 -15.098 820 HB2 PRO 104 HB2 PRO 104 -22.295 -14.996 -17.707 821 HB3 PRO 104 HB3 PRO 104 -23.432 -14.674 -16.392 822 HG2 PRO 104 HG2 PRO 104 -22.074 -12.747 -18.238 823 HG3 PRO 104 HG3 PRO 104 -23.760 -12.771 -17.688 824 HD2 PRO 104 HD2 PRO 104 -21.899 -11.124 -16.612 825 HD3 PRO 104 HD3 PRO 104 -23.245 -11.791 -15.666 826 H PHE 105 H PHE 105 -19.887 -12.708 -17.280 827 HA PHE 105 HA PHE 105 -18.348 -14.625 -18.660 828 HB2 PHE 105 HB2 PHE 105 -18.742 -12.059 -19.103 829 HB3 PHE 105 HB3 PHE 105 -17.285 -11.878 -18.132 830 HD1 PHE 105 HD2 PHE 105 -18.605 -13.683 -21.102 831 HD2 PHE 105 HD1 PHE 105 -15.206 -12.050 -19.129 832 HE1 PHE 105 HE2 PHE 105 -17.231 -14.155 -23.088 833 HE2 PHE 105 HE1 PHE 105 -13.826 -12.518 -21.111 834 HZ PHE 105 HZ PHE 105 -14.838 -13.573 -23.094 835 H ILE 106 H ILE 106 -18.140 -13.388 -15.479 836 HA ILE 106 HA ILE 106 -15.429 -13.516 -14.912 837 HB ILE 106 HB ILE 106 -17.729 -14.272 -13.106 838 HG12 ILE 106 HG12 ILE 106 -16.227 -11.662 -13.398 839 HG13 ILE 106 HG13 ILE 106 -17.837 -11.977 -14.034 840 HG21 ILE 106 HG21 ILE 106 -14.850 -13.643 -12.481 841 HG22 ILE 106 HG22 ILE 106 -16.134 -13.719 -11.276 842 HG23 ILE 106 HG23 ILE 106 -15.700 -15.161 -12.194 843 HD11 ILE 106 HD11 ILE 106 -16.958 -11.628 -11.207 844 HD12 ILE 106 HD12 ILE 106 -18.278 -10.848 -12.079 845 HD13 ILE 106 HD13 ILE 106 -18.425 -12.532 -11.577 846 H ALA 107 H ALA 107 -17.718 -16.083 -15.415 847 HA ALA 107 HA ALA 107 -16.314 -18.189 -14.180 848 HB1 ALA 107 HB1 ALA 107 -17.676 -19.665 -15.613 849 HB2 ALA 107 HB2 ALA 107 -18.637 -18.429 -14.800 850 HB3 ALA 107 HB3 ALA 107 -18.231 -18.250 -16.507 851 H SER 108 H SER 108 -15.825 -16.511 -17.161 852 HA SER 108 HA SER 108 -14.102 -18.586 -18.252 853 HB2 SER 108 HB2 SER 108 -15.727 -16.970 -19.556 854 HB3 SER 108 HB3 SER 108 -14.352 -15.868 -19.481 855 HG SER 108 HG SER 108 -14.247 -17.117 -21.360 856 H LEU 109 H LEU 109 -13.875 -15.434 -16.735 857 HA LEU 109 HA LEU 109 -10.968 -15.423 -17.058 858 HB2 LEU 109 HB2 LEU 109 -13.013 -13.384 -16.326 859 HB3 LEU 109 HB3 LEU 109 -11.353 -13.157 -15.779 860 HG LEU 109 HG LEU 109 -10.563 -13.092 -18.056 861 HD11 LEU 109 HD11 LEU 109 -11.976 -14.672 -19.134 862 HD12 LEU 109 HD12 LEU 109 -12.227 -13.117 -19.927 863 HD13 LEU 109 HD13 LEU 109 -13.418 -13.721 -18.774 864 HD21 LEU 109 HD21 LEU 109 -11.698 -11.061 -18.831 865 HD22 LEU 109 HD22 LEU 109 -11.355 -11.001 -17.101 866 HD23 LEU 109 HD23 LEU 109 -12.991 -11.345 -17.665 867 H LYS 110 H LYS 110 -12.384 -17.303 -15.284 868 HA LYS 110 HA LYS 110 -12.226 -18.183 -13.190 869 HB2 LYS 110 HB2 LYS 110 -9.751 -17.783 -13.960 870 HB3 LYS 110 HB3 LYS 110 -9.765 -16.542 -12.713 871 HG2 LYS 110 HG2 LYS 110 -9.931 -18.062 -11.006 872 HG3 LYS 110 HG3 LYS 110 -10.695 -19.285 -12.024 873 HD2 LYS 110 HD2 LYS 110 -8.709 -20.077 -12.797 874 HD3 LYS 110 HD3 LYS 110 -7.930 -18.494 -12.730 875 HE2 LYS 110 HE2 LYS 110 -6.984 -19.029 -10.795 876 HE3 LYS 110 HE3 LYS 110 -8.573 -19.288 -10.076 877 HZ1 LYS 110 HZ1 LYS 110 -6.632 -21.192 -10.615 878 HZ2 LYS 110 HZ2 LYS 110 -7.891 -21.488 -11.705 879 HZ3 LYS 110 HZ3 LYS 110 -8.202 -21.456 -10.043 Start of MODEL 10 1 H1 MET 1 H MET 1 2.836 1.964 -1.657 2 HA MET 1 HA MET 1 0.339 1.215 -1.432 3 HB2 MET 1 HB2 MET 1 1.623 1.647 -4.135 4 HB3 MET 1 HB3 MET 1 -0.100 1.762 -3.800 5 HG2 MET 1 HG2 MET 1 1.107 3.453 -1.949 6 HG3 MET 1 HG3 MET 1 1.976 3.724 -3.457 7 HE1 MET 1 HE1 MET 1 -0.060 6.664 -4.269 8 HE2 MET 1 HE2 MET 1 1.444 6.000 -3.629 9 HE3 MET 1 HE3 MET 1 0.925 5.591 -5.265 10 H SER 2 H SER 2 0.178 -0.970 -0.797 11 HA SER 2 HA SER 2 0.330 -2.901 -3.020 12 HB2 SER 2 HB2 SER 2 0.275 -4.446 -0.748 13 HB3 SER 2 HB3 SER 2 1.734 -3.999 -1.632 14 HG SER 2 HG SER 2 0.852 -3.177 0.826 15 H LEU 3 H LEU 3 -1.628 -3.324 -3.783 16 HA LEU 3 HA LEU 3 -3.883 -3.449 -1.892 17 HB2 LEU 3 HB2 LEU 3 -3.723 -2.664 -4.780 18 HB3 LEU 3 HB3 LEU 3 -5.247 -3.170 -4.056 19 HG LEU 3 HG LEU 3 -3.970 -1.113 -2.475 20 HD11 LEU 3 HD11 LEU 3 -3.009 -0.072 -4.267 21 HD12 LEU 3 HD12 LEU 3 -4.625 0.629 -4.334 22 HD13 LEU 3 HD13 LEU 3 -4.195 -0.698 -5.412 23 HD21 LEU 3 HD21 LEU 3 -6.601 -1.741 -3.676 24 HD22 LEU 3 HD22 LEU 3 -6.278 -0.050 -3.295 25 HD23 LEU 3 HD23 LEU 3 -6.187 -1.273 -2.027 26 H LYS 4 H LYS 4 -4.949 -5.313 -1.656 27 HA LYS 4 HA LYS 4 -3.965 -7.733 -2.614 28 HB2 LYS 4 HB2 LYS 4 -6.446 -6.855 -1.243 29 HB3 LYS 4 HB3 LYS 4 -6.497 -8.425 -2.035 30 HG2 LYS 4 HG2 LYS 4 -4.124 -7.965 -0.373 31 HG3 LYS 4 HG3 LYS 4 -5.656 -8.000 0.504 32 HD2 LYS 4 HD2 LYS 4 -6.148 -10.183 -0.244 33 HD3 LYS 4 HD3 LYS 4 -4.894 -10.125 -1.484 34 HE2 LYS 4 HE2 LYS 4 -3.192 -10.013 0.318 35 HE3 LYS 4 HE3 LYS 4 -4.483 -10.208 1.503 36 HZ1 LYS 4 HZ1 LYS 4 -3.094 -12.209 0.211 37 HZ2 LYS 4 HZ2 LYS 4 -4.636 -12.225 -0.483 38 HZ3 LYS 4 HZ3 LYS 4 -4.461 -12.388 1.192 39 H SER 5 H SER 5 -6.337 -5.555 -3.971 40 HA SER 5 HA SER 5 -7.566 -7.248 -5.814 41 HB2 SER 5 HB2 SER 5 -7.781 -5.020 -7.169 42 HB3 SER 5 HB3 SER 5 -8.598 -5.171 -5.614 43 HG SER 5 HG SER 5 -5.983 -4.147 -5.731 44 H ASP 6 H ASP 6 -4.395 -5.894 -5.781 45 HA ASP 6 HA ASP 6 -3.728 -5.844 -8.472 46 HB2 ASP 6 HB2 ASP 6 -2.106 -6.441 -6.006 47 HB3 ASP 6 HB3 ASP 6 -1.374 -6.436 -7.608 48 H GLU 7 H GLU 7 -3.940 -8.567 -6.259 49 HA GLU 7 HA GLU 7 -2.695 -10.483 -7.919 50 HB2 GLU 7 HB2 GLU 7 -3.991 -10.437 -5.379 51 HB3 GLU 7 HB3 GLU 7 -4.692 -11.741 -6.327 52 HG2 GLU 7 HG2 GLU 7 -2.170 -12.290 -6.825 53 HG3 GLU 7 HG3 GLU 7 -1.918 -11.403 -5.323 54 H VAL 8 H VAL 8 -6.128 -9.710 -7.387 55 HA VAL 8 HA VAL 8 -7.252 -11.575 -9.105 56 HB VAL 8 HB VAL 8 -8.168 -8.818 -8.316 57 HG11 VAL 8 HG11 VAL 8 -9.561 -10.820 -10.083 58 HG12 VAL 8 HG12 VAL 8 -10.395 -9.502 -9.257 59 HG13 VAL 8 HG13 VAL 8 -9.152 -9.146 -10.457 60 HG21 VAL 8 HG21 VAL 8 -9.655 -11.278 -7.625 61 HG22 VAL 8 HG22 VAL 8 -8.086 -11.060 -6.850 62 HG23 VAL 8 HG23 VAL 8 -9.340 -9.834 -6.663 63 H PHE 9 H PHE 9 -6.275 -8.228 -9.828 64 HA PHE 9 HA PHE 9 -6.989 -8.226 -12.530 65 HB2 PHE 9 HB2 PHE 9 -4.921 -6.675 -10.982 66 HB3 PHE 9 HB3 PHE 9 -5.189 -6.408 -12.701 67 HD1 PHE 9 HD1 PHE 9 -7.909 -6.304 -13.192 68 HD2 PHE 9 HD2 PHE 9 -5.884 -5.090 -9.651 69 HE1 PHE 9 HE1 PHE 9 -9.757 -4.768 -12.666 70 HE2 PHE 9 HE2 PHE 9 -7.729 -3.552 -9.119 71 HZ PHE 9 HZ PHE 9 -9.670 -3.390 -10.627 72 H ALA 10 H ALA 10 -4.090 -9.362 -10.908 73 HA ALA 10 HA ALA 10 -2.524 -9.738 -13.246 74 HB1 ALA 10 HB1 ALA 10 -1.657 -9.579 -10.894 75 HB2 ALA 10 HB2 ALA 10 -2.229 -11.229 -10.648 76 HB3 ALA 10 HB3 ALA 10 -0.987 -10.897 -11.855 77 H LYS 11 H LYS 11 -4.644 -11.862 -11.368 78 HA LYS 11 HA LYS 11 -4.094 -14.196 -12.906 79 HB2 LYS 11 HB2 LYS 11 -6.579 -13.690 -11.275 80 HB3 LYS 11 HB3 LYS 11 -5.843 -15.238 -11.668 81 HG2 LYS 11 HG2 LYS 11 -4.380 -15.117 -9.974 82 HG3 LYS 11 HG3 LYS 11 -4.105 -13.388 -10.198 83 HD2 LYS 11 HD2 LYS 11 -5.328 -13.062 -8.364 84 HD3 LYS 11 HD3 LYS 11 -6.733 -13.569 -9.305 85 HE2 LYS 11 HE2 LYS 11 -5.832 -15.974 -8.649 86 HE3 LYS 11 HE3 LYS 11 -5.129 -15.075 -7.306 87 HZ1 LYS 11 HZ1 LYS 11 -7.437 -16.047 -6.985 88 HZ2 LYS 11 HZ2 LYS 11 -7.988 -14.819 -8.009 89 HZ3 LYS 11 HZ3 LYS 11 -7.222 -14.426 -6.552 90 H ILE 12 H ILE 12 -6.764 -11.853 -12.886 91 HA ILE 12 HA ILE 12 -8.322 -13.047 -14.878 92 HB ILE 12 HB ILE 12 -8.060 -10.143 -14.106 93 HG12 ILE 12 HG12 ILE 12 -10.200 -12.187 -13.479 94 HG13 ILE 12 HG13 ILE 12 -8.917 -11.707 -12.374 95 HG21 ILE 12 HG21 ILE 12 -10.547 -10.483 -15.258 96 HG22 ILE 12 HG22 ILE 12 -9.160 -9.674 -15.986 97 HG23 ILE 12 HG23 ILE 12 -9.465 -11.378 -16.324 98 HD11 ILE 12 HD11 ILE 12 -9.792 -9.380 -12.491 99 HD12 ILE 12 HD12 ILE 12 -11.155 -10.000 -13.423 100 HD13 ILE 12 HD13 ILE 12 -10.899 -10.546 -11.766 101 H ALA 13 H ALA 13 -5.679 -10.709 -15.104 102 HA ALA 13 HA ALA 13 -5.876 -10.161 -17.847 103 HB1 ALA 13 HB1 ALA 13 -4.520 -8.872 -16.208 104 HB2 ALA 13 HB2 ALA 13 -3.346 -10.189 -16.209 105 HB3 ALA 13 HB3 ALA 13 -3.653 -9.280 -17.689 106 H LYS 14 H LYS 14 -4.158 -12.701 -16.091 107 HA LYS 14 HA LYS 14 -2.767 -13.762 -18.309 108 HB2 LYS 14 HB2 LYS 14 -2.272 -14.201 -15.874 109 HB3 LYS 14 HB3 LYS 14 -3.661 -15.280 -15.856 110 HG2 LYS 14 HG2 LYS 14 -2.629 -16.849 -17.196 111 HG3 LYS 14 HG3 LYS 14 -1.495 -15.678 -17.872 112 HD2 LYS 14 HD2 LYS 14 -0.437 -15.521 -15.610 113 HD3 LYS 14 HD3 LYS 14 -1.478 -16.849 -15.092 114 HE2 LYS 14 HE2 LYS 14 0.136 -18.215 -15.803 115 HE3 LYS 14 HE3 LYS 14 -0.357 -17.779 -17.438 116 HZ1 LYS 14 HZ1 LYS 14 1.788 -16.502 -15.832 117 HZ2 LYS 14 HZ2 LYS 14 1.259 -15.935 -17.335 118 HZ3 LYS 14 HZ3 LYS 14 1.988 -17.456 -17.215 119 H ARG 15 H ARG 15 -5.991 -14.266 -17.046 120 HA ARG 15 HA ARG 15 -6.535 -16.580 -18.651 121 HB2 ARG 15 HB2 ARG 15 -7.694 -15.513 -16.431 122 HB3 ARG 15 HB3 ARG 15 -8.819 -14.993 -17.678 123 HG2 ARG 15 HG2 ARG 15 -9.693 -17.025 -17.853 124 HG3 ARG 15 HG3 ARG 15 -8.101 -17.773 -17.997 125 HD2 ARG 15 HD2 ARG 15 -8.694 -16.829 -15.302 126 HD3 ARG 15 HD3 ARG 15 -9.831 -18.049 -15.876 127 HE ARG 15 HE ARG 15 -7.075 -18.442 -15.186 128 HH11 ARG 15 HH11 ARG 15 -9.725 -19.621 -17.112 129 HH12 ARG 15 HH12 ARG 15 -9.102 -21.235 -17.216 130 HH21 ARG 15 HH21 ARG 15 -6.245 -20.563 -15.315 131 HH22 ARG 15 HH22 ARG 15 -7.123 -21.769 -16.193 132 H LEU 16 H LEU 16 -6.971 -13.122 -18.967 133 HA LEU 16 HA LEU 16 -8.702 -13.263 -21.239 134 HB2 LEU 16 HB2 LEU 16 -6.998 -10.987 -20.240 135 HB3 LEU 16 HB3 LEU 16 -8.279 -10.862 -21.443 136 HG LEU 16 HG LEU 16 -8.999 -11.930 -18.766 137 HD11 LEU 16 HD11 LEU 16 -9.408 -9.245 -18.453 138 HD12 LEU 16 HD12 LEU 16 -7.817 -9.298 -19.210 139 HD13 LEU 16 HD13 LEU 16 -8.108 -10.175 -17.708 140 HD21 LEU 16 HD21 LEU 16 -10.513 -11.606 -20.825 141 HD22 LEU 16 HD22 LEU 16 -10.447 -9.891 -20.417 142 HD23 LEU 16 HD23 LEU 16 -11.095 -11.051 -19.255 143 H GLU 17 H GLU 17 -5.415 -13.810 -20.811 144 HA GLU 17 HA GLU 17 -4.515 -12.829 -23.362 145 HB2 GLU 17 HB2 GLU 17 -3.255 -14.533 -21.223 146 HB3 GLU 17 HB3 GLU 17 -2.456 -14.237 -22.760 147 HG2 GLU 17 HG2 GLU 17 -3.128 -11.713 -22.001 148 HG3 GLU 17 HG3 GLU 17 -2.804 -12.482 -20.448 149 H SER 18 H SER 18 -6.289 -15.489 -22.381 150 HA SER 18 HA SER 18 -5.350 -17.148 -24.617 151 HB2 SER 18 HB2 SER 18 -5.950 -17.825 -21.988 152 HB3 SER 18 HB3 SER 18 -7.361 -18.369 -22.896 153 HG SER 18 HG SER 18 -5.312 -19.762 -22.658 154 H ILE 19 H ILE 19 -7.572 -14.838 -24.057 155 HA ILE 19 HA ILE 19 -10.014 -15.828 -24.940 156 HB ILE 19 HB ILE 19 -8.880 -13.088 -25.514 157 HG12 ILE 19 HG12 ILE 19 -8.885 -13.845 -23.086 158 HG13 ILE 19 HG13 ILE 19 -9.776 -12.368 -23.435 159 HG21 ILE 19 HG21 ILE 19 -10.760 -13.049 -26.779 160 HG22 ILE 19 HG22 ILE 19 -11.543 -14.328 -25.853 161 HG23 ILE 19 HG23 ILE 19 -11.503 -12.681 -25.222 162 HD11 ILE 19 HD11 ILE 19 -11.827 -13.383 -23.121 163 HD12 ILE 19 HD12 ILE 19 -11.178 -15.004 -23.374 164 HD13 ILE 19 HD13 ILE 19 -10.821 -14.133 -21.882 165 H ASP 20 H ASP 20 -10.966 -16.103 -26.923 166 HA ASP 20 HA ASP 20 -9.231 -15.797 -29.284 167 HB2 ASP 20 HB2 ASP 20 -10.174 -18.220 -28.181 168 HB3 ASP 20 HB3 ASP 20 -11.113 -17.943 -29.646 169 HA PRO 21 HA PRO 21 -12.556 -13.590 -31.120 170 HB2 PRO 21 HB2 PRO 21 -12.079 -14.097 -33.744 171 HB3 PRO 21 HB3 PRO 21 -11.075 -13.010 -32.778 172 HG2 PRO 21 HG2 PRO 21 -10.592 -15.867 -33.528 173 HG3 PRO 21 HG3 PRO 21 -9.456 -14.506 -33.518 174 HD2 PRO 21 HD2 PRO 21 -9.547 -16.343 -31.530 175 HD3 PRO 21 HD3 PRO 21 -9.114 -14.646 -31.242 176 H ALA 22 H ALA 22 -12.317 -16.960 -31.240 177 HA ALA 22 HA ALA 22 -14.694 -17.370 -32.857 178 HB1 ALA 22 HB1 ALA 22 -13.419 -19.555 -31.279 179 HB2 ALA 22 HB2 ALA 22 -14.170 -19.606 -32.875 180 HB3 ALA 22 HB3 ALA 22 -12.570 -18.891 -32.675 181 H ASN 23 H ASN 23 -13.923 -16.816 -29.587 182 HA ASN 23 HA ASN 23 -16.671 -17.515 -28.820 183 HB2 ASN 23 HB2 ASN 23 -14.273 -18.751 -27.852 184 HB3 ASN 23 HB3 ASN 23 -15.028 -17.859 -26.534 185 HD21 ASN 23 HD21 ASN 23 -15.778 -20.149 -29.124 186 HD22 ASN 23 HD22 ASN 23 -16.978 -21.023 -28.240 187 H ARG 24 H ARG 24 -17.658 -15.703 -28.244 188 HA ARG 24 HA ARG 24 -16.814 -14.050 -26.154 189 HB2 ARG 24 HB2 ARG 24 -16.359 -11.959 -27.474 190 HB3 ARG 24 HB3 ARG 24 -15.105 -13.187 -27.580 191 HG2 ARG 24 HG2 ARG 24 -16.885 -13.689 -29.695 192 HG3 ARG 24 HG3 ARG 24 -16.603 -11.947 -29.671 193 HD2 ARG 24 HD2 ARG 24 -14.102 -12.655 -29.398 194 HD3 ARG 24 HD3 ARG 24 -14.665 -14.181 -30.078 195 HE ARG 24 HE ARG 24 -14.771 -13.165 -32.114 196 HH11 ARG 24 HH11 ARG 24 -14.835 -10.710 -29.647 197 HH12 ARG 24 HH12 ARG 24 -14.770 -9.394 -30.771 198 HH21 ARG 24 HH21 ARG 24 -14.685 -11.440 -33.605 199 HH22 ARG 24 HH22 ARG 24 -14.686 -9.810 -33.022 200 H GLN 25 H GLN 25 -18.051 -11.762 -26.424 201 HA GLN 25 HA GLN 25 -20.624 -12.150 -27.736 202 HB2 GLN 25 HB2 GLN 25 -20.402 -11.577 -24.777 203 HB3 GLN 25 HB3 GLN 25 -21.893 -11.666 -25.705 204 HG2 GLN 25 HG2 GLN 25 -21.032 -14.071 -26.275 205 HG3 GLN 25 HG3 GLN 25 -20.086 -13.849 -24.804 206 HE21 GLN 25 HE21 GLN 25 -21.954 -15.830 -24.962 207 HE22 GLN 25 HE22 GLN 25 -23.288 -15.463 -23.928 208 H VAL 26 H VAL 26 -18.707 -10.038 -25.615 209 HA VAL 26 HA VAL 26 -19.248 -7.794 -27.380 210 HB VAL 26 HB VAL 26 -21.102 -7.755 -25.719 211 HG11 VAL 26 HG11 VAL 26 -19.020 -7.066 -23.664 212 HG12 VAL 26 HG12 VAL 26 -20.736 -7.401 -23.422 213 HG13 VAL 26 HG13 VAL 26 -19.636 -8.706 -23.871 214 HG21 VAL 26 HG21 VAL 26 -19.133 -5.478 -25.515 215 HG22 VAL 26 HG22 VAL 26 -20.335 -5.699 -26.787 216 HG23 VAL 26 HG23 VAL 26 -20.851 -5.391 -25.129 217 H GLU 27 H GLU 27 -17.570 -6.406 -27.487 218 HA GLU 27 HA GLU 27 -15.481 -6.604 -25.423 219 HB2 GLU 27 HB2 GLU 27 -15.268 -6.977 -28.356 220 HB3 GLU 27 HB3 GLU 27 -13.994 -6.036 -27.595 221 HG2 GLU 27 HG2 GLU 27 -14.814 -8.764 -26.643 222 HG3 GLU 27 HG3 GLU 27 -13.548 -8.493 -27.838 223 H HIS 28 H HIS 28 -15.104 -4.709 -24.505 224 HA HIS 28 HA HIS 28 -14.913 -2.293 -26.067 225 HB2 HIS 28 HB2 HIS 28 -17.320 -2.916 -24.515 226 HB3 HIS 28 HB3 HIS 28 -16.599 -1.363 -24.098 227 HD1 HIS 28 HD1 HIS 28 -16.092 0.191 -26.340 228 HD2 HIS 28 HD2 HIS 28 -18.986 -2.775 -26.637 229 HE1 HIS 28 HE1 HIS 28 -17.496 0.818 -28.330 230 H VAL 29 H VAL 29 -14.464 -0.373 -24.541 231 HA VAL 29 HA VAL 29 -12.300 -1.149 -22.827 232 HB VAL 29 HB VAL 29 -13.477 1.613 -23.139 233 HG11 VAL 29 HG11 VAL 29 -10.778 0.613 -22.244 234 HG12 VAL 29 HG12 VAL 29 -11.152 2.305 -22.578 235 HG13 VAL 29 HG13 VAL 29 -11.981 1.458 -21.271 236 HG21 VAL 29 HG21 VAL 29 -11.361 1.709 -24.746 237 HG22 VAL 29 HG22 VAL 29 -11.760 0.003 -24.945 238 HG23 VAL 29 HG23 VAL 29 -12.960 1.239 -25.324 239 H TYR 30 H TYR 30 -12.170 -1.089 -20.629 240 HA TYR 30 HA TYR 30 -14.522 -0.209 -19.117 241 HB2 TYR 30 HB2 TYR 30 -13.143 -2.874 -18.735 242 HB3 TYR 30 HB3 TYR 30 -14.431 -2.234 -17.720 243 HD1 TYR 30 HD1 TYR 30 -16.648 -1.613 -18.998 244 HD2 TYR 30 HD2 TYR 30 -13.696 -4.299 -20.471 245 HE1 TYR 30 HE1 TYR 30 -18.326 -2.637 -20.475 246 HE2 TYR 30 HE2 TYR 30 -15.365 -5.330 -21.954 247 HH TYR 30 HH TYR 30 -17.997 -5.544 -21.893 248 H LYS 31 H LYS 31 -14.052 -0.082 -16.745 249 HA LYS 31 HA LYS 31 -11.239 0.241 -16.063 250 HB2 LYS 31 HB2 LYS 31 -13.094 2.464 -16.527 251 HB3 LYS 31 HB3 LYS 31 -12.289 2.533 -14.965 252 HG2 LYS 31 HG2 LYS 31 -10.242 1.928 -16.706 253 HG3 LYS 31 HG3 LYS 31 -11.247 3.052 -17.623 254 HD2 LYS 31 HD2 LYS 31 -10.156 3.521 -14.847 255 HD3 LYS 31 HD3 LYS 31 -9.524 4.226 -16.337 256 HE2 LYS 31 HE2 LYS 31 -11.971 5.077 -16.636 257 HE3 LYS 31 HE3 LYS 31 -12.083 4.795 -14.899 258 HZ1 LYS 31 HZ1 LYS 31 -10.989 6.666 -14.520 259 HZ2 LYS 31 HZ2 LYS 31 -11.025 7.009 -16.176 260 HZ3 LYS 31 HZ3 LYS 31 -9.702 6.192 -15.510 261 H PHE 32 H PHE 32 -10.811 -0.169 -13.953 262 HA PHE 32 HA PHE 32 -13.108 -0.483 -12.138 263 HB2 PHE 32 HB2 PHE 32 -10.729 -2.281 -11.892 264 HB3 PHE 32 HB3 PHE 32 -12.394 -2.559 -11.393 265 HD1 PHE 32 HD2 PHE 32 -14.068 -3.294 -12.998 266 HD2 PHE 32 HD1 PHE 32 -10.004 -2.738 -14.134 267 HE1 PHE 32 HE2 PHE 32 -14.473 -4.575 -15.060 268 HE2 PHE 32 HE1 PHE 32 -10.402 -4.018 -16.197 269 HZ PHE 32 HZ PHE 32 -12.638 -4.939 -16.662 270 H ARG 33 H ARG 33 -12.845 1.275 -10.871 271 HA ARG 33 HA ARG 33 -10.209 2.022 -9.909 272 HB2 ARG 33 HB2 ARG 33 -11.351 3.936 -8.893 273 HB3 ARG 33 HB3 ARG 33 -11.762 3.782 -10.596 274 HG2 ARG 33 HG2 ARG 33 -13.822 2.471 -9.709 275 HG3 ARG 33 HG3 ARG 33 -13.454 3.289 -8.190 276 HD2 ARG 33 HD2 ARG 33 -13.366 5.124 -10.417 277 HD3 ARG 33 HD3 ARG 33 -14.921 4.296 -10.336 278 HE ARG 33 HE ARG 33 -14.056 5.319 -7.802 279 HH11 ARG 33 HH11 ARG 33 -15.664 6.105 -10.788 280 HH12 ARG 33 HH12 ARG 33 -16.571 7.415 -10.106 281 HH21 ARG 33 HH21 ARG 33 -15.244 7.040 -6.893 282 HH22 ARG 33 HH22 ARG 33 -16.331 7.946 -7.890 283 H ILE 34 H ILE 34 -9.366 1.194 -8.125 284 HA ILE 34 HA ILE 34 -11.063 -0.218 -6.232 285 HB ILE 34 HB ILE 34 -8.057 0.070 -6.286 286 HG12 ILE 34 HG12 ILE 34 -8.856 -1.147 -8.233 287 HG13 ILE 34 HG13 ILE 34 -8.098 -2.269 -7.108 288 HG21 ILE 34 HG21 ILE 34 -9.948 -1.286 -4.449 289 HG22 ILE 34 HG22 ILE 34 -8.450 -2.127 -4.845 290 HG23 ILE 34 HG23 ILE 34 -8.394 -0.522 -4.116 291 HD11 ILE 34 HD11 ILE 34 -10.555 -2.585 -6.261 292 HD12 ILE 34 HD12 ILE 34 -10.954 -1.984 -7.871 293 HD13 ILE 34 HD13 ILE 34 -9.969 -3.435 -7.690 294 H THR 35 H THR 35 -11.583 0.474 -4.245 295 HA THR 35 HA THR 35 -10.506 3.077 -3.391 296 HB THR 35 HB THR 35 -12.524 3.401 -2.099 297 HG1 THR 35 HG1 THR 35 -14.207 1.763 -2.277 298 HG21 THR 35 HG21 THR 35 -12.462 3.160 -4.922 299 HG22 THR 35 HG22 THR 35 -13.500 4.192 -3.938 300 HG23 THR 35 HG23 THR 35 -14.029 2.567 -4.375 301 H GLN 36 H GLN 36 -9.758 3.373 -1.309 302 HA GLN 36 HA GLN 36 -9.168 0.900 0.158 303 HB2 GLN 36 HB2 GLN 36 -7.290 2.413 -0.608 304 HB3 GLN 36 HB3 GLN 36 -7.881 3.602 0.545 305 HG2 GLN 36 HG2 GLN 36 -7.620 1.766 2.300 306 HG3 GLN 36 HG3 GLN 36 -6.670 0.916 1.083 307 HE21 GLN 36 HE21 GLN 36 -4.772 1.982 0.254 308 HE22 GLN 36 HE22 GLN 36 -3.908 3.092 1.257 309 H GLY 37 H GLY 37 -10.611 0.487 1.703 310 HA2 GLY 37 HA2 GLY 37 -11.651 0.785 3.757 311 HA3 GLY 37 HA3 GLY 37 -11.053 2.437 3.786 312 H GLY 38 H GLY 38 -12.125 3.405 1.406 313 HA2 GLY 38 HA2 GLY 38 -14.805 2.872 0.913 314 HA3 GLY 38 HA3 GLY 38 -14.767 4.026 2.239 315 H LYS 39 H LYS 39 -12.069 4.534 0.393 316 HA LYS 39 HA LYS 39 -13.428 6.433 -1.392 317 HB2 LYS 39 HB2 LYS 39 -12.527 7.583 0.643 318 HB3 LYS 39 HB3 LYS 39 -10.917 7.058 0.169 319 HG2 LYS 39 HG2 LYS 39 -11.235 8.293 -1.980 320 HG3 LYS 39 HG3 LYS 39 -12.735 8.942 -1.312 321 HD2 LYS 39 HD2 LYS 39 -11.230 9.665 0.679 322 HD3 LYS 39 HD3 LYS 39 -9.907 9.451 -0.471 323 HE2 LYS 39 HE2 LYS 39 -10.520 11.727 -0.601 324 HE3 LYS 39 HE3 LYS 39 -11.200 10.960 -2.035 325 HZ1 LYS 39 HZ1 LYS 39 -12.799 11.307 0.424 326 HZ2 LYS 39 HZ2 LYS 39 -13.339 11.045 -1.157 327 HZ3 LYS 39 HZ3 LYS 39 -12.679 12.542 -0.726 328 H VAL 40 H VAL 40 -12.611 6.578 -3.418 329 HA VAL 40 HA VAL 40 -11.069 4.552 -4.496 330 HB VAL 40 HB VAL 40 -12.520 6.198 -5.755 331 HG11 VAL 40 HG11 VAL 40 -11.683 8.282 -6.432 332 HG12 VAL 40 HG12 VAL 40 -11.315 8.190 -4.708 333 HG13 VAL 40 HG13 VAL 40 -10.047 7.896 -5.899 334 HG21 VAL 40 HG21 VAL 40 -10.990 6.192 -7.773 335 HG22 VAL 40 HG22 VAL 40 -9.766 5.472 -6.727 336 HG23 VAL 40 HG23 VAL 40 -11.285 4.626 -7.018 337 H VAL 41 H VAL 41 -8.929 4.283 -5.005 338 HA VAL 41 HA VAL 41 -7.057 6.310 -3.967 339 HB VAL 41 HB VAL 41 -5.508 4.378 -3.454 340 HG11 VAL 41 HG11 VAL 41 -8.014 4.236 -1.811 341 HG12 VAL 41 HG12 VAL 41 -6.334 4.129 -1.283 342 HG13 VAL 41 HG13 VAL 41 -6.995 5.675 -1.815 343 HG21 VAL 41 HG21 VAL 41 -8.004 2.704 -3.498 344 HG22 VAL 41 HG22 VAL 41 -6.889 2.767 -4.862 345 HG23 VAL 41 HG23 VAL 41 -6.333 2.178 -3.296 346 H LYS 42 H LYS 42 -7.847 3.996 -6.435 347 HA LYS 42 HA LYS 42 -5.976 5.244 -8.247 348 HB2 LYS 42 HB2 LYS 42 -4.564 3.471 -8.660 349 HB3 LYS 42 HB3 LYS 42 -4.829 3.281 -6.932 350 HG2 LYS 42 HG2 LYS 42 -6.771 1.717 -7.679 351 HG3 LYS 42 HG3 LYS 42 -5.875 1.650 -9.199 352 HD2 LYS 42 HD2 LYS 42 -4.537 1.141 -6.559 353 HD3 LYS 42 HD3 LYS 42 -5.380 -0.142 -7.430 354 HE2 LYS 42 HE2 LYS 42 -3.943 0.508 -9.434 355 HE3 LYS 42 HE3 LYS 42 -2.973 1.439 -8.294 356 HZ1 LYS 42 HZ1 LYS 42 -2.055 -0.766 -8.645 357 HZ2 LYS 42 HZ2 LYS 42 -3.500 -1.480 -8.131 358 HZ3 LYS 42 HZ3 LYS 42 -2.565 -0.585 -7.042 359 H ASN 43 H ASN 43 -6.118 4.076 -10.465 360 HA ASN 43 HA ASN 43 -8.810 2.994 -10.899 361 HB2 ASN 43 HB2 ASN 43 -8.721 4.457 -13.085 362 HB3 ASN 43 HB3 ASN 43 -9.272 5.159 -11.566 363 HD21 ASN 43 HD21 ASN 43 -8.578 7.160 -11.435 364 HD22 ASN 43 HD22 ASN 43 -6.989 7.716 -11.824 365 H TRP 44 H TRP 44 -8.826 1.265 -12.186 366 HA TRP 44 HA TRP 44 -6.370 0.642 -13.678 367 HB2 TRP 44 HB2 TRP 44 -8.489 -1.085 -12.424 368 HB3 TRP 44 HB3 TRP 44 -7.428 -1.722 -13.678 369 HD1 TRP 44 HD1 TRP 44 -7.415 -0.583 -10.036 370 HE1 TRP 44 HE1 TRP 44 -5.210 -1.333 -8.941 371 HE3 TRP 44 HE3 TRP 44 -4.966 -2.251 -14.203 372 HZ2 TRP 44 HZ2 TRP 44 -2.757 -2.479 -9.738 373 HZ3 TRP 44 HZ3 TRP 44 -2.694 -3.159 -13.950 374 HH2 TRP 44 HH2 TRP 44 -1.613 -3.269 -11.763 375 H VAL 45 H VAL 45 -6.458 -0.013 -15.820 376 HA VAL 45 HA VAL 45 -9.053 0.368 -17.169 377 HB VAL 45 HB VAL 45 -6.325 1.157 -18.201 378 HG11 VAL 45 HG11 VAL 45 -7.591 0.393 -20.055 379 HG12 VAL 45 HG12 VAL 45 -9.046 1.214 -19.487 380 HG13 VAL 45 HG13 VAL 45 -7.676 2.154 -20.080 381 HG21 VAL 45 HG21 VAL 45 -6.836 3.344 -17.762 382 HG22 VAL 45 HG22 VAL 45 -8.576 3.072 -17.849 383 HG23 VAL 45 HG23 VAL 45 -7.674 2.563 -16.421 384 H MET 46 H MET 46 -9.559 -1.008 -18.853 385 HA MET 46 HA MET 46 -7.953 -3.451 -18.970 386 HB2 MET 46 HB2 MET 46 -10.426 -3.525 -18.473 387 HB3 MET 46 HB3 MET 46 -10.705 -2.988 -20.124 388 HG2 MET 46 HG2 MET 46 -10.546 -5.061 -20.864 389 HG3 MET 46 HG3 MET 46 -8.938 -5.222 -20.163 390 HE1 MET 46 HE1 MET 46 -12.530 -6.289 -20.148 391 HE2 MET 46 HE2 MET 46 -12.891 -6.785 -18.495 392 HE3 MET 46 HE3 MET 46 -12.739 -5.072 -18.889 393 H ASP 47 H ASP 47 -6.395 -3.325 -20.467 394 HA ASP 47 HA ASP 47 -6.624 -1.788 -22.857 395 HB2 ASP 47 HB2 ASP 47 -4.525 -2.805 -21.446 396 HB3 ASP 47 HB3 ASP 47 -4.594 -3.925 -22.803 397 H LEU 48 H LEU 48 -7.932 -2.339 -24.468 398 HA LEU 48 HA LEU 48 -8.679 -5.087 -24.936 399 HB2 LEU 48 HB2 LEU 48 -9.510 -2.430 -25.940 400 HB3 LEU 48 HB3 LEU 48 -9.759 -3.801 -27.019 401 HG LEU 48 HG LEU 48 -11.135 -4.892 -25.307 402 HD11 LEU 48 HD11 LEU 48 -10.985 -2.342 -23.727 403 HD12 LEU 48 HD12 LEU 48 -9.940 -3.723 -23.395 404 HD13 LEU 48 HD13 LEU 48 -11.690 -3.889 -23.257 405 HD21 LEU 48 HD21 LEU 48 -12.317 -2.180 -25.488 406 HD22 LEU 48 HD22 LEU 48 -13.019 -3.753 -25.868 407 HD23 LEU 48 HD23 LEU 48 -11.904 -2.988 -27.001 408 H LYS 49 H LYS 49 -6.286 -2.928 -26.069 409 HA LYS 49 HA LYS 49 -5.905 -4.129 -28.646 410 HB2 LYS 49 HB2 LYS 49 -4.979 -1.824 -27.306 411 HB3 LYS 49 HB3 LYS 49 -3.553 -2.781 -27.684 412 HG2 LYS 49 HG2 LYS 49 -4.038 -2.749 -30.004 413 HG3 LYS 49 HG3 LYS 49 -5.648 -2.082 -29.723 414 HD2 LYS 49 HD2 LYS 49 -4.642 -0.019 -28.871 415 HD3 LYS 49 HD3 LYS 49 -3.032 -0.689 -29.147 416 HE2 LYS 49 HE2 LYS 49 -3.174 -0.451 -31.414 417 HE3 LYS 49 HE3 LYS 49 -4.926 -0.641 -31.434 418 HZ1 LYS 49 HZ1 LYS 49 -4.150 1.633 -31.967 419 HZ2 LYS 49 HZ2 LYS 49 -3.532 1.765 -30.398 420 HZ3 LYS 49 HZ3 LYS 49 -5.196 1.576 -30.637 421 H ASN 50 H ASN 50 -4.297 -4.351 -25.495 422 HA ASN 50 HA ASN 50 -2.678 -6.580 -26.510 423 HB2 ASN 50 HB2 ASN 50 -1.846 -4.449 -25.097 424 HB3 ASN 50 HB3 ASN 50 -2.241 -5.533 -23.767 425 HD21 ASN 50 HD21 ASN 50 0.344 -4.545 -24.555 426 HD22 ASN 50 HD22 ASN 50 1.311 -5.926 -24.934 427 H VAL 51 H VAL 51 -5.500 -5.992 -24.829 428 HA VAL 51 HA VAL 51 -6.916 -7.286 -23.603 429 HB VAL 51 HB VAL 51 -5.269 -9.699 -24.296 430 HG11 VAL 51 HG11 VAL 51 -8.190 -9.156 -23.829 431 HG12 VAL 51 HG12 VAL 51 -7.600 -10.660 -24.538 432 HG13 VAL 51 HG13 VAL 51 -7.111 -10.201 -22.906 433 HG21 VAL 51 HG21 VAL 51 -6.824 -7.940 -26.129 434 HG22 VAL 51 HG22 VAL 51 -5.329 -8.830 -26.419 435 HG23 VAL 51 HG23 VAL 51 -6.871 -9.684 -26.383 436 H LYS 52 H LYS 52 -4.751 -6.100 -22.230 437 HA LYS 52 HA LYS 52 -4.408 -8.040 -20.044 438 HB2 LYS 52 HB2 LYS 52 -2.295 -7.688 -21.363 439 HB3 LYS 52 HB3 LYS 52 -2.333 -6.003 -20.862 440 HG2 LYS 52 HG2 LYS 52 -1.711 -6.474 -18.729 441 HG3 LYS 52 HG3 LYS 52 -2.484 -8.061 -18.736 442 HD2 LYS 52 HD2 LYS 52 -0.248 -8.631 -18.755 443 HD3 LYS 52 HD3 LYS 52 -0.631 -8.644 -20.478 444 HE2 LYS 52 HE2 LYS 52 1.033 -7.202 -20.782 445 HE3 LYS 52 HE3 LYS 52 0.085 -6.008 -19.899 446 HZ1 LYS 52 HZ1 LYS 52 2.462 -6.583 -19.113 447 HZ2 LYS 52 HZ2 LYS 52 1.735 -7.944 -18.422 448 HZ3 LYS 52 HZ3 LYS 52 1.236 -6.395 -17.962 449 H LEU 53 H LEU 53 -3.969 -6.994 -17.931 450 HA LEU 53 HA LEU 53 -5.633 -4.604 -17.662 451 HB2 LEU 53 HB2 LEU 53 -4.880 -6.864 -15.907 452 HB3 LEU 53 HB3 LEU 53 -5.139 -5.305 -15.126 453 HG LEU 53 HG LEU 53 -7.158 -6.609 -15.010 454 HD11 LEU 53 HD11 LEU 53 -6.985 -4.039 -16.005 455 HD12 LEU 53 HD12 LEU 53 -8.431 -4.819 -15.365 456 HD13 LEU 53 HD13 LEU 53 -8.113 -4.839 -17.100 457 HD21 LEU 53 HD21 LEU 53 -6.561 -7.970 -17.080 458 HD22 LEU 53 HD22 LEU 53 -7.277 -6.655 -18.012 459 HD23 LEU 53 HD23 LEU 53 -8.260 -7.554 -16.855 460 H VAL 54 H VAL 54 -4.846 -2.670 -17.102 461 HA VAL 54 HA VAL 54 -2.259 -2.449 -15.789 462 HB VAL 54 HB VAL 54 -1.480 -0.737 -17.445 463 HG11 VAL 54 HG11 VAL 54 -1.787 -3.296 -18.934 464 HG12 VAL 54 HG12 VAL 54 -0.354 -2.296 -18.687 465 HG13 VAL 54 HG13 VAL 54 -0.954 -3.317 -17.379 466 HG21 VAL 54 HG21 VAL 54 -3.888 -0.562 -18.404 467 HG22 VAL 54 HG22 VAL 54 -2.509 -0.406 -19.492 468 HG23 VAL 54 HG23 VAL 54 -3.398 -1.927 -19.408 469 H GLU 55 H GLU 55 -1.754 0.006 -15.484 470 HA GLU 55 HA GLU 55 -4.238 1.250 -14.528 471 HB2 GLU 55 HB2 GLU 55 -2.458 2.700 -13.249 472 HB3 GLU 55 HB3 GLU 55 -2.898 1.102 -12.664 473 HG2 GLU 55 HG2 GLU 55 -0.880 0.209 -13.157 474 HG3 GLU 55 HG3 GLU 55 -0.637 1.248 -14.560 475 H SER 56 H SER 56 -5.031 2.811 -15.759 476 HA SER 56 HA SER 56 -3.281 4.880 -16.795 477 HB2 SER 56 HB2 SER 56 -3.147 3.576 -18.725 478 HB3 SER 56 HB3 SER 56 -4.793 2.969 -18.550 479 HG SER 56 HG SER 56 -4.943 4.455 -20.130 480 H ASP 57 H ASP 57 -4.597 6.642 -17.866 481 HA ASP 57 HA ASP 57 -7.104 6.975 -16.366 482 HB2 ASP 57 HB2 ASP 57 -4.984 8.611 -16.318 483 HB3 ASP 57 HB3 ASP 57 -5.817 9.294 -17.712 484 H ASP 58 H ASP 58 -6.235 5.932 -19.267 485 HA ASP 58 HA ASP 58 -7.463 7.440 -21.212 486 HB2 ASP 58 HB2 ASP 58 -6.161 5.367 -21.627 487 HB3 ASP 58 HB3 ASP 58 -7.518 4.421 -21.022 488 H ALA 59 H ALA 59 -9.532 7.450 -22.159 489 HA ALA 59 HA ALA 59 -11.684 7.450 -20.332 490 HB1 ALA 59 HB1 ALA 59 -13.091 7.917 -22.274 491 HB2 ALA 59 HB2 ALA 59 -11.629 8.904 -22.291 492 HB3 ALA 59 HB3 ALA 59 -11.755 7.497 -23.347 493 H ALA 60 H ALA 60 -13.285 6.004 -19.921 494 HA ALA 60 HA ALA 60 -13.144 3.412 -21.319 495 HB1 ALA 60 HB1 ALA 60 -12.474 2.606 -19.338 496 HB2 ALA 60 HB2 ALA 60 -13.034 4.028 -18.457 497 HB3 ALA 60 HB3 ALA 60 -14.173 2.752 -18.888 498 H GLU 61 H GLU 61 -15.115 2.264 -21.558 499 HA GLU 61 HA GLU 61 -17.351 3.914 -22.128 500 HB2 GLU 61 HB2 GLU 61 -16.938 0.933 -22.083 501 HB3 GLU 61 HB3 GLU 61 -18.510 1.639 -22.429 502 HG2 GLU 61 HG2 GLU 61 -16.193 2.634 -23.982 503 HG3 GLU 61 HG3 GLU 61 -16.782 1.010 -24.333 504 H ALA 62 H ALA 62 -16.264 2.442 -19.274 505 HA ALA 62 HA ALA 62 -18.509 3.414 -17.791 506 HB1 ALA 62 HB1 ALA 62 -18.559 0.791 -16.895 507 HB2 ALA 62 HB2 ALA 62 -19.786 1.594 -17.876 508 HB3 ALA 62 HB3 ALA 62 -18.514 0.651 -18.653 509 H THR 63 H THR 63 -18.246 3.070 -15.453 510 HA THR 63 HA THR 63 -15.436 2.563 -14.720 511 HB THR 63 HB THR 63 -17.063 4.459 -13.093 512 HG1 THR 63 HG1 THR 63 -16.311 6.160 -14.534 513 HG21 THR 63 HG21 THR 63 -14.666 3.624 -12.628 514 HG22 THR 63 HG22 THR 63 -14.989 5.353 -12.492 515 HG23 THR 63 HG23 THR 63 -14.192 4.715 -13.930 516 H LEU 64 H LEU 64 -15.172 0.985 -13.291 517 HA LEU 64 HA LEU 64 -17.482 0.170 -11.660 518 HB2 LEU 64 HB2 LEU 64 -15.156 -1.337 -12.796 519 HB3 LEU 64 HB3 LEU 64 -16.050 -1.969 -11.415 520 HG LEU 64 HG LEU 64 -17.959 -1.304 -13.383 521 HD11 LEU 64 HD11 LEU 64 -16.109 -3.239 -14.646 522 HD12 LEU 64 HD12 LEU 64 -15.699 -1.529 -14.772 523 HD13 LEU 64 HD13 LEU 64 -17.249 -2.110 -15.379 524 HD21 LEU 64 HD21 LEU 64 -18.572 -3.561 -13.184 525 HD22 LEU 64 HD22 LEU 64 -17.892 -3.135 -11.614 526 HD23 LEU 64 HD23 LEU 64 -16.932 -4.059 -12.769 527 H THR 65 H THR 65 -17.356 1.045 -9.696 528 HA THR 65 HA THR 65 -14.738 1.336 -8.411 529 HB THR 65 HB THR 65 -17.342 2.381 -7.318 530 HG1 THR 65 HG1 THR 65 -16.598 3.064 -9.615 531 HG21 THR 65 HG21 THR 65 -15.295 4.156 -6.776 532 HG22 THR 65 HG22 THR 65 -14.520 2.579 -6.626 533 HG23 THR 65 HG23 THR 65 -15.948 2.955 -5.663 534 H MET 66 H MET 66 -14.089 -0.171 -7.032 535 HA MET 66 HA MET 66 -15.978 -1.351 -5.166 536 HB2 MET 66 HB2 MET 66 -14.438 -2.948 -7.204 537 HB3 MET 66 HB3 MET 66 -15.022 -3.662 -5.707 538 HG2 MET 66 HG2 MET 66 -16.852 -4.146 -6.877 539 HG3 MET 66 HG3 MET 66 -17.267 -2.449 -6.647 540 HE1 MET 66 HE1 MET 66 -17.052 -4.845 -10.106 541 HE2 MET 66 HE2 MET 66 -15.310 -4.617 -9.956 542 HE3 MET 66 HE3 MET 66 -16.240 -5.230 -8.588 543 H GLU 67 H GLU 67 -15.082 -1.672 -3.214 544 HA GLU 67 HA GLU 67 -12.595 -0.646 -2.546 545 HB2 GLU 67 HB2 GLU 67 -14.701 -2.129 -1.204 546 HB3 GLU 67 HB3 GLU 67 -13.111 -2.573 -0.600 547 HG2 GLU 67 HG2 GLU 67 -12.642 -0.158 -0.242 548 HG3 GLU 67 HG3 GLU 67 -14.314 0.181 -0.686 549 H ASP 68 H ASP 68 -10.738 -1.819 -1.591 550 HA ASP 68 HA ASP 68 -9.698 -3.702 -3.446 551 HB2 ASP 68 HB2 ASP 68 -8.281 -2.082 -2.233 552 HB3 ASP 68 HB3 ASP 68 -8.632 -2.919 -0.724 553 H ASP 69 H ASP 69 -10.538 -4.000 0.006 554 HA ASP 69 HA ASP 69 -10.092 -6.773 0.172 555 HB2 ASP 69 HB2 ASP 69 -10.959 -4.699 1.907 556 HB3 ASP 69 HB3 ASP 69 -12.151 -5.993 2.002 557 H ILE 70 H ILE 70 -12.814 -4.900 -0.926 558 HA ILE 70 HA ILE 70 -14.653 -7.121 -0.894 559 HB ILE 70 HB ILE 70 -15.059 -4.567 -2.426 560 HG12 ILE 70 HG12 ILE 70 -14.303 -4.018 -0.124 561 HG13 ILE 70 HG13 ILE 70 -15.970 -3.537 -0.426 562 HG21 ILE 70 HG21 ILE 70 -16.860 -6.620 -1.176 563 HG22 ILE 70 HG22 ILE 70 -17.440 -5.032 -1.675 564 HG23 ILE 70 HG23 ILE 70 -16.756 -6.136 -2.868 565 HD11 ILE 70 HD11 ILE 70 -15.846 -6.201 0.658 566 HD12 ILE 70 HD12 ILE 70 -15.014 -5.045 1.697 567 HD13 ILE 70 HD13 ILE 70 -16.699 -4.777 1.254 568 H MET 71 H MET 71 -12.993 -5.230 -3.415 569 HA MET 71 HA MET 71 -13.935 -6.606 -5.636 570 HB2 MET 71 HB2 MET 71 -12.645 -4.500 -5.736 571 HB3 MET 71 HB3 MET 71 -11.195 -5.380 -5.271 572 HG2 MET 71 HG2 MET 71 -10.861 -5.413 -7.493 573 HG3 MET 71 HG3 MET 71 -11.907 -6.828 -7.398 574 HE1 MET 71 HE1 MET 71 -12.014 -3.091 -9.429 575 HE2 MET 71 HE2 MET 71 -10.895 -4.447 -9.289 576 HE3 MET 71 HE3 MET 71 -12.154 -4.466 -10.525 577 H PHE 72 H PHE 72 -11.466 -7.475 -3.332 578 HA PHE 72 HA PHE 72 -10.227 -9.514 -4.860 579 HB2 PHE 72 HB2 PHE 72 -9.475 -8.318 -2.641 580 HB3 PHE 72 HB3 PHE 72 -10.346 -9.641 -1.871 581 HD1 PHE 72 HD1 PHE 72 -8.196 -9.545 -4.912 582 HD2 PHE 72 HD2 PHE 72 -8.787 -11.085 -0.989 583 HE1 PHE 72 HE1 PHE 72 -6.228 -10.995 -5.189 584 HE2 PHE 72 HE2 PHE 72 -6.819 -12.537 -1.259 585 HZ PHE 72 HZ PHE 72 -5.536 -12.493 -3.360 586 H ALA 73 H ALA 73 -12.833 -9.544 -2.460 587 HA ALA 73 HA ALA 73 -13.211 -12.304 -2.297 588 HB1 ALA 73 HB1 ALA 73 -15.311 -11.841 -1.308 589 HB2 ALA 73 HB2 ALA 73 -14.233 -10.530 -0.827 590 HB3 ALA 73 HB3 ALA 73 -15.420 -10.272 -2.106 591 H ILE 74 H ILE 74 -14.729 -9.929 -4.461 592 HA ILE 74 HA ILE 74 -16.220 -11.951 -5.867 593 HB ILE 74 HB ILE 74 -15.745 -9.124 -6.794 594 HG12 ILE 74 HG12 ILE 74 -17.947 -10.094 -4.961 595 HG13 ILE 74 HG13 ILE 74 -16.540 -9.183 -4.425 596 HG21 ILE 74 HG21 ILE 74 -17.643 -9.390 -8.114 597 HG22 ILE 74 HG22 ILE 74 -16.822 -10.943 -8.259 598 HG23 ILE 74 HG23 ILE 74 -18.212 -10.777 -7.186 599 HD11 ILE 74 HD11 ILE 74 -17.747 -7.770 -6.568 600 HD12 ILE 74 HD12 ILE 74 -18.999 -8.208 -5.405 601 HD13 ILE 74 HD13 ILE 74 -17.586 -7.295 -4.877 602 H GLY 75 H GLY 75 -13.211 -10.204 -6.322 603 HA2 GLY 75 HA2 GLY 75 -12.768 -10.802 -9.031 604 HA3 GLY 75 HA3 GLY 75 -11.517 -10.446 -7.850 605 H THR 76 H THR 76 -12.264 -12.704 -6.136 606 HA THR 76 HA THR 76 -10.932 -14.797 -7.696 607 HB THR 76 HB THR 76 -9.857 -14.192 -5.584 608 HG1 THR 76 HG1 THR 76 -9.612 -16.338 -6.153 609 HG21 THR 76 HG21 THR 76 -10.936 -13.926 -3.634 610 HG22 THR 76 HG22 THR 76 -11.868 -15.408 -3.848 611 HG23 THR 76 HG23 THR 76 -12.408 -13.909 -4.603 612 H GLY 77 H GLY 77 -13.997 -13.939 -7.102 613 HA2 GLY 77 HA2 GLY 77 -15.912 -15.178 -7.602 614 HA3 GLY 77 HA3 GLY 77 -14.959 -16.650 -7.500 615 H ALA 78 H ALA 78 -14.041 -15.252 -4.803 616 HA ALA 78 HA ALA 78 -15.292 -16.897 -3.024 617 HB1 ALA 78 HB1 ALA 78 -13.665 -14.554 -2.866 618 HB2 ALA 78 HB2 ALA 78 -14.932 -14.469 -1.641 619 HB3 ALA 78 HB3 ALA 78 -13.850 -15.861 -1.696 620 H LEU 79 H LEU 79 -16.150 -13.445 -3.072 621 HA LEU 79 HA LEU 79 -18.851 -14.149 -2.223 622 HB2 LEU 79 HB2 LEU 79 -17.169 -11.702 -2.143 623 HB3 LEU 79 HB3 LEU 79 -18.919 -11.497 -2.195 624 HG LEU 79 HG LEU 79 -17.560 -13.193 -0.116 625 HD11 LEU 79 HD11 LEU 79 -18.463 -10.649 0.865 626 HD12 LEU 79 HD12 LEU 79 -17.254 -10.428 -0.400 627 HD13 LEU 79 HD13 LEU 79 -16.880 -11.412 1.015 628 HD21 LEU 79 HD21 LEU 79 -20.276 -11.910 -0.355 629 HD22 LEU 79 HD22 LEU 79 -19.664 -12.654 1.122 630 HD23 LEU 79 HD23 LEU 79 -19.898 -13.633 -0.327 631 HA PRO 80 HA PRO 80 -20.640 -13.533 -6.196 632 HB2 PRO 80 HB2 PRO 80 -23.175 -12.920 -5.441 633 HB3 PRO 80 HB3 PRO 80 -22.514 -14.556 -5.346 634 HG2 PRO 80 HG2 PRO 80 -22.814 -12.505 -3.186 635 HG3 PRO 80 HG3 PRO 80 -23.149 -14.246 -3.130 636 HD2 PRO 80 HD2 PRO 80 -20.880 -13.167 -2.121 637 HD3 PRO 80 HD3 PRO 80 -20.929 -14.792 -2.834 638 H ALA 81 H ALA 81 -20.470 -11.850 -7.526 639 HA ALA 81 HA ALA 81 -20.096 -9.209 -6.705 640 HB1 ALA 81 HB1 ALA 81 -21.163 -9.769 -9.430 641 HB2 ALA 81 HB2 ALA 81 -19.867 -8.683 -8.926 642 HB3 ALA 81 HB3 ALA 81 -19.591 -10.424 -8.974 643 H LYS 82 H LYS 82 -23.003 -10.986 -7.353 644 HA LYS 82 HA LYS 82 -24.748 -8.811 -7.809 645 HB2 LYS 82 HB2 LYS 82 -25.554 -11.408 -6.512 646 HB3 LYS 82 HB3 LYS 82 -26.521 -10.359 -7.540 647 HG2 LYS 82 HG2 LYS 82 -26.022 -11.797 -9.166 648 HG3 LYS 82 HG3 LYS 82 -24.440 -11.013 -9.186 649 HD2 LYS 82 HD2 LYS 82 -23.895 -12.730 -7.289 650 HD3 LYS 82 HD3 LYS 82 -25.255 -13.621 -7.976 651 HE2 LYS 82 HE2 LYS 82 -23.727 -12.838 -10.169 652 HE3 LYS 82 HE3 LYS 82 -22.549 -13.332 -8.955 653 HZ1 LYS 82 HZ1 LYS 82 -23.528 -15.086 -10.544 654 HZ2 LYS 82 HZ2 LYS 82 -24.881 -15.036 -9.531 655 HZ3 LYS 82 HZ3 LYS 82 -23.371 -15.471 -8.904 656 H GLU 83 H GLU 83 -24.262 -10.769 -4.862 657 HA GLU 83 HA GLU 83 -25.855 -9.273 -3.155 658 HB2 GLU 83 HB2 GLU 83 -23.321 -10.794 -2.520 659 HB3 GLU 83 HB3 GLU 83 -24.468 -10.215 -1.320 660 HG2 GLU 83 HG2 GLU 83 -25.135 -12.160 -3.516 661 HG3 GLU 83 HG3 GLU 83 -24.715 -12.613 -1.865 662 H ALA 84 H ALA 84 -22.325 -9.010 -3.592 663 HA ALA 84 HA ALA 84 -21.813 -6.897 -1.911 664 HB1 ALA 84 HB1 ALA 84 -20.343 -8.331 -3.699 665 HB2 ALA 84 HB2 ALA 84 -20.356 -6.733 -4.447 666 HB3 ALA 84 HB3 ALA 84 -19.755 -6.931 -2.800 667 H MET 85 H MET 85 -22.973 -6.785 -5.256 668 HA MET 85 HA MET 85 -22.895 -3.964 -5.501 669 HB2 MET 85 HB2 MET 85 -23.815 -6.226 -7.081 670 HB3 MET 85 HB3 MET 85 -24.896 -4.846 -7.220 671 HG2 MET 85 HG2 MET 85 -22.573 -3.583 -7.549 672 HG3 MET 85 HG3 MET 85 -22.110 -5.178 -8.139 673 HE1 MET 85 HE1 MET 85 -25.485 -2.545 -9.585 674 HE2 MET 85 HE2 MET 85 -24.488 -2.393 -8.138 675 HE3 MET 85 HE3 MET 85 -23.898 -1.780 -9.684 676 H ALA 86 H ALA 86 -25.337 -6.231 -4.379 677 HA ALA 86 HA ALA 86 -27.412 -4.256 -4.188 678 HB1 ALA 86 HB1 ALA 86 -27.960 -6.502 -2.526 679 HB2 ALA 86 HB2 ALA 86 -28.691 -6.063 -4.071 680 HB3 ALA 86 HB3 ALA 86 -27.247 -7.075 -4.035 681 H GLN 87 H GLN 87 -24.776 -5.220 -2.233 682 HA GLN 87 HA GLN 87 -25.945 -4.281 0.247 683 HB2 GLN 87 HB2 GLN 87 -23.157 -5.241 -0.415 684 HB3 GLN 87 HB3 GLN 87 -23.701 -4.797 1.197 685 HG2 GLN 87 HG2 GLN 87 -25.545 -6.671 0.139 686 HG3 GLN 87 HG3 GLN 87 -23.916 -7.292 -0.124 687 HE21 GLN 87 HE21 GLN 87 -23.993 -8.898 1.378 688 HE22 GLN 87 HE22 GLN 87 -24.096 -8.614 3.079 689 H ASP 88 H ASP 88 -25.007 -2.678 -2.342 690 HA ASP 88 HA ASP 88 -24.364 -0.536 -2.759 691 HB2 ASP 88 HB2 ASP 88 -25.785 -0.339 -0.486 692 HB3 ASP 88 HB3 ASP 88 -24.222 0.214 0.109 693 H LYS 89 H LYS 89 -22.466 -2.751 -1.732 694 HA LYS 89 HA LYS 89 -20.223 -1.153 -0.787 695 HB2 LYS 89 HB2 LYS 89 -20.582 -4.117 -1.234 696 HB3 LYS 89 HB3 LYS 89 -19.054 -3.397 -0.745 697 HG2 LYS 89 HG2 LYS 89 -20.127 -2.523 1.281 698 HG3 LYS 89 HG3 LYS 89 -21.640 -3.290 0.794 699 HD2 LYS 89 HD2 LYS 89 -20.578 -5.481 0.894 700 HD3 LYS 89 HD3 LYS 89 -19.041 -4.730 1.329 701 HE2 LYS 89 HE2 LYS 89 -20.646 -3.683 3.227 702 HE3 LYS 89 HE3 LYS 89 -21.443 -5.234 2.964 703 HZ1 LYS 89 HZ1 LYS 89 -19.055 -6.158 3.181 704 HZ2 LYS 89 HZ2 LYS 89 -19.907 -5.735 4.579 705 HZ3 LYS 89 HZ3 LYS 89 -18.728 -4.692 3.959 706 H MET 90 H MET 90 -21.550 -1.862 -3.718 707 HA MET 90 HA MET 90 -19.094 -1.164 -5.098 708 HB2 MET 90 HB2 MET 90 -18.724 -3.418 -5.386 709 HB3 MET 90 HB3 MET 90 -20.437 -3.814 -5.344 710 HG2 MET 90 HG2 MET 90 -20.708 -2.894 -7.588 711 HG3 MET 90 HG3 MET 90 -18.993 -2.492 -7.629 712 HE1 MET 90 HE1 MET 90 -20.706 -5.433 -9.738 713 HE2 MET 90 HE2 MET 90 -20.355 -3.705 -9.714 714 HE3 MET 90 HE3 MET 90 -19.119 -4.849 -10.239 715 H GLU 91 H GLU 91 -19.441 -0.018 -6.951 716 HA GLU 91 HA GLU 91 -22.173 0.134 -8.000 717 HB2 GLU 91 HB2 GLU 91 -21.828 1.993 -6.375 718 HB3 GLU 91 HB3 GLU 91 -20.497 2.568 -7.369 719 HG2 GLU 91 HG2 GLU 91 -22.612 3.794 -7.724 720 HG3 GLU 91 HG3 GLU 91 -21.970 3.048 -9.187 721 H VAL 92 H VAL 92 -22.270 1.225 -10.128 722 HA VAL 92 HA VAL 92 -19.740 1.256 -11.597 723 HB VAL 92 HB VAL 92 -20.912 0.003 -13.487 724 HG11 VAL 92 HG11 VAL 92 -19.812 -1.868 -12.865 725 HG12 VAL 92 HG12 VAL 92 -19.229 -0.833 -11.560 726 HG13 VAL 92 HG13 VAL 92 -20.585 -1.926 -11.281 727 HG21 VAL 92 HG21 VAL 92 -23.176 0.191 -12.417 728 HG22 VAL 92 HG22 VAL 92 -22.740 -1.430 -12.957 729 HG23 VAL 92 HG23 VAL 92 -22.647 -1.016 -11.245 730 H ASP 93 H ASP 93 -19.707 2.624 -13.354 731 HA ASP 93 HA ASP 93 -22.163 4.180 -13.835 732 HB2 ASP 93 HB2 ASP 93 -19.715 5.106 -12.797 733 HB3 ASP 93 HB3 ASP 93 -19.782 5.680 -14.462 734 H GLY 94 H GLY 94 -21.782 5.555 -15.969 735 HA2 GLY 94 HA2 GLY 94 -21.191 5.595 -18.229 736 HA3 GLY 94 HA3 GLY 94 -20.323 4.084 -18.005 737 H GLN 95 H GLN 95 -21.172 2.405 -19.022 738 HA GLN 95 HA GLN 95 -24.003 2.506 -19.780 739 HB2 GLN 95 HB2 GLN 95 -21.726 1.881 -21.241 740 HB3 GLN 95 HB3 GLN 95 -22.454 0.315 -20.911 741 HG2 GLN 95 HG2 GLN 95 -23.202 1.255 -23.039 742 HG3 GLN 95 HG3 GLN 95 -24.534 1.029 -21.906 743 HE21 GLN 95 HE21 GLN 95 -25.697 2.759 -21.247 744 HE22 GLN 95 HE22 GLN 95 -25.439 4.371 -21.809 745 H VAL 96 H VAL 96 -25.310 1.516 -18.392 746 HA VAL 96 HA VAL 96 -24.433 -0.544 -16.617 747 HB VAL 96 HB VAL 96 -27.263 0.304 -17.245 748 HG11 VAL 96 HG11 VAL 96 -27.635 -0.552 -14.890 749 HG12 VAL 96 HG12 VAL 96 -27.330 -1.775 -16.125 750 HG13 VAL 96 HG13 VAL 96 -26.044 -1.302 -15.013 751 HG21 VAL 96 HG21 VAL 96 -25.791 2.165 -16.496 752 HG22 VAL 96 HG22 VAL 96 -27.112 1.813 -15.382 753 HG23 VAL 96 HG23 VAL 96 -25.477 1.264 -15.013 754 H GLU 97 H GLU 97 -25.639 -0.502 -19.815 755 HA GLU 97 HA GLU 97 -26.828 -3.100 -19.825 756 HB2 GLU 97 HB2 GLU 97 -27.457 -1.413 -21.478 757 HB3 GLU 97 HB3 GLU 97 -25.815 -1.392 -22.105 758 HG2 GLU 97 HG2 GLU 97 -26.023 -3.490 -23.078 759 HG3 GLU 97 HG3 GLU 97 -27.409 -3.922 -22.078 760 H LEU 98 H LEU 98 -23.659 -1.807 -20.720 761 HA LEU 98 HA LEU 98 -22.658 -4.348 -21.605 762 HB2 LEU 98 HB2 LEU 98 -21.614 -1.600 -21.317 763 HB3 LEU 98 HB3 LEU 98 -20.427 -2.899 -21.220 764 HG LEU 98 HG LEU 98 -22.153 -3.271 -23.498 765 HD11 LEU 98 HD11 LEU 98 -21.090 -0.548 -23.019 766 HD12 LEU 98 HD12 LEU 98 -22.517 -1.070 -23.914 767 HD13 LEU 98 HD13 LEU 98 -20.917 -1.216 -24.642 768 HD21 LEU 98 HD21 LEU 98 -19.963 -3.260 -24.664 769 HD22 LEU 98 HD22 LEU 98 -20.016 -4.350 -23.278 770 HD23 LEU 98 HD23 LEU 98 -19.197 -2.793 -23.145 771 H ILE 99 H ILE 99 -22.140 -2.300 -18.746 772 HA ILE 99 HA ILE 99 -20.285 -3.852 -17.406 773 HB ILE 99 HB ILE 99 -22.542 -2.247 -16.200 774 HG12 ILE 99 HG12 ILE 99 -19.676 -1.378 -16.431 775 HG13 ILE 99 HG13 ILE 99 -20.781 -1.162 -17.784 776 HG21 ILE 99 HG21 ILE 99 -19.965 -3.158 -14.928 777 HG22 ILE 99 HG22 ILE 99 -21.236 -2.202 -14.167 778 HG23 ILE 99 HG23 ILE 99 -21.549 -3.874 -14.633 779 HD11 ILE 99 HD11 ILE 99 -22.141 -0.165 -15.568 780 HD12 ILE 99 HD12 ILE 99 -20.480 0.404 -15.397 781 HD13 ILE 99 HD13 ILE 99 -21.386 0.756 -16.869 782 H PHE 100 H PHE 100 -23.750 -4.287 -17.700 783 HA PHE 100 HA PHE 100 -23.986 -6.276 -15.675 784 HB2 PHE 100 HB2 PHE 100 -25.823 -4.801 -16.815 785 HB3 PHE 100 HB3 PHE 100 -25.869 -6.100 -18.001 786 HD1 PHE 100 HD2 PHE 100 -26.509 -8.386 -17.301 787 HD2 PHE 100 HD1 PHE 100 -26.779 -5.055 -14.665 788 HE1 PHE 100 HE2 PHE 100 -28.007 -9.673 -15.834 789 HE2 PHE 100 HE1 PHE 100 -28.276 -6.338 -13.193 790 HZ PHE 100 HZ PHE 100 -28.894 -8.649 -13.777 791 H LEU 101 H LEU 101 -23.333 -6.329 -19.122 792 HA LEU 101 HA LEU 101 -23.626 -9.150 -19.430 793 HB2 LEU 101 HB2 LEU 101 -22.790 -6.875 -21.075 794 HB3 LEU 101 HB3 LEU 101 -21.974 -8.387 -21.466 795 HG LEU 101 HG LEU 101 -23.990 -7.907 -22.850 796 HD11 LEU 101 HD11 LEU 101 -23.042 -10.244 -22.099 797 HD12 LEU 101 HD12 LEU 101 -24.537 -10.118 -23.025 798 HD13 LEU 101 HD13 LEU 101 -24.599 -10.358 -21.279 799 HD21 LEU 101 HD21 LEU 101 -25.233 -6.935 -20.820 800 HD22 LEU 101 HD22 LEU 101 -25.622 -8.612 -20.435 801 HD23 LEU 101 HD23 LEU 101 -26.147 -7.914 -21.968 802 H LEU 102 H LEU 102 -21.311 -7.289 -17.900 803 HA LEU 102 HA LEU 102 -19.087 -9.083 -18.476 804 HB2 LEU 102 HB2 LEU 102 -19.370 -6.507 -16.973 805 HB3 LEU 102 HB3 LEU 102 -17.934 -7.511 -16.784 806 HG LEU 102 HG LEU 102 -18.900 -6.256 -19.354 807 HD11 LEU 102 HD11 LEU 102 -16.454 -5.241 -18.919 808 HD12 LEU 102 HD12 LEU 102 -16.998 -5.437 -17.253 809 HD13 LEU 102 HD13 LEU 102 -17.942 -4.461 -18.379 810 HD21 LEU 102 HD21 LEU 102 -16.767 -8.234 -18.722 811 HD22 LEU 102 HD22 LEU 102 -16.454 -7.018 -19.961 812 HD23 LEU 102 HD23 LEU 102 -17.822 -8.120 -20.131 813 H GLU 103 H GLU 103 -21.321 -8.283 -15.896 814 HA GLU 103 HA GLU 103 -20.170 -9.422 -13.694 815 HB2 GLU 103 HB2 GLU 103 -22.943 -9.018 -14.612 816 HB3 GLU 103 HB3 GLU 103 -22.741 -10.246 -13.370 817 HG2 GLU 103 HG2 GLU 103 -21.235 -8.202 -12.382 818 HG3 GLU 103 HG3 GLU 103 -22.541 -7.338 -13.193 819 HA PRO 104 HA PRO 104 -21.843 -13.784 -14.935 820 HB2 PRO 104 HB2 PRO 104 -22.783 -14.078 -17.464 821 HB3 PRO 104 HB3 PRO 104 -23.810 -13.599 -16.108 822 HG2 PRO 104 HG2 PRO 104 -22.543 -11.896 -18.219 823 HG3 PRO 104 HG3 PRO 104 -24.183 -11.812 -17.549 824 HD2 PRO 104 HD2 PRO 104 -22.204 -10.137 -16.769 825 HD3 PRO 104 HD3 PRO 104 -23.493 -10.669 -15.670 826 H PHE 105 H PHE 105 -19.802 -11.760 -16.669 827 HA PHE 105 HA PHE 105 -18.594 -13.784 -18.335 828 HB2 PHE 105 HB2 PHE 105 -18.711 -11.070 -18.508 829 HB3 PHE 105 HB3 PHE 105 -17.098 -11.291 -17.839 830 HD1 PHE 105 HD2 PHE 105 -19.250 -12.753 -20.516 831 HD2 PHE 105 HD1 PHE 105 -15.368 -11.475 -19.326 832 HE1 PHE 105 HE2 PHE 105 -18.394 -13.272 -22.764 833 HE2 PHE 105 HE1 PHE 105 -14.506 -11.990 -21.572 834 HZ PHE 105 HZ PHE 105 -16.019 -12.891 -23.294 835 H ILE 106 H ILE 106 -18.200 -12.566 -15.142 836 HA ILE 106 HA ILE 106 -15.481 -13.191 -14.723 837 HB ILE 106 HB ILE 106 -17.764 -13.053 -12.752 838 HG12 ILE 106 HG12 ILE 106 -15.634 -11.006 -12.805 839 HG13 ILE 106 HG13 ILE 106 -16.694 -11.027 -14.210 840 HG21 ILE 106 HG21 ILE 106 -16.274 -14.209 -11.484 841 HG22 ILE 106 HG22 ILE 106 -14.883 -13.651 -12.411 842 HG23 ILE 106 HG23 ILE 106 -15.637 -12.585 -11.226 843 HD11 ILE 106 HD11 ILE 106 -18.391 -11.208 -12.008 844 HD12 ILE 106 HD12 ILE 106 -17.174 -10.006 -11.574 845 HD13 ILE 106 HD13 ILE 106 -18.123 -9.809 -13.048 846 H ALA 107 H ALA 107 -18.362 -15.129 -14.774 847 HA ALA 107 HA ALA 107 -17.537 -17.339 -13.282 848 HB1 ALA 107 HB1 ALA 107 -19.369 -18.433 -14.122 849 HB2 ALA 107 HB2 ALA 107 -19.825 -16.755 -14.423 850 HB3 ALA 107 HB3 ALA 107 -19.180 -17.742 -15.734 851 H SER 108 H SER 108 -17.054 -16.582 -16.710 852 HA SER 108 HA SER 108 -15.903 -18.982 -17.521 853 HB2 SER 108 HB2 SER 108 -14.712 -16.563 -18.714 854 HB3 SER 108 HB3 SER 108 -15.538 -17.915 -19.488 855 HG SER 108 HG SER 108 -16.533 -15.498 -18.613 856 H LEU 109 H LEU 109 -14.177 -15.995 -16.602 857 HA LEU 109 HA LEU 109 -11.794 -17.615 -16.055 858 HB2 LEU 109 HB2 LEU 109 -10.636 -15.395 -15.989 859 HB3 LEU 109 HB3 LEU 109 -11.323 -15.846 -17.549 860 HG LEU 109 HG LEU 109 -13.251 -14.300 -16.133 861 HD11 LEU 109 HD11 LEU 109 -11.788 -13.148 -14.809 862 HD12 LEU 109 HD12 LEU 109 -11.725 -12.163 -16.271 863 HD13 LEU 109 HD13 LEU 109 -10.445 -13.330 -15.939 864 HD21 LEU 109 HD21 LEU 109 -11.654 -14.092 -18.645 865 HD22 LEU 109 HD22 LEU 109 -12.606 -12.710 -18.103 866 HD23 LEU 109 HD23 LEU 109 -13.397 -14.253 -18.429 867 H LYS 110 H LYS 110 -12.083 -18.404 -14.022 868 HA LYS 110 HA LYS 110 -12.284 -18.455 -11.752 869 HB2 LYS 110 HB2 LYS 110 -10.260 -16.768 -12.367 870 HB3 LYS 110 HB3 LYS 110 -11.289 -15.687 -11.437 871 HG2 LYS 110 HG2 LYS 110 -9.836 -16.584 -9.861 872 HG3 LYS 110 HG3 LYS 110 -11.312 -17.532 -9.665 873 HD2 LYS 110 HD2 LYS 110 -9.433 -18.626 -11.629 874 HD3 LYS 110 HD3 LYS 110 -8.805 -18.570 -9.980 875 HE2 LYS 110 HE2 LYS 110 -11.141 -19.594 -9.385 876 HE3 LYS 110 HE3 LYS 110 -11.136 -20.077 -11.080 877 HZ1 LYS 110 HZ1 LYS 110 -9.719 -21.707 -10.641 878 HZ2 LYS 110 HZ2 LYS 110 -9.936 -21.396 -8.993 879 HZ3 LYS 110 HZ3 LYS 110 -8.654 -20.675 -9.828 Start of MODEL 11 1 H1 MET 1 H MET 1 4.215 1.218 -2.803 2 HA MET 1 HA MET 1 2.027 0.258 -1.650 3 HB2 MET 1 HB2 MET 1 2.386 1.960 -4.052 4 HB3 MET 1 HB3 MET 1 0.766 1.340 -3.763 5 HG2 MET 1 HG2 MET 1 0.427 2.677 -1.999 6 HG3 MET 1 HG3 MET 1 2.078 2.496 -1.412 7 HE1 MET 1 HE1 MET 1 2.809 4.367 -0.735 8 HE2 MET 1 HE2 MET 1 3.352 5.736 -1.705 9 HE3 MET 1 HE3 MET 1 1.730 5.734 -1.012 10 H SER 2 H SER 2 1.081 -1.665 -1.687 11 HA SER 2 HA SER 2 0.570 -2.929 -4.294 12 HB2 SER 2 HB2 SER 2 0.884 -5.151 -2.993 13 HB3 SER 2 HB3 SER 2 2.324 -4.265 -3.497 14 HG SER 2 HG SER 2 1.683 -5.004 -1.064 15 H LEU 3 H LEU 3 -1.401 -3.891 -4.538 16 HA LEU 3 HA LEU 3 -3.254 -3.658 -2.258 17 HB2 LEU 3 HB2 LEU 3 -3.634 -3.220 -5.196 18 HB3 LEU 3 HB3 LEU 3 -5.004 -3.622 -4.163 19 HG LEU 3 HG LEU 3 -3.266 -1.314 -3.420 20 HD11 LEU 3 HD11 LEU 3 -5.288 -0.162 -4.866 21 HD12 LEU 3 HD12 LEU 3 -4.820 -1.529 -5.877 22 HD13 LEU 3 HD13 LEU 3 -3.614 -0.336 -5.395 23 HD21 LEU 3 HD21 LEU 3 -4.915 -1.810 -1.829 24 HD22 LEU 3 HD22 LEU 3 -6.140 -2.111 -3.062 25 HD23 LEU 3 HD23 LEU 3 -5.579 -0.466 -2.758 26 H LYS 4 H LYS 4 -4.822 -5.288 -1.969 27 HA LYS 4 HA LYS 4 -3.915 -7.914 -2.435 28 HB2 LYS 4 HB2 LYS 4 -6.218 -6.634 -1.152 29 HB3 LYS 4 HB3 LYS 4 -6.592 -8.200 -1.859 30 HG2 LYS 4 HG2 LYS 4 -4.987 -9.297 -0.516 31 HG3 LYS 4 HG3 LYS 4 -4.267 -7.768 -0.006 32 HD2 LYS 4 HD2 LYS 4 -6.902 -7.496 0.744 33 HD3 LYS 4 HD3 LYS 4 -6.574 -9.202 1.059 34 HE2 LYS 4 HE2 LYS 4 -4.627 -7.122 1.960 35 HE3 LYS 4 HE3 LYS 4 -6.094 -7.407 2.895 36 HZ1 LYS 4 HZ1 LYS 4 -4.627 -9.789 2.151 37 HZ2 LYS 4 HZ2 LYS 4 -5.344 -9.375 3.625 38 HZ3 LYS 4 HZ3 LYS 4 -3.818 -8.765 3.227 39 H SER 5 H SER 5 -6.227 -5.869 -4.111 40 HA SER 5 HA SER 5 -7.441 -7.811 -5.722 41 HB2 SER 5 HB2 SER 5 -7.208 -5.400 -7.220 42 HB3 SER 5 HB3 SER 5 -8.611 -6.005 -6.338 43 HG SER 5 HG SER 5 -6.525 -4.360 -5.343 44 H ASP 6 H ASP 6 -4.285 -6.477 -5.809 45 HA ASP 6 HA ASP 6 -3.597 -6.661 -8.490 46 HB2 ASP 6 HB2 ASP 6 -2.237 -5.897 -6.357 47 HB3 ASP 6 HB3 ASP 6 -1.630 -7.549 -6.422 48 H GLU 7 H GLU 7 -3.707 -9.182 -6.019 49 HA GLU 7 HA GLU 7 -2.509 -11.241 -7.489 50 HB2 GLU 7 HB2 GLU 7 -3.913 -10.971 -5.008 51 HB3 GLU 7 HB3 GLU 7 -4.536 -12.375 -5.864 52 HG2 GLU 7 HG2 GLU 7 -1.759 -12.523 -6.113 53 HG3 GLU 7 HG3 GLU 7 -2.063 -12.046 -4.444 54 H VAL 8 H VAL 8 -5.854 -10.129 -7.350 55 HA VAL 8 HA VAL 8 -6.847 -12.232 -9.035 56 HB VAL 8 HB VAL 8 -8.165 -9.609 -8.322 57 HG11 VAL 8 HG11 VAL 8 -9.892 -10.258 -9.559 58 HG12 VAL 8 HG12 VAL 8 -8.903 -11.589 -10.162 59 HG13 VAL 8 HG13 VAL 8 -9.939 -11.826 -8.754 60 HG21 VAL 8 HG21 VAL 8 -9.422 -11.189 -6.706 61 HG22 VAL 8 HG22 VAL 8 -8.021 -12.241 -6.902 62 HG23 VAL 8 HG23 VAL 8 -7.817 -10.613 -6.257 63 H PHE 9 H PHE 9 -6.012 -8.818 -9.468 64 HA PHE 9 HA PHE 9 -6.835 -8.625 -12.161 65 HB2 PHE 9 HB2 PHE 9 -5.036 -7.022 -10.384 66 HB3 PHE 9 HB3 PHE 9 -5.051 -6.691 -12.113 67 HD1 PHE 9 HD2 PHE 9 -7.969 -7.766 -10.130 68 HD2 PHE 9 HD1 PHE 9 -5.991 -4.527 -12.058 69 HE1 PHE 9 HE2 PHE 9 -9.977 -6.373 -9.842 70 HE2 PHE 9 HE1 PHE 9 -7.995 -3.129 -11.772 71 HZ PHE 9 HZ PHE 9 -9.992 -4.051 -10.664 72 H ALA 10 H ALA 10 -3.803 -9.574 -10.648 73 HA ALA 10 HA ALA 10 -2.226 -9.616 -12.991 74 HB1 ALA 10 HB1 ALA 10 -1.858 -11.294 -10.514 75 HB2 ALA 10 HB2 ALA 10 -0.628 -10.870 -11.706 76 HB3 ALA 10 HB3 ALA 10 -1.328 -9.620 -10.677 77 H LYS 11 H LYS 11 -3.958 -12.209 -11.275 78 HA LYS 11 HA LYS 11 -3.284 -14.259 -13.093 79 HB2 LYS 11 HB2 LYS 11 -5.089 -15.534 -12.031 80 HB3 LYS 11 HB3 LYS 11 -4.083 -14.732 -10.832 81 HG2 LYS 11 HG2 LYS 11 -5.755 -13.001 -10.545 82 HG3 LYS 11 HG3 LYS 11 -6.754 -13.735 -11.802 83 HD2 LYS 11 HD2 LYS 11 -7.621 -14.390 -9.661 84 HD3 LYS 11 HD3 LYS 11 -6.872 -15.800 -10.416 85 HE2 LYS 11 HE2 LYS 11 -5.697 -16.058 -8.544 86 HE3 LYS 11 HE3 LYS 11 -4.819 -14.592 -8.979 87 HZ1 LYS 11 HZ1 LYS 11 -7.387 -14.308 -7.602 88 HZ2 LYS 11 HZ2 LYS 11 -6.006 -13.336 -7.518 89 HZ3 LYS 11 HZ3 LYS 11 -6.052 -14.811 -6.693 90 H ILE 12 H ILE 12 -5.949 -11.966 -12.963 91 HA ILE 12 HA ILE 12 -7.551 -13.138 -14.965 92 HB ILE 12 HB ILE 12 -7.346 -10.313 -13.945 93 HG12 ILE 12 HG12 ILE 12 -9.696 -12.179 -13.757 94 HG13 ILE 12 HG13 ILE 12 -8.360 -12.297 -12.618 95 HG21 ILE 12 HG21 ILE 12 -8.215 -9.696 -15.927 96 HG22 ILE 12 HG22 ILE 12 -8.729 -11.334 -16.329 97 HG23 ILE 12 HG23 ILE 12 -9.712 -10.341 -15.253 98 HD11 ILE 12 HD11 ILE 12 -10.201 -10.966 -11.736 99 HD12 ILE 12 HD12 ILE 12 -8.735 -10.003 -11.920 100 HD13 ILE 12 HD13 ILE 12 -10.045 -9.849 -13.091 101 H ALA 13 H ALA 13 -5.037 -10.640 -15.109 102 HA ALA 13 HA ALA 13 -5.263 -10.009 -17.823 103 HB1 ALA 13 HB1 ALA 13 -3.303 -8.826 -17.586 104 HB2 ALA 13 HB2 ALA 13 -3.853 -8.923 -15.913 105 HB3 ALA 13 HB3 ALA 13 -2.593 -10.013 -16.491 106 H LYS 14 H LYS 14 -3.191 -12.405 -16.207 107 HA LYS 14 HA LYS 14 -1.866 -13.344 -18.483 108 HB2 LYS 14 HB2 LYS 14 -2.576 -14.752 -15.906 109 HB3 LYS 14 HB3 LYS 14 -1.512 -15.434 -17.129 110 HG2 LYS 14 HG2 LYS 14 -0.675 -12.771 -16.431 111 HG3 LYS 14 HG3 LYS 14 -0.808 -13.788 -14.994 112 HD2 LYS 14 HD2 LYS 14 0.665 -15.427 -15.948 113 HD3 LYS 14 HD3 LYS 14 0.679 -14.579 -17.496 114 HE2 LYS 14 HE2 LYS 14 1.919 -12.778 -16.608 115 HE3 LYS 14 HE3 LYS 14 1.627 -13.295 -14.948 116 HZ1 LYS 14 HZ1 LYS 14 2.891 -15.385 -16.314 117 HZ2 LYS 14 HZ2 LYS 14 3.486 -14.467 -15.024 118 HZ3 LYS 14 HZ3 LYS 14 3.766 -13.970 -16.617 119 H ARG 15 H ARG 15 -4.910 -14.378 -17.000 120 HA ARG 15 HA ARG 15 -5.379 -16.580 -18.695 121 HB2 ARG 15 HB2 ARG 15 -7.378 -14.835 -17.243 122 HB3 ARG 15 HB3 ARG 15 -7.714 -16.417 -17.933 123 HG2 ARG 15 HG2 ARG 15 -5.458 -16.565 -16.161 124 HG3 ARG 15 HG3 ARG 15 -6.842 -15.834 -15.346 125 HD2 ARG 15 HD2 ARG 15 -8.232 -17.719 -15.927 126 HD3 ARG 15 HD3 ARG 15 -6.931 -18.425 -16.885 127 HE ARG 15 HE ARG 15 -5.869 -18.167 -14.387 128 HH11 ARG 15 HH11 ARG 15 -8.703 -19.699 -15.705 129 HH12 ARG 15 HH12 ARG 15 -8.745 -20.949 -14.506 130 HH21 ARG 15 HH21 ARG 15 -5.913 -19.807 -12.803 131 HH22 ARG 15 HH22 ARG 15 -7.157 -21.009 -12.855 132 H LEU 16 H LEU 16 -5.923 -13.157 -19.067 133 HA LEU 16 HA LEU 16 -7.694 -13.376 -21.303 134 HB2 LEU 16 HB2 LEU 16 -6.032 -11.068 -20.305 135 HB3 LEU 16 HB3 LEU 16 -7.243 -10.956 -21.581 136 HG LEU 16 HG LEU 16 -8.114 -12.000 -18.939 137 HD11 LEU 16 HD11 LEU 16 -8.491 -9.236 -18.812 138 HD12 LEU 16 HD12 LEU 16 -6.798 -9.462 -19.251 139 HD13 LEU 16 HD13 LEU 16 -7.440 -10.223 -17.795 140 HD21 LEU 16 HD21 LEU 16 -9.570 -11.781 -20.982 141 HD22 LEU 16 HD22 LEU 16 -9.410 -10.033 -20.813 142 HD23 LEU 16 HD23 LEU 16 -10.170 -10.978 -19.531 143 H GLU 17 H GLU 17 -4.404 -13.890 -20.932 144 HA GLU 17 HA GLU 17 -3.533 -12.913 -23.489 145 HB2 GLU 17 HB2 GLU 17 -2.187 -14.854 -21.601 146 HB3 GLU 17 HB3 GLU 17 -1.429 -14.061 -22.974 147 HG2 GLU 17 HG2 GLU 17 -1.963 -11.869 -21.853 148 HG3 GLU 17 HG3 GLU 17 -2.405 -12.806 -20.427 149 H SER 18 H SER 18 -5.189 -15.667 -22.409 150 HA SER 18 HA SER 18 -4.337 -17.290 -24.692 151 HB2 SER 18 HB2 SER 18 -5.415 -17.855 -22.036 152 HB3 SER 18 HB3 SER 18 -6.231 -18.765 -23.307 153 HG SER 18 HG SER 18 -3.417 -18.626 -23.200 154 H ILE 19 H ILE 19 -6.532 -14.946 -24.134 155 HA ILE 19 HA ILE 19 -8.971 -15.925 -25.070 156 HB ILE 19 HB ILE 19 -7.849 -13.159 -25.531 157 HG12 ILE 19 HG12 ILE 19 -7.867 -14.010 -23.130 158 HG13 ILE 19 HG13 ILE 19 -8.751 -12.518 -23.432 159 HG21 ILE 19 HG21 ILE 19 -10.372 -12.630 -25.368 160 HG22 ILE 19 HG22 ILE 19 -9.737 -13.299 -26.871 161 HG23 ILE 19 HG23 ILE 19 -10.590 -14.342 -25.733 162 HD11 ILE 19 HD11 ILE 19 -9.731 -14.584 -22.033 163 HD12 ILE 19 HD12 ILE 19 -10.735 -13.442 -22.927 164 HD13 ILE 19 HD13 ILE 19 -10.318 -14.999 -23.643 165 H ASP 20 H ASP 20 -9.871 -16.178 -27.070 166 HA ASP 20 HA ASP 20 -8.013 -16.021 -29.348 167 HB2 ASP 20 HB2 ASP 20 -9.772 -18.096 -28.431 168 HB3 ASP 20 HB3 ASP 20 -10.270 -17.582 -30.040 169 HA PRO 21 HA PRO 21 -10.514 -13.066 -31.409 170 HB2 PRO 21 HB2 PRO 21 -10.316 -13.866 -33.996 171 HB3 PRO 21 HB3 PRO 21 -8.979 -13.114 -33.118 172 HG2 PRO 21 HG2 PRO 21 -9.489 -16.011 -33.672 173 HG3 PRO 21 HG3 PRO 21 -7.968 -15.105 -33.768 174 HD2 PRO 21 HD2 PRO 21 -8.595 -16.680 -31.656 175 HD3 PRO 21 HD3 PRO 21 -7.618 -15.206 -31.492 176 H ALA 22 H ALA 22 -11.191 -16.455 -32.123 177 HA ALA 22 HA ALA 22 -13.741 -15.984 -33.312 178 HB1 ALA 22 HB1 ALA 22 -14.035 -18.471 -32.903 179 HB2 ALA 22 HB2 ALA 22 -12.672 -17.994 -33.917 180 HB3 ALA 22 HB3 ALA 22 -12.402 -18.450 -32.235 181 H ASN 23 H ASN 23 -12.773 -17.287 -30.134 182 HA ASN 23 HA ASN 23 -15.493 -16.937 -29.153 183 HB2 ASN 23 HB2 ASN 23 -13.207 -18.585 -28.438 184 HB3 ASN 23 HB3 ASN 23 -13.907 -17.797 -27.027 185 HD21 ASN 23 HD21 ASN 23 -14.196 -20.305 -29.279 186 HD22 ASN 23 HD22 ASN 23 -15.731 -20.912 -28.770 187 H ARG 24 H ARG 24 -16.112 -15.117 -28.211 188 HA ARG 24 HA ARG 24 -14.568 -13.795 -26.227 189 HB2 ARG 24 HB2 ARG 24 -14.254 -12.917 -28.975 190 HB3 ARG 24 HB3 ARG 24 -14.894 -11.632 -27.960 191 HG2 ARG 24 HG2 ARG 24 -12.999 -11.505 -26.683 192 HG3 ARG 24 HG3 ARG 24 -12.551 -13.184 -26.988 193 HD2 ARG 24 HD2 ARG 24 -11.061 -12.332 -28.425 194 HD3 ARG 24 HD3 ARG 24 -12.444 -12.096 -29.492 195 HE ARG 24 HE ARG 24 -12.048 -9.901 -27.702 196 HH11 ARG 24 HH11 ARG 24 -11.008 -11.321 -30.706 197 HH12 ARG 24 HH12 ARG 24 -10.475 -9.818 -31.383 198 HH21 ARG 24 HH21 ARG 24 -11.349 -7.916 -28.582 199 HH22 ARG 24 HH22 ARG 24 -10.668 -7.882 -30.173 200 H GLN 25 H GLN 25 -17.224 -13.628 -28.537 201 HA GLN 25 HA GLN 25 -19.423 -13.092 -28.254 202 HB2 GLN 25 HB2 GLN 25 -18.921 -12.585 -25.334 203 HB3 GLN 25 HB3 GLN 25 -20.402 -13.124 -26.115 204 HG2 GLN 25 HG2 GLN 25 -18.789 -15.165 -26.757 205 HG3 GLN 25 HG3 GLN 25 -18.047 -14.663 -25.239 206 HE21 GLN 25 HE21 GLN 25 -19.441 -17.118 -25.820 207 HE22 GLN 25 HE22 GLN 25 -20.782 -17.197 -24.734 208 H VAL 26 H VAL 26 -17.827 -11.069 -25.790 209 HA VAL 26 HA VAL 26 -18.065 -8.704 -27.415 210 HB VAL 26 HB VAL 26 -20.369 -8.971 -26.487 211 HG11 VAL 26 HG11 VAL 26 -20.820 -9.174 -24.290 212 HG12 VAL 26 HG12 VAL 26 -19.158 -9.759 -24.201 213 HG13 VAL 26 HG13 VAL 26 -19.525 -8.077 -23.815 214 HG21 VAL 26 HG21 VAL 26 -20.010 -6.568 -25.181 215 HG22 VAL 26 HG22 VAL 26 -18.631 -6.648 -26.278 216 HG23 VAL 26 HG23 VAL 26 -20.271 -6.781 -26.913 217 H GLU 27 H GLU 27 -16.591 -7.207 -26.838 218 HA GLU 27 HA GLU 27 -15.366 -7.405 -24.175 219 HB2 GLU 27 HB2 GLU 27 -13.990 -7.444 -26.843 220 HB3 GLU 27 HB3 GLU 27 -13.164 -6.824 -25.421 221 HG2 GLU 27 HG2 GLU 27 -14.412 -9.552 -25.501 222 HG3 GLU 27 HG3 GLU 27 -12.753 -9.245 -26.013 223 H HIS 28 H HIS 28 -15.479 -5.520 -23.168 224 HA HIS 28 HA HIS 28 -15.214 -3.049 -24.735 225 HB2 HIS 28 HB2 HIS 28 -16.925 -2.142 -22.933 226 HB3 HIS 28 HB3 HIS 28 -17.489 -2.923 -24.408 227 HD1 HIS 28 HD1 HIS 28 -17.514 -3.234 -20.739 228 HD2 HIS 28 HD2 HIS 28 -18.430 -5.608 -24.023 229 HE1 HIS 28 HE1 HIS 28 -18.857 -5.154 -19.826 230 H VAL 29 H VAL 29 -14.167 -1.359 -23.718 231 HA VAL 29 HA VAL 29 -12.256 -2.007 -21.766 232 HB VAL 29 HB VAL 29 -13.235 0.743 -22.545 233 HG11 VAL 29 HG11 VAL 29 -11.410 -0.087 -20.550 234 HG12 VAL 29 HG12 VAL 29 -10.475 0.649 -21.853 235 HG13 VAL 29 HG13 VAL 29 -11.778 1.554 -21.081 236 HG21 VAL 29 HG21 VAL 29 -12.411 -0.774 -24.405 237 HG22 VAL 29 HG22 VAL 29 -11.586 0.776 -24.232 238 HG23 VAL 29 HG23 VAL 29 -10.828 -0.698 -23.629 239 H TYR 30 H TYR 30 -12.295 -2.002 -19.608 240 HA TYR 30 HA TYR 30 -14.574 -0.713 -18.258 241 HB2 TYR 30 HB2 TYR 30 -14.104 -3.442 -18.381 242 HB3 TYR 30 HB3 TYR 30 -13.451 -2.984 -16.813 243 HD1 TYR 30 HD2 TYR 30 -16.486 -2.232 -18.871 244 HD2 TYR 30 HD1 TYR 30 -14.898 -3.161 -15.035 245 HE1 TYR 30 HE2 TYR 30 -18.760 -2.222 -17.934 246 HE2 TYR 30 HE1 TYR 30 -17.168 -3.156 -14.087 247 HH TYR 30 HH TYR 30 -19.559 -1.824 -15.046 248 H LYS 31 H LYS 31 -14.178 0.230 -16.252 249 HA LYS 31 HA LYS 31 -11.327 0.638 -15.630 250 HB2 LYS 31 HB2 LYS 31 -12.158 2.740 -16.229 251 HB3 LYS 31 HB3 LYS 31 -13.710 2.454 -15.452 252 HG2 LYS 31 HG2 LYS 31 -12.992 3.185 -13.458 253 HG3 LYS 31 HG3 LYS 31 -11.402 2.440 -13.639 254 HD2 LYS 31 HD2 LYS 31 -10.928 4.718 -13.668 255 HD3 LYS 31 HD3 LYS 31 -10.981 4.298 -15.382 256 HE2 LYS 31 HE2 LYS 31 -13.303 5.097 -15.486 257 HE3 LYS 31 HE3 LYS 31 -13.215 5.547 -13.783 258 HZ1 LYS 31 HZ1 LYS 31 -11.789 7.280 -14.224 259 HZ2 LYS 31 HZ2 LYS 31 -12.788 7.321 -15.587 260 HZ3 LYS 31 HZ3 LYS 31 -11.249 6.628 -15.688 261 H PHE 32 H PHE 32 -10.587 0.143 -13.651 262 HA PHE 32 HA PHE 32 -12.563 -0.716 -11.642 263 HB2 PHE 32 HB2 PHE 32 -9.761 -1.718 -12.166 264 HB3 PHE 32 HB3 PHE 32 -10.709 -2.166 -10.752 265 HD1 PHE 32 HD1 PHE 32 -13.230 -2.919 -11.479 266 HD2 PHE 32 HD2 PHE 32 -9.699 -3.282 -13.827 267 HE1 PHE 32 HE1 PHE 32 -14.271 -4.747 -12.755 268 HE2 PHE 32 HE2 PHE 32 -10.734 -5.110 -15.107 269 HZ PHE 32 HZ PHE 32 -13.023 -5.844 -14.573 270 H ARG 33 H ARG 33 -12.635 0.386 -9.800 271 HA ARG 33 HA ARG 33 -10.361 2.139 -9.138 272 HB2 ARG 33 HB2 ARG 33 -13.234 2.605 -9.241 273 HB3 ARG 33 HB3 ARG 33 -12.543 3.061 -7.690 274 HG2 ARG 33 HG2 ARG 33 -10.750 4.218 -9.278 275 HG3 ARG 33 HG3 ARG 33 -12.134 4.236 -10.373 276 HD2 ARG 33 HD2 ARG 33 -12.965 5.051 -7.756 277 HD3 ARG 33 HD3 ARG 33 -11.568 6.005 -8.255 278 HE ARG 33 HE ARG 33 -14.216 6.181 -9.290 279 HH11 ARG 33 HH11 ARG 33 -10.856 6.498 -10.145 280 HH12 ARG 33 HH12 ARG 33 -11.156 7.608 -11.441 281 HH21 ARG 33 HH21 ARG 33 -14.623 7.642 -10.993 282 HH22 ARG 33 HH22 ARG 33 -13.299 8.259 -11.922 283 H ILE 34 H ILE 34 -9.241 1.567 -7.405 284 HA ILE 34 HA ILE 34 -10.564 -0.081 -5.353 285 HB ILE 34 HB ILE 34 -7.668 0.036 -6.185 286 HG12 ILE 34 HG12 ILE 34 -9.426 -2.396 -5.984 287 HG13 ILE 34 HG13 ILE 34 -9.450 -1.380 -7.421 288 HG21 ILE 34 HG21 ILE 34 -8.917 -0.886 -3.668 289 HG22 ILE 34 HG22 ILE 34 -7.676 -1.923 -4.371 290 HG23 ILE 34 HG23 ILE 34 -7.300 -0.248 -3.967 291 HD11 ILE 34 HD11 ILE 34 -6.917 -2.560 -6.332 292 HD12 ILE 34 HD12 ILE 34 -7.951 -3.411 -7.481 293 HD13 ILE 34 HD13 ILE 34 -7.212 -1.873 -7.929 294 H THR 35 H THR 35 -11.015 0.965 -3.543 295 HA THR 35 HA THR 35 -9.528 3.385 -2.855 296 HB THR 35 HB THR 35 -11.290 3.800 -1.206 297 HG1 THR 35 HG1 THR 35 -12.156 1.974 -0.507 298 HG21 THR 35 HG21 THR 35 -12.398 4.786 -2.867 299 HG22 THR 35 HG22 THR 35 -13.163 3.250 -3.272 300 HG23 THR 35 HG23 THR 35 -11.634 3.700 -4.026 301 H GLN 36 H GLN 36 -8.405 3.656 -0.955 302 HA GLN 36 HA GLN 36 -7.628 1.189 0.396 303 HB2 GLN 36 HB2 GLN 36 -6.282 3.592 -0.339 304 HB3 GLN 36 HB3 GLN 36 -6.215 3.444 1.412 305 HG2 GLN 36 HG2 GLN 36 -5.632 0.901 0.339 306 HG3 GLN 36 HG3 GLN 36 -4.687 2.083 -0.565 307 HE21 GLN 36 HE21 GLN 36 -2.743 1.425 0.303 308 HE22 GLN 36 HE22 GLN 36 -2.303 1.728 1.946 309 H GLY 37 H GLY 37 -8.950 0.645 2.022 310 HA2 GLY 37 HA2 GLY 37 -9.789 0.775 4.179 311 HA3 GLY 37 HA3 GLY 37 -9.168 2.415 4.287 312 H GLY 38 H GLY 38 -10.438 3.692 2.239 313 HA2 GLY 38 HA2 GLY 38 -13.192 3.168 1.991 314 HA3 GLY 38 HA3 GLY 38 -12.950 4.270 3.338 315 H LYS 39 H LYS 39 -10.513 4.729 1.118 316 HA LYS 39 HA LYS 39 -12.026 6.733 -0.403 317 HB2 LYS 39 HB2 LYS 39 -10.640 7.595 1.665 318 HB3 LYS 39 HB3 LYS 39 -9.278 7.406 0.569 319 HG2 LYS 39 HG2 LYS 39 -9.849 9.602 0.231 320 HG3 LYS 39 HG3 LYS 39 -10.743 8.803 -1.064 321 HD2 LYS 39 HD2 LYS 39 -12.509 9.936 -0.265 322 HD3 LYS 39 HD3 LYS 39 -12.532 8.700 0.995 323 HE2 LYS 39 HE2 LYS 39 -10.827 10.279 2.178 324 HE3 LYS 39 HE3 LYS 39 -11.494 11.502 1.099 325 HZ1 LYS 39 HZ1 LYS 39 -12.539 11.159 3.413 326 HZ2 LYS 39 HZ2 LYS 39 -13.294 9.819 2.710 327 HZ3 LYS 39 HZ3 LYS 39 -13.560 11.366 2.080 328 H VAL 40 H VAL 40 -11.395 7.002 -2.498 329 HA VAL 40 HA VAL 40 -10.123 4.977 -3.862 330 HB VAL 40 HB VAL 40 -11.530 6.837 -4.846 331 HG11 VAL 40 HG11 VAL 40 -10.730 8.929 -5.189 332 HG12 VAL 40 HG12 VAL 40 -9.751 8.527 -3.777 333 HG13 VAL 40 HG13 VAL 40 -9.068 8.379 -5.397 334 HG21 VAL 40 HG21 VAL 40 -9.025 5.768 -6.066 335 HG22 VAL 40 HG22 VAL 40 -10.707 5.390 -6.439 336 HG23 VAL 40 HG23 VAL 40 -10.008 6.920 -6.970 337 H VAL 41 H VAL 41 -8.071 4.491 -4.446 338 HA VAL 41 HA VAL 41 -5.939 6.291 -3.490 339 HB VAL 41 HB VAL 41 -6.265 4.017 -2.301 340 HG11 VAL 41 HG11 VAL 41 -6.309 2.934 -4.706 341 HG12 VAL 41 HG12 VAL 41 -4.561 2.898 -4.467 342 HG13 VAL 41 HG13 VAL 41 -5.626 2.075 -3.326 343 HG21 VAL 41 HG21 VAL 41 -3.490 4.420 -3.348 344 HG22 VAL 41 HG22 VAL 41 -4.243 5.636 -2.317 345 HG23 VAL 41 HG23 VAL 41 -4.018 3.992 -1.720 346 H LYS 42 H LYS 42 -7.140 4.279 -6.056 347 HA LYS 42 HA LYS 42 -5.597 5.594 -8.023 348 HB2 LYS 42 HB2 LYS 42 -4.020 3.835 -6.787 349 HB3 LYS 42 HB3 LYS 42 -4.798 2.727 -7.911 350 HG2 LYS 42 HG2 LYS 42 -4.142 4.481 -9.702 351 HG3 LYS 42 HG3 LYS 42 -3.001 5.043 -8.479 352 HD2 LYS 42 HD2 LYS 42 -3.172 2.159 -9.314 353 HD3 LYS 42 HD3 LYS 42 -2.147 3.324 -10.154 354 HE2 LYS 42 HE2 LYS 42 -1.776 3.494 -7.300 355 HE3 LYS 42 HE3 LYS 42 -1.519 1.845 -7.867 356 HZ1 LYS 42 HZ1 LYS 42 0.472 3.383 -7.871 357 HZ2 LYS 42 HZ2 LYS 42 -0.248 4.168 -9.186 358 HZ3 LYS 42 HZ3 LYS 42 0.174 2.534 -9.304 359 H ASN 43 H ASN 43 -6.059 4.833 -10.184 360 HA ASN 43 HA ASN 43 -8.391 3.040 -10.315 361 HB2 ASN 43 HB2 ASN 43 -9.235 4.462 -12.187 362 HB3 ASN 43 HB3 ASN 43 -9.193 5.294 -10.635 363 HD21 ASN 43 HD21 ASN 43 -8.058 7.123 -10.450 364 HD22 ASN 43 HD22 ASN 43 -7.065 7.799 -11.692 365 H TRP 44 H TRP 44 -8.341 1.480 -11.833 366 HA TRP 44 HA TRP 44 -6.000 1.429 -13.615 367 HB2 TRP 44 HB2 TRP 44 -7.602 -0.752 -12.304 368 HB3 TRP 44 HB3 TRP 44 -6.615 -1.086 -13.724 369 HD1 TRP 44 HD1 TRP 44 -6.295 -0.048 -10.041 370 HE1 TRP 44 HE1 TRP 44 -3.886 -0.522 -9.268 371 HE3 TRP 44 HE3 TRP 44 -4.244 -1.363 -14.536 372 HZ2 TRP 44 HZ2 TRP 44 -1.440 -1.343 -10.412 373 HZ3 TRP 44 HZ3 TRP 44 -1.863 -1.979 -14.610 374 HH2 TRP 44 HH2 TRP 44 -0.492 -1.968 -12.590 375 H VAL 45 H VAL 45 -6.274 0.547 -15.758 376 HA VAL 45 HA VAL 45 -9.028 0.712 -16.783 377 HB VAL 45 HB VAL 45 -6.570 1.978 -17.994 378 HG11 VAL 45 HG11 VAL 45 -9.178 1.212 -19.202 379 HG12 VAL 45 HG12 VAL 45 -8.432 2.732 -19.701 380 HG13 VAL 45 HG13 VAL 45 -7.562 1.211 -19.907 381 HG21 VAL 45 HG21 VAL 45 -7.509 4.018 -17.530 382 HG22 VAL 45 HG22 VAL 45 -9.155 3.384 -17.525 383 HG23 VAL 45 HG23 VAL 45 -8.089 3.082 -16.153 384 H MET 46 H MET 46 -9.613 -0.928 -18.063 385 HA MET 46 HA MET 46 -7.566 -2.887 -18.800 386 HB2 MET 46 HB2 MET 46 -9.338 -3.906 -17.615 387 HB3 MET 46 HB3 MET 46 -10.561 -3.033 -18.528 388 HG2 MET 46 HG2 MET 46 -10.263 -4.371 -20.425 389 HG3 MET 46 HG3 MET 46 -8.729 -5.009 -19.837 390 HE1 MET 46 HE1 MET 46 -12.762 -5.224 -18.413 391 HE2 MET 46 HE2 MET 46 -12.295 -5.051 -20.104 392 HE3 MET 46 HE3 MET 46 -12.811 -6.622 -19.488 393 H ASP 47 H ASP 47 -6.898 -3.111 -20.830 394 HA ASP 47 HA ASP 47 -7.711 -1.395 -22.895 395 HB2 ASP 47 HB2 ASP 47 -5.575 -3.015 -22.516 396 HB3 ASP 47 HB3 ASP 47 -6.481 -3.965 -23.691 397 H LEU 48 H LEU 48 -7.940 -3.028 -25.152 398 HA LEU 48 HA LEU 48 -10.195 -4.796 -24.805 399 HB2 LEU 48 HB2 LEU 48 -10.963 -2.295 -24.931 400 HB3 LEU 48 HB3 LEU 48 -10.658 -2.500 -26.655 401 HG LEU 48 HG LEU 48 -12.656 -3.995 -24.963 402 HD11 LEU 48 HD11 LEU 48 -13.682 -2.015 -25.500 403 HD12 LEU 48 HD12 LEU 48 -14.117 -3.003 -26.894 404 HD13 LEU 48 HD13 LEU 48 -12.798 -1.839 -27.016 405 HD21 LEU 48 HD21 LEU 48 -11.911 -5.646 -26.418 406 HD22 LEU 48 HD22 LEU 48 -11.632 -4.503 -27.732 407 HD23 LEU 48 HD23 LEU 48 -13.280 -4.941 -27.279 408 H LYS 49 H LYS 49 -8.337 -2.894 -27.167 409 HA LYS 49 HA LYS 49 -8.698 -4.792 -29.272 410 HB2 LYS 49 HB2 LYS 49 -8.312 -2.572 -29.968 411 HB3 LYS 49 HB3 LYS 49 -6.924 -2.390 -28.905 412 HG2 LYS 49 HG2 LYS 49 -5.534 -3.624 -30.302 413 HG3 LYS 49 HG3 LYS 49 -6.891 -4.367 -31.152 414 HD2 LYS 49 HD2 LYS 49 -7.416 -2.302 -32.248 415 HD3 LYS 49 HD3 LYS 49 -6.239 -1.425 -31.268 416 HE2 LYS 49 HE2 LYS 49 -4.672 -3.348 -32.362 417 HE3 LYS 49 HE3 LYS 49 -5.849 -3.106 -33.652 418 HZ1 LYS 49 HZ1 LYS 49 -3.707 -1.413 -32.813 419 HZ2 LYS 49 HZ2 LYS 49 -5.178 -0.580 -32.862 420 HZ3 LYS 49 HZ3 LYS 49 -4.612 -1.375 -34.243 421 H ASN 50 H ASN 50 -6.383 -4.347 -26.718 422 HA ASN 50 HA ASN 50 -4.653 -6.424 -27.864 423 HB2 ASN 50 HB2 ASN 50 -4.217 -4.243 -25.857 424 HB3 ASN 50 HB3 ASN 50 -3.182 -5.667 -25.825 425 HD21 ASN 50 HD21 ASN 50 -1.397 -5.511 -26.956 426 HD22 ASN 50 HD22 ASN 50 -1.147 -4.503 -28.337 427 H VAL 51 H VAL 51 -6.866 -5.756 -25.295 428 HA VAL 51 HA VAL 51 -7.827 -7.103 -23.727 429 HB VAL 51 HB VAL 51 -6.274 -9.432 -24.837 430 HG11 VAL 51 HG11 VAL 51 -9.080 -9.707 -24.009 431 HG12 VAL 51 HG12 VAL 51 -7.689 -10.742 -23.678 432 HG13 VAL 51 HG13 VAL 51 -7.957 -9.287 -22.716 433 HG21 VAL 51 HG21 VAL 51 -8.713 -9.534 -26.077 434 HG22 VAL 51 HG22 VAL 51 -8.331 -7.814 -26.138 435 HG23 VAL 51 HG23 VAL 51 -7.211 -8.991 -26.824 436 H LYS 52 H LYS 52 -5.778 -5.657 -22.826 437 HA LYS 52 HA LYS 52 -4.524 -7.453 -20.882 438 HB2 LYS 52 HB2 LYS 52 -2.374 -6.281 -21.096 439 HB3 LYS 52 HB3 LYS 52 -2.828 -7.080 -22.595 440 HG2 LYS 52 HG2 LYS 52 -3.103 -5.129 -23.719 441 HG3 LYS 52 HG3 LYS 52 -3.615 -4.243 -22.280 442 HD2 LYS 52 HD2 LYS 52 -1.548 -3.324 -22.542 443 HD3 LYS 52 HD3 LYS 52 -1.098 -4.725 -21.566 444 HE2 LYS 52 HE2 LYS 52 -0.065 -5.766 -23.296 445 HE3 LYS 52 HE3 LYS 52 -1.188 -5.125 -24.494 446 HZ1 LYS 52 HZ1 LYS 52 0.501 -3.139 -23.255 447 HZ2 LYS 52 HZ2 LYS 52 0.114 -3.366 -24.886 448 HZ3 LYS 52 HZ3 LYS 52 1.341 -4.286 -24.173 449 H LEU 53 H LEU 53 -3.903 -6.425 -18.910 450 HA LEU 53 HA LEU 53 -5.486 -4.022 -18.366 451 HB2 LEU 53 HB2 LEU 53 -4.842 -6.420 -16.903 452 HB3 LEU 53 HB3 LEU 53 -4.411 -4.987 -15.972 453 HG LEU 53 HG LEU 53 -6.714 -4.177 -16.156 454 HD11 LEU 53 HD11 LEU 53 -7.091 -6.698 -17.746 455 HD12 LEU 53 HD12 LEU 53 -7.466 -5.040 -18.213 456 HD13 LEU 53 HD13 LEU 53 -8.432 -5.847 -16.978 457 HD21 LEU 53 HD21 LEU 53 -6.381 -5.348 -14.183 458 HD22 LEU 53 HD22 LEU 53 -6.179 -6.891 -15.012 459 HD23 LEU 53 HD23 LEU 53 -7.780 -6.161 -14.884 460 H VAL 54 H VAL 54 -4.598 -2.127 -17.774 461 HA VAL 54 HA VAL 54 -1.808 -2.015 -16.940 462 HB VAL 54 HB VAL 54 -1.325 -0.175 -18.561 463 HG11 VAL 54 HG11 VAL 54 -0.698 -2.633 -18.845 464 HG12 VAL 54 HG12 VAL 54 -2.006 -2.705 -20.028 465 HG13 VAL 54 HG13 VAL 54 -0.644 -1.614 -20.283 466 HG21 VAL 54 HG21 VAL 54 -3.768 -1.168 -20.017 467 HG22 VAL 54 HG22 VAL 54 -3.734 0.307 -19.050 468 HG23 VAL 54 HG23 VAL 54 -2.708 0.164 -20.478 469 H GLU 55 H GLU 55 -1.208 0.032 -16.007 470 HA GLU 55 HA GLU 55 -3.420 1.264 -14.617 471 HB2 GLU 55 HB2 GLU 55 -1.570 2.580 -13.498 472 HB3 GLU 55 HB3 GLU 55 -1.511 0.837 -13.278 473 HG2 GLU 55 HG2 GLU 55 0.480 0.682 -14.249 474 HG3 GLU 55 HG3 GLU 55 -0.011 1.696 -15.604 475 H SER 56 H SER 56 -4.577 2.641 -15.842 476 HA SER 56 HA SER 56 -3.217 5.024 -16.826 477 HB2 SER 56 HB2 SER 56 -3.279 3.557 -18.785 478 HB3 SER 56 HB3 SER 56 -5.016 3.329 -18.577 479 HG SER 56 HG SER 56 -3.719 5.801 -19.097 480 H ASP 57 H ASP 57 -4.859 6.689 -17.562 481 HA ASP 57 HA ASP 57 -7.203 6.557 -15.784 482 HB2 ASP 57 HB2 ASP 57 -5.201 8.415 -15.760 483 HB3 ASP 57 HB3 ASP 57 -6.392 9.202 -16.793 484 H ASP 58 H ASP 58 -6.648 5.871 -18.781 485 HA ASP 58 HA ASP 58 -8.168 7.595 -20.380 486 HB2 ASP 58 HB2 ASP 58 -6.636 5.781 -21.199 487 HB3 ASP 58 HB3 ASP 58 -7.876 4.610 -20.758 488 H ALA 59 H ALA 59 -10.298 7.330 -21.249 489 HA ALA 59 HA ALA 59 -12.247 6.753 -19.263 490 HB1 ALA 59 HB1 ALA 59 -12.816 8.472 -20.740 491 HB2 ALA 59 HB2 ALA 59 -12.409 7.510 -22.161 492 HB3 ALA 59 HB3 ALA 59 -13.851 7.127 -21.221 493 H ALA 60 H ALA 60 -14.245 5.390 -19.952 494 HA ALA 60 HA ALA 60 -13.657 3.022 -21.487 495 HB1 ALA 60 HB1 ALA 60 -12.624 2.681 -19.176 496 HB2 ALA 60 HB2 ALA 60 -14.283 2.582 -18.584 497 HB3 ALA 60 HB3 ALA 60 -13.702 1.421 -19.778 498 H GLU 61 H GLU 61 -15.523 1.564 -21.628 499 HA GLU 61 HA GLU 61 -17.903 2.920 -22.126 500 HB2 GLU 61 HB2 GLU 61 -17.098 0.070 -21.935 501 HB3 GLU 61 HB3 GLU 61 -18.819 0.413 -21.837 502 HG2 GLU 61 HG2 GLU 61 -17.439 1.798 -24.013 503 HG3 GLU 61 HG3 GLU 61 -17.424 0.039 -24.137 504 H ALA 62 H ALA 62 -16.717 1.421 -19.213 505 HA ALA 62 HA ALA 62 -18.825 2.661 -17.679 506 HB1 ALA 62 HB1 ALA 62 -20.165 0.889 -17.583 507 HB2 ALA 62 HB2 ALA 62 -18.975 -0.136 -18.387 508 HB3 ALA 62 HB3 ALA 62 -18.910 0.086 -16.639 509 H THR 63 H THR 63 -18.467 2.447 -15.340 510 HA THR 63 HA THR 63 -15.661 1.829 -14.685 511 HB THR 63 HB THR 63 -17.283 4.168 -13.665 512 HG1 THR 63 HG1 THR 63 -15.026 3.958 -15.386 513 HG21 THR 63 HG21 THR 63 -15.991 3.941 -11.837 514 HG22 THR 63 HG22 THR 63 -14.702 4.574 -12.861 515 HG23 THR 63 HG23 THR 63 -14.882 2.834 -12.644 516 H LEU 64 H LEU 64 -15.383 0.491 -13.018 517 HA LEU 64 HA LEU 64 -17.683 -0.009 -11.246 518 HB2 LEU 64 HB2 LEU 64 -16.361 -1.792 -12.878 519 HB3 LEU 64 HB3 LEU 64 -15.630 -2.075 -11.300 520 HG LEU 64 HG LEU 64 -18.543 -2.333 -12.034 521 HD11 LEU 64 HD11 LEU 64 -17.960 -4.421 -12.508 522 HD12 LEU 64 HD12 LEU 64 -17.575 -4.638 -10.801 523 HD13 LEU 64 HD13 LEU 64 -16.313 -4.154 -11.935 524 HD21 LEU 64 HD21 LEU 64 -18.897 -3.020 -9.714 525 HD22 LEU 64 HD22 LEU 64 -18.338 -1.350 -9.814 526 HD23 LEU 64 HD23 LEU 64 -17.219 -2.629 -9.340 527 H THR 65 H THR 65 -17.352 1.007 -9.378 528 HA THR 65 HA THR 65 -14.640 1.204 -8.294 529 HB THR 65 HB THR 65 -17.174 2.517 -7.294 530 HG1 THR 65 HG1 THR 65 -16.629 3.330 -9.334 531 HG21 THR 65 HG21 THR 65 -15.338 2.232 -5.628 532 HG22 THR 65 HG22 THR 65 -15.724 3.916 -5.980 533 HG23 THR 65 HG23 THR 65 -14.291 3.174 -6.689 534 H MET 66 H MET 66 -13.958 -0.085 -6.717 535 HA MET 66 HA MET 66 -15.774 -1.073 -4.696 536 HB2 MET 66 HB2 MET 66 -14.447 -2.904 -6.686 537 HB3 MET 66 HB3 MET 66 -14.962 -3.465 -5.101 538 HG2 MET 66 HG2 MET 66 -17.259 -2.807 -5.616 539 HG3 MET 66 HG3 MET 66 -16.739 -2.258 -7.207 540 HE1 MET 66 HE1 MET 66 -15.060 -3.729 -8.431 541 HE2 MET 66 HE2 MET 66 -14.681 -5.367 -7.899 542 HE3 MET 66 HE3 MET 66 -15.845 -5.109 -9.199 543 H GLU 67 H GLU 67 -14.747 -1.619 -2.801 544 HA GLU 67 HA GLU 67 -12.175 -0.559 -2.360 545 HB2 GLU 67 HB2 GLU 67 -13.956 -2.338 -0.706 546 HB3 GLU 67 HB3 GLU 67 -12.383 -1.801 -0.135 547 HG2 GLU 67 HG2 GLU 67 -13.238 0.122 0.530 548 HG3 GLU 67 HG3 GLU 67 -13.841 0.454 -1.092 549 H ASP 68 H ASP 68 -10.244 -1.649 -1.697 550 HA ASP 68 HA ASP 68 -9.301 -3.575 -3.400 551 HB2 ASP 68 HB2 ASP 68 -7.923 -2.173 -1.851 552 HB3 ASP 68 HB3 ASP 68 -8.397 -3.243 -0.534 553 H ASP 69 H ASP 69 -10.588 -4.108 -0.127 554 HA ASP 69 HA ASP 69 -10.325 -6.923 -0.189 555 HB2 ASP 69 HB2 ASP 69 -11.782 -4.962 1.526 556 HB3 ASP 69 HB3 ASP 69 -12.225 -6.663 1.642 557 H ILE 70 H ILE 70 -12.802 -4.728 -1.294 558 HA ILE 70 HA ILE 70 -14.858 -6.675 -1.604 559 HB ILE 70 HB ILE 70 -14.555 -4.016 -3.004 560 HG12 ILE 70 HG12 ILE 70 -14.623 -4.124 -0.407 561 HG13 ILE 70 HG13 ILE 70 -15.695 -3.003 -1.239 562 HG21 ILE 70 HG21 ILE 70 -16.137 -5.363 -4.173 563 HG22 ILE 70 HG22 ILE 70 -16.903 -5.870 -2.669 564 HG23 ILE 70 HG23 ILE 70 -17.043 -4.197 -3.209 565 HD11 ILE 70 HD11 ILE 70 -17.568 -4.194 -0.714 566 HD12 ILE 70 HD12 ILE 70 -16.699 -5.725 -0.601 567 HD13 ILE 70 HD13 ILE 70 -16.564 -4.537 0.695 568 H MET 71 H MET 71 -12.687 -5.076 -3.936 569 HA MET 71 HA MET 71 -13.502 -6.377 -6.235 570 HB2 MET 71 HB2 MET 71 -11.888 -4.482 -6.133 571 HB3 MET 71 HB3 MET 71 -10.662 -5.600 -5.551 572 HG2 MET 71 HG2 MET 71 -10.120 -5.673 -7.731 573 HG3 MET 71 HG3 MET 71 -11.394 -6.891 -7.770 574 HE1 MET 71 HE1 MET 71 -11.871 -2.513 -9.140 575 HE2 MET 71 HE2 MET 71 -11.557 -2.962 -7.464 576 HE3 MET 71 HE3 MET 71 -10.331 -3.252 -8.699 577 H PHE 72 H PHE 72 -11.443 -7.518 -3.648 578 HA PHE 72 HA PHE 72 -10.355 -9.761 -4.973 579 HB2 PHE 72 HB2 PHE 72 -9.820 -8.609 -2.626 580 HB3 PHE 72 HB3 PHE 72 -10.872 -9.895 -2.043 581 HD1 PHE 72 HD2 PHE 72 -7.926 -9.383 -4.267 582 HD2 PHE 72 HD1 PHE 72 -9.944 -11.932 -1.520 583 HE1 PHE 72 HE2 PHE 72 -6.036 -10.956 -4.344 584 HE2 PHE 72 HE1 PHE 72 -8.057 -13.509 -1.591 585 HZ PHE 72 HZ PHE 72 -6.100 -13.022 -3.006 586 H ALA 73 H ALA 73 -13.294 -9.298 -3.076 587 HA ALA 73 HA ALA 73 -14.070 -12.004 -2.940 588 HB1 ALA 73 HB1 ALA 73 -16.219 -9.991 -3.067 589 HB2 ALA 73 HB2 ALA 73 -15.904 -11.246 -1.868 590 HB3 ALA 73 HB3 ALA 73 -14.995 -9.735 -1.823 591 H ILE 74 H ILE 74 -15.127 -9.409 -5.147 592 HA ILE 74 HA ILE 74 -16.702 -11.130 -6.768 593 HB ILE 74 HB ILE 74 -15.545 -8.419 -7.426 594 HG12 ILE 74 HG12 ILE 74 -18.169 -7.980 -7.020 595 HG13 ILE 74 HG13 ILE 74 -17.934 -9.335 -5.921 596 HG21 ILE 74 HG21 ILE 74 -17.353 -10.265 -8.883 597 HG22 ILE 74 HG22 ILE 74 -17.716 -8.541 -8.947 598 HG23 ILE 74 HG23 ILE 74 -16.150 -9.133 -9.501 599 HD11 ILE 74 HD11 ILE 74 -15.924 -7.205 -5.729 600 HD12 ILE 74 HD12 ILE 74 -17.562 -6.756 -5.253 601 HD13 ILE 74 HD13 ILE 74 -16.754 -8.110 -4.463 602 H GLY 75 H GLY 75 -13.344 -10.535 -6.579 603 HA2 GLY 75 HA2 GLY 75 -12.797 -11.306 -9.327 604 HA3 GLY 75 HA3 GLY 75 -11.607 -10.909 -8.096 605 H THR 76 H THR 76 -12.682 -12.748 -6.126 606 HA THR 76 HA THR 76 -11.547 -15.208 -7.236 607 HB THR 76 HB THR 76 -10.594 -14.297 -5.125 608 HG1 THR 76 HG1 THR 76 -10.947 -16.413 -3.956 609 HG21 THR 76 HG21 THR 76 -13.268 -13.968 -4.409 610 HG22 THR 76 HG22 THR 76 -11.859 -13.728 -3.375 611 HG23 THR 76 HG23 THR 76 -12.687 -15.284 -3.390 612 H GLY 77 H GLY 77 -14.338 -14.257 -7.720 613 HA2 GLY 77 HA2 GLY 77 -16.460 -15.131 -7.815 614 HA3 GLY 77 HA3 GLY 77 -15.665 -16.693 -7.694 615 H ALA 78 H ALA 78 -15.264 -14.423 -5.119 616 HA ALA 78 HA ALA 78 -16.420 -16.231 -3.233 617 HB1 ALA 78 HB1 ALA 78 -15.890 -14.481 -1.576 618 HB2 ALA 78 HB2 ALA 78 -14.515 -14.883 -2.606 619 HB3 ALA 78 HB3 ALA 78 -15.429 -13.403 -2.894 620 H LEU 79 H LEU 79 -17.173 -12.771 -3.505 621 HA LEU 79 HA LEU 79 -19.990 -13.429 -2.993 622 HB2 LEU 79 HB2 LEU 79 -18.238 -11.130 -2.328 623 HB3 LEU 79 HB3 LEU 79 -19.940 -10.791 -2.634 624 HG LEU 79 HG LEU 79 -18.991 -12.788 -0.587 625 HD11 LEU 79 HD11 LEU 79 -19.039 -9.878 -0.495 626 HD12 LEU 79 HD12 LEU 79 -18.285 -11.037 0.600 627 HD13 LEU 79 HD13 LEU 79 -19.991 -10.630 0.786 628 HD21 LEU 79 HD21 LEU 79 -21.253 -13.166 -1.286 629 HD22 LEU 79 HD22 LEU 79 -21.639 -11.452 -1.127 630 HD23 LEU 79 HD23 LEU 79 -21.282 -12.413 0.309 631 HA PRO 80 HA PRO 80 -21.126 -12.219 -7.071 632 HB2 PRO 80 HB2 PRO 80 -23.730 -11.597 -6.622 633 HB3 PRO 80 HB3 PRO 80 -23.132 -13.260 -6.658 634 HG2 PRO 80 HG2 PRO 80 -23.708 -11.504 -4.303 635 HG3 PRO 80 HG3 PRO 80 -24.091 -13.219 -4.540 636 HD2 PRO 80 HD2 PRO 80 -21.977 -12.388 -3.065 637 HD3 PRO 80 HD3 PRO 80 -21.957 -13.900 -3.996 638 H ALA 81 H ALA 81 -20.805 -10.385 -8.158 639 HA ALA 81 HA ALA 81 -20.456 -7.894 -6.926 640 HB1 ALA 81 HB1 ALA 81 -19.832 -8.919 -9.353 641 HB2 ALA 81 HB2 ALA 81 -21.149 -7.826 -9.780 642 HB3 ALA 81 HB3 ALA 81 -19.728 -7.207 -8.938 643 H LYS 82 H LYS 82 -23.286 -9.449 -8.179 644 HA LYS 82 HA LYS 82 -24.896 -7.154 -8.568 645 HB2 LYS 82 HB2 LYS 82 -25.441 -9.357 -9.523 646 HB3 LYS 82 HB3 LYS 82 -25.726 -9.986 -7.905 647 HG2 LYS 82 HG2 LYS 82 -27.553 -8.335 -7.637 648 HG3 LYS 82 HG3 LYS 82 -27.308 -7.847 -9.316 649 HD2 LYS 82 HD2 LYS 82 -27.697 -10.259 -9.948 650 HD3 LYS 82 HD3 LYS 82 -28.205 -10.530 -8.280 651 HE2 LYS 82 HE2 LYS 82 -29.744 -8.436 -8.808 652 HE3 LYS 82 HE3 LYS 82 -29.542 -9.016 -10.461 653 HZ1 LYS 82 HZ1 LYS 82 -31.449 -10.074 -9.654 654 HZ2 LYS 82 HZ2 LYS 82 -30.743 -10.437 -8.161 655 HZ3 LYS 82 HZ3 LYS 82 -30.242 -11.256 -9.554 656 H GLU 83 H GLU 83 -24.851 -9.512 -5.888 657 HA GLU 83 HA GLU 83 -26.640 -8.182 -4.222 658 HB2 GLU 83 HB2 GLU 83 -24.288 -9.914 -3.441 659 HB3 GLU 83 HB3 GLU 83 -25.619 -9.474 -2.381 660 HG2 GLU 83 HG2 GLU 83 -25.987 -10.981 -4.954 661 HG3 GLU 83 HG3 GLU 83 -25.743 -11.762 -3.393 662 H ALA 84 H ALA 84 -23.084 -8.016 -4.253 663 HA ALA 84 HA ALA 84 -22.669 -6.262 -2.175 664 HB1 ALA 84 HB1 ALA 84 -21.204 -6.721 -4.743 665 HB2 ALA 84 HB2 ALA 84 -20.674 -5.467 -3.620 666 HB3 ALA 84 HB3 ALA 84 -20.738 -7.150 -3.096 667 H MET 85 H MET 85 -23.625 -5.533 -5.495 668 HA MET 85 HA MET 85 -23.402 -2.717 -5.274 669 HB2 MET 85 HB2 MET 85 -24.038 -4.566 -7.292 670 HB3 MET 85 HB3 MET 85 -25.444 -3.520 -7.149 671 HG2 MET 85 HG2 MET 85 -23.579 -1.640 -7.171 672 HG3 MET 85 HG3 MET 85 -22.689 -2.892 -8.034 673 HE1 MET 85 HE1 MET 85 -26.735 -1.765 -8.399 674 HE2 MET 85 HE2 MET 85 -25.571 -0.615 -7.742 675 HE3 MET 85 HE3 MET 85 -26.202 -0.395 -9.374 676 H ALA 86 H ALA 86 -25.963 -5.005 -4.567 677 HA ALA 86 HA ALA 86 -28.004 -3.034 -4.209 678 HB1 ALA 86 HB1 ALA 86 -27.774 -5.939 -3.987 679 HB2 ALA 86 HB2 ALA 86 -28.875 -5.217 -2.813 680 HB3 ALA 86 HB3 ALA 86 -29.123 -4.944 -4.537 681 H GLN 87 H GLN 87 -25.480 -4.323 -2.242 682 HA GLN 87 HA GLN 87 -26.694 -3.435 0.242 683 HB2 GLN 87 HB2 GLN 87 -23.971 -4.629 -0.304 684 HB3 GLN 87 HB3 GLN 87 -24.633 -4.296 1.291 685 HG2 GLN 87 HG2 GLN 87 -26.592 -5.831 0.178 686 HG3 GLN 87 HG3 GLN 87 -25.133 -6.525 -0.526 687 HE21 GLN 87 HE21 GLN 87 -24.925 -8.372 0.574 688 HE22 GLN 87 HE22 GLN 87 -24.782 -8.491 2.291 689 H ASP 88 H ASP 88 -25.530 -1.746 -2.149 690 HA ASP 88 HA ASP 88 -24.592 0.311 -2.396 691 HB2 ASP 88 HB2 ASP 88 -24.707 0.680 0.586 692 HB3 ASP 88 HB3 ASP 88 -24.906 1.885 -0.683 693 H LYS 89 H LYS 89 -22.998 -2.152 -1.476 694 HA LYS 89 HA LYS 89 -20.670 -0.901 -0.258 695 HB2 LYS 89 HB2 LYS 89 -21.160 -3.762 -1.105 696 HB3 LYS 89 HB3 LYS 89 -19.738 -3.190 -0.242 697 HG2 LYS 89 HG2 LYS 89 -21.976 -2.336 1.235 698 HG3 LYS 89 HG3 LYS 89 -22.263 -4.020 0.794 699 HD2 LYS 89 HD2 LYS 89 -20.440 -4.780 1.969 700 HD3 LYS 89 HD3 LYS 89 -19.580 -3.244 1.837 701 HE2 LYS 89 HE2 LYS 89 -20.991 -2.239 3.487 702 HE3 LYS 89 HE3 LYS 89 -22.060 -3.641 3.504 703 HZ1 LYS 89 HZ1 LYS 89 -20.587 -4.867 4.716 704 HZ2 LYS 89 HZ2 LYS 89 -20.233 -3.329 5.323 705 HZ3 LYS 89 HZ3 LYS 89 -19.228 -4.030 4.156 706 H MET 90 H MET 90 -21.854 -1.019 -3.284 707 HA MET 90 HA MET 90 -19.365 -0.326 -4.481 708 HB2 MET 90 HB2 MET 90 -19.057 -2.127 -5.992 709 HB3 MET 90 HB3 MET 90 -19.268 -2.856 -4.406 710 HG2 MET 90 HG2 MET 90 -21.564 -3.406 -4.927 711 HG3 MET 90 HG3 MET 90 -21.426 -2.596 -6.486 712 HE1 MET 90 HE1 MET 90 -21.515 -4.743 -8.531 713 HE2 MET 90 HE2 MET 90 -20.542 -3.280 -8.378 714 HE3 MET 90 HE3 MET 90 -19.772 -4.812 -8.797 715 H GLU 91 H GLU 91 -19.620 0.656 -6.493 716 HA GLU 91 HA GLU 91 -22.382 0.849 -7.492 717 HB2 GLU 91 HB2 GLU 91 -20.451 3.040 -6.829 718 HB3 GLU 91 HB3 GLU 91 -21.627 3.279 -8.113 719 HG2 GLU 91 HG2 GLU 91 -22.365 2.461 -5.317 720 HG3 GLU 91 HG3 GLU 91 -22.304 4.135 -5.865 721 H VAL 92 H VAL 92 -22.455 1.775 -9.748 722 HA VAL 92 HA VAL 92 -20.063 1.257 -11.334 723 HB VAL 92 HB VAL 92 -22.664 -0.054 -12.102 724 HG11 VAL 92 HG11 VAL 92 -20.276 -1.290 -13.096 725 HG12 VAL 92 HG12 VAL 92 -21.614 -0.567 -13.991 726 HG13 VAL 92 HG13 VAL 92 -20.258 0.433 -13.468 727 HG21 VAL 92 HG21 VAL 92 -21.852 -0.984 -9.961 728 HG22 VAL 92 HG22 VAL 92 -21.798 -2.155 -11.279 729 HG23 VAL 92 HG23 VAL 92 -20.316 -1.368 -10.738 730 H ASP 93 H ASP 93 -20.000 2.355 -13.277 731 HA ASP 93 HA ASP 93 -22.316 4.062 -13.901 732 HB2 ASP 93 HB2 ASP 93 -20.089 5.076 -12.771 733 HB3 ASP 93 HB3 ASP 93 -19.619 5.155 -14.466 734 H GLY 94 H GLY 94 -22.592 4.616 -16.097 735 HA2 GLY 94 HA2 GLY 94 -21.611 4.545 -18.375 736 HA3 GLY 94 HA3 GLY 94 -21.018 2.944 -17.959 737 H GLN 95 H GLN 95 -22.122 1.388 -18.920 738 HA GLN 95 HA GLN 95 -24.976 1.830 -19.484 739 HB2 GLN 95 HB2 GLN 95 -22.891 0.138 -20.849 740 HB3 GLN 95 HB3 GLN 95 -24.611 -0.093 -21.134 741 HG2 GLN 95 HG2 GLN 95 -23.845 2.683 -21.394 742 HG3 GLN 95 HG3 GLN 95 -22.922 1.639 -22.473 743 HE21 GLN 95 HE21 GLN 95 -26.273 1.626 -21.305 744 HE22 GLN 95 HE22 GLN 95 -26.999 1.572 -22.871 745 H VAL 96 H VAL 96 -26.140 0.985 -17.868 746 HA VAL 96 HA VAL 96 -25.470 -0.980 -16.080 747 HB VAL 96 HB VAL 96 -28.229 -0.473 -17.204 748 HG11 VAL 96 HG11 VAL 96 -28.598 -2.391 -16.036 749 HG12 VAL 96 HG12 VAL 96 -27.216 -2.139 -14.967 750 HG13 VAL 96 HG13 VAL 96 -28.710 -1.238 -14.707 751 HG21 VAL 96 HG21 VAL 96 -28.317 1.405 -16.008 752 HG22 VAL 96 HG22 VAL 96 -27.648 0.614 -14.581 753 HG23 VAL 96 HG23 VAL 96 -26.570 1.263 -15.816 754 H GLU 97 H GLU 97 -26.561 -1.351 -19.374 755 HA GLU 97 HA GLU 97 -27.153 -4.139 -19.190 756 HB2 GLU 97 HB2 GLU 97 -27.210 -4.062 -21.655 757 HB3 GLU 97 HB3 GLU 97 -28.177 -2.787 -20.926 758 HG2 GLU 97 HG2 GLU 97 -26.216 -1.253 -21.273 759 HG3 GLU 97 HG3 GLU 97 -25.484 -2.537 -22.233 760 H LEU 98 H LEU 98 -24.368 -2.258 -20.309 761 HA LEU 98 HA LEU 98 -22.796 -4.289 -21.332 762 HB2 LEU 98 HB2 LEU 98 -22.285 -1.639 -20.126 763 HB3 LEU 98 HB3 LEU 98 -20.909 -2.737 -20.220 764 HG LEU 98 HG LEU 98 -21.117 -1.111 -22.115 765 HD11 LEU 98 HD11 LEU 98 -21.261 -3.430 -23.704 766 HD12 LEU 98 HD12 LEU 98 -20.560 -3.913 -22.160 767 HD13 LEU 98 HD13 LEU 98 -19.820 -2.615 -23.097 768 HD21 LEU 98 HD21 LEU 98 -22.862 -1.112 -23.572 769 HD22 LEU 98 HD22 LEU 98 -23.725 -1.623 -22.121 770 HD23 LEU 98 HD23 LEU 98 -23.223 -2.819 -23.316 771 H ILE 99 H ILE 99 -22.677 -3.005 -18.004 772 HA ILE 99 HA ILE 99 -20.856 -4.785 -16.938 773 HB ILE 99 HB ILE 99 -21.611 -2.883 -15.660 774 HG12 ILE 99 HG12 ILE 99 -22.667 -5.092 -13.973 775 HG13 ILE 99 HG13 ILE 99 -21.036 -5.281 -14.608 776 HG21 ILE 99 HG21 ILE 99 -23.875 -2.658 -16.315 777 HG22 ILE 99 HG22 ILE 99 -24.284 -4.261 -15.704 778 HG23 ILE 99 HG23 ILE 99 -23.888 -2.963 -14.578 779 HD11 ILE 99 HD11 ILE 99 -21.319 -4.228 -12.301 780 HD12 ILE 99 HD12 ILE 99 -20.246 -3.424 -13.448 781 HD13 ILE 99 HD13 ILE 99 -21.869 -2.794 -13.167 782 H PHE 100 H PHE 100 -24.205 -5.288 -17.737 783 HA PHE 100 HA PHE 100 -24.658 -7.606 -16.189 784 HB2 PHE 100 HB2 PHE 100 -26.170 -6.014 -17.889 785 HB3 PHE 100 HB3 PHE 100 -26.108 -7.567 -18.717 786 HD1 PHE 100 HD1 PHE 100 -26.816 -6.079 -15.380 787 HD2 PHE 100 HD2 PHE 100 -27.597 -9.231 -18.132 788 HE1 PHE 100 HE1 PHE 100 -28.582 -6.934 -13.895 789 HE2 PHE 100 HE2 PHE 100 -29.365 -10.090 -16.652 790 HZ PHE 100 HZ PHE 100 -29.860 -8.942 -14.531 791 H LEU 101 H LEU 101 -23.385 -7.105 -19.438 792 HA LEU 101 HA LEU 101 -23.323 -9.837 -20.185 793 HB2 LEU 101 HB2 LEU 101 -22.103 -7.319 -21.189 794 HB3 LEU 101 HB3 LEU 101 -21.422 -8.848 -21.742 795 HG LEU 101 HG LEU 101 -23.121 -7.802 -23.266 796 HD11 LEU 101 HD11 LEU 101 -24.136 -10.453 -22.344 797 HD12 LEU 101 HD12 LEU 101 -22.508 -10.318 -23.006 798 HD13 LEU 101 HD13 LEU 101 -23.898 -9.848 -23.983 799 HD21 LEU 101 HD21 LEU 101 -24.599 -7.071 -21.347 800 HD22 LEU 101 HD22 LEU 101 -25.132 -8.749 -21.239 801 HD23 LEU 101 HD23 LEU 101 -25.417 -7.825 -22.715 802 H LEU 102 H LEU 102 -21.377 -7.962 -18.095 803 HA LEU 102 HA LEU 102 -18.998 -9.564 -18.341 804 HB2 LEU 102 HB2 LEU 102 -19.889 -7.311 -16.607 805 HB3 LEU 102 HB3 LEU 102 -18.521 -8.294 -16.089 806 HG LEU 102 HG LEU 102 -18.647 -6.851 -18.733 807 HD11 LEU 102 HD11 LEU 102 -17.176 -5.193 -17.738 808 HD12 LEU 102 HD12 LEU 102 -17.285 -6.009 -16.179 809 HD13 LEU 102 HD13 LEU 102 -18.716 -5.254 -16.879 810 HD21 LEU 102 HD21 LEU 102 -17.089 -8.569 -18.939 811 HD22 LEU 102 HD22 LEU 102 -16.549 -8.412 -17.267 812 HD23 LEU 102 HD23 LEU 102 -16.112 -7.183 -18.455 813 H GLU 103 H GLU 103 -21.673 -9.278 -16.038 814 HA GLU 103 HA GLU 103 -20.982 -10.792 -13.946 815 HB2 GLU 103 HB2 GLU 103 -23.477 -10.331 -15.371 816 HB3 GLU 103 HB3 GLU 103 -23.454 -11.898 -14.573 817 HG2 GLU 103 HG2 GLU 103 -22.427 -9.987 -12.754 818 HG3 GLU 103 HG3 GLU 103 -23.909 -9.335 -13.449 819 HA PRO 104 HA PRO 104 -21.729 -14.985 -16.227 820 HB2 PRO 104 HB2 PRO 104 -22.074 -14.895 -18.918 821 HB3 PRO 104 HB3 PRO 104 -23.416 -14.780 -17.773 822 HG2 PRO 104 HG2 PRO 104 -21.984 -12.598 -19.240 823 HG3 PRO 104 HG3 PRO 104 -23.723 -12.803 -18.958 824 HD2 PRO 104 HD2 PRO 104 -22.199 -11.114 -17.490 825 HD3 PRO 104 HD3 PRO 104 -23.602 -11.966 -16.814 826 H PHE 105 H PHE 105 -19.978 -12.472 -17.967 827 HA PHE 105 HA PHE 105 -18.105 -14.065 -19.292 828 HB2 PHE 105 HB2 PHE 105 -18.393 -11.677 -19.765 829 HB3 PHE 105 HB3 PHE 105 -17.754 -11.275 -18.175 830 HD1 PHE 105 HD2 PHE 105 -16.796 -13.188 -21.230 831 HD2 PHE 105 HD1 PHE 105 -15.538 -10.704 -18.011 832 HE1 PHE 105 HE2 PHE 105 -14.520 -13.134 -22.165 833 HE2 PHE 105 HE1 PHE 105 -13.261 -10.645 -18.941 834 HZ PHE 105 HZ PHE 105 -12.749 -11.863 -21.019 835 H ILE 106 H ILE 106 -18.295 -13.035 -15.968 836 HA ILE 106 HA ILE 106 -15.672 -13.415 -15.133 837 HB ILE 106 HB ILE 106 -18.186 -14.020 -13.570 838 HG12 ILE 106 HG12 ILE 106 -16.533 -11.490 -13.571 839 HG13 ILE 106 HG13 ILE 106 -17.976 -11.700 -14.557 840 HG21 ILE 106 HG21 ILE 106 -16.361 -13.177 -11.757 841 HG22 ILE 106 HG22 ILE 106 -16.692 -14.870 -12.122 842 HG23 ILE 106 HG23 ILE 106 -15.329 -14.053 -12.887 843 HD11 ILE 106 HD11 ILE 106 -19.377 -11.537 -12.783 844 HD12 ILE 106 HD12 ILE 106 -18.212 -12.231 -11.655 845 HD13 ILE 106 HD13 ILE 106 -18.042 -10.555 -12.179 846 H ALA 107 H ALA 107 -18.111 -15.741 -15.964 847 HA ALA 107 HA ALA 107 -17.018 -17.992 -14.646 848 HB1 ALA 107 HB1 ALA 107 -19.259 -18.154 -15.357 849 HB2 ALA 107 HB2 ALA 107 -18.847 -17.714 -17.015 850 HB3 ALA 107 HB3 ALA 107 -18.355 -19.280 -16.370 851 H SER 108 H SER 108 -16.296 -16.412 -17.673 852 HA SER 108 HA SER 108 -14.912 -18.465 -18.972 853 HB2 SER 108 HB2 SER 108 -15.611 -16.157 -19.874 854 HB3 SER 108 HB3 SER 108 -14.111 -15.565 -19.161 855 HG SER 108 HG SER 108 -14.473 -17.410 -21.259 856 H LEU 109 H LEU 109 -13.543 -15.773 -17.069 857 HA LEU 109 HA LEU 109 -11.278 -17.533 -16.399 858 HB2 LEU 109 HB2 LEU 109 -10.010 -15.276 -16.231 859 HB3 LEU 109 HB3 LEU 109 -10.252 -16.035 -17.804 860 HG LEU 109 HG LEU 109 -12.373 -14.159 -17.118 861 HD11 LEU 109 HD11 LEU 109 -10.396 -13.124 -15.965 862 HD12 LEU 109 HD12 LEU 109 -11.133 -12.141 -17.229 863 HD13 LEU 109 HD13 LEU 109 -9.628 -13.003 -17.548 864 HD21 LEU 109 HD21 LEU 109 -11.737 -13.299 -19.383 865 HD22 LEU 109 HD22 LEU 109 -12.170 -15.008 -19.335 866 HD23 LEU 109 HD23 LEU 109 -10.474 -14.530 -19.427 867 H LYS 110 H LYS 110 -11.543 -18.069 -14.330 868 HA LYS 110 HA LYS 110 -11.933 -17.934 -12.090 869 HB2 LYS 110 HB2 LYS 110 -9.997 -16.177 -12.638 870 HB3 LYS 110 HB3 LYS 110 -11.208 -15.048 -12.046 871 HG2 LYS 110 HG2 LYS 110 -9.861 -15.617 -10.198 872 HG3 LYS 110 HG3 LYS 110 -11.383 -16.486 -9.988 873 HD2 LYS 110 HD2 LYS 110 -9.576 -18.102 -11.505 874 HD3 LYS 110 HD3 LYS 110 -8.764 -17.541 -10.042 875 HE2 LYS 110 HE2 LYS 110 -11.517 -18.458 -9.628 876 HE3 LYS 110 HE3 LYS 110 -10.411 -19.710 -10.191 877 HZ1 LYS 110 HZ1 LYS 110 -8.936 -19.189 -8.354 878 HZ2 LYS 110 HZ2 LYS 110 -10.473 -19.598 -7.779 879 HZ3 LYS 110 HZ3 LYS 110 -9.988 -17.978 -7.816 Start of MODEL 12 1 H1 MET 1 H MET 1 3.368 -0.512 0.711 2 HA MET 1 HA MET 1 0.503 -0.027 1.020 3 HB2 MET 1 HB2 MET 1 2.568 1.272 -0.765 4 HB3 MET 1 HB3 MET 1 0.867 1.715 -0.727 5 HG2 MET 1 HG2 MET 1 1.468 3.229 0.784 6 HG3 MET 1 HG3 MET 1 1.568 1.876 1.909 7 HE1 MET 1 HE1 MET 1 4.625 4.784 0.837 8 HE2 MET 1 HE2 MET 1 4.243 3.958 -0.673 9 HE3 MET 1 HE3 MET 1 2.950 4.666 0.297 10 H SER 2 H SER 2 0.157 -2.331 0.360 11 HA SER 2 HA SER 2 -0.004 -2.504 -2.575 12 HB2 SER 2 HB2 SER 2 0.259 -5.000 -0.951 13 HB3 SER 2 HB3 SER 2 0.759 -4.685 -2.613 14 HG SER 2 HG SER 2 2.188 -4.477 -0.342 15 H LEU 3 H LEU 3 -1.844 -3.465 -3.435 16 HA LEU 3 HA LEU 3 -4.069 -3.769 -1.533 17 HB2 LEU 3 HB2 LEU 3 -3.960 -2.878 -4.395 18 HB3 LEU 3 HB3 LEU 3 -5.465 -3.416 -3.654 19 HG LEU 3 HG LEU 3 -4.097 -1.367 -2.095 20 HD11 LEU 3 HD11 LEU 3 -3.371 -0.282 -3.977 21 HD12 LEU 3 HD12 LEU 3 -4.997 0.383 -3.827 22 HD13 LEU 3 HD13 LEU 3 -4.678 -0.912 -4.980 23 HD21 LEU 3 HD21 LEU 3 -6.246 -1.631 -1.414 24 HD22 LEU 3 HD22 LEU 3 -6.821 -2.070 -3.023 25 HD23 LEU 3 HD23 LEU 3 -6.513 -0.379 -2.628 26 H LYS 4 H LYS 4 -4.968 -5.704 -1.293 27 HA LYS 4 HA LYS 4 -3.976 -8.035 -2.413 28 HB2 LYS 4 HB2 LYS 4 -6.722 -7.501 -1.267 29 HB3 LYS 4 HB3 LYS 4 -6.079 -9.104 -1.601 30 HG2 LYS 4 HG2 LYS 4 -4.417 -7.358 0.101 31 HG3 LYS 4 HG3 LYS 4 -5.938 -7.924 0.796 32 HD2 LYS 4 HD2 LYS 4 -5.091 -10.238 -0.184 33 HD3 LYS 4 HD3 LYS 4 -3.519 -9.457 -0.005 34 HE2 LYS 4 HE2 LYS 4 -4.821 -8.891 2.371 35 HE3 LYS 4 HE3 LYS 4 -5.300 -10.550 2.013 36 HZ1 LYS 4 HZ1 LYS 4 -2.593 -9.467 2.459 37 HZ2 LYS 4 HZ2 LYS 4 -2.811 -10.908 1.601 38 HZ3 LYS 4 HZ3 LYS 4 -3.344 -10.789 3.202 39 H SER 5 H SER 5 -6.422 -5.855 -3.608 40 HA SER 5 HA SER 5 -7.687 -7.508 -5.471 41 HB2 SER 5 HB2 SER 5 -8.050 -5.264 -6.719 42 HB3 SER 5 HB3 SER 5 -8.730 -5.440 -5.101 43 HG SER 5 HG SER 5 -6.270 -4.178 -5.751 44 H ASP 6 H ASP 6 -4.549 -6.075 -5.491 45 HA ASP 6 HA ASP 6 -3.978 -5.906 -8.199 46 HB2 ASP 6 HB2 ASP 6 -2.269 -6.530 -5.803 47 HB3 ASP 6 HB3 ASP 6 -1.580 -6.493 -7.424 48 H GLU 7 H GLU 7 -4.056 -8.715 -6.090 49 HA GLU 7 HA GLU 7 -2.816 -10.536 -7.857 50 HB2 GLU 7 HB2 GLU 7 -3.982 -10.617 -5.276 51 HB3 GLU 7 HB3 GLU 7 -4.775 -11.858 -6.236 52 HG2 GLU 7 HG2 GLU 7 -1.816 -11.691 -6.349 53 HG3 GLU 7 HG3 GLU 7 -2.560 -12.332 -4.885 54 H VAL 8 H VAL 8 -6.253 -9.883 -7.195 55 HA VAL 8 HA VAL 8 -7.434 -11.693 -8.886 56 HB VAL 8 HB VAL 8 -8.280 -8.873 -8.236 57 HG11 VAL 8 HG11 VAL 8 -10.561 -9.685 -9.002 58 HG12 VAL 8 HG12 VAL 8 -9.386 -9.324 -10.268 59 HG13 VAL 8 HG13 VAL 8 -9.708 -10.997 -9.813 60 HG21 VAL 8 HG21 VAL 8 -8.994 -11.590 -7.164 61 HG22 VAL 8 HG22 VAL 8 -8.306 -10.218 -6.296 62 HG23 VAL 8 HG23 VAL 8 -9.977 -10.158 -6.856 63 H PHE 9 H PHE 9 -6.374 -8.397 -9.718 64 HA PHE 9 HA PHE 9 -7.113 -8.467 -12.416 65 HB2 PHE 9 HB2 PHE 9 -5.120 -6.872 -10.844 66 HB3 PHE 9 HB3 PHE 9 -5.164 -6.728 -12.599 67 HD1 PHE 9 HD2 PHE 9 -8.053 -6.924 -13.121 68 HD2 PHE 9 HD1 PHE 9 -5.932 -4.844 -10.073 69 HE1 PHE 9 HE2 PHE 9 -9.901 -5.310 -12.942 70 HE2 PHE 9 HE1 PHE 9 -7.777 -3.226 -9.888 71 HZ PHE 9 HZ PHE 9 -9.764 -3.457 -11.324 72 H ALA 10 H ALA 10 -4.237 -9.616 -10.770 73 HA ALA 10 HA ALA 10 -2.654 -10.066 -13.073 74 HB1 ALA 10 HB1 ALA 10 -1.106 -10.575 -11.566 75 HB2 ALA 10 HB2 ALA 10 -2.318 -10.304 -10.313 76 HB3 ALA 10 HB3 ALA 10 -2.062 -11.926 -10.956 77 H LYS 11 H LYS 11 -4.809 -12.172 -11.197 78 HA LYS 11 HA LYS 11 -4.336 -14.489 -12.776 79 HB2 LYS 11 HB2 LYS 11 -6.803 -13.951 -11.129 80 HB3 LYS 11 HB3 LYS 11 -6.096 -15.508 -11.538 81 HG2 LYS 11 HG2 LYS 11 -4.991 -13.443 -9.651 82 HG3 LYS 11 HG3 LYS 11 -5.617 -15.044 -9.250 83 HD2 LYS 11 HD2 LYS 11 -3.164 -14.469 -10.912 84 HD3 LYS 11 HD3 LYS 11 -3.171 -15.011 -9.233 85 HE2 LYS 11 HE2 LYS 11 -4.678 -16.938 -10.287 86 HE3 LYS 11 HE3 LYS 11 -3.753 -16.510 -11.726 87 HZ1 LYS 11 HZ1 LYS 11 -2.650 -17.364 -9.105 88 HZ2 LYS 11 HZ2 LYS 11 -1.714 -16.842 -10.414 89 HZ3 LYS 11 HZ3 LYS 11 -2.636 -18.254 -10.544 90 H ILE 12 H ILE 12 -6.938 -12.074 -12.721 91 HA ILE 12 HA ILE 12 -8.545 -13.207 -14.709 92 HB ILE 12 HB ILE 12 -8.188 -10.323 -13.905 93 HG12 ILE 12 HG12 ILE 12 -10.422 -12.281 -13.334 94 HG13 ILE 12 HG13 ILE 12 -9.115 -11.911 -12.215 95 HG21 ILE 12 HG21 ILE 12 -10.000 -11.579 -15.927 96 HG22 ILE 12 HG22 ILE 12 -10.505 -10.138 -15.045 97 HG23 ILE 12 HG23 ILE 12 -9.052 -10.097 -16.043 98 HD11 ILE 12 HD11 ILE 12 -11.014 -10.653 -11.558 99 HD12 ILE 12 HD12 ILE 12 -9.860 -9.528 -12.275 100 HD13 ILE 12 HD13 ILE 12 -11.265 -10.059 -13.200 101 H ALA 13 H ALA 13 -5.806 -10.990 -14.934 102 HA ALA 13 HA ALA 13 -6.008 -10.395 -17.671 103 HB1 ALA 13 HB1 ALA 13 -4.596 -9.132 -16.117 104 HB2 ALA 13 HB2 ALA 13 -3.519 -10.522 -15.972 105 HB3 ALA 13 HB3 ALA 13 -3.684 -9.692 -17.520 106 H LYS 14 H LYS 14 -4.295 -12.984 -15.964 107 HA LYS 14 HA LYS 14 -2.933 -14.094 -18.124 108 HB2 LYS 14 HB2 LYS 14 -4.102 -15.487 -15.709 109 HB3 LYS 14 HB3 LYS 14 -2.918 -16.191 -16.802 110 HG2 LYS 14 HG2 LYS 14 -1.929 -13.679 -15.916 111 HG3 LYS 14 HG3 LYS 14 -2.474 -14.596 -14.510 112 HD2 LYS 14 HD2 LYS 14 -1.159 -16.550 -15.458 113 HD3 LYS 14 HD3 LYS 14 -0.440 -15.393 -16.580 114 HE2 LYS 14 HE2 LYS 14 0.280 -14.044 -14.609 115 HE3 LYS 14 HE3 LYS 14 -0.302 -15.342 -13.568 116 HZ1 LYS 14 HZ1 LYS 14 2.034 -15.280 -15.333 117 HZ2 LYS 14 HZ2 LYS 14 1.252 -16.762 -15.104 118 HZ3 LYS 14 HZ3 LYS 14 1.876 -15.921 -13.775 119 H ARG 15 H ARG 15 -6.261 -14.507 -17.069 120 HA ARG 15 HA ARG 15 -6.873 -16.677 -18.797 121 HB2 ARG 15 HB2 ARG 15 -8.678 -14.637 -17.485 122 HB3 ARG 15 HB3 ARG 15 -9.239 -16.084 -18.312 123 HG2 ARG 15 HG2 ARG 15 -7.240 -16.643 -16.271 124 HG3 ARG 15 HG3 ARG 15 -8.692 -15.865 -15.635 125 HD2 ARG 15 HD2 ARG 15 -8.906 -18.293 -15.587 126 HD3 ARG 15 HD3 ARG 15 -10.076 -17.576 -16.693 127 HE ARG 15 HE ARG 15 -7.651 -18.398 -17.986 128 HH11 ARG 15 HH11 ARG 15 -10.771 -19.447 -16.851 129 HH12 ARG 15 HH12 ARG 15 -10.872 -20.776 -17.958 130 HH21 ARG 15 HH21 ARG 15 -7.772 -20.145 -19.447 131 HH22 ARG 15 HH22 ARG 15 -9.165 -21.173 -19.433 132 H LEU 16 H LEU 16 -6.736 -13.234 -19.204 133 HA LEU 16 HA LEU 16 -8.375 -12.985 -21.482 134 HB2 LEU 16 HB2 LEU 16 -5.979 -11.331 -20.703 135 HB3 LEU 16 HB3 LEU 16 -7.231 -10.866 -21.853 136 HG LEU 16 HG LEU 16 -7.520 -11.186 -18.870 137 HD11 LEU 16 HD11 LEU 16 -6.562 -9.102 -19.290 138 HD12 LEU 16 HD12 LEU 16 -8.289 -8.762 -19.180 139 HD13 LEU 16 HD13 LEU 16 -7.508 -8.857 -20.758 140 HD21 LEU 16 HD21 LEU 16 -9.865 -10.244 -19.447 141 HD22 LEU 16 HD22 LEU 16 -9.564 -11.974 -19.618 142 HD23 LEU 16 HD23 LEU 16 -9.561 -10.932 -21.042 143 H GLU 17 H GLU 17 -5.203 -14.244 -21.046 144 HA GLU 17 HA GLU 17 -4.384 -13.927 -23.789 145 HB2 GLU 17 HB2 GLU 17 -3.210 -15.593 -21.556 146 HB3 GLU 17 HB3 GLU 17 -2.462 -15.340 -23.126 147 HG2 GLU 17 HG2 GLU 17 -2.482 -12.879 -22.620 148 HG3 GLU 17 HG3 GLU 17 -2.964 -13.302 -20.978 149 H SER 18 H SER 18 -6.406 -16.048 -22.125 150 HA SER 18 HA SER 18 -5.930 -18.298 -23.918 151 HB2 SER 18 HB2 SER 18 -6.818 -18.082 -21.264 152 HB3 SER 18 HB3 SER 18 -8.224 -18.619 -22.183 153 HG SER 18 HG SER 18 -6.497 -20.200 -21.323 154 H ILE 19 H ILE 19 -7.930 -15.558 -23.676 155 HA ILE 19 HA ILE 19 -10.306 -16.436 -24.856 156 HB ILE 19 HB ILE 19 -8.999 -13.728 -25.143 157 HG12 ILE 19 HG12 ILE 19 -11.091 -14.654 -23.164 158 HG13 ILE 19 HG13 ILE 19 -9.378 -14.488 -22.792 159 HG21 ILE 19 HG21 ILE 19 -11.623 -13.220 -25.259 160 HG22 ILE 19 HG22 ILE 19 -10.640 -13.533 -26.689 161 HG23 ILE 19 HG23 ILE 19 -11.610 -14.827 -25.985 162 HD11 ILE 19 HD11 ILE 19 -11.333 -12.321 -23.491 163 HD12 ILE 19 HD12 ILE 19 -10.451 -12.551 -21.981 164 HD13 ILE 19 HD13 ILE 19 -9.588 -12.070 -23.442 165 H ASP 20 H ASP 20 -11.030 -16.540 -26.964 166 HA ASP 20 HA ASP 20 -8.948 -16.394 -29.045 167 HB2 ASP 20 HB2 ASP 20 -10.542 -18.614 -28.248 168 HB3 ASP 20 HB3 ASP 20 -11.065 -18.128 -29.858 169 HA PRO 21 HA PRO 21 -11.485 -13.589 -31.271 170 HB2 PRO 21 HB2 PRO 21 -10.852 -14.233 -33.831 171 HB3 PRO 21 HB3 PRO 21 -9.742 -13.379 -32.752 172 HG2 PRO 21 HG2 PRO 21 -9.828 -16.284 -33.468 173 HG3 PRO 21 HG3 PRO 21 -8.426 -15.209 -33.323 174 HD2 PRO 21 HD2 PRO 21 -9.137 -16.946 -31.372 175 HD3 PRO 21 HD3 PRO 21 -8.372 -15.382 -31.025 176 H ALA 22 H ALA 22 -11.801 -17.004 -31.784 177 HA ALA 22 HA ALA 22 -13.930 -17.041 -33.613 178 HB1 ALA 22 HB1 ALA 22 -12.612 -19.023 -33.060 179 HB2 ALA 22 HB2 ALA 22 -13.300 -19.030 -31.435 180 HB3 ALA 22 HB3 ALA 22 -14.337 -19.314 -32.833 181 H ASN 23 H ASN 23 -13.945 -17.107 -30.054 182 HA ASN 23 HA ASN 23 -16.821 -16.483 -30.129 183 HB2 ASN 23 HB2 ASN 23 -15.433 -18.441 -28.692 184 HB3 ASN 23 HB3 ASN 23 -15.811 -17.195 -27.505 185 HD21 ASN 23 HD21 ASN 23 -17.142 -19.445 -29.820 186 HD22 ASN 23 HD22 ASN 23 -18.744 -19.463 -29.173 187 H ARG 24 H ARG 24 -17.286 -14.419 -29.806 188 HA ARG 24 HA ARG 24 -16.122 -12.970 -27.604 189 HB2 ARG 24 HB2 ARG 24 -15.385 -12.388 -30.433 190 HB3 ARG 24 HB3 ARG 24 -15.642 -11.025 -29.352 191 HG2 ARG 24 HG2 ARG 24 -14.029 -12.566 -27.829 192 HG3 ARG 24 HG3 ARG 24 -13.454 -12.980 -29.445 193 HD2 ARG 24 HD2 ARG 24 -13.870 -10.139 -29.199 194 HD3 ARG 24 HD3 ARG 24 -12.794 -10.725 -27.932 195 HE ARG 24 HE ARG 24 -11.199 -11.170 -29.525 196 HH11 ARG 24 HH11 ARG 24 -14.248 -10.512 -31.071 197 HH12 ARG 24 HH12 ARG 24 -13.570 -10.428 -32.664 198 HH21 ARG 24 HH21 ARG 24 -10.295 -11.063 -31.617 199 HH22 ARG 24 HH22 ARG 24 -11.322 -10.743 -32.973 200 H GLN 25 H GLN 25 -18.340 -13.030 -26.973 201 HA GLN 25 HA GLN 25 -20.518 -12.151 -28.426 202 HB2 GLN 25 HB2 GLN 25 -19.956 -12.777 -25.712 203 HB3 GLN 25 HB3 GLN 25 -20.813 -11.242 -25.733 204 HG2 GLN 25 HG2 GLN 25 -22.565 -12.692 -25.623 205 HG3 GLN 25 HG3 GLN 25 -22.414 -12.510 -27.370 206 HE21 GLN 25 HE21 GLN 25 -23.416 -14.707 -25.583 207 HE22 GLN 25 HE22 GLN 25 -22.581 -16.119 -26.125 208 H VAL 26 H VAL 26 -18.471 -10.213 -26.244 209 HA VAL 26 HA VAL 26 -18.602 -7.920 -27.924 210 HB VAL 26 HB VAL 26 -20.877 -7.836 -26.915 211 HG11 VAL 26 HG11 VAL 26 -21.241 -7.534 -24.625 212 HG12 VAL 26 HG12 VAL 26 -20.030 -8.815 -24.704 213 HG13 VAL 26 HG13 VAL 26 -19.545 -7.165 -24.311 214 HG21 VAL 26 HG21 VAL 26 -20.844 -5.577 -26.886 215 HG22 VAL 26 HG22 VAL 26 -19.523 -5.502 -25.721 216 HG23 VAL 26 HG23 VAL 26 -19.181 -5.811 -27.423 217 H GLU 27 H GLU 27 -17.004 -6.491 -27.441 218 HA GLU 27 HA GLU 27 -15.656 -6.751 -24.844 219 HB2 GLU 27 HB2 GLU 27 -14.424 -6.957 -27.578 220 HB3 GLU 27 HB3 GLU 27 -13.477 -6.415 -26.199 221 HG2 GLU 27 HG2 GLU 27 -14.964 -9.027 -26.296 222 HG3 GLU 27 HG3 GLU 27 -13.264 -8.836 -26.719 223 H HIS 28 H HIS 28 -15.529 -4.843 -23.884 224 HA HIS 28 HA HIS 28 -15.057 -2.447 -25.504 225 HB2 HIS 28 HB2 HIS 28 -17.400 -2.999 -23.763 226 HB3 HIS 28 HB3 HIS 28 -16.710 -1.381 -23.680 227 HD1 HIS 28 HD1 HIS 28 -16.362 -0.306 -26.251 228 HD2 HIS 28 HD2 HIS 28 -19.284 -3.203 -25.679 229 HE1 HIS 28 HE1 HIS 28 -17.945 -0.056 -28.189 230 H VAL 29 H VAL 29 -14.603 -0.518 -23.986 231 HA VAL 29 HA VAL 29 -12.413 -1.272 -22.304 232 HB VAL 29 HB VAL 29 -12.088 0.742 -23.469 233 HG11 VAL 29 HG11 VAL 29 -13.720 2.693 -23.079 234 HG12 VAL 29 HG12 VAL 29 -14.210 1.400 -24.175 235 HG13 VAL 29 HG13 VAL 29 -14.845 1.451 -22.530 236 HG21 VAL 29 HG21 VAL 29 -12.872 1.581 -20.681 237 HG22 VAL 29 HG22 VAL 29 -11.355 0.788 -21.104 238 HG23 VAL 29 HG23 VAL 29 -11.721 2.390 -21.744 239 H TYR 30 H TYR 30 -12.231 -1.183 -20.100 240 HA TYR 30 HA TYR 30 -14.583 -0.397 -18.540 241 HB2 TYR 30 HB2 TYR 30 -13.169 -3.060 -18.340 242 HB3 TYR 30 HB3 TYR 30 -14.293 -2.454 -17.128 243 HD1 TYR 30 HD2 TYR 30 -16.689 -2.024 -17.811 244 HD2 TYR 30 HD1 TYR 30 -13.948 -4.138 -20.285 245 HE1 TYR 30 HE2 TYR 30 -18.572 -2.970 -19.079 246 HE2 TYR 30 HE1 TYR 30 -15.824 -5.089 -21.561 247 HH TYR 30 HH TYR 30 -18.828 -5.257 -20.564 248 H LYS 31 H LYS 31 -14.036 0.869 -16.898 249 HA LYS 31 HA LYS 31 -11.220 0.942 -16.064 250 HB2 LYS 31 HB2 LYS 31 -13.228 2.967 -16.540 251 HB3 LYS 31 HB3 LYS 31 -12.579 3.110 -14.912 252 HG2 LYS 31 HG2 LYS 31 -10.318 2.758 -16.411 253 HG3 LYS 31 HG3 LYS 31 -11.346 3.711 -17.484 254 HD2 LYS 31 HD2 LYS 31 -11.124 4.534 -14.631 255 HD3 LYS 31 HD3 LYS 31 -9.763 4.860 -15.707 256 HE2 LYS 31 HE2 LYS 31 -12.402 5.570 -16.787 257 HE3 LYS 31 HE3 LYS 31 -11.901 6.502 -15.377 258 HZ1 LYS 31 HZ1 LYS 31 -11.035 6.745 -18.046 259 HZ2 LYS 31 HZ2 LYS 31 -9.708 6.344 -17.076 260 HZ3 LYS 31 HZ3 LYS 31 -10.638 7.710 -16.713 261 H PHE 32 H PHE 32 -10.618 0.636 -13.971 262 HA PHE 32 HA PHE 32 -12.757 -0.087 -12.077 263 HB2 PHE 32 HB2 PHE 32 -9.974 -1.239 -12.343 264 HB3 PHE 32 HB3 PHE 32 -11.077 -1.610 -11.022 265 HD1 PHE 32 HD2 PHE 32 -13.418 -2.519 -11.734 266 HD2 PHE 32 HD1 PHE 32 -9.956 -2.584 -14.211 267 HE1 PHE 32 HE2 PHE 32 -14.415 -4.324 -13.075 268 HE2 PHE 32 HE1 PHE 32 -10.949 -4.389 -15.556 269 HZ PHE 32 HZ PHE 32 -13.180 -5.263 -14.988 270 H ARG 33 H ARG 33 -12.809 0.934 -10.167 271 HA ARG 33 HA ARG 33 -10.597 2.777 -9.555 272 HB2 ARG 33 HB2 ARG 33 -13.555 2.927 -9.094 273 HB3 ARG 33 HB3 ARG 33 -12.460 3.836 -8.060 274 HG2 ARG 33 HG2 ARG 33 -11.571 5.011 -9.983 275 HG3 ARG 33 HG3 ARG 33 -12.592 4.056 -11.060 276 HD2 ARG 33 HD2 ARG 33 -14.483 5.191 -10.499 277 HD3 ARG 33 HD3 ARG 33 -13.933 5.508 -8.854 278 HE ARG 33 HE ARG 33 -12.321 6.978 -10.588 279 HH11 ARG 33 HH11 ARG 33 -15.649 6.848 -9.572 280 HH12 ARG 33 HH12 ARG 33 -15.931 8.537 -9.833 281 HH21 ARG 33 HH21 ARG 33 -12.680 9.204 -10.935 282 HH22 ARG 33 HH22 ARG 33 -14.242 9.876 -10.609 283 H ILE 34 H ILE 34 -9.303 2.062 -8.004 284 HA ILE 34 HA ILE 34 -10.298 0.177 -6.017 285 HB ILE 34 HB ILE 34 -7.489 1.204 -6.435 286 HG12 ILE 34 HG12 ILE 34 -8.401 -0.079 -8.366 287 HG13 ILE 34 HG13 ILE 34 -7.047 -0.883 -7.579 288 HG21 ILE 34 HG21 ILE 34 -7.063 -1.046 -5.170 289 HG22 ILE 34 HG22 ILE 34 -7.461 0.420 -4.275 290 HG23 ILE 34 HG23 ILE 34 -8.706 -0.791 -4.583 291 HD11 ILE 34 HD11 ILE 34 -9.460 -1.773 -6.368 292 HD12 ILE 34 HD12 ILE 34 -9.613 -1.904 -8.120 293 HD13 ILE 34 HD13 ILE 34 -8.272 -2.694 -7.289 294 H THR 35 H THR 35 -11.156 0.937 -4.208 295 HA THR 35 HA THR 35 -10.137 3.473 -3.111 296 HB THR 35 HB THR 35 -12.254 3.782 -2.007 297 HG1 THR 35 HG1 THR 35 -13.944 2.155 -2.467 298 HG21 THR 35 HG21 THR 35 -13.012 4.672 -3.902 299 HG22 THR 35 HG22 THR 35 -13.613 3.089 -4.396 300 HG23 THR 35 HG23 THR 35 -11.981 3.590 -4.838 301 H GLN 36 H GLN 36 -9.586 3.624 -0.951 302 HA GLN 36 HA GLN 36 -9.106 1.056 0.377 303 HB2 GLN 36 HB2 GLN 36 -7.448 3.212 -0.035 304 HB3 GLN 36 HB3 GLN 36 -7.975 3.453 1.625 305 HG2 GLN 36 HG2 GLN 36 -7.065 0.741 0.855 306 HG3 GLN 36 HG3 GLN 36 -5.847 2.007 1.002 307 HE21 GLN 36 HE21 GLN 36 -6.299 -0.388 2.623 308 HE22 GLN 36 HE22 GLN 36 -6.508 0.171 4.244 309 H GLY 37 H GLY 37 -10.913 0.533 1.497 310 HA2 GLY 37 HA2 GLY 37 -12.218 0.569 3.419 311 HA3 GLY 37 HA3 GLY 37 -11.540 2.141 3.816 312 H GLY 38 H GLY 38 -12.214 3.320 1.234 313 HA2 GLY 38 HA2 GLY 38 -14.819 3.155 0.423 314 HA3 GLY 38 HA3 GLY 38 -14.891 4.131 1.883 315 H LYS 39 H LYS 39 -11.936 4.623 0.461 316 HA LYS 39 HA LYS 39 -12.926 6.905 -1.117 317 HB2 LYS 39 HB2 LYS 39 -12.040 7.674 1.050 318 HB3 LYS 39 HB3 LYS 39 -10.510 6.879 0.703 319 HG2 LYS 39 HG2 LYS 39 -10.178 8.357 -1.217 320 HG3 LYS 39 HG3 LYS 39 -11.710 9.158 -0.860 321 HD2 LYS 39 HD2 LYS 39 -10.824 9.817 1.342 322 HD3 LYS 39 HD3 LYS 39 -9.282 9.060 0.933 323 HE2 LYS 39 HE2 LYS 39 -8.647 10.786 -0.350 324 HE3 LYS 39 HE3 LYS 39 -10.243 10.950 -1.081 325 HZ1 LYS 39 HZ1 LYS 39 -10.837 11.910 1.250 326 HZ2 LYS 39 HZ2 LYS 39 -10.085 12.889 0.094 327 HZ3 LYS 39 HZ3 LYS 39 -9.174 12.208 1.346 328 H VAL 40 H VAL 40 -12.096 7.105 -3.107 329 HA VAL 40 HA VAL 40 -10.649 5.079 -4.334 330 HB VAL 40 HB VAL 40 -10.956 7.972 -5.137 331 HG11 VAL 40 HG11 VAL 40 -9.241 7.549 -6.528 332 HG12 VAL 40 HG12 VAL 40 -9.381 5.800 -6.335 333 HG13 VAL 40 HG13 VAL 40 -10.447 6.654 -7.452 334 HG21 VAL 40 HG21 VAL 40 -12.369 5.440 -5.960 335 HG22 VAL 40 HG22 VAL 40 -13.053 6.811 -5.086 336 HG23 VAL 40 HG23 VAL 40 -12.566 6.993 -6.771 337 H VAL 41 H VAL 41 -8.534 4.654 -4.660 338 HA VAL 41 HA VAL 41 -6.556 6.626 -3.741 339 HB VAL 41 HB VAL 41 -5.199 4.656 -2.875 340 HG11 VAL 41 HG11 VAL 41 -7.700 4.980 -1.273 341 HG12 VAL 41 HG12 VAL 41 -6.020 4.943 -0.735 342 HG13 VAL 41 HG13 VAL 41 -6.652 6.369 -1.560 343 HG21 VAL 41 HG21 VAL 41 -6.700 2.973 -4.032 344 HG22 VAL 41 HG22 VAL 41 -6.274 2.617 -2.358 345 HG23 VAL 41 HG23 VAL 41 -7.866 3.272 -2.742 346 H LYS 42 H LYS 42 -7.665 4.768 -6.215 347 HA LYS 42 HA LYS 42 -5.519 5.322 -7.927 348 HB2 LYS 42 HB2 LYS 42 -4.874 3.213 -6.302 349 HB3 LYS 42 HB3 LYS 42 -5.547 2.392 -7.704 350 HG2 LYS 42 HG2 LYS 42 -3.970 3.651 -9.140 351 HG3 LYS 42 HG3 LYS 42 -3.248 4.336 -7.682 352 HD2 LYS 42 HD2 LYS 42 -3.320 1.585 -7.227 353 HD3 LYS 42 HD3 LYS 42 -2.823 1.755 -8.913 354 HE2 LYS 42 HE2 LYS 42 -1.544 3.467 -6.830 355 HE3 LYS 42 HE3 LYS 42 -1.049 1.782 -6.981 356 HZ1 LYS 42 HZ1 LYS 42 0.395 2.839 -8.396 357 HZ2 LYS 42 HZ2 LYS 42 -0.741 3.985 -8.904 358 HZ3 LYS 42 HZ3 LYS 42 -0.831 2.394 -9.473 359 H ASN 43 H ASN 43 -5.805 4.367 -10.085 360 HA ASN 43 HA ASN 43 -8.406 3.120 -10.551 361 HB2 ASN 43 HB2 ASN 43 -7.583 5.487 -12.216 362 HB3 ASN 43 HB3 ASN 43 -9.172 4.740 -12.077 363 HD21 ASN 43 HD21 ASN 43 -7.519 7.404 -11.327 364 HD22 ASN 43 HD22 ASN 43 -8.344 7.896 -9.890 365 H TRP 44 H TRP 44 -8.240 1.513 -11.968 366 HA TRP 44 HA TRP 44 -5.836 1.396 -13.657 367 HB2 TRP 44 HB2 TRP 44 -7.628 -0.764 -12.551 368 HB3 TRP 44 HB3 TRP 44 -6.442 -1.074 -13.816 369 HD1 TRP 44 HD1 TRP 44 -6.674 -0.139 -10.100 370 HE1 TRP 44 HE1 TRP 44 -4.409 -0.650 -8.988 371 HE3 TRP 44 HE3 TRP 44 -3.974 -1.340 -14.272 372 HZ2 TRP 44 HZ2 TRP 44 -1.821 -1.456 -9.776 373 HZ3 TRP 44 HZ3 TRP 44 -1.610 -1.969 -14.006 374 HH2 TRP 44 HH2 TRP 44 -0.558 -2.025 -11.804 375 H VAL 45 H VAL 45 -6.023 0.644 -15.832 376 HA VAL 45 HA VAL 45 -8.691 1.110 -16.996 377 HB VAL 45 HB VAL 45 -7.051 2.848 -17.608 378 HG11 VAL 45 HG11 VAL 45 -5.504 0.476 -18.594 379 HG12 VAL 45 HG12 VAL 45 -5.257 2.082 -19.281 380 HG13 VAL 45 HG13 VAL 45 -4.966 1.802 -17.564 381 HG21 VAL 45 HG21 VAL 45 -7.325 1.492 -20.185 382 HG22 VAL 45 HG22 VAL 45 -8.814 1.546 -19.241 383 HG23 VAL 45 HG23 VAL 45 -7.970 3.042 -19.644 384 H MET 46 H MET 46 -9.418 -0.252 -18.615 385 HA MET 46 HA MET 46 -7.864 -2.732 -18.954 386 HB2 MET 46 HB2 MET 46 -10.017 -2.985 -17.743 387 HB3 MET 46 HB3 MET 46 -10.858 -2.367 -19.158 388 HG2 MET 46 HG2 MET 46 -10.708 -4.312 -20.260 389 HG3 MET 46 HG3 MET 46 -9.076 -4.634 -19.680 390 HE1 MET 46 HE1 MET 46 -12.478 -5.357 -19.811 391 HE2 MET 46 HE2 MET 46 -12.745 -6.683 -18.680 392 HE3 MET 46 HE3 MET 46 -13.053 -5.020 -18.178 393 H ASP 47 H ASP 47 -6.968 -2.913 -20.890 394 HA ASP 47 HA ASP 47 -7.491 -1.285 -23.088 395 HB2 ASP 47 HB2 ASP 47 -5.659 -3.287 -22.459 396 HB3 ASP 47 HB3 ASP 47 -6.508 -3.906 -23.873 397 H LEU 48 H LEU 48 -7.795 -2.859 -25.310 398 HA LEU 48 HA LEU 48 -10.211 -4.432 -25.049 399 HB2 LEU 48 HB2 LEU 48 -10.714 -1.866 -25.280 400 HB3 LEU 48 HB3 LEU 48 -10.354 -2.163 -26.979 401 HG LEU 48 HG LEU 48 -12.590 -3.319 -25.329 402 HD11 LEU 48 HD11 LEU 48 -13.873 -2.378 -27.335 403 HD12 LEU 48 HD12 LEU 48 -12.396 -1.484 -27.692 404 HD13 LEU 48 HD13 LEU 48 -13.229 -1.234 -26.158 405 HD21 LEU 48 HD21 LEU 48 -13.192 -4.518 -27.464 406 HD22 LEU 48 HD22 LEU 48 -11.803 -5.163 -26.589 407 HD23 LEU 48 HD23 LEU 48 -11.557 -4.168 -28.025 408 H LYS 49 H LYS 49 -8.221 -2.708 -27.455 409 HA LYS 49 HA LYS 49 -8.579 -4.707 -29.456 410 HB2 LYS 49 HB2 LYS 49 -7.325 -2.122 -29.239 411 HB3 LYS 49 HB3 LYS 49 -6.239 -3.250 -30.039 412 HG2 LYS 49 HG2 LYS 49 -7.868 -3.724 -31.725 413 HG3 LYS 49 HG3 LYS 49 -9.096 -2.790 -30.867 414 HD2 LYS 49 HD2 LYS 49 -7.846 -0.748 -31.234 415 HD3 LYS 49 HD3 LYS 49 -6.534 -1.655 -31.991 416 HE2 LYS 49 HE2 LYS 49 -7.564 -1.609 -33.961 417 HE3 LYS 49 HE3 LYS 49 -9.040 -2.271 -33.260 418 HZ1 LYS 49 HZ1 LYS 49 -8.362 0.472 -33.893 419 HZ2 LYS 49 HZ2 LYS 49 -9.141 0.258 -32.407 420 HZ3 LYS 49 HZ3 LYS 49 -9.874 -0.284 -33.833 421 H ASN 50 H ASN 50 -6.335 -4.234 -26.855 422 HA ASN 50 HA ASN 50 -4.630 -6.400 -27.869 423 HB2 ASN 50 HB2 ASN 50 -3.701 -4.109 -27.079 424 HB3 ASN 50 HB3 ASN 50 -3.999 -4.722 -25.455 425 HD21 ASN 50 HD21 ASN 50 -2.320 -5.408 -28.474 426 HD22 ASN 50 HD22 ASN 50 -1.031 -6.311 -27.762 427 H VAL 51 H VAL 51 -6.919 -5.582 -25.420 428 HA VAL 51 HA VAL 51 -7.949 -6.822 -23.811 429 HB VAL 51 HB VAL 51 -6.490 -9.264 -24.782 430 HG11 VAL 51 HG11 VAL 51 -8.102 -10.460 -23.731 431 HG12 VAL 51 HG12 VAL 51 -8.203 -8.999 -22.745 432 HG13 VAL 51 HG13 VAL 51 -9.356 -9.262 -24.054 433 HG21 VAL 51 HG21 VAL 51 -8.734 -9.395 -26.218 434 HG22 VAL 51 HG22 VAL 51 -8.534 -7.643 -26.187 435 HG23 VAL 51 HG23 VAL 51 -7.253 -8.665 -26.837 436 H LYS 52 H LYS 52 -5.630 -5.479 -23.106 437 HA LYS 52 HA LYS 52 -4.431 -7.316 -21.137 438 HB2 LYS 52 HB2 LYS 52 -3.015 -6.191 -23.096 439 HB3 LYS 52 HB3 LYS 52 -2.975 -4.851 -21.957 440 HG2 LYS 52 HG2 LYS 52 -1.303 -5.830 -20.896 441 HG3 LYS 52 HG3 LYS 52 -2.362 -7.185 -20.499 442 HD2 LYS 52 HD2 LYS 52 -1.597 -8.470 -22.245 443 HD3 LYS 52 HD3 LYS 52 -1.127 -7.069 -23.210 444 HE2 LYS 52 HE2 LYS 52 0.948 -7.717 -22.579 445 HE3 LYS 52 HE3 LYS 52 0.555 -6.760 -21.152 446 HZ1 LYS 52 HZ1 LYS 52 0.264 -9.704 -21.417 447 HZ2 LYS 52 HZ2 LYS 52 -0.182 -8.802 -20.057 448 HZ3 LYS 52 HZ3 LYS 52 1.444 -8.894 -20.514 449 H LEU 53 H LEU 53 -3.350 -5.894 -19.311 450 HA LEU 53 HA LEU 53 -5.211 -3.751 -18.545 451 HB2 LEU 53 HB2 LEU 53 -5.050 -6.297 -17.368 452 HB3 LEU 53 HB3 LEU 53 -4.272 -5.187 -16.242 453 HG LEU 53 HG LEU 53 -6.334 -3.804 -16.262 454 HD11 LEU 53 HD11 LEU 53 -8.274 -4.429 -17.354 455 HD12 LEU 53 HD12 LEU 53 -7.742 -6.097 -17.565 456 HD13 LEU 53 HD13 LEU 53 -7.029 -4.814 -18.542 457 HD21 LEU 53 HD21 LEU 53 -7.720 -5.956 -15.287 458 HD22 LEU 53 HD22 LEU 53 -6.539 -5.004 -14.386 459 HD23 LEU 53 HD23 LEU 53 -6.045 -6.500 -15.180 460 H VAL 54 H VAL 54 -4.233 -1.945 -17.901 461 HA VAL 54 HA VAL 54 -1.600 -2.057 -16.657 462 HB VAL 54 HB VAL 54 -1.931 -0.095 -18.888 463 HG11 VAL 54 HG11 VAL 54 0.328 -1.363 -17.389 464 HG12 VAL 54 HG12 VAL 54 0.601 -0.632 -18.972 465 HG13 VAL 54 HG13 VAL 54 -0.024 0.346 -17.644 466 HG21 VAL 54 HG21 VAL 54 -0.791 -1.729 -20.399 467 HG22 VAL 54 HG22 VAL 54 -1.127 -2.983 -19.205 468 HG23 VAL 54 HG23 VAL 54 -2.459 -2.145 -20.001 469 H GLU 55 H GLU 55 -0.920 0.111 -15.846 470 HA GLU 55 HA GLU 55 -3.178 1.397 -14.586 471 HB2 GLU 55 HB2 GLU 55 -1.368 2.762 -13.462 472 HB3 GLU 55 HB3 GLU 55 -1.312 1.030 -13.169 473 HG2 GLU 55 HG2 GLU 55 0.717 0.854 -14.042 474 HG3 GLU 55 HG3 GLU 55 0.260 1.768 -15.478 475 H SER 56 H SER 56 -4.296 2.730 -15.888 476 HA SER 56 HA SER 56 -2.975 5.124 -16.836 477 HB2 SER 56 HB2 SER 56 -3.124 3.084 -18.638 478 HB3 SER 56 HB3 SER 56 -4.643 3.922 -18.952 479 HG SER 56 HG SER 56 -3.559 5.463 -19.868 480 H ASP 57 H ASP 57 -4.658 6.602 -17.921 481 HA ASP 57 HA ASP 57 -7.237 6.289 -16.529 482 HB2 ASP 57 HB2 ASP 57 -5.320 8.336 -16.227 483 HB3 ASP 57 HB3 ASP 57 -6.655 9.043 -17.132 484 H ASP 58 H ASP 58 -6.212 5.697 -19.350 485 HA ASP 58 HA ASP 58 -7.228 7.422 -21.241 486 HB2 ASP 58 HB2 ASP 58 -5.993 5.583 -22.042 487 HB3 ASP 58 HB3 ASP 58 -7.007 4.421 -21.190 488 H ALA 59 H ALA 59 -9.201 7.583 -22.357 489 HA ALA 59 HA ALA 59 -11.503 7.710 -20.871 490 HB1 ALA 59 HB1 ALA 59 -12.666 7.480 -23.184 491 HB2 ALA 59 HB2 ALA 59 -11.606 8.856 -22.873 492 HB3 ALA 59 HB3 ALA 59 -11.017 7.484 -23.811 493 H ALA 60 H ALA 60 -13.436 6.442 -20.823 494 HA ALA 60 HA ALA 60 -13.227 3.654 -21.654 495 HB1 ALA 60 HB1 ALA 60 -13.955 2.889 -19.380 496 HB2 ALA 60 HB2 ALA 60 -12.304 3.506 -19.465 497 HB3 ALA 60 HB3 ALA 60 -13.586 4.510 -18.789 498 H GLU 61 H GLU 61 -15.342 2.476 -21.106 499 HA GLU 61 HA GLU 61 -17.544 4.265 -21.838 500 HB2 GLU 61 HB2 GLU 61 -18.456 2.551 -23.018 501 HB3 GLU 61 HB3 GLU 61 -16.794 1.980 -23.021 502 HG2 GLU 61 HG2 GLU 61 -17.250 0.511 -21.164 503 HG3 GLU 61 HG3 GLU 61 -18.890 1.142 -21.032 504 H ALA 62 H ALA 62 -16.349 2.394 -19.239 505 HA ALA 62 HA ALA 62 -18.578 3.184 -17.581 506 HB1 ALA 62 HB1 ALA 62 -19.638 1.233 -18.184 507 HB2 ALA 62 HB2 ALA 62 -18.126 0.341 -18.366 508 HB3 ALA 62 HB3 ALA 62 -18.741 0.714 -16.756 509 H THR 63 H THR 63 -18.178 2.833 -15.305 510 HA THR 63 HA THR 63 -15.367 2.250 -14.655 511 HB THR 63 HB THR 63 -16.951 4.505 -13.414 512 HG1 THR 63 HG1 THR 63 -16.333 4.855 -15.659 513 HG21 THR 63 HG21 THR 63 -14.840 5.153 -12.421 514 HG22 THR 63 HG22 THR 63 -14.011 3.836 -13.251 515 HG23 THR 63 HG23 THR 63 -15.197 3.479 -11.997 516 H LEU 64 H LEU 64 -15.107 0.874 -13.014 517 HA LEU 64 HA LEU 64 -17.435 0.317 -11.297 518 HB2 LEU 64 HB2 LEU 64 -15.567 -1.417 -12.729 519 HB3 LEU 64 HB3 LEU 64 -15.798 -1.865 -11.040 520 HG LEU 64 HG LEU 64 -18.329 -1.381 -12.358 521 HD11 LEU 64 HD11 LEU 64 -16.784 -3.708 -13.456 522 HD12 LEU 64 HD12 LEU 64 -16.855 -2.155 -14.290 523 HD13 LEU 64 HD13 LEU 64 -18.337 -3.061 -13.987 524 HD21 LEU 64 HD21 LEU 64 -17.209 -3.914 -11.175 525 HD22 LEU 64 HD22 LEU 64 -18.904 -3.458 -11.352 526 HD23 LEU 64 HD23 LEU 64 -17.873 -2.596 -10.209 527 H THR 65 H THR 65 -17.139 1.302 -9.404 528 HA THR 65 HA THR 65 -14.449 1.298 -8.212 529 HB THR 65 HB THR 65 -16.751 2.986 -7.255 530 HG1 THR 65 HG1 THR 65 -16.085 4.582 -8.670 531 HG21 THR 65 HG21 THR 65 -14.239 4.261 -7.044 532 HG22 THR 65 HG22 THR 65 -14.024 2.605 -6.478 533 HG23 THR 65 HG23 THR 65 -15.251 3.636 -5.743 534 H MET 66 H MET 66 -14.059 0.082 -6.479 535 HA MET 66 HA MET 66 -16.090 -0.487 -4.524 536 HB2 MET 66 HB2 MET 66 -16.045 -2.907 -4.740 537 HB3 MET 66 HB3 MET 66 -16.592 -2.181 -6.245 538 HG2 MET 66 HG2 MET 66 -13.789 -2.446 -6.421 539 HG3 MET 66 HG3 MET 66 -14.424 -3.967 -5.797 540 HE1 MET 66 HE1 MET 66 -14.935 -5.856 -7.554 541 HE2 MET 66 HE2 MET 66 -16.426 -5.212 -6.868 542 HE3 MET 66 HE3 MET 66 -16.322 -5.541 -8.598 543 H GLU 67 H GLU 67 -15.247 -1.390 -2.598 544 HA GLU 67 HA GLU 67 -12.651 -0.584 -1.937 545 HB2 GLU 67 HB2 GLU 67 -14.876 -1.872 -0.612 546 HB3 GLU 67 HB3 GLU 67 -13.352 -2.583 -0.100 547 HG2 GLU 67 HG2 GLU 67 -12.580 -0.157 0.252 548 HG3 GLU 67 HG3 GLU 67 -14.295 0.241 0.179 549 H ASP 68 H ASP 68 -10.796 -1.823 -1.362 550 HA ASP 68 HA ASP 68 -9.919 -3.631 -3.244 551 HB2 ASP 68 HB2 ASP 68 -8.485 -2.400 -1.605 552 HB3 ASP 68 HB3 ASP 68 -8.995 -3.544 -0.367 553 H ASP 69 H ASP 69 -11.186 -4.368 0.000 554 HA ASP 69 HA ASP 69 -10.985 -7.140 -0.123 555 HB2 ASP 69 HB2 ASP 69 -13.017 -7.031 1.492 556 HB3 ASP 69 HB3 ASP 69 -11.495 -6.298 1.991 557 H ILE 70 H ILE 70 -13.437 -4.982 -1.408 558 HA ILE 70 HA ILE 70 -15.368 -6.949 -2.031 559 HB ILE 70 HB ILE 70 -15.009 -4.421 -3.615 560 HG12 ILE 70 HG12 ILE 70 -14.795 -3.709 -1.327 561 HG13 ILE 70 HG13 ILE 70 -16.423 -3.312 -1.864 562 HG21 ILE 70 HG21 ILE 70 -16.735 -6.083 -4.274 563 HG22 ILE 70 HG22 ILE 70 -17.496 -5.856 -2.701 564 HG23 ILE 70 HG23 ILE 70 -17.398 -4.509 -3.835 565 HD11 ILE 70 HD11 ILE 70 -16.501 -4.189 0.366 566 HD12 ILE 70 HD12 ILE 70 -17.244 -5.348 -0.737 567 HD13 ILE 70 HD13 ILE 70 -15.613 -5.630 -0.129 568 H MET 71 H MET 71 -12.917 -5.348 -4.065 569 HA MET 71 HA MET 71 -13.419 -6.654 -6.448 570 HB2 MET 71 HB2 MET 71 -11.816 -4.755 -6.083 571 HB3 MET 71 HB3 MET 71 -10.673 -5.918 -5.424 572 HG2 MET 71 HG2 MET 71 -10.229 -6.851 -7.458 573 HG3 MET 71 HG3 MET 71 -11.807 -6.430 -8.119 574 HE1 MET 71 HE1 MET 71 -12.522 -4.038 -8.757 575 HE2 MET 71 HE2 MET 71 -11.894 -3.204 -7.335 576 HE3 MET 71 HE3 MET 71 -11.435 -2.662 -8.950 577 H PHE 72 H PHE 72 -11.409 -7.699 -3.728 578 HA PHE 72 HA PHE 72 -10.306 -9.985 -4.893 579 HB2 PHE 72 HB2 PHE 72 -9.986 -8.779 -2.515 580 HB3 PHE 72 HB3 PHE 72 -11.020 -10.112 -2.014 581 HD1 PHE 72 HD1 PHE 72 -8.059 -9.619 -4.237 582 HD2 PHE 72 HD2 PHE 72 -9.929 -11.951 -1.207 583 HE1 PHE 72 HE1 PHE 72 -6.101 -11.108 -4.180 584 HE2 PHE 72 HE2 PHE 72 -7.974 -13.443 -1.144 585 HZ PHE 72 HZ PHE 72 -6.056 -13.022 -2.631 586 H ALA 73 H ALA 73 -13.359 -9.520 -3.177 587 HA ALA 73 HA ALA 73 -14.140 -12.216 -3.051 588 HB1 ALA 73 HB1 ALA 73 -15.147 -10.012 -1.990 589 HB2 ALA 73 HB2 ALA 73 -16.217 -10.120 -3.388 590 HB3 ALA 73 HB3 ALA 73 -16.130 -11.455 -2.239 591 H ILE 74 H ILE 74 -14.944 -9.695 -5.436 592 HA ILE 74 HA ILE 74 -16.429 -11.450 -7.114 593 HB ILE 74 HB ILE 74 -15.134 -8.910 -8.063 594 HG12 ILE 74 HG12 ILE 74 -16.135 -8.321 -5.949 595 HG13 ILE 74 HG13 ILE 74 -17.180 -7.731 -7.237 596 HG21 ILE 74 HG21 ILE 74 -17.213 -8.763 -9.401 597 HG22 ILE 74 HG22 ILE 74 -16.261 -10.204 -9.752 598 HG23 ILE 74 HG23 ILE 74 -17.705 -10.325 -8.749 599 HD11 ILE 74 HD11 ILE 74 -17.611 -10.011 -5.356 600 HD12 ILE 74 HD12 ILE 74 -18.659 -8.637 -5.709 601 HD13 ILE 74 HD13 ILE 74 -18.470 -9.930 -6.893 602 H GLY 75 H GLY 75 -13.088 -10.905 -6.662 603 HA2 GLY 75 HA2 GLY 75 -12.327 -11.785 -9.325 604 HA3 GLY 75 HA3 GLY 75 -11.237 -11.361 -8.013 605 H THR 76 H THR 76 -12.277 -13.064 -6.026 606 HA THR 76 HA THR 76 -11.220 -15.607 -6.997 607 HB THR 76 HB THR 76 -10.964 -16.244 -4.689 608 HG1 THR 76 HG1 THR 76 -11.627 -14.579 -3.072 609 HG21 THR 76 HG21 THR 76 -9.757 -13.940 -5.821 610 HG22 THR 76 HG22 THR 76 -9.092 -15.041 -4.614 611 HG23 THR 76 HG23 THR 76 -10.009 -13.623 -4.105 612 H GLY 77 H GLY 77 -13.935 -14.697 -7.688 613 HA2 GLY 77 HA2 GLY 77 -16.100 -15.479 -7.734 614 HA3 GLY 77 HA3 GLY 77 -15.332 -17.055 -7.601 615 H ALA 78 H ALA 78 -15.001 -14.711 -5.056 616 HA ALA 78 HA ALA 78 -16.142 -16.513 -3.149 617 HB1 ALA 78 HB1 ALA 78 -14.801 -15.362 -1.811 618 HB2 ALA 78 HB2 ALA 78 -14.495 -14.186 -3.090 619 HB3 ALA 78 HB3 ALA 78 -15.852 -13.956 -1.988 620 H LEU 79 H LEU 79 -16.973 -13.094 -3.726 621 HA LEU 79 HA LEU 79 -19.783 -13.790 -3.190 622 HB2 LEU 79 HB2 LEU 79 -18.113 -11.419 -2.526 623 HB3 LEU 79 HB3 LEU 79 -19.834 -11.175 -2.819 624 HG LEU 79 HG LEU 79 -18.724 -13.069 -0.752 625 HD11 LEU 79 HD11 LEU 79 -19.239 -11.403 0.900 626 HD12 LEU 79 HD12 LEU 79 -19.853 -10.306 -0.337 627 HD13 LEU 79 HD13 LEU 79 -18.136 -10.707 -0.288 628 HD21 LEU 79 HD21 LEU 79 -21.490 -12.037 -1.350 629 HD22 LEU 79 HD22 LEU 79 -21.056 -12.888 0.132 630 HD23 LEU 79 HD23 LEU 79 -20.923 -13.705 -1.426 631 HA PRO 80 HA PRO 80 -20.834 -12.611 -7.297 632 HB2 PRO 80 HB2 PRO 80 -23.441 -11.954 -6.917 633 HB3 PRO 80 HB3 PRO 80 -22.860 -13.624 -6.912 634 HG2 PRO 80 HG2 PRO 80 -23.469 -11.823 -4.599 635 HG3 PRO 80 HG3 PRO 80 -23.865 -13.538 -4.817 636 HD2 PRO 80 HD2 PRO 80 -21.775 -12.706 -3.309 637 HD3 PRO 80 HD3 PRO 80 -21.751 -14.233 -4.215 638 H ALA 81 H ALA 81 -20.461 -10.799 -8.403 639 HA ALA 81 HA ALA 81 -20.068 -8.301 -7.237 640 HB1 ALA 81 HB1 ALA 81 -20.857 -8.285 -10.074 641 HB2 ALA 81 HB2 ALA 81 -19.416 -7.637 -9.289 642 HB3 ALA 81 HB3 ALA 81 -19.521 -9.359 -9.657 643 H LYS 82 H LYS 82 -22.968 -9.805 -8.408 644 HA LYS 82 HA LYS 82 -24.534 -7.467 -8.739 645 HB2 LYS 82 HB2 LYS 82 -25.643 -10.154 -7.965 646 HB3 LYS 82 HB3 LYS 82 -26.389 -8.908 -8.957 647 HG2 LYS 82 HG2 LYS 82 -25.710 -10.070 -10.719 648 HG3 LYS 82 HG3 LYS 82 -24.071 -9.544 -10.325 649 HD2 LYS 82 HD2 LYS 82 -23.602 -11.730 -10.178 650 HD3 LYS 82 HD3 LYS 82 -24.435 -11.661 -8.623 651 HE2 LYS 82 HE2 LYS 82 -26.556 -12.203 -9.831 652 HE3 LYS 82 HE3 LYS 82 -25.598 -12.453 -11.290 653 HZ1 LYS 82 HZ1 LYS 82 -25.874 -14.135 -8.946 654 HZ2 LYS 82 HZ2 LYS 82 -24.299 -14.001 -9.549 655 HZ3 LYS 82 HZ3 LYS 82 -25.544 -14.557 -10.551 656 H GLU 83 H GLU 83 -24.500 -9.874 -6.103 657 HA GLU 83 HA GLU 83 -26.225 -8.549 -4.377 658 HB2 GLU 83 HB2 GLU 83 -25.403 -10.886 -4.100 659 HB3 GLU 83 HB3 GLU 83 -23.853 -10.243 -3.579 660 HG2 GLU 83 HG2 GLU 83 -25.715 -10.974 -1.861 661 HG3 GLU 83 HG3 GLU 83 -24.632 -9.620 -1.544 662 H ALA 84 H ALA 84 -22.676 -8.375 -4.530 663 HA ALA 84 HA ALA 84 -22.189 -6.667 -2.426 664 HB1 ALA 84 HB1 ALA 84 -20.813 -7.219 -4.997 665 HB2 ALA 84 HB2 ALA 84 -20.293 -5.813 -4.067 666 HB3 ALA 84 HB3 ALA 84 -20.243 -7.419 -3.340 667 H MET 85 H MET 85 -23.185 -5.853 -5.723 668 HA MET 85 HA MET 85 -22.980 -3.050 -5.438 669 HB2 MET 85 HB2 MET 85 -23.672 -4.855 -7.477 670 HB3 MET 85 HB3 MET 85 -25.071 -3.810 -7.275 671 HG2 MET 85 HG2 MET 85 -23.271 -1.909 -7.332 672 HG3 MET 85 HG3 MET 85 -22.311 -3.138 -8.153 673 HE1 MET 85 HE1 MET 85 -24.174 -4.805 -9.774 674 HE2 MET 85 HE2 MET 85 -24.474 -3.950 -11.286 675 HE3 MET 85 HE3 MET 85 -22.838 -4.037 -10.632 676 H ALA 86 H ALA 86 -25.454 -5.358 -4.594 677 HA ALA 86 HA ALA 86 -27.525 -3.414 -4.194 678 HB1 ALA 86 HB1 ALA 86 -28.007 -5.815 -2.718 679 HB2 ALA 86 HB2 ALA 86 -28.812 -5.220 -4.171 680 HB3 ALA 86 HB3 ALA 86 -27.367 -6.222 -4.311 681 H GLN 87 H GLN 87 -24.946 -4.733 -2.291 682 HA GLN 87 HA GLN 87 -26.069 -3.820 0.222 683 HB2 GLN 87 HB2 GLN 87 -23.388 -5.044 -0.445 684 HB3 GLN 87 HB3 GLN 87 -23.925 -4.643 1.181 685 HG2 GLN 87 HG2 GLN 87 -25.985 -6.180 0.261 686 HG3 GLN 87 HG3 GLN 87 -24.585 -6.928 -0.507 687 HE21 GLN 87 HE21 GLN 87 -23.879 -8.582 0.616 688 HE22 GLN 87 HE22 GLN 87 -23.804 -8.694 2.338 689 H ASP 88 H ASP 88 -24.882 -2.187 -2.248 690 HA ASP 88 HA ASP 88 -23.997 -0.108 -2.519 691 HB2 ASP 88 HB2 ASP 88 -25.262 -0.050 -0.002 692 HB3 ASP 88 HB3 ASP 88 -23.699 0.729 0.223 693 H LYS 89 H LYS 89 -22.388 -2.582 -1.582 694 HA LYS 89 HA LYS 89 -20.021 -1.350 -0.447 695 HB2 LYS 89 HB2 LYS 89 -20.774 -4.164 -1.191 696 HB3 LYS 89 HB3 LYS 89 -19.111 -3.746 -0.802 697 HG2 LYS 89 HG2 LYS 89 -20.763 -2.671 1.230 698 HG3 LYS 89 HG3 LYS 89 -21.255 -4.345 0.958 699 HD2 LYS 89 HD2 LYS 89 -18.856 -5.004 1.147 700 HD3 LYS 89 HD3 LYS 89 -18.483 -3.338 1.595 701 HE2 LYS 89 HE2 LYS 89 -18.682 -4.454 3.640 702 HE3 LYS 89 HE3 LYS 89 -20.232 -3.639 3.439 703 HZ1 LYS 89 HZ1 LYS 89 -21.265 -5.650 2.823 704 HZ2 LYS 89 HZ2 LYS 89 -20.337 -6.014 4.189 705 HZ3 LYS 89 HZ3 LYS 89 -19.790 -6.462 2.652 706 H MET 90 H MET 90 -21.304 -1.563 -3.481 707 HA MET 90 HA MET 90 -18.845 -0.767 -4.719 708 HB2 MET 90 HB2 MET 90 -18.570 -2.539 -6.268 709 HB3 MET 90 HB3 MET 90 -18.738 -3.299 -4.692 710 HG2 MET 90 HG2 MET 90 -21.036 -3.860 -5.162 711 HG3 MET 90 HG3 MET 90 -20.959 -3.000 -6.699 712 HE1 MET 90 HE1 MET 90 -19.804 -5.047 -9.178 713 HE2 MET 90 HE2 MET 90 -19.682 -3.426 -8.495 714 HE3 MET 90 HE3 MET 90 -18.273 -4.489 -8.503 715 H GLU 91 H GLU 91 -19.171 0.320 -6.643 716 HA GLU 91 HA GLU 91 -21.939 0.450 -7.632 717 HB2 GLU 91 HB2 GLU 91 -21.332 2.416 -6.179 718 HB3 GLU 91 HB3 GLU 91 -20.112 2.840 -7.372 719 HG2 GLU 91 HG2 GLU 91 -22.253 4.100 -7.562 720 HG3 GLU 91 HG3 GLU 91 -21.753 3.262 -9.030 721 H VAL 92 H VAL 92 -22.082 1.421 -9.835 722 HA VAL 92 HA VAL 92 -19.654 1.172 -11.438 723 HB VAL 92 HB VAL 92 -22.165 -0.330 -12.183 724 HG11 VAL 92 HG11 VAL 92 -19.521 0.126 -13.465 725 HG12 VAL 92 HG12 VAL 92 -20.306 -1.438 -13.693 726 HG13 VAL 92 HG13 VAL 92 -21.128 0.043 -14.186 727 HG21 VAL 92 HG21 VAL 92 -19.672 -1.227 -10.782 728 HG22 VAL 92 HG22 VAL 92 -21.355 -1.553 -10.371 729 HG23 VAL 92 HG23 VAL 92 -20.618 -2.346 -11.763 730 H ASP 93 H ASP 93 -19.663 2.386 -13.303 731 HA ASP 93 HA ASP 93 -22.078 4.004 -13.788 732 HB2 ASP 93 HB2 ASP 93 -19.568 4.916 -12.944 733 HB3 ASP 93 HB3 ASP 93 -19.642 5.305 -14.660 734 H GLY 94 H GLY 94 -21.814 5.148 -16.051 735 HA2 GLY 94 HA2 GLY 94 -21.419 4.973 -18.338 736 HA3 GLY 94 HA3 GLY 94 -20.485 3.514 -18.038 737 H GLN 95 H GLN 95 -21.336 1.786 -18.964 738 HA GLN 95 HA GLN 95 -24.217 1.713 -19.472 739 HB2 GLN 95 HB2 GLN 95 -21.829 0.475 -20.725 740 HB3 GLN 95 HB3 GLN 95 -23.313 -0.469 -20.749 741 HG2 GLN 95 HG2 GLN 95 -23.345 2.377 -21.643 742 HG3 GLN 95 HG3 GLN 95 -22.749 1.115 -22.721 743 HE21 GLN 95 HE21 GLN 95 -25.513 2.409 -21.067 744 HE22 GLN 95 HE22 GLN 95 -26.707 1.506 -21.928 745 H VAL 96 H VAL 96 -25.185 1.011 -17.632 746 HA VAL 96 HA VAL 96 -24.167 -0.930 -15.874 747 HB VAL 96 HB VAL 96 -27.088 -0.299 -16.302 748 HG11 VAL 96 HG11 VAL 96 -26.888 -0.698 -13.692 749 HG12 VAL 96 HG12 VAL 96 -27.119 -2.035 -14.821 750 HG13 VAL 96 HG13 VAL 96 -25.510 -1.675 -14.195 751 HG21 VAL 96 HG21 VAL 96 -26.518 1.810 -15.802 752 HG22 VAL 96 HG22 VAL 96 -26.295 1.204 -14.161 753 HG23 VAL 96 HG23 VAL 96 -24.911 1.345 -15.245 754 H GLU 97 H GLU 97 -25.955 -1.191 -18.845 755 HA GLU 97 HA GLU 97 -26.808 -3.893 -18.468 756 HB2 GLU 97 HB2 GLU 97 -27.266 -3.801 -20.934 757 HB3 GLU 97 HB3 GLU 97 -28.056 -2.544 -19.993 758 HG2 GLU 97 HG2 GLU 97 -26.821 -0.878 -20.911 759 HG3 GLU 97 HG3 GLU 97 -25.412 -1.907 -21.161 760 H LEU 98 H LEU 98 -23.951 -2.346 -19.723 761 HA LEU 98 HA LEU 98 -22.918 -4.698 -21.009 762 HB2 LEU 98 HB2 LEU 98 -22.009 -1.929 -20.525 763 HB3 LEU 98 HB3 LEU 98 -20.746 -3.142 -20.719 764 HG LEU 98 HG LEU 98 -22.893 -3.052 -22.770 765 HD11 LEU 98 HD11 LEU 98 -22.605 -0.855 -23.098 766 HD12 LEU 98 HD12 LEU 98 -21.069 -1.331 -23.821 767 HD13 LEU 98 HD13 LEU 98 -21.126 -0.803 -22.139 768 HD21 LEU 98 HD21 LEU 98 -20.822 -4.620 -22.583 769 HD22 LEU 98 HD22 LEU 98 -19.947 -3.234 -23.234 770 HD23 LEU 98 HD23 LEU 98 -21.276 -3.947 -24.149 771 H ILE 99 H ILE 99 -21.972 -2.863 -18.100 772 HA ILE 99 HA ILE 99 -19.979 -4.539 -17.178 773 HB ILE 99 HB ILE 99 -20.469 -3.676 -14.914 774 HG12 ILE 99 HG12 ILE 99 -22.332 -1.780 -15.044 775 HG13 ILE 99 HG13 ILE 99 -22.991 -2.850 -16.277 776 HG21 ILE 99 HG21 ILE 99 -19.198 -2.009 -15.648 777 HG22 ILE 99 HG22 ILE 99 -19.877 -2.137 -17.270 778 HG23 ILE 99 HG23 ILE 99 -20.673 -1.134 -16.058 779 HD11 ILE 99 HD11 ILE 99 -23.906 -4.085 -14.695 780 HD12 ILE 99 HD12 ILE 99 -22.307 -4.435 -14.037 781 HD13 ILE 99 HD13 ILE 99 -23.211 -3.035 -13.461 782 H PHE 100 H PHE 100 -23.423 -4.977 -17.111 783 HA PHE 100 HA PHE 100 -23.473 -7.007 -15.109 784 HB2 PHE 100 HB2 PHE 100 -25.380 -5.512 -16.456 785 HB3 PHE 100 HB3 PHE 100 -25.633 -7.144 -17.066 786 HD1 PHE 100 HD1 PHE 100 -25.484 -8.980 -15.071 787 HD2 PHE 100 HD2 PHE 100 -26.667 -4.911 -14.669 788 HE1 PHE 100 HE1 PHE 100 -26.736 -9.549 -13.031 789 HE2 PHE 100 HE2 PHE 100 -27.920 -5.473 -12.628 790 HZ PHE 100 HZ PHE 100 -27.955 -7.794 -11.805 791 H LEU 101 H LEU 101 -23.149 -6.981 -18.606 792 HA LEU 101 HA LEU 101 -23.490 -9.766 -19.001 793 HB2 LEU 101 HB2 LEU 101 -22.619 -7.455 -20.581 794 HB3 LEU 101 HB3 LEU 101 -21.886 -8.983 -21.064 795 HG LEU 101 HG LEU 101 -23.941 -8.336 -22.338 796 HD11 LEU 101 HD11 LEU 101 -24.748 -10.536 -22.489 797 HD12 LEU 101 HD12 LEU 101 -24.339 -10.891 -20.811 798 HD13 LEU 101 HD13 LEU 101 -23.059 -10.695 -22.008 799 HD21 LEU 101 HD21 LEU 101 -24.976 -7.705 -19.899 800 HD22 LEU 101 HD22 LEU 101 -25.710 -9.280 -20.203 801 HD23 LEU 101 HD23 LEU 101 -25.925 -7.968 -21.362 802 H LEU 102 H LEU 102 -21.007 -7.996 -17.571 803 HA LEU 102 HA LEU 102 -18.845 -9.761 -18.310 804 HB2 LEU 102 HB2 LEU 102 -19.124 -7.428 -16.452 805 HB3 LEU 102 HB3 LEU 102 -17.685 -8.446 -16.414 806 HG LEU 102 HG LEU 102 -18.636 -7.022 -18.893 807 HD11 LEU 102 HD11 LEU 102 -18.145 -5.205 -17.580 808 HD12 LEU 102 HD12 LEU 102 -16.560 -5.561 -18.265 809 HD13 LEU 102 HD13 LEU 102 -16.947 -6.079 -16.624 810 HD21 LEU 102 HD21 LEU 102 -17.159 -8.958 -19.224 811 HD22 LEU 102 HD22 LEU 102 -15.970 -8.223 -18.148 812 HD23 LEU 102 HD23 LEU 102 -16.379 -7.443 -19.677 813 H GLU 103 H GLU 103 -21.047 -9.339 -15.612 814 HA GLU 103 HA GLU 103 -19.862 -10.804 -13.624 815 HB2 GLU 103 HB2 GLU 103 -22.464 -9.859 -14.190 816 HB3 GLU 103 HB3 GLU 103 -22.631 -11.558 -13.770 817 HG2 GLU 103 HG2 GLU 103 -21.256 -9.466 -12.100 818 HG3 GLU 103 HG3 GLU 103 -22.874 -10.108 -11.825 819 HA PRO 104 HA PRO 104 -21.657 -14.906 -15.443 820 HB2 PRO 104 HB2 PRO 104 -22.684 -14.807 -17.954 821 HB3 PRO 104 HB3 PRO 104 -23.657 -14.518 -16.507 822 HG2 PRO 104 HG2 PRO 104 -22.423 -12.541 -18.387 823 HG3 PRO 104 HG3 PRO 104 -24.039 -12.533 -17.656 824 HD2 PRO 104 HD2 PRO 104 -22.002 -11.022 -16.706 825 HD3 PRO 104 HD3 PRO 104 -23.266 -11.690 -15.654 826 H PHE 105 H PHE 105 -19.645 -12.673 -16.949 827 HA PHE 105 HA PHE 105 -18.482 -14.568 -18.829 828 HB2 PHE 105 HB2 PHE 105 -18.824 -11.977 -19.147 829 HB3 PHE 105 HB3 PHE 105 -17.298 -11.876 -18.275 830 HD1 PHE 105 HD1 PHE 105 -18.682 -14.039 -20.988 831 HD2 PHE 105 HD2 PHE 105 -15.496 -11.556 -19.644 832 HE1 PHE 105 HE1 PHE 105 -17.464 -14.474 -23.082 833 HE2 PHE 105 HE2 PHE 105 -14.274 -11.986 -21.736 834 HZ PHE 105 HZ PHE 105 -15.258 -13.446 -23.458 835 H ILE 106 H ILE 106 -18.070 -13.585 -15.609 836 HA ILE 106 HA ILE 106 -15.326 -13.740 -15.211 837 HB ILE 106 HB ILE 106 -17.545 -14.602 -13.354 838 HG12 ILE 106 HG12 ILE 106 -15.929 -12.048 -13.358 839 HG13 ILE 106 HG13 ILE 106 -17.496 -12.202 -14.146 840 HG21 ILE 106 HG21 ILE 106 -14.603 -14.533 -13.036 841 HG22 ILE 106 HG22 ILE 106 -15.571 -13.943 -11.687 842 HG23 ILE 106 HG23 ILE 106 -15.801 -15.586 -12.285 843 HD11 ILE 106 HD11 ILE 106 -18.531 -11.805 -12.237 844 HD12 ILE 106 HD12 ILE 106 -17.685 -13.140 -11.455 845 HD13 ILE 106 HD13 ILE 106 -16.962 -11.532 -11.480 846 H ALA 107 H ALA 107 -17.671 -16.276 -15.701 847 HA ALA 107 HA ALA 107 -16.324 -18.486 -14.711 848 HB1 ALA 107 HB1 ALA 107 -17.722 -19.816 -16.057 849 HB2 ALA 107 HB2 ALA 107 -18.664 -18.371 -15.691 850 HB3 ALA 107 HB3 ALA 107 -17.898 -18.547 -17.270 851 H SER 108 H SER 108 -15.846 -16.730 -17.715 852 HA SER 108 HA SER 108 -13.932 -18.664 -18.711 853 HB2 SER 108 HB2 SER 108 -15.605 -16.959 -19.989 854 HB3 SER 108 HB3 SER 108 -14.119 -16.010 -20.009 855 HG SER 108 HG SER 108 -13.321 -17.330 -21.435 856 H LEU 109 H LEU 109 -13.939 -15.681 -16.951 857 HA LEU 109 HA LEU 109 -11.026 -15.441 -17.237 858 HB2 LEU 109 HB2 LEU 109 -13.202 -13.536 -16.507 859 HB3 LEU 109 HB3 LEU 109 -11.563 -13.234 -15.933 860 HG LEU 109 HG LEU 109 -10.760 -13.122 -18.226 861 HD11 LEU 109 HD11 LEU 109 -12.686 -12.968 -19.987 862 HD12 LEU 109 HD12 LEU 109 -13.546 -13.989 -18.836 863 HD13 LEU 109 HD13 LEU 109 -12.018 -14.534 -19.528 864 HD21 LEU 109 HD21 LEU 109 -12.671 -11.236 -18.857 865 HD22 LEU 109 HD22 LEU 109 -11.223 -10.967 -17.887 866 HD23 LEU 109 HD23 LEU 109 -12.756 -11.337 -17.098 867 H LYS 110 H LYS 110 -12.179 -17.511 -15.632 868 HA LYS 110 HA LYS 110 -12.270 -16.880 -12.897 869 HB2 LYS 110 HB2 LYS 110 -12.997 -19.037 -14.084 870 HB3 LYS 110 HB3 LYS 110 -11.308 -19.519 -13.983 871 HG2 LYS 110 HG2 LYS 110 -12.258 -18.601 -11.426 872 HG3 LYS 110 HG3 LYS 110 -13.291 -19.883 -12.062 873 HD2 LYS 110 HD2 LYS 110 -10.384 -20.317 -12.320 874 HD3 LYS 110 HD3 LYS 110 -11.024 -20.334 -10.675 875 HE2 LYS 110 HE2 LYS 110 -12.846 -21.845 -12.093 876 HE3 LYS 110 HE3 LYS 110 -11.299 -22.292 -12.810 877 HZ1 LYS 110 HZ1 LYS 110 -12.327 -22.818 -10.150 878 HZ2 LYS 110 HZ2 LYS 110 -10.697 -22.371 -10.217 879 HZ3 LYS 110 HZ3 LYS 110 -11.242 -23.714 -11.090 Start of MODEL 13 1 H1 MET 1 H MET 1 3.696 0.097 -0.824 2 HA MET 1 HA MET 1 0.918 -0.022 -0.581 3 HB2 MET 1 HB2 MET 1 2.353 1.595 -1.961 4 HB3 MET 1 HB3 MET 1 2.340 0.355 -3.208 5 HG2 MET 1 HG2 MET 1 -0.026 0.494 -3.429 6 HG3 MET 1 HG3 MET 1 -0.151 1.539 -2.016 7 HE1 MET 1 HE1 MET 1 -0.311 3.901 -2.080 8 HE2 MET 1 HE2 MET 1 -0.410 4.840 -3.569 9 HE3 MET 1 HE3 MET 1 -1.531 3.506 -3.291 10 H SER 2 H SER 2 0.667 -2.346 -0.153 11 HA SER 2 HA SER 2 0.508 -3.901 -2.652 12 HB2 SER 2 HB2 SER 2 0.535 -5.881 -0.899 13 HB3 SER 2 HB3 SER 2 2.039 -5.136 -1.440 14 HG SER 2 HG SER 2 0.728 -4.937 1.019 15 H LEU 3 H LEU 3 -1.509 -4.170 -3.313 16 HA LEU 3 HA LEU 3 -3.663 -4.230 -1.310 17 HB2 LEU 3 HB2 LEU 3 -3.559 -3.346 -4.168 18 HB3 LEU 3 HB3 LEU 3 -5.092 -3.807 -3.429 19 HG LEU 3 HG LEU 3 -3.441 -1.780 -2.019 20 HD11 LEU 3 HD11 LEU 3 -3.442 -1.235 -4.510 21 HD12 LEU 3 HD12 LEU 3 -4.038 0.006 -3.410 22 HD13 LEU 3 HD13 LEU 3 -5.177 -0.975 -4.331 23 HD21 LEU 3 HD21 LEU 3 -5.525 -2.538 -1.048 24 HD22 LEU 3 HD22 LEU 3 -6.392 -2.136 -2.530 25 HD23 LEU 3 HD23 LEU 3 -5.674 -0.855 -1.553 26 H LYS 4 H LYS 4 -5.121 -5.890 -1.265 27 HA LYS 4 HA LYS 4 -4.315 -8.418 -2.164 28 HB2 LYS 4 HB2 LYS 4 -6.722 -7.278 -0.875 29 HB3 LYS 4 HB3 LYS 4 -6.960 -8.795 -1.734 30 HG2 LYS 4 HG2 LYS 4 -6.069 -9.935 -0.061 31 HG3 LYS 4 HG3 LYS 4 -4.596 -8.964 -0.128 32 HD2 LYS 4 HD2 LYS 4 -5.919 -7.199 1.169 33 HD3 LYS 4 HD3 LYS 4 -7.090 -8.484 1.480 34 HE2 LYS 4 HE2 LYS 4 -5.261 -9.847 2.450 35 HE3 LYS 4 HE3 LYS 4 -4.167 -8.483 2.228 36 HZ1 LYS 4 HZ1 LYS 4 -5.621 -7.169 3.681 37 HZ2 LYS 4 HZ2 LYS 4 -4.983 -8.519 4.474 38 HZ3 LYS 4 HZ3 LYS 4 -6.590 -8.531 3.945 39 H SER 5 H SER 5 -6.511 -6.045 -3.551 40 HA SER 5 HA SER 5 -7.748 -7.586 -5.496 41 HB2 SER 5 HB2 SER 5 -8.022 -5.455 -6.755 42 HB3 SER 5 HB3 SER 5 -8.450 -5.304 -5.051 43 HG SER 5 HG SER 5 -6.991 -3.815 -4.909 44 H ASP 6 H ASP 6 -4.487 -6.471 -5.309 45 HA ASP 6 HA ASP 6 -3.704 -6.438 -7.967 46 HB2 ASP 6 HB2 ASP 6 -2.385 -5.974 -5.728 47 HB3 ASP 6 HB3 ASP 6 -1.883 -7.651 -5.928 48 H GLU 7 H GLU 7 -4.043 -9.182 -5.765 49 HA GLU 7 HA GLU 7 -2.924 -11.154 -7.407 50 HB2 GLU 7 HB2 GLU 7 -4.474 -11.051 -4.970 51 HB3 GLU 7 HB3 GLU 7 -5.006 -12.383 -5.986 52 HG2 GLU 7 HG2 GLU 7 -2.214 -12.469 -6.039 53 HG3 GLU 7 HG3 GLU 7 -2.653 -12.152 -4.362 54 H VAL 8 H VAL 8 -6.269 -10.006 -7.133 55 HA VAL 8 HA VAL 8 -7.361 -11.823 -9.009 56 HB VAL 8 HB VAL 8 -8.338 -9.158 -7.994 57 HG11 VAL 8 HG11 VAL 8 -10.519 -9.767 -9.026 58 HG12 VAL 8 HG12 VAL 8 -9.253 -9.403 -10.200 59 HG13 VAL 8 HG13 VAL 8 -9.702 -11.078 -9.875 60 HG21 VAL 8 HG21 VAL 8 -9.739 -11.725 -7.506 61 HG22 VAL 8 HG22 VAL 8 -8.216 -11.457 -6.659 62 HG23 VAL 8 HG23 VAL 8 -9.549 -10.320 -6.457 63 H PHE 9 H PHE 9 -6.218 -8.476 -9.298 64 HA PHE 9 HA PHE 9 -6.889 -8.126 -12.008 65 HB2 PHE 9 HB2 PHE 9 -5.029 -6.774 -10.100 66 HB3 PHE 9 HB3 PHE 9 -4.887 -6.408 -11.817 67 HD1 PHE 9 HD1 PHE 9 -7.400 -6.112 -12.910 68 HD2 PHE 9 HD2 PHE 9 -6.219 -5.226 -8.918 69 HE1 PHE 9 HE1 PHE 9 -9.253 -4.505 -12.723 70 HE2 PHE 9 HE2 PHE 9 -8.072 -3.619 -8.724 71 HZ PHE 9 HZ PHE 9 -9.592 -3.257 -10.627 72 H ALA 10 H ALA 10 -3.983 -9.363 -10.434 73 HA ALA 10 HA ALA 10 -2.326 -9.507 -12.689 74 HB1 ALA 10 HB1 ALA 10 -0.974 -9.985 -10.982 75 HB2 ALA 10 HB2 ALA 10 -2.311 -10.541 -9.974 76 HB3 ALA 10 HB3 ALA 10 -1.557 -11.644 -11.125 77 H LYS 11 H LYS 11 -4.413 -12.003 -11.238 78 HA LYS 11 HA LYS 11 -3.889 -13.987 -13.164 79 HB2 LYS 11 HB2 LYS 11 -5.956 -15.060 -12.310 80 HB3 LYS 11 HB3 LYS 11 -4.856 -14.570 -11.028 81 HG2 LYS 11 HG2 LYS 11 -6.215 -12.641 -10.538 82 HG3 LYS 11 HG3 LYS 11 -7.273 -13.001 -11.904 83 HD2 LYS 11 HD2 LYS 11 -8.443 -13.839 -10.070 84 HD3 LYS 11 HD3 LYS 11 -7.650 -15.267 -10.739 85 HE2 LYS 11 HE2 LYS 11 -6.624 -15.627 -8.804 86 HE3 LYS 11 HE3 LYS 11 -5.882 -14.029 -8.880 87 HZ1 LYS 11 HZ1 LYS 11 -7.558 -14.777 -6.962 88 HZ2 LYS 11 HZ2 LYS 11 -8.664 -14.100 -8.049 89 HZ3 LYS 11 HZ3 LYS 11 -7.380 -13.169 -7.460 90 H ILE 12 H ILE 12 -6.327 -11.445 -12.986 91 HA ILE 12 HA ILE 12 -7.982 -12.233 -15.076 92 HB ILE 12 HB ILE 12 -7.250 -9.479 -14.098 93 HG12 ILE 12 HG12 ILE 12 -8.626 -11.254 -12.747 94 HG13 ILE 12 HG13 ILE 12 -9.172 -9.581 -12.805 95 HG21 ILE 12 HG21 ILE 12 -8.999 -10.316 -16.357 96 HG22 ILE 12 HG22 ILE 12 -9.491 -8.946 -15.362 97 HG23 ILE 12 HG23 ILE 12 -7.944 -8.911 -16.206 98 HD11 ILE 12 HD11 ILE 12 -10.886 -10.082 -14.317 99 HD12 ILE 12 HD12 ILE 12 -10.190 -11.654 -14.715 100 HD13 ILE 12 HD13 ILE 12 -10.918 -11.386 -13.131 101 H ALA 13 H ALA 13 -5.195 -10.013 -15.212 102 HA ALA 13 HA ALA 13 -5.220 -9.570 -17.964 103 HB1 ALA 13 HB1 ALA 13 -3.492 -8.259 -17.482 104 HB2 ALA 13 HB2 ALA 13 -3.613 -8.820 -15.814 105 HB3 ALA 13 HB3 ALA 13 -2.525 -9.631 -16.941 106 H LYS 14 H LYS 14 -3.604 -12.092 -16.074 107 HA LYS 14 HA LYS 14 -2.231 -13.269 -18.254 108 HB2 LYS 14 HB2 LYS 14 -1.611 -13.625 -15.885 109 HB3 LYS 14 HB3 LYS 14 -3.096 -14.539 -15.648 110 HG2 LYS 14 HG2 LYS 14 -2.354 -16.317 -16.960 111 HG3 LYS 14 HG3 LYS 14 -1.089 -15.348 -17.720 112 HD2 LYS 14 HD2 LYS 14 0.199 -15.322 -15.710 113 HD3 LYS 14 HD3 LYS 14 -1.124 -16.036 -14.785 114 HE2 LYS 14 HE2 LYS 14 -0.364 -17.650 -17.081 115 HE3 LYS 14 HE3 LYS 14 0.977 -17.393 -15.965 116 HZ1 LYS 14 HZ1 LYS 14 -0.273 -18.313 -14.194 117 HZ2 LYS 14 HZ2 LYS 14 -0.421 -19.385 -15.494 118 HZ3 LYS 14 HZ3 LYS 14 -1.697 -18.345 -15.106 119 H ARG 15 H ARG 15 -5.433 -13.712 -16.894 120 HA ARG 15 HA ARG 15 -6.014 -16.079 -18.410 121 HB2 ARG 15 HB2 ARG 15 -7.801 -14.187 -16.873 122 HB3 ARG 15 HB3 ARG 15 -8.353 -15.679 -17.623 123 HG2 ARG 15 HG2 ARG 15 -6.054 -15.908 -15.787 124 HG3 ARG 15 HG3 ARG 15 -7.612 -15.505 -15.062 125 HD2 ARG 15 HD2 ARG 15 -8.376 -17.494 -16.692 126 HD3 ARG 15 HD3 ARG 15 -6.712 -17.990 -16.386 127 HE ARG 15 HE ARG 15 -7.911 -17.353 -13.940 128 HH11 ARG 15 HH11 ARG 15 -8.142 -19.734 -16.469 129 HH12 ARG 15 HH12 ARG 15 -8.708 -20.988 -15.416 130 HH21 ARG 15 HH21 ARG 15 -8.656 -18.995 -12.543 131 HH22 ARG 15 HH22 ARG 15 -9.001 -20.566 -13.183 132 H LEU 16 H LEU 16 -6.438 -12.635 -18.833 133 HA LEU 16 HA LEU 16 -8.294 -12.766 -20.976 134 HB2 LEU 16 HB2 LEU 16 -6.348 -10.630 -20.130 135 HB3 LEU 16 HB3 LEU 16 -7.527 -10.422 -21.424 136 HG LEU 16 HG LEU 16 -8.473 -11.200 -18.701 137 HD11 LEU 16 HD11 LEU 16 -7.394 -8.537 -19.520 138 HD12 LEU 16 HD12 LEU 16 -7.208 -9.403 -17.995 139 HD13 LEU 16 HD13 LEU 16 -8.746 -8.638 -18.391 140 HD21 LEU 16 HD21 LEU 16 -10.209 -11.191 -20.236 141 HD22 LEU 16 HD22 LEU 16 -9.566 -9.803 -21.112 142 HD23 LEU 16 HD23 LEU 16 -10.313 -9.579 -19.529 143 H GLU 17 H GLU 17 -4.998 -13.502 -20.771 144 HA GLU 17 HA GLU 17 -4.305 -12.826 -23.482 145 HB2 GLU 17 HB2 GLU 17 -2.896 -14.469 -21.377 146 HB3 GLU 17 HB3 GLU 17 -2.228 -14.148 -22.971 147 HG2 GLU 17 HG2 GLU 17 -2.896 -11.642 -22.064 148 HG3 GLU 17 HG3 GLU 17 -2.325 -12.459 -20.610 149 H SER 18 H SER 18 -5.958 -15.366 -21.976 150 HA SER 18 HA SER 18 -5.292 -17.322 -24.034 151 HB2 SER 18 HB2 SER 18 -6.167 -17.471 -21.323 152 HB3 SER 18 HB3 SER 18 -7.383 -18.253 -22.332 153 HG SER 18 HG SER 18 -6.059 -19.871 -22.394 154 H ILE 19 H ILE 19 -7.491 -14.843 -23.565 155 HA ILE 19 HA ILE 19 -9.878 -15.878 -24.597 156 HB ILE 19 HB ILE 19 -8.840 -13.066 -24.963 157 HG12 ILE 19 HG12 ILE 19 -10.477 -14.236 -22.702 158 HG13 ILE 19 HG13 ILE 19 -8.781 -13.777 -22.599 159 HG21 ILE 19 HG21 ILE 19 -11.613 -13.095 -24.580 160 HG22 ILE 19 HG22 ILE 19 -10.737 -12.742 -26.069 161 HG23 ILE 19 HG23 ILE 19 -11.273 -14.387 -25.731 162 HD11 ILE 19 HD11 ILE 19 -10.919 -12.198 -21.951 163 HD12 ILE 19 HD12 ILE 19 -9.279 -11.635 -22.275 164 HD13 ILE 19 HD13 ILE 19 -10.485 -11.628 -23.562 165 H ASP 20 H ASP 20 -10.703 -16.085 -26.637 166 HA ASP 20 HA ASP 20 -8.873 -15.539 -28.879 167 HB2 ASP 20 HB2 ASP 20 -9.750 -18.072 -27.982 168 HB3 ASP 20 HB3 ASP 20 -10.613 -17.745 -29.482 169 HA PRO 21 HA PRO 21 -12.210 -13.393 -30.761 170 HB2 PRO 21 HB2 PRO 21 -11.597 -13.739 -33.383 171 HB3 PRO 21 HB3 PRO 21 -10.686 -12.662 -32.318 172 HG2 PRO 21 HG2 PRO 21 -10.043 -15.452 -33.191 173 HG3 PRO 21 HG3 PRO 21 -8.971 -14.046 -33.059 174 HD2 PRO 21 HD2 PRO 21 -9.065 -15.988 -31.174 175 HD3 PRO 21 HD3 PRO 21 -8.722 -14.291 -30.780 176 H ALA 22 H ALA 22 -11.640 -16.743 -31.448 177 HA ALA 22 HA ALA 22 -13.773 -17.296 -33.174 178 HB1 ALA 22 HB1 ALA 22 -12.341 -18.998 -31.150 179 HB2 ALA 22 HB2 ALA 22 -13.602 -19.631 -32.210 180 HB3 ALA 22 HB3 ALA 22 -12.123 -18.961 -32.900 181 H ASN 23 H ASN 23 -13.622 -17.588 -29.622 182 HA ASN 23 HA ASN 23 -16.560 -17.664 -29.577 183 HB2 ASN 23 HB2 ASN 23 -14.702 -19.291 -28.309 184 HB3 ASN 23 HB3 ASN 23 -15.236 -18.198 -27.035 185 HD21 ASN 23 HD21 ASN 23 -16.168 -20.699 -29.248 186 HD22 ASN 23 HD22 ASN 23 -17.700 -21.047 -28.529 187 H ARG 24 H ARG 24 -17.502 -15.784 -29.166 188 HA ARG 24 HA ARG 24 -17.060 -14.266 -26.870 189 HB2 ARG 24 HB2 ARG 24 -15.095 -13.761 -28.788 190 HB3 ARG 24 HB3 ARG 24 -16.220 -12.418 -28.942 191 HG2 ARG 24 HG2 ARG 24 -15.398 -11.463 -27.125 192 HG3 ARG 24 HG3 ARG 24 -15.705 -12.918 -26.174 193 HD2 ARG 24 HD2 ARG 24 -13.564 -13.594 -26.289 194 HD3 ARG 24 HD3 ARG 24 -13.394 -13.095 -27.971 195 HE ARG 24 HE ARG 24 -12.409 -11.185 -27.225 196 HH11 ARG 24 HH11 ARG 24 -14.390 -12.468 -24.666 197 HH12 ARG 24 HH12 ARG 24 -13.910 -11.266 -23.515 198 HH21 ARG 24 HH21 ARG 24 -11.768 -9.597 -25.718 199 HH22 ARG 24 HH22 ARG 24 -12.419 -9.633 -24.114 200 H GLN 25 H GLN 25 -18.030 -11.910 -27.240 201 HA GLN 25 HA GLN 25 -20.192 -11.987 -29.204 202 HB2 GLN 25 HB2 GLN 25 -20.508 -12.178 -26.271 203 HB3 GLN 25 HB3 GLN 25 -21.574 -11.038 -27.080 204 HG2 GLN 25 HG2 GLN 25 -21.860 -13.171 -28.692 205 HG3 GLN 25 HG3 GLN 25 -21.529 -13.978 -27.159 206 HE21 GLN 25 HE21 GLN 25 -23.810 -12.280 -29.034 207 HE22 GLN 25 HE22 GLN 25 -25.097 -12.267 -27.881 208 H VAL 26 H VAL 26 -19.574 -9.983 -26.333 209 HA VAL 26 HA VAL 26 -19.174 -7.681 -28.131 210 HB VAL 26 HB VAL 26 -21.386 -7.642 -26.961 211 HG11 VAL 26 HG11 VAL 26 -20.025 -6.906 -24.427 212 HG12 VAL 26 HG12 VAL 26 -21.616 -7.622 -24.693 213 HG13 VAL 26 HG13 VAL 26 -20.167 -8.619 -24.820 214 HG21 VAL 26 HG21 VAL 26 -21.067 -5.292 -26.054 215 HG22 VAL 26 HG22 VAL 26 -19.356 -5.485 -26.439 216 HG23 VAL 26 HG23 VAL 26 -20.563 -5.567 -27.722 217 H GLU 27 H GLU 27 -17.462 -6.392 -27.729 218 HA GLU 27 HA GLU 27 -16.014 -6.736 -25.198 219 HB2 GLU 27 HB2 GLU 27 -14.762 -6.740 -27.950 220 HB3 GLU 27 HB3 GLU 27 -13.871 -6.709 -26.435 221 HG2 GLU 27 HG2 GLU 27 -13.786 -8.927 -26.757 222 HG3 GLU 27 HG3 GLU 27 -15.388 -8.882 -26.022 223 H HIS 28 H HIS 28 -15.748 -4.842 -24.238 224 HA HIS 28 HA HIS 28 -15.184 -2.470 -25.856 225 HB2 HIS 28 HB2 HIS 28 -17.554 -2.896 -24.119 226 HB3 HIS 28 HB3 HIS 28 -16.775 -1.320 -24.025 227 HD1 HIS 28 HD1 HIS 28 -16.509 -0.083 -26.446 228 HD2 HIS 28 HD2 HIS 28 -19.296 -3.152 -26.184 229 HE1 HIS 28 HE1 HIS 28 -18.034 0.224 -28.421 230 H VAL 29 H VAL 29 -14.559 -0.585 -24.389 231 HA VAL 29 HA VAL 29 -12.433 -1.452 -22.699 232 HB VAL 29 HB VAL 29 -13.529 1.351 -22.923 233 HG11 VAL 29 HG11 VAL 29 -11.979 1.670 -21.335 234 HG12 VAL 29 HG12 VAL 29 -11.196 0.121 -21.651 235 HG13 VAL 29 HG13 VAL 29 -10.820 1.522 -22.655 236 HG21 VAL 29 HG21 VAL 29 -13.033 1.155 -25.105 237 HG22 VAL 29 HG22 VAL 29 -11.362 1.299 -24.563 238 HG23 VAL 29 HG23 VAL 29 -12.059 -0.294 -24.858 239 H TYR 30 H TYR 30 -12.206 -1.295 -20.485 240 HA TYR 30 HA TYR 30 -14.568 -0.506 -18.933 241 HB2 TYR 30 HB2 TYR 30 -14.060 -3.127 -19.375 242 HB3 TYR 30 HB3 TYR 30 -13.096 -2.867 -17.926 243 HD1 TYR 30 HD1 TYR 30 -16.502 -2.841 -19.315 244 HD2 TYR 30 HD2 TYR 30 -14.139 -2.460 -15.798 245 HE1 TYR 30 HE1 TYR 30 -18.528 -3.056 -17.938 246 HE2 TYR 30 HE2 TYR 30 -16.159 -2.675 -14.411 247 HH TYR 30 HH TYR 30 -18.841 -3.924 -15.248 248 H LYS 31 H LYS 31 -14.096 -0.122 -16.648 249 HA LYS 31 HA LYS 31 -11.269 0.426 -16.080 250 HB2 LYS 31 HB2 LYS 31 -13.410 2.378 -16.402 251 HB3 LYS 31 HB3 LYS 31 -12.619 2.506 -14.837 252 HG2 LYS 31 HG2 LYS 31 -10.654 2.216 -16.905 253 HG3 LYS 31 HG3 LYS 31 -11.754 3.542 -17.288 254 HD2 LYS 31 HD2 LYS 31 -10.302 3.193 -14.665 255 HD3 LYS 31 HD3 LYS 31 -9.798 4.272 -15.968 256 HE2 LYS 31 HE2 LYS 31 -12.020 5.405 -15.773 257 HE3 LYS 31 HE3 LYS 31 -12.332 4.422 -14.343 258 HZ1 LYS 31 HZ1 LYS 31 -10.733 6.775 -14.614 259 HZ2 LYS 31 HZ2 LYS 31 -9.874 5.513 -13.886 260 HZ3 LYS 31 HZ3 LYS 31 -11.335 6.039 -13.215 261 H PHE 32 H PHE 32 -10.641 -0.028 -14.039 262 HA PHE 32 HA PHE 32 -12.733 -0.641 -12.062 263 HB2 PHE 32 HB2 PHE 32 -10.183 -2.228 -12.239 264 HB3 PHE 32 HB3 PHE 32 -11.675 -2.639 -11.400 265 HD1 PHE 32 HD2 PHE 32 -10.120 -2.302 -14.732 266 HD2 PHE 32 HD1 PHE 32 -13.399 -3.820 -12.482 267 HE1 PHE 32 HE2 PHE 32 -10.854 -3.603 -16.687 268 HE2 PHE 32 HE1 PHE 32 -14.138 -5.125 -14.433 269 HZ PHE 32 HZ PHE 32 -12.866 -5.016 -16.540 270 H ARG 33 H ARG 33 -12.540 0.843 -10.519 271 HA ARG 33 HA ARG 33 -9.851 1.736 -9.736 272 HB2 ARG 33 HB2 ARG 33 -10.926 3.699 -8.787 273 HB3 ARG 33 HB3 ARG 33 -11.413 3.498 -10.465 274 HG2 ARG 33 HG2 ARG 33 -13.480 2.318 -9.535 275 HG3 ARG 33 HG3 ARG 33 -13.014 3.011 -7.981 276 HD2 ARG 33 HD2 ARG 33 -14.080 4.321 -10.408 277 HD3 ARG 33 HD3 ARG 33 -14.352 4.694 -8.707 278 HE ARG 33 HE ARG 33 -11.824 5.460 -8.988 279 HH11 ARG 33 HH11 ARG 33 -14.590 6.016 -11.027 280 HH12 ARG 33 HH12 ARG 33 -14.011 7.538 -11.620 281 HH21 ARG 33 HH21 ARG 33 -11.050 7.461 -9.761 282 HH22 ARG 33 HH22 ARG 33 -11.997 8.358 -10.900 283 H ILE 34 H ILE 34 -9.034 1.006 -7.896 284 HA ILE 34 HA ILE 34 -10.775 -0.372 -6.004 285 HB ILE 34 HB ILE 34 -7.762 -0.179 -6.089 286 HG12 ILE 34 HG12 ILE 34 -8.619 -1.450 -7.969 287 HG13 ILE 34 HG13 ILE 34 -7.903 -2.556 -6.803 288 HG21 ILE 34 HG21 ILE 34 -8.615 -2.399 -4.586 289 HG22 ILE 34 HG22 ILE 34 -7.780 -0.957 -4.011 290 HG23 ILE 34 HG23 ILE 34 -9.543 -1.013 -4.012 291 HD11 ILE 34 HD11 ILE 34 -10.728 -2.215 -7.612 292 HD12 ILE 34 HD12 ILE 34 -9.813 -3.682 -7.261 293 HD13 ILE 34 HD13 ILE 34 -10.400 -2.671 -5.941 294 H THR 35 H THR 35 -11.330 0.410 -4.069 295 HA THR 35 HA THR 35 -10.183 2.990 -3.255 296 HB THR 35 HB THR 35 -12.191 3.273 -1.863 297 HG1 THR 35 HG1 THR 35 -13.419 1.072 -3.096 298 HG21 THR 35 HG21 THR 35 -12.110 3.197 -4.724 299 HG22 THR 35 HG22 THR 35 -13.020 4.279 -3.669 300 HG23 THR 35 HG23 THR 35 -13.723 2.743 -4.175 301 H GLN 36 H GLN 36 -9.381 3.316 -1.204 302 HA GLN 36 HA GLN 36 -8.795 0.870 0.307 303 HB2 GLN 36 HB2 GLN 36 -6.981 2.518 -0.549 304 HB3 GLN 36 HB3 GLN 36 -7.490 3.529 0.797 305 HG2 GLN 36 HG2 GLN 36 -7.027 1.623 2.323 306 HG3 GLN 36 HG3 GLN 36 -6.368 0.743 0.945 307 HE21 GLN 36 HE21 GLN 36 -4.247 0.736 1.010 308 HE22 GLN 36 HE22 GLN 36 -3.232 2.060 1.458 309 H GLY 37 H GLY 37 -10.214 0.488 1.883 310 HA2 GLY 37 HA2 GLY 37 -11.230 0.825 3.942 311 HA3 GLY 37 HA3 GLY 37 -10.625 2.475 3.935 312 H GLY 38 H GLY 38 -11.712 3.516 1.658 313 HA2 GLY 38 HA2 GLY 38 -14.409 2.951 1.172 314 HA3 GLY 38 HA3 GLY 38 -14.339 4.125 2.479 315 H LYS 39 H LYS 39 -11.703 4.436 0.415 316 HA LYS 39 HA LYS 39 -13.066 6.371 -1.315 317 HB2 LYS 39 HB2 LYS 39 -11.717 7.235 0.876 318 HB3 LYS 39 HB3 LYS 39 -10.421 7.222 -0.313 319 HG2 LYS 39 HG2 LYS 39 -11.393 8.865 -1.594 320 HG3 LYS 39 HG3 LYS 39 -13.017 8.520 -0.994 321 HD2 LYS 39 HD2 LYS 39 -12.789 9.907 0.760 322 HD3 LYS 39 HD3 LYS 39 -11.128 9.396 1.070 323 HE2 LYS 39 HE2 LYS 39 -10.263 10.891 -0.531 324 HE3 LYS 39 HE3 LYS 39 -11.849 11.169 -1.247 325 HZ1 LYS 39 HZ1 LYS 39 -11.959 12.954 0.044 326 HZ2 LYS 39 HZ2 LYS 39 -10.598 12.502 0.941 327 HZ3 LYS 39 HZ3 LYS 39 -12.126 11.917 1.371 328 H VAL 40 H VAL 40 -12.104 6.703 -3.318 329 HA VAL 40 HA VAL 40 -10.672 4.548 -4.410 330 HB VAL 40 HB VAL 40 -12.141 6.234 -5.642 331 HG11 VAL 40 HG11 VAL 40 -9.568 7.784 -5.849 332 HG12 VAL 40 HG12 VAL 40 -11.153 8.223 -6.489 333 HG13 VAL 40 HG13 VAL 40 -10.876 8.214 -4.747 334 HG21 VAL 40 HG21 VAL 40 -10.258 6.195 -7.601 335 HG22 VAL 40 HG22 VAL 40 -9.668 4.925 -6.529 336 HG23 VAL 40 HG23 VAL 40 -11.301 4.834 -7.188 337 H VAL 41 H VAL 41 -8.543 4.246 -4.920 338 HA VAL 41 HA VAL 41 -6.643 6.298 -3.991 339 HB VAL 41 HB VAL 41 -5.106 4.378 -3.398 340 HG11 VAL 41 HG11 VAL 41 -6.774 5.764 -1.870 341 HG12 VAL 41 HG12 VAL 41 -7.489 4.167 -1.640 342 HG13 VAL 41 HG13 VAL 41 -5.796 4.444 -1.228 343 HG21 VAL 41 HG21 VAL 41 -7.622 2.734 -3.334 344 HG22 VAL 41 HG22 VAL 41 -6.511 2.710 -4.703 345 HG23 VAL 41 HG23 VAL 41 -5.957 2.199 -3.109 346 H LYS 42 H LYS 42 -7.459 3.841 -6.316 347 HA LYS 42 HA LYS 42 -5.579 4.979 -8.201 348 HB2 LYS 42 HB2 LYS 42 -4.670 2.863 -6.745 349 HB3 LYS 42 HB3 LYS 42 -5.388 2.039 -8.123 350 HG2 LYS 42 HG2 LYS 42 -4.008 3.364 -9.640 351 HG3 LYS 42 HG3 LYS 42 -3.291 4.198 -8.260 352 HD2 LYS 42 HD2 LYS 42 -3.199 1.231 -8.270 353 HD3 LYS 42 HD3 LYS 42 -2.145 2.083 -9.402 354 HE2 LYS 42 HE2 LYS 42 -2.228 2.982 -6.563 355 HE3 LYS 42 HE3 LYS 42 -1.351 1.504 -6.956 356 HZ1 LYS 42 HZ1 LYS 42 -0.859 3.938 -8.529 357 HZ2 LYS 42 HZ2 LYS 42 0.175 2.637 -8.217 358 HZ3 LYS 42 HZ3 LYS 42 -0.139 3.776 -7.007 359 H ASN 43 H ASN 43 -5.853 4.008 -10.396 360 HA ASN 43 HA ASN 43 -8.453 2.722 -10.794 361 HB2 ASN 43 HB2 ASN 43 -8.670 4.388 -12.818 362 HB3 ASN 43 HB3 ASN 43 -9.188 4.875 -11.207 363 HD21 ASN 43 HD21 ASN 43 -8.386 6.684 -10.403 364 HD22 ASN 43 HD22 ASN 43 -7.019 7.542 -11.021 365 H TRP 44 H TRP 44 -8.331 1.105 -12.207 366 HA TRP 44 HA TRP 44 -5.946 0.941 -13.920 367 HB2 TRP 44 HB2 TRP 44 -7.785 -1.219 -12.872 368 HB3 TRP 44 HB3 TRP 44 -6.489 -1.506 -14.030 369 HD1 TRP 44 HD1 TRP 44 -7.050 -0.555 -10.351 370 HE1 TRP 44 HE1 TRP 44 -4.883 -1.036 -9.047 371 HE3 TRP 44 HE3 TRP 44 -3.995 -1.758 -14.269 372 HZ2 TRP 44 HZ2 TRP 44 -2.230 -1.821 -9.606 373 HZ3 TRP 44 HZ3 TRP 44 -1.657 -2.362 -13.799 374 HH2 TRP 44 HH2 TRP 44 -0.794 -2.391 -11.515 375 H VAL 45 H VAL 45 -6.126 0.431 -16.101 376 HA VAL 45 HA VAL 45 -8.841 0.678 -17.226 377 HB VAL 45 HB VAL 45 -7.279 2.625 -17.646 378 HG11 VAL 45 HG11 VAL 45 -5.905 0.623 -19.436 379 HG12 VAL 45 HG12 VAL 45 -5.561 2.352 -19.350 380 HG13 VAL 45 HG13 VAL 45 -5.231 1.316 -17.961 381 HG21 VAL 45 HG21 VAL 45 -9.194 1.467 -19.230 382 HG22 VAL 45 HG22 VAL 45 -8.473 3.055 -19.490 383 HG23 VAL 45 HG23 VAL 45 -7.834 1.648 -20.339 384 H MET 46 H MET 46 -9.484 -0.775 -18.734 385 HA MET 46 HA MET 46 -7.574 -2.914 -19.401 386 HB2 MET 46 HB2 MET 46 -9.376 -3.818 -18.134 387 HB3 MET 46 HB3 MET 46 -10.572 -2.942 -19.081 388 HG2 MET 46 HG2 MET 46 -8.989 -4.637 -20.777 389 HG3 MET 46 HG3 MET 46 -9.690 -5.560 -19.451 390 HE1 MET 46 HE1 MET 46 -13.465 -5.166 -19.886 391 HE2 MET 46 HE2 MET 46 -12.256 -6.391 -19.501 392 HE3 MET 46 HE3 MET 46 -12.221 -4.830 -18.681 393 H ASP 47 H ASP 47 -6.872 -2.931 -21.423 394 HA ASP 47 HA ASP 47 -7.819 -1.250 -23.450 395 HB2 ASP 47 HB2 ASP 47 -5.583 -2.715 -23.139 396 HB3 ASP 47 HB3 ASP 47 -6.451 -3.753 -24.267 397 H LEU 48 H LEU 48 -7.992 -2.861 -25.729 398 HA LEU 48 HA LEU 48 -10.265 -4.637 -25.317 399 HB2 LEU 48 HB2 LEU 48 -10.897 -2.121 -25.788 400 HB3 LEU 48 HB3 LEU 48 -10.540 -2.580 -27.452 401 HG LEU 48 HG LEU 48 -12.717 -3.608 -25.654 402 HD11 LEU 48 HD11 LEU 48 -13.559 -1.795 -26.775 403 HD12 LEU 48 HD12 LEU 48 -13.942 -3.088 -27.910 404 HD13 LEU 48 HD13 LEU 48 -12.540 -2.056 -28.191 405 HD21 LEU 48 HD21 LEU 48 -11.971 -5.615 -26.561 406 HD22 LEU 48 HD22 LEU 48 -11.518 -4.869 -28.094 407 HD23 LEU 48 HD23 LEU 48 -13.221 -5.099 -27.694 408 H LYS 49 H LYS 49 -8.263 -3.042 -27.794 409 HA LYS 49 HA LYS 49 -8.536 -5.163 -29.676 410 HB2 LYS 49 HB2 LYS 49 -6.790 -2.735 -29.463 411 HB3 LYS 49 HB3 LYS 49 -6.445 -3.956 -30.681 412 HG2 LYS 49 HG2 LYS 49 -8.756 -3.687 -31.534 413 HG3 LYS 49 HG3 LYS 49 -8.986 -2.369 -30.383 414 HD2 LYS 49 HD2 LYS 49 -7.290 -1.058 -31.435 415 HD3 LYS 49 HD3 LYS 49 -6.790 -2.414 -32.448 416 HE2 LYS 49 HE2 LYS 49 -8.077 -1.142 -33.896 417 HE3 LYS 49 HE3 LYS 49 -9.224 -2.350 -33.320 418 HZ1 LYS 49 HZ1 LYS 49 -9.646 0.306 -33.292 419 HZ2 LYS 49 HZ2 LYS 49 -9.111 0.041 -31.710 420 HZ3 LYS 49 HZ3 LYS 49 -10.452 -0.803 -32.302 421 H ASN 50 H ASN 50 -6.423 -4.548 -27.006 422 HA ASN 50 HA ASN 50 -4.638 -6.727 -27.835 423 HB2 ASN 50 HB2 ASN 50 -4.234 -4.241 -26.440 424 HB3 ASN 50 HB3 ASN 50 -3.704 -5.583 -25.431 425 HD21 ASN 50 HD21 ASN 50 -2.387 -3.400 -27.150 426 HD22 ASN 50 HD22 ASN 50 -1.169 -4.265 -28.017 427 H VAL 51 H VAL 51 -7.051 -5.838 -25.518 428 HA VAL 51 HA VAL 51 -8.193 -7.075 -23.978 429 HB VAL 51 HB VAL 51 -6.553 -9.492 -24.687 430 HG11 VAL 51 HG11 VAL 51 -8.118 -10.658 -23.591 431 HG12 VAL 51 HG12 VAL 51 -8.575 -9.107 -22.885 432 HG13 VAL 51 HG13 VAL 51 -9.439 -9.725 -24.293 433 HG21 VAL 51 HG21 VAL 51 -8.495 -8.026 -26.365 434 HG22 VAL 51 HG22 VAL 51 -7.149 -9.066 -26.831 435 HG23 VAL 51 HG23 VAL 51 -8.673 -9.779 -26.302 436 H LYS 52 H LYS 52 -5.848 -5.636 -23.269 437 HA LYS 52 HA LYS 52 -5.045 -7.172 -20.897 438 HB2 LYS 52 HB2 LYS 52 -3.206 -7.261 -22.534 439 HB3 LYS 52 HB3 LYS 52 -3.187 -5.504 -22.605 440 HG2 LYS 52 HG2 LYS 52 -1.420 -6.072 -21.188 441 HG3 LYS 52 HG3 LYS 52 -2.719 -5.565 -20.106 442 HD2 LYS 52 HD2 LYS 52 -3.190 -7.764 -19.456 443 HD3 LYS 52 HD3 LYS 52 -2.332 -8.451 -20.837 444 HE2 LYS 52 HE2 LYS 52 -0.963 -6.881 -18.665 445 HE3 LYS 52 HE3 LYS 52 -1.167 -8.630 -18.601 446 HZ1 LYS 52 HZ1 LYS 52 0.764 -8.682 -19.688 447 HZ2 LYS 52 HZ2 LYS 52 0.678 -7.056 -20.147 448 HZ3 LYS 52 HZ3 LYS 52 -0.120 -8.236 -21.060 449 H LEU 53 H LEU 53 -4.799 -5.994 -19.023 450 HA LEU 53 HA LEU 53 -5.625 -3.171 -19.185 451 HB2 LEU 53 HB2 LEU 53 -6.920 -3.419 -17.344 452 HB3 LEU 53 HB3 LEU 53 -6.994 -5.072 -17.950 453 HG LEU 53 HG LEU 53 -5.087 -4.155 -15.803 454 HD11 LEU 53 HD11 LEU 53 -7.289 -5.904 -15.027 455 HD12 LEU 53 HD12 LEU 53 -7.806 -4.295 -15.528 456 HD13 LEU 53 HD13 LEU 53 -6.633 -4.477 -14.225 457 HD21 LEU 53 HD21 LEU 53 -5.452 -6.604 -17.312 458 HD22 LEU 53 HD22 LEU 53 -5.583 -6.867 -15.573 459 HD23 LEU 53 HD23 LEU 53 -4.134 -6.119 -16.246 460 H VAL 54 H VAL 54 -4.433 -1.625 -18.182 461 HA VAL 54 HA VAL 54 -2.170 -2.463 -16.513 462 HB VAL 54 HB VAL 54 -1.744 -0.286 -18.521 463 HG11 VAL 54 HG11 VAL 54 -0.010 -2.177 -16.959 464 HG12 VAL 54 HG12 VAL 54 0.611 -1.251 -18.326 465 HG13 VAL 54 HG13 VAL 54 -0.037 -0.414 -16.915 466 HG21 VAL 54 HG21 VAL 54 -0.602 -2.223 -19.870 467 HG22 VAL 54 HG22 VAL 54 -1.807 -3.220 -19.055 468 HG23 VAL 54 HG23 VAL 54 -2.318 -1.878 -20.078 469 H GLU 55 H GLU 55 -1.193 -0.630 -15.320 470 HA GLU 55 HA GLU 55 -3.187 0.887 -14.013 471 HB2 GLU 55 HB2 GLU 55 -1.200 2.041 -12.941 472 HB3 GLU 55 HB3 GLU 55 -1.278 0.296 -12.742 473 HG2 GLU 55 HG2 GLU 55 0.624 -0.040 -13.859 474 HG3 GLU 55 HG3 GLU 55 0.224 1.150 -15.096 475 H SER 56 H SER 56 -4.278 2.358 -15.195 476 HA SER 56 HA SER 56 -2.832 4.712 -16.071 477 HB2 SER 56 HB2 SER 56 -3.158 2.859 -17.987 478 HB3 SER 56 HB3 SER 56 -4.720 3.668 -18.116 479 HG SER 56 HG SER 56 -2.139 4.802 -18.391 480 H ASP 57 H ASP 57 -4.422 6.405 -16.893 481 HA ASP 57 HA ASP 57 -6.919 6.206 -15.341 482 HB2 ASP 57 HB2 ASP 57 -4.900 7.994 -14.921 483 HB3 ASP 57 HB3 ASP 57 -5.946 8.905 -16.006 484 H ASP 58 H ASP 58 -5.961 5.872 -18.339 485 HA ASP 58 HA ASP 58 -7.216 7.724 -19.953 486 HB2 ASP 58 HB2 ASP 58 -5.779 5.859 -20.756 487 HB3 ASP 58 HB3 ASP 58 -7.103 4.741 -20.442 488 H ALA 59 H ALA 59 -9.257 7.778 -20.999 489 HA ALA 59 HA ALA 59 -11.457 7.351 -19.302 490 HB1 ALA 59 HB1 ALA 59 -12.453 7.549 -21.914 491 HB2 ALA 59 HB2 ALA 59 -12.276 8.842 -20.728 492 HB3 ALA 59 HB3 ALA 59 -10.980 8.519 -21.880 493 H ALA 60 H ALA 60 -13.445 6.101 -20.009 494 HA ALA 60 HA ALA 60 -12.960 3.679 -21.510 495 HB1 ALA 60 HB1 ALA 60 -12.049 3.070 -19.334 496 HB2 ALA 60 HB2 ALA 60 -13.569 3.520 -18.561 497 HB3 ALA 60 HB3 ALA 60 -13.519 2.158 -19.680 498 H GLU 61 H GLU 61 -14.950 2.302 -21.602 499 HA GLU 61 HA GLU 61 -17.203 3.926 -22.198 500 HB2 GLU 61 HB2 GLU 61 -16.978 0.919 -21.985 501 HB3 GLU 61 HB3 GLU 61 -18.342 1.785 -22.679 502 HG2 GLU 61 HG2 GLU 61 -15.553 1.530 -23.736 503 HG3 GLU 61 HG3 GLU 61 -17.075 1.091 -24.509 504 H ALA 62 H ALA 62 -16.169 2.214 -19.386 505 HA ALA 62 HA ALA 62 -18.365 3.294 -17.863 506 HB1 ALA 62 HB1 ALA 62 -18.293 0.453 -18.641 507 HB2 ALA 62 HB2 ALA 62 -18.635 0.778 -16.941 508 HB3 ALA 62 HB3 ALA 62 -19.658 1.477 -18.196 509 H THR 63 H THR 63 -18.106 2.907 -15.533 510 HA THR 63 HA THR 63 -15.325 2.263 -14.801 511 HB THR 63 HB THR 63 -16.978 4.441 -13.515 512 HG1 THR 63 HG1 THR 63 -16.437 5.160 -15.557 513 HG21 THR 63 HG21 THR 63 -14.311 4.922 -13.032 514 HG22 THR 63 HG22 THR 63 -14.423 3.166 -12.914 515 HG23 THR 63 HG23 THR 63 -15.444 4.185 -11.901 516 H LEU 64 H LEU 64 -15.098 0.834 -13.198 517 HA LEU 64 HA LEU 64 -17.474 0.184 -11.581 518 HB2 LEU 64 HB2 LEU 64 -17.035 -1.690 -12.921 519 HB3 LEU 64 HB3 LEU 64 -15.293 -1.548 -12.695 520 HG LEU 64 HG LEU 64 -15.663 -2.195 -10.289 521 HD11 LEU 64 HD11 LEU 64 -18.250 -1.672 -10.703 522 HD12 LEU 64 HD12 LEU 64 -17.684 -2.806 -9.477 523 HD13 LEU 64 HD13 LEU 64 -18.255 -3.405 -11.034 524 HD21 LEU 64 HD21 LEU 64 -16.643 -4.574 -11.509 525 HD22 LEU 64 HD22 LEU 64 -14.997 -4.182 -11.012 526 HD23 LEU 64 HD23 LEU 64 -15.550 -3.770 -12.635 527 H THR 65 H THR 65 -17.236 1.070 -9.634 528 HA THR 65 HA THR 65 -14.579 1.216 -8.419 529 HB THR 65 HB THR 65 -17.097 2.360 -7.229 530 HG1 THR 65 HG1 THR 65 -16.848 3.140 -9.399 531 HG21 THR 65 HG21 THR 65 -15.670 3.039 -5.659 532 HG22 THR 65 HG22 THR 65 -14.840 4.010 -6.875 533 HG23 THR 65 HG23 THR 65 -14.311 2.359 -6.554 534 H MET 66 H MET 66 -13.948 -0.305 -7.048 535 HA MET 66 HA MET 66 -15.861 -1.455 -5.174 536 HB2 MET 66 HB2 MET 66 -14.902 -2.855 -7.487 537 HB3 MET 66 HB3 MET 66 -14.272 -3.630 -6.040 538 HG2 MET 66 HG2 MET 66 -16.669 -3.588 -5.179 539 HG3 MET 66 HG3 MET 66 -17.128 -3.204 -6.837 540 HE1 MET 66 HE1 MET 66 -17.120 -5.741 -8.861 541 HE2 MET 66 HE2 MET 66 -16.073 -4.328 -8.725 542 HE3 MET 66 HE3 MET 66 -15.372 -5.947 -8.754 543 H GLU 67 H GLU 67 -14.994 -1.796 -3.209 544 HA GLU 67 HA GLU 67 -12.453 -0.792 -2.573 545 HB2 GLU 67 HB2 GLU 67 -14.706 -1.795 -1.166 546 HB3 GLU 67 HB3 GLU 67 -13.292 -2.652 -0.570 547 HG2 GLU 67 HG2 GLU 67 -12.429 -0.052 -0.648 548 HG3 GLU 67 HG3 GLU 67 -14.117 0.108 -0.166 549 H ASP 68 H ASP 68 -10.752 -2.073 -1.388 550 HA ASP 68 HA ASP 68 -9.734 -4.085 -3.107 551 HB2 ASP 68 HB2 ASP 68 -8.439 -2.443 -1.599 552 HB3 ASP 68 HB3 ASP 68 -8.747 -3.599 -0.306 553 H ASP 69 H ASP 69 -11.099 -4.187 0.169 554 HA ASP 69 HA ASP 69 -10.812 -6.986 0.499 555 HB2 ASP 69 HB2 ASP 69 -11.242 -5.142 2.276 556 HB3 ASP 69 HB3 ASP 69 -12.942 -5.377 1.878 557 H ILE 70 H ILE 70 -13.303 -4.966 -0.900 558 HA ILE 70 HA ILE 70 -15.235 -7.093 -1.087 559 HB ILE 70 HB ILE 70 -15.138 -4.278 -2.129 560 HG12 ILE 70 HG12 ILE 70 -17.531 -4.884 -0.762 561 HG13 ILE 70 HG13 ILE 70 -16.236 -5.638 0.161 562 HG21 ILE 70 HG21 ILE 70 -17.626 -4.974 -2.793 563 HG22 ILE 70 HG22 ILE 70 -16.275 -5.078 -3.920 564 HG23 ILE 70 HG23 ILE 70 -16.824 -6.520 -3.068 565 HD11 ILE 70 HD11 ILE 70 -16.690 -3.408 0.976 566 HD12 ILE 70 HD12 ILE 70 -15.077 -3.485 0.266 567 HD13 ILE 70 HD13 ILE 70 -16.400 -2.740 -0.630 568 H MET 71 H MET 71 -13.243 -5.286 -3.425 569 HA MET 71 HA MET 71 -13.989 -6.621 -5.732 570 HB2 MET 71 HB2 MET 71 -12.508 -4.584 -5.549 571 HB3 MET 71 HB3 MET 71 -11.186 -5.669 -5.141 572 HG2 MET 71 HG2 MET 71 -10.805 -5.553 -7.353 573 HG3 MET 71 HG3 MET 71 -12.012 -6.836 -7.395 574 HE1 MET 71 HE1 MET 71 -12.127 -4.368 -10.436 575 HE2 MET 71 HE2 MET 71 -11.446 -3.213 -9.290 576 HE3 MET 71 HE3 MET 71 -10.805 -4.855 -9.376 577 H PHE 72 H PHE 72 -11.679 -7.558 -3.252 578 HA PHE 72 HA PHE 72 -10.419 -9.666 -4.579 579 HB2 PHE 72 HB2 PHE 72 -9.946 -8.581 -2.250 580 HB3 PHE 72 HB3 PHE 72 -11.036 -9.826 -1.648 581 HD1 PHE 72 HD2 PHE 72 -8.306 -9.774 -4.195 582 HD2 PHE 72 HD1 PHE 72 -9.881 -11.532 -0.653 583 HE1 PHE 72 HE2 PHE 72 -6.445 -11.382 -4.170 584 HE2 PHE 72 HE1 PHE 72 -8.022 -13.144 -0.622 585 HZ PHE 72 HZ PHE 72 -6.301 -13.071 -2.383 586 H ALA 73 H ALA 73 -13.348 -9.661 -2.575 587 HA ALA 73 HA ALA 73 -13.854 -12.420 -2.679 588 HB1 ALA 73 HB1 ALA 73 -15.506 -11.853 -1.311 589 HB2 ALA 73 HB2 ALA 73 -15.091 -10.158 -1.573 590 HB3 ALA 73 HB3 ALA 73 -16.306 -10.935 -2.588 591 H ILE 74 H ILE 74 -15.114 -9.771 -4.695 592 HA ILE 74 HA ILE 74 -16.629 -11.470 -6.396 593 HB ILE 74 HB ILE 74 -15.601 -8.776 -7.234 594 HG12 ILE 74 HG12 ILE 74 -16.367 -8.379 -5.002 595 HG13 ILE 74 HG13 ILE 74 -17.640 -7.834 -6.087 596 HG21 ILE 74 HG21 ILE 74 -18.234 -10.169 -7.699 597 HG22 ILE 74 HG22 ILE 74 -17.714 -8.640 -8.406 598 HG23 ILE 74 HG23 ILE 74 -16.886 -10.137 -8.836 599 HD11 ILE 74 HD11 ILE 74 -17.572 -10.328 -4.422 600 HD12 ILE 74 HD12 ILE 74 -18.702 -8.976 -4.327 601 HD13 ILE 74 HD13 ILE 74 -18.744 -10.066 -5.713 602 H GLY 75 H GLY 75 -13.301 -10.718 -6.210 603 HA2 GLY 75 HA2 GLY 75 -12.766 -11.329 -9.004 604 HA3 GLY 75 HA3 GLY 75 -11.577 -10.898 -7.784 605 H THR 76 H THR 76 -12.442 -12.864 -5.856 606 HA THR 76 HA THR 76 -11.172 -15.198 -7.074 607 HB THR 76 HB THR 76 -10.238 -14.345 -4.955 608 HG1 THR 76 HG1 THR 76 -9.818 -16.460 -5.098 609 HG21 THR 76 HG21 THR 76 -11.528 -13.768 -3.232 610 HG22 THR 76 HG22 THR 76 -12.219 -15.389 -3.160 611 HG23 THR 76 HG23 THR 76 -12.945 -14.166 -4.203 612 H GLY 77 H GLY 77 -14.006 -14.466 -7.553 613 HA2 GLY 77 HA2 GLY 77 -16.073 -15.468 -7.641 614 HA3 GLY 77 HA3 GLY 77 -15.162 -16.971 -7.618 615 H ALA 78 H ALA 78 -15.033 -14.723 -4.957 616 HA ALA 78 HA ALA 78 -16.059 -16.756 -3.176 617 HB1 ALA 78 HB1 ALA 78 -15.460 -15.198 -1.390 618 HB2 ALA 78 HB2 ALA 78 -14.121 -15.433 -2.515 619 HB3 ALA 78 HB3 ALA 78 -15.090 -13.961 -2.591 620 H LEU 79 H LEU 79 -16.795 -13.279 -3.192 621 HA LEU 79 HA LEU 79 -19.567 -13.919 -2.522 622 HB2 LEU 79 HB2 LEU 79 -17.765 -11.956 -1.668 623 HB3 LEU 79 HB3 LEU 79 -18.974 -11.102 -2.624 624 HG LEU 79 HG LEU 79 -20.173 -12.948 -0.726 625 HD11 LEU 79 HD11 LEU 79 -17.940 -12.058 0.352 626 HD12 LEU 79 HD12 LEU 79 -19.436 -12.148 1.280 627 HD13 LEU 79 HD13 LEU 79 -18.911 -10.607 0.602 628 HD21 LEU 79 HD21 LEU 79 -20.602 -10.058 -0.475 629 HD22 LEU 79 HD22 LEU 79 -21.765 -11.366 -0.690 630 HD23 LEU 79 HD23 LEU 79 -20.907 -10.710 -2.085 631 HA PRO 80 HA PRO 80 -21.058 -12.995 -6.560 632 HB2 PRO 80 HB2 PRO 80 -23.623 -12.364 -5.934 633 HB3 PRO 80 HB3 PRO 80 -23.008 -14.021 -5.910 634 HG2 PRO 80 HG2 PRO 80 -23.407 -12.116 -3.635 635 HG3 PRO 80 HG3 PRO 80 -23.785 -13.846 -3.725 636 HD2 PRO 80 HD2 PRO 80 -21.566 -12.903 -2.494 637 HD3 PRO 80 HD3 PRO 80 -21.604 -14.473 -3.322 638 H ALA 81 H ALA 81 -20.653 -11.221 -7.708 639 HA ALA 81 HA ALA 81 -20.280 -8.669 -6.716 640 HB1 ALA 81 HB1 ALA 81 -19.962 -9.862 -9.147 641 HB2 ALA 81 HB2 ALA 81 -21.267 -8.720 -9.470 642 HB3 ALA 81 HB3 ALA 81 -19.732 -8.143 -8.823 643 H LYS 82 H LYS 82 -23.228 -10.274 -7.584 644 HA LYS 82 HA LYS 82 -24.876 -8.013 -7.951 645 HB2 LYS 82 HB2 LYS 82 -25.831 -10.634 -6.820 646 HB3 LYS 82 HB3 LYS 82 -26.709 -9.500 -7.838 647 HG2 LYS 82 HG2 LYS 82 -24.626 -10.150 -9.451 648 HG3 LYS 82 HG3 LYS 82 -24.868 -11.659 -8.567 649 HD2 LYS 82 HD2 LYS 82 -27.392 -11.218 -9.134 650 HD3 LYS 82 HD3 LYS 82 -26.711 -10.223 -10.423 651 HE2 LYS 82 HE2 LYS 82 -25.223 -12.423 -10.743 652 HE3 LYS 82 HE3 LYS 82 -26.671 -13.161 -10.058 653 HZ1 LYS 82 HZ1 LYS 82 -26.960 -11.241 -12.260 654 HZ2 LYS 82 HZ2 LYS 82 -27.937 -12.559 -11.848 655 HZ3 LYS 82 HZ3 LYS 82 -26.450 -12.815 -12.614 656 H GLU 83 H GLU 83 -24.395 -10.094 -5.096 657 HA GLU 83 HA GLU 83 -26.033 -8.650 -3.349 658 HB2 GLU 83 HB2 GLU 83 -23.625 -10.395 -2.840 659 HB3 GLU 83 HB3 GLU 83 -24.593 -9.707 -1.545 660 HG2 GLU 83 HG2 GLU 83 -25.826 -11.374 -3.705 661 HG3 GLU 83 HG3 GLU 83 -25.090 -12.100 -2.278 662 H ALA 84 H ALA 84 -22.497 -8.483 -3.760 663 HA ALA 84 HA ALA 84 -21.911 -6.509 -1.936 664 HB1 ALA 84 HB1 ALA 84 -20.628 -6.770 -4.651 665 HB2 ALA 84 HB2 ALA 84 -19.916 -6.071 -3.196 666 HB3 ALA 84 HB3 ALA 84 -20.256 -7.800 -3.268 667 H MET 85 H MET 85 -22.990 -6.111 -5.294 668 HA MET 85 HA MET 85 -22.879 -3.270 -5.260 669 HB2 MET 85 HB2 MET 85 -23.361 -5.271 -7.172 670 HB3 MET 85 HB3 MET 85 -24.822 -4.293 -7.134 671 HG2 MET 85 HG2 MET 85 -23.232 -2.285 -7.318 672 HG3 MET 85 HG3 MET 85 -22.029 -3.472 -7.815 673 HE1 MET 85 HE1 MET 85 -24.838 -5.300 -9.705 674 HE2 MET 85 HE2 MET 85 -23.512 -5.118 -10.853 675 HE3 MET 85 HE3 MET 85 -23.171 -5.500 -9.164 676 H ALA 86 H ALA 86 -25.331 -5.632 -4.443 677 HA ALA 86 HA ALA 86 -27.505 -3.792 -4.313 678 HB1 ALA 86 HB1 ALA 86 -27.167 -6.531 -3.098 679 HB2 ALA 86 HB2 ALA 86 -28.676 -5.618 -3.128 680 HB3 ALA 86 HB3 ALA 86 -27.934 -6.144 -4.639 681 H GLN 87 H GLN 87 -24.954 -4.690 -2.157 682 HA GLN 87 HA GLN 87 -26.286 -3.556 0.167 683 HB2 GLN 87 HB2 GLN 87 -23.503 -4.702 -0.122 684 HB3 GLN 87 HB3 GLN 87 -24.268 -4.236 1.391 685 HG2 GLN 87 HG2 GLN 87 -25.914 -6.085 -0.094 686 HG3 GLN 87 HG3 GLN 87 -24.302 -6.738 0.198 687 HE21 GLN 87 HE21 GLN 87 -25.141 -8.288 1.609 688 HE22 GLN 87 HE22 GLN 87 -25.659 -7.881 3.206 689 H ASP 88 H ASP 88 -25.130 -2.120 -2.367 690 HA ASP 88 HA ASP 88 -24.282 -0.060 -2.827 691 HB2 ASP 88 HB2 ASP 88 -24.339 0.574 0.114 692 HB3 ASP 88 HB3 ASP 88 -24.570 1.664 -1.250 693 H LYS 89 H LYS 89 -22.577 -2.369 -1.874 694 HA LYS 89 HA LYS 89 -20.259 -0.979 -0.777 695 HB2 LYS 89 HB2 LYS 89 -20.783 -3.895 -1.368 696 HB3 LYS 89 HB3 LYS 89 -19.254 -3.284 -0.750 697 HG2 LYS 89 HG2 LYS 89 -20.713 -2.274 1.141 698 HG3 LYS 89 HG3 LYS 89 -21.908 -3.459 0.607 699 HD2 LYS 89 HD2 LYS 89 -19.429 -4.801 0.782 700 HD3 LYS 89 HD3 LYS 89 -19.603 -3.843 2.255 701 HE2 LYS 89 HE2 LYS 89 -22.101 -4.917 1.962 702 HE3 LYS 89 HE3 LYS 89 -21.070 -6.213 1.360 703 HZ1 LYS 89 HZ1 LYS 89 -21.581 -5.527 4.009 704 HZ2 LYS 89 HZ2 LYS 89 -19.954 -5.170 3.719 705 HZ3 LYS 89 HZ3 LYS 89 -20.541 -6.730 3.431 706 H MET 90 H MET 90 -21.540 -1.436 -3.764 707 HA MET 90 HA MET 90 -19.007 -0.875 -5.049 708 HB2 MET 90 HB2 MET 90 -18.797 -3.167 -5.345 709 HB3 MET 90 HB3 MET 90 -20.533 -3.412 -5.485 710 HG2 MET 90 HG2 MET 90 -20.467 -2.300 -7.693 711 HG3 MET 90 HG3 MET 90 -18.714 -2.199 -7.550 712 HE1 MET 90 HE1 MET 90 -20.341 -3.172 -9.766 713 HE2 MET 90 HE2 MET 90 -19.705 -4.727 -10.303 714 HE3 MET 90 HE3 MET 90 -21.261 -4.649 -9.474 715 H GLU 91 H GLU 91 -19.235 0.400 -6.821 716 HA GLU 91 HA GLU 91 -21.973 0.851 -7.813 717 HB2 GLU 91 HB2 GLU 91 -19.822 2.931 -7.378 718 HB3 GLU 91 HB3 GLU 91 -21.391 3.231 -8.112 719 HG2 GLU 91 HG2 GLU 91 -21.989 3.830 -6.046 720 HG3 GLU 91 HG3 GLU 91 -22.136 2.095 -5.774 721 H VAL 92 H VAL 92 -22.138 1.579 -10.011 722 HA VAL 92 HA VAL 92 -19.747 1.219 -11.664 723 HB VAL 92 HB VAL 92 -22.289 -0.038 -12.606 724 HG11 VAL 92 HG11 VAL 92 -20.583 0.111 -14.238 725 HG12 VAL 92 HG12 VAL 92 -19.352 -0.457 -13.108 726 HG13 VAL 92 HG13 VAL 92 -20.594 -1.566 -13.692 727 HG21 VAL 92 HG21 VAL 92 -21.308 -2.219 -11.658 728 HG22 VAL 92 HG22 VAL 92 -20.407 -1.170 -10.564 729 HG23 VAL 92 HG23 VAL 92 -22.170 -1.145 -10.556 730 H ASP 93 H ASP 93 -19.680 2.488 -13.461 731 HA ASP 93 HA ASP 93 -22.048 4.156 -14.005 732 HB2 ASP 93 HB2 ASP 93 -19.603 5.040 -13.031 733 HB3 ASP 93 HB3 ASP 93 -19.512 5.382 -14.756 734 H GLY 94 H GLY 94 -21.800 5.262 -16.242 735 HA2 GLY 94 HA2 GLY 94 -21.223 5.115 -18.517 736 HA3 GLY 94 HA3 GLY 94 -20.438 3.576 -18.196 737 H GLN 95 H GLN 95 -21.406 1.916 -19.129 738 HA GLN 95 HA GLN 95 -24.288 2.090 -19.673 739 HB2 GLN 95 HB2 GLN 95 -22.044 1.212 -21.227 740 HB3 GLN 95 HB3 GLN 95 -23.159 -0.131 -21.014 741 HG2 GLN 95 HG2 GLN 95 -23.481 1.340 -23.055 742 HG3 GLN 95 HG3 GLN 95 -24.905 0.996 -22.075 743 HE21 GLN 95 HE21 GLN 95 -26.016 2.640 -21.203 744 HE22 GLN 95 HE22 GLN 95 -25.569 4.305 -21.326 745 H VAL 96 H VAL 96 -25.373 1.209 -18.016 746 HA VAL 96 HA VAL 96 -24.422 -0.847 -16.345 747 HB VAL 96 HB VAL 96 -27.275 0.000 -16.871 748 HG11 VAL 96 HG11 VAL 96 -27.324 -2.158 -15.871 749 HG12 VAL 96 HG12 VAL 96 -26.067 -1.720 -14.714 750 HG13 VAL 96 HG13 VAL 96 -27.668 -0.990 -14.597 751 HG21 VAL 96 HG21 VAL 96 -26.081 0.776 -14.342 752 HG22 VAL 96 HG22 VAL 96 -25.212 1.444 -15.724 753 HG23 VAL 96 HG23 VAL 96 -26.937 1.754 -15.534 754 H GLU 97 H GLU 97 -25.858 -0.916 -19.465 755 HA GLU 97 HA GLU 97 -26.900 -3.574 -19.337 756 HB2 GLU 97 HB2 GLU 97 -27.294 -1.524 -21.039 757 HB3 GLU 97 HB3 GLU 97 -26.115 -2.445 -21.963 758 HG2 GLU 97 HG2 GLU 97 -27.660 -4.456 -21.502 759 HG3 GLU 97 HG3 GLU 97 -28.866 -3.233 -21.102 760 H LEU 98 H LEU 98 -23.846 -2.130 -20.293 761 HA LEU 98 HA LEU 98 -22.778 -4.557 -21.397 762 HB2 LEU 98 HB2 LEU 98 -21.884 -1.792 -20.999 763 HB3 LEU 98 HB3 LEU 98 -20.605 -2.998 -20.874 764 HG LEU 98 HG LEU 98 -22.362 -3.230 -23.234 765 HD11 LEU 98 HD11 LEU 98 -20.391 -0.964 -22.967 766 HD12 LEU 98 HD12 LEU 98 -22.144 -0.801 -23.062 767 HD13 LEU 98 HD13 LEU 98 -21.242 -1.437 -24.438 768 HD21 LEU 98 HD21 LEU 98 -20.426 -3.994 -24.266 769 HD22 LEU 98 HD22 LEU 98 -20.244 -4.561 -22.606 770 HD23 LEU 98 HD23 LEU 98 -19.369 -3.129 -23.150 771 H ILE 99 H ILE 99 -22.182 -2.688 -18.426 772 HA ILE 99 HA ILE 99 -20.277 -4.315 -17.257 773 HB ILE 99 HB ILE 99 -20.843 -3.357 -15.153 774 HG12 ILE 99 HG12 ILE 99 -23.495 -2.573 -16.384 775 HG13 ILE 99 HG13 ILE 99 -23.254 -3.849 -15.196 776 HG21 ILE 99 HG21 ILE 99 -20.506 -1.815 -17.481 777 HG22 ILE 99 HG22 ILE 99 -21.689 -0.969 -16.484 778 HG23 ILE 99 HG23 ILE 99 -20.106 -1.373 -15.821 779 HD11 ILE 99 HD11 ILE 99 -24.130 -1.859 -14.146 780 HD12 ILE 99 HD12 ILE 99 -22.490 -2.175 -13.579 781 HD13 ILE 99 HD13 ILE 99 -22.783 -0.909 -14.771 782 H PHE 100 H PHE 100 -23.725 -4.785 -17.525 783 HA PHE 100 HA PHE 100 -23.915 -6.863 -15.581 784 HB2 PHE 100 HB2 PHE 100 -25.751 -5.331 -16.826 785 HB3 PHE 100 HB3 PHE 100 -25.873 -6.789 -17.806 786 HD1 PHE 100 HD1 PHE 100 -25.964 -5.597 -14.290 787 HD2 PHE 100 HD2 PHE 100 -27.148 -8.587 -17.079 788 HE1 PHE 100 HE1 PHE 100 -27.405 -6.619 -12.578 789 HE2 PHE 100 HE2 PHE 100 -28.591 -9.613 -15.371 790 HZ PHE 100 HZ PHE 100 -28.722 -8.629 -13.117 791 H LEU 101 H LEU 101 -23.298 -6.745 -19.033 792 HA LEU 101 HA LEU 101 -23.599 -9.522 -19.525 793 HB2 LEU 101 HB2 LEU 101 -22.100 -7.370 -21.003 794 HB3 LEU 101 HB3 LEU 101 -22.270 -9.022 -21.592 795 HG LEU 101 HG LEU 101 -24.603 -7.192 -21.050 796 HD11 LEU 101 HD11 LEU 101 -23.738 -7.848 -23.809 797 HD12 LEU 101 HD12 LEU 101 -22.830 -6.616 -22.934 798 HD13 LEU 101 HD13 LEU 101 -24.564 -6.419 -23.187 799 HD21 LEU 101 HD21 LEU 101 -25.240 -9.104 -22.962 800 HD22 LEU 101 HD22 LEU 101 -25.756 -9.080 -21.276 801 HD23 LEU 101 HD23 LEU 101 -24.314 -9.983 -21.745 802 H LEU 102 H LEU 102 -21.260 -7.790 -17.843 803 HA LEU 102 HA LEU 102 -19.089 -9.642 -18.422 804 HB2 LEU 102 HB2 LEU 102 -19.342 -7.111 -16.851 805 HB3 LEU 102 HB3 LEU 102 -17.966 -8.181 -16.589 806 HG LEU 102 HG LEU 102 -18.702 -6.814 -19.177 807 HD11 LEU 102 HD11 LEU 102 -16.154 -6.382 -17.704 808 HD12 LEU 102 HD12 LEU 102 -17.611 -5.574 -17.130 809 HD13 LEU 102 HD13 LEU 102 -17.040 -5.297 -18.776 810 HD21 LEU 102 HD21 LEU 102 -17.678 -8.675 -19.992 811 HD22 LEU 102 HD22 LEU 102 -16.781 -8.973 -18.503 812 HD23 LEU 102 HD23 LEU 102 -16.245 -7.717 -19.620 813 H GLU 103 H GLU 103 -21.313 -8.822 -15.822 814 HA GLU 103 HA GLU 103 -20.330 -10.069 -13.642 815 HB2 GLU 103 HB2 GLU 103 -23.050 -9.683 -14.713 816 HB3 GLU 103 HB3 GLU 103 -22.900 -10.952 -13.506 817 HG2 GLU 103 HG2 GLU 103 -21.474 -8.819 -12.450 818 HG3 GLU 103 HG3 GLU 103 -22.900 -8.086 -13.182 819 HA PRO 104 HA PRO 104 -21.835 -14.421 -15.110 820 HB2 PRO 104 HB2 PRO 104 -22.630 -14.654 -17.696 821 HB3 PRO 104 HB3 PRO 104 -23.739 -14.237 -16.383 822 HG2 PRO 104 HG2 PRO 104 -22.396 -12.444 -18.369 823 HG3 PRO 104 HG3 PRO 104 -24.071 -12.414 -17.788 824 HD2 PRO 104 HD2 PRO 104 -22.174 -10.726 -16.850 825 HD3 PRO 104 HD3 PRO 104 -23.509 -11.317 -15.840 826 H PHE 105 H PHE 105 -20.121 -12.336 -17.344 827 HA PHE 105 HA PHE 105 -18.651 -14.352 -18.682 828 HB2 PHE 105 HB2 PHE 105 -18.877 -11.542 -18.812 829 HB3 PHE 105 HB3 PHE 105 -17.175 -11.886 -18.523 830 HD1 PHE 105 HD1 PHE 105 -16.788 -14.388 -19.979 831 HD2 PHE 105 HD2 PHE 105 -19.023 -10.923 -21.033 832 HE1 PHE 105 HE1 PHE 105 -16.492 -14.926 -22.361 833 HE2 PHE 105 HE2 PHE 105 -18.732 -11.456 -23.417 834 HZ PHE 105 HZ PHE 105 -17.465 -13.460 -24.084 835 H ILE 106 H ILE 106 -18.482 -13.181 -15.525 836 HA ILE 106 HA ILE 106 -15.753 -13.230 -14.952 837 HB ILE 106 HB ILE 106 -18.114 -13.913 -13.204 838 HG12 ILE 106 HG12 ILE 106 -16.357 -11.452 -13.322 839 HG13 ILE 106 HG13 ILE 106 -17.950 -11.584 -14.060 840 HG21 ILE 106 HG21 ILE 106 -16.512 -13.540 -11.308 841 HG22 ILE 106 HG22 ILE 106 -16.254 -15.023 -12.225 842 HG23 ILE 106 HG23 ILE 106 -15.204 -13.631 -12.488 843 HD11 ILE 106 HD11 ILE 106 -18.349 -12.327 -11.421 844 HD12 ILE 106 HD12 ILE 106 -17.223 -10.972 -11.341 845 HD13 ILE 106 HD13 ILE 106 -18.770 -10.786 -12.167 846 H ALA 107 H ALA 107 -18.019 -15.826 -15.439 847 HA ALA 107 HA ALA 107 -16.705 -17.931 -14.177 848 HB1 ALA 107 HB1 ALA 107 -18.031 -18.424 -16.795 849 HB2 ALA 107 HB2 ALA 107 -18.146 -19.323 -15.281 850 HB3 ALA 107 HB3 ALA 107 -18.999 -17.790 -15.464 851 H SER 108 H SER 108 -15.887 -16.196 -17.047 852 HA SER 108 HA SER 108 -13.723 -18.125 -17.586 853 HB2 SER 108 HB2 SER 108 -14.837 -16.234 -19.651 854 HB3 SER 108 HB3 SER 108 -13.870 -17.687 -19.902 855 HG SER 108 HG SER 108 -15.968 -18.217 -20.365 856 H LEU 109 H LEU 109 -14.481 -15.034 -16.539 857 HA LEU 109 HA LEU 109 -13.243 -13.196 -16.033 858 HB2 LEU 109 HB2 LEU 109 -10.851 -14.930 -16.616 859 HB3 LEU 109 HB3 LEU 109 -10.889 -13.462 -15.640 860 HG LEU 109 HG LEU 109 -12.717 -15.205 -14.435 861 HD11 LEU 109 HD11 LEU 109 -10.937 -17.072 -13.960 862 HD12 LEU 109 HD12 LEU 109 -10.359 -16.629 -15.566 863 HD13 LEU 109 HD13 LEU 109 -12.019 -17.186 -15.349 864 HD21 LEU 109 HD21 LEU 109 -11.231 -13.555 -13.358 865 HD22 LEU 109 HD22 LEU 109 -9.860 -14.622 -13.665 866 HD23 LEU 109 HD23 LEU 109 -11.159 -15.141 -12.590 867 H LYS 110 H LYS 110 -14.248 -13.093 -18.501 868 HA LYS 110 HA LYS 110 -12.046 -12.214 -20.243 869 HB2 LYS 110 HB2 LYS 110 -14.639 -13.512 -20.735 870 HB3 LYS 110 HB3 LYS 110 -14.273 -12.186 -21.831 871 HG2 LYS 110 HG2 LYS 110 -12.662 -13.334 -22.889 872 HG3 LYS 110 HG3 LYS 110 -12.072 -14.081 -21.402 873 HD2 LYS 110 HD2 LYS 110 -13.971 -15.635 -21.441 874 HD3 LYS 110 HD3 LYS 110 -14.544 -14.892 -22.936 875 HE2 LYS 110 HE2 LYS 110 -13.031 -15.976 -24.194 876 HE3 LYS 110 HE3 LYS 110 -11.744 -15.754 -23.010 877 HZ1 LYS 110 HZ1 LYS 110 -13.196 -17.523 -21.723 878 HZ2 LYS 110 HZ2 LYS 110 -12.017 -17.983 -22.845 879 HZ3 LYS 110 HZ3 LYS 110 -13.647 -17.949 -23.297 Start of MODEL 14 1 H1 MET 1 H MET 1 1.518 1.026 -0.205 2 HA MET 1 HA MET 1 1.839 1.118 -2.938 3 HB2 MET 1 HB2 MET 1 3.480 0.087 -0.685 4 HB3 MET 1 HB3 MET 1 3.959 -0.391 -2.309 5 HG2 MET 1 HG2 MET 1 4.272 1.866 -2.971 6 HG3 MET 1 HG3 MET 1 3.519 2.467 -1.496 7 HE1 MET 1 HE1 MET 1 4.683 3.429 0.174 8 HE2 MET 1 HE2 MET 1 4.877 1.936 1.092 9 HE3 MET 1 HE3 MET 1 6.260 3.001 0.838 10 H SER 2 H SER 2 0.889 -1.567 -0.943 11 HA SER 2 HA SER 2 0.766 -3.262 -3.352 12 HB2 SER 2 HB2 SER 2 1.017 -4.433 -0.598 13 HB3 SER 2 HB3 SER 2 1.438 -5.150 -2.153 14 HG SER 2 HG SER 2 3.028 -3.870 -0.482 15 H LEU 3 H LEU 3 -1.230 -3.778 -3.926 16 HA LEU 3 HA LEU 3 -3.342 -3.734 -1.873 17 HB2 LEU 3 HB2 LEU 3 -3.330 -2.962 -4.762 18 HB3 LEU 3 HB3 LEU 3 -4.831 -3.457 -3.983 19 HG LEU 3 HG LEU 3 -3.232 -1.310 -2.688 20 HD11 LEU 3 HD11 LEU 3 -4.844 -0.948 -5.206 21 HD12 LEU 3 HD12 LEU 3 -3.141 -0.565 -4.955 22 HD13 LEU 3 HD13 LEU 3 -4.386 0.368 -4.125 23 HD21 LEU 3 HD21 LEU 3 -5.534 -0.459 -2.250 24 HD22 LEU 3 HD22 LEU 3 -5.216 -2.058 -1.578 25 HD23 LEU 3 HD23 LEU 3 -6.166 -1.894 -3.056 26 H LYS 4 H LYS 4 -4.767 -5.423 -1.733 27 HA LYS 4 HA LYS 4 -3.902 -7.968 -2.546 28 HB2 LYS 4 HB2 LYS 4 -6.104 -6.848 -1.034 29 HB3 LYS 4 HB3 LYS 4 -6.650 -8.179 -2.046 30 HG2 LYS 4 HG2 LYS 4 -5.827 -9.640 -0.608 31 HG3 LYS 4 HG3 LYS 4 -4.215 -8.942 -0.787 32 HD2 LYS 4 HD2 LYS 4 -4.999 -7.155 0.864 33 HD3 LYS 4 HD3 LYS 4 -6.355 -8.234 1.202 34 HE2 LYS 4 HE2 LYS 4 -3.420 -8.835 1.546 35 HE3 LYS 4 HE3 LYS 4 -4.614 -8.613 2.824 36 HZ1 LYS 4 HZ1 LYS 4 -4.342 -10.867 0.934 37 HZ2 LYS 4 HZ2 LYS 4 -5.798 -10.577 1.745 38 HZ3 LYS 4 HZ3 LYS 4 -4.390 -10.906 2.625 39 H SER 5 H SER 5 -6.250 -5.734 -3.928 40 HA SER 5 HA SER 5 -7.491 -7.390 -5.771 41 HB2 SER 5 HB2 SER 5 -7.783 -5.270 -7.136 42 HB3 SER 5 HB3 SER 5 -8.340 -5.181 -5.465 43 HG SER 5 HG SER 5 -5.704 -4.440 -6.004 44 H ASP 6 H ASP 6 -4.274 -6.124 -5.761 45 HA ASP 6 HA ASP 6 -3.603 -6.187 -8.451 46 HB2 ASP 6 HB2 ASP 6 -2.227 -5.569 -6.264 47 HB3 ASP 6 HB3 ASP 6 -1.619 -7.209 -6.471 48 H GLU 7 H GLU 7 -3.769 -8.823 -6.112 49 HA GLU 7 HA GLU 7 -2.602 -10.819 -7.712 50 HB2 GLU 7 HB2 GLU 7 -4.059 -10.676 -5.204 51 HB3 GLU 7 HB3 GLU 7 -4.491 -12.112 -6.122 52 HG2 GLU 7 HG2 GLU 7 -1.707 -11.938 -6.271 53 HG3 GLU 7 HG3 GLU 7 -2.123 -11.560 -4.600 54 H VAL 8 H VAL 8 -6.020 -9.978 -7.190 55 HA VAL 8 HA VAL 8 -7.138 -11.896 -8.884 56 HB VAL 8 HB VAL 8 -8.201 -9.128 -8.303 57 HG11 VAL 8 HG11 VAL 8 -10.108 -11.292 -8.724 58 HG12 VAL 8 HG12 VAL 8 -10.077 -9.661 -9.397 59 HG13 VAL 8 HG13 VAL 8 -9.124 -10.944 -10.146 60 HG21 VAL 8 HG21 VAL 8 -7.696 -11.182 -6.514 61 HG22 VAL 8 HG22 VAL 8 -8.771 -9.808 -6.257 62 HG23 VAL 8 HG23 VAL 8 -9.417 -11.331 -6.866 63 H PHE 9 H PHE 9 -6.230 -8.525 -9.572 64 HA PHE 9 HA PHE 9 -7.004 -8.515 -12.268 65 HB2 PHE 9 HB2 PHE 9 -5.132 -6.866 -10.615 66 HB3 PHE 9 HB3 PHE 9 -5.130 -6.666 -12.364 67 HD1 PHE 9 HD2 PHE 9 -7.874 -6.844 -13.142 68 HD2 PHE 9 HD1 PHE 9 -6.195 -5.076 -9.653 69 HE1 PHE 9 HE2 PHE 9 -9.816 -5.343 -12.972 70 HE2 PHE 9 HE1 PHE 9 -8.135 -3.573 -9.477 71 HZ PHE 9 HZ PHE 9 -9.948 -3.704 -11.139 72 H ALA 10 H ALA 10 -4.058 -9.569 -10.685 73 HA ALA 10 HA ALA 10 -2.462 -9.817 -13.009 74 HB1 ALA 10 HB1 ALA 10 -1.399 -9.736 -10.870 75 HB2 ALA 10 HB2 ALA 10 -2.279 -11.162 -10.319 76 HB3 ALA 10 HB3 ALA 10 -1.060 -11.313 -11.584 77 H LYS 11 H LYS 11 -4.487 -12.129 -11.234 78 HA LYS 11 HA LYS 11 -3.881 -14.361 -12.864 79 HB2 LYS 11 HB2 LYS 11 -6.455 -13.967 -11.345 80 HB3 LYS 11 HB3 LYS 11 -5.651 -15.481 -11.738 81 HG2 LYS 11 HG2 LYS 11 -3.754 -14.131 -10.273 82 HG3 LYS 11 HG3 LYS 11 -5.269 -13.696 -9.478 83 HD2 LYS 11 HD2 LYS 11 -5.211 -15.664 -8.441 84 HD3 LYS 11 HD3 LYS 11 -5.455 -16.439 -10.008 85 HE2 LYS 11 HE2 LYS 11 -2.696 -15.595 -9.360 86 HE3 LYS 11 HE3 LYS 11 -3.347 -16.939 -8.424 87 HZ1 LYS 11 HZ1 LYS 11 -2.514 -18.076 -10.180 88 HZ2 LYS 11 HZ2 LYS 11 -2.705 -16.796 -11.268 89 HZ3 LYS 11 HZ3 LYS 11 -4.040 -17.735 -10.826 90 H ILE 12 H ILE 12 -6.426 -11.916 -12.979 91 HA ILE 12 HA ILE 12 -7.984 -13.076 -15.007 92 HB ILE 12 HB ILE 12 -7.612 -10.153 -14.345 93 HG12 ILE 12 HG12 ILE 12 -10.005 -11.786 -13.596 94 HG13 ILE 12 HG13 ILE 12 -8.541 -11.926 -12.628 95 HG21 ILE 12 HG21 ILE 12 -8.812 -9.737 -16.168 96 HG22 ILE 12 HG22 ILE 12 -9.059 -11.458 -16.465 97 HG23 ILE 12 HG23 ILE 12 -10.159 -10.580 -15.402 98 HD11 ILE 12 HD11 ILE 12 -10.267 -10.276 -11.829 99 HD12 ILE 12 HD12 ILE 12 -8.625 -9.657 -12.005 100 HD13 ILE 12 HD13 ILE 12 -9.842 -9.289 -13.227 101 H ALA 13 H ALA 13 -5.431 -10.600 -15.212 102 HA ALA 13 HA ALA 13 -5.423 -10.124 -17.914 103 HB1 ALA 13 HB1 ALA 13 -3.866 -9.328 -15.865 104 HB2 ALA 13 HB2 ALA 13 -2.745 -10.393 -16.714 105 HB3 ALA 13 HB3 ALA 13 -3.482 -9.033 -17.560 106 H LYS 14 H LYS 14 -3.604 -12.670 -16.212 107 HA LYS 14 HA LYS 14 -2.351 -13.816 -18.406 108 HB2 LYS 14 HB2 LYS 14 -2.148 -14.326 -15.857 109 HB3 LYS 14 HB3 LYS 14 -3.405 -15.516 -16.169 110 HG2 LYS 14 HG2 LYS 14 -2.023 -16.870 -17.361 111 HG3 LYS 14 HG3 LYS 14 -1.033 -15.531 -17.946 112 HD2 LYS 14 HD2 LYS 14 -0.996 -16.170 -15.037 113 HD3 LYS 14 HD3 LYS 14 -0.120 -17.228 -16.145 114 HE2 LYS 14 HE2 LYS 14 1.526 -15.718 -15.674 115 HE3 LYS 14 HE3 LYS 14 0.787 -14.923 -17.064 116 HZ1 LYS 14 HZ1 LYS 14 1.246 -13.570 -14.938 117 HZ2 LYS 14 HZ2 LYS 14 -0.153 -14.309 -14.342 118 HZ3 LYS 14 HZ3 LYS 14 -0.230 -13.357 -15.737 119 H ARG 15 H ARG 15 -5.634 -14.192 -17.238 120 HA ARG 15 HA ARG 15 -6.254 -16.403 -18.960 121 HB2 ARG 15 HB2 ARG 15 -7.416 -15.343 -16.719 122 HB3 ARG 15 HB3 ARG 15 -8.498 -14.776 -17.984 123 HG2 ARG 15 HG2 ARG 15 -9.381 -16.821 -17.219 124 HG3 ARG 15 HG3 ARG 15 -8.630 -17.163 -18.779 125 HD2 ARG 15 HD2 ARG 15 -8.064 -18.911 -17.217 126 HD3 ARG 15 HD3 ARG 15 -6.620 -17.972 -17.595 127 HE ARG 15 HE ARG 15 -7.907 -16.987 -15.262 128 HH11 ARG 15 HH11 ARG 15 -5.871 -19.558 -16.430 129 HH12 ARG 15 HH12 ARG 15 -5.125 -19.842 -14.892 130 HH21 ARG 15 HH21 ARG 15 -6.933 -17.351 -13.232 131 HH22 ARG 15 HH22 ARG 15 -5.731 -18.587 -13.074 132 H LEU 16 H LEU 16 -6.499 -12.918 -19.128 133 HA LEU 16 HA LEU 16 -8.254 -12.757 -21.336 134 HB2 LEU 16 HB2 LEU 16 -6.112 -10.810 -20.497 135 HB3 LEU 16 HB3 LEU 16 -7.475 -10.466 -21.560 136 HG LEU 16 HG LEU 16 -7.449 -10.864 -18.590 137 HD11 LEU 16 HD11 LEU 16 -7.246 -8.612 -19.821 138 HD12 LEU 16 HD12 LEU 16 -8.412 -8.752 -18.506 139 HD13 LEU 16 HD13 LEU 16 -8.959 -8.825 -20.180 140 HD21 LEU 16 HD21 LEU 16 -9.824 -11.132 -20.428 141 HD22 LEU 16 HD22 LEU 16 -9.927 -10.912 -18.681 142 HD23 LEU 16 HD23 LEU 16 -9.172 -12.362 -19.345 143 H GLU 17 H GLU 17 -5.052 -13.807 -21.104 144 HA GLU 17 HA GLU 17 -4.303 -13.063 -23.805 145 HB2 GLU 17 HB2 GLU 17 -2.926 -14.622 -21.625 146 HB3 GLU 17 HB3 GLU 17 -2.260 -14.494 -23.247 147 HG2 GLU 17 HG2 GLU 17 -2.498 -11.948 -22.892 148 HG3 GLU 17 HG3 GLU 17 -2.618 -12.364 -21.184 149 H SER 18 H SER 18 -6.039 -15.539 -22.329 150 HA SER 18 HA SER 18 -5.426 -17.460 -24.462 151 HB2 SER 18 HB2 SER 18 -6.007 -17.738 -21.675 152 HB3 SER 18 HB3 SER 18 -7.267 -18.560 -22.595 153 HG SER 18 HG SER 18 -5.789 -20.087 -22.596 154 H ILE 19 H ILE 19 -7.735 -15.172 -23.496 155 HA ILE 19 HA ILE 19 -10.126 -16.297 -24.415 156 HB ILE 19 HB ILE 19 -9.313 -13.388 -24.452 157 HG12 ILE 19 HG12 ILE 19 -10.741 -15.044 -22.361 158 HG13 ILE 19 HG13 ILE 19 -9.134 -14.339 -22.219 159 HG21 ILE 19 HG21 ILE 19 -12.052 -14.646 -24.539 160 HG22 ILE 19 HG22 ILE 19 -11.709 -12.920 -24.451 161 HG23 ILE 19 HG23 ILE 19 -11.241 -13.839 -25.881 162 HD11 ILE 19 HD11 ILE 19 -11.736 -12.842 -22.413 163 HD12 ILE 19 HD12 ILE 19 -10.726 -13.030 -20.979 164 HD13 ILE 19 HD13 ILE 19 -10.138 -12.099 -22.357 165 H ASP 20 H ASP 20 -11.182 -16.264 -26.376 166 HA ASP 20 HA ASP 20 -9.540 -15.499 -28.702 167 HB2 ASP 20 HB2 ASP 20 -10.709 -18.015 -28.033 168 HB3 ASP 20 HB3 ASP 20 -11.524 -17.394 -29.466 169 HA PRO 21 HA PRO 21 -12.750 -12.835 -30.061 170 HB2 PRO 21 HB2 PRO 21 -12.533 -13.072 -32.757 171 HB3 PRO 21 HB3 PRO 21 -11.347 -12.210 -31.770 172 HG2 PRO 21 HG2 PRO 21 -11.233 -14.992 -32.870 173 HG3 PRO 21 HG3 PRO 21 -9.960 -13.759 -32.811 174 HD2 PRO 21 HD2 PRO 21 -10.094 -15.800 -31.037 175 HD3 PRO 21 HD3 PRO 21 -9.461 -14.199 -30.604 176 H ALA 22 H ALA 22 -12.682 -16.020 -31.628 177 HA ALA 22 HA ALA 22 -15.271 -16.004 -32.680 178 HB1 ALA 22 HB1 ALA 22 -14.761 -18.648 -31.966 179 HB2 ALA 22 HB2 ALA 22 -14.416 -17.878 -33.515 180 HB3 ALA 22 HB3 ALA 22 -13.174 -17.940 -32.265 181 H ASN 23 H ASN 23 -14.192 -16.256 -29.435 182 HA ASN 23 HA ASN 23 -16.651 -17.484 -28.487 183 HB2 ASN 23 HB2 ASN 23 -13.981 -17.168 -27.475 184 HB3 ASN 23 HB3 ASN 23 -15.128 -16.517 -26.308 185 HD21 ASN 23 HD21 ASN 23 -14.544 -19.349 -28.345 186 HD22 ASN 23 HD22 ASN 23 -15.190 -20.500 -27.231 187 H ARG 24 H ARG 24 -17.443 -16.329 -26.313 188 HA ARG 24 HA ARG 24 -18.860 -14.665 -25.629 189 HB2 ARG 24 HB2 ARG 24 -17.749 -12.704 -24.977 190 HB3 ARG 24 HB3 ARG 24 -16.486 -13.926 -24.999 191 HG2 ARG 24 HG2 ARG 24 -16.771 -12.556 -27.547 192 HG3 ARG 24 HG3 ARG 24 -16.382 -11.468 -26.214 193 HD2 ARG 24 HD2 ARG 24 -14.611 -13.310 -25.635 194 HD3 ARG 24 HD3 ARG 24 -14.812 -13.745 -27.332 195 HE ARG 24 HE ARG 24 -13.379 -11.523 -26.315 196 HH11 ARG 24 HH11 ARG 24 -15.442 -12.498 -28.945 197 HH12 ARG 24 HH12 ARG 24 -14.785 -11.347 -30.060 198 HH21 ARG 24 HH21 ARG 24 -12.505 -10.003 -27.774 199 HH22 ARG 24 HH22 ARG 24 -13.114 -9.928 -29.393 200 H GLN 25 H GLN 25 -19.106 -11.991 -26.340 201 HA GLN 25 HA GLN 25 -19.673 -11.993 -29.212 202 HB2 GLN 25 HB2 GLN 25 -21.731 -12.714 -28.015 203 HB3 GLN 25 HB3 GLN 25 -21.709 -11.198 -27.123 204 HG2 GLN 25 HG2 GLN 25 -22.142 -9.935 -29.071 205 HG3 GLN 25 HG3 GLN 25 -21.830 -11.317 -30.120 206 HE21 GLN 25 HE21 GLN 25 -24.181 -9.619 -29.961 207 HE22 GLN 25 HE22 GLN 25 -25.510 -10.664 -29.604 208 H VAL 26 H VAL 26 -20.394 -9.880 -26.431 209 HA VAL 26 HA VAL 26 -19.360 -7.603 -27.933 210 HB VAL 26 HB VAL 26 -21.559 -7.517 -26.679 211 HG11 VAL 26 HG11 VAL 26 -20.062 -6.925 -24.191 212 HG12 VAL 26 HG12 VAL 26 -21.683 -7.588 -24.411 213 HG13 VAL 26 HG13 VAL 26 -20.269 -8.621 -24.626 214 HG21 VAL 26 HG21 VAL 26 -21.365 -5.273 -26.540 215 HG22 VAL 26 HG22 VAL 26 -19.924 -5.351 -25.527 216 HG23 VAL 26 HG23 VAL 26 -19.788 -5.572 -27.271 217 H GLU 27 H GLU 27 -17.670 -6.309 -27.261 218 HA GLU 27 HA GLU 27 -16.258 -6.901 -24.805 219 HB2 GLU 27 HB2 GLU 27 -15.331 -7.843 -27.435 220 HB3 GLU 27 HB3 GLU 27 -14.121 -6.973 -26.502 221 HG2 GLU 27 HG2 GLU 27 -15.691 -9.140 -25.194 222 HG3 GLU 27 HG3 GLU 27 -14.368 -9.558 -26.281 223 H HIS 28 H HIS 28 -15.718 -5.008 -23.969 224 HA HIS 28 HA HIS 28 -14.652 -2.908 -25.695 225 HB2 HIS 28 HB2 HIS 28 -17.234 -2.796 -24.256 226 HB3 HIS 28 HB3 HIS 28 -16.207 -1.376 -24.091 227 HD1 HIS 28 HD1 HIS 28 -15.059 -1.247 -26.947 228 HD2 HIS 28 HD2 HIS 28 -19.066 -1.904 -26.063 229 HE1 HIS 28 HE1 HIS 28 -16.327 -0.534 -28.999 230 H VAL 29 H VAL 29 -13.899 -1.001 -24.286 231 HA VAL 29 HA VAL 29 -12.084 -2.030 -22.348 232 HB VAL 29 HB VAL 29 -12.772 0.835 -23.017 233 HG11 VAL 29 HG11 VAL 29 -11.668 1.240 -21.100 234 HG12 VAL 29 HG12 VAL 29 -10.949 -0.371 -21.053 235 HG13 VAL 29 HG13 VAL 29 -10.236 0.886 -22.065 236 HG21 VAL 29 HG21 VAL 29 -11.639 -0.954 -24.680 237 HG22 VAL 29 HG22 VAL 29 -11.262 0.769 -24.696 238 HG23 VAL 29 HG23 VAL 29 -10.205 -0.357 -23.844 239 H TYR 30 H TYR 30 -12.039 -1.768 -20.135 240 HA TYR 30 HA TYR 30 -14.459 -0.655 -18.883 241 HB2 TYR 30 HB2 TYR 30 -13.968 -3.335 -19.006 242 HB3 TYR 30 HB3 TYR 30 -13.208 -2.920 -17.474 243 HD1 TYR 30 HD2 TYR 30 -16.394 -2.261 -19.319 244 HD2 TYR 30 HD1 TYR 30 -14.517 -3.022 -15.578 245 HE1 TYR 30 HE2 TYR 30 -18.598 -2.292 -18.227 246 HE2 TYR 30 HE1 TYR 30 -16.715 -3.057 -14.475 247 HH TYR 30 HH TYR 30 -19.220 -3.590 -15.383 248 H LYS 31 H LYS 31 -14.184 0.352 -16.901 249 HA LYS 31 HA LYS 31 -11.385 0.903 -16.172 250 HB2 LYS 31 HB2 LYS 31 -13.722 2.599 -16.505 251 HB3 LYS 31 HB3 LYS 31 -12.979 2.819 -14.926 252 HG2 LYS 31 HG2 LYS 31 -10.804 2.849 -16.561 253 HG3 LYS 31 HG3 LYS 31 -12.033 3.600 -17.581 254 HD2 LYS 31 HD2 LYS 31 -10.994 5.360 -16.382 255 HD3 LYS 31 HD3 LYS 31 -12.566 5.102 -15.620 256 HE2 LYS 31 HE2 LYS 31 -11.638 4.134 -13.736 257 HE3 LYS 31 HE3 LYS 31 -10.157 3.677 -14.575 258 HZ1 LYS 31 HZ1 LYS 31 -10.454 5.830 -12.953 259 HZ2 LYS 31 HZ2 LYS 31 -10.576 6.514 -14.495 260 HZ3 LYS 31 HZ3 LYS 31 -9.207 5.613 -14.075 261 H PHE 32 H PHE 32 -10.677 0.483 -14.158 262 HA PHE 32 HA PHE 32 -12.661 -0.440 -12.185 263 HB2 PHE 32 HB2 PHE 32 -9.846 -1.462 -12.616 264 HB3 PHE 32 HB3 PHE 32 -10.924 -1.980 -11.325 265 HD1 PHE 32 HD2 PHE 32 -13.028 -3.197 -11.906 266 HD2 PHE 32 HD1 PHE 32 -9.989 -2.385 -14.774 267 HE1 PHE 32 HE2 PHE 32 -13.959 -4.933 -13.379 268 HE2 PHE 32 HE1 PHE 32 -10.916 -4.119 -16.252 269 HZ PHE 32 HZ PHE 32 -12.903 -5.397 -15.555 270 H ARG 33 H ARG 33 -12.684 0.595 -10.297 271 HA ARG 33 HA ARG 33 -10.434 2.392 -9.682 272 HB2 ARG 33 HB2 ARG 33 -13.328 2.726 -9.592 273 HB3 ARG 33 HB3 ARG 33 -12.558 3.165 -8.074 274 HG2 ARG 33 HG2 ARG 33 -10.927 4.464 -9.708 275 HG3 ARG 33 HG3 ARG 33 -12.355 4.431 -10.744 276 HD2 ARG 33 HD2 ARG 33 -13.672 5.527 -9.069 277 HD3 ARG 33 HD3 ARG 33 -12.368 5.394 -7.890 278 HE ARG 33 HE ARG 33 -11.400 6.823 -10.081 279 HH11 ARG 33 HH11 ARG 33 -13.771 7.167 -7.556 280 HH12 ARG 33 HH12 ARG 33 -13.665 8.896 -7.513 281 HH21 ARG 33 HH21 ARG 33 -11.251 9.098 -10.034 282 HH22 ARG 33 HH22 ARG 33 -12.232 9.993 -8.923 283 H ILE 34 H ILE 34 -9.185 1.806 -8.046 284 HA ILE 34 HA ILE 34 -10.224 -0.106 -6.077 285 HB ILE 34 HB ILE 34 -7.384 0.676 -6.741 286 HG12 ILE 34 HG12 ILE 34 -8.440 -0.756 -8.421 287 HG13 ILE 34 HG13 ILE 34 -7.209 -1.648 -7.536 288 HG21 ILE 34 HG21 ILE 34 -8.503 -1.116 -4.608 289 HG22 ILE 34 HG22 ILE 34 -6.857 -1.297 -5.214 290 HG23 ILE 34 HG23 ILE 34 -7.352 0.210 -4.442 291 HD11 ILE 34 HD11 ILE 34 -10.189 -1.865 -7.305 292 HD12 ILE 34 HD12 ILE 34 -9.025 -3.110 -7.760 293 HD13 ILE 34 HD13 ILE 34 -9.092 -2.532 -6.096 294 H THR 35 H THR 35 -10.956 0.736 -4.249 295 HA THR 35 HA THR 35 -9.683 3.179 -3.205 296 HB THR 35 HB THR 35 -11.720 3.777 -2.142 297 HG1 THR 35 HG1 THR 35 -12.732 2.063 -1.363 298 HG21 THR 35 HG21 THR 35 -13.134 2.842 -4.495 299 HG22 THR 35 HG22 THR 35 -11.543 3.486 -4.900 300 HG23 THR 35 HG23 THR 35 -12.701 4.484 -4.021 301 H GLN 36 H GLN 36 -9.138 3.306 -1.028 302 HA GLN 36 HA GLN 36 -8.779 0.715 0.275 303 HB2 GLN 36 HB2 GLN 36 -6.943 2.550 -0.083 304 HB3 GLN 36 HB3 GLN 36 -7.667 3.282 1.343 305 HG2 GLN 36 HG2 GLN 36 -7.159 1.391 2.679 306 HG3 GLN 36 HG3 GLN 36 -6.700 0.439 1.268 307 HE21 GLN 36 HE21 GLN 36 -4.681 0.649 0.419 308 HE22 GLN 36 HE22 GLN 36 -3.432 1.598 1.143 309 H GLY 37 H GLY 37 -10.631 0.191 1.323 310 HA2 GLY 37 HA2 GLY 37 -12.044 0.193 3.155 311 HA3 GLY 37 HA3 GLY 37 -11.274 1.675 3.701 312 H GLY 38 H GLY 38 -11.772 3.067 1.166 313 HA2 GLY 38 HA2 GLY 38 -14.387 3.145 0.328 314 HA3 GLY 38 HA3 GLY 38 -14.367 4.087 1.811 315 H LYS 39 H LYS 39 -11.380 4.536 0.716 316 HA LYS 39 HA LYS 39 -12.147 6.881 -0.896 317 HB2 LYS 39 HB2 LYS 39 -9.782 7.674 -0.063 318 HB3 LYS 39 HB3 LYS 39 -11.199 7.853 0.963 319 HG2 LYS 39 HG2 LYS 39 -10.511 6.263 2.434 320 HG3 LYS 39 HG3 LYS 39 -9.635 5.346 1.206 321 HD2 LYS 39 HD2 LYS 39 -7.960 7.219 1.150 322 HD3 LYS 39 HD3 LYS 39 -8.782 7.904 2.553 323 HE2 LYS 39 HE2 LYS 39 -8.432 5.438 3.475 324 HE3 LYS 39 HE3 LYS 39 -7.091 5.472 2.330 325 HZ1 LYS 39 HZ1 LYS 39 -6.346 6.202 4.478 326 HZ2 LYS 39 HZ2 LYS 39 -7.555 7.382 4.556 327 HZ3 LYS 39 HZ3 LYS 39 -6.314 7.518 3.415 328 H VAL 40 H VAL 40 -11.497 6.877 -2.939 329 HA VAL 40 HA VAL 40 -10.167 4.836 -4.209 330 HB VAL 40 HB VAL 40 -11.435 6.716 -5.307 331 HG11 VAL 40 HG11 VAL 40 -10.160 8.519 -4.118 332 HG12 VAL 40 HG12 VAL 40 -8.802 8.174 -5.191 333 HG13 VAL 40 HG13 VAL 40 -10.330 8.752 -5.857 334 HG21 VAL 40 HG21 VAL 40 -8.823 6.486 -6.707 335 HG22 VAL 40 HG22 VAL 40 -9.718 5.005 -6.364 336 HG23 VAL 40 HG23 VAL 40 -10.461 6.281 -7.329 337 H VAL 41 H VAL 41 -8.093 4.276 -4.595 338 HA VAL 41 HA VAL 41 -5.986 6.043 -3.531 339 HB VAL 41 HB VAL 41 -6.238 4.119 -2.066 340 HG11 VAL 41 HG11 VAL 41 -6.054 2.590 -4.631 341 HG12 VAL 41 HG12 VAL 41 -5.560 1.846 -3.109 342 HG13 VAL 41 HG13 VAL 41 -7.214 2.426 -3.313 343 HG21 VAL 41 HG21 VAL 41 -3.924 5.060 -2.993 344 HG22 VAL 41 HG22 VAL 41 -4.009 3.741 -1.826 345 HG23 VAL 41 HG23 VAL 41 -3.772 3.390 -3.538 346 H LYS 42 H LYS 42 -7.110 4.062 -6.117 347 HA LYS 42 HA LYS 42 -5.179 5.118 -7.921 348 HB2 LYS 42 HB2 LYS 42 -4.163 3.027 -6.552 349 HB3 LYS 42 HB3 LYS 42 -4.951 2.165 -7.866 350 HG2 LYS 42 HG2 LYS 42 -3.703 3.589 -9.474 351 HG3 LYS 42 HG3 LYS 42 -2.835 4.291 -8.107 352 HD2 LYS 42 HD2 LYS 42 -2.904 1.324 -8.414 353 HD3 LYS 42 HD3 LYS 42 -1.827 2.269 -9.445 354 HE2 LYS 42 HE2 LYS 42 -1.498 3.279 -6.850 355 HE3 LYS 42 HE3 LYS 42 -1.527 1.524 -6.684 356 HZ1 LYS 42 HZ1 LYS 42 0.711 2.512 -7.092 357 HZ2 LYS 42 HZ2 LYS 42 0.188 2.946 -8.641 358 HZ3 LYS 42 HZ3 LYS 42 0.263 1.315 -8.201 359 H ASN 43 H ASN 43 -5.492 4.292 -10.141 360 HA ASN 43 HA ASN 43 -8.134 3.054 -10.524 361 HB2 ASN 43 HB2 ASN 43 -7.171 5.170 -12.414 362 HB3 ASN 43 HB3 ASN 43 -8.818 4.655 -12.063 363 HD21 ASN 43 HD21 ASN 43 -9.039 4.851 -9.415 364 HD22 ASN 43 HD22 ASN 43 -8.789 6.477 -8.888 365 H TRP 44 H TRP 44 -8.211 1.461 -11.995 366 HA TRP 44 HA TRP 44 -5.817 1.034 -13.660 367 HB2 TRP 44 HB2 TRP 44 -7.554 -0.876 -12.142 368 HB3 TRP 44 HB3 TRP 44 -6.728 -1.429 -13.596 369 HD1 TRP 44 HD1 TRP 44 -6.021 -0.218 -10.029 370 HE1 TRP 44 HE1 TRP 44 -3.617 -0.887 -9.399 371 HE3 TRP 44 HE3 TRP 44 -4.446 -1.959 -14.570 372 HZ2 TRP 44 HZ2 TRP 44 -1.352 -2.004 -10.660 373 HZ3 TRP 44 HZ3 TRP 44 -2.146 -2.810 -14.774 374 HH2 TRP 44 HH2 TRP 44 -0.633 -2.830 -12.859 375 H VAL 45 H VAL 45 -6.083 0.392 -15.793 376 HA VAL 45 HA VAL 45 -8.838 0.515 -16.834 377 HB VAL 45 HB VAL 45 -6.338 1.710 -18.025 378 HG11 VAL 45 HG11 VAL 45 -7.274 0.936 -19.955 379 HG12 VAL 45 HG12 VAL 45 -8.909 0.924 -19.289 380 HG13 VAL 45 HG13 VAL 45 -8.170 2.446 -19.789 381 HG21 VAL 45 HG21 VAL 45 -7.829 2.898 -16.253 382 HG22 VAL 45 HG22 VAL 45 -7.305 3.782 -17.686 383 HG23 VAL 45 HG23 VAL 45 -8.939 3.122 -17.605 384 H MET 46 H MET 46 -9.426 -0.999 -18.309 385 HA MET 46 HA MET 46 -7.504 -3.146 -18.808 386 HB2 MET 46 HB2 MET 46 -9.626 -3.822 -17.841 387 HB3 MET 46 HB3 MET 46 -10.505 -3.036 -19.145 388 HG2 MET 46 HG2 MET 46 -10.015 -4.679 -20.657 389 HG3 MET 46 HG3 MET 46 -8.531 -5.148 -19.831 390 HE1 MET 46 HE1 MET 46 -12.170 -4.905 -19.877 391 HE2 MET 46 HE2 MET 46 -12.438 -6.633 -20.106 392 HE3 MET 46 HE3 MET 46 -12.776 -5.887 -18.543 393 H ASP 47 H ASP 47 -6.422 -3.116 -20.656 394 HA ASP 47 HA ASP 47 -7.290 -1.527 -22.891 395 HB2 ASP 47 HB2 ASP 47 -4.837 -2.413 -21.971 396 HB3 ASP 47 HB3 ASP 47 -5.099 -3.390 -23.413 397 H LEU 48 H LEU 48 -8.633 -2.179 -24.424 398 HA LEU 48 HA LEU 48 -9.244 -5.012 -24.701 399 HB2 LEU 48 HB2 LEU 48 -10.804 -2.784 -24.763 400 HB3 LEU 48 HB3 LEU 48 -10.575 -3.095 -26.483 401 HG LEU 48 HG LEU 48 -12.625 -4.115 -25.779 402 HD11 LEU 48 HD11 LEU 48 -10.471 -6.196 -26.125 403 HD12 LEU 48 HD12 LEU 48 -11.322 -5.349 -27.417 404 HD13 LEU 48 HD13 LEU 48 -12.200 -6.454 -26.360 405 HD21 LEU 48 HD21 LEU 48 -11.233 -5.925 -23.863 406 HD22 LEU 48 HD22 LEU 48 -12.923 -5.424 -23.918 407 HD23 LEU 48 HD23 LEU 48 -11.690 -4.304 -23.337 408 H LYS 49 H LYS 49 -7.397 -2.585 -26.253 409 HA LYS 49 HA LYS 49 -7.403 -3.766 -28.871 410 HB2 LYS 49 HB2 LYS 49 -6.880 -1.299 -28.122 411 HB3 LYS 49 HB3 LYS 49 -5.245 -1.918 -27.929 412 HG2 LYS 49 HG2 LYS 49 -5.012 -1.342 -30.075 413 HG3 LYS 49 HG3 LYS 49 -5.868 -2.851 -30.399 414 HD2 LYS 49 HD2 LYS 49 -8.006 -1.418 -30.177 415 HD3 LYS 49 HD3 LYS 49 -6.921 -0.043 -30.397 416 HE2 LYS 49 HE2 LYS 49 -6.112 -1.646 -32.417 417 HE3 LYS 49 HE3 LYS 49 -7.816 -2.088 -32.322 418 HZ1 LYS 49 HZ1 LYS 49 -6.593 0.396 -33.179 419 HZ2 LYS 49 HZ2 LYS 49 -7.968 0.571 -32.211 420 HZ3 LYS 49 HZ3 LYS 49 -8.056 -0.311 -33.651 421 H ASN 50 H ASN 50 -5.229 -3.775 -26.081 422 HA ASN 50 HA ASN 50 -3.526 -5.742 -27.442 423 HB2 ASN 50 HB2 ASN 50 -2.722 -3.535 -26.173 424 HB3 ASN 50 HB3 ASN 50 -2.775 -4.621 -24.787 425 HD21 ASN 50 HD21 ASN 50 -1.220 -6.127 -24.536 426 HD22 ASN 50 HD22 ASN 50 0.117 -6.330 -25.611 427 H VAL 51 H VAL 51 -5.967 -5.478 -25.116 428 HA VAL 51 HA VAL 51 -6.977 -6.996 -23.751 429 HB VAL 51 HB VAL 51 -5.154 -9.132 -24.825 430 HG11 VAL 51 HG11 VAL 51 -7.509 -10.308 -24.653 431 HG12 VAL 51 HG12 VAL 51 -6.467 -10.130 -23.240 432 HG13 VAL 51 HG13 VAL 51 -7.810 -9.015 -23.492 433 HG21 VAL 51 HG21 VAL 51 -5.868 -8.063 -26.805 434 HG22 VAL 51 HG22 VAL 51 -6.941 -9.447 -26.598 435 HG23 VAL 51 HG23 VAL 51 -7.501 -7.827 -26.181 436 H LYS 52 H LYS 52 -4.733 -5.518 -22.805 437 HA LYS 52 HA LYS 52 -3.750 -7.378 -20.745 438 HB2 LYS 52 HB2 LYS 52 -1.990 -6.735 -22.435 439 HB3 LYS 52 HB3 LYS 52 -2.154 -5.076 -21.875 440 HG2 LYS 52 HG2 LYS 52 -1.008 -5.460 -19.978 441 HG3 LYS 52 HG3 LYS 52 -1.673 -7.083 -19.777 442 HD2 LYS 52 HD2 LYS 52 0.277 -7.888 -20.488 443 HD3 LYS 52 HD3 LYS 52 -0.088 -7.210 -22.077 444 HE2 LYS 52 HE2 LYS 52 1.750 -5.973 -21.819 445 HE3 LYS 52 HE3 LYS 52 0.826 -5.036 -20.646 446 HZ1 LYS 52 HZ1 LYS 52 1.733 -6.251 -18.874 447 HZ2 LYS 52 HZ2 LYS 52 3.046 -5.911 -19.884 448 HZ3 LYS 52 HZ3 LYS 52 2.355 -7.455 -19.887 449 H LEU 53 H LEU 53 -3.158 -6.330 -18.707 450 HA LEU 53 HA LEU 53 -4.960 -4.087 -18.146 451 HB2 LEU 53 HB2 LEU 53 -3.738 -6.245 -16.471 452 HB3 LEU 53 HB3 LEU 53 -4.348 -4.772 -15.720 453 HG LEU 53 HG LEU 53 -6.000 -6.526 -15.568 454 HD11 LEU 53 HD11 LEU 53 -7.565 -4.977 -15.812 455 HD12 LEU 53 HD12 LEU 53 -7.477 -5.122 -17.567 456 HD13 LEU 53 HD13 LEU 53 -6.421 -3.990 -16.722 457 HD21 LEU 53 HD21 LEU 53 -6.434 -6.628 -18.497 458 HD22 LEU 53 HD22 LEU 53 -6.677 -7.870 -17.268 459 HD23 LEU 53 HD23 LEU 53 -5.051 -7.514 -17.853 460 H VAL 54 H VAL 54 -4.243 -2.141 -17.499 461 HA VAL 54 HA VAL 54 -1.509 -1.820 -16.550 462 HB VAL 54 HB VAL 54 -0.963 -0.056 -18.135 463 HG11 VAL 54 HG11 VAL 54 -0.388 -1.415 -19.945 464 HG12 VAL 54 HG12 VAL 54 -0.548 -2.547 -18.601 465 HG13 VAL 54 HG13 VAL 54 -1.844 -2.398 -19.789 466 HG21 VAL 54 HG21 VAL 54 -3.668 -0.685 -19.295 467 HG22 VAL 54 HG22 VAL 54 -3.084 0.859 -18.676 468 HG23 VAL 54 HG23 VAL 54 -2.425 0.205 -20.175 469 H GLU 55 H GLU 55 -1.110 0.559 -15.985 470 HA GLU 55 HA GLU 55 -3.468 1.514 -14.546 471 HB2 GLU 55 HB2 GLU 55 -0.527 1.803 -14.203 472 HB3 GLU 55 HB3 GLU 55 -1.542 3.120 -13.632 473 HG2 GLU 55 HG2 GLU 55 -2.306 1.947 -11.887 474 HG3 GLU 55 HG3 GLU 55 -2.441 0.456 -12.817 475 H SER 56 H SER 56 -4.693 2.844 -15.727 476 HA SER 56 HA SER 56 -3.478 5.270 -16.777 477 HB2 SER 56 HB2 SER 56 -3.425 3.766 -18.706 478 HB3 SER 56 HB3 SER 56 -5.142 3.421 -18.505 479 HG SER 56 HG SER 56 -3.900 5.602 -19.628 480 H ASP 57 H ASP 57 -5.253 6.777 -17.622 481 HA ASP 57 HA ASP 57 -7.608 6.524 -15.868 482 HB2 ASP 57 HB2 ASP 57 -5.711 8.503 -15.798 483 HB3 ASP 57 HB3 ASP 57 -6.946 9.221 -16.829 484 H ASP 58 H ASP 58 -6.864 5.974 -18.887 485 HA ASP 58 HA ASP 58 -8.373 7.570 -20.556 486 HB2 ASP 58 HB2 ASP 58 -6.854 5.693 -21.250 487 HB3 ASP 58 HB3 ASP 58 -8.135 4.568 -20.806 488 H ALA 59 H ALA 59 -10.469 7.149 -21.573 489 HA ALA 59 HA ALA 59 -12.496 6.737 -19.592 490 HB1 ALA 59 HB1 ALA 59 -13.503 8.171 -20.958 491 HB2 ALA 59 HB2 ALA 59 -12.327 7.869 -22.239 492 HB3 ALA 59 HB3 ALA 59 -13.746 6.832 -22.081 493 H ALA 60 H ALA 60 -14.511 5.400 -20.401 494 HA ALA 60 HA ALA 60 -13.940 2.989 -21.832 495 HB1 ALA 60 HB1 ALA 60 -12.904 2.730 -19.472 496 HB2 ALA 60 HB2 ALA 60 -14.574 2.518 -18.947 497 HB3 ALA 60 HB3 ALA 60 -13.877 1.416 -20.135 498 H GLU 61 H GLU 61 -15.812 1.578 -21.993 499 HA GLU 61 HA GLU 61 -18.205 2.980 -22.366 500 HB2 GLU 61 HB2 GLU 61 -17.740 0.007 -22.083 501 HB3 GLU 61 HB3 GLU 61 -19.237 0.733 -22.652 502 HG2 GLU 61 HG2 GLU 61 -16.576 0.597 -23.994 503 HG3 GLU 61 HG3 GLU 61 -18.164 0.143 -24.608 504 H ALA 62 H ALA 62 -16.865 1.520 -19.558 505 HA ALA 62 HA ALA 62 -19.053 2.482 -17.948 506 HB1 ALA 62 HB1 ALA 62 -20.200 0.584 -17.833 507 HB2 ALA 62 HB2 ALA 62 -18.960 -0.287 -18.736 508 HB3 ALA 62 HB3 ALA 62 -18.826 -0.126 -16.985 509 H THR 63 H THR 63 -18.613 2.253 -15.623 510 HA THR 63 HA THR 63 -15.747 1.891 -15.045 511 HB THR 63 HB THR 63 -17.507 4.034 -13.838 512 HG1 THR 63 HG1 THR 63 -16.637 5.398 -15.272 513 HG21 THR 63 HG21 THR 63 -15.071 4.852 -13.247 514 HG22 THR 63 HG22 THR 63 -14.700 3.133 -13.388 515 HG23 THR 63 HG23 THR 63 -15.907 3.683 -12.226 516 H LEU 64 H LEU 64 -15.278 0.672 -13.313 517 HA LEU 64 HA LEU 64 -17.497 -0.074 -11.523 518 HB2 LEU 64 HB2 LEU 64 -16.000 -1.722 -13.183 519 HB3 LEU 64 HB3 LEU 64 -15.308 -1.969 -11.581 520 HG LEU 64 HG LEU 64 -18.177 -2.411 -12.403 521 HD11 LEU 64 HD11 LEU 64 -17.728 -4.617 -12.493 522 HD12 LEU 64 HD12 LEU 64 -16.539 -4.541 -11.193 523 HD13 LEU 64 HD13 LEU 64 -16.090 -4.054 -12.828 524 HD21 LEU 64 HD21 LEU 64 -17.998 -1.483 -10.126 525 HD22 LEU 64 HD22 LEU 64 -16.896 -2.792 -9.698 526 HD23 LEU 64 HD23 LEU 64 -18.568 -3.152 -10.134 527 H THR 65 H THR 65 -17.232 0.818 -9.593 528 HA THR 65 HA THR 65 -14.499 1.163 -8.553 529 HB THR 65 HB THR 65 -17.028 2.625 -7.766 530 HG1 THR 65 HG1 THR 65 -16.451 3.678 -9.533 531 HG21 THR 65 HG21 THR 65 -15.747 2.634 -5.823 532 HG22 THR 65 HG22 THR 65 -15.240 4.120 -6.626 533 HG23 THR 65 HG23 THR 65 -14.224 2.682 -6.710 534 H MET 66 H MET 66 -13.884 0.022 -6.832 535 HA MET 66 HA MET 66 -15.743 -0.795 -4.795 536 HB2 MET 66 HB2 MET 66 -14.898 -2.656 -6.906 537 HB3 MET 66 HB3 MET 66 -14.657 -3.261 -5.273 538 HG2 MET 66 HG2 MET 66 -17.079 -2.599 -4.850 539 HG3 MET 66 HG3 MET 66 -17.213 -2.439 -6.600 540 HE1 MET 66 HE1 MET 66 -16.141 -4.108 -8.089 541 HE2 MET 66 HE2 MET 66 -15.294 -5.510 -7.436 542 HE3 MET 66 HE3 MET 66 -16.916 -5.692 -8.106 543 H GLU 67 H GLU 67 -14.719 -1.532 -2.900 544 HA GLU 67 HA GLU 67 -12.158 -0.455 -2.427 545 HB2 GLU 67 HB2 GLU 67 -13.924 -2.310 -0.842 546 HB3 GLU 67 HB3 GLU 67 -12.344 -1.807 -0.256 547 HG2 GLU 67 HG2 GLU 67 -13.056 0.241 0.293 548 HG3 GLU 67 HG3 GLU 67 -14.062 0.389 -1.146 549 H ASP 68 H ASP 68 -10.372 -1.808 -1.387 550 HA ASP 68 HA ASP 68 -9.422 -3.656 -3.321 551 HB2 ASP 68 HB2 ASP 68 -8.011 -2.140 -1.860 552 HB3 ASP 68 HB3 ASP 68 -8.320 -3.262 -0.537 553 H ASP 69 H ASP 69 -10.473 -4.059 0.056 554 HA ASP 69 HA ASP 69 -10.192 -6.879 0.071 555 HB2 ASP 69 HB2 ASP 69 -11.058 -4.820 1.901 556 HB3 ASP 69 HB3 ASP 69 -12.153 -6.198 1.967 557 H ILE 70 H ILE 70 -12.731 -4.726 -0.939 558 HA ILE 70 HA ILE 70 -14.764 -6.764 -1.031 559 HB ILE 70 HB ILE 70 -14.835 -4.079 -2.401 560 HG12 ILE 70 HG12 ILE 70 -14.280 -4.003 0.091 561 HG13 ILE 70 HG13 ILE 70 -15.695 -3.093 -0.427 562 HG21 ILE 70 HG21 ILE 70 -16.672 -5.175 -3.193 563 HG22 ILE 70 HG22 ILE 70 -16.818 -6.195 -1.762 564 HG23 ILE 70 HG23 ILE 70 -17.347 -4.513 -1.704 565 HD11 ILE 70 HD11 ILE 70 -17.170 -4.641 0.507 566 HD12 ILE 70 HD12 ILE 70 -15.921 -5.879 0.646 567 HD13 ILE 70 HD13 ILE 70 -15.885 -4.467 1.702 568 H MET 71 H MET 71 -12.926 -4.928 -3.471 569 HA MET 71 HA MET 71 -13.939 -6.125 -5.751 570 HB2 MET 71 HB2 MET 71 -12.421 -4.165 -5.727 571 HB3 MET 71 HB3 MET 71 -11.086 -5.229 -5.308 572 HG2 MET 71 HG2 MET 71 -10.741 -5.193 -7.526 573 HG3 MET 71 HG3 MET 71 -11.955 -6.470 -7.510 574 HE1 MET 71 HE1 MET 71 -11.732 -3.429 -10.238 575 HE2 MET 71 HE2 MET 71 -11.759 -2.358 -8.837 576 HE3 MET 71 HE3 MET 71 -10.622 -3.705 -8.894 577 H PHE 72 H PHE 72 -11.620 -7.339 -3.446 578 HA PHE 72 HA PHE 72 -10.584 -9.444 -5.040 579 HB2 PHE 72 HB2 PHE 72 -9.726 -8.410 -2.780 580 HB3 PHE 72 HB3 PHE 72 -10.742 -9.653 -2.058 581 HD1 PHE 72 HD2 PHE 72 -7.833 -9.052 -4.236 582 HD2 PHE 72 HD1 PHE 72 -10.092 -11.930 -2.060 583 HE1 PHE 72 HE2 PHE 72 -6.031 -10.698 -4.548 584 HE2 PHE 72 HE1 PHE 72 -8.292 -13.580 -2.367 585 HZ PHE 72 HZ PHE 72 -6.259 -12.965 -3.613 586 H ALA 73 H ALA 73 -13.223 -9.254 -2.690 587 HA ALA 73 HA ALA 73 -13.897 -11.946 -2.545 588 HB1 ALA 73 HB1 ALA 73 -16.193 -10.126 -2.560 589 HB2 ALA 73 HB2 ALA 73 -15.635 -11.243 -1.314 590 HB3 ALA 73 HB3 ALA 73 -14.891 -9.652 -1.468 591 H ILE 74 H ILE 74 -15.123 -9.468 -4.787 592 HA ILE 74 HA ILE 74 -16.671 -11.391 -6.269 593 HB ILE 74 HB ILE 74 -16.002 -8.659 -7.302 594 HG12 ILE 74 HG12 ILE 74 -16.575 -8.247 -4.993 595 HG13 ILE 74 HG13 ILE 74 -17.950 -7.796 -5.995 596 HG21 ILE 74 HG21 ILE 74 -18.730 -9.768 -7.391 597 HG22 ILE 74 HG22 ILE 74 -17.806 -8.921 -8.630 598 HG23 ILE 74 HG23 ILE 74 -17.514 -10.634 -8.330 599 HD11 ILE 74 HD11 ILE 74 -19.059 -9.883 -5.429 600 HD12 ILE 74 HD12 ILE 74 -17.673 -10.363 -4.450 601 HD13 ILE 74 HD13 ILE 74 -18.644 -8.969 -3.980 602 H GLY 75 H GLY 75 -13.507 -9.941 -6.499 603 HA2 GLY 75 HA2 GLY 75 -12.998 -10.546 -9.222 604 HA3 GLY 75 HA3 GLY 75 -11.784 -10.223 -7.993 605 H THR 76 H THR 76 -12.623 -12.390 -6.256 606 HA THR 76 HA THR 76 -11.344 -14.574 -7.723 607 HB THR 76 HB THR 76 -10.388 -13.914 -5.537 608 HG1 THR 76 HG1 THR 76 -9.886 -15.976 -5.835 609 HG21 THR 76 HG21 THR 76 -12.996 -13.708 -4.706 610 HG22 THR 76 HG22 THR 76 -11.586 -13.727 -3.647 611 HG23 THR 76 HG23 THR 76 -12.475 -15.218 -3.958 612 H GLY 77 H GLY 77 -14.396 -13.582 -7.286 613 HA2 GLY 77 HA2 GLY 77 -16.360 -14.717 -7.794 614 HA3 GLY 77 HA3 GLY 77 -15.463 -16.229 -7.752 615 H ALA 78 H ALA 78 -14.615 -14.771 -4.982 616 HA ALA 78 HA ALA 78 -15.884 -16.515 -3.270 617 HB1 ALA 78 HB1 ALA 78 -14.959 -13.712 -2.648 618 HB2 ALA 78 HB2 ALA 78 -15.284 -14.978 -1.463 619 HB3 ALA 78 HB3 ALA 78 -13.963 -15.167 -2.616 620 H LEU 79 H LEU 79 -16.695 -13.055 -3.197 621 HA LEU 79 HA LEU 79 -19.407 -13.734 -2.392 622 HB2 LEU 79 HB2 LEU 79 -17.630 -11.664 -1.784 623 HB3 LEU 79 HB3 LEU 79 -18.915 -10.912 -2.728 624 HG LEU 79 HG LEU 79 -19.894 -12.663 -0.600 625 HD11 LEU 79 HD11 LEU 79 -18.162 -10.295 0.049 626 HD12 LEU 79 HD12 LEU 79 -18.047 -11.940 0.673 627 HD13 LEU 79 HD13 LEU 79 -19.394 -10.908 1.151 628 HD21 LEU 79 HD21 LEU 79 -20.625 -9.859 -0.532 629 HD22 LEU 79 HD22 LEU 79 -21.637 -11.286 -0.759 630 HD23 LEU 79 HD23 LEU 79 -20.816 -10.557 -2.140 631 HA PRO 80 HA PRO 80 -21.178 -13.148 -6.380 632 HB2 PRO 80 HB2 PRO 80 -23.723 -12.569 -5.634 633 HB3 PRO 80 HB3 PRO 80 -23.041 -14.197 -5.540 634 HG2 PRO 80 HG2 PRO 80 -23.375 -12.155 -3.376 635 HG3 PRO 80 HG3 PRO 80 -23.689 -13.900 -3.326 636 HD2 PRO 80 HD2 PRO 80 -21.438 -12.794 -2.305 637 HD3 PRO 80 HD3 PRO 80 -21.463 -14.418 -3.022 638 H ALA 81 H ALA 81 -20.925 -11.446 -7.671 639 HA ALA 81 HA ALA 81 -20.648 -8.805 -6.828 640 HB1 ALA 81 HB1 ALA 81 -21.598 -9.333 -9.595 641 HB2 ALA 81 HB2 ALA 81 -20.305 -8.277 -9.024 642 HB3 ALA 81 HB3 ALA 81 -20.055 -10.021 -9.092 643 H LYS 82 H LYS 82 -23.491 -10.634 -7.597 644 HA LYS 82 HA LYS 82 -25.255 -8.483 -8.108 645 HB2 LYS 82 HB2 LYS 82 -27.035 -10.181 -7.483 646 HB3 LYS 82 HB3 LYS 82 -25.960 -10.634 -8.799 647 HG2 LYS 82 HG2 LYS 82 -24.643 -11.995 -7.233 648 HG3 LYS 82 HG3 LYS 82 -25.773 -11.572 -5.943 649 HD2 LYS 82 HD2 LYS 82 -26.662 -13.574 -6.605 650 HD3 LYS 82 HD3 LYS 82 -27.546 -12.483 -7.675 651 HE2 LYS 82 HE2 LYS 82 -25.998 -12.941 -9.476 652 HE3 LYS 82 HE3 LYS 82 -25.007 -13.936 -8.410 653 HZ1 LYS 82 HZ1 LYS 82 -26.221 -15.638 -9.115 654 HZ2 LYS 82 HZ2 LYS 82 -27.359 -14.636 -9.864 655 HZ3 LYS 82 HZ3 LYS 82 -27.513 -15.011 -8.222 656 H GLU 83 H GLU 83 -24.596 -10.357 -5.155 657 HA GLU 83 HA GLU 83 -26.376 -8.946 -3.493 658 HB2 GLU 83 HB2 GLU 83 -23.861 -10.475 -2.809 659 HB3 GLU 83 HB3 GLU 83 -25.020 -9.891 -1.623 660 HG2 GLU 83 HG2 GLU 83 -25.661 -11.827 -3.835 661 HG3 GLU 83 HG3 GLU 83 -25.288 -12.280 -2.173 662 H ALA 84 H ALA 84 -22.846 -8.632 -3.865 663 HA ALA 84 HA ALA 84 -22.371 -6.561 -2.123 664 HB1 ALA 84 HB1 ALA 84 -20.530 -5.914 -3.805 665 HB2 ALA 84 HB2 ALA 84 -20.480 -7.521 -3.078 666 HB3 ALA 84 HB3 ALA 84 -21.085 -7.316 -4.721 667 H MET 85 H MET 85 -23.639 -6.396 -5.411 668 HA MET 85 HA MET 85 -23.553 -3.566 -5.626 669 HB2 MET 85 HB2 MET 85 -24.294 -5.756 -7.274 670 HB3 MET 85 HB3 MET 85 -25.661 -4.651 -7.226 671 HG2 MET 85 HG2 MET 85 -23.729 -2.875 -7.652 672 HG3 MET 85 HG3 MET 85 -22.963 -4.287 -8.375 673 HE1 MET 85 HE1 MET 85 -26.471 -1.828 -9.546 674 HE2 MET 85 HE2 MET 85 -25.151 -1.562 -8.406 675 HE3 MET 85 HE3 MET 85 -24.897 -1.287 -10.131 676 H ALA 86 H ALA 86 -25.999 -5.858 -4.533 677 HA ALA 86 HA ALA 86 -28.033 -3.859 -4.202 678 HB1 ALA 86 HB1 ALA 86 -28.987 -5.910 -4.573 679 HB2 ALA 86 HB2 ALA 86 -27.795 -6.766 -3.595 680 HB3 ALA 86 HB3 ALA 86 -29.068 -5.829 -2.813 681 H GLN 87 H GLN 87 -25.378 -4.968 -2.350 682 HA GLN 87 HA GLN 87 -26.487 -4.095 0.189 683 HB2 GLN 87 HB2 GLN 87 -23.782 -5.206 -0.565 684 HB3 GLN 87 HB3 GLN 87 -24.229 -4.740 1.071 685 HG2 GLN 87 HG2 GLN 87 -26.195 -6.512 -0.056 686 HG3 GLN 87 HG3 GLN 87 -24.583 -7.220 -0.143 687 HE21 GLN 87 HE21 GLN 87 -24.385 -8.591 1.476 688 HE22 GLN 87 HE22 GLN 87 -24.814 -8.287 3.122 689 H ASP 88 H ASP 88 -25.521 -2.427 -2.334 690 HA ASP 88 HA ASP 88 -24.693 -0.340 -2.701 691 HB2 ASP 88 HB2 ASP 88 -25.420 -0.210 0.212 692 HB3 ASP 88 HB3 ASP 88 -24.649 1.162 -0.579 693 H LYS 89 H LYS 89 -22.924 -2.620 -1.758 694 HA LYS 89 HA LYS 89 -20.692 -1.159 -0.573 695 HB2 LYS 89 HB2 LYS 89 -21.137 -4.083 -1.176 696 HB3 LYS 89 HB3 LYS 89 -19.606 -3.450 -0.587 697 HG2 LYS 89 HG2 LYS 89 -21.165 -2.431 1.291 698 HG3 LYS 89 HG3 LYS 89 -22.193 -3.788 0.823 699 HD2 LYS 89 HD2 LYS 89 -19.318 -4.364 1.246 700 HD3 LYS 89 HD3 LYS 89 -20.276 -3.985 2.680 701 HE2 LYS 89 HE2 LYS 89 -21.948 -5.714 1.678 702 HE3 LYS 89 HE3 LYS 89 -20.546 -6.263 0.761 703 HZ1 LYS 89 HZ1 LYS 89 -20.060 -5.898 3.583 704 HZ2 LYS 89 HZ2 LYS 89 -19.627 -7.178 2.566 705 HZ3 LYS 89 HZ3 LYS 89 -21.183 -7.112 3.227 706 H MET 90 H MET 90 -21.869 -1.531 -3.584 707 HA MET 90 HA MET 90 -19.363 -0.838 -4.806 708 HB2 MET 90 HB2 MET 90 -19.185 -2.651 -6.344 709 HB3 MET 90 HB3 MET 90 -19.328 -3.353 -4.738 710 HG2 MET 90 HG2 MET 90 -21.677 -3.825 -5.132 711 HG3 MET 90 HG3 MET 90 -21.571 -3.079 -6.725 712 HE1 MET 90 HE1 MET 90 -19.029 -3.924 -8.006 713 HE2 MET 90 HE2 MET 90 -19.304 -5.522 -8.700 714 HE3 MET 90 HE3 MET 90 -20.533 -4.266 -8.861 715 H GLU 91 H GLU 91 -19.619 0.212 -6.764 716 HA GLU 91 HA GLU 91 -22.345 0.394 -7.840 717 HB2 GLU 91 HB2 GLU 91 -20.580 2.640 -6.927 718 HB3 GLU 91 HB3 GLU 91 -21.740 2.901 -8.222 719 HG2 GLU 91 HG2 GLU 91 -23.373 3.159 -6.759 720 HG3 GLU 91 HG3 GLU 91 -23.045 1.573 -6.065 721 H VAL 92 H VAL 92 -22.389 1.404 -10.028 722 HA VAL 92 HA VAL 92 -19.883 1.230 -11.512 723 HB VAL 92 HB VAL 92 -21.098 -0.133 -13.301 724 HG11 VAL 92 HG11 VAL 92 -19.322 -0.882 -11.551 725 HG12 VAL 92 HG12 VAL 92 -20.675 -1.753 -10.826 726 HG13 VAL 92 HG13 VAL 92 -20.193 -2.096 -12.488 727 HG21 VAL 92 HG21 VAL 92 -23.270 0.199 -11.708 728 HG22 VAL 92 HG22 VAL 92 -23.102 -1.078 -12.913 729 HG23 VAL 92 HG23 VAL 92 -22.732 -1.408 -11.220 730 H ASP 93 H ASP 93 -19.864 2.401 -13.428 731 HA ASP 93 HA ASP 93 -22.268 4.026 -13.947 732 HB2 ASP 93 HB2 ASP 93 -19.898 5.000 -12.991 733 HB3 ASP 93 HB3 ASP 93 -19.690 5.207 -14.728 734 H GLY 94 H GLY 94 -22.199 5.032 -16.198 735 HA2 GLY 94 HA2 GLY 94 -21.526 4.861 -18.485 736 HA3 GLY 94 HA3 GLY 94 -20.896 3.256 -18.145 737 H GLN 95 H GLN 95 -22.049 1.646 -18.951 738 HA GLN 95 HA GLN 95 -24.919 2.094 -19.438 739 HB2 GLN 95 HB2 GLN 95 -22.807 0.655 -20.976 740 HB3 GLN 95 HB3 GLN 95 -24.454 0.043 -21.053 741 HG2 GLN 95 HG2 GLN 95 -23.453 2.750 -21.882 742 HG3 GLN 95 HG3 GLN 95 -24.152 1.491 -22.898 743 HE21 GLN 95 HE21 GLN 95 -26.416 0.924 -22.458 744 HE22 GLN 95 HE22 GLN 95 -27.498 2.182 -21.973 745 H VAL 96 H VAL 96 -26.165 1.092 -18.013 746 HA VAL 96 HA VAL 96 -25.472 -0.734 -16.110 747 HB VAL 96 HB VAL 96 -28.141 -0.672 -17.524 748 HG11 VAL 96 HG11 VAL 96 -27.448 -1.554 -14.725 749 HG12 VAL 96 HG12 VAL 96 -29.045 -1.582 -15.476 750 HG13 VAL 96 HG13 VAL 96 -27.767 -2.639 -16.077 751 HG21 VAL 96 HG21 VAL 96 -27.033 0.986 -15.270 752 HG22 VAL 96 HG22 VAL 96 -27.678 1.543 -16.814 753 HG23 VAL 96 HG23 VAL 96 -28.759 0.848 -15.606 754 H GLU 97 H GLU 97 -26.790 -1.495 -19.329 755 HA GLU 97 HA GLU 97 -26.783 -4.276 -19.074 756 HB2 GLU 97 HB2 GLU 97 -27.069 -2.338 -21.220 757 HB3 GLU 97 HB3 GLU 97 -26.218 -3.780 -21.756 758 HG2 GLU 97 HG2 GLU 97 -28.511 -4.134 -22.185 759 HG3 GLU 97 HG3 GLU 97 -28.093 -5.133 -20.794 760 H LEU 98 H LEU 98 -24.354 -2.218 -20.686 761 HA LEU 98 HA LEU 98 -22.494 -4.156 -21.297 762 HB2 LEU 98 HB2 LEU 98 -22.538 -1.283 -21.050 763 HB3 LEU 98 HB3 LEU 98 -20.993 -1.935 -20.508 764 HG LEU 98 HG LEU 98 -21.151 -1.213 -22.935 765 HD11 LEU 98 HD11 LEU 98 -19.441 -2.593 -23.373 766 HD12 LEU 98 HD12 LEU 98 -20.388 -4.041 -23.036 767 HD13 LEU 98 HD13 LEU 98 -19.667 -3.130 -21.709 768 HD21 LEU 98 HD21 LEU 98 -22.480 -2.268 -24.418 769 HD22 LEU 98 HD22 LEU 98 -23.447 -2.625 -22.986 770 HD23 LEU 98 HD23 LEU 98 -22.321 -3.830 -23.615 771 H ILE 99 H ILE 99 -23.171 -2.658 -18.217 772 HA ILE 99 HA ILE 99 -20.807 -3.535 -16.893 773 HB ILE 99 HB ILE 99 -23.487 -2.717 -15.765 774 HG12 ILE 99 HG12 ILE 99 -20.992 -1.083 -15.576 775 HG13 ILE 99 HG13 ILE 99 -21.868 -1.105 -17.103 776 HG21 ILE 99 HG21 ILE 99 -21.049 -3.747 -14.495 777 HG22 ILE 99 HG22 ILE 99 -21.694 -2.270 -13.781 778 HG23 ILE 99 HG23 ILE 99 -22.710 -3.706 -13.903 779 HD11 ILE 99 HD11 ILE 99 -23.314 0.370 -16.327 780 HD12 ILE 99 HD12 ILE 99 -23.707 -0.677 -14.963 781 HD13 ILE 99 HD13 ILE 99 -22.373 0.469 -14.839 782 H PHE 100 H PHE 100 -24.166 -4.724 -16.864 783 HA PHE 100 HA PHE 100 -23.580 -7.002 -15.271 784 HB2 PHE 100 HB2 PHE 100 -25.919 -6.110 -16.913 785 HB3 PHE 100 HB3 PHE 100 -25.861 -7.769 -16.328 786 HD1 PHE 100 HD2 PHE 100 -25.560 -8.127 -13.820 787 HD2 PHE 100 HD1 PHE 100 -26.662 -4.392 -15.538 788 HE1 PHE 100 HE2 PHE 100 -26.439 -7.389 -11.644 789 HE2 PHE 100 HE1 PHE 100 -27.542 -3.648 -13.365 790 HZ PHE 100 HZ PHE 100 -27.432 -5.147 -11.414 791 H LEU 101 H LEU 101 -23.251 -6.301 -18.618 792 HA LEU 101 HA LEU 101 -23.475 -8.849 -19.746 793 HB2 LEU 101 HB2 LEU 101 -22.181 -6.298 -20.484 794 HB3 LEU 101 HB3 LEU 101 -21.578 -7.741 -21.297 795 HG LEU 101 HG LEU 101 -24.485 -6.952 -21.275 796 HD11 LEU 101 HD11 LEU 101 -22.243 -5.918 -22.854 797 HD12 LEU 101 HD12 LEU 101 -23.842 -5.235 -22.564 798 HD13 LEU 101 HD13 LEU 101 -23.623 -6.470 -23.803 799 HD21 LEU 101 HD21 LEU 101 -23.146 -9.296 -22.031 800 HD22 LEU 101 HD22 LEU 101 -23.565 -8.469 -23.532 801 HD23 LEU 101 HD23 LEU 101 -24.823 -8.860 -22.359 802 H LEU 102 H LEU 102 -21.113 -7.561 -17.643 803 HA LEU 102 HA LEU 102 -19.110 -9.551 -18.391 804 HB2 LEU 102 HB2 LEU 102 -19.076 -7.255 -16.446 805 HB3 LEU 102 HB3 LEU 102 -17.752 -8.407 -16.608 806 HG LEU 102 HG LEU 102 -18.476 -7.239 -19.161 807 HD11 LEU 102 HD11 LEU 102 -18.148 -5.005 -18.819 808 HD12 LEU 102 HD12 LEU 102 -17.238 -5.250 -17.329 809 HD13 LEU 102 HD13 LEU 102 -18.994 -5.421 -17.328 810 HD21 LEU 102 HD21 LEU 102 -16.417 -8.405 -18.868 811 HD22 LEU 102 HD22 LEU 102 -15.970 -7.391 -17.495 812 HD23 LEU 102 HD23 LEU 102 -16.032 -6.702 -19.118 813 H GLU 103 H GLU 103 -21.465 -8.864 -15.929 814 HA GLU 103 HA GLU 103 -20.713 -10.207 -13.724 815 HB2 GLU 103 HB2 GLU 103 -23.163 -9.414 -14.820 816 HB3 GLU 103 HB3 GLU 103 -23.363 -11.120 -14.448 817 HG2 GLU 103 HG2 GLU 103 -24.004 -10.228 -12.466 818 HG3 GLU 103 HG3 GLU 103 -22.276 -10.395 -12.160 819 HA PRO 104 HA PRO 104 -21.878 -14.512 -15.596 820 HB2 PRO 104 HB2 PRO 104 -22.294 -14.621 -18.277 821 HB3 PRO 104 HB3 PRO 104 -23.589 -14.304 -17.116 822 HG2 PRO 104 HG2 PRO 104 -22.036 -12.373 -18.796 823 HG3 PRO 104 HG3 PRO 104 -23.777 -12.415 -18.459 824 HD2 PRO 104 HD2 PRO 104 -22.084 -10.736 -17.175 825 HD3 PRO 104 HD3 PRO 104 -23.529 -11.413 -16.398 826 H PHE 105 H PHE 105 -20.000 -12.308 -17.607 827 HA PHE 105 HA PHE 105 -18.291 -14.156 -18.817 828 HB2 PHE 105 HB2 PHE 105 -18.127 -11.244 -18.182 829 HB3 PHE 105 HB3 PHE 105 -16.657 -12.071 -18.688 830 HD1 PHE 105 HD1 PHE 105 -20.176 -12.529 -19.804 831 HD2 PHE 105 HD2 PHE 105 -16.222 -11.339 -20.836 832 HE1 PHE 105 HE1 PHE 105 -20.863 -12.299 -22.155 833 HE2 PHE 105 HE2 PHE 105 -16.903 -11.106 -23.189 834 HZ PHE 105 HZ PHE 105 -19.226 -11.585 -23.851 835 H ILE 106 H ILE 106 -18.438 -13.026 -15.570 836 HA ILE 106 HA ILE 106 -15.784 -13.428 -14.753 837 HB ILE 106 HB ILE 106 -18.280 -13.812 -13.096 838 HG12 ILE 106 HG12 ILE 106 -16.590 -11.325 -13.430 839 HG13 ILE 106 HG13 ILE 106 -18.119 -11.598 -14.259 840 HG21 ILE 106 HG21 ILE 106 -16.429 -12.868 -11.391 841 HG22 ILE 106 HG22 ILE 106 -16.725 -14.586 -11.655 842 HG23 ILE 106 HG23 ILE 106 -15.394 -13.783 -12.488 843 HD11 ILE 106 HD11 ILE 106 -19.233 -10.826 -12.517 844 HD12 ILE 106 HD12 ILE 106 -18.476 -12.018 -11.460 845 HD13 ILE 106 HD13 ILE 106 -17.697 -10.460 -11.731 846 H ALA 107 H ALA 107 -18.363 -15.660 -15.393 847 HA ALA 107 HA ALA 107 -17.419 -17.874 -13.927 848 HB1 ALA 107 HB1 ALA 107 -19.035 -17.888 -16.474 849 HB2 ALA 107 HB2 ALA 107 -18.889 -19.209 -15.313 850 HB3 ALA 107 HB3 ALA 107 -19.696 -17.711 -14.848 851 H SER 108 H SER 108 -16.618 -16.611 -17.099 852 HA SER 108 HA SER 108 -15.167 -18.895 -17.985 853 HB2 SER 108 HB2 SER 108 -16.106 -16.659 -19.219 854 HB3 SER 108 HB3 SER 108 -14.391 -16.270 -19.092 855 HG SER 108 HG SER 108 -13.911 -17.858 -20.433 856 H LEU 109 H LEU 109 -14.237 -15.825 -16.480 857 HA LEU 109 HA LEU 109 -11.459 -16.189 -16.580 858 HB2 LEU 109 HB2 LEU 109 -12.934 -14.133 -15.913 859 HB3 LEU 109 HB3 LEU 109 -12.756 -14.786 -14.286 860 HG LEU 109 HG LEU 109 -11.125 -13.058 -14.620 861 HD11 LEU 109 HD11 LEU 109 -10.539 -15.286 -13.468 862 HD12 LEU 109 HD12 LEU 109 -9.231 -14.180 -13.886 863 HD13 LEU 109 HD13 LEU 109 -9.550 -15.589 -14.897 864 HD21 LEU 109 HD21 LEU 109 -10.727 -14.441 -17.204 865 HD22 LEU 109 HD22 LEU 109 -9.290 -13.767 -16.434 866 HD23 LEU 109 HD23 LEU 109 -10.661 -12.722 -16.811 867 H LYS 110 H LYS 110 -10.834 -18.239 -15.985 868 HA LYS 110 HA LYS 110 -10.156 -19.909 -14.597 869 HB2 LYS 110 HB2 LYS 110 -9.338 -17.820 -13.331 870 HB3 LYS 110 HB3 LYS 110 -10.710 -18.088 -12.265 871 HG2 LYS 110 HG2 LYS 110 -9.850 -20.354 -11.788 872 HG3 LYS 110 HG3 LYS 110 -8.435 -19.992 -12.779 873 HD2 LYS 110 HD2 LYS 110 -7.670 -18.353 -11.280 874 HD3 LYS 110 HD3 LYS 110 -9.231 -18.253 -10.462 875 HE2 LYS 110 HE2 LYS 110 -8.374 -19.646 -8.945 876 HE3 LYS 110 HE3 LYS 110 -8.514 -20.904 -10.172 877 HZ1 LYS 110 HZ1 LYS 110 -6.125 -19.242 -9.590 878 HZ2 LYS 110 HZ2 LYS 110 -6.245 -20.298 -10.906 879 HZ3 LYS 110 HZ3 LYS 110 -6.298 -20.904 -9.328 Start of MODEL 15 1 H1 MET 1 H MET 1 3.747 0.607 -0.895 2 HA MET 1 HA MET 1 2.178 -1.036 -0.119 3 HB2 MET 1 HB2 MET 1 -0.017 0.107 -0.460 4 HB3 MET 1 HB3 MET 1 1.262 1.173 0.105 5 HG2 MET 1 HG2 MET 1 1.290 2.382 -1.801 6 HG3 MET 1 HG3 MET 1 0.896 0.997 -2.816 7 HE1 MET 1 HE1 MET 1 0.138 3.847 -3.007 8 HE2 MET 1 HE2 MET 1 -1.590 3.937 -3.351 9 HE3 MET 1 HE3 MET 1 -0.977 4.434 -1.773 10 H SER 2 H SER 2 0.561 -2.575 -0.588 11 HA SER 2 HA SER 2 0.152 -3.158 -3.442 12 HB2 SER 2 HB2 SER 2 0.237 -5.655 -2.570 13 HB3 SER 2 HB3 SER 2 1.716 -4.801 -3.010 14 HG SER 2 HG SER 2 0.675 -5.317 -0.435 15 H LEU 3 H LEU 3 -1.832 -3.986 -3.997 16 HA LEU 3 HA LEU 3 -3.828 -4.064 -1.833 17 HB2 LEU 3 HB2 LEU 3 -3.982 -3.195 -4.694 18 HB3 LEU 3 HB3 LEU 3 -5.433 -3.688 -3.825 19 HG LEU 3 HG LEU 3 -3.721 -1.607 -2.575 20 HD11 LEU 3 HD11 LEU 3 -5.253 0.016 -3.980 21 HD12 LEU 3 HD12 LEU 3 -5.163 -1.296 -5.154 22 HD13 LEU 3 HD13 LEU 3 -3.685 -0.523 -4.581 23 HD21 LEU 3 HD21 LEU 3 -5.927 -0.736 -1.921 24 HD22 LEU 3 HD22 LEU 3 -5.696 -2.412 -1.425 25 HD23 LEU 3 HD23 LEU 3 -6.696 -2.038 -2.829 26 H LYS 4 H LYS 4 -5.298 -5.735 -1.734 27 HA LYS 4 HA LYS 4 -4.472 -8.261 -2.609 28 HB2 LYS 4 HB2 LYS 4 -7.161 -7.289 -1.636 29 HB3 LYS 4 HB3 LYS 4 -6.793 -8.983 -1.934 30 HG2 LYS 4 HG2 LYS 4 -4.773 -8.461 -0.314 31 HG3 LYS 4 HG3 LYS 4 -5.865 -7.189 0.240 32 HD2 LYS 4 HD2 LYS 4 -7.600 -8.850 0.665 33 HD3 LYS 4 HD3 LYS 4 -6.536 -10.128 0.072 34 HE2 LYS 4 HE2 LYS 4 -5.130 -8.665 2.056 35 HE3 LYS 4 HE3 LYS 4 -6.729 -9.042 2.695 36 HZ1 LYS 4 HZ1 LYS 4 -5.359 -10.848 3.252 37 HZ2 LYS 4 HZ2 LYS 4 -4.673 -10.930 1.709 38 HZ3 LYS 4 HZ3 LYS 4 -6.285 -11.389 1.944 39 H SER 5 H SER 5 -6.692 -5.931 -4.015 40 HA SER 5 HA SER 5 -7.974 -7.517 -5.894 41 HB2 SER 5 HB2 SER 5 -8.052 -5.335 -7.264 42 HB3 SER 5 HB3 SER 5 -8.783 -5.316 -5.660 43 HG SER 5 HG SER 5 -7.302 -3.963 -4.997 44 H ASP 6 H ASP 6 -4.728 -6.257 -5.872 45 HA ASP 6 HA ASP 6 -4.047 -6.436 -8.556 46 HB2 ASP 6 HB2 ASP 6 -2.392 -6.927 -6.078 47 HB3 ASP 6 HB3 ASP 6 -1.706 -6.872 -7.699 48 H GLU 7 H GLU 7 -4.155 -8.957 -6.087 49 HA GLU 7 HA GLU 7 -2.941 -11.017 -7.531 50 HB2 GLU 7 HB2 GLU 7 -4.359 -10.743 -5.077 51 HB3 GLU 7 HB3 GLU 7 -5.046 -12.108 -5.946 52 HG2 GLU 7 HG2 GLU 7 -2.128 -11.735 -5.310 53 HG3 GLU 7 HG3 GLU 7 -3.246 -12.780 -4.435 54 H VAL 8 H VAL 8 -6.259 -9.843 -7.533 55 HA VAL 8 HA VAL 8 -7.255 -11.963 -9.191 56 HB VAL 8 HB VAL 8 -8.438 -9.297 -8.414 57 HG11 VAL 8 HG11 VAL 8 -9.348 -9.886 -10.559 58 HG12 VAL 8 HG12 VAL 8 -9.655 -11.539 -10.022 59 HG13 VAL 8 HG13 VAL 8 -10.565 -10.200 -9.323 60 HG21 VAL 8 HG21 VAL 8 -9.551 -11.934 -7.605 61 HG22 VAL 8 HG22 VAL 8 -8.091 -11.359 -6.800 62 HG23 VAL 8 HG23 VAL 8 -9.565 -10.391 -6.750 63 H PHE 9 H PHE 9 -6.248 -8.609 -9.704 64 HA PHE 9 HA PHE 9 -6.966 -8.469 -12.432 65 HB2 PHE 9 HB2 PHE 9 -5.037 -6.910 -10.725 66 HB3 PHE 9 HB3 PHE 9 -5.222 -6.577 -12.444 67 HD1 PHE 9 HD2 PHE 9 -8.068 -6.830 -12.885 68 HD2 PHE 9 HD1 PHE 9 -5.980 -5.152 -9.578 69 HE1 PHE 9 HE2 PHE 9 -10.004 -5.392 -12.398 70 HE2 PHE 9 HE1 PHE 9 -7.913 -3.711 -9.084 71 HZ PHE 9 HZ PHE 9 -9.928 -3.829 -10.496 72 H ALA 10 H ALA 10 -3.978 -9.393 -10.789 73 HA ALA 10 HA ALA 10 -2.344 -9.622 -13.061 74 HB1 ALA 10 HB1 ALA 10 -1.025 -11.227 -11.589 75 HB2 ALA 10 HB2 ALA 10 -1.256 -9.587 -10.982 76 HB3 ALA 10 HB3 ALA 10 -2.239 -10.908 -10.349 77 H LYS 11 H LYS 11 -4.203 -12.110 -11.316 78 HA LYS 11 HA LYS 11 -3.561 -14.235 -13.046 79 HB2 LYS 11 HB2 LYS 11 -5.446 -15.405 -12.016 80 HB3 LYS 11 HB3 LYS 11 -4.477 -14.583 -10.800 81 HG2 LYS 11 HG2 LYS 11 -6.107 -12.802 -10.656 82 HG3 LYS 11 HG3 LYS 11 -7.059 -13.540 -11.946 83 HD2 LYS 11 HD2 LYS 11 -8.118 -14.171 -9.935 84 HD3 LYS 11 HD3 LYS 11 -7.212 -15.593 -10.458 85 HE2 LYS 11 HE2 LYS 11 -5.348 -14.769 -8.939 86 HE3 LYS 11 HE3 LYS 11 -6.529 -13.642 -8.273 87 HZ1 LYS 11 HZ1 LYS 11 -6.680 -15.445 -6.866 88 HZ2 LYS 11 HZ2 LYS 11 -6.475 -16.582 -8.101 89 HZ3 LYS 11 HZ3 LYS 11 -7.942 -15.753 -7.950 90 H ILE 12 H ILE 12 -6.124 -11.827 -13.109 91 HA ILE 12 HA ILE 12 -7.629 -13.031 -15.199 92 HB ILE 12 HB ILE 12 -7.560 -10.242 -14.076 93 HG12 ILE 12 HG12 ILE 12 -9.767 -12.307 -14.117 94 HG13 ILE 12 HG13 ILE 12 -8.614 -12.139 -12.798 95 HG21 ILE 12 HG21 ILE 12 -8.913 -11.247 -16.530 96 HG22 ILE 12 HG22 ILE 12 -9.751 -10.074 -15.516 97 HG23 ILE 12 HG23 ILE 12 -8.179 -9.676 -16.208 98 HD11 ILE 12 HD11 ILE 12 -9.406 -9.729 -12.635 99 HD12 ILE 12 HD12 ILE 12 -10.744 -10.225 -13.672 100 HD13 ILE 12 HD13 ILE 12 -10.518 -10.987 -12.098 101 H ALA 13 H ALA 13 -5.134 -10.519 -15.120 102 HA ALA 13 HA ALA 13 -5.216 -9.761 -17.804 103 HB1 ALA 13 HB1 ALA 13 -3.818 -8.908 -15.697 104 HB2 ALA 13 HB2 ALA 13 -2.563 -9.856 -16.496 105 HB3 ALA 13 HB3 ALA 13 -3.359 -8.540 -17.360 106 H LYS 14 H LYS 14 -3.110 -12.176 -16.239 107 HA LYS 14 HA LYS 14 -1.796 -13.047 -18.541 108 HB2 LYS 14 HB2 LYS 14 -1.296 -13.580 -16.076 109 HB3 LYS 14 HB3 LYS 14 -2.482 -14.868 -16.243 110 HG2 LYS 14 HG2 LYS 14 -1.141 -15.790 -18.114 111 HG3 LYS 14 HG3 LYS 14 0.081 -14.558 -17.791 112 HD2 LYS 14 HD2 LYS 14 0.838 -15.611 -15.942 113 HD3 LYS 14 HD3 LYS 14 -0.776 -16.138 -15.457 114 HE2 LYS 14 HE2 LYS 14 -0.235 -17.546 -17.798 115 HE3 LYS 14 HE3 LYS 14 1.282 -17.568 -16.900 116 HZ1 LYS 14 HZ1 LYS 14 -0.724 -18.089 -15.066 117 HZ2 LYS 14 HZ2 LYS 14 0.425 -19.175 -15.665 118 HZ3 LYS 14 HZ3 LYS 14 -1.083 -19.038 -16.420 119 H ARG 15 H ARG 15 -4.807 -14.177 -17.059 120 HA ARG 15 HA ARG 15 -5.247 -16.354 -18.788 121 HB2 ARG 15 HB2 ARG 15 -6.440 -16.082 -16.663 122 HB3 ARG 15 HB3 ARG 15 -7.258 -14.659 -17.296 123 HG2 ARG 15 HG2 ARG 15 -7.558 -17.100 -18.905 124 HG3 ARG 15 HG3 ARG 15 -8.301 -17.144 -17.305 125 HD2 ARG 15 HD2 ARG 15 -9.943 -15.776 -17.937 126 HD3 ARG 15 HD3 ARG 15 -8.808 -14.635 -18.658 127 HE ARG 15 HE ARG 15 -9.344 -15.492 -20.699 128 HH11 ARG 15 HH11 ARG 15 -10.156 -17.846 -18.265 129 HH12 ARG 15 HH12 ARG 15 -10.885 -18.946 -19.387 130 HH21 ARG 15 HH21 ARG 15 -10.302 -16.933 -22.185 131 HH22 ARG 15 HH22 ARG 15 -10.967 -18.426 -21.616 132 H LEU 16 H LEU 16 -5.808 -12.937 -19.129 133 HA LEU 16 HA LEU 16 -7.596 -13.144 -21.354 134 HB2 LEU 16 HB2 LEU 16 -5.988 -10.877 -20.207 135 HB3 LEU 16 HB3 LEU 16 -7.009 -10.693 -21.631 136 HG LEU 16 HG LEU 16 -8.135 -11.685 -19.032 137 HD11 LEU 16 HD11 LEU 16 -8.280 -8.803 -19.779 138 HD12 LEU 16 HD12 LEU 16 -6.857 -9.406 -18.930 139 HD13 LEU 16 HD13 LEU 16 -8.453 -9.571 -18.200 140 HD21 LEU 16 HD21 LEU 16 -9.985 -11.782 -20.252 141 HD22 LEU 16 HD22 LEU 16 -9.137 -11.124 -21.652 142 HD23 LEU 16 HD23 LEU 16 -9.893 -10.036 -20.486 143 H GLU 17 H GLU 17 -4.299 -13.640 -21.005 144 HA GLU 17 HA GLU 17 -3.464 -12.648 -23.572 145 HB2 GLU 17 HB2 GLU 17 -2.075 -14.519 -21.646 146 HB3 GLU 17 HB3 GLU 17 -1.336 -13.789 -23.064 147 HG2 GLU 17 HG2 GLU 17 -1.918 -11.547 -22.018 148 HG3 GLU 17 HG3 GLU 17 -2.245 -12.451 -20.541 149 H SER 18 H SER 18 -5.086 -15.405 -22.481 150 HA SER 18 HA SER 18 -4.209 -17.032 -24.755 151 HB2 SER 18 HB2 SER 18 -5.244 -17.608 -22.082 152 HB3 SER 18 HB3 SER 18 -6.043 -18.549 -23.342 153 HG SER 18 HG SER 18 -3.979 -19.238 -24.032 154 H ILE 19 H ILE 19 -6.448 -14.737 -24.179 155 HA ILE 19 HA ILE 19 -8.879 -15.772 -25.069 156 HB ILE 19 HB ILE 19 -7.823 -12.990 -25.588 157 HG12 ILE 19 HG12 ILE 19 -7.758 -13.790 -23.178 158 HG13 ILE 19 HG13 ILE 19 -8.708 -12.339 -23.478 159 HG21 ILE 19 HG21 ILE 19 -9.731 -13.086 -26.855 160 HG22 ILE 19 HG22 ILE 19 -10.503 -14.271 -25.802 161 HG23 ILE 19 HG23 ILE 19 -10.402 -12.582 -25.304 162 HD11 ILE 19 HD11 ILE 19 -9.773 -13.947 -21.928 163 HD12 ILE 19 HD12 ILE 19 -10.748 -13.581 -23.352 164 HD13 ILE 19 HD13 ILE 19 -9.865 -15.105 -23.255 165 H ASP 20 H ASP 20 -9.806 -16.065 -27.051 166 HA ASP 20 HA ASP 20 -8.042 -15.733 -29.389 167 HB2 ASP 20 HB2 ASP 20 -9.251 -18.096 -28.366 168 HB3 ASP 20 HB3 ASP 20 -10.037 -17.714 -29.896 169 HA PRO 21 HA PRO 21 -11.147 -13.279 -31.286 170 HB2 PRO 21 HB2 PRO 21 -10.758 -13.891 -33.903 171 HB3 PRO 21 HB3 PRO 21 -9.635 -12.892 -32.972 172 HG2 PRO 21 HG2 PRO 21 -9.461 -15.800 -33.661 173 HG3 PRO 21 HG3 PRO 21 -8.189 -14.564 -33.694 174 HD2 PRO 21 HD2 PRO 21 -8.445 -16.338 -31.664 175 HD3 PRO 21 HD3 PRO 21 -7.835 -14.688 -31.420 176 H ALA 22 H ALA 22 -10.985 -16.638 -32.438 177 HA ALA 22 HA ALA 22 -13.547 -16.747 -33.581 178 HB1 ALA 22 HB1 ALA 22 -11.599 -18.405 -33.791 179 HB2 ALA 22 HB2 ALA 22 -12.232 -19.122 -32.308 180 HB3 ALA 22 HB3 ALA 22 -13.240 -19.052 -33.753 181 H ASN 23 H ASN 23 -12.448 -17.877 -30.379 182 HA ASN 23 HA ASN 23 -15.184 -18.261 -29.513 183 HB2 ASN 23 HB2 ASN 23 -12.488 -18.905 -28.448 184 HB3 ASN 23 HB3 ASN 23 -13.765 -18.654 -27.262 185 HD21 ASN 23 HD21 ASN 23 -13.338 -20.288 -30.386 186 HD22 ASN 23 HD22 ASN 23 -14.135 -21.748 -29.921 187 H ARG 24 H ARG 24 -16.365 -16.611 -28.829 188 HA ARG 24 HA ARG 24 -15.669 -14.949 -26.700 189 HB2 ARG 24 HB2 ARG 24 -14.486 -14.102 -29.110 190 HB3 ARG 24 HB3 ARG 24 -15.832 -13.007 -28.822 191 HG2 ARG 24 HG2 ARG 24 -14.865 -12.071 -27.009 192 HG3 ARG 24 HG3 ARG 24 -14.088 -13.575 -26.511 193 HD2 ARG 24 HD2 ARG 24 -12.288 -12.276 -27.169 194 HD3 ARG 24 HD3 ARG 24 -12.621 -13.227 -28.616 195 HE ARG 24 HE ARG 24 -14.085 -10.940 -28.934 196 HH11 ARG 24 HH11 ARG 24 -10.727 -11.673 -28.379 197 HH12 ARG 24 HH12 ARG 24 -10.148 -10.278 -29.227 198 HH21 ARG 24 HH21 ARG 24 -13.335 -9.100 -30.053 199 HH22 ARG 24 HH22 ARG 24 -11.632 -8.814 -30.178 200 H GLN 25 H GLN 25 -17.141 -12.724 -27.035 201 HA GLN 25 HA GLN 25 -19.650 -13.274 -28.326 202 HB2 GLN 25 HB2 GLN 25 -19.348 -14.304 -25.772 203 HB3 GLN 25 HB3 GLN 25 -20.187 -12.783 -25.503 204 HG2 GLN 25 HG2 GLN 25 -21.933 -14.245 -25.769 205 HG3 GLN 25 HG3 GLN 25 -21.749 -13.604 -27.402 206 HE21 GLN 25 HE21 GLN 25 -21.187 -14.946 -29.034 207 HE22 GLN 25 HE22 GLN 25 -20.962 -16.649 -28.853 208 H VAL 26 H VAL 26 -17.949 -11.323 -25.904 209 HA VAL 26 HA VAL 26 -18.483 -8.900 -27.294 210 HB VAL 26 HB VAL 26 -20.704 -9.345 -26.181 211 HG11 VAL 26 HG11 VAL 26 -19.670 -10.279 -24.092 212 HG12 VAL 26 HG12 VAL 26 -19.245 -8.625 -23.647 213 HG13 VAL 26 HG13 VAL 26 -20.939 -9.083 -23.828 214 HG21 VAL 26 HG21 VAL 26 -21.073 -7.123 -26.066 215 HG22 VAL 26 HG22 VAL 26 -19.741 -6.852 -24.942 216 HG23 VAL 26 HG23 VAL 26 -19.418 -7.021 -26.668 217 H GLU 27 H GLU 27 -17.076 -7.329 -26.695 218 HA GLU 27 HA GLU 27 -15.725 -7.517 -24.114 219 HB2 GLU 27 HB2 GLU 27 -14.417 -7.854 -26.783 220 HB3 GLU 27 HB3 GLU 27 -13.532 -7.056 -25.491 221 HG2 GLU 27 HG2 GLU 27 -14.825 -9.649 -24.873 222 HG3 GLU 27 HG3 GLU 27 -13.393 -9.664 -25.901 223 H HIS 28 H HIS 28 -15.760 -5.572 -23.224 224 HA HIS 28 HA HIS 28 -15.395 -3.212 -24.934 225 HB2 HIS 28 HB2 HIS 28 -17.087 -2.153 -23.171 226 HB3 HIS 28 HB3 HIS 28 -17.650 -2.930 -24.648 227 HD1 HIS 28 HD1 HIS 28 -16.838 -4.128 -21.118 228 HD2 HIS 28 HD2 HIS 28 -19.687 -4.602 -24.104 229 HE1 HIS 28 HE1 HIS 28 -18.540 -5.721 -20.176 230 H VAL 29 H VAL 29 -14.349 -1.469 -23.973 231 HA VAL 29 HA VAL 29 -12.446 -2.069 -21.999 232 HB VAL 29 HB VAL 29 -13.389 0.667 -22.865 233 HG11 VAL 29 HG11 VAL 29 -11.873 1.518 -21.484 234 HG12 VAL 29 HG12 VAL 29 -11.594 -0.101 -20.841 235 HG13 VAL 29 HG13 VAL 29 -10.614 0.499 -22.180 236 HG21 VAL 29 HG21 VAL 29 -12.602 -0.934 -24.678 237 HG22 VAL 29 HG22 VAL 29 -11.773 0.619 -24.576 238 HG23 VAL 29 HG23 VAL 29 -11.010 -0.832 -23.926 239 H TYR 30 H TYR 30 -12.460 -1.943 -19.840 240 HA TYR 30 HA TYR 30 -14.688 -0.538 -18.529 241 HB2 TYR 30 HB2 TYR 30 -14.135 -3.359 -18.498 242 HB3 TYR 30 HB3 TYR 30 -13.953 -2.706 -16.874 243 HD1 TYR 30 HD1 TYR 30 -16.320 -2.707 -19.757 244 HD2 TYR 30 HD2 TYR 30 -15.834 -2.421 -15.540 245 HE1 TYR 30 HE1 TYR 30 -18.763 -2.737 -19.480 246 HE2 TYR 30 HE2 TYR 30 -18.276 -2.451 -15.251 247 HH TYR 30 HH TYR 30 -20.257 -3.093 -16.389 248 H LYS 31 H LYS 31 -14.210 0.528 -16.646 249 HA LYS 31 HA LYS 31 -11.351 0.740 -16.005 250 HB2 LYS 31 HB2 LYS 31 -12.158 2.872 -16.569 251 HB3 LYS 31 HB3 LYS 31 -13.671 2.627 -15.706 252 HG2 LYS 31 HG2 LYS 31 -12.799 3.248 -13.720 253 HG3 LYS 31 HG3 LYS 31 -11.214 2.554 -14.074 254 HD2 LYS 31 HD2 LYS 31 -11.101 4.991 -13.932 255 HD3 LYS 31 HD3 LYS 31 -10.721 4.431 -15.562 256 HE2 LYS 31 HE2 LYS 31 -12.360 5.671 -16.401 257 HE3 LYS 31 HE3 LYS 31 -13.534 4.871 -15.359 258 HZ1 LYS 31 HZ1 LYS 31 -13.573 7.215 -14.944 259 HZ2 LYS 31 HZ2 LYS 31 -11.903 7.257 -14.681 260 HZ3 LYS 31 HZ3 LYS 31 -12.911 6.447 -13.589 261 H PHE 32 H PHE 32 -10.585 0.395 -13.970 262 HA PHE 32 HA PHE 32 -12.540 -0.526 -11.965 263 HB2 PHE 32 HB2 PHE 32 -9.742 -1.538 -12.506 264 HB3 PHE 32 HB3 PHE 32 -10.707 -2.006 -11.109 265 HD1 PHE 32 HD2 PHE 32 -13.244 -2.696 -11.909 266 HD2 PHE 32 HD1 PHE 32 -9.653 -3.109 -14.158 267 HE1 PHE 32 HE2 PHE 32 -14.281 -4.495 -13.228 268 HE2 PHE 32 HE1 PHE 32 -10.685 -4.909 -15.481 269 HZ PHE 32 HZ PHE 32 -13.001 -5.605 -15.016 270 H ARG 33 H ARG 33 -12.579 0.565 -10.116 271 HA ARG 33 HA ARG 33 -10.278 2.287 -9.467 272 HB2 ARG 33 HB2 ARG 33 -13.191 2.753 -9.423 273 HB3 ARG 33 HB3 ARG 33 -12.318 3.354 -8.020 274 HG2 ARG 33 HG2 ARG 33 -10.745 4.463 -9.708 275 HG3 ARG 33 HG3 ARG 33 -12.010 4.134 -10.894 276 HD2 ARG 33 HD2 ARG 33 -13.501 5.586 -9.905 277 HD3 ARG 33 HD3 ARG 33 -12.726 5.471 -8.326 278 HE ARG 33 HE ARG 33 -10.950 6.680 -10.134 279 HH11 ARG 33 HH11 ARG 33 -13.940 7.327 -8.472 280 HH12 ARG 33 HH12 ARG 33 -13.698 9.042 -8.431 281 HH21 ARG 33 HH21 ARG 33 -10.620 8.937 -10.087 282 HH22 ARG 33 HH22 ARG 33 -11.810 9.957 -9.351 283 H ILE 34 H ILE 34 -9.132 1.543 -7.817 284 HA ILE 34 HA ILE 34 -10.401 -0.190 -5.835 285 HB ILE 34 HB ILE 34 -7.470 0.482 -6.061 286 HG12 ILE 34 HG12 ILE 34 -8.303 -0.512 -8.167 287 HG13 ILE 34 HG13 ILE 34 -7.198 -1.587 -7.319 288 HG21 ILE 34 HG21 ILE 34 -7.454 -1.906 -4.974 289 HG22 ILE 34 HG22 ILE 34 -7.717 -0.467 -3.990 290 HG23 ILE 34 HG23 ILE 34 -9.088 -1.459 -4.486 291 HD11 ILE 34 HD11 ILE 34 -10.138 -1.862 -6.909 292 HD12 ILE 34 HD12 ILE 34 -9.376 -2.525 -8.356 293 HD13 ILE 34 HD13 ILE 34 -8.863 -3.071 -6.760 294 H THR 35 H THR 35 -11.084 0.609 -3.973 295 HA THR 35 HA THR 35 -9.865 3.100 -2.973 296 HB THR 35 HB THR 35 -11.928 3.685 -1.935 297 HG1 THR 35 HG1 THR 35 -13.526 2.272 -1.584 298 HG21 THR 35 HG21 THR 35 -12.817 4.408 -3.849 299 HG22 THR 35 HG22 THR 35 -13.314 2.776 -4.296 300 HG23 THR 35 HG23 THR 35 -11.696 3.348 -4.703 301 H GLN 36 H GLN 36 -9.386 3.283 -0.777 302 HA GLN 36 HA GLN 36 -9.030 0.718 0.585 303 HB2 GLN 36 HB2 GLN 36 -7.297 2.796 0.219 304 HB3 GLN 36 HB3 GLN 36 -7.911 3.138 1.831 305 HG2 GLN 36 HG2 GLN 36 -7.254 0.912 2.566 306 HG3 GLN 36 HG3 GLN 36 -6.659 0.548 0.947 307 HE21 GLN 36 HE21 GLN 36 -4.546 0.644 0.821 308 HE22 GLN 36 HE22 GLN 36 -3.516 1.742 1.668 309 H GLY 37 H GLY 37 -10.895 0.232 1.628 310 HA2 GLY 37 HA2 GLY 37 -12.328 0.290 3.443 311 HA3 GLY 37 HA3 GLY 37 -11.554 1.781 3.960 312 H GLY 38 H GLY 38 -12.025 3.075 1.347 313 HA2 GLY 38 HA2 GLY 38 -14.621 3.161 0.486 314 HA3 GLY 38 HA3 GLY 38 -14.624 4.132 1.950 315 H LYS 39 H LYS 39 -11.614 4.529 0.861 316 HA LYS 39 HA LYS 39 -12.352 6.866 -0.777 317 HB2 LYS 39 HB2 LYS 39 -9.971 7.631 0.037 318 HB3 LYS 39 HB3 LYS 39 -11.380 7.843 1.067 319 HG2 LYS 39 HG2 LYS 39 -9.857 5.314 1.333 320 HG3 LYS 39 HG3 LYS 39 -9.120 6.792 1.957 321 HD2 LYS 39 HD2 LYS 39 -11.514 7.118 3.024 322 HD3 LYS 39 HD3 LYS 39 -11.574 5.362 2.850 323 HE2 LYS 39 HE2 LYS 39 -9.691 5.061 4.238 324 HE3 LYS 39 HE3 LYS 39 -9.259 6.768 4.153 325 HZ1 LYS 39 HZ1 LYS 39 -11.231 5.434 5.823 326 HZ2 LYS 39 HZ2 LYS 39 -11.680 6.947 5.213 327 HZ3 LYS 39 HZ3 LYS 39 -10.278 6.795 6.147 328 H VAL 40 H VAL 40 -11.661 6.888 -2.810 329 HA VAL 40 HA VAL 40 -10.325 4.776 -4.026 330 HB VAL 40 HB VAL 40 -11.701 6.576 -5.161 331 HG11 VAL 40 HG11 VAL 40 -9.143 8.094 -5.460 332 HG12 VAL 40 HG12 VAL 40 -10.804 8.636 -5.712 333 HG13 VAL 40 HG13 VAL 40 -10.193 8.392 -4.075 334 HG21 VAL 40 HG21 VAL 40 -9.963 6.614 -7.168 335 HG22 VAL 40 HG22 VAL 40 -9.167 5.401 -6.165 336 HG23 VAL 40 HG23 VAL 40 -10.826 5.147 -6.706 337 H VAL 41 H VAL 41 -8.228 4.360 -4.576 338 HA VAL 41 HA VAL 41 -6.189 6.224 -3.546 339 HB VAL 41 HB VAL 41 -6.488 4.078 -2.205 340 HG11 VAL 41 HG11 VAL 41 -6.001 2.034 -3.069 341 HG12 VAL 41 HG12 VAL 41 -6.576 2.810 -4.546 342 HG13 VAL 41 HG13 VAL 41 -4.845 2.678 -4.235 343 HG21 VAL 41 HG21 VAL 41 -4.340 4.256 -1.543 344 HG22 VAL 41 HG22 VAL 41 -3.707 4.039 -3.175 345 HG23 VAL 41 HG23 VAL 41 -4.316 5.615 -2.668 346 H LYS 42 H LYS 42 -7.211 4.059 -6.064 347 HA LYS 42 HA LYS 42 -5.412 5.273 -7.937 348 HB2 LYS 42 HB2 LYS 42 -4.237 3.259 -6.615 349 HB3 LYS 42 HB3 LYS 42 -5.060 2.323 -7.856 350 HG2 LYS 42 HG2 LYS 42 -3.892 3.413 -9.592 351 HG3 LYS 42 HG3 LYS 42 -3.289 4.662 -8.501 352 HD2 LYS 42 HD2 LYS 42 -2.608 1.824 -7.916 353 HD3 LYS 42 HD3 LYS 42 -1.775 2.627 -9.249 354 HE2 LYS 42 HE2 LYS 42 -1.968 4.098 -6.683 355 HE3 LYS 42 HE3 LYS 42 -0.890 2.704 -6.732 356 HZ1 LYS 42 HZ1 LYS 42 0.369 4.603 -7.322 357 HZ2 LYS 42 HZ2 LYS 42 -0.784 5.121 -8.446 358 HZ3 LYS 42 HZ3 LYS 42 0.127 3.727 -8.749 359 H ASN 43 H ASN 43 -5.704 4.336 -10.153 360 HA ASN 43 HA ASN 43 -8.256 2.937 -10.489 361 HB2 ASN 43 HB2 ASN 43 -8.676 4.586 -12.448 362 HB3 ASN 43 HB3 ASN 43 -9.028 5.119 -10.806 363 HD21 ASN 43 HD21 ASN 43 -8.149 6.948 -10.135 364 HD22 ASN 43 HD22 ASN 43 -6.862 7.793 -10.918 365 H TRP 44 H TRP 44 -8.103 1.331 -11.909 366 HA TRP 44 HA TRP 44 -5.778 1.290 -13.710 367 HB2 TRP 44 HB2 TRP 44 -7.409 -0.904 -12.447 368 HB3 TRP 44 HB3 TRP 44 -6.368 -1.214 -13.833 369 HD1 TRP 44 HD1 TRP 44 -6.188 -0.198 -10.132 370 HE1 TRP 44 HE1 TRP 44 -3.808 -0.673 -9.274 371 HE3 TRP 44 HE3 TRP 44 -3.974 -1.494 -14.554 372 HZ2 TRP 44 HZ2 TRP 44 -1.321 -1.489 -10.332 373 HZ3 TRP 44 HZ3 TRP 44 -1.591 -2.108 -14.545 374 HH2 TRP 44 HH2 TRP 44 -0.294 -2.104 -12.476 375 H VAL 45 H VAL 45 -6.043 0.507 -15.868 376 HA VAL 45 HA VAL 45 -8.790 0.808 -16.898 377 HB VAL 45 HB VAL 45 -7.066 2.641 -17.471 378 HG11 VAL 45 HG11 VAL 45 -5.230 1.105 -18.019 379 HG12 VAL 45 HG12 VAL 45 -6.161 0.494 -19.387 380 HG13 VAL 45 HG13 VAL 45 -5.621 2.173 -19.366 381 HG21 VAL 45 HG21 VAL 45 -8.301 1.398 -19.898 382 HG22 VAL 45 HG22 VAL 45 -9.316 2.039 -18.605 383 HG23 VAL 45 HG23 VAL 45 -8.189 3.100 -19.450 384 H MET 46 H MET 46 -9.521 -0.662 -18.369 385 HA MET 46 HA MET 46 -7.748 -2.950 -18.898 386 HB2 MET 46 HB2 MET 46 -9.659 -3.622 -17.621 387 HB3 MET 46 HB3 MET 46 -10.754 -2.763 -18.697 388 HG2 MET 46 HG2 MET 46 -9.209 -4.666 -20.183 389 HG3 MET 46 HG3 MET 46 -9.988 -5.450 -18.810 390 HE1 MET 46 HE1 MET 46 -12.515 -5.010 -18.219 391 HE2 MET 46 HE2 MET 46 -13.669 -5.360 -19.506 392 HE3 MET 46 HE3 MET 46 -12.372 -6.502 -19.150 393 H ASP 47 H ASP 47 -7.011 -3.137 -20.898 394 HA ASP 47 HA ASP 47 -7.803 -1.498 -23.033 395 HB2 ASP 47 HB2 ASP 47 -5.669 -3.096 -22.576 396 HB3 ASP 47 HB3 ASP 47 -6.563 -4.099 -23.715 397 H LEU 48 H LEU 48 -8.004 -3.222 -25.229 398 HA LEU 48 HA LEU 48 -10.228 -5.008 -24.862 399 HB2 LEU 48 HB2 LEU 48 -11.048 -2.512 -24.987 400 HB3 LEU 48 HB3 LEU 48 -10.792 -2.743 -26.715 401 HG LEU 48 HG LEU 48 -12.750 -4.148 -24.917 402 HD11 LEU 48 HD11 LEU 48 -13.802 -2.269 -25.694 403 HD12 LEU 48 HD12 LEU 48 -14.186 -3.408 -26.984 404 HD13 LEU 48 HD13 LEU 48 -12.883 -2.241 -27.200 405 HD21 LEU 48 HD21 LEU 48 -13.334 -5.372 -27.107 406 HD22 LEU 48 HD22 LEU 48 -11.963 -5.950 -26.160 407 HD23 LEU 48 HD23 LEU 48 -11.690 -4.964 -27.598 408 H LYS 49 H LYS 49 -8.429 -3.063 -27.231 409 HA LYS 49 HA LYS 49 -8.776 -4.964 -29.340 410 HB2 LYS 49 HB2 LYS 49 -8.339 -2.450 -29.564 411 HB3 LYS 49 HB3 LYS 49 -6.654 -2.828 -29.231 412 HG2 LYS 49 HG2 LYS 49 -6.648 -4.343 -31.183 413 HG3 LYS 49 HG3 LYS 49 -8.302 -3.838 -31.539 414 HD2 LYS 49 HD2 LYS 49 -7.130 -1.431 -31.352 415 HD3 LYS 49 HD3 LYS 49 -5.749 -2.386 -31.895 416 HE2 LYS 49 HE2 LYS 49 -6.539 -2.420 -33.971 417 HE3 LYS 49 HE3 LYS 49 -8.068 -3.100 -33.416 418 HZ1 LYS 49 HZ1 LYS 49 -8.964 -1.181 -34.040 419 HZ2 LYS 49 HZ2 LYS 49 -7.460 -0.429 -34.227 420 HZ3 LYS 49 HZ3 LYS 49 -8.203 -0.468 -32.708 421 H ASN 50 H ASN 50 -6.416 -4.431 -26.835 422 HA ASN 50 HA ASN 50 -4.666 -6.483 -27.994 423 HB2 ASN 50 HB2 ASN 50 -3.893 -4.114 -27.104 424 HB3 ASN 50 HB3 ASN 50 -3.917 -4.939 -25.548 425 HD21 ASN 50 HD21 ASN 50 -1.927 -4.026 -27.881 426 HD22 ASN 50 HD22 ASN 50 -0.742 -5.281 -27.813 427 H VAL 51 H VAL 51 -6.872 -5.864 -25.423 428 HA VAL 51 HA VAL 51 -7.754 -7.208 -23.808 429 HB VAL 51 HB VAL 51 -6.156 -9.535 -24.824 430 HG11 VAL 51 HG11 VAL 51 -8.143 -9.215 -22.896 431 HG12 VAL 51 HG12 VAL 51 -8.955 -9.966 -24.272 432 HG13 VAL 51 HG13 VAL 51 -7.536 -10.733 -23.557 433 HG21 VAL 51 HG21 VAL 51 -6.929 -8.869 -26.879 434 HG22 VAL 51 HG22 VAL 51 -8.294 -9.838 -26.325 435 HG23 VAL 51 HG23 VAL 51 -8.357 -8.080 -26.209 436 H LYS 52 H LYS 52 -5.673 -5.687 -23.020 437 HA LYS 52 HA LYS 52 -4.314 -7.433 -21.088 438 HB2 LYS 52 HB2 LYS 52 -2.814 -6.716 -23.023 439 HB3 LYS 52 HB3 LYS 52 -2.944 -5.082 -22.386 440 HG2 LYS 52 HG2 LYS 52 -0.897 -6.153 -21.640 441 HG3 LYS 52 HG3 LYS 52 -1.966 -5.817 -20.276 442 HD2 LYS 52 HD2 LYS 52 -2.499 -8.056 -19.980 443 HD3 LYS 52 HD3 LYS 52 -2.047 -8.485 -21.632 444 HE2 LYS 52 HE2 LYS 52 -0.091 -9.169 -20.825 445 HE3 LYS 52 HE3 LYS 52 0.285 -7.480 -20.487 446 HZ1 LYS 52 HZ1 LYS 52 -0.964 -9.429 -18.630 447 HZ2 LYS 52 HZ2 LYS 52 -0.790 -7.780 -18.298 448 HZ3 LYS 52 HZ3 LYS 52 0.581 -8.750 -18.503 449 H LEU 53 H LEU 53 -3.569 -6.299 -19.155 450 HA LEU 53 HA LEU 53 -5.294 -3.993 -18.545 451 HB2 LEU 53 HB2 LEU 53 -4.784 -6.451 -17.175 452 HB3 LEU 53 HB3 LEU 53 -4.252 -5.105 -16.169 453 HG LEU 53 HG LEU 53 -6.476 -4.139 -16.233 454 HD11 LEU 53 HD11 LEU 53 -7.072 -4.889 -18.504 455 HD12 LEU 53 HD12 LEU 53 -8.329 -5.241 -17.318 456 HD13 LEU 53 HD13 LEU 53 -7.269 -6.530 -17.888 457 HD21 LEU 53 HD21 LEU 53 -7.156 -5.434 -14.547 458 HD22 LEU 53 HD22 LEU 53 -5.731 -6.418 -14.882 459 HD23 LEU 53 HD23 LEU 53 -7.291 -6.857 -15.581 460 H VAL 54 H VAL 54 -4.416 -2.122 -17.878 461 HA VAL 54 HA VAL 54 -1.636 -2.063 -16.980 462 HB VAL 54 HB VAL 54 -0.964 -0.337 -18.495 463 HG11 VAL 54 HG11 VAL 54 -2.370 -2.439 -20.135 464 HG12 VAL 54 HG12 VAL 54 -0.929 -1.521 -20.576 465 HG13 VAL 54 HG13 VAL 54 -0.856 -2.705 -19.271 466 HG21 VAL 54 HG21 VAL 54 -2.719 0.122 -20.433 467 HG22 VAL 54 HG22 VAL 54 -3.861 -0.244 -19.140 468 HG23 VAL 54 HG23 VAL 54 -2.701 1.070 -18.945 469 H GLU 55 H GLU 55 -1.033 0.032 -16.035 470 HA GLU 55 HA GLU 55 -3.260 1.123 -14.528 471 HB2 GLU 55 HB2 GLU 55 -1.396 2.396 -13.352 472 HB3 GLU 55 HB3 GLU 55 -1.375 0.646 -13.192 473 HG2 GLU 55 HG2 GLU 55 0.601 0.463 -14.200 474 HG3 GLU 55 HG3 GLU 55 0.160 1.600 -15.473 475 H SER 56 H SER 56 -4.416 2.633 -15.553 476 HA SER 56 HA SER 56 -3.100 5.076 -16.371 477 HB2 SER 56 HB2 SER 56 -3.109 3.538 -18.398 478 HB3 SER 56 HB3 SER 56 -4.867 3.675 -18.381 479 HG SER 56 HG SER 56 -3.127 5.344 -19.452 480 H ASP 57 H ASP 57 -4.822 6.688 -17.181 481 HA ASP 57 HA ASP 57 -7.227 6.359 -15.510 482 HB2 ASP 57 HB2 ASP 57 -5.282 8.413 -15.536 483 HB3 ASP 57 HB3 ASP 57 -6.753 9.101 -16.217 484 H ASP 58 H ASP 58 -6.411 5.976 -18.547 485 HA ASP 58 HA ASP 58 -7.883 7.660 -20.156 486 HB2 ASP 58 HB2 ASP 58 -6.365 5.830 -20.938 487 HB3 ASP 58 HB3 ASP 58 -7.632 4.671 -20.545 488 H ALA 59 H ALA 59 -9.970 7.416 -21.166 489 HA ALA 59 HA ALA 59 -12.029 6.862 -19.269 490 HB1 ALA 59 HB1 ALA 59 -11.796 8.339 -21.646 491 HB2 ALA 59 HB2 ALA 59 -13.057 7.138 -21.930 492 HB3 ALA 59 HB3 ALA 59 -13.186 8.245 -20.563 493 H ALA 60 H ALA 60 -14.035 5.593 -20.133 494 HA ALA 60 HA ALA 60 -13.467 3.278 -21.733 495 HB1 ALA 60 HB1 ALA 60 -12.429 2.709 -19.532 496 HB2 ALA 60 HB2 ALA 60 -14.039 2.796 -18.815 497 HB3 ALA 60 HB3 ALA 60 -13.691 1.594 -20.057 498 H GLU 61 H GLU 61 -15.369 1.820 -21.880 499 HA GLU 61 HA GLU 61 -17.715 3.252 -22.375 500 HB2 GLU 61 HB2 GLU 61 -17.154 0.313 -22.064 501 HB3 GLU 61 HB3 GLU 61 -18.776 0.905 -22.391 502 HG2 GLU 61 HG2 GLU 61 -16.958 2.118 -24.222 503 HG3 GLU 61 HG3 GLU 61 -16.711 0.373 -24.225 504 H ALA 62 H ALA 62 -16.495 1.900 -19.460 505 HA ALA 62 HA ALA 62 -18.648 3.033 -17.941 506 HB1 ALA 62 HB1 ALA 62 -19.052 0.729 -16.794 507 HB2 ALA 62 HB2 ALA 62 -19.896 1.127 -18.291 508 HB3 ALA 62 HB3 ALA 62 -18.480 0.077 -18.329 509 H THR 63 H THR 63 -18.294 2.817 -15.601 510 HA THR 63 HA THR 63 -15.474 2.258 -14.948 511 HB THR 63 HB THR 63 -17.147 4.479 -13.760 512 HG1 THR 63 HG1 THR 63 -15.392 4.375 -15.935 513 HG21 THR 63 HG21 THR 63 -15.511 4.795 -12.265 514 HG22 THR 63 HG22 THR 63 -14.254 4.627 -13.490 515 HG23 THR 63 HG23 THR 63 -14.932 3.193 -12.718 516 H LEU 64 H LEU 64 -15.126 0.963 -13.249 517 HA LEU 64 HA LEU 64 -17.418 0.338 -11.505 518 HB2 LEU 64 HB2 LEU 64 -15.799 -1.365 -13.106 519 HB3 LEU 64 HB3 LEU 64 -15.486 -1.739 -11.413 520 HG LEU 64 HG LEU 64 -18.240 -1.692 -12.638 521 HD11 LEU 64 HD11 LEU 64 -16.160 -3.797 -12.564 522 HD12 LEU 64 HD12 LEU 64 -17.440 -3.505 -13.741 523 HD13 LEU 64 HD13 LEU 64 -17.817 -4.282 -12.203 524 HD21 LEU 64 HD21 LEU 64 -18.858 -2.925 -10.627 525 HD22 LEU 64 HD22 LEU 64 -18.167 -1.354 -10.220 526 HD23 LEU 64 HD23 LEU 64 -17.198 -2.817 -10.040 527 H THR 65 H THR 65 -17.104 1.336 -9.623 528 HA THR 65 HA THR 65 -14.394 1.330 -8.466 529 HB THR 65 HB THR 65 -16.675 3.194 -7.785 530 HG1 THR 65 HG1 THR 65 -15.967 3.760 -9.809 531 HG21 THR 65 HG21 THR 65 -14.372 4.410 -6.993 532 HG22 THR 65 HG22 THR 65 -14.001 2.717 -6.664 533 HG23 THR 65 HG23 THR 65 -15.420 3.467 -5.934 534 H MET 66 H MET 66 -14.050 0.201 -6.664 535 HA MET 66 HA MET 66 -16.089 -0.187 -4.681 536 HB2 MET 66 HB2 MET 66 -15.855 -2.733 -4.812 537 HB3 MET 66 HB3 MET 66 -16.870 -1.954 -6.019 538 HG2 MET 66 HG2 MET 66 -15.156 -2.142 -7.676 539 HG3 MET 66 HG3 MET 66 -14.001 -2.726 -6.480 540 HE1 MET 66 HE1 MET 66 -16.417 -4.541 -9.322 541 HE2 MET 66 HE2 MET 66 -14.955 -3.558 -9.244 542 HE3 MET 66 HE3 MET 66 -14.839 -5.318 -9.192 543 H GLU 67 H GLU 67 -15.277 -1.332 -2.779 544 HA GLU 67 HA GLU 67 -12.682 -0.513 -2.080 545 HB2 GLU 67 HB2 GLU 67 -14.915 -1.773 -0.793 546 HB3 GLU 67 HB3 GLU 67 -13.440 -2.622 -0.352 547 HG2 GLU 67 HG2 GLU 67 -12.581 -0.139 0.019 548 HG3 GLU 67 HG3 GLU 67 -14.303 0.139 0.272 549 H ASP 68 H ASP 68 -10.962 -1.992 -1.242 550 HA ASP 68 HA ASP 68 -10.123 -3.750 -3.309 551 HB2 ASP 68 HB2 ASP 68 -8.664 -2.366 -1.712 552 HB3 ASP 68 HB3 ASP 68 -8.930 -3.658 -0.544 553 H ASP 69 H ASP 69 -11.210 -4.298 0.030 554 HA ASP 69 HA ASP 69 -10.950 -7.085 0.042 555 HB2 ASP 69 HB2 ASP 69 -12.171 -5.056 1.719 556 HB3 ASP 69 HB3 ASP 69 -13.148 -6.521 1.669 557 H ILE 70 H ILE 70 -13.512 -5.002 -1.141 558 HA ILE 70 HA ILE 70 -15.404 -7.107 -1.553 559 HB ILE 70 HB ILE 70 -15.259 -4.250 -2.471 560 HG12 ILE 70 HG12 ILE 70 -17.567 -4.414 -1.193 561 HG13 ILE 70 HG13 ILE 70 -16.823 -5.840 -0.479 562 HG21 ILE 70 HG21 ILE 70 -17.613 -4.677 -3.361 563 HG22 ILE 70 HG22 ILE 70 -16.261 -5.245 -4.340 564 HG23 ILE 70 HG23 ILE 70 -17.175 -6.385 -3.353 565 HD11 ILE 70 HD11 ILE 70 -14.846 -4.015 -0.180 566 HD12 ILE 70 HD12 ILE 70 -16.282 -3.003 -0.025 567 HD13 ILE 70 HD13 ILE 70 -16.062 -4.391 1.040 568 H MET 71 H MET 71 -13.341 -5.202 -3.748 569 HA MET 71 HA MET 71 -14.019 -6.407 -6.138 570 HB2 MET 71 HB2 MET 71 -12.632 -4.496 -6.230 571 HB3 MET 71 HB3 MET 71 -11.429 -5.217 -5.169 572 HG2 MET 71 HG2 MET 71 -10.340 -5.521 -7.112 573 HG3 MET 71 HG3 MET 71 -11.331 -6.977 -7.171 574 HE1 MET 71 HE1 MET 71 -11.382 -3.137 -9.310 575 HE2 MET 71 HE2 MET 71 -12.989 -3.151 -8.584 576 HE3 MET 71 HE3 MET 71 -11.560 -3.332 -7.566 577 H PHE 72 H PHE 72 -11.802 -7.518 -3.642 578 HA PHE 72 HA PHE 72 -10.630 -9.629 -5.095 579 HB2 PHE 72 HB2 PHE 72 -10.035 -8.553 -2.754 580 HB3 PHE 72 HB3 PHE 72 -11.044 -9.861 -2.145 581 HD1 PHE 72 HD1 PHE 72 -8.540 -9.664 -4.903 582 HD2 PHE 72 HD2 PHE 72 -9.718 -11.506 -1.251 583 HE1 PHE 72 HE1 PHE 72 -6.631 -11.207 -5.070 584 HE2 PHE 72 HE2 PHE 72 -7.810 -13.051 -1.412 585 HZ PHE 72 HZ PHE 72 -6.263 -12.903 -3.322 586 H ALA 73 H ALA 73 -13.471 -9.492 -2.987 587 HA ALA 73 HA ALA 73 -14.090 -12.201 -2.894 588 HB1 ALA 73 HB1 ALA 73 -16.499 -10.656 -3.062 589 HB2 ALA 73 HB2 ALA 73 -15.774 -11.448 -1.662 590 HB3 ALA 73 HB3 ALA 73 -15.303 -9.803 -2.086 591 H ILE 74 H ILE 74 -15.130 -9.748 -5.249 592 HA ILE 74 HA ILE 74 -16.660 -11.560 -6.819 593 HB ILE 74 HB ILE 74 -15.477 -8.903 -7.635 594 HG12 ILE 74 HG12 ILE 74 -18.342 -9.038 -7.051 595 HG13 ILE 74 HG13 ILE 74 -17.335 -9.377 -5.648 596 HG21 ILE 74 HG21 ILE 74 -17.299 -10.831 -8.947 597 HG22 ILE 74 HG22 ILE 74 -17.695 -9.120 -9.103 598 HG23 ILE 74 HG23 ILE 74 -16.128 -9.716 -9.650 599 HD11 ILE 74 HD11 ILE 74 -16.540 -7.262 -5.539 600 HD12 ILE 74 HD12 ILE 74 -16.626 -7.018 -7.284 601 HD13 ILE 74 HD13 ILE 74 -18.092 -6.927 -6.307 602 H GLY 75 H GLY 75 -13.308 -10.914 -6.570 603 HA2 GLY 75 HA2 GLY 75 -12.685 -11.870 -9.245 604 HA3 GLY 75 HA3 GLY 75 -11.530 -11.350 -8.027 605 H THR 76 H THR 76 -12.556 -13.044 -5.930 606 HA THR 76 HA THR 76 -11.337 -15.548 -6.810 607 HB THR 76 HB THR 76 -11.099 -16.109 -4.476 608 HG1 THR 76 HG1 THR 76 -12.845 -13.914 -4.121 609 HG21 THR 76 HG21 THR 76 -9.955 -13.819 -5.673 610 HG22 THR 76 HG22 THR 76 -9.289 -14.815 -4.379 611 HG23 THR 76 HG23 THR 76 -10.283 -13.411 -3.989 612 H GLY 77 H GLY 77 -14.115 -14.759 -7.518 613 HA2 GLY 77 HA2 GLY 77 -16.214 -15.691 -7.615 614 HA3 GLY 77 HA3 GLY 77 -15.371 -17.215 -7.380 615 H ALA 78 H ALA 78 -15.165 -14.781 -4.928 616 HA ALA 78 HA ALA 78 -16.440 -16.541 -3.032 617 HB1 ALA 78 HB1 ALA 78 -14.445 -15.323 -2.380 618 HB2 ALA 78 HB2 ALA 78 -15.263 -13.788 -2.673 619 HB3 ALA 78 HB3 ALA 78 -15.811 -14.845 -1.372 620 H LEU 79 H LEU 79 -16.907 -13.036 -3.373 621 HA LEU 79 HA LEU 79 -19.774 -13.452 -2.908 622 HB2 LEU 79 HB2 LEU 79 -17.917 -11.661 -1.828 623 HB3 LEU 79 HB3 LEU 79 -18.939 -10.693 -2.889 624 HG LEU 79 HG LEU 79 -19.592 -10.859 -0.424 625 HD11 LEU 79 HD11 LEU 79 -21.441 -9.993 -1.283 626 HD12 LEU 79 HD12 LEU 79 -22.051 -11.625 -1.555 627 HD13 LEU 79 HD13 LEU 79 -21.145 -10.800 -2.823 628 HD21 LEU 79 HD21 LEU 79 -19.305 -13.502 -0.724 629 HD22 LEU 79 HD22 LEU 79 -21.026 -13.359 -1.083 630 HD23 LEU 79 HD23 LEU 79 -20.396 -12.781 0.460 631 HA PRO 80 HA PRO 80 -20.653 -12.421 -7.110 632 HB2 PRO 80 HB2 PRO 80 -23.296 -11.875 -6.815 633 HB3 PRO 80 HB3 PRO 80 -22.646 -13.519 -6.793 634 HG2 PRO 80 HG2 PRO 80 -23.406 -11.752 -4.499 635 HG3 PRO 80 HG3 PRO 80 -23.722 -13.482 -4.732 636 HD2 PRO 80 HD2 PRO 80 -21.720 -12.567 -3.156 637 HD3 PRO 80 HD3 PRO 80 -21.602 -14.088 -4.062 638 H ALA 81 H ALA 81 -20.466 -10.600 -8.268 639 HA ALA 81 HA ALA 81 -20.081 -8.096 -7.135 640 HB1 ALA 81 HB1 ALA 81 -21.023 -7.781 -9.816 641 HB2 ALA 81 HB2 ALA 81 -19.380 -7.643 -9.190 642 HB3 ALA 81 HB3 ALA 81 -19.993 -9.210 -9.719 643 H LYS 82 H LYS 82 -23.018 -9.683 -8.072 644 HA LYS 82 HA LYS 82 -24.687 -7.418 -8.309 645 HB2 LYS 82 HB2 LYS 82 -25.117 -9.897 -8.966 646 HB3 LYS 82 HB3 LYS 82 -25.670 -10.072 -7.306 647 HG2 LYS 82 HG2 LYS 82 -27.569 -8.917 -7.673 648 HG3 LYS 82 HG3 LYS 82 -26.802 -7.803 -8.807 649 HD2 LYS 82 HD2 LYS 82 -28.375 -9.116 -10.033 650 HD3 LYS 82 HD3 LYS 82 -26.759 -9.669 -10.477 651 HE2 LYS 82 HE2 LYS 82 -27.612 -11.711 -10.073 652 HE3 LYS 82 HE3 LYS 82 -27.297 -11.302 -8.387 653 HZ1 LYS 82 HZ1 LYS 82 -29.685 -10.256 -8.613 654 HZ2 LYS 82 HZ2 LYS 82 -29.469 -11.892 -8.243 655 HZ3 LYS 82 HZ3 LYS 82 -29.838 -11.425 -9.827 656 H GLU 83 H GLU 83 -24.308 -9.704 -5.594 657 HA GLU 83 HA GLU 83 -25.915 -8.376 -3.763 658 HB2 GLU 83 HB2 GLU 83 -23.501 -10.138 -3.394 659 HB3 GLU 83 HB3 GLU 83 -24.400 -9.496 -2.027 660 HG2 GLU 83 HG2 GLU 83 -25.513 -11.253 -4.202 661 HG3 GLU 83 HG3 GLU 83 -25.095 -11.761 -2.567 662 H ALA 84 H ALA 84 -22.379 -8.127 -4.137 663 HA ALA 84 HA ALA 84 -21.844 -6.245 -2.203 664 HB1 ALA 84 HB1 ALA 84 -20.569 -6.711 -4.884 665 HB2 ALA 84 HB2 ALA 84 -19.943 -5.534 -3.728 666 HB3 ALA 84 HB3 ALA 84 -20.014 -7.242 -3.296 667 H MET 85 H MET 85 -22.990 -5.712 -5.509 668 HA MET 85 HA MET 85 -22.903 -2.861 -5.321 669 HB2 MET 85 HB2 MET 85 -23.293 -4.755 -7.360 670 HB3 MET 85 HB3 MET 85 -24.776 -3.812 -7.299 671 HG2 MET 85 HG2 MET 85 -22.228 -2.315 -7.246 672 HG3 MET 85 HG3 MET 85 -22.669 -3.107 -8.757 673 HE1 MET 85 HE1 MET 85 -26.179 -2.481 -8.794 674 HE2 MET 85 HE2 MET 85 -25.609 -1.452 -10.108 675 HE3 MET 85 HE3 MET 85 -24.821 -2.999 -9.794 676 H ALA 86 H ALA 86 -25.273 -5.330 -4.635 677 HA ALA 86 HA ALA 86 -27.517 -3.569 -4.473 678 HB1 ALA 86 HB1 ALA 86 -28.062 -5.820 -2.905 679 HB2 ALA 86 HB2 ALA 86 -28.530 -5.542 -4.584 680 HB3 ALA 86 HB3 ALA 86 -27.028 -6.391 -4.216 681 H GLN 87 H GLN 87 -24.971 -4.486 -2.320 682 HA GLN 87 HA GLN 87 -26.380 -3.483 0.024 683 HB2 GLN 87 HB2 GLN 87 -23.598 -4.631 -0.262 684 HB3 GLN 87 HB3 GLN 87 -24.362 -4.187 1.259 685 HG2 GLN 87 HG2 GLN 87 -26.207 -5.842 0.561 686 HG3 GLN 87 HG3 GLN 87 -25.010 -6.450 -0.582 687 HE21 GLN 87 HE21 GLN 87 -25.958 -8.137 1.278 688 HE22 GLN 87 HE22 GLN 87 -24.759 -8.464 2.478 689 H ASP 88 H ASP 88 -25.250 -1.894 -2.390 690 HA ASP 88 HA ASP 88 -24.364 0.171 -2.749 691 HB2 ASP 88 HB2 ASP 88 -25.404 0.263 0.006 692 HB3 ASP 88 HB3 ASP 88 -24.191 1.486 -0.363 693 H LYS 89 H LYS 89 -22.670 -2.158 -1.821 694 HA LYS 89 HA LYS 89 -20.413 -0.800 -0.574 695 HB2 LYS 89 HB2 LYS 89 -20.982 -3.675 -1.268 696 HB3 LYS 89 HB3 LYS 89 -19.388 -3.144 -0.749 697 HG2 LYS 89 HG2 LYS 89 -20.434 -2.262 1.332 698 HG3 LYS 89 HG3 LYS 89 -21.953 -2.998 0.817 699 HD2 LYS 89 HD2 LYS 89 -21.143 -5.157 1.079 700 HD3 LYS 89 HD3 LYS 89 -19.458 -4.644 0.970 701 HE2 LYS 89 HE2 LYS 89 -19.770 -3.463 3.156 702 HE3 LYS 89 HE3 LYS 89 -21.360 -4.217 3.269 703 HZ1 LYS 89 HZ1 LYS 89 -20.368 -6.362 3.327 704 HZ2 LYS 89 HZ2 LYS 89 -19.569 -5.411 4.474 705 HZ3 LYS 89 HZ3 LYS 89 -18.831 -5.743 2.989 706 H MET 90 H MET 90 -21.555 -0.930 -3.594 707 HA MET 90 HA MET 90 -19.048 -0.231 -4.768 708 HB2 MET 90 HB2 MET 90 -18.529 -2.451 -5.113 709 HB3 MET 90 HB3 MET 90 -20.214 -2.933 -5.259 710 HG2 MET 90 HG2 MET 90 -20.303 -1.849 -7.468 711 HG3 MET 90 HG3 MET 90 -18.590 -1.461 -7.320 712 HE1 MET 90 HE1 MET 90 -20.082 -4.819 -5.912 713 HE2 MET 90 HE2 MET 90 -21.183 -4.396 -7.223 714 HE3 MET 90 HE3 MET 90 -20.136 -5.808 -7.371 715 H GLU 91 H GLU 91 -19.283 0.830 -6.735 716 HA GLU 91 HA GLU 91 -22.041 1.106 -7.729 717 HB2 GLU 91 HB2 GLU 91 -20.021 3.263 -7.153 718 HB3 GLU 91 HB3 GLU 91 -21.365 3.523 -8.255 719 HG2 GLU 91 HG2 GLU 91 -22.784 3.853 -6.586 720 HG3 GLU 91 HG3 GLU 91 -22.259 2.388 -5.757 721 H VAL 92 H VAL 92 -22.161 1.940 -9.966 722 HA VAL 92 HA VAL 92 -19.765 1.476 -11.577 723 HB VAL 92 HB VAL 92 -22.385 0.167 -12.295 724 HG11 VAL 92 HG11 VAL 92 -19.828 0.546 -13.618 725 HG12 VAL 92 HG12 VAL 92 -20.304 -1.151 -13.540 726 HG13 VAL 92 HG13 VAL 92 -21.379 0.034 -14.281 727 HG21 VAL 92 HG21 VAL 92 -21.823 -1.100 -10.459 728 HG22 VAL 92 HG22 VAL 92 -20.953 -1.953 -11.734 729 HG23 VAL 92 HG23 VAL 92 -20.092 -0.839 -10.672 730 H ASP 93 H ASP 93 -19.683 2.646 -13.458 731 HA ASP 93 HA ASP 93 -21.981 4.411 -14.001 732 HB2 ASP 93 HB2 ASP 93 -19.447 5.189 -13.154 733 HB3 ASP 93 HB3 ASP 93 -19.425 5.478 -14.891 734 H GLY 94 H GLY 94 -21.871 5.354 -16.275 735 HA2 GLY 94 HA2 GLY 94 -21.337 5.107 -18.567 736 HA3 GLY 94 HA3 GLY 94 -20.633 3.537 -18.208 737 H GLN 95 H GLN 95 -21.752 1.844 -18.889 738 HA GLN 95 HA GLN 95 -24.653 2.165 -19.287 739 HB2 GLN 95 HB2 GLN 95 -22.585 1.270 -21.068 740 HB3 GLN 95 HB3 GLN 95 -23.730 -0.037 -20.797 741 HG2 GLN 95 HG2 GLN 95 -24.178 1.509 -22.753 742 HG3 GLN 95 HG3 GLN 95 -25.520 1.194 -21.653 743 HE21 GLN 95 HE21 GLN 95 -26.465 2.855 -20.628 744 HE22 GLN 95 HE22 GLN 95 -25.960 4.503 -20.752 745 H VAL 96 H VAL 96 -25.719 1.170 -17.709 746 HA VAL 96 HA VAL 96 -24.689 -0.830 -16.040 747 HB VAL 96 HB VAL 96 -27.588 -0.219 -16.635 748 HG11 VAL 96 HG11 VAL 96 -26.280 -2.136 -14.862 749 HG12 VAL 96 HG12 VAL 96 -27.440 -1.089 -14.042 750 HG13 VAL 96 HG13 VAL 96 -27.951 -2.064 -15.421 751 HG21 VAL 96 HG21 VAL 96 -27.276 0.975 -14.340 752 HG22 VAL 96 HG22 VAL 96 -25.571 0.996 -14.793 753 HG23 VAL 96 HG23 VAL 96 -26.767 1.782 -15.823 754 H GLU 97 H GLU 97 -25.959 -1.011 -19.209 755 HA GLU 97 HA GLU 97 -26.988 -3.638 -19.191 756 HB2 GLU 97 HB2 GLU 97 -26.630 -3.535 -21.667 757 HB3 GLU 97 HB3 GLU 97 -27.548 -2.188 -21.010 758 HG2 GLU 97 HG2 GLU 97 -25.623 -0.751 -21.129 759 HG3 GLU 97 HG3 GLU 97 -24.608 -2.098 -21.641 760 H LEU 98 H LEU 98 -23.753 -2.345 -19.678 761 HA LEU 98 HA LEU 98 -22.588 -4.814 -20.503 762 HB2 LEU 98 HB2 LEU 98 -21.096 -2.543 -19.232 763 HB3 LEU 98 HB3 LEU 98 -20.519 -3.707 -20.423 764 HG LEU 98 HG LEU 98 -22.630 -1.665 -21.069 765 HD11 LEU 98 HD11 LEU 98 -19.697 -1.344 -21.633 766 HD12 LEU 98 HD12 LEU 98 -20.476 -0.637 -20.218 767 HD13 LEU 98 HD13 LEU 98 -20.990 -0.162 -21.836 768 HD21 LEU 98 HD21 LEU 98 -21.796 -3.867 -22.436 769 HD22 LEU 98 HD22 LEU 98 -20.747 -2.616 -23.102 770 HD23 LEU 98 HD23 LEU 98 -22.500 -2.427 -23.173 771 H ILE 99 H ILE 99 -23.254 -3.315 -17.440 772 HA ILE 99 HA ILE 99 -21.464 -4.612 -15.767 773 HB ILE 99 HB ILE 99 -24.338 -3.896 -15.177 774 HG12 ILE 99 HG12 ILE 99 -21.759 -2.371 -14.754 775 HG13 ILE 99 HG13 ILE 99 -23.028 -1.970 -15.906 776 HG21 ILE 99 HG21 ILE 99 -24.062 -4.774 -13.160 777 HG22 ILE 99 HG22 ILE 99 -22.462 -5.344 -13.632 778 HG23 ILE 99 HG23 ILE 99 -22.649 -3.754 -12.894 779 HD11 ILE 99 HD11 ILE 99 -23.011 -1.691 -12.937 780 HD12 ILE 99 HD12 ILE 99 -23.437 -0.510 -14.177 781 HD13 ILE 99 HD13 ILE 99 -24.538 -1.837 -13.808 782 H PHE 100 H PHE 100 -24.736 -5.668 -16.703 783 HA PHE 100 HA PHE 100 -24.546 -8.166 -15.359 784 HB2 PHE 100 HB2 PHE 100 -26.479 -6.812 -17.121 785 HB3 PHE 100 HB3 PHE 100 -26.485 -8.568 -17.238 786 HD1 PHE 100 HD1 PHE 100 -26.717 -5.776 -14.807 787 HD2 PHE 100 HD2 PHE 100 -27.588 -9.857 -15.646 788 HE1 PHE 100 HE1 PHE 100 -28.082 -5.901 -12.764 789 HE2 PHE 100 HE2 PHE 100 -28.955 -9.988 -13.605 790 HZ PHE 100 HZ PHE 100 -29.205 -8.008 -12.161 791 H LEU 101 H LEU 101 -23.666 -7.038 -18.528 792 HA LEU 101 HA LEU 101 -23.514 -9.516 -19.855 793 HB2 LEU 101 HB2 LEU 101 -22.710 -6.778 -20.337 794 HB3 LEU 101 HB3 LEU 101 -21.515 -7.921 -20.945 795 HG LEU 101 HG LEU 101 -23.078 -7.281 -22.692 796 HD11 LEU 101 HD11 LEU 101 -23.181 -9.348 -23.581 797 HD12 LEU 101 HD12 LEU 101 -23.980 -10.036 -22.168 798 HD13 LEU 101 HD13 LEU 101 -22.236 -9.778 -22.156 799 HD21 LEU 101 HD21 LEU 101 -25.458 -8.515 -22.126 800 HD22 LEU 101 HD22 LEU 101 -25.153 -6.780 -22.030 801 HD23 LEU 101 HD23 LEU 101 -25.030 -7.779 -20.581 802 H LEU 102 H LEU 102 -21.471 -8.013 -17.517 803 HA LEU 102 HA LEU 102 -19.195 -9.714 -18.120 804 HB2 LEU 102 HB2 LEU 102 -19.717 -7.580 -16.072 805 HB3 LEU 102 HB3 LEU 102 -18.273 -8.589 -16.022 806 HG LEU 102 HG LEU 102 -18.811 -7.201 -18.577 807 HD11 LEU 102 HD11 LEU 102 -18.105 -5.756 -16.037 808 HD12 LEU 102 HD12 LEU 102 -19.391 -5.387 -17.185 809 HD13 LEU 102 HD13 LEU 102 -17.706 -5.132 -17.638 810 HD21 LEU 102 HD21 LEU 102 -16.747 -8.637 -17.534 811 HD22 LEU 102 HD22 LEU 102 -16.219 -6.983 -17.225 812 HD23 LEU 102 HD23 LEU 102 -16.607 -7.493 -18.869 813 H GLU 103 H GLU 103 -21.817 -9.499 -15.814 814 HA GLU 103 HA GLU 103 -21.134 -10.981 -13.698 815 HB2 GLU 103 HB2 GLU 103 -23.559 -10.406 -15.021 816 HB3 GLU 103 HB3 GLU 103 -23.568 -12.136 -14.707 817 HG2 GLU 103 HG2 GLU 103 -23.046 -10.031 -12.622 818 HG3 GLU 103 HG3 GLU 103 -24.613 -10.782 -12.919 819 HA PRO 104 HA PRO 104 -21.599 -15.195 -16.018 820 HB2 PRO 104 HB2 PRO 104 -21.814 -15.107 -18.723 821 HB3 PRO 104 HB3 PRO 104 -23.215 -15.055 -17.645 822 HG2 PRO 104 HG2 PRO 104 -21.807 -12.807 -19.033 823 HG3 PRO 104 HG3 PRO 104 -23.547 -13.087 -18.839 824 HD2 PRO 104 HD2 PRO 104 -22.171 -11.342 -17.292 825 HD3 PRO 104 HD3 PRO 104 -23.568 -12.256 -16.689 826 H PHE 105 H PHE 105 -19.878 -12.605 -17.677 827 HA PHE 105 HA PHE 105 -17.873 -14.116 -18.902 828 HB2 PHE 105 HB2 PHE 105 -18.251 -11.742 -19.396 829 HB3 PHE 105 HB3 PHE 105 -17.695 -11.311 -17.782 830 HD1 PHE 105 HD1 PHE 105 -16.522 -13.217 -20.767 831 HD2 PHE 105 HD2 PHE 105 -15.523 -10.615 -17.550 832 HE1 PHE 105 HE1 PHE 105 -14.214 -13.069 -21.608 833 HE2 PHE 105 HE2 PHE 105 -13.215 -10.462 -18.386 834 HZ PHE 105 HZ PHE 105 -12.558 -11.689 -20.418 835 H ILE 106 H ILE 106 -18.378 -13.316 -15.592 836 HA ILE 106 HA ILE 106 -15.818 -13.392 -14.536 837 HB ILE 106 HB ILE 106 -18.369 -14.460 -13.324 838 HG12 ILE 106 HG12 ILE 106 -16.954 -11.824 -12.879 839 HG13 ILE 106 HG13 ILE 106 -18.329 -12.037 -13.958 840 HG21 ILE 106 HG21 ILE 106 -15.613 -14.423 -12.349 841 HG22 ILE 106 HG22 ILE 106 -16.777 -13.700 -11.241 842 HG23 ILE 106 HG23 ILE 106 -17.002 -15.358 -11.795 843 HD11 ILE 106 HD11 ILE 106 -18.325 -11.515 -11.181 844 HD12 ILE 106 HD12 ILE 106 -19.703 -11.717 -12.263 845 HD13 ILE 106 HD13 ILE 106 -19.022 -13.115 -11.431 846 H ALA 107 H ALA 107 -17.766 -15.971 -15.800 847 HA ALA 107 HA ALA 107 -16.643 -18.196 -14.584 848 HB1 ALA 107 HB1 ALA 107 -17.151 -19.285 -16.900 849 HB2 ALA 107 HB2 ALA 107 -18.472 -18.694 -15.891 850 HB3 ALA 107 HB3 ALA 107 -17.900 -17.727 -17.250 851 H SER 108 H SER 108 -15.307 -16.061 -16.967 852 HA SER 108 HA SER 108 -13.355 -17.693 -18.111 853 HB2 SER 108 HB2 SER 108 -13.460 -14.724 -17.597 854 HB3 SER 108 HB3 SER 108 -12.092 -15.479 -18.413 855 HG SER 108 HG SER 108 -14.670 -16.066 -19.322 856 H LEU 109 H LEU 109 -12.712 -15.227 -15.617 857 HA LEU 109 HA LEU 109 -11.413 -16.914 -13.806 858 HB2 LEU 109 HB2 LEU 109 -9.884 -16.662 -16.035 859 HB3 LEU 109 HB3 LEU 109 -9.275 -15.329 -15.055 860 HG LEU 109 HG LEU 109 -9.368 -17.578 -13.365 861 HD11 LEU 109 HD11 LEU 109 -9.442 -18.703 -15.742 862 HD12 LEU 109 HD12 LEU 109 -8.417 -19.345 -14.458 863 HD13 LEU 109 HD13 LEU 109 -7.717 -18.332 -15.722 864 HD21 LEU 109 HD21 LEU 109 -7.306 -15.841 -14.616 865 HD22 LEU 109 HD22 LEU 109 -6.776 -17.320 -13.815 866 HD23 LEU 109 HD23 LEU 109 -7.684 -16.105 -12.914 867 H LYS 110 H LYS 110 -13.174 -14.640 -13.881 868 HA LYS 110 HA LYS 110 -11.573 -12.651 -12.409 869 HB2 LYS 110 HB2 LYS 110 -12.697 -11.815 -14.465 870 HB3 LYS 110 HB3 LYS 110 -14.249 -12.253 -13.762 871 HG2 LYS 110 HG2 LYS 110 -14.255 -10.496 -12.332 872 HG3 LYS 110 HG3 LYS 110 -12.498 -10.484 -12.161 873 HD2 LYS 110 HD2 LYS 110 -12.424 -8.777 -13.584 874 HD3 LYS 110 HD3 LYS 110 -13.026 -9.853 -14.847 875 HE2 LYS 110 HE2 LYS 110 -14.903 -8.525 -12.925 876 HE3 LYS 110 HE3 LYS 110 -14.312 -7.670 -14.349 877 HZ1 LYS 110 HZ1 LYS 110 -15.697 -8.794 -15.648 878 HZ2 LYS 110 HZ2 LYS 110 -16.456 -9.364 -14.248 879 HZ3 LYS 110 HZ3 LYS 110 -15.249 -10.287 -14.991 Start of MODEL 16 1 H1 MET 1 H MET 1 2.501 1.599 -0.963 2 HA MET 1 HA MET 1 1.111 -0.159 0.926 3 HB2 MET 1 HB2 MET 1 -0.104 1.769 -1.056 4 HB3 MET 1 HB3 MET 1 -0.915 0.973 0.285 5 HG2 MET 1 HG2 MET 1 -0.532 2.836 1.427 6 HG3 MET 1 HG3 MET 1 1.142 2.293 1.524 7 HE1 MET 1 HE1 MET 1 0.961 5.357 1.905 8 HE2 MET 1 HE2 MET 1 0.417 6.298 0.517 9 HE3 MET 1 HE3 MET 1 -0.691 5.179 1.313 10 H SER 2 H SER 2 0.092 -1.987 0.314 11 HA SER 2 HA SER 2 0.050 -2.624 -2.563 12 HB2 SER 2 HB2 SER 2 0.388 -4.741 -0.454 13 HB3 SER 2 HB3 SER 2 0.793 -4.812 -2.169 14 HG SER 2 HG SER 2 2.528 -3.451 -1.788 15 H LEU 3 H LEU 3 -1.818 -3.380 -3.375 16 HA LEU 3 HA LEU 3 -4.061 -3.691 -1.509 17 HB2 LEU 3 HB2 LEU 3 -3.936 -3.078 -4.451 18 HB3 LEU 3 HB3 LEU 3 -5.439 -3.475 -3.620 19 HG LEU 3 HG LEU 3 -4.012 -1.323 -2.299 20 HD11 LEU 3 HD11 LEU 3 -3.224 -0.319 -4.148 21 HD12 LEU 3 HD12 LEU 3 -4.902 0.177 -4.361 22 HD13 LEU 3 HD13 LEU 3 -4.282 -1.230 -5.225 23 HD21 LEU 3 HD21 LEU 3 -6.236 -1.579 -1.714 24 HD22 LEU 3 HD22 LEU 3 -6.750 -1.860 -3.377 25 HD23 LEU 3 HD23 LEU 3 -6.299 -0.236 -2.855 26 H LYS 4 H LYS 4 -5.055 -5.589 -1.234 27 HA LYS 4 HA LYS 4 -3.955 -7.994 -2.100 28 HB2 LYS 4 HB2 LYS 4 -6.205 -8.970 -1.401 29 HB3 LYS 4 HB3 LYS 4 -5.318 -8.071 -0.177 30 HG2 LYS 4 HG2 LYS 4 -7.070 -6.324 -1.647 31 HG3 LYS 4 HG3 LYS 4 -7.960 -7.693 -0.976 32 HD2 LYS 4 HD2 LYS 4 -6.414 -7.036 1.137 33 HD3 LYS 4 HD3 LYS 4 -6.610 -5.451 0.385 34 HE2 LYS 4 HE2 LYS 4 -9.124 -6.105 0.288 35 HE3 LYS 4 HE3 LYS 4 -8.685 -7.283 1.523 36 HZ1 LYS 4 HZ1 LYS 4 -9.428 -4.801 2.080 37 HZ2 LYS 4 HZ2 LYS 4 -7.759 -4.561 1.957 38 HZ3 LYS 4 HZ3 LYS 4 -8.372 -5.686 3.062 39 H SER 5 H SER 5 -6.443 -5.986 -3.533 40 HA SER 5 HA SER 5 -7.497 -7.817 -5.370 41 HB2 SER 5 HB2 SER 5 -7.224 -4.808 -5.520 42 HB3 SER 5 HB3 SER 5 -8.137 -5.765 -6.687 43 HG SER 5 HG SER 5 -8.641 -5.970 -3.920 44 H ASP 6 H ASP 6 -4.432 -6.341 -5.235 45 HA ASP 6 HA ASP 6 -3.701 -6.056 -7.889 46 HB2 ASP 6 HB2 ASP 6 -2.113 -6.876 -5.461 47 HB3 ASP 6 HB3 ASP 6 -1.360 -6.665 -7.039 48 H GLU 7 H GLU 7 -3.809 -8.971 -5.903 49 HA GLU 7 HA GLU 7 -2.548 -10.701 -7.734 50 HB2 GLU 7 HB2 GLU 7 -4.694 -11.574 -5.815 51 HB3 GLU 7 HB3 GLU 7 -3.289 -12.475 -6.369 52 HG2 GLU 7 HG2 GLU 7 -3.400 -10.219 -4.400 53 HG3 GLU 7 HG3 GLU 7 -2.818 -11.865 -4.158 54 H VAL 8 H VAL 8 -5.947 -9.848 -7.238 55 HA VAL 8 HA VAL 8 -7.123 -11.656 -8.994 56 HB VAL 8 HB VAL 8 -7.953 -8.857 -8.241 57 HG11 VAL 8 HG11 VAL 8 -9.425 -10.908 -9.883 58 HG12 VAL 8 HG12 VAL 8 -10.199 -9.514 -9.127 59 HG13 VAL 8 HG13 VAL 8 -8.962 -9.276 -10.363 60 HG21 VAL 8 HG21 VAL 8 -9.580 -10.007 -6.831 61 HG22 VAL 8 HG22 VAL 8 -8.966 -11.566 -7.381 62 HG23 VAL 8 HG23 VAL 8 -7.935 -10.499 -6.428 63 H PHE 9 H PHE 9 -5.972 -8.351 -9.641 64 HA PHE 9 HA PHE 9 -6.645 -8.272 -12.356 65 HB2 PHE 9 HB2 PHE 9 -4.584 -6.824 -10.711 66 HB3 PHE 9 HB3 PHE 9 -4.723 -6.547 -12.444 67 HD1 PHE 9 HD2 PHE 9 -7.560 -6.542 -12.934 68 HD2 PHE 9 HD1 PHE 9 -5.393 -4.965 -9.628 69 HE1 PHE 9 HE2 PHE 9 -9.364 -4.919 -12.531 70 HE2 PHE 9 HE1 PHE 9 -7.195 -3.340 -9.218 71 HZ PHE 9 HZ PHE 9 -9.183 -3.314 -10.671 72 H ALA 10 H ALA 10 -3.849 -9.584 -10.698 73 HA ALA 10 HA ALA 10 -2.228 -9.967 -12.993 74 HB1 ALA 10 HB1 ALA 10 -2.028 -11.709 -10.570 75 HB2 ALA 10 HB2 ALA 10 -0.746 -11.075 -11.602 76 HB3 ALA 10 HB3 ALA 10 -1.587 -10.003 -10.483 77 H LYS 11 H LYS 11 -4.404 -12.130 -11.200 78 HA LYS 11 HA LYS 11 -3.968 -14.373 -12.891 79 HB2 LYS 11 HB2 LYS 11 -6.017 -15.282 -11.779 80 HB3 LYS 11 HB3 LYS 11 -4.768 -14.750 -10.662 81 HG2 LYS 11 HG2 LYS 11 -5.999 -12.640 -10.334 82 HG3 LYS 11 HG3 LYS 11 -7.275 -13.249 -11.392 83 HD2 LYS 11 HD2 LYS 11 -6.372 -14.522 -8.807 84 HD3 LYS 11 HD3 LYS 11 -7.833 -13.555 -9.023 85 HE2 LYS 11 HE2 LYS 11 -7.211 -16.150 -10.430 86 HE3 LYS 11 HE3 LYS 11 -8.313 -15.959 -9.068 87 HZ1 LYS 11 HZ1 LYS 11 -8.620 -14.887 -11.812 88 HZ2 LYS 11 HZ2 LYS 11 -9.568 -14.359 -10.515 89 HZ3 LYS 11 HZ3 LYS 11 -9.630 -15.977 -11.004 90 H ILE 12 H ILE 12 -6.581 -11.973 -12.678 91 HA ILE 12 HA ILE 12 -8.224 -12.978 -14.685 92 HB ILE 12 HB ILE 12 -7.768 -10.144 -13.768 93 HG12 ILE 12 HG12 ILE 12 -10.004 -12.131 -13.308 94 HG13 ILE 12 HG13 ILE 12 -8.789 -11.647 -12.131 95 HG21 ILE 12 HG21 ILE 12 -8.532 -9.973 -16.028 96 HG22 ILE 12 HG22 ILE 12 -9.779 -11.188 -15.753 97 HG23 ILE 12 HG23 ILE 12 -9.892 -9.615 -14.965 98 HD11 ILE 12 HD11 ILE 12 -10.806 -10.498 -11.630 99 HD12 ILE 12 HD12 ILE 12 -9.674 -9.322 -12.298 100 HD13 ILE 12 HD13 ILE 12 -10.980 -9.956 -13.299 101 H ALA 13 H ALA 13 -5.427 -10.833 -14.906 102 HA ALA 13 HA ALA 13 -5.663 -10.182 -17.630 103 HB1 ALA 13 HB1 ALA 13 -4.190 -8.814 -16.511 104 HB2 ALA 13 HB2 ALA 13 -3.420 -10.155 -15.663 105 HB3 ALA 13 HB3 ALA 13 -3.083 -9.883 -17.372 106 H LYS 14 H LYS 14 -3.852 -12.768 -16.000 107 HA LYS 14 HA LYS 14 -2.604 -13.873 -18.224 108 HB2 LYS 14 HB2 LYS 14 -2.387 -14.439 -15.692 109 HB3 LYS 14 HB3 LYS 14 -3.667 -15.601 -16.012 110 HG2 LYS 14 HG2 LYS 14 -2.321 -16.964 -17.227 111 HG3 LYS 14 HG3 LYS 14 -1.324 -15.635 -17.822 112 HD2 LYS 14 HD2 LYS 14 0.207 -16.196 -16.308 113 HD3 LYS 14 HD3 LYS 14 -0.926 -15.692 -15.052 114 HE2 LYS 14 HE2 LYS 14 -1.134 -18.423 -16.250 115 HE3 LYS 14 HE3 LYS 14 0.078 -18.095 -15.012 116 HZ1 LYS 14 HZ1 LYS 14 -2.273 -18.930 -14.347 117 HZ2 LYS 14 HZ2 LYS 14 -2.712 -17.308 -14.535 118 HZ3 LYS 14 HZ3 LYS 14 -1.513 -17.736 -13.421 119 H ARG 15 H ARG 15 -5.904 -14.126 -17.138 120 HA ARG 15 HA ARG 15 -6.576 -16.361 -18.805 121 HB2 ARG 15 HB2 ARG 15 -8.342 -14.347 -17.402 122 HB3 ARG 15 HB3 ARG 15 -8.909 -15.817 -18.185 123 HG2 ARG 15 HG2 ARG 15 -6.976 -15.754 -15.878 124 HG3 ARG 15 HG3 ARG 15 -8.717 -16.002 -15.726 125 HD2 ARG 15 HD2 ARG 15 -6.850 -17.747 -17.328 126 HD3 ARG 15 HD3 ARG 15 -7.428 -18.113 -15.703 127 HE ARG 15 HE ARG 15 -9.716 -17.759 -17.089 128 HH11 ARG 15 HH11 ARG 15 -6.876 -19.693 -17.647 129 HH12 ARG 15 HH12 ARG 15 -7.730 -20.935 -18.501 130 HH21 ARG 15 HH21 ARG 15 -10.852 -19.387 -18.211 131 HH22 ARG 15 HH22 ARG 15 -9.992 -20.760 -18.821 132 H LEU 16 H LEU 16 -6.705 -12.867 -19.083 133 HA LEU 16 HA LEU 16 -8.359 -12.683 -21.344 134 HB2 LEU 16 HB2 LEU 16 -6.081 -10.845 -20.640 135 HB3 LEU 16 HB3 LEU 16 -7.497 -10.462 -21.617 136 HG LEU 16 HG LEU 16 -7.276 -10.760 -18.645 137 HD11 LEU 16 HD11 LEU 16 -8.222 -8.673 -20.572 138 HD12 LEU 16 HD12 LEU 16 -7.023 -8.541 -19.286 139 HD13 LEU 16 HD13 LEU 16 -8.737 -8.657 -18.886 140 HD21 LEU 16 HD21 LEU 16 -9.699 -11.181 -20.359 141 HD22 LEU 16 HD22 LEU 16 -9.837 -10.540 -18.721 142 HD23 LEU 16 HD23 LEU 16 -9.126 -12.132 -18.988 143 H GLU 17 H GLU 17 -5.100 -13.711 -20.986 144 HA GLU 17 HA GLU 17 -4.347 -13.236 -23.729 145 HB2 GLU 17 HB2 GLU 17 -2.993 -14.886 -21.587 146 HB3 GLU 17 HB3 GLU 17 -2.294 -14.460 -23.143 147 HG2 GLU 17 HG2 GLU 17 -2.530 -12.056 -22.489 148 HG3 GLU 17 HG3 GLU 17 -2.986 -12.609 -20.879 149 H SER 18 H SER 18 -6.271 -15.481 -22.201 150 HA SER 18 HA SER 18 -5.604 -17.655 -24.048 151 HB2 SER 18 HB2 SER 18 -6.825 -17.490 -21.389 152 HB3 SER 18 HB3 SER 18 -7.686 -18.569 -22.486 153 HG SER 18 HG SER 18 -5.944 -19.840 -22.636 154 H ILE 19 H ILE 19 -7.751 -15.068 -23.723 155 HA ILE 19 HA ILE 19 -10.136 -16.035 -24.775 156 HB ILE 19 HB ILE 19 -8.917 -13.316 -25.271 157 HG12 ILE 19 HG12 ILE 19 -10.846 -14.164 -23.102 158 HG13 ILE 19 HG13 ILE 19 -9.112 -13.986 -22.860 159 HG21 ILE 19 HG21 ILE 19 -11.449 -14.540 -26.022 160 HG22 ILE 19 HG22 ILE 19 -11.647 -13.032 -25.132 161 HG23 ILE 19 HG23 ILE 19 -10.686 -13.063 -26.610 162 HD11 ILE 19 HD11 ILE 19 -9.228 -11.643 -23.299 163 HD12 ILE 19 HD12 ILE 19 -10.921 -11.769 -23.779 164 HD13 ILE 19 HD13 ILE 19 -10.457 -12.049 -22.101 165 H ASP 20 H ASP 20 -10.949 -16.292 -26.827 166 HA ASP 20 HA ASP 20 -8.998 -16.131 -29.031 167 HB2 ASP 20 HB2 ASP 20 -10.354 -18.418 -28.027 168 HB3 ASP 20 HB3 ASP 20 -11.029 -18.058 -29.614 169 HA PRO 21 HA PRO 21 -11.869 -13.631 -31.217 170 HB2 PRO 21 HB2 PRO 21 -11.305 -14.328 -33.780 171 HB3 PRO 21 HB3 PRO 21 -10.222 -13.339 -32.792 172 HG2 PRO 21 HG2 PRO 21 -10.093 -16.269 -33.391 173 HG3 PRO 21 HG3 PRO 21 -8.782 -15.075 -33.359 174 HD2 PRO 21 HD2 PRO 21 -9.249 -16.782 -31.309 175 HD3 PRO 21 HD3 PRO 21 -8.605 -15.146 -31.062 176 H ALA 22 H ALA 22 -11.845 -17.085 -31.793 177 HA ALA 22 HA ALA 22 -14.105 -17.323 -33.418 178 HB1 ALA 22 HB1 ALA 22 -12.578 -19.173 -33.037 179 HB2 ALA 22 HB2 ALA 22 -13.066 -19.250 -31.344 180 HB3 ALA 22 HB3 ALA 22 -14.226 -19.638 -32.614 181 H ASN 23 H ASN 23 -13.882 -17.646 -29.871 182 HA ASN 23 HA ASN 23 -16.782 -17.174 -29.729 183 HB2 ASN 23 HB2 ASN 23 -15.115 -19.097 -28.475 184 HB3 ASN 23 HB3 ASN 23 -15.694 -18.011 -27.215 185 HD21 ASN 23 HD21 ASN 23 -16.305 -20.863 -28.240 186 HD22 ASN 23 HD22 ASN 23 -18.032 -20.912 -28.230 187 H ARG 24 H ARG 24 -17.330 -15.167 -29.223 188 HA ARG 24 HA ARG 24 -16.231 -13.846 -26.937 189 HB2 ARG 24 HB2 ARG 24 -15.209 -13.205 -29.607 190 HB3 ARG 24 HB3 ARG 24 -15.809 -11.804 -28.731 191 HG2 ARG 24 HG2 ARG 24 -14.354 -12.529 -26.806 192 HG3 ARG 24 HG3 ARG 24 -13.628 -13.699 -27.910 193 HD2 ARG 24 HD2 ARG 24 -13.599 -11.303 -29.316 194 HD3 ARG 24 HD3 ARG 24 -13.174 -10.849 -27.666 195 HE ARG 24 HE ARG 24 -11.719 -13.126 -28.635 196 HH11 ARG 24 HH11 ARG 24 -11.836 -9.649 -28.526 197 HH12 ARG 24 HH12 ARG 24 -10.133 -9.453 -28.774 198 HH21 ARG 24 HH21 ARG 24 -9.475 -12.882 -28.962 199 HH22 ARG 24 HH22 ARG 24 -8.791 -11.294 -29.022 200 H GLN 25 H GLN 25 -18.488 -14.005 -26.434 201 HA GLN 25 HA GLN 25 -20.594 -13.000 -27.920 202 HB2 GLN 25 HB2 GLN 25 -20.113 -13.668 -25.115 203 HB3 GLN 25 HB3 GLN 25 -21.307 -12.393 -25.323 204 HG2 GLN 25 HG2 GLN 25 -21.468 -14.954 -26.867 205 HG3 GLN 25 HG3 GLN 25 -22.124 -14.811 -25.237 206 HE21 GLN 25 HE21 GLN 25 -24.251 -14.765 -25.480 207 HE22 GLN 25 HE22 GLN 25 -25.121 -13.707 -26.533 208 H VAL 26 H VAL 26 -18.801 -11.289 -25.353 209 HA VAL 26 HA VAL 26 -18.943 -8.812 -26.817 210 HB VAL 26 HB VAL 26 -21.176 -9.033 -25.599 211 HG11 VAL 26 HG11 VAL 26 -19.456 -8.404 -23.203 212 HG12 VAL 26 HG12 VAL 26 -21.216 -8.526 -23.238 213 HG13 VAL 26 HG13 VAL 26 -20.226 -9.960 -23.514 214 HG21 VAL 26 HG21 VAL 26 -21.330 -6.749 -25.403 215 HG22 VAL 26 HG22 VAL 26 -19.740 -6.596 -24.656 216 HG23 VAL 26 HG23 VAL 26 -19.875 -6.896 -26.388 217 H GLU 27 H GLU 27 -17.559 -7.210 -25.995 218 HA GLU 27 HA GLU 27 -16.186 -7.504 -23.512 219 HB2 GLU 27 HB2 GLU 27 -13.917 -7.613 -24.962 220 HB3 GLU 27 HB3 GLU 27 -14.694 -9.030 -24.270 221 HG2 GLU 27 HG2 GLU 27 -14.067 -9.427 -26.574 222 HG3 GLU 27 HG3 GLU 27 -15.819 -9.460 -26.388 223 H HIS 28 H HIS 28 -15.846 -5.491 -22.873 224 HA HIS 28 HA HIS 28 -14.886 -3.509 -24.802 225 HB2 HIS 28 HB2 HIS 28 -17.418 -3.376 -23.224 226 HB3 HIS 28 HB3 HIS 28 -16.510 -1.888 -23.479 227 HD1 HIS 28 HD1 HIS 28 -15.756 -1.796 -26.273 228 HD2 HIS 28 HD2 HIS 28 -19.323 -3.582 -25.112 229 HE1 HIS 28 HE1 HIS 28 -17.209 -1.791 -28.325 230 H VAL 29 H VAL 29 -14.128 -1.491 -23.681 231 HA VAL 29 HA VAL 29 -12.255 -2.143 -21.687 232 HB VAL 29 HB VAL 29 -13.251 0.629 -22.348 233 HG11 VAL 29 HG11 VAL 29 -10.446 -0.024 -21.595 234 HG12 VAL 29 HG12 VAL 29 -11.372 1.455 -21.332 235 HG13 VAL 29 HG13 VAL 29 -11.671 0.035 -20.328 236 HG21 VAL 29 HG21 VAL 29 -11.380 0.687 -23.978 237 HG22 VAL 29 HG22 VAL 29 -11.143 -1.041 -23.714 238 HG23 VAL 29 HG23 VAL 29 -12.653 -0.455 -24.413 239 H TYR 30 H TYR 30 -12.331 -2.113 -19.523 240 HA TYR 30 HA TYR 30 -14.634 -0.840 -18.211 241 HB2 TYR 30 HB2 TYR 30 -13.572 -3.624 -17.709 242 HB3 TYR 30 HB3 TYR 30 -14.671 -2.791 -16.616 243 HD1 TYR 30 HD1 TYR 30 -16.497 -1.483 -18.548 244 HD2 TYR 30 HD2 TYR 30 -14.841 -5.402 -18.533 245 HE1 TYR 30 HE1 TYR 30 -18.416 -2.292 -19.856 246 HE2 TYR 30 HE2 TYR 30 -16.755 -6.222 -19.843 247 HH TYR 30 HH TYR 30 -18.540 -4.785 -21.591 248 H LYS 31 H LYS 31 -14.092 0.437 -16.567 249 HA LYS 31 HA LYS 31 -11.310 0.506 -15.708 250 HB2 LYS 31 HB2 LYS 31 -13.272 2.460 -16.144 251 HB3 LYS 31 HB3 LYS 31 -13.027 2.434 -14.402 252 HG2 LYS 31 HG2 LYS 31 -10.470 2.361 -15.577 253 HG3 LYS 31 HG3 LYS 31 -11.396 3.594 -16.437 254 HD2 LYS 31 HD2 LYS 31 -11.281 3.442 -13.433 255 HD3 LYS 31 HD3 LYS 31 -10.122 4.370 -14.388 256 HE2 LYS 31 HE2 LYS 31 -13.037 4.787 -14.848 257 HE3 LYS 31 HE3 LYS 31 -12.291 5.495 -13.416 258 HZ1 LYS 31 HZ1 LYS 31 -10.889 6.808 -14.707 259 HZ2 LYS 31 HZ2 LYS 31 -12.370 6.895 -15.520 260 HZ3 LYS 31 HZ3 LYS 31 -11.140 5.894 -16.108 261 H PHE 32 H PHE 32 -10.595 0.032 -13.690 262 HA PHE 32 HA PHE 32 -12.598 -0.776 -11.691 263 HB2 PHE 32 HB2 PHE 32 -9.981 -2.201 -12.205 264 HB3 PHE 32 HB3 PHE 32 -11.218 -2.664 -11.042 265 HD1 PHE 32 HD2 PHE 32 -13.610 -3.051 -12.100 266 HD2 PHE 32 HD1 PHE 32 -9.931 -3.278 -14.228 267 HE1 PHE 32 HE2 PHE 32 -14.689 -4.457 -13.806 268 HE2 PHE 32 HE1 PHE 32 -11.004 -4.685 -15.939 269 HZ PHE 32 HZ PHE 32 -13.385 -5.277 -15.728 270 H ARG 33 H ARG 33 -12.445 0.915 -10.316 271 HA ARG 33 HA ARG 33 -9.772 1.720 -9.398 272 HB2 ARG 33 HB2 ARG 33 -10.619 3.824 -8.896 273 HB3 ARG 33 HB3 ARG 33 -11.521 3.392 -10.342 274 HG2 ARG 33 HG2 ARG 33 -13.457 2.849 -9.066 275 HG3 ARG 33 HG3 ARG 33 -12.563 2.988 -7.551 276 HD2 ARG 33 HD2 ARG 33 -13.891 4.967 -7.854 277 HD3 ARG 33 HD3 ARG 33 -12.190 5.387 -8.049 278 HE ARG 33 HE ARG 33 -13.249 4.807 -10.572 279 HH11 ARG 33 HH11 ARG 33 -13.552 7.191 -8.053 280 HH12 ARG 33 HH12 ARG 33 -13.993 8.469 -9.137 281 HH21 ARG 33 HH21 ARG 33 -13.829 6.481 -12.008 282 HH22 ARG 33 HH22 ARG 33 -14.151 8.064 -11.386 283 H ILE 34 H ILE 34 -9.115 1.219 -7.411 284 HA ILE 34 HA ILE 34 -11.073 0.047 -5.561 285 HB ILE 34 HB ILE 34 -8.061 -0.182 -5.563 286 HG12 ILE 34 HG12 ILE 34 -9.835 -2.532 -5.944 287 HG13 ILE 34 HG13 ILE 34 -9.718 -1.407 -7.292 288 HG21 ILE 34 HG21 ILE 34 -8.568 -0.454 -3.342 289 HG22 ILE 34 HG22 ILE 34 -10.171 -1.107 -3.675 290 HG23 ILE 34 HG23 ILE 34 -8.742 -2.110 -3.923 291 HD11 ILE 34 HD11 ILE 34 -7.160 -2.207 -6.091 292 HD12 ILE 34 HD12 ILE 34 -8.059 -3.485 -6.909 293 HD13 ILE 34 HD13 ILE 34 -7.617 -2.019 -7.784 294 H THR 35 H THR 35 -11.512 0.958 -3.644 295 HA THR 35 HA THR 35 -10.067 3.424 -2.955 296 HB THR 35 HB THR 35 -12.013 4.088 -1.671 297 HG1 THR 35 HG1 THR 35 -13.135 1.589 -2.471 298 HG21 THR 35 HG21 THR 35 -12.036 3.614 -4.492 299 HG22 THR 35 HG22 THR 35 -12.802 4.915 -3.582 300 HG23 THR 35 HG23 THR 35 -13.667 3.404 -3.857 301 H GLN 36 H GLN 36 -9.188 3.730 -0.945 302 HA GLN 36 HA GLN 36 -8.737 1.322 0.618 303 HB2 GLN 36 HB2 GLN 36 -7.259 3.688 0.057 304 HB3 GLN 36 HB3 GLN 36 -7.505 3.609 1.796 305 HG2 GLN 36 HG2 GLN 36 -6.690 1.183 1.593 306 HG3 GLN 36 HG3 GLN 36 -6.091 1.673 0.009 307 HE21 GLN 36 HE21 GLN 36 -4.314 0.782 1.810 308 HE22 GLN 36 HE22 GLN 36 -3.348 2.080 2.415 309 H GLY 37 H GLY 37 -10.435 0.853 1.906 310 HA2 GLY 37 HA2 GLY 37 -11.682 1.015 3.849 311 HA3 GLY 37 HA3 GLY 37 -10.946 2.583 4.146 312 H GLY 38 H GLY 38 -11.685 3.894 1.777 313 HA2 GLY 38 HA2 GLY 38 -14.395 3.680 1.100 314 HA3 GLY 38 HA3 GLY 38 -14.268 4.790 2.457 315 H LYS 39 H LYS 39 -11.428 5.088 0.882 316 HA LYS 39 HA LYS 39 -12.451 7.204 -0.897 317 HB2 LYS 39 HB2 LYS 39 -10.097 8.245 -0.349 318 HB3 LYS 39 HB3 LYS 39 -11.460 8.490 0.735 319 HG2 LYS 39 HG2 LYS 39 -10.661 6.764 2.209 320 HG3 LYS 39 HG3 LYS 39 -9.360 6.361 1.086 321 HD2 LYS 39 HD2 LYS 39 -9.485 9.183 1.918 322 HD3 LYS 39 HD3 LYS 39 -9.087 8.034 3.197 323 HE2 LYS 39 HE2 LYS 39 -7.161 7.302 2.102 324 HE3 LYS 39 HE3 LYS 39 -7.689 7.943 0.547 325 HZ1 LYS 39 HZ1 LYS 39 -7.390 9.939 2.607 326 HZ2 LYS 39 HZ2 LYS 39 -6.847 9.947 1.005 327 HZ3 LYS 39 HZ3 LYS 39 -5.946 9.157 2.200 328 H VAL 40 H VAL 40 -11.774 7.145 -2.949 329 HA VAL 40 HA VAL 40 -10.471 4.963 -4.051 330 HB VAL 40 HB VAL 40 -11.846 6.659 -5.296 331 HG11 VAL 40 HG11 VAL 40 -9.285 8.228 -5.485 332 HG12 VAL 40 HG12 VAL 40 -10.888 8.679 -6.070 333 HG13 VAL 40 HG13 VAL 40 -10.566 8.617 -4.337 334 HG21 VAL 40 HG21 VAL 40 -10.616 4.953 -6.488 335 HG22 VAL 40 HG22 VAL 40 -10.530 6.473 -7.379 336 HG23 VAL 40 HG23 VAL 40 -9.147 5.927 -6.430 337 H VAL 41 H VAL 41 -8.396 4.430 -4.487 338 HA VAL 41 HA VAL 41 -6.314 6.315 -3.590 339 HB VAL 41 HB VAL 41 -6.591 4.180 -2.249 340 HG11 VAL 41 HG11 VAL 41 -5.065 2.726 -4.327 341 HG12 VAL 41 HG12 VAL 41 -6.216 2.124 -3.133 342 HG13 VAL 41 HG13 VAL 41 -6.797 2.921 -4.596 343 HG21 VAL 41 HG21 VAL 41 -4.329 4.081 -1.782 344 HG22 VAL 41 HG22 VAL 41 -3.863 4.279 -3.471 345 HG23 VAL 41 HG23 VAL 41 -4.473 5.659 -2.557 346 H LYS 42 H LYS 42 -7.391 4.156 -6.098 347 HA LYS 42 HA LYS 42 -5.742 5.404 -8.048 348 HB2 LYS 42 HB2 LYS 42 -4.326 3.568 -6.687 349 HB3 LYS 42 HB3 LYS 42 -5.065 2.518 -7.889 350 HG2 LYS 42 HG2 LYS 42 -4.201 4.425 -9.522 351 HG3 LYS 42 HG3 LYS 42 -3.035 4.649 -8.216 352 HD2 LYS 42 HD2 LYS 42 -3.605 2.042 -9.627 353 HD3 LYS 42 HD3 LYS 42 -2.218 3.090 -9.935 354 HE2 LYS 42 HE2 LYS 42 -2.106 2.752 -7.221 355 HE3 LYS 42 HE3 LYS 42 -2.698 1.184 -7.767 356 HZ1 LYS 42 HZ1 LYS 42 -0.817 0.986 -9.230 357 HZ2 LYS 42 HZ2 LYS 42 -0.264 1.298 -7.662 358 HZ3 LYS 42 HZ3 LYS 42 -0.270 2.533 -8.818 359 H ASN 43 H ASN 43 -6.143 4.598 -10.208 360 HA ASN 43 HA ASN 43 -8.531 2.884 -10.395 361 HB2 ASN 43 HB2 ASN 43 -8.095 5.096 -12.364 362 HB3 ASN 43 HB3 ASN 43 -9.598 4.326 -11.864 363 HD21 ASN 43 HD21 ASN 43 -10.825 5.357 -10.452 364 HD22 ASN 43 HD22 ASN 43 -10.334 6.698 -9.480 365 H TRP 44 H TRP 44 -8.406 1.257 -11.815 366 HA TRP 44 HA TRP 44 -6.044 1.159 -13.564 367 HB2 TRP 44 HB2 TRP 44 -7.626 -0.931 -12.127 368 HB3 TRP 44 HB3 TRP 44 -6.802 -1.371 -13.620 369 HD1 TRP 44 HD1 TRP 44 -6.140 -0.485 -9.984 370 HE1 TRP 44 HE1 TRP 44 -3.663 -0.940 -9.448 371 HE3 TRP 44 HE3 TRP 44 -4.442 -1.410 -14.716 372 HZ2 TRP 44 HZ2 TRP 44 -1.303 -1.602 -10.847 373 HZ3 TRP 44 HZ3 TRP 44 -2.062 -1.946 -15.032 374 HH2 TRP 44 HH2 TRP 44 -0.526 -2.039 -13.136 375 H VAL 45 H VAL 45 -6.254 0.382 -15.710 376 HA VAL 45 HA VAL 45 -8.985 0.316 -16.789 377 HB VAL 45 HB VAL 45 -6.705 1.938 -17.928 378 HG11 VAL 45 HG11 VAL 45 -7.645 1.605 -19.917 379 HG12 VAL 45 HG12 VAL 45 -9.012 0.751 -19.198 380 HG13 VAL 45 HG13 VAL 45 -9.040 2.510 -19.329 381 HG21 VAL 45 HG21 VAL 45 -7.811 3.837 -17.273 382 HG22 VAL 45 HG22 VAL 45 -9.387 3.046 -17.251 383 HG23 VAL 45 HG23 VAL 45 -8.234 2.751 -15.949 384 H MET 46 H MET 46 -9.310 -1.408 -18.026 385 HA MET 46 HA MET 46 -6.988 -2.925 -18.960 386 HB2 MET 46 HB2 MET 46 -8.505 -4.798 -19.213 387 HB3 MET 46 HB3 MET 46 -8.691 -4.103 -17.609 388 HG2 MET 46 HG2 MET 46 -10.868 -4.054 -17.995 389 HG3 MET 46 HG3 MET 46 -10.555 -2.755 -19.143 390 HE1 MET 46 HE1 MET 46 -13.301 -5.050 -20.009 391 HE2 MET 46 HE2 MET 46 -12.465 -6.559 -19.643 392 HE3 MET 46 HE3 MET 46 -12.471 -5.245 -18.466 393 H ASP 47 H ASP 47 -6.447 -3.033 -21.044 394 HA ASP 47 HA ASP 47 -7.629 -1.394 -22.985 395 HB2 ASP 47 HB2 ASP 47 -5.280 -2.744 -22.809 396 HB3 ASP 47 HB3 ASP 47 -6.140 -3.746 -23.975 397 H LEU 48 H LEU 48 -7.797 -2.988 -25.279 398 HA LEU 48 HA LEU 48 -9.806 -5.021 -24.827 399 HB2 LEU 48 HB2 LEU 48 -10.820 -2.587 -24.939 400 HB3 LEU 48 HB3 LEU 48 -10.627 -2.836 -26.673 401 HG LEU 48 HG LEU 48 -12.494 -4.147 -24.758 402 HD11 LEU 48 HD11 LEU 48 -13.964 -3.926 -26.805 403 HD12 LEU 48 HD12 LEU 48 -12.653 -2.997 -27.531 404 HD13 LEU 48 HD13 LEU 48 -13.432 -2.419 -26.058 405 HD21 LEU 48 HD21 LEU 48 -12.882 -5.946 -26.425 406 HD22 LEU 48 HD22 LEU 48 -11.315 -6.052 -25.623 407 HD23 LEU 48 HD23 LEU 48 -11.423 -5.427 -27.269 408 H LYS 49 H LYS 49 -8.163 -2.968 -27.207 409 HA LYS 49 HA LYS 49 -8.456 -4.874 -29.330 410 HB2 LYS 49 HB2 LYS 49 -7.763 -2.172 -29.137 411 HB3 LYS 49 HB3 LYS 49 -6.309 -2.967 -29.727 412 HG2 LYS 49 HG2 LYS 49 -9.040 -3.211 -30.972 413 HG3 LYS 49 HG3 LYS 49 -7.750 -2.150 -31.539 414 HD2 LYS 49 HD2 LYS 49 -6.321 -4.107 -31.924 415 HD3 LYS 49 HD3 LYS 49 -7.624 -5.162 -31.370 416 HE2 LYS 49 HE2 LYS 49 -8.555 -5.148 -33.388 417 HE3 LYS 49 HE3 LYS 49 -8.601 -3.386 -33.399 418 HZ1 LYS 49 HZ1 LYS 49 -6.188 -4.961 -34.100 419 HZ2 LYS 49 HZ2 LYS 49 -6.430 -3.302 -34.316 420 HZ3 LYS 49 HZ3 LYS 49 -7.307 -4.411 -35.244 421 H ASN 50 H ASN 50 -6.060 -4.170 -26.894 422 HA ASN 50 HA ASN 50 -4.185 -6.066 -28.107 423 HB2 ASN 50 HB2 ASN 50 -3.627 -3.675 -27.076 424 HB3 ASN 50 HB3 ASN 50 -3.534 -4.611 -25.588 425 HD21 ASN 50 HD21 ASN 50 -1.929 -3.653 -28.384 426 HD22 ASN 50 HD22 ASN 50 -0.543 -4.675 -28.241 427 H VAL 51 H VAL 51 -6.498 -5.793 -25.600 428 HA VAL 51 HA VAL 51 -7.269 -7.272 -24.048 429 HB VAL 51 HB VAL 51 -5.415 -9.362 -25.160 430 HG11 VAL 51 HG11 VAL 51 -6.504 -10.310 -23.380 431 HG12 VAL 51 HG12 VAL 51 -7.949 -9.320 -23.596 432 HG13 VAL 51 HG13 VAL 51 -7.639 -10.679 -24.678 433 HG21 VAL 51 HG21 VAL 51 -6.331 -8.659 -27.155 434 HG22 VAL 51 HG22 VAL 51 -7.504 -9.872 -26.641 435 HG23 VAL 51 HG23 VAL 51 -7.847 -8.159 -26.406 436 H LYS 52 H LYS 52 -5.310 -5.580 -23.198 437 HA LYS 52 HA LYS 52 -3.927 -7.235 -21.212 438 HB2 LYS 52 HB2 LYS 52 -2.283 -6.689 -22.955 439 HB3 LYS 52 HB3 LYS 52 -2.642 -4.978 -22.763 440 HG2 LYS 52 HG2 LYS 52 -1.565 -4.842 -20.728 441 HG3 LYS 52 HG3 LYS 52 -1.718 -6.573 -20.414 442 HD2 LYS 52 HD2 LYS 52 0.090 -7.107 -21.721 443 HD3 LYS 52 HD3 LYS 52 -0.103 -5.690 -22.756 444 HE2 LYS 52 HE2 LYS 52 0.547 -4.340 -20.665 445 HE3 LYS 52 HE3 LYS 52 1.124 -5.878 -20.025 446 HZ1 LYS 52 HZ1 LYS 52 2.888 -5.869 -21.379 447 HZ2 LYS 52 HZ2 LYS 52 2.595 -4.209 -21.519 448 HZ3 LYS 52 HZ3 LYS 52 2.022 -5.271 -22.704 449 H LEU 53 H LEU 53 -3.529 -6.208 -19.219 450 HA LEU 53 HA LEU 53 -5.250 -3.883 -18.747 451 HB2 LEU 53 HB2 LEU 53 -4.579 -6.271 -17.262 452 HB3 LEU 53 HB3 LEU 53 -4.317 -4.820 -16.296 453 HG LEU 53 HG LEU 53 -6.763 -4.260 -17.174 454 HD11 LEU 53 HD11 LEU 53 -6.568 -7.260 -17.285 455 HD12 LEU 53 HD12 LEU 53 -7.112 -6.159 -18.550 456 HD13 LEU 53 HD13 LEU 53 -8.092 -6.391 -17.103 457 HD21 LEU 53 HD21 LEU 53 -5.745 -4.732 -14.804 458 HD22 LEU 53 HD22 LEU 53 -6.603 -6.263 -14.972 459 HD23 LEU 53 HD23 LEU 53 -7.491 -4.741 -15.052 460 H VAL 54 H VAL 54 -4.486 -1.973 -18.019 461 HA VAL 54 HA VAL 54 -1.725 -1.779 -17.089 462 HB VAL 54 HB VAL 54 -2.654 0.172 -19.168 463 HG11 VAL 54 HG11 VAL 54 -0.735 1.077 -18.440 464 HG12 VAL 54 HG12 VAL 54 -0.188 -0.431 -17.705 465 HG13 VAL 54 HG13 VAL 54 0.036 -0.159 -19.434 466 HG21 VAL 54 HG21 VAL 54 -1.297 -2.472 -19.673 467 HG22 VAL 54 HG22 VAL 54 -2.878 -1.959 -20.262 468 HG23 VAL 54 HG23 VAL 54 -1.418 -1.169 -20.855 469 H GLU 55 H GLU 55 -1.236 0.374 -16.173 470 HA GLU 55 HA GLU 55 -3.526 1.335 -14.669 471 HB2 GLU 55 HB2 GLU 55 -1.748 2.718 -13.493 472 HB3 GLU 55 HB3 GLU 55 -1.611 0.973 -13.334 473 HG2 GLU 55 HG2 GLU 55 0.413 0.979 -14.225 474 HG3 GLU 55 HG3 GLU 55 -0.142 1.894 -15.626 475 H SER 56 H SER 56 -4.770 2.760 -15.715 476 HA SER 56 HA SER 56 -3.582 5.264 -16.570 477 HB2 SER 56 HB2 SER 56 -3.537 3.779 -18.593 478 HB3 SER 56 HB3 SER 56 -5.295 3.682 -18.499 479 HG SER 56 HG SER 56 -4.490 5.329 -19.940 480 H ASP 57 H ASP 57 -5.368 6.813 -17.304 481 HA ASP 57 HA ASP 57 -7.798 6.322 -15.710 482 HB2 ASP 57 HB2 ASP 57 -5.920 8.194 -15.107 483 HB3 ASP 57 HB3 ASP 57 -7.000 9.132 -16.136 484 H ASP 58 H ASP 58 -6.769 6.434 -18.741 485 HA ASP 58 HA ASP 58 -8.225 8.302 -20.148 486 HB2 ASP 58 HB2 ASP 58 -6.576 6.472 -20.976 487 HB3 ASP 58 HB3 ASP 58 -8.018 5.473 -21.138 488 H ALA 59 H ALA 59 -10.192 7.922 -21.501 489 HA ALA 59 HA ALA 59 -12.421 7.415 -19.881 490 HB1 ALA 59 HB1 ALA 59 -13.696 8.053 -21.667 491 HB2 ALA 59 HB2 ALA 59 -12.141 8.734 -22.146 492 HB3 ALA 59 HB3 ALA 59 -12.683 7.205 -22.836 493 H ALA 60 H ALA 60 -14.175 5.823 -20.433 494 HA ALA 60 HA ALA 60 -13.381 3.333 -21.638 495 HB1 ALA 60 HB1 ALA 60 -13.373 3.676 -18.696 496 HB2 ALA 60 HB2 ALA 60 -14.070 2.187 -19.335 497 HB3 ALA 60 HB3 ALA 60 -12.404 2.616 -19.719 498 H GLU 61 H GLU 61 -15.138 1.788 -21.749 499 HA GLU 61 HA GLU 61 -17.599 2.945 -22.370 500 HB2 GLU 61 HB2 GLU 61 -16.954 0.070 -21.695 501 HB3 GLU 61 HB3 GLU 61 -18.462 0.611 -22.419 502 HG2 GLU 61 HG2 GLU 61 -15.723 0.532 -23.610 503 HG3 GLU 61 HG3 GLU 61 -17.227 -0.153 -24.224 504 H ALA 62 H ALA 62 -16.354 1.736 -19.360 505 HA ALA 62 HA ALA 62 -18.521 2.908 -17.902 506 HB1 ALA 62 HB1 ALA 62 -18.629 0.080 -18.546 507 HB2 ALA 62 HB2 ALA 62 -18.669 0.377 -16.807 508 HB3 ALA 62 HB3 ALA 62 -19.867 1.133 -17.859 509 H THR 63 H THR 63 -18.215 2.722 -15.551 510 HA THR 63 HA THR 63 -15.413 2.146 -14.841 511 HB THR 63 HB THR 63 -17.117 4.416 -13.798 512 HG1 THR 63 HG1 THR 63 -14.998 4.241 -15.660 513 HG21 THR 63 HG21 THR 63 -15.607 3.448 -12.094 514 HG22 THR 63 HG22 THR 63 -15.157 5.094 -12.541 515 HG23 THR 63 HG23 THR 63 -14.244 3.726 -13.176 516 H LEU 64 H LEU 64 -15.130 0.794 -13.186 517 HA LEU 64 HA LEU 64 -17.455 0.188 -11.482 518 HB2 LEU 64 HB2 LEU 64 -15.293 -1.511 -12.630 519 HB3 LEU 64 HB3 LEU 64 -16.006 -1.970 -11.085 520 HG LEU 64 HG LEU 64 -18.260 -1.836 -12.327 521 HD11 LEU 64 HD11 LEU 64 -16.387 -2.089 -14.676 522 HD12 LEU 64 HD12 LEU 64 -17.413 -0.700 -14.320 523 HD13 LEU 64 HD13 LEU 64 -18.142 -2.255 -14.721 524 HD21 LEU 64 HD21 LEU 64 -17.137 -4.122 -13.559 525 HD22 LEU 64 HD22 LEU 64 -18.077 -4.030 -12.070 526 HD23 LEU 64 HD23 LEU 64 -16.318 -3.894 -12.014 527 H THR 65 H THR 65 -17.236 1.224 -9.607 528 HA THR 65 HA THR 65 -14.570 1.400 -8.382 529 HB THR 65 HB THR 65 -17.076 2.975 -7.761 530 HG1 THR 65 HG1 THR 65 -16.320 3.935 -9.529 531 HG21 THR 65 HG21 THR 65 -15.329 4.398 -6.497 532 HG22 THR 65 HG22 THR 65 -14.338 2.940 -6.535 533 HG23 THR 65 HG23 THR 65 -15.911 2.916 -5.739 534 H MET 66 H MET 66 -14.105 0.171 -6.683 535 HA MET 66 HA MET 66 -16.084 -0.504 -4.707 536 HB2 MET 66 HB2 MET 66 -15.701 -2.976 -4.936 537 HB3 MET 66 HB3 MET 66 -16.632 -2.251 -6.241 538 HG2 MET 66 HG2 MET 66 -14.415 -2.107 -7.499 539 HG3 MET 66 HG3 MET 66 -13.797 -3.213 -6.276 540 HE1 MET 66 HE1 MET 66 -14.503 -4.470 -9.915 541 HE2 MET 66 HE2 MET 66 -16.058 -3.638 -9.897 542 HE3 MET 66 HE3 MET 66 -14.596 -2.787 -9.396 543 H GLU 67 H GLU 67 -15.178 -1.349 -2.789 544 HA GLU 67 HA GLU 67 -12.601 -0.431 -2.176 545 HB2 GLU 67 HB2 GLU 67 -14.787 -1.545 -0.772 546 HB3 GLU 67 HB3 GLU 67 -13.382 -2.523 -0.370 547 HG2 GLU 67 HG2 GLU 67 -12.761 0.295 -0.287 548 HG3 GLU 67 HG3 GLU 67 -14.119 -0.103 0.765 549 H ASP 68 H ASP 68 -10.874 -1.869 -1.191 550 HA ASP 68 HA ASP 68 -9.915 -3.636 -3.185 551 HB2 ASP 68 HB2 ASP 68 -8.660 -2.222 -1.334 552 HB3 ASP 68 HB3 ASP 68 -8.812 -3.713 -0.409 553 H ASP 69 H ASP 69 -11.277 -4.175 0.045 554 HA ASP 69 HA ASP 69 -10.964 -6.967 0.091 555 HB2 ASP 69 HB2 ASP 69 -11.430 -5.897 2.153 556 HB3 ASP 69 HB3 ASP 69 -12.865 -5.106 1.507 557 H ILE 70 H ILE 70 -13.492 -4.905 -1.215 558 HA ILE 70 HA ILE 70 -15.331 -7.017 -1.756 559 HB ILE 70 HB ILE 70 -15.133 -4.163 -2.668 560 HG12 ILE 70 HG12 ILE 70 -17.642 -4.740 -1.575 561 HG13 ILE 70 HG13 ILE 70 -16.503 -5.649 -0.587 562 HG21 ILE 70 HG21 ILE 70 -17.375 -4.560 -3.769 563 HG22 ILE 70 HG22 ILE 70 -15.970 -5.216 -4.609 564 HG23 ILE 70 HG23 ILE 70 -17.014 -6.284 -3.670 565 HD11 ILE 70 HD11 ILE 70 -16.931 -3.450 0.345 566 HD12 ILE 70 HD12 ILE 70 -15.247 -3.606 -0.155 567 HD13 ILE 70 HD13 ILE 70 -16.383 -2.696 -1.151 568 H MET 71 H MET 71 -13.139 -5.120 -3.830 569 HA MET 71 HA MET 71 -13.655 -6.337 -6.251 570 HB2 MET 71 HB2 MET 71 -12.256 -4.436 -6.268 571 HB3 MET 71 HB3 MET 71 -11.136 -5.147 -5.114 572 HG2 MET 71 HG2 MET 71 -10.065 -6.381 -6.695 573 HG3 MET 71 HG3 MET 71 -11.497 -6.522 -7.714 574 HE1 MET 71 HE1 MET 71 -11.844 -2.802 -8.752 575 HE2 MET 71 HE2 MET 71 -11.921 -4.175 -9.856 576 HE3 MET 71 HE3 MET 71 -12.667 -4.283 -8.261 577 H PHE 72 H PHE 72 -11.481 -7.393 -3.671 578 HA PHE 72 HA PHE 72 -10.267 -9.525 -5.011 579 HB2 PHE 72 HB2 PHE 72 -9.818 -8.456 -2.646 580 HB3 PHE 72 HB3 PHE 72 -10.891 -9.737 -2.093 581 HD1 PHE 72 HD1 PHE 72 -8.126 -9.534 -4.595 582 HD2 PHE 72 HD2 PHE 72 -9.737 -11.483 -1.171 583 HE1 PHE 72 HE1 PHE 72 -6.240 -11.114 -4.611 584 HE2 PHE 72 HE2 PHE 72 -7.853 -13.065 -1.181 585 HZ PHE 72 HZ PHE 72 -6.101 -12.882 -2.902 586 H ALA 73 H ALA 73 -13.230 -9.416 -3.072 587 HA ALA 73 HA ALA 73 -13.841 -12.134 -3.074 588 HB1 ALA 73 HB1 ALA 73 -15.006 -9.925 -2.032 589 HB2 ALA 73 HB2 ALA 73 -16.144 -10.325 -3.319 590 HB3 ALA 73 HB3 ALA 73 -15.761 -11.518 -2.079 591 H ILE 74 H ILE 74 -14.838 -9.610 -5.378 592 HA ILE 74 HA ILE 74 -16.251 -11.410 -7.074 593 HB ILE 74 HB ILE 74 -15.150 -8.684 -7.763 594 HG12 ILE 74 HG12 ILE 74 -17.986 -8.760 -7.269 595 HG13 ILE 74 HG13 ILE 74 -17.122 -9.386 -5.870 596 HG21 ILE 74 HG21 ILE 74 -15.735 -9.719 -9.776 597 HG22 ILE 74 HG22 ILE 74 -17.148 -10.500 -9.069 598 HG23 ILE 74 HG23 ILE 74 -17.154 -8.760 -9.355 599 HD11 ILE 74 HD11 ILE 74 -15.692 -7.294 -6.018 600 HD12 ILE 74 HD12 ILE 74 -16.911 -6.680 -7.134 601 HD13 ILE 74 HD13 ILE 74 -17.359 -7.096 -5.480 602 H GLY 75 H GLY 75 -12.943 -10.685 -6.658 603 HA2 GLY 75 HA2 GLY 75 -12.175 -11.439 -9.358 604 HA3 GLY 75 HA3 GLY 75 -11.090 -10.990 -8.050 605 H THR 76 H THR 76 -12.121 -12.839 -6.122 606 HA THR 76 HA THR 76 -10.905 -15.283 -7.186 607 HB THR 76 HB THR 76 -10.638 -15.985 -4.864 608 HG1 THR 76 HG1 THR 76 -11.650 -14.995 -3.270 609 HG21 THR 76 HG21 THR 76 -9.550 -13.434 -4.300 610 HG22 THR 76 HG22 THR 76 -9.423 -13.683 -6.042 611 HG23 THR 76 HG23 THR 76 -8.720 -14.857 -4.929 612 H GLY 77 H GLY 77 -13.679 -14.490 -7.779 613 HA2 GLY 77 HA2 GLY 77 -15.792 -15.397 -7.826 614 HA3 GLY 77 HA3 GLY 77 -14.949 -16.933 -7.684 615 H ALA 78 H ALA 78 -14.655 -14.595 -5.146 616 HA ALA 78 HA ALA 78 -15.731 -16.419 -3.229 617 HB1 ALA 78 HB1 ALA 78 -15.492 -13.800 -2.134 618 HB2 ALA 78 HB2 ALA 78 -14.474 -15.214 -1.856 619 HB3 ALA 78 HB3 ALA 78 -14.105 -14.108 -3.180 620 H LEU 79 H LEU 79 -16.666 -13.021 -3.754 621 HA LEU 79 HA LEU 79 -19.451 -13.805 -3.209 622 HB2 LEU 79 HB2 LEU 79 -17.840 -11.399 -2.534 623 HB3 LEU 79 HB3 LEU 79 -19.566 -11.190 -2.824 624 HG LEU 79 HG LEU 79 -18.442 -13.104 -0.785 625 HD11 LEU 79 HD11 LEU 79 -19.742 -10.660 0.164 626 HD12 LEU 79 HD12 LEU 79 -18.188 -10.397 -0.627 627 HD13 LEU 79 HD13 LEU 79 -18.300 -11.487 0.755 628 HD21 LEU 79 HD21 LEU 79 -21.201 -11.957 -1.203 629 HD22 LEU 79 HD22 LEU 79 -20.718 -13.031 0.110 630 HD23 LEU 79 HD23 LEU 79 -20.698 -13.610 -1.556 631 HA PRO 80 HA PRO 80 -20.563 -12.635 -7.303 632 HB2 PRO 80 HB2 PRO 80 -23.193 -12.093 -6.902 633 HB3 PRO 80 HB3 PRO 80 -22.543 -13.737 -6.920 634 HG2 PRO 80 HG2 PRO 80 -23.214 -11.990 -4.583 635 HG3 PRO 80 HG3 PRO 80 -23.539 -13.717 -4.819 636 HD2 PRO 80 HD2 PRO 80 -21.479 -12.815 -3.312 637 HD3 PRO 80 HD3 PRO 80 -21.395 -14.329 -4.235 638 H ALA 81 H ALA 81 -20.288 -10.798 -8.396 639 HA ALA 81 HA ALA 81 -19.987 -8.298 -7.203 640 HB1 ALA 81 HB1 ALA 81 -19.674 -7.433 -9.349 641 HB2 ALA 81 HB2 ALA 81 -19.168 -9.117 -9.488 642 HB3 ALA 81 HB3 ALA 81 -20.751 -8.620 -10.086 643 H LYS 82 H LYS 82 -22.830 -9.915 -8.351 644 HA LYS 82 HA LYS 82 -24.508 -7.668 -8.690 645 HB2 LYS 82 HB2 LYS 82 -24.932 -10.039 -9.488 646 HB3 LYS 82 HB3 LYS 82 -25.396 -10.424 -7.836 647 HG2 LYS 82 HG2 LYS 82 -26.808 -8.092 -8.664 648 HG3 LYS 82 HG3 LYS 82 -26.989 -9.344 -9.895 649 HD2 LYS 82 HD2 LYS 82 -27.441 -10.876 -7.808 650 HD3 LYS 82 HD3 LYS 82 -27.853 -9.341 -7.040 651 HE2 LYS 82 HE2 LYS 82 -29.701 -9.031 -8.340 652 HE3 LYS 82 HE3 LYS 82 -29.012 -9.893 -9.715 653 HZ1 LYS 82 HZ1 LYS 82 -30.791 -11.178 -8.808 654 HZ2 LYS 82 HZ2 LYS 82 -30.141 -11.097 -7.248 655 HZ3 LYS 82 HZ3 LYS 82 -29.341 -11.975 -8.453 656 H GLU 83 H GLU 83 -24.302 -9.977 -5.974 657 HA GLU 83 HA GLU 83 -26.037 -8.633 -4.256 658 HB2 GLU 83 HB2 GLU 83 -23.663 -10.386 -3.601 659 HB3 GLU 83 HB3 GLU 83 -24.875 -9.877 -2.433 660 HG2 GLU 83 HG2 GLU 83 -25.418 -11.519 -4.896 661 HG3 GLU 83 HG3 GLU 83 -25.254 -12.153 -3.259 662 H ALA 84 H ALA 84 -22.494 -8.428 -4.487 663 HA ALA 84 HA ALA 84 -21.977 -6.667 -2.436 664 HB1 ALA 84 HB1 ALA 84 -20.100 -5.838 -4.048 665 HB2 ALA 84 HB2 ALA 84 -20.076 -7.493 -3.438 666 HB3 ALA 84 HB3 ALA 84 -20.661 -7.162 -5.068 667 H MET 85 H MET 85 -22.995 -5.915 -5.748 668 HA MET 85 HA MET 85 -22.852 -3.107 -5.492 669 HB2 MET 85 HB2 MET 85 -23.507 -4.948 -7.512 670 HB3 MET 85 HB3 MET 85 -24.928 -3.930 -7.322 671 HG2 MET 85 HG2 MET 85 -23.073 -2.025 -7.364 672 HG3 MET 85 HG3 MET 85 -22.220 -3.254 -8.295 673 HE1 MET 85 HE1 MET 85 -23.403 -0.310 -8.718 674 HE2 MET 85 HE2 MET 85 -24.361 -0.204 -10.195 675 HE3 MET 85 HE3 MET 85 -25.159 -0.455 -8.641 676 H ALA 86 H ALA 86 -25.304 -5.452 -4.659 677 HA ALA 86 HA ALA 86 -27.401 -3.539 -4.267 678 HB1 ALA 86 HB1 ALA 86 -27.069 -6.437 -3.993 679 HB2 ALA 86 HB2 ALA 86 -28.179 -5.715 -2.828 680 HB3 ALA 86 HB3 ALA 86 -28.452 -5.498 -4.557 681 H GLN 87 H GLN 87 -24.798 -4.785 -2.354 682 HA GLN 87 HA GLN 87 -25.946 -3.881 0.152 683 HB2 GLN 87 HB2 GLN 87 -23.182 -4.963 -0.420 684 HB3 GLN 87 HB3 GLN 87 -23.896 -4.725 1.169 685 HG2 GLN 87 HG2 GLN 87 -25.728 -6.323 -0.139 686 HG3 GLN 87 HG3 GLN 87 -24.167 -6.936 -0.680 687 HE21 GLN 87 HE21 GLN 87 -23.549 -8.595 0.487 688 HE22 GLN 87 HE22 GLN 87 -23.753 -8.781 2.192 689 H ASP 88 H ASP 88 -24.783 -2.245 -2.328 690 HA ASP 88 HA ASP 88 -23.940 -0.151 -2.612 691 HB2 ASP 88 HB2 ASP 88 -25.240 -0.083 -0.132 692 HB3 ASP 88 HB3 ASP 88 -23.674 0.672 0.152 693 H LYS 89 H LYS 89 -22.287 -2.589 -1.639 694 HA LYS 89 HA LYS 89 -19.948 -1.313 -0.505 695 HB2 LYS 89 HB2 LYS 89 -20.406 -4.153 -1.437 696 HB3 LYS 89 HB3 LYS 89 -18.961 -3.584 -0.611 697 HG2 LYS 89 HG2 LYS 89 -21.137 -2.815 0.990 698 HG3 LYS 89 HG3 LYS 89 -21.442 -4.481 0.490 699 HD2 LYS 89 HD2 LYS 89 -19.172 -5.089 1.255 700 HD3 LYS 89 HD3 LYS 89 -18.945 -3.434 1.824 701 HE2 LYS 89 HE2 LYS 89 -21.411 -4.562 2.822 702 HE3 LYS 89 HE3 LYS 89 -20.030 -5.573 3.246 703 HZ1 LYS 89 HZ1 LYS 89 -19.106 -3.940 4.521 704 HZ2 LYS 89 HZ2 LYS 89 -20.742 -3.584 4.754 705 HZ3 LYS 89 HZ3 LYS 89 -19.827 -2.677 3.657 706 H MET 90 H MET 90 -21.216 -1.649 -3.568 707 HA MET 90 HA MET 90 -18.740 -0.792 -4.779 708 HB2 MET 90 HB2 MET 90 -18.538 -2.531 -6.391 709 HB3 MET 90 HB3 MET 90 -18.668 -3.313 -4.822 710 HG2 MET 90 HG2 MET 90 -21.002 -3.814 -5.234 711 HG3 MET 90 HG3 MET 90 -20.929 -2.966 -6.777 712 HE1 MET 90 HE1 MET 90 -18.236 -4.886 -8.627 713 HE2 MET 90 HE2 MET 90 -19.882 -4.675 -9.223 714 HE3 MET 90 HE3 MET 90 -19.087 -3.366 -8.347 715 H GLU 91 H GLU 91 -19.043 0.337 -6.686 716 HA GLU 91 HA GLU 91 -21.818 0.580 -7.637 717 HB2 GLU 91 HB2 GLU 91 -21.131 3.049 -8.087 718 HB3 GLU 91 HB3 GLU 91 -21.620 2.571 -6.468 719 HG2 GLU 91 HG2 GLU 91 -18.763 2.274 -6.938 720 HG3 GLU 91 HG3 GLU 91 -19.337 3.930 -7.123 721 H VAL 92 H VAL 92 -22.022 1.383 -9.838 722 HA VAL 92 HA VAL 92 -19.629 1.245 -11.497 723 HB VAL 92 HB VAL 92 -22.016 -0.452 -12.204 724 HG11 VAL 92 HG11 VAL 92 -20.298 -1.542 -13.685 725 HG12 VAL 92 HG12 VAL 92 -20.718 0.119 -14.111 726 HG13 VAL 92 HG13 VAL 92 -19.208 -0.221 -13.265 727 HG21 VAL 92 HG21 VAL 92 -19.484 -1.270 -10.787 728 HG22 VAL 92 HG22 VAL 92 -21.132 -1.377 -10.169 729 HG23 VAL 92 HG23 VAL 92 -20.627 -2.397 -11.516 730 H ASP 93 H ASP 93 -19.765 2.430 -13.360 731 HA ASP 93 HA ASP 93 -22.342 3.748 -13.909 732 HB2 ASP 93 HB2 ASP 93 -19.939 4.961 -13.048 733 HB3 ASP 93 HB3 ASP 93 -20.135 5.384 -14.747 734 H GLY 94 H GLY 94 -21.990 5.001 -16.178 735 HA2 GLY 94 HA2 GLY 94 -21.183 4.825 -18.412 736 HA3 GLY 94 HA3 GLY 94 -20.650 3.188 -18.059 737 H GLN 95 H GLN 95 -21.848 1.595 -18.852 738 HA GLN 95 HA GLN 95 -24.651 2.183 -19.545 739 HB2 GLN 95 HB2 GLN 95 -22.484 1.167 -21.156 740 HB3 GLN 95 HB3 GLN 95 -23.796 -0.002 -21.091 741 HG2 GLN 95 HG2 GLN 95 -24.695 2.733 -21.555 742 HG3 GLN 95 HG3 GLN 95 -23.625 2.112 -22.811 743 HE21 GLN 95 HE21 GLN 95 -26.732 1.940 -21.365 744 HE22 GLN 95 HE22 GLN 95 -27.426 0.801 -22.463 745 H VAL 96 H VAL 96 -25.975 1.176 -18.193 746 HA VAL 96 HA VAL 96 -25.292 -0.919 -16.479 747 HB VAL 96 HB VAL 96 -28.074 -0.304 -17.478 748 HG11 VAL 96 HG11 VAL 96 -26.969 -1.778 -15.116 749 HG12 VAL 96 HG12 VAL 96 -28.570 -1.039 -15.053 750 HG13 VAL 96 HG13 VAL 96 -28.217 -2.278 -16.258 751 HG21 VAL 96 HG21 VAL 96 -26.332 1.082 -15.480 752 HG22 VAL 96 HG22 VAL 96 -27.368 1.772 -16.730 753 HG23 VAL 96 HG23 VAL 96 -28.084 1.074 -15.277 754 H GLU 97 H GLU 97 -26.068 -0.962 -19.809 755 HA GLU 97 HA GLU 97 -27.110 -3.607 -19.969 756 HB2 GLU 97 HB2 GLU 97 -27.426 -1.830 -21.707 757 HB3 GLU 97 HB3 GLU 97 -25.734 -2.024 -22.144 758 HG2 GLU 97 HG2 GLU 97 -26.305 -4.484 -22.531 759 HG3 GLU 97 HG3 GLU 97 -27.989 -3.965 -22.485 760 H LEU 98 H LEU 98 -23.891 -2.208 -20.489 761 HA LEU 98 HA LEU 98 -22.672 -4.717 -21.113 762 HB2 LEU 98 HB2 LEU 98 -21.216 -2.283 -20.135 763 HB3 LEU 98 HB3 LEU 98 -20.639 -3.547 -21.220 764 HG LEU 98 HG LEU 98 -22.855 -1.686 -22.022 765 HD11 LEU 98 HD11 LEU 98 -21.104 -0.345 -23.170 766 HD12 LEU 98 HD12 LEU 98 -19.886 -1.235 -22.258 767 HD13 LEU 98 HD13 LEU 98 -21.058 -0.227 -21.411 768 HD21 LEU 98 HD21 LEU 98 -22.834 -3.113 -23.739 769 HD22 LEU 98 HD22 LEU 98 -21.290 -3.815 -23.254 770 HD23 LEU 98 HD23 LEU 98 -21.324 -2.331 -24.208 771 H ILE 99 H ILE 99 -23.121 -2.815 -18.203 772 HA ILE 99 HA ILE 99 -21.287 -3.979 -16.495 773 HB ILE 99 HB ILE 99 -24.083 -3.018 -15.893 774 HG12 ILE 99 HG12 ILE 99 -21.424 -1.687 -15.357 775 HG13 ILE 99 HG13 ILE 99 -22.382 -1.386 -16.803 776 HG21 ILE 99 HG21 ILE 99 -23.801 -4.130 -13.959 777 HG22 ILE 99 HG22 ILE 99 -22.058 -4.276 -14.178 778 HG23 ILE 99 HG23 ILE 99 -22.745 -2.778 -13.551 779 HD11 ILE 99 HD11 ILE 99 -23.271 0.281 -15.626 780 HD12 ILE 99 HD12 ILE 99 -24.201 -0.977 -14.811 781 HD13 ILE 99 HD13 ILE 99 -22.707 -0.378 -14.090 782 H PHE 100 H PHE 100 -24.654 -5.011 -17.055 783 HA PHE 100 HA PHE 100 -24.498 -7.312 -15.427 784 HB2 PHE 100 HB2 PHE 100 -26.434 -6.080 -17.196 785 HB3 PHE 100 HB3 PHE 100 -26.431 -7.830 -17.385 786 HD1 PHE 100 HD2 PHE 100 -26.139 -5.453 -14.518 787 HD2 PHE 100 HD1 PHE 100 -28.056 -8.876 -16.167 788 HE1 PHE 100 HE2 PHE 100 -27.498 -5.670 -12.478 789 HE2 PHE 100 HE1 PHE 100 -29.419 -9.098 -14.131 790 HZ PHE 100 HZ PHE 100 -29.140 -7.495 -12.282 791 H LEU 101 H LEU 101 -23.657 -6.692 -18.753 792 HA LEU 101 HA LEU 101 -23.577 -9.324 -19.715 793 HB2 LEU 101 HB2 LEU 101 -22.600 -6.712 -20.541 794 HB3 LEU 101 HB3 LEU 101 -21.521 -8.020 -21.020 795 HG LEU 101 HG LEU 101 -23.029 -7.526 -22.826 796 HD11 LEU 101 HD11 LEU 101 -23.279 -9.677 -23.351 797 HD12 LEU 101 HD12 LEU 101 -24.374 -9.968 -22.000 798 HD13 LEU 101 HD13 LEU 101 -22.629 -10.026 -21.749 799 HD21 LEU 101 HD21 LEU 101 -24.991 -6.621 -22.241 800 HD22 LEU 101 HD22 LEU 101 -24.991 -7.407 -20.662 801 HD23 LEU 101 HD23 LEU 101 -25.548 -8.287 -22.086 802 H LEU 102 H LEU 102 -21.586 -7.719 -17.458 803 HA LEU 102 HA LEU 102 -19.277 -9.417 -17.875 804 HB2 LEU 102 HB2 LEU 102 -19.970 -7.210 -15.978 805 HB3 LEU 102 HB3 LEU 102 -18.590 -8.258 -15.654 806 HG LEU 102 HG LEU 102 -18.724 -6.986 -18.330 807 HD11 LEU 102 HD11 LEU 102 -18.849 -5.467 -15.873 808 HD12 LEU 102 HD12 LEU 102 -18.943 -4.918 -17.546 809 HD13 LEU 102 HD13 LEU 102 -17.371 -5.131 -16.776 810 HD21 LEU 102 HD21 LEU 102 -16.575 -7.562 -18.364 811 HD22 LEU 102 HD22 LEU 102 -16.873 -8.448 -16.868 812 HD23 LEU 102 HD23 LEU 102 -16.271 -6.791 -16.807 813 H GLU 103 H GLU 103 -21.992 -9.159 -15.658 814 HA GLU 103 HA GLU 103 -21.366 -10.686 -13.541 815 HB2 GLU 103 HB2 GLU 103 -23.761 -9.979 -14.855 816 HB3 GLU 103 HB3 GLU 103 -23.852 -11.710 -14.561 817 HG2 GLU 103 HG2 GLU 103 -22.908 -10.134 -12.279 818 HG3 GLU 103 HG3 GLU 103 -24.562 -9.792 -12.784 819 HA PRO 104 HA PRO 104 -22.033 -14.842 -15.915 820 HB2 PRO 104 HB2 PRO 104 -22.251 -14.709 -18.618 821 HB3 PRO 104 HB3 PRO 104 -23.644 -14.604 -17.536 822 HG2 PRO 104 HG2 PRO 104 -22.135 -12.407 -18.899 823 HG3 PRO 104 HG3 PRO 104 -23.886 -12.607 -18.703 824 HD2 PRO 104 HD2 PRO 104 -22.424 -10.950 -17.138 825 HD3 PRO 104 HD3 PRO 104 -23.863 -11.804 -16.542 826 H PHE 105 H PHE 105 -20.193 -12.315 -17.541 827 HA PHE 105 HA PHE 105 -18.267 -13.899 -18.797 828 HB2 PHE 105 HB2 PHE 105 -18.751 -11.220 -18.641 829 HB3 PHE 105 HB3 PHE 105 -17.287 -11.357 -17.672 830 HD1 PHE 105 HD2 PHE 105 -18.729 -12.115 -20.996 831 HD2 PHE 105 HD1 PHE 105 -15.193 -11.607 -18.683 832 HE1 PHE 105 HE2 PHE 105 -17.380 -12.173 -23.053 833 HE2 PHE 105 HE1 PHE 105 -13.838 -11.663 -20.736 834 HZ PHE 105 HZ PHE 105 -14.931 -11.947 -22.924 835 H ILE 106 H ILE 106 -18.548 -12.817 -15.478 836 HA ILE 106 HA ILE 106 -15.969 -13.297 -14.560 837 HB ILE 106 HB ILE 106 -18.555 -13.739 -13.062 838 HG12 ILE 106 HG12 ILE 106 -16.789 -11.307 -12.913 839 HG13 ILE 106 HG13 ILE 106 -18.050 -11.440 -14.134 840 HG21 ILE 106 HG21 ILE 106 -16.772 -14.810 -11.887 841 HG22 ILE 106 HG22 ILE 106 -15.718 -13.413 -12.106 842 HG23 ILE 106 HG23 ILE 106 -17.131 -13.296 -11.057 843 HD11 ILE 106 HD11 ILE 106 -18.247 -10.776 -11.330 844 HD12 ILE 106 HD12 ILE 106 -19.414 -10.551 -12.633 845 HD13 ILE 106 HD13 ILE 106 -19.334 -12.090 -11.777 846 H ALA 107 H ALA 107 -18.491 -15.526 -15.410 847 HA ALA 107 HA ALA 107 -17.589 -17.795 -14.005 848 HB1 ALA 107 HB1 ALA 107 -19.198 -18.954 -15.127 849 HB2 ALA 107 HB2 ALA 107 -19.788 -17.313 -15.395 850 HB3 ALA 107 HB3 ALA 107 -18.876 -18.140 -16.658 851 H SER 108 H SER 108 -16.632 -16.367 -17.058 852 HA SER 108 HA SER 108 -15.163 -18.569 -18.055 853 HB2 SER 108 HB2 SER 108 -15.362 -17.146 -19.798 854 HB3 SER 108 HB3 SER 108 -15.527 -15.741 -18.745 855 HG SER 108 HG SER 108 -13.137 -17.014 -19.581 856 H LEU 109 H LEU 109 -14.086 -15.603 -16.396 857 HA LEU 109 HA LEU 109 -11.526 -16.926 -15.826 858 HB2 LEU 109 HB2 LEU 109 -10.867 -14.548 -15.143 859 HB3 LEU 109 HB3 LEU 109 -11.066 -14.901 -16.858 860 HG LEU 109 HG LEU 109 -13.511 -13.895 -15.654 861 HD11 LEU 109 HD11 LEU 109 -12.165 -11.516 -15.811 862 HD12 LEU 109 HD12 LEU 109 -11.003 -12.561 -14.995 863 HD13 LEU 109 HD13 LEU 109 -12.617 -12.344 -14.320 864 HD21 LEU 109 HD21 LEU 109 -13.298 -12.310 -17.569 865 HD22 LEU 109 HD22 LEU 109 -13.242 -14.013 -18.026 866 HD23 LEU 109 HD23 LEU 109 -11.754 -13.068 -17.957 867 H LYS 110 H LYS 110 -12.009 -18.144 -14.036 868 HA LYS 110 HA LYS 110 -12.492 -16.622 -11.582 869 HB2 LYS 110 HB2 LYS 110 -14.093 -18.277 -10.766 870 HB3 LYS 110 HB3 LYS 110 -14.670 -17.533 -12.252 871 HG2 LYS 110 HG2 LYS 110 -15.069 -19.618 -12.926 872 HG3 LYS 110 HG3 LYS 110 -13.326 -19.720 -13.190 873 HD2 LYS 110 HD2 LYS 110 -13.299 -21.410 -11.739 874 HD3 LYS 110 HD3 LYS 110 -13.672 -20.238 -10.473 875 HE2 LYS 110 HE2 LYS 110 -16.135 -20.610 -11.335 876 HE3 LYS 110 HE3 LYS 110 -15.465 -22.139 -11.902 877 HZ1 LYS 110 HZ1 LYS 110 -16.374 -22.413 -9.711 878 HZ2 LYS 110 HZ2 LYS 110 -15.445 -21.135 -9.107 879 HZ3 LYS 110 HZ3 LYS 110 -14.691 -22.559 -9.623 Start of MODEL 17 1 H1 MET 1 H MET 1 3.177 -1.432 0.241 2 HA MET 1 HA MET 1 1.723 0.012 -0.788 3 HB2 MET 1 HB2 MET 1 4.078 0.492 -2.613 4 HB3 MET 1 HB3 MET 1 2.520 1.277 -2.832 5 HG2 MET 1 HG2 MET 1 2.887 2.736 -1.185 6 HG3 MET 1 HG3 MET 1 3.584 1.512 -0.126 7 HE1 MET 1 HE1 MET 1 6.293 4.313 -0.203 8 HE2 MET 1 HE2 MET 1 4.716 4.810 -0.816 9 HE3 MET 1 HE3 MET 1 4.821 3.737 0.581 10 H SER 2 H SER 2 1.053 -2.406 -1.105 11 HA SER 2 HA SER 2 0.469 -2.730 -3.967 12 HB2 SER 2 HB2 SER 2 1.076 -5.076 -2.166 13 HB3 SER 2 HB3 SER 2 0.921 -5.067 -3.922 14 HG SER 2 HG SER 2 2.945 -3.719 -2.457 15 H LEU 3 H LEU 3 -1.526 -3.664 -4.456 16 HA LEU 3 HA LEU 3 -3.411 -3.740 -2.198 17 HB2 LEU 3 HB2 LEU 3 -3.737 -3.023 -5.091 18 HB3 LEU 3 HB3 LEU 3 -5.124 -3.457 -4.094 19 HG LEU 3 HG LEU 3 -3.363 -1.329 -3.037 20 HD11 LEU 3 HD11 LEU 3 -4.974 0.184 -4.571 21 HD12 LEU 3 HD12 LEU 3 -4.687 -1.170 -5.664 22 HD13 LEU 3 HD13 LEU 3 -3.325 -0.256 -5.017 23 HD21 LEU 3 HD21 LEU 3 -5.296 -1.922 -1.783 24 HD22 LEU 3 HD22 LEU 3 -6.330 -1.820 -3.208 25 HD23 LEU 3 HD23 LEU 3 -5.619 -0.356 -2.528 26 H LYS 4 H LYS 4 -4.787 -5.456 -1.928 27 HA LYS 4 HA LYS 4 -3.959 -7.989 -2.753 28 HB2 LYS 4 HB2 LYS 4 -5.714 -7.063 -0.902 29 HB3 LYS 4 HB3 LYS 4 -6.827 -7.696 -2.108 30 HG2 LYS 4 HG2 LYS 4 -6.563 -9.645 -1.063 31 HG3 LYS 4 HG3 LYS 4 -5.005 -9.722 -1.889 32 HD2 LYS 4 HD2 LYS 4 -3.838 -9.306 0.001 33 HD3 LYS 4 HD3 LYS 4 -5.046 -8.179 0.623 34 HE2 LYS 4 HE2 LYS 4 -5.051 -10.044 2.083 35 HE3 LYS 4 HE3 LYS 4 -6.502 -10.183 1.092 36 HZ1 LYS 4 HZ1 LYS 4 -5.513 -11.866 -0.205 37 HZ2 LYS 4 HZ2 LYS 4 -5.190 -12.279 1.403 38 HZ3 LYS 4 HZ3 LYS 4 -3.976 -11.592 0.447 39 H SER 5 H SER 5 -6.375 -5.812 -4.107 40 HA SER 5 HA SER 5 -7.660 -7.504 -5.875 41 HB2 SER 5 HB2 SER 5 -7.852 -5.359 -7.324 42 HB3 SER 5 HB3 SER 5 -8.569 -5.350 -5.712 43 HG SER 5 HG SER 5 -5.916 -4.541 -5.918 44 H ASP 6 H ASP 6 -4.461 -6.155 -6.041 45 HA ASP 6 HA ASP 6 -3.895 -6.377 -8.748 46 HB2 ASP 6 HB2 ASP 6 -2.461 -5.574 -6.649 47 HB3 ASP 6 HB3 ASP 6 -1.786 -7.193 -6.810 48 H GLU 7 H GLU 7 -3.865 -8.849 -6.232 49 HA GLU 7 HA GLU 7 -2.667 -10.910 -7.705 50 HB2 GLU 7 HB2 GLU 7 -4.068 -10.634 -5.195 51 HB3 GLU 7 HB3 GLU 7 -4.554 -12.114 -6.009 52 HG2 GLU 7 HG2 GLU 7 -1.852 -12.191 -6.308 53 HG3 GLU 7 HG3 GLU 7 -2.019 -11.409 -4.737 54 H VAL 8 H VAL 8 -6.059 -9.948 -7.390 55 HA VAL 8 HA VAL 8 -7.053 -12.079 -9.017 56 HB VAL 8 HB VAL 8 -8.389 -9.471 -8.276 57 HG11 VAL 8 HG11 VAL 8 -9.161 -11.391 -10.138 58 HG12 VAL 8 HG12 VAL 8 -10.127 -11.737 -8.702 59 HG13 VAL 8 HG13 VAL 8 -10.172 -10.131 -9.431 60 HG21 VAL 8 HG21 VAL 8 -8.551 -12.179 -6.956 61 HG22 VAL 8 HG22 VAL 8 -7.719 -10.765 -6.309 62 HG23 VAL 8 HG23 VAL 8 -9.473 -10.747 -6.498 63 H PHE 9 H PHE 9 -6.350 -8.647 -9.561 64 HA PHE 9 HA PHE 9 -7.274 -8.540 -12.221 65 HB2 PHE 9 HB2 PHE 9 -5.543 -6.847 -10.495 66 HB3 PHE 9 HB3 PHE 9 -5.432 -6.596 -12.234 67 HD1 PHE 9 HD1 PHE 9 -8.067 -6.832 -13.242 68 HD2 PHE 9 HD2 PHE 9 -6.795 -5.194 -9.525 69 HE1 PHE 9 HE1 PHE 9 -10.091 -5.435 -13.170 70 HE2 PHE 9 HE2 PHE 9 -8.817 -3.795 -9.446 71 HZ PHE 9 HZ PHE 9 -10.468 -3.914 -11.270 72 H ALA 10 H ALA 10 -4.173 -9.413 -10.814 73 HA ALA 10 HA ALA 10 -2.696 -9.472 -13.228 74 HB1 ALA 10 HB1 ALA 10 -1.701 -9.381 -10.951 75 HB2 ALA 10 HB2 ALA 10 -2.163 -11.069 -10.728 76 HB3 ALA 10 HB3 ALA 10 -1.005 -10.630 -11.984 77 H LYS 11 H LYS 11 -4.308 -12.038 -11.363 78 HA LYS 11 HA LYS 11 -3.655 -14.133 -13.144 79 HB2 LYS 11 HB2 LYS 11 -5.387 -15.412 -11.962 80 HB3 LYS 11 HB3 LYS 11 -4.332 -14.563 -10.839 81 HG2 LYS 11 HG2 LYS 11 -6.021 -12.843 -10.525 82 HG3 LYS 11 HG3 LYS 11 -7.075 -13.651 -11.688 83 HD2 LYS 11 HD2 LYS 11 -7.751 -14.195 -9.421 84 HD3 LYS 11 HD3 LYS 11 -7.129 -15.634 -10.231 85 HE2 LYS 11 HE2 LYS 11 -5.557 -15.893 -8.681 86 HE3 LYS 11 HE3 LYS 11 -4.995 -14.238 -8.908 87 HZ1 LYS 11 HZ1 LYS 11 -5.732 -13.915 -6.845 88 HZ2 LYS 11 HZ2 LYS 11 -6.645 -15.339 -6.832 89 HZ3 LYS 11 HZ3 LYS 11 -7.291 -13.927 -7.504 90 H ILE 12 H ILE 12 -6.416 -11.949 -12.918 91 HA ILE 12 HA ILE 12 -8.065 -13.204 -14.813 92 HB ILE 12 HB ILE 12 -7.880 -10.351 -13.879 93 HG12 ILE 12 HG12 ILE 12 -10.121 -12.348 -13.560 94 HG13 ILE 12 HG13 ILE 12 -8.789 -12.229 -12.415 95 HG21 ILE 12 HG21 ILE 12 -9.532 -11.510 -16.077 96 HG22 ILE 12 HG22 ILE 12 -10.198 -10.224 -15.071 97 HG23 ILE 12 HG23 ILE 12 -8.716 -9.949 -15.987 98 HD11 ILE 12 HD11 ILE 12 -10.772 -11.015 -11.666 99 HD12 ILE 12 HD12 ILE 12 -9.396 -9.939 -11.915 100 HD13 ILE 12 HD13 ILE 12 -10.692 -10.004 -13.109 101 H ALA 13 H ALA 13 -5.753 -10.522 -15.189 102 HA ALA 13 HA ALA 13 -6.090 -10.019 -17.886 103 HB1 ALA 13 HB1 ALA 13 -3.440 -9.940 -16.458 104 HB2 ALA 13 HB2 ALA 13 -3.938 -8.990 -17.858 105 HB3 ALA 13 HB3 ALA 13 -4.687 -8.705 -16.287 106 H LYS 14 H LYS 14 -3.924 -12.376 -16.345 107 HA LYS 14 HA LYS 14 -2.642 -13.335 -18.611 108 HB2 LYS 14 HB2 LYS 14 -1.877 -13.989 -16.435 109 HB3 LYS 14 HB3 LYS 14 -3.420 -14.744 -16.057 110 HG2 LYS 14 HG2 LYS 14 -2.900 -16.646 -17.128 111 HG3 LYS 14 HG3 LYS 14 -2.068 -15.805 -18.438 112 HD2 LYS 14 HD2 LYS 14 -0.199 -15.366 -16.787 113 HD3 LYS 14 HD3 LYS 14 -1.005 -16.510 -15.711 114 HE2 LYS 14 HE2 LYS 14 -0.803 -18.259 -17.379 115 HE3 LYS 14 HE3 LYS 14 -0.086 -17.121 -18.519 116 HZ1 LYS 14 HZ1 LYS 14 1.718 -16.804 -16.827 117 HZ2 LYS 14 HZ2 LYS 14 1.679 -18.327 -17.562 118 HZ3 LYS 14 HZ3 LYS 14 1.084 -18.130 -15.991 119 H ARG 15 H ARG 15 -5.790 -14.183 -17.274 120 HA ARG 15 HA ARG 15 -6.287 -16.392 -18.974 121 HB2 ARG 15 HB2 ARG 15 -7.495 -15.630 -16.789 122 HB3 ARG 15 HB3 ARG 15 -8.480 -14.664 -17.880 123 HG2 ARG 15 HG2 ARG 15 -8.121 -17.546 -18.499 124 HG3 ARG 15 HG3 ARG 15 -9.182 -17.098 -17.162 125 HD2 ARG 15 HD2 ARG 15 -10.399 -15.584 -18.707 126 HD3 ARG 15 HD3 ARG 15 -9.393 -16.180 -20.026 127 HE ARG 15 HE ARG 15 -11.659 -17.473 -18.893 128 HH11 ARG 15 HH11 ARG 15 -8.549 -18.068 -20.340 129 HH12 ARG 15 HH12 ARG 15 -8.978 -19.640 -20.928 130 HH21 ARG 15 HH21 ARG 15 -12.236 -19.541 -19.662 131 HH22 ARG 15 HH22 ARG 15 -11.076 -20.477 -20.543 132 H LEU 16 H LEU 16 -6.867 -12.937 -19.269 133 HA LEU 16 HA LEU 16 -8.573 -12.953 -21.480 134 HB2 LEU 16 HB2 LEU 16 -6.447 -10.890 -20.961 135 HB3 LEU 16 HB3 LEU 16 -7.982 -10.671 -21.798 136 HG LEU 16 HG LEU 16 -7.548 -11.071 -18.843 137 HD11 LEU 16 HD11 LEU 16 -7.241 -8.797 -20.066 138 HD12 LEU 16 HD12 LEU 16 -8.180 -8.871 -18.575 139 HD13 LEU 16 HD13 LEU 16 -9.004 -8.805 -20.132 140 HD21 LEU 16 HD21 LEU 16 -9.509 -12.333 -19.554 141 HD22 LEU 16 HD22 LEU 16 -10.141 -10.907 -20.377 142 HD23 LEU 16 HD23 LEU 16 -9.978 -10.912 -18.620 143 H GLU 17 H GLU 17 -5.222 -13.674 -21.238 144 HA GLU 17 HA GLU 17 -4.549 -13.136 -23.969 145 HB2 GLU 17 HB2 GLU 17 -3.119 -14.916 -21.989 146 HB3 GLU 17 HB3 GLU 17 -2.452 -14.260 -23.477 147 HG2 GLU 17 HG2 GLU 17 -3.074 -11.966 -22.365 148 HG3 GLU 17 HG3 GLU 17 -2.987 -12.915 -20.882 149 H SER 18 H SER 18 -6.183 -15.649 -22.357 150 HA SER 18 HA SER 18 -5.576 -17.655 -24.376 151 HB2 SER 18 HB2 SER 18 -5.994 -17.989 -21.778 152 HB3 SER 18 HB3 SER 18 -7.677 -18.076 -22.294 153 HG SER 18 HG SER 18 -6.599 -20.129 -22.263 154 H ILE 19 H ILE 19 -7.724 -15.120 -23.997 155 HA ILE 19 HA ILE 19 -10.140 -16.116 -24.973 156 HB ILE 19 HB ILE 19 -8.956 -13.376 -25.439 157 HG12 ILE 19 HG12 ILE 19 -10.850 -14.336 -23.283 158 HG13 ILE 19 HG13 ILE 19 -9.131 -14.037 -23.049 159 HG21 ILE 19 HG21 ILE 19 -10.757 -13.716 -26.965 160 HG22 ILE 19 HG22 ILE 19 -11.768 -14.418 -25.704 161 HG23 ILE 19 HG23 ILE 19 -11.357 -12.704 -25.652 162 HD11 ILE 19 HD11 ILE 19 -9.520 -11.674 -23.700 163 HD12 ILE 19 HD12 ILE 19 -11.250 -12.020 -23.736 164 HD13 ILE 19 HD13 ILE 19 -10.352 -12.165 -22.225 165 H ASP 20 H ASP 20 -11.021 -16.312 -27.015 166 HA ASP 20 HA ASP 20 -9.102 -16.195 -29.250 167 HB2 ASP 20 HB2 ASP 20 -10.597 -18.404 -28.271 168 HB3 ASP 20 HB3 ASP 20 -11.265 -17.969 -29.842 169 HA PRO 21 HA PRO 21 -11.823 -13.458 -31.342 170 HB2 PRO 21 HB2 PRO 21 -11.318 -14.121 -33.925 171 HB3 PRO 21 HB3 PRO 21 -10.170 -13.227 -32.921 172 HG2 PRO 21 HG2 PRO 21 -10.227 -16.143 -33.596 173 HG3 PRO 21 HG3 PRO 21 -8.844 -15.033 -33.542 174 HD2 PRO 21 HD2 PRO 21 -9.404 -16.761 -31.534 175 HD3 PRO 21 HD3 PRO 21 -8.659 -15.175 -31.249 176 H ALA 22 H ALA 22 -12.018 -16.891 -32.003 177 HA ALA 22 HA ALA 22 -14.296 -16.948 -33.620 178 HB1 ALA 22 HB1 ALA 22 -12.971 -18.918 -33.374 179 HB2 ALA 22 HB2 ALA 22 -13.259 -18.961 -31.634 180 HB3 ALA 22 HB3 ALA 22 -14.584 -19.274 -32.755 181 H ASN 23 H ASN 23 -14.077 -17.372 -30.082 182 HA ASN 23 HA ASN 23 -16.956 -16.845 -29.897 183 HB2 ASN 23 HB2 ASN 23 -15.047 -18.454 -28.359 184 HB3 ASN 23 HB3 ASN 23 -16.130 -17.496 -27.353 185 HD21 ASN 23 HD21 ASN 23 -15.974 -19.927 -29.871 186 HD22 ASN 23 HD22 ASN 23 -17.541 -20.597 -29.583 187 H ARG 24 H ARG 24 -17.528 -14.818 -29.510 188 HA ARG 24 HA ARG 24 -16.691 -13.341 -27.294 189 HB2 ARG 24 HB2 ARG 24 -14.908 -13.153 -29.533 190 HB3 ARG 24 HB3 ARG 24 -15.681 -11.594 -29.278 191 HG2 ARG 24 HG2 ARG 24 -14.912 -11.526 -27.002 192 HG3 ARG 24 HG3 ARG 24 -14.259 -13.160 -27.137 193 HD2 ARG 24 HD2 ARG 24 -12.553 -12.476 -28.594 194 HD3 ARG 24 HD3 ARG 24 -13.355 -10.947 -28.951 195 HE ARG 24 HE ARG 24 -12.602 -11.255 -26.192 196 HH11 ARG 24 HH11 ARG 24 -11.570 -10.224 -29.353 197 HH12 ARG 24 HH12 ARG 24 -10.350 -9.153 -28.748 198 HH21 ARG 24 HH21 ARG 24 -10.999 -9.847 -25.383 199 HH22 ARG 24 HH22 ARG 24 -10.025 -8.940 -26.490 200 H GLN 25 H GLN 25 -18.917 -13.034 -27.160 201 HA GLN 25 HA GLN 25 -20.487 -11.951 -29.255 202 HB2 GLN 25 HB2 GLN 25 -20.878 -12.381 -26.322 203 HB3 GLN 25 HB3 GLN 25 -22.024 -11.376 -27.199 204 HG2 GLN 25 HG2 GLN 25 -22.599 -13.829 -26.927 205 HG3 GLN 25 HG3 GLN 25 -22.725 -13.148 -28.548 206 HE21 GLN 25 HE21 GLN 25 -20.471 -14.874 -26.434 207 HE22 GLN 25 HE22 GLN 25 -19.754 -15.826 -27.684 208 H VAL 26 H VAL 26 -19.818 -10.402 -26.118 209 HA VAL 26 HA VAL 26 -19.515 -7.844 -27.554 210 HB VAL 26 HB VAL 26 -21.643 -8.113 -26.175 211 HG11 VAL 26 HG11 VAL 26 -19.932 -7.522 -23.797 212 HG12 VAL 26 HG12 VAL 26 -21.583 -8.140 -23.866 213 HG13 VAL 26 HG13 VAL 26 -20.229 -9.193 -24.275 214 HG21 VAL 26 HG21 VAL 26 -21.644 -5.840 -25.549 215 HG22 VAL 26 HG22 VAL 26 -19.900 -5.829 -25.285 216 HG23 VAL 26 HG23 VAL 26 -20.543 -5.949 -26.923 217 H GLU 27 H GLU 27 -17.851 -6.524 -26.970 218 HA GLU 27 HA GLU 27 -16.305 -7.064 -24.579 219 HB2 GLU 27 HB2 GLU 27 -15.387 -7.785 -27.305 220 HB3 GLU 27 HB3 GLU 27 -14.214 -6.981 -26.271 221 HG2 GLU 27 HG2 GLU 27 -15.736 -9.456 -25.492 222 HG3 GLU 27 HG3 GLU 27 -14.122 -9.461 -26.200 223 H HIS 28 H HIS 28 -15.863 -5.158 -23.715 224 HA HIS 28 HA HIS 28 -15.046 -2.942 -25.437 225 HB2 HIS 28 HB2 HIS 28 -17.519 -3.053 -23.812 226 HB3 HIS 28 HB3 HIS 28 -16.585 -1.564 -23.695 227 HD1 HIS 28 HD1 HIS 28 -15.685 -1.229 -26.592 228 HD2 HIS 28 HD2 HIS 28 -19.532 -2.345 -25.489 229 HE1 HIS 28 HE1 HIS 28 -17.151 -0.597 -28.534 230 H VAL 29 H VAL 29 -14.330 -1.028 -24.018 231 HA VAL 29 HA VAL 29 -12.399 -2.043 -22.142 232 HB VAL 29 HB VAL 29 -13.008 0.834 -22.829 233 HG11 VAL 29 HG11 VAL 29 -11.312 -0.326 -20.893 234 HG12 VAL 29 HG12 VAL 29 -10.280 0.315 -22.173 235 HG13 VAL 29 HG13 VAL 29 -11.435 1.370 -21.358 236 HG21 VAL 29 HG21 VAL 29 -12.461 -0.253 -24.869 237 HG22 VAL 29 HG22 VAL 29 -11.006 0.592 -24.338 238 HG23 VAL 29 HG23 VAL 29 -11.144 -1.152 -24.114 239 H TYR 30 H TYR 30 -12.452 -1.968 -19.971 240 HA TYR 30 HA TYR 30 -14.701 -0.549 -18.700 241 HB2 TYR 30 HB2 TYR 30 -13.562 -3.263 -18.014 242 HB3 TYR 30 HB3 TYR 30 -14.682 -2.383 -16.981 243 HD1 TYR 30 HD2 TYR 30 -14.311 -4.137 -20.197 244 HD2 TYR 30 HD1 TYR 30 -17.020 -2.268 -17.500 245 HE1 TYR 30 HE2 TYR 30 -16.203 -5.100 -21.439 246 HE2 TYR 30 HE1 TYR 30 -18.919 -3.228 -18.733 247 HH TYR 30 HH TYR 30 -18.405 -5.337 -21.546 248 H LYS 31 H LYS 31 -14.258 0.647 -16.920 249 HA LYS 31 HA LYS 31 -11.431 0.897 -16.182 250 HB2 LYS 31 HB2 LYS 31 -13.698 2.751 -16.369 251 HB3 LYS 31 HB3 LYS 31 -12.731 2.957 -14.915 252 HG2 LYS 31 HG2 LYS 31 -10.848 2.733 -16.920 253 HG3 LYS 31 HG3 LYS 31 -12.142 3.681 -17.658 254 HD2 LYS 31 HD2 LYS 31 -10.776 5.289 -16.660 255 HD3 LYS 31 HD3 LYS 31 -12.081 5.066 -15.492 256 HE2 LYS 31 HE2 LYS 31 -10.658 4.376 -13.925 257 HE3 LYS 31 HE3 LYS 31 -9.929 3.201 -15.018 258 HZ1 LYS 31 HZ1 LYS 31 -8.936 5.730 -14.177 259 HZ2 LYS 31 HZ2 LYS 31 -9.004 5.643 -15.865 260 HZ3 LYS 31 HZ3 LYS 31 -8.136 4.483 -14.992 261 H PHE 32 H PHE 32 -10.701 0.521 -14.156 262 HA PHE 32 HA PHE 32 -12.690 -0.310 -12.146 263 HB2 PHE 32 HB2 PHE 32 -9.890 -1.398 -12.514 264 HB3 PHE 32 HB3 PHE 32 -11.051 -1.916 -11.295 265 HD1 PHE 32 HD2 PHE 32 -13.407 -2.638 -12.342 266 HD2 PHE 32 HD1 PHE 32 -9.666 -2.712 -14.370 267 HE1 PHE 32 HE2 PHE 32 -14.289 -4.325 -13.901 268 HE2 PHE 32 HE1 PHE 32 -10.543 -4.399 -15.933 269 HZ PHE 32 HZ PHE 32 -12.857 -5.208 -15.699 270 H ARG 33 H ARG 33 -12.652 0.725 -10.255 271 HA ARG 33 HA ARG 33 -10.358 2.485 -9.698 272 HB2 ARG 33 HB2 ARG 33 -13.292 2.755 -9.101 273 HB3 ARG 33 HB3 ARG 33 -12.095 3.666 -8.191 274 HG2 ARG 33 HG2 ARG 33 -11.341 4.778 -10.172 275 HG3 ARG 33 HG3 ARG 33 -12.356 3.752 -11.187 276 HD2 ARG 33 HD2 ARG 33 -14.159 5.021 -10.836 277 HD3 ARG 33 HD3 ARG 33 -13.866 5.093 -9.099 278 HE ARG 33 HE ARG 33 -12.951 7.160 -9.398 279 HH11 ARG 33 HH11 ARG 33 -12.921 5.480 -12.447 280 HH12 ARG 33 HH12 ARG 33 -12.342 6.846 -13.342 281 HH21 ARG 33 HH21 ARG 33 -12.190 8.965 -10.565 282 HH22 ARG 33 HH22 ARG 33 -11.926 8.828 -12.270 283 H ILE 34 H ILE 34 -9.072 1.756 -8.148 284 HA ILE 34 HA ILE 34 -10.097 -0.117 -6.162 285 HB ILE 34 HB ILE 34 -7.269 0.819 -6.665 286 HG12 ILE 34 HG12 ILE 34 -8.224 -0.501 -8.521 287 HG13 ILE 34 HG13 ILE 34 -6.937 -1.372 -7.694 288 HG21 ILE 34 HG21 ILE 34 -7.192 0.124 -4.475 289 HG22 ILE 34 HG22 ILE 34 -8.476 -1.063 -4.693 290 HG23 ILE 34 HG23 ILE 34 -6.861 -1.387 -5.321 291 HD11 ILE 34 HD11 ILE 34 -9.524 -2.261 -8.247 292 HD12 ILE 34 HD12 ILE 34 -8.293 -3.064 -7.272 293 HD13 ILE 34 HD13 ILE 34 -9.468 -1.996 -6.505 294 H THR 35 H THR 35 -10.804 0.579 -4.267 295 HA THR 35 HA THR 35 -9.707 3.093 -3.186 296 HB THR 35 HB THR 35 -11.781 3.575 -2.149 297 HG1 THR 35 HG1 THR 35 -13.531 2.022 -2.271 298 HG21 THR 35 HG21 THR 35 -13.121 2.569 -4.521 299 HG22 THR 35 HG22 THR 35 -11.572 3.320 -4.903 300 HG23 THR 35 HG23 THR 35 -12.802 4.231 -4.027 301 H GLN 36 H GLN 36 -9.243 3.212 -0.978 302 HA GLN 36 HA GLN 36 -8.773 0.610 0.279 303 HB2 GLN 36 HB2 GLN 36 -7.491 3.279 0.440 304 HB3 GLN 36 HB3 GLN 36 -7.510 2.325 1.918 305 HG2 GLN 36 HG2 GLN 36 -6.708 0.658 -0.251 306 HG3 GLN 36 HG3 GLN 36 -5.742 2.133 -0.265 307 HE21 GLN 36 HE21 GLN 36 -4.976 -0.616 0.364 308 HE22 GLN 36 HE22 GLN 36 -4.314 -0.572 1.959 309 H GLY 37 H GLY 37 -10.624 0.027 1.304 310 HA2 GLY 37 HA2 GLY 37 -12.045 -0.034 3.129 311 HA3 GLY 37 HA3 GLY 37 -11.312 1.458 3.702 312 H GLY 38 H GLY 38 -11.852 2.787 1.088 313 HA2 GLY 38 HA2 GLY 38 -14.447 2.847 0.265 314 HA3 GLY 38 HA3 GLY 38 -14.475 3.759 1.767 315 H LYS 39 H LYS 39 -11.489 4.319 0.719 316 HA LYS 39 HA LYS 39 -12.308 6.695 -0.818 317 HB2 LYS 39 HB2 LYS 39 -9.935 7.482 -0.006 318 HB3 LYS 39 HB3 LYS 39 -11.331 7.605 1.057 319 HG2 LYS 39 HG2 LYS 39 -10.649 5.820 2.371 320 HG3 LYS 39 HG3 LYS 39 -9.581 5.180 1.120 321 HD2 LYS 39 HD2 LYS 39 -9.121 7.817 2.502 322 HD3 LYS 39 HD3 LYS 39 -8.429 6.294 3.065 323 HE2 LYS 39 HE2 LYS 39 -6.775 6.477 1.595 324 HE3 LYS 39 HE3 LYS 39 -7.935 6.550 0.269 325 HZ1 LYS 39 HZ1 LYS 39 -8.133 8.949 0.668 326 HZ2 LYS 39 HZ2 LYS 39 -6.554 8.501 0.258 327 HZ3 LYS 39 HZ3 LYS 39 -6.944 8.849 1.867 328 H VAL 40 H VAL 40 -11.667 6.816 -2.863 329 HA VAL 40 HA VAL 40 -10.323 4.812 -4.218 330 HB VAL 40 HB VAL 40 -10.712 7.719 -4.893 331 HG11 VAL 40 HG11 VAL 40 -9.295 5.590 -6.468 332 HG12 VAL 40 HG12 VAL 40 -10.047 6.987 -7.241 333 HG13 VAL 40 HG13 VAL 40 -8.745 7.218 -6.074 334 HG21 VAL 40 HG21 VAL 40 -12.715 6.361 -4.892 335 HG22 VAL 40 HG22 VAL 40 -12.286 6.785 -6.549 336 HG23 VAL 40 HG23 VAL 40 -11.940 5.168 -5.936 337 H VAL 41 H VAL 41 -8.244 4.310 -4.595 338 HA VAL 41 HA VAL 41 -6.182 6.175 -3.614 339 HB VAL 41 HB VAL 41 -6.354 4.236 -2.132 340 HG11 VAL 41 HG11 VAL 41 -7.222 2.497 -3.406 341 HG12 VAL 41 HG12 VAL 41 -6.037 2.717 -4.694 342 HG13 VAL 41 HG13 VAL 41 -5.547 2.009 -3.155 343 HG21 VAL 41 HG21 VAL 41 -3.843 3.621 -3.553 344 HG22 VAL 41 HG22 VAL 41 -4.089 5.310 -3.109 345 HG23 VAL 41 HG23 VAL 41 -4.116 4.058 -1.866 346 H LYS 42 H LYS 42 -7.359 4.293 -6.200 347 HA LYS 42 HA LYS 42 -5.492 5.345 -8.039 348 HB2 LYS 42 HB2 LYS 42 -4.429 3.222 -6.676 349 HB3 LYS 42 HB3 LYS 42 -5.122 2.429 -8.084 350 HG2 LYS 42 HG2 LYS 42 -3.852 3.919 -9.548 351 HG3 LYS 42 HG3 LYS 42 -3.151 4.706 -8.132 352 HD2 LYS 42 HD2 LYS 42 -2.900 1.760 -8.282 353 HD3 LYS 42 HD3 LYS 42 -1.947 2.699 -9.434 354 HE2 LYS 42 HE2 LYS 42 -0.457 2.712 -7.733 355 HE3 LYS 42 HE3 LYS 42 -1.429 4.083 -7.199 356 HZ1 LYS 42 HZ1 LYS 42 -2.720 1.931 -6.156 357 HZ2 LYS 42 HZ2 LYS 42 -1.665 2.950 -5.314 358 HZ3 LYS 42 HZ3 LYS 42 -1.090 1.509 -5.988 359 H ASN 43 H ASN 43 -5.755 4.302 -10.245 360 HA ASN 43 HA ASN 43 -8.320 2.938 -10.571 361 HB2 ASN 43 HB2 ASN 43 -8.743 4.580 -12.540 362 HB3 ASN 43 HB3 ASN 43 -9.108 5.110 -10.900 363 HD21 ASN 43 HD21 ASN 43 -8.191 6.908 -10.172 364 HD22 ASN 43 HD22 ASN 43 -6.928 7.778 -10.968 365 H TRP 44 H TRP 44 -8.155 1.321 -11.977 366 HA TRP 44 HA TRP 44 -5.840 1.290 -13.790 367 HB2 TRP 44 HB2 TRP 44 -7.442 -0.913 -12.504 368 HB3 TRP 44 HB3 TRP 44 -6.401 -1.221 -13.890 369 HD1 TRP 44 HD1 TRP 44 -6.223 -0.177 -10.197 370 HE1 TRP 44 HE1 TRP 44 -3.836 -0.618 -9.342 371 HE3 TRP 44 HE3 TRP 44 -4.005 -1.476 -14.616 372 HZ2 TRP 44 HZ2 TRP 44 -1.342 -1.411 -10.401 373 HZ3 TRP 44 HZ3 TRP 44 -1.615 -2.062 -14.609 374 HH2 TRP 44 HH2 TRP 44 -0.313 -2.029 -12.544 375 H VAL 45 H VAL 45 -6.126 0.391 -15.928 376 HA VAL 45 HA VAL 45 -8.886 0.568 -16.938 377 HB VAL 45 HB VAL 45 -6.425 1.749 -18.231 378 HG11 VAL 45 HG11 VAL 45 -9.128 1.109 -19.291 379 HG12 VAL 45 HG12 VAL 45 -8.351 2.601 -19.825 380 HG13 VAL 45 HG13 VAL 45 -7.557 1.048 -20.089 381 HG21 VAL 45 HG21 VAL 45 -7.417 3.868 -17.885 382 HG22 VAL 45 HG22 VAL 45 -8.955 3.153 -17.403 383 HG23 VAL 45 HG23 VAL 45 -7.549 3.013 -16.348 384 H MET 46 H MET 46 -9.499 -1.074 -18.202 385 HA MET 46 HA MET 46 -7.476 -3.062 -18.937 386 HB2 MET 46 HB2 MET 46 -9.278 -3.992 -17.670 387 HB3 MET 46 HB3 MET 46 -10.480 -3.213 -18.691 388 HG2 MET 46 HG2 MET 46 -8.686 -4.957 -20.174 389 HG3 MET 46 HG3 MET 46 -9.591 -5.797 -18.917 390 HE1 MET 46 HE1 MET 46 -11.768 -6.179 -18.722 391 HE2 MET 46 HE2 MET 46 -12.803 -4.789 -19.049 392 HE3 MET 46 HE3 MET 46 -12.937 -6.242 -20.041 393 H ASP 47 H ASP 47 -6.742 -3.084 -20.948 394 HA ASP 47 HA ASP 47 -8.150 -1.658 -23.042 395 HB2 ASP 47 HB2 ASP 47 -5.432 -2.390 -22.509 396 HB3 ASP 47 HB3 ASP 47 -5.889 -3.014 -24.091 397 H LEU 48 H LEU 48 -9.757 -2.663 -24.054 398 HA LEU 48 HA LEU 48 -9.845 -5.539 -24.275 399 HB2 LEU 48 HB2 LEU 48 -12.036 -5.298 -24.783 400 HB3 LEU 48 HB3 LEU 48 -11.777 -3.741 -23.999 401 HG LEU 48 HG LEU 48 -13.066 -3.321 -25.934 402 HD11 LEU 48 HD11 LEU 48 -10.465 -2.277 -25.628 403 HD12 LEU 48 HD12 LEU 48 -11.857 -1.527 -26.409 404 HD13 LEU 48 HD13 LEU 48 -10.733 -2.502 -27.357 405 HD21 LEU 48 HD21 LEU 48 -12.959 -4.467 -27.852 406 HD22 LEU 48 HD22 LEU 48 -11.944 -5.597 -26.955 407 HD23 LEU 48 HD23 LEU 48 -11.202 -4.337 -27.942 408 H LYS 49 H LYS 49 -8.666 -2.948 -26.147 409 HA LYS 49 HA LYS 49 -8.942 -4.208 -28.715 410 HB2 LYS 49 HB2 LYS 49 -8.127 -1.649 -27.710 411 HB3 LYS 49 HB3 LYS 49 -6.884 -2.261 -28.794 412 HG2 LYS 49 HG2 LYS 49 -8.217 -2.129 -30.624 413 HG3 LYS 49 HG3 LYS 49 -9.693 -2.453 -29.711 414 HD2 LYS 49 HD2 LYS 49 -9.753 -0.216 -28.877 415 HD3 LYS 49 HD3 LYS 49 -8.144 0.126 -29.517 416 HE2 LYS 49 HE2 LYS 49 -9.285 -0.535 -31.799 417 HE3 LYS 49 HE3 LYS 49 -10.755 -0.086 -30.935 418 HZ1 LYS 49 HZ1 LYS 49 -9.260 1.999 -30.353 419 HZ2 LYS 49 HZ2 LYS 49 -10.196 1.929 -31.760 420 HZ3 LYS 49 HZ3 LYS 49 -8.541 1.589 -31.829 421 H ASN 50 H ASN 50 -6.394 -3.873 -26.297 422 HA ASN 50 HA ASN 50 -4.641 -5.575 -27.926 423 HB2 ASN 50 HB2 ASN 50 -4.176 -3.331 -26.190 424 HB3 ASN 50 HB3 ASN 50 -3.288 -4.729 -25.591 425 HD21 ASN 50 HD21 ASN 50 -3.700 -2.506 -28.231 426 HD22 ASN 50 HD22 ASN 50 -2.224 -2.887 -29.045 427 H VAL 51 H VAL 51 -6.732 -5.663 -25.268 428 HA VAL 51 HA VAL 51 -7.304 -7.307 -23.800 429 HB VAL 51 HB VAL 51 -5.382 -9.153 -25.196 430 HG11 VAL 51 HG11 VAL 51 -7.503 -10.653 -24.662 431 HG12 VAL 51 HG12 VAL 51 -6.239 -10.364 -23.466 432 HG13 VAL 51 HG13 VAL 51 -7.736 -9.433 -23.411 433 HG21 VAL 51 HG21 VAL 51 -8.079 -8.197 -26.112 434 HG22 VAL 51 HG22 VAL 51 -6.561 -8.226 -27.010 435 HG23 VAL 51 HG23 VAL 51 -7.396 -9.735 -26.641 436 H LYS 52 H LYS 52 -5.349 -5.535 -22.990 437 HA LYS 52 HA LYS 52 -3.820 -7.219 -21.143 438 HB2 LYS 52 HB2 LYS 52 -2.199 -6.693 -22.825 439 HB3 LYS 52 HB3 LYS 52 -2.688 -5.003 -22.852 440 HG2 LYS 52 HG2 LYS 52 -1.521 -4.488 -20.972 441 HG3 LYS 52 HG3 LYS 52 -1.703 -6.102 -20.282 442 HD2 LYS 52 HD2 LYS 52 0.473 -6.300 -20.849 443 HD3 LYS 52 HD3 LYS 52 -0.189 -6.670 -22.443 444 HE2 LYS 52 HE2 LYS 52 -0.114 -3.987 -22.586 445 HE3 LYS 52 HE3 LYS 52 1.231 -4.264 -21.480 446 HZ1 LYS 52 HZ1 LYS 52 1.677 -4.241 -23.995 447 HZ2 LYS 52 HZ2 LYS 52 1.020 -5.799 -23.988 448 HZ3 LYS 52 HZ3 LYS 52 2.394 -5.457 -23.062 449 H LEU 53 H LEU 53 -3.395 -6.281 -19.134 450 HA LEU 53 HA LEU 53 -5.096 -3.983 -18.513 451 HB2 LEU 53 HB2 LEU 53 -4.416 -6.409 -17.177 452 HB3 LEU 53 HB3 LEU 53 -3.905 -5.050 -16.178 453 HG LEU 53 HG LEU 53 -6.221 -4.163 -16.289 454 HD11 LEU 53 HD11 LEU 53 -7.967 -5.886 -16.976 455 HD12 LEU 53 HD12 LEU 53 -6.658 -6.700 -17.832 456 HD13 LEU 53 HD13 LEU 53 -7.105 -5.051 -18.269 457 HD21 LEU 53 HD21 LEU 53 -7.158 -6.347 -15.036 458 HD22 LEU 53 HD22 LEU 53 -6.025 -5.212 -14.300 459 HD23 LEU 53 HD23 LEU 53 -5.432 -6.708 -15.023 460 H VAL 54 H VAL 54 -4.314 -2.054 -17.915 461 HA VAL 54 HA VAL 54 -1.573 -1.798 -16.971 462 HB VAL 54 HB VAL 54 -0.943 -0.109 -18.584 463 HG11 VAL 54 HG11 VAL 54 -1.992 -2.525 -20.050 464 HG12 VAL 54 HG12 VAL 54 -0.644 -1.491 -20.528 465 HG13 VAL 54 HG13 VAL 54 -0.514 -2.503 -19.088 466 HG21 VAL 54 HG21 VAL 54 -3.770 -0.168 -19.206 467 HG22 VAL 54 HG22 VAL 54 -2.564 1.069 -19.561 468 HG23 VAL 54 HG23 VAL 54 -2.777 -0.294 -20.659 469 H GLU 55 H GLU 55 -1.123 0.660 -16.577 470 HA GLU 55 HA GLU 55 -3.456 1.689 -15.128 471 HB2 GLU 55 HB2 GLU 55 -0.529 1.795 -14.712 472 HB3 GLU 55 HB3 GLU 55 -1.417 3.250 -14.279 473 HG2 GLU 55 HG2 GLU 55 -2.860 1.084 -13.215 474 HG3 GLU 55 HG3 GLU 55 -1.161 0.795 -12.846 475 H SER 56 H SER 56 -4.610 3.104 -16.263 476 HA SER 56 HA SER 56 -3.251 5.397 -17.443 477 HB2 SER 56 HB2 SER 56 -3.396 3.996 -19.371 478 HB3 SER 56 HB3 SER 56 -5.052 3.526 -18.987 479 HG SER 56 HG SER 56 -5.474 5.089 -20.352 480 H ASP 57 H ASP 57 -4.802 7.123 -18.060 481 HA ASP 57 HA ASP 57 -7.061 7.138 -16.180 482 HB2 ASP 57 HB2 ASP 57 -5.023 9.037 -16.766 483 HB3 ASP 57 HB3 ASP 57 -6.563 9.731 -17.267 484 H ASP 58 H ASP 58 -6.886 6.079 -19.035 485 HA ASP 58 HA ASP 58 -8.520 7.782 -20.632 486 HB2 ASP 58 HB2 ASP 58 -7.126 6.237 -21.786 487 HB3 ASP 58 HB3 ASP 58 -7.744 4.875 -20.856 488 H ALA 59 H ALA 59 -10.700 7.477 -21.249 489 HA ALA 59 HA ALA 59 -12.359 6.470 -19.090 490 HB1 ALA 59 HB1 ALA 59 -12.700 8.335 -21.338 491 HB2 ALA 59 HB2 ALA 59 -14.125 7.379 -20.926 492 HB3 ALA 59 HB3 ALA 59 -13.358 8.391 -19.702 493 H ALA 60 H ALA 60 -13.991 4.918 -19.327 494 HA ALA 60 HA ALA 60 -13.763 3.215 -21.722 495 HB1 ALA 60 HB1 ALA 60 -13.265 1.438 -20.486 496 HB2 ALA 60 HB2 ALA 60 -13.078 2.522 -19.107 497 HB3 ALA 60 HB3 ALA 60 -14.628 1.737 -19.407 498 H GLU 61 H GLU 61 -15.728 1.600 -21.723 499 HA GLU 61 HA GLU 61 -18.038 3.108 -22.194 500 HB2 GLU 61 HB2 GLU 61 -17.753 0.135 -21.725 501 HB3 GLU 61 HB3 GLU 61 -19.192 0.915 -22.365 502 HG2 GLU 61 HG2 GLU 61 -16.531 0.512 -23.647 503 HG3 GLU 61 HG3 GLU 61 -18.141 0.152 -24.267 504 H ALA 62 H ALA 62 -16.776 1.790 -19.292 505 HA ALA 62 HA ALA 62 -18.873 2.980 -17.741 506 HB1 ALA 62 HB1 ALA 62 -19.050 0.522 -16.590 507 HB2 ALA 62 HB2 ALA 62 -20.211 1.180 -17.744 508 HB3 ALA 62 HB3 ALA 62 -18.929 0.104 -18.299 509 H THR 63 H THR 63 -18.462 2.806 -15.407 510 HA THR 63 HA THR 63 -15.627 2.243 -14.823 511 HB THR 63 HB THR 63 -17.085 4.332 -13.266 512 HG1 THR 63 HG1 THR 63 -17.462 5.220 -15.208 513 HG21 THR 63 HG21 THR 63 -14.774 3.511 -12.710 514 HG22 THR 63 HG22 THR 63 -14.899 5.251 -12.974 515 HG23 THR 63 HG23 THR 63 -14.231 4.214 -14.234 516 H LEU 64 H LEU 64 -15.265 0.876 -13.198 517 HA LEU 64 HA LEU 64 -17.488 0.290 -11.355 518 HB2 LEU 64 HB2 LEU 64 -15.524 -1.450 -12.743 519 HB3 LEU 64 HB3 LEU 64 -16.021 -1.911 -11.116 520 HG LEU 64 HG LEU 64 -18.268 -1.294 -12.875 521 HD11 LEU 64 HD11 LEU 64 -17.373 -2.269 -14.701 522 HD12 LEU 64 HD12 LEU 64 -17.812 -3.752 -13.854 523 HD13 LEU 64 HD13 LEU 64 -16.157 -3.148 -13.773 524 HD21 LEU 64 HD21 LEU 64 -17.627 -3.836 -11.402 525 HD22 LEU 64 HD22 LEU 64 -19.208 -3.200 -11.855 526 HD23 LEU 64 HD23 LEU 64 -18.265 -2.404 -10.594 527 H THR 65 H THR 65 -17.133 1.084 -9.399 528 HA THR 65 HA THR 65 -14.363 1.221 -8.407 529 HB THR 65 HB THR 65 -16.702 2.801 -7.340 530 HG1 THR 65 HG1 THR 65 -16.053 4.461 -8.679 531 HG21 THR 65 HG21 THR 65 -14.106 2.377 -6.383 532 HG22 THR 65 HG22 THR 65 -15.258 3.596 -5.838 533 HG23 THR 65 HG23 THR 65 -14.087 3.990 -7.096 534 H MET 66 H MET 66 -13.808 -0.015 -6.734 535 HA MET 66 HA MET 66 -15.732 -0.763 -4.712 536 HB2 MET 66 HB2 MET 66 -14.417 -2.861 -6.447 537 HB3 MET 66 HB3 MET 66 -15.299 -3.197 -4.962 538 HG2 MET 66 HG2 MET 66 -17.334 -2.302 -5.956 539 HG3 MET 66 HG3 MET 66 -16.454 -1.936 -7.438 540 HE1 MET 66 HE1 MET 66 -15.778 -4.574 -9.303 541 HE2 MET 66 HE2 MET 66 -17.524 -4.402 -9.488 542 HE3 MET 66 HE3 MET 66 -16.525 -2.981 -9.178 543 H GLU 67 H GLU 67 -14.773 -1.532 -2.801 544 HA GLU 67 HA GLU 67 -12.200 -0.530 -2.253 545 HB2 GLU 67 HB2 GLU 67 -14.040 -2.371 -0.738 546 HB3 GLU 67 HB3 GLU 67 -12.466 -1.906 -0.108 547 HG2 GLU 67 HG2 GLU 67 -13.175 0.119 0.496 548 HG3 GLU 67 HG3 GLU 67 -14.071 0.356 -1.003 549 H ASP 68 H ASP 68 -10.382 -1.820 -1.362 550 HA ASP 68 HA ASP 68 -9.500 -3.727 -3.248 551 HB2 ASP 68 HB2 ASP 68 -8.124 -2.164 -1.700 552 HB3 ASP 68 HB3 ASP 68 -8.294 -3.451 -0.509 553 H ASP 69 H ASP 69 -10.674 -4.044 0.083 554 HA ASP 69 HA ASP 69 -10.337 -6.867 0.198 555 HB2 ASP 69 HB2 ASP 69 -11.230 -6.744 2.327 556 HB3 ASP 69 HB3 ASP 69 -10.641 -5.097 2.117 557 H ILE 70 H ILE 70 -12.868 -4.760 -0.927 558 HA ILE 70 HA ILE 70 -14.891 -6.801 -1.014 559 HB ILE 70 HB ILE 70 -14.882 -4.149 -2.455 560 HG12 ILE 70 HG12 ILE 70 -14.533 -4.099 0.094 561 HG13 ILE 70 HG13 ILE 70 -15.850 -3.135 -0.566 562 HG21 ILE 70 HG21 ILE 70 -17.442 -4.591 -1.945 563 HG22 ILE 70 HG22 ILE 70 -16.653 -5.244 -3.380 564 HG23 ILE 70 HG23 ILE 70 -16.901 -6.270 -1.968 565 HD11 ILE 70 HD11 ILE 70 -16.517 -5.885 0.267 566 HD12 ILE 70 HD12 ILE 70 -16.125 -4.734 1.545 567 HD13 ILE 70 HD13 ILE 70 -17.440 -4.390 0.422 568 H MET 71 H MET 71 -13.001 -5.058 -3.484 569 HA MET 71 HA MET 71 -13.939 -6.372 -5.731 570 HB2 MET 71 HB2 MET 71 -12.405 -4.381 -5.680 571 HB3 MET 71 HB3 MET 71 -11.083 -5.481 -5.314 572 HG2 MET 71 HG2 MET 71 -10.808 -5.420 -7.543 573 HG3 MET 71 HG3 MET 71 -12.041 -6.678 -7.500 574 HE1 MET 71 HE1 MET 71 -11.916 -3.286 -10.024 575 HE2 MET 71 HE2 MET 71 -11.842 -2.496 -8.449 576 HE3 MET 71 HE3 MET 71 -10.729 -3.811 -8.830 577 H PHE 72 H PHE 72 -11.555 -7.401 -3.375 578 HA PHE 72 HA PHE 72 -10.452 -9.553 -4.805 579 HB2 PHE 72 HB2 PHE 72 -9.811 -8.432 -2.488 580 HB3 PHE 72 HB3 PHE 72 -10.784 -9.751 -1.845 581 HD1 PHE 72 HD2 PHE 72 -8.083 -9.230 -4.369 582 HD2 PHE 72 HD1 PHE 72 -9.683 -11.673 -1.273 583 HE1 PHE 72 HE2 PHE 72 -6.155 -10.745 -4.573 584 HE2 PHE 72 HE1 PHE 72 -7.757 -13.192 -1.471 585 HZ PHE 72 HZ PHE 72 -5.991 -12.729 -3.124 586 H ALA 73 H ALA 73 -13.308 -9.311 -2.755 587 HA ALA 73 HA ALA 73 -13.901 -12.061 -2.611 588 HB1 ALA 73 HB1 ALA 73 -15.472 -9.556 -2.206 589 HB2 ALA 73 HB2 ALA 73 -16.305 -11.111 -2.254 590 HB3 ALA 73 HB3 ALA 73 -15.050 -10.820 -1.049 591 H ILE 74 H ILE 74 -15.197 -9.528 -4.758 592 HA ILE 74 HA ILE 74 -16.751 -11.323 -6.314 593 HB ILE 74 HB ILE 74 -15.735 -8.634 -7.222 594 HG12 ILE 74 HG12 ILE 74 -18.333 -8.331 -6.230 595 HG13 ILE 74 HG13 ILE 74 -17.500 -9.295 -5.015 596 HG21 ILE 74 HG21 ILE 74 -18.439 -9.302 -7.936 597 HG22 ILE 74 HG22 ILE 74 -17.069 -8.912 -8.975 598 HG23 ILE 74 HG23 ILE 74 -17.331 -10.575 -8.449 599 HD11 ILE 74 HD11 ILE 74 -16.693 -7.401 -4.208 600 HD12 ILE 74 HD12 ILE 74 -15.714 -7.268 -5.669 601 HD13 ILE 74 HD13 ILE 74 -17.293 -6.486 -5.592 602 H GLY 75 H GLY 75 -13.420 -10.617 -6.242 603 HA2 GLY 75 HA2 GLY 75 -12.971 -11.401 -9.017 604 HA3 GLY 75 HA3 GLY 75 -11.748 -10.863 -7.876 605 H THR 76 H THR 76 -12.562 -12.693 -5.776 606 HA THR 76 HA THR 76 -11.250 -15.082 -6.825 607 HB THR 76 HB THR 76 -11.052 -15.752 -4.437 608 HG1 THR 76 HG1 THR 76 -12.283 -14.747 -3.052 609 HG21 THR 76 HG21 THR 76 -9.780 -13.342 -3.941 610 HG22 THR 76 HG22 THR 76 -9.819 -13.443 -5.702 611 HG23 THR 76 HG23 THR 76 -9.083 -14.740 -4.760 612 H GLY 77 H GLY 77 -14.113 -14.414 -7.343 613 HA2 GLY 77 HA2 GLY 77 -16.115 -15.528 -7.481 614 HA3 GLY 77 HA3 GLY 77 -15.190 -16.989 -7.167 615 H ALA 78 H ALA 78 -14.999 -14.540 -4.778 616 HA ALA 78 HA ALA 78 -16.158 -16.230 -2.799 617 HB1 ALA 78 HB1 ALA 78 -15.529 -14.613 -1.238 618 HB2 ALA 78 HB2 ALA 78 -14.312 -14.475 -2.508 619 HB3 ALA 78 HB3 ALA 78 -15.626 -13.303 -2.415 620 H LEU 79 H LEU 79 -17.089 -12.880 -3.586 621 HA LEU 79 HA LEU 79 -19.894 -13.660 -3.129 622 HB2 LEU 79 HB2 LEU 79 -18.353 -11.670 -1.904 623 HB3 LEU 79 HB3 LEU 79 -19.438 -10.819 -3.002 624 HG LEU 79 HG LEU 79 -20.825 -12.816 -1.410 625 HD11 LEU 79 HD11 LEU 79 -19.673 -10.500 0.117 626 HD12 LEU 79 HD12 LEU 79 -18.949 -12.107 0.138 627 HD13 LEU 79 HD13 LEU 79 -20.592 -11.873 0.734 628 HD21 LEU 79 HD21 LEU 79 -21.329 -9.891 -1.250 629 HD22 LEU 79 HD22 LEU 79 -22.468 -11.232 -1.373 630 HD23 LEU 79 HD23 LEU 79 -21.576 -10.698 -2.798 631 HA PRO 80 HA PRO 80 -20.772 -12.579 -7.306 632 HB2 PRO 80 HB2 PRO 80 -23.430 -12.082 -7.070 633 HB3 PRO 80 HB3 PRO 80 -22.750 -13.713 -7.024 634 HG2 PRO 80 HG2 PRO 80 -23.592 -11.947 -4.758 635 HG3 PRO 80 HG3 PRO 80 -23.870 -13.684 -4.987 636 HD2 PRO 80 HD2 PRO 80 -21.920 -12.721 -3.374 637 HD3 PRO 80 HD3 PRO 80 -21.754 -14.246 -4.268 638 H ALA 81 H ALA 81 -20.630 -10.765 -8.486 639 HA ALA 81 HA ALA 81 -20.360 -8.237 -7.315 640 HB1 ALA 81 HB1 ALA 81 -21.097 -8.057 -10.100 641 HB2 ALA 81 HB2 ALA 81 -19.557 -7.701 -9.317 642 HB3 ALA 81 HB3 ALA 81 -19.926 -9.348 -9.829 643 H LYS 82 H LYS 82 -23.151 -9.929 -8.478 644 HA LYS 82 HA LYS 82 -24.853 -7.684 -8.835 645 HB2 LYS 82 HB2 LYS 82 -25.302 -9.905 -9.824 646 HB3 LYS 82 HB3 LYS 82 -25.585 -10.552 -8.214 647 HG2 LYS 82 HG2 LYS 82 -27.340 -8.554 -8.153 648 HG3 LYS 82 HG3 LYS 82 -27.298 -8.825 -9.897 649 HD2 LYS 82 HD2 LYS 82 -28.276 -10.868 -9.738 650 HD3 LYS 82 HD3 LYS 82 -27.523 -11.227 -8.182 651 HE2 LYS 82 HE2 LYS 82 -29.189 -10.226 -6.990 652 HE3 LYS 82 HE3 LYS 82 -29.546 -9.058 -8.262 653 HZ1 LYS 82 HZ1 LYS 82 -30.585 -11.751 -7.868 654 HZ2 LYS 82 HZ2 LYS 82 -30.305 -11.279 -9.468 655 HZ3 LYS 82 HZ3 LYS 82 -31.349 -10.375 -8.491 656 H GLU 83 H GLU 83 -24.704 -10.103 -6.213 657 HA GLU 83 HA GLU 83 -26.531 -8.929 -4.498 658 HB2 GLU 83 HB2 GLU 83 -25.484 -11.185 -4.223 659 HB3 GLU 83 HB3 GLU 83 -24.022 -10.388 -3.658 660 HG2 GLU 83 HG2 GLU 83 -25.823 -11.316 -1.985 661 HG3 GLU 83 HG3 GLU 83 -24.925 -9.836 -1.648 662 H ALA 84 H ALA 84 -23.004 -8.459 -4.585 663 HA ALA 84 HA ALA 84 -22.702 -6.700 -2.491 664 HB1 ALA 84 HB1 ALA 84 -20.936 -5.703 -4.334 665 HB2 ALA 84 HB2 ALA 84 -20.639 -7.073 -3.264 666 HB3 ALA 84 HB3 ALA 84 -21.207 -7.348 -4.911 667 H MET 85 H MET 85 -23.838 -6.037 -5.760 668 HA MET 85 HA MET 85 -23.876 -3.195 -5.436 669 HB2 MET 85 HB2 MET 85 -24.185 -5.003 -7.565 670 HB3 MET 85 HB3 MET 85 -25.712 -4.137 -7.454 671 HG2 MET 85 HG2 MET 85 -23.729 -2.187 -7.205 672 HG3 MET 85 HG3 MET 85 -23.182 -3.263 -8.489 673 HE1 MET 85 HE1 MET 85 -24.827 -3.389 -11.069 674 HE2 MET 85 HE2 MET 85 -24.561 -1.665 -11.329 675 HE3 MET 85 HE3 MET 85 -23.342 -2.630 -10.496 676 H ALA 86 H ALA 86 -26.083 -5.797 -4.779 677 HA ALA 86 HA ALA 86 -28.447 -4.215 -4.599 678 HB1 ALA 86 HB1 ALA 86 -27.856 -6.908 -3.377 679 HB2 ALA 86 HB2 ALA 86 -29.449 -6.175 -3.561 680 HB3 ALA 86 HB3 ALA 86 -28.518 -6.632 -4.988 681 H GLN 87 H GLN 87 -25.978 -5.242 -2.308 682 HA GLN 87 HA GLN 87 -27.396 -4.024 -0.081 683 HB2 GLN 87 HB2 GLN 87 -25.326 -4.780 1.198 684 HB3 GLN 87 HB3 GLN 87 -26.337 -6.044 0.512 685 HG2 GLN 87 HG2 GLN 87 -24.795 -6.275 -1.360 686 HG3 GLN 87 HG3 GLN 87 -23.785 -4.994 -0.690 687 HE21 GLN 87 HE21 GLN 87 -22.106 -6.627 -0.775 688 HE22 GLN 87 HE22 GLN 87 -21.960 -7.757 0.523 689 H ASP 88 H ASP 88 -26.206 -2.503 -2.416 690 HA ASP 88 HA ASP 88 -25.023 -0.594 -2.816 691 HB2 ASP 88 HB2 ASP 88 -25.999 -0.210 0.005 692 HB3 ASP 88 HB3 ASP 88 -25.073 1.040 -0.821 693 H LYS 89 H LYS 89 -23.315 -2.645 -2.414 694 HA LYS 89 HA LYS 89 -21.224 -1.554 -0.650 695 HB2 LYS 89 HB2 LYS 89 -21.947 -4.336 -1.468 696 HB3 LYS 89 HB3 LYS 89 -20.267 -3.977 -1.091 697 HG2 LYS 89 HG2 LYS 89 -21.629 -2.853 1.017 698 HG3 LYS 89 HG3 LYS 89 -22.545 -4.324 0.678 699 HD2 LYS 89 HD2 LYS 89 -20.557 -5.668 0.889 700 HD3 LYS 89 HD3 LYS 89 -19.553 -4.226 1.054 701 HE2 LYS 89 HE2 LYS 89 -21.056 -3.703 3.091 702 HE3 LYS 89 HE3 LYS 89 -21.506 -5.405 2.997 703 HZ1 LYS 89 HZ1 LYS 89 -19.716 -5.282 4.489 704 HZ2 LYS 89 HZ2 LYS 89 -18.821 -4.257 3.485 705 HZ3 LYS 89 HZ3 LYS 89 -19.048 -5.877 3.054 706 H MET 90 H MET 90 -22.109 -1.381 -3.732 707 HA MET 90 HA MET 90 -19.453 -0.783 -4.643 708 HB2 MET 90 HB2 MET 90 -19.243 -2.378 -6.369 709 HB3 MET 90 HB3 MET 90 -19.722 -3.298 -4.949 710 HG2 MET 90 HG2 MET 90 -21.873 -3.653 -5.750 711 HG3 MET 90 HG3 MET 90 -21.762 -2.330 -6.907 712 HE1 MET 90 HE1 MET 90 -20.663 -6.386 -6.568 713 HE2 MET 90 HE2 MET 90 -19.086 -5.976 -7.242 714 HE3 MET 90 HE3 MET 90 -19.653 -5.176 -5.775 715 H GLU 91 H GLU 91 -19.429 0.474 -6.525 716 HA GLU 91 HA GLU 91 -22.084 1.284 -7.516 717 HB2 GLU 91 HB2 GLU 91 -19.671 3.070 -7.162 718 HB3 GLU 91 HB3 GLU 91 -21.255 3.564 -7.744 719 HG2 GLU 91 HG2 GLU 91 -21.905 3.966 -5.675 720 HG3 GLU 91 HG3 GLU 91 -21.601 2.286 -5.237 721 H VAL 92 H VAL 92 -22.222 1.920 -9.706 722 HA VAL 92 HA VAL 92 -19.890 1.402 -11.395 723 HB VAL 92 HB VAL 92 -22.565 0.136 -11.985 724 HG11 VAL 92 HG11 VAL 92 -20.016 0.405 -13.418 725 HG12 VAL 92 HG12 VAL 92 -20.702 -1.221 -13.414 726 HG13 VAL 92 HG13 VAL 92 -21.645 0.133 -14.036 727 HG21 VAL 92 HG21 VAL 92 -20.143 -0.951 -10.596 728 HG22 VAL 92 HG22 VAL 92 -21.841 -1.087 -10.140 729 HG23 VAL 92 HG23 VAL 92 -21.218 -2.011 -11.507 730 H ASP 93 H ASP 93 -19.780 2.678 -13.169 731 HA ASP 93 HA ASP 93 -22.102 4.405 -13.730 732 HB2 ASP 93 HB2 ASP 93 -19.462 5.137 -12.943 733 HB3 ASP 93 HB3 ASP 93 -19.696 5.658 -14.610 734 H GLY 94 H GLY 94 -22.032 5.361 -15.973 735 HA2 GLY 94 HA2 GLY 94 -21.532 5.193 -18.265 736 HA3 GLY 94 HA3 GLY 94 -20.638 3.715 -17.940 737 H GLN 95 H GLN 95 -21.531 2.057 -18.956 738 HA GLN 95 HA GLN 95 -24.445 2.001 -19.296 739 HB2 GLN 95 HB2 GLN 95 -22.252 1.340 -21.000 740 HB3 GLN 95 HB3 GLN 95 -23.192 -0.119 -20.717 741 HG2 GLN 95 HG2 GLN 95 -23.828 1.278 -22.723 742 HG3 GLN 95 HG3 GLN 95 -25.133 0.819 -21.631 743 HE21 GLN 95 HE21 GLN 95 -26.326 2.366 -20.694 744 HE22 GLN 95 HE22 GLN 95 -26.050 4.063 -20.868 745 H VAL 96 H VAL 96 -25.332 1.055 -17.550 746 HA VAL 96 HA VAL 96 -24.143 -0.955 -15.986 747 HB VAL 96 HB VAL 96 -27.085 -0.338 -16.297 748 HG11 VAL 96 HG11 VAL 96 -27.296 -2.207 -15.074 749 HG12 VAL 96 HG12 VAL 96 -25.590 -2.225 -14.625 750 HG13 VAL 96 HG13 VAL 96 -26.725 -1.204 -13.742 751 HG21 VAL 96 HG21 VAL 96 -26.346 0.755 -13.936 752 HG22 VAL 96 HG22 VAL 96 -24.882 1.009 -14.885 753 HG23 VAL 96 HG23 VAL 96 -26.424 1.646 -15.456 754 H GLU 97 H GLU 97 -25.723 -1.092 -19.019 755 HA GLU 97 HA GLU 97 -26.636 -3.794 -18.866 756 HB2 GLU 97 HB2 GLU 97 -26.916 -1.661 -20.662 757 HB3 GLU 97 HB3 GLU 97 -26.074 -2.913 -21.563 758 HG2 GLU 97 HG2 GLU 97 -27.889 -4.496 -20.729 759 HG3 GLU 97 HG3 GLU 97 -28.770 -3.042 -20.263 760 H LEU 98 H LEU 98 -23.659 -2.227 -19.816 761 HA LEU 98 HA LEU 98 -22.523 -4.561 -21.042 762 HB2 LEU 98 HB2 LEU 98 -21.705 -1.794 -20.499 763 HB3 LEU 98 HB3 LEU 98 -20.393 -2.970 -20.458 764 HG LEU 98 HG LEU 98 -20.640 -1.866 -22.650 765 HD11 LEU 98 HD11 LEU 98 -21.122 -4.235 -23.851 766 HD12 LEU 98 HD12 LEU 98 -20.775 -4.769 -22.207 767 HD13 LEU 98 HD13 LEU 98 -19.591 -3.805 -23.089 768 HD21 LEU 98 HD21 LEU 98 -22.605 -1.614 -23.652 769 HD22 LEU 98 HD22 LEU 98 -23.368 -2.286 -22.211 770 HD23 LEU 98 HD23 LEU 98 -22.937 -3.344 -23.555 771 H ILE 99 H ILE 99 -21.813 -2.778 -18.034 772 HA ILE 99 HA ILE 99 -19.933 -4.515 -16.977 773 HB ILE 99 HB ILE 99 -20.515 -3.624 -14.769 774 HG12 ILE 99 HG12 ILE 99 -22.427 -1.683 -15.225 775 HG13 ILE 99 HG13 ILE 99 -23.042 -3.059 -16.134 776 HG21 ILE 99 HG21 ILE 99 -20.738 -1.276 -16.589 777 HG22 ILE 99 HG22 ILE 99 -19.717 -1.511 -15.171 778 HG23 ILE 99 HG23 ILE 99 -19.311 -2.306 -16.691 779 HD11 ILE 99 HD11 ILE 99 -22.169 -3.979 -13.593 780 HD12 ILE 99 HD12 ILE 99 -23.205 -2.569 -13.363 781 HD13 ILE 99 HD13 ILE 99 -23.798 -3.962 -14.269 782 H PHE 100 H PHE 100 -23.362 -4.881 -17.242 783 HA PHE 100 HA PHE 100 -23.666 -6.879 -15.228 784 HB2 PHE 100 HB2 PHE 100 -25.359 -5.466 -17.063 785 HB3 PHE 100 HB3 PHE 100 -25.691 -7.190 -17.183 786 HD1 PHE 100 HD1 PHE 100 -25.477 -8.238 -14.568 787 HD2 PHE 100 HD2 PHE 100 -26.934 -4.424 -15.771 788 HE1 PHE 100 HE1 PHE 100 -26.841 -8.118 -12.523 789 HE2 PHE 100 HE2 PHE 100 -28.299 -4.297 -13.728 790 HZ PHE 100 HZ PHE 100 -28.253 -6.145 -12.100 791 H LEU 101 H LEU 101 -23.008 -6.911 -18.682 792 HA LEU 101 HA LEU 101 -23.321 -9.721 -19.018 793 HB2 LEU 101 HB2 LEU 101 -22.284 -7.463 -20.626 794 HB3 LEU 101 HB3 LEU 101 -21.713 -9.074 -21.058 795 HG LEU 101 HG LEU 101 -23.710 -8.184 -22.341 796 HD11 LEU 101 HD11 LEU 101 -23.600 -10.821 -20.945 797 HD12 LEU 101 HD12 LEU 101 -23.334 -10.437 -22.645 798 HD13 LEU 101 HD13 LEU 101 -24.970 -10.430 -21.985 799 HD21 LEU 101 HD21 LEU 101 -24.722 -7.438 -20.008 800 HD22 LEU 101 HD22 LEU 101 -25.418 -9.058 -20.074 801 HD23 LEU 101 HD23 LEU 101 -25.749 -7.902 -21.365 802 H LEU 102 H LEU 102 -21.021 -7.941 -17.400 803 HA LEU 102 HA LEU 102 -18.750 -9.625 -18.026 804 HB2 LEU 102 HB2 LEU 102 -19.218 -7.284 -16.223 805 HB3 LEU 102 HB3 LEU 102 -17.772 -8.275 -16.035 806 HG LEU 102 HG LEU 102 -18.558 -6.735 -18.509 807 HD11 LEU 102 HD11 LEU 102 -16.473 -6.251 -16.392 808 HD12 LEU 102 HD12 LEU 102 -17.842 -5.222 -16.810 809 HD13 LEU 102 HD13 LEU 102 -16.511 -5.424 -17.949 810 HD21 LEU 102 HD21 LEU 102 -16.077 -7.348 -19.030 811 HD22 LEU 102 HD22 LEU 102 -17.362 -8.507 -19.368 812 HD23 LEU 102 HD23 LEU 102 -16.374 -8.683 -17.918 813 H GLU 103 H GLU 103 -21.040 -9.168 -15.382 814 HA GLU 103 HA GLU 103 -19.950 -10.656 -13.373 815 HB2 GLU 103 HB2 GLU 103 -22.623 -9.868 -14.160 816 HB3 GLU 103 HB3 GLU 103 -22.632 -11.454 -13.400 817 HG2 GLU 103 HG2 GLU 103 -21.133 -9.234 -12.101 818 HG3 GLU 103 HG3 GLU 103 -22.891 -9.280 -11.976 819 HA PRO 104 HA PRO 104 -21.701 -14.749 -15.254 820 HB2 PRO 104 HB2 PRO 104 -22.637 -14.646 -17.800 821 HB3 PRO 104 HB3 PRO 104 -23.659 -14.351 -16.389 822 HG2 PRO 104 HG2 PRO 104 -22.348 -12.381 -18.223 823 HG3 PRO 104 HG3 PRO 104 -23.989 -12.364 -17.551 824 HD2 PRO 104 HD2 PRO 104 -21.980 -10.864 -16.529 825 HD3 PRO 104 HD3 PRO 104 -23.284 -11.525 -15.523 826 H PHE 105 H PHE 105 -19.656 -12.512 -16.742 827 HA PHE 105 HA PHE 105 -18.446 -14.372 -18.603 828 HB2 PHE 105 HB2 PHE 105 -18.615 -11.626 -18.509 829 HB3 PHE 105 HB3 PHE 105 -16.954 -11.922 -18.008 830 HD1 PHE 105 HD1 PHE 105 -19.346 -13.139 -20.603 831 HD2 PHE 105 HD2 PHE 105 -15.371 -11.946 -19.660 832 HE1 PHE 105 HE1 PHE 105 -18.699 -13.449 -22.957 833 HE2 PHE 105 HE2 PHE 105 -14.717 -12.253 -22.012 834 HZ PHE 105 HZ PHE 105 -16.382 -13.005 -23.664 835 H ILE 106 H ILE 106 -18.140 -13.584 -15.320 836 HA ILE 106 HA ILE 106 -15.385 -13.959 -14.899 837 HB ILE 106 HB ILE 106 -17.700 -14.488 -13.034 838 HG12 ILE 106 HG12 ILE 106 -15.802 -12.141 -13.076 839 HG13 ILE 106 HG13 ILE 106 -17.341 -12.137 -13.930 840 HG21 ILE 106 HG21 ILE 106 -15.595 -13.953 -11.421 841 HG22 ILE 106 HG22 ILE 106 -16.136 -15.578 -11.840 842 HG23 ILE 106 HG23 ILE 106 -14.799 -14.840 -12.721 843 HD11 ILE 106 HD11 ILE 106 -16.799 -12.102 -11.002 844 HD12 ILE 106 HD12 ILE 106 -17.881 -11.092 -11.961 845 HD13 ILE 106 HD13 ILE 106 -18.318 -12.763 -11.605 846 H ALA 107 H ALA 107 -18.011 -16.207 -15.349 847 HA ALA 107 HA ALA 107 -16.977 -18.531 -14.262 848 HB1 ALA 107 HB1 ALA 107 -18.808 -19.422 -15.149 849 HB2 ALA 107 HB2 ALA 107 -19.138 -17.856 -15.889 850 HB3 ALA 107 HB3 ALA 107 -18.248 -19.085 -16.788 851 H SER 108 H SER 108 -16.044 -16.839 -17.157 852 HA SER 108 HA SER 108 -14.761 -18.819 -18.600 853 HB2 SER 108 HB2 SER 108 -15.108 -16.300 -19.140 854 HB3 SER 108 HB3 SER 108 -13.554 -16.077 -18.337 855 HG SER 108 HG SER 108 -12.921 -16.465 -20.344 856 H LEU 109 H LEU 109 -13.138 -16.556 -16.365 857 HA LEU 109 HA LEU 109 -10.797 -18.211 -16.233 858 HB2 LEU 109 HB2 LEU 109 -10.118 -16.551 -14.454 859 HB3 LEU 109 HB3 LEU 109 -10.403 -15.905 -16.068 860 HG LEU 109 HG LEU 109 -12.778 -15.773 -14.402 861 HD11 LEU 109 HD11 LEU 109 -11.916 -13.947 -12.958 862 HD12 LEU 109 HD12 LEU 109 -10.281 -14.375 -13.461 863 HD13 LEU 109 HD13 LEU 109 -11.258 -15.536 -12.563 864 HD21 LEU 109 HD21 LEU 109 -12.910 -14.427 -16.236 865 HD22 LEU 109 HD22 LEU 109 -11.189 -14.043 -16.219 866 HD23 LEU 109 HD23 LEU 109 -12.279 -13.261 -15.073 867 H LYS 110 H LYS 110 -11.392 -20.187 -15.377 868 HA LYS 110 HA LYS 110 -12.989 -20.598 -13.117 869 HB2 LYS 110 HB2 LYS 110 -12.070 -22.278 -14.887 870 HB3 LYS 110 HB3 LYS 110 -10.704 -22.423 -13.790 871 HG2 LYS 110 HG2 LYS 110 -11.897 -23.548 -12.229 872 HG3 LYS 110 HG3 LYS 110 -13.400 -22.704 -12.609 873 HD2 LYS 110 HD2 LYS 110 -13.985 -24.647 -13.577 874 HD3 LYS 110 HD3 LYS 110 -12.967 -24.094 -14.908 875 HE2 LYS 110 HE2 LYS 110 -11.848 -25.673 -12.613 876 HE3 LYS 110 HE3 LYS 110 -12.585 -26.463 -14.006 877 HZ1 LYS 110 HZ1 LYS 110 -10.634 -24.440 -14.668 878 HZ2 LYS 110 HZ2 LYS 110 -10.832 -25.999 -15.294 879 HZ3 LYS 110 HZ3 LYS 110 -9.997 -25.772 -13.840 Start of MODEL 18 1 H1 MET 1 H MET 1 3.338 1.308 -0.271 2 HA MET 1 HA MET 1 0.791 0.684 -0.153 3 HB2 MET 1 HB2 MET 1 2.277 2.384 -2.051 4 HB3 MET 1 HB3 MET 1 0.644 1.962 -2.548 5 HG2 MET 1 HG2 MET 1 0.713 2.781 0.215 6 HG3 MET 1 HG3 MET 1 1.408 4.011 -0.838 7 HE1 MET 1 HE1 MET 1 -1.616 4.144 0.947 8 HE2 MET 1 HE2 MET 1 -0.488 5.362 0.351 9 HE3 MET 1 HE3 MET 1 -2.169 5.377 -0.186 10 H SER 2 H SER 2 0.236 -1.447 -0.470 11 HA SER 2 HA SER 2 0.061 -2.292 -3.281 12 HB2 SER 2 HB2 SER 2 0.442 -4.663 -2.435 13 HB3 SER 2 HB3 SER 2 1.855 -3.607 -2.429 14 HG SER 2 HG SER 2 1.878 -3.628 -0.306 15 H LEU 3 H LEU 3 -1.758 -3.486 -3.842 16 HA LEU 3 HA LEU 3 -3.868 -3.583 -1.786 17 HB2 LEU 3 HB2 LEU 3 -4.005 -2.957 -4.720 18 HB3 LEU 3 HB3 LEU 3 -5.429 -3.432 -3.798 19 HG LEU 3 HG LEU 3 -3.916 -1.201 -2.637 20 HD11 LEU 3 HD11 LEU 3 -3.682 0.003 -4.488 21 HD12 LEU 3 HD12 LEU 3 -5.441 0.077 -4.576 22 HD13 LEU 3 HD13 LEU 3 -4.568 -1.180 -5.451 23 HD21 LEU 3 HD21 LEU 3 -6.750 -2.002 -3.106 24 HD22 LEU 3 HD22 LEU 3 -6.375 -0.312 -2.769 25 HD23 LEU 3 HD23 LEU 3 -5.937 -1.563 -1.604 26 H LYS 4 H LYS 4 -5.030 -5.431 -1.546 27 HA LYS 4 HA LYS 4 -3.932 -7.871 -2.374 28 HB2 LYS 4 HB2 LYS 4 -6.641 -7.157 -1.258 29 HB3 LYS 4 HB3 LYS 4 -6.170 -8.816 -1.600 30 HG2 LYS 4 HG2 LYS 4 -4.068 -8.012 -0.112 31 HG3 LYS 4 HG3 LYS 4 -5.358 -7.029 0.586 32 HD2 LYS 4 HD2 LYS 4 -6.425 -8.821 1.469 33 HD3 LYS 4 HD3 LYS 4 -6.002 -9.872 0.115 34 HE2 LYS 4 HE2 LYS 4 -4.233 -10.692 1.197 35 HE3 LYS 4 HE3 LYS 4 -3.666 -9.082 1.634 36 HZ1 LYS 4 HZ1 LYS 4 -5.064 -11.001 3.219 37 HZ2 LYS 4 HZ2 LYS 4 -5.838 -9.498 3.236 38 HZ3 LYS 4 HZ3 LYS 4 -4.217 -9.619 3.703 39 H SER 5 H SER 5 -6.424 -5.851 -3.779 40 HA SER 5 HA SER 5 -7.548 -7.703 -5.558 41 HB2 SER 5 HB2 SER 5 -7.645 -5.246 -6.874 42 HB3 SER 5 HB3 SER 5 -8.867 -5.899 -5.784 43 HG SER 5 HG SER 5 -6.686 -4.217 -5.099 44 H ASP 6 H ASP 6 -4.476 -6.222 -5.534 45 HA ASP 6 HA ASP 6 -3.827 -6.010 -8.219 46 HB2 ASP 6 HB2 ASP 6 -2.155 -6.737 -5.818 47 HB3 ASP 6 HB3 ASP 6 -1.456 -6.551 -7.424 48 H GLU 7 H GLU 7 -3.910 -8.855 -6.148 49 HA GLU 7 HA GLU 7 -2.637 -10.648 -7.903 50 HB2 GLU 7 HB2 GLU 7 -4.145 -10.795 -5.425 51 HB3 GLU 7 HB3 GLU 7 -4.506 -12.152 -6.483 52 HG2 GLU 7 HG2 GLU 7 -1.919 -12.318 -6.699 53 HG3 GLU 7 HG3 GLU 7 -1.926 -11.383 -5.205 54 H VAL 8 H VAL 8 -6.092 -9.970 -7.385 55 HA VAL 8 HA VAL 8 -7.183 -11.761 -9.182 56 HB VAL 8 HB VAL 8 -8.102 -9.006 -8.382 57 HG11 VAL 8 HG11 VAL 8 -10.308 -9.662 -9.358 58 HG12 VAL 8 HG12 VAL 8 -9.043 -9.358 -10.550 59 HG13 VAL 8 HG13 VAL 8 -9.495 -11.014 -10.144 60 HG21 VAL 8 HG21 VAL 8 -8.026 -11.167 -6.865 61 HG22 VAL 8 HG22 VAL 8 -9.378 -10.038 -6.789 62 HG23 VAL 8 HG23 VAL 8 -9.527 -11.530 -7.716 63 H PHE 9 H PHE 9 -6.147 -8.414 -9.813 64 HA PHE 9 HA PHE 9 -6.805 -8.341 -12.528 65 HB2 PHE 9 HB2 PHE 9 -4.729 -6.862 -10.918 66 HB3 PHE 9 HB3 PHE 9 -4.991 -6.543 -12.629 67 HD1 PHE 9 HD2 PHE 9 -7.911 -6.730 -12.832 68 HD2 PHE 9 HD1 PHE 9 -5.468 -4.958 -9.831 69 HE1 PHE 9 HE2 PHE 9 -9.737 -5.183 -12.263 70 HE2 PHE 9 HE1 PHE 9 -7.290 -3.408 -9.257 71 HZ PHE 9 HZ PHE 9 -9.428 -3.518 -10.475 72 H ALA 10 H ALA 10 -3.929 -9.515 -10.879 73 HA ALA 10 HA ALA 10 -2.341 -9.885 -13.199 74 HB1 ALA 10 HB1 ALA 10 -1.601 -9.803 -10.745 75 HB2 ALA 10 HB2 ALA 10 -2.042 -11.510 -10.696 76 HB3 ALA 10 HB3 ALA 10 -0.797 -10.953 -11.814 77 H LYS 11 H LYS 11 -4.505 -12.016 -11.381 78 HA LYS 11 HA LYS 11 -3.956 -14.352 -12.892 79 HB2 LYS 11 HB2 LYS 11 -6.536 -13.788 -11.441 80 HB3 LYS 11 HB3 LYS 11 -5.783 -15.347 -11.747 81 HG2 LYS 11 HG2 LYS 11 -3.864 -14.003 -10.308 82 HG3 LYS 11 HG3 LYS 11 -5.374 -13.470 -9.567 83 HD2 LYS 11 HD2 LYS 11 -5.940 -15.592 -8.874 84 HD3 LYS 11 HD3 LYS 11 -4.983 -16.373 -10.135 85 HE2 LYS 11 HE2 LYS 11 -3.113 -16.376 -8.885 86 HE3 LYS 11 HE3 LYS 11 -3.430 -14.772 -8.227 87 HZ1 LYS 11 HZ1 LYS 11 -5.253 -15.989 -6.899 88 HZ2 LYS 11 HZ2 LYS 11 -3.645 -16.129 -6.394 89 HZ3 LYS 11 HZ3 LYS 11 -4.373 -17.389 -7.258 90 H ILE 12 H ILE 12 -6.489 -11.882 -13.096 91 HA ILE 12 HA ILE 12 -7.951 -13.082 -15.187 92 HB ILE 12 HB ILE 12 -7.735 -10.173 -14.404 93 HG12 ILE 12 HG12 ILE 12 -9.972 -12.123 -13.852 94 HG13 ILE 12 HG13 ILE 12 -8.647 -11.852 -12.726 95 HG21 ILE 12 HG21 ILE 12 -8.812 -9.721 -16.296 96 HG22 ILE 12 HG22 ILE 12 -9.012 -11.433 -16.665 97 HG23 ILE 12 HG23 ILE 12 -10.188 -10.609 -15.641 98 HD11 ILE 12 HD11 ILE 12 -9.274 -9.470 -12.624 99 HD12 ILE 12 HD12 ILE 12 -10.654 -9.819 -13.666 100 HD13 ILE 12 HD13 ILE 12 -10.550 -10.551 -12.065 101 H ALA 13 H ALA 13 -5.197 -10.894 -15.161 102 HA ALA 13 HA ALA 13 -5.207 -10.209 -17.890 103 HB1 ALA 13 HB1 ALA 13 -3.012 -10.297 -15.838 104 HB2 ALA 13 HB2 ALA 13 -2.748 -9.745 -17.492 105 HB3 ALA 13 HB3 ALA 13 -3.885 -8.892 -16.449 106 H LYS 14 H LYS 14 -3.721 -12.894 -16.137 107 HA LYS 14 HA LYS 14 -2.241 -13.942 -18.296 108 HB2 LYS 14 HB2 LYS 14 -3.377 -15.367 -15.883 109 HB3 LYS 14 HB3 LYS 14 -2.148 -16.015 -16.961 110 HG2 LYS 14 HG2 LYS 14 -1.108 -13.579 -16.191 111 HG3 LYS 14 HG3 LYS 14 -1.889 -14.184 -14.728 112 HD2 LYS 14 HD2 LYS 14 -0.561 -16.386 -15.828 113 HD3 LYS 14 HD3 LYS 14 0.563 -15.034 -15.987 114 HE2 LYS 14 HE2 LYS 14 1.115 -15.510 -13.867 115 HE3 LYS 14 HE3 LYS 14 -0.382 -14.673 -13.456 116 HZ1 LYS 14 HZ1 LYS 14 -0.738 -16.617 -12.379 117 HZ2 LYS 14 HZ2 LYS 14 0.217 -17.530 -13.435 118 HZ3 LYS 14 HZ3 LYS 14 -1.348 -17.077 -13.888 119 H ARG 15 H ARG 15 -5.575 -14.304 -17.306 120 HA ARG 15 HA ARG 15 -6.122 -16.521 -19.043 121 HB2 ARG 15 HB2 ARG 15 -7.964 -14.616 -17.588 122 HB3 ARG 15 HB3 ARG 15 -8.503 -16.032 -18.481 123 HG2 ARG 15 HG2 ARG 15 -6.951 -17.363 -16.945 124 HG3 ARG 15 HG3 ARG 15 -6.917 -15.910 -15.944 125 HD2 ARG 15 HD2 ARG 15 -8.734 -16.799 -14.972 126 HD3 ARG 15 HD3 ARG 15 -9.582 -16.188 -16.392 127 HE ARG 15 HE ARG 15 -8.757 -18.642 -17.174 128 HH11 ARG 15 HH11 ARG 15 -10.512 -17.479 -14.401 129 HH12 ARG 15 HH12 ARG 15 -11.417 -18.942 -14.197 130 HH21 ARG 15 HH21 ARG 15 -9.943 -20.573 -16.916 131 HH22 ARG 15 HH22 ARG 15 -11.092 -20.701 -15.627 132 H LEU 16 H LEU 16 -6.034 -13.088 -19.363 133 HA LEU 16 HA LEU 16 -7.776 -12.829 -21.587 134 HB2 LEU 16 HB2 LEU 16 -5.582 -11.124 -20.456 135 HB3 LEU 16 HB3 LEU 16 -6.421 -10.678 -21.940 136 HG LEU 16 HG LEU 16 -7.926 -11.186 -19.394 137 HD11 LEU 16 HD11 LEU 16 -5.976 -9.301 -19.497 138 HD12 LEU 16 HD12 LEU 16 -7.433 -9.186 -18.511 139 HD13 LEU 16 HD13 LEU 16 -7.369 -8.392 -20.084 140 HD21 LEU 16 HD21 LEU 16 -9.701 -10.537 -20.568 141 HD22 LEU 16 HD22 LEU 16 -8.693 -10.675 -22.008 142 HD23 LEU 16 HD23 LEU 16 -8.860 -9.119 -21.193 143 H GLU 17 H GLU 17 -4.572 -13.992 -21.241 144 HA GLU 17 HA GLU 17 -3.817 -13.517 -23.993 145 HB2 GLU 17 HB2 GLU 17 -2.501 -14.991 -21.715 146 HB3 GLU 17 HB3 GLU 17 -1.829 -14.966 -23.339 147 HG2 GLU 17 HG2 GLU 17 -2.150 -12.342 -22.979 148 HG3 GLU 17 HG3 GLU 17 -1.948 -12.835 -21.299 149 H SER 18 H SER 18 -5.699 -15.767 -22.374 150 HA SER 18 HA SER 18 -5.111 -17.932 -24.255 151 HB2 SER 18 HB2 SER 18 -5.248 -18.790 -22.069 152 HB3 SER 18 HB3 SER 18 -6.645 -17.791 -21.669 153 HG SER 18 HG SER 18 -7.398 -19.838 -22.038 154 H ILE 19 H ILE 19 -7.372 -15.429 -23.663 155 HA ILE 19 HA ILE 19 -9.731 -16.430 -24.716 156 HB ILE 19 HB ILE 19 -8.670 -13.628 -25.095 157 HG12 ILE 19 HG12 ILE 19 -10.304 -14.821 -22.845 158 HG13 ILE 19 HG13 ILE 19 -8.633 -14.281 -22.737 159 HG21 ILE 19 HG21 ILE 19 -11.012 -12.989 -25.271 160 HG22 ILE 19 HG22 ILE 19 -10.591 -14.167 -26.512 161 HG23 ILE 19 HG23 ILE 19 -11.498 -14.674 -25.087 162 HD11 ILE 19 HD11 ILE 19 -9.639 -12.002 -23.526 163 HD12 ILE 19 HD12 ILE 19 -11.135 -12.687 -22.891 164 HD13 ILE 19 HD13 ILE 19 -9.734 -12.497 -21.836 165 H ASP 20 H ASP 20 -10.601 -16.610 -26.749 166 HA ASP 20 HA ASP 20 -8.773 -16.149 -29.013 167 HB2 ASP 20 HB2 ASP 20 -9.776 -18.629 -28.096 168 HB3 ASP 20 HB3 ASP 20 -10.631 -18.262 -29.592 169 HA PRO 21 HA PRO 21 -12.011 -13.837 -30.873 170 HB2 PRO 21 HB2 PRO 21 -11.439 -14.223 -33.499 171 HB3 PRO 21 HB3 PRO 21 -10.465 -13.192 -32.445 172 HG2 PRO 21 HG2 PRO 21 -9.974 -16.014 -33.313 173 HG3 PRO 21 HG3 PRO 21 -8.830 -14.665 -33.196 174 HD2 PRO 21 HD2 PRO 21 -9.008 -16.594 -31.303 175 HD3 PRO 21 HD3 PRO 21 -8.575 -14.916 -30.918 176 H ALA 22 H ALA 22 -11.599 -17.210 -31.618 177 HA ALA 22 HA ALA 22 -13.796 -17.641 -33.293 178 HB1 ALA 22 HB1 ALA 22 -13.415 -19.880 -33.003 179 HB2 ALA 22 HB2 ALA 22 -11.858 -19.226 -32.492 180 HB3 ALA 22 HB3 ALA 22 -13.050 -19.709 -31.286 181 H ASN 23 H ASN 23 -13.585 -18.062 -29.755 182 HA ASN 23 HA ASN 23 -16.517 -18.031 -29.636 183 HB2 ASN 23 HB2 ASN 23 -14.434 -19.406 -28.147 184 HB3 ASN 23 HB3 ASN 23 -15.550 -18.564 -27.074 185 HD21 ASN 23 HD21 ASN 23 -15.020 -21.464 -27.938 186 HD22 ASN 23 HD22 ASN 23 -16.606 -22.081 -28.238 187 H ARG 24 H ARG 24 -17.422 -16.131 -29.236 188 HA ARG 24 HA ARG 24 -16.901 -14.583 -26.975 189 HB2 ARG 24 HB2 ARG 24 -14.914 -14.156 -28.801 190 HB3 ARG 24 HB3 ARG 24 -16.055 -12.885 -29.223 191 HG2 ARG 24 HG2 ARG 24 -15.191 -11.665 -27.592 192 HG3 ARG 24 HG3 ARG 24 -15.871 -12.815 -26.439 193 HD2 ARG 24 HD2 ARG 24 -13.675 -14.165 -27.101 194 HD3 ARG 24 HD3 ARG 24 -13.093 -12.536 -27.442 195 HE ARG 24 HE ARG 24 -13.083 -12.094 -25.188 196 HH11 ARG 24 HH11 ARG 24 -14.812 -15.055 -25.791 197 HH12 ARG 24 HH12 ARG 24 -14.917 -15.488 -24.117 198 HH21 ARG 24 HH21 ARG 24 -13.214 -12.654 -22.980 199 HH22 ARG 24 HH22 ARG 24 -14.008 -14.121 -22.519 200 H GLN 25 H GLN 25 -18.142 -12.550 -26.951 201 HA GLN 25 HA GLN 25 -20.232 -12.468 -29.019 202 HB2 GLN 25 HB2 GLN 25 -20.628 -13.351 -26.419 203 HB3 GLN 25 HB3 GLN 25 -21.176 -11.680 -26.377 204 HG2 GLN 25 HG2 GLN 25 -22.593 -12.201 -28.381 205 HG3 GLN 25 HG3 GLN 25 -22.171 -13.896 -28.145 206 HE21 GLN 25 HE21 GLN 25 -24.706 -13.574 -28.076 207 HE22 GLN 25 HE22 GLN 25 -25.357 -13.522 -26.477 208 H VAL 26 H VAL 26 -18.931 -10.693 -26.213 209 HA VAL 26 HA VAL 26 -18.803 -8.277 -27.841 210 HB VAL 26 HB VAL 26 -21.035 -8.280 -26.688 211 HG11 VAL 26 HG11 VAL 26 -19.755 -7.558 -24.126 212 HG12 VAL 26 HG12 VAL 26 -21.278 -8.392 -24.441 213 HG13 VAL 26 HG13 VAL 26 -19.752 -9.269 -24.550 214 HG21 VAL 26 HG21 VAL 26 -20.078 -6.202 -27.419 215 HG22 VAL 26 HG22 VAL 26 -20.804 -5.955 -25.831 216 HG23 VAL 26 HG23 VAL 26 -19.054 -6.117 -25.985 217 H GLU 27 H GLU 27 -17.173 -6.904 -27.267 218 HA GLU 27 HA GLU 27 -15.766 -7.352 -24.745 219 HB2 GLU 27 HB2 GLU 27 -14.183 -7.165 -27.292 220 HB3 GLU 27 HB3 GLU 27 -13.660 -7.722 -25.709 221 HG2 GLU 27 HG2 GLU 27 -13.816 -9.692 -26.868 222 HG3 GLU 27 HG3 GLU 27 -15.396 -9.613 -26.089 223 H HIS 28 H HIS 28 -15.471 -5.459 -23.794 224 HA HIS 28 HA HIS 28 -14.774 -3.122 -25.410 225 HB2 HIS 28 HB2 HIS 28 -17.236 -3.468 -23.799 226 HB3 HIS 28 HB3 HIS 28 -16.406 -1.924 -23.626 227 HD1 HIS 28 HD1 HIS 28 -15.817 -0.809 -26.132 228 HD2 HIS 28 HD2 HIS 28 -19.008 -3.453 -25.831 229 HE1 HIS 28 HE1 HIS 28 -17.252 -0.363 -28.148 230 H VAL 29 H VAL 29 -14.204 -1.227 -23.895 231 HA VAL 29 HA VAL 29 -12.230 -2.207 -22.035 232 HB VAL 29 HB VAL 29 -12.973 0.631 -22.759 233 HG11 VAL 29 HG11 VAL 29 -10.401 0.712 -21.892 234 HG12 VAL 29 HG12 VAL 29 -11.806 1.093 -20.895 235 HG13 VAL 29 HG13 VAL 29 -11.085 -0.515 -20.826 236 HG21 VAL 29 HG21 VAL 29 -10.826 -1.217 -23.783 237 HG22 VAL 29 HG22 VAL 29 -12.145 -0.488 -24.699 238 HG23 VAL 29 HG23 VAL 29 -10.843 0.523 -24.073 239 H TYR 30 H TYR 30 -12.145 -1.839 -19.830 240 HA TYR 30 HA TYR 30 -14.559 -0.720 -18.579 241 HB2 TYR 30 HB2 TYR 30 -14.116 -3.397 -18.651 242 HB3 TYR 30 HB3 TYR 30 -13.284 -2.976 -17.158 243 HD1 TYR 30 HD2 TYR 30 -16.518 -2.135 -18.847 244 HD2 TYR 30 HD1 TYR 30 -14.526 -3.176 -15.234 245 HE1 TYR 30 HE2 TYR 30 -18.672 -2.111 -17.659 246 HE2 TYR 30 HE1 TYR 30 -16.675 -3.157 -14.037 247 HH TYR 30 HH TYR 30 -18.872 -2.898 -14.200 248 H LYS 31 H LYS 31 -14.223 -0.174 -16.265 249 HA LYS 31 HA LYS 31 -11.424 0.549 -15.701 250 HB2 LYS 31 HB2 LYS 31 -12.279 2.632 -16.235 251 HB3 LYS 31 HB3 LYS 31 -13.887 2.242 -15.637 252 HG2 LYS 31 HG2 LYS 31 -13.048 3.797 -14.115 253 HG3 LYS 31 HG3 LYS 31 -12.843 2.238 -13.314 254 HD2 LYS 31 HD2 LYS 31 -10.840 3.530 -13.008 255 HD3 LYS 31 HD3 LYS 31 -10.489 2.201 -14.115 256 HE2 LYS 31 HE2 LYS 31 -9.673 3.717 -15.525 257 HE3 LYS 31 HE3 LYS 31 -11.326 4.285 -15.756 258 HZ1 LYS 31 HZ1 LYS 31 -10.054 5.323 -13.390 259 HZ2 LYS 31 HZ2 LYS 31 -10.927 6.132 -14.592 260 HZ3 LYS 31 HZ3 LYS 31 -9.288 5.786 -14.826 261 H PHE 32 H PHE 32 -10.696 -0.070 -13.770 262 HA PHE 32 HA PHE 32 -12.673 -0.835 -11.722 263 HB2 PHE 32 HB2 PHE 32 -9.964 -2.116 -12.105 264 HB3 PHE 32 HB3 PHE 32 -11.259 -2.651 -11.039 265 HD1 PHE 32 HD1 PHE 32 -10.213 -2.342 -14.558 266 HD2 PHE 32 HD2 PHE 32 -13.024 -4.011 -11.834 267 HE1 PHE 32 HE1 PHE 32 -11.071 -3.801 -16.344 268 HE2 PHE 32 HE2 PHE 32 -13.887 -5.473 -13.614 269 HZ PHE 32 HZ PHE 32 -12.910 -5.370 -15.873 270 H ARG 33 H ARG 33 -12.628 0.889 -10.382 271 HA ARG 33 HA ARG 33 -10.021 1.908 -9.498 272 HB2 ARG 33 HB2 ARG 33 -11.185 3.881 -8.746 273 HB3 ARG 33 HB3 ARG 33 -11.666 3.537 -10.402 274 HG2 ARG 33 HG2 ARG 33 -13.697 2.383 -9.430 275 HG3 ARG 33 HG3 ARG 33 -13.243 3.105 -7.885 276 HD2 ARG 33 HD2 ARG 33 -14.307 4.375 -10.345 277 HD3 ARG 33 HD3 ARG 33 -14.650 4.726 -8.651 278 HE ARG 33 HE ARG 33 -12.136 5.574 -8.847 279 HH11 ARG 33 HH11 ARG 33 -14.867 6.069 -10.949 280 HH12 ARG 33 HH12 ARG 33 -14.324 7.618 -11.504 281 HH21 ARG 33 HH21 ARG 33 -11.411 7.612 -9.570 282 HH22 ARG 33 HH22 ARG 33 -12.357 8.494 -10.720 283 H ILE 34 H ILE 34 -9.258 1.180 -7.635 284 HA ILE 34 HA ILE 34 -11.085 -0.036 -5.705 285 HB ILE 34 HB ILE 34 -8.078 -0.081 -5.932 286 HG12 ILE 34 HG12 ILE 34 -9.767 -2.527 -5.849 287 HG13 ILE 34 HG13 ILE 34 -9.847 -1.549 -7.311 288 HG21 ILE 34 HG21 ILE 34 -9.859 -0.794 -3.676 289 HG22 ILE 34 HG22 ILE 34 -8.531 -1.896 -4.038 290 HG23 ILE 34 HG23 ILE 34 -8.196 -0.205 -3.668 291 HD11 ILE 34 HD11 ILE 34 -7.508 -1.808 -7.690 292 HD12 ILE 34 HD12 ILE 34 -7.289 -2.588 -6.124 293 HD13 ILE 34 HD13 ILE 34 -8.199 -3.403 -7.395 294 H THR 35 H THR 35 -11.542 0.819 -3.767 295 HA THR 35 HA THR 35 -10.323 3.408 -3.110 296 HB THR 35 HB THR 35 -12.252 3.784 -1.649 297 HG1 THR 35 HG1 THR 35 -13.831 2.255 -1.419 298 HG21 THR 35 HG21 THR 35 -13.251 4.644 -3.444 299 HG22 THR 35 HG22 THR 35 -13.886 3.053 -3.860 300 HG23 THR 35 HG23 THR 35 -12.318 3.567 -4.482 301 H GLN 36 H GLN 36 -9.371 3.803 -1.147 302 HA GLN 36 HA GLN 36 -8.711 1.428 0.435 303 HB2 GLN 36 HB2 GLN 36 -7.162 3.543 -0.521 304 HB3 GLN 36 HB3 GLN 36 -7.320 3.854 1.203 305 HG2 GLN 36 HG2 GLN 36 -6.601 1.447 1.552 306 HG3 GLN 36 HG3 GLN 36 -6.152 1.448 -0.152 307 HE21 GLN 36 HE21 GLN 36 -4.296 0.973 1.811 308 HE22 GLN 36 HE22 GLN 36 -3.185 2.294 1.888 309 H GLY 37 H GLY 37 -10.058 1.081 2.081 310 HA2 GLY 37 HA2 GLY 37 -10.968 1.475 4.181 311 HA3 GLY 37 HA3 GLY 37 -10.399 3.135 4.083 312 H GLY 38 H GLY 38 -11.618 4.068 1.826 313 HA2 GLY 38 HA2 GLY 38 -14.332 3.429 1.519 314 HA3 GLY 38 HA3 GLY 38 -14.205 4.677 2.750 315 H LYS 39 H LYS 39 -11.661 5.025 0.646 316 HA LYS 39 HA LYS 39 -13.156 6.755 -1.193 317 HB2 LYS 39 HB2 LYS 39 -12.157 8.043 0.770 318 HB3 LYS 39 HB3 LYS 39 -10.581 7.643 0.100 319 HG2 LYS 39 HG2 LYS 39 -10.723 9.434 -1.188 320 HG3 LYS 39 HG3 LYS 39 -12.088 8.689 -2.024 321 HD2 LYS 39 HD2 LYS 39 -13.561 9.619 -0.198 322 HD3 LYS 39 HD3 LYS 39 -12.160 10.542 0.351 323 HE2 LYS 39 HE2 LYS 39 -12.184 11.922 -1.474 324 HE3 LYS 39 HE3 LYS 39 -12.910 10.705 -2.521 325 HZ1 LYS 39 HZ1 LYS 39 -14.670 12.094 -2.230 326 HZ2 LYS 39 HZ2 LYS 39 -14.199 12.580 -0.680 327 HZ3 LYS 39 HZ3 LYS 39 -14.928 11.070 -0.909 328 H VAL 40 H VAL 40 -12.325 6.901 -3.245 329 HA VAL 40 HA VAL 40 -10.791 4.807 -4.238 330 HB VAL 40 HB VAL 40 -12.311 6.502 -5.488 331 HG11 VAL 40 HG11 VAL 40 -11.233 8.338 -6.549 332 HG12 VAL 40 HG12 VAL 40 -10.874 8.453 -4.825 333 HG13 VAL 40 HG13 VAL 40 -9.653 7.842 -5.942 334 HG21 VAL 40 HG21 VAL 40 -10.539 6.174 -7.524 335 HG22 VAL 40 HG22 VAL 40 -9.989 4.948 -6.382 336 HG23 VAL 40 HG23 VAL 40 -11.656 4.933 -6.957 337 H VAL 41 H VAL 41 -8.658 4.569 -4.823 338 HA VAL 41 HA VAL 41 -6.802 6.714 -4.041 339 HB VAL 41 HB VAL 41 -6.749 5.114 -2.232 340 HG11 VAL 41 HG11 VAL 41 -6.198 3.048 -4.360 341 HG12 VAL 41 HG12 VAL 41 -6.104 2.765 -2.621 342 HG13 VAL 41 HG13 VAL 41 -7.649 3.174 -3.367 343 HG21 VAL 41 HG21 VAL 41 -4.281 4.378 -3.717 344 HG22 VAL 41 HG22 VAL 41 -4.592 6.088 -3.416 345 HG23 VAL 41 HG23 VAL 41 -4.475 4.962 -2.064 346 H LYS 42 H LYS 42 -7.516 3.944 -6.048 347 HA LYS 42 HA LYS 42 -5.603 4.911 -8.023 348 HB2 LYS 42 HB2 LYS 42 -4.893 2.818 -6.381 349 HB3 LYS 42 HB3 LYS 42 -5.543 1.992 -7.791 350 HG2 LYS 42 HG2 LYS 42 -3.996 3.235 -9.225 351 HG3 LYS 42 HG3 LYS 42 -3.334 4.039 -7.800 352 HD2 LYS 42 HD2 LYS 42 -3.241 1.315 -7.204 353 HD3 LYS 42 HD3 LYS 42 -2.731 1.433 -8.890 354 HE2 LYS 42 HE2 LYS 42 -1.378 3.507 -7.731 355 HE3 LYS 42 HE3 LYS 42 -1.379 2.302 -6.443 356 HZ1 LYS 42 HZ1 LYS 42 -0.567 1.650 -9.214 357 HZ2 LYS 42 HZ2 LYS 42 -0.279 0.761 -7.804 358 HZ3 LYS 42 HZ3 LYS 42 0.534 2.222 -8.063 359 H ASN 43 H ASN 43 -5.953 3.989 -10.161 360 HA ASN 43 HA ASN 43 -8.566 2.705 -10.520 361 HB2 ASN 43 HB2 ASN 43 -7.860 4.782 -12.511 362 HB3 ASN 43 HB3 ASN 43 -9.433 4.337 -11.855 363 HD21 ASN 43 HD21 ASN 43 -6.500 6.153 -11.271 364 HD22 ASN 43 HD22 ASN 43 -7.174 7.231 -10.101 365 H TRP 44 H TRP 44 -8.462 1.022 -11.851 366 HA TRP 44 HA TRP 44 -6.090 0.757 -13.570 367 HB2 TRP 44 HB2 TRP 44 -7.881 -1.284 -12.264 368 HB3 TRP 44 HB3 TRP 44 -6.789 -1.713 -13.578 369 HD1 TRP 44 HD1 TRP 44 -6.753 -0.547 -9.921 370 HE1 TRP 44 HE1 TRP 44 -4.440 -1.069 -8.921 371 HE3 TRP 44 HE3 TRP 44 -4.363 -2.090 -14.169 372 HZ2 TRP 44 HZ2 TRP 44 -1.933 -2.010 -9.815 373 HZ3 TRP 44 HZ3 TRP 44 -2.008 -2.784 -14.010 374 HH2 TRP 44 HH2 TRP 44 -0.820 -2.744 -11.878 375 H VAL 45 H VAL 45 -6.285 0.341 -15.730 376 HA VAL 45 HA VAL 45 -9.018 0.446 -16.831 377 HB VAL 45 HB VAL 45 -6.448 1.425 -18.084 378 HG11 VAL 45 HG11 VAL 45 -7.774 0.661 -19.863 379 HG12 VAL 45 HG12 VAL 45 -9.262 1.253 -19.121 380 HG13 VAL 45 HG13 VAL 45 -8.089 2.394 -19.779 381 HG21 VAL 45 HG21 VAL 45 -8.837 3.064 -17.279 382 HG22 VAL 45 HG22 VAL 45 -7.475 2.779 -16.195 383 HG23 VAL 45 HG23 VAL 45 -7.224 3.622 -17.724 384 H MET 46 H MET 46 -9.614 -0.988 -18.408 385 HA MET 46 HA MET 46 -7.794 -3.249 -18.819 386 HB2 MET 46 HB2 MET 46 -9.862 -3.985 -17.940 387 HB3 MET 46 HB3 MET 46 -10.783 -2.954 -19.026 388 HG2 MET 46 HG2 MET 46 -10.575 -4.384 -20.792 389 HG3 MET 46 HG3 MET 46 -9.053 -5.055 -20.210 390 HE1 MET 46 HE1 MET 46 -12.633 -4.534 -19.663 391 HE2 MET 46 HE2 MET 46 -13.133 -6.162 -20.120 392 HE3 MET 46 HE3 MET 46 -13.125 -5.686 -18.421 393 H ASP 47 H ASP 47 -6.580 -3.007 -20.586 394 HA ASP 47 HA ASP 47 -7.407 -1.493 -22.862 395 HB2 ASP 47 HB2 ASP 47 -4.999 -2.032 -21.953 396 HB3 ASP 47 HB3 ASP 47 -5.149 -3.457 -22.978 397 H LEU 48 H LEU 48 -8.719 -2.142 -24.422 398 HA LEU 48 HA LEU 48 -9.324 -4.972 -24.725 399 HB2 LEU 48 HB2 LEU 48 -11.139 -3.316 -24.630 400 HB3 LEU 48 HB3 LEU 48 -10.512 -2.563 -26.095 401 HG LEU 48 HG LEU 48 -12.550 -4.148 -26.252 402 HD11 LEU 48 HD11 LEU 48 -10.727 -5.122 -28.268 403 HD12 LEU 48 HD12 LEU 48 -10.547 -3.386 -28.020 404 HD13 LEU 48 HD13 LEU 48 -12.124 -4.058 -28.430 405 HD21 LEU 48 HD21 LEU 48 -12.246 -6.407 -26.166 406 HD22 LEU 48 HD22 LEU 48 -11.068 -5.911 -24.951 407 HD23 LEU 48 HD23 LEU 48 -10.535 -6.307 -26.585 408 H LYS 49 H LYS 49 -7.476 -2.513 -26.259 409 HA LYS 49 HA LYS 49 -7.380 -3.740 -28.853 410 HB2 LYS 49 HB2 LYS 49 -6.052 -1.963 -29.494 411 HB3 LYS 49 HB3 LYS 49 -6.953 -1.251 -28.162 412 HG2 LYS 49 HG2 LYS 49 -5.029 -1.786 -26.669 413 HG3 LYS 49 HG3 LYS 49 -4.130 -2.291 -28.102 414 HD2 LYS 49 HD2 LYS 49 -4.282 -0.079 -29.039 415 HD3 LYS 49 HD3 LYS 49 -5.345 0.446 -27.732 416 HE2 LYS 49 HE2 LYS 49 -3.612 0.366 -26.148 417 HE3 LYS 49 HE3 LYS 49 -2.579 -0.599 -27.202 418 HZ1 LYS 49 HZ1 LYS 49 -2.471 1.352 -28.704 419 HZ2 LYS 49 HZ2 LYS 49 -1.771 1.626 -27.189 420 HZ3 LYS 49 HZ3 LYS 49 -3.300 2.259 -27.541 421 H ASN 50 H ASN 50 -5.359 -3.733 -25.966 422 HA ASN 50 HA ASN 50 -3.512 -5.611 -27.266 423 HB2 ASN 50 HB2 ASN 50 -3.250 -3.848 -24.833 424 HB3 ASN 50 HB3 ASN 50 -2.111 -5.148 -25.170 425 HD21 ASN 50 HD21 ASN 50 -1.314 -2.521 -24.992 426 HD22 ASN 50 HD22 ASN 50 -0.805 -1.972 -26.549 427 H VAL 51 H VAL 51 -6.116 -5.496 -25.129 428 HA VAL 51 HA VAL 51 -7.159 -7.076 -23.864 429 HB VAL 51 HB VAL 51 -5.186 -9.144 -24.779 430 HG11 VAL 51 HG11 VAL 51 -6.749 -10.647 -24.171 431 HG12 VAL 51 HG12 VAL 51 -7.357 -9.321 -23.177 432 HG13 VAL 51 HG13 VAL 51 -8.084 -9.650 -24.751 433 HG21 VAL 51 HG21 VAL 51 -5.593 -8.358 -26.876 434 HG22 VAL 51 HG22 VAL 51 -7.025 -9.370 -26.689 435 HG23 VAL 51 HG23 VAL 51 -7.134 -7.630 -26.425 436 H LYS 52 H LYS 52 -5.011 -5.533 -22.756 437 HA LYS 52 HA LYS 52 -4.187 -7.363 -20.606 438 HB2 LYS 52 HB2 LYS 52 -2.312 -6.759 -22.223 439 HB3 LYS 52 HB3 LYS 52 -2.447 -5.114 -21.614 440 HG2 LYS 52 HG2 LYS 52 -1.450 -5.613 -19.656 441 HG3 LYS 52 HG3 LYS 52 -2.165 -7.225 -19.576 442 HD2 LYS 52 HD2 LYS 52 0.029 -7.771 -19.950 443 HD3 LYS 52 HD3 LYS 52 -0.555 -7.673 -21.613 444 HE2 LYS 52 HE2 LYS 52 0.712 -5.879 -22.073 445 HE3 LYS 52 HE3 LYS 52 0.366 -5.119 -20.520 446 HZ1 LYS 52 HZ1 LYS 52 1.945 -7.139 -19.774 447 HZ2 LYS 52 HZ2 LYS 52 2.511 -5.585 -20.128 448 HZ3 LYS 52 HZ3 LYS 52 2.591 -6.801 -21.301 449 H LEU 53 H LEU 53 -3.649 -6.229 -18.572 450 HA LEU 53 HA LEU 53 -5.358 -3.855 -18.241 451 HB2 LEU 53 HB2 LEU 53 -5.029 -6.303 -16.722 452 HB3 LEU 53 HB3 LEU 53 -4.820 -4.872 -15.715 453 HG LEU 53 HG LEU 53 -7.050 -4.077 -16.489 454 HD11 LEU 53 HD11 LEU 53 -7.421 -6.855 -17.577 455 HD12 LEU 53 HD12 LEU 53 -6.991 -5.478 -18.592 456 HD13 LEU 53 HD13 LEU 53 -8.513 -5.475 -17.701 457 HD21 LEU 53 HD21 LEU 53 -6.944 -6.770 -15.135 458 HD22 LEU 53 HD22 LEU 53 -8.339 -5.691 -15.138 459 HD23 LEU 53 HD23 LEU 53 -6.838 -5.191 -14.356 460 H VAL 54 H VAL 54 -4.506 -2.006 -17.497 461 HA VAL 54 HA VAL 54 -1.928 -2.025 -16.134 462 HB VAL 54 HB VAL 54 -0.911 -0.392 -17.578 463 HG11 VAL 54 HG11 VAL 54 -0.807 -2.853 -18.152 464 HG12 VAL 54 HG12 VAL 54 -2.016 -2.521 -19.394 465 HG13 VAL 54 HG13 VAL 54 -0.438 -1.735 -19.464 466 HG21 VAL 54 HG21 VAL 54 -3.562 -0.423 -18.985 467 HG22 VAL 54 HG22 VAL 54 -2.678 0.953 -18.326 468 HG23 VAL 54 HG23 VAL 54 -2.096 0.147 -19.782 469 H GLU 55 H GLU 55 -1.331 0.372 -15.587 470 HA GLU 55 HA GLU 55 -3.706 1.516 -14.333 471 HB2 GLU 55 HB2 GLU 55 -1.153 1.092 -13.404 472 HB3 GLU 55 HB3 GLU 55 -1.130 2.806 -13.793 473 HG2 GLU 55 HG2 GLU 55 -3.544 2.201 -12.401 474 HG3 GLU 55 HG3 GLU 55 -2.174 1.551 -11.502 475 H SER 56 H SER 56 -4.779 2.939 -15.537 476 HA SER 56 HA SER 56 -3.381 5.258 -16.567 477 HB2 SER 56 HB2 SER 56 -3.233 3.719 -18.465 478 HB3 SER 56 HB3 SER 56 -4.975 3.455 -18.406 479 HG SER 56 HG SER 56 -3.540 5.722 -19.231 480 H ASP 57 H ASP 57 -5.024 6.814 -17.589 481 HA ASP 57 HA ASP 57 -7.544 6.663 -16.067 482 HB2 ASP 57 HB2 ASP 57 -5.578 8.534 -15.723 483 HB3 ASP 57 HB3 ASP 57 -6.635 9.341 -16.878 484 H ASP 58 H ASP 58 -6.424 6.248 -19.034 485 HA ASP 58 HA ASP 58 -7.712 7.934 -20.781 486 HB2 ASP 58 HB2 ASP 58 -6.268 5.657 -21.064 487 HB3 ASP 58 HB3 ASP 58 -7.874 5.067 -21.486 488 H ALA 59 H ALA 59 -9.677 7.532 -22.093 489 HA ALA 59 HA ALA 59 -11.980 7.515 -20.559 490 HB1 ALA 59 HB1 ALA 59 -13.124 6.977 -22.807 491 HB2 ALA 59 HB2 ALA 59 -12.198 8.473 -22.665 492 HB3 ALA 59 HB3 ALA 59 -11.497 7.076 -23.481 493 H ALA 60 H ALA 60 -13.784 5.982 -20.572 494 HA ALA 60 HA ALA 60 -13.132 3.198 -21.093 495 HB1 ALA 60 HB1 ALA 60 -13.752 4.215 -18.326 496 HB2 ALA 60 HB2 ALA 60 -13.793 2.514 -18.790 497 HB3 ALA 60 HB3 ALA 60 -12.278 3.412 -18.867 498 H GLU 61 H GLU 61 -14.901 1.965 -21.544 499 HA GLU 61 HA GLU 61 -17.283 3.198 -22.302 500 HB2 GLU 61 HB2 GLU 61 -16.880 0.285 -21.601 501 HB3 GLU 61 HB3 GLU 61 -18.184 0.946 -22.578 502 HG2 GLU 61 HG2 GLU 61 -15.289 0.648 -23.256 503 HG3 GLU 61 HG3 GLU 61 -16.705 0.079 -24.138 504 H ALA 62 H ALA 62 -16.275 1.914 -19.240 505 HA ALA 62 HA ALA 62 -18.557 3.077 -17.935 506 HB1 ALA 62 HB1 ALA 62 -18.823 0.641 -16.789 507 HB2 ALA 62 HB2 ALA 62 -19.827 1.230 -18.115 508 HB3 ALA 62 HB3 ALA 62 -18.447 0.185 -18.451 509 H THR 63 H THR 63 -18.404 2.915 -15.568 510 HA THR 63 HA THR 63 -15.619 2.502 -14.688 511 HB THR 63 HB THR 63 -17.530 4.480 -13.449 512 HG1 THR 63 HG1 THR 63 -15.459 5.065 -15.314 513 HG21 THR 63 HG21 THR 63 -14.863 3.539 -12.856 514 HG22 THR 63 HG22 THR 63 -15.923 4.578 -11.903 515 HG23 THR 63 HG23 THR 63 -14.875 5.279 -13.136 516 H LEU 64 H LEU 64 -15.361 0.976 -13.204 517 HA LEU 64 HA LEU 64 -17.676 0.229 -11.540 518 HB2 LEU 64 HB2 LEU 64 -17.202 -1.607 -12.922 519 HB3 LEU 64 HB3 LEU 64 -15.462 -1.413 -12.724 520 HG LEU 64 HG LEU 64 -15.807 -2.087 -10.302 521 HD11 LEU 64 HD11 LEU 64 -18.550 -2.251 -11.305 522 HD12 LEU 64 HD12 LEU 64 -17.949 -2.097 -9.655 523 HD13 LEU 64 HD13 LEU 64 -18.010 -3.682 -10.426 524 HD21 LEU 64 HD21 LEU 64 -15.142 -4.123 -10.926 525 HD22 LEU 64 HD22 LEU 64 -15.361 -3.564 -12.585 526 HD23 LEU 64 HD23 LEU 64 -16.654 -4.448 -11.773 527 H THR 65 H THR 65 -17.451 0.969 -9.541 528 HA THR 65 HA THR 65 -14.765 1.227 -8.393 529 HB THR 65 HB THR 65 -17.294 2.261 -7.130 530 HG1 THR 65 HG1 THR 65 -17.352 3.845 -8.537 531 HG21 THR 65 HG21 THR 65 -14.517 2.309 -6.475 532 HG22 THR 65 HG22 THR 65 -15.874 2.994 -5.579 533 HG23 THR 65 HG23 THR 65 -15.048 3.958 -6.804 534 H MET 66 H MET 66 -14.059 -0.322 -7.091 535 HA MET 66 HA MET 66 -15.896 -1.570 -5.202 536 HB2 MET 66 HB2 MET 66 -14.234 -3.105 -7.202 537 HB3 MET 66 HB3 MET 66 -14.951 -3.836 -5.772 538 HG2 MET 66 HG2 MET 66 -17.140 -3.467 -6.559 539 HG3 MET 66 HG3 MET 66 -16.580 -2.378 -7.826 540 HE1 MET 66 HE1 MET 66 -14.688 -6.257 -7.583 541 HE2 MET 66 HE2 MET 66 -15.705 -5.607 -6.298 542 HE3 MET 66 HE3 MET 66 -16.352 -6.815 -7.409 543 H GLU 67 H GLU 67 -14.994 -1.777 -3.251 544 HA GLU 67 HA GLU 67 -12.479 -0.747 -2.642 545 HB2 GLU 67 HB2 GLU 67 -14.670 -1.805 -1.214 546 HB3 GLU 67 HB3 GLU 67 -13.255 -2.700 -0.679 547 HG2 GLU 67 HG2 GLU 67 -12.510 0.011 -0.762 548 HG3 GLU 67 HG3 GLU 67 -14.090 -0.064 0.016 549 H ASP 68 H ASP 68 -10.706 -1.976 -1.515 550 HA ASP 68 HA ASP 68 -9.608 -3.885 -3.281 551 HB2 ASP 68 HB2 ASP 68 -8.285 -2.339 -1.828 552 HB3 ASP 68 HB3 ASP 68 -8.751 -3.314 -0.437 553 H ASP 69 H ASP 69 -10.802 -4.239 0.059 554 HA ASP 69 HA ASP 69 -10.480 -7.012 0.235 555 HB2 ASP 69 HB2 ASP 69 -11.646 -6.889 2.235 556 HB3 ASP 69 HB3 ASP 69 -11.078 -5.231 2.057 557 H ILE 70 H ILE 70 -13.082 -5.064 -1.085 558 HA ILE 70 HA ILE 70 -14.897 -7.260 -1.409 559 HB ILE 70 HB ILE 70 -14.877 -4.424 -2.395 560 HG12 ILE 70 HG12 ILE 70 -17.282 -5.074 -1.122 561 HG13 ILE 70 HG13 ILE 70 -16.042 -5.909 -0.193 562 HG21 ILE 70 HG21 ILE 70 -15.796 -5.562 -4.251 563 HG22 ILE 70 HG22 ILE 70 -16.733 -6.641 -3.218 564 HG23 ILE 70 HG23 ILE 70 -17.167 -4.935 -3.335 565 HD11 ILE 70 HD11 ILE 70 -16.206 -2.966 -0.779 566 HD12 ILE 70 HD12 ILE 70 -16.399 -3.767 0.780 567 HD13 ILE 70 HD13 ILE 70 -14.824 -3.748 -0.013 568 H MET 71 H MET 71 -12.911 -5.335 -3.656 569 HA MET 71 HA MET 71 -13.541 -6.651 -6.008 570 HB2 MET 71 HB2 MET 71 -12.163 -4.570 -5.790 571 HB3 MET 71 HB3 MET 71 -10.811 -5.575 -5.286 572 HG2 MET 71 HG2 MET 71 -10.522 -6.479 -7.380 573 HG3 MET 71 HG3 MET 71 -12.185 -6.154 -7.864 574 HE1 MET 71 HE1 MET 71 -12.425 -2.638 -8.799 575 HE2 MET 71 HE2 MET 71 -12.312 -3.964 -9.956 576 HE3 MET 71 HE3 MET 71 -13.156 -4.200 -8.425 577 H PHE 72 H PHE 72 -11.279 -7.557 -3.475 578 HA PHE 72 HA PHE 72 -10.055 -9.688 -4.907 579 HB2 PHE 72 HB2 PHE 72 -9.317 -8.411 -2.715 580 HB3 PHE 72 HB3 PHE 72 -10.214 -9.703 -1.922 581 HD1 PHE 72 HD1 PHE 72 -8.061 -9.763 -4.957 582 HD2 PHE 72 HD2 PHE 72 -8.644 -11.091 -0.956 583 HE1 PHE 72 HE1 PHE 72 -6.105 -11.241 -5.166 584 HE2 PHE 72 HE2 PHE 72 -6.689 -12.571 -1.158 585 HZ PHE 72 HZ PHE 72 -5.416 -12.647 -3.265 586 H ALA 73 H ALA 73 -12.765 -9.482 -2.655 587 HA ALA 73 HA ALA 73 -13.216 -12.238 -2.342 588 HB1 ALA 73 HB1 ALA 73 -15.316 -11.658 -1.412 589 HB2 ALA 73 HB2 ALA 73 -14.198 -10.370 -0.964 590 HB3 ALA 73 HB3 ALA 73 -15.352 -10.119 -2.273 591 H ILE 74 H ILE 74 -14.696 -9.898 -4.582 592 HA ILE 74 HA ILE 74 -16.193 -11.932 -5.949 593 HB ILE 74 HB ILE 74 -15.687 -9.029 -6.594 594 HG12 ILE 74 HG12 ILE 74 -18.431 -9.821 -6.163 595 HG13 ILE 74 HG13 ILE 74 -17.432 -10.309 -4.799 596 HG21 ILE 74 HG21 ILE 74 -17.307 -11.085 -8.076 597 HG22 ILE 74 HG22 ILE 74 -17.550 -9.349 -8.263 598 HG23 ILE 74 HG23 ILE 74 -16.002 -10.073 -8.696 599 HD11 ILE 74 HD11 ILE 74 -17.565 -8.247 -4.024 600 HD12 ILE 74 HD12 ILE 74 -16.679 -7.681 -5.441 601 HD13 ILE 74 HD13 ILE 74 -18.442 -7.729 -5.464 602 H GLY 75 H GLY 75 -13.172 -10.206 -6.476 603 HA2 GLY 75 HA2 GLY 75 -12.718 -10.945 -9.145 604 HA3 GLY 75 HA3 GLY 75 -11.469 -10.535 -7.978 605 H THR 76 H THR 76 -12.235 -12.708 -6.160 606 HA THR 76 HA THR 76 -10.886 -14.871 -7.602 607 HB THR 76 HB THR 76 -10.360 -15.822 -5.442 608 HG1 THR 76 HG1 THR 76 -11.729 -15.422 -3.884 609 HG21 THR 76 HG21 THR 76 -9.641 -13.210 -4.548 610 HG22 THR 76 HG22 THR 76 -9.511 -13.260 -6.306 611 HG23 THR 76 HG23 THR 76 -8.628 -14.427 -5.322 612 H GLY 77 H GLY 77 -13.942 -14.012 -7.255 613 HA2 GLY 77 HA2 GLY 77 -15.895 -15.198 -7.573 614 HA3 GLY 77 HA3 GLY 77 -14.937 -16.670 -7.626 615 H ALA 78 H ALA 78 -14.476 -14.679 -4.878 616 HA ALA 78 HA ALA 78 -15.491 -16.720 -3.138 617 HB1 ALA 78 HB1 ALA 78 -14.507 -15.551 -1.400 618 HB2 ALA 78 HB2 ALA 78 -13.487 -15.118 -2.773 619 HB3 ALA 78 HB3 ALA 78 -14.713 -13.990 -2.196 620 H LEU 79 H LEU 79 -16.273 -13.242 -3.367 621 HA LEU 79 HA LEU 79 -18.936 -13.839 -2.296 622 HB2 LEU 79 HB2 LEU 79 -17.163 -11.462 -2.301 623 HB3 LEU 79 HB3 LEU 79 -18.901 -11.175 -2.327 624 HG LEU 79 HG LEU 79 -17.429 -12.758 -0.221 625 HD11 LEU 79 HD11 LEU 79 -16.982 -10.837 0.786 626 HD12 LEU 79 HD12 LEU 79 -18.694 -10.418 0.776 627 HD13 LEU 79 HD13 LEU 79 -17.667 -9.958 -0.581 628 HD21 LEU 79 HD21 LEU 79 -19.583 -12.575 0.994 629 HD22 LEU 79 HD22 LEU 79 -19.686 -13.549 -0.473 630 HD23 LEU 79 HD23 LEU 79 -20.309 -11.898 -0.464 631 HA PRO 80 HA PRO 80 -20.856 -13.226 -6.209 632 HB2 PRO 80 HB2 PRO 80 -23.342 -12.535 -5.366 633 HB3 PRO 80 HB3 PRO 80 -22.722 -14.188 -5.275 634 HG2 PRO 80 HG2 PRO 80 -22.884 -12.104 -3.131 635 HG3 PRO 80 HG3 PRO 80 -23.263 -13.834 -3.041 636 HD2 PRO 80 HD2 PRO 80 -20.929 -12.805 -2.132 637 HD3 PRO 80 HD3 PRO 80 -21.050 -14.437 -2.822 638 H ALA 81 H ALA 81 -20.416 -11.533 -7.468 639 HA ALA 81 HA ALA 81 -20.099 -8.896 -6.661 640 HB1 ALA 81 HB1 ALA 81 -19.676 -8.419 -8.845 641 HB2 ALA 81 HB2 ALA 81 -19.537 -10.176 -8.915 642 HB3 ALA 81 HB3 ALA 81 -21.026 -9.388 -9.436 643 H LYS 82 H LYS 82 -22.985 -10.644 -7.474 644 HA LYS 82 HA LYS 82 -24.674 -8.447 -8.029 645 HB2 LYS 82 HB2 LYS 82 -26.517 -10.076 -7.436 646 HB3 LYS 82 HB3 LYS 82 -25.417 -10.599 -8.705 647 HG2 LYS 82 HG2 LYS 82 -24.186 -11.933 -7.017 648 HG3 LYS 82 HG3 LYS 82 -25.413 -11.487 -5.828 649 HD2 LYS 82 HD2 LYS 82 -26.450 -12.588 -8.353 650 HD3 LYS 82 HD3 LYS 82 -25.513 -13.715 -7.369 651 HE2 LYS 82 HE2 LYS 82 -26.955 -13.374 -5.491 652 HE3 LYS 82 HE3 LYS 82 -27.792 -12.055 -6.307 653 HZ1 LYS 82 HZ1 LYS 82 -29.209 -13.533 -7.109 654 HZ2 LYS 82 HZ2 LYS 82 -28.357 -14.807 -6.394 655 HZ3 LYS 82 HZ3 LYS 82 -27.956 -14.292 -7.955 656 H GLU 83 H GLU 83 -24.136 -10.315 -5.046 657 HA GLU 83 HA GLU 83 -25.892 -8.823 -3.431 658 HB2 GLU 83 HB2 GLU 83 -23.432 -10.393 -2.642 659 HB3 GLU 83 HB3 GLU 83 -24.666 -9.819 -1.529 660 HG2 GLU 83 HG2 GLU 83 -25.287 -11.659 -3.817 661 HG3 GLU 83 HG3 GLU 83 -24.799 -12.243 -2.227 662 H ALA 84 H ALA 84 -22.351 -8.631 -3.767 663 HA ALA 84 HA ALA 84 -21.827 -6.567 -2.026 664 HB1 ALA 84 HB1 ALA 84 -19.927 -7.523 -2.898 665 HB2 ALA 84 HB2 ALA 84 -20.531 -7.473 -4.555 666 HB3 ALA 84 HB3 ALA 84 -19.972 -5.993 -3.775 667 H MET 85 H MET 85 -22.878 -6.346 -5.406 668 HA MET 85 HA MET 85 -22.775 -3.514 -5.539 669 HB2 MET 85 HB2 MET 85 -23.287 -5.625 -7.320 670 HB3 MET 85 HB3 MET 85 -24.744 -4.640 -7.324 671 HG2 MET 85 HG2 MET 85 -22.330 -3.040 -7.469 672 HG3 MET 85 HG3 MET 85 -22.456 -4.198 -8.791 673 HE1 MET 85 HE1 MET 85 -25.803 -3.273 -10.477 674 HE2 MET 85 HE2 MET 85 -24.187 -3.851 -10.881 675 HE3 MET 85 HE3 MET 85 -25.111 -4.639 -9.601 676 H ALA 86 H ALA 86 -25.243 -5.819 -4.591 677 HA ALA 86 HA ALA 86 -27.357 -3.880 -4.475 678 HB1 ALA 86 HB1 ALA 86 -27.715 -6.317 -4.870 679 HB2 ALA 86 HB2 ALA 86 -27.280 -6.601 -3.184 680 HB3 ALA 86 HB3 ALA 86 -28.704 -5.639 -3.576 681 H GLN 87 H GLN 87 -24.800 -4.828 -2.404 682 HA GLN 87 HA GLN 87 -26.107 -3.871 0.009 683 HB2 GLN 87 HB2 GLN 87 -23.291 -4.879 -0.430 684 HB3 GLN 87 HB3 GLN 87 -24.008 -4.502 1.131 685 HG2 GLN 87 HG2 GLN 87 -25.507 -6.418 -0.518 686 HG3 GLN 87 HG3 GLN 87 -23.930 -6.966 0.049 687 HE21 GLN 87 HE21 GLN 87 -24.805 -8.492 1.425 688 HE22 GLN 87 HE22 GLN 87 -25.623 -8.067 2.886 689 H ASP 88 H ASP 88 -25.077 -2.263 -2.486 690 HA ASP 88 HA ASP 88 -24.352 -0.139 -2.859 691 HB2 ASP 88 HB2 ASP 88 -25.805 0.116 -0.658 692 HB3 ASP 88 HB3 ASP 88 -24.236 0.465 0.063 693 H LYS 89 H LYS 89 -22.539 -2.445 -1.877 694 HA LYS 89 HA LYS 89 -20.239 -0.953 -0.898 695 HB2 LYS 89 HB2 LYS 89 -20.811 -3.874 -1.326 696 HB3 LYS 89 HB3 LYS 89 -19.175 -3.303 -1.024 697 HG2 LYS 89 HG2 LYS 89 -21.194 -2.324 0.867 698 HG3 LYS 89 HG3 LYS 89 -20.918 -4.067 0.897 699 HD2 LYS 89 HD2 LYS 89 -18.597 -3.771 1.343 700 HD3 LYS 89 HD3 LYS 89 -18.695 -2.037 1.026 701 HE2 LYS 89 HE2 LYS 89 -20.235 -1.838 2.974 702 HE3 LYS 89 HE3 LYS 89 -19.943 -3.542 3.322 703 HZ1 LYS 89 HZ1 LYS 89 -17.490 -2.163 3.009 704 HZ2 LYS 89 HZ2 LYS 89 -18.065 -3.023 4.348 705 HZ3 LYS 89 HZ3 LYS 89 -18.444 -1.384 4.170 706 H MET 90 H MET 90 -21.587 -1.654 -3.853 707 HA MET 90 HA MET 90 -19.112 -0.970 -5.218 708 HB2 MET 90 HB2 MET 90 -18.838 -3.263 -5.467 709 HB3 MET 90 HB3 MET 90 -20.568 -3.563 -5.566 710 HG2 MET 90 HG2 MET 90 -20.491 -2.339 -7.792 711 HG3 MET 90 HG3 MET 90 -18.739 -2.489 -7.683 712 HE1 MET 90 HE1 MET 90 -19.010 -6.582 -7.001 713 HE2 MET 90 HE2 MET 90 -18.154 -5.154 -6.418 714 HE3 MET 90 HE3 MET 90 -19.791 -5.492 -5.854 715 H GLU 91 H GLU 91 -19.443 0.315 -6.952 716 HA GLU 91 HA GLU 91 -22.210 0.608 -7.921 717 HB2 GLU 91 HB2 GLU 91 -20.194 2.833 -7.568 718 HB3 GLU 91 HB3 GLU 91 -21.838 3.006 -8.167 719 HG2 GLU 91 HG2 GLU 91 -22.424 3.457 -6.080 720 HG3 GLU 91 HG3 GLU 91 -22.164 1.748 -5.734 721 H VAL 92 H VAL 92 -22.456 1.243 -10.116 722 HA VAL 92 HA VAL 92 -20.052 1.062 -11.788 723 HB VAL 92 HB VAL 92 -22.577 -0.416 -12.508 724 HG11 VAL 92 HG11 VAL 92 -19.845 -0.142 -13.664 725 HG12 VAL 92 HG12 VAL 92 -20.720 -1.657 -13.890 726 HG13 VAL 92 HG13 VAL 92 -21.415 -0.141 -14.467 727 HG21 VAL 92 HG21 VAL 92 -20.284 -1.259 -10.816 728 HG22 VAL 92 HG22 VAL 92 -21.987 -1.707 -10.718 729 HG23 VAL 92 HG23 VAL 92 -20.954 -2.432 -11.950 730 H ASP 93 H ASP 93 -20.060 2.363 -13.553 731 HA ASP 93 HA ASP 93 -22.547 3.829 -14.144 732 HB2 ASP 93 HB2 ASP 93 -20.449 5.001 -12.929 733 HB3 ASP 93 HB3 ASP 93 -19.967 5.215 -14.610 734 H GLY 94 H GLY 94 -21.909 5.226 -16.319 735 HA2 GLY 94 HA2 GLY 94 -21.267 5.138 -18.553 736 HA3 GLY 94 HA3 GLY 94 -20.460 3.609 -18.233 737 H GLN 95 H GLN 95 -21.278 2.048 -19.446 738 HA GLN 95 HA GLN 95 -24.057 2.179 -20.308 739 HB2 GLN 95 HB2 GLN 95 -21.601 0.936 -21.290 740 HB3 GLN 95 HB3 GLN 95 -22.993 -0.135 -21.373 741 HG2 GLN 95 HG2 GLN 95 -22.696 2.577 -22.635 742 HG3 GLN 95 HG3 GLN 95 -22.806 1.017 -23.448 743 HE21 GLN 95 HE21 GLN 95 -24.861 -0.238 -22.697 744 HE22 GLN 95 HE22 GLN 95 -26.325 0.677 -22.762 745 H VAL 96 H VAL 96 -25.432 1.476 -18.783 746 HA VAL 96 HA VAL 96 -24.867 -0.502 -16.857 747 HB VAL 96 HB VAL 96 -27.565 0.413 -17.865 748 HG11 VAL 96 HG11 VAL 96 -27.869 -0.285 -15.241 749 HG12 VAL 96 HG12 VAL 96 -28.297 -1.301 -16.620 750 HG13 VAL 96 HG13 VAL 96 -26.738 -1.508 -15.820 751 HG21 VAL 96 HG21 VAL 96 -26.073 2.214 -16.995 752 HG22 VAL 96 HG22 VAL 96 -27.557 1.997 -16.068 753 HG23 VAL 96 HG23 VAL 96 -26.031 1.364 -15.450 754 H GLU 97 H GLU 97 -25.957 -0.688 -20.138 755 HA GLU 97 HA GLU 97 -27.064 -3.320 -19.974 756 HB2 GLU 97 HB2 GLU 97 -27.678 -1.665 -21.731 757 HB3 GLU 97 HB3 GLU 97 -26.067 -1.838 -22.412 758 HG2 GLU 97 HG2 GLU 97 -26.472 -3.984 -23.170 759 HG3 GLU 97 HG3 GLU 97 -27.809 -4.235 -22.049 760 H LEU 98 H LEU 98 -23.916 -1.972 -20.774 761 HA LEU 98 HA LEU 98 -22.810 -4.481 -21.627 762 HB2 LEU 98 HB2 LEU 98 -21.818 -1.718 -21.222 763 HB3 LEU 98 HB3 LEU 98 -20.630 -3.018 -21.160 764 HG LEU 98 HG LEU 98 -22.447 -3.021 -23.491 765 HD11 LEU 98 HD11 LEU 98 -20.396 -1.330 -24.283 766 HD12 LEU 98 HD12 LEU 98 -20.946 -0.667 -22.745 767 HD13 LEU 98 HD13 LEU 98 -22.094 -0.904 -24.062 768 HD21 LEU 98 HD21 LEU 98 -19.502 -3.141 -23.703 769 HD22 LEU 98 HD22 LEU 98 -20.739 -4.123 -24.486 770 HD23 LEU 98 HD23 LEU 98 -20.285 -4.447 -22.812 771 H ILE 99 H ILE 99 -22.343 -2.407 -18.768 772 HA ILE 99 HA ILE 99 -20.588 -4.008 -17.357 773 HB ILE 99 HB ILE 99 -21.266 -2.876 -15.363 774 HG12 ILE 99 HG12 ILE 99 -23.383 -1.261 -15.801 775 HG13 ILE 99 HG13 ILE 99 -23.839 -2.626 -16.815 776 HG21 ILE 99 HG21 ILE 99 -21.811 -0.523 -16.837 777 HG22 ILE 99 HG22 ILE 99 -20.275 -1.059 -16.157 778 HG23 ILE 99 HG23 ILE 99 -20.718 -1.518 -17.801 779 HD11 ILE 99 HD11 ILE 99 -23.976 -2.341 -13.967 780 HD12 ILE 99 HD12 ILE 99 -24.644 -3.601 -15.004 781 HD13 ILE 99 HD13 ILE 99 -22.993 -3.740 -14.400 782 H PHE 100 H PHE 100 -24.016 -4.385 -17.842 783 HA PHE 100 HA PHE 100 -24.447 -6.264 -15.742 784 HB2 PHE 100 HB2 PHE 100 -26.018 -4.966 -17.767 785 HB3 PHE 100 HB3 PHE 100 -26.358 -6.693 -17.782 786 HD1 PHE 100 HD2 PHE 100 -26.364 -7.589 -15.131 787 HD2 PHE 100 HD1 PHE 100 -27.592 -3.788 -16.603 788 HE1 PHE 100 HE2 PHE 100 -27.841 -7.315 -13.183 789 HE2 PHE 100 HE1 PHE 100 -29.070 -3.508 -14.656 790 HZ PHE 100 HZ PHE 100 -29.197 -5.273 -12.943 791 H LEU 101 H LEU 101 -23.568 -6.504 -19.136 792 HA LEU 101 HA LEU 101 -23.892 -9.322 -19.339 793 HB2 LEU 101 HB2 LEU 101 -22.767 -7.156 -20.988 794 HB3 LEU 101 HB3 LEU 101 -22.083 -8.756 -21.266 795 HG LEU 101 HG LEU 101 -23.938 -8.136 -22.811 796 HD11 LEU 101 HD11 LEU 101 -24.750 -10.285 -22.924 797 HD12 LEU 101 HD12 LEU 101 -24.844 -10.458 -21.172 798 HD13 LEU 101 HD13 LEU 101 -23.278 -10.516 -21.980 799 HD21 LEU 101 HD21 LEU 101 -25.997 -7.566 -22.118 800 HD22 LEU 101 HD22 LEU 101 -25.179 -7.154 -20.610 801 HD23 LEU 101 HD23 LEU 101 -25.979 -8.717 -20.782 802 H LEU 102 H LEU 102 -21.643 -7.439 -17.718 803 HA LEU 102 HA LEU 102 -19.393 -9.230 -18.045 804 HB2 LEU 102 HB2 LEU 102 -19.901 -6.725 -16.492 805 HB3 LEU 102 HB3 LEU 102 -18.504 -7.732 -16.117 806 HG LEU 102 HG LEU 102 -19.078 -6.381 -18.754 807 HD11 LEU 102 HD11 LEU 102 -16.656 -5.822 -17.148 808 HD12 LEU 102 HD12 LEU 102 -18.182 -5.161 -16.560 809 HD13 LEU 102 HD13 LEU 102 -17.611 -4.754 -18.178 810 HD21 LEU 102 HD21 LEU 102 -16.940 -8.298 -17.881 811 HD22 LEU 102 HD22 LEU 102 -16.674 -7.149 -19.192 812 HD23 LEU 102 HD23 LEU 102 -17.957 -8.353 -19.320 813 H GLU 103 H GLU 103 -21.871 -8.534 -15.645 814 HA GLU 103 HA GLU 103 -20.948 -9.833 -13.425 815 HB2 GLU 103 HB2 GLU 103 -23.610 -9.270 -14.550 816 HB3 GLU 103 HB3 GLU 103 -23.567 -10.603 -13.404 817 HG2 GLU 103 HG2 GLU 103 -22.059 -8.416 -12.360 818 HG3 GLU 103 HG3 GLU 103 -23.649 -7.847 -12.863 819 HA PRO 104 HA PRO 104 -22.609 -14.067 -15.061 820 HB2 PRO 104 HB2 PRO 104 -23.352 -14.187 -17.669 821 HB3 PRO 104 HB3 PRO 104 -24.472 -13.759 -16.369 822 HG2 PRO 104 HG2 PRO 104 -23.004 -11.971 -18.269 823 HG3 PRO 104 HG3 PRO 104 -24.689 -11.883 -17.725 824 HD2 PRO 104 HD2 PRO 104 -22.741 -10.310 -16.694 825 HD3 PRO 104 HD3 PRO 104 -24.125 -10.870 -15.733 826 H PHE 105 H PHE 105 -20.395 -12.000 -16.512 827 HA PHE 105 HA PHE 105 -19.030 -14.151 -17.959 828 HB2 PHE 105 HB2 PHE 105 -19.224 -11.273 -18.283 829 HB3 PHE 105 HB3 PHE 105 -17.546 -11.805 -18.263 830 HD1 PHE 105 HD2 PHE 105 -20.816 -12.402 -19.903 831 HD2 PHE 105 HD1 PHE 105 -16.584 -12.786 -20.145 832 HE1 PHE 105 HE2 PHE 105 -21.018 -13.108 -22.251 833 HE2 PHE 105 HE1 PHE 105 -16.779 -13.491 -22.494 834 HZ PHE 105 HZ PHE 105 -18.998 -13.655 -23.550 835 H ILE 106 H ILE 106 -19.079 -12.840 -14.932 836 HA ILE 106 HA ILE 106 -16.436 -12.443 -14.202 837 HB ILE 106 HB ILE 106 -18.706 -13.609 -12.593 838 HG12 ILE 106 HG12 ILE 106 -17.483 -10.867 -12.360 839 HG13 ILE 106 HG13 ILE 106 -18.764 -11.204 -13.519 840 HG21 ILE 106 HG21 ILE 106 -15.963 -12.739 -11.703 841 HG22 ILE 106 HG22 ILE 106 -17.321 -12.992 -10.609 842 HG23 ILE 106 HG23 ILE 106 -16.684 -14.341 -11.549 843 HD11 ILE 106 HD11 ILE 106 -18.919 -11.467 -10.527 844 HD12 ILE 106 HD12 ILE 106 -19.718 -10.261 -11.537 845 HD13 ILE 106 HD13 ILE 106 -20.192 -11.956 -11.646 846 H ALA 107 H ALA 107 -18.118 -15.397 -14.900 847 HA ALA 107 HA ALA 107 -16.272 -17.160 -13.625 848 HB1 ALA 107 HB1 ALA 107 -17.624 -18.837 -14.325 849 HB2 ALA 107 HB2 ALA 107 -18.754 -17.502 -14.555 850 HB3 ALA 107 HB3 ALA 107 -17.849 -18.138 -15.929 851 H SER 108 H SER 108 -16.502 -15.684 -16.791 852 HA SER 108 HA SER 108 -14.745 -17.310 -18.220 853 HB2 SER 108 HB2 SER 108 -15.338 -14.356 -18.465 854 HB3 SER 108 HB3 SER 108 -14.347 -15.244 -19.623 855 HG SER 108 HG SER 108 -17.092 -15.552 -19.041 856 H LEU 109 H LEU 109 -13.903 -14.088 -16.948 857 HA LEU 109 HA LEU 109 -11.279 -15.156 -16.168 858 HB2 LEU 109 HB2 LEU 109 -11.822 -12.633 -17.720 859 HB3 LEU 109 HB3 LEU 109 -10.279 -12.999 -16.952 860 HG LEU 109 HG LEU 109 -10.302 -15.123 -18.414 861 HD11 LEU 109 HD11 LEU 109 -11.604 -14.058 -20.622 862 HD12 LEU 109 HD12 LEU 109 -12.723 -13.805 -19.283 863 HD13 LEU 109 HD13 LEU 109 -12.129 -15.426 -19.640 864 HD21 LEU 109 HD21 LEU 109 -10.005 -12.459 -19.792 865 HD22 LEU 109 HD22 LEU 109 -9.183 -13.970 -20.186 866 HD23 LEU 109 HD23 LEU 109 -8.818 -13.135 -18.676 867 H LYS 110 H LYS 110 -11.795 -15.141 -13.998 868 HA LYS 110 HA LYS 110 -11.313 -12.814 -12.549 869 HB2 LYS 110 HB2 LYS 110 -13.963 -12.908 -13.515 870 HB3 LYS 110 HB3 LYS 110 -14.051 -13.276 -11.798 871 HG2 LYS 110 HG2 LYS 110 -13.121 -11.220 -11.190 872 HG3 LYS 110 HG3 LYS 110 -12.513 -10.914 -12.819 873 HD2 LYS 110 HD2 LYS 110 -14.924 -10.850 -13.571 874 HD3 LYS 110 HD3 LYS 110 -15.369 -10.849 -11.863 875 HE2 LYS 110 HE2 LYS 110 -13.396 -8.850 -12.876 876 HE3 LYS 110 HE3 LYS 110 -15.115 -8.597 -13.170 877 HZ1 LYS 110 HZ1 LYS 110 -15.111 -9.196 -10.567 878 HZ2 LYS 110 HZ2 LYS 110 -15.034 -7.618 -11.170 879 HZ3 LYS 110 HZ3 LYS 110 -13.617 -8.413 -10.700 Start of MODEL 19 1 H1 MET 1 H MET 1 0.208 1.897 -0.773 2 HA MET 1 HA MET 1 1.800 1.371 -2.311 3 HB2 MET 1 HB2 MET 1 2.770 0.286 0.251 4 HB3 MET 1 HB3 MET 1 3.536 -0.396 -1.177 5 HG2 MET 1 HG2 MET 1 3.299 2.563 -0.747 6 HG3 MET 1 HG3 MET 1 4.644 1.619 -0.111 7 HE1 MET 1 HE1 MET 1 4.854 4.098 -3.067 8 HE2 MET 1 HE2 MET 1 5.306 3.825 -1.384 9 HE3 MET 1 HE3 MET 1 6.442 3.438 -2.678 10 H SER 2 H SER 2 0.711 -1.498 -0.530 11 HA SER 2 HA SER 2 0.649 -2.953 -3.093 12 HB2 SER 2 HB2 SER 2 1.091 -5.021 -1.850 13 HB3 SER 2 HB3 SER 2 2.380 -3.848 -1.580 14 HG SER 2 HG SER 2 1.966 -4.212 0.448 15 H LEU 3 H LEU 3 -1.328 -3.447 -3.744 16 HA LEU 3 HA LEU 3 -3.481 -3.589 -1.745 17 HB2 LEU 3 HB2 LEU 3 -3.473 -2.888 -4.665 18 HB3 LEU 3 HB3 LEU 3 -4.957 -3.297 -3.807 19 HG LEU 3 HG LEU 3 -3.358 -1.192 -2.532 20 HD11 LEU 3 HD11 LEU 3 -4.162 0.522 -4.163 21 HD12 LEU 3 HD12 LEU 3 -4.551 -0.795 -5.268 22 HD13 LEU 3 HD13 LEU 3 -2.880 -0.526 -4.770 23 HD21 LEU 3 HD21 LEU 3 -6.201 -1.858 -3.080 24 HD22 LEU 3 HD22 LEU 3 -5.785 -0.167 -2.800 25 HD23 LEU 3 HD23 LEU 3 -5.418 -1.381 -1.573 26 H LYS 4 H LYS 4 -4.738 -5.373 -1.565 27 HA LYS 4 HA LYS 4 -3.771 -7.851 -2.457 28 HB2 LYS 4 HB2 LYS 4 -5.756 -6.945 -0.691 29 HB3 LYS 4 HB3 LYS 4 -6.597 -7.952 -1.861 30 HG2 LYS 4 HG2 LYS 4 -6.021 -9.507 -0.291 31 HG3 LYS 4 HG3 LYS 4 -4.636 -9.619 -1.381 32 HD2 LYS 4 HD2 LYS 4 -3.431 -8.013 0.094 33 HD3 LYS 4 HD3 LYS 4 -4.789 -8.093 1.218 34 HE2 LYS 4 HE2 LYS 4 -4.394 -10.646 1.142 35 HE3 LYS 4 HE3 LYS 4 -2.816 -10.224 0.479 36 HZ1 LYS 4 HZ1 LYS 4 -3.904 -9.306 3.086 37 HZ2 LYS 4 HZ2 LYS 4 -2.398 -8.878 2.448 38 HZ3 LYS 4 HZ3 LYS 4 -2.710 -10.486 2.870 39 H SER 5 H SER 5 -6.156 -5.658 -3.790 40 HA SER 5 HA SER 5 -7.389 -7.380 -5.618 41 HB2 SER 5 HB2 SER 5 -7.323 -4.892 -6.875 42 HB3 SER 5 HB3 SER 5 -8.584 -5.486 -5.796 43 HG SER 5 HG SER 5 -6.314 -3.931 -5.116 44 H ASP 6 H ASP 6 -4.227 -6.096 -5.568 45 HA ASP 6 HA ASP 6 -3.567 -5.870 -8.249 46 HB2 ASP 6 HB2 ASP 6 -1.948 -6.745 -5.862 47 HB3 ASP 6 HB3 ASP 6 -1.235 -6.588 -7.466 48 H GLU 7 H GLU 7 -3.848 -8.747 -6.244 49 HA GLU 7 HA GLU 7 -2.701 -10.569 -8.072 50 HB2 GLU 7 HB2 GLU 7 -3.891 -10.678 -5.500 51 HB3 GLU 7 HB3 GLU 7 -4.736 -11.842 -6.510 52 HG2 GLU 7 HG2 GLU 7 -2.387 -12.643 -7.184 53 HG3 GLU 7 HG3 GLU 7 -1.843 -11.754 -5.763 54 H VAL 8 H VAL 8 -6.093 -9.722 -7.409 55 HA VAL 8 HA VAL 8 -7.388 -11.402 -9.143 56 HB VAL 8 HB VAL 8 -8.022 -8.540 -8.441 57 HG11 VAL 8 HG11 VAL 8 -9.064 -8.961 -10.567 58 HG12 VAL 8 HG12 VAL 8 -9.689 -10.510 -10.000 59 HG13 VAL 8 HG13 VAL 8 -10.299 -9.005 -9.310 60 HG21 VAL 8 HG21 VAL 8 -8.142 -10.030 -6.568 61 HG22 VAL 8 HG22 VAL 8 -9.788 -9.641 -7.068 62 HG23 VAL 8 HG23 VAL 8 -9.081 -11.199 -7.496 63 H PHE 9 H PHE 9 -6.172 -8.143 -9.926 64 HA PHE 9 HA PHE 9 -6.852 -8.160 -12.633 65 HB2 PHE 9 HB2 PHE 9 -4.662 -6.721 -11.136 66 HB3 PHE 9 HB3 PHE 9 -4.986 -6.445 -12.844 67 HD1 PHE 9 HD2 PHE 9 -7.922 -6.516 -12.904 68 HD2 PHE 9 HD1 PHE 9 -5.264 -4.744 -10.092 69 HE1 PHE 9 HE2 PHE 9 -9.653 -4.871 -12.310 70 HE2 PHE 9 HE1 PHE 9 -6.990 -3.097 -9.492 71 HZ PHE 9 HZ PHE 9 -9.188 -3.158 -10.602 72 H ALA 10 H ALA 10 -4.123 -9.543 -10.947 73 HA ALA 10 HA ALA 10 -2.509 -10.024 -13.238 74 HB1 ALA 10 HB1 ALA 10 -1.113 -11.298 -11.812 75 HB2 ALA 10 HB2 ALA 10 -1.727 -9.959 -10.840 76 HB3 ALA 10 HB3 ALA 10 -2.419 -11.571 -10.659 77 H LYS 11 H LYS 11 -4.823 -12.001 -11.420 78 HA LYS 11 HA LYS 11 -4.439 -14.340 -13.004 79 HB2 LYS 11 HB2 LYS 11 -6.887 -13.692 -11.368 80 HB3 LYS 11 HB3 LYS 11 -6.255 -15.279 -11.784 81 HG2 LYS 11 HG2 LYS 11 -5.115 -13.290 -9.844 82 HG3 LYS 11 HG3 LYS 11 -5.742 -14.905 -9.508 83 HD2 LYS 11 HD2 LYS 11 -3.832 -15.554 -11.258 84 HD3 LYS 11 HD3 LYS 11 -3.124 -14.069 -10.620 85 HE2 LYS 11 HE2 LYS 11 -3.496 -15.007 -8.318 86 HE3 LYS 11 HE3 LYS 11 -3.936 -16.532 -9.086 87 HZ1 LYS 11 HZ1 LYS 11 -1.456 -15.492 -10.060 88 HZ2 LYS 11 HZ2 LYS 11 -1.811 -17.024 -9.439 89 HZ3 LYS 11 HZ3 LYS 11 -1.419 -15.756 -8.390 90 H ILE 12 H ILE 12 -6.984 -11.856 -12.901 91 HA ILE 12 HA ILE 12 -8.579 -12.889 -14.953 92 HB ILE 12 HB ILE 12 -8.192 -10.031 -14.065 93 HG12 ILE 12 HG12 ILE 12 -10.419 -12.000 -13.504 94 HG13 ILE 12 HG13 ILE 12 -9.108 -11.629 -12.389 95 HG21 ILE 12 HG21 ILE 12 -9.989 -11.233 -16.122 96 HG22 ILE 12 HG22 ILE 12 -10.547 -9.855 -15.174 97 HG23 ILE 12 HG23 ILE 12 -9.092 -9.715 -16.161 98 HD11 ILE 12 HD11 ILE 12 -10.953 -10.369 -11.673 99 HD12 ILE 12 HD12 ILE 12 -9.887 -9.228 -12.494 100 HD13 ILE 12 HD13 ILE 12 -11.327 -9.835 -13.311 101 H ALA 13 H ALA 13 -5.725 -10.843 -15.051 102 HA ALA 13 HA ALA 13 -5.913 -10.123 -17.787 103 HB1 ALA 13 HB1 ALA 13 -3.741 -10.060 -15.740 104 HB2 ALA 13 HB2 ALA 13 -3.355 -9.767 -17.436 105 HB3 ALA 13 HB3 ALA 13 -4.512 -8.729 -16.603 106 H LYS 14 H LYS 14 -4.419 -12.818 -16.083 107 HA LYS 14 HA LYS 14 -3.005 -13.857 -18.315 108 HB2 LYS 14 HB2 LYS 14 -2.569 -14.375 -15.876 109 HB3 LYS 14 HB3 LYS 14 -3.985 -15.417 -15.923 110 HG2 LYS 14 HG2 LYS 14 -2.968 -16.891 -17.465 111 HG3 LYS 14 HG3 LYS 14 -1.654 -15.757 -17.788 112 HD2 LYS 14 HD2 LYS 14 -1.532 -16.130 -15.053 113 HD3 LYS 14 HD3 LYS 14 -1.938 -17.733 -15.670 114 HE2 LYS 14 HE2 LYS 14 0.412 -17.653 -15.644 115 HE3 LYS 14 HE3 LYS 14 -0.042 -17.408 -17.329 116 HZ1 LYS 14 HZ1 LYS 14 1.550 -15.775 -15.765 117 HZ2 LYS 14 HZ2 LYS 14 0.105 -14.924 -15.986 118 HZ3 LYS 14 HZ3 LYS 14 0.984 -15.460 -17.328 119 H ARG 15 H ARG 15 -6.255 -14.281 -17.079 120 HA ARG 15 HA ARG 15 -6.887 -16.533 -18.724 121 HB2 ARG 15 HB2 ARG 15 -8.041 -15.428 -16.531 122 HB3 ARG 15 HB3 ARG 15 -9.095 -14.807 -17.794 123 HG2 ARG 15 HG2 ARG 15 -10.166 -16.738 -17.857 124 HG3 ARG 15 HG3 ARG 15 -8.669 -17.563 -18.296 125 HD2 ARG 15 HD2 ARG 15 -8.158 -17.432 -15.753 126 HD3 ARG 15 HD3 ARG 15 -9.894 -17.167 -15.595 127 HE ARG 15 HE ARG 15 -10.235 -19.377 -16.075 128 HH11 ARG 15 HH11 ARG 15 -6.999 -18.498 -17.012 129 HH12 ARG 15 HH12 ARG 15 -6.522 -20.124 -17.372 130 HH21 ARG 15 HH21 ARG 15 -9.619 -21.522 -16.546 131 HH22 ARG 15 HH22 ARG 15 -8.013 -21.843 -17.107 132 H LEU 16 H LEU 16 -7.174 -13.052 -19.032 133 HA LEU 16 HA LEU 16 -8.898 -12.991 -21.260 134 HB2 LEU 16 HB2 LEU 16 -6.797 -11.043 -20.329 135 HB3 LEU 16 HB3 LEU 16 -7.939 -10.714 -21.631 136 HG LEU 16 HG LEU 16 -9.032 -11.487 -18.975 137 HD11 LEU 16 HD11 LEU 16 -7.241 -9.275 -19.342 138 HD12 LEU 16 HD12 LEU 16 -8.057 -9.824 -17.879 139 HD13 LEU 16 HD13 LEU 16 -8.862 -8.693 -18.966 140 HD21 LEU 16 HD21 LEU 16 -9.876 -10.062 -21.412 141 HD22 LEU 16 HD22 LEU 16 -10.480 -9.406 -19.890 142 HD23 LEU 16 HD23 LEU 16 -10.801 -11.088 -20.315 143 H GLU 17 H GLU 17 -5.650 -13.948 -20.958 144 HA GLU 17 HA GLU 17 -4.862 -13.326 -23.659 145 HB2 GLU 17 HB2 GLU 17 -3.591 -14.954 -21.462 146 HB3 GLU 17 HB3 GLU 17 -2.883 -14.811 -23.065 147 HG2 GLU 17 HG2 GLU 17 -2.929 -12.311 -22.724 148 HG3 GLU 17 HG3 GLU 17 -3.328 -12.641 -21.039 149 H SER 18 H SER 18 -6.665 -15.771 -22.162 150 HA SER 18 HA SER 18 -6.046 -17.786 -24.174 151 HB2 SER 18 HB2 SER 18 -6.463 -18.248 -21.660 152 HB3 SER 18 HB3 SER 18 -8.170 -18.051 -22.057 153 HG SER 18 HG SER 18 -8.151 -19.954 -22.935 154 H ILE 19 H ILE 19 -8.169 -15.206 -23.762 155 HA ILE 19 HA ILE 19 -10.561 -16.103 -24.858 156 HB ILE 19 HB ILE 19 -9.305 -13.385 -25.257 157 HG12 ILE 19 HG12 ILE 19 -11.211 -14.330 -23.105 158 HG13 ILE 19 HG13 ILE 19 -9.484 -14.078 -22.875 159 HG21 ILE 19 HG21 ILE 19 -11.645 -12.629 -25.506 160 HG22 ILE 19 HG22 ILE 19 -11.141 -13.739 -26.779 161 HG23 ILE 19 HG23 ILE 19 -12.165 -14.314 -25.463 162 HD11 ILE 19 HD11 ILE 19 -9.760 -11.711 -23.386 163 HD12 ILE 19 HD12 ILE 19 -11.491 -11.964 -23.620 164 HD13 ILE 19 HD13 ILE 19 -10.771 -12.206 -22.028 165 H ASP 20 H ASP 20 -11.370 -16.268 -26.923 166 HA ASP 20 HA ASP 20 -9.363 -16.232 -29.079 167 HB2 ASP 20 HB2 ASP 20 -11.199 -18.255 -28.244 168 HB3 ASP 20 HB3 ASP 20 -11.658 -17.722 -29.859 169 HA PRO 21 HA PRO 21 -11.634 -13.170 -31.252 170 HB2 PRO 21 HB2 PRO 21 -11.173 -13.898 -33.826 171 HB3 PRO 21 HB3 PRO 21 -9.932 -13.175 -32.796 172 HG2 PRO 21 HG2 PRO 21 -10.384 -16.054 -33.480 173 HG3 PRO 21 HG3 PRO 21 -8.861 -15.150 -33.394 174 HD2 PRO 21 HD2 PRO 21 -9.701 -16.781 -31.403 175 HD3 PRO 21 HD3 PRO 21 -8.745 -15.316 -31.098 176 H ALA 22 H ALA 22 -12.181 -16.507 -32.327 177 HA ALA 22 HA ALA 22 -14.540 -16.088 -33.765 178 HB1 ALA 22 HB1 ALA 22 -13.373 -18.165 -33.965 179 HB2 ALA 22 HB2 ALA 22 -13.588 -18.511 -32.248 180 HB3 ALA 22 HB3 ALA 22 -14.983 -18.503 -33.327 181 H ASN 23 H ASN 23 -14.168 -17.177 -30.386 182 HA ASN 23 HA ASN 23 -16.991 -16.657 -29.901 183 HB2 ASN 23 HB2 ASN 23 -15.067 -18.454 -28.835 184 HB3 ASN 23 HB3 ASN 23 -15.593 -17.408 -27.519 185 HD21 ASN 23 HD21 ASN 23 -17.061 -19.075 -30.292 186 HD22 ASN 23 HD22 ASN 23 -18.396 -19.723 -29.408 187 H ARG 24 H ARG 24 -17.611 -14.684 -29.342 188 HA ARG 24 HA ARG 24 -16.664 -13.305 -27.112 189 HB2 ARG 24 HB2 ARG 24 -15.076 -12.895 -29.479 190 HB3 ARG 24 HB3 ARG 24 -15.860 -11.390 -29.017 191 HG2 ARG 24 HG2 ARG 24 -14.851 -11.413 -26.876 192 HG3 ARG 24 HG3 ARG 24 -14.294 -13.075 -27.085 193 HD2 ARG 24 HD2 ARG 24 -12.636 -12.458 -28.600 194 HD3 ARG 24 HD3 ARG 24 -13.409 -10.915 -28.961 195 HE ARG 24 HE ARG 24 -12.771 -10.680 -26.346 196 HH11 ARG 24 HH11 ARG 24 -10.951 -11.589 -29.171 197 HH12 ARG 24 HH12 ARG 24 -9.451 -10.972 -28.563 198 HH21 ARG 24 HH21 ARG 24 -10.802 -9.864 -25.535 199 HH22 ARG 24 HH22 ARG 24 -9.367 -9.992 -26.494 200 H GLN 25 H GLN 25 -18.894 -13.119 -26.819 201 HA GLN 25 HA GLN 25 -20.701 -12.060 -28.681 202 HB2 GLN 25 HB2 GLN 25 -20.716 -12.777 -25.865 203 HB3 GLN 25 HB3 GLN 25 -21.701 -11.355 -26.180 204 HG2 GLN 25 HG2 GLN 25 -23.326 -12.742 -26.759 205 HG3 GLN 25 HG3 GLN 25 -22.389 -13.102 -28.208 206 HE21 GLN 25 HE21 GLN 25 -20.708 -14.826 -27.916 207 HE22 GLN 25 HE22 GLN 25 -21.152 -16.202 -26.971 208 H VAL 26 H VAL 26 -18.865 -10.487 -26.084 209 HA VAL 26 HA VAL 26 -18.722 -8.025 -27.503 210 HB VAL 26 HB VAL 26 -21.102 -8.038 -26.556 211 HG11 VAL 26 HG11 VAL 26 -19.903 -7.141 -23.986 212 HG12 VAL 26 HG12 VAL 26 -21.491 -7.837 -24.311 213 HG13 VAL 26 HG13 VAL 26 -20.063 -8.872 -24.280 214 HG21 VAL 26 HG21 VAL 26 -20.661 -5.610 -25.603 215 HG22 VAL 26 HG22 VAL 26 -19.063 -5.890 -26.296 216 HG23 VAL 26 HG23 VAL 26 -20.496 -5.972 -27.321 217 H GLU 27 H GLU 27 -17.204 -6.637 -26.637 218 HA GLU 27 HA GLU 27 -16.210 -6.958 -23.962 219 HB2 GLU 27 HB2 GLU 27 -13.808 -7.314 -25.134 220 HB3 GLU 27 HB3 GLU 27 -14.792 -8.633 -24.517 221 HG2 GLU 27 HG2 GLU 27 -13.938 -9.138 -26.729 222 HG3 GLU 27 HG3 GLU 27 -15.696 -9.020 -26.742 223 H HIS 28 H HIS 28 -15.748 -4.973 -23.310 224 HA HIS 28 HA HIS 28 -14.455 -3.117 -25.181 225 HB2 HIS 28 HB2 HIS 28 -17.048 -2.772 -23.775 226 HB3 HIS 28 HB3 HIS 28 -15.981 -1.371 -23.828 227 HD1 HIS 28 HD1 HIS 28 -15.938 -0.055 -25.958 228 HD2 HIS 28 HD2 HIS 28 -17.802 -3.741 -26.404 229 HE1 HIS 28 HE1 HIS 28 -16.939 -0.027 -28.264 230 H VAL 29 H VAL 29 -13.687 -1.100 -23.939 231 HA VAL 29 HA VAL 29 -11.917 -1.967 -21.897 232 HB VAL 29 HB VAL 29 -12.596 0.891 -22.587 233 HG11 VAL 29 HG11 VAL 29 -9.847 0.330 -21.939 234 HG12 VAL 29 HG12 VAL 29 -10.968 1.467 -21.186 235 HG13 VAL 29 HG13 VAL 29 -10.916 -0.212 -20.646 236 HG21 VAL 29 HG21 VAL 29 -11.963 0.209 -24.662 237 HG22 VAL 29 HG22 VAL 29 -10.362 0.478 -23.975 238 HG23 VAL 29 HG23 VAL 29 -11.025 -1.154 -24.051 239 H TYR 30 H TYR 30 -12.041 -1.841 -19.728 240 HA TYR 30 HA TYR 30 -14.428 -0.554 -18.573 241 HB2 TYR 30 HB2 TYR 30 -13.293 -3.256 -18.172 242 HB3 TYR 30 HB3 TYR 30 -13.820 -2.424 -16.713 243 HD1 TYR 30 HD1 TYR 30 -15.022 -3.265 -20.147 244 HD2 TYR 30 HD2 TYR 30 -16.040 -2.586 -16.072 245 HE1 TYR 30 HE1 TYR 30 -17.346 -3.914 -20.626 246 HE2 TYR 30 HE2 TYR 30 -18.366 -3.234 -16.539 247 HH TYR 30 HH TYR 30 -19.347 -4.378 -19.745 248 H LYS 31 H LYS 31 -14.171 0.074 -16.277 249 HA LYS 31 HA LYS 31 -11.396 0.862 -15.674 250 HB2 LYS 31 HB2 LYS 31 -13.851 2.469 -15.850 251 HB3 LYS 31 HB3 LYS 31 -12.911 2.747 -14.390 252 HG2 LYS 31 HG2 LYS 31 -10.988 2.788 -16.334 253 HG3 LYS 31 HG3 LYS 31 -12.371 3.522 -17.149 254 HD2 LYS 31 HD2 LYS 31 -11.815 4.441 -14.392 255 HD3 LYS 31 HD3 LYS 31 -10.650 4.912 -15.631 256 HE2 LYS 31 HE2 LYS 31 -12.944 5.475 -16.915 257 HE3 LYS 31 HE3 LYS 31 -13.463 5.732 -15.250 258 HZ1 LYS 31 HZ1 LYS 31 -12.642 7.779 -16.134 259 HZ2 LYS 31 HZ2 LYS 31 -11.194 7.060 -16.629 260 HZ3 LYS 31 HZ3 LYS 31 -11.534 7.229 -14.980 261 H PHE 32 H PHE 32 -10.645 0.239 -13.755 262 HA PHE 32 HA PHE 32 -12.586 -0.533 -11.678 263 HB2 PHE 32 HB2 PHE 32 -9.976 -1.915 -12.339 264 HB3 PHE 32 HB3 PHE 32 -11.042 -2.335 -11.002 265 HD1 PHE 32 HD1 PHE 32 -10.824 -2.169 -14.692 266 HD2 PHE 32 HD2 PHE 32 -12.866 -3.770 -11.318 267 HE1 PHE 32 HE1 PHE 32 -12.066 -3.693 -16.171 268 HE2 PHE 32 HE2 PHE 32 -14.111 -5.297 -12.792 269 HZ PHE 32 HZ PHE 32 -13.712 -5.260 -15.222 270 H ARG 33 H ARG 33 -12.449 1.021 -10.187 271 HA ARG 33 HA ARG 33 -9.796 2.049 -9.453 272 HB2 ARG 33 HB2 ARG 33 -11.070 3.902 -8.366 273 HB3 ARG 33 HB3 ARG 33 -11.300 3.801 -10.106 274 HG2 ARG 33 HG2 ARG 33 -13.409 2.450 -9.548 275 HG3 ARG 33 HG3 ARG 33 -13.210 3.089 -7.915 276 HD2 ARG 33 HD2 ARG 33 -14.739 4.417 -9.386 277 HD3 ARG 33 HD3 ARG 33 -13.406 5.333 -8.685 278 HE ARG 33 HE ARG 33 -12.835 4.296 -11.302 279 HH11 ARG 33 HH11 ARG 33 -14.269 6.918 -9.517 280 HH12 ARG 33 HH12 ARG 33 -14.077 8.069 -10.799 281 HH21 ARG 33 HH21 ARG 33 -12.576 5.801 -12.997 282 HH22 ARG 33 HH22 ARG 33 -13.114 7.431 -12.778 283 H ILE 34 H ILE 34 -8.928 1.537 -7.551 284 HA ILE 34 HA ILE 34 -10.613 0.136 -5.592 285 HB ILE 34 HB ILE 34 -7.647 0.058 -6.097 286 HG12 ILE 34 HG12 ILE 34 -9.284 -2.384 -5.751 287 HG13 ILE 34 HG13 ILE 34 -9.630 -1.424 -7.185 288 HG21 ILE 34 HG21 ILE 34 -9.158 -0.571 -3.632 289 HG22 ILE 34 HG22 ILE 34 -7.908 -1.714 -4.121 290 HG23 ILE 34 HG23 ILE 34 -7.494 -0.024 -3.836 291 HD11 ILE 34 HD11 ILE 34 -6.932 -2.512 -6.418 292 HD12 ILE 34 HD12 ILE 34 -8.012 -3.186 -7.639 293 HD13 ILE 34 HD13 ILE 34 -7.307 -1.586 -7.871 294 H THR 35 H THR 35 -11.079 1.077 -3.721 295 HA THR 35 HA THR 35 -9.661 3.545 -3.004 296 HB THR 35 HB THR 35 -11.564 4.046 -1.550 297 HG1 THR 35 HG1 THR 35 -12.712 1.637 -2.558 298 HG21 THR 35 HG21 THR 35 -12.469 5.005 -3.344 299 HG22 THR 35 HG22 THR 35 -13.252 3.480 -3.759 300 HG23 THR 35 HG23 THR 35 -11.647 3.848 -4.391 301 H GLN 36 H GLN 36 -8.731 3.846 -1.005 302 HA GLN 36 HA GLN 36 -8.190 1.395 0.497 303 HB2 GLN 36 HB2 GLN 36 -6.469 3.263 -0.381 304 HB3 GLN 36 HB3 GLN 36 -6.828 3.933 1.205 305 HG2 GLN 36 HG2 GLN 36 -6.057 1.963 2.296 306 HG3 GLN 36 HG3 GLN 36 -5.916 1.104 0.763 307 HE21 GLN 36 HE21 GLN 36 -4.218 1.616 -0.638 308 HE22 GLN 36 HE22 GLN 36 -2.810 2.455 -0.092 309 H GLY 37 H GLY 37 -9.574 0.999 2.099 310 HA2 GLY 37 HA2 GLY 37 -10.576 1.304 4.164 311 HA3 GLY 37 HA3 GLY 37 -9.908 2.929 4.208 312 H GLY 38 H GLY 38 -10.988 4.069 1.959 313 HA2 GLY 38 HA2 GLY 38 -13.719 3.627 1.525 314 HA3 GLY 38 HA3 GLY 38 -13.568 4.775 2.847 315 H LYS 39 H LYS 39 -10.936 5.096 0.837 316 HA LYS 39 HA LYS 39 -12.261 7.083 -0.873 317 HB2 LYS 39 HB2 LYS 39 -11.083 8.043 1.226 318 HB3 LYS 39 HB3 LYS 39 -9.590 7.654 0.382 319 HG2 LYS 39 HG2 LYS 39 -9.939 9.239 -1.251 320 HG3 LYS 39 HG3 LYS 39 -11.687 9.264 -1.000 321 HD2 LYS 39 HD2 LYS 39 -11.553 10.791 0.654 322 HD3 LYS 39 HD3 LYS 39 -10.076 10.089 1.320 323 HE2 LYS 39 HE2 LYS 39 -8.716 11.225 -0.231 324 HE3 LYS 39 HE3 LYS 39 -10.091 11.636 -1.256 325 HZ1 LYS 39 HZ1 LYS 39 -10.026 12.638 1.502 326 HZ2 LYS 39 HZ2 LYS 39 -10.738 13.320 0.127 327 HZ3 LYS 39 HZ3 LYS 39 -9.061 13.397 0.337 328 H VAL 40 H VAL 40 -11.465 7.256 -2.921 329 HA VAL 40 HA VAL 40 -10.158 5.140 -4.110 330 HB VAL 40 HB VAL 40 -10.411 8.013 -4.973 331 HG11 VAL 40 HG11 VAL 40 -8.867 5.801 -6.222 332 HG12 VAL 40 HG12 VAL 40 -9.780 6.882 -7.276 333 HG13 VAL 40 HG13 VAL 40 -8.544 7.534 -6.199 334 HG21 VAL 40 HG21 VAL 40 -12.063 7.170 -6.489 335 HG22 VAL 40 HG22 VAL 40 -11.662 5.502 -6.080 336 HG23 VAL 40 HG23 VAL 40 -12.427 6.545 -4.881 337 H VAL 41 H VAL 41 -8.099 4.518 -4.376 338 HA VAL 41 HA VAL 41 -5.977 6.359 -3.480 339 HB VAL 41 HB VAL 41 -6.255 4.555 -1.863 340 HG11 VAL 41 HG11 VAL 41 -5.429 2.228 -2.887 341 HG12 VAL 41 HG12 VAL 41 -7.131 2.688 -2.805 342 HG13 VAL 41 HG13 VAL 41 -6.233 2.892 -4.309 343 HG21 VAL 41 HG21 VAL 41 -4.044 4.402 -1.542 344 HG22 VAL 41 HG22 VAL 41 -3.781 3.603 -3.092 345 HG23 VAL 41 HG23 VAL 41 -3.903 5.361 -3.016 346 H LYS 42 H LYS 42 -7.168 4.318 -5.945 347 HA LYS 42 HA LYS 42 -5.236 5.167 -7.819 348 HB2 LYS 42 HB2 LYS 42 -3.918 3.469 -6.465 349 HB3 LYS 42 HB3 LYS 42 -5.004 2.243 -7.107 350 HG2 LYS 42 HG2 LYS 42 -4.216 2.521 -9.289 351 HG3 LYS 42 HG3 LYS 42 -3.466 4.074 -8.915 352 HD2 LYS 42 HD2 LYS 42 -2.577 1.498 -7.640 353 HD3 LYS 42 HD3 LYS 42 -1.906 2.084 -9.164 354 HE2 LYS 42 HE2 LYS 42 -1.769 4.295 -7.535 355 HE3 LYS 42 HE3 LYS 42 -1.410 2.970 -6.429 356 HZ1 LYS 42 HZ1 LYS 42 0.100 3.917 -8.748 357 HZ2 LYS 42 HZ2 LYS 42 0.147 2.262 -8.405 358 HZ3 LYS 42 HZ3 LYS 42 0.657 3.381 -7.243 359 H ASN 43 H ASN 43 -5.666 4.398 -9.958 360 HA ASN 43 HA ASN 43 -8.186 2.904 -10.234 361 HB2 ASN 43 HB2 ASN 43 -8.565 4.454 -12.281 362 HB3 ASN 43 HB3 ASN 43 -8.921 5.077 -10.673 363 HD21 ASN 43 HD21 ASN 43 -7.931 6.869 -10.007 364 HD22 ASN 43 HD22 ASN 43 -6.660 7.674 -10.855 365 H TRP 44 H TRP 44 -8.101 1.260 -11.626 366 HA TRP 44 HA TRP 44 -5.736 1.052 -13.363 367 HB2 TRP 44 HB2 TRP 44 -7.496 -1.030 -12.079 368 HB3 TRP 44 HB3 TRP 44 -6.411 -1.425 -13.410 369 HD1 TRP 44 HD1 TRP 44 -6.342 -0.287 -9.741 370 HE1 TRP 44 HE1 TRP 44 -4.019 -0.818 -8.769 371 HE3 TRP 44 HE3 TRP 44 -4.003 -1.818 -14.021 372 HZ2 TRP 44 HZ2 TRP 44 -1.524 -1.760 -9.695 373 HZ3 TRP 44 HZ3 TRP 44 -1.648 -2.517 -13.892 374 HH2 TRP 44 HH2 TRP 44 -0.435 -2.487 -11.773 375 H VAL 45 H VAL 45 -5.964 0.328 -15.512 376 HA VAL 45 HA VAL 45 -8.685 0.628 -16.609 377 HB VAL 45 HB VAL 45 -6.916 2.430 -17.159 378 HG11 VAL 45 HG11 VAL 45 -5.415 1.943 -18.973 379 HG12 VAL 45 HG12 VAL 45 -5.125 0.786 -17.672 380 HG13 VAL 45 HG13 VAL 45 -6.037 0.298 -19.101 381 HG21 VAL 45 HG21 VAL 45 -8.791 2.710 -18.409 382 HG22 VAL 45 HG22 VAL 45 -7.701 2.204 -19.700 383 HG23 VAL 45 HG23 VAL 45 -8.803 1.038 -18.969 384 H MET 46 H MET 46 -9.385 -0.832 -18.117 385 HA MET 46 HA MET 46 -7.698 -3.208 -18.464 386 HB2 MET 46 HB2 MET 46 -9.777 -3.787 -17.485 387 HB3 MET 46 HB3 MET 46 -10.676 -2.777 -18.609 388 HG2 MET 46 HG2 MET 46 -10.598 -4.317 -20.281 389 HG3 MET 46 HG3 MET 46 -9.073 -5.005 -19.727 390 HE1 MET 46 HE1 MET 46 -13.285 -5.736 -18.293 391 HE2 MET 46 HE2 MET 46 -12.668 -4.606 -19.500 392 HE3 MET 46 HE3 MET 46 -12.893 -6.306 -19.916 393 H ASP 47 H ASP 47 -6.586 -3.240 -20.300 394 HA ASP 47 HA ASP 47 -7.509 -1.801 -22.636 395 HB2 ASP 47 HB2 ASP 47 -5.026 -2.280 -21.666 396 HB3 ASP 47 HB3 ASP 47 -5.149 -3.571 -22.859 397 H LEU 48 H LEU 48 -8.829 -2.665 -24.080 398 HA LEU 48 HA LEU 48 -9.105 -5.570 -24.225 399 HB2 LEU 48 HB2 LEU 48 -10.955 -3.568 -24.223 400 HB3 LEU 48 HB3 LEU 48 -10.805 -3.911 -25.945 401 HG LEU 48 HG LEU 48 -12.626 -5.193 -25.147 402 HD11 LEU 48 HD11 LEU 48 -10.193 -6.962 -25.348 403 HD12 LEU 48 HD12 LEU 48 -11.185 -6.386 -26.686 404 HD13 LEU 48 HD13 LEU 48 -11.865 -7.501 -25.501 405 HD21 LEU 48 HD21 LEU 48 -12.789 -5.769 -23.012 406 HD22 LEU 48 HD22 LEU 48 -11.118 -5.277 -22.737 407 HD23 LEU 48 HD23 LEU 48 -11.481 -6.932 -23.226 408 H LYS 49 H LYS 49 -7.593 -3.020 -25.866 409 HA LYS 49 HA LYS 49 -7.667 -4.173 -28.499 410 HB2 LYS 49 HB2 LYS 49 -6.950 -1.685 -27.387 411 HB3 LYS 49 HB3 LYS 49 -5.489 -2.325 -28.128 412 HG2 LYS 49 HG2 LYS 49 -6.651 -2.588 -30.244 413 HG3 LYS 49 HG3 LYS 49 -8.146 -2.005 -29.509 414 HD2 LYS 49 HD2 LYS 49 -7.012 0.140 -29.009 415 HD3 LYS 49 HD3 LYS 49 -5.583 -0.451 -29.859 416 HE2 LYS 49 HE2 LYS 49 -6.446 0.170 -31.809 417 HE3 LYS 49 HE3 LYS 49 -7.882 -0.811 -31.518 418 HZ1 LYS 49 HZ1 LYS 49 -8.373 1.299 -29.961 419 HZ2 LYS 49 HZ2 LYS 49 -8.902 1.172 -31.562 420 HZ3 LYS 49 HZ3 LYS 49 -7.497 2.043 -31.202 421 H ASN 50 H ASN 50 -5.326 -4.008 -25.850 422 HA ASN 50 HA ASN 50 -3.566 -5.838 -27.325 423 HB2 ASN 50 HB2 ASN 50 -3.068 -4.045 -24.946 424 HB3 ASN 50 HB3 ASN 50 -1.903 -5.237 -25.512 425 HD21 ASN 50 HD21 ASN 50 -2.514 -2.096 -25.558 426 HD22 ASN 50 HD22 ASN 50 -1.852 -1.655 -27.091 427 H VAL 51 H VAL 51 -5.882 -5.782 -24.879 428 HA VAL 51 HA VAL 51 -6.681 -7.383 -23.469 429 HB VAL 51 HB VAL 51 -4.669 -9.314 -24.601 430 HG11 VAL 51 HG11 VAL 51 -6.988 -10.666 -24.276 431 HG12 VAL 51 HG12 VAL 51 -5.726 -10.555 -23.047 432 HG13 VAL 51 HG13 VAL 51 -7.120 -9.475 -22.983 433 HG21 VAL 51 HG21 VAL 51 -6.776 -9.826 -26.131 434 HG22 VAL 51 HG22 VAL 51 -7.052 -8.101 -25.891 435 HG23 VAL 51 HG23 VAL 51 -5.540 -8.661 -26.605 436 H LYS 52 H LYS 52 -4.825 -5.655 -22.436 437 HA LYS 52 HA LYS 52 -3.624 -7.309 -20.357 438 HB2 LYS 52 HB2 LYS 52 -1.492 -6.030 -20.482 439 HB3 LYS 52 HB3 LYS 52 -1.783 -7.044 -21.889 440 HG2 LYS 52 HG2 LYS 52 -1.824 -5.300 -23.280 441 HG3 LYS 52 HG3 LYS 52 -2.805 -4.326 -22.181 442 HD2 LYS 52 HD2 LYS 52 -0.746 -3.924 -20.824 443 HD3 LYS 52 HD3 LYS 52 0.181 -4.744 -22.083 444 HE2 LYS 52 HE2 LYS 52 -1.266 -2.928 -23.524 445 HE3 LYS 52 HE3 LYS 52 -0.957 -2.046 -22.029 446 HZ1 LYS 52 HZ1 LYS 52 1.386 -2.403 -22.298 447 HZ2 LYS 52 HZ2 LYS 52 0.778 -1.719 -23.720 448 HZ3 LYS 52 HZ3 LYS 52 1.138 -3.371 -23.664 449 H LEU 53 H LEU 53 -3.621 -6.362 -18.368 450 HA LEU 53 HA LEU 53 -4.964 -3.771 -18.177 451 HB2 LEU 53 HB2 LEU 53 -4.815 -6.185 -16.530 452 HB3 LEU 53 HB3 LEU 53 -4.703 -4.684 -15.613 453 HG LEU 53 HG LEU 53 -6.848 -3.958 -16.577 454 HD11 LEU 53 HD11 LEU 53 -8.229 -5.593 -17.786 455 HD12 LEU 53 HD12 LEU 53 -6.856 -6.698 -17.833 456 HD13 LEU 53 HD13 LEU 53 -6.774 -5.153 -18.680 457 HD21 LEU 53 HD21 LEU 53 -7.431 -6.657 -15.493 458 HD22 LEU 53 HD22 LEU 53 -8.090 -5.085 -15.039 459 HD23 LEU 53 HD23 LEU 53 -6.482 -5.559 -14.491 460 H VAL 54 H VAL 54 -4.066 -1.998 -17.246 461 HA VAL 54 HA VAL 54 -1.491 -2.217 -15.897 462 HB VAL 54 HB VAL 54 -0.364 -0.615 -17.261 463 HG11 VAL 54 HG11 VAL 54 -0.227 -1.784 -19.407 464 HG12 VAL 54 HG12 VAL 54 -0.279 -2.919 -18.057 465 HG13 VAL 54 HG13 VAL 54 -1.721 -2.643 -19.035 466 HG21 VAL 54 HG21 VAL 54 -1.735 0.996 -18.054 467 HG22 VAL 54 HG22 VAL 54 -1.757 -0.028 -19.490 468 HG23 VAL 54 HG23 VAL 54 -3.073 -0.122 -18.320 469 H GLU 55 H GLU 55 -0.810 -0.087 -14.968 470 HA GLU 55 HA GLU 55 -3.068 1.129 -13.667 471 HB2 GLU 55 HB2 GLU 55 -1.272 2.505 -12.532 472 HB3 GLU 55 HB3 GLU 55 -1.173 0.767 -12.292 473 HG2 GLU 55 HG2 GLU 55 0.850 0.671 -13.188 474 HG3 GLU 55 HG3 GLU 55 0.344 1.593 -14.603 475 H SER 56 H SER 56 -4.242 2.491 -14.882 476 HA SER 56 HA SER 56 -2.959 4.915 -15.833 477 HB2 SER 56 HB2 SER 56 -2.899 3.278 -17.752 478 HB3 SER 56 HB3 SER 56 -4.662 3.289 -17.731 479 HG SER 56 HG SER 56 -2.873 5.336 -18.434 480 H ASP 57 H ASP 57 -4.654 6.480 -16.683 481 HA ASP 57 HA ASP 57 -7.078 6.220 -15.033 482 HB2 ASP 57 HB2 ASP 57 -5.218 8.187 -14.892 483 HB3 ASP 57 HB3 ASP 57 -6.332 8.888 -16.063 484 H ASP 58 H ASP 58 -6.322 5.532 -17.989 485 HA ASP 58 HA ASP 58 -7.734 7.082 -19.774 486 HB2 ASP 58 HB2 ASP 58 -6.448 5.345 -20.696 487 HB3 ASP 58 HB3 ASP 58 -7.200 4.124 -19.674 488 H ALA 59 H ALA 59 -9.840 7.007 -20.632 489 HA ALA 59 HA ALA 59 -11.860 6.275 -18.666 490 HB1 ALA 59 HB1 ALA 59 -13.298 7.411 -20.614 491 HB2 ALA 59 HB2 ALA 59 -12.450 8.341 -19.378 492 HB3 ALA 59 HB3 ALA 59 -11.724 8.122 -20.970 493 H ALA 60 H ALA 60 -13.465 4.789 -18.978 494 HA ALA 60 HA ALA 60 -13.290 3.161 -21.430 495 HB1 ALA 60 HB1 ALA 60 -12.832 1.409 -20.149 496 HB2 ALA 60 HB2 ALA 60 -13.014 2.381 -18.689 497 HB3 ALA 60 HB3 ALA 60 -14.418 1.583 -19.397 498 H GLU 61 H GLU 61 -15.376 1.770 -21.654 499 HA GLU 61 HA GLU 61 -17.520 3.520 -22.123 500 HB2 GLU 61 HB2 GLU 61 -18.789 1.564 -22.739 501 HB3 GLU 61 HB3 GLU 61 -17.144 1.384 -23.332 502 HG2 GLU 61 HG2 GLU 61 -16.605 -0.173 -21.632 503 HG3 GLU 61 HG3 GLU 61 -18.098 0.166 -20.758 504 H ALA 62 H ALA 62 -16.521 1.920 -19.283 505 HA ALA 62 HA ALA 62 -18.742 3.034 -17.810 506 HB1 ALA 62 HB1 ALA 62 -19.048 0.675 -16.699 507 HB2 ALA 62 HB2 ALA 62 -19.919 1.101 -18.173 508 HB3 ALA 62 HB3 ALA 62 -18.469 0.103 -18.264 509 H THR 63 H THR 63 -18.451 2.824 -15.466 510 HA THR 63 HA THR 63 -15.636 2.363 -14.725 511 HB THR 63 HB THR 63 -17.393 4.470 -13.468 512 HG1 THR 63 HG1 THR 63 -16.722 4.704 -15.835 513 HG21 THR 63 HG21 THR 63 -15.622 4.998 -12.169 514 HG22 THR 63 HG22 THR 63 -14.458 4.696 -13.459 515 HG23 THR 63 HG23 THR 63 -15.110 3.349 -12.526 516 H LEU 64 H LEU 64 -15.349 0.926 -13.154 517 HA LEU 64 HA LEU 64 -17.648 0.254 -11.440 518 HB2 LEU 64 HB2 LEU 64 -17.149 -1.646 -12.718 519 HB3 LEU 64 HB3 LEU 64 -15.411 -1.412 -12.542 520 HG LEU 64 HG LEU 64 -15.674 -1.997 -10.114 521 HD11 LEU 64 HD11 LEU 64 -18.213 -1.516 -10.254 522 HD12 LEU 64 HD12 LEU 64 -17.645 -2.854 -9.256 523 HD13 LEU 64 HD13 LEU 64 -18.324 -3.171 -10.852 524 HD21 LEU 64 HD21 LEU 64 -14.874 -3.903 -10.929 525 HD22 LEU 64 HD22 LEU 64 -15.769 -3.706 -12.436 526 HD23 LEU 64 HD23 LEU 64 -16.537 -4.478 -11.048 527 H THR 65 H THR 65 -17.416 1.228 -9.535 528 HA THR 65 HA THR 65 -14.752 1.566 -8.383 529 HB THR 65 HB THR 65 -17.276 2.546 -7.087 530 HG1 THR 65 HG1 THR 65 -17.332 4.275 -8.436 531 HG21 THR 65 HG21 THR 65 -14.572 2.725 -6.466 532 HG22 THR 65 HG22 THR 65 -15.876 3.686 -5.768 533 HG23 THR 65 HG23 THR 65 -14.969 4.302 -7.149 534 H MET 66 H MET 66 -13.979 0.156 -6.966 535 HA MET 66 HA MET 66 -15.721 -1.046 -4.983 536 HB2 MET 66 HB2 MET 66 -15.085 -2.465 -7.326 537 HB3 MET 66 HB3 MET 66 -14.065 -3.144 -6.065 538 HG2 MET 66 HG2 MET 66 -15.797 -4.068 -4.968 539 HG3 MET 66 HG3 MET 66 -16.886 -2.735 -5.342 540 HE1 MET 66 HE1 MET 66 -15.446 -6.099 -6.251 541 HE2 MET 66 HE2 MET 66 -16.128 -6.506 -7.825 542 HE3 MET 66 HE3 MET 66 -14.825 -5.322 -7.708 543 H GLU 67 H GLU 67 -14.685 -1.463 -3.093 544 HA GLU 67 HA GLU 67 -12.156 -0.323 -2.634 545 HB2 GLU 67 HB2 GLU 67 -13.883 -2.172 -1.000 546 HB3 GLU 67 HB3 GLU 67 -12.330 -1.590 -0.416 547 HG2 GLU 67 HG2 GLU 67 -13.157 0.403 0.119 548 HG3 GLU 67 HG3 GLU 67 -14.028 0.549 -1.406 549 H ASP 68 H ASP 68 -10.336 -1.574 -1.550 550 HA ASP 68 HA ASP 68 -9.260 -3.408 -3.392 551 HB2 ASP 68 HB2 ASP 68 -7.875 -1.975 -1.941 552 HB3 ASP 68 HB3 ASP 68 -8.412 -2.888 -0.534 553 H ASP 69 H ASP 69 -10.397 -3.937 -0.054 554 HA ASP 69 HA ASP 69 -10.105 -6.729 -0.078 555 HB2 ASP 69 HB2 ASP 69 -11.160 -6.723 1.988 556 HB3 ASP 69 HB3 ASP 69 -10.552 -5.073 1.894 557 H ILE 70 H ILE 70 -12.680 -4.639 -1.185 558 HA ILE 70 HA ILE 70 -14.619 -6.721 -1.497 559 HB ILE 70 HB ILE 70 -14.624 -4.059 -2.909 560 HG12 ILE 70 HG12 ILE 70 -14.267 -3.944 -0.374 561 HG13 ILE 70 HG13 ILE 70 -15.629 -3.043 -1.030 562 HG21 ILE 70 HG21 ILE 70 -17.087 -4.366 -2.752 563 HG22 ILE 70 HG22 ILE 70 -16.278 -5.581 -3.740 564 HG23 ILE 70 HG23 ILE 70 -16.800 -5.981 -2.104 565 HD11 ILE 70 HD11 ILE 70 -17.174 -4.673 -0.267 566 HD12 ILE 70 HD12 ILE 70 -15.877 -5.788 0.162 567 HD13 ILE 70 HD13 ILE 70 -16.095 -4.295 1.075 568 H MET 71 H MET 71 -12.610 -4.870 -3.786 569 HA MET 71 HA MET 71 -13.385 -6.080 -6.139 570 HB2 MET 71 HB2 MET 71 -11.839 -4.129 -5.925 571 HB3 MET 71 HB3 MET 71 -10.563 -5.244 -5.456 572 HG2 MET 71 HG2 MET 71 -10.272 -6.020 -7.560 573 HG3 MET 71 HG3 MET 71 -11.970 -5.821 -7.987 574 HE1 MET 71 HE1 MET 71 -12.404 -2.619 -9.542 575 HE2 MET 71 HE2 MET 71 -13.093 -3.929 -8.583 576 HE3 MET 71 HE3 MET 71 -12.575 -2.437 -7.796 577 H PHE 72 H PHE 72 -11.269 -7.289 -3.634 578 HA PHE 72 HA PHE 72 -10.171 -9.439 -5.142 579 HB2 PHE 72 HB2 PHE 72 -9.399 -8.340 -2.870 580 HB3 PHE 72 HB3 PHE 72 -10.430 -9.582 -2.167 581 HD1 PHE 72 HD2 PHE 72 -7.574 -9.094 -4.486 582 HD2 PHE 72 HD1 PHE 72 -9.637 -11.746 -1.874 583 HE1 PHE 72 HE2 PHE 72 -5.748 -10.728 -4.709 584 HE2 PHE 72 HE1 PHE 72 -7.814 -13.384 -2.091 585 HZ PHE 72 HZ PHE 72 -5.867 -12.876 -3.511 586 H ALA 73 H ALA 73 -12.920 -9.123 -2.947 587 HA ALA 73 HA ALA 73 -13.615 -11.828 -2.765 588 HB1 ALA 73 HB1 ALA 73 -15.889 -9.994 -2.803 589 HB2 ALA 73 HB2 ALA 73 -15.331 -11.087 -1.535 590 HB3 ALA 73 HB3 ALA 73 -14.589 -9.498 -1.719 591 H ILE 74 H ILE 74 -14.883 -9.323 -4.963 592 HA ILE 74 HA ILE 74 -16.349 -11.271 -6.502 593 HB ILE 74 HB ILE 74 -15.838 -8.481 -7.459 594 HG12 ILE 74 HG12 ILE 74 -16.366 -8.163 -5.120 595 HG13 ILE 74 HG13 ILE 74 -17.777 -7.731 -6.080 596 HG21 ILE 74 HG21 ILE 74 -17.861 -10.607 -7.849 597 HG22 ILE 74 HG22 ILE 74 -18.429 -8.938 -7.889 598 HG23 ILE 74 HG23 ILE 74 -17.172 -9.468 -9.006 599 HD11 ILE 74 HD11 ILE 74 -17.372 -10.317 -4.596 600 HD12 ILE 74 HD12 ILE 74 -18.414 -8.980 -4.106 601 HD13 ILE 74 HD13 ILE 74 -18.782 -9.895 -5.568 602 H GLY 75 H GLY 75 -13.190 -9.945 -6.534 603 HA2 GLY 75 HA2 GLY 75 -12.666 -10.273 -9.330 604 HA3 GLY 75 HA3 GLY 75 -11.469 -10.019 -8.069 605 H THR 76 H THR 76 -12.266 -12.296 -6.481 606 HA THR 76 HA THR 76 -11.016 -14.383 -8.115 607 HB THR 76 HB THR 76 -9.981 -13.779 -5.920 608 HG1 THR 76 HG1 THR 76 -10.893 -16.376 -6.531 609 HG21 THR 76 HG21 THR 76 -12.425 -13.618 -4.900 610 HG22 THR 76 HG22 THR 76 -11.035 -14.051 -3.906 611 HG23 THR 76 HG23 THR 76 -12.110 -15.309 -4.514 612 H GLY 77 H GLY 77 -14.026 -13.464 -7.659 613 HA2 GLY 77 HA2 GLY 77 -15.992 -14.611 -8.107 614 HA3 GLY 77 HA3 GLY 77 -15.085 -16.116 -8.072 615 H ALA 78 H ALA 78 -14.223 -14.611 -5.320 616 HA ALA 78 HA ALA 78 -15.418 -16.364 -3.571 617 HB1 ALA 78 HB1 ALA 78 -15.135 -14.027 -2.090 618 HB2 ALA 78 HB2 ALA 78 -13.938 -15.307 -2.293 619 HB3 ALA 78 HB3 ALA 78 -13.920 -13.905 -3.363 620 H LEU 79 H LEU 79 -16.455 -12.987 -4.095 621 HA LEU 79 HA LEU 79 -19.138 -13.770 -3.168 622 HB2 LEU 79 HB2 LEU 79 -17.501 -11.326 -2.820 623 HB3 LEU 79 HB3 LEU 79 -19.239 -11.106 -3.016 624 HG LEU 79 HG LEU 79 -18.027 -12.888 -0.911 625 HD11 LEU 79 HD11 LEU 79 -17.499 -10.309 -0.883 626 HD12 LEU 79 HD12 LEU 79 -17.943 -11.170 0.591 627 HD13 LEU 79 HD13 LEU 79 -19.149 -10.211 -0.267 628 HD21 LEU 79 HD21 LEU 79 -20.297 -12.431 0.132 629 HD22 LEU 79 HD22 LEU 79 -20.274 -13.483 -1.284 630 HD23 LEU 79 HD23 LEU 79 -20.777 -11.800 -1.444 631 HA PRO 80 HA PRO 80 -20.722 -12.952 -7.192 632 HB2 PRO 80 HB2 PRO 80 -23.308 -12.435 -6.544 633 HB3 PRO 80 HB3 PRO 80 -22.615 -14.061 -6.509 634 HG2 PRO 80 HG2 PRO 80 -23.079 -12.151 -4.251 635 HG3 PRO 80 HG3 PRO 80 -23.377 -13.898 -4.318 636 HD2 PRO 80 HD2 PRO 80 -21.191 -12.837 -3.122 637 HD3 PRO 80 HD3 PRO 80 -21.164 -14.417 -3.931 638 H ALA 81 H ALA 81 -20.667 -11.205 -8.458 639 HA ALA 81 HA ALA 81 -20.372 -8.597 -7.432 640 HB1 ALA 81 HB1 ALA 81 -21.171 -8.476 -10.160 641 HB2 ALA 81 HB2 ALA 81 -19.561 -8.268 -9.469 642 HB3 ALA 81 HB3 ALA 81 -20.116 -9.873 -9.944 643 H LYS 82 H LYS 82 -23.152 -10.428 -8.397 644 HA LYS 82 HA LYS 82 -24.934 -8.274 -8.851 645 HB2 LYS 82 HB2 LYS 82 -26.707 -10.028 -8.424 646 HB3 LYS 82 HB3 LYS 82 -25.558 -10.399 -9.703 647 HG2 LYS 82 HG2 LYS 82 -24.296 -11.800 -8.095 648 HG3 LYS 82 HG3 LYS 82 -25.563 -11.504 -6.903 649 HD2 LYS 82 HD2 LYS 82 -26.444 -13.402 -7.741 650 HD3 LYS 82 HD3 LYS 82 -27.044 -12.332 -9.011 651 HE2 LYS 82 HE2 LYS 82 -24.567 -12.886 -9.947 652 HE3 LYS 82 HE3 LYS 82 -24.932 -14.385 -9.093 653 HZ1 LYS 82 HZ1 LYS 82 -25.769 -14.769 -11.190 654 HZ2 LYS 82 HZ2 LYS 82 -26.319 -13.183 -11.396 655 HZ3 LYS 82 HZ3 LYS 82 -27.149 -14.239 -10.368 656 H GLU 83 H GLU 83 -24.385 -10.339 -6.003 657 HA GLU 83 HA GLU 83 -26.241 -9.041 -4.331 658 HB2 GLU 83 HB2 GLU 83 -23.741 -10.562 -3.572 659 HB3 GLU 83 HB3 GLU 83 -25.054 -10.147 -2.479 660 HG2 GLU 83 HG2 GLU 83 -25.476 -11.811 -4.939 661 HG3 GLU 83 HG3 GLU 83 -25.015 -12.509 -3.387 662 H ALA 84 H ALA 84 -22.709 -8.677 -4.594 663 HA ALA 84 HA ALA 84 -22.281 -6.759 -2.671 664 HB1 ALA 84 HB1 ALA 84 -20.774 -7.921 -4.667 665 HB2 ALA 84 HB2 ALA 84 -20.751 -6.205 -5.078 666 HB3 ALA 84 HB3 ALA 84 -20.207 -6.738 -3.487 667 H MET 85 H MET 85 -23.473 -6.320 -5.966 668 HA MET 85 HA MET 85 -23.430 -3.478 -5.908 669 HB2 MET 85 HB2 MET 85 -24.075 -5.519 -7.786 670 HB3 MET 85 HB3 MET 85 -25.438 -4.412 -7.703 671 HG2 MET 85 HG2 MET 85 -23.082 -2.854 -7.794 672 HG3 MET 85 HG3 MET 85 -22.954 -4.093 -9.040 673 HE1 MET 85 HE1 MET 85 -23.301 -3.331 -11.208 674 HE2 MET 85 HE2 MET 85 -24.781 -4.287 -11.137 675 HE3 MET 85 HE3 MET 85 -24.808 -2.673 -11.848 676 H ALA 86 H ALA 86 -25.834 -5.914 -5.095 677 HA ALA 86 HA ALA 86 -27.953 -4.017 -4.701 678 HB1 ALA 86 HB1 ALA 86 -28.881 -6.028 -5.207 679 HB2 ALA 86 HB2 ALA 86 -27.621 -6.945 -4.381 680 HB3 ALA 86 HB3 ALA 86 -28.898 -6.163 -3.448 681 H GLN 87 H GLN 87 -25.382 -5.303 -2.789 682 HA GLN 87 HA GLN 87 -26.603 -4.544 -0.268 683 HB2 GLN 87 HB2 GLN 87 -23.828 -5.586 -0.862 684 HB3 GLN 87 HB3 GLN 87 -24.520 -5.372 0.740 685 HG2 GLN 87 HG2 GLN 87 -26.259 -6.979 -0.878 686 HG3 GLN 87 HG3 GLN 87 -24.626 -7.644 -0.884 687 HE21 GLN 87 HE21 GLN 87 -24.546 -9.239 0.523 688 HE22 GLN 87 HE22 GLN 87 -25.180 -9.211 2.130 689 H ASP 88 H ASP 88 -25.484 -2.743 -2.621 690 HA ASP 88 HA ASP 88 -24.616 -0.649 -2.805 691 HB2 ASP 88 HB2 ASP 88 -25.974 -0.732 -0.309 692 HB3 ASP 88 HB3 ASP 88 -24.493 0.192 -0.076 693 H LYS 89 H LYS 89 -22.951 -3.071 -1.885 694 HA LYS 89 HA LYS 89 -20.719 -1.810 -0.536 695 HB2 LYS 89 HB2 LYS 89 -21.371 -4.587 -1.438 696 HB3 LYS 89 HB3 LYS 89 -19.695 -4.169 -1.106 697 HG2 LYS 89 HG2 LYS 89 -21.767 -3.514 0.928 698 HG3 LYS 89 HG3 LYS 89 -21.228 -5.187 0.755 699 HD2 LYS 89 HD2 LYS 89 -18.853 -4.236 0.910 700 HD3 LYS 89 HD3 LYS 89 -19.620 -2.762 1.504 701 HE2 LYS 89 HE2 LYS 89 -20.600 -3.961 3.350 702 HE3 LYS 89 HE3 LYS 89 -20.008 -5.496 2.716 703 HZ1 LYS 89 HZ1 LYS 89 -18.391 -3.259 3.802 704 HZ2 LYS 89 HZ2 LYS 89 -17.723 -4.584 2.991 705 HZ3 LYS 89 HZ3 LYS 89 -18.556 -4.815 4.445 706 H MET 90 H MET 90 -21.802 -1.776 -3.628 707 HA MET 90 HA MET 90 -19.317 -0.810 -4.654 708 HB2 MET 90 HB2 MET 90 -18.700 -2.469 -6.127 709 HB3 MET 90 HB3 MET 90 -19.301 -3.435 -4.787 710 HG2 MET 90 HG2 MET 90 -20.442 -4.485 -6.404 711 HG3 MET 90 HG3 MET 90 -21.567 -3.145 -6.195 712 HE1 MET 90 HE1 MET 90 -20.177 -4.456 -10.052 713 HE2 MET 90 HE2 MET 90 -19.155 -4.961 -8.706 714 HE3 MET 90 HE3 MET 90 -20.899 -5.220 -8.635 715 H GLU 91 H GLU 91 -19.531 0.172 -6.732 716 HA GLU 91 HA GLU 91 -22.282 0.377 -7.743 717 HB2 GLU 91 HB2 GLU 91 -21.702 2.320 -6.251 718 HB3 GLU 91 HB3 GLU 91 -20.447 2.751 -7.404 719 HG2 GLU 91 HG2 GLU 91 -22.574 4.029 -7.635 720 HG3 GLU 91 HG3 GLU 91 -22.037 3.209 -9.100 721 H VAL 92 H VAL 92 -22.357 1.405 -9.933 722 HA VAL 92 HA VAL 92 -19.904 1.211 -11.485 723 HB VAL 92 HB VAL 92 -21.063 -1.084 -11.415 724 HG11 VAL 92 HG11 VAL 92 -22.811 -0.090 -13.596 725 HG12 VAL 92 HG12 VAL 92 -23.046 -1.435 -12.478 726 HG13 VAL 92 HG13 VAL 92 -23.315 0.222 -11.936 727 HG21 VAL 92 HG21 VAL 92 -20.024 -1.574 -13.357 728 HG22 VAL 92 HG22 VAL 92 -20.851 -0.296 -14.247 729 HG23 VAL 92 HG23 VAL 92 -19.460 0.092 -13.236 730 H ASP 93 H ASP 93 -19.919 2.441 -13.332 731 HA ASP 93 HA ASP 93 -22.402 3.929 -13.889 732 HB2 ASP 93 HB2 ASP 93 -20.249 5.093 -12.816 733 HB3 ASP 93 HB3 ASP 93 -19.773 5.178 -14.510 734 H GLY 94 H GLY 94 -22.033 5.138 -16.147 735 HA2 GLY 94 HA2 GLY 94 -21.509 4.971 -18.415 736 HA3 GLY 94 HA3 GLY 94 -20.649 3.476 -18.082 737 H GLN 95 H GLN 95 -21.516 1.827 -19.131 738 HA GLN 95 HA GLN 95 -24.377 1.854 -19.736 739 HB2 GLN 95 HB2 GLN 95 -21.987 0.737 -21.000 740 HB3 GLN 95 HB3 GLN 95 -23.332 -0.394 -20.941 741 HG2 GLN 95 HG2 GLN 95 -23.382 2.370 -22.131 742 HG3 GLN 95 HG3 GLN 95 -23.336 0.847 -23.019 743 HE21 GLN 95 HE21 GLN 95 -25.160 -0.670 -22.500 744 HE22 GLN 95 HE22 GLN 95 -26.731 0.026 -22.323 745 H VAL 96 H VAL 96 -25.458 1.135 -17.973 746 HA VAL 96 HA VAL 96 -24.598 -0.821 -16.170 747 HB VAL 96 HB VAL 96 -27.449 -0.106 -16.873 748 HG11 VAL 96 HG11 VAL 96 -26.223 -1.836 -14.821 749 HG12 VAL 96 HG12 VAL 96 -27.500 -0.753 -14.262 750 HG13 VAL 96 HG13 VAL 96 -27.824 -1.905 -15.558 751 HG21 VAL 96 HG21 VAL 96 -26.788 1.917 -16.135 752 HG22 VAL 96 HG22 VAL 96 -26.929 1.168 -14.544 753 HG23 VAL 96 HG23 VAL 96 -25.355 1.274 -15.333 754 H GLU 97 H GLU 97 -26.138 -1.090 -19.280 755 HA GLU 97 HA GLU 97 -26.979 -3.805 -18.986 756 HB2 GLU 97 HB2 GLU 97 -26.668 -1.955 -21.336 757 HB3 GLU 97 HB3 GLU 97 -27.073 -3.651 -21.562 758 HG2 GLU 97 HG2 GLU 97 -28.757 -2.385 -19.574 759 HG3 GLU 97 HG3 GLU 97 -28.840 -1.575 -21.137 760 H LEU 98 H LEU 98 -24.010 -2.248 -19.790 761 HA LEU 98 HA LEU 98 -22.832 -4.491 -21.140 762 HB2 LEU 98 HB2 LEU 98 -22.031 -1.783 -20.355 763 HB3 LEU 98 HB3 LEU 98 -20.727 -2.967 -20.315 764 HG LEU 98 HG LEU 98 -20.922 -1.655 -22.441 765 HD11 LEU 98 HD11 LEU 98 -21.366 -4.365 -23.394 766 HD12 LEU 98 HD12 LEU 98 -20.264 -4.294 -22.019 767 HD13 LEU 98 HD13 LEU 98 -19.921 -3.357 -23.472 768 HD21 LEU 98 HD21 LEU 98 -23.097 -3.366 -23.413 769 HD22 LEU 98 HD22 LEU 98 -22.765 -1.662 -23.723 770 HD23 LEU 98 HD23 LEU 98 -23.588 -2.144 -22.239 771 H ILE 99 H ILE 99 -22.153 -2.931 -18.002 772 HA ILE 99 HA ILE 99 -20.389 -4.809 -17.001 773 HB ILE 99 HB ILE 99 -20.850 -3.974 -14.810 774 HG12 ILE 99 HG12 ILE 99 -22.928 -2.215 -14.878 775 HG13 ILE 99 HG13 ILE 99 -23.519 -3.469 -15.962 776 HG21 ILE 99 HG21 ILE 99 -20.385 -2.290 -17.036 777 HG22 ILE 99 HG22 ILE 99 -21.405 -1.407 -15.902 778 HG23 ILE 99 HG23 ILE 99 -19.861 -2.069 -15.367 779 HD11 ILE 99 HD11 ILE 99 -23.006 -5.123 -14.140 780 HD12 ILE 99 HD12 ILE 99 -22.733 -3.740 -13.079 781 HD13 ILE 99 HD13 ILE 99 -24.319 -3.993 -13.809 782 H PHE 100 H PHE 100 -23.821 -5.018 -17.379 783 HA PHE 100 HA PHE 100 -24.286 -7.107 -15.505 784 HB2 PHE 100 HB2 PHE 100 -25.850 -5.507 -17.226 785 HB3 PHE 100 HB3 PHE 100 -26.159 -7.177 -17.688 786 HD1 PHE 100 HD2 PHE 100 -26.532 -8.799 -15.609 787 HD2 PHE 100 HD1 PHE 100 -27.169 -4.591 -15.596 788 HE1 PHE 100 HE2 PHE 100 -28.069 -9.041 -13.703 789 HE2 PHE 100 HE1 PHE 100 -28.706 -4.826 -13.689 790 HZ PHE 100 HZ PHE 100 -29.159 -7.053 -12.741 791 H LEU 101 H LEU 101 -23.476 -7.013 -18.930 792 HA LEU 101 HA LEU 101 -23.854 -9.776 -19.431 793 HB2 LEU 101 HB2 LEU 101 -22.412 -7.559 -20.821 794 HB3 LEU 101 HB3 LEU 101 -22.193 -9.223 -21.360 795 HG LEU 101 HG LEU 101 -24.905 -7.938 -21.155 796 HD11 LEU 101 HD11 LEU 101 -24.625 -6.819 -23.055 797 HD12 LEU 101 HD12 LEU 101 -23.861 -8.201 -23.840 798 HD13 LEU 101 HD13 LEU 101 -22.893 -7.095 -22.865 799 HD21 LEU 101 HD21 LEU 101 -23.793 -10.488 -22.172 800 HD22 LEU 101 HD22 LEU 101 -25.096 -9.747 -23.102 801 HD23 LEU 101 HD23 LEU 101 -25.344 -10.151 -21.402 802 H LEU 102 H LEU 102 -21.524 -8.126 -17.649 803 HA LEU 102 HA LEU 102 -19.351 -9.966 -18.148 804 HB2 LEU 102 HB2 LEU 102 -19.762 -7.599 -16.369 805 HB3 LEU 102 HB3 LEU 102 -18.408 -8.692 -16.084 806 HG LEU 102 HG LEU 102 -18.914 -7.081 -18.585 807 HD11 LEU 102 HD11 LEU 102 -16.907 -5.873 -17.934 808 HD12 LEU 102 HD12 LEU 102 -16.775 -6.850 -16.472 809 HD13 LEU 102 HD13 LEU 102 -18.141 -5.754 -16.680 810 HD21 LEU 102 HD21 LEU 102 -17.778 -8.783 -19.532 811 HD22 LEU 102 HD22 LEU 102 -17.131 -9.352 -17.993 812 HD23 LEU 102 HD23 LEU 102 -16.385 -7.977 -18.808 813 H GLU 103 H GLU 103 -21.806 -9.417 -15.690 814 HA GLU 103 HA GLU 103 -20.944 -10.933 -13.594 815 HB2 GLU 103 HB2 GLU 103 -23.523 -10.090 -14.629 816 HB3 GLU 103 HB3 GLU 103 -23.627 -11.653 -13.830 817 HG2 GLU 103 HG2 GLU 103 -22.056 -9.814 -12.271 818 HG3 GLU 103 HG3 GLU 103 -23.641 -9.137 -12.639 819 HA PRO 104 HA PRO 104 -22.647 -14.982 -15.602 820 HB2 PRO 104 HB2 PRO 104 -23.397 -14.863 -18.209 821 HB3 PRO 104 HB3 PRO 104 -24.509 -14.538 -16.874 822 HG2 PRO 104 HG2 PRO 104 -23.021 -12.608 -18.612 823 HG3 PRO 104 HG3 PRO 104 -24.705 -12.547 -18.059 824 HD2 PRO 104 HD2 PRO 104 -22.736 -11.095 -16.898 825 HD3 PRO 104 HD3 PRO 104 -24.125 -11.720 -15.987 826 H PHE 105 H PHE 105 -20.412 -12.821 -16.874 827 HA PHE 105 HA PHE 105 -19.080 -14.845 -18.519 828 HB2 PHE 105 HB2 PHE 105 -19.476 -12.288 -19.121 829 HB3 PHE 105 HB3 PHE 105 -17.985 -12.088 -18.207 830 HD1 PHE 105 HD2 PHE 105 -19.362 -14.304 -20.876 831 HD2 PHE 105 HD1 PHE 105 -16.026 -12.119 -19.390 832 HE1 PHE 105 HE2 PHE 105 -18.063 -14.941 -22.866 833 HE2 PHE 105 HE1 PHE 105 -14.722 -12.752 -21.378 834 HZ PHE 105 HZ PHE 105 -15.740 -14.166 -23.119 835 H ILE 106 H ILE 106 -19.000 -13.521 -15.408 836 HA ILE 106 HA ILE 106 -16.331 -13.436 -14.720 837 HB ILE 106 HB ILE 106 -18.593 -14.481 -13.012 838 HG12 ILE 106 HG12 ILE 106 -17.442 -11.689 -13.154 839 HG13 ILE 106 HG13 ILE 106 -18.907 -12.188 -13.991 840 HG21 ILE 106 HG21 ILE 106 -17.182 -13.821 -11.116 841 HG22 ILE 106 HG22 ILE 106 -16.422 -15.073 -12.097 842 HG23 ILE 106 HG23 ILE 106 -15.887 -13.399 -12.236 843 HD11 ILE 106 HD11 ILE 106 -20.025 -12.597 -11.924 844 HD12 ILE 106 HD12 ILE 106 -18.536 -12.341 -11.013 845 HD13 ILE 106 HD13 ILE 106 -19.298 -10.992 -11.855 846 H ALA 107 H ALA 107 -18.420 -16.235 -15.112 847 HA ALA 107 HA ALA 107 -16.834 -18.197 -13.937 848 HB1 ALA 107 HB1 ALA 107 -19.218 -18.321 -14.968 849 HB2 ALA 107 HB2 ALA 107 -18.360 -18.779 -16.440 850 HB3 ALA 107 HB3 ALA 107 -18.186 -19.751 -14.979 851 H SER 108 H SER 108 -16.543 -16.603 -17.034 852 HA SER 108 HA SER 108 -14.711 -18.441 -18.194 853 HB2 SER 108 HB2 SER 108 -16.161 -16.397 -19.193 854 HB3 SER 108 HB3 SER 108 -14.597 -15.598 -19.035 855 HG SER 108 HG SER 108 -14.085 -16.588 -20.805 856 H LEU 109 H LEU 109 -14.273 -15.276 -16.625 857 HA LEU 109 HA LEU 109 -11.392 -15.786 -16.471 858 HB2 LEU 109 HB2 LEU 109 -12.710 -13.249 -15.596 859 HB3 LEU 109 HB3 LEU 109 -11.071 -13.503 -16.192 860 HG LEU 109 HG LEU 109 -13.564 -13.626 -17.887 861 HD11 LEU 109 HD11 LEU 109 -11.488 -11.479 -18.020 862 HD12 LEU 109 HD12 LEU 109 -12.824 -11.365 -16.875 863 HD13 LEU 109 HD13 LEU 109 -13.152 -11.466 -18.605 864 HD21 LEU 109 HD21 LEU 109 -11.798 -15.016 -18.770 865 HD22 LEU 109 HD22 LEU 109 -10.631 -13.706 -18.587 866 HD23 LEU 109 HD23 LEU 109 -11.947 -13.559 -19.753 867 H LYS 110 H LYS 110 -12.208 -17.497 -14.832 868 HA LYS 110 HA LYS 110 -12.341 -18.237 -12.682 869 HB2 LYS 110 HB2 LYS 110 -10.149 -16.696 -12.840 870 HB3 LYS 110 HB3 LYS 110 -11.037 -15.786 -11.626 871 HG2 LYS 110 HG2 LYS 110 -10.447 -17.226 -10.055 872 HG3 LYS 110 HG3 LYS 110 -11.125 -18.569 -10.977 873 HD2 LYS 110 HD2 LYS 110 -8.926 -18.368 -12.361 874 HD3 LYS 110 HD3 LYS 110 -8.326 -17.515 -10.937 875 HE2 LYS 110 HE2 LYS 110 -7.791 -19.561 -10.191 876 HE3 LYS 110 HE3 LYS 110 -9.508 -19.700 -9.817 877 HZ1 LYS 110 HZ1 LYS 110 -8.464 -21.566 -11.146 878 HZ2 LYS 110 HZ2 LYS 110 -8.414 -20.490 -12.449 879 HZ3 LYS 110 HZ3 LYS 110 -9.900 -20.914 -11.760 Start of MODEL 20 1 H1 MET 1 H MET 1 1.618 1.689 -1.294 2 HA MET 1 HA MET 1 0.390 1.287 -3.196 3 HB2 MET 1 HB2 MET 1 1.755 1.318 -5.201 4 HB3 MET 1 HB3 MET 1 2.442 2.402 -3.999 5 HG2 MET 1 HG2 MET 1 3.971 0.459 -3.375 6 HG3 MET 1 HG3 MET 1 3.438 -0.281 -4.883 7 HE1 MET 1 HE1 MET 1 4.982 2.775 -3.196 8 HE2 MET 1 HE2 MET 1 6.346 1.686 -3.453 9 HE3 MET 1 HE3 MET 1 6.277 3.230 -4.304 10 H SER 2 H SER 2 0.526 -1.027 -1.583 11 HA SER 2 HA SER 2 0.507 -3.125 -3.652 12 HB2 SER 2 HB2 SER 2 0.987 -4.671 -1.596 13 HB3 SER 2 HB3 SER 2 2.317 -3.794 -2.351 14 HG SER 2 HG SER 2 1.351 -3.603 0.165 15 H LEU 3 H LEU 3 -1.501 -3.759 -4.033 16 HA LEU 3 HA LEU 3 -3.399 -3.856 -1.780 17 HB2 LEU 3 HB2 LEU 3 -3.776 -3.041 -4.637 18 HB3 LEU 3 HB3 LEU 3 -5.134 -3.636 -3.684 19 HG LEU 3 HG LEU 3 -3.515 -1.393 -2.584 20 HD11 LEU 3 HD11 LEU 3 -4.680 -1.284 -5.168 21 HD12 LEU 3 HD12 LEU 3 -3.935 0.016 -4.239 22 HD13 LEU 3 HD13 LEU 3 -5.662 -0.301 -4.080 23 HD21 LEU 3 HD21 LEU 3 -5.450 -0.877 -1.429 24 HD22 LEU 3 HD22 LEU 3 -5.525 -2.637 -1.511 25 HD23 LEU 3 HD23 LEU 3 -6.493 -1.660 -2.616 26 H LYS 4 H LYS 4 -4.788 -5.615 -1.640 27 HA LYS 4 HA LYS 4 -3.787 -8.088 -2.525 28 HB2 LYS 4 HB2 LYS 4 -6.557 -7.422 -1.509 29 HB3 LYS 4 HB3 LYS 4 -5.872 -9.038 -1.627 30 HG2 LYS 4 HG2 LYS 4 -4.570 -6.894 0.014 31 HG3 LYS 4 HG3 LYS 4 -5.866 -7.907 0.656 32 HD2 LYS 4 HD2 LYS 4 -4.453 -9.894 -0.100 33 HD3 LYS 4 HD3 LYS 4 -3.135 -8.735 -0.292 34 HE2 LYS 4 HE2 LYS 4 -4.241 -8.217 2.226 35 HE3 LYS 4 HE3 LYS 4 -4.156 -9.973 2.100 36 HZ1 LYS 4 HZ1 LYS 4 -2.132 -8.706 2.991 37 HZ2 LYS 4 HZ2 LYS 4 -1.837 -8.301 1.376 38 HZ3 LYS 4 HZ3 LYS 4 -1.870 -9.925 1.848 39 H SER 5 H SER 5 -6.256 -5.951 -3.813 40 HA SER 5 HA SER 5 -7.484 -7.677 -5.623 41 HB2 SER 5 HB2 SER 5 -8.009 -5.573 -6.917 42 HB3 SER 5 HB3 SER 5 -8.456 -5.523 -5.212 43 HG SER 5 HG SER 5 -5.941 -4.576 -6.040 44 H ASP 6 H ASP 6 -4.361 -6.209 -5.695 45 HA ASP 6 HA ASP 6 -3.785 -6.148 -8.406 46 HB2 ASP 6 HB2 ASP 6 -2.369 -5.542 -6.228 47 HB3 ASP 6 HB3 ASP 6 -1.663 -7.121 -6.557 48 H GLU 7 H GLU 7 -3.789 -8.866 -6.170 49 HA GLU 7 HA GLU 7 -2.535 -10.743 -7.854 50 HB2 GLU 7 HB2 GLU 7 -4.163 -10.834 -5.387 51 HB3 GLU 7 HB3 GLU 7 -4.147 -12.306 -6.347 52 HG2 GLU 7 HG2 GLU 7 -2.309 -12.800 -5.189 53 HG3 GLU 7 HG3 GLU 7 -1.505 -11.678 -6.286 54 H VAL 8 H VAL 8 -5.978 -10.070 -7.267 55 HA VAL 8 HA VAL 8 -7.081 -11.988 -8.939 56 HB VAL 8 HB VAL 8 -8.069 -9.234 -8.214 57 HG11 VAL 8 HG11 VAL 8 -10.282 -9.994 -9.055 58 HG12 VAL 8 HG12 VAL 8 -9.081 -9.764 -10.327 59 HG13 VAL 8 HG13 VAL 8 -9.483 -11.391 -9.775 60 HG21 VAL 8 HG21 VAL 8 -7.854 -11.018 -6.455 61 HG22 VAL 8 HG22 VAL 8 -9.477 -10.359 -6.662 62 HG23 VAL 8 HG23 VAL 8 -9.073 -11.936 -7.340 63 H PHE 9 H PHE 9 -6.240 -8.617 -9.728 64 HA PHE 9 HA PHE 9 -6.984 -8.696 -12.422 65 HB2 PHE 9 HB2 PHE 9 -5.073 -7.004 -10.845 66 HB3 PHE 9 HB3 PHE 9 -5.159 -6.833 -12.595 67 HD1 PHE 9 HD2 PHE 9 -7.969 -7.092 -13.187 68 HD2 PHE 9 HD1 PHE 9 -6.069 -5.156 -9.906 69 HE1 PHE 9 HE2 PHE 9 -9.912 -5.602 -12.945 70 HE2 PHE 9 HE1 PHE 9 -8.010 -3.664 -9.659 71 HZ PHE 9 HZ PHE 9 -9.934 -3.885 -11.180 72 H ALA 10 H ALA 10 -3.994 -9.623 -10.819 73 HA ALA 10 HA ALA 10 -2.417 -9.960 -13.134 74 HB1 ALA 10 HB1 ALA 10 -2.243 -10.906 -10.313 75 HB2 ALA 10 HB2 ALA 10 -1.177 -11.617 -11.525 76 HB3 ALA 10 HB3 ALA 10 -1.140 -9.879 -11.229 77 H LYS 11 H LYS 11 -4.371 -12.254 -11.252 78 HA LYS 11 HA LYS 11 -3.764 -14.517 -12.837 79 HB2 LYS 11 HB2 LYS 11 -6.308 -14.131 -11.266 80 HB3 LYS 11 HB3 LYS 11 -5.482 -15.639 -11.638 81 HG2 LYS 11 HG2 LYS 11 -3.579 -14.214 -10.256 82 HG3 LYS 11 HG3 LYS 11 -5.082 -13.782 -9.439 83 HD2 LYS 11 HD2 LYS 11 -4.893 -15.705 -8.325 84 HD3 LYS 11 HD3 LYS 11 -5.289 -16.520 -9.840 85 HE2 LYS 11 HE2 LYS 11 -2.741 -16.275 -10.317 86 HE3 LYS 11 HE3 LYS 11 -2.620 -16.058 -8.572 87 HZ1 LYS 11 HZ1 LYS 11 -3.724 -18.410 -10.006 88 HZ2 LYS 11 HZ2 LYS 11 -3.827 -18.193 -8.332 89 HZ3 LYS 11 HZ3 LYS 11 -2.314 -18.353 -9.072 90 H ILE 12 H ILE 12 -6.399 -12.158 -12.926 91 HA ILE 12 HA ILE 12 -7.893 -13.428 -14.964 92 HB ILE 12 HB ILE 12 -7.810 -10.525 -14.138 93 HG12 ILE 12 HG12 ILE 12 -9.902 -12.619 -13.540 94 HG13 ILE 12 HG13 ILE 12 -8.564 -12.264 -12.454 95 HG21 ILE 12 HG21 ILE 12 -9.098 -11.814 -16.376 96 HG22 ILE 12 HG22 ILE 12 -10.279 -11.080 -15.294 97 HG23 ILE 12 HG23 ILE 12 -8.983 -10.100 -15.979 98 HD11 ILE 12 HD11 ILE 12 -9.358 -9.911 -12.357 99 HD12 ILE 12 HD12 ILE 12 -10.771 -10.405 -13.292 100 HD13 ILE 12 HD13 ILE 12 -10.489 -11.090 -11.692 101 H ALA 13 H ALA 13 -5.565 -10.738 -15.067 102 HA ALA 13 HA ALA 13 -5.645 -10.163 -17.765 103 HB1 ALA 13 HB1 ALA 13 -3.574 -9.086 -17.504 104 HB2 ALA 13 HB2 ALA 13 -4.345 -8.983 -15.921 105 HB3 ALA 13 HB3 ALA 13 -3.076 -10.174 -16.208 106 H LYS 14 H LYS 14 -3.938 -12.758 -16.106 107 HA LYS 14 HA LYS 14 -2.429 -13.627 -18.348 108 HB2 LYS 14 HB2 LYS 14 -3.252 -15.036 -15.807 109 HB3 LYS 14 HB3 LYS 14 -2.178 -15.745 -17.005 110 HG2 LYS 14 HG2 LYS 14 -1.164 -13.183 -16.402 111 HG3 LYS 14 HG3 LYS 14 -1.560 -13.965 -14.870 112 HD2 LYS 14 HD2 LYS 14 -0.285 -15.968 -15.656 113 HD3 LYS 14 HD3 LYS 14 0.228 -15.023 -17.056 114 HE2 LYS 14 HE2 LYS 14 2.000 -14.697 -15.630 115 HE3 LYS 14 HE3 LYS 14 0.992 -13.304 -15.240 116 HZ1 LYS 14 HZ1 LYS 14 1.657 -15.615 -13.625 117 HZ2 LYS 14 HZ2 LYS 14 0.042 -15.122 -13.535 118 HZ3 LYS 14 HZ3 LYS 14 1.281 -14.035 -13.152 119 H ARG 15 H ARG 15 -5.640 -14.346 -17.150 120 HA ARG 15 HA ARG 15 -6.060 -16.592 -18.883 121 HB2 ARG 15 HB2 ARG 15 -7.305 -15.647 -16.630 122 HB3 ARG 15 HB3 ARG 15 -8.446 -15.200 -17.891 123 HG2 ARG 15 HG2 ARG 15 -9.251 -17.260 -17.738 124 HG3 ARG 15 HG3 ARG 15 -7.759 -17.810 -18.503 125 HD2 ARG 15 HD2 ARG 15 -6.862 -18.546 -16.542 126 HD3 ARG 15 HD3 ARG 15 -7.703 -17.333 -15.577 127 HE ARG 15 HE ARG 15 -9.531 -19.209 -16.665 128 HH11 ARG 15 HH11 ARG 15 -7.136 -18.814 -14.170 129 HH12 ARG 15 HH12 ARG 15 -7.855 -19.983 -13.113 130 HH21 ARG 15 HH21 ARG 15 -10.488 -20.751 -15.283 131 HH22 ARG 15 HH22 ARG 15 -9.761 -21.085 -13.747 132 H LEU 16 H LEU 16 -6.655 -13.146 -19.024 133 HA LEU 16 HA LEU 16 -8.374 -13.222 -21.297 134 HB2 LEU 16 HB2 LEU 16 -6.688 -10.951 -20.253 135 HB3 LEU 16 HB3 LEU 16 -8.021 -10.815 -21.398 136 HG LEU 16 HG LEU 16 -8.678 -12.032 -18.790 137 HD11 LEU 16 HD11 LEU 16 -7.690 -10.434 -17.584 138 HD12 LEU 16 HD12 LEU 16 -8.946 -9.368 -18.214 139 HD13 LEU 16 HD13 LEU 16 -7.369 -9.434 -19.001 140 HD21 LEU 16 HD21 LEU 16 -10.500 -10.125 -19.234 141 HD22 LEU 16 HD22 LEU 16 -10.586 -11.726 -19.969 142 HD23 LEU 16 HD23 LEU 16 -9.933 -10.368 -20.887 143 H GLU 17 H GLU 17 -5.079 -13.747 -20.924 144 HA GLU 17 HA GLU 17 -4.222 -12.649 -23.444 145 HB2 GLU 17 HB2 GLU 17 -2.892 -14.439 -21.414 146 HB3 GLU 17 HB3 GLU 17 -2.118 -13.983 -22.925 147 HG2 GLU 17 HG2 GLU 17 -2.939 -11.570 -21.907 148 HG3 GLU 17 HG3 GLU 17 -2.461 -12.469 -20.468 149 H SER 18 H SER 18 -5.831 -15.453 -22.467 150 HA SER 18 HA SER 18 -4.900 -17.007 -24.768 151 HB2 SER 18 HB2 SER 18 -5.934 -17.666 -22.133 152 HB3 SER 18 HB3 SER 18 -6.801 -18.529 -23.404 153 HG SER 18 HG SER 18 -5.129 -19.771 -23.560 154 H ILE 19 H ILE 19 -7.185 -14.750 -24.148 155 HA ILE 19 HA ILE 19 -9.578 -15.763 -25.144 156 HB ILE 19 HB ILE 19 -8.535 -12.959 -25.554 157 HG12 ILE 19 HG12 ILE 19 -8.486 -13.819 -23.169 158 HG13 ILE 19 HG13 ILE 19 -9.463 -12.380 -23.437 159 HG21 ILE 19 HG21 ILE 19 -11.175 -12.676 -25.221 160 HG22 ILE 19 HG22 ILE 19 -10.425 -12.912 -26.799 161 HG23 ILE 19 HG23 ILE 19 -11.149 -14.280 -25.953 162 HD11 ILE 19 HD11 ILE 19 -11.478 -13.660 -23.361 163 HD12 ILE 19 HD12 ILE 19 -10.570 -15.172 -23.312 164 HD13 ILE 19 HD13 ILE 19 -10.505 -14.059 -21.945 165 H ASP 20 H ASP 20 -10.444 -16.018 -27.154 166 HA ASP 20 HA ASP 20 -8.726 -15.408 -29.463 167 HB2 ASP 20 HB2 ASP 20 -9.313 -17.985 -28.507 168 HB3 ASP 20 HB3 ASP 20 -10.323 -17.767 -29.934 169 HA PRO 21 HA PRO 21 -12.319 -13.520 -31.158 170 HB2 PRO 21 HB2 PRO 21 -11.690 -13.651 -33.796 171 HB3 PRO 21 HB3 PRO 21 -10.904 -12.532 -32.675 172 HG2 PRO 21 HG2 PRO 21 -9.942 -15.176 -33.698 173 HG3 PRO 21 HG3 PRO 21 -9.043 -13.662 -33.492 174 HD2 PRO 21 HD2 PRO 21 -8.892 -15.699 -31.714 175 HD3 PRO 21 HD3 PRO 21 -8.749 -13.997 -31.230 176 H ALA 22 H ALA 22 -11.535 -16.775 -31.614 177 HA ALA 22 HA ALA 22 -13.781 -17.367 -33.362 178 HB1 ALA 22 HB1 ALA 22 -12.943 -19.790 -32.774 179 HB2 ALA 22 HB2 ALA 22 -12.064 -18.775 -33.919 180 HB3 ALA 22 HB3 ALA 22 -11.498 -18.922 -32.255 181 H ASN 23 H ASN 23 -13.147 -17.109 -30.026 182 HA ASN 23 HA ASN 23 -15.797 -18.192 -29.431 183 HB2 ASN 23 HB2 ASN 23 -13.402 -19.559 -28.794 184 HB3 ASN 23 HB3 ASN 23 -14.025 -18.901 -27.284 185 HD21 ASN 23 HD21 ASN 23 -14.756 -20.948 -30.028 186 HD22 ASN 23 HD22 ASN 23 -16.011 -21.854 -29.260 187 H ARG 24 H ARG 24 -16.868 -16.585 -28.506 188 HA ARG 24 HA ARG 24 -16.087 -15.366 -26.107 189 HB2 ARG 24 HB2 ARG 24 -15.659 -13.071 -26.861 190 HB3 ARG 24 HB3 ARG 24 -14.449 -14.185 -27.482 191 HG2 ARG 24 HG2 ARG 24 -16.568 -14.002 -29.373 192 HG3 ARG 24 HG3 ARG 24 -16.066 -12.373 -28.916 193 HD2 ARG 24 HD2 ARG 24 -13.662 -13.323 -29.253 194 HD3 ARG 24 HD3 ARG 24 -14.485 -14.557 -30.206 195 HE ARG 24 HE ARG 24 -13.953 -11.885 -30.992 196 HH11 ARG 24 HH11 ARG 24 -16.330 -14.416 -31.248 197 HH12 ARG 24 HH12 ARG 24 -16.956 -13.854 -32.763 198 HH21 ARG 24 HH21 ARG 24 -14.769 -11.135 -32.986 199 HH22 ARG 24 HH22 ARG 24 -16.066 -11.988 -33.751 200 H GLN 25 H GLN 25 -17.450 -13.129 -25.916 201 HA GLN 25 HA GLN 25 -20.058 -13.509 -27.192 202 HB2 GLN 25 HB2 GLN 25 -19.603 -13.286 -24.214 203 HB3 GLN 25 HB3 GLN 25 -21.176 -13.149 -24.988 204 HG2 GLN 25 HG2 GLN 25 -21.406 -15.350 -25.124 205 HG3 GLN 25 HG3 GLN 25 -19.788 -15.556 -25.792 206 HE21 GLN 25 HE21 GLN 25 -21.474 -14.920 -22.745 207 HE22 GLN 25 HE22 GLN 25 -20.381 -15.815 -21.751 208 H VAL 26 H VAL 26 -18.240 -11.463 -24.911 209 HA VAL 26 HA VAL 26 -18.575 -9.132 -26.501 210 HB VAL 26 HB VAL 26 -20.874 -9.431 -25.428 211 HG11 VAL 26 HG11 VAL 26 -19.758 -8.183 -22.977 212 HG12 VAL 26 HG12 VAL 26 -21.193 -9.189 -23.185 213 HG13 VAL 26 HG13 VAL 26 -19.592 -9.929 -23.159 214 HG21 VAL 26 HG21 VAL 26 -19.181 -7.014 -25.496 215 HG22 VAL 26 HG22 VAL 26 -20.721 -7.344 -26.289 216 HG23 VAL 26 HG23 VAL 26 -20.687 -6.887 -24.587 217 H GLU 27 H GLU 27 -17.114 -7.596 -25.945 218 HA GLU 27 HA GLU 27 -15.981 -7.523 -23.278 219 HB2 GLU 27 HB2 GLU 27 -14.559 -8.646 -25.619 220 HB3 GLU 27 HB3 GLU 27 -13.640 -7.528 -24.621 221 HG2 GLU 27 HG2 GLU 27 -15.104 -9.885 -23.476 222 HG3 GLU 27 HG3 GLU 27 -13.444 -9.984 -24.061 223 H HIS 28 H HIS 28 -15.846 -5.455 -22.749 224 HA HIS 28 HA HIS 28 -15.013 -3.511 -24.786 225 HB2 HIS 28 HB2 HIS 28 -17.461 -3.403 -23.048 226 HB3 HIS 28 HB3 HIS 28 -16.699 -1.919 -23.613 227 HD1 HIS 28 HD1 HIS 28 -17.620 -1.071 -25.737 228 HD2 HIS 28 HD2 HIS 28 -18.065 -5.188 -25.403 229 HE1 HIS 28 HE1 HIS 28 -18.876 -1.781 -27.797 230 H VAL 29 H VAL 29 -14.270 -1.446 -23.838 231 HA VAL 29 HA VAL 29 -12.362 -1.875 -21.823 232 HB VAL 29 HB VAL 29 -13.473 0.783 -22.733 233 HG11 VAL 29 HG11 VAL 29 -10.659 0.616 -21.996 234 HG12 VAL 29 HG12 VAL 29 -11.890 1.785 -21.514 235 HG13 VAL 29 HG13 VAL 29 -11.750 0.249 -20.660 236 HG21 VAL 29 HG21 VAL 29 -12.673 -0.667 -24.591 237 HG22 VAL 29 HG22 VAL 29 -11.745 0.819 -24.399 238 HG23 VAL 29 HG23 VAL 29 -11.089 -0.711 -23.817 239 H TYR 30 H TYR 30 -12.521 -1.889 -19.682 240 HA TYR 30 HA TYR 30 -14.803 -0.515 -18.427 241 HB2 TYR 30 HB2 TYR 30 -13.665 -3.217 -17.680 242 HB3 TYR 30 HB3 TYR 30 -14.890 -2.351 -16.758 243 HD1 TYR 30 HD2 TYR 30 -16.657 -1.338 -18.867 244 HD2 TYR 30 HD1 TYR 30 -14.725 -5.112 -18.509 245 HE1 TYR 30 HE2 TYR 30 -18.420 -2.365 -20.241 246 HE2 TYR 30 HE1 TYR 30 -16.482 -6.149 -19.882 247 HH TYR 30 HH TYR 30 -18.519 -5.849 -20.801 248 H LYS 31 H LYS 31 -14.322 0.784 -16.764 249 HA LYS 31 HA LYS 31 -11.524 1.033 -15.991 250 HB2 LYS 31 HB2 LYS 31 -12.401 3.136 -16.452 251 HB3 LYS 31 HB3 LYS 31 -13.956 2.760 -15.721 252 HG2 LYS 31 HG2 LYS 31 -13.224 3.210 -13.597 253 HG3 LYS 31 HG3 LYS 31 -11.538 2.862 -13.987 254 HD2 LYS 31 HD2 LYS 31 -13.039 5.238 -15.075 255 HD3 LYS 31 HD3 LYS 31 -12.080 5.290 -13.594 256 HE2 LYS 31 HE2 LYS 31 -10.166 4.377 -15.033 257 HE3 LYS 31 HE3 LYS 31 -11.159 4.833 -16.416 258 HZ1 LYS 31 HZ1 LYS 31 -10.777 7.006 -16.081 259 HZ2 LYS 31 HZ2 LYS 31 -9.416 6.467 -15.235 260 HZ3 LYS 31 HZ3 LYS 31 -10.823 6.883 -14.395 261 H PHE 32 H PHE 32 -10.716 0.562 -14.020 262 HA PHE 32 HA PHE 32 -12.597 -0.529 -12.033 263 HB2 PHE 32 HB2 PHE 32 -9.709 -1.246 -12.567 264 HB3 PHE 32 HB3 PHE 32 -10.641 -1.854 -11.204 265 HD1 PHE 32 HD2 PHE 32 -13.087 -2.761 -12.067 266 HD2 PHE 32 HD1 PHE 32 -9.447 -2.738 -14.273 267 HE1 PHE 32 HE2 PHE 32 -13.926 -4.604 -13.464 268 HE2 PHE 32 HE1 PHE 32 -10.281 -4.581 -15.675 269 HZ PHE 32 HZ PHE 32 -12.523 -5.517 -15.270 270 H ARG 33 H ARG 33 -12.786 0.542 -10.185 271 HA ARG 33 HA ARG 33 -10.627 2.396 -9.415 272 HB2 ARG 33 HB2 ARG 33 -13.589 2.668 -9.401 273 HB3 ARG 33 HB3 ARG 33 -12.705 3.414 -8.076 274 HG2 ARG 33 HG2 ARG 33 -11.295 4.569 -9.810 275 HG3 ARG 33 HG3 ARG 33 -12.442 3.980 -11.015 276 HD2 ARG 33 HD2 ARG 33 -14.006 5.111 -8.998 277 HD3 ARG 33 HD3 ARG 33 -12.654 6.222 -9.213 278 HE ARG 33 HE ARG 33 -14.795 5.723 -11.058 279 HH11 ARG 33 HH11 ARG 33 -11.493 6.778 -10.737 280 HH12 ARG 33 HH12 ARG 33 -11.510 7.704 -12.201 281 HH21 ARG 33 HH21 ARG 33 -14.830 6.939 -12.988 282 HH22 ARG 33 HH22 ARG 33 -13.408 7.796 -13.480 283 H ILE 34 H ILE 34 -9.547 1.766 -7.678 284 HA ILE 34 HA ILE 34 -10.925 0.089 -5.687 285 HB ILE 34 HB ILE 34 -7.938 0.313 -5.936 286 HG12 ILE 34 HG12 ILE 34 -9.835 -1.426 -7.501 287 HG13 ILE 34 HG13 ILE 34 -8.519 -0.424 -8.103 288 HG21 ILE 34 HG21 ILE 34 -7.848 -1.555 -4.584 289 HG22 ILE 34 HG22 ILE 34 -9.249 -0.706 -3.934 290 HG23 ILE 34 HG23 ILE 34 -9.475 -2.078 -5.019 291 HD11 ILE 34 HD11 ILE 34 -8.484 -3.161 -7.050 292 HD12 ILE 34 HD12 ILE 34 -7.446 -2.384 -8.246 293 HD13 ILE 34 HD13 ILE 34 -7.153 -2.129 -6.525 294 H THR 35 H THR 35 -11.550 1.230 -3.981 295 HA THR 35 HA THR 35 -9.965 3.541 -3.126 296 HB THR 35 HB THR 35 -11.878 4.204 -1.794 297 HG1 THR 35 HG1 THR 35 -13.092 1.789 -2.709 298 HG21 THR 35 HG21 THR 35 -13.533 3.625 -4.046 299 HG22 THR 35 HG22 THR 35 -11.895 3.948 -4.615 300 HG23 THR 35 HG23 THR 35 -12.735 5.140 -3.624 301 H GLN 36 H GLN 36 -9.123 3.742 -1.072 302 HA GLN 36 HA GLN 36 -8.685 1.239 0.336 303 HB2 GLN 36 HB2 GLN 36 -7.168 3.575 -0.098 304 HB3 GLN 36 HB3 GLN 36 -7.488 3.513 1.630 305 HG2 GLN 36 HG2 GLN 36 -6.558 1.266 1.735 306 HG3 GLN 36 HG3 GLN 36 -6.261 1.303 -0.003 307 HE21 GLN 36 HE21 GLN 36 -4.063 1.061 0.167 308 HE22 GLN 36 HE22 GLN 36 -3.025 2.289 0.797 309 H GLY 37 H GLY 37 -10.432 0.701 1.542 310 HA2 GLY 37 HA2 GLY 37 -11.690 0.731 3.486 311 HA3 GLY 37 HA3 GLY 37 -10.949 2.270 3.901 312 H GLY 38 H GLY 38 -11.670 3.646 1.494 313 HA2 GLY 38 HA2 GLY 38 -14.360 3.530 0.812 314 HA3 GLY 38 HA3 GLY 38 -14.256 4.542 2.245 315 H LYS 39 H LYS 39 -11.388 4.955 0.760 316 HA LYS 39 HA LYS 39 -12.378 7.188 -0.889 317 HB2 LYS 39 HB2 LYS 39 -10.033 8.183 -0.229 318 HB3 LYS 39 HB3 LYS 39 -11.415 8.353 0.846 319 HG2 LYS 39 HG2 LYS 39 -10.589 6.861 2.374 320 HG3 LYS 39 HG3 LYS 39 -9.628 5.996 1.173 321 HD2 LYS 39 HD2 LYS 39 -7.886 7.470 1.304 322 HD3 LYS 39 HD3 LYS 39 -8.928 8.830 1.731 323 HE2 LYS 39 HE2 LYS 39 -8.323 6.527 3.579 324 HE3 LYS 39 HE3 LYS 39 -7.415 8.038 3.565 325 HZ1 LYS 39 HZ1 LYS 39 -9.610 9.168 3.954 326 HZ2 LYS 39 HZ2 LYS 39 -9.026 8.246 5.246 327 HZ3 LYS 39 HZ3 LYS 39 -10.264 7.639 4.267 328 H VAL 40 H VAL 40 -11.670 7.265 -2.929 329 HA VAL 40 HA VAL 40 -10.360 5.170 -4.168 330 HB VAL 40 HB VAL 40 -10.675 8.048 -4.990 331 HG11 VAL 40 HG11 VAL 40 -9.085 5.894 -6.264 332 HG12 VAL 40 HG12 VAL 40 -10.069 6.912 -7.317 333 HG13 VAL 40 HG13 VAL 40 -8.844 7.641 -6.277 334 HG21 VAL 40 HG21 VAL 40 -12.268 7.097 -6.592 335 HG22 VAL 40 HG22 VAL 40 -11.937 5.484 -5.961 336 HG23 VAL 40 HG23 VAL 40 -12.700 6.695 -4.930 337 H VAL 41 H VAL 41 -8.328 4.490 -4.153 338 HA VAL 41 HA VAL 41 -6.170 6.445 -3.748 339 HB VAL 41 HB VAL 41 -6.710 5.155 -1.629 340 HG11 VAL 41 HG11 VAL 41 -5.458 2.886 -3.173 341 HG12 VAL 41 HG12 VAL 41 -5.916 2.866 -1.469 342 HG13 VAL 41 HG13 VAL 41 -7.157 2.995 -2.715 343 HG21 VAL 41 HG21 VAL 41 -3.970 4.363 -2.072 344 HG22 VAL 41 HG22 VAL 41 -4.285 5.964 -2.740 345 HG23 VAL 41 HG23 VAL 41 -4.618 5.638 -1.040 346 H LYS 42 H LYS 42 -7.486 4.195 -5.717 347 HA LYS 42 HA LYS 42 -5.099 3.961 -7.293 348 HB2 LYS 42 HB2 LYS 42 -4.915 2.110 -5.566 349 HB3 LYS 42 HB3 LYS 42 -6.331 1.385 -6.316 350 HG2 LYS 42 HG2 LYS 42 -4.935 0.318 -7.667 351 HG3 LYS 42 HG3 LYS 42 -4.616 1.874 -8.437 352 HD2 LYS 42 HD2 LYS 42 -2.507 1.784 -7.741 353 HD3 LYS 42 HD3 LYS 42 -3.061 1.734 -6.065 354 HE2 LYS 42 HE2 LYS 42 -3.495 -0.816 -6.729 355 HE3 LYS 42 HE3 LYS 42 -2.183 -0.461 -7.852 356 HZ1 LYS 42 HZ1 LYS 42 -1.757 0.436 -5.131 357 HZ2 LYS 42 HZ2 LYS 42 -0.692 -0.331 -6.198 358 HZ3 LYS 42 HZ3 LYS 42 -1.818 -1.244 -5.326 359 H ASN 43 H ASN 43 -5.523 3.436 -9.427 360 HA ASN 43 HA ASN 43 -8.260 2.691 -10.143 361 HB2 ASN 43 HB2 ASN 43 -8.099 4.488 -11.995 362 HB3 ASN 43 HB3 ASN 43 -8.493 5.012 -10.360 363 HD21 ASN 43 HD21 ASN 43 -7.050 6.245 -9.222 364 HD22 ASN 43 HD22 ASN 43 -5.634 6.936 -9.931 365 H TRP 44 H TRP 44 -8.263 1.147 -11.636 366 HA TRP 44 HA TRP 44 -5.866 0.836 -13.324 367 HB2 TRP 44 HB2 TRP 44 -7.666 -1.243 -12.084 368 HB3 TRP 44 HB3 TRP 44 -6.566 -1.617 -13.407 369 HD1 TRP 44 HD1 TRP 44 -6.533 -0.550 -9.713 370 HE1 TRP 44 HE1 TRP 44 -4.235 -1.144 -8.718 371 HE3 TRP 44 HE3 TRP 44 -4.165 -2.058 -13.985 372 HZ2 TRP 44 HZ2 TRP 44 -1.747 -2.122 -9.624 373 HZ3 TRP 44 HZ3 TRP 44 -1.826 -2.808 -13.835 374 HH2 TRP 44 HH2 TRP 44 -0.644 -2.838 -11.699 375 H VAL 45 H VAL 45 -6.137 0.333 -15.492 376 HA VAL 45 HA VAL 45 -8.897 0.387 -16.516 377 HB VAL 45 HB VAL 45 -6.544 1.929 -17.613 378 HG11 VAL 45 HG11 VAL 45 -7.491 1.561 -19.608 379 HG12 VAL 45 HG12 VAL 45 -8.990 0.966 -18.892 380 HG13 VAL 45 HG13 VAL 45 -8.724 2.701 -19.069 381 HG21 VAL 45 HG21 VAL 45 -9.170 3.154 -16.952 382 HG22 VAL 45 HG22 VAL 45 -8.093 2.727 -15.622 383 HG23 VAL 45 HG23 VAL 45 -7.549 3.844 -16.874 384 H MET 46 H MET 46 -9.357 -1.127 -17.995 385 HA MET 46 HA MET 46 -7.127 -2.755 -19.009 386 HB2 MET 46 HB2 MET 46 -8.910 -4.497 -19.386 387 HB3 MET 46 HB3 MET 46 -8.594 -4.099 -17.702 388 HG2 MET 46 HG2 MET 46 -10.722 -3.608 -17.394 389 HG3 MET 46 HG3 MET 46 -10.645 -2.383 -18.658 390 HE1 MET 46 HE1 MET 46 -12.990 -6.166 -18.719 391 HE2 MET 46 HE2 MET 46 -11.422 -6.232 -17.915 392 HE3 MET 46 HE3 MET 46 -12.612 -5.024 -17.429 393 H ASP 47 H ASP 47 -6.672 -2.677 -21.105 394 HA ASP 47 HA ASP 47 -8.056 -1.008 -22.901 395 HB2 ASP 47 HB2 ASP 47 -5.592 -2.138 -22.885 396 HB3 ASP 47 HB3 ASP 47 -6.403 -3.165 -24.064 397 H LEU 48 H LEU 48 -8.117 -2.559 -25.270 398 HA LEU 48 HA LEU 48 -10.031 -4.697 -24.808 399 HB2 LEU 48 HB2 LEU 48 -11.107 -2.287 -25.042 400 HB3 LEU 48 HB3 LEU 48 -10.877 -2.620 -26.758 401 HG LEU 48 HG LEU 48 -12.723 -3.910 -24.800 402 HD11 LEU 48 HD11 LEU 48 -12.902 -2.803 -27.585 403 HD12 LEU 48 HD12 LEU 48 -13.739 -2.267 -26.129 404 HD13 LEU 48 HD13 LEU 48 -14.179 -3.799 -26.884 405 HD21 LEU 48 HD21 LEU 48 -13.055 -5.765 -26.412 406 HD22 LEU 48 HD22 LEU 48 -11.480 -5.799 -25.620 407 HD23 LEU 48 HD23 LEU 48 -11.619 -5.222 -27.281 408 H LYS 49 H LYS 49 -8.266 -2.701 -27.128 409 HA LYS 49 HA LYS 49 -8.486 -4.616 -29.254 410 HB2 LYS 49 HB2 LYS 49 -7.948 -1.965 -29.197 411 HB3 LYS 49 HB3 LYS 49 -6.317 -2.606 -29.345 412 HG2 LYS 49 HG2 LYS 49 -8.442 -3.609 -31.177 413 HG3 LYS 49 HG3 LYS 49 -7.722 -2.024 -31.467 414 HD2 LYS 49 HD2 LYS 49 -5.739 -2.898 -32.103 415 HD3 LYS 49 HD3 LYS 49 -5.815 -4.200 -30.913 416 HE2 LYS 49 HE2 LYS 49 -6.056 -5.411 -32.835 417 HE3 LYS 49 HE3 LYS 49 -7.748 -5.060 -32.487 418 HZ1 LYS 49 HZ1 LYS 49 -6.436 -3.038 -34.062 419 HZ2 LYS 49 HZ2 LYS 49 -7.930 -3.794 -34.301 420 HZ3 LYS 49 HZ3 LYS 49 -6.508 -4.546 -34.826 421 H ASN 50 H ASN 50 -6.199 -3.920 -26.708 422 HA ASN 50 HA ASN 50 -4.285 -5.843 -27.805 423 HB2 ASN 50 HB2 ASN 50 -4.011 -3.451 -26.334 424 HB3 ASN 50 HB3 ASN 50 -3.493 -4.748 -25.261 425 HD21 ASN 50 HD21 ASN 50 -2.154 -6.469 -26.589 426 HD22 ASN 50 HD22 ASN 50 -0.851 -5.786 -27.495 427 H VAL 51 H VAL 51 -6.693 -5.516 -25.358 428 HA VAL 51 HA VAL 51 -7.614 -7.040 -23.932 429 HB VAL 51 HB VAL 51 -5.678 -9.123 -24.910 430 HG11 VAL 51 HG11 VAL 51 -7.934 -10.441 -24.611 431 HG12 VAL 51 HG12 VAL 51 -6.902 -10.082 -23.226 432 HG13 VAL 51 HG13 VAL 51 -8.325 -9.090 -23.546 433 HG21 VAL 51 HG21 VAL 51 -7.908 -7.825 -26.367 434 HG22 VAL 51 HG22 VAL 51 -6.418 -8.540 -26.981 435 HG23 VAL 51 HG23 VAL 51 -7.762 -9.577 -26.504 436 H LYS 52 H LYS 52 -5.439 -5.369 -23.141 437 HA LYS 52 HA LYS 52 -4.410 -6.978 -20.911 438 HB2 LYS 52 HB2 LYS 52 -2.555 -6.840 -22.427 439 HB3 LYS 52 HB3 LYS 52 -2.809 -5.116 -22.669 440 HG2 LYS 52 HG2 LYS 52 -1.806 -4.548 -20.712 441 HG3 LYS 52 HG3 LYS 52 -2.281 -6.045 -19.905 442 HD2 LYS 52 HD2 LYS 52 -0.432 -7.151 -20.588 443 HD3 LYS 52 HD3 LYS 52 -0.407 -6.349 -22.160 444 HE2 LYS 52 HE2 LYS 52 0.272 -4.256 -20.746 445 HE3 LYS 52 HE3 LYS 52 0.747 -5.462 -19.551 446 HZ1 LYS 52 HZ1 LYS 52 1.739 -5.273 -22.344 447 HZ2 LYS 52 HZ2 LYS 52 2.153 -6.497 -21.252 448 HZ3 LYS 52 HZ3 LYS 52 2.610 -4.898 -20.942 449 H LEU 53 H LEU 53 -4.277 -5.927 -18.960 450 HA LEU 53 HA LEU 53 -5.249 -3.145 -18.918 451 HB2 LEU 53 HB2 LEU 53 -6.700 -3.597 -17.243 452 HB3 LEU 53 HB3 LEU 53 -6.665 -5.191 -17.993 453 HG LEU 53 HG LEU 53 -4.991 -4.417 -15.607 454 HD11 LEU 53 HD11 LEU 53 -7.219 -6.280 -15.230 455 HD12 LEU 53 HD12 LEU 53 -7.703 -4.620 -15.573 456 HD13 LEU 53 HD13 LEU 53 -6.647 -4.965 -14.203 457 HD21 LEU 53 HD21 LEU 53 -5.451 -7.166 -15.705 458 HD22 LEU 53 HD22 LEU 53 -3.944 -6.323 -16.064 459 HD23 LEU 53 HD23 LEU 53 -5.075 -6.701 -17.364 460 H VAL 54 H VAL 54 -4.181 -1.690 -17.669 461 HA VAL 54 HA VAL 54 -2.157 -2.607 -15.782 462 HB VAL 54 HB VAL 54 -0.392 -1.228 -16.724 463 HG11 VAL 54 HG11 VAL 54 0.179 -2.583 -18.610 464 HG12 VAL 54 HG12 VAL 54 -0.681 -3.600 -17.452 465 HG13 VAL 54 HG13 VAL 54 -1.511 -3.000 -18.889 466 HG21 VAL 54 HG21 VAL 54 -1.382 -0.716 -19.339 467 HG22 VAL 54 HG22 VAL 54 -2.527 -0.050 -18.174 468 HG23 VAL 54 HG23 VAL 54 -0.833 0.439 -18.124 469 H GLU 55 H GLU 55 -1.048 -0.560 -14.793 470 HA GLU 55 HA GLU 55 -3.066 0.942 -13.525 471 HB2 GLU 55 HB2 GLU 55 -0.090 0.974 -13.551 472 HB3 GLU 55 HB3 GLU 55 -0.912 2.399 -12.931 473 HG2 GLU 55 HG2 GLU 55 -2.204 0.272 -11.707 474 HG3 GLU 55 HG3 GLU 55 -0.499 -0.178 -11.700 475 H SER 56 H SER 56 -4.325 2.125 -14.897 476 HA SER 56 HA SER 56 -3.118 4.536 -15.983 477 HB2 SER 56 HB2 SER 56 -2.964 3.014 -17.878 478 HB3 SER 56 HB3 SER 56 -4.668 2.592 -17.711 479 HG SER 56 HG SER 56 -4.864 4.156 -19.126 480 H ASP 57 H ASP 57 -4.845 6.035 -16.847 481 HA ASP 57 HA ASP 57 -7.332 5.699 -15.302 482 HB2 ASP 57 HB2 ASP 57 -5.414 7.643 -14.903 483 HB3 ASP 57 HB3 ASP 57 -6.598 8.463 -15.918 484 H ASP 58 H ASP 58 -6.388 5.305 -18.240 485 HA ASP 58 HA ASP 58 -7.613 7.095 -19.943 486 HB2 ASP 58 HB2 ASP 58 -6.270 5.382 -20.893 487 HB3 ASP 58 HB3 ASP 58 -7.242 4.110 -20.159 488 H ALA 59 H ALA 59 -9.648 7.160 -20.977 489 HA ALA 59 HA ALA 59 -11.856 6.739 -19.260 490 HB1 ALA 59 HB1 ALA 59 -12.225 8.496 -20.683 491 HB2 ALA 59 HB2 ALA 59 -11.511 7.669 -22.068 492 HB3 ALA 59 HB3 ALA 59 -13.124 7.223 -21.510 493 H ALA 60 H ALA 60 -13.901 5.617 -20.206 494 HA ALA 60 HA ALA 60 -13.450 3.247 -21.760 495 HB1 ALA 60 HB1 ALA 60 -13.955 1.615 -20.050 496 HB2 ALA 60 HB2 ALA 60 -12.540 2.555 -19.574 497 HB3 ALA 60 HB3 ALA 60 -14.108 2.888 -18.839 498 H GLU 61 H GLU 61 -15.436 1.990 -22.067 499 HA GLU 61 HA GLU 61 -17.649 3.607 -22.596 500 HB2 GLU 61 HB2 GLU 61 -17.675 0.612 -22.194 501 HB3 GLU 61 HB3 GLU 61 -18.844 1.561 -23.100 502 HG2 GLU 61 HG2 GLU 61 -16.040 0.836 -23.815 503 HG3 GLU 61 HG3 GLU 61 -17.520 0.648 -24.754 504 H ALA 62 H ALA 62 -16.688 1.982 -19.706 505 HA ALA 62 HA ALA 62 -18.875 3.196 -18.257 506 HB1 ALA 62 HB1 ALA 62 -19.041 0.462 -19.066 507 HB2 ALA 62 HB2 ALA 62 -18.899 0.542 -17.309 508 HB3 ALA 62 HB3 ALA 62 -20.192 1.416 -18.130 509 H THR 63 H THR 63 -18.629 2.943 -15.903 510 HA THR 63 HA THR 63 -15.820 2.453 -15.151 511 HB THR 63 HB THR 63 -17.678 4.509 -13.939 512 HG1 THR 63 HG1 THR 63 -16.743 5.936 -15.239 513 HG21 THR 63 HG21 THR 63 -15.251 3.309 -13.004 514 HG22 THR 63 HG22 THR 63 -16.248 4.542 -12.231 515 HG23 THR 63 HG23 THR 63 -14.966 5.015 -13.346 516 H LEU 64 H LEU 64 -15.525 0.921 -13.677 517 HA LEU 64 HA LEU 64 -17.812 0.140 -11.993 518 HB2 LEU 64 HB2 LEU 64 -17.313 -1.675 -13.395 519 HB3 LEU 64 HB3 LEU 64 -15.575 -1.457 -13.196 520 HG LEU 64 HG LEU 64 -15.857 -2.187 -10.808 521 HD11 LEU 64 HD11 LEU 64 -18.651 -2.301 -11.708 522 HD12 LEU 64 HD12 LEU 64 -17.983 -2.098 -10.089 523 HD13 LEU 64 HD13 LEU 64 -18.094 -3.708 -10.801 524 HD21 LEU 64 HD21 LEU 64 -15.788 -3.706 -13.204 525 HD22 LEU 64 HD22 LEU 64 -16.778 -4.577 -12.032 526 HD23 LEU 64 HD23 LEU 64 -15.125 -4.115 -11.622 527 H THR 65 H THR 65 -17.566 0.997 -10.033 528 HA THR 65 HA THR 65 -14.891 1.263 -8.884 529 HB THR 65 HB THR 65 -17.414 2.192 -7.543 530 HG1 THR 65 HG1 THR 65 -17.446 3.983 -8.792 531 HG21 THR 65 HG21 THR 65 -14.734 2.274 -6.848 532 HG22 THR 65 HG22 THR 65 -16.024 3.248 -6.143 533 HG23 THR 65 HG23 THR 65 -15.057 3.892 -7.469 534 H MET 66 H MET 66 -14.119 -0.213 -7.535 535 HA MET 66 HA MET 66 -15.913 -1.576 -5.686 536 HB2 MET 66 HB2 MET 66 -14.063 -3.071 -7.552 537 HB3 MET 66 HB3 MET 66 -14.995 -3.790 -6.246 538 HG2 MET 66 HG2 MET 66 -17.051 -3.308 -7.344 539 HG3 MET 66 HG3 MET 66 -16.233 -2.329 -8.561 540 HE1 MET 66 HE1 MET 66 -15.831 -5.500 -6.747 541 HE2 MET 66 HE2 MET 66 -16.461 -6.707 -7.868 542 HE3 MET 66 HE3 MET 66 -14.733 -6.353 -7.832 543 H GLU 67 H GLU 67 -15.018 -1.833 -3.728 544 HA GLU 67 HA GLU 67 -12.515 -0.680 -3.130 545 HB2 GLU 67 HB2 GLU 67 -14.735 -1.707 -1.684 546 HB3 GLU 67 HB3 GLU 67 -13.290 -2.487 -1.057 547 HG2 GLU 67 HG2 GLU 67 -12.738 0.279 -1.369 548 HG3 GLU 67 HG3 GLU 67 -14.273 0.109 -0.519 549 H ASP 68 H ASP 68 -10.774 -1.864 -1.903 550 HA ASP 68 HA ASP 68 -9.670 -3.879 -3.548 551 HB2 ASP 68 HB2 ASP 68 -8.364 -2.245 -2.160 552 HB3 ASP 68 HB3 ASP 68 -8.827 -3.169 -0.733 553 H ASP 69 H ASP 69 -10.896 -4.020 -0.204 554 HA ASP 69 HA ASP 69 -10.610 -6.796 0.108 555 HB2 ASP 69 HB2 ASP 69 -12.000 -4.616 1.530 556 HB3 ASP 69 HB3 ASP 69 -12.687 -6.220 1.769 557 H ILE 70 H ILE 70 -13.173 -4.847 -1.273 558 HA ILE 70 HA ILE 70 -15.051 -7.014 -1.449 559 HB ILE 70 HB ILE 70 -14.999 -4.217 -2.535 560 HG12 ILE 70 HG12 ILE 70 -17.395 -4.859 -1.185 561 HG13 ILE 70 HG13 ILE 70 -16.090 -5.563 -0.238 562 HG21 ILE 70 HG21 ILE 70 -16.739 -6.487 -3.378 563 HG22 ILE 70 HG22 ILE 70 -17.418 -4.862 -3.288 564 HG23 ILE 70 HG23 ILE 70 -16.041 -5.185 -4.341 565 HD11 ILE 70 HD11 ILE 70 -16.355 -2.683 -1.064 566 HD12 ILE 70 HD12 ILE 70 -16.579 -3.348 0.555 567 HD13 ILE 70 HD13 ILE 70 -14.982 -3.366 -0.193 568 H MET 71 H MET 71 -13.085 -5.218 -3.817 569 HA MET 71 HA MET 71 -13.795 -6.589 -6.106 570 HB2 MET 71 HB2 MET 71 -12.337 -4.560 -5.989 571 HB3 MET 71 HB3 MET 71 -11.016 -5.593 -5.460 572 HG2 MET 71 HG2 MET 71 -10.966 -6.737 -7.536 573 HG3 MET 71 HG3 MET 71 -12.477 -5.993 -8.053 574 HE1 MET 71 HE1 MET 71 -11.684 -3.226 -9.981 575 HE2 MET 71 HE2 MET 71 -12.859 -4.145 -9.040 576 HE3 MET 71 HE3 MET 71 -12.160 -2.668 -8.376 577 H PHE 72 H PHE 72 -11.540 -7.512 -3.576 578 HA PHE 72 HA PHE 72 -10.293 -9.656 -4.890 579 HB2 PHE 72 HB2 PHE 72 -9.752 -8.504 -2.608 580 HB3 PHE 72 HB3 PHE 72 -10.838 -9.719 -1.941 581 HD1 PHE 72 HD2 PHE 72 -7.736 -9.265 -3.908 582 HD2 PHE 72 HD1 PHE 72 -10.110 -11.912 -1.568 583 HE1 PHE 72 HE2 PHE 72 -5.889 -10.890 -3.879 584 HE2 PHE 72 HE1 PHE 72 -8.266 -13.541 -1.534 585 HZ PHE 72 HZ PHE 72 -6.152 -13.031 -2.691 586 H ALA 73 H ALA 73 -13.192 -9.541 -2.852 587 HA ALA 73 HA ALA 73 -13.743 -12.270 -2.750 588 HB1 ALA 73 HB1 ALA 73 -15.599 -11.650 -1.663 589 HB2 ALA 73 HB2 ALA 73 -14.932 -10.020 -1.770 590 HB3 ALA 73 HB3 ALA 73 -16.114 -10.569 -2.958 591 H ILE 74 H ILE 74 -14.825 -9.840 -5.108 592 HA ILE 74 HA ILE 74 -16.320 -11.671 -6.683 593 HB ILE 74 HB ILE 74 -15.198 -8.949 -7.340 594 HG12 ILE 74 HG12 ILE 74 -17.819 -8.568 -7.315 595 HG13 ILE 74 HG13 ILE 74 -17.790 -9.992 -6.280 596 HG21 ILE 74 HG21 ILE 74 -16.956 -9.100 -9.216 597 HG22 ILE 74 HG22 ILE 74 -15.411 -9.916 -9.443 598 HG23 ILE 74 HG23 ILE 74 -16.837 -10.843 -8.980 599 HD11 ILE 74 HD11 ILE 74 -17.736 -7.734 -5.140 600 HD12 ILE 74 HD12 ILE 74 -16.511 -8.903 -4.645 601 HD13 ILE 74 HD13 ILE 74 -16.083 -7.588 -5.738 602 H GLY 75 H GLY 75 -12.966 -10.814 -6.535 603 HA2 GLY 75 HA2 GLY 75 -12.305 -11.797 -9.159 604 HA3 GLY 75 HA3 GLY 75 -11.170 -11.338 -7.899 605 H THR 76 H THR 76 -12.168 -13.070 -5.870 606 HA THR 76 HA THR 76 -11.023 -15.574 -6.840 607 HB THR 76 HB THR 76 -11.150 -16.182 -4.345 608 HG1 THR 76 HG1 THR 76 -11.128 -14.140 -3.063 609 HG21 THR 76 HG21 THR 76 -9.239 -14.877 -5.861 610 HG22 THR 76 HG22 THR 76 -8.988 -15.606 -4.274 611 HG23 THR 76 HG23 THR 76 -9.362 -13.888 -4.406 612 H GLY 77 H GLY 77 -13.817 -14.667 -7.436 613 HA2 GLY 77 HA2 GLY 77 -15.928 -15.566 -7.549 614 HA3 GLY 77 HA3 GLY 77 -15.115 -17.115 -7.373 615 H ALA 78 H ALA 78 -14.747 -14.824 -4.829 616 HA ALA 78 HA ALA 78 -15.944 -16.587 -2.935 617 HB1 ALA 78 HB1 ALA 78 -14.358 -14.168 -2.879 618 HB2 ALA 78 HB2 ALA 78 -15.645 -14.133 -1.673 619 HB3 ALA 78 HB3 ALA 78 -14.485 -15.462 -1.687 620 H LEU 79 H LEU 79 -16.711 -13.136 -3.261 621 HA LEU 79 HA LEU 79 -19.528 -13.794 -2.772 622 HB2 LEU 79 HB2 LEU 79 -17.815 -11.420 -2.238 623 HB3 LEU 79 HB3 LEU 79 -19.541 -11.169 -2.490 624 HG LEU 79 HG LEU 79 -18.351 -12.962 -0.375 625 HD11 LEU 79 HD11 LEU 79 -18.870 -11.254 1.209 626 HD12 LEU 79 HD12 LEU 79 -19.618 -10.251 -0.034 627 HD13 LEU 79 HD13 LEU 79 -17.878 -10.533 -0.059 628 HD21 LEU 79 HD21 LEU 79 -20.668 -12.857 0.540 629 HD22 LEU 79 HD22 LEU 79 -20.536 -13.715 -0.995 630 HD23 LEU 79 HD23 LEU 79 -21.170 -12.069 -0.956 631 HA PRO 80 HA PRO 80 -20.641 -12.770 -6.907 632 HB2 PRO 80 HB2 PRO 80 -23.257 -12.167 -6.505 633 HB3 PRO 80 HB3 PRO 80 -22.636 -13.822 -6.469 634 HG2 PRO 80 HG2 PRO 80 -23.257 -11.981 -4.191 635 HG3 PRO 80 HG3 PRO 80 -23.614 -13.710 -4.362 636 HD2 PRO 80 HD2 PRO 80 -21.525 -12.791 -2.905 637 HD3 PRO 80 HD3 PRO 80 -21.476 -14.339 -3.774 638 H ALA 81 H ALA 81 -20.274 -10.973 -8.035 639 HA ALA 81 HA ALA 81 -19.951 -8.442 -6.937 640 HB1 ALA 81 HB1 ALA 81 -19.411 -9.552 -9.345 641 HB2 ALA 81 HB2 ALA 81 -20.750 -8.483 -9.764 642 HB3 ALA 81 HB3 ALA 81 -19.304 -7.826 -9.000 643 H LYS 82 H LYS 82 -22.820 -10.041 -8.050 644 HA LYS 82 HA LYS 82 -24.456 -7.784 -8.476 645 HB2 LYS 82 HB2 LYS 82 -25.473 -10.430 -7.466 646 HB3 LYS 82 HB3 LYS 82 -26.278 -9.283 -8.529 647 HG2 LYS 82 HG2 LYS 82 -25.611 -10.554 -10.219 648 HG3 LYS 82 HG3 LYS 82 -23.976 -9.969 -9.905 649 HD2 LYS 82 HD2 LYS 82 -23.340 -11.896 -8.864 650 HD3 LYS 82 HD3 LYS 82 -24.963 -12.231 -8.256 651 HE2 LYS 82 HE2 LYS 82 -25.626 -12.760 -10.620 652 HE3 LYS 82 HE3 LYS 82 -23.921 -12.645 -11.053 653 HZ1 LYS 82 HZ1 LYS 82 -24.223 -14.888 -10.665 654 HZ2 LYS 82 HZ2 LYS 82 -25.266 -14.645 -9.356 655 HZ3 LYS 82 HZ3 LYS 82 -23.608 -14.356 -9.182 656 H GLU 83 H GLU 83 -24.170 -9.929 -5.642 657 HA GLU 83 HA GLU 83 -25.926 -8.516 -3.983 658 HB2 GLU 83 HB2 GLU 83 -23.565 -10.278 -3.326 659 HB3 GLU 83 HB3 GLU 83 -24.657 -9.637 -2.107 660 HG2 GLU 83 HG2 GLU 83 -25.529 -11.355 -4.416 661 HG3 GLU 83 HG3 GLU 83 -25.147 -11.968 -2.808 662 H ALA 84 H ALA 84 -22.371 -8.358 -4.163 663 HA ALA 84 HA ALA 84 -21.898 -6.442 -2.242 664 HB1 ALA 84 HB1 ALA 84 -20.473 -6.873 -4.862 665 HB2 ALA 84 HB2 ALA 84 -19.864 -5.866 -3.548 666 HB3 ALA 84 HB3 ALA 84 -20.083 -7.599 -3.303 667 H MET 85 H MET 85 -22.798 -5.961 -5.637 668 HA MET 85 HA MET 85 -22.649 -3.120 -5.536 669 HB2 MET 85 HB2 MET 85 -23.305 -5.152 -7.488 670 HB3 MET 85 HB3 MET 85 -24.439 -3.811 -7.577 671 HG2 MET 85 HG2 MET 85 -21.964 -2.589 -7.377 672 HG3 MET 85 HG3 MET 85 -21.684 -3.970 -8.434 673 HE1 MET 85 HE1 MET 85 -23.862 -3.319 -11.499 674 HE2 MET 85 HE2 MET 85 -22.473 -4.176 -10.830 675 HE3 MET 85 HE3 MET 85 -24.085 -4.460 -10.172 676 H ALA 86 H ALA 86 -25.167 -5.473 -4.916 677 HA ALA 86 HA ALA 86 -27.298 -3.558 -4.819 678 HB1 ALA 86 HB1 ALA 86 -28.688 -5.359 -4.136 679 HB2 ALA 86 HB2 ALA 86 -27.572 -6.000 -5.343 680 HB3 ALA 86 HB3 ALA 86 -27.300 -6.323 -3.631 681 H GLN 87 H GLN 87 -24.872 -4.614 -2.639 682 HA GLN 87 HA GLN 87 -26.335 -3.734 -0.280 683 HB2 GLN 87 HB2 GLN 87 -23.523 -4.813 -0.540 684 HB3 GLN 87 HB3 GLN 87 -24.367 -4.501 0.971 685 HG2 GLN 87 HG2 GLN 87 -25.959 -6.203 -0.690 686 HG3 GLN 87 HG3 GLN 87 -24.333 -6.866 -0.532 687 HE21 GLN 87 HE21 GLN 87 -24.993 -8.581 0.731 688 HE22 GLN 87 HE22 GLN 87 -25.509 -8.390 2.368 689 H ASP 88 H ASP 88 -25.169 -2.018 -2.589 690 HA ASP 88 HA ASP 88 -24.365 0.100 -2.805 691 HB2 ASP 88 HB2 ASP 88 -25.854 0.262 -0.623 692 HB3 ASP 88 HB3 ASP 88 -24.292 0.499 0.155 693 H LYS 89 H LYS 89 -22.650 -2.327 -1.963 694 HA LYS 89 HA LYS 89 -20.314 -0.964 -0.868 695 HB2 LYS 89 HB2 LYS 89 -20.927 -3.859 -1.451 696 HB3 LYS 89 HB3 LYS 89 -19.326 -3.311 -0.973 697 HG2 LYS 89 HG2 LYS 89 -20.590 -2.243 1.036 698 HG3 LYS 89 HG3 LYS 89 -21.847 -3.410 0.617 699 HD2 LYS 89 HD2 LYS 89 -20.187 -5.222 0.789 700 HD3 LYS 89 HD3 LYS 89 -18.966 -4.039 1.265 701 HE2 LYS 89 HE2 LYS 89 -21.516 -4.157 2.798 702 HE3 LYS 89 HE3 LYS 89 -20.318 -5.424 3.058 703 HZ1 LYS 89 HZ1 LYS 89 -20.083 -3.543 4.600 704 HZ2 LYS 89 HZ2 LYS 89 -19.772 -2.515 3.293 705 HZ3 LYS 89 HZ3 LYS 89 -18.699 -3.772 3.653 706 H MET 90 H MET 90 -21.643 -1.483 -3.858 707 HA MET 90 HA MET 90 -19.118 -0.878 -5.166 708 HB2 MET 90 HB2 MET 90 -20.733 -3.355 -5.708 709 HB3 MET 90 HB3 MET 90 -19.727 -2.638 -6.960 710 HG2 MET 90 HG2 MET 90 -17.755 -2.938 -5.618 711 HG3 MET 90 HG3 MET 90 -18.724 -3.511 -4.262 712 HE1 MET 90 HE1 MET 90 -20.171 -5.004 -7.653 713 HE2 MET 90 HE2 MET 90 -18.764 -4.005 -8.017 714 HE3 MET 90 HE3 MET 90 -18.692 -5.752 -8.257 715 H GLU 91 H GLU 91 -19.352 0.401 -6.941 716 HA GLU 91 HA GLU 91 -22.096 0.902 -7.888 717 HB2 GLU 91 HB2 GLU 91 -19.943 2.986 -7.479 718 HB3 GLU 91 HB3 GLU 91 -21.561 3.278 -8.102 719 HG2 GLU 91 HG2 GLU 91 -22.271 3.623 -6.042 720 HG3 GLU 91 HG3 GLU 91 -21.869 1.955 -5.637 721 H VAL 92 H VAL 92 -22.290 1.613 -10.071 722 HA VAL 92 HA VAL 92 -19.915 1.439 -11.756 723 HB VAL 92 HB VAL 92 -20.746 -0.863 -11.690 724 HG11 VAL 92 HG11 VAL 92 -23.196 0.098 -11.364 725 HG12 VAL 92 HG12 VAL 92 -23.246 -0.131 -13.113 726 HG13 VAL 92 HG13 VAL 92 -22.903 -1.499 -12.054 727 HG21 VAL 92 HG21 VAL 92 -20.164 -1.100 -13.826 728 HG22 VAL 92 HG22 VAL 92 -21.628 -0.291 -14.383 729 HG23 VAL 92 HG23 VAL 92 -20.205 0.658 -13.955 730 H ASP 93 H ASP 93 -20.043 2.638 -13.606 731 HA ASP 93 HA ASP 93 -22.590 4.039 -14.095 732 HB2 ASP 93 HB2 ASP 93 -20.493 5.322 -13.128 733 HB3 ASP 93 HB3 ASP 93 -19.980 5.306 -14.812 734 H GLY 94 H GLY 94 -22.489 5.120 -16.386 735 HA2 GLY 94 HA2 GLY 94 -21.866 4.919 -18.673 736 HA3 GLY 94 HA3 GLY 94 -21.181 3.340 -18.318 737 H GLN 95 H GLN 95 -22.296 1.663 -19.041 738 HA GLN 95 HA GLN 95 -25.194 1.995 -19.460 739 HB2 GLN 95 HB2 GLN 95 -23.946 1.830 -21.572 740 HB3 GLN 95 HB3 GLN 95 -23.263 0.296 -21.048 741 HG2 GLN 95 HG2 GLN 95 -25.056 -0.114 -22.584 742 HG3 GLN 95 HG3 GLN 95 -25.531 -0.658 -20.976 743 HE21 GLN 95 HE21 GLN 95 -27.439 -0.031 -20.261 744 HE22 GLN 95 HE22 GLN 95 -28.374 1.283 -20.881 745 H VAL 96 H VAL 96 -26.308 0.874 -18.013 746 HA VAL 96 HA VAL 96 -25.424 -0.989 -16.229 747 HB VAL 96 HB VAL 96 -28.163 -0.976 -17.505 748 HG11 VAL 96 HG11 VAL 96 -28.413 -2.843 -16.289 749 HG12 VAL 96 HG12 VAL 96 -26.962 -2.530 -15.334 750 HG13 VAL 96 HG13 VAL 96 -28.485 -1.749 -14.908 751 HG21 VAL 96 HG21 VAL 96 -28.618 0.895 -16.393 752 HG22 VAL 96 HG22 VAL 96 -27.995 0.216 -14.889 753 HG23 VAL 96 HG23 VAL 96 -26.900 1.021 -16.012 754 H GLU 97 H GLU 97 -26.481 -1.549 -19.543 755 HA GLU 97 HA GLU 97 -26.597 -4.349 -19.472 756 HB2 GLU 97 HB2 GLU 97 -26.816 -2.308 -21.432 757 HB3 GLU 97 HB3 GLU 97 -25.646 -3.478 -22.026 758 HG2 GLU 97 HG2 GLU 97 -27.573 -5.144 -21.174 759 HG3 GLU 97 HG3 GLU 97 -28.547 -3.740 -21.608 760 H LEU 98 H LEU 98 -23.940 -2.222 -20.531 761 HA LEU 98 HA LEU 98 -22.062 -4.147 -21.146 762 HB2 LEU 98 HB2 LEU 98 -21.998 -1.320 -20.343 763 HB3 LEU 98 HB3 LEU 98 -20.501 -2.209 -20.067 764 HG LEU 98 HG LEU 98 -20.519 -1.002 -22.213 765 HD11 LEU 98 HD11 LEU 98 -20.483 -4.010 -22.395 766 HD12 LEU 98 HD12 LEU 98 -19.125 -2.952 -22.012 767 HD13 LEU 98 HD13 LEU 98 -19.842 -2.919 -23.623 768 HD21 LEU 98 HD21 LEU 98 -22.094 -1.260 -23.826 769 HD22 LEU 98 HD22 LEU 98 -23.105 -1.615 -22.425 770 HD23 LEU 98 HD23 LEU 98 -22.434 -2.933 -23.386 771 H ILE 99 H ILE 99 -22.316 -2.425 -18.030 772 HA ILE 99 HA ILE 99 -20.432 -3.949 -16.653 773 HB ILE 99 HB ILE 99 -21.208 -1.878 -15.714 774 HG12 ILE 99 HG12 ILE 99 -21.721 -2.589 -13.403 775 HG13 ILE 99 HG13 ILE 99 -22.066 -4.213 -13.989 776 HG21 ILE 99 HG21 ILE 99 -23.484 -1.626 -14.817 777 HG22 ILE 99 HG22 ILE 99 -23.477 -1.884 -16.561 778 HG23 ILE 99 HG23 ILE 99 -23.903 -3.207 -15.476 779 HD11 ILE 99 HD11 ILE 99 -19.421 -3.101 -14.672 780 HD12 ILE 99 HD12 ILE 99 -19.710 -3.492 -12.977 781 HD13 ILE 99 HD13 ILE 99 -19.886 -4.738 -14.212 782 H PHE 100 H PHE 100 -23.819 -4.551 -17.305 783 HA PHE 100 HA PHE 100 -24.127 -6.689 -15.451 784 HB2 PHE 100 HB2 PHE 100 -26.083 -5.517 -16.249 785 HB3 PHE 100 HB3 PHE 100 -25.704 -5.934 -17.917 786 HD1 PHE 100 HD2 PHE 100 -25.870 -7.929 -14.768 787 HD2 PHE 100 HD1 PHE 100 -27.288 -7.371 -18.742 788 HE1 PHE 100 HE2 PHE 100 -27.235 -9.965 -14.563 789 HE2 PHE 100 HE1 PHE 100 -28.657 -9.406 -18.543 790 HZ PHE 100 HZ PHE 100 -28.631 -10.707 -16.453 791 H LEU 101 H LEU 101 -23.101 -6.463 -18.795 792 HA LEU 101 HA LEU 101 -23.238 -9.217 -19.414 793 HB2 LEU 101 HB2 LEU 101 -21.605 -6.964 -20.558 794 HB3 LEU 101 HB3 LEU 101 -21.573 -8.601 -21.211 795 HG LEU 101 HG LEU 101 -24.128 -7.036 -20.995 796 HD11 LEU 101 HD11 LEU 101 -22.312 -7.115 -23.395 797 HD12 LEU 101 HD12 LEU 101 -22.430 -5.748 -22.288 798 HD13 LEU 101 HD13 LEU 101 -23.837 -6.245 -23.229 799 HD21 LEU 101 HD21 LEU 101 -24.944 -8.577 -22.598 800 HD22 LEU 101 HD22 LEU 101 -24.117 -9.529 -21.365 801 HD23 LEU 101 HD23 LEU 101 -23.329 -9.214 -22.912 802 H LEU 102 H LEU 102 -21.201 -7.504 -17.347 803 HA LEU 102 HA LEU 102 -18.896 -9.226 -17.661 804 HB2 LEU 102 HB2 LEU 102 -19.597 -6.909 -15.911 805 HB3 LEU 102 HB3 LEU 102 -18.243 -7.951 -15.479 806 HG LEU 102 HG LEU 102 -18.513 -6.370 -18.037 807 HD11 LEU 102 HD11 LEU 102 -17.821 -5.471 -15.522 808 HD12 LEU 102 HD12 LEU 102 -17.423 -4.696 -17.055 809 HD13 LEU 102 HD13 LEU 102 -16.267 -5.789 -16.293 810 HD21 LEU 102 HD21 LEU 102 -15.967 -7.059 -18.020 811 HD22 LEU 102 HD22 LEU 102 -17.199 -8.112 -18.715 812 HD23 LEU 102 HD23 LEU 102 -16.582 -8.426 -17.092 813 H GLU 103 H GLU 103 -21.522 -8.754 -15.341 814 HA GLU 103 HA GLU 103 -20.857 -10.266 -13.222 815 HB2 GLU 103 HB2 GLU 103 -23.390 -9.777 -14.645 816 HB3 GLU 103 HB3 GLU 103 -23.389 -11.199 -13.611 817 HG2 GLU 103 HG2 GLU 103 -23.978 -9.764 -12.007 818 HG3 GLU 103 HG3 GLU 103 -22.262 -9.364 -11.967 819 HA PRO 104 HA PRO 104 -21.971 -14.425 -15.412 820 HB2 PRO 104 HB2 PRO 104 -22.385 -14.349 -18.094 821 HB3 PRO 104 HB3 PRO 104 -23.682 -14.121 -16.915 822 HG2 PRO 104 HG2 PRO 104 -22.139 -12.069 -18.455 823 HG3 PRO 104 HG3 PRO 104 -23.879 -12.143 -18.123 824 HD2 PRO 104 HD2 PRO 104 -22.196 -10.549 -16.725 825 HD3 PRO 104 HD3 PRO 104 -23.638 -11.287 -15.997 826 H PHE 105 H PHE 105 -20.080 -12.064 -17.208 827 HA PHE 105 HA PHE 105 -18.372 -13.796 -18.581 828 HB2 PHE 105 HB2 PHE 105 -18.541 -11.333 -18.953 829 HB3 PHE 105 HB3 PHE 105 -17.658 -11.084 -17.450 830 HD1 PHE 105 HD2 PHE 105 -17.258 -13.229 -20.482 831 HD2 PHE 105 HD1 PHE 105 -15.469 -10.504 -17.746 832 HE1 PHE 105 HE2 PHE 105 -15.133 -13.398 -21.709 833 HE2 PHE 105 HE1 PHE 105 -13.340 -10.668 -18.970 834 HZ PHE 105 HZ PHE 105 -13.170 -12.118 -20.953 835 H ILE 106 H ILE 106 -18.502 -12.931 -15.241 836 HA ILE 106 HA ILE 106 -15.868 -13.449 -14.454 837 HB ILE 106 HB ILE 106 -18.401 -13.916 -12.876 838 HG12 ILE 106 HG12 ILE 106 -16.559 -11.516 -12.915 839 HG13 ILE 106 HG13 ILE 106 -18.103 -11.600 -13.756 840 HG21 ILE 106 HG21 ILE 106 -17.031 -14.842 -11.381 841 HG22 ILE 106 HG22 ILE 106 -15.592 -14.314 -12.252 842 HG23 ILE 106 HG23 ILE 106 -16.390 -13.220 -11.123 843 HD11 ILE 106 HD11 ILE 106 -19.098 -12.104 -11.448 844 HD12 ILE 106 HD12 ILE 106 -17.566 -11.498 -10.818 845 HD13 ILE 106 HD13 ILE 106 -18.590 -10.453 -11.803 846 H ALA 107 H ALA 107 -18.510 -15.598 -15.208 847 HA ALA 107 HA ALA 107 -17.715 -17.942 -13.974 848 HB1 ALA 107 HB1 ALA 107 -18.845 -17.917 -16.754 849 HB2 ALA 107 HB2 ALA 107 -19.115 -19.085 -15.459 850 HB3 ALA 107 HB3 ALA 107 -19.817 -17.470 -15.352 851 H SER 108 H SER 108 -16.364 -16.337 -16.752 852 HA SER 108 HA SER 108 -14.820 -18.603 -17.627 853 HB2 SER 108 HB2 SER 108 -15.657 -16.599 -19.047 854 HB3 SER 108 HB3 SER 108 -14.249 -15.753 -18.405 855 HG SER 108 HG SER 108 -14.315 -18.097 -19.989 856 H LEU 109 H LEU 109 -14.314 -15.781 -15.611 857 HA LEU 109 HA LEU 109 -11.487 -16.443 -15.276 858 HB2 LEU 109 HB2 LEU 109 -13.187 -14.087 -14.561 859 HB3 LEU 109 HB3 LEU 109 -11.629 -14.333 -13.775 860 HG LEU 109 HG LEU 109 -11.401 -12.761 -15.594 861 HD11 LEU 109 HD11 LEU 109 -9.551 -13.725 -16.692 862 HD12 LEU 109 HD12 LEU 109 -10.196 -15.356 -16.515 863 HD13 LEU 109 HD13 LEU 109 -9.613 -14.481 -15.099 864 HD21 LEU 109 HD21 LEU 109 -13.346 -13.588 -16.904 865 HD22 LEU 109 HD22 LEU 109 -12.360 -14.955 -17.426 866 HD23 LEU 109 HD23 LEU 109 -11.900 -13.312 -17.875 867 H LYS 110 H LYS 110 -12.846 -18.460 -14.264 868 HA LYS 110 HA LYS 110 -13.296 -19.700 -12.406 869 HB2 LYS 110 HB2 LYS 110 -10.838 -18.930 -12.119 870 HB3 LYS 110 HB3 LYS 110 -11.477 -17.858 -10.879 871 HG2 LYS 110 HG2 LYS 110 -12.579 -20.327 -10.273 872 HG3 LYS 110 HG3 LYS 110 -10.925 -20.693 -10.771 873 HD2 LYS 110 HD2 LYS 110 -10.069 -19.073 -9.164 874 HD3 LYS 110 HD3 LYS 110 -11.717 -18.652 -8.691 875 HE2 LYS 110 HE2 LYS 110 -11.394 -20.181 -7.075 876 HE3 LYS 110 HE3 LYS 110 -11.751 -21.342 -8.353 877 HZ1 LYS 110 HZ1 LYS 110 -9.264 -20.807 -6.998 878 HZ2 LYS 110 HZ2 LYS 110 -9.113 -20.914 -8.679 879 HZ3 LYS 110 HZ3 LYS 110 -9.778 -22.202 -7.807
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