NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
641384 | 6rh6 | 34395 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -4 H1 GLY -4 4.585 10.148 19.016 2 H2 GLY -4 H2 GLY -4 3.915 10.455 20.478 3 H3 GLY -4 H3 GLY -4 5.505 10.073 20.372 4 HA2 GLY -4 HA2 GLY -4 5.247 12.436 20.753 5 HA3 GLY -4 HA3 GLY -4 5.996 12.097 19.183 6 H SER -3 H SER -3 4.600 14.510 19.888 7 HA SER -3 HA SER -3 1.961 14.516 18.680 8 HB2 SER -3 HB2 SER -3 2.212 17.013 18.929 9 HB3 SER -3 HB3 SER -3 2.369 16.073 20.421 10 HG SER -3 HG SER -3 4.007 17.680 20.215 11 HA PRO -2 HA PRO -2 3.136 15.181 14.446 12 HB2 PRO -2 HB2 PRO -2 1.039 16.599 13.417 13 HB3 PRO -2 HB3 PRO -2 0.904 14.892 13.943 14 HG2 PRO -2 HG2 PRO -2 0.184 17.383 15.518 15 HG3 PRO -2 HG3 PRO -2 -0.816 15.920 15.258 16 HD2 PRO -2 HD2 PRO -2 0.658 16.263 17.512 17 HD3 PRO -2 HD3 PRO -2 0.490 14.650 16.758 18 H ASN -1 H ASN -1 3.794 16.777 12.861 19 HA ASN -1 HA ASN -1 5.324 18.894 13.989 20 HB2 ASN -1 HB2 ASN -1 5.899 17.577 11.954 21 HB3 ASN -1 HB3 ASN -1 4.568 18.344 11.082 22 HD21 ASN -1 HD21 ASN -1 7.988 20.502 11.853 23 HD22 ASN -1 HD22 ASN -1 7.639 19.078 12.821 24 H SER 0 H SER 0 2.097 18.936 12.621 25 HA SER 0 HA SER 0 1.775 21.811 13.409 26 HB2 SER 0 HB2 SER 0 0.457 20.404 11.056 27 HB3 SER 0 HB3 SER 0 0.046 22.019 11.663 28 HG SER 0 HG SER 0 1.515 22.089 9.887 29 H MET 1 H MET 1 0.377 22.105 14.951 30 HA MET 1 HA MET 1 -1.972 20.353 15.244 31 HB2 MET 1 HB2 MET 1 -0.060 19.375 16.615 32 HB3 MET 1 HB3 MET 1 -0.110 20.834 17.607 33 HG2 MET 1 HG2 MET 1 -2.457 20.357 18.197 34 HG3 MET 1 HG3 MET 1 -2.462 18.962 17.109 35 HE1 MET 1 HE1 MET 1 -3.470 17.471 18.991 36 HE2 MET 1 HE2 MET 1 -2.767 17.294 20.614 37 HE3 MET 1 HE3 MET 1 -3.464 18.851 20.115 38 H ALA 2 H ALA 2 -3.663 21.455 15.700 39 HA ALA 2 HA ALA 2 -3.594 24.073 17.128 40 HB1 ALA 2 HB1 ALA 2 -5.158 25.010 15.485 41 HB2 ALA 2 HB2 ALA 2 -3.668 24.485 14.683 42 HB3 ALA 2 HB3 ALA 2 -5.137 23.489 14.564 43 H THR 3 H THR 3 -4.162 21.473 18.154 44 HA THR 3 HA THR 3 -5.610 20.271 19.383 45 HB THR 3 HB THR 3 -7.304 22.642 19.910 46 HG1 THR 3 HG1 THR 3 -5.771 23.300 21.418 47 HG21 THR 3 HG21 THR 3 -7.827 20.461 21.028 48 HG22 THR 3 HG22 THR 3 -6.177 20.414 21.668 49 HG23 THR 3 HG23 THR 3 -7.307 21.686 22.194 50 H GLU 4 H GLU 4 -6.006 19.968 16.776 51 HA GLU 4 HA GLU 4 -8.931 19.622 16.338 52 HB2 GLU 4 HB2 GLU 4 -8.427 19.162 14.067 53 HB3 GLU 4 HB3 GLU 4 -7.647 20.666 14.514 54 HG2 GLU 4 HG2 GLU 4 -6.139 18.017 14.455 55 HG3 GLU 4 HG3 GLU 4 -6.388 18.984 13.017 56 H LEU 5 H LEU 5 -9.451 17.478 15.149 57 HA LEU 5 HA LEU 5 -8.756 15.258 16.928 58 HB2 LEU 5 HB2 LEU 5 -10.593 15.401 14.508 59 HB3 LEU 5 HB3 LEU 5 -10.452 14.031 15.605 60 HG LEU 5 HG LEU 5 -11.485 16.798 16.360 61 HD11 LEU 5 HD11 LEU 5 -12.914 14.125 16.055 62 HD12 LEU 5 HD12 LEU 5 -13.648 15.660 16.572 63 HD13 LEU 5 HD13 LEU 5 -13.015 15.495 14.926 64 HD21 LEU 5 HD21 LEU 5 -12.178 15.701 18.488 65 HD22 LEU 5 HD22 LEU 5 -11.282 14.241 18.013 66 HD23 LEU 5 HD23 LEU 5 -10.424 15.770 18.317 67 H GLU 6 H GLU 6 -6.429 15.741 16.087 68 HA GLU 6 HA GLU 6 -5.711 14.588 13.535 69 HB2 GLU 6 HB2 GLU 6 -4.601 16.440 15.347 70 HB3 GLU 6 HB3 GLU 6 -3.434 15.148 15.305 71 HG2 GLU 6 HG2 GLU 6 -4.553 16.663 12.909 72 HG3 GLU 6 HG3 GLU 6 -2.981 16.922 13.652 73 H TYR 7 H TYR 7 -6.980 12.611 15.100 74 HA TYR 7 HA TYR 7 -4.929 10.778 16.132 75 HB2 TYR 7 HB2 TYR 7 -6.642 9.532 17.063 76 HB3 TYR 7 HB3 TYR 7 -7.187 11.183 17.237 77 HD1 TYR 7 HD1 TYR 7 -9.030 12.054 15.706 78 HD2 TYR 7 HD2 TYR 7 -7.886 7.894 15.824 79 HE1 TYR 7 HE1 TYR 7 -11.125 11.443 14.518 80 HE2 TYR 7 HE2 TYR 7 -9.977 7.282 14.644 81 HH TYR 7 HH TYR 7 -12.405 9.739 13.665 82 H GLU 8 H GLU 8 -5.413 8.394 15.598 83 HA GLU 8 HA GLU 8 -6.483 7.558 13.129 84 HB2 GLU 8 HB2 GLU 8 -4.505 6.695 11.968 85 HB3 GLU 8 HB3 GLU 8 -4.500 8.438 12.045 86 HG2 GLU 8 HG2 GLU 8 -2.954 8.053 14.194 87 HG3 GLU 8 HG3 GLU 8 -2.744 6.449 13.490 88 H SER 9 H SER 9 -7.227 5.607 13.567 89 HA SER 9 HA SER 9 -6.252 4.147 15.931 90 HB2 SER 9 HB2 SER 9 -8.767 3.992 14.254 91 HB3 SER 9 HB3 SER 9 -8.414 2.882 15.600 92 HG SER 9 HG SER 9 -9.665 4.677 16.292 93 H VAL 10 H VAL 10 -5.152 2.196 15.819 94 HA VAL 10 HA VAL 10 -4.173 1.301 13.281 95 HB VAL 10 HB VAL 10 -4.128 -0.190 15.892 96 HG11 VAL 10 HG11 VAL 10 -2.065 -1.253 14.960 97 HG12 VAL 10 HG12 VAL 10 -3.493 -1.654 14.014 98 HG13 VAL 10 HG13 VAL 10 -2.354 -0.425 13.414 99 HG21 VAL 10 HG21 VAL 10 -2.053 1.737 14.761 100 HG22 VAL 10 HG22 VAL 10 -3.077 2.031 16.183 101 HG23 VAL 10 HG23 VAL 10 -1.868 0.751 16.222 102 H LEU 11 H LEU 11 -4.769 -0.207 11.888 103 HA LEU 11 HA LEU 11 -7.197 -1.886 12.417 104 HB2 LEU 11 HB2 LEU 11 -6.088 -0.816 9.793 105 HB3 LEU 11 HB3 LEU 11 -7.457 -1.905 9.956 106 HG LEU 11 HG LEU 11 -7.335 0.995 10.874 107 HD11 LEU 11 HD11 LEU 11 -8.886 -0.485 8.701 108 HD12 LEU 11 HD12 LEU 11 -9.121 1.214 9.137 109 HD13 LEU 11 HD13 LEU 11 -7.575 0.691 8.459 110 HD21 LEU 11 HD21 LEU 11 -9.766 0.699 11.383 111 HD22 LEU 11 HD22 LEU 11 -9.586 -1.054 11.146 112 HD23 LEU 11 HD23 LEU 11 -8.731 -0.220 12.472 113 H CYS 12 H CYS 12 -3.936 -1.876 10.882 114 HA CYS 12 HA CYS 12 -3.791 -4.796 11.240 115 HB2 CYS 12 HB2 CYS 12 -4.885 -4.307 8.988 116 HB3 CYS 12 HB3 CYS 12 -3.312 -3.674 8.464 117 HG CYS 12 HG CYS 12 -4.037 -6.200 7.720 118 H VAL 13 H VAL 13 -1.814 -5.726 11.031 119 HA VAL 13 HA VAL 13 0.546 -4.091 10.492 120 HB VAL 13 HB VAL 13 0.337 -4.020 12.935 121 HG11 VAL 13 HG11 VAL 13 -0.797 -6.181 13.357 122 HG12 VAL 13 HG12 VAL 13 0.706 -7.040 12.948 123 HG13 VAL 13 HG13 VAL 13 0.647 -5.959 14.352 124 HG21 VAL 13 HG21 VAL 13 2.696 -5.722 12.030 125 HG22 VAL 13 HG22 VAL 13 2.580 -3.949 11.939 126 HG23 VAL 13 HG23 VAL 13 2.599 -4.749 13.511 127 H LYS 14 H LYS 14 1.964 -5.192 9.270 128 HA LYS 14 HA LYS 14 1.857 -8.154 9.305 129 HB2 LYS 14 HB2 LYS 14 1.925 -6.604 6.687 130 HB3 LYS 14 HB3 LYS 14 2.354 -8.285 6.811 131 HG2 LYS 14 HG2 LYS 14 -0.353 -7.190 7.666 132 HG3 LYS 14 HG3 LYS 14 0.004 -7.846 6.070 133 HD2 LYS 14 HD2 LYS 14 0.585 -10.014 6.987 134 HD3 LYS 14 HD3 LYS 14 0.362 -9.467 8.649 135 HE2 LYS 14 HE2 LYS 14 -1.852 -9.276 6.598 136 HE3 LYS 14 HE3 LYS 14 -1.546 -10.767 7.521 137 HZ1 LYS 14 HZ1 LYS 14 -1.997 -9.590 9.544 138 HZ2 LYS 14 HZ2 LYS 14 -2.062 -8.135 8.791 139 HZ3 LYS 14 HZ3 LYS 14 -3.224 -9.245 8.490 140 HA PRO 15 HA PRO 15 5.829 -7.897 10.507 141 HB2 PRO 15 HB2 PRO 15 6.818 -10.429 10.105 142 HB3 PRO 15 HB3 PRO 15 5.489 -10.051 11.239 143 HG2 PRO 15 HG2 PRO 15 5.241 -11.046 8.370 144 HG3 PRO 15 HG3 PRO 15 4.440 -11.700 9.839 145 HD2 PRO 15 HD2 PRO 15 3.161 -9.982 8.226 146 HD3 PRO 15 HD3 PRO 15 3.010 -9.852 10.005 147 H ASP 16 H ASP 16 5.676 -8.943 7.109 148 HA ASP 16 HA ASP 16 8.227 -7.548 6.573 149 HB2 ASP 16 HB2 ASP 16 8.793 -9.925 6.986 150 HB3 ASP 16 HB3 ASP 16 7.710 -10.400 5.685 151 H VAL 17 H VAL 17 8.079 -6.301 4.813 152 HA VAL 17 HA VAL 17 6.243 -6.917 2.598 153 HB VAL 17 HB VAL 17 4.878 -5.671 4.289 154 HG11 VAL 17 HG11 VAL 17 5.158 -3.301 4.638 155 HG12 VAL 17 HG12 VAL 17 6.618 -4.149 5.178 156 HG13 VAL 17 HG13 VAL 17 6.612 -3.274 3.633 157 HG21 VAL 17 HG21 VAL 17 4.341 -5.649 1.873 158 HG22 VAL 17 HG22 VAL 17 3.845 -4.170 2.707 159 HG23 VAL 17 HG23 VAL 17 5.297 -4.158 1.691 160 H SER 18 H SER 18 6.906 -6.001 0.691 161 HA SER 18 HA SER 18 9.429 -4.382 0.680 162 HB2 SER 18 HB2 SER 18 8.551 -6.428 -1.381 163 HB3 SER 18 HB3 SER 18 10.119 -5.614 -1.231 164 HG SER 18 HG SER 18 10.066 -7.808 -0.413 165 H VAL 19 H VAL 19 9.666 -2.772 -0.967 166 HA VAL 19 HA VAL 19 7.125 -2.080 -2.410 167 HB VAL 19 HB VAL 19 7.476 0.186 -2.226 168 HG11 VAL 19 HG11 VAL 19 6.936 0.453 0.106 169 HG12 VAL 19 HG12 VAL 19 6.210 -1.038 -0.485 170 HG13 VAL 19 HG13 VAL 19 7.671 -1.105 0.521 171 HG21 VAL 19 HG21 VAL 19 9.980 0.222 -2.159 172 HG22 VAL 19 HG22 VAL 19 9.207 1.234 -0.977 173 HG23 VAL 19 HG23 VAL 19 9.883 -0.341 -0.483 174 H TYR 20 H TYR 20 7.169 -1.022 -4.297 175 HA TYR 20 HA TYR 20 9.734 -0.983 -5.861 176 HB2 TYR 20 HB2 TYR 20 6.996 -1.484 -7.050 177 HB3 TYR 20 HB3 TYR 20 8.567 -1.698 -7.801 178 HD1 TYR 20 HD1 TYR 20 10.126 -3.552 -6.742 179 HD2 TYR 20 HD2 TYR 20 5.869 -3.291 -6.107 180 HE1 TYR 20 HE1 TYR 20 10.089 -5.902 -5.900 181 HE2 TYR 20 HE2 TYR 20 5.826 -5.682 -5.434 182 HH TYR 20 HH TYR 20 8.799 -7.646 -5.157 183 H ARG 21 H ARG 21 10.228 1.210 -5.784 184 HA ARG 21 HA ARG 21 8.386 3.353 -6.469 185 HB2 ARG 21 HB2 ARG 21 11.417 3.123 -6.530 186 HB3 ARG 21 HB3 ARG 21 10.549 4.622 -6.883 187 HG2 ARG 21 HG2 ARG 21 9.727 4.846 -4.669 188 HG3 ARG 21 HG3 ARG 21 10.028 3.152 -4.276 189 HD2 ARG 21 HD2 ARG 21 11.684 4.455 -3.148 190 HD3 ARG 21 HD3 ARG 21 12.442 3.509 -4.436 191 HE ARG 21 HE ARG 21 11.726 6.257 -5.186 192 HH11 ARG 21 HH11 ARG 21 13.341 7.706 -5.652 193 HH12 ARG 21 HH12 ARG 21 14.990 7.339 -5.240 194 HH21 ARG 21 HH21 ARG 21 14.332 4.238 -3.900 195 HH22 ARG 21 HH22 ARG 21 15.530 5.452 -4.270 196 H ILE 22 H ILE 22 7.242 2.355 -8.125 197 HA ILE 22 HA ILE 22 8.338 1.435 -10.546 198 HB ILE 22 HB ILE 22 6.023 1.302 -11.350 199 HG12 ILE 22 HG12 ILE 22 5.389 2.995 -8.906 200 HG13 ILE 22 HG13 ILE 22 4.977 3.278 -10.600 201 HG21 ILE 22 HG21 ILE 22 6.215 0.371 -8.484 202 HG22 ILE 22 HG22 ILE 22 5.276 -0.320 -9.785 203 HG23 ILE 22 HG23 ILE 22 7.041 -0.409 -9.853 204 HD11 ILE 22 HD11 ILE 22 3.449 1.273 -10.479 205 HD12 ILE 22 HD12 ILE 22 3.763 1.226 -8.726 206 HD13 ILE 22 HD13 ILE 22 2.997 2.650 -9.444 207 HA PRO 23 HA PRO 23 8.539 5.124 -13.032 208 HB2 PRO 23 HB2 PRO 23 8.563 3.953 -15.586 209 HB3 PRO 23 HB3 PRO 23 9.950 4.313 -14.526 210 HG2 PRO 23 HG2 PRO 23 8.645 1.693 -15.056 211 HG3 PRO 23 HG3 PRO 23 10.300 2.041 -14.509 212 HD2 PRO 23 HD2 PRO 23 8.183 1.129 -12.887 213 HD3 PRO 23 HD3 PRO 23 9.703 1.866 -12.313 214 HA PRO 24 HA PRO 24 4.611 5.062 -15.647 215 HB2 PRO 24 HB2 PRO 24 2.836 3.011 -15.784 216 HB3 PRO 24 HB3 PRO 24 4.390 2.992 -16.673 217 HG2 PRO 24 HG2 PRO 24 3.792 1.744 -13.962 218 HG3 PRO 24 HG3 PRO 24 4.513 0.959 -15.408 219 HD2 PRO 24 HD2 PRO 24 6.060 1.966 -13.423 220 HD3 PRO 24 HD3 PRO 24 6.543 2.119 -15.139 221 H ARG 25 H ARG 25 2.360 5.576 -15.420 222 HA ARG 25 HA ARG 25 1.206 5.528 -12.646 223 HB2 ARG 25 HB2 ARG 25 1.939 7.775 -13.237 224 HB3 ARG 25 HB3 ARG 25 0.982 7.725 -14.728 225 HG2 ARG 25 HG2 ARG 25 -1.099 7.533 -13.439 226 HG3 ARG 25 HG3 ARG 25 -0.182 7.431 -11.922 227 HD2 ARG 25 HD2 ARG 25 0.721 9.716 -12.344 228 HD3 ARG 25 HD3 ARG 25 -0.257 9.811 -13.825 229 HE ARG 25 HE ARG 25 -2.017 9.162 -11.717 230 HH11 ARG 25 HH11 ARG 25 -3.312 10.653 -10.695 231 HH12 ARG 25 HH12 ARG 25 -2.872 12.334 -10.700 232 HH21 ARG 25 HH21 ARG 25 -0.026 11.917 -12.565 233 HH22 ARG 25 HH22 ARG 25 -1.062 13.040 -11.728 234 H ALA 26 H ALA 26 0.317 5.528 -16.111 235 HA ALA 26 HA ALA 26 -2.135 3.991 -15.429 236 HB1 ALA 26 HB1 ALA 26 -3.548 5.703 -16.465 237 HB2 ALA 26 HB2 ALA 26 -2.667 6.355 -15.062 238 HB3 ALA 26 HB3 ALA 26 -2.125 6.754 -16.707 239 H SER 27 H SER 27 -1.396 2.327 -16.486 240 HA SER 27 HA SER 27 -1.202 2.427 -19.460 241 HB2 SER 27 HB2 SER 27 0.388 0.985 -18.153 242 HB3 SER 27 HB3 SER 27 -1.002 0.022 -17.625 243 HG SER 27 HG SER 27 -0.004 0.429 -20.264 244 H ASN 28 H ASN 28 -2.562 0.954 -20.643 245 HA ASN 28 HA ASN 28 -5.282 1.378 -20.413 246 HB2 ASN 28 HB2 ASN 28 -5.506 -0.077 -22.262 247 HB3 ASN 28 HB3 ASN 28 -3.913 0.642 -22.430 248 HD21 ASN 28 HD21 ASN 28 -2.315 -2.591 -21.608 249 HD22 ASN 28 HD22 ASN 28 -2.170 -0.952 -21.003 250 H ARG 29 H ARG 29 -3.543 -1.173 -18.762 251 HA ARG 29 HA ARG 29 -6.089 -2.449 -17.825 252 HB2 ARG 29 HB2 ARG 29 -3.317 -3.543 -18.075 253 HB3 ARG 29 HB3 ARG 29 -4.637 -4.389 -17.250 254 HG2 ARG 29 HG2 ARG 29 -5.824 -4.833 -19.152 255 HG3 ARG 29 HG3 ARG 29 -5.375 -3.311 -19.930 256 HD2 ARG 29 HD2 ARG 29 -3.071 -4.149 -20.168 257 HD3 ARG 29 HD3 ARG 29 -3.623 -5.747 -19.630 258 HE ARG 29 HE ARG 29 -4.546 -4.256 -22.090 259 HH11 ARG 29 HH11 ARG 29 -5.092 -5.393 -23.882 260 HH12 ARG 29 HH12 ARG 29 -5.065 -7.134 -23.874 261 HH21 ARG 29 HH21 ARG 29 -4.026 -7.405 -20.612 262 HH22 ARG 29 HH22 ARG 29 -4.473 -8.250 -22.069 263 H GLY 30 H GLY 30 -3.961 -0.225 -16.772 264 HA2 GLY 30 HA2 GLY 30 -4.309 0.631 -14.432 265 HA3 GLY 30 HA3 GLY 30 -4.057 -1.037 -13.888 266 H TYR 31 H TYR 31 -2.075 -1.590 -13.332 267 HA TYR 31 HA TYR 31 0.288 0.100 -14.152 268 HB2 TYR 31 HB2 TYR 31 -0.414 -1.223 -11.516 269 HB3 TYR 31 HB3 TYR 31 1.209 -0.695 -11.915 270 HD1 TYR 31 HD1 TYR 31 1.831 1.608 -12.155 271 HD2 TYR 31 HD2 TYR 31 -2.170 0.428 -11.045 272 HE1 TYR 31 HE1 TYR 31 1.435 3.869 -11.194 273 HE2 TYR 31 HE2 TYR 31 -2.596 2.721 -10.136 274 HH TYR 31 HH TYR 31 -0.058 5.253 -10.101 275 H ARG 32 H ARG 32 -0.840 -3.189 -13.626 276 HA ARG 32 HA ARG 32 0.116 -5.193 -13.536 277 HB2 ARG 32 HB2 ARG 32 1.628 -5.232 -15.944 278 HB3 ARG 32 HB3 ARG 32 0.080 -5.916 -15.523 279 HG2 ARG 32 HG2 ARG 32 -0.249 -4.786 -17.509 280 HG3 ARG 32 HG3 ARG 32 -1.047 -3.796 -16.304 281 HD2 ARG 32 HD2 ARG 32 0.413 -2.038 -16.571 282 HD3 ARG 32 HD3 ARG 32 1.790 -3.060 -16.938 283 HE ARG 32 HE ARG 32 -0.004 -1.778 -18.793 284 HH11 ARG 32 HH11 ARG 32 0.408 -1.850 -20.906 285 HH12 ARG 32 HH12 ARG 32 1.347 -3.146 -21.598 286 HH21 ARG 32 HH21 ARG 32 1.983 -4.669 -18.586 287 HH22 ARG 32 HH22 ARG 32 2.261 -4.682 -20.304 288 H ALA 33 H ALA 33 1.443 -5.675 -11.895 289 HA ALA 33 HA ALA 33 3.997 -4.690 -11.365 290 HB1 ALA 33 HB1 ALA 33 4.253 -6.618 -9.920 291 HB2 ALA 33 HB2 ALA 33 2.586 -6.068 -9.839 292 HB3 ALA 33 HB3 ALA 33 2.985 -7.508 -10.800 293 H SER 34 H SER 34 3.145 -7.389 -13.427 294 HA SER 34 HA SER 34 5.557 -8.457 -14.280 295 HB2 SER 34 HB2 SER 34 2.961 -7.910 -15.768 296 HB3 SER 34 HB3 SER 34 4.196 -9.107 -16.253 297 HG SER 34 HG SER 34 2.428 -9.969 -15.045 298 H ASP 35 H ASP 35 4.363 -5.221 -15.040 299 HA ASP 35 HA ASP 35 6.001 -4.918 -17.460 300 HB2 ASP 35 HB2 ASP 35 3.728 -3.925 -17.135 301 HB3 ASP 35 HB3 ASP 35 4.408 -2.851 -15.904 302 H TRP 36 H TRP 36 6.465 -4.360 -14.018 303 HA TRP 36 HA TRP 36 8.840 -2.652 -14.635 304 HB2 TRP 36 HB2 TRP 36 8.276 -1.785 -12.165 305 HB3 TRP 36 HB3 TRP 36 7.799 -1.044 -13.661 306 HD1 TRP 36 HD1 TRP 36 5.335 -0.905 -14.306 307 HE1 TRP 36 HE1 TRP 36 3.142 -1.289 -13.105 308 HE3 TRP 36 HE3 TRP 36 7.075 -3.372 -10.124 309 HZ2 TRP 36 HZ2 TRP 36 2.292 -2.051 -10.444 310 HZ3 TRP 36 HZ3 TRP 36 5.504 -3.972 -8.328 311 HH2 TRP 36 HH2 TRP 36 3.129 -3.267 -8.425 312 H LYS 37 H LYS 37 7.969 -4.059 -11.538 313 HA LYS 37 HA LYS 37 10.719 -5.223 -11.340 314 HB2 LYS 37 HB2 LYS 37 9.539 -2.967 -9.635 315 HB3 LYS 37 HB3 LYS 37 11.063 -3.755 -9.276 316 HG2 LYS 37 HG2 LYS 37 10.570 -2.172 -11.802 317 HG3 LYS 37 HG3 LYS 37 11.257 -1.517 -10.327 318 HD2 LYS 37 HD2 LYS 37 12.566 -3.935 -11.543 319 HD3 LYS 37 HD3 LYS 37 12.768 -2.359 -12.328 320 HE2 LYS 37 HE2 LYS 37 13.523 -1.405 -10.125 321 HE3 LYS 37 HE3 LYS 37 13.473 -3.031 -9.441 322 HZ1 LYS 37 HZ1 LYS 37 15.708 -2.513 -10.213 323 HZ2 LYS 37 HZ2 LYS 37 15.109 -3.685 -11.197 324 HZ3 LYS 37 HZ3 LYS 37 15.182 -2.136 -11.710 325 H LEU 38 H LEU 38 8.115 -6.545 -11.206 326 HA LEU 38 HA LEU 38 7.238 -7.002 -8.628 327 HB2 LEU 38 HB2 LEU 38 6.030 -8.818 -9.440 328 HB3 LEU 38 HB3 LEU 38 6.108 -7.648 -10.735 329 HG LEU 38 HG LEU 38 7.809 -10.169 -10.573 330 HD11 LEU 38 HD11 LEU 38 5.291 -9.532 -12.195 331 HD12 LEU 38 HD12 LEU 38 6.259 -11.023 -12.320 332 HD13 LEU 38 HD13 LEU 38 5.388 -10.640 -10.827 333 HD21 LEU 38 HD21 LEU 38 8.941 -8.579 -12.001 334 HD22 LEU 38 HD22 LEU 38 8.178 -9.802 -13.009 335 HD23 LEU 38 HD23 LEU 38 7.423 -8.198 -12.855 336 H ASP 39 H ASP 39 10.270 -8.108 -9.722 337 HA ASP 39 HA ASP 39 10.603 -9.874 -7.349 338 HB2 ASP 39 HB2 ASP 39 12.075 -11.232 -8.627 339 HB3 ASP 39 HB3 ASP 39 10.609 -11.022 -9.580 340 H GLN 40 H GLN 40 11.259 -6.816 -8.092 341 HA GLN 40 HA GLN 40 14.105 -6.759 -7.145 342 HB2 GLN 40 HB2 GLN 40 12.811 -5.380 -9.518 343 HB3 GLN 40 HB3 GLN 40 14.397 -4.932 -8.872 344 HG2 GLN 40 HG2 GLN 40 15.409 -6.927 -9.559 345 HG3 GLN 40 HG3 GLN 40 13.868 -7.751 -9.795 346 HE21 GLN 40 HE21 GLN 40 13.481 -6.661 -13.121 347 HE22 GLN 40 HE22 GLN 40 12.912 -7.709 -11.810 348 HA PRO 41 HA PRO 41 11.459 -3.674 -4.856 349 HB2 PRO 41 HB2 PRO 41 12.010 -4.347 -2.285 350 HB3 PRO 41 HB3 PRO 41 10.812 -5.222 -3.295 351 HG2 PRO 41 HG2 PRO 41 13.711 -5.981 -2.784 352 HG3 PRO 41 HG3 PRO 41 12.256 -7.016 -2.616 353 HD2 PRO 41 HD2 PRO 41 13.789 -7.024 -4.878 354 HD3 PRO 41 HD3 PRO 41 12.012 -7.215 -4.953 355 H ASP 42 H ASP 42 12.076 -1.785 -3.769 356 HA ASP 42 HA ASP 42 14.999 -1.138 -3.905 357 HB2 ASP 42 HB2 ASP 42 13.376 0.202 -5.255 358 HB3 ASP 42 HB3 ASP 42 12.616 0.737 -3.754 359 H TRP 43 H TRP 43 12.304 -1.379 -1.686 360 HA TRP 43 HA TRP 43 14.119 -1.185 0.610 361 HB2 TRP 43 HB2 TRP 43 13.350 1.079 0.512 362 HB3 TRP 43 HB3 TRP 43 11.707 0.610 0.190 363 HD1 TRP 43 HD1 TRP 43 13.955 1.585 2.909 364 HE1 TRP 43 HE1 TRP 43 12.794 1.467 5.194 365 HE3 TRP 43 HE3 TRP 43 9.742 -1.036 1.578 366 HZ2 TRP 43 HZ2 TRP 43 10.311 0.490 6.269 367 HZ3 TRP 43 HZ3 TRP 43 7.997 -1.545 3.261 368 HH2 TRP 43 HH2 TRP 43 8.261 -0.766 5.607 369 H THR 44 H THR 44 13.421 -2.429 2.388 370 HA THR 44 HA THR 44 10.711 -3.527 2.368 371 HB THR 44 HB THR 44 11.226 -5.711 2.745 372 HG1 THR 44 HG1 THR 44 13.985 -5.146 2.990 373 HG21 THR 44 HG21 THR 44 13.452 -5.114 0.778 374 HG22 THR 44 HG22 THR 44 12.536 -6.628 0.992 375 HG23 THR 44 HG23 THR 44 11.726 -5.184 0.371 376 H GLY 45 H GLY 45 9.923 -4.165 4.318 377 HA2 GLY 45 HA2 GLY 45 11.255 -3.720 6.846 378 HA3 GLY 45 HA3 GLY 45 10.315 -2.320 6.362 379 H ARG 46 H ARG 46 8.634 -2.378 7.601 380 HA ARG 46 HA ARG 46 6.935 -4.830 7.899 381 HB2 ARG 46 HB2 ARG 46 8.350 -4.310 9.889 382 HB3 ARG 46 HB3 ARG 46 7.585 -2.729 10.015 383 HG2 ARG 46 HG2 ARG 46 5.382 -3.848 10.432 384 HG3 ARG 46 HG3 ARG 46 6.182 -5.419 10.226 385 HD2 ARG 46 HD2 ARG 46 5.957 -5.067 12.558 386 HD3 ARG 46 HD3 ARG 46 7.669 -4.902 12.145 387 HE ARG 46 HE ARG 46 6.134 -2.362 12.243 388 HH11 ARG 46 HH11 ARG 46 6.439 -0.966 13.718 389 HH12 ARG 46 HH12 ARG 46 7.406 -1.276 15.168 390 HH21 ARG 46 HH21 ARG 46 8.108 -4.524 14.202 391 HH22 ARG 46 HH22 ARG 46 8.368 -3.289 15.403 392 H LEU 47 H LEU 47 4.698 -4.512 7.919 393 HA LEU 47 HA LEU 47 3.732 -1.952 6.723 394 HB2 LEU 47 HB2 LEU 47 3.142 -4.146 5.638 395 HB3 LEU 47 HB3 LEU 47 2.428 -4.631 7.168 396 HG LEU 47 HG LEU 47 0.855 -2.545 6.874 397 HD11 LEU 47 HD11 LEU 47 0.382 -1.975 4.557 398 HD12 LEU 47 HD12 LEU 47 2.038 -1.535 4.976 399 HD13 LEU 47 HD13 LEU 47 1.731 -2.990 3.999 400 HD21 LEU 47 HD21 LEU 47 0.555 -4.985 5.112 401 HD22 LEU 47 HD22 LEU 47 0.109 -4.866 6.829 402 HD23 LEU 47 HD23 LEU 47 -0.740 -3.886 5.643 403 H ARG 48 H ARG 48 2.529 -0.526 7.873 404 HA ARG 48 HA ARG 48 0.771 -1.590 10.025 405 HB2 ARG 48 HB2 ARG 48 2.764 0.257 10.523 406 HB3 ARG 48 HB3 ARG 48 1.452 1.323 10.065 407 HG2 ARG 48 HG2 ARG 48 1.369 1.112 12.423 408 HG3 ARG 48 HG3 ARG 48 0.011 0.146 11.825 409 HD2 ARG 48 HD2 ARG 48 1.270 -1.914 12.135 410 HD3 ARG 48 HD3 ARG 48 2.753 -1.031 12.491 411 HE ARG 48 HE ARG 48 0.516 -1.564 14.300 412 HH11 ARG 48 HH11 ARG 48 0.755 -1.098 16.453 413 HH12 ARG 48 HH12 ARG 48 2.025 -0.036 16.979 414 HH21 ARG 48 HH21 ARG 48 3.343 0.545 13.858 415 HH22 ARG 48 HH22 ARG 48 3.436 0.845 15.571 416 H ILE 49 H ILE 49 -1.322 -1.077 9.845 417 HA ILE 49 HA ILE 49 -2.146 1.054 7.900 418 HB ILE 49 HB ILE 49 -3.629 -1.545 8.383 419 HG12 ILE 49 HG12 ILE 49 -2.070 -0.492 5.978 420 HG13 ILE 49 HG13 ILE 49 -1.710 -1.931 6.934 421 HG21 ILE 49 HG21 ILE 49 -5.267 -0.770 6.797 422 HG22 ILE 49 HG22 ILE 49 -5.128 0.441 8.052 423 HG23 ILE 49 HG23 ILE 49 -4.337 0.718 6.479 424 HD11 ILE 49 HD11 ILE 49 -4.025 -1.556 5.005 425 HD12 ILE 49 HD12 ILE 49 -2.649 -2.645 4.870 426 HD13 ILE 49 HD13 ILE 49 -3.870 -2.948 6.118 427 H THR 50 H THR 50 -3.299 2.603 8.781 428 HA THR 50 HA THR 50 -4.714 2.189 11.386 429 HB THR 50 HB THR 50 -3.992 4.330 12.201 430 HG1 THR 50 HG1 THR 50 -2.385 4.498 9.873 431 HG21 THR 50 HG21 THR 50 -2.411 2.384 12.586 432 HG22 THR 50 HG22 THR 50 -1.451 2.960 11.217 433 HG23 THR 50 HG23 THR 50 -1.661 3.988 12.649 434 H SER 51 H SER 51 -6.423 3.994 11.706 435 HA SER 51 HA SER 51 -7.171 5.459 9.275 436 HB2 SER 51 HB2 SER 51 -9.483 4.685 9.302 437 HB3 SER 51 HB3 SER 51 -8.355 3.369 8.957 438 HG SER 51 HG SER 51 -9.412 3.929 11.553 439 H LYS 52 H LYS 52 -7.804 7.366 9.639 440 HA LYS 52 HA LYS 52 -9.100 8.194 12.202 441 HB2 LYS 52 HB2 LYS 52 -6.992 9.356 11.481 442 HB3 LYS 52 HB3 LYS 52 -7.861 9.913 10.042 443 HG2 LYS 52 HG2 LYS 52 -9.623 10.782 11.854 444 HG3 LYS 52 HG3 LYS 52 -8.222 10.697 12.926 445 HD2 LYS 52 HD2 LYS 52 -8.423 12.172 10.281 446 HD3 LYS 52 HD3 LYS 52 -8.491 12.909 11.905 447 HE2 LYS 52 HE2 LYS 52 -6.197 12.380 12.321 448 HE3 LYS 52 HE3 LYS 52 -6.070 11.412 10.849 449 HZ1 LYS 52 HZ1 LYS 52 -5.179 13.766 10.757 450 HZ2 LYS 52 HZ2 LYS 52 -6.210 13.362 9.532 451 HZ3 LYS 52 HZ3 LYS 52 -6.715 14.303 10.778 452 H GLY 53 H GLY 53 -10.999 7.233 11.649 453 HA2 GLY 53 HA2 GLY 53 -13.259 7.341 11.073 454 HA3 GLY 53 HA3 GLY 53 -12.944 8.877 10.266 455 H LYS 54 H LYS 54 -13.727 8.694 8.252 456 HA LYS 54 HA LYS 54 -13.748 6.322 6.578 457 HB2 LYS 54 HB2 LYS 54 -15.330 8.311 6.497 458 HB3 LYS 54 HB3 LYS 54 -14.007 9.254 5.799 459 HG2 LYS 54 HG2 LYS 54 -13.989 7.727 3.827 460 HG3 LYS 54 HG3 LYS 54 -15.271 6.761 4.577 461 HD2 LYS 54 HD2 LYS 54 -16.787 8.678 4.512 462 HD3 LYS 54 HD3 LYS 54 -15.508 9.736 3.913 463 HE2 LYS 54 HE2 LYS 54 -16.553 7.304 2.389 464 HE3 LYS 54 HE3 LYS 54 -17.190 8.941 2.201 465 HZ1 LYS 54 HZ1 LYS 54 -15.563 8.617 0.513 466 HZ2 LYS 54 HZ2 LYS 54 -14.873 9.641 1.588 467 HZ3 LYS 54 HZ3 LYS 54 -14.422 8.069 1.537 468 H THR 55 H THR 55 -11.133 8.189 7.427 469 HA THR 55 HA THR 55 -9.711 7.508 4.902 470 HB THR 55 HB THR 55 -8.645 9.270 7.123 471 HG1 THR 55 HG1 THR 55 -9.636 11.033 6.154 472 HG21 THR 55 HG21 THR 55 -8.582 9.271 4.055 473 HG22 THR 55 HG22 THR 55 -7.594 10.345 5.093 474 HG23 THR 55 HG23 THR 55 -7.296 8.588 5.072 475 H ALA 56 H ALA 56 -8.460 5.808 4.858 476 HA ALA 56 HA ALA 56 -7.118 4.896 7.351 477 HB1 ALA 56 HB1 ALA 56 -7.589 3.380 4.786 478 HB2 ALA 56 HB2 ALA 56 -6.507 2.851 6.086 479 HB3 ALA 56 HB3 ALA 56 -8.229 3.050 6.401 480 H TYR 57 H TYR 57 -4.825 4.338 7.172 481 HA TYR 57 HA TYR 57 -3.311 5.952 5.199 482 HB2 TYR 57 HB2 TYR 57 -2.898 6.011 8.206 483 HB3 TYR 57 HB3 TYR 57 -1.851 6.744 7.004 484 HD1 TYR 57 HD1 TYR 57 -2.303 8.941 6.153 485 HD2 TYR 57 HD2 TYR 57 -5.269 6.905 8.539 486 HE1 TYR 57 HE1 TYR 57 -3.640 11.036 6.298 487 HE2 TYR 57 HE2 TYR 57 -6.644 8.953 8.572 488 HH TYR 57 HH TYR 57 -5.575 12.012 7.043 489 H ILE 58 H ILE 58 -2.143 4.452 4.168 490 HA ILE 58 HA ILE 58 -1.197 1.995 5.532 491 HB ILE 58 HB ILE 58 -0.204 2.977 2.849 492 HG12 ILE 58 HG12 ILE 58 -2.558 3.039 2.489 493 HG13 ILE 58 HG13 ILE 58 -1.855 1.661 1.668 494 HG21 ILE 58 HG21 ILE 58 -0.436 0.240 4.115 495 HG22 ILE 58 HG22 ILE 58 0.218 0.599 2.493 496 HG23 ILE 58 HG23 ILE 58 1.044 1.196 3.927 497 HD11 ILE 58 HD11 ILE 58 -2.733 0.134 3.378 498 HD12 ILE 58 HD12 ILE 58 -3.380 1.514 4.304 499 HD13 ILE 58 HD13 ILE 58 -4.016 1.152 2.691 500 H LYS 59 H LYS 59 0.418 2.280 6.975 501 HA LYS 59 HA LYS 59 2.586 4.271 6.333 502 HB2 LYS 59 HB2 LYS 59 1.676 3.452 9.110 503 HB3 LYS 59 HB3 LYS 59 2.928 4.625 8.677 504 HG2 LYS 59 HG2 LYS 59 0.985 5.778 7.296 505 HG3 LYS 59 HG3 LYS 59 -0.079 4.823 8.339 506 HD2 LYS 59 HD2 LYS 59 1.028 5.871 10.340 507 HD3 LYS 59 HD3 LYS 59 2.022 6.844 9.227 508 HE2 LYS 59 HE2 LYS 59 -0.191 7.639 8.178 509 HE3 LYS 59 HE3 LYS 59 -1.005 6.886 9.570 510 HZ1 LYS 59 HZ1 LYS 59 0.969 9.096 9.649 511 HZ2 LYS 59 HZ2 LYS 59 -0.638 9.138 10.091 512 HZ3 LYS 59 HZ3 LYS 59 0.359 8.295 11.000 513 H LEU 60 H LEU 60 4.527 3.573 6.013 514 HA LEU 60 HA LEU 60 5.094 0.677 6.493 515 HB2 LEU 60 HB2 LEU 60 6.260 2.704 4.560 516 HB3 LEU 60 HB3 LEU 60 6.812 1.035 4.725 517 HG LEU 60 HG LEU 60 3.971 1.812 3.910 518 HD11 LEU 60 HD11 LEU 60 6.336 0.896 2.242 519 HD12 LEU 60 HD12 LEU 60 4.673 1.121 1.648 520 HD13 LEU 60 HD13 LEU 60 5.601 2.517 2.219 521 HD21 LEU 60 HD21 LEU 60 4.113 -0.445 4.910 522 HD22 LEU 60 HD22 LEU 60 3.840 -0.553 3.168 523 HD23 LEU 60 HD23 LEU 60 5.463 -0.851 3.830 524 H GLU 61 H GLU 61 6.730 -0.005 7.703 525 HA GLU 61 HA GLU 61 8.170 2.047 9.335 526 HB2 GLU 61 HB2 GLU 61 6.903 -0.590 10.132 527 HB3 GLU 61 HB3 GLU 61 7.811 0.476 11.204 528 HG2 GLU 61 HG2 GLU 61 6.112 2.256 10.863 529 HG3 GLU 61 HG3 GLU 61 5.174 1.156 9.841 530 H ASP 62 H ASP 62 10.286 1.530 10.148 531 HA ASP 62 HA ASP 62 11.884 -0.234 8.563 532 HB2 ASP 62 HB2 ASP 62 12.760 1.828 9.476 533 HB3 ASP 62 HB3 ASP 62 12.345 1.339 11.122 534 H LYS 63 H LYS 63 12.625 -2.245 8.970 535 HA LYS 63 HA LYS 63 10.999 -3.980 10.534 536 HB2 LYS 63 HB2 LYS 63 12.714 -4.221 8.367 537 HB3 LYS 63 HB3 LYS 63 13.633 -5.041 9.615 538 HG2 LYS 63 HG2 LYS 63 11.689 -6.509 10.097 539 HG3 LYS 63 HG3 LYS 63 10.727 -5.659 8.883 540 HD2 LYS 63 HD2 LYS 63 13.270 -7.250 8.324 541 HD3 LYS 63 HD3 LYS 63 11.615 -7.823 8.064 542 HE2 LYS 63 HE2 LYS 63 11.218 -5.989 6.444 543 HE3 LYS 63 HE3 LYS 63 12.887 -5.425 6.668 544 HZ1 LYS 63 HZ1 LYS 63 13.598 -7.660 5.858 545 HZ2 LYS 63 HZ2 LYS 63 12.024 -8.010 5.518 546 HZ3 LYS 63 HZ3 LYS 63 12.797 -6.786 4.730 547 H VAL 64 H VAL 64 13.518 -2.100 11.670 548 HA VAL 64 HA VAL 64 14.290 -3.980 13.861 549 HB VAL 64 HB VAL 64 15.946 -1.598 13.010 550 HG11 VAL 64 HG11 VAL 64 16.657 -4.322 14.164 551 HG12 VAL 64 HG12 VAL 64 17.783 -2.982 13.852 552 HG13 VAL 64 HG13 VAL 64 16.524 -2.801 15.078 553 HG21 VAL 64 HG21 VAL 64 15.671 -2.724 10.886 554 HG22 VAL 64 HG22 VAL 64 17.283 -3.064 11.511 555 HG23 VAL 64 HG23 VAL 64 16.015 -4.309 11.629 556 H SER 65 H SER 65 13.468 -0.600 13.085 557 HA SER 65 HA SER 65 13.162 -0.087 16.020 558 HB2 SER 65 HB2 SER 65 14.216 1.744 13.837 559 HB3 SER 65 HB3 SER 65 13.972 2.208 15.532 560 HG SER 65 HG SER 65 16.142 1.569 15.090 561 H GLY 66 H GLY 66 11.261 -0.313 13.279 562 HA2 GLY 66 HA2 GLY 66 9.078 0.235 12.933 563 HA3 GLY 66 HA3 GLY 66 9.010 0.943 14.546 564 H GLU 67 H GLU 67 11.451 2.389 12.610 565 HA GLU 67 HA GLU 67 10.152 4.960 12.730 566 HB2 GLU 67 HB2 GLU 67 12.698 4.106 11.295 567 HB3 GLU 67 HB3 GLU 67 12.159 5.774 11.539 568 HG2 GLU 67 HG2 GLU 67 12.204 5.377 14.026 569 HG3 GLU 67 HG3 GLU 67 12.898 3.782 13.724 570 H LEU 68 H LEU 68 9.394 6.332 11.062 571 HA LEU 68 HA LEU 68 7.886 4.897 9.110 572 HB2 LEU 68 HB2 LEU 68 7.154 6.968 10.356 573 HB3 LEU 68 HB3 LEU 68 8.271 7.900 9.362 574 HG LEU 68 HG LEU 68 6.979 7.031 7.310 575 HD11 LEU 68 HD11 LEU 68 4.951 6.284 9.469 576 HD12 LEU 68 HD12 LEU 68 4.659 6.297 7.717 577 HD13 LEU 68 HD13 LEU 68 5.791 5.138 8.408 578 HD21 LEU 68 HD21 LEU 68 6.703 9.311 8.201 579 HD22 LEU 68 HD22 LEU 68 5.177 8.663 7.583 580 HD23 LEU 68 HD23 LEU 68 5.466 8.725 9.337 581 H PHE 69 H PHE 69 8.407 4.256 7.171 582 HA PHE 69 HA PHE 69 10.597 5.433 5.543 583 HB2 PHE 69 HB2 PHE 69 10.526 3.079 5.536 584 HB3 PHE 69 HB3 PHE 69 8.782 3.029 5.331 585 HD1 PHE 69 HD1 PHE 69 11.615 4.697 3.444 586 HD2 PHE 69 HD2 PHE 69 8.179 2.108 3.291 587 HE1 PHE 69 HE1 PHE 69 11.848 4.522 0.996 588 HE2 PHE 69 HE2 PHE 69 8.400 1.917 0.845 589 HZ PHE 69 HZ PHE 69 10.212 3.176 -0.338 590 H ALA 70 H ALA 70 7.057 4.873 5.227 591 HA ALA 70 HA ALA 70 6.664 7.423 3.856 592 HB1 ALA 70 HB1 ALA 70 5.731 6.405 1.807 593 HB2 ALA 70 HB2 ALA 70 7.437 5.973 1.989 594 HB3 ALA 70 HB3 ALA 70 6.175 4.787 2.386 595 H GLN 71 H GLN 71 4.362 7.849 3.437 596 HA GLN 71 HA GLN 71 2.440 6.021 4.670 597 HB2 GLN 71 HB2 GLN 71 1.318 7.779 5.969 598 HB3 GLN 71 HB3 GLN 71 2.924 7.357 6.553 599 HG2 GLN 71 HG2 GLN 71 3.836 9.413 5.420 600 HG3 GLN 71 HG3 GLN 71 2.186 9.865 4.984 601 HE21 GLN 71 HE21 GLN 71 3.151 11.612 8.168 602 HE22 GLN 71 HE22 GLN 71 3.807 11.579 6.539 603 H ALA 72 H ALA 72 0.520 5.903 3.678 604 HA ALA 72 HA ALA 72 -0.068 7.778 1.417 605 HB1 ALA 72 HB1 ALA 72 -0.458 4.782 1.655 606 HB2 ALA 72 HB2 ALA 72 -1.136 5.775 0.362 607 HB3 ALA 72 HB3 ALA 72 0.613 5.664 0.538 608 HA PRO 73 HA PRO 73 -3.976 8.041 3.856 609 HB2 PRO 73 HB2 PRO 73 -4.388 10.511 2.226 610 HB3 PRO 73 HB3 PRO 73 -4.489 10.294 3.991 611 HG2 PRO 73 HG2 PRO 73 -2.379 11.585 2.831 612 HG3 PRO 73 HG3 PRO 73 -2.124 10.485 4.224 613 HD2 PRO 73 HD2 PRO 73 -1.784 9.868 1.270 614 HD3 PRO 73 HD3 PRO 73 -0.664 9.546 2.630 615 H VAL 74 H VAL 74 -5.870 7.070 3.245 616 HA VAL 74 HA VAL 74 -6.842 7.289 0.428 617 HB VAL 74 HB VAL 74 -5.815 5.157 0.722 618 HG11 VAL 74 HG11 VAL 74 -7.779 4.409 2.858 619 HG12 VAL 74 HG12 VAL 74 -6.634 3.328 2.049 620 HG13 VAL 74 HG13 VAL 74 -6.019 4.635 3.060 621 HG21 VAL 74 HG21 VAL 74 -7.615 3.758 -0.148 622 HG22 VAL 74 HG22 VAL 74 -8.828 4.751 0.646 623 HG23 VAL 74 HG23 VAL 74 -7.888 5.407 -0.713 624 H GLU 75 H GLU 75 -8.917 7.889 0.203 625 HA GLU 75 HA GLU 75 -10.716 7.606 2.559 626 HB2 GLU 75 HB2 GLU 75 -9.910 9.989 1.643 627 HB3 GLU 75 HB3 GLU 75 -11.201 9.706 0.473 628 HG2 GLU 75 HG2 GLU 75 -12.581 9.112 2.710 629 HG3 GLU 75 HG3 GLU 75 -11.332 10.074 3.473 630 H GLN 76 H GLN 76 -10.172 6.126 -0.277 631 HA GLN 76 HA GLN 76 -12.807 5.030 -0.382 632 HB2 GLN 76 HB2 GLN 76 -13.428 5.530 -2.602 633 HB3 GLN 76 HB3 GLN 76 -13.069 7.063 -1.830 634 HG2 GLN 76 HG2 GLN 76 -11.322 5.605 -3.855 635 HG3 GLN 76 HG3 GLN 76 -12.326 7.005 -4.151 636 HE21 GLN 76 HE21 GLN 76 -8.614 7.539 -2.560 637 HE22 GLN 76 HE22 GLN 76 -9.324 5.909 -2.611 638 H TYR 77 H TYR 77 -12.754 2.932 -1.050 639 HA TYR 77 HA TYR 77 -10.395 1.950 -2.554 640 HB2 TYR 77 HB2 TYR 77 -10.229 1.454 -0.114 641 HB3 TYR 77 HB3 TYR 77 -11.695 0.480 -0.247 642 HD1 TYR 77 HD1 TYR 77 -8.662 0.775 -2.450 643 HD2 TYR 77 HD2 TYR 77 -10.916 -1.764 0.203 644 HE1 TYR 77 HE1 TYR 77 -7.101 -1.032 -2.891 645 HE2 TYR 77 HE2 TYR 77 -9.362 -3.637 -0.311 646 HH TYR 77 HH TYR 77 -6.572 -3.254 -2.517 647 HA PRO 78 HA PRO 78 -9.823 0.453 -4.300 648 HB2 PRO 78 HB2 PRO 78 -11.258 0.691 -6.924 649 HB3 PRO 78 HB3 PRO 78 -9.814 -0.282 -6.499 650 HG2 PRO 78 HG2 PRO 78 -12.221 -1.486 -6.708 651 HG3 PRO 78 HG3 PRO 78 -11.158 -1.880 -5.312 652 HD2 PRO 78 HD2 PRO 78 -13.474 0.088 -5.404 653 HD3 PRO 78 HD3 PRO 78 -13.151 -1.204 -4.209 654 H GLY 79 H GLY 79 -8.489 2.130 -5.235 655 HA2 GLY 79 HA2 GLY 79 -9.593 4.549 -6.383 656 HA3 GLY 79 HA3 GLY 79 -9.101 4.782 -4.705 657 H ILE 80 H ILE 80 -7.656 6.369 -5.762 658 HA ILE 80 HA ILE 80 -5.387 5.399 -7.333 659 HB ILE 80 HB ILE 80 -6.394 7.600 -7.756 660 HG12 ILE 80 HG12 ILE 80 -4.407 8.993 -7.889 661 HG13 ILE 80 HG13 ILE 80 -3.548 7.970 -6.746 662 HG21 ILE 80 HG21 ILE 80 -6.072 9.501 -6.238 663 HG22 ILE 80 HG22 ILE 80 -7.035 8.256 -5.445 664 HG23 ILE 80 HG23 ILE 80 -5.316 8.457 -5.028 665 HD11 ILE 80 HD11 ILE 80 -3.513 6.125 -8.371 666 HD12 ILE 80 HD12 ILE 80 -4.542 7.061 -9.485 667 HD13 ILE 80 HD13 ILE 80 -2.890 7.599 -9.122 668 H ALA 81 H ALA 81 -6.135 5.857 -3.960 669 HA ALA 81 HA ALA 81 -3.339 5.930 -3.202 670 HB1 ALA 81 HB1 ALA 81 -5.875 5.946 -1.527 671 HB2 ALA 81 HB2 ALA 81 -4.216 6.164 -0.904 672 HB3 ALA 81 HB3 ALA 81 -4.935 7.368 -2.007 673 H VAL 82 H VAL 82 -5.502 3.438 -3.820 674 HA VAL 82 HA VAL 82 -3.441 1.516 -3.255 675 HB VAL 82 HB VAL 82 -4.171 1.512 -1.081 676 HG11 VAL 82 HG11 VAL 82 -6.866 1.897 -1.987 677 HG12 VAL 82 HG12 VAL 82 -6.703 0.616 -0.756 678 HG13 VAL 82 HG13 VAL 82 -6.072 2.228 -0.448 679 HG21 VAL 82 HG21 VAL 82 -3.471 -0.535 -1.926 680 HG22 VAL 82 HG22 VAL 82 -4.787 -0.817 -0.773 681 HG23 VAL 82 HG23 VAL 82 -5.065 -0.962 -2.521 682 H GLU 83 H GLU 83 -3.478 0.537 -5.112 683 HA GLU 83 HA GLU 83 -6.020 -0.339 -6.436 684 HB2 GLU 83 HB2 GLU 83 -4.190 1.625 -7.325 685 HB3 GLU 83 HB3 GLU 83 -3.736 0.185 -8.225 686 HG2 GLU 83 HG2 GLU 83 -6.552 1.350 -8.091 687 HG3 GLU 83 HG3 GLU 83 -5.379 1.685 -9.361 688 H THR 84 H THR 84 -5.913 -2.280 -7.692 689 HA THR 84 HA THR 84 -3.660 -4.122 -6.948 690 HB THR 84 HB THR 84 -6.149 -5.055 -8.253 691 HG1 THR 84 HG1 THR 84 -7.098 -5.372 -6.241 692 HG21 THR 84 HG21 THR 84 -4.279 -6.268 -6.202 693 HG22 THR 84 HG22 THR 84 -5.622 -7.090 -7.044 694 HG23 THR 84 HG23 THR 84 -4.209 -6.548 -7.959 695 H VAL 85 H VAL 85 -2.352 -3.218 -8.306 696 HA VAL 85 HA VAL 85 -1.265 -2.914 -10.450 697 HB VAL 85 HB VAL 85 -0.362 -5.338 -10.762 698 HG11 VAL 85 HG11 VAL 85 -0.112 -3.802 -8.127 699 HG12 VAL 85 HG12 VAL 85 1.055 -4.968 -8.757 700 HG13 VAL 85 HG13 VAL 85 0.776 -3.460 -9.624 701 HG21 VAL 85 HG21 VAL 85 -2.311 -6.433 -9.455 702 HG22 VAL 85 HG22 VAL 85 -0.673 -6.873 -8.984 703 HG23 VAL 85 HG23 VAL 85 -1.600 -5.721 -8.011 704 H THR 86 H THR 86 -2.908 -5.977 -11.020 705 HA THR 86 HA THR 86 -4.576 -4.752 -13.055 706 HB THR 86 HB THR 86 -4.414 -6.882 -14.498 707 HG1 THR 86 HG1 THR 86 -2.486 -7.954 -14.433 708 HG21 THR 86 HG21 THR 86 -3.515 -4.611 -15.168 709 HG22 THR 86 HG22 THR 86 -1.971 -5.079 -14.458 710 HG23 THR 86 HG23 THR 86 -2.600 -5.973 -15.863 711 H ASP 87 H ASP 87 -3.751 -7.859 -11.434 712 HA ASP 87 HA ASP 87 -6.522 -7.956 -10.399 713 HB2 ASP 87 HB2 ASP 87 -5.973 -9.173 -12.832 714 HB3 ASP 87 HB3 ASP 87 -5.766 -10.487 -11.698 715 H SER 88 H SER 88 -3.759 -10.360 -10.678 716 HA SER 88 HA SER 88 -4.115 -11.501 -8.201 717 HB2 SER 88 HB3 SER 88 -2.163 -12.079 -9.688 718 HB3 SER 88 HB2 SER 88 -1.264 -10.771 -8.922 719 HG SER 88 HG SER 88 -2.289 -13.161 -7.935 720 H SER 89 H SER 89 -4.582 -10.630 -6.363 721 HA SER 89 HA SER 89 -3.302 -8.198 -5.394 722 HB2 SER 89 HB2 SER 89 -4.997 -8.379 -3.625 723 HB3 SER 89 HB3 SER 89 -5.575 -8.341 -5.308 724 HG SER 89 HG SER 89 -6.718 -9.891 -4.128 725 H ARG 90 H ARG 90 -1.748 -10.647 -5.766 726 HA ARG 90 HA ARG 90 -0.244 -11.028 -3.289 727 HB2 ARG 90 HB2 ARG 90 -0.095 -12.444 -5.374 728 HB3 ARG 90 HB3 ARG 90 0.565 -11.060 -6.240 729 HG2 ARG 90 HG2 ARG 90 2.523 -11.035 -4.687 730 HG3 ARG 90 HG3 ARG 90 1.876 -12.457 -3.860 731 HD2 ARG 90 HD2 ARG 90 2.654 -12.318 -6.813 732 HD3 ARG 90 HD3 ARG 90 3.688 -12.924 -5.531 733 HE ARG 90 HE ARG 90 2.344 -14.852 -5.275 734 HH11 ARG 90 HH11 ARG 90 1.016 -16.491 -6.214 735 HH12 ARG 90 HH12 ARG 90 0.056 -16.000 -7.628 736 HH21 ARG 90 HH21 ARG 90 1.009 -12.888 -7.915 737 HH22 ARG 90 HH22 ARG 90 0.060 -14.285 -8.452 738 H TYR 91 H TYR 91 -0.529 -8.554 -5.777 739 HA TYR 91 HA TYR 91 1.450 -6.814 -4.368 740 HB2 TYR 91 HB2 TYR 91 0.763 -6.658 -7.295 741 HB3 TYR 91 HB3 TYR 91 2.100 -5.886 -6.479 742 HD1 TYR 91 HD1 TYR 91 0.980 -8.679 -8.389 743 HD2 TYR 91 HD2 TYR 91 3.989 -7.408 -5.574 744 HE1 TYR 91 HE1 TYR 91 2.442 -10.500 -9.183 745 HE2 TYR 91 HE2 TYR 91 5.474 -9.290 -6.332 746 HH TYR 91 HH TYR 91 4.447 -11.616 -8.839 747 H PHE 92 H PHE 92 1.112 -4.539 -4.666 748 HA PHE 92 HA PHE 92 -1.510 -3.591 -5.649 749 HB2 PHE 92 HB2 PHE 92 -0.484 -2.873 -2.874 750 HB3 PHE 92 HB3 PHE 92 -1.904 -2.188 -3.656 751 HD1 PHE 92 HD1 PHE 92 -3.892 -3.672 -4.211 752 HD2 PHE 92 HD2 PHE 92 -0.595 -4.987 -1.760 753 HE1 PHE 92 HE1 PHE 92 -5.257 -5.582 -3.403 754 HE2 PHE 92 HE2 PHE 92 -1.976 -6.855 -0.917 755 HZ PHE 92 HZ PHE 92 -4.285 -7.196 -1.767 756 H VAL 93 H VAL 93 -1.517 -1.117 -5.614 757 HA VAL 93 HA VAL 93 1.165 0.157 -5.545 758 HB VAL 93 HB VAL 93 -0.936 0.772 -7.663 759 HG11 VAL 93 HG11 VAL 93 0.225 2.825 -6.967 760 HG12 VAL 93 HG12 VAL 93 1.800 2.010 -7.126 761 HG13 VAL 93 HG13 VAL 93 0.798 2.320 -8.549 762 HG21 VAL 93 HG21 VAL 93 0.271 -1.265 -8.262 763 HG22 VAL 93 HG22 VAL 93 0.836 0.069 -9.271 764 HG23 VAL 93 HG23 VAL 93 1.830 -0.488 -7.920 765 H ILE 94 H ILE 94 1.182 1.952 -4.278 766 HA ILE 94 HA ILE 94 -1.425 3.167 -3.508 767 HB ILE 94 HB ILE 94 -0.695 3.441 -1.217 768 HG12 ILE 94 HG12 ILE 94 1.742 1.700 -1.861 769 HG13 ILE 94 HG13 ILE 94 1.823 3.455 -1.730 770 HG21 ILE 94 HG21 ILE 94 -0.425 0.504 -2.036 771 HG22 ILE 94 HG22 ILE 94 -0.920 1.135 -0.455 772 HG23 ILE 94 HG23 ILE 94 -1.941 1.389 -1.843 773 HD11 ILE 94 HD11 ILE 94 2.513 2.420 0.364 774 HD12 ILE 94 HD12 ILE 94 1.025 3.366 0.581 775 HD13 ILE 94 HD13 ILE 94 0.940 1.611 0.510 776 H ARG 95 H ARG 95 -1.408 5.355 -2.989 777 HA ARG 95 HA ARG 95 0.912 6.904 -4.066 778 HB2 ARG 95 HB2 ARG 95 -0.444 8.726 -4.479 779 HB3 ARG 95 HB3 ARG 95 -1.366 7.325 -4.993 780 HG2 ARG 95 HG2 ARG 95 -3.049 8.413 -3.936 781 HG3 ARG 95 HG3 ARG 95 -2.404 7.560 -2.528 782 HD2 ARG 95 HD2 ARG 95 -1.037 9.583 -1.988 783 HD3 ARG 95 HD3 ARG 95 -1.883 10.424 -3.296 784 HE ARG 95 HE ARG 95 -3.252 9.137 -0.923 785 HH11 ARG 95 HH11 ARG 95 -5.014 10.010 -0.133 786 HH12 ARG 95 HH12 ARG 95 -5.579 11.585 -0.661 787 HH21 ARG 95 HH21 ARG 95 -3.076 11.970 -2.998 788 HH22 ARG 95 HH22 ARG 95 -4.504 12.663 -2.281 789 H ILE 96 H ILE 96 2.392 7.427 -2.682 790 HA ILE 96 HA ILE 96 1.728 7.871 0.195 791 HB ILE 96 HB ILE 96 4.152 7.709 0.581 792 HG12 ILE 96 HG12 ILE 96 4.480 6.544 -2.200 793 HG13 ILE 96 HG13 ILE 96 4.706 8.276 -1.917 794 HG21 ILE 96 HG21 ILE 96 2.792 5.318 -0.726 795 HG22 ILE 96 HG22 ILE 96 4.273 5.209 0.237 796 HG23 ILE 96 HG23 ILE 96 2.784 5.771 0.992 797 HD11 ILE 96 HD11 ILE 96 6.259 6.077 -0.548 798 HD12 ILE 96 HD12 ILE 96 6.833 7.172 -1.828 799 HD13 ILE 96 HD13 ILE 96 6.407 7.821 -0.226 800 H GLN 97 H GLN 97 2.702 9.655 1.315 801 HA GLN 97 HA GLN 97 3.275 12.082 -0.318 802 HB2 GLN 97 HB2 GLN 97 2.961 11.563 2.658 803 HB3 GLN 97 HB3 GLN 97 3.603 13.078 2.029 804 HG2 GLN 97 HG2 GLN 97 0.877 11.941 1.281 805 HG3 GLN 97 HG3 GLN 97 1.165 13.158 2.538 806 HE21 GLN 97 HE21 GLN 97 1.975 15.755 0.124 807 HE22 GLN 97 HE22 GLN 97 2.465 15.185 1.716 808 H ASP 98 H ASP 98 5.317 13.010 -0.489 809 HA ASP 98 HA ASP 98 7.619 11.403 0.457 810 HB2 ASP 98 HB2 ASP 98 7.430 12.379 -1.871 811 HB3 ASP 98 HB3 ASP 98 7.603 13.970 -1.126 812 H GLY 99 H GLY 99 5.667 13.629 1.872 813 HA2 GLY 99 HA2 GLY 99 5.826 14.506 4.018 814 HA3 GLY 99 HA3 GLY 99 7.539 14.096 4.067 815 H THR 100 H THR 100 6.888 15.920 1.292 816 HA THR 100 HA THR 100 7.738 18.483 2.593 817 HB THR 100 HB THR 100 9.064 18.952 0.601 818 HG1 THR 100 HG1 THR 100 9.312 17.347 -0.942 819 HG21 THR 100 HG21 THR 100 9.729 16.149 1.591 820 HG22 THR 100 HG22 THR 100 10.836 17.341 0.881 821 HG23 THR 100 HG23 THR 100 10.116 17.646 2.475 822 H GLY 101 H GLY 101 4.999 17.410 1.599 823 HA2 GLY 101 HA2 GLY 101 3.079 18.661 1.004 824 HA3 GLY 101 HA3 GLY 101 4.085 19.901 0.256 825 H ARG 102 H ARG 102 4.911 16.655 -0.570 826 HA ARG 102 HA ARG 102 3.381 16.691 -3.130 827 HB2 ARG 102 HB2 ARG 102 5.311 16.375 -4.422 828 HB3 ARG 102 HB3 ARG 102 5.693 17.701 -3.299 829 HG2 ARG 102 HG2 ARG 102 6.900 16.007 -1.876 830 HG3 ARG 102 HG3 ARG 102 6.675 14.828 -3.184 831 HD2 ARG 102 HD2 ARG 102 7.856 16.314 -4.756 832 HD3 ARG 102 HD3 ARG 102 8.074 17.520 -3.470 833 HE ARG 102 HE ARG 102 9.195 15.116 -2.496 834 HH11 ARG 102 HH11 ARG 102 11.207 14.643 -2.484 835 HH12 ARG 102 HH12 ARG 102 12.383 15.417 -3.553 836 HH21 ARG 102 HH21 ARG 102 9.960 17.359 -5.094 837 HH22 ARG 102 HH22 ARG 102 11.653 16.948 -5.030 838 H SER 103 H SER 103 3.416 14.658 -4.306 839 HA SER 103 HA SER 103 3.479 12.306 -2.484 840 HB2 SER 103 HB2 SER 103 1.534 11.451 -3.741 841 HB3 SER 103 HB3 SER 103 1.201 13.006 -2.964 842 HG SER 103 HG SER 103 0.453 12.977 -5.127 843 H ALA 104 H ALA 104 3.614 10.213 -3.479 844 HA ALA 104 HA ALA 104 4.758 9.962 -6.188 845 HB1 ALA 104 HB1 ALA 104 6.198 8.928 -3.708 846 HB2 ALA 104 HB2 ALA 104 6.643 8.580 -5.391 847 HB3 ALA 104 HB3 ALA 104 6.758 10.239 -4.771 848 H PHE 105 H PHE 105 4.474 7.889 -7.114 849 HA PHE 105 HA PHE 105 2.630 6.078 -5.630 850 HB2 PHE 105 HB2 PHE 105 3.391 5.947 -8.550 851 HB3 PHE 105 HB3 PHE 105 2.095 5.086 -7.730 852 HD1 PHE 105 HD1 PHE 105 3.016 8.075 -9.516 853 HD2 PHE 105 HD2 PHE 105 0.186 6.526 -6.648 854 HE1 PHE 105 HE1 PHE 105 1.527 10.005 -9.946 855 HE2 PHE 105 HE2 PHE 105 -1.316 8.450 -7.113 856 HZ PHE 105 HZ PHE 105 -0.660 10.188 -8.753 857 H ILE 106 H ILE 106 3.316 4.239 -4.780 858 HA ILE 106 HA ILE 106 5.653 2.882 -6.021 859 HB ILE 106 HB ILE 106 6.468 1.921 -3.972 860 HG12 ILE 106 HG12 ILE 106 4.227 3.521 -2.616 861 HG13 ILE 106 HG13 ILE 106 4.463 1.769 -2.620 862 HG21 ILE 106 HG21 ILE 106 7.255 4.204 -4.811 863 HG22 ILE 106 HG22 ILE 106 6.226 4.948 -3.580 864 HG23 ILE 106 HG23 ILE 106 7.567 3.883 -3.104 865 HD11 ILE 106 HD11 ILE 106 6.116 3.840 -1.156 866 HD12 ILE 106 HD12 ILE 106 5.138 2.523 -0.485 867 HD13 ILE 106 HD13 ILE 106 6.637 2.161 -1.375 868 H GLY 107 H GLY 107 5.458 0.846 -6.446 869 HA2 GLY 107 HA2 GLY 107 2.982 -0.674 -6.080 870 HA3 GLY 107 HA3 GLY 107 4.486 -1.253 -6.792 871 H ILE 108 H ILE 108 2.975 -2.640 -4.847 872 HA ILE 108 HA ILE 108 5.021 -2.830 -2.698 873 HB ILE 108 HB ILE 108 2.065 -3.447 -2.255 874 HG12 ILE 108 HG12 ILE 108 3.569 -0.918 -1.436 875 HG13 ILE 108 HG13 ILE 108 2.232 -1.024 -2.591 876 HG21 ILE 108 HG21 ILE 108 4.473 -3.143 -0.407 877 HG22 ILE 108 HG22 ILE 108 2.821 -3.538 0.137 878 HG23 ILE 108 HG23 ILE 108 3.693 -4.682 -0.844 879 HD11 ILE 108 HD11 ILE 108 2.091 -1.469 0.408 880 HD12 ILE 108 HD12 ILE 108 1.270 -0.265 -0.577 881 HD13 ILE 108 HD13 ILE 108 0.789 -1.959 -0.711 882 H GLY 109 H GLY 109 5.665 -4.960 -2.259 883 HA2 GLY 109 HA2 GLY 109 4.077 -7.244 -3.323 884 HA3 GLY 109 HA3 GLY 109 5.827 -7.227 -3.559 885 H PHE 110 H PHE 110 3.750 -8.798 -1.866 886 HA PHE 110 HA PHE 110 4.856 -8.416 0.865 887 HB2 PHE 110 HB2 PHE 110 2.471 -9.798 -0.310 888 HB3 PHE 110 HB3 PHE 110 2.994 -10.207 1.300 889 HD1 PHE 110 HD1 PHE 110 2.620 -8.881 3.186 890 HD2 PHE 110 HD2 PHE 110 1.862 -7.263 -0.740 891 HE1 PHE 110 HE1 PHE 110 1.400 -6.994 4.206 892 HE2 PHE 110 HE2 PHE 110 0.743 -5.296 0.298 893 HZ PHE 110 HZ PHE 110 0.533 -5.149 2.761 894 H THR 111 H THR 111 5.257 -10.164 2.236 895 HA THR 111 HA THR 111 7.122 -12.111 1.223 896 HB THR 111 HB THR 111 7.097 -10.879 3.427 897 HG1 THR 111 HG1 THR 111 8.559 -12.486 3.173 898 HG21 THR 111 HG21 THR 111 4.789 -11.397 4.148 899 HG22 THR 111 HG22 THR 111 5.225 -13.116 4.293 900 HG23 THR 111 HG23 THR 111 5.994 -11.913 5.337 901 H ASP 112 H ASP 112 3.689 -12.132 1.824 902 HA ASP 112 HA ASP 112 3.494 -14.873 0.741 903 HB2 ASP 112 HB2 ASP 112 3.415 -14.867 3.324 904 HB3 ASP 112 HB3 ASP 112 1.857 -14.046 3.163 905 H ARG 113 H ARG 113 1.670 -15.286 -0.474 906 HA ARG 113 HA ARG 113 0.244 -13.148 -1.723 907 HB2 ARG 113 HB2 ARG 113 0.747 -15.742 -2.322 908 HB3 ARG 113 HB3 ARG 113 -0.855 -15.968 -1.651 909 HG2 ARG 113 HG2 ARG 113 -0.033 -14.300 -4.056 910 HG3 ARG 113 HG3 ARG 113 -0.948 -15.806 -4.054 911 HD2 ARG 113 HD2 ARG 113 -2.772 -14.572 -2.779 912 HD3 ARG 113 HD3 ARG 113 -1.871 -13.076 -3.110 913 HE ARG 113 HE ARG 113 -2.332 -14.515 -5.568 914 HH11 ARG 113 HH11 ARG 113 -3.930 -13.874 -7.007 915 HH12 ARG 113 HH12 ARG 113 -5.311 -12.990 -6.388 916 HH21 ARG 113 HH21 ARG 113 -4.005 -12.564 -3.231 917 HH22 ARG 113 HH22 ARG 113 -5.142 -11.935 -4.383 918 H GLY 114 H GLY 114 -0.568 -15.177 1.071 919 HA2 GLY 114 HA2 GLY 114 -3.324 -14.254 1.362 920 HA3 GLY 114 HA3 GLY 114 -2.365 -15.189 2.515 921 H ASP 115 H ASP 115 -0.143 -13.235 2.687 922 HA ASP 115 HA ASP 115 -1.245 -11.368 4.630 923 HB2 ASP 115 HB2 ASP 115 1.491 -11.582 3.352 924 HB3 ASP 115 HB3 ASP 115 1.050 -10.345 4.524 925 H ALA 116 H ALA 116 -0.324 -11.082 1.196 926 HA ALA 116 HA ALA 116 -1.020 -8.291 1.029 927 HB1 ALA 116 HB1 ALA 116 -0.951 -10.438 -1.140 928 HB2 ALA 116 HB2 ALA 116 -0.874 -8.675 -1.387 929 HB3 ALA 116 HB3 ALA 116 0.443 -9.510 -0.588 930 H PHE 117 H PHE 117 -2.933 -11.311 0.306 931 HA PHE 117 HA PHE 117 -5.282 -9.906 -0.462 932 HB2 PHE 117 HB2 PHE 117 -4.883 -12.353 -0.756 933 HB3 PHE 117 HB3 PHE 117 -5.155 -12.579 0.974 934 HD1 PHE 117 HD1 PHE 117 -7.414 -12.582 1.878 935 HD2 PHE 117 HD2 PHE 117 -6.730 -11.427 -2.226 936 HE1 PHE 117 HE1 PHE 117 -9.857 -12.620 1.451 937 HE2 PHE 117 HE2 PHE 117 -9.153 -11.394 -2.621 938 HZ PHE 117 HZ PHE 117 -10.741 -12.003 -0.793 939 H ASP 118 H ASP 118 -3.990 -10.523 2.786 940 HA ASP 118 HA ASP 118 -6.376 -9.588 4.156 941 HB2 ASP 118 HB2 ASP 118 -4.672 -11.274 5.012 942 HB3 ASP 118 HB3 ASP 118 -3.577 -9.912 5.263 943 H PHE 119 H PHE 119 -3.389 -8.049 2.938 944 HA PHE 119 HA PHE 119 -3.798 -5.494 4.156 945 HB2 PHE 119 HB2 PHE 119 -1.709 -5.896 3.168 946 HB3 PHE 119 HB3 PHE 119 -2.388 -6.409 1.648 947 HD1 PHE 119 HD1 PHE 119 -1.079 -3.584 3.449 948 HD2 PHE 119 HD2 PHE 119 -3.500 -4.727 0.096 949 HE1 PHE 119 HE1 PHE 119 -0.828 -1.329 2.497 950 HE2 PHE 119 HE2 PHE 119 -3.162 -2.495 -0.912 951 HZ PHE 119 HZ PHE 119 -1.867 -0.765 0.311 952 H ASN 120 H ASN 120 -5.087 -6.959 1.161 953 HA ASN 120 HA ASN 120 -6.828 -4.778 0.448 954 HB2 ASN 120 HB2 ASN 120 -6.582 -6.220 -1.290 955 HB3 ASN 120 HB3 ASN 120 -6.509 -7.652 -0.272 956 HD21 ASN 120 HD21 ASN 120 -9.826 -8.520 -0.804 957 HD22 ASN 120 HD22 ASN 120 -8.275 -8.933 -0.090 958 H VAL 121 H VAL 121 -7.608 -7.784 2.357 959 HA VAL 121 HA VAL 121 -10.268 -6.966 2.804 960 HB VAL 121 HB VAL 121 -8.527 -8.908 4.355 961 HG11 VAL 121 HG11 VAL 121 -10.294 -8.258 5.915 962 HG12 VAL 121 HG12 VAL 121 -11.529 -8.455 4.649 963 HG13 VAL 121 HG13 VAL 121 -10.641 -9.862 5.277 964 HG21 VAL 121 HG21 VAL 121 -9.107 -9.523 1.999 965 HG22 VAL 121 HG22 VAL 121 -9.868 -10.602 3.165 966 HG23 VAL 121 HG23 VAL 121 -10.824 -9.326 2.380 967 H SER 122 H SER 122 -7.395 -6.189 4.723 968 HA SER 122 HA SER 122 -8.609 -4.945 6.965 969 HB2 SER 122 HB2 SER 122 -6.067 -4.150 5.481 970 HB3 SER 122 HB3 SER 122 -6.529 -3.613 7.105 971 HG SER 122 HG SER 122 -5.947 -6.258 6.238 972 H LEU 123 H LEU 123 -8.425 -3.822 3.644 973 HA LEU 123 HA LEU 123 -9.453 -1.129 4.390 974 HB2 LEU 123 HB2 LEU 123 -8.430 -2.170 1.746 975 HB3 LEU 123 HB3 LEU 123 -8.925 -0.509 2.088 976 HG LEU 123 HG LEU 123 -6.588 -1.988 3.354 977 HD11 LEU 123 HD11 LEU 123 -6.376 -1.346 0.928 978 HD12 LEU 123 HD12 LEU 123 -6.499 0.354 1.454 979 HD13 LEU 123 HD13 LEU 123 -5.156 -0.675 2.011 980 HD21 LEU 123 HD21 LEU 123 -7.456 0.917 3.668 981 HD22 LEU 123 HD22 LEU 123 -7.428 -0.320 4.945 982 HD23 LEU 123 HD23 LEU 123 -5.913 0.242 4.236 983 H GLN 124 H GLN 124 -10.383 -4.090 2.560 984 HA GLN 124 HA GLN 124 -12.874 -3.124 1.566 985 HB2 GLN 124 HB2 GLN 124 -12.207 -5.908 2.609 986 HB3 GLN 124 HB3 GLN 124 -13.651 -5.500 1.700 987 HG2 GLN 124 HG2 GLN 124 -10.815 -5.250 0.637 988 HG3 GLN 124 HG3 GLN 124 -11.889 -6.598 0.335 989 HE21 GLN 124 HE21 GLN 124 -12.033 -4.385 -2.631 990 HE22 GLN 124 HE22 GLN 124 -10.787 -5.318 -1.792 991 H ASP 125 H ASP 125 -12.190 -4.684 4.758 992 HA ASP 125 HA ASP 125 -14.895 -4.192 5.723 993 HB2 ASP 125 HB2 ASP 125 -13.258 -6.056 6.398 994 HB3 ASP 125 HB3 ASP 125 -12.399 -4.824 7.337 995 H HIS 126 H HIS 126 -12.307 -2.078 5.332 996 HA HIS 126 HA HIS 126 -13.123 -0.240 7.527 997 HB2 HIS 126 HB2 HIS 126 -10.739 -0.415 7.113 998 HB3 HIS 126 HB3 HIS 126 -10.976 -0.000 5.412 999 HD2 HIS 126 HD2 HIS 126 -11.836 1.698 8.839 1000 HE1 HIS 126 HE1 HIS 126 -10.758 4.746 6.067 1001 HE2 HIS 126 HE2 HIS 126 -11.572 4.298 8.425 1002 H PHE 127 H PHE 127 -13.313 -0.567 3.982 1003 HA PHE 127 HA PHE 127 -15.011 1.841 3.808 1004 HB2 PHE 127 HB2 PHE 127 -13.631 0.132 1.759 1005 HB3 PHE 127 HB3 PHE 127 -14.790 1.384 1.342 1006 HD1 PHE 127 HD1 PHE 127 -11.329 0.790 2.143 1007 HD2 PHE 127 HD2 PHE 127 -14.433 3.771 2.368 1008 HE1 PHE 127 HE1 PHE 127 -9.612 2.551 2.462 1009 HE2 PHE 127 HE2 PHE 127 -12.700 5.522 2.726 1010 HZ PHE 127 HZ PHE 127 -10.306 4.914 2.766 1011 H LYS 128 H LYS 128 -15.677 -1.472 4.263 1012 HA LYS 128 HA LYS 128 -18.120 -1.663 2.874 1013 HB2 LYS 128 HB2 LYS 128 -18.555 -3.638 4.016 1014 HB3 LYS 128 HB3 LYS 128 -16.828 -3.544 3.817 1015 HG2 LYS 128 HG2 LYS 128 -16.915 -4.289 5.955 1016 HG3 LYS 128 HG3 LYS 128 -16.898 -2.547 6.297 1017 HD2 LYS 128 HD2 LYS 128 -19.465 -2.757 6.370 1018 HD3 LYS 128 HD3 LYS 128 -19.226 -4.502 6.230 1019 HE2 LYS 128 HE2 LYS 128 -18.002 -2.814 8.441 1020 HE3 LYS 128 HE3 LYS 128 -19.629 -3.485 8.560 1021 HZ1 LYS 128 HZ1 LYS 128 -18.007 -4.957 9.593 1022 HZ2 LYS 128 HZ2 LYS 128 -18.674 -5.710 8.309 1023 HZ3 LYS 128 HZ3 LYS 128 -17.155 -5.107 8.211 1024 H TRP 129 H TRP 129 -17.560 -0.052 5.911 1025 HA TRP 129 HA TRP 129 -20.489 0.214 6.428 1026 HB2 TRP 129 HB2 TRP 129 -19.777 0.884 8.688 1027 HB3 TRP 129 HB3 TRP 129 -19.278 -0.730 8.226 1028 HD1 TRP 129 HD1 TRP 129 -16.691 -1.270 8.172 1029 HE1 TRP 129 HE1 TRP 129 -14.612 -0.021 8.799 1030 HE3 TRP 129 HE3 TRP 129 -18.700 3.424 8.722 1031 HZ2 TRP 129 HZ2 TRP 129 -13.832 2.702 9.489 1032 HZ3 TRP 129 HZ3 TRP 129 -17.206 5.359 9.215 1033 HH2 TRP 129 HH2 TRP 129 -14.784 5.003 9.611 1034 H VAL 130 H VAL 130 -18.165 1.993 4.911 1035 HA VAL 130 HA VAL 130 -19.638 4.575 5.263 1036 HB VAL 130 HB VAL 130 -17.194 5.240 4.066 1037 HG11 VAL 130 HG11 VAL 130 -18.196 5.477 6.928 1038 HG12 VAL 130 HG12 VAL 130 -16.841 6.399 6.264 1039 HG13 VAL 130 HG13 VAL 130 -18.471 6.629 5.605 1040 HG21 VAL 130 HG21 VAL 130 -16.191 3.132 4.781 1041 HG22 VAL 130 HG22 VAL 130 -15.440 4.552 5.513 1042 HG23 VAL 130 HG23 VAL 130 -16.531 3.535 6.465 1043 H LYS 131 H LYS 131 -18.483 5.650 2.834 1044 HA LYS 131 HA LYS 131 -19.060 5.877 0.612 1045 HB2 LYS 131 HB2 LYS 131 -18.543 2.900 0.853 1046 HB3 LYS 131 HB3 LYS 131 -18.878 3.673 -0.703 1047 HG2 LYS 131 HG2 LYS 131 -16.898 5.136 -0.415 1048 HG3 LYS 131 HG3 LYS 131 -16.595 4.397 1.171 1049 HD2 LYS 131 HD2 LYS 131 -15.158 3.264 -0.357 1050 HD3 LYS 131 HD3 LYS 131 -16.485 2.156 0.037 1051 HE2 LYS 131 HE2 LYS 131 -17.613 3.051 -2.140 1052 HE3 LYS 131 HE3 LYS 131 -16.037 3.737 -2.530 1053 HZ1 LYS 131 HZ1 LYS 131 -16.310 1.537 -3.507 1054 HZ2 LYS 131 HZ2 LYS 131 -15.124 1.438 -2.388 1055 HZ3 LYS 131 HZ3 LYS 131 -16.614 0.853 -2.059 1056 H GLN 132 H GLN 132 -21.269 5.571 2.487 1057 HA GLN 132 HA GLN 132 -23.496 5.366 2.612 1058 HB2 GLN 132 HB2 GLN 132 -23.590 5.956 -0.364 1059 HB3 GLN 132 HB3 GLN 132 -24.833 6.249 0.844 1060 HG2 GLN 132 HG2 GLN 132 -23.953 8.370 0.529 1061 HG3 GLN 132 HG3 GLN 132 -23.146 7.836 1.997 1062 HE21 GLN 132 HE21 GLN 132 -19.989 8.523 0.510 1063 HE22 GLN 132 HE22 GLN 132 -20.957 8.440 1.975 1064 H GLU 133 H GLU 133 -22.093 2.903 2.249 1065 HA GLU 133 HA GLU 133 -23.879 1.122 0.820 1066 HB2 GLU 133 HB2 GLU 133 -21.667 0.638 2.845 1067 HB3 GLU 133 HB3 GLU 133 -22.538 -0.659 2.033 1068 HG2 GLU 133 HG2 GLU 133 -20.933 1.485 0.563 1069 HG3 GLU 133 HG3 GLU 133 -20.296 -0.080 1.039 1070 H1 SER 149 H1 SER 149 14.572 -11.979 -13.367 1071 H2 SER 149 H2 SER 149 14.793 -10.368 -13.606 1072 H3 SER 149 H3 SER 149 14.122 -10.895 -12.208 1073 HA SER 149 HA SER 149 16.869 -11.409 -13.111 1074 HB2 SER 149 HB2 SER 149 15.919 -9.535 -10.917 1075 HB3 SER 149 HB3 SER 149 17.605 -9.911 -11.334 1076 HG SER 149 HG SER 149 16.950 -8.032 -12.411 1077 H GLN 150 H GLN 150 14.921 -11.455 -10.038 1078 HA GLN 150 HA GLN 150 16.605 -13.685 -9.033 1079 HB2 GLN 150 HB2 GLN 150 14.307 -12.154 -7.737 1080 HB3 GLN 150 HB3 GLN 150 15.339 -13.358 -6.957 1081 HG2 GLN 150 HG2 GLN 150 17.334 -11.868 -7.498 1082 HG3 GLN 150 HG3 GLN 150 16.181 -10.624 -8.002 1083 HE21 GLN 150 HE21 GLN 150 15.102 -9.949 -4.610 1084 HE22 GLN 150 HE22 GLN 150 14.553 -9.876 -6.284 1085 H ILE 151 H ILE 151 13.222 -13.063 -9.928 1086 HA ILE 151 HA ILE 151 12.657 -15.821 -10.619 1087 HB ILE 151 HB ILE 151 12.429 -15.790 -8.115 1088 HG12 ILE 151 HG12 ILE 151 9.740 -16.305 -9.418 1089 HG13 ILE 151 HG13 ILE 151 11.151 -17.347 -9.643 1090 HG21 ILE 151 HG21 ILE 151 10.604 -14.632 -7.009 1091 HG22 ILE 151 HG22 ILE 151 11.598 -13.454 -7.855 1092 HG23 ILE 151 HG23 ILE 151 10.035 -13.950 -8.542 1093 HD11 ILE 151 HD11 ILE 151 11.247 -17.715 -7.175 1094 HD12 ILE 151 HD12 ILE 151 9.757 -16.754 -7.001 1095 HD13 ILE 151 HD13 ILE 151 9.732 -18.268 -7.916 1096 H THR 152 H THR 152 10.310 -15.936 -11.494 1097 HA THR 152 HA THR 152 9.106 -13.257 -11.981 1098 HB THR 152 HB THR 152 8.119 -14.168 -14.116 1099 HG1 THR 152 HG1 THR 152 8.815 -16.331 -13.892 1100 HG21 THR 152 HG21 THR 152 11.112 -13.615 -14.047 1101 HG22 THR 152 HG22 THR 152 10.045 -13.470 -15.463 1102 HG23 THR 152 HG23 THR 152 9.816 -12.394 -14.071 1103 H SER 153 H SER 153 7.225 -13.046 -11.212 1104 HA SER 153 HA SER 153 5.403 -15.348 -10.696 1105 HB2 SER 153 HB2 SER 153 6.276 -13.265 -8.682 1106 HB3 SER 153 HB3 SER 153 5.008 -14.487 -8.430 1107 HG SER 153 HG SER 153 7.024 -15.148 -7.542 1108 H GLN 154 H GLN 154 4.994 -13.921 -12.724 1109 HA GLN 154 HA GLN 154 4.006 -11.380 -12.860 1110 HB2 GLN 154 HB2 GLN 154 3.138 -13.820 -14.435 1111 HB3 GLN 154 HB3 GLN 154 2.672 -12.166 -14.848 1112 HG2 GLN 154 HG2 GLN 154 5.081 -11.529 -15.012 1113 HG3 GLN 154 HG3 GLN 154 5.538 -13.202 -14.694 1114 HE21 GLN 154 HE21 GLN 154 5.672 -12.836 -18.359 1115 HE22 GLN 154 HE22 GLN 154 6.564 -12.237 -16.968 1116 H VAL 155 H VAL 155 2.136 -10.227 -12.660 1117 HA VAL 155 HA VAL 155 0.223 -11.161 -10.732 1118 HB VAL 155 HB VAL 155 0.586 -8.868 -10.730 1119 HG11 VAL 155 HG11 VAL 155 0.028 -7.326 -12.564 1120 HG12 VAL 155 HG12 VAL 155 1.399 -8.400 -12.902 1121 HG13 VAL 155 HG13 VAL 155 -0.194 -8.715 -13.637 1122 HG21 VAL 155 HG21 VAL 155 -1.728 -7.834 -11.181 1123 HG22 VAL 155 HG22 VAL 155 -2.283 -9.452 -11.600 1124 HG23 VAL 155 HG23 VAL 155 -1.624 -9.069 -9.991 1125 H TPO 156 H T2P 156 -1.240 -12.509 -10.989 1126 HA TPO 156 HA T2P 156 -2.328 -13.889 -13.135 1127 HB TPO 156 HB T2P 156 -3.610 -13.121 -10.529 1128 HG21 TPO 156 HG21 T2P 156 -4.563 -15.156 -12.500 1129 HG22 TPO 156 HG22 T2P 156 -5.398 -13.736 -11.744 1130 HG23 TPO 156 HG23 T2P 156 -5.004 -15.159 -10.780 1131 H GLY 157 H GLY 157 -4.354 -13.842 -14.089 1132 HA2 GLY 157 HA2 GLY 157 -6.107 -11.588 -14.270 1133 HA3 GLY 157 HA3 GLY 157 -4.929 -11.483 -15.583 1134 H GLN 158 H GLN 158 -4.774 -14.419 -16.019 1135 HA GLN 158 HA GLN 158 -6.971 -14.825 -17.769 1136 HB2 GLN 158 HB2 GLN 158 -6.076 -17.030 -18.126 1137 HB3 GLN 158 HB3 GLN 158 -4.771 -15.846 -18.063 1138 HG2 GLN 158 HG2 GLN 158 -4.262 -16.559 -15.713 1139 HG3 GLN 158 HG3 GLN 158 -5.559 -17.751 -15.804 1140 HE21 GLN 158 HE21 GLN 158 -2.531 -19.687 -16.503 1141 HE22 GLN 158 HE22 GLN 158 -3.320 -18.923 -15.131 1142 H ILE 159 H ILE 159 -6.723 -15.537 -14.388 1143 HA ILE 159 HA ILE 159 -9.516 -16.588 -14.403 1144 HB ILE 159 HB ILE 159 -7.965 -18.334 -13.775 1145 HG12 ILE 159 HG12 ILE 159 -9.553 -17.454 -11.332 1146 HG13 ILE 159 HG13 ILE 159 -10.290 -18.110 -12.797 1147 HG21 ILE 159 HG21 ILE 159 -7.152 -16.626 -11.386 1148 HG22 ILE 159 HG22 ILE 159 -6.641 -18.285 -11.713 1149 HG23 ILE 159 HG23 ILE 159 -6.124 -17.004 -12.791 1150 HD11 ILE 159 HD11 ILE 159 -10.068 -19.867 -11.142 1151 HD12 ILE 159 HD12 ILE 159 -9.001 -20.214 -12.517 1152 HD13 ILE 159 HD13 ILE 159 -8.327 -19.585 -10.996 1153 H GLY 160 H GLY 160 -7.190 -14.509 -12.731 1154 HA2 GLY 160 HA2 GLY 160 -7.488 -12.404 -11.848 1155 HA3 GLY 160 HA3 GLY 160 -9.118 -12.405 -12.525 1156 H TRP 161 H TRP 161 -7.262 -13.887 -9.851 1157 HA TRP 161 HA TRP 161 -9.648 -13.647 -8.086 1158 HB2 TRP 161 HB2 TRP 161 -9.664 -15.940 -7.604 1159 HB3 TRP 161 HB3 TRP 161 -9.592 -15.782 -9.339 1160 HD1 TRP 161 HD1 TRP 161 -6.166 -15.209 -8.672 1161 HE1 TRP 161 HE1 TRP 161 -4.762 -17.304 -8.904 1162 HE3 TRP 161 HE3 TRP 161 -9.862 -18.597 -7.864 1163 HZ2 TRP 161 HZ2 TRP 161 -5.208 -20.190 -8.727 1164 HZ3 TRP 161 HZ3 TRP 161 -9.351 -21.057 -7.854 1165 HH2 TRP 161 HH2 TRP 161 -7.039 -21.854 -8.300 1166 H ARG 162 H ARG 162 -8.496 -15.471 -6.128 1167 HA ARG 162 HA ARG 162 -7.627 -13.089 -4.506 1168 HB2 ARG 162 HB2 ARG 162 -10.026 -14.944 -4.229 1169 HB3 ARG 162 HB3 ARG 162 -9.691 -13.551 -3.217 1170 HG2 ARG 162 HG2 ARG 162 -10.450 -13.619 -6.154 1171 HG3 ARG 162 HG3 ARG 162 -11.433 -13.025 -4.839 1172 HD2 ARG 162 HD2 ARG 162 -10.156 -11.038 -4.569 1173 HD3 ARG 162 HD3 ARG 162 -8.793 -11.645 -5.479 1174 HE ARG 162 HE ARG 162 -11.454 -10.930 -6.675 1175 HH11 ARG 162 HH11 ARG 162 -11.432 -9.978 -8.741 1176 HH12 ARG 162 HH12 ARG 162 -9.870 -9.821 -9.541 1177 HH21 ARG 162 HH21 ARG 162 -7.933 -11.123 -7.222 1178 HH22 ARG 162 HH22 ARG 162 -8.130 -10.264 -8.739 1179 H ARG 163 H ARG 163 -8.412 -16.565 -4.063 1180 HA ARG 163 HA ARG 163 -6.107 -16.905 -2.220 1181 HB2 ARG 163 HB2 ARG 163 -8.998 -17.617 -1.561 1182 HB3 ARG 163 HB3 ARG 163 -7.608 -18.192 -0.662 1183 HG2 ARG 163 HG2 ARG 163 -8.528 -15.295 -0.886 1184 HG3 ARG 163 HG3 ARG 163 -8.728 -16.361 0.496 1185 HD2 ARG 163 HD2 ARG 163 -6.122 -15.216 -0.561 1186 HD3 ARG 163 HD3 ARG 163 -6.938 -14.828 0.942 1187 HE ARG 163 HE ARG 163 -6.470 -17.112 1.745 1188 HH11 ARG 163 HH11 ARG 163 -4.802 -18.487 2.194 1189 HH12 ARG 163 HH12 ARG 163 -3.352 -18.446 1.238 1190 HH21 ARG 163 HH21 ARG 163 -4.432 -15.963 -0.859 1191 HH22 ARG 163 HH22 ARG 163 -3.161 -17.097 -0.473 Start of MODEL 2 1 H1 GLY -4 H1 GLY -4 -15.180 24.226 21.149 2 H2 GLY -4 H2 GLY -4 -14.213 23.877 22.421 3 H3 GLY -4 H3 GLY -4 -15.054 22.680 21.680 4 HA2 GLY -4 HA2 GLY -4 -12.745 22.566 21.030 5 HA3 GLY -4 HA3 GLY -4 -13.791 22.953 19.652 6 H SER -3 H SER -3 -11.480 23.656 18.967 7 HA SER -3 HA SER -3 -10.295 26.007 20.002 8 HB2 SER -3 HB2 SER -3 -10.103 25.031 17.134 9 HB3 SER -3 HB3 SER -3 -8.911 25.981 18.025 10 HG SER -3 HG SER -3 -8.567 24.179 19.384 11 HA PRO -2 HA PRO -2 -12.778 29.242 18.123 12 HB2 PRO -2 HB2 PRO -2 -11.131 31.398 18.262 13 HB3 PRO -2 HB3 PRO -2 -11.760 30.589 19.729 14 HG2 PRO -2 HG2 PRO -2 -9.069 30.151 18.381 15 HG3 PRO -2 HG3 PRO -2 -9.389 30.511 20.110 16 HD2 PRO -2 HD2 PRO -2 -9.040 27.964 19.207 17 HD3 PRO -2 HD3 PRO -2 -10.209 28.338 20.507 18 H ASN -1 H ASN -1 -10.059 27.940 16.568 19 HA ASN -1 HA ASN -1 -10.581 29.349 13.995 20 HB2 ASN -1 HB2 ASN -1 -8.197 29.460 13.606 21 HB3 ASN -1 HB3 ASN -1 -8.552 30.212 15.148 22 HD21 ASN -1 HD21 ASN -1 -5.578 28.273 15.875 23 HD22 ASN -1 HD22 ASN -1 -6.054 29.785 15.115 24 H SER 0 H SER 0 -9.102 28.005 12.275 25 HA SER 0 HA SER 0 -10.600 25.775 11.605 26 HB2 SER 0 HB2 SER 0 -7.766 26.376 10.688 27 HB3 SER 0 HB3 SER 0 -8.992 25.429 9.821 28 HG SER 0 HG SER 0 -8.877 27.595 9.059 29 H MET 1 H MET 1 -8.028 25.683 13.937 30 HA MET 1 HA MET 1 -7.088 23.009 13.579 31 HB2 MET 1 HB2 MET 1 -6.074 24.791 15.020 32 HB3 MET 1 HB3 MET 1 -7.404 24.580 16.171 33 HG2 MET 1 HG2 MET 1 -6.727 22.256 16.563 34 HG3 MET 1 HG3 MET 1 -5.483 22.383 15.312 35 HE1 MET 1 HE1 MET 1 -3.699 21.387 16.969 36 HE2 MET 1 HE2 MET 1 -3.397 22.023 18.601 37 HE3 MET 1 HE3 MET 1 -4.953 21.251 18.224 38 H ALA 2 H ALA 2 -10.157 24.203 14.825 39 HA ALA 2 HA ALA 2 -11.031 21.886 16.241 40 HB1 ALA 2 HB1 ALA 2 -12.606 23.995 14.694 41 HB2 ALA 2 HB2 ALA 2 -13.269 22.889 15.917 42 HB3 ALA 2 HB3 ALA 2 -12.086 24.118 16.390 43 H THR 3 H THR 3 -10.517 22.242 12.827 44 HA THR 3 HA THR 3 -12.475 20.200 12.023 45 HB THR 3 HB THR 3 -11.634 20.461 9.789 46 HG1 THR 3 HG1 THR 3 -9.727 22.292 10.817 47 HG21 THR 3 HG21 THR 3 -13.203 22.183 10.614 48 HG22 THR 3 HG22 THR 3 -11.833 23.201 11.104 49 HG23 THR 3 HG23 THR 3 -12.089 22.819 9.387 50 H GLU 4 H GLU 4 -9.434 20.037 13.403 51 HA GLU 4 HA GLU 4 -8.802 17.351 12.266 52 HB2 GLU 4 HB2 GLU 4 -7.089 19.056 11.889 53 HB3 GLU 4 HB3 GLU 4 -7.047 19.439 13.608 54 HG2 GLU 4 HG2 GLU 4 -5.124 18.085 13.007 55 HG3 GLU 4 HG3 GLU 4 -6.167 17.213 14.119 56 H LEU 5 H LEU 5 -8.409 15.639 13.615 57 HA LEU 5 HA LEU 5 -9.158 15.916 16.502 58 HB2 LEU 5 HB2 LEU 5 -9.872 13.681 14.572 59 HB3 LEU 5 HB3 LEU 5 -10.198 13.660 16.307 60 HG LEU 5 HG LEU 5 -11.403 15.663 14.345 61 HD11 LEU 5 HD11 LEU 5 -13.484 14.406 14.694 62 HD12 LEU 5 HD12 LEU 5 -12.232 13.376 13.987 63 HD13 LEU 5 HD13 LEU 5 -12.623 13.233 15.717 64 HD21 LEU 5 HD21 LEU 5 -11.274 16.607 16.617 65 HD22 LEU 5 HD22 LEU 5 -12.942 16.186 16.225 66 HD23 LEU 5 HD23 LEU 5 -11.993 15.128 17.293 67 H GLU 6 H GLU 6 -6.734 15.153 14.432 68 HA GLU 6 HA GLU 6 -4.649 14.332 14.649 69 HB2 GLU 6 HB2 GLU 6 -5.022 15.063 17.560 70 HB3 GLU 6 HB3 GLU 6 -3.487 14.930 16.686 71 HG2 GLU 6 HG2 GLU 6 -4.188 16.815 15.228 72 HG3 GLU 6 HG3 GLU 6 -5.621 17.026 16.259 73 H TYR 7 H TYR 7 -6.654 12.131 15.088 74 HA TYR 7 HA TYR 7 -4.837 10.222 16.503 75 HB2 TYR 7 HB2 TYR 7 -6.624 9.018 17.334 76 HB3 TYR 7 HB3 TYR 7 -7.064 10.688 17.616 77 HD1 TYR 7 HD1 TYR 7 -8.028 7.542 16.108 78 HD2 TYR 7 HD2 TYR 7 -8.733 11.794 16.004 79 HE1 TYR 7 HE1 TYR 7 -10.187 7.142 14.963 80 HE2 TYR 7 HE2 TYR 7 -10.922 11.391 14.855 81 HH TYR 7 HH TYR 7 -12.108 8.097 14.122 82 H GLU 8 H GLU 8 -5.384 7.899 15.902 83 HA GLU 8 HA GLU 8 -6.475 7.277 13.356 84 HB2 GLU 8 HB2 GLU 8 -4.576 6.358 12.195 85 HB3 GLU 8 HB3 GLU 8 -4.267 8.052 12.495 86 HG2 GLU 8 HG2 GLU 8 -2.913 7.300 14.570 87 HG3 GLU 8 HG3 GLU 8 -3.017 5.667 13.886 88 H SER 9 H SER 9 -7.354 5.343 13.576 89 HA SER 9 HA SER 9 -6.693 3.635 15.871 90 HB2 SER 9 HB2 SER 9 -8.982 3.721 13.896 91 HB3 SER 9 HB3 SER 9 -8.810 2.448 15.123 92 HG SER 9 HG SER 9 -10.116 4.183 15.875 93 H VAL 10 H VAL 10 -5.585 1.681 15.698 94 HA VAL 10 HA VAL 10 -4.429 0.995 13.170 95 HB VAL 10 HB VAL 10 -3.292 0.641 15.290 96 HG11 VAL 10 HG11 VAL 10 -5.150 -0.303 16.649 97 HG12 VAL 10 HG12 VAL 10 -5.075 -1.796 15.688 98 HG13 VAL 10 HG13 VAL 10 -3.693 -1.306 16.683 99 HG21 VAL 10 HG21 VAL 10 -2.556 -0.518 13.228 100 HG22 VAL 10 HG22 VAL 10 -2.190 -1.434 14.699 101 HG23 VAL 10 HG23 VAL 10 -3.548 -1.927 13.675 102 H LEU 11 H LEU 11 -4.813 -0.458 11.655 103 HA LEU 11 HA LEU 11 -7.293 -2.136 11.821 104 HB2 LEU 11 HB2 LEU 11 -5.995 -0.799 9.419 105 HB3 LEU 11 HB3 LEU 11 -7.366 -1.894 9.351 106 HG LEU 11 HG LEU 11 -7.347 0.864 10.640 107 HD11 LEU 11 HD11 LEU 11 -8.556 -0.287 8.091 108 HD12 LEU 11 HD12 LEU 11 -8.986 1.292 8.762 109 HD13 LEU 11 HD13 LEU 11 -7.329 0.990 8.230 110 HD21 LEU 11 HD21 LEU 11 -9.816 0.523 10.837 111 HD22 LEU 11 HD22 LEU 11 -9.600 -1.178 10.368 112 HD23 LEU 11 HD23 LEU 11 -8.898 -0.553 11.886 113 H CYS 12 H CYS 12 -3.926 -1.992 10.537 114 HA CYS 12 HA CYS 12 -3.784 -4.923 10.664 115 HB2 CYS 12 HB2 CYS 12 -4.724 -4.192 8.362 116 HB3 CYS 12 HB3 CYS 12 -3.086 -3.612 8.023 117 HG CYS 12 HG CYS 12 -3.558 -5.969 6.909 118 H VAL 13 H VAL 13 -1.767 -5.800 10.585 119 HA VAL 13 HA VAL 13 0.603 -4.163 10.204 120 HB VAL 13 HB VAL 13 0.207 -3.892 12.590 121 HG11 VAL 13 HG11 VAL 13 0.348 -5.667 14.215 122 HG12 VAL 13 HG12 VAL 13 -0.999 -5.991 13.116 123 HG13 VAL 13 HG13 VAL 13 0.526 -6.892 12.949 124 HG21 VAL 13 HG21 VAL 13 2.537 -3.963 11.773 125 HG22 VAL 13 HG22 VAL 13 2.403 -4.578 13.423 126 HG23 VAL 13 HG23 VAL 13 2.597 -5.713 12.073 127 H LYS 14 H LYS 14 2.004 -5.313 8.997 128 HA LYS 14 HA LYS 14 1.870 -8.273 9.151 129 HB2 LYS 14 HB2 LYS 14 1.932 -6.657 6.594 130 HB3 LYS 14 HB3 LYS 14 2.497 -8.310 6.635 131 HG2 LYS 14 HG2 LYS 14 -0.299 -7.455 7.491 132 HG3 LYS 14 HG3 LYS 14 0.141 -8.080 5.899 133 HD2 LYS 14 HD2 LYS 14 0.962 -10.192 6.966 134 HD3 LYS 14 HD3 LYS 14 0.370 -9.612 8.540 135 HE2 LYS 14 HE2 LYS 14 -1.896 -9.447 7.690 136 HE3 LYS 14 HE3 LYS 14 -1.341 -9.898 6.066 137 HZ1 LYS 14 HZ1 LYS 14 -2.285 -11.800 7.177 138 HZ2 LYS 14 HZ2 LYS 14 -0.670 -12.058 6.962 139 HZ3 LYS 14 HZ3 LYS 14 -1.252 -11.663 8.451 140 HA PRO 15 HA PRO 15 5.875 -8.186 10.412 141 HB2 PRO 15 HB2 PRO 15 6.699 -10.778 10.034 142 HB3 PRO 15 HB3 PRO 15 5.396 -10.315 11.169 143 HG2 PRO 15 HG2 PRO 15 5.078 -11.304 8.299 144 HG3 PRO 15 HG3 PRO 15 4.250 -11.912 9.774 145 HD2 PRO 15 HD2 PRO 15 3.071 -10.130 8.167 146 HD3 PRO 15 HD3 PRO 15 2.932 -9.988 9.946 147 H ASP 16 H ASP 16 5.556 -9.164 7.025 148 HA ASP 16 HA ASP 16 8.113 -7.823 6.455 149 HB2 ASP 16 HB2 ASP 16 8.694 -10.231 6.667 150 HB3 ASP 16 HB3 ASP 16 7.517 -10.613 5.406 151 H VAL 17 H VAL 17 7.953 -6.521 4.787 152 HA VAL 17 HA VAL 17 6.203 -7.104 2.501 153 HB VAL 17 HB VAL 17 4.742 -5.841 4.021 154 HG11 VAL 17 HG11 VAL 17 6.368 -4.489 5.254 155 HG12 VAL 17 HG12 VAL 17 6.730 -3.556 3.788 156 HG13 VAL 17 HG13 VAL 17 5.118 -3.475 4.518 157 HG21 VAL 17 HG21 VAL 17 3.974 -4.183 2.459 158 HG22 VAL 17 HG22 VAL 17 5.538 -4.162 1.625 159 HG23 VAL 17 HG23 VAL 17 4.508 -5.614 1.568 160 H SER 18 H SER 18 6.985 -6.278 0.605 161 HA SER 18 HA SER 18 9.479 -4.633 0.720 162 HB2 SER 18 HB2 SER 18 10.352 -5.779 -1.130 163 HB3 SER 18 HB3 SER 18 9.828 -7.009 0.023 164 HG SER 18 HG SER 18 7.821 -7.061 -1.298 165 H VAL 19 H VAL 19 9.850 -3.105 -0.895 166 HA VAL 19 HA VAL 19 7.398 -2.095 -2.314 167 HB VAL 19 HB VAL 19 9.387 -0.682 -0.566 168 HG11 VAL 19 HG11 VAL 19 7.619 0.614 -2.665 169 HG12 VAL 19 HG12 VAL 19 8.435 1.481 -1.353 170 HG13 VAL 19 HG13 VAL 19 9.397 0.695 -2.580 171 HG21 VAL 19 HG21 VAL 19 7.314 0.178 0.431 172 HG22 VAL 19 HG22 VAL 19 6.347 -0.637 -0.806 173 HG23 VAL 19 HG23 VAL 19 7.262 -1.580 0.387 174 H TYR 20 H TYR 20 7.560 -1.316 -4.276 175 HA TYR 20 HA TYR 20 10.251 -0.933 -5.531 176 HB2 TYR 20 HB2 TYR 20 7.998 -1.815 -7.289 177 HB3 TYR 20 HB3 TYR 20 9.715 -2.073 -7.445 178 HD1 TYR 20 HD1 TYR 20 10.775 -4.025 -6.328 179 HD2 TYR 20 HD2 TYR 20 6.541 -3.320 -6.104 180 HE1 TYR 20 HE1 TYR 20 10.430 -6.377 -5.550 181 HE2 TYR 20 HE2 TYR 20 6.184 -5.682 -5.398 182 HH TYR 20 HH TYR 20 8.909 -7.943 -4.890 183 H ARG 21 H ARG 21 10.374 1.294 -5.946 184 HA ARG 21 HA ARG 21 8.177 3.055 -6.599 185 HB2 ARG 21 HB2 ARG 21 11.090 3.128 -7.465 186 HB3 ARG 21 HB3 ARG 21 9.954 4.460 -7.655 187 HG2 ARG 21 HG2 ARG 21 9.752 4.794 -5.285 188 HG3 ARG 21 HG3 ARG 21 10.631 3.307 -4.908 189 HD2 ARG 21 HD2 ARG 21 11.818 5.702 -6.361 190 HD3 ARG 21 HD3 ARG 21 12.015 5.355 -4.632 191 HE ARG 21 HE ARG 21 12.808 3.020 -5.975 192 HH11 ARG 21 HH11 ARG 21 14.914 2.471 -6.311 193 HH12 ARG 21 HH12 ARG 21 16.124 3.716 -6.546 194 HH21 ARG 21 HH21 ARG 21 13.976 6.333 -5.948 195 HH22 ARG 21 HH22 ARG 21 15.611 5.854 -6.313 196 H ILE 22 H ILE 22 7.169 3.539 -8.502 197 HA ILE 22 HA ILE 22 7.800 1.791 -10.846 198 HB ILE 22 HB ILE 22 5.442 1.487 -11.255 199 HG12 ILE 22 HG12 ILE 22 4.993 3.071 -8.689 200 HG13 ILE 22 HG13 ILE 22 4.491 3.524 -10.324 201 HG21 ILE 22 HG21 ILE 22 6.195 0.716 -8.435 202 HG22 ILE 22 HG22 ILE 22 5.031 -0.097 -9.476 203 HG23 ILE 22 HG23 ILE 22 6.749 -0.114 -9.897 204 HD11 ILE 22 HD11 ILE 22 3.380 1.312 -8.596 205 HD12 ILE 22 HD12 ILE 22 2.563 2.730 -9.276 206 HD13 ILE 22 HD13 ILE 22 3.078 1.403 -10.344 207 HA PRO 23 HA PRO 23 7.384 5.499 -13.268 208 HB2 PRO 23 HB2 PRO 23 7.654 4.472 -15.811 209 HB3 PRO 23 HB3 PRO 23 8.976 4.791 -14.657 210 HG2 PRO 23 HG2 PRO 23 7.700 2.169 -15.354 211 HG3 PRO 23 HG3 PRO 23 9.392 2.522 -14.934 212 HD2 PRO 23 HD2 PRO 23 7.495 1.467 -13.166 213 HD3 PRO 23 HD3 PRO 23 8.983 2.326 -12.683 214 HA PRO 24 HA PRO 24 3.443 4.739 -15.819 215 HB2 PRO 24 HB2 PRO 24 1.799 2.598 -15.452 216 HB3 PRO 24 HB3 PRO 24 3.261 2.530 -16.482 217 HG2 PRO 24 HG2 PRO 24 2.993 1.671 -13.582 218 HG3 PRO 24 HG3 PRO 24 3.657 0.732 -14.959 219 HD2 PRO 24 HD2 PRO 24 5.252 2.132 -13.270 220 HD3 PRO 24 HD3 PRO 24 5.612 2.040 -15.018 221 H ARG 25 H ARG 25 1.106 5.026 -15.460 222 HA ARG 25 HA ARG 25 0.203 5.384 -12.613 223 HB2 ARG 25 HB2 ARG 25 0.985 7.559 -13.688 224 HB3 ARG 25 HB3 ARG 25 -0.364 7.381 -14.820 225 HG2 ARG 25 HG2 ARG 25 -1.921 7.300 -12.795 226 HG3 ARG 25 HG3 ARG 25 -0.511 7.645 -11.777 227 HD2 ARG 25 HD2 ARG 25 -0.143 9.748 -13.078 228 HD3 ARG 25 HD3 ARG 25 -1.583 9.398 -14.039 229 HE ARG 25 HE ARG 25 -1.452 10.433 -11.304 230 HH11 ARG 25 HH11 ARG 25 -3.308 11.089 -10.278 231 HH12 ARG 25 HH12 ARG 25 -4.858 10.620 -10.906 232 HH21 ARG 25 HH21 ARG 25 -3.621 8.864 -13.571 233 HH22 ARG 25 HH22 ARG 25 -5.040 9.394 -12.713 234 H ALA 26 H ALA 26 -0.752 4.905 -15.972 235 HA ALA 26 HA ALA 26 -3.132 3.383 -15.127 236 HB1 ALA 26 HB1 ALA 26 -3.295 5.953 -16.767 237 HB2 ALA 26 HB2 ALA 26 -4.664 4.916 -16.301 238 HB3 ALA 26 HB3 ALA 26 -3.755 5.822 -15.053 239 H SER 27 H SER 27 -0.611 2.967 -16.669 240 HA SER 27 HA SER 27 -1.117 4.220 -19.057 241 HB2 SER 27 HB2 SER 27 1.320 2.563 -18.355 242 HB3 SER 27 HB3 SER 27 1.223 3.899 -19.524 243 HG SER 27 HG SER 27 1.863 4.933 -17.758 244 H ASN 28 H ASN 28 -2.053 1.142 -18.543 245 HA ASN 28 HA ASN 28 -2.632 0.942 -21.379 246 HB2 ASN 28 HB2 ASN 28 -1.616 -1.549 -19.899 247 HB3 ASN 28 HB3 ASN 28 -2.253 -1.497 -21.539 248 HD21 ASN 28 HD21 ASN 28 1.609 -0.402 -20.787 249 HD22 ASN 28 HD22 ASN 28 0.472 -0.575 -19.457 250 H ARG 29 H ARG 29 -3.197 -1.371 -18.745 251 HA ARG 29 HA ARG 29 -6.131 -0.715 -18.714 252 HB2 ARG 29 HB2 ARG 29 -4.862 -3.371 -17.950 253 HB3 ARG 29 HB3 ARG 29 -6.560 -3.033 -18.261 254 HG2 ARG 29 HG2 ARG 29 -4.307 -3.175 -20.298 255 HG3 ARG 29 HG3 ARG 29 -5.635 -4.318 -20.079 256 HD2 ARG 29 HD2 ARG 29 -7.254 -2.513 -20.714 257 HD3 ARG 29 HD3 ARG 29 -5.874 -1.435 -21.001 258 HE ARG 29 HE ARG 29 -5.700 -3.932 -22.493 259 HH11 ARG 29 HH11 ARG 29 -5.866 -3.901 -24.711 260 HH12 ARG 29 HH12 ARG 29 -6.513 -2.503 -25.516 261 HH21 ARG 29 HH21 ARG 29 -7.058 -0.705 -22.645 262 HH22 ARG 29 HH22 ARG 29 -7.174 -0.736 -24.385 263 H GLY 30 H GLY 30 -3.468 -0.272 -16.934 264 HA2 GLY 30 HA2 GLY 30 -4.440 0.519 -14.460 265 HA3 GLY 30 HA3 GLY 30 -4.208 -1.236 -14.327 266 H TYR 31 H TYR 31 -2.336 -1.529 -13.223 267 HA TYR 31 HA TYR 31 0.047 0.177 -13.915 268 HB2 TYR 31 HB2 TYR 31 -0.848 -1.191 -11.374 269 HB3 TYR 31 HB3 TYR 31 0.819 -0.703 -11.627 270 HD1 TYR 31 HD1 TYR 31 1.484 1.602 -11.891 271 HD2 TYR 31 HD2 TYR 31 -2.591 0.483 -11.029 272 HE1 TYR 31 HE1 TYR 31 1.037 3.899 -10.995 273 HE2 TYR 31 HE2 TYR 31 -3.077 2.804 -10.255 274 HH TYR 31 HH TYR 31 -2.192 4.878 -9.798 275 H ARG 32 H ARG 32 -0.992 -3.152 -13.490 276 HA ARG 32 HA ARG 32 -0.008 -5.133 -13.393 277 HB2 ARG 32 HB2 ARG 32 1.672 -4.773 -15.772 278 HB3 ARG 32 HB3 ARG 32 0.408 -5.910 -15.362 279 HG2 ARG 32 HG2 ARG 32 -0.580 -4.952 -17.138 280 HG3 ARG 32 HG3 ARG 32 -1.208 -3.880 -15.910 281 HD2 ARG 32 HD2 ARG 32 -0.557 -2.426 -17.603 282 HD3 ARG 32 HD3 ARG 32 0.764 -2.322 -16.437 283 HE ARG 32 HE ARG 32 2.208 -3.028 -18.063 284 HH11 ARG 32 HH11 ARG 32 2.941 -3.531 -19.903 285 HH12 ARG 32 HH12 ARG 32 1.959 -4.320 -21.136 286 HH21 ARG 32 HH21 ARG 32 -0.896 -4.270 -19.180 287 HH22 ARG 32 HH22 ARG 32 -0.206 -4.701 -20.719 288 H ALA 33 H ALA 33 1.274 -5.726 -11.737 289 HA ALA 33 HA ALA 33 3.825 -4.735 -11.078 290 HB1 ALA 33 HB1 ALA 33 2.826 -7.604 -10.786 291 HB2 ALA 33 HB2 ALA 33 4.134 -6.832 -9.867 292 HB3 ALA 33 HB3 ALA 33 2.477 -6.276 -9.659 293 H SER 34 H SER 34 2.939 -7.213 -13.405 294 HA SER 34 HA SER 34 5.411 -8.158 -14.303 295 HB2 SER 34 HB2 SER 34 2.704 -7.718 -15.634 296 HB3 SER 34 HB3 SER 34 4.006 -8.697 -16.363 297 HG SER 34 HG SER 34 2.365 -9.825 -15.067 298 H ASP 35 H ASP 35 4.148 -4.931 -14.838 299 HA ASP 35 HA ASP 35 5.660 -4.451 -17.308 300 HB2 ASP 35 HB2 ASP 35 3.361 -3.469 -16.512 301 HB3 ASP 35 HB3 ASP 35 4.338 -2.355 -15.570 302 H TRP 36 H TRP 36 6.216 -4.159 -13.864 303 HA TRP 36 HA TRP 36 8.723 -2.600 -14.293 304 HB2 TRP 36 HB2 TRP 36 8.105 -1.857 -11.784 305 HB3 TRP 36 HB3 TRP 36 7.715 -0.970 -13.229 306 HD1 TRP 36 HD1 TRP 36 5.230 -0.717 -13.934 307 HE1 TRP 36 HE1 TRP 36 3.001 -1.165 -12.805 308 HE3 TRP 36 HE3 TRP 36 6.881 -3.406 -9.890 309 HZ2 TRP 36 HZ2 TRP 36 2.129 -1.954 -10.149 310 HZ3 TRP 36 HZ3 TRP 36 5.309 -3.974 -8.056 311 HH2 TRP 36 HH2 TRP 36 2.942 -3.223 -8.148 312 H LYS 37 H LYS 37 9.923 -2.828 -11.904 313 HA LYS 37 HA LYS 37 10.810 -5.591 -11.664 314 HB2 LYS 37 HB2 LYS 37 11.232 -3.026 -10.079 315 HB3 LYS 37 HB3 LYS 37 11.785 -4.580 -9.451 316 HG2 LYS 37 HG2 LYS 37 13.193 -4.980 -11.359 317 HG3 LYS 37 HG3 LYS 37 12.599 -3.533 -12.193 318 HD2 LYS 37 HD2 LYS 37 13.663 -2.057 -10.675 319 HD3 LYS 37 HD3 LYS 37 13.900 -3.321 -9.454 320 HE2 LYS 37 HE2 LYS 37 15.474 -4.503 -10.915 321 HE3 LYS 37 HE3 LYS 37 15.255 -3.284 -12.183 322 HZ1 LYS 37 HZ1 LYS 37 16.383 -2.752 -9.480 323 HZ2 LYS 37 HZ2 LYS 37 17.253 -2.869 -10.852 324 HZ3 LYS 37 HZ3 LYS 37 16.204 -1.634 -10.661 325 H LEU 38 H LEU 38 9.176 -7.019 -11.151 326 HA LEU 38 HA LEU 38 7.808 -6.628 -8.547 327 HB2 LEU 38 HB2 LEU 38 6.400 -8.459 -9.087 328 HB3 LEU 38 HB3 LEU 38 6.397 -7.242 -10.338 329 HG LEU 38 HG LEU 38 7.838 -8.711 -11.754 330 HD11 LEU 38 HD11 LEU 38 7.823 -11.173 -11.206 331 HD12 LEU 38 HD12 LEU 38 8.943 -10.213 -10.250 332 HD13 LEU 38 HD13 LEU 38 7.402 -10.745 -9.539 333 HD21 LEU 38 HD21 LEU 38 5.256 -10.020 -10.770 334 HD22 LEU 38 HD22 LEU 38 5.336 -8.681 -11.917 335 HD23 LEU 38 HD23 LEU 38 6.032 -10.240 -12.355 336 H ASP 39 H ASP 39 10.762 -7.679 -9.387 337 HA ASP 39 HA ASP 39 10.877 -9.866 -7.358 338 HB2 ASP 39 HB2 ASP 39 11.110 -10.550 -9.740 339 HB3 ASP 39 HB3 ASP 39 12.493 -9.474 -9.905 340 H GLN 40 H GLN 40 12.007 -6.708 -8.003 341 HA GLN 40 HA GLN 40 14.496 -7.027 -6.366 342 HB2 GLN 40 HB2 GLN 40 14.116 -5.608 -9.000 343 HB3 GLN 40 HB3 GLN 40 15.497 -5.339 -7.924 344 HG2 GLN 40 HG2 GLN 40 16.112 -7.732 -8.097 345 HG3 GLN 40 HG3 GLN 40 14.726 -8.020 -9.152 346 HE21 GLN 40 HE21 GLN 40 16.619 -7.160 -12.010 347 HE22 GLN 40 HE22 GLN 40 15.331 -8.128 -11.309 348 HA PRO 41 HA PRO 41 11.875 -3.767 -4.427 349 HB2 PRO 41 HB2 PRO 41 13.459 -4.638 -2.021 350 HB3 PRO 41 HB3 PRO 41 11.714 -4.280 -2.158 351 HG2 PRO 41 HG2 PRO 41 12.579 -6.847 -2.069 352 HG3 PRO 41 HG3 PRO 41 11.300 -6.381 -3.240 353 HD2 PRO 41 HD2 PRO 41 14.277 -6.686 -3.743 354 HD3 PRO 41 HD3 PRO 41 12.898 -7.341 -4.675 355 H ASP 42 H ASP 42 12.251 -1.753 -3.588 356 HA ASP 42 HA ASP 42 15.023 -0.633 -3.590 357 HB2 ASP 42 HB2 ASP 42 12.257 0.647 -3.353 358 HB3 ASP 42 HB3 ASP 42 13.774 1.534 -3.241 359 H TRP 43 H TRP 43 12.280 -1.393 -1.513 360 HA TRP 43 HA TRP 43 13.918 -0.980 0.899 361 HB2 TRP 43 HB2 TRP 43 12.828 1.179 0.582 362 HB3 TRP 43 HB3 TRP 43 11.269 0.408 0.337 363 HD1 TRP 43 HD1 TRP 43 13.664 1.496 3.057 364 HE1 TRP 43 HE1 TRP 43 12.535 1.315 5.356 365 HE3 TRP 43 HE3 TRP 43 9.392 -0.966 1.677 366 HZ2 TRP 43 HZ2 TRP 43 10.049 0.322 6.432 367 HZ3 TRP 43 HZ3 TRP 43 7.671 -1.550 3.366 368 HH2 TRP 43 HH2 TRP 43 7.984 -0.906 5.748 369 H THR 44 H THR 44 13.223 -2.173 2.696 370 HA THR 44 HA THR 44 10.794 -3.827 2.531 371 HB THR 44 HB THR 44 12.013 -5.820 3.272 372 HG1 THR 44 HG1 THR 44 14.275 -5.876 3.111 373 HG21 THR 44 HG21 THR 44 13.051 -6.510 1.191 374 HG22 THR 44 HG22 THR 44 11.638 -5.513 0.829 375 HG23 THR 44 HG23 THR 44 13.264 -4.820 0.673 376 H GLY 45 H GLY 45 9.938 -4.464 4.445 377 HA2 GLY 45 HA2 GLY 45 11.052 -4.073 7.030 378 HA3 GLY 45 HA3 GLY 45 10.259 -2.576 6.550 379 H ARG 46 H ARG 46 8.489 -2.466 7.611 380 HA ARG 46 HA ARG 46 6.628 -4.792 7.991 381 HB2 ARG 46 HB2 ARG 46 7.915 -4.229 10.014 382 HB3 ARG 46 HB3 ARG 46 7.375 -2.552 9.925 383 HG2 ARG 46 HG2 ARG 46 5.040 -3.249 10.342 384 HG3 ARG 46 HG3 ARG 46 5.538 -4.947 10.290 385 HD2 ARG 46 HD2 ARG 46 5.311 -4.427 12.567 386 HD3 ARG 46 HD3 ARG 46 7.045 -4.516 12.243 387 HE ARG 46 HE ARG 46 5.728 -1.823 12.191 388 HH11 ARG 46 HH11 ARG 46 6.217 -0.378 13.611 389 HH12 ARG 46 HH12 ARG 46 7.281 -0.711 14.982 390 HH21 ARG 46 HH21 ARG 46 7.755 -4.003 14.073 391 HH22 ARG 46 HH22 ARG 46 8.165 -2.743 15.202 392 H LEU 47 H LEU 47 4.489 -4.461 7.723 393 HA LEU 47 HA LEU 47 3.541 -1.907 6.521 394 HB2 LEU 47 HB2 LEU 47 2.891 -4.112 5.518 395 HB3 LEU 47 HB3 LEU 47 2.203 -4.561 7.073 396 HG LEU 47 HG LEU 47 0.632 -2.497 6.789 397 HD11 LEU 47 HD11 LEU 47 0.163 -1.852 4.504 398 HD12 LEU 47 HD12 LEU 47 1.821 -1.435 4.932 399 HD13 LEU 47 HD13 LEU 47 1.511 -2.854 3.908 400 HD21 LEU 47 HD21 LEU 47 -0.109 -4.821 6.710 401 HD22 LEU 47 HD22 LEU 47 -0.943 -3.864 5.492 402 HD23 LEU 47 HD23 LEU 47 0.382 -4.944 5.010 403 H ARG 48 H ARG 48 2.201 -0.456 7.619 404 HA ARG 48 HA ARG 48 0.735 -1.435 10.010 405 HB2 ARG 48 HB2 ARG 48 3.013 -0.141 10.505 406 HB3 ARG 48 HB3 ARG 48 2.090 1.288 10.102 407 HG2 ARG 48 HG2 ARG 48 1.939 1.086 12.442 408 HG3 ARG 48 HG3 ARG 48 0.373 0.486 11.880 409 HD2 ARG 48 HD2 ARG 48 1.103 -1.824 12.147 410 HD3 ARG 48 HD3 ARG 48 2.768 -1.334 12.449 411 HE ARG 48 HE ARG 48 0.546 -1.341 14.347 412 HH11 ARG 48 HH11 ARG 48 0.958 -0.917 16.484 413 HH12 ARG 48 HH12 ARG 48 2.463 -0.189 16.955 414 HH21 ARG 48 HH21 ARG 48 3.752 0.059 13.777 415 HH22 ARG 48 HH22 ARG 48 3.967 0.373 15.478 416 H ILE 49 H ILE 49 -1.273 -1.328 9.220 417 HA ILE 49 HA ILE 49 -2.154 1.102 7.714 418 HB ILE 49 HB ILE 49 -3.606 -1.525 8.053 419 HG12 ILE 49 HG12 ILE 49 -2.032 -0.351 5.708 420 HG13 ILE 49 HG13 ILE 49 -1.628 -1.799 6.632 421 HG21 ILE 49 HG21 ILE 49 -4.264 0.799 6.209 422 HG22 ILE 49 HG22 ILE 49 -5.212 -0.687 6.477 423 HG23 ILE 49 HG23 ILE 49 -5.088 0.502 7.753 424 HD11 ILE 49 HD11 ILE 49 -2.557 -2.476 4.539 425 HD12 ILE 49 HD12 ILE 49 -3.718 -2.885 5.806 426 HD13 ILE 49 HD13 ILE 49 -3.993 -1.469 4.748 427 H THR 50 H THR 50 -3.316 2.580 8.659 428 HA THR 50 HA THR 50 -4.781 2.052 11.208 429 HB THR 50 HB THR 50 -4.027 4.285 11.980 430 HG1 THR 50 HG1 THR 50 -2.472 5.375 10.825 431 HG21 THR 50 HG21 THR 50 -1.626 2.525 11.319 432 HG22 THR 50 HG22 THR 50 -1.740 3.760 12.590 433 HG23 THR 50 HG23 THR 50 -2.710 2.290 12.707 434 H SER 51 H SER 51 -6.355 3.952 11.662 435 HA SER 51 HA SER 51 -7.195 5.453 9.295 436 HB2 SER 51 HB2 SER 51 -9.528 4.644 9.389 437 HB3 SER 51 HB3 SER 51 -8.373 3.402 8.898 438 HG SER 51 HG SER 51 -8.387 2.795 11.228 439 H LYS 52 H LYS 52 -7.691 7.409 9.829 440 HA LYS 52 HA LYS 52 -8.881 8.094 12.482 441 HB2 LYS 52 HB2 LYS 52 -6.836 9.259 11.682 442 HB3 LYS 52 HB3 LYS 52 -7.787 9.916 10.330 443 HG2 LYS 52 HG2 LYS 52 -9.387 10.787 12.229 444 HG3 LYS 52 HG3 LYS 52 -8.008 10.487 13.288 445 HD2 LYS 52 HD2 LYS 52 -8.170 12.283 10.860 446 HD3 LYS 52 HD3 LYS 52 -7.964 12.789 12.564 447 HE2 LYS 52 HE2 LYS 52 -5.707 11.971 12.592 448 HE3 LYS 52 HE3 LYS 52 -5.891 11.196 11.012 449 HZ1 LYS 52 HZ1 LYS 52 -6.106 14.125 11.462 450 HZ2 LYS 52 HZ2 LYS 52 -4.754 13.384 10.893 451 HZ3 LYS 52 HZ3 LYS 52 -6.131 13.375 10.010 452 H GLY 53 H GLY 53 -10.776 7.024 11.941 453 HA2 GLY 53 HA2 GLY 53 -13.092 7.158 11.579 454 HA3 GLY 53 HA3 GLY 53 -12.869 8.738 10.828 455 H LYS 54 H LYS 54 -13.751 8.628 8.838 456 HA LYS 54 HA LYS 54 -13.770 6.264 7.134 457 HB2 LYS 54 HB2 LYS 54 -15.528 8.087 7.281 458 HB3 LYS 54 HB3 LYS 54 -14.427 9.172 6.450 459 HG2 LYS 54 HG2 LYS 54 -15.073 6.550 5.106 460 HG3 LYS 54 HG3 LYS 54 -16.388 7.708 5.298 461 HD2 LYS 54 HD2 LYS 54 -15.033 9.461 4.143 462 HD3 LYS 54 HD3 LYS 54 -13.809 8.232 3.784 463 HE2 LYS 54 HE2 LYS 54 -15.634 6.861 2.668 464 HE3 LYS 54 HE3 LYS 54 -16.736 8.228 2.900 465 HZ1 LYS 54 HZ1 LYS 54 -14.220 8.242 1.309 466 HZ2 LYS 54 HZ2 LYS 54 -15.735 8.344 0.705 467 HZ3 LYS 54 HZ3 LYS 54 -15.131 9.582 1.583 468 H THR 55 H THR 55 -11.216 8.139 7.827 469 HA THR 55 HA THR 55 -10.013 7.672 5.147 470 HB THR 55 HB THR 55 -8.845 9.297 7.422 471 HG1 THR 55 HG1 THR 55 -10.709 10.357 6.893 472 HG21 THR 55 HG21 THR 55 -8.500 9.113 4.395 473 HG22 THR 55 HG22 THR 55 -7.687 10.342 5.406 474 HG23 THR 55 HG23 THR 55 -7.314 8.615 5.615 475 H ALA 56 H ALA 56 -8.696 5.986 4.880 476 HA ALA 56 HA ALA 56 -7.345 4.726 7.214 477 HB1 ALA 56 HB1 ALA 56 -8.462 3.102 5.827 478 HB2 ALA 56 HB2 ALA 56 -7.700 3.744 4.362 479 HB3 ALA 56 HB3 ALA 56 -6.721 2.931 5.600 480 H TYR 57 H TYR 57 -5.070 4.374 7.113 481 HA TYR 57 HA TYR 57 -3.509 6.033 5.192 482 HB2 TYR 57 HB2 TYR 57 -3.110 5.935 8.198 483 HB3 TYR 57 HB3 TYR 57 -2.015 6.683 7.053 484 HD1 TYR 57 HD1 TYR 57 -2.431 8.906 6.199 485 HD2 TYR 57 HD2 TYR 57 -5.402 6.916 8.613 486 HE1 TYR 57 HE1 TYR 57 -3.711 11.033 6.392 487 HE2 TYR 57 HE2 TYR 57 -6.733 9.001 8.687 488 HH TYR 57 HH TYR 57 -5.596 12.056 7.208 489 H ILE 58 H ILE 58 -2.225 4.710 4.118 490 HA ILE 58 HA ILE 58 -1.334 2.111 5.274 491 HB ILE 58 HB ILE 58 -0.526 3.286 2.594 492 HG12 ILE 58 HG12 ILE 58 -2.942 3.221 2.496 493 HG13 ILE 58 HG13 ILE 58 -2.197 2.045 1.436 494 HG21 ILE 58 HG21 ILE 58 -0.513 0.490 3.780 495 HG22 ILE 58 HG22 ILE 58 -0.138 0.874 2.086 496 HG23 ILE 58 HG23 ILE 58 0.890 1.499 3.379 497 HD11 ILE 58 HD11 ILE 58 -3.433 1.381 4.137 498 HD12 ILE 58 HD12 ILE 58 -4.195 1.180 2.546 499 HD13 ILE 58 HD13 ILE 58 -2.765 0.218 2.964 500 H LYS 59 H LYS 59 0.147 2.595 6.894 501 HA LYS 59 HA LYS 59 2.454 4.363 6.181 502 HB2 LYS 59 HB2 LYS 59 1.736 3.259 8.907 503 HB3 LYS 59 HB3 LYS 59 2.999 4.418 8.519 504 HG2 LYS 59 HG2 LYS 59 1.193 5.995 7.677 505 HG3 LYS 59 HG3 LYS 59 -0.015 4.868 8.306 506 HD2 LYS 59 HD2 LYS 59 2.126 6.294 9.940 507 HD3 LYS 59 HD3 LYS 59 0.408 6.725 9.871 508 HE2 LYS 59 HE2 LYS 59 -0.246 4.620 10.866 509 HE3 LYS 59 HE3 LYS 59 1.427 4.029 10.847 510 HZ1 LYS 59 HZ1 LYS 59 1.996 5.883 12.363 511 HZ2 LYS 59 HZ2 LYS 59 0.417 6.335 12.430 512 HZ3 LYS 59 HZ3 LYS 59 0.885 4.889 13.032 513 H LEU 60 H LEU 60 4.523 3.640 6.298 514 HA LEU 60 HA LEU 60 4.953 0.671 6.436 515 HB2 LEU 60 HB2 LEU 60 6.097 2.733 4.509 516 HB3 LEU 60 HB3 LEU 60 6.679 1.077 4.648 517 HG LEU 60 HG LEU 60 3.823 1.811 3.849 518 HD11 LEU 60 HD11 LEU 60 6.199 0.970 2.164 519 HD12 LEU 60 HD12 LEU 60 4.533 1.168 1.573 520 HD13 LEU 60 HD13 LEU 60 5.433 2.574 2.166 521 HD21 LEU 60 HD21 LEU 60 3.736 -0.546 3.069 522 HD22 LEU 60 HD22 LEU 60 5.361 -0.827 3.735 523 HD23 LEU 60 HD23 LEU 60 4.000 -0.454 4.811 524 H GLU 61 H GLU 61 6.540 0.020 7.738 525 HA GLU 61 HA GLU 61 8.070 2.117 9.226 526 HB2 GLU 61 HB2 GLU 61 6.629 -0.331 10.300 527 HB3 GLU 61 HB3 GLU 61 7.613 0.792 11.244 528 HG2 GLU 61 HG2 GLU 61 6.046 2.644 10.592 529 HG3 GLU 61 HG3 GLU 61 5.005 1.446 9.810 530 H ASP 62 H ASP 62 10.130 1.604 10.040 531 HA ASP 62 HA ASP 62 11.608 -0.471 8.697 532 HB2 ASP 62 HB2 ASP 62 12.652 1.631 9.179 533 HB3 ASP 62 HB3 ASP 62 12.200 1.541 10.883 534 H LYS 63 H LYS 63 12.231 -2.415 9.414 535 HA LYS 63 HA LYS 63 10.585 -3.735 11.353 536 HB2 LYS 63 HB2 LYS 63 11.578 -4.590 9.159 537 HB3 LYS 63 HB3 LYS 63 13.099 -4.820 10.024 538 HG2 LYS 63 HG2 LYS 63 11.941 -6.406 11.568 539 HG3 LYS 63 HG3 LYS 63 10.422 -6.143 10.702 540 HD2 LYS 63 HD2 LYS 63 12.977 -7.256 9.454 541 HD3 LYS 63 HD3 LYS 63 11.667 -8.247 10.109 542 HE2 LYS 63 HE2 LYS 63 10.083 -7.276 8.471 543 HE3 LYS 63 HE3 LYS 63 11.381 -6.278 7.798 544 HZ1 LYS 63 HZ1 LYS 63 11.383 -9.245 7.841 545 HZ2 LYS 63 HZ2 LYS 63 11.068 -8.339 6.522 546 HZ3 LYS 63 HZ3 LYS 63 12.561 -8.313 7.191 547 H VAL 64 H VAL 64 13.404 -1.943 11.915 548 HA VAL 64 HA VAL 64 14.276 -3.544 14.278 549 HB VAL 64 HB VAL 64 15.829 -1.239 13.089 550 HG11 VAL 64 HG11 VAL 64 16.671 -3.819 14.466 551 HG12 VAL 64 HG12 VAL 64 17.749 -2.511 13.931 552 HG13 VAL 64 HG13 VAL 64 16.582 -2.211 15.220 553 HG21 VAL 64 HG21 VAL 64 15.865 -4.078 11.993 554 HG22 VAL 64 HG22 VAL 64 15.448 -2.583 11.112 555 HG23 VAL 64 HG23 VAL 64 17.099 -2.837 11.666 556 H SER 65 H SER 65 13.112 -0.388 13.243 557 HA SER 65 HA SER 65 13.210 0.555 16.072 558 HB2 SER 65 HB2 SER 65 13.713 2.785 15.107 559 HB3 SER 65 HB3 SER 65 14.930 1.573 14.666 560 HG SER 65 HG SER 65 13.954 1.362 12.640 561 H GLY 66 H GLY 66 11.054 0.050 13.436 562 HA2 GLY 66 HA2 GLY 66 8.857 0.594 13.115 563 HA3 GLY 66 HA3 GLY 66 8.804 1.402 14.688 564 H GLU 67 H GLU 67 11.374 2.591 12.686 565 HA GLU 67 HA GLU 67 10.165 5.207 12.586 566 HB2 GLU 67 HB2 GLU 67 12.691 4.044 11.386 567 HB3 GLU 67 HB3 GLU 67 12.201 5.704 11.069 568 HG2 GLU 67 HG2 GLU 67 12.455 4.663 13.906 569 HG3 GLU 67 HG3 GLU 67 13.840 5.283 13.008 570 H LEU 68 H LEU 68 9.426 6.438 10.893 571 HA LEU 68 HA LEU 68 7.858 4.913 9.014 572 HB2 LEU 68 HB2 LEU 68 7.118 7.022 10.208 573 HB3 LEU 68 HB3 LEU 68 8.203 7.927 9.153 574 HG LEU 68 HG LEU 68 6.885 6.897 7.170 575 HD11 LEU 68 HD11 LEU 68 5.710 5.103 8.425 576 HD12 LEU 68 HD12 LEU 68 4.902 6.327 9.422 577 HD13 LEU 68 HD13 LEU 68 4.562 6.222 7.682 578 HD21 LEU 68 HD21 LEU 68 5.113 8.549 7.314 579 HD22 LEU 68 HD22 LEU 68 5.396 8.747 9.069 580 HD23 LEU 68 HD23 LEU 68 6.635 9.242 7.891 581 H PHE 69 H PHE 69 8.329 4.272 7.050 582 HA PHE 69 HA PHE 69 10.540 5.414 5.423 583 HB2 PHE 69 HB2 PHE 69 10.439 3.066 5.431 584 HB3 PHE 69 HB3 PHE 69 8.698 3.037 5.199 585 HD1 PHE 69 HD1 PHE 69 8.052 2.223 3.139 586 HD2 PHE 69 HD2 PHE 69 11.621 4.623 3.369 587 HE1 PHE 69 HE1 PHE 69 8.319 2.045 0.700 588 HE2 PHE 69 HE2 PHE 69 11.880 4.467 0.916 589 HZ PHE 69 HZ PHE 69 10.211 3.185 -0.449 590 H ALA 70 H ALA 70 6.992 4.900 5.100 591 HA ALA 70 HA ALA 70 6.638 7.480 3.782 592 HB1 ALA 70 HB1 ALA 70 5.642 6.533 1.733 593 HB2 ALA 70 HB2 ALA 70 7.336 6.036 1.870 594 HB3 ALA 70 HB3 ALA 70 6.036 4.890 2.269 595 H GLN 71 H GLN 71 4.335 7.922 3.334 596 HA GLN 71 HA GLN 71 2.409 6.019 4.413 597 HB2 GLN 71 HB2 GLN 71 1.128 7.633 5.679 598 HB3 GLN 71 HB3 GLN 71 2.747 7.427 6.343 599 HG2 GLN 71 HG2 GLN 71 3.466 9.569 5.372 600 HG3 GLN 71 HG3 GLN 71 1.906 9.765 4.565 601 HE21 GLN 71 HE21 GLN 71 2.157 10.572 8.579 602 HE22 GLN 71 HE22 GLN 71 3.490 9.744 7.794 603 H ALA 72 H ALA 72 0.483 5.941 3.365 604 HA ALA 72 HA ALA 72 -0.077 7.963 1.233 605 HB1 ALA 72 HB1 ALA 72 -0.633 4.983 1.197 606 HB2 ALA 72 HB2 ALA 72 -1.189 6.137 -0.013 607 HB3 ALA 72 HB3 ALA 72 0.547 5.863 0.197 608 HA PRO 73 HA PRO 73 -3.934 8.088 3.744 609 HB2 PRO 73 HB2 PRO 73 -4.936 10.457 2.897 610 HB3 PRO 73 HB3 PRO 73 -3.523 10.356 3.989 611 HG2 PRO 73 HG2 PRO 73 -3.523 10.787 0.991 612 HG3 PRO 73 HG3 PRO 73 -2.587 11.660 2.240 613 HD2 PRO 73 HD2 PRO 73 -1.583 9.555 0.749 614 HD3 PRO 73 HD3 PRO 73 -1.020 9.937 2.405 615 H VAL 74 H VAL 74 -5.705 6.956 3.224 616 HA VAL 74 HA VAL 74 -6.724 6.868 0.407 617 HB VAL 74 HB VAL 74 -6.830 4.662 2.488 618 HG11 VAL 74 HG11 VAL 74 -7.684 3.257 0.709 619 HG12 VAL 74 HG12 VAL 74 -8.754 4.621 0.953 620 HG13 VAL 74 HG13 VAL 74 -7.640 4.628 -0.430 621 HG21 VAL 74 HG21 VAL 74 -4.517 4.929 1.630 622 HG22 VAL 74 HG22 VAL 74 -5.280 3.382 1.254 623 HG23 VAL 74 HG23 VAL 74 -5.140 4.611 -0.002 624 H GLU 75 H GLU 75 -8.706 7.712 0.165 625 HA GLU 75 HA GLU 75 -10.580 7.848 2.505 626 HB2 GLU 75 HB2 GLU 75 -10.255 9.655 0.074 627 HB3 GLU 75 HB3 GLU 75 -11.600 9.763 1.215 628 HG2 GLU 75 HG2 GLU 75 -10.069 10.245 3.060 629 HG3 GLU 75 HG3 GLU 75 -8.675 10.111 1.980 630 H GLN 76 H GLN 76 -10.087 6.059 -0.239 631 HA GLN 76 HA GLN 76 -12.758 5.046 -0.266 632 HB2 GLN 76 HB2 GLN 76 -13.353 5.512 -2.524 633 HB3 GLN 76 HB3 GLN 76 -12.978 7.048 -1.765 634 HG2 GLN 76 HG2 GLN 76 -11.224 5.525 -3.736 635 HG3 GLN 76 HG3 GLN 76 -12.192 6.941 -4.074 636 HE21 GLN 76 HE21 GLN 76 -8.491 7.419 -2.442 637 HE22 GLN 76 HE22 GLN 76 -9.228 5.802 -2.482 638 H TYR 77 H TYR 77 -12.800 2.953 -1.016 639 HA TYR 77 HA TYR 77 -10.434 1.911 -2.438 640 HB2 TYR 77 HB2 TYR 77 -10.426 1.375 0.033 641 HB3 TYR 77 HB3 TYR 77 -11.848 0.374 -0.232 642 HD1 TYR 77 HD1 TYR 77 -8.794 0.754 -2.360 643 HD2 TYR 77 HD2 TYR 77 -10.891 -1.803 0.386 644 HE1 TYR 77 HE1 TYR 77 -7.077 -0.947 -2.685 645 HE2 TYR 77 HE2 TYR 77 -9.226 -3.591 -0.052 646 HH TYR 77 HH TYR 77 -6.419 -3.109 -2.221 647 HA PRO 78 HA PRO 78 -9.839 0.646 -4.212 648 HB2 PRO 78 HB2 PRO 78 -10.182 0.677 -6.896 649 HB3 PRO 78 HB3 PRO 78 -10.327 -0.813 -5.916 650 HG2 PRO 78 HG2 PRO 78 -12.571 1.011 -6.857 651 HG3 PRO 78 HG3 PRO 78 -12.448 -0.772 -7.036 652 HD2 PRO 78 HD2 PRO 78 -13.845 0.351 -4.998 653 HD3 PRO 78 HD3 PRO 78 -12.872 -1.124 -4.734 654 H GLY 79 H GLY 79 -8.542 2.326 -5.248 655 HA2 GLY 79 HA2 GLY 79 -9.762 4.741 -6.339 656 HA3 GLY 79 HA3 GLY 79 -9.106 4.964 -4.718 657 H ILE 80 H ILE 80 -7.664 6.533 -5.706 658 HA ILE 80 HA ILE 80 -5.465 5.493 -7.383 659 HB ILE 80 HB ILE 80 -6.458 7.704 -7.864 660 HG12 ILE 80 HG12 ILE 80 -4.447 9.045 -8.109 661 HG13 ILE 80 HG13 ILE 80 -3.572 8.049 -6.953 662 HG21 ILE 80 HG21 ILE 80 -5.249 8.641 -5.218 663 HG22 ILE 80 HG22 ILE 80 -6.047 9.648 -6.433 664 HG23 ILE 80 HG23 ILE 80 -6.991 8.452 -5.544 665 HD11 ILE 80 HD11 ILE 80 -4.668 7.050 -9.619 666 HD12 ILE 80 HD12 ILE 80 -2.997 7.582 -9.333 667 HD13 ILE 80 HD13 ILE 80 -3.614 6.150 -8.496 668 H ALA 81 H ALA 81 -6.110 6.185 -3.999 669 HA ALA 81 HA ALA 81 -3.310 6.310 -3.296 670 HB1 ALA 81 HB1 ALA 81 -5.787 6.152 -1.565 671 HB2 ALA 81 HB2 ALA 81 -4.103 6.420 -1.009 672 HB3 ALA 81 HB3 ALA 81 -4.907 7.623 -2.050 673 H VAL 82 H VAL 82 -5.651 3.718 -3.484 674 HA VAL 82 HA VAL 82 -3.409 1.804 -3.191 675 HB VAL 82 HB VAL 82 -4.297 1.862 -1.004 676 HG11 VAL 82 HG11 VAL 82 -6.666 1.119 -0.556 677 HG12 VAL 82 HG12 VAL 82 -6.367 2.776 -1.098 678 HG13 VAL 82 HG13 VAL 82 -6.971 1.605 -2.236 679 HG21 VAL 82 HG21 VAL 82 -3.475 -0.215 -1.769 680 HG22 VAL 82 HG22 VAL 82 -4.877 -0.498 -0.722 681 HG23 VAL 82 HG23 VAL 82 -5.015 -0.666 -2.486 682 H GLU 83 H GLU 83 -3.462 0.395 -4.845 683 HA GLU 83 HA GLU 83 -6.006 -0.503 -6.111 684 HB2 GLU 83 HB2 GLU 83 -4.281 1.484 -7.232 685 HB3 GLU 83 HB3 GLU 83 -3.931 0.009 -8.119 686 HG2 GLU 83 HG2 GLU 83 -6.740 1.111 -7.685 687 HG3 GLU 83 HG3 GLU 83 -5.729 1.512 -9.071 688 H THR 84 H THR 84 -5.832 -2.458 -7.401 689 HA THR 84 HA THR 84 -3.475 -4.176 -6.657 690 HB THR 84 HB THR 84 -6.027 -5.278 -7.679 691 HG1 THR 84 HG1 THR 84 -6.286 -5.745 -5.248 692 HG21 THR 84 HG21 THR 84 -4.072 -6.687 -7.633 693 HG22 THR 84 HG22 THR 84 -3.835 -6.354 -5.896 694 HG23 THR 84 HG23 THR 84 -5.260 -7.257 -6.460 695 H VAL 85 H VAL 85 -2.388 -3.164 -8.157 696 HA VAL 85 HA VAL 85 -1.346 -2.987 -10.281 697 HB VAL 85 HB VAL 85 -0.471 -5.421 -10.604 698 HG11 VAL 85 HG11 VAL 85 1.035 -5.009 -8.679 699 HG12 VAL 85 HG12 VAL 85 0.714 -3.529 -9.572 700 HG13 VAL 85 HG13 VAL 85 -0.101 -3.826 -8.022 701 HG21 VAL 85 HG21 VAL 85 -2.357 -6.484 -9.195 702 HG22 VAL 85 HG22 VAL 85 -0.703 -6.928 -8.790 703 HG23 VAL 85 HG23 VAL 85 -1.575 -5.754 -7.791 704 H THR 86 H THR 86 -3.006 -6.049 -10.816 705 HA THR 86 HA THR 86 -4.621 -4.831 -12.889 706 HB THR 86 HB THR 86 -4.442 -6.988 -14.302 707 HG1 THR 86 HG1 THR 86 -2.498 -8.047 -14.174 708 HG21 THR 86 HG21 THR 86 -3.580 -4.788 -15.054 709 HG22 THR 86 HG22 THR 86 -2.066 -5.126 -14.192 710 HG23 THR 86 HG23 THR 86 -2.531 -6.126 -15.592 711 H ASP 87 H ASP 87 -3.839 -7.935 -11.399 712 HA ASP 87 HA ASP 87 -6.698 -8.266 -10.622 713 HB2 ASP 87 HB2 ASP 87 -6.245 -9.318 -12.872 714 HB3 ASP 87 HB3 ASP 87 -5.143 -10.429 -12.058 715 H SER 88 H SER 88 -3.801 -10.432 -10.439 716 HA SER 88 HA SER 88 -4.582 -11.350 -7.940 717 HB2 SER 88 HB2 SER 88 -2.864 -12.204 -9.668 718 HB3 SER 88 HB3 SER 88 -1.674 -11.452 -8.572 719 HG SER 88 HG SER 88 -2.542 -13.780 -8.178 720 H SER 89 H SER 89 -3.699 -11.365 -5.921 721 HA SER 89 HA SER 89 -2.266 -8.893 -5.061 722 HB2 SER 89 HB2 SER 89 -3.553 -8.952 -3.031 723 HB3 SER 89 HB3 SER 89 -4.568 -8.846 -4.485 724 HG SER 89 HG SER 89 -3.999 -11.200 -2.973 725 H ARG 90 H ARG 90 -0.456 -10.534 -5.737 726 HA ARG 90 HA ARG 90 0.654 -10.894 -2.973 727 HB2 ARG 90 HB2 ARG 90 1.553 -12.420 -4.829 728 HB3 ARG 90 HB3 ARG 90 2.291 -10.977 -5.537 729 HG2 ARG 90 HG2 ARG 90 3.560 -10.618 -3.412 730 HG3 ARG 90 HG3 ARG 90 2.720 -11.992 -2.686 731 HD2 ARG 90 HD2 ARG 90 4.799 -12.866 -3.264 732 HD3 ARG 90 HD3 ARG 90 3.749 -13.424 -4.554 733 HE ARG 90 HE ARG 90 4.845 -11.990 -6.087 734 HH11 ARG 90 HH11 ARG 90 6.619 -10.986 -6.819 735 HH12 ARG 90 HH12 ARG 90 7.831 -10.379 -5.744 736 HH21 ARG 90 HH21 ARG 90 6.094 -11.225 -2.884 737 HH22 ARG 90 HH22 ARG 90 7.564 -10.560 -3.555 738 H TYR 91 H TYR 91 0.004 -8.673 -5.523 739 HA TYR 91 HA TYR 91 1.795 -6.630 -4.322 740 HB2 TYR 91 HB2 TYR 91 0.773 -6.670 -7.157 741 HB3 TYR 91 HB3 TYR 91 2.104 -5.722 -6.524 742 HD1 TYR 91 HD1 TYR 91 1.102 -8.710 -8.206 743 HD2 TYR 91 HD2 TYR 91 4.209 -6.982 -5.767 744 HE1 TYR 91 HE1 TYR 91 2.650 -10.459 -8.999 745 HE2 TYR 91 HE2 TYR 91 5.791 -8.747 -6.538 746 HH TYR 91 HH TYR 91 4.765 -11.376 -8.742 747 H PHE 92 H PHE 92 1.284 -4.475 -4.596 748 HA PHE 92 HA PHE 92 -1.401 -3.652 -5.450 749 HB2 PHE 92 HB2 PHE 92 -0.274 -2.865 -2.728 750 HB3 PHE 92 HB3 PHE 92 -1.707 -2.167 -3.476 751 HD1 PHE 92 HD1 PHE 92 -3.749 -3.568 -3.893 752 HD2 PHE 92 HD2 PHE 92 -0.354 -5.028 -1.670 753 HE1 PHE 92 HE1 PHE 92 -5.116 -5.464 -3.060 754 HE2 PHE 92 HE2 PHE 92 -1.734 -6.894 -0.813 755 HZ PHE 92 HZ PHE 92 -4.110 -7.150 -1.549 756 H VAL 93 H VAL 93 -1.443 -1.209 -5.508 757 HA VAL 93 HA VAL 93 1.218 0.111 -5.620 758 HB VAL 93 HB VAL 93 -1.087 0.558 -7.560 759 HG11 VAL 93 HG11 VAL 93 -0.225 2.749 -6.944 760 HG12 VAL 93 HG12 VAL 93 1.454 2.186 -7.136 761 HG13 VAL 93 HG13 VAL 93 0.376 2.322 -8.534 762 HG21 VAL 93 HG21 VAL 93 0.339 -1.295 -8.233 763 HG22 VAL 93 HG22 VAL 93 0.715 0.100 -9.249 764 HG23 VAL 93 HG23 VAL 93 1.804 -0.340 -7.929 765 H ILE 94 H ILE 94 1.284 1.978 -4.427 766 HA ILE 94 HA ILE 94 -1.288 3.176 -3.617 767 HB ILE 94 HB ILE 94 -0.631 3.565 -1.329 768 HG12 ILE 94 HG12 ILE 94 1.884 1.902 -1.868 769 HG13 ILE 94 HG13 ILE 94 1.872 3.659 -1.775 770 HG21 ILE 94 HG21 ILE 94 -1.784 1.418 -1.913 771 HG22 ILE 94 HG22 ILE 94 -0.216 0.594 -1.907 772 HG23 ILE 94 HG23 ILE 94 -0.854 1.343 -0.433 773 HD11 ILE 94 HD11 ILE 94 0.965 3.533 0.538 774 HD12 ILE 94 HD12 ILE 94 1.110 1.776 0.469 775 HD13 ILE 94 HD13 ILE 94 2.565 2.784 0.368 776 H ARG 95 H ARG 95 -1.300 5.347 -3.250 777 HA ARG 95 HA ARG 95 0.967 6.920 -4.427 778 HB2 ARG 95 HB2 ARG 95 -1.235 7.219 -5.439 779 HB3 ARG 95 HB3 ARG 95 -1.921 7.710 -3.905 780 HG2 ARG 95 HG2 ARG 95 0.368 9.262 -5.174 781 HG3 ARG 95 HG3 ARG 95 -1.328 9.529 -5.603 782 HD2 ARG 95 HD2 ARG 95 -1.805 9.839 -3.112 783 HD3 ARG 95 HD3 ARG 95 -0.058 9.895 -2.884 784 HE ARG 95 HE ARG 95 0.029 12.029 -3.679 785 HH11 ARG 95 HH11 ARG 95 -0.624 13.908 -4.364 786 HH12 ARG 95 HH12 ARG 95 -2.241 14.159 -4.992 787 HH21 ARG 95 HH21 ARG 95 -3.161 10.857 -4.580 788 HH22 ARG 95 HH22 ARG 95 -3.656 12.440 -5.114 789 H ILE 96 H ILE 96 2.437 7.221 -2.893 790 HA ILE 96 HA ILE 96 1.663 7.937 -0.118 791 HB ILE 96 HB ILE 96 4.058 7.851 0.384 792 HG12 ILE 96 HG12 ILE 96 4.558 6.679 -2.372 793 HG13 ILE 96 HG13 ILE 96 4.787 8.402 -2.030 794 HG21 ILE 96 HG21 ILE 96 2.970 5.348 -0.946 795 HG22 ILE 96 HG22 ILE 96 4.315 5.375 0.190 796 HG23 ILE 96 HG23 ILE 96 2.716 5.852 0.741 797 HD11 ILE 96 HD11 ILE 96 6.381 7.848 -0.237 798 HD12 ILE 96 HD12 ILE 96 6.248 6.126 -0.672 799 HD13 ILE 96 HD13 ILE 96 6.902 7.286 -1.843 800 H GLN 97 H GLN 97 2.712 9.783 0.917 801 HA GLN 97 HA GLN 97 3.512 11.960 -0.972 802 HB2 GLN 97 HB2 GLN 97 2.555 12.143 1.890 803 HB3 GLN 97 HB3 GLN 97 3.520 13.399 1.111 804 HG2 GLN 97 HG2 GLN 97 1.698 13.139 -0.841 805 HG3 GLN 97 HG3 GLN 97 0.701 12.537 0.488 806 HE21 GLN 97 HE21 GLN 97 1.956 16.486 0.402 807 HE22 GLN 97 HE22 GLN 97 2.879 15.244 -0.458 808 H ASP 98 H ASP 98 5.499 12.925 -0.851 809 HA ASP 98 HA ASP 98 7.610 11.225 0.333 810 HB2 ASP 98 HB2 ASP 98 7.646 12.145 -2.022 811 HB3 ASP 98 HB3 ASP 98 7.857 13.746 -1.306 812 H GLY 99 H GLY 99 5.722 13.652 1.529 813 HA2 GLY 99 HA2 GLY 99 5.782 14.676 3.605 814 HA3 GLY 99 HA3 GLY 99 7.388 14.003 3.879 815 H THR 100 H THR 100 7.215 15.829 1.001 816 HA THR 100 HA THR 100 8.154 18.339 2.302 817 HB THR 100 HB THR 100 10.053 16.940 1.716 818 HG1 THR 100 HG1 THR 100 11.203 18.611 0.798 819 HG21 THR 100 HG21 THR 100 10.780 16.732 -0.594 820 HG22 THR 100 HG22 THR 100 9.223 15.925 -0.350 821 HG23 THR 100 HG23 THR 100 9.284 17.508 -1.163 822 H GLY 101 H GLY 101 5.574 17.688 1.238 823 HA2 GLY 101 HA2 GLY 101 3.928 19.105 0.385 824 HA3 GLY 101 HA3 GLY 101 5.154 20.091 -0.414 825 H ARG 102 H ARG 102 5.304 16.656 -0.906 826 HA ARG 102 HA ARG 102 4.006 16.782 -3.574 827 HB2 ARG 102 HB2 ARG 102 5.969 16.194 -4.741 828 HB3 ARG 102 HB3 ARG 102 6.368 17.569 -3.689 829 HG2 ARG 102 HG2 ARG 102 7.440 15.970 -2.093 830 HG3 ARG 102 HG3 ARG 102 7.134 14.661 -3.265 831 HD2 ARG 102 HD2 ARG 102 8.459 15.858 -4.967 832 HD3 ARG 102 HD3 ARG 102 8.755 17.180 -3.818 833 HE ARG 102 HE ARG 102 9.635 14.716 -2.636 834 HH11 ARG 102 HH11 ARG 102 11.608 14.183 -2.427 835 HH12 ARG 102 HH12 ARG 102 12.903 14.882 -3.407 836 HH21 ARG 102 HH21 ARG 102 10.703 16.890 -5.185 837 HH22 ARG 102 HH22 ARG 102 12.367 16.418 -4.966 838 H SER 103 H SER 103 4.248 14.662 -4.747 839 HA SER 103 HA SER 103 3.593 12.396 -2.912 840 HB2 SER 103 HB2 SER 103 2.200 13.209 -5.491 841 HB3 SER 103 HB3 SER 103 1.853 11.750 -4.552 842 HG SER 103 HG SER 103 1.643 14.427 -3.579 843 H ALA 104 H ALA 104 3.760 10.259 -3.803 844 HA ALA 104 HA ALA 104 5.099 9.870 -6.390 845 HB1 ALA 104 HB1 ALA 104 7.015 10.109 -4.854 846 HB2 ALA 104 HB2 ALA 104 6.336 8.858 -3.792 847 HB3 ALA 104 HB3 ALA 104 6.872 8.439 -5.432 848 H PHE 105 H PHE 105 4.733 7.856 -7.309 849 HA PHE 105 HA PHE 105 2.813 6.065 -5.896 850 HB2 PHE 105 HB2 PHE 105 3.633 6.026 -8.809 851 HB3 PHE 105 HB3 PHE 105 2.347 5.101 -8.046 852 HD1 PHE 105 HD1 PHE 105 0.284 6.318 -7.148 853 HD2 PHE 105 HD2 PHE 105 3.308 8.312 -9.492 854 HE1 PHE 105 HE1 PHE 105 -1.292 8.169 -7.625 855 HE2 PHE 105 HE2 PHE 105 1.762 10.200 -9.883 856 HZ PHE 105 HZ PHE 105 -0.563 10.128 -8.954 857 H ILE 106 H ILE 106 3.431 4.195 -5.091 858 HA ILE 106 HA ILE 106 5.816 2.815 -6.229 859 HB ILE 106 HB ILE 106 6.549 1.923 -4.151 860 HG12 ILE 106 HG12 ILE 106 4.190 3.504 -2.947 861 HG13 ILE 106 HG13 ILE 106 4.409 1.756 -2.920 862 HG21 ILE 106 HG21 ILE 106 6.228 4.934 -3.743 863 HG22 ILE 106 HG22 ILE 106 7.546 3.881 -3.181 864 HG23 ILE 106 HG23 ILE 106 7.350 4.207 -4.904 865 HD11 ILE 106 HD11 ILE 106 6.224 1.960 -1.322 866 HD12 ILE 106 HD12 ILE 106 6.096 3.737 -1.353 867 HD13 ILE 106 HD13 ILE 106 4.765 2.752 -0.735 868 H GLY 107 H GLY 107 5.654 0.733 -6.531 869 HA2 GLY 107 HA2 GLY 107 3.141 -0.752 -6.153 870 HA3 GLY 107 HA3 GLY 107 4.621 -1.334 -6.918 871 H ILE 108 H ILE 108 3.100 -2.563 -4.804 872 HA ILE 108 HA ILE 108 5.252 -2.816 -2.764 873 HB ILE 108 HB ILE 108 2.260 -3.118 -2.198 874 HG12 ILE 108 HG12 ILE 108 4.247 -0.865 -1.662 875 HG13 ILE 108 HG13 ILE 108 2.697 -0.767 -2.494 876 HG21 ILE 108 HG21 ILE 108 4.698 -3.182 -0.386 877 HG22 ILE 108 HG22 ILE 108 3.004 -3.390 0.133 878 HG23 ILE 108 HG23 ILE 108 3.747 -4.611 -0.864 879 HD11 ILE 108 HD11 ILE 108 1.536 -1.225 -0.331 880 HD12 ILE 108 HD12 ILE 108 3.128 -1.182 0.489 881 HD13 ILE 108 HD13 ILE 108 2.538 0.249 -0.327 882 H GLY 109 H GLY 109 5.747 -5.004 -2.230 883 HA2 GLY 109 HA2 GLY 109 4.116 -7.190 -3.445 884 HA3 GLY 109 HA3 GLY 109 5.870 -7.210 -3.612 885 H PHE 110 H PHE 110 3.506 -8.603 -1.972 886 HA PHE 110 HA PHE 110 4.771 -8.655 0.706 887 HB2 PHE 110 HB2 PHE 110 2.187 -9.707 -0.442 888 HB3 PHE 110 HB3 PHE 110 2.759 -10.214 1.130 889 HD1 PHE 110 HD1 PHE 110 2.538 -8.900 3.062 890 HD2 PHE 110 HD2 PHE 110 1.848 -7.112 -0.803 891 HE1 PHE 110 HE1 PHE 110 1.583 -6.906 4.159 892 HE2 PHE 110 HE2 PHE 110 0.964 -5.071 0.310 893 HZ PHE 110 HZ PHE 110 0.848 -4.959 2.778 894 H THR 111 H THR 111 5.129 -10.629 1.829 895 HA THR 111 HA THR 111 6.773 -12.470 0.298 896 HB THR 111 HB THR 111 7.221 -11.496 2.549 897 HG1 THR 111 HG1 THR 111 8.346 -13.319 3.163 898 HG21 THR 111 HG21 THR 111 5.425 -13.735 3.560 899 HG22 THR 111 HG22 THR 111 6.454 -12.675 4.540 900 HG23 THR 111 HG23 THR 111 5.073 -11.996 3.666 901 H ASP 112 H ASP 112 3.509 -12.472 1.394 902 HA ASP 112 HA ASP 112 3.068 -15.169 0.233 903 HB2 ASP 112 HB2 ASP 112 3.259 -15.144 2.831 904 HB3 ASP 112 HB3 ASP 112 1.694 -14.322 2.802 905 H ARG 113 H ARG 113 1.046 -15.515 -0.722 906 HA ARG 113 HA ARG 113 -0.499 -13.280 -1.710 907 HB2 ARG 113 HB2 ARG 113 -0.989 -16.292 -1.534 908 HB3 ARG 113 HB3 ARG 113 -2.191 -15.203 -2.212 909 HG2 ARG 113 HG2 ARG 113 0.651 -15.409 -3.292 910 HG3 ARG 113 HG3 ARG 113 -0.722 -16.346 -3.903 911 HD2 ARG 113 HD2 ARG 113 -1.939 -14.233 -4.429 912 HD3 ARG 113 HD3 ARG 113 -0.586 -13.310 -3.815 913 HE ARG 113 HE ARG 113 0.677 -13.789 -5.730 914 HH11 ARG 113 HH11 ARG 113 0.915 -14.281 -7.903 915 HH12 ARG 113 HH12 ARG 113 -0.271 -15.280 -8.703 916 HH21 ARG 113 HH21 ARG 113 -2.252 -15.701 -5.951 917 HH22 ARG 113 HH22 ARG 113 -2.012 -15.975 -7.674 918 H GLY 114 H GLY 114 -0.922 -15.342 1.160 919 HA2 GLY 114 HA2 GLY 114 -3.535 -14.305 1.880 920 HA3 GLY 114 HA3 GLY 114 -2.391 -15.160 2.927 921 H ASP 115 H ASP 115 -0.169 -13.276 2.581 922 HA ASP 115 HA ASP 115 -0.940 -11.325 4.578 923 HB2 ASP 115 HB2 ASP 115 1.631 -11.674 3.023 924 HB3 ASP 115 HB3 ASP 115 1.371 -10.455 4.273 925 H ALA 116 H ALA 116 -0.380 -11.110 1.057 926 HA ALA 116 HA ALA 116 -1.063 -8.281 0.966 927 HB1 ALA 116 HB1 ALA 116 -1.445 -8.977 -1.544 928 HB2 ALA 116 HB2 ALA 116 0.174 -8.891 -0.869 929 HB3 ALA 116 HB3 ALA 116 -0.616 -10.474 -1.031 930 H PHE 117 H PHE 117 -3.044 -11.299 0.217 931 HA PHE 117 HA PHE 117 -5.420 -9.881 -0.226 932 HB2 PHE 117 HB2 PHE 117 -5.008 -12.354 -0.498 933 HB3 PHE 117 HB3 PHE 117 -5.292 -12.534 1.232 934 HD1 PHE 117 HD1 PHE 117 -7.575 -12.664 2.044 935 HD2 PHE 117 HD2 PHE 117 -6.794 -11.285 -1.963 936 HE1 PHE 117 HE1 PHE 117 -10.006 -12.767 1.530 937 HE2 PHE 117 HE2 PHE 117 -9.218 -11.439 -2.496 938 HZ PHE 117 HZ PHE 117 -10.829 -12.173 -0.742 939 H ASP 118 H ASP 118 -3.895 -10.391 2.952 940 HA ASP 118 HA ASP 118 -6.195 -9.415 4.472 941 HB2 ASP 118 HB2 ASP 118 -3.270 -9.877 5.128 942 HB3 ASP 118 HB3 ASP 118 -4.391 -9.151 6.272 943 H PHE 119 H PHE 119 -3.355 -7.891 2.911 944 HA PHE 119 HA PHE 119 -3.760 -5.282 4.029 945 HB2 PHE 119 HB2 PHE 119 -1.670 -5.802 3.002 946 HB3 PHE 119 HB3 PHE 119 -2.414 -6.283 1.502 947 HD1 PHE 119 HD1 PHE 119 -3.586 -4.543 0.046 948 HD2 PHE 119 HD2 PHE 119 -0.878 -3.564 3.214 949 HE1 PHE 119 HE1 PHE 119 -3.263 -2.277 -0.932 950 HE2 PHE 119 HE2 PHE 119 -0.591 -1.298 2.288 951 HZ PHE 119 HZ PHE 119 -1.789 -0.639 0.208 952 H ASN 120 H ASN 120 -5.257 -7.038 1.323 953 HA ASN 120 HA ASN 120 -6.986 -4.825 0.536 954 HB2 ASN 120 HB2 ASN 120 -6.670 -6.356 -1.164 955 HB3 ASN 120 HB3 ASN 120 -6.825 -7.757 -0.113 956 HD21 ASN 120 HD21 ASN 120 -10.226 -8.149 -0.765 957 HD22 ASN 120 HD22 ASN 120 -8.746 -8.806 -0.108 958 H VAL 121 H VAL 121 -7.714 -7.822 2.479 959 HA VAL 121 HA VAL 121 -10.385 -7.026 2.963 960 HB VAL 121 HB VAL 121 -8.595 -8.962 4.461 961 HG11 VAL 121 HG11 VAL 121 -11.606 -8.577 4.766 962 HG12 VAL 121 HG12 VAL 121 -10.689 -9.976 5.367 963 HG13 VAL 121 HG13 VAL 121 -10.374 -8.378 6.035 964 HG21 VAL 121 HG21 VAL 121 -9.895 -10.660 3.234 965 HG22 VAL 121 HG22 VAL 121 -10.890 -9.392 2.482 966 HG23 VAL 121 HG23 VAL 121 -9.170 -9.536 2.086 967 H SER 122 H SER 122 -7.522 -6.236 4.935 968 HA SER 122 HA SER 122 -8.965 -5.061 7.120 969 HB2 SER 122 HB2 SER 122 -6.854 -3.792 7.536 970 HB3 SER 122 HB3 SER 122 -6.647 -5.550 7.416 971 HG SER 122 HG SER 122 -5.765 -5.334 5.434 972 H LEU 123 H LEU 123 -8.363 -3.830 3.887 973 HA LEU 123 HA LEU 123 -9.389 -1.134 4.601 974 HB2 LEU 123 HB2 LEU 123 -8.459 -2.299 1.970 975 HB3 LEU 123 HB3 LEU 123 -8.956 -0.625 2.219 976 HG LEU 123 HG LEU 123 -6.592 -1.985 3.563 977 HD11 LEU 123 HD11 LEU 123 -6.377 -1.661 1.089 978 HD12 LEU 123 HD12 LEU 123 -6.574 0.087 1.362 979 HD13 LEU 123 HD13 LEU 123 -5.184 -0.793 2.049 980 HD21 LEU 123 HD21 LEU 123 -5.910 0.332 4.172 981 HD22 LEU 123 HD22 LEU 123 -7.452 0.941 3.534 982 HD23 LEU 123 HD23 LEU 123 -7.422 -0.135 4.949 983 H GLN 124 H GLN 124 -10.407 -4.059 2.749 984 HA GLN 124 HA GLN 124 -12.863 -3.009 1.776 985 HB2 GLN 124 HB2 GLN 124 -12.238 -5.847 2.683 986 HB3 GLN 124 HB3 GLN 124 -13.685 -5.383 1.807 987 HG2 GLN 124 HG2 GLN 124 -10.858 -5.077 0.740 988 HG3 GLN 124 HG3 GLN 124 -11.928 -6.415 0.377 989 HE21 GLN 124 HE21 GLN 124 -12.104 -4.050 -2.470 990 HE22 GLN 124 HE22 GLN 124 -10.848 -5.020 -1.686 991 H ASP 125 H ASP 125 -12.299 -4.756 4.902 992 HA ASP 125 HA ASP 125 -15.024 -4.238 5.797 993 HB2 ASP 125 HB2 ASP 125 -13.515 -6.193 6.429 994 HB3 ASP 125 HB3 ASP 125 -12.591 -5.058 7.429 995 H HIS 126 H HIS 126 -12.374 -2.174 5.617 996 HA HIS 126 HA HIS 126 -13.233 -0.444 7.882 997 HB2 HIS 126 HB2 HIS 126 -10.866 -0.515 7.586 998 HB3 HIS 126 HB3 HIS 126 -11.001 -0.163 5.860 999 HD2 HIS 126 HD2 HIS 126 -11.971 1.621 9.216 1000 HE1 HIS 126 HE1 HIS 126 -10.960 4.630 6.370 1001 HE2 HIS 126 HE2 HIS 126 -11.721 4.212 8.753 1002 H PHE 127 H PHE 127 -13.277 -0.531 4.296 1003 HA PHE 127 HA PHE 127 -14.921 1.890 4.253 1004 HB2 PHE 127 HB2 PHE 127 -13.689 0.192 2.097 1005 HB3 PHE 127 HB3 PHE 127 -14.830 1.481 1.749 1006 HD1 PHE 127 HD1 PHE 127 -11.364 0.773 2.358 1007 HD2 PHE 127 HD2 PHE 127 -14.349 3.858 2.760 1008 HE1 PHE 127 HE1 PHE 127 -9.578 2.476 2.578 1009 HE2 PHE 127 HE2 PHE 127 -12.555 5.555 2.976 1010 HZ PHE 127 HZ PHE 127 -10.177 4.865 2.904 1011 H LYS 128 H LYS 128 -15.679 -1.505 4.341 1012 HA LYS 128 HA LYS 128 -18.030 -1.537 2.862 1013 HB2 LYS 128 HB2 LYS 128 -18.562 -3.605 3.782 1014 HB3 LYS 128 HB3 LYS 128 -16.829 -3.514 3.698 1015 HG2 LYS 128 HG2 LYS 128 -17.061 -4.471 5.747 1016 HG3 LYS 128 HG3 LYS 128 -17.041 -2.771 6.259 1017 HD2 LYS 128 HD2 LYS 128 -19.614 -2.930 6.138 1018 HD3 LYS 128 HD3 LYS 128 -19.393 -4.658 5.859 1019 HE2 LYS 128 HE2 LYS 128 -18.311 -3.196 8.295 1020 HE3 LYS 128 HE3 LYS 128 -19.949 -3.850 8.230 1021 HZ1 LYS 128 HZ1 LYS 128 -18.473 -5.450 9.244 1022 HZ2 LYS 128 HZ2 LYS 128 -18.966 -6.061 7.812 1023 HZ3 LYS 128 HZ3 LYS 128 -17.452 -5.447 7.977 1024 H TRP 129 H TRP 129 -17.706 -0.200 6.056 1025 HA TRP 129 HA TRP 129 -20.662 0.050 6.366 1026 HB2 TRP 129 HB2 TRP 129 -20.125 0.550 8.715 1027 HB3 TRP 129 HB3 TRP 129 -19.604 -1.031 8.176 1028 HD1 TRP 129 HD1 TRP 129 -16.991 -1.569 8.186 1029 HE1 TRP 129 HE1 TRP 129 -14.957 -0.384 9.057 1030 HE3 TRP 129 HE3 TRP 129 -19.095 2.985 9.165 1031 HZ2 TRP 129 HZ2 TRP 129 -14.229 2.294 9.966 1032 HZ3 TRP 129 HZ3 TRP 129 -17.667 4.894 9.917 1033 HH2 TRP 129 HH2 TRP 129 -15.235 4.559 10.287 1034 H VAL 130 H VAL 130 -18.554 1.814 4.777 1035 HA VAL 130 HA VAL 130 -19.754 4.455 5.466 1036 HB VAL 130 HB VAL 130 -17.053 4.915 4.573 1037 HG11 VAL 130 HG11 VAL 130 -18.433 6.420 5.970 1038 HG12 VAL 130 HG12 VAL 130 -18.463 5.215 7.274 1039 HG13 VAL 130 HG13 VAL 130 -16.943 6.004 6.847 1040 HG21 VAL 130 HG21 VAL 130 -16.994 3.161 7.014 1041 HG22 VAL 130 HG22 VAL 130 -16.439 2.693 5.411 1042 HG23 VAL 130 HG23 VAL 130 -15.653 4.032 6.258 1043 H LYS 131 H LYS 131 -18.509 5.978 3.522 1044 HA LYS 131 HA LYS 131 -18.291 6.446 1.275 1045 HB2 LYS 131 HB2 LYS 131 -16.583 4.653 1.984 1046 HB3 LYS 131 HB3 LYS 131 -17.599 3.507 1.140 1047 HG2 LYS 131 HG2 LYS 131 -17.191 5.190 -0.936 1048 HG3 LYS 131 HG3 LYS 131 -15.847 5.733 0.078 1049 HD2 LYS 131 HD2 LYS 131 -14.924 3.975 -1.245 1050 HD3 LYS 131 HD3 LYS 131 -15.250 3.254 0.354 1051 HE2 LYS 131 HE2 LYS 131 -17.568 2.598 -0.671 1052 HE3 LYS 131 HE3 LYS 131 -16.874 3.004 -2.233 1053 HZ1 LYS 131 HZ1 LYS 131 -15.239 1.230 -1.914 1054 HZ2 LYS 131 HZ2 LYS 131 -15.774 0.945 -0.389 1055 HZ3 LYS 131 HZ3 LYS 131 -16.761 0.636 -1.640 1056 H GLN 132 H GLN 132 -20.926 5.748 2.039 1057 HA GLN 132 HA GLN 132 -22.978 5.306 1.273 1058 HB2 GLN 132 HB2 GLN 132 -22.006 6.174 -1.461 1059 HB3 GLN 132 HB3 GLN 132 -23.604 6.344 -0.748 1060 HG2 GLN 132 HG2 GLN 132 -22.824 8.496 -0.462 1061 HG3 GLN 132 HG3 GLN 132 -22.391 7.791 1.092 1062 HE21 GLN 132 HE21 GLN 132 -19.217 9.283 0.512 1063 HE22 GLN 132 HE22 GLN 132 -20.664 9.262 1.509 1064 H GLU 133 H GLU 133 -21.351 2.990 1.366 1065 HA GLU 133 HA GLU 133 -22.296 1.209 -0.729 1066 HB2 GLU 133 HB2 GLU 133 -21.051 0.691 1.992 1067 HB3 GLU 133 HB3 GLU 133 -21.432 -0.585 0.848 1068 HG2 GLU 133 HG2 GLU 133 -19.527 1.715 0.211 1069 HG3 GLU 133 HG3 GLU 133 -19.023 0.207 0.954 1070 H1 SER 149 H1 SER 149 15.174 -23.100 -9.246 1071 H2 SER 149 H2 SER 149 14.029 -24.269 -9.376 1072 H3 SER 149 H3 SER 149 13.736 -22.931 -8.477 1073 HA SER 149 HA SER 149 14.158 -22.965 -11.387 1074 HB2 SER 149 HB2 SER 149 11.547 -22.598 -9.866 1075 HB3 SER 149 HB3 SER 149 11.766 -22.549 -11.629 1076 HG SER 149 HG SER 149 11.077 -24.616 -10.902 1077 H GLN 150 H GLN 150 13.813 -20.952 -12.463 1078 HA GLN 150 HA GLN 150 14.209 -18.537 -10.736 1079 HB2 GLN 150 HB2 GLN 150 15.320 -19.171 -13.492 1080 HB3 GLN 150 HB3 GLN 150 15.538 -17.646 -12.621 1081 HG2 GLN 150 HG2 GLN 150 16.670 -18.865 -10.767 1082 HG3 GLN 150 HG3 GLN 150 16.548 -20.365 -11.690 1083 HE21 GLN 150 HE21 GLN 150 19.951 -19.120 -12.345 1084 HE22 GLN 150 HE22 GLN 150 19.054 -19.797 -10.992 1085 H ILE 151 H ILE 151 11.644 -19.754 -12.078 1086 HA ILE 151 HA ILE 151 10.766 -17.758 -13.988 1087 HB ILE 151 HB ILE 151 9.176 -19.815 -12.409 1088 HG12 ILE 151 HG12 ILE 151 10.241 -19.902 -15.275 1089 HG13 ILE 151 HG13 ILE 151 10.929 -20.787 -13.918 1090 HG21 ILE 151 HG21 ILE 151 7.398 -19.453 -14.101 1091 HG22 ILE 151 HG22 ILE 151 7.722 -17.973 -13.228 1092 HG23 ILE 151 HG23 ILE 151 8.374 -18.184 -14.869 1093 HD11 ILE 151 HD11 ILE 151 9.612 -22.325 -15.158 1094 HD12 ILE 151 HD12 ILE 151 8.755 -22.009 -13.637 1095 HD13 ILE 151 HD13 ILE 151 8.202 -21.261 -15.158 1096 H THR 152 H THR 152 9.834 -15.824 -13.655 1097 HA THR 152 HA THR 152 9.603 -14.773 -10.942 1098 HB THR 152 HB THR 152 8.991 -12.638 -12.277 1099 HG1 THR 152 HG1 THR 152 8.643 -13.217 -14.265 1100 HG21 THR 152 HG21 THR 152 11.727 -13.932 -12.577 1101 HG22 THR 152 HG22 THR 152 11.355 -12.201 -12.767 1102 HG23 THR 152 HG23 THR 152 11.151 -12.977 -11.189 1103 H SER 153 H SER 153 7.850 -13.745 -10.027 1104 HA SER 153 HA SER 153 5.445 -15.347 -10.387 1105 HB2 SER 153 HB2 SER 153 6.204 -13.407 -8.207 1106 HB3 SER 153 HB3 SER 153 4.889 -14.597 -8.164 1107 HG SER 153 HG SER 153 6.449 -16.255 -8.261 1108 H GLN 154 H GLN 154 5.199 -13.925 -12.398 1109 HA GLN 154 HA GLN 154 4.195 -11.381 -12.611 1110 HB2 GLN 154 HB2 GLN 154 2.889 -13.718 -14.031 1111 HB3 GLN 154 HB3 GLN 154 2.986 -12.053 -14.573 1112 HG2 GLN 154 HG2 GLN 154 5.171 -14.143 -14.496 1113 HG3 GLN 154 HG3 GLN 154 4.531 -13.271 -15.882 1114 HE21 GLN 154 HE21 GLN 154 6.481 -10.258 -14.965 1115 HE22 GLN 154 HE22 GLN 154 4.766 -10.570 -15.216 1116 H VAL 155 H VAL 155 2.198 -10.252 -12.477 1117 HA VAL 155 HA VAL 155 0.285 -11.252 -10.535 1118 HB VAL 155 HB VAL 155 0.668 -8.915 -10.542 1119 HG11 VAL 155 HG11 VAL 155 -0.386 -8.822 -13.372 1120 HG12 VAL 155 HG12 VAL 155 -0.141 -7.415 -12.330 1121 HG13 VAL 155 HG13 VAL 155 1.252 -8.419 -12.815 1122 HG21 VAL 155 HG21 VAL 155 -2.203 -9.566 -11.347 1123 HG22 VAL 155 HG22 VAL 155 -1.503 -9.511 -9.708 1124 HG23 VAL 155 HG23 VAL 155 -1.706 -8.045 -10.646 1125 H TPO 156 H T2P 156 -1.444 -12.287 -10.829 1126 HA TPO 156 HA T2P 156 -1.705 -14.056 -12.980 1127 HB TPO 156 HB T2P 156 -2.539 -13.936 -10.419 1128 HG21 TPO 156 HG21 T2P 156 -4.804 -13.123 -11.070 1129 HG22 TPO 156 HG22 T2P 156 -4.746 -14.647 -10.170 1130 HG23 TPO 156 HG23 T2P 156 -5.044 -14.685 -11.911 1131 H GLY 157 H GLY 157 -3.697 -14.822 -13.798 1132 HA2 GLY 157 HA2 GLY 157 -5.787 -13.119 -14.755 1133 HA3 GLY 157 HA3 GLY 157 -4.576 -13.280 -16.035 1134 H GLN 158 H GLN 158 -3.945 -16.086 -15.074 1135 HA GLN 158 HA GLN 158 -5.732 -17.611 -16.652 1136 HB2 GLN 158 HB2 GLN 158 -4.477 -19.524 -15.816 1137 HB3 GLN 158 HB3 GLN 158 -3.401 -18.199 -16.258 1138 HG2 GLN 158 HG2 GLN 158 -3.174 -17.593 -13.830 1139 HG3 GLN 158 HG3 GLN 158 -4.224 -18.942 -13.405 1140 HE21 GLN 158 HE21 GLN 158 -0.740 -20.133 -12.954 1141 HE22 GLN 158 HE22 GLN 158 -1.760 -18.886 -12.219 1142 H ILE 159 H ILE 159 -6.080 -16.673 -13.321 1143 HA ILE 159 HA ILE 159 -8.293 -18.659 -12.974 1144 HB ILE 159 HB ILE 159 -6.310 -19.411 -11.850 1145 HG12 ILE 159 HG12 ILE 159 -7.138 -19.682 -9.533 1146 HG13 ILE 159 HG13 ILE 159 -8.390 -18.481 -9.836 1147 HG21 ILE 159 HG21 ILE 159 -5.316 -18.229 -9.935 1148 HG22 ILE 159 HG22 ILE 159 -5.110 -17.334 -11.430 1149 HG23 ILE 159 HG23 ILE 159 -6.346 -16.831 -10.258 1150 HD11 ILE 159 HD11 ILE 159 -9.425 -19.953 -11.527 1151 HD12 ILE 159 HD12 ILE 159 -8.091 -21.119 -11.342 1152 HD13 ILE 159 HD13 ILE 159 -9.213 -20.821 -9.999 1153 H GLY 160 H GLY 160 -7.216 -15.465 -11.819 1154 HA2 GLY 160 HA2 GLY 160 -8.503 -13.532 -11.627 1155 HA3 GLY 160 HA3 GLY 160 -9.913 -14.426 -12.182 1156 H TRP 161 H TRP 161 -7.996 -15.313 -9.369 1157 HA TRP 161 HA TRP 161 -10.362 -15.485 -7.704 1158 HB2 TRP 161 HB2 TRP 161 -9.050 -16.851 -6.292 1159 HB3 TRP 161 HB3 TRP 161 -8.939 -17.346 -7.970 1160 HD1 TRP 161 HD1 TRP 161 -6.423 -15.056 -8.471 1161 HE1 TRP 161 HE1 TRP 161 -4.134 -16.121 -8.151 1162 HE3 TRP 161 HE3 TRP 161 -7.687 -18.671 -5.087 1163 HZ2 TRP 161 HZ2 TRP 161 -2.937 -18.097 -6.470 1164 HZ3 TRP 161 HZ3 TRP 161 -5.912 -20.103 -4.066 1165 HH2 TRP 161 HH2 TRP 161 -3.539 -19.838 -4.760 1166 H ARG 162 H ARG 162 -7.434 -14.831 -6.288 1167 HA ARG 162 HA ARG 162 -8.447 -12.948 -4.357 1168 HB2 ARG 162 HB2 ARG 162 -5.578 -13.762 -4.988 1169 HB3 ARG 162 HB3 ARG 162 -6.094 -12.917 -3.527 1170 HG2 ARG 162 HG2 ARG 162 -6.978 -15.726 -4.308 1171 HG3 ARG 162 HG3 ARG 162 -5.653 -15.346 -3.211 1172 HD2 ARG 162 HD2 ARG 162 -7.177 -14.252 -1.656 1173 HD3 ARG 162 HD3 ARG 162 -8.550 -14.523 -2.751 1174 HE ARG 162 HE ARG 162 -7.408 -17.044 -2.295 1175 HH11 ARG 162 HH11 ARG 162 -8.192 -18.507 -0.817 1176 HH12 ARG 162 HH12 ARG 162 -9.114 -17.955 0.550 1177 HH21 ARG 162 HH21 ARG 162 -8.931 -14.626 -0.266 1178 HH22 ARG 162 HH22 ARG 162 -9.533 -15.820 0.854 1179 H ARG 163 H ARG 163 -7.874 -10.757 -3.981 1180 HA ARG 163 HA ARG 163 -6.360 -9.153 -5.804 1181 HB2 ARG 163 HB2 ARG 163 -8.204 -7.572 -6.386 1182 HB3 ARG 163 HB3 ARG 163 -8.216 -9.059 -7.272 1183 HG2 ARG 163 HG2 ARG 163 -9.940 -8.826 -4.794 1184 HG3 ARG 163 HG3 ARG 163 -10.438 -7.986 -6.260 1185 HD2 ARG 163 HD2 ARG 163 -9.823 -10.956 -6.200 1186 HD3 ARG 163 HD3 ARG 163 -11.418 -10.298 -5.903 1187 HE ARG 163 HE ARG 163 -11.632 -9.614 -8.135 1188 HH11 ARG 163 HH11 ARG 163 -11.270 -9.822 -10.310 1189 HH12 ARG 163 HH12 ARG 163 -9.745 -10.483 -10.863 1190 HH21 ARG 163 HH21 ARG 163 -8.458 -11.180 -7.829 1191 HH22 ARG 163 HH22 ARG 163 -8.327 -11.344 -9.550 Start of MODEL 3 1 H1 GLY -4 H1 GLY -4 -9.165 29.061 14.814 2 H2 GLY -4 H2 GLY -4 -8.420 30.519 14.820 3 H3 GLY -4 H3 GLY -4 -8.473 29.621 16.190 4 HA2 GLY -4 HA2 GLY -4 -6.277 29.502 15.210 5 HA3 GLY -4 HA3 GLY -4 -7.079 27.922 15.232 6 H SER -3 H SER -3 -4.988 29.243 13.406 7 HA SER -3 HA SER -3 -6.128 29.696 10.850 8 HB2 SER -3 HB2 SER -3 -3.313 28.806 11.574 9 HB3 SER -3 HB3 SER -3 -3.816 29.502 10.021 10 HG SER -3 HG SER -3 -2.931 31.086 11.439 11 HA PRO -2 HA PRO -2 -7.162 25.672 9.497 12 HB2 PRO -2 HB2 PRO -2 -7.136 25.867 6.760 13 HB3 PRO -2 HB3 PRO -2 -8.318 26.712 7.802 14 HG2 PRO -2 HG2 PRO -2 -5.724 27.819 6.666 15 HG3 PRO -2 HG3 PRO -2 -7.365 28.544 6.582 16 HD2 PRO -2 HD2 PRO -2 -5.608 29.309 8.487 17 HD3 PRO -2 HD3 PRO -2 -7.337 29.094 8.890 18 H ASN -1 H ASN -1 -3.972 26.780 8.767 19 HA ASN -1 HA ASN -1 -3.009 24.196 7.747 20 HB2 ASN -1 HB2 ASN -1 -0.866 25.284 7.594 21 HB3 ASN -1 HB3 ASN -1 -2.095 26.307 6.863 22 HD21 ASN -1 HD21 ASN -1 0.135 28.481 8.884 23 HD22 ASN -1 HD22 ASN -1 0.340 27.408 7.505 24 H SER 0 H SER 0 -3.785 25.314 10.849 25 HA SER 0 HA SER 0 -1.631 23.967 12.308 26 HB2 SER 0 HB2 SER 0 -2.724 25.965 13.216 27 HB3 SER 0 HB3 SER 0 -4.276 25.103 13.277 28 HG SER 0 HG SER 0 -2.954 25.144 15.271 29 H MET 1 H MET 1 -1.821 22.123 13.582 30 HA MET 1 HA MET 1 -3.651 20.012 12.711 31 HB2 MET 1 HB2 MET 1 -2.479 18.625 14.326 32 HB3 MET 1 HB3 MET 1 -1.332 19.513 13.322 33 HG2 MET 1 HG2 MET 1 -1.006 21.151 15.174 34 HG3 MET 1 HG3 MET 1 -2.145 20.238 16.170 35 HE1 MET 1 HE1 MET 1 -0.373 20.169 18.118 36 HE2 MET 1 HE2 MET 1 1.295 19.588 17.920 37 HE3 MET 1 HE3 MET 1 0.774 21.080 17.108 38 H ALA 2 H ALA 2 -3.853 22.532 15.069 39 HA ALA 2 HA ALA 2 -5.404 21.108 17.041 40 HB1 ALA 2 HB1 ALA 2 -4.946 24.092 16.633 41 HB2 ALA 2 HB2 ALA 2 -5.510 23.304 18.122 42 HB3 ALA 2 HB3 ALA 2 -3.867 22.993 17.528 43 H THR 3 H THR 3 -6.429 22.251 14.019 44 HA THR 3 HA THR 3 -9.025 23.321 14.816 45 HB THR 3 HB THR 3 -9.429 23.527 12.407 46 HG1 THR 3 HG1 THR 3 -7.779 22.870 10.984 47 HG21 THR 3 HG21 THR 3 -6.579 24.374 13.066 48 HG22 THR 3 HG22 THR 3 -7.671 25.100 11.866 49 HG23 THR 3 HG23 THR 3 -8.037 25.244 13.595 50 H GLU 4 H GLU 4 -7.916 20.191 14.440 51 HA GLU 4 HA GLU 4 -10.672 19.077 14.238 52 HB2 GLU 4 HB2 GLU 4 -10.019 17.450 12.585 53 HB3 GLU 4 HB3 GLU 4 -9.727 19.067 11.959 54 HG2 GLU 4 HG2 GLU 4 -7.316 18.843 12.348 55 HG3 GLU 4 HG3 GLU 4 -7.552 17.303 13.174 56 H LEU 5 H LEU 5 -10.639 16.647 14.567 57 HA LEU 5 HA LEU 5 -9.021 15.859 16.923 58 HB2 LEU 5 HB2 LEU 5 -11.231 14.419 15.401 59 HB3 LEU 5 HB3 LEU 5 -10.416 13.813 16.842 60 HG LEU 5 HG LEU 5 -12.145 16.323 16.721 61 HD11 LEU 5 HD11 LEU 5 -12.664 13.587 17.957 62 HD12 LEU 5 HD12 LEU 5 -13.741 15.000 18.038 63 HD13 LEU 5 HD13 LEU 5 -13.420 14.223 16.479 64 HD21 LEU 5 HD21 LEU 5 -10.453 16.566 18.480 65 HD22 LEU 5 HD22 LEU 5 -12.027 16.235 19.208 66 HD23 LEU 5 HD23 LEU 5 -10.819 14.935 19.094 67 H GLU 6 H GLU 6 -7.006 15.881 16.001 68 HA GLU 6 HA GLU 6 -6.473 14.634 13.462 69 HB2 GLU 6 HB2 GLU 6 -5.526 16.786 14.776 70 HB3 GLU 6 HB3 GLU 6 -4.226 15.670 15.151 71 HG2 GLU 6 HG2 GLU 6 -5.280 16.457 12.393 72 HG3 GLU 6 HG3 GLU 6 -3.809 17.052 13.135 73 H TYR 7 H TYR 7 -7.379 12.587 14.942 74 HA TYR 7 HA TYR 7 -5.108 11.015 15.997 75 HB2 TYR 7 HB2 TYR 7 -6.650 9.651 17.079 76 HB3 TYR 7 HB3 TYR 7 -7.296 11.265 17.259 77 HD1 TYR 7 HD1 TYR 7 -7.903 7.887 16.044 78 HD2 TYR 7 HD2 TYR 7 -9.282 11.967 15.809 79 HE1 TYR 7 HE1 TYR 7 -10.041 7.104 15.074 80 HE2 TYR 7 HE2 TYR 7 -11.414 11.187 14.796 81 HH TYR 7 HH TYR 7 -12.130 7.705 14.316 82 H GLU 8 H GLU 8 -5.503 8.551 15.597 83 HA GLU 8 HA GLU 8 -6.737 7.586 13.275 84 HB2 GLU 8 HB2 GLU 8 -4.873 6.730 11.959 85 HB3 GLU 8 HB3 GLU 8 -4.912 8.471 11.942 86 HG2 GLU 8 HG2 GLU 8 -3.098 8.423 13.780 87 HG3 GLU 8 HG3 GLU 8 -2.949 6.694 13.433 88 H SER 9 H SER 9 -7.286 5.580 13.745 89 HA SER 9 HA SER 9 -6.053 4.211 16.049 90 HB2 SER 9 HB2 SER 9 -8.727 3.953 14.654 91 HB3 SER 9 HB3 SER 9 -8.202 2.894 15.984 92 HG SER 9 HG SER 9 -9.416 4.674 16.764 93 H VAL 10 H VAL 10 -4.953 2.267 15.889 94 HA VAL 10 HA VAL 10 -4.301 1.259 13.283 95 HB VAL 10 HB VAL 10 -2.703 1.187 15.090 96 HG11 VAL 10 HG11 VAL 10 -4.327 -1.094 16.290 97 HG12 VAL 10 HG12 VAL 10 -2.750 -0.496 16.838 98 HG13 VAL 10 HG13 VAL 10 -4.180 0.535 16.985 99 HG21 VAL 10 HG21 VAL 10 -2.463 -0.308 13.138 100 HG22 VAL 10 HG22 VAL 10 -1.748 -0.963 14.618 101 HG23 VAL 10 HG23 VAL 10 -3.298 -1.600 14.036 102 H LEU 11 H LEU 11 -5.007 -0.273 12.050 103 HA LEU 11 HA LEU 11 -7.291 -2.008 12.917 104 HB2 LEU 11 HB2 LEU 11 -6.440 -1.123 10.127 105 HB3 LEU 11 HB3 LEU 11 -7.797 -2.172 10.512 106 HG LEU 11 HG LEU 11 -7.541 0.782 11.193 107 HD11 LEU 11 HD11 LEU 11 -9.353 -0.783 9.300 108 HD12 LEU 11 HD12 LEU 11 -9.433 0.963 9.604 109 HD13 LEU 11 HD13 LEU 11 -8.000 0.270 8.828 110 HD21 LEU 11 HD21 LEU 11 -9.783 -1.196 11.824 111 HD22 LEU 11 HD22 LEU 11 -8.801 -0.277 12.996 112 HD23 LEU 11 HD23 LEU 11 -9.929 0.571 11.938 113 H CYS 12 H CYS 12 -4.200 -1.964 11.083 114 HA CYS 12 HA CYS 12 -3.931 -4.881 11.478 115 HB2 CYS 12 HB2 CYS 12 -5.212 -4.415 9.337 116 HB3 CYS 12 HB3 CYS 12 -3.724 -3.700 8.696 117 HG CYS 12 HG CYS 12 -4.245 -6.178 7.857 118 H VAL 13 H VAL 13 -1.949 -5.755 11.104 119 HA VAL 13 HA VAL 13 0.371 -4.066 10.569 120 HB VAL 13 HB VAL 13 0.222 -3.953 12.976 121 HG11 VAL 13 HG11 VAL 13 0.441 -5.843 14.474 122 HG12 VAL 13 HG12 VAL 13 -1.013 -6.036 13.489 123 HG13 VAL 13 HG13 VAL 13 0.448 -6.980 13.117 124 HG21 VAL 13 HG21 VAL 13 2.504 -5.794 12.156 125 HG22 VAL 13 HG22 VAL 13 2.476 -4.021 12.013 126 HG23 VAL 13 HG23 VAL 13 2.440 -4.775 13.607 127 H LYS 14 H LYS 14 1.730 -5.106 9.261 128 HA LYS 14 HA LYS 14 1.685 -8.075 9.242 129 HB2 LYS 14 HB2 LYS 14 1.620 -6.377 6.737 130 HB3 LYS 14 HB3 LYS 14 2.253 -8.001 6.715 131 HG2 LYS 14 HG2 LYS 14 -0.560 -7.283 7.638 132 HG3 LYS 14 HG3 LYS 14 -0.112 -7.846 6.026 133 HD2 LYS 14 HD2 LYS 14 0.826 -9.950 7.068 134 HD3 LYS 14 HD3 LYS 14 0.138 -9.431 8.627 135 HE2 LYS 14 HE2 LYS 14 -2.100 -9.341 7.632 136 HE3 LYS 14 HE3 LYS 14 -1.414 -9.780 6.052 137 HZ1 LYS 14 HZ1 LYS 14 -0.717 -11.899 7.008 138 HZ2 LYS 14 HZ2 LYS 14 -1.426 -11.530 8.449 139 HZ3 LYS 14 HZ3 LYS 14 -2.344 -11.724 7.093 140 HA PRO 15 HA PRO 15 5.682 -7.871 10.411 141 HB2 PRO 15 HB2 PRO 15 6.609 -10.408 9.960 142 HB3 PRO 15 HB3 PRO 15 5.263 -10.043 11.079 143 HG2 PRO 15 HG2 PRO 15 5.052 -10.943 8.171 144 HG3 PRO 15 HG3 PRO 15 4.216 -11.633 9.602 145 HD2 PRO 15 HD2 PRO 15 3.013 -9.835 8.017 146 HD3 PRO 15 HD3 PRO 15 2.803 -9.794 9.796 147 H ASP 16 H ASP 16 5.462 -8.833 6.997 148 HA ASP 16 HA ASP 16 8.102 -7.616 6.434 149 HB2 ASP 16 HB2 ASP 16 8.567 -9.965 6.961 150 HB3 ASP 16 HB3 ASP 16 7.373 -10.481 5.776 151 H VAL 17 H VAL 17 7.952 -6.362 4.715 152 HA VAL 17 HA VAL 17 6.138 -6.918 2.467 153 HB VAL 17 HB VAL 17 4.700 -5.732 4.050 154 HG11 VAL 17 HG11 VAL 17 6.312 -4.430 5.332 155 HG12 VAL 17 HG12 VAL 17 6.658 -3.413 3.918 156 HG13 VAL 17 HG13 VAL 17 5.050 -3.390 4.659 157 HG21 VAL 17 HG21 VAL 17 3.874 -4.013 2.592 158 HG22 VAL 17 HG22 VAL 17 5.423 -3.912 1.735 159 HG23 VAL 17 HG23 VAL 17 4.421 -5.382 1.614 160 H SER 18 H SER 18 6.833 -6.019 0.569 161 HA SER 18 HA SER 18 9.458 -4.588 0.622 162 HB2 SER 18 HB2 SER 18 8.531 -6.748 -1.295 163 HB3 SER 18 HB3 SER 18 10.120 -5.960 -1.237 164 HG SER 18 HG SER 18 10.016 -8.054 -0.195 165 H VAL 19 H VAL 19 9.862 -3.040 -0.926 166 HA VAL 19 HA VAL 19 7.515 -2.116 -2.542 167 HB VAL 19 HB VAL 19 9.358 -0.491 -0.797 168 HG11 VAL 19 HG11 VAL 19 7.354 0.430 -2.880 169 HG12 VAL 19 HG12 VAL 19 8.041 1.477 -1.622 170 HG13 VAL 19 HG13 VAL 19 9.101 0.783 -2.841 171 HG21 VAL 19 HG21 VAL 19 6.338 -0.918 -0.912 172 HG22 VAL 19 HG22 VAL 19 7.424 -1.554 0.333 173 HG23 VAL 19 HG23 VAL 19 7.166 0.185 0.193 174 H TYR 20 H TYR 20 7.754 -1.612 -4.494 175 HA TYR 20 HA TYR 20 10.378 -2.220 -5.767 176 HB2 TYR 20 HB2 TYR 20 7.516 -2.731 -6.625 177 HB3 TYR 20 HB3 TYR 20 8.927 -3.129 -7.588 178 HD1 TYR 20 HD1 TYR 20 10.252 -5.079 -7.154 179 HD2 TYR 20 HD2 TYR 20 7.165 -3.924 -4.381 180 HE1 TYR 20 HE1 TYR 20 10.437 -7.288 -6.020 181 HE2 TYR 20 HE2 TYR 20 7.454 -6.096 -3.188 182 HH TYR 20 HH TYR 20 9.719 -8.614 -4.282 183 H ARG 21 H ARG 21 8.695 0.488 -5.340 184 HA ARG 21 HA ARG 21 8.532 2.593 -6.351 185 HB2 ARG 21 HB2 ARG 21 11.460 1.863 -6.677 186 HB3 ARG 21 HB3 ARG 21 10.791 3.500 -6.664 187 HG2 ARG 21 HG2 ARG 21 9.925 3.081 -4.324 188 HG3 ARG 21 HG3 ARG 21 10.709 1.493 -4.375 189 HD2 ARG 21 HD2 ARG 21 12.214 2.870 -3.218 190 HD3 ARG 21 HD3 ARG 21 12.888 2.655 -4.845 191 HE ARG 21 HE ARG 21 11.316 5.053 -4.757 192 HH11 ARG 21 HH11 ARG 21 12.285 7.060 -4.661 193 HH12 ARG 21 HH12 ARG 21 13.932 7.205 -4.124 194 HH21 ARG 21 HH21 ARG 21 14.418 3.835 -3.608 195 HH22 ARG 21 HH22 ARG 21 15.104 5.442 -3.538 196 H ILE 22 H ILE 22 7.258 2.705 -8.074 197 HA ILE 22 HA ILE 22 8.136 1.411 -10.547 198 HB ILE 22 HB ILE 22 5.807 1.145 -11.045 199 HG12 ILE 22 HG12 ILE 22 5.285 2.939 -8.633 200 HG13 ILE 22 HG13 ILE 22 4.857 3.244 -10.320 201 HG21 ILE 22 HG21 ILE 22 6.386 0.480 -8.135 202 HG22 ILE 22 HG22 ILE 22 5.220 -0.309 -9.204 203 HG23 ILE 22 HG23 ILE 22 6.951 -0.429 -9.543 204 HD11 ILE 22 HD11 ILE 22 3.625 1.217 -8.453 205 HD12 ILE 22 HD12 ILE 22 2.877 2.616 -9.236 206 HD13 ILE 22 HD13 ILE 22 3.355 1.206 -10.212 207 HA PRO 23 HA PRO 23 7.885 5.170 -12.955 208 HB2 PRO 23 HB2 PRO 23 8.169 4.159 -15.504 209 HB3 PRO 23 HB3 PRO 23 9.477 4.434 -14.323 210 HG2 PRO 23 HG2 PRO 23 8.164 1.854 -15.086 211 HG3 PRO 23 HG3 PRO 23 9.844 2.162 -14.592 212 HD2 PRO 23 HD2 PRO 23 7.826 1.144 -12.922 213 HD3 PRO 23 HD3 PRO 23 9.342 1.906 -12.371 214 HA PRO 24 HA PRO 24 3.998 4.594 -15.617 215 HB2 PRO 24 HB2 PRO 24 2.303 2.477 -15.422 216 HB3 PRO 24 HB3 PRO 24 3.826 2.405 -16.359 217 HG2 PRO 24 HG2 PRO 24 3.355 1.475 -13.507 218 HG3 PRO 24 HG3 PRO 24 4.082 0.559 -14.867 219 HD2 PRO 24 HD2 PRO 24 5.596 1.886 -13.032 220 HD3 PRO 24 HD3 PRO 24 6.071 1.800 -14.754 221 H ARG 25 H ARG 25 1.616 4.854 -15.349 222 HA ARG 25 HA ARG 25 0.638 5.189 -12.529 223 HB2 ARG 25 HB2 ARG 25 1.529 7.356 -13.439 224 HB3 ARG 25 HB3 ARG 25 0.295 7.274 -14.706 225 HG2 ARG 25 HG2 ARG 25 -1.477 7.251 -12.915 226 HG3 ARG 25 HG3 ARG 25 -0.199 7.382 -11.688 227 HD2 ARG 25 HD2 ARG 25 0.516 9.531 -12.700 228 HD3 ARG 25 HD3 ARG 25 -0.765 9.367 -13.926 229 HE ARG 25 HE ARG 25 -2.020 9.171 -11.413 230 HH11 ARG 25 HH11 ARG 25 -3.138 10.862 -10.486 231 HH12 ARG 25 HH12 ARG 25 -2.722 12.500 -10.889 232 HH21 ARG 25 HH21 ARG 25 -0.276 11.669 -13.141 233 HH22 ARG 25 HH22 ARG 25 -1.153 12.955 -12.357 234 H ALA 26 H ALA 26 -0.270 4.921 -15.948 235 HA ALA 26 HA ALA 26 -2.733 3.472 -15.231 236 HB1 ALA 26 HB1 ALA 26 -3.254 5.912 -14.935 237 HB2 ALA 26 HB2 ALA 26 -2.770 6.193 -16.620 238 HB3 ALA 26 HB3 ALA 26 -4.189 5.178 -16.264 239 H SER 27 H SER 27 -0.297 2.920 -16.749 240 HA SER 27 HA SER 27 -0.585 4.363 -19.079 241 HB2 SER 27 HB2 SER 27 1.651 2.445 -18.378 242 HB3 SER 27 HB3 SER 27 1.728 3.834 -19.483 243 HG SER 27 HG SER 27 2.418 4.686 -17.630 244 H ASN 28 H ASN 28 -1.985 1.517 -18.833 245 HA ASN 28 HA ASN 28 -2.552 1.518 -21.611 246 HB2 ASN 28 HB2 ASN 28 -2.010 -0.949 -22.065 247 HB3 ASN 28 HB3 ASN 28 -0.643 0.141 -22.008 248 HD21 ASN 28 HD21 ASN 28 0.936 -1.565 -19.370 249 HD22 ASN 28 HD22 ASN 28 1.026 -0.317 -20.602 250 H ARG 29 H ARG 29 -2.879 -0.421 -18.637 251 HA ARG 29 HA ARG 29 -5.858 -0.244 -18.852 252 HB2 ARG 29 HB2 ARG 29 -4.281 -2.813 -18.280 253 HB3 ARG 29 HB3 ARG 29 -5.981 -2.579 -17.904 254 HG2 ARG 29 HG2 ARG 29 -6.192 -3.674 -19.857 255 HG3 ARG 29 HG3 ARG 29 -6.257 -2.008 -20.436 256 HD2 ARG 29 HD2 ARG 29 -3.797 -2.219 -21.047 257 HD3 ARG 29 HD3 ARG 29 -3.838 -3.874 -20.467 258 HE ARG 29 HE ARG 29 -4.888 -4.542 -22.406 259 HH11 ARG 29 HH11 ARG 29 -5.643 -4.374 -24.471 260 HH12 ARG 29 HH12 ARG 29 -6.020 -2.815 -25.143 261 HH21 ARG 29 HH21 ARG 29 -5.187 -1.017 -22.339 262 HH22 ARG 29 HH22 ARG 29 -5.764 -0.982 -23.982 263 H GLY 30 H GLY 30 -3.216 -1.293 -16.779 264 HA2 GLY 30 HA2 GLY 30 -4.171 0.484 -14.599 265 HA3 GLY 30 HA3 GLY 30 -3.966 -1.243 -14.256 266 H TYR 31 H TYR 31 -2.066 -1.672 -13.319 267 HA TYR 31 HA TYR 31 0.356 -0.011 -13.987 268 HB2 TYR 31 HB2 TYR 31 -0.558 -1.328 -11.428 269 HB3 TYR 31 HB3 TYR 31 1.099 -0.826 -11.687 270 HD1 TYR 31 HD1 TYR 31 -2.341 0.341 -11.124 271 HD2 TYR 31 HD2 TYR 31 1.759 1.465 -11.862 272 HE1 TYR 31 HE1 TYR 31 -2.822 2.636 -10.276 273 HE2 TYR 31 HE2 TYR 31 1.318 3.718 -10.902 274 HH TYR 31 HH TYR 31 -1.933 4.690 -9.731 275 H ARG 32 H ARG 32 -0.803 -3.311 -13.507 276 HA ARG 32 HA ARG 32 0.116 -5.317 -13.321 277 HB2 ARG 32 HB2 ARG 32 1.818 -5.140 -15.697 278 HB3 ARG 32 HB3 ARG 32 0.463 -6.162 -15.269 279 HG2 ARG 32 HG2 ARG 32 -0.407 -5.185 -17.102 280 HG3 ARG 32 HG3 ARG 32 -0.996 -4.055 -15.907 281 HD2 ARG 32 HD2 ARG 32 -0.190 -2.666 -17.595 282 HD3 ARG 32 HD3 ARG 32 1.117 -2.653 -16.420 283 HE ARG 32 HE ARG 32 2.529 -3.536 -17.991 284 HH11 ARG 32 HH11 ARG 32 3.259 -4.279 -19.761 285 HH12 ARG 32 HH12 ARG 32 2.229 -5.056 -20.962 286 HH21 ARG 32 HH21 ARG 32 -0.664 -4.184 -19.297 287 HH22 ARG 32 HH22 ARG 32 0.010 -5.030 -20.662 288 H ALA 33 H ALA 33 1.362 -5.898 -11.655 289 HA ALA 33 HA ALA 33 3.865 -4.878 -10.922 290 HB1 ALA 33 HB1 ALA 33 4.102 -6.924 -9.588 291 HB2 ALA 33 HB2 ALA 33 2.453 -6.309 -9.484 292 HB3 ALA 33 HB3 ALA 33 2.806 -7.714 -10.513 293 H SER 34 H SER 34 3.172 -7.298 -13.353 294 HA SER 34 HA SER 34 5.830 -8.333 -13.718 295 HB2 SER 34 HB2 SER 34 3.460 -9.266 -14.340 296 HB3 SER 34 HB3 SER 34 3.648 -8.305 -15.815 297 HG SER 34 HG SER 34 4.464 -10.370 -16.181 298 H ASP 35 H ASP 35 4.407 -5.311 -14.737 299 HA ASP 35 HA ASP 35 6.052 -4.931 -17.116 300 HB2 ASP 35 HB2 ASP 35 3.707 -3.948 -16.447 301 HB3 ASP 35 HB3 ASP 35 4.643 -2.739 -15.578 302 H TRP 36 H TRP 36 6.211 -4.040 -13.720 303 HA TRP 36 HA TRP 36 8.881 -2.747 -14.029 304 HB2 TRP 36 HB2 TRP 36 8.179 -2.023 -11.539 305 HB3 TRP 36 HB3 TRP 36 7.813 -1.127 -12.983 306 HD1 TRP 36 HD1 TRP 36 5.335 -1.059 -13.845 307 HE1 TRP 36 HE1 TRP 36 3.097 -1.385 -12.699 308 HE3 TRP 36 HE3 TRP 36 6.935 -3.404 -9.578 309 HZ2 TRP 36 HZ2 TRP 36 2.187 -2.003 -10.008 310 HZ3 TRP 36 HZ3 TRP 36 5.338 -3.864 -7.734 311 HH2 TRP 36 HH2 TRP 36 2.963 -3.147 -7.923 312 H LYS 37 H LYS 37 9.789 -3.060 -11.408 313 HA LYS 37 HA LYS 37 10.802 -5.795 -11.360 314 HB2 LYS 37 HB2 LYS 37 10.753 -3.587 -9.217 315 HB3 LYS 37 HB3 LYS 37 11.594 -5.128 -9.065 316 HG2 LYS 37 HG2 LYS 37 12.254 -2.918 -11.045 317 HG3 LYS 37 HG3 LYS 37 13.161 -3.395 -9.605 318 HD2 LYS 37 HD2 LYS 37 13.245 -5.768 -10.798 319 HD3 LYS 37 HD3 LYS 37 12.911 -4.842 -12.258 320 HE2 LYS 37 HE2 LYS 37 15.217 -4.360 -10.307 321 HE3 LYS 37 HE3 LYS 37 15.347 -5.258 -11.819 322 HZ1 LYS 37 HZ1 LYS 37 14.732 -3.225 -13.021 323 HZ2 LYS 37 HZ2 LYS 37 14.635 -2.378 -11.622 324 HZ3 LYS 37 HZ3 LYS 37 16.068 -2.971 -12.122 325 H LEU 38 H LEU 38 9.883 -7.392 -11.036 326 HA LEU 38 HA LEU 38 7.443 -7.672 -9.413 327 HB2 LEU 38 HB2 LEU 38 7.535 -8.270 -11.813 328 HB3 LEU 38 HB3 LEU 38 8.924 -9.317 -11.517 329 HG LEU 38 HG LEU 38 7.551 -10.704 -10.074 330 HD11 LEU 38 HD11 LEU 38 5.177 -9.146 -11.238 331 HD12 LEU 38 HD12 LEU 38 5.065 -10.596 -10.224 332 HD13 LEU 38 HD13 LEU 38 5.693 -9.103 -9.538 333 HD21 LEU 38 HD21 LEU 38 7.972 -11.298 -12.434 334 HD22 LEU 38 HD22 LEU 38 6.384 -11.871 -11.910 335 HD23 LEU 38 HD23 LEU 38 6.508 -10.422 -12.926 336 H ASP 39 H ASP 39 10.818 -8.693 -9.410 337 HA ASP 39 HA ASP 39 10.415 -10.269 -6.895 338 HB2 ASP 39 HB2 ASP 39 10.642 -11.624 -8.993 339 HB3 ASP 39 HB3 ASP 39 12.232 -10.910 -9.245 340 H GLN 40 H GLN 40 11.975 -7.550 -8.108 341 HA GLN 40 HA GLN 40 14.258 -7.760 -6.173 342 HB2 GLN 40 HB2 GLN 40 14.267 -6.541 -8.936 343 HB3 GLN 40 HB3 GLN 40 15.561 -6.391 -7.744 344 HG2 GLN 40 HG2 GLN 40 15.815 -8.873 -7.718 345 HG3 GLN 40 HG3 GLN 40 14.570 -9.005 -8.967 346 HE21 GLN 40 HE21 GLN 40 16.755 -7.999 -11.613 347 HE22 GLN 40 HE22 GLN 40 15.081 -8.286 -11.162 348 HA PRO 41 HA PRO 41 11.833 -4.019 -4.966 349 HB2 PRO 41 HB2 PRO 41 12.048 -4.230 -2.260 350 HB3 PRO 41 HB3 PRO 41 10.896 -5.203 -3.219 351 HG2 PRO 41 HG2 PRO 41 13.653 -6.007 -2.231 352 HG3 PRO 41 HG3 PRO 41 12.122 -6.924 -2.075 353 HD2 PRO 41 HD2 PRO 41 13.929 -7.409 -4.063 354 HD3 PRO 41 HD3 PRO 41 12.170 -7.571 -4.334 355 H ASP 42 H ASP 42 12.463 -2.059 -3.830 356 HA ASP 42 HA ASP 42 15.420 -1.582 -3.758 357 HB2 ASP 42 HB2 ASP 42 14.029 -0.205 -5.310 358 HB3 ASP 42 HB3 ASP 42 13.137 0.405 -3.917 359 H TRP 43 H TRP 43 12.536 -1.698 -1.801 360 HA TRP 43 HA TRP 43 14.132 -1.289 0.658 361 HB2 TRP 43 HB2 TRP 43 13.129 0.895 0.219 362 HB3 TRP 43 HB3 TRP 43 11.557 0.166 -0.056 363 HD1 TRP 43 HD1 TRP 43 13.852 1.345 2.692 364 HE1 TRP 43 HE1 TRP 43 12.618 1.347 4.941 365 HE3 TRP 43 HE3 TRP 43 9.614 -1.183 1.309 366 HZ2 TRP 43 HZ2 TRP 43 10.080 0.464 5.972 367 HZ3 TRP 43 HZ3 TRP 43 7.813 -1.630 2.964 368 HH2 TRP 43 HH2 TRP 43 8.026 -0.785 5.294 369 H THR 44 H THR 44 13.398 -2.561 2.420 370 HA THR 44 HA THR 44 10.705 -3.679 2.288 371 HB THR 44 HB THR 44 11.185 -5.844 2.764 372 HG1 THR 44 HG1 THR 44 13.934 -5.283 3.127 373 HG21 THR 44 HG21 THR 44 13.484 -5.313 0.866 374 HG22 THR 44 HG22 THR 44 12.594 -6.836 1.121 375 HG23 THR 44 HG23 THR 44 11.773 -5.444 0.406 376 H GLY 45 H GLY 45 9.821 -4.280 4.234 377 HA2 GLY 45 HA2 GLY 45 11.028 -3.657 6.796 378 HA3 GLY 45 HA3 GLY 45 10.083 -2.324 6.172 379 H ARG 46 H ARG 46 8.398 -2.313 7.352 380 HA ARG 46 HA ARG 46 6.701 -4.718 7.892 381 HB2 ARG 46 HB2 ARG 46 8.315 -4.083 9.744 382 HB3 ARG 46 HB3 ARG 46 7.492 -2.532 9.875 383 HG2 ARG 46 HG2 ARG 46 5.375 -3.744 10.478 384 HG3 ARG 46 HG3 ARG 46 6.251 -5.276 10.278 385 HD2 ARG 46 HD2 ARG 46 6.157 -4.837 12.607 386 HD3 ARG 46 HD3 ARG 46 7.825 -4.584 12.078 387 HE ARG 46 HE ARG 46 6.233 -2.109 12.133 388 HH11 ARG 46 HH11 ARG 46 6.514 -0.640 13.617 389 HH12 ARG 46 HH12 ARG 46 7.438 -0.950 15.089 390 HH21 ARG 46 HH21 ARG 46 8.141 -4.212 14.209 391 HH22 ARG 46 HH22 ARG 46 8.366 -2.954 15.392 392 H LEU 47 H LEU 47 4.467 -4.279 8.167 393 HA LEU 47 HA LEU 47 3.522 -1.691 6.975 394 HB2 LEU 47 HB2 LEU 47 2.945 -3.819 5.788 395 HB3 LEU 47 HB3 LEU 47 2.231 -4.400 7.283 396 HG LEU 47 HG LEU 47 0.637 -2.319 7.105 397 HD11 LEU 47 HD11 LEU 47 1.554 -2.558 4.220 398 HD12 LEU 47 HD12 LEU 47 0.176 -1.610 4.825 399 HD13 LEU 47 HD13 LEU 47 1.818 -1.165 5.298 400 HD21 LEU 47 HD21 LEU 47 -0.091 -4.637 6.904 401 HD22 LEU 47 HD22 LEU 47 -0.929 -3.596 5.760 402 HD23 LEU 47 HD23 LEU 47 0.388 -4.651 5.192 403 H ARG 48 H ARG 48 2.320 -0.315 8.157 404 HA ARG 48 HA ARG 48 0.492 -1.454 10.225 405 HB2 ARG 48 HB2 ARG 48 1.842 1.275 10.199 406 HB3 ARG 48 HB3 ARG 48 0.375 0.959 11.120 407 HG2 ARG 48 HG2 ARG 48 2.991 -0.550 11.511 408 HG3 ARG 48 HG3 ARG 48 2.467 0.862 12.443 409 HD2 ARG 48 HD2 ARG 48 0.392 -0.431 13.100 410 HD3 ARG 48 HD3 ARG 48 1.143 -1.868 12.365 411 HE ARG 48 HE ARG 48 2.994 -0.639 14.152 412 HH11 ARG 48 HH11 ARG 48 3.457 -1.434 16.163 413 HH12 ARG 48 HH12 ARG 48 2.307 -2.445 16.986 414 HH21 ARG 48 HH21 ARG 48 -0.003 -2.420 14.453 415 HH22 ARG 48 HH22 ARG 48 0.396 -2.989 16.053 416 H ILE 49 H ILE 49 -1.587 -1.080 9.893 417 HA ILE 49 HA ILE 49 -2.394 1.083 7.975 418 HB ILE 49 HB ILE 49 -3.692 -1.623 8.338 419 HG12 ILE 49 HG12 ILE 49 -2.443 -0.140 5.976 420 HG13 ILE 49 HG13 ILE 49 -1.812 -1.581 6.770 421 HG21 ILE 49 HG21 ILE 49 -4.773 0.734 6.748 422 HG22 ILE 49 HG22 ILE 49 -5.496 -0.887 6.897 423 HG23 ILE 49 HG23 ILE 49 -5.443 0.152 8.301 424 HD11 ILE 49 HD11 ILE 49 -3.812 -2.862 5.975 425 HD12 ILE 49 HD12 ILE 49 -4.312 -1.413 5.046 426 HD13 ILE 49 HD13 ILE 49 -2.786 -2.205 4.684 427 H THR 50 H THR 50 -3.289 2.664 8.939 428 HA THR 50 HA THR 50 -4.745 2.343 11.528 429 HB THR 50 HB THR 50 -3.942 4.765 11.895 430 HG1 THR 50 HG1 THR 50 -2.460 5.533 10.616 431 HG21 THR 50 HG21 THR 50 -1.665 4.082 12.686 432 HG22 THR 50 HG22 THR 50 -2.971 3.051 13.273 433 HG23 THR 50 HG23 THR 50 -1.925 2.487 11.944 434 H SER 51 H SER 51 -6.400 4.051 11.914 435 HA SER 51 HA SER 51 -7.460 5.323 9.478 436 HB2 SER 51 HB2 SER 51 -9.656 4.303 9.711 437 HB3 SER 51 HB3 SER 51 -8.402 3.096 9.394 438 HG SER 51 HG SER 51 -8.366 2.822 11.775 439 H LYS 52 H LYS 52 -8.164 7.217 9.817 440 HA LYS 52 HA LYS 52 -9.368 8.076 12.418 441 HB2 LYS 52 HB2 LYS 52 -7.377 9.325 11.538 442 HB3 LYS 52 HB3 LYS 52 -8.364 9.792 10.140 443 HG2 LYS 52 HG2 LYS 52 -10.063 10.605 12.028 444 HG3 LYS 52 HG3 LYS 52 -8.611 10.598 13.034 445 HD2 LYS 52 HD2 LYS 52 -8.962 12.032 10.376 446 HD3 LYS 52 HD3 LYS 52 -9.082 12.790 11.990 447 HE2 LYS 52 HE2 LYS 52 -6.762 12.406 12.421 448 HE3 LYS 52 HE3 LYS 52 -6.572 11.417 10.977 449 HZ1 LYS 52 HZ1 LYS 52 -6.831 13.361 9.620 450 HZ2 LYS 52 HZ2 LYS 52 -7.289 14.308 10.880 451 HZ3 LYS 52 HZ3 LYS 52 -5.755 13.747 10.805 452 H GLY 53 H GLY 53 -11.213 6.933 11.980 453 HA2 GLY 53 HA2 GLY 53 -13.493 6.812 11.483 454 HA3 GLY 53 HA3 GLY 53 -13.367 8.403 10.731 455 H LYS 54 H LYS 54 -14.160 8.259 8.714 456 HA LYS 54 HA LYS 54 -14.032 5.977 6.923 457 HB2 LYS 54 HB2 LYS 54 -15.741 7.815 6.855 458 HB3 LYS 54 HB3 LYS 54 -14.471 8.934 6.338 459 HG2 LYS 54 HG2 LYS 54 -14.168 7.605 4.256 460 HG3 LYS 54 HG3 LYS 54 -15.415 6.466 4.812 461 HD2 LYS 54 HD2 LYS 54 -17.084 8.249 4.762 462 HD3 LYS 54 HD3 LYS 54 -15.858 9.458 4.367 463 HE2 LYS 54 HE2 LYS 54 -16.604 7.095 2.576 464 HE3 LYS 54 HE3 LYS 54 -17.271 8.724 2.435 465 HZ1 LYS 54 HZ1 LYS 54 -14.445 7.941 1.944 466 HZ2 LYS 54 HZ2 LYS 54 -15.494 8.610 0.903 467 HZ3 LYS 54 HZ3 LYS 54 -14.895 9.506 2.126 468 H THR 55 H THR 55 -11.531 8.057 7.840 469 HA THR 55 HA THR 55 -10.148 7.560 5.282 470 HB THR 55 HB THR 55 -8.929 9.114 7.558 471 HG1 THR 55 HG1 THR 55 -10.796 10.194 7.407 472 HG21 THR 55 HG21 THR 55 -8.988 9.231 4.496 473 HG22 THR 55 HG22 THR 55 -8.029 10.341 5.520 474 HG23 THR 55 HG23 THR 55 -7.651 8.602 5.478 475 H ALA 56 H ALA 56 -8.644 6.047 5.018 476 HA ALA 56 HA ALA 56 -7.363 4.754 7.379 477 HB1 ALA 56 HB1 ALA 56 -7.731 3.771 4.532 478 HB2 ALA 56 HB2 ALA 56 -6.692 2.985 5.739 479 HB3 ALA 56 HB3 ALA 56 -8.428 3.100 6.019 480 H TYR 57 H TYR 57 -5.051 4.391 7.259 481 HA TYR 57 HA TYR 57 -3.518 6.107 5.381 482 HB2 TYR 57 HB2 TYR 57 -3.204 5.993 8.399 483 HB3 TYR 57 HB3 TYR 57 -2.072 6.757 7.296 484 HD1 TYR 57 HD1 TYR 57 -5.492 6.944 8.764 485 HD2 TYR 57 HD2 TYR 57 -2.499 8.970 6.412 486 HE1 TYR 57 HE1 TYR 57 -6.875 8.987 8.777 487 HE2 TYR 57 HE2 TYR 57 -3.854 11.070 6.521 488 HH TYR 57 HH TYR 57 -7.065 11.176 8.107 489 H ILE 58 H ILE 58 -2.230 4.765 4.319 490 HA ILE 58 HA ILE 58 -1.343 2.198 5.528 491 HB ILE 58 HB ILE 58 -0.424 3.331 2.877 492 HG12 ILE 58 HG12 ILE 58 -2.814 3.305 2.634 493 HG13 ILE 58 HG13 ILE 58 -2.066 2.040 1.681 494 HG21 ILE 58 HG21 ILE 58 -0.468 0.576 4.136 495 HG22 ILE 58 HG22 ILE 58 -0.051 0.882 2.435 496 HG23 ILE 58 HG23 ILE 58 0.947 1.561 3.724 497 HD11 ILE 58 HD11 ILE 58 -2.749 0.352 3.371 498 HD12 ILE 58 HD12 ILE 58 -3.532 1.640 4.321 499 HD13 ILE 58 HD13 ILE 58 -4.111 1.253 2.685 500 H LYS 59 H LYS 59 0.231 2.421 6.982 501 HA LYS 59 HA LYS 59 2.472 4.389 6.530 502 HB2 LYS 59 HB2 LYS 59 1.183 3.260 9.021 503 HB3 LYS 59 HB3 LYS 59 2.838 3.901 9.047 504 HG2 LYS 59 HG2 LYS 59 2.116 6.050 8.225 505 HG3 LYS 59 HG3 LYS 59 0.455 5.485 7.979 506 HD2 LYS 59 HD2 LYS 59 0.004 5.389 10.295 507 HD3 LYS 59 HD3 LYS 59 1.724 5.339 10.724 508 HE2 LYS 59 HE2 LYS 59 0.908 7.505 11.302 509 HE3 LYS 59 HE3 LYS 59 1.997 7.666 9.903 510 HZ1 LYS 59 HZ1 LYS 59 0.031 7.863 8.497 511 HZ2 LYS 59 HZ2 LYS 59 -0.968 7.638 9.819 512 HZ3 LYS 59 HZ3 LYS 59 -0.044 8.970 9.690 513 H LEU 60 H LEU 60 4.376 3.621 5.936 514 HA LEU 60 HA LEU 60 4.974 0.709 6.324 515 HB2 LEU 60 HB2 LEU 60 5.998 2.755 4.325 516 HB3 LEU 60 HB3 LEU 60 6.645 1.124 4.493 517 HG LEU 60 HG LEU 60 3.729 1.704 3.799 518 HD11 LEU 60 HD11 LEU 60 6.074 0.996 2.003 519 HD12 LEU 60 HD12 LEU 60 4.372 1.089 1.495 520 HD13 LEU 60 HD13 LEU 60 5.211 2.549 2.043 521 HD21 LEU 60 HD21 LEU 60 4.102 -0.551 4.770 522 HD22 LEU 60 HD22 LEU 60 3.721 -0.653 3.049 523 HD23 LEU 60 HD23 LEU 60 5.400 -0.844 3.595 524 H GLU 61 H GLU 61 6.613 0.097 7.559 525 HA GLU 61 HA GLU 61 8.237 2.190 8.950 526 HB2 GLU 61 HB2 GLU 61 6.965 -0.325 10.076 527 HB3 GLU 61 HB3 GLU 61 7.957 0.834 10.961 528 HG2 GLU 61 HG2 GLU 61 6.227 2.598 10.487 529 HG3 GLU 61 HG3 GLU 61 5.195 1.335 9.792 530 H ASP 62 H ASP 62 10.430 1.522 9.691 531 HA ASP 62 HA ASP 62 11.571 -0.420 7.889 532 HB2 ASP 62 HB2 ASP 62 13.576 0.458 8.385 533 HB3 ASP 62 HB3 ASP 62 12.560 1.834 8.806 534 H LYS 63 H LYS 63 12.842 -2.227 8.439 535 HA LYS 63 HA LYS 63 11.367 -4.070 10.070 536 HB2 LYS 63 HB2 LYS 63 12.664 -4.385 7.842 537 HB3 LYS 63 HB3 LYS 63 14.111 -4.530 8.814 538 HG2 LYS 63 HG2 LYS 63 13.363 -6.551 9.823 539 HG3 LYS 63 HG3 LYS 63 11.680 -6.296 9.334 540 HD2 LYS 63 HD2 LYS 63 13.913 -6.656 7.294 541 HD3 LYS 63 HD3 LYS 63 13.071 -8.033 8.024 542 HE2 LYS 63 HE2 LYS 63 10.919 -7.278 7.199 543 HE3 LYS 63 HE3 LYS 63 11.603 -5.780 6.576 544 HZ1 LYS 63 HZ1 LYS 63 12.599 -8.381 5.602 545 HZ2 LYS 63 HZ2 LYS 63 11.247 -7.733 4.977 546 HZ3 LYS 63 HZ3 LYS 63 12.672 -6.916 4.849 547 H VAL 64 H VAL 64 13.818 -1.942 11.061 548 HA VAL 64 HA VAL 64 14.916 -3.758 13.162 549 HB VAL 64 HB VAL 64 16.202 -1.206 12.140 550 HG11 VAL 64 HG11 VAL 64 17.323 -3.690 13.495 551 HG12 VAL 64 HG12 VAL 64 18.254 -2.265 12.977 552 HG13 VAL 64 HG13 VAL 64 17.053 -2.105 14.259 553 HG21 VAL 64 HG21 VAL 64 15.983 -2.560 10.141 554 HG22 VAL 64 HG22 VAL 64 17.654 -2.625 10.698 555 HG23 VAL 64 HG23 VAL 64 16.572 -4.007 11.004 556 H SER 65 H SER 65 13.778 -0.401 12.577 557 HA SER 65 HA SER 65 13.508 -0.111 15.541 558 HB2 SER 65 HB2 SER 65 14.321 1.995 13.508 559 HB3 SER 65 HB3 SER 65 14.065 2.274 15.237 560 HG SER 65 HG SER 65 16.280 1.916 14.725 561 H GLY 66 H GLY 66 11.679 -0.103 12.661 562 HA2 GLY 66 HA2 GLY 66 9.418 0.184 12.408 563 HA3 GLY 66 HA3 GLY 66 9.268 0.679 14.094 564 H GLU 67 H GLU 67 11.577 2.421 12.085 565 HA GLU 67 HA GLU 67 10.075 4.924 12.469 566 HB2 GLU 67 HB2 GLU 67 12.738 4.312 11.136 567 HB3 GLU 67 HB3 GLU 67 12.035 5.923 11.221 568 HG2 GLU 67 HG2 GLU 67 12.658 4.229 13.666 569 HG3 GLU 67 HG3 GLU 67 13.749 5.427 12.972 570 H LEU 68 H LEU 68 9.438 6.331 10.816 571 HA LEU 68 HA LEU 68 7.895 4.864 8.884 572 HB2 LEU 68 HB2 LEU 68 7.147 6.926 10.173 573 HB3 LEU 68 HB3 LEU 68 8.160 7.879 9.091 574 HG LEU 68 HG LEU 68 6.792 6.827 7.149 575 HD11 LEU 68 HD11 LEU 68 4.538 6.053 7.713 576 HD12 LEU 68 HD12 LEU 68 5.716 4.999 8.492 577 HD13 LEU 68 HD13 LEU 68 4.873 6.228 9.451 578 HD21 LEU 68 HD21 LEU 68 4.964 8.442 7.427 579 HD22 LEU 68 HD22 LEU 68 5.378 8.639 9.146 580 HD23 LEU 68 HD23 LEU 68 6.516 9.158 7.883 581 H PHE 69 H PHE 69 8.406 4.240 6.942 582 HA PHE 69 HA PHE 69 10.585 5.413 5.306 583 HB2 PHE 69 HB2 PHE 69 10.462 3.047 5.322 584 HB3 PHE 69 HB3 PHE 69 8.723 3.040 5.075 585 HD1 PHE 69 HD1 PHE 69 11.639 4.645 3.262 586 HD2 PHE 69 HD2 PHE 69 8.125 2.160 3.018 587 HE1 PHE 69 HE1 PHE 69 11.959 4.429 0.823 588 HE2 PHE 69 HE2 PHE 69 8.490 1.884 0.586 589 HZ PHE 69 HZ PHE 69 10.374 3.048 -0.539 590 H ALA 70 H ALA 70 7.040 4.891 5.033 591 HA ALA 70 HA ALA 70 6.663 7.444 3.675 592 HB1 ALA 70 HB1 ALA 70 7.344 5.970 1.781 593 HB2 ALA 70 HB2 ALA 70 6.049 4.829 2.213 594 HB3 ALA 70 HB3 ALA 70 5.649 6.467 1.659 595 H GLN 71 H GLN 71 4.358 7.905 3.300 596 HA GLN 71 HA GLN 71 2.449 6.030 4.448 597 HB2 GLN 71 HB2 GLN 71 1.288 7.680 5.818 598 HB3 GLN 71 HB3 GLN 71 2.923 7.348 6.387 599 HG2 GLN 71 HG2 GLN 71 3.729 9.459 5.352 600 HG3 GLN 71 HG3 GLN 71 2.092 9.821 4.799 601 HE21 GLN 71 HE21 GLN 71 2.804 11.544 8.103 602 HE22 GLN 71 HE22 GLN 71 3.704 11.487 6.595 603 H ALA 72 H ALA 72 0.441 6.052 3.571 604 HA ALA 72 HA ALA 72 -0.147 8.038 1.410 605 HB1 ALA 72 HB1 ALA 72 -1.255 6.182 0.200 606 HB2 ALA 72 HB2 ALA 72 0.486 5.931 0.396 607 HB3 ALA 72 HB3 ALA 72 -0.672 5.051 1.424 608 HA PRO 73 HA PRO 73 -4.035 8.102 3.895 609 HB2 PRO 73 HB2 PRO 73 -5.073 10.450 3.038 610 HB3 PRO 73 HB3 PRO 73 -3.658 10.379 4.131 611 HG2 PRO 73 HG2 PRO 73 -3.666 10.796 1.131 612 HG3 PRO 73 HG3 PRO 73 -2.745 11.691 2.376 613 HD2 PRO 73 HD2 PRO 73 -1.711 9.591 0.890 614 HD3 PRO 73 HD3 PRO 73 -1.143 10.003 2.536 615 H VAL 74 H VAL 74 -5.830 6.991 3.377 616 HA VAL 74 HA VAL 74 -6.838 6.877 0.552 617 HB VAL 74 HB VAL 74 -6.842 4.644 2.617 618 HG11 VAL 74 HG11 VAL 74 -7.696 4.623 -0.292 619 HG12 VAL 74 HG12 VAL 74 -7.626 3.216 0.794 620 HG13 VAL 74 HG13 VAL 74 -8.772 4.502 1.120 621 HG21 VAL 74 HG21 VAL 74 -5.258 3.425 1.367 622 HG22 VAL 74 HG22 VAL 74 -5.196 4.639 0.093 623 HG23 VAL 74 HG23 VAL 74 -4.544 5.003 1.706 624 H GLU 75 H GLU 75 -8.946 7.574 0.341 625 HA GLU 75 HA GLU 75 -10.730 7.358 2.731 626 HB2 GLU 75 HB2 GLU 75 -9.864 9.746 1.890 627 HB3 GLU 75 HB3 GLU 75 -11.198 9.544 0.749 628 HG2 GLU 75 HG2 GLU 75 -12.516 8.863 3.006 629 HG3 GLU 75 HG3 GLU 75 -11.229 9.773 3.768 630 H GLN 76 H GLN 76 -10.259 5.846 -0.025 631 HA GLN 76 HA GLN 76 -12.918 4.842 -0.162 632 HB2 GLN 76 HB2 GLN 76 -13.453 5.278 -2.429 633 HB3 GLN 76 HB3 GLN 76 -13.110 6.832 -1.691 634 HG2 GLN 76 HG2 GLN 76 -11.290 5.277 -3.578 635 HG3 GLN 76 HG3 GLN 76 -12.258 6.675 -3.980 636 HE21 GLN 76 HE21 GLN 76 -8.615 7.235 -2.246 637 HE22 GLN 76 HE22 GLN 76 -9.329 5.608 -2.271 638 H TYR 77 H TYR 77 -12.920 2.745 -1.017 639 HA TYR 77 HA TYR 77 -10.365 1.709 -2.106 640 HB2 TYR 77 HB2 TYR 77 -10.503 1.167 0.253 641 HB3 TYR 77 HB3 TYR 77 -12.017 0.265 -0.017 642 HD1 TYR 77 HD1 TYR 77 -8.542 0.647 -0.983 643 HD2 TYR 77 HD2 TYR 77 -11.767 -2.145 -0.694 644 HE1 TYR 77 HE1 TYR 77 -7.003 -1.146 -1.773 645 HE2 TYR 77 HE2 TYR 77 -10.242 -3.972 -1.424 646 HH TYR 77 HH TYR 77 -8.185 -4.541 -2.138 647 HA PRO 78 HA PRO 78 -9.477 0.623 -3.679 648 HB2 PRO 78 HB2 PRO 78 -9.361 0.364 -6.369 649 HB3 PRO 78 HB3 PRO 78 -9.510 -1.046 -5.277 650 HG2 PRO 78 HG2 PRO 78 -11.740 0.398 -6.756 651 HG3 PRO 78 HG3 PRO 78 -11.398 -1.363 -6.724 652 HD2 PRO 78 HD2 PRO 78 -13.239 -0.229 -5.068 653 HD3 PRO 78 HD3 PRO 78 -12.199 -1.572 -4.511 654 H GLY 79 H GLY 79 -8.284 2.337 -4.909 655 HA2 GLY 79 HA2 GLY 79 -9.762 4.485 -6.240 656 HA3 GLY 79 HA3 GLY 79 -9.183 4.925 -4.635 657 H ILE 80 H ILE 80 -7.867 6.565 -5.644 658 HA ILE 80 HA ILE 80 -5.600 5.729 -7.316 659 HB ILE 80 HB ILE 80 -6.708 7.905 -7.628 660 HG12 ILE 80 HG12 ILE 80 -4.771 9.354 -7.830 661 HG13 ILE 80 HG13 ILE 80 -3.837 8.359 -6.719 662 HG21 ILE 80 HG21 ILE 80 -6.380 9.776 -6.088 663 HG22 ILE 80 HG22 ILE 80 -7.235 8.478 -5.253 664 HG23 ILE 80 HG23 ILE 80 -5.498 8.747 -4.953 665 HD11 ILE 80 HD11 ILE 80 -4.873 7.405 -9.424 666 HD12 ILE 80 HD12 ILE 80 -3.244 8.043 -9.120 667 HD13 ILE 80 HD13 ILE 80 -3.749 6.538 -8.343 668 H ALA 81 H ALA 81 -6.288 6.230 -3.905 669 HA ALA 81 HA ALA 81 -3.494 6.399 -3.215 670 HB1 ALA 81 HB1 ALA 81 -5.933 6.179 -1.451 671 HB2 ALA 81 HB2 ALA 81 -4.245 6.476 -0.925 672 HB3 ALA 81 HB3 ALA 81 -5.091 7.674 -1.937 673 H VAL 82 H VAL 82 -5.827 3.700 -3.348 674 HA VAL 82 HA VAL 82 -3.463 1.927 -3.195 675 HB VAL 82 HB VAL 82 -4.331 1.942 -0.958 676 HG11 VAL 82 HG11 VAL 82 -6.977 1.248 -2.126 677 HG12 VAL 82 HG12 VAL 82 -6.535 1.276 -0.384 678 HG13 VAL 82 HG13 VAL 82 -6.548 2.758 -1.317 679 HG21 VAL 82 HG21 VAL 82 -3.444 -0.140 -1.918 680 HG22 VAL 82 HG22 VAL 82 -4.716 -0.457 -0.733 681 HG23 VAL 82 HG23 VAL 82 -5.052 -0.598 -2.474 682 H GLU 83 H GLU 83 -3.469 0.633 -4.893 683 HA GLU 83 HA GLU 83 -5.973 -0.184 -6.288 684 HB2 GLU 83 HB2 GLU 83 -4.105 1.762 -7.220 685 HB3 GLU 83 HB3 GLU 83 -3.747 0.299 -8.129 686 HG2 GLU 83 HG2 GLU 83 -6.543 1.478 -7.847 687 HG3 GLU 83 HG3 GLU 83 -5.430 1.905 -9.146 688 H THR 84 H THR 84 -5.771 -2.084 -7.644 689 HA THR 84 HA THR 84 -3.581 -3.923 -6.713 690 HB THR 84 HB THR 84 -6.202 -4.865 -7.759 691 HG1 THR 84 HG1 THR 84 -6.657 -3.676 -5.863 692 HG21 THR 84 HG21 THR 84 -5.567 -6.883 -6.474 693 HG22 THR 84 HG22 THR 84 -4.386 -6.462 -7.723 694 HG23 THR 84 HG23 THR 84 -4.041 -6.080 -6.019 695 H VAL 85 H VAL 85 -2.402 -3.034 -8.242 696 HA VAL 85 HA VAL 85 -1.348 -2.927 -10.359 697 HB VAL 85 HB VAL 85 -0.507 -5.374 -10.625 698 HG11 VAL 85 HG11 VAL 85 -0.160 -3.765 -8.043 699 HG12 VAL 85 HG12 VAL 85 0.996 -4.925 -8.710 700 HG13 VAL 85 HG13 VAL 85 0.654 -3.444 -9.586 701 HG21 VAL 85 HG21 VAL 85 -2.384 -6.450 -9.289 702 HG22 VAL 85 HG22 VAL 85 -0.751 -6.812 -8.724 703 HG23 VAL 85 HG23 VAL 85 -1.752 -5.630 -7.867 704 H THR 86 H THR 86 -3.127 -5.930 -10.801 705 HA THR 86 HA THR 86 -4.580 -4.747 -13.009 706 HB THR 86 HB THR 86 -4.495 -6.999 -14.271 707 HG1 THR 86 HG1 THR 86 -2.626 -8.174 -13.994 708 HG21 THR 86 HG21 THR 86 -2.490 -6.364 -15.540 709 HG22 THR 86 HG22 THR 86 -3.388 -4.892 -15.090 710 HG23 THR 86 HG23 THR 86 -1.940 -5.367 -14.174 711 H ASP 87 H ASP 87 -4.063 -7.742 -11.237 712 HA ASP 87 HA ASP 87 -6.981 -7.888 -10.574 713 HB2 ASP 87 HB2 ASP 87 -5.410 -9.705 -12.360 714 HB3 ASP 87 HB3 ASP 87 -6.661 -10.422 -11.336 715 H SER 88 H SER 88 -4.358 -10.321 -10.231 716 HA SER 88 HA SER 88 -4.963 -11.205 -7.740 717 HB2 SER 88 HB2 SER 88 -3.047 -11.821 -9.252 718 HB3 SER 88 HB3 SER 88 -2.036 -10.732 -8.320 719 HG SER 88 HG SER 88 -2.190 -13.013 -7.599 720 H SER 89 H SER 89 -5.213 -10.446 -5.832 721 HA SER 89 HA SER 89 -3.890 -8.030 -4.849 722 HB2 SER 89 HB2 SER 89 -5.470 -8.304 -3.025 723 HB3 SER 89 HB3 SER 89 -6.136 -8.259 -4.686 724 HG SER 89 HG SER 89 -7.187 -9.883 -3.503 725 H ARG 90 H ARG 90 -2.048 -9.147 -5.398 726 HA ARG 90 HA ARG 90 -0.587 -10.684 -3.266 727 HB2 ARG 90 HB2 ARG 90 -1.130 -12.001 -5.220 728 HB3 ARG 90 HB3 ARG 90 -0.538 -10.739 -6.302 729 HG2 ARG 90 HG2 ARG 90 1.784 -11.143 -5.540 730 HG3 ARG 90 HG3 ARG 90 1.194 -12.409 -4.430 731 HD2 ARG 90 HD2 ARG 90 0.159 -13.588 -6.334 732 HD3 ARG 90 HD3 ARG 90 0.730 -12.346 -7.456 733 HE ARG 90 HE ARG 90 3.046 -13.282 -6.255 734 HH11 ARG 90 HH11 ARG 90 4.243 -15.039 -6.971 735 HH12 ARG 90 HH12 ARG 90 3.506 -16.240 -7.995 736 HH21 ARG 90 HH21 ARG 90 0.404 -14.736 -8.084 737 HH22 ARG 90 HH22 ARG 90 1.384 -16.073 -8.607 738 H TYR 91 H TYR 91 -0.561 -8.206 -5.721 739 HA TYR 91 HA TYR 91 1.571 -6.688 -4.331 740 HB2 TYR 91 HB2 TYR 91 1.025 -6.593 -7.308 741 HB3 TYR 91 HB3 TYR 91 2.375 -5.858 -6.479 742 HD1 TYR 91 HD1 TYR 91 1.026 -8.774 -8.097 743 HD2 TYR 91 HD2 TYR 91 4.252 -7.370 -5.626 744 HE1 TYR 91 HE1 TYR 91 2.314 -10.778 -8.718 745 HE2 TYR 91 HE2 TYR 91 5.525 -9.475 -6.116 746 HH TYR 91 HH TYR 91 4.329 -12.001 -8.327 747 H PHE 92 H PHE 92 1.296 -4.347 -4.754 748 HA PHE 92 HA PHE 92 -1.389 -3.413 -5.603 749 HB2 PHE 92 HB2 PHE 92 -0.236 -2.800 -2.851 750 HB3 PHE 92 HB3 PHE 92 -1.676 -2.065 -3.546 751 HD1 PHE 92 HD1 PHE 92 -3.707 -3.502 -4.077 752 HD2 PHE 92 HD2 PHE 92 -0.341 -4.946 -1.799 753 HE1 PHE 92 HE1 PHE 92 -5.072 -5.411 -3.284 754 HE2 PHE 92 HE2 PHE 92 -1.723 -6.810 -0.960 755 HZ PHE 92 HZ PHE 92 -4.073 -7.092 -1.737 756 H VAL 93 H VAL 93 -1.436 -0.993 -5.572 757 HA VAL 93 HA VAL 93 1.228 0.312 -5.519 758 HB VAL 93 HB VAL 93 -0.944 0.968 -7.549 759 HG11 VAL 93 HG11 VAL 93 0.718 2.625 -8.381 760 HG12 VAL 93 HG12 VAL 93 0.144 3.025 -6.776 761 HG13 VAL 93 HG13 VAL 93 1.751 2.287 -6.988 762 HG21 VAL 93 HG21 VAL 93 0.900 0.399 -9.181 763 HG22 VAL 93 HG22 VAL 93 1.837 -0.251 -7.833 764 HG23 VAL 93 HG23 VAL 93 0.283 -0.986 -8.281 765 H ILE 94 H ILE 94 1.251 2.128 -4.246 766 HA ILE 94 HA ILE 94 -1.367 3.299 -3.511 767 HB ILE 94 HB ILE 94 -0.765 3.647 -1.191 768 HG12 ILE 94 HG12 ILE 94 1.719 1.947 -1.725 769 HG13 ILE 94 HG13 ILE 94 1.748 3.701 -1.553 770 HG21 ILE 94 HG21 ILE 94 -0.381 0.690 -1.860 771 HG22 ILE 94 HG22 ILE 94 -1.042 1.401 -0.374 772 HG23 ILE 94 HG23 ILE 94 -1.929 1.546 -1.872 773 HD11 ILE 94 HD11 ILE 94 2.374 2.742 0.564 774 HD12 ILE 94 HD12 ILE 94 0.761 3.460 0.736 775 HD13 ILE 94 HD13 ILE 94 0.937 1.707 0.576 776 H ARG 95 H ARG 95 -1.450 5.458 -3.060 777 HA ARG 95 HA ARG 95 0.750 7.113 -4.229 778 HB2 ARG 95 HB2 ARG 95 -1.515 7.383 -5.133 779 HB3 ARG 95 HB3 ARG 95 -2.114 7.861 -3.555 780 HG2 ARG 95 HG2 ARG 95 0.101 9.431 -4.920 781 HG3 ARG 95 HG3 ARG 95 -1.612 9.691 -5.280 782 HD2 ARG 95 HD2 ARG 95 -1.996 9.983 -2.772 783 HD3 ARG 95 HD3 ARG 95 -0.243 10.033 -2.601 784 HE ARG 95 HE ARG 95 -0.175 12.175 -3.394 785 HH11 ARG 95 HH11 ARG 95 -0.855 14.062 -4.033 786 HH12 ARG 95 HH12 ARG 95 -2.499 14.321 -4.581 787 HH21 ARG 95 HH21 ARG 95 -3.409 11.019 -4.153 788 HH22 ARG 95 HH22 ARG 95 -3.923 12.607 -4.650 789 H ILE 96 H ILE 96 2.259 7.379 -2.741 790 HA ILE 96 HA ILE 96 1.582 8.062 0.065 791 HB ILE 96 HB ILE 96 4.005 7.943 0.472 792 HG12 ILE 96 HG12 ILE 96 4.341 6.805 -2.326 793 HG13 ILE 96 HG13 ILE 96 4.639 8.511 -1.956 794 HG21 ILE 96 HG21 ILE 96 2.775 5.479 -0.810 795 HG22 ILE 96 HG22 ILE 96 4.199 5.454 0.224 796 HG23 ILE 96 HG23 ILE 96 2.661 5.971 0.895 797 HD11 ILE 96 HD11 ILE 96 6.096 6.154 -0.744 798 HD12 ILE 96 HD12 ILE 96 6.725 7.344 -1.899 799 HD13 ILE 96 HD13 ILE 96 6.295 7.856 -0.250 800 H GLN 97 H GLN 97 2.729 9.878 1.078 801 HA GLN 97 HA GLN 97 3.512 12.042 -0.831 802 HB2 GLN 97 HB2 GLN 97 2.478 12.280 2.004 803 HB3 GLN 97 HB3 GLN 97 3.464 13.524 1.231 804 HG2 GLN 97 HG2 GLN 97 1.728 13.289 -0.759 805 HG3 GLN 97 HG3 GLN 97 0.677 12.620 0.495 806 HE21 GLN 97 HE21 GLN 97 1.829 16.597 0.587 807 HE22 GLN 97 HE22 GLN 97 2.813 15.403 -0.277 808 H ASP 98 H ASP 98 5.471 13.045 -0.670 809 HA ASP 98 HA ASP 98 7.577 11.441 0.651 810 HB2 ASP 98 HB2 ASP 98 7.719 12.314 -1.714 811 HB3 ASP 98 HB3 ASP 98 7.833 13.936 -1.028 812 H GLY 99 H GLY 99 5.555 13.889 1.626 813 HA2 GLY 99 HA2 GLY 99 5.435 14.885 3.723 814 HA3 GLY 99 HA3 GLY 99 7.072 14.339 4.082 815 H THR 100 H THR 100 7.199 16.002 1.174 816 HA THR 100 HA THR 100 8.037 18.556 2.482 817 HB THR 100 HB THR 100 9.485 18.895 0.537 818 HG1 THR 100 HG1 THR 100 9.705 17.237 -0.943 819 HG21 THR 100 HG21 THR 100 9.904 16.099 1.676 820 HG22 THR 100 HG22 THR 100 11.127 17.173 0.967 821 HG23 THR 100 HG23 THR 100 10.357 17.609 2.505 822 H GLY 101 H GLY 101 5.287 17.655 1.332 823 HA2 GLY 101 HA2 GLY 101 3.500 19.047 0.614 824 HA3 GLY 101 HA3 GLY 101 4.637 20.160 -0.145 825 H ARG 102 H ARG 102 5.290 16.848 -0.798 826 HA ARG 102 HA ARG 102 3.890 16.909 -3.435 827 HB2 ARG 102 HB2 ARG 102 5.847 16.303 -4.585 828 HB3 ARG 102 HB3 ARG 102 6.276 17.656 -3.521 829 HG2 ARG 102 HG2 ARG 102 7.247 15.975 -1.920 830 HG3 ARG 102 HG3 ARG 102 6.975 14.719 -3.147 831 HD2 ARG 102 HD2 ARG 102 8.368 15.945 -4.756 832 HD3 ARG 102 HD3 ARG 102 8.612 17.254 -3.584 833 HE ARG 102 HE ARG 102 9.518 14.943 -2.283 834 HH11 ARG 102 HH11 ARG 102 11.499 14.321 -2.141 835 HH12 ARG 102 HH12 ARG 102 12.747 14.838 -3.280 836 HH21 ARG 102 HH21 ARG 102 10.514 16.702 -5.161 837 HH22 ARG 102 HH22 ARG 102 12.168 16.178 -4.985 838 H SER 103 H SER 103 4.015 14.820 -4.591 839 HA SER 103 HA SER 103 3.381 12.539 -2.767 840 HB2 SER 103 HB2 SER 103 1.934 13.404 -5.300 841 HB3 SER 103 HB3 SER 103 1.595 11.935 -4.373 842 HG SER 103 HG SER 103 1.434 14.602 -3.364 843 H ALA 104 H ALA 104 3.535 10.412 -3.670 844 HA ALA 104 HA ALA 104 4.755 10.028 -6.317 845 HB1 ALA 104 HB1 ALA 104 6.740 10.279 -4.870 846 HB2 ALA 104 HB2 ALA 104 6.117 9.023 -3.779 847 HB3 ALA 104 HB3 ALA 104 6.580 8.608 -5.442 848 H PHE 105 H PHE 105 4.397 7.963 -7.192 849 HA PHE 105 HA PHE 105 2.538 6.192 -5.677 850 HB2 PHE 105 HB2 PHE 105 3.307 6.054 -8.601 851 HB3 PHE 105 HB3 PHE 105 2.040 5.149 -7.783 852 HD1 PHE 105 HD1 PHE 105 0.030 6.438 -6.803 853 HD2 PHE 105 HD2 PHE 105 2.913 8.259 -9.445 854 HE1 PHE 105 HE1 PHE 105 -1.558 8.279 -7.283 855 HE2 PHE 105 HE2 PHE 105 1.353 10.133 -9.859 856 HZ PHE 105 HZ PHE 105 -0.907 10.142 -8.781 857 H ILE 106 H ILE 106 3.242 4.370 -4.775 858 HA ILE 106 HA ILE 106 5.735 3.093 -5.832 859 HB ILE 106 HB ILE 106 6.109 2.090 -3.608 860 HG12 ILE 106 HG12 ILE 106 4.332 4.318 -2.507 861 HG13 ILE 106 HG13 ILE 106 3.837 2.632 -2.626 862 HG21 ILE 106 HG21 ILE 106 7.397 4.021 -2.804 863 HG22 ILE 106 HG22 ILE 106 7.428 3.999 -4.567 864 HG23 ILE 106 HG23 ILE 106 6.363 5.137 -3.720 865 HD11 ILE 106 HD11 ILE 106 6.154 3.643 -0.942 866 HD12 ILE 106 HD12 ILE 106 4.570 3.094 -0.375 867 HD13 ILE 106 HD13 ILE 106 5.673 1.939 -1.139 868 H GLY 107 H GLY 107 5.718 1.061 -6.342 869 HA2 GLY 107 HA2 GLY 107 3.259 -0.553 -6.122 870 HA3 GLY 107 HA3 GLY 107 4.726 -0.990 -6.995 871 H ILE 108 H ILE 108 3.065 -2.289 -4.790 872 HA ILE 108 HA ILE 108 5.276 -2.847 -2.867 873 HB ILE 108 HB ILE 108 2.310 -3.082 -2.218 874 HG12 ILE 108 HG12 ILE 108 4.254 -0.777 -1.739 875 HG13 ILE 108 HG13 ILE 108 2.700 -0.724 -2.566 876 HG21 ILE 108 HG21 ILE 108 4.829 -3.129 -0.516 877 HG22 ILE 108 HG22 ILE 108 3.159 -3.317 0.086 878 HG23 ILE 108 HG23 ILE 108 3.837 -4.546 -0.936 879 HD11 ILE 108 HD11 ILE 108 3.146 -1.122 0.414 880 HD12 ILE 108 HD12 ILE 108 2.475 0.276 -0.399 881 HD13 ILE 108 HD13 ILE 108 1.560 -1.253 -0.405 882 H GLY 109 H GLY 109 5.670 -5.018 -2.429 883 HA2 GLY 109 HA2 GLY 109 3.743 -7.102 -3.311 884 HA3 GLY 109 HA3 GLY 109 5.458 -7.323 -3.682 885 H PHE 110 H PHE 110 3.396 -8.616 -1.779 886 HA PHE 110 HA PHE 110 4.748 -8.292 0.843 887 HB2 PHE 110 HB2 PHE 110 2.224 -9.657 -0.076 888 HB3 PHE 110 HB3 PHE 110 2.905 -9.984 1.493 889 HD1 PHE 110 HD1 PHE 110 1.808 -7.027 -0.602 890 HD2 PHE 110 HD2 PHE 110 2.484 -8.655 3.335 891 HE1 PHE 110 HE1 PHE 110 0.832 -4.983 0.420 892 HE2 PHE 110 HE2 PHE 110 1.402 -6.684 4.340 893 HZ PHE 110 HZ PHE 110 0.656 -4.793 2.882 894 H THR 111 H THR 111 5.233 -10.155 2.155 895 HA THR 111 HA THR 111 7.070 -11.948 0.843 896 HB THR 111 HB THR 111 7.123 -10.892 3.178 897 HG1 THR 111 HG1 THR 111 8.662 -12.171 3.532 898 HG21 THR 111 HG21 THR 111 5.602 -13.432 3.895 899 HG22 THR 111 HG22 THR 111 6.389 -12.337 5.030 900 HG23 THR 111 HG23 THR 111 5.012 -11.762 4.074 901 H ASP 112 H ASP 112 3.710 -12.139 1.625 902 HA ASP 112 HA ASP 112 3.547 -14.830 0.423 903 HB2 ASP 112 HB2 ASP 112 3.495 -14.897 3.017 904 HB3 ASP 112 HB3 ASP 112 1.914 -14.112 2.883 905 H ARG 113 H ARG 113 1.672 -15.223 -0.756 906 HA ARG 113 HA ARG 113 0.185 -13.080 -1.913 907 HB2 ARG 113 HB2 ARG 113 0.624 -15.631 -2.591 908 HB3 ARG 113 HB3 ARG 113 -0.872 -15.920 -1.723 909 HG2 ARG 113 HG2 ARG 113 -0.430 -14.216 -4.203 910 HG3 ARG 113 HG3 ARG 113 -1.278 -15.755 -4.090 911 HD2 ARG 113 HD2 ARG 113 -2.959 -14.576 -2.563 912 HD3 ARG 113 HD3 ARG 113 -2.176 -13.054 -3.047 913 HE ARG 113 HE ARG 113 -2.924 -14.598 -5.386 914 HH11 ARG 113 HH11 ARG 113 -4.526 -14.167 -6.534 915 HH12 ARG 113 HH12 ARG 113 -5.920 -13.196 -5.969 916 HH21 ARG 113 HH21 ARG 113 -4.228 -12.343 -3.065 917 HH22 ARG 113 HH22 ARG 113 -5.643 -12.038 -4.004 918 H GLY 114 H GLY 114 -0.500 -15.148 0.907 919 HA2 GLY 114 HA2 GLY 114 -3.183 -14.166 1.382 920 HA3 GLY 114 HA3 GLY 114 -2.160 -15.079 2.499 921 H ASP 115 H ASP 115 0.061 -13.101 2.481 922 HA ASP 115 HA ASP 115 -0.968 -11.248 4.475 923 HB2 ASP 115 HB2 ASP 115 1.734 -11.442 3.130 924 HB3 ASP 115 HB3 ASP 115 1.309 -10.263 4.375 925 H ALA 116 H ALA 116 -0.208 -10.957 1.009 926 HA ALA 116 HA ALA 116 -0.955 -8.157 0.860 927 HB1 ALA 116 HB1 ALA 116 -1.220 -8.808 -1.627 928 HB2 ALA 116 HB2 ALA 116 0.378 -8.981 -0.920 929 HB3 ALA 116 HB3 ALA 116 -0.650 -10.417 -1.140 930 H PHE 117 H PHE 117 -2.831 -11.233 0.245 931 HA PHE 117 HA PHE 117 -5.248 -9.929 -0.450 932 HB2 PHE 117 HB2 PHE 117 -4.870 -12.329 -0.729 933 HB3 PHE 117 HB3 PHE 117 -4.804 -12.535 1.018 934 HD1 PHE 117 HD1 PHE 117 -7.051 -11.743 -1.856 935 HD2 PHE 117 HD2 PHE 117 -6.835 -12.580 2.367 936 HE1 PHE 117 HE1 PHE 117 -9.508 -11.922 -1.765 937 HE2 PHE 117 HE2 PHE 117 -9.297 -12.907 2.421 938 HZ PHE 117 HZ PHE 117 -10.645 -12.538 0.368 939 H ASP 118 H ASP 118 -3.830 -10.462 2.765 940 HA ASP 118 HA ASP 118 -6.148 -9.545 4.252 941 HB2 ASP 118 HB2 ASP 118 -3.238 -9.913 5.010 942 HB3 ASP 118 HB3 ASP 118 -4.513 -9.471 6.141 943 H PHE 119 H PHE 119 -3.296 -7.922 2.787 944 HA PHE 119 HA PHE 119 -3.702 -5.384 4.029 945 HB2 PHE 119 HB2 PHE 119 -1.645 -5.853 2.900 946 HB3 PHE 119 HB3 PHE 119 -2.445 -6.213 1.393 947 HD1 PHE 119 HD1 PHE 119 -3.280 -4.458 -0.103 948 HD2 PHE 119 HD2 PHE 119 -1.230 -3.539 3.539 949 HE1 PHE 119 HE1 PHE 119 -2.947 -2.105 -0.894 950 HE2 PHE 119 HE2 PHE 119 -0.984 -1.183 2.814 951 HZ PHE 119 HZ PHE 119 -1.836 -0.466 0.595 952 H ASN 120 H ASN 120 -5.026 -6.876 1.068 953 HA ASN 120 HA ASN 120 -6.878 -4.775 0.406 954 HB2 ASN 120 HB2 ASN 120 -6.644 -6.197 -1.339 955 HB3 ASN 120 HB3 ASN 120 -6.445 -7.628 -0.326 956 HD21 ASN 120 HD21 ASN 120 -9.766 -8.647 -0.544 957 HD22 ASN 120 HD22 ASN 120 -8.195 -8.899 0.206 958 H VAL 121 H VAL 121 -7.434 -7.765 2.431 959 HA VAL 121 HA VAL 121 -10.133 -7.089 2.894 960 HB VAL 121 HB VAL 121 -8.253 -8.861 4.478 961 HG11 VAL 121 HG11 VAL 121 -10.273 -9.856 5.551 962 HG12 VAL 121 HG12 VAL 121 -9.967 -8.210 6.094 963 HG13 VAL 121 HG13 VAL 121 -11.253 -8.522 4.904 964 HG21 VAL 121 HG21 VAL 121 -8.917 -9.628 2.192 965 HG22 VAL 121 HG22 VAL 121 -9.588 -10.664 3.450 966 HG23 VAL 121 HG23 VAL 121 -10.623 -9.467 2.640 967 H SER 122 H SER 122 -7.264 -6.104 4.704 968 HA SER 122 HA SER 122 -8.490 -4.817 6.923 969 HB2 SER 122 HB2 SER 122 -5.974 -4.007 5.406 970 HB3 SER 122 HB3 SER 122 -6.427 -3.485 7.038 971 HG SER 122 HG SER 122 -5.802 -6.115 6.146 972 H LEU 123 H LEU 123 -8.378 -3.834 3.564 973 HA LEU 123 HA LEU 123 -9.437 -1.122 4.184 974 HB2 LEU 123 HB2 LEU 123 -8.377 -2.404 1.648 975 HB3 LEU 123 HB3 LEU 123 -9.057 -0.782 1.728 976 HG LEU 123 HG LEU 123 -6.742 -1.549 3.549 977 HD11 LEU 123 HD11 LEU 123 -6.011 -2.127 1.310 978 HD12 LEU 123 HD12 LEU 123 -6.567 -0.567 0.702 979 HD13 LEU 123 HD13 LEU 123 -5.206 -0.650 1.849 980 HD21 LEU 123 HD21 LEU 123 -7.614 1.101 2.322 981 HD22 LEU 123 HD22 LEU 123 -7.967 0.580 3.983 982 HD23 LEU 123 HD23 LEU 123 -6.296 0.851 3.486 983 H GLN 124 H GLN 124 -10.351 -4.146 2.456 984 HA GLN 124 HA GLN 124 -12.897 -3.392 1.504 985 HB2 GLN 124 HB2 GLN 124 -12.006 -6.031 2.726 986 HB3 GLN 124 HB3 GLN 124 -13.522 -5.822 1.883 987 HG2 GLN 124 HG2 GLN 124 -10.855 -5.254 0.535 988 HG3 GLN 124 HG3 GLN 124 -11.558 -6.861 0.602 989 HE21 GLN 124 HE21 GLN 124 -12.590 -5.631 -2.655 990 HE22 GLN 124 HE22 GLN 124 -11.118 -6.175 -1.837 991 H ASP 125 H ASP 125 -12.176 -4.853 4.744 992 HA ASP 125 HA ASP 125 -14.906 -4.408 5.666 993 HB2 ASP 125 HB2 ASP 125 -13.298 -6.275 6.344 994 HB3 ASP 125 HB3 ASP 125 -12.422 -5.061 7.293 995 H HIS 126 H HIS 126 -12.328 -2.258 5.375 996 HA HIS 126 HA HIS 126 -13.177 -0.506 7.625 997 HB2 HIS 126 HB2 HIS 126 -10.800 -0.640 7.265 998 HB3 HIS 126 HB3 HIS 126 -10.988 -0.217 5.559 999 HD2 HIS 126 HD2 HIS 126 -11.886 1.437 9.003 1000 HE1 HIS 126 HE1 HIS 126 -10.956 4.538 6.236 1001 HE2 HIS 126 HE2 HIS 126 -11.699 4.047 8.613 1002 H PHE 127 H PHE 127 -13.378 -0.706 4.059 1003 HA PHE 127 HA PHE 127 -15.077 1.704 4.047 1004 HB2 PHE 127 HB2 PHE 127 -13.768 0.132 1.854 1005 HB3 PHE 127 HB3 PHE 127 -14.980 1.374 1.545 1006 HD1 PHE 127 HD1 PHE 127 -11.485 0.810 2.423 1007 HD2 PHE 127 HD2 PHE 127 -14.653 3.730 2.472 1008 HE1 PHE 127 HE1 PHE 127 -9.817 2.604 2.803 1009 HE2 PHE 127 HE2 PHE 127 -12.979 5.511 2.935 1010 HZ PHE 127 HZ PHE 127 -10.569 4.951 3.079 1011 H LYS 128 H LYS 128 -15.682 -1.700 4.193 1012 HA LYS 128 HA LYS 128 -18.100 -1.857 2.822 1013 HB2 LYS 128 HB2 LYS 128 -18.519 -3.898 3.848 1014 HB3 LYS 128 HB3 LYS 128 -16.791 -3.756 3.707 1015 HG2 LYS 128 HG2 LYS 128 -16.929 -4.620 5.802 1016 HG3 LYS 128 HG3 LYS 128 -16.954 -2.897 6.234 1017 HD2 LYS 128 HD2 LYS 128 -19.513 -3.141 6.220 1018 HD3 LYS 128 HD3 LYS 128 -19.252 -4.873 5.986 1019 HE2 LYS 128 HE2 LYS 128 -18.116 -3.306 8.329 1020 HE3 LYS 128 HE3 LYS 128 -19.740 -3.999 8.353 1021 HZ1 LYS 128 HZ1 LYS 128 -18.170 -5.526 9.354 1022 HZ2 LYS 128 HZ2 LYS 128 -18.732 -6.198 7.977 1023 HZ3 LYS 128 HZ3 LYS 128 -17.224 -5.556 8.029 1024 H TRP 129 H TRP 129 -17.659 -0.388 5.937 1025 HA TRP 129 HA TRP 129 -20.599 -0.185 6.394 1026 HB2 TRP 129 HB2 TRP 129 -19.947 0.465 8.682 1027 HB3 TRP 129 HB3 TRP 129 -19.431 -1.136 8.198 1028 HD1 TRP 129 HD1 TRP 129 -16.849 -1.671 8.179 1029 HE1 TRP 129 HE1 TRP 129 -14.783 -0.443 8.904 1030 HE3 TRP 129 HE3 TRP 129 -18.877 2.998 8.814 1031 HZ2 TRP 129 HZ2 TRP 129 -14.020 2.273 9.645 1032 HZ3 TRP 129 HZ3 TRP 129 -17.401 4.927 9.386 1033 HH2 TRP 129 HH2 TRP 129 -14.984 4.568 9.814 1034 H VAL 130 H VAL 130 -18.545 1.608 4.701 1035 HA VAL 130 HA VAL 130 -19.987 4.169 5.201 1036 HB VAL 130 HB VAL 130 -17.505 4.989 4.227 1037 HG11 VAL 130 HG11 VAL 130 -18.593 4.964 7.062 1038 HG12 VAL 130 HG12 VAL 130 -17.278 6.000 6.477 1039 HG13 VAL 130 HG13 VAL 130 -18.912 6.192 5.818 1040 HG21 VAL 130 HG21 VAL 130 -16.494 2.855 4.803 1041 HG22 VAL 130 HG22 VAL 130 -15.795 4.224 5.675 1042 HG23 VAL 130 HG23 VAL 130 -16.896 3.110 6.503 1043 H LYS 131 H LYS 131 -18.843 5.521 2.969 1044 HA LYS 131 HA LYS 131 -19.267 5.911 0.808 1045 HB2 LYS 131 HB2 LYS 131 -17.494 3.922 1.016 1046 HB3 LYS 131 HB3 LYS 131 -18.762 2.985 0.251 1047 HG2 LYS 131 HG2 LYS 131 -17.419 3.708 -1.506 1048 HG3 LYS 131 HG3 LYS 131 -18.797 4.824 -1.554 1049 HD2 LYS 131 HD2 LYS 131 -17.454 6.557 -0.410 1050 HD3 LYS 131 HD3 LYS 131 -16.118 5.408 -0.231 1051 HE2 LYS 131 HE2 LYS 131 -15.566 6.795 -2.095 1052 HE3 LYS 131 HE3 LYS 131 -15.995 5.197 -2.722 1053 HZ1 LYS 131 HZ1 LYS 131 -18.187 6.094 -3.315 1054 HZ2 LYS 131 HZ2 LYS 131 -17.806 7.564 -2.707 1055 HZ3 LYS 131 HZ3 LYS 131 -17.023 6.991 -4.016 1056 H GLN 132 H GLN 132 -21.579 4.968 2.377 1057 HA GLN 132 HA GLN 132 -23.719 4.289 2.240 1058 HB2 GLN 132 HB2 GLN 132 -23.712 5.448 -0.564 1059 HB3 GLN 132 HB3 GLN 132 -25.104 5.231 0.494 1060 HG2 GLN 132 HG2 GLN 132 -22.790 7.170 0.892 1061 HG3 GLN 132 HG3 GLN 132 -24.444 7.573 0.467 1062 HE21 GLN 132 HE21 GLN 132 -23.658 7.811 4.275 1063 HE22 GLN 132 HE22 GLN 132 -22.588 8.177 2.929 1064 H GLU 133 H GLU 133 -21.791 2.295 1.570 1065 HA GLU 133 HA GLU 133 -23.132 0.517 -0.328 1066 HB2 GLU 133 HB2 GLU 133 -20.739 0.168 1.509 1067 HB3 GLU 133 HB3 GLU 133 -21.343 -1.112 0.463 1068 HG2 GLU 133 HG2 GLU 133 -20.443 1.612 -0.584 1069 HG3 GLU 133 HG3 GLU 133 -19.382 0.224 -0.440 1070 H1 SER 149 H1 SER 149 8.952 -23.738 -15.368 1071 H2 SER 149 H2 SER 149 7.595 -23.984 -14.488 1072 H3 SER 149 H3 SER 149 8.458 -22.600 -14.303 1073 HA SER 149 HA SER 149 7.033 -23.407 -16.750 1074 HB2 SER 149 HB2 SER 149 5.483 -22.751 -14.939 1075 HB3 SER 149 HB3 SER 149 6.321 -21.195 -14.779 1076 HG SER 149 HG SER 149 4.376 -21.286 -16.161 1077 H GLN 150 H GLN 150 7.019 -21.858 -18.442 1078 HA GLN 150 HA GLN 150 9.411 -20.170 -18.700 1079 HB2 GLN 150 HB2 GLN 150 8.548 -21.532 -20.565 1080 HB3 GLN 150 HB3 GLN 150 7.010 -20.673 -20.508 1081 HG2 GLN 150 HG2 GLN 150 8.374 -19.914 -22.375 1082 HG3 GLN 150 HG3 GLN 150 8.095 -18.597 -21.253 1083 HE21 GLN 150 HE21 GLN 150 11.578 -18.249 -20.418 1084 HE22 GLN 150 HE22 GLN 150 9.932 -17.890 -19.882 1085 H ILE 151 H ILE 151 6.131 -19.758 -17.597 1086 HA ILE 151 HA ILE 151 5.994 -16.872 -18.099 1087 HB ILE 151 HB ILE 151 4.156 -18.658 -16.464 1088 HG12 ILE 151 HG12 ILE 151 3.931 -17.750 -19.376 1089 HG13 ILE 151 HG13 ILE 151 4.283 -19.393 -18.838 1090 HG21 ILE 151 HG21 ILE 151 2.508 -16.827 -16.726 1091 HG22 ILE 151 HG22 ILE 151 3.930 -16.246 -15.900 1092 HG23 ILE 151 HG23 ILE 151 3.704 -15.865 -17.622 1093 HD11 ILE 151 HD11 ILE 151 2.046 -19.469 -17.699 1094 HD12 ILE 151 HD12 ILE 151 1.656 -17.921 -18.492 1095 HD13 ILE 151 HD13 ILE 151 2.002 -19.351 -19.469 1096 H THR 152 H THR 152 6.190 -15.234 -16.589 1097 HA THR 152 HA THR 152 7.960 -15.555 -14.333 1098 HB THR 152 HB THR 152 7.265 -13.149 -13.891 1099 HG1 THR 152 HG1 THR 152 6.091 -12.165 -15.541 1100 HG21 THR 152 HG21 THR 152 8.176 -13.708 -16.738 1101 HG22 THR 152 HG22 THR 152 8.402 -12.209 -15.801 1102 HG23 THR 152 HG23 THR 152 9.226 -13.693 -15.300 1103 H SER 153 H SER 153 7.448 -14.786 -12.137 1104 HA SER 153 HA SER 153 5.055 -15.978 -11.005 1105 HB2 SER 153 HB2 SER 153 7.194 -14.273 -9.702 1106 HB3 SER 153 HB3 SER 153 6.003 -15.288 -8.861 1107 HG SER 153 HG SER 153 8.048 -16.342 -9.078 1108 H GLN 154 H GLN 154 4.263 -14.169 -12.715 1109 HA GLN 154 HA GLN 154 3.862 -11.523 -11.822 1110 HB2 GLN 154 HB2 GLN 154 2.448 -11.256 -13.807 1111 HB3 GLN 154 HB3 GLN 154 3.997 -12.019 -14.134 1112 HG2 GLN 154 HG2 GLN 154 2.847 -14.253 -14.219 1113 HG3 GLN 154 HG3 GLN 154 1.305 -13.442 -13.931 1114 HE21 GLN 154 HE21 GLN 154 3.161 -12.926 -17.596 1115 HE22 GLN 154 HE22 GLN 154 4.163 -13.243 -16.180 1116 H VAL 155 H VAL 155 1.823 -10.375 -11.651 1117 HA VAL 155 HA VAL 155 -0.048 -11.268 -9.717 1118 HB VAL 155 HB VAL 155 0.240 -8.957 -10.069 1119 HG11 VAL 155 HG11 VAL 155 -0.566 -9.219 -12.951 1120 HG12 VAL 155 HG12 VAL 155 -0.315 -7.701 -12.082 1121 HG13 VAL 155 HG13 VAL 155 1.052 -8.817 -12.305 1122 HG21 VAL 155 HG21 VAL 155 -2.185 -8.159 -10.820 1123 HG22 VAL 155 HG22 VAL 155 -2.520 -9.889 -10.720 1124 HG23 VAL 155 HG23 VAL 155 -1.927 -8.976 -9.315 1125 H TPO 156 H T2P 156 -1.401 -12.835 -9.853 1126 HA TPO 156 HA T2P 156 -2.410 -14.403 -11.957 1127 HB TPO 156 HB T2P 156 -3.619 -13.634 -9.338 1128 HG21 TPO 156 HG21 T2P 156 -5.271 -15.383 -9.464 1129 HG22 TPO 156 HG22 T2P 156 -5.031 -15.427 -11.222 1130 HG23 TPO 156 HG23 T2P 156 -5.571 -13.915 -10.411 1131 H GLY 157 H GLY 157 -4.134 -14.452 -13.013 1132 HA2 GLY 157 HA2 GLY 157 -6.267 -12.472 -13.144 1133 HA3 GLY 157 HA3 GLY 157 -5.254 -12.436 -14.594 1134 H GLN 158 H GLN 158 -4.870 -15.491 -14.051 1135 HA GLN 158 HA GLN 158 -6.820 -16.525 -15.820 1136 HB2 GLN 158 HB2 GLN 158 -5.678 -18.580 -15.546 1137 HB3 GLN 158 HB3 GLN 158 -4.472 -17.314 -15.564 1138 HG2 GLN 158 HG2 GLN 158 -5.486 -18.743 -13.052 1139 HG3 GLN 158 HG3 GLN 158 -4.047 -19.182 -13.946 1140 HE21 GLN 158 HE21 GLN 158 -3.006 -17.119 -11.001 1141 HE22 GLN 158 HE22 GLN 158 -3.779 -18.679 -11.243 1142 H ILE 159 H ILE 159 -7.121 -16.016 -12.450 1143 HA ILE 159 HA ILE 159 -9.621 -17.584 -12.361 1144 HB ILE 159 HB ILE 159 -7.849 -19.134 -11.682 1145 HG12 ILE 159 HG12 ILE 159 -9.717 -18.436 -9.383 1146 HG13 ILE 159 HG13 ILE 159 -10.188 -19.295 -10.850 1147 HG21 ILE 159 HG21 ILE 159 -7.372 -17.362 -9.258 1148 HG22 ILE 159 HG22 ILE 159 -6.595 -18.909 -9.614 1149 HG23 ILE 159 HG23 ILE 159 -6.264 -17.523 -10.637 1150 HD11 ILE 159 HD11 ILE 159 -8.550 -21.103 -10.298 1151 HD12 ILE 159 HD12 ILE 159 -8.204 -20.276 -8.759 1152 HD13 ILE 159 HD13 ILE 159 -9.828 -20.898 -9.081 1153 H GLY 160 H GLY 160 -7.557 -15.217 -10.710 1154 HA2 GLY 160 HA2 GLY 160 -8.143 -13.234 -9.656 1155 HA3 GLY 160 HA3 GLY 160 -9.792 -13.455 -10.246 1156 H TRP 161 H TRP 161 -7.832 -15.434 -8.027 1157 HA TRP 161 HA TRP 161 -10.063 -15.682 -6.123 1158 HB2 TRP 161 HB2 TRP 161 -9.052 -17.725 -5.487 1159 HB3 TRP 161 HB3 TRP 161 -9.157 -17.641 -7.227 1160 HD1 TRP 161 HD1 TRP 161 -6.264 -15.654 -6.787 1161 HE1 TRP 161 HE1 TRP 161 -4.109 -16.921 -7.032 1162 HE3 TRP 161 HE3 TRP 161 -8.106 -20.304 -5.855 1163 HZ2 TRP 161 HZ2 TRP 161 -3.267 -19.731 -6.939 1164 HZ3 TRP 161 HZ3 TRP 161 -6.589 -22.296 -5.917 1165 HH2 TRP 161 HH2 TRP 161 -4.181 -22.019 -6.470 1166 H ARG 162 H ARG 162 -7.837 -16.722 -4.266 1167 HA ARG 162 HA ARG 162 -7.933 -14.255 -2.574 1168 HB2 ARG 162 HB2 ARG 162 -8.911 -17.076 -1.910 1169 HB3 ARG 162 HB3 ARG 162 -9.138 -15.637 -0.910 1170 HG2 ARG 162 HG2 ARG 162 -10.415 -16.106 -3.643 1171 HG3 ARG 162 HG3 ARG 162 -11.194 -16.356 -2.084 1172 HD2 ARG 162 HD2 ARG 162 -11.028 -14.007 -1.516 1173 HD3 ARG 162 HD3 ARG 162 -10.065 -13.665 -2.950 1174 HE ARG 162 HE ARG 162 -12.976 -14.336 -2.862 1175 HH11 ARG 162 HH11 ARG 162 -14.214 -13.863 -4.656 1176 HH12 ARG 162 HH12 ARG 162 -13.461 -13.174 -6.065 1177 HH21 ARG 162 HH21 ARG 162 -10.278 -13.191 -4.815 1178 HH22 ARG 162 HH22 ARG 162 -11.274 -13.020 -6.220 1179 H ARG 163 H ARG 163 -7.243 -15.087 -0.193 1180 HA ARG 163 HA ARG 163 -4.447 -15.760 -0.138 1181 HB2 ARG 163 HB2 ARG 163 -4.645 -15.823 2.233 1182 HB3 ARG 163 HB3 ARG 163 -5.605 -14.480 1.642 1183 HG2 ARG 163 HG2 ARG 163 -7.648 -16.063 1.862 1184 HG3 ARG 163 HG3 ARG 163 -6.564 -17.128 2.755 1185 HD2 ARG 163 HD2 ARG 163 -7.658 -14.421 3.496 1186 HD3 ARG 163 HD3 ARG 163 -7.691 -15.905 4.425 1187 HE ARG 163 HE ARG 163 -5.788 -13.800 4.612 1188 HH11 ARG 163 HH11 ARG 163 -4.029 -13.889 5.857 1189 HH12 ARG 163 HH12 ARG 163 -3.367 -15.433 6.356 1190 HH21 ARG 163 HH21 ARG 163 -5.764 -17.313 4.776 1191 HH22 ARG 163 HH22 ARG 163 -4.326 -17.323 5.759 Start of MODEL 4 1 H1 GLY -4 H1 GLY -4 -3.970 23.641 25.504 2 H2 GLY -4 H2 GLY -4 -4.293 23.856 27.095 3 H3 GLY -4 H3 GLY -4 -2.750 23.606 26.599 4 HA2 GLY -4 HA2 GLY -4 -3.054 25.924 27.134 5 HA3 GLY -4 HA3 GLY -4 -2.725 25.696 25.408 6 H SER -3 H SER -3 -3.755 27.719 24.959 7 HA SER -3 HA SER -3 -6.543 28.201 25.589 8 HB2 SER -3 HB2 SER -3 -6.212 30.175 24.061 9 HB3 SER -3 HB3 SER -3 -5.098 30.078 25.432 10 HG SER -3 HG SER -3 -4.022 30.585 23.462 11 HA PRO -2 HA PRO -2 -8.445 26.228 22.094 12 HB2 PRO -2 HB2 PRO -2 -10.673 27.746 21.625 13 HB3 PRO -2 HB3 PRO -2 -10.474 26.714 23.074 14 HG2 PRO -2 HG2 PRO -2 -9.932 29.692 22.827 15 HG3 PRO -2 HG3 PRO -2 -10.890 28.844 24.084 16 HD2 PRO -2 HD2 PRO -2 -8.299 29.528 24.498 17 HD3 PRO -2 HD3 PRO -2 -8.945 27.979 25.114 18 H ASN -1 H ASN -1 -8.578 26.283 19.853 19 HA ASN -1 HA ASN -1 -8.050 28.743 18.326 20 HB2 ASN -1 HB2 ASN -1 -5.800 27.976 19.089 21 HB3 ASN -1 HB3 ASN -1 -6.093 26.391 18.386 22 HD21 ASN -1 HD21 ASN -1 -5.036 29.521 15.976 23 HD22 ASN -1 HD22 ASN -1 -5.425 29.803 17.668 24 H SER 0 H SER 0 -8.393 28.496 16.054 25 HA SER 0 HA SER 0 -10.523 26.877 15.242 26 HB2 SER 0 HB2 SER 0 -8.406 28.164 13.479 27 HB3 SER 0 HB3 SER 0 -10.054 27.708 13.003 28 HG SER 0 HG SER 0 -9.897 29.940 13.522 29 H MET 1 H MET 1 -7.165 25.911 15.355 30 HA MET 1 HA MET 1 -7.175 23.835 13.416 31 HB2 MET 1 HB2 MET 1 -5.204 23.034 14.504 32 HB3 MET 1 HB3 MET 1 -5.171 24.797 14.542 33 HG2 MET 1 HG2 MET 1 -6.099 24.670 16.903 34 HG3 MET 1 HG3 MET 1 -5.886 22.926 16.842 35 HE1 MET 1 HE1 MET 1 -2.022 22.457 16.800 36 HE2 MET 1 HE2 MET 1 -3.614 21.670 16.867 37 HE3 MET 1 HE3 MET 1 -3.080 22.484 15.376 38 H ALA 2 H ALA 2 -9.094 23.929 16.217 39 HA ALA 2 HA ALA 2 -9.182 21.297 17.162 40 HB1 ALA 2 HB1 ALA 2 -11.433 23.328 16.826 41 HB2 ALA 2 HB2 ALA 2 -11.428 21.957 17.954 42 HB3 ALA 2 HB3 ALA 2 -10.271 23.283 18.179 43 H THR 3 H THR 3 -10.112 22.274 13.984 44 HA THR 3 HA THR 3 -12.086 20.200 13.475 45 HB THR 3 HB THR 3 -11.761 20.836 11.112 46 HG1 THR 3 HG1 THR 3 -10.343 22.545 10.658 47 HG21 THR 3 HG21 THR 3 -13.305 22.156 12.559 48 HG22 THR 3 HG22 THR 3 -11.979 23.285 12.912 49 HG23 THR 3 HG23 THR 3 -12.592 23.119 11.252 50 H GLU 4 H GLU 4 -8.698 20.196 13.701 51 HA GLU 4 HA GLU 4 -8.389 17.551 12.370 52 HB2 GLU 4 HB2 GLU 4 -6.618 19.164 11.938 53 HB3 GLU 4 HB3 GLU 4 -6.399 19.451 13.663 54 HG2 GLU 4 HG2 GLU 4 -4.611 18.043 12.819 55 HG3 GLU 4 HG3 GLU 4 -5.585 17.178 13.995 56 H LEU 5 H LEU 5 -7.997 15.698 13.545 57 HA LEU 5 HA LEU 5 -8.768 15.802 16.433 58 HB2 LEU 5 HB2 LEU 5 -9.260 13.606 14.395 59 HB3 LEU 5 HB3 LEU 5 -9.762 13.584 16.087 60 HG LEU 5 HG LEU 5 -10.799 15.520 13.965 61 HD11 LEU 5 HD11 LEU 5 -12.892 14.268 14.178 62 HD12 LEU 5 HD12 LEU 5 -11.577 13.203 13.658 63 HD13 LEU 5 HD13 LEU 5 -12.137 13.161 15.348 64 HD21 LEU 5 HD21 LEU 5 -12.498 16.121 15.678 65 HD22 LEU 5 HD22 LEU 5 -11.630 15.135 16.877 66 HD23 LEU 5 HD23 LEU 5 -10.872 16.586 16.178 67 H GLU 6 H GLU 6 -6.233 15.145 14.418 68 HA GLU 6 HA GLU 6 -4.140 14.234 14.701 69 HB2 GLU 6 HB2 GLU 6 -4.651 15.181 17.526 70 HB3 GLU 6 HB3 GLU 6 -3.067 14.889 16.780 71 HG2 GLU 6 HG2 GLU 6 -3.615 16.684 15.110 72 HG3 GLU 6 HG3 GLU 6 -5.041 17.070 16.102 73 H TYR 7 H TYR 7 -5.785 12.012 14.657 74 HA TYR 7 HA TYR 7 -4.198 10.158 16.284 75 HB2 TYR 7 HB2 TYR 7 -5.953 8.978 17.238 76 HB3 TYR 7 HB3 TYR 7 -6.382 10.650 17.540 77 HD1 TYR 7 HD1 TYR 7 -8.188 11.730 16.071 78 HD2 TYR 7 HD2 TYR 7 -7.405 7.491 16.066 79 HE1 TYR 7 HE1 TYR 7 -10.381 11.322 14.958 80 HE2 TYR 7 HE2 TYR 7 -9.578 7.088 14.933 81 HH TYR 7 HH TYR 7 -11.824 9.755 14.108 82 H GLU 8 H GLU 8 -4.872 7.858 15.700 83 HA GLU 8 HA GLU 8 -6.277 7.299 13.297 84 HB2 GLU 8 HB2 GLU 8 -4.518 6.157 12.054 85 HB3 GLU 8 HB3 GLU 8 -4.292 7.882 12.048 86 HG2 GLU 8 HG2 GLU 8 -2.788 6.181 14.058 87 HG3 GLU 8 HG3 GLU 8 -2.251 6.282 12.395 88 H SER 9 H SER 9 -7.169 5.357 13.553 89 HA SER 9 HA SER 9 -6.370 3.695 15.859 90 HB2 SER 9 HB2 SER 9 -8.827 3.831 14.095 91 HB3 SER 9 HB3 SER 9 -8.582 2.552 15.307 92 HG SER 9 HG SER 9 -9.762 4.323 16.171 93 H VAL 10 H VAL 10 -5.304 1.742 15.625 94 HA VAL 10 HA VAL 10 -4.345 0.972 13.032 95 HB VAL 10 HB VAL 10 -4.326 -0.660 15.555 96 HG11 VAL 10 HG11 VAL 10 -2.267 -1.696 14.568 97 HG12 VAL 10 HG12 VAL 10 -3.706 -2.039 13.620 98 HG13 VAL 10 HG13 VAL 10 -2.563 -0.793 13.063 99 HG21 VAL 10 HG21 VAL 10 -2.067 0.223 15.960 100 HG22 VAL 10 HG22 VAL 10 -2.207 1.282 14.537 101 HG23 VAL 10 HG23 VAL 10 -3.239 1.533 15.959 102 H LEU 11 H LEU 11 -4.885 -0.579 11.630 103 HA LEU 11 HA LEU 11 -7.418 -2.136 12.051 104 HB2 LEU 11 HB2 LEU 11 -6.305 -0.921 9.493 105 HB3 LEU 11 HB3 LEU 11 -7.721 -1.958 9.603 106 HG LEU 11 HG LEU 11 -7.479 0.837 10.783 107 HD11 LEU 11 HD11 LEU 11 -8.981 -0.340 8.403 108 HD12 LEU 11 HD12 LEU 11 -9.223 1.296 9.034 109 HD13 LEU 11 HD13 LEU 11 -7.652 0.840 8.356 110 HD21 LEU 11 HD21 LEU 11 -8.981 -0.515 12.186 111 HD22 LEU 11 HD22 LEU 11 -9.926 0.599 11.200 112 HD23 LEU 11 HD23 LEU 11 -9.832 -1.115 10.740 113 H CYS 12 H CYS 12 -4.200 -2.111 10.460 114 HA CYS 12 HA CYS 12 -4.016 -5.016 10.817 115 HB2 CYS 12 HB2 CYS 12 -5.043 -4.876 8.625 116 HB3 CYS 12 HB3 CYS 12 -3.806 -3.750 8.058 117 HG CYS 12 HG CYS 12 -3.536 -6.132 6.974 118 H VAL 13 H VAL 13 -2.001 -5.853 10.810 119 HA VAL 13 HA VAL 13 0.322 -4.117 10.376 120 HB VAL 13 HB VAL 13 -0.031 -3.951 12.755 121 HG11 VAL 13 HG11 VAL 13 0.117 -5.828 14.302 122 HG12 VAL 13 HG12 VAL 13 -1.270 -6.031 13.229 123 HG13 VAL 13 HG13 VAL 13 0.209 -6.980 12.958 124 HG21 VAL 13 HG21 VAL 13 2.142 -4.665 13.565 125 HG22 VAL 13 HG22 VAL 13 2.324 -5.816 12.229 126 HG23 VAL 13 HG23 VAL 13 2.314 -4.069 11.911 127 H LYS 14 H LYS 14 1.827 -5.155 9.210 128 HA LYS 14 HA LYS 14 1.912 -8.111 9.391 129 HB2 LYS 14 HB2 LYS 14 2.053 -6.647 6.730 130 HB3 LYS 14 HB3 LYS 14 2.544 -8.310 6.939 131 HG2 LYS 14 HG2 LYS 14 -0.245 -7.285 7.588 132 HG3 LYS 14 HG3 LYS 14 0.220 -8.016 6.056 133 HD2 LYS 14 HD2 LYS 14 0.772 -10.118 7.095 134 HD3 LYS 14 HD3 LYS 14 0.527 -9.497 8.721 135 HE2 LYS 14 HE2 LYS 14 -1.671 -9.511 6.642 136 HE3 LYS 14 HE3 LYS 14 -1.353 -10.876 7.737 137 HZ1 LYS 14 HZ1 LYS 14 -3.065 -9.251 8.528 138 HZ2 LYS 14 HZ2 LYS 14 -1.833 -9.479 9.607 139 HZ3 LYS 14 HZ3 LYS 14 -1.899 -8.123 8.696 140 HA PRO 15 HA PRO 15 5.966 -7.578 10.566 141 HB2 PRO 15 HB2 PRO 15 6.940 -10.126 10.478 142 HB3 PRO 15 HB3 PRO 15 5.593 -9.647 11.553 143 HG2 PRO 15 HG2 PRO 15 5.386 -10.942 8.799 144 HG3 PRO 15 HG3 PRO 15 4.594 -11.465 10.324 145 HD2 PRO 15 HD2 PRO 15 3.301 -9.928 8.531 146 HD3 PRO 15 HD3 PRO 15 3.108 -9.669 10.292 147 H ASP 16 H ASP 16 5.557 -8.805 7.291 148 HA ASP 16 HA ASP 16 8.227 -7.785 6.522 149 HB2 ASP 16 HB2 ASP 16 8.520 -10.167 7.117 150 HB3 ASP 16 HB3 ASP 16 7.268 -10.608 5.958 151 H VAL 17 H VAL 17 8.076 -6.589 4.734 152 HA VAL 17 HA VAL 17 6.177 -7.142 2.571 153 HB VAL 17 HB VAL 17 4.782 -5.902 4.173 154 HG11 VAL 17 HG11 VAL 17 6.433 -4.550 5.346 155 HG12 VAL 17 HG12 VAL 17 6.735 -3.598 3.878 156 HG13 VAL 17 HG13 VAL 17 5.151 -3.537 4.667 157 HG21 VAL 17 HG21 VAL 17 5.438 -4.181 1.765 158 HG22 VAL 17 HG22 VAL 17 4.439 -5.657 1.728 159 HG23 VAL 17 HG23 VAL 17 3.913 -4.253 2.665 160 H SER 18 H SER 18 6.874 -6.188 0.635 161 HA SER 18 HA SER 18 9.460 -4.685 0.720 162 HB2 SER 18 HB2 SER 18 8.652 -6.801 -1.299 163 HB3 SER 18 HB3 SER 18 10.213 -5.964 -1.152 164 HG SER 18 HG SER 18 10.192 -8.096 -0.223 165 H VAL 19 H VAL 19 9.807 -3.096 -0.809 166 HA VAL 19 HA VAL 19 7.350 -2.115 -2.221 167 HB VAL 19 HB VAL 19 9.359 -0.748 -0.479 168 HG11 VAL 19 HG11 VAL 19 7.649 0.599 -2.582 169 HG12 VAL 19 HG12 VAL 19 8.413 1.441 -1.223 170 HG13 VAL 19 HG13 VAL 19 9.421 0.672 -2.434 171 HG21 VAL 19 HG21 VAL 19 7.227 -1.661 0.441 172 HG22 VAL 19 HG22 VAL 19 7.295 0.093 0.549 173 HG23 VAL 19 HG23 VAL 19 6.322 -0.668 -0.717 174 H TYR 20 H TYR 20 7.413 -1.348 -4.156 175 HA TYR 20 HA TYR 20 9.989 -1.236 -5.684 176 HB2 TYR 20 HB2 TYR 20 7.255 -1.993 -6.779 177 HB3 TYR 20 HB3 TYR 20 8.807 -2.108 -7.586 178 HD1 TYR 20 HD1 TYR 20 6.291 -4.016 -6.179 179 HD2 TYR 20 HD2 TYR 20 10.572 -3.615 -6.096 180 HE1 TYR 20 HE1 TYR 20 6.497 -6.401 -5.536 181 HE2 TYR 20 HE2 TYR 20 10.772 -6.008 -5.357 182 HH TYR 20 HH TYR 20 7.937 -8.129 -4.985 183 H ARG 21 H ARG 21 10.331 1.010 -5.811 184 HA ARG 21 HA ARG 21 8.348 2.991 -6.553 185 HB2 ARG 21 HB2 ARG 21 11.321 2.846 -7.208 186 HB3 ARG 21 HB3 ARG 21 10.291 4.255 -7.479 187 HG2 ARG 21 HG2 ARG 21 9.828 4.422 -5.057 188 HG3 ARG 21 HG3 ARG 21 10.862 3.023 -4.740 189 HD2 ARG 21 HD2 ARG 21 11.784 5.632 -6.025 190 HD3 ARG 21 HD3 ARG 21 11.980 5.209 -4.315 191 HE ARG 21 HE ARG 21 13.123 3.105 -5.860 192 HH11 ARG 21 HH11 ARG 21 15.149 2.775 -6.040 193 HH12 ARG 21 HH12 ARG 21 16.338 4.073 -5.910 194 HH21 ARG 21 HH21 ARG 21 13.922 6.461 -5.209 195 HH22 ARG 21 HH22 ARG 21 15.625 6.154 -5.419 196 H ILE 22 H ILE 22 7.323 3.399 -8.385 197 HA ILE 22 HA ILE 22 8.021 1.802 -10.810 198 HB ILE 22 HB ILE 22 5.699 1.583 -11.355 199 HG12 ILE 22 HG12 ILE 22 5.145 3.210 -8.851 200 HG13 ILE 22 HG13 ILE 22 4.687 3.581 -10.516 201 HG21 ILE 22 HG21 ILE 22 6.120 0.737 -8.495 202 HG22 ILE 22 HG22 ILE 22 5.089 -0.024 -9.699 203 HG23 ILE 22 HG23 ILE 22 6.848 -0.074 -9.897 204 HD11 ILE 22 HD11 ILE 22 3.525 1.434 -8.721 205 HD12 ILE 22 HD12 ILE 22 2.726 2.862 -9.391 206 HD13 ILE 22 HD13 ILE 22 3.200 1.533 -10.472 207 HA PRO 23 HA PRO 23 7.954 5.663 -13.007 208 HB2 PRO 23 HB2 PRO 23 7.884 4.707 -15.634 209 HB3 PRO 23 HB3 PRO 23 9.318 4.977 -14.611 210 HG2 PRO 23 HG2 PRO 23 7.968 2.406 -15.288 211 HG3 PRO 23 HG3 PRO 23 9.665 2.712 -14.855 212 HD2 PRO 23 HD2 PRO 23 7.704 1.654 -13.139 213 HD3 PRO 23 HD3 PRO 23 9.252 2.381 -12.630 214 HA PRO 24 HA PRO 24 3.863 5.599 -15.368 215 HB2 PRO 24 HB2 PRO 24 2.101 3.533 -15.395 216 HB3 PRO 24 HB3 PRO 24 3.574 3.545 -16.415 217 HG2 PRO 24 HG2 PRO 24 3.216 2.234 -13.691 218 HG3 PRO 24 HG3 PRO 24 3.829 1.486 -15.203 219 HD2 PRO 24 HD2 PRO 24 5.508 2.482 -13.322 220 HD3 PRO 24 HD3 PRO 24 5.863 2.660 -15.066 221 H ARG 25 H ARG 25 1.741 6.271 -14.899 222 HA ARG 25 HA ARG 25 0.753 5.977 -12.077 223 HB2 ARG 25 HB2 ARG 25 -0.335 8.099 -12.264 224 HB3 ARG 25 HB3 ARG 25 1.385 8.291 -12.599 225 HG2 ARG 25 HG2 ARG 25 0.972 8.496 -14.992 226 HG3 ARG 25 HG3 ARG 25 -0.742 8.078 -14.788 227 HD2 ARG 25 HD2 ARG 25 -1.135 10.078 -13.470 228 HD3 ARG 25 HD3 ARG 25 0.587 10.524 -13.572 229 HE ARG 25 HE ARG 25 -0.385 10.199 -16.217 230 HH11 ARG 25 HH11 ARG 25 -0.940 11.910 -17.524 231 HH12 ARG 25 HH12 ARG 25 -1.344 13.447 -16.820 232 HH21 ARG 25 HH21 ARG 25 -0.894 12.440 -13.572 233 HH22 ARG 25 HH22 ARG 25 -1.322 13.748 -14.641 234 H ALA 26 H ALA 26 -0.162 5.536 -15.407 235 HA ALA 26 HA ALA 26 -2.495 3.981 -14.617 236 HB1 ALA 26 HB1 ALA 26 -2.869 6.698 -15.963 237 HB2 ALA 26 HB2 ALA 26 -4.144 5.476 -15.682 238 HB3 ALA 26 HB3 ALA 26 -3.349 6.282 -14.312 239 H SER 27 H SER 27 -1.942 2.338 -15.781 240 HA SER 27 HA SER 27 -1.824 2.545 -18.754 241 HB2 SER 27 HB2 SER 27 -0.291 0.924 -17.634 242 HB3 SER 27 HB3 SER 27 -1.703 0.086 -16.968 243 HG SER 27 HG SER 27 -0.993 0.449 -19.704 244 H ASN 28 H ASN 28 -3.421 1.213 -19.938 245 HA ASN 28 HA ASN 28 -6.149 1.666 -19.039 246 HB2 ASN 28 HB2 ASN 28 -6.737 0.539 -21.184 247 HB3 ASN 28 HB3 ASN 28 -5.625 1.891 -21.374 248 HD21 ASN 28 HD21 ASN 28 -4.138 -1.901 -21.974 249 HD22 ASN 28 HD22 ASN 28 -5.478 -1.683 -20.857 250 H ARG 29 H ARG 29 -3.923 -0.925 -18.562 251 HA ARG 29 HA ARG 29 -6.028 -2.847 -17.661 252 HB2 ARG 29 HB2 ARG 29 -2.998 -3.076 -17.471 253 HB3 ARG 29 HB3 ARG 29 -4.174 -4.370 -17.262 254 HG2 ARG 29 HG2 ARG 29 -3.456 -2.951 -19.843 255 HG3 ARG 29 HG3 ARG 29 -3.078 -4.618 -19.389 256 HD2 ARG 29 HD2 ARG 29 -5.549 -5.093 -19.297 257 HD3 ARG 29 HD3 ARG 29 -5.835 -3.445 -19.903 258 HE ARG 29 HE ARG 29 -4.016 -4.887 -21.624 259 HH11 ARG 29 HH11 ARG 29 -4.658 -5.590 -23.633 260 HH12 ARG 29 HH12 ARG 29 -6.349 -5.793 -23.982 261 HH21 ARG 29 HH21 ARG 29 -7.446 -4.774 -20.898 262 HH22 ARG 29 HH22 ARG 29 -7.889 -5.334 -22.486 263 H GLY 30 H GLY 30 -4.346 -0.249 -16.349 264 HA2 GLY 30 HA2 GLY 30 -4.849 0.328 -13.992 265 HA3 GLY 30 HA3 GLY 30 -4.430 -1.360 -13.585 266 H TYR 31 H TYR 31 -2.316 -1.869 -13.239 267 HA TYR 31 HA TYR 31 -0.166 0.094 -14.026 268 HB2 TYR 31 HB2 TYR 31 -0.610 -1.307 -11.378 269 HB3 TYR 31 HB3 TYR 31 0.946 -0.663 -11.862 270 HD1 TYR 31 HD1 TYR 31 -2.460 0.209 -10.826 271 HD2 TYR 31 HD2 TYR 31 1.400 1.679 -12.064 272 HE1 TYR 31 HE1 TYR 31 -2.982 2.440 -9.810 273 HE2 TYR 31 HE2 TYR 31 0.912 3.877 -11.023 274 HH TYR 31 HH TYR 31 -0.607 5.124 -9.808 275 H ARG 32 H ARG 32 -1.004 -3.277 -13.501 276 HA ARG 32 HA ARG 32 0.096 -5.183 -13.425 277 HB2 ARG 32 HB2 ARG 32 1.499 -5.116 -15.916 278 HB3 ARG 32 HB3 ARG 32 0.071 -5.970 -15.384 279 HG2 ARG 32 HG2 ARG 32 -0.634 -4.964 -17.292 280 HG3 ARG 32 HG3 ARG 32 -1.289 -3.888 -16.069 281 HD2 ARG 32 HD2 ARG 32 0.337 -2.205 -16.541 282 HD3 ARG 32 HD3 ARG 32 1.373 -3.326 -17.424 283 HE ARG 32 HE ARG 32 -0.842 -1.777 -18.438 284 HH11 ARG 32 HH11 ARG 32 -1.212 -1.703 -20.544 285 HH12 ARG 32 HH12 ARG 32 -0.593 -2.931 -21.619 286 HH21 ARG 32 HH21 ARG 32 0.955 -4.721 -19.123 287 HH22 ARG 32 HH22 ARG 32 0.604 -4.614 -20.825 288 H ALA 33 H ALA 33 1.562 -5.615 -11.885 289 HA ALA 33 HA ALA 33 4.059 -4.463 -11.449 290 HB1 ALA 33 HB1 ALA 33 4.610 -6.541 -10.246 291 HB2 ALA 33 HB2 ALA 33 2.983 -5.991 -9.869 292 HB3 ALA 33 HB3 ALA 33 3.209 -7.358 -10.989 293 H SER 34 H SER 34 3.296 -7.088 -13.647 294 HA SER 34 HA SER 34 5.762 -7.924 -14.605 295 HB2 SER 34 HB2 SER 34 3.076 -7.559 -15.990 296 HB3 SER 34 HB3 SER 34 4.387 -8.635 -16.553 297 HG SER 34 HG SER 34 2.736 -9.665 -15.306 298 H ASP 35 H ASP 35 4.291 -4.770 -15.217 299 HA ASP 35 HA ASP 35 5.847 -4.239 -17.662 300 HB2 ASP 35 HB2 ASP 35 3.530 -3.384 -17.231 301 HB3 ASP 35 HB3 ASP 35 4.174 -2.388 -15.921 302 H TRP 36 H TRP 36 6.263 -3.812 -14.224 303 HA TRP 36 HA TRP 36 8.703 -2.145 -14.617 304 HB2 TRP 36 HB2 TRP 36 8.010 -1.066 -12.354 305 HB3 TRP 36 HB3 TRP 36 7.397 -0.540 -13.887 306 HD1 TRP 36 HD1 TRP 36 4.999 -0.498 -14.337 307 HE1 TRP 36 HE1 TRP 36 2.843 -1.055 -13.073 308 HE3 TRP 36 HE3 TRP 36 7.022 -2.949 -10.320 309 HZ2 TRP 36 HZ2 TRP 36 2.151 -1.954 -10.397 310 HZ3 TRP 36 HZ3 TRP 36 5.589 -3.656 -8.437 311 HH2 TRP 36 HH2 TRP 36 3.156 -3.144 -8.437 312 H LYS 37 H LYS 37 9.100 -2.226 -11.642 313 HA LYS 37 HA LYS 37 10.681 -4.704 -11.584 314 HB2 LYS 37 HB2 LYS 37 10.366 -2.563 -9.428 315 HB3 LYS 37 HB3 LYS 37 11.598 -3.821 -9.533 316 HG2 LYS 37 HG2 LYS 37 12.147 -2.697 -11.876 317 HG3 LYS 37 HG3 LYS 37 11.271 -1.316 -11.210 318 HD2 LYS 37 HD2 LYS 37 13.818 -2.617 -10.224 319 HD3 LYS 37 HD3 LYS 37 13.616 -0.970 -10.803 320 HE2 LYS 37 HE2 LYS 37 12.358 -2.084 -8.253 321 HE3 LYS 37 HE3 LYS 37 13.921 -1.289 -8.297 322 HZ1 LYS 37 HZ1 LYS 37 11.352 0.033 -9.054 323 HZ2 LYS 37 HZ2 LYS 37 12.188 0.238 -7.662 324 HZ3 LYS 37 HZ3 LYS 37 12.840 0.734 -9.077 325 H LEU 38 H LEU 38 9.367 -6.179 -11.741 326 HA LEU 38 HA LEU 38 7.188 -6.876 -10.070 327 HB2 LEU 38 HB2 LEU 38 7.575 -7.525 -12.436 328 HB3 LEU 38 HB3 LEU 38 9.088 -8.310 -11.992 329 HG LEU 38 HG LEU 38 7.859 -9.926 -10.661 330 HD11 LEU 38 HD11 LEU 38 5.727 -8.683 -10.294 331 HD12 LEU 38 HD12 LEU 38 5.391 -8.736 -12.039 332 HD13 LEU 38 HD13 LEU 38 5.402 -10.229 -11.081 333 HD21 LEU 38 HD21 LEU 38 7.042 -11.245 -12.591 334 HD22 LEU 38 HD22 LEU 38 7.050 -9.778 -13.595 335 HD23 LEU 38 HD23 LEU 38 8.573 -10.428 -12.951 336 H ASP 39 H ASP 39 10.650 -7.461 -9.671 337 HA ASP 39 HA ASP 39 10.128 -8.863 -7.101 338 HB2 ASP 39 HB2 ASP 39 11.591 -10.722 -7.703 339 HB3 ASP 39 HB3 ASP 39 10.203 -10.622 -8.766 340 H GLN 40 H GLN 40 11.634 -6.322 -8.343 341 HA GLN 40 HA GLN 40 14.238 -6.676 -6.913 342 HB2 GLN 40 HB2 GLN 40 13.600 -4.638 -9.061 343 HB3 GLN 40 HB3 GLN 40 15.149 -5.046 -8.359 344 HG2 GLN 40 HG2 GLN 40 15.316 -6.126 -10.322 345 HG3 GLN 40 HG3 GLN 40 14.663 -7.449 -9.364 346 HE21 GLN 40 HE21 GLN 40 12.831 -6.870 -12.716 347 HE22 GLN 40 HE22 GLN 40 14.550 -6.892 -12.343 348 HA PRO 41 HA PRO 41 11.879 -3.718 -4.328 349 HB2 PRO 41 HB2 PRO 41 12.931 -4.226 -1.865 350 HB3 PRO 41 HB3 PRO 41 11.721 -5.273 -2.670 351 HG2 PRO 41 HG2 PRO 41 14.739 -5.617 -2.637 352 HG3 PRO 41 HG3 PRO 41 13.484 -6.842 -2.259 353 HD2 PRO 41 HD2 PRO 41 14.621 -6.701 -4.720 354 HD3 PRO 41 HD3 PRO 41 12.876 -7.057 -4.530 355 H ASP 42 H ASP 42 12.197 -1.702 -3.640 356 HA ASP 42 HA ASP 42 14.922 -0.484 -3.682 357 HB2 ASP 42 HB2 ASP 42 12.134 0.739 -3.422 358 HB3 ASP 42 HB3 ASP 42 13.641 1.647 -3.484 359 H TRP 43 H TRP 43 12.278 -1.336 -1.554 360 HA TRP 43 HA TRP 43 13.929 -0.917 0.828 361 HB2 TRP 43 HB2 TRP 43 12.800 1.246 0.588 362 HB3 TRP 43 HB3 TRP 43 11.252 0.456 0.346 363 HD1 TRP 43 HD1 TRP 43 13.651 1.555 3.039 364 HE1 TRP 43 HE1 TRP 43 12.552 1.341 5.350 365 HE3 TRP 43 HE3 TRP 43 9.421 -1.013 1.706 366 HZ2 TRP 43 HZ2 TRP 43 10.086 0.332 6.440 367 HZ3 TRP 43 HZ3 TRP 43 7.713 -1.603 3.408 368 HH2 TRP 43 HH2 TRP 43 8.022 -0.910 5.776 369 H THR 44 H THR 44 13.247 -2.270 2.586 370 HA THR 44 HA THR 44 10.679 -3.657 2.378 371 HB THR 44 HB THR 44 11.479 -5.805 2.812 372 HG1 THR 44 HG1 THR 44 14.139 -4.818 2.806 373 HG21 THR 44 HG21 THR 44 13.372 -4.862 0.633 374 HG22 THR 44 HG22 THR 44 12.726 -6.504 0.908 375 HG23 THR 44 HG23 THR 44 11.646 -5.196 0.423 376 H GLY 45 H GLY 45 9.854 -4.390 4.332 377 HA2 GLY 45 HA2 GLY 45 11.109 -4.028 6.867 378 HA3 GLY 45 HA3 GLY 45 10.274 -2.543 6.438 379 H ARG 46 H ARG 46 8.499 -2.438 7.503 380 HA ARG 46 HA ARG 46 6.708 -4.792 8.020 381 HB2 ARG 46 HB2 ARG 46 8.173 -4.080 9.934 382 HB3 ARG 46 HB3 ARG 46 7.464 -2.474 9.846 383 HG2 ARG 46 HG2 ARG 46 5.195 -3.564 10.364 384 HG3 ARG 46 HG3 ARG 46 6.103 -5.067 10.644 385 HD2 ARG 46 HD2 ARG 46 7.536 -3.729 12.290 386 HD3 ARG 46 HD3 ARG 46 6.382 -2.406 12.097 387 HE ARG 46 HE ARG 46 5.552 -5.141 13.020 388 HH11 ARG 46 HH11 ARG 46 4.576 -5.336 14.983 389 HH12 ARG 46 HH12 ARG 46 4.182 -3.920 15.908 390 HH21 ARG 46 HH21 ARG 46 5.400 -1.651 13.639 391 HH22 ARG 46 HH22 ARG 46 4.724 -1.927 15.222 392 H LEU 47 H LEU 47 4.512 -4.397 8.052 393 HA LEU 47 HA LEU 47 3.545 -1.870 6.768 394 HB2 LEU 47 HB2 LEU 47 2.986 -4.042 5.668 395 HB3 LEU 47 HB3 LEU 47 2.311 -4.590 7.195 396 HG LEU 47 HG LEU 47 0.646 -2.586 6.979 397 HD11 LEU 47 HD11 LEU 47 1.527 -2.862 4.085 398 HD12 LEU 47 HD12 LEU 47 0.140 -1.929 4.697 399 HD13 LEU 47 HD13 LEU 47 1.781 -1.440 5.126 400 HD21 LEU 47 HD21 LEU 47 -0.870 -3.978 5.639 401 HD22 LEU 47 HD22 LEU 47 0.504 -5.010 5.169 402 HD23 LEU 47 HD23 LEU 47 -0.016 -4.910 6.862 403 H ARG 48 H ARG 48 2.383 -0.418 7.964 404 HA ARG 48 HA ARG 48 0.472 -1.589 9.928 405 HB2 ARG 48 HB2 ARG 48 1.493 1.278 10.018 406 HB3 ARG 48 HB3 ARG 48 0.308 0.557 11.093 407 HG2 ARG 48 HG2 ARG 48 3.200 -0.377 10.888 408 HG3 ARG 48 HG3 ARG 48 2.636 0.839 12.021 409 HD2 ARG 48 HD2 ARG 48 1.260 -1.854 11.961 410 HD3 ARG 48 HD3 ARG 48 2.843 -1.713 12.728 411 HE ARG 48 HE ARG 48 0.313 -0.779 13.762 412 HH11 ARG 48 HH11 ARG 48 0.234 0.136 15.786 413 HH12 ARG 48 HH12 ARG 48 1.677 0.777 16.509 414 HH21 ARG 48 HH21 ARG 48 3.746 0.092 13.865 415 HH22 ARG 48 HH22 ARG 48 3.571 0.798 15.438 416 H ILE 49 H ILE 49 -1.573 -1.170 9.563 417 HA ILE 49 HA ILE 49 -2.350 0.987 7.644 418 HB ILE 49 HB ILE 49 -3.782 -1.653 8.046 419 HG12 ILE 49 HG12 ILE 49 -2.173 -0.507 5.720 420 HG13 ILE 49 HG13 ILE 49 -1.825 -1.967 6.650 421 HG21 ILE 49 HG21 ILE 49 -4.505 0.637 6.183 422 HG22 ILE 49 HG22 ILE 49 -5.399 -0.886 6.436 423 HG23 ILE 49 HG23 ILE 49 -5.328 0.289 7.727 424 HD11 ILE 49 HD11 ILE 49 -3.946 -2.979 5.752 425 HD12 ILE 49 HD12 ILE 49 -4.081 -1.556 4.665 426 HD13 ILE 49 HD13 ILE 49 -2.687 -2.642 4.556 427 H THR 50 H THR 50 -3.558 2.474 8.549 428 HA THR 50 HA THR 50 -4.901 1.988 11.175 429 HB THR 50 HB THR 50 -4.029 4.044 12.061 430 HG1 THR 50 HG1 THR 50 -2.508 4.224 9.668 431 HG21 THR 50 HG21 THR 50 -2.548 2.019 12.326 432 HG22 THR 50 HG22 THR 50 -1.608 2.583 10.932 433 HG23 THR 50 HG23 THR 50 -1.705 3.576 12.398 434 H SER 51 H SER 51 -6.492 3.869 11.637 435 HA SER 51 HA SER 51 -7.291 5.436 9.266 436 HB2 SER 51 HB2 SER 51 -9.654 4.759 9.521 437 HB3 SER 51 HB3 SER 51 -8.597 3.441 9.003 438 HG SER 51 HG SER 51 -9.453 3.919 11.688 439 H LYS 52 H LYS 52 -7.587 7.419 9.779 440 HA LYS 52 HA LYS 52 -8.823 8.237 12.375 441 HB2 LYS 52 HB2 LYS 52 -6.598 9.214 11.660 442 HB3 LYS 52 HB3 LYS 52 -7.451 9.983 10.315 443 HG2 LYS 52 HG2 LYS 52 -9.035 10.874 12.266 444 HG3 LYS 52 HG3 LYS 52 -7.623 10.528 13.262 445 HD2 LYS 52 HD2 LYS 52 -7.850 12.360 10.867 446 HD3 LYS 52 HD3 LYS 52 -7.544 12.833 12.563 447 HE2 LYS 52 HE2 LYS 52 -5.302 11.977 12.460 448 HE3 LYS 52 HE3 LYS 52 -5.579 11.218 10.889 449 HZ1 LYS 52 HZ1 LYS 52 -5.731 14.145 11.369 450 HZ2 LYS 52 HZ2 LYS 52 -4.413 13.392 10.740 451 HZ3 LYS 52 HZ3 LYS 52 -5.822 13.411 9.913 452 H GLY 53 H GLY 53 -10.879 7.699 11.942 453 HA2 GLY 53 HA2 GLY 53 -13.093 8.183 11.388 454 HA3 GLY 53 HA3 GLY 53 -12.534 9.530 10.398 455 H LYS 54 H LYS 54 -13.581 9.194 8.508 456 HA LYS 54 HA LYS 54 -13.846 6.639 7.126 457 HB2 LYS 54 HB2 LYS 54 -15.460 8.518 6.999 458 HB3 LYS 54 HB3 LYS 54 -14.259 9.528 6.216 459 HG2 LYS 54 HG2 LYS 54 -15.047 6.920 4.900 460 HG3 LYS 54 HG3 LYS 54 -16.211 8.247 4.938 461 HD2 LYS 54 HD2 LYS 54 -14.389 9.725 3.897 462 HD3 LYS 54 HD3 LYS 54 -13.507 8.216 3.584 463 HE2 LYS 54 HE2 LYS 54 -15.550 7.340 2.392 464 HE3 LYS 54 HE3 LYS 54 -16.318 8.911 2.647 465 HZ1 LYS 54 HZ1 LYS 54 -15.330 8.977 0.488 466 HZ2 LYS 54 HZ2 LYS 54 -14.329 9.883 1.412 467 HZ3 LYS 54 HZ3 LYS 54 -13.901 8.362 1.007 468 H THR 55 H THR 55 -11.150 8.411 7.559 469 HA THR 55 HA THR 55 -10.004 7.614 4.966 470 HB THR 55 HB THR 55 -8.755 9.297 7.167 471 HG1 THR 55 HG1 THR 55 -9.604 11.084 6.080 472 HG21 THR 55 HG21 THR 55 -7.313 8.534 5.269 473 HG22 THR 55 HG22 THR 55 -8.523 9.149 4.119 474 HG23 THR 55 HG23 THR 55 -7.598 10.284 5.142 475 H ALA 56 H ALA 56 -8.582 5.993 4.752 476 HA ALA 56 HA ALA 56 -7.344 4.736 7.151 477 HB1 ALA 56 HB1 ALA 56 -8.561 3.140 5.776 478 HB2 ALA 56 HB2 ALA 56 -7.670 3.656 4.329 479 HB3 ALA 56 HB3 ALA 56 -6.821 2.833 5.654 480 H TYR 57 H TYR 57 -5.018 4.276 7.046 481 HA TYR 57 HA TYR 57 -3.449 5.901 5.113 482 HB2 TYR 57 HB2 TYR 57 -3.095 5.943 8.131 483 HB3 TYR 57 HB3 TYR 57 -2.033 6.695 6.956 484 HD1 TYR 57 HD1 TYR 57 -5.423 6.844 8.515 485 HD2 TYR 57 HD2 TYR 57 -2.532 8.874 6.034 486 HE1 TYR 57 HE1 TYR 57 -6.806 8.886 8.579 487 HE2 TYR 57 HE2 TYR 57 -3.878 10.967 6.205 488 HH TYR 57 HH TYR 57 -6.974 11.111 8.000 489 H ILE 58 H ILE 58 -2.105 4.535 4.150 490 HA ILE 58 HA ILE 58 -1.201 2.040 5.485 491 HB ILE 58 HB ILE 58 -0.175 3.067 2.832 492 HG12 ILE 58 HG12 ILE 58 -2.542 3.113 2.464 493 HG13 ILE 58 HG13 ILE 58 -1.791 1.795 1.592 494 HG21 ILE 58 HG21 ILE 58 0.232 0.673 2.447 495 HG22 ILE 58 HG22 ILE 58 1.065 1.264 3.884 496 HG23 ILE 58 HG23 ILE 58 -0.417 0.309 4.063 497 HD11 ILE 58 HD11 ILE 58 -2.649 0.161 3.200 498 HD12 ILE 58 HD12 ILE 58 -3.331 1.471 4.201 499 HD13 ILE 58 HD13 ILE 58 -3.954 1.183 2.566 500 H LYS 59 H LYS 59 0.283 2.419 7.037 501 HA LYS 59 HA LYS 59 2.480 4.417 6.518 502 HB2 LYS 59 HB2 LYS 59 1.242 3.588 9.173 503 HB3 LYS 59 HB3 LYS 59 2.662 4.627 8.971 504 HG2 LYS 59 HG2 LYS 59 1.213 6.117 7.477 505 HG3 LYS 59 HG3 LYS 59 -0.185 5.184 8.029 506 HD2 LYS 59 HD2 LYS 59 0.252 5.890 10.363 507 HD3 LYS 59 HD3 LYS 59 1.718 6.749 9.826 508 HE2 LYS 59 HE2 LYS 59 0.225 8.057 8.219 509 HE3 LYS 59 HE3 LYS 59 -1.172 7.351 9.043 510 HZ1 LYS 59 HZ1 LYS 59 0.903 8.960 10.441 511 HZ2 LYS 59 HZ2 LYS 59 -0.499 9.581 9.881 512 HZ3 LYS 59 HZ3 LYS 59 -0.539 8.481 11.064 513 H LEU 60 H LEU 60 4.310 3.557 5.975 514 HA LEU 60 HA LEU 60 4.848 0.695 6.587 515 HB2 LEU 60 HB2 LEU 60 6.072 2.691 4.652 516 HB3 LEU 60 HB3 LEU 60 6.625 1.028 4.834 517 HG LEU 60 HG LEU 60 3.769 1.748 4.027 518 HD11 LEU 60 HD11 LEU 60 5.335 2.587 2.343 519 HD12 LEU 60 HD12 LEU 60 6.144 1.003 2.288 520 HD13 LEU 60 HD13 LEU 60 4.464 1.172 1.732 521 HD21 LEU 60 HD21 LEU 60 5.363 -0.850 3.825 522 HD22 LEU 60 HD22 LEU 60 4.031 -0.535 4.952 523 HD23 LEU 60 HD23 LEU 60 3.714 -0.589 3.214 524 H GLU 61 H GLU 61 6.443 0.000 7.906 525 HA GLU 61 HA GLU 61 8.068 2.068 9.345 526 HB2 GLU 61 HB2 GLU 61 6.746 -0.434 10.449 527 HB3 GLU 61 HB3 GLU 61 7.835 0.634 11.336 528 HG2 GLU 61 HG2 GLU 61 6.210 2.519 10.916 529 HG3 GLU 61 HG3 GLU 61 5.079 1.327 10.260 530 H ASP 62 H ASP 62 10.195 1.547 10.012 531 HA ASP 62 HA ASP 62 11.598 -0.429 8.471 532 HB2 ASP 62 HB2 ASP 62 12.433 1.828 9.151 533 HB3 ASP 62 HB3 ASP 62 12.470 1.282 10.828 534 H LYS 63 H LYS 63 12.211 -2.437 9.036 535 HA LYS 63 HA LYS 63 10.826 -3.871 11.091 536 HB2 LYS 63 HB2 LYS 63 11.591 -4.667 8.836 537 HB3 LYS 63 HB3 LYS 63 13.247 -4.720 9.443 538 HG2 LYS 63 HG2 LYS 63 12.556 -6.450 11.091 539 HG3 LYS 63 HG3 LYS 63 10.889 -6.359 10.501 540 HD2 LYS 63 HD2 LYS 63 13.306 -7.117 8.794 541 HD3 LYS 63 HD3 LYS 63 12.270 -8.286 9.621 542 HE2 LYS 63 HE2 LYS 63 10.324 -7.576 8.316 543 HE3 LYS 63 HE3 LYS 63 11.264 -6.307 7.525 544 HZ1 LYS 63 HZ1 LYS 63 11.877 -9.202 7.304 545 HZ2 LYS 63 HZ2 LYS 63 11.086 -8.347 6.162 546 HZ3 LYS 63 HZ3 LYS 63 12.649 -7.999 6.509 547 H VAL 64 H VAL 64 13.686 -2.008 11.381 548 HA VAL 64 HA VAL 64 14.850 -3.621 13.596 549 HB VAL 64 HB VAL 64 15.949 -1.121 12.251 550 HG11 VAL 64 HG11 VAL 64 16.973 -1.597 14.406 551 HG12 VAL 64 HG12 VAL 64 17.282 -3.283 13.920 552 HG13 VAL 64 HG13 VAL 64 18.111 -1.936 13.104 553 HG21 VAL 64 HG21 VAL 64 16.485 -4.036 11.540 554 HG22 VAL 64 HG22 VAL 64 15.719 -2.810 10.500 555 HG23 VAL 64 HG23 VAL 64 17.415 -2.638 10.940 556 H SER 65 H SER 65 13.433 -0.444 12.875 557 HA SER 65 HA SER 65 13.639 0.237 15.756 558 HB2 SER 65 HB2 SER 65 14.037 2.575 14.941 559 HB3 SER 65 HB3 SER 65 15.291 1.415 14.459 560 HG SER 65 HG SER 65 14.557 2.807 12.761 561 H GLY 66 H GLY 66 11.325 -0.139 13.275 562 HA2 GLY 66 HA2 GLY 66 9.098 0.393 13.154 563 HA3 GLY 66 HA3 GLY 66 9.169 1.136 14.754 564 H GLU 67 H GLU 67 11.550 2.411 12.563 565 HA GLU 67 HA GLU 67 10.322 5.037 12.689 566 HB2 GLU 67 HB2 GLU 67 12.779 3.980 11.260 567 HB3 GLU 67 HB3 GLU 67 12.243 5.659 11.136 568 HG2 GLU 67 HG2 GLU 67 12.407 5.972 13.550 569 HG3 GLU 67 HG3 GLU 67 12.862 4.289 13.784 570 H LEU 68 H LEU 68 9.328 6.282 11.081 571 HA LEU 68 HA LEU 68 7.818 4.777 9.168 572 HB2 LEU 68 HB2 LEU 68 7.029 6.809 10.437 573 HB3 LEU 68 HB3 LEU 68 8.090 7.788 9.428 574 HG LEU 68 HG LEU 68 6.785 6.862 7.397 575 HD11 LEU 68 HD11 LEU 68 4.784 6.128 9.585 576 HD12 LEU 68 HD12 LEU 68 4.505 6.071 7.828 577 HD13 LEU 68 HD13 LEU 68 5.656 4.961 8.577 578 HD21 LEU 68 HD21 LEU 68 5.310 8.553 9.456 579 HD22 LEU 68 HD22 LEU 68 6.472 9.142 8.245 580 HD23 LEU 68 HD23 LEU 68 4.930 8.445 7.721 581 H PHE 69 H PHE 69 8.316 4.186 7.196 582 HA PHE 69 HA PHE 69 10.513 5.373 5.590 583 HB2 PHE 69 HB2 PHE 69 10.409 3.028 5.545 584 HB3 PHE 69 HB3 PHE 69 8.664 3.003 5.347 585 HD1 PHE 69 HD1 PHE 69 11.514 4.653 3.461 586 HD2 PHE 69 HD2 PHE 69 8.021 2.139 3.303 587 HE1 PHE 69 HE1 PHE 69 11.718 4.519 1.008 588 HE2 PHE 69 HE2 PHE 69 8.228 1.992 0.854 589 HZ PHE 69 HZ PHE 69 10.047 3.199 -0.334 590 H ALA 70 H ALA 70 6.969 4.868 5.219 591 HA ALA 70 HA ALA 70 6.631 7.455 3.904 592 HB1 ALA 70 HB1 ALA 70 5.740 6.506 1.807 593 HB2 ALA 70 HB2 ALA 70 7.429 6.027 2.019 594 HB3 ALA 70 HB3 ALA 70 6.127 4.864 2.357 595 H GLN 71 H GLN 71 4.393 7.968 3.506 596 HA GLN 71 HA GLN 71 2.391 6.142 4.677 597 HB2 GLN 71 HB2 GLN 71 1.196 7.866 5.756 598 HB3 GLN 71 HB3 GLN 71 2.844 7.856 6.360 599 HG2 GLN 71 HG2 GLN 71 1.731 9.869 4.337 600 HG3 GLN 71 HG3 GLN 71 1.833 10.121 6.063 601 HE21 GLN 71 HE21 GLN 71 5.263 11.025 6.012 602 HE22 GLN 71 HE22 GLN 71 3.854 10.724 7.016 603 H ALA 72 H ALA 72 0.595 5.813 3.458 604 HA ALA 72 HA ALA 72 0.054 7.678 1.177 605 HB1 ALA 72 HB1 ALA 72 0.687 5.544 0.279 606 HB2 ALA 72 HB2 ALA 72 -0.489 4.704 1.323 607 HB3 ALA 72 HB3 ALA 72 -1.042 5.789 0.041 608 HA PRO 73 HA PRO 73 -3.799 8.018 3.671 609 HB2 PRO 73 HB2 PRO 73 -4.701 10.401 2.743 610 HB3 PRO 73 HB3 PRO 73 -3.317 10.277 3.871 611 HG2 PRO 73 HG2 PRO 73 -3.233 10.632 0.864 612 HG3 PRO 73 HG3 PRO 73 -2.296 11.504 2.114 613 HD2 PRO 73 HD2 PRO 73 -1.330 9.334 0.699 614 HD3 PRO 73 HD3 PRO 73 -0.799 9.727 2.363 615 H VAL 74 H VAL 74 -5.555 6.880 3.136 616 HA VAL 74 HA VAL 74 -6.508 6.737 0.300 617 HB VAL 74 HB VAL 74 -6.687 4.582 2.431 618 HG11 VAL 74 HG11 VAL 74 -7.562 3.152 0.761 619 HG12 VAL 74 HG12 VAL 74 -8.532 4.598 0.721 620 HG13 VAL 74 HG13 VAL 74 -7.293 4.358 -0.526 621 HG21 VAL 74 HG21 VAL 74 -5.067 3.290 1.340 622 HG22 VAL 74 HG22 VAL 74 -4.901 4.447 0.016 623 HG23 VAL 74 HG23 VAL 74 -4.334 4.861 1.648 624 H GLU 75 H GLU 75 -8.483 7.574 -0.025 625 HA GLU 75 HA GLU 75 -10.436 7.624 2.242 626 HB2 GLU 75 HB2 GLU 75 -9.335 9.844 1.126 627 HB3 GLU 75 HB3 GLU 75 -10.685 9.597 0.015 628 HG2 GLU 75 HG2 GLU 75 -12.023 9.283 2.327 629 HG3 GLU 75 HG3 GLU 75 -10.680 10.202 2.980 630 H GLN 76 H GLN 76 -9.865 5.924 -0.470 631 HA GLN 76 HA GLN 76 -12.534 4.972 -0.678 632 HB2 GLN 76 HB2 GLN 76 -13.003 5.430 -2.960 633 HB3 GLN 76 HB3 GLN 76 -12.647 6.973 -2.205 634 HG2 GLN 76 HG2 GLN 76 -10.820 5.393 -4.061 635 HG3 GLN 76 HG3 GLN 76 -11.747 6.817 -4.470 636 HE21 GLN 76 HE21 GLN 76 -8.134 7.283 -2.644 637 HE22 GLN 76 HE22 GLN 76 -8.885 5.673 -2.688 638 H TYR 77 H TYR 77 -12.564 2.877 -1.536 639 HA TYR 77 HA TYR 77 -10.129 1.852 -2.857 640 HB2 TYR 77 HB2 TYR 77 -10.007 1.378 -0.408 641 HB3 TYR 77 HB3 TYR 77 -11.468 0.397 -0.570 642 HD1 TYR 77 HD1 TYR 77 -10.686 -1.815 -0.053 643 HD2 TYR 77 HD2 TYR 77 -8.393 0.670 -2.723 644 HE1 TYR 77 HE1 TYR 77 -9.184 -3.708 -0.546 645 HE2 TYR 77 HE2 TYR 77 -6.815 -1.153 -3.094 646 HH TYR 77 HH TYR 77 -7.458 -4.470 -1.837 647 HA PRO 78 HA PRO 78 -9.500 0.341 -4.586 648 HB2 PRO 78 HB2 PRO 78 -10.896 0.580 -7.233 649 HB3 PRO 78 HB3 PRO 78 -9.439 -0.368 -6.795 650 HG2 PRO 78 HG2 PRO 78 -11.818 -1.618 -7.041 651 HG3 PRO 78 HG3 PRO 78 -10.769 -1.997 -5.632 652 HD2 PRO 78 HD2 PRO 78 -13.125 -0.078 -5.752 653 HD3 PRO 78 HD3 PRO 78 -12.789 -1.364 -4.554 654 H GLY 79 H GLY 79 -8.156 2.040 -5.452 655 HA2 GLY 79 HA2 GLY 79 -9.310 4.502 -6.521 656 HA3 GLY 79 HA3 GLY 79 -8.752 4.647 -4.853 657 H ILE 80 H ILE 80 -7.326 6.277 -5.786 658 HA ILE 80 HA ILE 80 -5.067 5.328 -7.417 659 HB ILE 80 HB ILE 80 -6.126 7.531 -7.830 660 HG12 ILE 80 HG12 ILE 80 -4.112 8.902 -8.045 661 HG13 ILE 80 HG13 ILE 80 -3.223 7.821 -6.975 662 HG21 ILE 80 HG21 ILE 80 -6.635 8.212 -5.489 663 HG22 ILE 80 HG22 ILE 80 -4.892 8.426 -5.184 664 HG23 ILE 80 HG23 ILE 80 -5.725 9.442 -6.365 665 HD11 ILE 80 HD11 ILE 80 -2.741 7.476 -9.410 666 HD12 ILE 80 HD12 ILE 80 -3.364 6.014 -8.631 667 HD13 ILE 80 HD13 ILE 80 -4.433 7.002 -9.659 668 H ALA 81 H ALA 81 -5.815 5.910 -4.045 669 HA ALA 81 HA ALA 81 -3.015 5.903 -3.271 670 HB1 ALA 81 HB1 ALA 81 -5.519 6.043 -1.592 671 HB2 ALA 81 HB2 ALA 81 -3.832 6.251 -1.028 672 HB3 ALA 81 HB3 ALA 81 -4.544 7.421 -2.163 673 H VAL 82 H VAL 82 -5.529 3.475 -3.473 674 HA VAL 82 HA VAL 82 -3.365 1.513 -3.165 675 HB VAL 82 HB VAL 82 -4.146 1.593 -0.972 676 HG11 VAL 82 HG11 VAL 82 -6.652 0.446 -0.855 677 HG12 VAL 82 HG12 VAL 82 -6.088 2.001 -0.298 678 HG13 VAL 82 HG13 VAL 82 -6.777 1.891 -1.909 679 HG21 VAL 82 HG21 VAL 82 -4.907 -1.006 -2.277 680 HG22 VAL 82 HG22 VAL 82 -3.290 -0.468 -1.846 681 HG23 VAL 82 HG23 VAL 82 -4.491 -0.737 -0.578 682 H GLU 83 H GLU 83 -3.441 0.166 -4.789 683 HA GLU 83 HA GLU 83 -5.982 -0.750 -6.045 684 HB2 GLU 83 HB2 GLU 83 -4.299 1.291 -7.116 685 HB3 GLU 83 HB3 GLU 83 -3.886 -0.145 -8.028 686 HG2 GLU 83 HG2 GLU 83 -6.725 0.897 -7.646 687 HG3 GLU 83 HG3 GLU 83 -5.676 1.313 -9.003 688 H THR 84 H THR 84 -5.772 -2.658 -7.412 689 HA THR 84 HA THR 84 -3.372 -4.368 -6.782 690 HB THR 84 HB THR 84 -5.821 -5.490 -7.994 691 HG1 THR 84 HG1 THR 84 -6.634 -4.423 -6.148 692 HG21 THR 84 HG21 THR 84 -3.808 -6.523 -5.981 693 HG22 THR 84 HG22 THR 84 -5.138 -7.456 -6.703 694 HG23 THR 84 HG23 THR 84 -3.820 -6.870 -7.729 695 H VAL 85 H VAL 85 -2.114 -3.582 -8.172 696 HA VAL 85 HA VAL 85 -1.235 -3.148 -10.424 697 HB VAL 85 HB VAL 85 -0.280 -5.542 -10.801 698 HG11 VAL 85 HG11 VAL 85 0.898 -3.661 -9.762 699 HG12 VAL 85 HG12 VAL 85 0.120 -3.991 -8.200 700 HG13 VAL 85 HG13 VAL 85 1.252 -5.153 -8.894 701 HG21 VAL 85 HG21 VAL 85 -2.095 -6.701 -9.351 702 HG22 VAL 85 HG22 VAL 85 -0.415 -7.075 -8.986 703 HG23 VAL 85 HG23 VAL 85 -1.313 -5.947 -7.962 704 H THR 86 H THR 86 -2.863 -6.249 -10.827 705 HA THR 86 HA THR 86 -4.679 -5.160 -12.799 706 HB THR 86 HB THR 86 -4.387 -7.243 -14.290 707 HG1 THR 86 HG1 THR 86 -2.367 -8.128 -14.327 708 HG21 THR 86 HG21 THR 86 -2.103 -5.241 -14.338 709 HG22 THR 86 HG22 THR 86 -2.757 -6.145 -15.724 710 HG23 THR 86 HG23 THR 86 -3.722 -4.874 -14.933 711 H ASP 87 H ASP 87 -3.503 -8.228 -11.393 712 HA ASP 87 HA ASP 87 -6.171 -8.660 -10.140 713 HB2 ASP 87 HB2 ASP 87 -6.282 -9.737 -12.369 714 HB3 ASP 87 HB3 ASP 87 -4.833 -10.666 -11.941 715 H SER 88 H SER 88 -3.219 -10.730 -10.606 716 HA SER 88 HA SER 88 -3.233 -11.929 -8.183 717 HB2 SER 88 HB2 SER 88 -1.506 -12.452 -9.805 718 HB3 SER 88 HB3 SER 88 -0.584 -11.025 -9.322 719 HG SER 88 HG SER 88 -0.662 -13.440 -8.303 720 H SER 89 H SER 89 -3.747 -11.078 -6.353 721 HA SER 89 HA SER 89 -2.817 -8.513 -5.462 722 HB2 SER 89 HB2 SER 89 -4.364 -8.938 -3.622 723 HB3 SER 89 HB3 SER 89 -5.033 -9.207 -5.255 724 HG SER 89 HG SER 89 -5.612 -10.898 -3.797 725 H ARG 90 H ARG 90 -1.195 -11.240 -5.516 726 HA ARG 90 HA ARG 90 0.643 -11.301 -3.346 727 HB2 ARG 90 HB2 ARG 90 0.455 -12.646 -5.514 728 HB3 ARG 90 HB3 ARG 90 1.096 -11.241 -6.369 729 HG2 ARG 90 HG2 ARG 90 3.202 -11.483 -4.954 730 HG3 ARG 90 HG3 ARG 90 2.522 -13.004 -4.343 731 HD2 ARG 90 HD2 ARG 90 3.205 -12.280 -7.223 732 HD3 ARG 90 HD3 ARG 90 4.030 -13.467 -6.230 733 HE ARG 90 HE ARG 90 1.424 -13.735 -7.630 734 HH11 ARG 90 HH11 ARG 90 0.548 -15.674 -7.947 735 HH12 ARG 90 HH12 ARG 90 1.162 -17.081 -7.097 736 HH21 ARG 90 HH21 ARG 90 3.606 -15.340 -5.402 737 HH22 ARG 90 HH22 ARG 90 2.858 -16.890 -5.674 738 H TYR 91 H TYR 91 -0.004 -8.867 -5.821 739 HA TYR 91 HA TYR 91 1.885 -6.990 -4.498 740 HB2 TYR 91 HB2 TYR 91 1.055 -6.832 -7.393 741 HB3 TYR 91 HB3 TYR 91 2.363 -5.967 -6.627 742 HD1 TYR 91 HD1 TYR 91 4.414 -7.321 -5.882 743 HD2 TYR 91 HD2 TYR 91 1.374 -8.837 -8.521 744 HE1 TYR 91 HE1 TYR 91 5.977 -9.110 -6.650 745 HE2 TYR 91 HE2 TYR 91 2.937 -10.542 -9.388 746 HH TYR 91 HH TYR 91 6.282 -10.872 -7.992 747 H PHE 92 H PHE 92 1.382 -4.770 -4.740 748 HA PHE 92 HA PHE 92 -1.331 -3.934 -5.570 749 HB2 PHE 92 HB2 PHE 92 -0.166 -3.261 -2.838 750 HB3 PHE 92 HB3 PHE 92 -1.606 -2.532 -3.534 751 HD1 PHE 92 HD1 PHE 92 -3.609 -4.014 -4.128 752 HD2 PHE 92 HD2 PHE 92 -0.317 -5.333 -1.675 753 HE1 PHE 92 HE1 PHE 92 -4.999 -5.883 -3.288 754 HE2 PHE 92 HE2 PHE 92 -1.749 -7.148 -0.759 755 HZ PHE 92 HZ PHE 92 -4.059 -7.474 -1.616 756 H VAL 93 H VAL 93 -1.389 -1.462 -5.494 757 HA VAL 93 HA VAL 93 1.259 -0.127 -5.624 758 HB VAL 93 HB VAL 93 -1.024 0.342 -7.586 759 HG11 VAL 93 HG11 VAL 93 1.545 1.923 -7.133 760 HG12 VAL 93 HG12 VAL 93 0.520 2.061 -8.563 761 HG13 VAL 93 HG13 VAL 93 -0.130 2.519 -6.997 762 HG21 VAL 93 HG21 VAL 93 0.413 -1.537 -8.238 763 HG22 VAL 93 HG22 VAL 93 0.718 -0.152 -9.286 764 HG23 VAL 93 HG23 VAL 93 1.867 -0.541 -8.001 765 H ILE 94 H ILE 94 1.331 1.721 -4.438 766 HA ILE 94 HA ILE 94 -1.210 2.956 -3.592 767 HB ILE 94 HB ILE 94 -0.485 3.313 -1.326 768 HG12 ILE 94 HG12 ILE 94 1.964 1.571 -1.877 769 HG13 ILE 94 HG13 ILE 94 2.007 3.330 -1.772 770 HG21 ILE 94 HG21 ILE 94 -0.806 1.096 -0.449 771 HG22 ILE 94 HG22 ILE 94 -1.709 1.199 -1.940 772 HG23 ILE 94 HG23 ILE 94 -0.167 0.331 -1.917 773 HD11 ILE 94 HD11 ILE 94 1.139 1.467 0.464 774 HD12 ILE 94 HD12 ILE 94 2.652 2.389 0.375 775 HD13 ILE 94 HD13 ILE 94 1.097 3.227 0.533 776 H ARG 95 H ARG 95 -1.174 5.113 -3.214 777 HA ARG 95 HA ARG 95 1.125 6.668 -4.351 778 HB2 ARG 95 HB2 ARG 95 -1.023 7.028 -5.406 779 HB3 ARG 95 HB3 ARG 95 -1.776 7.445 -3.881 780 HG2 ARG 95 HG2 ARG 95 0.553 9.081 -4.932 781 HG3 ARG 95 HG3 ARG 95 -1.097 9.315 -5.527 782 HD2 ARG 95 HD2 ARG 95 -1.861 9.572 -3.136 783 HD3 ARG 95 HD3 ARG 95 -0.158 9.651 -2.666 784 HE ARG 95 HE ARG 95 -0.145 11.563 -4.523 785 HH11 ARG 95 HH11 ARG 95 -0.338 13.652 -4.164 786 HH12 ARG 95 HH12 ARG 95 -1.590 14.282 -3.112 787 HH21 ARG 95 HH21 ARG 95 -2.611 11.158 -2.061 788 HH22 ARG 95 HH22 ARG 95 -2.818 12.880 -1.891 789 H ILE 96 H ILE 96 2.586 7.027 -2.847 790 HA ILE 96 HA ILE 96 1.826 7.671 -0.047 791 HB ILE 96 HB ILE 96 4.262 7.578 0.394 792 HG12 ILE 96 HG12 ILE 96 4.605 6.271 -2.328 793 HG13 ILE 96 HG13 ILE 96 4.874 8.005 -2.091 794 HG21 ILE 96 HG21 ILE 96 3.020 5.064 -0.781 795 HG22 ILE 96 HG22 ILE 96 4.430 5.090 0.285 796 HG23 ILE 96 HG23 ILE 96 2.874 5.648 0.894 797 HD11 ILE 96 HD11 ILE 96 6.368 5.801 -0.666 798 HD12 ILE 96 HD12 ILE 96 6.966 6.864 -1.964 799 HD13 ILE 96 HD13 ILE 96 6.549 7.549 -0.375 800 H GLN 97 H GLN 97 2.820 9.511 1.031 801 HA GLN 97 HA GLN 97 3.463 11.799 -0.772 802 HB2 GLN 97 HB2 GLN 97 2.735 11.715 2.164 803 HB3 GLN 97 HB3 GLN 97 3.456 13.115 1.369 804 HG2 GLN 97 HG2 GLN 97 1.473 12.657 -0.412 805 HG3 GLN 97 HG3 GLN 97 0.709 11.955 1.017 806 HE21 GLN 97 HE21 GLN 97 1.497 16.014 0.828 807 HE22 GLN 97 HE22 GLN 97 2.445 14.891 -0.159 808 H ASP 98 H ASP 98 5.361 13.030 -0.526 809 HA ASP 98 HA ASP 98 7.711 11.575 0.570 810 HB2 ASP 98 HB2 ASP 98 7.738 12.785 -1.620 811 HB3 ASP 98 HB3 ASP 98 7.449 14.280 -0.726 812 H GLY 99 H GLY 99 5.391 13.773 1.781 813 HA2 GLY 99 HA2 GLY 99 5.213 14.725 3.903 814 HA3 GLY 99 HA3 GLY 99 6.900 14.341 4.241 815 H THR 100 H THR 100 6.753 15.924 1.270 816 HA THR 100 HA THR 100 7.371 18.597 2.470 817 HB THR 100 HB THR 100 8.837 18.970 0.537 818 HG1 THR 100 HG1 THR 100 9.035 16.365 -0.166 819 HG21 THR 100 HG21 THR 100 10.630 17.445 1.112 820 HG22 THR 100 HG22 THR 100 9.810 18.000 2.586 821 HG23 THR 100 HG23 THR 100 9.500 16.364 1.956 822 H GLY 101 H GLY 101 4.715 17.497 1.436 823 HA2 GLY 101 HA2 GLY 101 2.845 18.643 0.594 824 HA3 GLY 101 HA3 GLY 101 3.885 19.868 -0.129 825 H ARG 102 H ARG 102 4.763 16.586 -0.750 826 HA ARG 102 HA ARG 102 3.477 16.524 -3.441 827 HB2 ARG 102 HB2 ARG 102 5.459 16.296 -4.573 828 HB3 ARG 102 HB3 ARG 102 5.791 17.572 -3.382 829 HG2 ARG 102 HG2 ARG 102 6.930 15.896 -1.966 830 HG3 ARG 102 HG3 ARG 102 6.696 14.674 -3.239 831 HD2 ARG 102 HD2 ARG 102 8.859 15.474 -3.648 832 HD3 ARG 102 HD3 ARG 102 7.840 16.340 -4.816 833 HE ARG 102 HE ARG 102 8.490 17.564 -2.165 834 HH11 ARG 102 HH11 ARG 102 9.295 19.593 -2.107 835 HH12 ARG 102 HH12 ARG 102 9.876 20.367 -3.555 836 HH21 ARG 102 HH21 ARG 102 9.074 17.742 -5.625 837 HH22 ARG 102 HH22 ARG 102 9.740 19.349 -5.513 838 H SER 103 H SER 103 4.032 14.375 -4.571 839 HA SER 103 HA SER 103 4.009 12.076 -2.714 840 HB2 SER 103 HB2 SER 103 1.949 11.192 -3.884 841 HB3 SER 103 HB3 SER 103 1.706 12.552 -2.788 842 HG SER 103 HG SER 103 1.988 12.835 -5.618 843 H ALA 104 H ALA 104 4.047 10.004 -3.634 844 HA ALA 104 HA ALA 104 5.086 9.712 -6.396 845 HB1 ALA 104 HB1 ALA 104 7.076 9.950 -4.963 846 HB2 ALA 104 HB2 ALA 104 6.482 8.642 -3.912 847 HB3 ALA 104 HB3 ALA 104 6.931 8.298 -5.596 848 H PHE 105 H PHE 105 4.724 7.711 -7.347 849 HA PHE 105 HA PHE 105 2.845 5.891 -5.939 850 HB2 PHE 105 HB2 PHE 105 3.774 5.786 -8.817 851 HB3 PHE 105 HB3 PHE 105 2.453 4.887 -8.076 852 HD1 PHE 105 HD1 PHE 105 3.384 7.918 -9.786 853 HD2 PHE 105 HD2 PHE 105 0.471 6.264 -7.066 854 HE1 PHE 105 HE1 PHE 105 1.853 9.798 -10.283 855 HE2 PHE 105 HE2 PHE 105 -1.075 8.123 -7.610 856 HZ PHE 105 HZ PHE 105 -0.405 9.894 -9.206 857 H ILE 106 H ILE 106 3.428 4.015 -5.123 858 HA ILE 106 HA ILE 106 5.822 2.624 -6.207 859 HB ILE 106 HB ILE 106 6.501 1.718 -4.103 860 HG12 ILE 106 HG12 ILE 106 4.246 3.458 -2.914 861 HG13 ILE 106 HG13 ILE 106 4.307 1.695 -2.906 862 HG21 ILE 106 HG21 ILE 106 6.286 4.742 -3.743 863 HG22 ILE 106 HG22 ILE 106 7.570 3.654 -3.171 864 HG23 ILE 106 HG23 ILE 106 7.380 3.968 -4.895 865 HD11 ILE 106 HD11 ILE 106 4.759 2.661 -0.714 866 HD12 ILE 106 HD12 ILE 106 6.089 1.678 -1.311 867 HD13 ILE 106 HD13 ILE 106 6.211 3.456 -1.335 868 H GLY 107 H GLY 107 5.603 0.564 -6.569 869 HA2 GLY 107 HA2 GLY 107 3.108 -0.929 -6.173 870 HA3 GLY 107 HA3 GLY 107 4.599 -1.519 -6.903 871 H ILE 108 H ILE 108 3.132 -2.845 -4.890 872 HA ILE 108 HA ILE 108 5.260 -3.061 -2.826 873 HB ILE 108 HB ILE 108 2.275 -3.460 -2.276 874 HG12 ILE 108 HG12 ILE 108 4.239 -1.225 -1.591 875 HG13 ILE 108 HG13 ILE 108 2.703 -1.091 -2.450 876 HG21 ILE 108 HG21 ILE 108 4.689 -3.612 -0.435 877 HG22 ILE 108 HG22 ILE 108 2.990 -3.851 0.042 878 HG23 ILE 108 HG23 ILE 108 3.753 -5.014 -1.007 879 HD11 ILE 108 HD11 ILE 108 2.446 -0.202 -0.250 880 HD12 ILE 108 HD12 ILE 108 1.522 -1.725 -0.324 881 HD13 ILE 108 HD13 ILE 108 3.105 -1.641 0.511 882 H GLY 109 H GLY 109 5.889 -5.191 -2.432 883 HA2 GLY 109 HA2 GLY 109 4.311 -7.448 -3.596 884 HA3 GLY 109 HA3 GLY 109 6.077 -7.466 -3.592 885 H PHE 110 H PHE 110 3.706 -8.920 -2.152 886 HA PHE 110 HA PHE 110 4.617 -8.651 0.664 887 HB2 PHE 110 HB2 PHE 110 2.166 -9.590 -0.734 888 HB3 PHE 110 HB3 PHE 110 2.546 -10.354 0.800 889 HD1 PHE 110 HD1 PHE 110 1.637 -7.138 -0.803 890 HD2 PHE 110 HD2 PHE 110 2.554 -9.148 2.902 891 HE1 PHE 110 HE1 PHE 110 0.726 -5.206 0.484 892 HE2 PHE 110 HE2 PHE 110 1.546 -7.281 4.173 893 HZ PHE 110 HZ PHE 110 0.703 -5.268 2.955 894 H THR 111 H THR 111 4.893 -10.442 2.021 895 HA THR 111 HA THR 111 6.705 -12.422 0.917 896 HB THR 111 HB THR 111 6.810 -11.113 3.121 897 HG1 THR 111 HG1 THR 111 8.286 -12.405 3.616 898 HG21 THR 111 HG21 THR 111 4.641 -11.803 4.080 899 HG22 THR 111 HG22 THR 111 5.201 -13.492 4.128 900 HG23 THR 111 HG23 THR 111 6.002 -12.266 5.115 901 H ASP 112 H ASP 112 3.336 -12.403 1.778 902 HA ASP 112 HA ASP 112 3.021 -15.178 0.824 903 HB2 ASP 112 HB2 ASP 112 3.199 -15.108 3.404 904 HB3 ASP 112 HB3 ASP 112 1.658 -14.239 3.379 905 H ARG 113 H ARG 113 1.057 -15.531 -0.253 906 HA ARG 113 HA ARG 113 -0.380 -13.248 -1.239 907 HB2 ARG 113 HB2 ARG 113 -0.093 -15.391 -2.473 908 HB3 ARG 113 HB3 ARG 113 -1.112 -16.212 -1.291 909 HG2 ARG 113 HG2 ARG 113 -2.325 -15.728 -3.358 910 HG3 ARG 113 HG3 ARG 113 -3.063 -14.889 -1.994 911 HD2 ARG 113 HD2 ARG 113 -2.131 -12.770 -2.668 912 HD3 ARG 113 HD3 ARG 113 -1.075 -13.533 -3.857 913 HE ARG 113 HE ARG 113 -3.926 -12.883 -4.126 914 HH11 ARG 113 HH11 ARG 113 -4.910 -13.194 -6.233 915 HH12 ARG 113 HH12 ARG 113 -3.882 -13.983 -7.442 916 HH21 ARG 113 HH21 ARG 113 -1.296 -14.770 -5.591 917 HH22 ARG 113 HH22 ARG 113 -2.146 -14.733 -7.140 918 H GLY 114 H GLY 114 -1.022 -15.377 1.527 919 HA2 GLY 114 HA2 GLY 114 -3.717 -14.377 2.038 920 HA3 GLY 114 HA3 GLY 114 -2.684 -15.310 3.132 921 H ASP 115 H ASP 115 -0.418 -13.471 3.137 922 HA ASP 115 HA ASP 115 -1.279 -11.459 5.046 923 HB2 ASP 115 HB2 ASP 115 1.330 -11.847 3.559 924 HB3 ASP 115 HB3 ASP 115 1.041 -10.553 4.711 925 H ALA 116 H ALA 116 -0.553 -11.382 1.566 926 HA ALA 116 HA ALA 116 -1.030 -8.567 1.278 927 HB1 ALA 116 HB1 ALA 116 0.223 -10.378 -0.220 928 HB2 ALA 116 HB2 ALA 116 -1.354 -10.544 -0.975 929 HB3 ALA 116 HB3 ALA 116 -0.540 -8.954 -0.944 930 H PHE 117 H PHE 117 -3.171 -11.446 0.688 931 HA PHE 117 HA PHE 117 -5.409 -9.910 -0.164 932 HB2 PHE 117 HB2 PHE 117 -5.066 -12.387 -0.417 933 HB3 PHE 117 HB3 PHE 117 -5.492 -12.572 1.283 934 HD1 PHE 117 HD1 PHE 117 -7.832 -12.203 2.026 935 HD2 PHE 117 HD2 PHE 117 -6.744 -11.773 -2.142 936 HE1 PHE 117 HE1 PHE 117 -10.227 -12.270 1.368 937 HE2 PHE 117 HE2 PHE 117 -9.086 -11.811 -2.763 938 HZ PHE 117 HZ PHE 117 -10.872 -12.056 -1.024 939 H ASP 118 H ASP 118 -4.124 -10.428 3.084 940 HA ASP 118 HA ASP 118 -6.478 -9.327 4.414 941 HB2 ASP 118 HB2 ASP 118 -4.923 -11.060 5.385 942 HB3 ASP 118 HB3 ASP 118 -3.699 -9.794 5.524 943 H PHE 119 H PHE 119 -3.407 -8.019 3.120 944 HA PHE 119 HA PHE 119 -3.701 -5.365 4.160 945 HB2 PHE 119 HB2 PHE 119 -1.629 -5.933 3.204 946 HB3 PHE 119 HB3 PHE 119 -2.331 -6.492 1.711 947 HD1 PHE 119 HD1 PHE 119 -0.936 -3.635 3.393 948 HD2 PHE 119 HD2 PHE 119 -3.330 -4.866 0.062 949 HE1 PHE 119 HE1 PHE 119 -0.688 -1.388 2.403 950 HE2 PHE 119 HE2 PHE 119 -3.015 -2.625 -0.993 951 HZ PHE 119 HZ PHE 119 -1.720 -0.878 0.198 952 H ASN 120 H ASN 120 -5.054 -7.001 1.292 953 HA ASN 120 HA ASN 120 -6.713 -4.806 0.434 954 HB2 ASN 120 HB2 ASN 120 -6.345 -6.407 -1.193 955 HB3 ASN 120 HB3 ASN 120 -6.560 -7.764 -0.097 956 HD21 ASN 120 HD21 ASN 120 -9.920 -8.209 -0.924 957 HD22 ASN 120 HD22 ASN 120 -8.508 -8.810 -0.072 958 H VAL 121 H VAL 121 -7.653 -7.718 2.416 959 HA VAL 121 HA VAL 121 -10.319 -6.821 2.729 960 HB VAL 121 HB VAL 121 -8.676 -8.807 4.317 961 HG11 VAL 121 HG11 VAL 121 -11.655 -8.237 4.630 962 HG12 VAL 121 HG12 VAL 121 -10.817 -9.677 5.250 963 HG13 VAL 121 HG13 VAL 121 -10.406 -8.088 5.889 964 HG21 VAL 121 HG21 VAL 121 -9.308 -9.373 1.952 965 HG22 VAL 121 HG22 VAL 121 -10.073 -10.442 3.129 966 HG23 VAL 121 HG23 VAL 121 -11.012 -9.137 2.370 967 H SER 122 H SER 122 -7.515 -6.049 4.773 968 HA SER 122 HA SER 122 -8.824 -4.761 6.917 969 HB2 SER 122 HB2 SER 122 -6.378 -5.181 6.714 970 HB3 SER 122 HB3 SER 122 -6.274 -3.919 5.471 971 HG SER 122 HG SER 122 -7.153 -3.579 8.167 972 H LEU 123 H LEU 123 -8.294 -3.606 3.594 973 HA LEU 123 HA LEU 123 -9.434 -0.945 4.198 974 HB2 LEU 123 HB2 LEU 123 -8.332 -2.104 1.627 975 HB3 LEU 123 HB3 LEU 123 -8.794 -0.419 1.889 976 HG LEU 123 HG LEU 123 -6.591 -1.895 3.384 977 HD11 LEU 123 HD11 LEU 123 -6.186 -1.453 0.931 978 HD12 LEU 123 HD12 LEU 123 -6.227 0.283 1.347 979 HD13 LEU 123 HD13 LEU 123 -5.005 -0.792 2.063 980 HD21 LEU 123 HD21 LEU 123 -5.887 0.388 4.111 981 HD22 LEU 123 HD22 LEU 123 -7.374 1.051 3.401 982 HD23 LEU 123 HD23 LEU 123 -7.453 -0.078 4.775 983 H GLN 124 H GLN 124 -10.351 -3.930 2.423 984 HA GLN 124 HA GLN 124 -12.792 -2.957 1.312 985 HB2 GLN 124 HB2 GLN 124 -12.205 -5.719 2.455 986 HB3 GLN 124 HB3 GLN 124 -13.602 -5.319 1.477 987 HG2 GLN 124 HG2 GLN 124 -10.721 -5.124 0.516 988 HG3 GLN 124 HG3 GLN 124 -11.785 -6.484 0.230 989 HE21 GLN 124 HE21 GLN 124 -11.839 -4.400 -2.829 990 HE22 GLN 124 HE22 GLN 124 -10.610 -5.286 -1.924 991 H ASP 125 H ASP 125 -12.228 -4.473 4.548 992 HA ASP 125 HA ASP 125 -14.923 -3.945 5.463 993 HB2 ASP 125 HB2 ASP 125 -13.386 -5.818 6.203 994 HB3 ASP 125 HB3 ASP 125 -12.486 -4.604 7.126 995 H HIS 126 H HIS 126 -12.294 -1.833 5.103 996 HA HIS 126 HA HIS 126 -13.135 0.016 7.265 997 HB2 HIS 126 HB2 HIS 126 -10.782 -0.029 6.835 998 HB3 HIS 126 HB3 HIS 126 -11.032 0.256 5.112 999 HD2 HIS 126 HD2 HIS 126 -11.815 2.667 4.316 1000 HE1 HIS 126 HE1 HIS 126 -11.165 4.742 7.957 1001 HE2 HIS 126 HE2 HIS 126 -11.693 5.010 5.480 1002 H PHE 127 H PHE 127 -13.585 -0.400 3.734 1003 HA PHE 127 HA PHE 127 -15.036 2.186 3.679 1004 HB2 PHE 127 HB2 PHE 127 -13.976 0.449 1.455 1005 HB3 PHE 127 HB3 PHE 127 -15.054 1.819 1.183 1006 HD1 PHE 127 HD1 PHE 127 -11.618 0.881 1.626 1007 HD2 PHE 127 HD2 PHE 127 -14.392 4.114 2.266 1008 HE1 PHE 127 HE1 PHE 127 -9.717 2.445 1.905 1009 HE2 PHE 127 HE2 PHE 127 -12.491 5.669 2.611 1010 HZ PHE 127 HZ PHE 127 -10.154 4.843 2.424 1011 H LYS 128 H LYS 128 -15.686 -1.170 3.632 1012 HA LYS 128 HA LYS 128 -18.229 -1.704 2.886 1013 HB2 LYS 128 HB2 LYS 128 -16.749 -3.218 3.922 1014 HB3 LYS 128 HB3 LYS 128 -16.638 -2.286 5.406 1015 HG2 LYS 128 HG2 LYS 128 -19.156 -3.704 4.505 1016 HG3 LYS 128 HG3 LYS 128 -17.842 -4.455 5.428 1017 HD2 LYS 128 HD2 LYS 128 -18.258 -2.331 7.022 1018 HD3 LYS 128 HD3 LYS 128 -19.891 -2.464 6.364 1019 HE2 LYS 128 HE2 LYS 128 -18.285 -4.676 7.711 1020 HE3 LYS 128 HE3 LYS 128 -19.494 -3.678 8.517 1021 HZ1 LYS 128 HZ1 LYS 128 -20.058 -5.520 6.249 1022 HZ2 LYS 128 HZ2 LYS 128 -20.454 -5.789 7.807 1023 HZ3 LYS 128 HZ3 LYS 128 -21.175 -4.578 6.986 1024 H TRP 129 H TRP 129 -17.529 0.210 5.830 1025 HA TRP 129 HA TRP 129 -20.446 0.596 6.302 1026 HB2 TRP 129 HB2 TRP 129 -19.733 1.228 8.578 1027 HB3 TRP 129 HB3 TRP 129 -19.324 -0.406 8.109 1028 HD1 TRP 129 HD1 TRP 129 -16.748 -1.065 7.955 1029 HE1 TRP 129 HE1 TRP 129 -14.603 0.065 8.605 1030 HE3 TRP 129 HE3 TRP 129 -18.572 3.621 8.820 1031 HZ2 TRP 129 HZ2 TRP 129 -13.709 2.721 9.438 1032 HZ3 TRP 129 HZ3 TRP 129 -17.035 5.470 9.502 1033 HH2 TRP 129 HH2 TRP 129 -14.604 5.024 9.809 1034 H VAL 130 H VAL 130 -18.375 2.248 4.523 1035 HA VAL 130 HA VAL 130 -19.631 4.906 5.008 1036 HB VAL 130 HB VAL 130 -17.106 5.667 4.262 1037 HG11 VAL 130 HG11 VAL 130 -18.521 6.779 5.903 1038 HG12 VAL 130 HG12 VAL 130 -18.324 5.425 7.036 1039 HG13 VAL 130 HG13 VAL 130 -16.938 6.449 6.627 1040 HG21 VAL 130 HG21 VAL 130 -15.475 4.741 5.725 1041 HG22 VAL 130 HG22 VAL 130 -16.633 3.578 6.385 1042 HG23 VAL 130 HG23 VAL 130 -16.144 3.479 4.689 1043 H LYS 131 H LYS 131 -18.172 6.136 2.855 1044 HA LYS 131 HA LYS 131 -18.471 6.609 0.702 1045 HB2 LYS 131 HB2 LYS 131 -16.813 4.615 0.980 1046 HB3 LYS 131 HB3 LYS 131 -18.081 3.631 0.267 1047 HG2 LYS 131 HG2 LYS 131 -16.533 4.207 -1.416 1048 HG3 LYS 131 HG3 LYS 131 -18.012 5.115 -1.742 1049 HD2 LYS 131 HD2 LYS 131 -16.953 7.162 -0.781 1050 HD3 LYS 131 HD3 LYS 131 -15.500 6.210 -0.421 1051 HE2 LYS 131 HE2 LYS 131 -15.051 7.396 -2.447 1052 HE3 LYS 131 HE3 LYS 131 -15.288 5.697 -2.874 1053 HZ1 LYS 131 HZ1 LYS 131 -17.556 6.268 -3.590 1054 HZ2 LYS 131 HZ2 LYS 131 -17.342 7.835 -3.173 1055 HZ3 LYS 131 HZ3 LYS 131 -16.476 7.187 -4.391 1056 H GLN 132 H GLN 132 -20.958 5.802 2.079 1057 HA GLN 132 HA GLN 132 -23.159 5.428 1.722 1058 HB2 GLN 132 HB2 GLN 132 -22.711 6.782 -0.957 1059 HB3 GLN 132 HB3 GLN 132 -24.216 6.707 -0.043 1060 HG2 GLN 132 HG2 GLN 132 -21.688 8.218 0.737 1061 HG3 GLN 132 HG3 GLN 132 -23.194 8.913 0.168 1062 HE21 GLN 132 HE21 GLN 132 -22.926 9.008 3.985 1063 HE22 GLN 132 HE22 GLN 132 -21.739 9.391 2.746 1064 H GLU 133 H GLU 133 -21.494 3.192 0.983 1065 HA GLU 133 HA GLU 133 -22.961 1.885 -1.201 1066 HB2 GLU 133 HB2 GLU 133 -20.763 0.835 0.620 1067 HB3 GLU 133 HB3 GLU 133 -21.522 -0.068 -0.695 1068 HG2 GLU 133 HG2 GLU 133 -20.814 1.817 -2.269 1069 HG3 GLU 133 HG3 GLU 133 -19.834 2.452 -0.947 1070 H1 SER 149 H1 SER 149 18.219 -16.842 -20.128 1071 H2 SER 149 H2 SER 149 18.887 -15.853 -19.004 1072 H3 SER 149 H3 SER 149 18.550 -15.284 -20.506 1073 HA SER 149 HA SER 149 16.901 -14.488 -18.972 1074 HB2 SER 149 HB2 SER 149 14.867 -15.386 -20.127 1075 HB3 SER 149 HB3 SER 149 16.136 -14.843 -21.233 1076 HG SER 149 HG SER 149 15.265 -16.891 -21.826 1077 H GLN 150 H GLN 150 14.933 -15.081 -17.696 1078 HA GLN 150 HA GLN 150 14.986 -17.719 -16.374 1079 HB2 GLN 150 HB2 GLN 150 15.853 -15.151 -15.120 1080 HB3 GLN 150 HB3 GLN 150 14.659 -16.031 -14.188 1081 HG2 GLN 150 HG2 GLN 150 17.278 -17.231 -15.175 1082 HG3 GLN 150 HG3 GLN 150 16.994 -16.585 -13.564 1083 HE21 GLN 150 HE21 GLN 150 16.525 -20.199 -13.138 1084 HE22 GLN 150 HE22 GLN 150 17.845 -19.064 -13.391 1085 H ILE 151 H ILE 151 13.178 -18.035 -14.906 1086 HA ILE 151 HA ILE 151 10.640 -17.270 -16.123 1087 HB ILE 151 HB ILE 151 11.278 -18.851 -13.601 1088 HG12 ILE 151 HG12 ILE 151 10.497 -19.788 -16.406 1089 HG13 ILE 151 HG13 ILE 151 12.118 -19.874 -15.724 1090 HG21 ILE 151 HG21 ILE 151 8.624 -18.571 -15.095 1091 HG22 ILE 151 HG22 ILE 151 8.931 -19.656 -13.723 1092 HG23 ILE 151 HG23 ILE 151 8.983 -17.929 -13.474 1093 HD11 ILE 151 HD11 ILE 151 9.705 -21.458 -14.800 1094 HD12 ILE 151 HD12 ILE 151 11.184 -22.048 -15.564 1095 HD13 ILE 151 HD13 ILE 151 11.253 -21.388 -13.918 1096 H THR 152 H THR 152 9.068 -15.902 -15.328 1097 HA THR 152 HA THR 152 9.779 -14.105 -13.042 1098 HB THR 152 HB THR 152 8.474 -12.336 -14.318 1099 HG1 THR 152 HG1 THR 152 9.213 -13.901 -16.550 1100 HG21 THR 152 HG21 THR 152 11.132 -13.268 -15.483 1101 HG22 THR 152 HG22 THR 152 10.412 -11.650 -15.662 1102 HG23 THR 152 HG23 THR 152 10.914 -12.223 -14.063 1103 H SER 153 H SER 153 8.238 -13.595 -11.593 1104 HA SER 153 HA SER 153 5.880 -15.347 -11.537 1105 HB2 SER 153 HB2 SER 153 7.009 -13.471 -9.453 1106 HB3 SER 153 HB3 SER 153 5.670 -14.612 -9.216 1107 HG SER 153 HG SER 153 8.380 -15.262 -9.855 1108 H GLN 154 H GLN 154 5.457 -13.711 -13.442 1109 HA GLN 154 HA GLN 154 4.480 -11.148 -13.251 1110 HB2 GLN 154 HB2 GLN 154 3.593 -13.422 -15.071 1111 HB3 GLN 154 HB3 GLN 154 3.121 -11.743 -15.320 1112 HG2 GLN 154 HG2 GLN 154 5.526 -11.085 -15.477 1113 HG3 GLN 154 HG3 GLN 154 5.994 -12.764 -15.223 1114 HE21 GLN 154 HE21 GLN 154 6.217 -12.904 -18.757 1115 HE22 GLN 154 HE22 GLN 154 7.099 -12.889 -17.226 1116 H VAL 155 H VAL 155 2.531 -10.074 -12.914 1117 HA VAL 155 HA VAL 155 0.716 -11.221 -11.024 1118 HB VAL 155 HB VAL 155 1.056 -8.899 -10.919 1119 HG11 VAL 155 HG11 VAL 155 -0.005 -8.636 -13.733 1120 HG12 VAL 155 HG12 VAL 155 0.253 -7.294 -12.609 1121 HG13 VAL 155 HG13 VAL 155 1.632 -8.269 -13.135 1122 HG21 VAL 155 HG21 VAL 155 -1.346 -7.938 -11.148 1123 HG22 VAL 155 HG22 VAL 155 -1.837 -9.573 -11.570 1124 HG23 VAL 155 HG23 VAL 155 -1.074 -9.188 -10.002 1125 H TPO 156 H T2P 156 -0.790 -12.490 -11.242 1126 HA TPO 156 HA T2P 156 -1.560 -14.091 -13.230 1127 HB TPO 156 HB T2P 156 -3.070 -13.220 -10.826 1128 HG21 TPO 156 HG21 T2P 156 -4.857 -13.983 -12.068 1129 HG22 TPO 156 HG22 T2P 156 -4.450 -15.257 -10.918 1130 HG23 TPO 156 HG23 T2P 156 -3.991 -15.462 -12.612 1131 H GLY 157 H GLY 157 -3.276 -14.570 -14.299 1132 HA2 GLY 157 HA2 GLY 157 -5.439 -12.877 -15.154 1133 HA3 GLY 157 HA3 GLY 157 -4.160 -12.858 -16.380 1134 H GLN 158 H GLN 158 -3.517 -15.749 -15.490 1135 HA GLN 158 HA GLN 158 -5.055 -17.224 -17.357 1136 HB2 GLN 158 HB2 GLN 158 -3.734 -19.063 -16.688 1137 HB3 GLN 158 HB3 GLN 158 -2.690 -17.660 -16.685 1138 HG2 GLN 158 HG2 GLN 158 -3.910 -18.948 -14.189 1139 HG3 GLN 158 HG3 GLN 158 -2.317 -19.298 -14.822 1140 HE21 GLN 158 HE21 GLN 158 -1.920 -16.889 -12.001 1141 HE22 GLN 158 HE22 GLN 158 -2.432 -18.546 -12.208 1142 H ILE 159 H ILE 159 -5.930 -16.343 -14.188 1143 HA ILE 159 HA ILE 159 -8.239 -18.161 -14.220 1144 HB ILE 159 HB ILE 159 -6.572 -19.476 -13.066 1145 HG12 ILE 159 HG12 ILE 159 -7.660 -19.915 -10.903 1146 HG13 ILE 159 HG13 ILE 159 -8.600 -18.433 -11.044 1147 HG21 ILE 159 HG21 ILE 159 -5.524 -18.844 -10.982 1148 HG22 ILE 159 HG22 ILE 159 -5.086 -17.686 -12.228 1149 HG23 ILE 159 HG23 ILE 159 -6.308 -17.258 -11.011 1150 HD11 ILE 159 HD11 ILE 159 -9.768 -19.349 -13.027 1151 HD12 ILE 159 HD12 ILE 159 -8.734 -20.797 -12.977 1152 HD13 ILE 159 HD13 ILE 159 -9.884 -20.471 -11.663 1153 H GLY 160 H GLY 160 -6.641 -15.491 -12.466 1154 HA2 GLY 160 HA2 GLY 160 -7.539 -13.378 -12.045 1155 HA3 GLY 160 HA3 GLY 160 -9.109 -13.906 -12.621 1156 H TRP 161 H TRP 161 -6.884 -14.195 -9.818 1157 HA TRP 161 HA TRP 161 -9.182 -14.631 -8.015 1158 HB2 TRP 161 HB2 TRP 161 -8.641 -16.800 -7.316 1159 HB3 TRP 161 HB3 TRP 161 -8.663 -16.820 -9.058 1160 HD1 TRP 161 HD1 TRP 161 -5.457 -15.415 -8.672 1161 HE1 TRP 161 HE1 TRP 161 -3.603 -17.170 -8.782 1162 HE3 TRP 161 HE3 TRP 161 -8.235 -19.456 -7.353 1163 HZ2 TRP 161 HZ2 TRP 161 -3.381 -20.023 -8.385 1164 HZ3 TRP 161 HZ3 TRP 161 -7.178 -21.733 -7.209 1165 HH2 TRP 161 HH2 TRP 161 -4.765 -22.025 -7.738 1166 H ARG 162 H ARG 162 -7.541 -15.946 -5.962 1167 HA ARG 162 HA ARG 162 -7.250 -13.262 -4.618 1168 HB2 ARG 162 HB2 ARG 162 -9.098 -15.609 -4.044 1169 HB3 ARG 162 HB3 ARG 162 -9.065 -14.092 -3.159 1170 HG2 ARG 162 HG2 ARG 162 -9.882 -14.569 -6.044 1171 HG3 ARG 162 HG3 ARG 162 -10.941 -14.138 -4.723 1172 HD2 ARG 162 HD2 ARG 162 -10.131 -11.897 -4.601 1173 HD3 ARG 162 HD3 ARG 162 -8.724 -12.218 -5.574 1174 HE ARG 162 HE ARG 162 -11.554 -12.138 -6.572 1175 HH11 ARG 162 HH11 ARG 162 -11.925 -11.355 -8.624 1176 HH12 ARG 162 HH12 ARG 162 -10.565 -10.933 -9.630 1177 HH21 ARG 162 HH21 ARG 162 -8.134 -11.837 -7.473 1178 HH22 ARG 162 HH22 ARG 162 -8.551 -11.218 -9.041 1179 H ARG 163 H ARG 163 -7.145 -16.736 -3.736 1180 HA ARG 163 HA ARG 163 -4.922 -16.211 -1.819 1181 HB2 ARG 163 HB2 ARG 163 -7.601 -17.494 -1.139 1182 HB3 ARG 163 HB3 ARG 163 -6.172 -17.513 -0.106 1183 HG2 ARG 163 HG2 ARG 163 -6.235 -15.008 0.012 1184 HG3 ARG 163 HG3 ARG 163 -7.696 -15.013 -0.985 1185 HD2 ARG 163 HD2 ARG 163 -8.391 -14.788 1.281 1186 HD3 ARG 163 HD3 ARG 163 -8.849 -16.404 0.731 1187 HE ARG 163 HE ARG 163 -6.297 -16.567 1.986 1188 HH11 ARG 163 HH11 ARG 163 -6.043 -17.350 4.051 1189 HH12 ARG 163 HH12 ARG 163 -7.386 -17.335 5.155 1190 HH21 ARG 163 HH21 ARG 163 -9.609 -15.961 2.943 1191 HH22 ARG 163 HH22 ARG 163 -9.351 -16.576 4.554 Start of MODEL 5 1 H1 GLY -4 H1 GLY -4 -16.552 29.641 25.860 2 H2 GLY -4 H2 GLY -4 -17.084 31.129 25.431 3 H3 GLY -4 H3 GLY -4 -15.483 30.869 25.671 4 HA2 GLY -4 HA2 GLY -4 -15.926 31.002 23.318 5 HA3 GLY -4 HA3 GLY -4 -15.378 29.381 23.781 6 H SER -3 H SER -3 -16.423 28.655 21.799 7 HA SER -3 HA SER -3 -19.202 28.914 21.290 8 HB2 SER -3 HB2 SER -3 -17.313 26.715 20.367 9 HB3 SER -3 HB3 SER -3 -18.856 27.158 19.617 10 HG SER -3 HG SER -3 -17.983 29.193 19.112 11 HA PRO -2 HA PRO -2 -20.948 25.860 24.021 12 HB2 PRO -2 HB2 PRO -2 -23.361 25.332 22.864 13 HB3 PRO -2 HB3 PRO -2 -22.961 26.919 23.587 14 HG2 PRO -2 HG2 PRO -2 -22.785 26.112 20.661 15 HG3 PRO -2 HG3 PRO -2 -23.586 27.557 21.361 16 HD2 PRO -2 HD2 PRO -2 -21.063 27.672 20.351 17 HD3 PRO -2 HD3 PRO -2 -21.517 28.603 21.809 18 H ASN -1 H ASN -1 -20.300 25.037 20.695 19 HA ASN -1 HA ASN -1 -19.769 22.240 21.426 20 HB2 ASN -1 HB2 ASN -1 -22.150 22.395 20.508 21 HB3 ASN -1 HB3 ASN -1 -21.461 22.964 18.989 22 HD21 ASN -1 HD21 ASN -1 -21.867 19.453 18.294 23 HD22 ASN -1 HD22 ASN -1 -22.713 20.993 18.229 24 H SER 0 H SER 0 -18.382 21.183 19.790 25 HA SER 0 HA SER 0 -16.328 23.006 18.762 26 HB2 SER 0 HB2 SER 0 -15.742 20.869 19.846 27 HB3 SER 0 HB3 SER 0 -16.546 19.985 18.531 28 HG SER 0 HG SER 0 -14.231 20.265 18.271 29 H MET 1 H MET 1 -15.648 23.205 16.657 30 HA MET 1 HA MET 1 -17.362 22.194 14.433 31 HB2 MET 1 HB2 MET 1 -16.287 25.030 14.692 32 HB3 MET 1 HB3 MET 1 -17.118 24.366 13.278 33 HG2 MET 1 HG2 MET 1 -19.120 23.917 14.682 34 HG3 MET 1 HG3 MET 1 -18.336 24.721 16.040 35 HE1 MET 1 HE1 MET 1 -18.237 28.464 14.985 36 HE2 MET 1 HE2 MET 1 -17.927 27.271 16.265 37 HE3 MET 1 HE3 MET 1 -16.917 27.293 14.799 38 H ALA 2 H ALA 2 -14.612 21.489 15.692 39 HA ALA 2 HA ALA 2 -12.710 22.027 13.584 40 HB1 ALA 2 HB1 ALA 2 -12.624 20.004 15.848 41 HB2 ALA 2 HB2 ALA 2 -11.276 20.464 14.788 42 HB3 ALA 2 HB3 ALA 2 -11.982 21.669 15.892 43 H THR 3 H THR 3 -12.482 21.075 11.772 44 HA THR 3 HA THR 3 -13.809 18.617 10.933 45 HB THR 3 HB THR 3 -12.503 19.022 8.826 46 HG1 THR 3 HG1 THR 3 -11.397 20.983 8.674 47 HG21 THR 3 HG21 THR 3 -14.023 21.455 9.865 48 HG22 THR 3 HG22 THR 3 -13.733 21.038 8.159 49 HG23 THR 3 HG23 THR 3 -14.767 20.002 9.161 50 H GLU 4 H GLU 4 -10.837 19.294 12.403 51 HA GLU 4 HA GLU 4 -9.619 16.676 11.666 52 HB2 GLU 4 HB2 GLU 4 -8.250 18.656 11.197 53 HB3 GLU 4 HB3 GLU 4 -8.409 19.195 12.867 54 HG2 GLU 4 HG2 GLU 4 -6.217 18.195 12.506 55 HG3 GLU 4 HG3 GLU 4 -7.146 17.242 13.652 56 H LEU 5 H LEU 5 -9.067 15.211 13.195 57 HA LEU 5 HA LEU 5 -9.971 15.637 16.015 58 HB2 LEU 5 HB2 LEU 5 -10.217 13.119 14.331 59 HB3 LEU 5 HB3 LEU 5 -10.625 13.240 16.043 60 HG LEU 5 HG LEU 5 -12.039 14.769 13.810 61 HD11 LEU 5 HD11 LEU 5 -12.930 12.354 15.436 62 HD12 LEU 5 HD12 LEU 5 -13.899 13.231 14.230 63 HD13 LEU 5 HD13 LEU 5 -12.456 12.343 13.721 64 HD21 LEU 5 HD21 LEU 5 -13.739 15.245 15.557 65 HD22 LEU 5 HD22 LEU 5 -12.691 14.492 16.780 66 HD23 LEU 5 HD23 LEU 5 -12.186 15.981 15.951 67 H GLU 6 H GLU 6 -7.367 15.132 14.093 68 HA GLU 6 HA GLU 6 -5.181 14.655 14.438 69 HB2 GLU 6 HB2 GLU 6 -5.789 15.547 17.264 70 HB3 GLU 6 HB3 GLU 6 -4.207 15.542 16.467 71 HG2 GLU 6 HG2 GLU 6 -5.099 17.176 14.800 72 HG3 GLU 6 HG3 GLU 6 -6.576 17.290 15.783 73 H TYR 7 H TYR 7 -6.700 12.210 14.670 74 HA TYR 7 HA TYR 7 -4.661 10.627 16.124 75 HB2 TYR 7 HB2 TYR 7 -6.134 9.312 17.314 76 HB3 TYR 7 HB3 TYR 7 -6.788 10.919 17.533 77 HD1 TYR 7 HD1 TYR 7 -7.489 7.534 16.526 78 HD2 TYR 7 HD2 TYR 7 -8.771 11.617 15.993 79 HE1 TYR 7 HE1 TYR 7 -9.671 6.731 15.667 80 HE2 TYR 7 HE2 TYR 7 -10.947 10.807 15.082 81 HH TYR 7 HH TYR 7 -11.741 7.312 14.879 82 H GLU 8 H GLU 8 -5.125 8.185 15.706 83 HA GLU 8 HA GLU 8 -6.557 7.367 13.438 84 HB2 GLU 8 HB2 GLU 8 -4.797 6.496 11.986 85 HB3 GLU 8 HB3 GLU 8 -4.773 8.234 12.042 86 HG2 GLU 8 HG2 GLU 8 -2.877 8.005 13.823 87 HG3 GLU 8 HG3 GLU 8 -2.791 6.315 13.301 88 H SER 9 H SER 9 -7.186 5.394 13.881 89 HA SER 9 HA SER 9 -5.910 3.869 16.064 90 HB2 SER 9 HB2 SER 9 -8.628 3.770 14.732 91 HB3 SER 9 HB3 SER 9 -8.087 2.555 15.913 92 HG SER 9 HG SER 9 -9.231 4.235 16.949 93 H VAL 10 H VAL 10 -5.102 1.741 15.831 94 HA VAL 10 HA VAL 10 -4.304 0.987 13.175 95 HB VAL 10 HB VAL 10 -2.946 0.536 15.144 96 HG11 VAL 10 HG11 VAL 10 -3.328 -1.385 16.582 97 HG12 VAL 10 HG12 VAL 10 -4.692 -0.266 16.725 98 HG13 VAL 10 HG13 VAL 10 -4.858 -1.753 15.766 99 HG21 VAL 10 HG21 VAL 10 -2.090 -1.614 14.430 100 HG22 VAL 10 HG22 VAL 10 -3.599 -2.000 13.592 101 HG23 VAL 10 HG23 VAL 10 -2.569 -0.671 13.010 102 H LEU 11 H LEU 11 -4.949 -0.478 11.766 103 HA LEU 11 HA LEU 11 -7.507 -1.979 12.236 104 HB2 LEU 11 HB2 LEU 11 -6.399 -0.920 9.605 105 HB3 LEU 11 HB3 LEU 11 -7.873 -1.846 9.824 106 HG LEU 11 HG LEU 11 -7.364 1.017 10.719 107 HD11 LEU 11 HD11 LEU 11 -9.203 1.433 9.075 108 HD12 LEU 11 HD12 LEU 11 -7.780 0.707 8.320 109 HD13 LEU 11 HD13 LEU 11 -9.212 -0.285 8.662 110 HD21 LEU 11 HD21 LEU 11 -8.806 -0.026 12.405 111 HD22 LEU 11 HD22 LEU 11 -9.759 1.048 11.382 112 HD23 LEU 11 HD23 LEU 11 -9.845 -0.712 11.130 113 H CYS 12 H CYS 12 -4.336 -1.994 10.555 114 HA CYS 12 HA CYS 12 -4.156 -4.908 10.901 115 HB2 CYS 12 HB2 CYS 12 -5.276 -4.421 8.661 116 HB3 CYS 12 HB3 CYS 12 -3.738 -3.716 8.138 117 HG CYS 12 HG CYS 12 -4.066 -6.151 7.173 118 H VAL 13 H VAL 13 -2.118 -5.761 10.739 119 HA VAL 13 HA VAL 13 0.223 -4.066 10.357 120 HB VAL 13 HB VAL 13 -0.156 -3.681 12.684 121 HG11 VAL 13 HG11 VAL 13 -1.550 -5.611 13.318 122 HG12 VAL 13 HG12 VAL 13 -0.131 -6.678 13.205 123 HG13 VAL 13 HG13 VAL 13 -0.185 -5.387 14.417 124 HG21 VAL 13 HG21 VAL 13 1.945 -4.427 13.638 125 HG22 VAL 13 HG22 VAL 13 2.082 -5.740 12.453 126 HG23 VAL 13 HG23 VAL 13 2.202 -4.048 11.930 127 H LYS 14 H LYS 14 1.649 -5.175 9.224 128 HA LYS 14 HA LYS 14 1.586 -8.167 9.280 129 HB2 LYS 14 HB2 LYS 14 1.916 -6.432 6.814 130 HB3 LYS 14 HB3 LYS 14 2.203 -8.144 6.846 131 HG2 LYS 14 HG2 LYS 14 -0.519 -6.966 7.608 132 HG3 LYS 14 HG3 LYS 14 -0.039 -7.308 5.955 133 HD2 LYS 14 HD2 LYS 14 -1.050 -9.269 6.386 134 HD3 LYS 14 HD3 LYS 14 0.573 -9.690 6.887 135 HE2 LYS 14 HE2 LYS 14 -0.131 -9.217 9.267 136 HE3 LYS 14 HE3 LYS 14 -1.774 -8.914 8.668 137 HZ1 LYS 14 HZ1 LYS 14 -1.946 -11.150 7.943 138 HZ2 LYS 14 HZ2 LYS 14 -0.344 -11.458 8.123 139 HZ3 LYS 14 HZ3 LYS 14 -1.311 -11.262 9.448 140 HA PRO 15 HA PRO 15 5.824 -7.657 10.335 141 HB2 PRO 15 HB2 PRO 15 6.703 -10.225 10.316 142 HB3 PRO 15 HB3 PRO 15 5.439 -9.668 11.457 143 HG2 PRO 15 HG2 PRO 15 5.034 -11.051 8.776 144 HG3 PRO 15 HG3 PRO 15 4.348 -11.516 10.368 145 HD2 PRO 15 HD2 PRO 15 2.951 -9.991 8.596 146 HD3 PRO 15 HD3 PRO 15 2.848 -9.702 10.361 147 H ASP 16 H ASP 16 4.913 -8.443 7.152 148 HA ASP 16 HA ASP 16 7.639 -7.822 6.179 149 HB2 ASP 16 HB2 ASP 16 7.603 -9.476 4.510 150 HB3 ASP 16 HB3 ASP 16 7.197 -10.314 6.002 151 H VAL 17 H VAL 17 7.726 -6.444 4.511 152 HA VAL 17 HA VAL 17 5.739 -6.369 2.449 153 HB VAL 17 HB VAL 17 4.501 -4.884 3.852 154 HG11 VAL 17 HG11 VAL 17 6.183 -4.195 5.458 155 HG12 VAL 17 HG12 VAL 17 6.996 -3.198 4.240 156 HG13 VAL 17 HG13 VAL 17 5.350 -2.795 4.787 157 HG21 VAL 17 HG21 VAL 17 4.682 -4.303 1.478 158 HG22 VAL 17 HG22 VAL 17 4.318 -2.923 2.522 159 HG23 VAL 17 HG23 VAL 17 5.957 -3.121 1.867 160 H SER 18 H SER 18 6.754 -5.842 0.557 161 HA SER 18 HA SER 18 9.363 -4.377 0.659 162 HB2 SER 18 HB2 SER 18 10.224 -5.741 -1.073 163 HB3 SER 18 HB3 SER 18 9.603 -6.814 0.180 164 HG SER 18 HG SER 18 7.623 -6.872 -1.177 165 H VAL 19 H VAL 19 9.827 -2.878 -0.988 166 HA VAL 19 HA VAL 19 7.454 -1.978 -2.590 167 HB VAL 19 HB VAL 19 9.237 -0.372 -0.778 168 HG11 VAL 19 HG11 VAL 19 7.409 0.603 -2.989 169 HG12 VAL 19 HG12 VAL 19 7.969 1.631 -1.658 170 HG13 VAL 19 HG13 VAL 19 9.143 0.962 -2.787 171 HG21 VAL 19 HG21 VAL 19 7.241 -1.405 0.231 172 HG22 VAL 19 HG22 VAL 19 7.023 0.340 0.099 173 HG23 VAL 19 HG23 VAL 19 6.224 -0.732 -1.059 174 H TYR 20 H TYR 20 7.673 -1.410 -4.555 175 HA TYR 20 HA TYR 20 10.276 -1.934 -5.858 176 HB2 TYR 20 HB2 TYR 20 7.419 -1.986 -6.895 177 HB3 TYR 20 HB3 TYR 20 8.826 -2.415 -7.855 178 HD1 TYR 20 HD1 TYR 20 6.213 -3.913 -6.249 179 HD2 TYR 20 HD2 TYR 20 10.507 -4.097 -6.490 180 HE1 TYR 20 HE1 TYR 20 6.153 -6.296 -5.579 181 HE2 TYR 20 HE2 TYR 20 10.446 -6.452 -5.645 182 HH TYR 20 HH TYR 20 7.395 -8.169 -4.994 183 H ARG 21 H ARG 21 8.693 0.897 -5.275 184 HA ARG 21 HA ARG 21 8.537 3.005 -6.345 185 HB2 ARG 21 HB2 ARG 21 11.444 2.143 -6.341 186 HB3 ARG 21 HB3 ARG 21 11.001 3.754 -6.887 187 HG2 ARG 21 HG2 ARG 21 9.987 2.779 -4.211 188 HG3 ARG 21 HG3 ARG 21 11.656 3.349 -4.374 189 HD2 ARG 21 HD2 ARG 21 10.930 5.510 -5.193 190 HD3 ARG 21 HD3 ARG 21 9.242 4.985 -5.243 191 HE ARG 21 HE ARG 21 10.290 4.675 -2.583 192 HH11 ARG 21 HH11 ARG 21 9.659 6.137 -0.927 193 HH12 ARG 21 HH12 ARG 21 9.043 7.711 -1.445 194 HH21 ARG 21 HH21 ARG 21 9.271 7.298 -4.727 195 HH22 ARG 21 HH22 ARG 21 8.861 8.297 -3.324 196 H ILE 22 H ILE 22 7.193 2.520 -8.001 197 HA ILE 22 HA ILE 22 8.158 1.448 -10.494 198 HB ILE 22 HB ILE 22 5.825 1.337 -11.148 199 HG12 ILE 22 HG12 ILE 22 5.327 3.096 -8.718 200 HG13 ILE 22 HG13 ILE 22 4.896 3.387 -10.404 201 HG21 ILE 22 HG21 ILE 22 6.233 0.471 -8.265 202 HG22 ILE 22 HG22 ILE 22 5.072 -0.189 -9.429 203 HG23 ILE 22 HG23 ILE 22 6.809 -0.384 -9.703 204 HD11 ILE 22 HD11 ILE 22 3.628 1.401 -8.510 205 HD12 ILE 22 HD12 ILE 22 2.918 2.865 -9.205 206 HD13 ILE 22 HD13 ILE 22 3.275 1.474 -10.258 207 HA PRO 23 HA PRO 23 8.371 5.240 -12.817 208 HB2 PRO 23 HB2 PRO 23 8.108 4.214 -15.421 209 HB3 PRO 23 HB3 PRO 23 9.600 4.429 -14.468 210 HG2 PRO 23 HG2 PRO 23 8.083 1.926 -15.008 211 HG3 PRO 23 HG3 PRO 23 9.801 2.142 -14.605 212 HD2 PRO 23 HD2 PRO 23 7.788 1.272 -12.836 213 HD3 PRO 23 HD3 PRO 23 9.395 1.894 -12.368 214 HA PRO 24 HA PRO 24 4.243 5.527 -15.083 215 HB2 PRO 24 HB2 PRO 24 2.321 3.605 -15.107 216 HB3 PRO 24 HB3 PRO 24 3.774 3.525 -16.152 217 HG2 PRO 24 HG2 PRO 24 3.366 2.196 -13.445 218 HG3 PRO 24 HG3 PRO 24 3.893 1.431 -14.979 219 HD2 PRO 24 HD2 PRO 24 5.679 2.257 -13.121 220 HD3 PRO 24 HD3 PRO 24 6.010 2.460 -14.867 221 H ARG 25 H ARG 25 2.270 6.458 -14.568 222 HA ARG 25 HA ARG 25 1.227 6.226 -11.761 223 HB2 ARG 25 HB2 ARG 25 0.175 8.373 -12.085 224 HB3 ARG 25 HB3 ARG 25 1.908 8.507 -12.384 225 HG2 ARG 25 HG2 ARG 25 1.561 8.602 -14.790 226 HG3 ARG 25 HG3 ARG 25 -0.162 8.207 -14.619 227 HD2 ARG 25 HD2 ARG 25 -0.587 10.276 -13.434 228 HD3 ARG 25 HD3 ARG 25 1.142 10.701 -13.479 229 HE ARG 25 HE ARG 25 0.258 10.245 -16.147 230 HH11 ARG 25 HH11 ARG 25 -0.183 11.902 -17.561 231 HH12 ARG 25 HH12 ARG 25 -0.544 13.491 -16.955 232 HH21 ARG 25 HH21 ARG 25 -0.240 12.647 -13.644 233 HH22 ARG 25 HH22 ARG 25 -0.578 13.911 -14.797 234 H ALA 26 H ALA 26 0.339 5.655 -15.038 235 HA ALA 26 HA ALA 26 -2.005 4.135 -14.254 236 HB1 ALA 26 HB1 ALA 26 -2.349 6.801 -15.713 237 HB2 ALA 26 HB2 ALA 26 -3.630 5.583 -15.423 238 HB3 ALA 26 HB3 ALA 26 -2.880 6.451 -14.063 239 H SER 27 H SER 27 -1.548 2.470 -15.341 240 HA SER 27 HA SER 27 -0.645 2.600 -18.165 241 HB2 SER 27 HB2 SER 27 0.523 1.087 -16.479 242 HB3 SER 27 HB3 SER 27 -0.955 0.102 -16.481 243 HG SER 27 HG SER 27 0.712 0.789 -18.703 244 H ASN 28 H ASN 28 -1.628 1.187 -19.624 245 HA ASN 28 HA ASN 28 -4.237 1.643 -20.260 246 HB2 ASN 28 HB2 ASN 28 -3.977 0.003 -21.972 247 HB3 ASN 28 HB3 ASN 28 -2.390 0.727 -21.728 248 HD21 ASN 28 HD21 ASN 28 -1.198 -2.457 -20.209 249 HD22 ASN 28 HD22 ASN 28 -1.125 -0.768 -19.748 250 H ARG 29 H ARG 29 -3.217 -1.077 -18.242 251 HA ARG 29 HA ARG 29 -6.013 -1.356 -17.334 252 HB2 ARG 29 HB2 ARG 29 -4.167 -3.705 -17.992 253 HB3 ARG 29 HB3 ARG 29 -5.525 -3.802 -16.876 254 HG2 ARG 29 HG2 ARG 29 -6.521 -4.564 -18.772 255 HG3 ARG 29 HG3 ARG 29 -6.964 -2.846 -18.826 256 HD2 ARG 29 HD2 ARG 29 -5.254 -2.406 -20.472 257 HD3 ARG 29 HD3 ARG 29 -4.607 -4.053 -20.320 258 HE ARG 29 HE ARG 29 -7.361 -4.210 -21.036 259 HH11 ARG 29 HH11 ARG 29 -8.017 -4.705 -23.099 260 HH12 ARG 29 HH12 ARG 29 -6.945 -4.439 -24.442 261 HH21 ARG 29 HH21 ARG 29 -4.357 -3.198 -22.549 262 HH22 ARG 29 HH22 ARG 29 -4.925 -3.625 -24.146 263 H GLY 30 H GLY 30 -5.550 -0.052 -15.678 264 HA2 GLY 30 HA2 GLY 30 -4.881 0.603 -13.585 265 HA3 GLY 30 HA3 GLY 30 -4.457 -1.109 -13.310 266 H TYR 31 H TYR 31 -2.414 -1.733 -13.426 267 HA TYR 31 HA TYR 31 -0.202 0.190 -14.062 268 HB2 TYR 31 HB2 TYR 31 -0.574 -1.293 -11.446 269 HB3 TYR 31 HB3 TYR 31 0.967 -0.657 -11.984 270 HD1 TYR 31 HD1 TYR 31 1.482 1.670 -12.079 271 HD2 TYR 31 HD2 TYR 31 -2.360 0.245 -10.727 272 HE1 TYR 31 HE1 TYR 31 1.084 3.839 -10.950 273 HE2 TYR 31 HE2 TYR 31 -2.783 2.448 -9.614 274 HH TYR 31 HH TYR 31 -0.414 5.116 -9.705 275 H ARG 32 H ARG 32 -1.225 -3.157 -13.641 276 HA ARG 32 HA ARG 32 -0.250 -5.109 -13.564 277 HB2 ARG 32 HB2 ARG 32 1.202 -5.008 -16.066 278 HB3 ARG 32 HB3 ARG 32 -0.165 -5.957 -15.509 279 HG2 ARG 32 HG2 ARG 32 -1.129 -4.951 -17.297 280 HG3 ARG 32 HG3 ARG 32 -1.563 -3.806 -16.055 281 HD2 ARG 32 HD2 ARG 32 -0.783 -2.445 -17.792 282 HD3 ARG 32 HD3 ARG 32 0.621 -2.545 -16.715 283 HE ARG 32 HE ARG 32 0.620 -4.661 -18.714 284 HH11 ARG 32 HH11 ARG 32 2.452 -4.768 -20.018 285 HH12 ARG 32 HH12 ARG 32 3.387 -3.318 -20.268 286 HH21 ARG 32 HH21 ARG 32 1.397 -1.266 -18.433 287 HH22 ARG 32 HH22 ARG 32 2.964 -1.508 -19.207 288 H ALA 33 H ALA 33 1.156 -5.665 -12.052 289 HA ALA 33 HA ALA 33 3.613 -4.531 -11.478 290 HB1 ALA 33 HB1 ALA 33 2.829 -7.447 -11.088 291 HB2 ALA 33 HB2 ALA 33 4.028 -6.524 -10.154 292 HB3 ALA 33 HB3 ALA 33 2.323 -6.102 -10.045 293 H SER 34 H SER 34 3.001 -6.993 -13.928 294 HA SER 34 HA SER 34 5.714 -7.777 -14.413 295 HB2 SER 34 HB2 SER 34 3.507 -8.941 -15.045 296 HB3 SER 34 HB3 SER 34 3.451 -7.845 -16.435 297 HG SER 34 HG SER 34 5.531 -8.668 -17.040 298 H ASP 35 H ASP 35 4.101 -4.802 -15.242 299 HA ASP 35 HA ASP 35 5.784 -4.110 -17.526 300 HB2 ASP 35 HB2 ASP 35 3.508 -3.181 -17.018 301 HB3 ASP 35 HB3 ASP 35 4.180 -2.363 -15.623 302 H TRP 36 H TRP 36 6.223 -4.114 -14.043 303 HA TRP 36 HA TRP 36 8.711 -2.518 -14.274 304 HB2 TRP 36 HB2 TRP 36 7.950 -1.441 -12.022 305 HB3 TRP 36 HB3 TRP 36 7.480 -0.847 -13.582 306 HD1 TRP 36 HD1 TRP 36 5.099 -0.665 -14.199 307 HE1 TRP 36 HE1 TRP 36 2.837 -1.120 -13.084 308 HE3 TRP 36 HE3 TRP 36 6.741 -3.288 -10.127 309 HZ2 TRP 36 HZ2 TRP 36 1.977 -1.878 -10.386 310 HZ3 TRP 36 HZ3 TRP 36 5.169 -3.875 -8.299 311 HH2 TRP 36 HH2 TRP 36 2.805 -3.134 -8.386 312 H LYS 37 H LYS 37 9.192 -2.582 -11.446 313 HA LYS 37 HA LYS 37 10.881 -4.883 -11.647 314 HB2 LYS 37 HB2 LYS 37 10.644 -2.805 -9.430 315 HB3 LYS 37 HB3 LYS 37 11.944 -3.972 -9.646 316 HG2 LYS 37 HG2 LYS 37 12.039 -2.810 -12.092 317 HG3 LYS 37 HG3 LYS 37 11.416 -1.445 -11.147 318 HD2 LYS 37 HD2 LYS 37 13.879 -3.135 -10.595 319 HD3 LYS 37 HD3 LYS 37 13.899 -1.473 -11.206 320 HE2 LYS 37 HE2 LYS 37 13.015 -2.441 -8.451 321 HE3 LYS 37 HE3 LYS 37 14.524 -1.629 -8.829 322 HZ1 LYS 37 HZ1 LYS 37 11.807 -0.421 -8.888 323 HZ2 LYS 37 HZ2 LYS 37 13.061 -0.024 -7.946 324 HZ3 LYS 37 HZ3 LYS 37 13.130 0.326 -9.544 325 H LEU 38 H LEU 38 8.440 -6.104 -11.325 326 HA LEU 38 HA LEU 38 7.674 -6.550 -8.666 327 HB2 LEU 38 HB2 LEU 38 6.226 -8.263 -9.385 328 HB3 LEU 38 HB3 LEU 38 6.235 -6.950 -10.536 329 HG LEU 38 HG LEU 38 7.574 -8.293 -12.102 330 HD11 LEU 38 HD11 LEU 38 7.653 -10.787 -11.757 331 HD12 LEU 38 HD12 LEU 38 8.845 -9.858 -10.867 332 HD13 LEU 38 HD13 LEU 38 7.404 -10.492 -10.028 333 HD21 LEU 38 HD21 LEU 38 5.008 -8.407 -11.994 334 HD22 LEU 38 HD22 LEU 38 5.782 -9.798 -12.760 335 HD23 LEU 38 HD23 LEU 38 5.169 -9.906 -11.092 336 H ASP 39 H ASP 39 10.579 -7.640 -9.779 337 HA ASP 39 HA ASP 39 10.716 -9.887 -7.841 338 HB2 ASP 39 HB2 ASP 39 11.030 -10.499 -10.221 339 HB3 ASP 39 HB3 ASP 39 12.397 -9.392 -10.317 340 H GLN 40 H GLN 40 11.645 -6.630 -8.183 341 HA GLN 40 HA GLN 40 14.208 -6.959 -6.661 342 HB2 GLN 40 HB2 GLN 40 13.768 -5.209 -9.102 343 HB3 GLN 40 HB3 GLN 40 15.212 -5.239 -8.084 344 HG2 GLN 40 HG2 GLN 40 15.494 -7.670 -8.672 345 HG3 GLN 40 HG3 GLN 40 14.148 -7.492 -9.813 346 HE21 GLN 40 HE21 GLN 40 16.086 -5.637 -12.204 347 HE22 GLN 40 HE22 GLN 40 14.448 -6.007 -11.689 348 HA PRO 41 HA PRO 41 11.758 -3.642 -4.591 349 HB2 PRO 41 HB2 PRO 41 12.259 -4.262 -1.982 350 HB3 PRO 41 HB3 PRO 41 11.048 -5.119 -2.988 351 HG2 PRO 41 HG2 PRO 41 13.903 -5.956 -2.389 352 HG3 PRO 41 HG3 PRO 41 12.415 -6.945 -2.267 353 HD2 PRO 41 HD2 PRO 41 14.068 -6.998 -4.456 354 HD3 PRO 41 HD3 PRO 41 12.302 -7.229 -4.597 355 H ASP 42 H ASP 42 12.419 -1.708 -3.710 356 HA ASP 42 HA ASP 42 15.361 -1.162 -3.510 357 HB2 ASP 42 HB2 ASP 42 12.942 0.635 -3.919 358 HB3 ASP 42 HB3 ASP 42 14.544 1.250 -3.518 359 H TRP 43 H TRP 43 12.432 -1.422 -1.643 360 HA TRP 43 HA TRP 43 13.952 -0.971 0.842 361 HB2 TRP 43 HB2 TRP 43 12.937 1.208 0.385 362 HB3 TRP 43 HB3 TRP 43 11.365 0.461 0.131 363 HD1 TRP 43 HD1 TRP 43 13.726 1.593 2.869 364 HE1 TRP 43 HE1 TRP 43 12.549 1.497 5.150 365 HE3 TRP 43 HE3 TRP 43 9.448 -0.857 1.475 366 HZ2 TRP 43 HZ2 TRP 43 10.054 0.526 6.213 367 HZ3 TRP 43 HZ3 TRP 43 7.689 -1.360 3.143 368 HH2 TRP 43 HH2 TRP 43 7.988 -0.701 5.527 369 H THR 44 H THR 44 13.194 -2.158 2.606 370 HA THR 44 HA THR 44 10.681 -3.673 2.405 371 HB THR 44 HB THR 44 11.717 -5.730 3.134 372 HG1 THR 44 HG1 THR 44 13.978 -5.949 3.155 373 HG21 THR 44 HG21 THR 44 12.817 -6.502 1.155 374 HG22 THR 44 HG22 THR 44 11.577 -5.337 0.671 375 HG23 THR 44 HG23 THR 44 13.281 -4.849 0.685 376 H GLY 45 H GLY 45 9.801 -4.337 4.359 377 HA2 GLY 45 HA2 GLY 45 10.994 -3.947 6.926 378 HA3 GLY 45 HA3 GLY 45 10.136 -2.479 6.474 379 H ARG 46 H ARG 46 8.340 -2.384 7.450 380 HA ARG 46 HA ARG 46 6.553 -4.728 8.003 381 HB2 ARG 46 HB2 ARG 46 8.050 -4.209 9.918 382 HB3 ARG 46 HB3 ARG 46 7.473 -2.544 9.929 383 HG2 ARG 46 HG2 ARG 46 5.186 -3.338 10.523 384 HG3 ARG 46 HG3 ARG 46 5.761 -5.012 10.416 385 HD2 ARG 46 HD2 ARG 46 5.688 -4.437 12.722 386 HD3 ARG 46 HD3 ARG 46 7.381 -4.557 12.238 387 HE ARG 46 HE ARG 46 6.044 -1.861 12.319 388 HH11 ARG 46 HH11 ARG 46 6.746 -0.386 13.599 389 HH12 ARG 46 HH12 ARG 46 8.065 -0.656 14.741 390 HH21 ARG 46 HH21 ARG 46 8.446 -3.959 13.818 391 HH22 ARG 46 HH22 ARG 46 9.038 -2.662 14.817 392 H LEU 47 H LEU 47 4.355 -4.292 8.096 393 HA LEU 47 HA LEU 47 3.464 -1.730 6.831 394 HB2 LEU 47 HB2 LEU 47 2.885 -3.935 5.771 395 HB3 LEU 47 HB3 LEU 47 2.112 -4.386 7.287 396 HG LEU 47 HG LEU 47 0.551 -2.330 6.915 397 HD11 LEU 47 HD11 LEU 47 0.173 -1.742 4.581 398 HD12 LEU 47 HD12 LEU 47 1.797 -1.279 5.092 399 HD13 LEU 47 HD13 LEU 47 1.569 -2.727 4.081 400 HD21 LEU 47 HD21 LEU 47 -0.197 -4.628 6.837 401 HD22 LEU 47 HD22 LEU 47 -0.949 -3.710 5.539 402 HD23 LEU 47 HD23 LEU 47 0.405 -4.807 5.177 403 H ARG 48 H ARG 48 2.109 -0.316 7.865 404 HA ARG 48 HA ARG 48 0.343 -1.386 10.015 405 HB2 ARG 48 HB2 ARG 48 1.580 1.407 10.035 406 HB3 ARG 48 HB3 ARG 48 0.382 0.805 11.179 407 HG2 ARG 48 HG2 ARG 48 3.198 -0.310 10.843 408 HG3 ARG 48 HG3 ARG 48 2.726 0.886 12.039 409 HD2 ARG 48 HD2 ARG 48 1.200 -1.718 11.962 410 HD3 ARG 48 HD3 ARG 48 2.846 -1.728 12.598 411 HE ARG 48 HE ARG 48 0.479 -0.638 13.868 412 HH11 ARG 48 HH11 ARG 48 0.639 0.066 15.968 413 HH12 ARG 48 HH12 ARG 48 2.188 0.488 16.628 414 HH21 ARG 48 HH21 ARG 48 3.983 -0.117 13.769 415 HH22 ARG 48 HH22 ARG 48 4.006 0.370 15.436 416 H ILE 49 H ILE 49 -1.689 -1.174 9.461 417 HA ILE 49 HA ILE 49 -2.510 1.075 7.649 418 HB ILE 49 HB ILE 49 -3.839 -1.620 7.988 419 HG12 ILE 49 HG12 ILE 49 -2.355 -0.298 5.664 420 HG13 ILE 49 HG13 ILE 49 -1.844 -1.725 6.565 421 HG21 ILE 49 HG21 ILE 49 -5.474 0.266 7.742 422 HG22 ILE 49 HG22 ILE 49 -4.678 0.698 6.208 423 HG23 ILE 49 HG23 ILE 49 -5.503 -0.868 6.407 424 HD11 ILE 49 HD11 ILE 49 -2.707 -2.408 4.442 425 HD12 ILE 49 HD12 ILE 49 -3.820 -2.967 5.698 426 HD13 ILE 49 HD13 ILE 49 -4.223 -1.549 4.681 427 H THR 50 H THR 50 -3.519 2.597 8.654 428 HA THR 50 HA THR 50 -4.904 2.109 11.257 429 HB THR 50 HB THR 50 -4.162 4.457 11.808 430 HG1 THR 50 HG1 THR 50 -2.725 5.449 10.476 431 HG21 THR 50 HG21 THR 50 -2.842 2.634 12.774 432 HG22 THR 50 HG22 THR 50 -1.873 2.513 11.285 433 HG23 THR 50 HG23 THR 50 -1.791 3.974 12.291 434 H SER 51 H SER 51 -6.561 3.863 11.743 435 HA SER 51 HA SER 51 -7.397 5.534 9.509 436 HB2 SER 51 HB2 SER 51 -8.674 3.580 8.918 437 HB3 SER 51 HB3 SER 51 -9.295 3.422 10.582 438 HG SER 51 HG SER 51 -9.689 5.633 8.822 439 H LYS 52 H LYS 52 -8.209 7.322 10.107 440 HA LYS 52 HA LYS 52 -9.080 7.918 12.893 441 HB2 LYS 52 HB2 LYS 52 -7.296 9.191 11.720 442 HB3 LYS 52 HB3 LYS 52 -8.505 9.720 10.529 443 HG2 LYS 52 HG2 LYS 52 -9.711 10.694 12.702 444 HG3 LYS 52 HG3 LYS 52 -8.130 10.487 13.420 445 HD2 LYS 52 HD2 LYS 52 -8.836 12.036 10.912 446 HD3 LYS 52 HD3 LYS 52 -8.445 12.735 12.506 447 HE2 LYS 52 HE2 LYS 52 -6.143 12.057 12.303 448 HE3 LYS 52 HE3 LYS 52 -6.481 11.074 10.873 449 HZ1 LYS 52 HZ1 LYS 52 -5.503 13.257 10.322 450 HZ2 LYS 52 HZ2 LYS 52 -6.986 13.094 9.655 451 HZ3 LYS 52 HZ3 LYS 52 -6.785 14.021 10.997 452 H GLY 53 H GLY 53 -10.683 6.327 10.938 453 HA2 GLY 53 HA2 GLY 53 -12.972 5.967 10.689 454 HA3 GLY 53 HA3 GLY 53 -13.326 7.576 11.309 455 H LYS 54 H LYS 54 -13.612 5.738 8.658 456 HA LYS 54 HA LYS 54 -13.772 5.856 6.436 457 HB2 LYS 54 HB2 LYS 54 -15.537 7.493 7.315 458 HB3 LYS 54 HB3 LYS 54 -14.517 8.787 6.703 459 HG2 LYS 54 HG2 LYS 54 -15.311 6.501 4.877 460 HG3 LYS 54 HG3 LYS 54 -16.525 7.695 5.337 461 HD2 LYS 54 HD2 LYS 54 -15.146 9.514 4.399 462 HD3 LYS 54 HD3 LYS 54 -13.948 8.325 3.865 463 HE2 LYS 54 HE2 LYS 54 -15.858 7.128 2.638 464 HE3 LYS 54 HE3 LYS 54 -16.857 8.544 2.984 465 HZ1 LYS 54 HZ1 LYS 54 -15.131 9.881 1.788 466 HZ2 LYS 54 HZ2 LYS 54 -14.331 8.496 1.400 467 HZ3 LYS 54 HZ3 LYS 54 -15.827 8.773 0.810 468 H THR 55 H THR 55 -11.336 7.899 7.661 469 HA THR 55 HA THR 55 -9.985 7.595 5.013 470 HB THR 55 HB THR 55 -8.927 9.301 7.256 471 HG1 THR 55 HG1 THR 55 -9.867 11.040 6.175 472 HG21 THR 55 HG21 THR 55 -8.606 9.121 4.231 473 HG22 THR 55 HG22 THR 55 -7.792 10.339 5.253 474 HG23 THR 55 HG23 THR 55 -7.409 8.610 5.431 475 H ALA 56 H ALA 56 -8.829 5.837 4.864 476 HA ALA 56 HA ALA 56 -7.492 4.684 7.251 477 HB1 ALA 56 HB1 ALA 56 -6.921 2.793 5.734 478 HB2 ALA 56 HB2 ALA 56 -8.665 3.025 5.915 479 HB3 ALA 56 HB3 ALA 56 -7.853 3.574 4.439 480 H TYR 57 H TYR 57 -5.190 4.513 7.289 481 HA TYR 57 HA TYR 57 -3.722 6.067 5.198 482 HB2 TYR 57 HB2 TYR 57 -3.203 6.108 8.179 483 HB3 TYR 57 HB3 TYR 57 -2.241 6.894 6.947 484 HD1 TYR 57 HD1 TYR 57 -2.891 9.035 6.037 485 HD2 TYR 57 HD2 TYR 57 -5.524 6.950 8.745 486 HE1 TYR 57 HE1 TYR 57 -4.296 11.080 6.265 487 HE2 TYR 57 HE2 TYR 57 -6.974 8.957 8.882 488 HH TYR 57 HH TYR 57 -6.167 12.010 7.195 489 H ILE 58 H ILE 58 -2.383 4.785 4.137 490 HA ILE 58 HA ILE 58 -1.451 2.221 5.325 491 HB ILE 58 HB ILE 58 -0.664 3.333 2.629 492 HG12 ILE 58 HG12 ILE 58 -3.083 3.238 2.543 493 HG13 ILE 58 HG13 ILE 58 -2.335 2.038 1.511 494 HG21 ILE 58 HG21 ILE 58 -0.621 0.566 3.872 495 HG22 ILE 58 HG22 ILE 58 -0.252 0.920 2.168 496 HG23 ILE 58 HG23 ILE 58 0.771 1.580 3.446 497 HD11 ILE 58 HD11 ILE 58 -2.877 0.248 3.092 498 HD12 ILE 58 HD12 ILE 58 -3.555 1.441 4.235 499 HD13 ILE 58 HD13 ILE 58 -4.317 1.185 2.654 500 H LYS 59 H LYS 59 0.064 2.561 6.805 501 HA LYS 59 HA LYS 59 2.371 4.390 6.219 502 HB2 LYS 59 HB2 LYS 59 1.136 3.388 8.790 503 HB3 LYS 59 HB3 LYS 59 2.773 4.068 8.730 504 HG2 LYS 59 HG2 LYS 59 1.967 6.153 7.809 505 HG3 LYS 59 HG3 LYS 59 0.317 5.529 7.645 506 HD2 LYS 59 HD2 LYS 59 -0.059 5.514 9.981 507 HD3 LYS 59 HD3 LYS 59 1.676 5.595 10.351 508 HE2 LYS 59 HE2 LYS 59 0.787 7.726 10.836 509 HE3 LYS 59 HE3 LYS 59 1.758 7.886 9.345 510 HZ1 LYS 59 HZ1 LYS 59 -0.399 9.036 9.229 511 HZ2 LYS 59 HZ2 LYS 59 -0.376 7.821 8.113 512 HZ3 LYS 59 HZ3 LYS 59 -1.189 7.652 9.548 513 H LEU 60 H LEU 60 4.406 3.680 6.140 514 HA LEU 60 HA LEU 60 4.909 0.725 6.377 515 HB2 LEU 60 HB2 LEU 60 6.039 2.790 4.446 516 HB3 LEU 60 HB3 LEU 60 6.614 1.133 4.583 517 HG LEU 60 HG LEU 60 3.783 1.924 3.747 518 HD11 LEU 60 HD11 LEU 60 6.136 0.879 2.126 519 HD12 LEU 60 HD12 LEU 60 4.493 1.170 1.508 520 HD13 LEU 60 HD13 LEU 60 5.484 2.530 2.061 521 HD21 LEU 60 HD21 LEU 60 3.879 -0.332 4.793 522 HD22 LEU 60 HD22 LEU 60 3.581 -0.438 3.056 523 HD23 LEU 60 HD23 LEU 60 5.205 -0.772 3.697 524 H GLU 61 H GLU 61 6.453 0.099 7.751 525 HA GLU 61 HA GLU 61 8.106 2.208 9.086 526 HB2 GLU 61 HB2 GLU 61 6.914 -0.311 10.293 527 HB3 GLU 61 HB3 GLU 61 7.923 0.875 11.124 528 HG2 GLU 61 HG2 GLU 61 6.147 2.611 10.633 529 HG3 GLU 61 HG3 GLU 61 5.109 1.301 10.043 530 H ASP 62 H ASP 62 10.265 1.727 9.681 531 HA ASP 62 HA ASP 62 11.613 -0.379 8.219 532 HB2 ASP 62 HB2 ASP 62 12.621 1.807 8.511 533 HB3 ASP 62 HB3 ASP 62 12.454 1.706 10.266 534 H LYS 63 H LYS 63 12.155 -2.355 8.950 535 HA LYS 63 HA LYS 63 10.834 -3.474 11.225 536 HB2 LYS 63 HB2 LYS 63 11.273 -4.663 9.157 537 HB3 LYS 63 HB3 LYS 63 13.022 -4.548 9.388 538 HG2 LYS 63 HG2 LYS 63 12.975 -6.052 11.258 539 HG3 LYS 63 HG3 LYS 63 11.207 -6.010 11.352 540 HD2 LYS 63 HD2 LYS 63 12.752 -7.110 8.959 541 HD3 LYS 63 HD3 LYS 63 12.226 -8.089 10.339 542 HE2 LYS 63 HE2 LYS 63 9.868 -7.356 9.940 543 HE3 LYS 63 HE3 LYS 63 10.388 -6.501 8.486 544 HZ1 LYS 63 HZ1 LYS 63 9.502 -8.741 8.092 545 HZ2 LYS 63 HZ2 LYS 63 11.045 -8.606 7.522 546 HZ3 LYS 63 HZ3 LYS 63 10.737 -9.419 8.914 547 H VAL 64 H VAL 64 13.785 -1.737 11.198 548 HA VAL 64 HA VAL 64 14.975 -3.240 13.474 549 HB VAL 64 HB VAL 64 16.339 -1.009 11.949 550 HG11 VAL 64 HG11 VAL 64 17.371 -3.496 13.367 551 HG12 VAL 64 HG12 VAL 64 18.361 -2.236 12.596 552 HG13 VAL 64 HG13 VAL 64 17.386 -1.838 14.014 553 HG21 VAL 64 HG21 VAL 64 15.667 -2.494 10.150 554 HG22 VAL 64 HG22 VAL 64 17.385 -2.719 10.469 555 HG23 VAL 64 HG23 VAL 64 16.216 -3.922 11.067 556 H SER 65 H SER 65 13.844 -0.015 12.462 557 HA SER 65 HA SER 65 14.154 0.871 15.301 558 HB2 SER 65 HB2 SER 65 14.702 2.415 12.746 559 HB3 SER 65 HB3 SER 65 14.779 3.097 14.383 560 HG SER 65 HG SER 65 16.836 2.416 13.599 561 H GLY 66 H GLY 66 11.745 0.321 13.044 562 HA2 GLY 66 HA2 GLY 66 9.531 0.873 13.005 563 HA3 GLY 66 HA3 GLY 66 9.732 1.734 14.538 564 H GLU 67 H GLU 67 11.800 2.824 11.975 565 HA GLU 67 HA GLU 67 10.612 5.467 12.068 566 HB2 GLU 67 HB2 GLU 67 12.838 4.332 10.328 567 HB3 GLU 67 HB3 GLU 67 12.344 6.031 10.364 568 HG2 GLU 67 HG2 GLU 67 12.832 6.096 12.820 569 HG3 GLU 67 HG3 GLU 67 13.438 4.443 12.722 570 H LEU 68 H LEU 68 9.417 6.585 10.585 571 HA LEU 68 HA LEU 68 7.719 5.021 8.860 572 HB2 LEU 68 HB2 LEU 68 6.994 6.946 10.253 573 HB3 LEU 68 HB3 LEU 68 7.971 8.022 9.245 574 HG LEU 68 HG LEU 68 6.547 7.548 7.303 575 HD11 LEU 68 HD11 LEU 68 4.898 5.838 9.220 576 HD12 LEU 68 HD12 LEU 68 4.378 6.374 7.603 577 HD13 LEU 68 HD13 LEU 68 5.747 5.287 7.756 578 HD21 LEU 68 HD21 LEU 68 5.981 9.409 8.822 579 HD22 LEU 68 HD22 LEU 68 4.509 8.691 8.156 580 HD23 LEU 68 HD23 LEU 68 4.996 8.318 9.823 581 H PHE 69 H PHE 69 8.261 4.342 6.917 582 HA PHE 69 HA PHE 69 10.280 5.640 5.221 583 HB2 PHE 69 HB2 PHE 69 10.288 3.266 5.286 584 HB3 PHE 69 HB3 PHE 69 8.555 3.162 5.018 585 HD1 PHE 69 HD1 PHE 69 7.947 2.346 2.935 586 HD2 PHE 69 HD2 PHE 69 11.495 4.768 3.250 587 HE1 PHE 69 HE1 PHE 69 8.324 2.103 0.501 588 HE2 PHE 69 HE2 PHE 69 11.858 4.554 0.816 589 HZ PHE 69 HZ PHE 69 10.268 3.204 -0.578 590 H ALA 70 H ALA 70 6.748 5.001 5.008 591 HA ALA 70 HA ALA 70 6.330 7.468 3.517 592 HB1 ALA 70 HB1 ALA 70 7.073 5.877 1.719 593 HB2 ALA 70 HB2 ALA 70 5.714 4.812 2.152 594 HB3 ALA 70 HB3 ALA 70 5.409 6.444 1.523 595 H GLN 71 H GLN 71 4.082 7.859 3.001 596 HA GLN 71 HA GLN 71 2.066 6.416 4.616 597 HB2 GLN 71 HB2 GLN 71 1.269 8.587 5.516 598 HB3 GLN 71 HB3 GLN 71 2.783 8.022 6.183 599 HG2 GLN 71 HG2 GLN 71 2.654 10.159 3.997 600 HG3 GLN 71 HG3 GLN 71 2.549 10.525 5.702 601 HE21 GLN 71 HE21 GLN 71 6.107 10.979 4.780 602 HE22 GLN 71 HE22 GLN 71 4.626 11.705 4.177 603 H ALA 72 H ALA 72 0.299 6.030 3.365 604 HA ALA 72 HA ALA 72 -0.394 8.007 1.220 605 HB1 ALA 72 HB1 ALA 72 -0.888 5.024 1.240 606 HB2 ALA 72 HB2 ALA 72 -1.497 6.164 0.036 607 HB3 ALA 72 HB3 ALA 72 0.241 5.926 0.198 608 HA PRO 73 HA PRO 73 -4.254 8.148 3.713 609 HB2 PRO 73 HB2 PRO 73 -5.289 10.469 2.748 610 HB3 PRO 73 HB3 PRO 73 -3.935 10.430 3.917 611 HG2 PRO 73 HG2 PRO 73 -3.781 10.779 0.911 612 HG3 PRO 73 HG3 PRO 73 -2.946 11.720 2.184 613 HD2 PRO 73 HD2 PRO 73 -1.760 9.641 0.834 614 HD3 PRO 73 HD3 PRO 73 -1.361 10.031 2.532 615 H VAL 74 H VAL 74 -5.912 6.913 3.169 616 HA VAL 74 HA VAL 74 -6.933 6.739 0.364 617 HB VAL 74 HB VAL 74 -7.100 4.639 2.558 618 HG11 VAL 74 HG11 VAL 74 -7.882 3.146 0.790 619 HG12 VAL 74 HG12 VAL 74 -8.967 4.515 0.977 620 HG13 VAL 74 HG13 VAL 74 -7.828 4.483 -0.382 621 HG21 VAL 74 HG21 VAL 74 -4.753 4.849 1.748 622 HG22 VAL 74 HG22 VAL 74 -5.520 3.282 1.487 623 HG23 VAL 74 HG23 VAL 74 -5.333 4.390 0.133 624 H GLU 75 H GLU 75 -8.863 7.707 0.119 625 HA GLU 75 HA GLU 75 -10.765 7.946 2.439 626 HB2 GLU 75 HB2 GLU 75 -10.352 9.681 -0.036 627 HB3 GLU 75 HB3 GLU 75 -11.670 9.889 1.122 628 HG2 GLU 75 HG2 GLU 75 -10.092 10.355 2.926 629 HG3 GLU 75 HG3 GLU 75 -8.718 10.099 1.841 630 H GLN 76 H GLN 76 -10.309 6.123 -0.282 631 HA GLN 76 HA GLN 76 -12.958 5.106 -0.203 632 HB2 GLN 76 HB2 GLN 76 -13.653 5.451 -2.451 633 HB3 GLN 76 HB3 GLN 76 -13.281 7.027 -1.789 634 HG2 GLN 76 HG2 GLN 76 -11.570 5.428 -3.747 635 HG3 GLN 76 HG3 GLN 76 -12.578 6.807 -4.122 636 HE21 GLN 76 HE21 GLN 76 -8.836 7.444 -2.634 637 HE22 GLN 76 HE22 GLN 76 -9.538 5.812 -2.569 638 H TYR 77 H TYR 77 -12.998 2.977 -0.890 639 HA TYR 77 HA TYR 77 -10.608 1.883 -2.269 640 HB2 TYR 77 HB2 TYR 77 -10.573 1.363 0.130 641 HB3 TYR 77 HB3 TYR 77 -12.090 0.457 -0.053 642 HD1 TYR 77 HD1 TYR 77 -12.043 -1.723 -1.441 643 HD2 TYR 77 HD2 TYR 77 -8.542 0.605 -0.579 644 HE1 TYR 77 HE1 TYR 77 -10.597 -3.563 -2.302 645 HE2 TYR 77 HE2 TYR 77 -7.090 -1.207 -1.445 646 HH TYR 77 HH TYR 77 -8.473 -4.244 -2.788 647 HA PRO 78 HA PRO 78 -9.970 0.467 -3.819 648 HB2 PRO 78 HB2 PRO 78 -11.065 0.382 -6.613 649 HB3 PRO 78 HB3 PRO 78 -9.713 -0.549 -5.894 650 HG2 PRO 78 HG2 PRO 78 -12.105 -1.741 -6.314 651 HG3 PRO 78 HG3 PRO 78 -11.229 -2.020 -4.769 652 HD2 PRO 78 HD2 PRO 78 -13.476 -0.040 -5.312 653 HD3 PRO 78 HD3 PRO 78 -13.335 -1.235 -3.985 654 H GLY 79 H GLY 79 -8.630 2.086 -4.986 655 HA2 GLY 79 HA2 GLY 79 -9.883 4.384 -6.295 656 HA3 GLY 79 HA3 GLY 79 -9.294 4.742 -4.674 657 H ILE 80 H ILE 80 -7.914 6.297 -5.744 658 HA ILE 80 HA ILE 80 -5.635 5.292 -7.318 659 HB ILE 80 HB ILE 80 -6.698 7.443 -7.843 660 HG12 ILE 80 HG12 ILE 80 -4.740 8.853 -8.107 661 HG13 ILE 80 HG13 ILE 80 -3.848 7.946 -6.891 662 HG21 ILE 80 HG21 ILE 80 -5.569 8.497 -5.206 663 HG22 ILE 80 HG22 ILE 80 -6.380 9.441 -6.461 664 HG23 ILE 80 HG23 ILE 80 -7.298 8.234 -5.558 665 HD11 ILE 80 HD11 ILE 80 -3.723 6.003 -8.353 666 HD12 ILE 80 HD12 ILE 80 -4.835 6.764 -9.524 667 HD13 ILE 80 HD13 ILE 80 -3.213 7.434 -9.258 668 H ALA 81 H ALA 81 -6.384 6.042 -3.971 669 HA ALA 81 HA ALA 81 -3.645 6.319 -3.159 670 HB1 ALA 81 HB1 ALA 81 -6.102 5.747 -1.513 671 HB2 ALA 81 HB2 ALA 81 -4.479 6.233 -0.921 672 HB3 ALA 81 HB3 ALA 81 -5.461 7.357 -1.913 673 H VAL 82 H VAL 82 -5.874 3.493 -3.307 674 HA VAL 82 HA VAL 82 -3.482 1.747 -3.107 675 HB VAL 82 HB VAL 82 -4.364 1.898 -0.869 676 HG11 VAL 82 HG11 VAL 82 -7.022 1.121 -1.982 677 HG12 VAL 82 HG12 VAL 82 -6.560 1.286 -0.258 678 HG13 VAL 82 HG13 VAL 82 -6.587 2.687 -1.298 679 HG21 VAL 82 HG21 VAL 82 -3.487 -0.252 -1.736 680 HG22 VAL 82 HG22 VAL 82 -4.714 -0.478 -0.489 681 HG23 VAL 82 HG23 VAL 82 -5.116 -0.736 -2.200 682 H GLU 83 H GLU 83 -3.490 0.302 -4.681 683 HA GLU 83 HA GLU 83 -5.985 -0.600 -6.031 684 HB2 GLU 83 HB2 GLU 83 -4.230 1.417 -7.022 685 HB3 GLU 83 HB3 GLU 83 -3.774 -0.033 -7.899 686 HG2 GLU 83 HG2 GLU 83 -6.622 1.023 -7.668 687 HG3 GLU 83 HG3 GLU 83 -5.515 1.426 -8.980 688 H THR 84 H THR 84 -5.811 -2.501 -7.273 689 HA THR 84 HA THR 84 -3.431 -4.224 -6.625 690 HB THR 84 HB THR 84 -6.059 -5.307 -7.493 691 HG1 THR 84 HG1 THR 84 -6.428 -4.224 -5.508 692 HG21 THR 84 HG21 THR 84 -5.194 -7.325 -6.358 693 HG22 THR 84 HG22 THR 84 -4.142 -6.773 -7.672 694 HG23 THR 84 HG23 THR 84 -3.698 -6.436 -5.982 695 H VAL 85 H VAL 85 -2.507 -3.100 -8.232 696 HA VAL 85 HA VAL 85 -1.602 -2.897 -10.400 697 HB VAL 85 HB VAL 85 -0.599 -5.258 -10.780 698 HG11 VAL 85 HG11 VAL 85 -0.226 -3.728 -8.160 699 HG12 VAL 85 HG12 VAL 85 0.954 -4.817 -8.900 700 HG13 VAL 85 HG13 VAL 85 0.508 -3.323 -9.724 701 HG21 VAL 85 HG21 VAL 85 -2.352 -6.477 -9.337 702 HG22 VAL 85 HG22 VAL 85 -0.657 -6.798 -8.973 703 HG23 VAL 85 HG23 VAL 85 -1.594 -5.710 -7.943 704 H THR 86 H THR 86 -3.230 -5.990 -10.801 705 HA THR 86 HA THR 86 -5.012 -4.866 -12.764 706 HB THR 86 HB THR 86 -4.852 -6.954 -14.248 707 HG1 THR 86 HG1 THR 86 -2.950 -8.011 -14.283 708 HG21 THR 86 HG21 THR 86 -3.209 -5.924 -15.704 709 HG22 THR 86 HG22 THR 86 -4.095 -4.614 -14.874 710 HG23 THR 86 HG23 THR 86 -2.473 -5.080 -14.320 711 H ASP 87 H ASP 87 -3.945 -7.890 -11.184 712 HA ASP 87 HA ASP 87 -6.635 -8.148 -9.957 713 HB2 ASP 87 HB2 ASP 87 -6.629 -9.299 -12.286 714 HB3 ASP 87 HB3 ASP 87 -5.568 -10.482 -11.520 715 H SER 88 H SER 88 -3.705 -10.260 -10.431 716 HA SER 88 HA SER 88 -3.834 -11.520 -7.963 717 HB2 SER 88 HB2 SER 88 -2.072 -12.129 -9.568 718 HB3 SER 88 HB3 SER 88 -1.143 -10.702 -9.089 719 HG SER 88 HG SER 88 -1.337 -13.083 -7.983 720 H SER 89 H SER 89 -3.789 -10.954 -6.005 721 HA SER 89 HA SER 89 -2.824 -8.324 -5.154 722 HB2 SER 89 HB2 SER 89 -4.158 -8.761 -3.203 723 HB3 SER 89 HB3 SER 89 -5.023 -8.994 -4.747 724 HG SER 89 HG SER 89 -5.397 -10.657 -3.120 725 H ARG 90 H ARG 90 -1.154 -10.944 -5.735 726 HA ARG 90 HA ARG 90 0.740 -11.158 -3.566 727 HB2 ARG 90 HB2 ARG 90 0.627 -12.507 -5.677 728 HB3 ARG 90 HB3 ARG 90 1.130 -11.091 -6.602 729 HG2 ARG 90 HG2 ARG 90 3.303 -11.081 -5.380 730 HG3 ARG 90 HG3 ARG 90 2.792 -12.507 -4.469 731 HD2 ARG 90 HD2 ARG 90 3.168 -12.339 -7.495 732 HD3 ARG 90 HD3 ARG 90 4.294 -13.077 -6.361 733 HE ARG 90 HE ARG 90 2.662 -14.821 -5.880 734 HH11 ARG 90 HH11 ARG 90 0.791 -16.018 -6.425 735 HH12 ARG 90 HH12 ARG 90 -0.167 -15.406 -7.790 736 HH21 ARG 90 HH21 ARG 90 1.969 -13.169 -8.938 737 HH22 ARG 90 HH22 ARG 90 0.380 -13.974 -9.002 738 H TYR 91 H TYR 91 -0.008 -8.641 -5.876 739 HA TYR 91 HA TYR 91 1.943 -6.795 -4.599 740 HB2 TYR 91 HB2 TYR 91 1.036 -6.609 -7.472 741 HB3 TYR 91 HB3 TYR 91 2.401 -5.800 -6.736 742 HD1 TYR 91 HD1 TYR 91 4.228 -7.490 -5.729 743 HD2 TYR 91 HD2 TYR 91 1.378 -8.430 -8.805 744 HE1 TYR 91 HE1 TYR 91 5.724 -9.328 -6.560 745 HE2 TYR 91 HE2 TYR 91 2.839 -10.222 -9.676 746 HH TYR 91 HH TYR 91 6.023 -10.944 -8.076 747 H PHE 92 H PHE 92 1.445 -4.559 -4.844 748 HA PHE 92 HA PHE 92 -1.300 -3.731 -5.553 749 HB2 PHE 92 HB2 PHE 92 -0.061 -3.025 -2.862 750 HB3 PHE 92 HB3 PHE 92 -1.594 -2.438 -3.486 751 HD1 PHE 92 HD1 PHE 92 -3.444 -4.180 -4.033 752 HD2 PHE 92 HD2 PHE 92 0.013 -5.029 -1.600 753 HE1 PHE 92 HE1 PHE 92 -4.582 -6.182 -3.118 754 HE2 PHE 92 HE2 PHE 92 -1.168 -6.975 -0.613 755 HZ PHE 92 HZ PHE 92 -3.434 -7.595 -1.410 756 H VAL 93 H VAL 93 -1.392 -1.270 -5.453 757 HA VAL 93 HA VAL 93 1.238 0.092 -5.487 758 HB VAL 93 HB VAL 93 -0.972 0.715 -7.490 759 HG11 VAL 93 HG11 VAL 93 0.727 2.344 -8.374 760 HG12 VAL 93 HG12 VAL 93 0.101 2.783 -6.794 761 HG13 VAL 93 HG13 VAL 93 1.717 2.049 -6.949 762 HG21 VAL 93 HG21 VAL 93 0.776 0.163 -9.190 763 HG22 VAL 93 HG22 VAL 93 1.827 -0.427 -7.900 764 HG23 VAL 93 HG23 VAL 93 0.280 -1.236 -8.239 765 H ILE 94 H ILE 94 1.216 1.968 -4.278 766 HA ILE 94 HA ILE 94 -1.425 3.083 -3.568 767 HB ILE 94 HB ILE 94 -0.833 3.555 -1.268 768 HG12 ILE 94 HG12 ILE 94 1.752 2.002 -1.780 769 HG13 ILE 94 HG13 ILE 94 1.652 3.748 -1.646 770 HG21 ILE 94 HG21 ILE 94 -0.972 1.346 -0.332 771 HG22 ILE 94 HG22 ILE 94 -1.887 1.363 -1.826 772 HG23 ILE 94 HG23 ILE 94 -0.291 0.596 -1.792 773 HD11 ILE 94 HD11 ILE 94 2.380 2.919 0.485 774 HD12 ILE 94 HD12 ILE 94 0.706 3.475 0.671 775 HD13 ILE 94 HD13 ILE 94 1.062 1.743 0.543 776 H ARG 95 H ARG 95 -1.525 5.268 -3.171 777 HA ARG 95 HA ARG 95 0.664 6.915 -4.401 778 HB2 ARG 95 HB2 ARG 95 -1.542 7.081 -5.425 779 HB3 ARG 95 HB3 ARG 95 -2.267 7.544 -3.903 780 HG2 ARG 95 HG2 ARG 95 -0.045 9.215 -5.057 781 HG3 ARG 95 HG3 ARG 95 -1.687 9.359 -5.684 782 HD2 ARG 95 HD2 ARG 95 -1.014 9.704 -2.749 783 HD3 ARG 95 HD3 ARG 95 -1.080 11.009 -3.925 784 HE ARG 95 HE ARG 95 -3.436 10.708 -4.181 785 HH11 ARG 95 HH11 ARG 95 -5.351 10.707 -3.028 786 HH12 ARG 95 HH12 ARG 95 -5.435 9.839 -1.518 787 HH21 ARG 95 HH21 ARG 95 -2.246 8.684 -1.542 788 HH22 ARG 95 HH22 ARG 95 -3.801 8.763 -0.722 789 H ILE 96 H ILE 96 2.109 7.449 -2.916 790 HA ILE 96 HA ILE 96 1.300 8.017 -0.114 791 HB ILE 96 HB ILE 96 3.737 7.997 0.358 792 HG12 ILE 96 HG12 ILE 96 4.100 6.853 -2.440 793 HG13 ILE 96 HG13 ILE 96 4.440 8.543 -2.040 794 HG21 ILE 96 HG21 ILE 96 2.532 5.521 -0.903 795 HG22 ILE 96 HG22 ILE 96 3.949 5.493 0.135 796 HG23 ILE 96 HG23 ILE 96 2.411 6.024 0.798 797 HD11 ILE 96 HD11 ILE 96 6.482 7.319 -2.013 798 HD12 ILE 96 HD12 ILE 96 6.079 7.809 -0.349 799 HD13 ILE 96 HD13 ILE 96 5.832 6.124 -0.877 800 H GLN 97 H GLN 97 1.968 9.870 0.974 801 HA GLN 97 HA GLN 97 2.917 12.206 -0.598 802 HB2 GLN 97 HB2 GLN 97 1.240 12.465 1.244 803 HB3 GLN 97 HB3 GLN 97 2.461 11.954 2.402 804 HG2 GLN 97 HG2 GLN 97 2.900 14.297 0.499 805 HG3 GLN 97 HG3 GLN 97 1.987 14.485 1.985 806 HE21 GLN 97 HE21 GLN 97 5.277 15.520 3.061 807 HE22 GLN 97 HE22 GLN 97 4.003 16.131 2.013 808 H ASP 98 H ASP 98 5.136 12.546 -0.792 809 HA ASP 98 HA ASP 98 6.678 10.129 -0.178 810 HB2 ASP 98 HB2 ASP 98 6.383 11.225 -2.451 811 HB3 ASP 98 HB3 ASP 98 7.451 12.503 -1.865 812 H GLY 99 H GLY 99 6.228 12.547 1.783 813 HA2 GLY 99 HA2 GLY 99 7.318 13.157 3.710 814 HA3 GLY 99 HA3 GLY 99 8.671 12.123 3.250 815 H THR 100 H THR 100 8.166 14.371 0.775 816 HA THR 100 HA THR 100 9.991 16.401 1.960 817 HB THR 100 HB THR 100 11.303 14.733 0.788 818 HG1 THR 100 HG1 THR 100 11.262 17.309 -0.366 819 HG21 THR 100 HG21 THR 100 9.778 14.122 -1.013 820 HG22 THR 100 HG22 THR 100 9.934 15.751 -1.717 821 HG23 THR 100 HG23 THR 100 11.340 14.664 -1.650 822 H GLY 101 H GLY 101 7.087 16.474 1.435 823 HA2 GLY 101 HA2 GLY 101 5.734 18.355 1.114 824 HA3 GLY 101 HA3 GLY 101 7.045 19.186 0.275 825 H ARG 102 H ARG 102 6.213 15.970 -0.695 826 HA ARG 102 HA ARG 102 4.596 16.797 -3.045 827 HB2 ARG 102 HB2 ARG 102 6.102 15.923 -4.616 828 HB3 ARG 102 HB3 ARG 102 7.103 16.895 -3.510 829 HG2 ARG 102 HG2 ARG 102 7.778 14.770 -2.366 830 HG3 ARG 102 HG3 ARG 102 6.884 13.867 -3.612 831 HD2 ARG 102 HD2 ARG 102 8.290 14.892 -5.372 832 HD3 ARG 102 HD3 ARG 102 9.215 15.748 -4.120 833 HE ARG 102 HE ARG 102 9.156 12.888 -3.605 834 HH11 ARG 102 HH11 ARG 102 10.777 11.667 -3.813 835 HH12 ARG 102 HH12 ARG 102 12.198 12.100 -4.773 836 HH21 ARG 102 HH21 ARG 102 10.848 15.168 -5.679 837 HH22 ARG 102 HH22 ARG 102 12.217 14.097 -5.825 838 H SER 103 H SER 103 4.033 14.758 -4.368 839 HA SER 103 HA SER 103 3.652 12.380 -2.600 840 HB2 SER 103 HB2 SER 103 1.646 13.515 -4.587 841 HB3 SER 103 HB3 SER 103 1.474 11.972 -3.731 842 HG SER 103 HG SER 103 0.389 13.757 -2.691 843 H ALA 104 H ALA 104 3.515 10.355 -3.639 844 HA ALA 104 HA ALA 104 4.538 10.074 -6.406 845 HB1 ALA 104 HB1 ALA 104 6.013 9.007 -3.957 846 HB2 ALA 104 HB2 ALA 104 6.431 8.679 -5.651 847 HB3 ALA 104 HB3 ALA 104 6.569 10.326 -5.011 848 H PHE 105 H PHE 105 4.357 7.943 -7.270 849 HA PHE 105 HA PHE 105 2.470 6.154 -5.812 850 HB2 PHE 105 HB2 PHE 105 3.373 5.994 -8.696 851 HB3 PHE 105 HB3 PHE 105 2.101 5.060 -7.918 852 HD1 PHE 105 HD1 PHE 105 0.006 6.286 -7.051 853 HD2 PHE 105 HD2 PHE 105 2.960 8.198 -9.552 854 HE1 PHE 105 HE1 PHE 105 -1.616 8.059 -7.633 855 HE2 PHE 105 HE2 PHE 105 1.361 10.019 -10.046 856 HZ PHE 105 HZ PHE 105 -0.959 9.939 -9.104 857 H ILE 106 H ILE 106 3.140 4.351 -4.886 858 HA ILE 106 HA ILE 106 5.676 3.085 -5.832 859 HB ILE 106 HB ILE 106 5.993 2.123 -3.575 860 HG12 ILE 106 HG12 ILE 106 4.287 4.413 -2.518 861 HG13 ILE 106 HG13 ILE 106 3.712 2.753 -2.656 862 HG21 ILE 106 HG21 ILE 106 6.290 5.160 -3.779 863 HG22 ILE 106 HG22 ILE 106 7.297 4.061 -2.811 864 HG23 ILE 106 HG23 ILE 106 7.344 3.976 -4.572 865 HD11 ILE 106 HD11 ILE 106 4.489 3.155 -0.390 866 HD12 ILE 106 HD12 ILE 106 5.512 1.951 -1.189 867 HD13 ILE 106 HD13 ILE 106 6.091 3.620 -0.972 868 H GLY 107 H GLY 107 5.633 1.115 -6.423 869 HA2 GLY 107 HA2 GLY 107 3.221 -0.568 -6.190 870 HA3 GLY 107 HA3 GLY 107 4.698 -0.970 -7.067 871 H ILE 108 H ILE 108 3.167 -2.458 -5.006 872 HA ILE 108 HA ILE 108 5.295 -2.820 -2.949 873 HB ILE 108 HB ILE 108 2.309 -3.246 -2.458 874 HG12 ILE 108 HG12 ILE 108 4.089 -0.818 -1.947 875 HG13 ILE 108 HG13 ILE 108 2.538 -0.874 -2.787 876 HG21 ILE 108 HG21 ILE 108 4.714 -3.105 -0.625 877 HG22 ILE 108 HG22 ILE 108 3.029 -3.417 -0.123 878 HG23 ILE 108 HG23 ILE 108 3.861 -4.600 -1.093 879 HD11 ILE 108 HD11 ILE 108 1.444 -1.463 -0.592 880 HD12 ILE 108 HD12 ILE 108 3.023 -1.165 0.199 881 HD13 ILE 108 HD13 ILE 108 2.210 0.140 -0.647 882 H GLY 109 H GLY 109 5.824 -4.957 -2.462 883 HA2 GLY 109 HA2 GLY 109 4.126 -7.162 -3.526 884 HA3 GLY 109 HA3 GLY 109 5.885 -7.284 -3.614 885 H PHE 110 H PHE 110 3.680 -8.727 -2.132 886 HA PHE 110 HA PHE 110 4.843 -8.644 0.632 887 HB2 PHE 110 HB2 PHE 110 2.283 -9.646 -0.561 888 HB3 PHE 110 HB3 PHE 110 2.854 -10.292 0.973 889 HD1 PHE 110 HD1 PHE 110 2.601 -9.128 3.009 890 HD2 PHE 110 HD2 PHE 110 1.866 -7.084 -0.718 891 HE1 PHE 110 HE1 PHE 110 1.604 -7.240 4.248 892 HE2 PHE 110 HE2 PHE 110 0.939 -5.145 0.541 893 HZ PHE 110 HZ PHE 110 0.817 -5.212 3.008 894 H THR 111 H THR 111 5.554 -10.490 1.654 895 HA THR 111 HA THR 111 6.928 -12.366 -0.122 896 HB THR 111 HB THR 111 7.664 -11.137 2.127 897 HG1 THR 111 HG1 THR 111 9.356 -12.616 2.144 898 HG21 THR 111 HG21 THR 111 7.123 -13.965 3.142 899 HG22 THR 111 HG22 THR 111 7.818 -12.591 4.026 900 HG23 THR 111 HG23 THR 111 6.107 -12.579 3.570 901 H ASP 112 H ASP 112 3.970 -12.375 1.603 902 HA ASP 112 HA ASP 112 3.464 -15.169 0.730 903 HB2 ASP 112 HB2 ASP 112 3.882 -14.889 3.311 904 HB3 ASP 112 HB3 ASP 112 2.279 -14.132 3.316 905 H ARG 113 H ARG 113 1.511 -15.432 -0.305 906 HA ARG 113 HA ARG 113 -0.052 -13.125 -1.047 907 HB2 ARG 113 HB2 ARG 113 0.231 -15.168 -2.456 908 HB3 ARG 113 HB3 ARG 113 -0.698 -16.101 -1.284 909 HG2 ARG 113 HG2 ARG 113 -2.054 -15.506 -3.224 910 HG3 ARG 113 HG3 ARG 113 -2.717 -14.761 -1.773 911 HD2 ARG 113 HD2 ARG 113 -1.745 -12.595 -2.370 912 HD3 ARG 113 HD3 ARG 113 -0.889 -13.305 -3.738 913 HE ARG 113 HE ARG 113 -3.634 -12.405 -3.641 914 HH11 ARG 113 HH11 ARG 113 -4.925 -12.563 -5.482 915 HH12 ARG 113 HH12 ARG 113 -4.253 -13.451 -6.875 916 HH21 ARG 113 HH21 ARG 113 -1.530 -14.629 -5.408 917 HH22 ARG 113 HH22 ARG 113 -2.546 -14.470 -6.834 918 H GLY 114 H GLY 114 -0.387 -15.457 1.589 919 HA2 GLY 114 HA2 GLY 114 -3.093 -14.732 2.362 920 HA3 GLY 114 HA3 GLY 114 -1.879 -15.570 3.341 921 H ASP 115 H ASP 115 0.175 -13.501 3.206 922 HA ASP 115 HA ASP 115 -0.834 -11.617 5.189 923 HB2 ASP 115 HB2 ASP 115 1.859 -11.967 3.890 924 HB3 ASP 115 HB3 ASP 115 1.481 -10.627 4.961 925 H ALA 116 H ALA 116 -0.056 -11.408 1.698 926 HA ALA 116 HA ALA 116 -0.737 -8.625 1.437 927 HB1 ALA 116 HB1 ALA 116 -0.481 -8.991 -0.790 928 HB2 ALA 116 HB2 ALA 116 0.363 -10.445 -0.215 929 HB3 ALA 116 HB3 ALA 116 -1.301 -10.571 -0.771 930 H PHE 117 H PHE 117 -2.784 -11.589 1.350 931 HA PHE 117 HA PHE 117 -5.120 -10.313 0.467 932 HB2 PHE 117 HB2 PHE 117 -4.738 -12.746 0.521 933 HB3 PHE 117 HB3 PHE 117 -4.884 -12.728 2.274 934 HD1 PHE 117 HD1 PHE 117 -6.774 -11.777 -0.854 935 HD2 PHE 117 HD2 PHE 117 -7.013 -13.064 3.255 936 HE1 PHE 117 HE1 PHE 117 -9.198 -12.203 -1.133 937 HE2 PHE 117 HE2 PHE 117 -9.436 -13.537 2.961 938 HZ PHE 117 HZ PHE 117 -10.529 -13.127 0.763 939 H ASP 118 H ASP 118 -3.645 -10.194 3.609 940 HA ASP 118 HA ASP 118 -6.034 -9.189 5.008 941 HB2 ASP 118 HB2 ASP 118 -3.127 -9.239 5.818 942 HB3 ASP 118 HB3 ASP 118 -4.439 -8.639 6.823 943 H PHE 119 H PHE 119 -3.313 -7.825 3.152 944 HA PHE 119 HA PHE 119 -3.602 -5.095 4.040 945 HB2 PHE 119 HB2 PHE 119 -1.553 -5.825 3.019 946 HB3 PHE 119 HB3 PHE 119 -2.372 -6.349 1.562 947 HD1 PHE 119 HD1 PHE 119 -0.965 -3.487 3.293 948 HD2 PHE 119 HD2 PHE 119 -3.257 -4.774 -0.075 949 HE1 PHE 119 HE1 PHE 119 -0.822 -1.209 2.359 950 HE2 PHE 119 HE2 PHE 119 -3.077 -2.465 -1.081 951 HZ PHE 119 HZ PHE 119 -1.876 -0.694 0.163 952 H ASN 120 H ASN 120 -5.053 -6.993 1.345 953 HA ASN 120 HA ASN 120 -6.615 -4.661 0.496 954 HB2 ASN 120 HB2 ASN 120 -7.217 -5.848 -1.333 955 HB3 ASN 120 HB3 ASN 120 -5.620 -6.531 -0.946 956 HD21 ASN 120 HD21 ASN 120 -8.727 -8.989 -1.221 957 HD22 ASN 120 HD22 ASN 120 -9.046 -7.297 -1.414 958 H VAL 121 H VAL 121 -7.408 -7.671 2.339 959 HA VAL 121 HA VAL 121 -10.189 -6.948 2.358 960 HB VAL 121 HB VAL 121 -8.650 -9.037 3.928 961 HG11 VAL 121 HG11 VAL 121 -11.670 -8.605 3.834 962 HG12 VAL 121 HG12 VAL 121 -10.861 -10.068 4.448 963 HG13 VAL 121 HG13 VAL 121 -10.631 -8.531 5.275 964 HG21 VAL 121 HG21 VAL 121 -10.614 -9.170 1.579 965 HG22 VAL 121 HG22 VAL 121 -8.865 -9.434 1.481 966 HG23 VAL 121 HG23 VAL 121 -9.865 -10.572 2.378 967 H SER 122 H SER 122 -7.586 -6.200 4.688 968 HA SER 122 HA SER 122 -9.328 -5.143 6.718 969 HB2 SER 122 HB2 SER 122 -7.411 -3.728 7.388 970 HB3 SER 122 HB3 SER 122 -6.986 -5.442 7.224 971 HG SER 122 HG SER 122 -5.911 -5.032 5.404 972 H LEU 123 H LEU 123 -8.279 -3.797 3.603 973 HA LEU 123 HA LEU 123 -9.527 -1.194 4.162 974 HB2 LEU 123 HB2 LEU 123 -8.300 -2.359 1.647 975 HB3 LEU 123 HB3 LEU 123 -8.849 -0.692 1.832 976 HG LEU 123 HG LEU 123 -6.715 -1.926 3.627 977 HD11 LEU 123 HD11 LEU 123 -6.065 -1.909 1.197 978 HD12 LEU 123 HD12 LEU 123 -6.232 -0.143 1.254 979 HD13 LEU 123 HD13 LEU 123 -5.034 -0.971 2.273 980 HD21 LEU 123 HD21 LEU 123 -7.474 0.971 3.070 981 HD22 LEU 123 HD22 LEU 123 -7.779 0.080 4.579 982 HD23 LEU 123 HD23 LEU 123 -6.123 0.422 4.084 983 H GLN 124 H GLN 124 -10.359 -4.068 2.130 984 HA GLN 124 HA GLN 124 -12.823 -3.117 1.115 985 HB2 GLN 124 HB2 GLN 124 -12.000 -5.887 2.050 986 HB3 GLN 124 HB3 GLN 124 -13.551 -5.580 1.306 987 HG2 GLN 124 HG2 GLN 124 -10.955 -4.881 -0.117 988 HG3 GLN 124 HG3 GLN 124 -11.682 -6.481 -0.184 989 HE21 GLN 124 HE21 GLN 124 -13.138 -5.124 -3.165 990 HE22 GLN 124 HE22 GLN 124 -11.730 -6.013 -2.562 991 H ASP 125 H ASP 125 -12.266 -4.770 4.303 992 HA ASP 125 HA ASP 125 -15.029 -4.445 5.095 993 HB2 ASP 125 HB2 ASP 125 -13.419 -6.254 5.839 994 HB3 ASP 125 HB3 ASP 125 -12.659 -5.031 6.874 995 H HIS 126 H HIS 126 -12.472 -2.204 5.032 996 HA HIS 126 HA HIS 126 -13.478 -0.548 7.282 997 HB2 HIS 126 HB2 HIS 126 -11.080 -0.656 6.945 998 HB3 HIS 126 HB3 HIS 126 -11.251 -0.067 5.285 999 HD2 HIS 126 HD2 HIS 126 -11.940 1.134 8.933 1000 HE1 HIS 126 HE1 HIS 126 -11.095 4.576 6.566 1001 HE2 HIS 126 HE2 HIS 126 -11.500 3.738 8.917 1002 H PHE 127 H PHE 127 -13.706 -0.690 3.763 1003 HA PHE 127 HA PHE 127 -15.192 1.892 3.718 1004 HB2 PHE 127 HB2 PHE 127 -13.748 0.313 1.616 1005 HB3 PHE 127 HB3 PHE 127 -14.878 1.592 1.210 1006 HD1 PHE 127 HD1 PHE 127 -14.543 3.947 2.216 1007 HD2 PHE 127 HD2 PHE 127 -11.502 0.899 2.383 1008 HE1 PHE 127 HE1 PHE 127 -12.835 5.662 2.733 1009 HE2 PHE 127 HE2 PHE 127 -9.800 2.617 2.895 1010 HZ PHE 127 HZ PHE 127 -10.476 5.004 3.083 1011 H LYS 128 H LYS 128 -15.745 -1.448 3.505 1012 HA LYS 128 HA LYS 128 -18.203 -1.868 2.348 1013 HB2 LYS 128 HB2 LYS 128 -16.997 -3.651 3.042 1014 HB3 LYS 128 HB3 LYS 128 -16.548 -2.950 4.580 1015 HG2 LYS 128 HG2 LYS 128 -19.355 -3.933 4.169 1016 HG3 LYS 128 HG3 LYS 128 -17.989 -5.030 4.465 1017 HD2 LYS 128 HD2 LYS 128 -17.411 -3.722 6.528 1018 HD3 LYS 128 HD3 LYS 128 -18.891 -2.790 6.298 1019 HE2 LYS 128 HE2 LYS 128 -19.241 -4.446 7.969 1020 HE3 LYS 128 HE3 LYS 128 -20.236 -4.846 6.559 1021 HZ1 LYS 128 HZ1 LYS 128 -18.650 -6.558 5.975 1022 HZ2 LYS 128 HZ2 LYS 128 -17.570 -6.071 7.100 1023 HZ3 LYS 128 HZ3 LYS 128 -18.986 -6.769 7.559 1024 H TRP 129 H TRP 129 -17.768 -0.201 5.457 1025 HA TRP 129 HA TRP 129 -20.744 -0.037 5.785 1026 HB2 TRP 129 HB2 TRP 129 -20.233 0.438 8.154 1027 HB3 TRP 129 HB3 TRP 129 -19.745 -1.146 7.605 1028 HD1 TRP 129 HD1 TRP 129 -17.141 -1.721 7.578 1029 HE1 TRP 129 HE1 TRP 129 -15.089 -0.599 8.465 1030 HE3 TRP 129 HE3 TRP 129 -19.181 2.825 8.684 1031 HZ2 TRP 129 HZ2 TRP 129 -14.337 2.027 9.543 1032 HZ3 TRP 129 HZ3 TRP 129 -17.755 4.658 9.612 1033 HH2 TRP 129 HH2 TRP 129 -15.336 4.273 10.015 1034 H VAL 130 H VAL 130 -18.585 1.826 4.339 1035 HA VAL 130 HA VAL 130 -19.962 4.389 5.016 1036 HB VAL 130 HB VAL 130 -17.400 5.208 4.290 1037 HG11 VAL 130 HG11 VAL 130 -17.333 5.937 6.699 1038 HG12 VAL 130 HG12 VAL 130 -18.876 6.306 5.903 1039 HG13 VAL 130 HG13 VAL 130 -18.745 4.923 7.012 1040 HG21 VAL 130 HG21 VAL 130 -17.025 3.126 6.444 1041 HG22 VAL 130 HG22 VAL 130 -16.487 2.978 4.769 1042 HG23 VAL 130 HG23 VAL 130 -15.829 4.259 5.794 1043 H LYS 131 H LYS 131 -18.501 5.810 2.970 1044 HA LYS 131 HA LYS 131 -18.785 6.425 0.784 1045 HB2 LYS 131 HB2 LYS 131 -18.351 3.439 0.579 1046 HB3 LYS 131 HB3 LYS 131 -18.592 4.405 -0.879 1047 HG2 LYS 131 HG2 LYS 131 -16.618 5.764 -0.366 1048 HG3 LYS 131 HG3 LYS 131 -16.437 4.935 1.194 1049 HD2 LYS 131 HD2 LYS 131 -14.910 3.864 -0.301 1050 HD3 LYS 131 HD3 LYS 131 -16.262 2.765 -0.028 1051 HE2 LYS 131 HE2 LYS 131 -17.119 4.135 -2.276 1052 HE3 LYS 131 HE3 LYS 131 -15.379 4.139 -2.535 1053 HZ1 LYS 131 HZ1 LYS 131 -15.458 1.666 -2.263 1054 HZ2 LYS 131 HZ2 LYS 131 -17.109 1.759 -2.098 1055 HZ3 LYS 131 HZ3 LYS 131 -16.398 2.174 -3.501 1056 H GLN 132 H GLN 132 -21.223 5.671 2.322 1057 HA GLN 132 HA GLN 132 -23.476 5.593 2.094 1058 HB2 GLN 132 HB2 GLN 132 -23.064 7.251 -0.413 1059 HB3 GLN 132 HB3 GLN 132 -24.448 7.231 0.671 1060 HG2 GLN 132 HG2 GLN 132 -23.366 9.190 1.300 1061 HG3 GLN 132 HG3 GLN 132 -22.829 8.046 2.523 1062 HE21 GLN 132 HE21 GLN 132 -19.486 8.996 1.818 1063 HE22 GLN 132 HE22 GLN 132 -20.696 8.600 3.031 1064 H GLU 133 H GLU 133 -22.194 3.295 0.986 1065 HA GLU 133 HA GLU 133 -24.120 2.440 -1.124 1066 HB2 GLU 133 HB2 GLU 133 -22.481 0.845 -1.886 1067 HB3 GLU 133 HB3 GLU 133 -21.852 2.486 -1.959 1068 HG2 GLU 133 HG2 GLU 133 -20.501 2.112 0.052 1069 HG3 GLU 133 HG3 GLU 133 -21.188 0.497 0.259 1070 H1 SER 149 H1 SER 149 18.875 -10.933 -18.315 1071 H2 SER 149 H2 SER 149 19.774 -12.175 -18.885 1072 H3 SER 149 H3 SER 149 19.835 -11.772 -17.294 1073 HA SER 149 HA SER 149 17.475 -12.829 -18.697 1074 HB2 SER 149 HB2 SER 149 19.339 -14.490 -18.311 1075 HB3 SER 149 HB3 SER 149 19.123 -14.240 -16.568 1076 HG SER 149 HG SER 149 17.911 -16.021 -17.415 1077 H GLN 150 H GLN 150 15.713 -13.455 -17.195 1078 HA GLN 150 HA GLN 150 15.612 -12.145 -14.578 1079 HB2 GLN 150 HB2 GLN 150 13.640 -10.798 -15.038 1080 HB3 GLN 150 HB3 GLN 150 14.997 -10.283 -16.033 1081 HG2 GLN 150 HG2 GLN 150 14.024 -11.498 -17.987 1082 HG3 GLN 150 HG3 GLN 150 12.665 -12.017 -16.983 1083 HE21 GLN 150 HE21 GLN 150 12.809 -8.117 -18.296 1084 HE22 GLN 150 HE22 GLN 150 14.267 -9.095 -18.369 1085 H ILE 151 H ILE 151 13.757 -12.701 -13.327 1086 HA ILE 151 HA ILE 151 12.105 -15.010 -14.237 1087 HB ILE 151 HB ILE 151 13.481 -14.772 -11.528 1088 HG12 ILE 151 HG12 ILE 151 13.914 -16.774 -13.798 1089 HG13 ILE 151 HG13 ILE 151 15.032 -15.495 -13.324 1090 HG21 ILE 151 HG21 ILE 151 11.609 -16.941 -12.600 1091 HG22 ILE 151 HG22 ILE 151 12.435 -16.964 -11.027 1092 HG23 ILE 151 HG23 ILE 151 11.210 -15.758 -11.330 1093 HD11 ILE 151 HD11 ILE 151 15.883 -17.520 -12.435 1094 HD12 ILE 151 HD12 ILE 151 15.268 -16.568 -11.068 1095 HD13 ILE 151 HD13 ILE 151 14.338 -17.955 -11.696 1096 H THR 152 H THR 152 9.953 -14.874 -13.586 1097 HA THR 152 HA THR 152 9.121 -12.537 -11.947 1098 HB THR 152 HB THR 152 7.392 -11.960 -13.653 1099 HG1 THR 152 HG1 THR 152 8.989 -13.571 -15.351 1100 HG21 THR 152 HG21 THR 152 8.810 -10.676 -15.122 1101 HG22 THR 152 HG22 THR 152 9.494 -10.638 -13.488 1102 HG23 THR 152 HG23 THR 152 10.223 -11.676 -14.732 1103 H SER 153 H SER 153 7.162 -12.625 -10.954 1104 HA SER 153 HA SER 153 5.599 -15.173 -11.064 1105 HB2 SER 153 HB2 SER 153 6.075 -13.343 -8.712 1106 HB3 SER 153 HB3 SER 153 5.026 -14.778 -8.729 1107 HG SER 153 HG SER 153 7.138 -15.233 -7.890 1108 H GLN 154 H GLN 154 5.018 -13.564 -12.858 1109 HA GLN 154 HA GLN 154 3.878 -11.151 -12.749 1110 HB2 GLN 154 HB2 GLN 154 2.952 -13.324 -14.662 1111 HB3 GLN 154 HB3 GLN 154 2.837 -11.575 -14.918 1112 HG2 GLN 154 HG2 GLN 154 5.335 -11.423 -14.830 1113 HG3 GLN 154 HG3 GLN 154 5.420 -13.174 -14.635 1114 HE21 GLN 154 HE21 GLN 154 6.080 -12.940 -18.139 1115 HE22 GLN 154 HE22 GLN 154 6.855 -12.890 -16.549 1116 H VAL 155 H VAL 155 1.960 -10.091 -12.609 1117 HA VAL 155 HA VAL 155 0.081 -11.122 -10.795 1118 HB VAL 155 HB VAL 155 0.473 -8.810 -10.805 1119 HG11 VAL 155 HG11 VAL 155 -0.528 -8.654 -13.642 1120 HG12 VAL 155 HG12 VAL 155 -0.190 -7.270 -12.599 1121 HG13 VAL 155 HG13 VAL 155 1.130 -8.371 -13.037 1122 HG21 VAL 155 HG21 VAL 155 -1.678 -8.937 -9.924 1123 HG22 VAL 155 HG22 VAL 155 -1.863 -7.763 -11.163 1124 HG23 VAL 155 HG23 VAL 155 -2.429 -9.399 -11.481 1125 H TPO 156 H T2P 156 -1.483 -12.397 -11.025 1126 HA TPO 156 HA T2P 156 -2.789 -13.742 -13.018 1127 HB TPO 156 HB T2P 156 -3.856 -12.679 -10.412 1128 HG21 TPO 156 HG21 T2P 156 -5.437 -14.576 -10.422 1129 HG22 TPO 156 HG22 T2P 156 -5.072 -14.836 -12.146 1130 HG23 TPO 156 HG23 T2P 156 -5.819 -13.303 -11.547 1131 H GLY 157 H GLY 157 -4.947 -13.651 -13.723 1132 HA2 GLY 157 HA2 GLY 157 -6.546 -11.351 -14.015 1133 HA3 GLY 157 HA3 GLY 157 -5.582 -11.489 -15.494 1134 H GLN 158 H GLN 158 -5.591 -14.500 -15.313 1135 HA GLN 158 HA GLN 158 -7.871 -14.991 -16.896 1136 HB2 GLN 158 HB2 GLN 158 -7.071 -17.279 -17.023 1137 HB3 GLN 158 HB3 GLN 158 -5.782 -16.113 -17.204 1138 HG2 GLN 158 HG2 GLN 158 -4.805 -17.759 -15.899 1139 HG3 GLN 158 HG3 GLN 158 -5.195 -16.520 -14.726 1140 HE21 GLN 158 HE21 GLN 158 -6.277 -19.445 -12.923 1141 HE22 GLN 158 HE22 GLN 158 -4.917 -18.359 -13.158 1142 H ILE 159 H ILE 159 -7.559 -15.411 -13.416 1143 HA ILE 159 HA ILE 159 -10.163 -16.863 -13.348 1144 HB ILE 159 HB ILE 159 -8.344 -17.911 -12.186 1145 HG12 ILE 159 HG12 ILE 159 -10.480 -16.936 -10.249 1146 HG13 ILE 159 HG13 ILE 159 -10.715 -18.182 -11.477 1147 HG21 ILE 159 HG21 ILE 159 -7.374 -17.004 -10.110 1148 HG22 ILE 159 HG22 ILE 159 -7.026 -15.986 -11.490 1149 HG23 ILE 159 HG23 ILE 159 -8.287 -15.502 -10.334 1150 HD11 ILE 159 HD11 ILE 159 -10.344 -19.254 -9.356 1151 HD12 ILE 159 HD12 ILE 159 -8.925 -19.555 -10.378 1152 HD13 ILE 159 HD13 ILE 159 -8.855 -18.347 -9.072 1153 H GLY 160 H GLY 160 -8.712 -13.860 -12.144 1154 HA2 GLY 160 HA2 GLY 160 -9.727 -11.806 -11.789 1155 HA3 GLY 160 HA3 GLY 160 -11.244 -12.474 -12.376 1156 H TRP 161 H TRP 161 -9.084 -12.725 -9.451 1157 HA TRP 161 HA TRP 161 -11.503 -13.129 -7.750 1158 HB2 TRP 161 HB2 TRP 161 -10.570 -15.076 -6.831 1159 HB3 TRP 161 HB3 TRP 161 -10.437 -15.260 -8.556 1160 HD1 TRP 161 HD1 TRP 161 -7.561 -13.359 -8.441 1161 HE1 TRP 161 HE1 TRP 161 -5.427 -14.727 -8.058 1162 HE3 TRP 161 HE3 TRP 161 -9.621 -17.321 -5.987 1163 HZ2 TRP 161 HZ2 TRP 161 -4.700 -17.170 -6.735 1164 HZ3 TRP 161 HZ3 TRP 161 -8.170 -19.142 -5.091 1165 HH2 TRP 161 HH2 TRP 161 -5.712 -19.082 -5.468 1166 H ARG 162 H ARG 162 -10.287 -13.684 -5.472 1167 HA ARG 162 HA ARG 162 -9.407 -12.970 -3.662 1168 HB2 ARG 162 HB2 ARG 162 -7.228 -12.538 -5.604 1169 HB3 ARG 162 HB3 ARG 162 -6.931 -12.070 -3.927 1170 HG2 ARG 162 HG2 ARG 162 -8.007 -14.809 -4.647 1171 HG3 ARG 162 HG3 ARG 162 -6.276 -14.447 -4.614 1172 HD2 ARG 162 HD2 ARG 162 -6.450 -13.761 -2.250 1173 HD3 ARG 162 HD3 ARG 162 -8.188 -14.135 -2.271 1174 HE ARG 162 HE ARG 162 -6.708 -16.422 -3.134 1175 HH11 ARG 162 HH11 ARG 162 -6.413 -18.177 -1.805 1176 HH12 ARG 162 HH12 ARG 162 -6.633 -18.021 -0.087 1177 HH21 ARG 162 HH21 ARG 162 -7.446 -14.687 -0.164 1178 HH22 ARG 162 HH22 ARG 162 -7.201 -16.101 0.818 1179 H ARG 163 H ARG 163 -11.179 -11.052 -4.700 1180 HA ARG 163 HA ARG 163 -12.205 -9.128 -4.021 1181 HB2 ARG 163 HB2 ARG 163 -10.627 -9.601 -1.474 1182 HB3 ARG 163 HB3 ARG 163 -12.096 -8.635 -1.636 1183 HG2 ARG 163 HG2 ARG 163 -13.368 -10.668 -2.270 1184 HG3 ARG 163 HG3 ARG 163 -11.893 -11.645 -2.086 1185 HD2 ARG 163 HD2 ARG 163 -11.716 -10.931 0.277 1186 HD3 ARG 163 HD3 ARG 163 -13.225 -10.010 0.110 1187 HE ARG 163 HE ARG 163 -13.817 -12.627 -0.704 1188 HH11 ARG 163 HH11 ARG 163 -14.751 -14.157 0.599 1189 HH12 ARG 163 HH12 ARG 163 -14.628 -14.023 2.329 1190 HH21 ARG 163 HH21 ARG 163 -12.802 -11.125 2.292 1191 HH22 ARG 163 HH22 ARG 163 -13.553 -12.358 3.267 Start of MODEL 6 1 H1 GLY -4 H1 GLY -4 2.817 26.545 2.732 2 H2 GLY -4 H2 GLY -4 1.179 26.572 2.790 3 H3 GLY -4 H3 GLY -4 1.988 25.190 3.135 4 HA2 GLY -4 HA2 GLY -4 2.961 26.167 5.104 5 HA3 GLY -4 HA3 GLY -4 2.103 27.672 4.726 6 H SER -3 H SER -3 1.928 25.922 7.106 7 HA SER -3 HA SER -3 -1.007 25.426 7.147 8 HB2 SER -3 HB2 SER -3 1.110 23.492 8.157 9 HB3 SER -3 HB3 SER -3 -0.638 23.302 8.358 10 HG SER -3 HG SER -3 -0.832 23.184 6.081 11 HA PRO -2 HA PRO -2 -0.726 27.669 10.878 12 HB2 PRO -2 HB2 PRO -2 -3.033 27.066 12.188 13 HB3 PRO -2 HB3 PRO -2 -3.016 27.886 10.598 14 HG2 PRO -2 HG2 PRO -2 -3.353 24.910 11.137 15 HG3 PRO -2 HG3 PRO -2 -4.406 25.976 10.149 16 HD2 PRO -2 HD2 PRO -2 -2.456 24.464 9.022 17 HD3 PRO -2 HD3 PRO -2 -2.798 26.116 8.426 18 H ASN -1 H ASN -1 -0.443 27.690 13.175 19 HA ASN -1 HA ASN -1 1.050 25.511 14.270 20 HB2 ASN -1 HB2 ASN -1 1.355 27.914 14.828 21 HB3 ASN -1 HB3 ASN -1 -0.228 27.939 15.613 22 HD21 ASN -1 HD21 ASN -1 2.929 26.100 17.509 23 HD22 ASN -1 HD22 ASN -1 3.004 26.345 15.772 24 H SER 0 H SER 0 -2.391 26.032 14.225 25 HA SER 0 HA SER 0 -3.175 24.561 16.538 26 HB2 SER 0 HB2 SER 0 -5.377 24.428 15.397 27 HB3 SER 0 HB3 SER 0 -4.700 26.064 15.465 28 HG SER 0 HG SER 0 -5.547 25.510 13.380 29 H MET 1 H MET 1 -1.680 23.295 13.700 30 HA MET 1 HA MET 1 -2.726 20.633 13.675 31 HB2 MET 1 HB2 MET 1 0.104 21.682 13.267 32 HB3 MET 1 HB3 MET 1 -0.387 20.008 12.973 33 HG2 MET 1 HG2 MET 1 -2.099 20.815 11.350 34 HG3 MET 1 HG3 MET 1 -1.474 22.451 11.527 35 HE1 MET 1 HE1 MET 1 1.766 21.896 11.693 36 HE2 MET 1 HE2 MET 1 2.158 22.108 9.977 37 HE3 MET 1 HE3 MET 1 0.995 23.199 10.758 38 H ALA 2 H ALA 2 -0.774 22.267 16.131 39 HA ALA 2 HA ALA 2 0.013 19.863 17.552 40 HB1 ALA 2 HB1 ALA 2 0.763 21.475 19.249 41 HB2 ALA 2 HB2 ALA 2 1.273 21.989 17.630 42 HB3 ALA 2 HB3 ALA 2 -0.110 22.782 18.421 43 H THR 3 H THR 3 -3.003 21.603 17.431 44 HA THR 3 HA THR 3 -3.981 20.263 19.924 45 HB THR 3 HB THR 3 -5.524 22.152 20.207 46 HG1 THR 3 HG1 THR 3 -5.239 23.992 18.962 47 HG21 THR 3 HG21 THR 3 -2.651 23.125 19.920 48 HG22 THR 3 HG22 THR 3 -3.918 23.805 20.967 49 HG23 THR 3 HG23 THR 3 -3.270 22.186 21.297 50 H GLU 4 H GLU 4 -4.387 20.439 16.606 51 HA GLU 4 HA GLU 4 -7.107 19.847 16.192 52 HB2 GLU 4 HB2 GLU 4 -5.464 20.496 14.460 53 HB3 GLU 4 HB3 GLU 4 -4.628 18.960 14.656 54 HG2 GLU 4 HG2 GLU 4 -5.952 18.966 12.634 55 HG3 GLU 4 HG3 GLU 4 -6.577 17.758 13.738 56 H LEU 5 H LEU 5 -8.134 17.902 15.589 57 HA LEU 5 HA LEU 5 -7.591 15.549 17.269 58 HB2 LEU 5 HB2 LEU 5 -9.788 16.109 15.240 59 HB3 LEU 5 HB3 LEU 5 -9.720 14.723 16.328 60 HG LEU 5 HG LEU 5 -10.018 17.638 17.182 61 HD11 LEU 5 HD11 LEU 5 -12.022 16.681 16.107 62 HD12 LEU 5 HD12 LEU 5 -11.981 15.309 17.236 63 HD13 LEU 5 HD13 LEU 5 -12.281 16.957 17.836 64 HD21 LEU 5 HD21 LEU 5 -10.016 15.080 18.848 65 HD22 LEU 5 HD22 LEU 5 -8.826 16.402 18.934 66 HD23 LEU 5 HD23 LEU 5 -10.493 16.689 19.436 67 H GLU 6 H GLU 6 -5.457 15.750 15.910 68 HA GLU 6 HA GLU 6 -5.381 14.340 13.365 69 HB2 GLU 6 HB2 GLU 6 -3.499 15.783 15.180 70 HB3 GLU 6 HB3 GLU 6 -2.764 14.609 14.091 71 HG2 GLU 6 HG2 GLU 6 -4.668 16.685 13.011 72 HG3 GLU 6 HG3 GLU 6 -2.984 17.074 13.345 73 H TYR 7 H TYR 7 -6.689 12.650 15.020 74 HA TYR 7 HA TYR 7 -4.829 10.630 16.076 75 HB2 TYR 7 HB2 TYR 7 -6.614 9.574 17.059 76 HB3 TYR 7 HB3 TYR 7 -7.031 11.267 17.203 77 HD1 TYR 7 HD1 TYR 7 -8.895 12.213 15.756 78 HD2 TYR 7 HD2 TYR 7 -7.949 8.001 15.849 79 HE1 TYR 7 HE1 TYR 7 -11.084 11.690 14.699 80 HE2 TYR 7 HE2 TYR 7 -10.119 7.482 14.777 81 HH TYR 7 HH TYR 7 -12.475 10.052 13.906 82 H GLU 8 H GLU 8 -5.453 8.312 15.599 83 HA GLU 8 HA GLU 8 -6.665 7.512 13.183 84 HB2 GLU 8 HB2 GLU 8 -4.796 6.523 11.978 85 HB3 GLU 8 HB3 GLU 8 -4.661 8.261 12.027 86 HG2 GLU 8 HG2 GLU 8 -3.050 7.868 14.081 87 HG3 GLU 8 HG3 GLU 8 -2.969 6.209 13.469 88 H SER 9 H SER 9 -7.474 5.616 13.604 89 HA SER 9 HA SER 9 -6.613 4.035 15.912 90 HB2 SER 9 HB2 SER 9 -8.980 3.894 14.030 91 HB3 SER 9 HB3 SER 9 -8.700 2.721 15.337 92 HG SER 9 HG SER 9 -10.064 4.448 16.008 93 H VAL 10 H VAL 10 -5.589 1.983 15.797 94 HA VAL 10 HA VAL 10 -4.412 1.268 13.264 95 HB VAL 10 HB VAL 10 -3.258 0.936 15.375 96 HG11 VAL 10 HG11 VAL 10 -3.685 -0.967 16.825 97 HG12 VAL 10 HG12 VAL 10 -5.118 0.069 16.782 98 HG13 VAL 10 HG13 VAL 10 -5.091 -1.449 15.858 99 HG21 VAL 10 HG21 VAL 10 -2.563 -0.296 13.344 100 HG22 VAL 10 HG22 VAL 10 -2.218 -1.193 14.838 101 HG23 VAL 10 HG23 VAL 10 -3.590 -1.666 13.830 102 H LEU 11 H LEU 11 -4.817 -0.265 11.788 103 HA LEU 11 HA LEU 11 -7.300 -1.927 12.061 104 HB2 LEU 11 HB2 LEU 11 -6.083 -0.674 9.569 105 HB3 LEU 11 HB3 LEU 11 -7.445 -1.782 9.601 106 HG LEU 11 HG LEU 11 -7.405 1.048 10.711 107 HD11 LEU 11 HD11 LEU 11 -7.527 0.939 8.287 108 HD12 LEU 11 HD12 LEU 11 -8.779 -0.321 8.355 109 HD13 LEU 11 HD13 LEU 11 -9.140 1.319 8.902 110 HD21 LEU 11 HD21 LEU 11 -8.861 -0.269 12.158 111 HD22 LEU 11 HD22 LEU 11 -9.858 0.692 11.072 112 HD23 LEU 11 HD23 LEU 11 -9.630 -1.040 10.747 113 H CYS 12 H CYS 12 -4.007 -1.821 10.586 114 HA CYS 12 HA CYS 12 -3.830 -4.748 10.878 115 HB2 CYS 12 HB2 CYS 12 -4.808 -4.164 8.566 116 HB3 CYS 12 HB3 CYS 12 -3.201 -3.526 8.180 117 HG CYS 12 HG CYS 12 -4.097 -6.570 9.154 118 H VAL 13 H VAL 13 -1.763 -5.600 10.826 119 HA VAL 13 HA VAL 13 0.525 -3.877 10.307 120 HB VAL 13 HB VAL 13 0.130 -3.544 12.709 121 HG11 VAL 13 HG11 VAL 13 0.481 -5.243 14.373 122 HG12 VAL 13 HG12 VAL 13 -0.835 -5.755 13.309 123 HG13 VAL 13 HG13 VAL 13 0.781 -6.480 13.141 124 HG21 VAL 13 HG21 VAL 13 2.400 -3.333 11.885 125 HG22 VAL 13 HG22 VAL 13 2.409 -4.031 13.502 126 HG23 VAL 13 HG23 VAL 13 2.684 -5.079 12.094 127 H LYS 14 H LYS 14 1.951 -4.995 9.114 128 HA LYS 14 HA LYS 14 1.982 -7.955 9.381 129 HB2 LYS 14 HB2 LYS 14 1.994 -6.457 6.749 130 HB3 LYS 14 HB3 LYS 14 2.648 -8.067 6.883 131 HG2 LYS 14 HG2 LYS 14 -0.199 -7.351 7.691 132 HG3 LYS 14 HG3 LYS 14 0.282 -7.957 6.103 133 HD2 LYS 14 HD2 LYS 14 1.217 -10.018 7.173 134 HD3 LYS 14 HD3 LYS 14 0.598 -9.461 8.748 135 HE2 LYS 14 HE2 LYS 14 -1.674 -9.398 7.879 136 HE3 LYS 14 HE3 LYS 14 -1.088 -9.845 6.265 137 HZ1 LYS 14 HZ1 LYS 14 -0.353 -11.966 7.178 138 HZ2 LYS 14 HZ2 LYS 14 -0.945 -11.581 8.666 139 HZ3 LYS 14 HZ3 LYS 14 -1.972 -11.759 7.392 140 HA PRO 15 HA PRO 15 6.006 -7.575 10.618 141 HB2 PRO 15 HB2 PRO 15 6.969 -10.131 10.332 142 HB3 PRO 15 HB3 PRO 15 5.658 -9.696 11.467 143 HG2 PRO 15 HG2 PRO 15 5.355 -10.821 8.646 144 HG3 PRO 15 HG3 PRO 15 4.584 -11.411 10.157 145 HD2 PRO 15 HD2 PRO 15 3.288 -9.767 8.495 146 HD3 PRO 15 HD3 PRO 15 3.160 -9.561 10.269 147 H ASP 16 H ASP 16 5.696 -8.738 7.287 148 HA ASP 16 HA ASP 16 8.276 -7.470 6.582 149 HB2 ASP 16 HB2 ASP 16 8.755 -9.865 7.043 150 HB3 ASP 16 HB3 ASP 16 7.571 -10.327 5.820 151 H VAL 17 H VAL 17 8.092 -6.290 4.771 152 HA VAL 17 HA VAL 17 6.286 -7.025 2.593 153 HB VAL 17 HB VAL 17 4.803 -5.746 4.113 154 HG11 VAL 17 HG11 VAL 17 6.600 -3.356 3.621 155 HG12 VAL 17 HG12 VAL 17 5.043 -3.364 4.463 156 HG13 VAL 17 HG13 VAL 17 6.425 -4.225 5.159 157 HG21 VAL 17 HG21 VAL 17 5.420 -4.207 1.574 158 HG22 VAL 17 HG22 VAL 17 4.468 -5.711 1.656 159 HG23 VAL 17 HG23 VAL 17 3.888 -4.249 2.466 160 H SER 18 H SER 18 6.994 -6.249 0.633 161 HA SER 18 HA SER 18 9.502 -4.627 0.651 162 HB2 SER 18 HB2 SER 18 8.663 -6.718 -1.371 163 HB3 SER 18 HB3 SER 18 10.203 -5.842 -1.274 164 HG SER 18 HG SER 18 10.244 -7.994 -0.365 165 H VAL 19 H VAL 19 9.793 -3.013 -0.825 166 HA VAL 19 HA VAL 19 7.356 -2.045 -2.265 167 HB VAL 19 HB VAL 19 9.301 -0.522 -0.554 168 HG11 VAL 19 HG11 VAL 19 7.253 0.572 -2.507 169 HG12 VAL 19 HG12 VAL 19 8.043 1.526 -1.242 170 HG13 VAL 19 HG13 VAL 19 9.012 0.857 -2.541 171 HG21 VAL 19 HG21 VAL 19 7.232 0.125 0.602 172 HG22 VAL 19 HG22 VAL 19 6.261 -0.782 -0.567 173 HG23 VAL 19 HG23 VAL 19 7.347 -1.629 0.550 174 H TYR 20 H TYR 20 7.500 -1.201 -4.139 175 HA TYR 20 HA TYR 20 10.037 -1.351 -5.716 176 HB2 TYR 20 HB2 TYR 20 7.276 -2.403 -6.484 177 HB3 TYR 20 HB3 TYR 20 8.746 -2.520 -7.433 178 HD1 TYR 20 HD1 TYR 20 10.200 -4.417 -7.156 179 HD2 TYR 20 HD2 TYR 20 7.061 -3.682 -4.295 180 HE1 TYR 20 HE1 TYR 20 10.557 -6.671 -6.154 181 HE2 TYR 20 HE2 TYR 20 7.511 -5.900 -3.248 182 HH TYR 20 HH TYR 20 9.965 -8.156 -4.499 183 H ARG 21 H ARG 21 9.976 1.057 -5.405 184 HA ARG 21 HA ARG 21 8.032 2.864 -6.247 185 HB2 ARG 21 HB2 ARG 21 11.023 3.079 -6.798 186 HB3 ARG 21 HB3 ARG 21 9.864 4.411 -6.801 187 HG2 ARG 21 HG2 ARG 21 9.432 4.004 -4.360 188 HG3 ARG 21 HG3 ARG 21 10.638 2.718 -4.381 189 HD2 ARG 21 HD2 ARG 21 11.688 4.683 -3.496 190 HD3 ARG 21 HD3 ARG 21 12.364 4.364 -5.085 191 HE ARG 21 HE ARG 21 11.421 6.326 -5.920 192 HH11 ARG 21 HH11 ARG 21 10.619 8.406 -5.715 193 HH12 ARG 21 HH12 ARG 21 9.883 8.895 -4.199 194 HH21 ARG 21 HH21 ARG 21 10.142 5.897 -2.654 195 HH22 ARG 21 HH22 ARG 21 9.543 7.558 -2.639 196 H ILE 22 H ILE 22 7.186 3.648 -8.139 197 HA ILE 22 HA ILE 22 7.941 2.139 -10.599 198 HB ILE 22 HB ILE 22 5.646 2.036 -11.251 199 HG12 ILE 22 HG12 ILE 22 5.061 3.635 -8.737 200 HG13 ILE 22 HG13 ILE 22 4.621 4.011 -10.405 201 HG21 ILE 22 HG21 ILE 22 5.861 1.128 -8.403 202 HG22 ILE 22 HG22 ILE 22 4.941 0.384 -9.698 203 HG23 ILE 22 HG23 ILE 22 6.712 0.323 -9.738 204 HD11 ILE 22 HD11 ILE 22 3.143 1.923 -10.349 205 HD12 ILE 22 HD12 ILE 22 3.432 1.892 -8.590 206 HD13 ILE 22 HD13 ILE 22 2.635 3.288 -9.337 207 HA PRO 23 HA PRO 23 8.042 6.061 -12.735 208 HB2 PRO 23 HB2 PRO 23 8.308 5.125 -15.343 209 HB3 PRO 23 HB3 PRO 23 9.613 5.414 -14.163 210 HG2 PRO 23 HG2 PRO 23 8.376 2.816 -14.978 211 HG3 PRO 23 HG3 PRO 23 10.037 3.155 -14.439 212 HD2 PRO 23 HD2 PRO 23 8.027 2.034 -12.850 213 HD3 PRO 23 HD3 PRO 23 9.483 2.858 -12.229 214 HA PRO 24 HA PRO 24 4.159 5.707 -15.450 215 HB2 PRO 24 HB2 PRO 24 2.452 3.581 -15.387 216 HB3 PRO 24 HB3 PRO 24 3.932 3.609 -16.395 217 HG2 PRO 24 HG2 PRO 24 3.600 2.400 -13.623 218 HG3 PRO 24 HG3 PRO 24 4.264 1.619 -15.096 219 HD2 PRO 24 HD2 PRO 24 5.888 2.742 -13.260 220 HD3 PRO 24 HD3 PRO 24 6.237 2.914 -15.003 221 H ARG 25 H ARG 25 2.011 6.354 -15.095 222 HA ARG 25 HA ARG 25 1.032 6.377 -12.254 223 HB2 ARG 25 HB2 ARG 25 0.048 8.524 -12.644 224 HB3 ARG 25 HB3 ARG 25 1.771 8.588 -13.010 225 HG2 ARG 25 HG2 ARG 25 1.249 8.467 -15.456 226 HG3 ARG 25 HG3 ARG 25 -0.473 8.343 -15.075 227 HD2 ARG 25 HD2 ARG 25 -0.025 10.599 -15.704 228 HD3 ARG 25 HD3 ARG 25 -0.385 10.566 -13.970 229 HE ARG 25 HE ARG 25 2.459 10.370 -14.405 230 HH11 ARG 25 HH11 ARG 25 3.817 12.087 -14.020 231 HH12 ARG 25 HH12 ARG 25 3.180 13.704 -13.970 232 HH21 ARG 25 HH21 ARG 25 -0.071 12.788 -14.566 233 HH22 ARG 25 HH22 ARG 25 1.038 14.100 -14.267 234 H ALA 26 H ALA 26 0.070 5.681 -15.525 235 HA ALA 26 HA ALA 26 -2.257 4.225 -14.573 236 HB1 ALA 26 HB1 ALA 26 -2.643 6.818 -16.141 237 HB2 ALA 26 HB2 ALA 26 -3.919 5.627 -15.742 238 HB3 ALA 26 HB3 ALA 26 -3.104 6.543 -14.453 239 H SER 27 H SER 27 -1.773 2.487 -15.611 240 HA SER 27 HA SER 27 -1.572 2.428 -18.578 241 HB2 SER 27 HB2 SER 27 -0.200 0.770 -17.641 242 HB3 SER 27 HB3 SER 27 -1.385 0.333 -16.416 243 HG SER 27 HG SER 27 -1.118 -0.620 -18.939 244 H ASN 28 H ASN 28 -3.196 1.305 -19.793 245 HA ASN 28 HA ASN 28 -5.946 1.832 -18.988 246 HB2 ASN 28 HB2 ASN 28 -6.551 1.241 -21.139 247 HB3 ASN 28 HB3 ASN 28 -4.968 1.980 -21.368 248 HD21 ASN 28 HD21 ASN 28 -3.538 -1.373 -22.110 249 HD22 ASN 28 HD22 ASN 28 -3.135 -0.075 -21.011 250 H ARG 29 H ARG 29 -3.824 -0.687 -18.284 251 HA ARG 29 HA ARG 29 -6.014 -2.644 -17.639 252 HB2 ARG 29 HB2 ARG 29 -3.058 -3.149 -17.236 253 HB3 ARG 29 HB3 ARG 29 -4.343 -4.320 -17.497 254 HG2 ARG 29 HG2 ARG 29 -3.155 -2.450 -19.609 255 HG3 ARG 29 HG3 ARG 29 -2.704 -4.111 -19.350 256 HD2 ARG 29 HD2 ARG 29 -4.170 -3.736 -21.274 257 HD3 ARG 29 HD3 ARG 29 -4.757 -4.957 -20.105 258 HE ARG 29 HE ARG 29 -5.944 -2.412 -19.572 259 HH11 ARG 29 HH11 ARG 29 -7.974 -1.914 -20.046 260 HH12 ARG 29 HH12 ARG 29 -8.892 -2.864 -21.194 261 HH21 ARG 29 HH21 ARG 29 -6.272 -4.986 -21.925 262 HH22 ARG 29 HH22 ARG 29 -7.934 -4.574 -22.254 263 H GLY 30 H GLY 30 -3.362 -0.863 -16.320 264 HA2 GLY 30 HA2 GLY 30 -4.598 0.432 -14.328 265 HA3 GLY 30 HA3 GLY 30 -4.236 -1.108 -13.501 266 H TYR 31 H TYR 31 -2.018 -1.748 -13.347 267 HA TYR 31 HA TYR 31 0.102 0.274 -13.977 268 HB2 TYR 31 HB2 TYR 31 -0.372 -1.074 -11.299 269 HB3 TYR 31 HB3 TYR 31 1.159 -0.352 -11.758 270 HD1 TYR 31 HD1 TYR 31 1.459 2.023 -12.079 271 HD2 TYR 31 HD2 TYR 31 -2.284 0.336 -10.747 272 HE1 TYR 31 HE1 TYR 31 0.782 4.245 -11.171 273 HE2 TYR 31 HE2 TYR 31 -2.980 2.568 -9.860 274 HH TYR 31 HH TYR 31 -0.875 5.448 -10.088 275 H ARG 32 H ARG 32 -0.765 -3.092 -13.427 276 HA ARG 32 HA ARG 32 0.249 -5.025 -13.305 277 HB2 ARG 32 HB2 ARG 32 1.978 -4.610 -15.661 278 HB3 ARG 32 HB3 ARG 32 0.793 -5.832 -15.252 279 HG2 ARG 32 HG2 ARG 32 -0.264 -4.972 -17.034 280 HG3 ARG 32 HG3 ARG 32 -0.936 -3.890 -15.836 281 HD2 ARG 32 HD2 ARG 32 -0.333 -2.485 -17.607 282 HD3 ARG 32 HD3 ARG 32 0.933 -2.252 -16.405 283 HE ARG 32 HE ARG 32 2.458 -2.856 -17.974 284 HH11 ARG 32 HH11 ARG 32 3.289 -3.369 -19.772 285 HH12 ARG 32 HH12 ARG 32 2.433 -4.335 -20.973 286 HH21 ARG 32 HH21 ARG 32 -0.458 -4.475 -19.080 287 HH22 ARG 32 HH22 ARG 32 0.309 -4.922 -20.581 288 H ALA 33 H ALA 33 1.583 -5.616 -11.655 289 HA ALA 33 HA ALA 33 4.038 -4.455 -10.950 290 HB1 ALA 33 HB1 ALA 33 2.676 -6.048 -9.547 291 HB2 ALA 33 HB2 ALA 33 3.279 -7.382 -10.547 292 HB3 ALA 33 HB3 ALA 33 4.402 -6.414 -9.582 293 H SER 34 H SER 34 3.422 -6.733 -13.501 294 HA SER 34 HA SER 34 6.171 -7.554 -13.936 295 HB2 SER 34 HB2 SER 34 3.984 -8.821 -14.413 296 HB3 SER 34 HB3 SER 34 3.832 -7.804 -15.853 297 HG SER 34 HG SER 34 5.923 -8.583 -16.499 298 H ASP 35 H ASP 35 4.494 -4.638 -14.787 299 HA ASP 35 HA ASP 35 5.971 -4.093 -17.255 300 HB2 ASP 35 HB2 ASP 35 3.648 -3.227 -16.467 301 HB3 ASP 35 HB3 ASP 35 4.547 -2.070 -15.500 302 H TRP 36 H TRP 36 6.197 -3.243 -13.851 303 HA TRP 36 HA TRP 36 8.862 -1.946 -14.152 304 HB2 TRP 36 HB2 TRP 36 8.169 -1.392 -11.602 305 HB3 TRP 36 HB3 TRP 36 7.795 -0.396 -12.982 306 HD1 TRP 36 HD1 TRP 36 5.285 -0.325 -13.858 307 HE1 TRP 36 HE1 TRP 36 3.058 -0.884 -12.793 308 HE3 TRP 36 HE3 TRP 36 6.968 -2.816 -9.697 309 HZ2 TRP 36 HZ2 TRP 36 2.123 -1.822 -10.216 310 HZ3 TRP 36 HZ3 TRP 36 5.368 -3.473 -7.918 311 HH2 TRP 36 HH2 TRP 36 2.948 -2.973 -8.151 312 H LYS 37 H LYS 37 9.856 -2.421 -11.590 313 HA LYS 37 HA LYS 37 10.802 -5.189 -11.742 314 HB2 LYS 37 HB2 LYS 37 11.166 -2.886 -9.776 315 HB3 LYS 37 HB3 LYS 37 11.715 -4.520 -9.389 316 HG2 LYS 37 HG2 LYS 37 13.167 -4.618 -11.295 317 HG3 LYS 37 HG3 LYS 37 12.556 -3.088 -11.942 318 HD2 LYS 37 HD2 LYS 37 13.591 -1.798 -10.253 319 HD3 LYS 37 HD3 LYS 37 13.857 -3.199 -9.200 320 HE2 LYS 37 HE2 LYS 37 15.480 -4.152 -10.729 321 HE3 LYS 37 HE3 LYS 37 15.190 -2.864 -11.912 322 HZ1 LYS 37 HZ1 LYS 37 17.179 -2.422 -10.584 323 HZ2 LYS 37 HZ2 LYS 37 16.065 -1.268 -10.293 324 HZ3 LYS 37 HZ3 LYS 37 16.326 -2.449 -9.193 325 H LEU 38 H LEU 38 9.914 -6.764 -11.339 326 HA LEU 38 HA LEU 38 7.444 -7.034 -9.803 327 HB2 LEU 38 HB2 LEU 38 7.722 -7.731 -12.160 328 HB3 LEU 38 HB3 LEU 38 9.115 -8.719 -11.730 329 HG LEU 38 HG LEU 38 7.685 -10.123 -10.352 330 HD11 LEU 38 HD11 LEU 38 5.371 -8.679 -11.738 331 HD12 LEU 38 HD12 LEU 38 5.222 -10.103 -10.693 332 HD13 LEU 38 HD13 LEU 38 5.749 -8.565 -10.006 333 HD21 LEU 38 HD21 LEU 38 8.306 -10.738 -12.652 334 HD22 LEU 38 HD22 LEU 38 6.702 -11.368 -12.238 335 HD23 LEU 38 HD23 LEU 38 6.852 -9.931 -13.275 336 H ASP 39 H ASP 39 10.801 -8.187 -9.592 337 HA ASP 39 HA ASP 39 10.241 -9.327 -6.900 338 HB2 ASP 39 HB2 ASP 39 10.180 -11.040 -8.817 339 HB3 ASP 39 HB3 ASP 39 11.915 -10.778 -8.969 340 H GLN 40 H GLN 40 11.853 -6.962 -8.252 341 HA GLN 40 HA GLN 40 14.326 -7.216 -6.571 342 HB2 GLN 40 HB2 GLN 40 13.934 -5.820 -9.227 343 HB3 GLN 40 HB3 GLN 40 15.333 -5.595 -8.166 344 HG2 GLN 40 HG2 GLN 40 15.836 -8.028 -8.314 345 HG3 GLN 40 HG3 GLN 40 14.476 -8.238 -9.424 346 HE21 GLN 40 HE21 GLN 40 16.213 -6.797 -12.218 347 HE22 GLN 40 HE22 GLN 40 14.627 -7.227 -11.598 348 HA PRO 41 HA PRO 41 11.750 -3.787 -4.869 349 HB2 PRO 41 HB2 PRO 41 12.216 -4.127 -2.210 350 HB3 PRO 41 HB3 PRO 41 11.073 -5.133 -3.147 351 HG2 PRO 41 HG2 PRO 41 13.953 -5.765 -2.423 352 HG3 PRO 41 HG3 PRO 41 12.512 -6.813 -2.221 353 HD2 PRO 41 HD2 PRO 41 14.189 -7.023 -4.371 354 HD3 PRO 41 HD3 PRO 41 12.427 -7.296 -4.524 355 H ASP 42 H ASP 42 12.228 -1.837 -3.778 356 HA ASP 42 HA ASP 42 15.099 -0.991 -3.848 357 HB2 ASP 42 HB2 ASP 42 13.479 0.208 -5.310 358 HB3 ASP 42 HB3 ASP 42 12.531 0.642 -3.887 359 H TRP 43 H TRP 43 12.359 -1.468 -1.742 360 HA TRP 43 HA TRP 43 14.028 -0.998 0.640 361 HB2 TRP 43 HB2 TRP 43 12.936 1.165 0.290 362 HB3 TRP 43 HB3 TRP 43 11.378 0.392 0.077 363 HD1 TRP 43 HD1 TRP 43 13.728 1.675 2.710 364 HE1 TRP 43 HE1 TRP 43 12.576 1.671 5.003 365 HE3 TRP 43 HE3 TRP 43 9.574 -1.093 1.545 366 HZ2 TRP 43 HZ2 TRP 43 10.085 0.759 6.128 367 HZ3 TRP 43 HZ3 TRP 43 7.815 -1.507 3.248 368 HH2 TRP 43 HH2 TRP 43 8.042 -0.550 5.531 369 H THR 44 H THR 44 13.366 -2.322 2.423 370 HA THR 44 HA THR 44 10.702 -3.511 2.310 371 HB THR 44 HB THR 44 11.226 -5.663 2.739 372 HG1 THR 44 HG1 THR 44 13.959 -5.080 3.149 373 HG21 THR 44 HG21 THR 44 11.825 -5.229 0.396 374 HG22 THR 44 HG22 THR 44 13.526 -5.037 0.867 375 HG23 THR 44 HG23 THR 44 12.695 -6.597 1.100 376 H GLY 45 H GLY 45 9.832 -4.091 4.249 377 HA2 GLY 45 HA2 GLY 45 11.046 -3.522 6.812 378 HA3 GLY 45 HA3 GLY 45 10.130 -2.148 6.221 379 H ARG 46 H ARG 46 8.377 -2.131 7.345 380 HA ARG 46 HA ARG 46 6.696 -4.578 7.819 381 HB2 ARG 46 HB2 ARG 46 8.120 -3.935 9.739 382 HB3 ARG 46 HB3 ARG 46 7.470 -2.304 9.687 383 HG2 ARG 46 HG2 ARG 46 5.153 -3.490 10.126 384 HG3 ARG 46 HG3 ARG 46 6.150 -4.867 10.622 385 HD2 ARG 46 HD2 ARG 46 6.286 -2.026 11.686 386 HD3 ARG 46 HD3 ARG 46 5.498 -3.375 12.513 387 HE ARG 46 HE ARG 46 8.058 -4.294 12.241 388 HH11 ARG 46 HH11 ARG 46 9.710 -4.032 13.722 389 HH12 ARG 46 HH12 ARG 46 9.615 -2.752 14.897 390 HH21 ARG 46 HH21 ARG 46 6.869 -1.213 13.513 391 HH22 ARG 46 HH22 ARG 46 8.055 -1.221 14.792 392 H LEU 47 H LEU 47 4.469 -4.258 7.786 393 HA LEU 47 HA LEU 47 3.470 -1.739 6.520 394 HB2 LEU 47 HB2 LEU 47 2.858 -3.986 5.562 395 HB3 LEU 47 HB3 LEU 47 2.166 -4.389 7.131 396 HG LEU 47 HG LEU 47 0.567 -2.370 6.783 397 HD11 LEU 47 HD11 LEU 47 1.786 -1.333 4.910 398 HD12 LEU 47 HD12 LEU 47 1.467 -2.771 3.912 399 HD13 LEU 47 HD13 LEU 47 0.125 -1.753 4.492 400 HD21 LEU 47 HD21 LEU 47 -0.128 -4.706 6.740 401 HD22 LEU 47 HD22 LEU 47 -0.965 -3.793 5.491 402 HD23 LEU 47 HD23 LEU 47 0.390 -4.857 5.052 403 H ARG 48 H ARG 48 2.124 -0.309 7.605 404 HA ARG 48 HA ARG 48 0.654 -1.275 10.006 405 HB2 ARG 48 HB2 ARG 48 2.797 0.005 10.647 406 HB3 ARG 48 HB3 ARG 48 2.069 1.422 9.929 407 HG2 ARG 48 HG2 ARG 48 1.515 1.677 12.165 408 HG3 ARG 48 HG3 ARG 48 0.042 0.920 11.554 409 HD2 ARG 48 HD2 ARG 48 0.795 -1.273 12.350 410 HD3 ARG 48 HD3 ARG 48 2.367 -0.621 12.813 411 HE ARG 48 HE ARG 48 -0.116 -0.457 14.312 412 HH11 ARG 48 HH11 ARG 48 -0.084 0.392 16.363 413 HH12 ARG 48 HH12 ARG 48 1.253 1.374 16.876 414 HH21 ARG 48 HH21 ARG 48 3.006 1.189 13.926 415 HH22 ARG 48 HH22 ARG 48 2.940 1.786 15.562 416 H ILE 49 H ILE 49 -1.384 -1.197 9.272 417 HA ILE 49 HA ILE 49 -2.297 1.154 7.656 418 HB ILE 49 HB ILE 49 -3.734 -1.465 8.100 419 HG12 ILE 49 HG12 ILE 49 -2.112 -0.404 5.738 420 HG13 ILE 49 HG13 ILE 49 -1.783 -1.847 6.698 421 HG21 ILE 49 HG21 ILE 49 -4.389 0.771 6.155 422 HG22 ILE 49 HG22 ILE 49 -5.332 -0.705 6.483 423 HG23 ILE 49 HG23 ILE 49 -5.219 0.531 7.714 424 HD11 ILE 49 HD11 ILE 49 -4.073 -1.449 4.737 425 HD12 ILE 49 HD12 ILE 49 -2.692 -2.542 4.601 426 HD13 ILE 49 HD13 ILE 49 -3.922 -2.854 5.837 427 H THR 50 H THR 50 -3.510 2.645 8.558 428 HA THR 50 HA THR 50 -4.939 2.126 11.129 429 HB THR 50 HB THR 50 -4.329 4.355 11.907 430 HG1 THR 50 HG1 THR 50 -2.920 5.629 10.641 431 HG21 THR 50 HG21 THR 50 -1.760 2.967 11.025 432 HG22 THR 50 HG22 THR 50 -1.960 4.126 12.354 433 HG23 THR 50 HG23 THR 50 -2.705 2.524 12.463 434 H SER 51 H SER 51 -6.561 4.023 11.521 435 HA SER 51 HA SER 51 -7.364 5.483 9.162 436 HB2 SER 51 HB2 SER 51 -9.707 4.803 9.146 437 HB3 SER 51 HB3 SER 51 -8.636 3.455 8.762 438 HG SER 51 HG SER 51 -8.823 2.948 11.109 439 H LYS 52 H LYS 52 -7.930 7.429 9.671 440 HA LYS 52 HA LYS 52 -8.968 8.153 12.373 441 HB2 LYS 52 HB2 LYS 52 -7.053 9.387 11.418 442 HB3 LYS 52 HB3 LYS 52 -8.088 9.901 10.068 443 HG2 LYS 52 HG2 LYS 52 -9.665 10.796 11.999 444 HG3 LYS 52 HG3 LYS 52 -8.212 10.670 12.990 445 HD2 LYS 52 HD2 LYS 52 -8.557 12.206 10.399 446 HD3 LYS 52 HD3 LYS 52 -8.459 12.909 12.041 447 HE2 LYS 52 HE2 LYS 52 -6.158 12.335 12.237 448 HE3 LYS 52 HE3 LYS 52 -6.189 11.340 10.779 449 HZ1 LYS 52 HZ1 LYS 52 -6.381 13.251 9.432 450 HZ2 LYS 52 HZ2 LYS 52 -6.798 14.235 10.676 451 HZ3 LYS 52 HZ3 LYS 52 -5.270 13.711 10.561 452 H GLY 53 H GLY 53 -10.761 6.848 11.863 453 HA2 GLY 53 HA2 GLY 53 -13.102 6.759 11.662 454 HA3 GLY 53 HA3 GLY 53 -13.091 8.376 10.957 455 H LYS 54 H LYS 54 -13.944 8.319 8.963 456 HA LYS 54 HA LYS 54 -13.988 5.994 7.215 457 HB2 LYS 54 HB2 LYS 54 -15.747 7.780 7.426 458 HB3 LYS 54 HB3 LYS 54 -14.665 8.920 6.644 459 HG2 LYS 54 HG2 LYS 54 -15.361 6.347 5.210 460 HG3 LYS 54 HG3 LYS 54 -16.610 7.580 5.401 461 HD2 LYS 54 HD2 LYS 54 -15.028 9.250 4.322 462 HD3 LYS 54 HD3 LYS 54 -13.991 7.870 3.915 463 HE2 LYS 54 HE2 LYS 54 -16.009 6.792 2.807 464 HE3 LYS 54 HE3 LYS 54 -16.890 8.294 3.097 465 HZ1 LYS 54 HZ1 LYS 54 -15.984 8.448 0.910 466 HZ2 LYS 54 HZ2 LYS 54 -15.017 9.423 1.801 467 HZ3 LYS 54 HZ3 LYS 54 -14.492 7.940 1.372 468 H THR 55 H THR 55 -11.489 8.121 7.774 469 HA THR 55 HA THR 55 -10.339 7.563 5.108 470 HB THR 55 HB THR 55 -9.139 9.294 7.282 471 HG1 THR 55 HG1 THR 55 -10.225 11.022 6.311 472 HG21 THR 55 HG21 THR 55 -8.210 10.406 5.204 473 HG22 THR 55 HG22 THR 55 -7.789 8.679 5.260 474 HG23 THR 55 HG23 THR 55 -9.122 9.221 4.220 475 H ALA 56 H ALA 56 -9.003 5.870 4.847 476 HA ALA 56 HA ALA 56 -7.532 4.723 7.152 477 HB1 ALA 56 HB1 ALA 56 -8.595 3.039 5.840 478 HB2 ALA 56 HB2 ALA 56 -7.950 3.700 4.328 479 HB3 ALA 56 HB3 ALA 56 -6.867 2.940 5.514 480 H TYR 57 H TYR 57 -5.241 4.354 6.991 481 HA TYR 57 HA TYR 57 -3.748 6.013 5.024 482 HB2 TYR 57 HB2 TYR 57 -3.209 5.948 8.007 483 HB3 TYR 57 HB3 TYR 57 -2.170 6.670 6.805 484 HD1 TYR 57 HD1 TYR 57 -5.634 6.920 8.289 485 HD2 TYR 57 HD2 TYR 57 -2.404 8.954 6.281 486 HE1 TYR 57 HE1 TYR 57 -6.901 9.029 8.412 487 HE2 TYR 57 HE2 TYR 57 -3.648 11.104 6.487 488 HH TYR 57 HH TYR 57 -5.581 12.125 7.158 489 H ILE 58 H ILE 58 -2.424 4.713 3.956 490 HA ILE 58 HA ILE 58 -1.523 2.119 5.121 491 HB ILE 58 HB ILE 58 -0.749 3.275 2.424 492 HG12 ILE 58 HG12 ILE 58 -3.154 3.163 2.343 493 HG13 ILE 58 HG13 ILE 58 -2.405 1.973 1.300 494 HG21 ILE 58 HG21 ILE 58 -0.658 0.510 3.667 495 HG22 ILE 58 HG22 ILE 58 -0.329 0.856 1.953 496 HG23 ILE 58 HG23 ILE 58 0.714 1.535 3.205 497 HD11 ILE 58 HD11 ILE 58 -2.906 0.182 2.915 498 HD12 ILE 58 HD12 ILE 58 -3.627 1.378 4.023 499 HD13 ILE 58 HD13 ILE 58 -4.360 1.077 2.433 500 H LYS 59 H LYS 59 -0.003 2.571 6.685 501 HA LYS 59 HA LYS 59 2.232 4.438 6.007 502 HB2 LYS 59 HB2 LYS 59 1.748 3.259 8.728 503 HB3 LYS 59 HB3 LYS 59 2.645 4.705 8.303 504 HG2 LYS 59 HG2 LYS 59 0.528 5.901 7.807 505 HG3 LYS 59 HG3 LYS 59 -0.390 4.418 8.077 506 HD2 LYS 59 HD2 LYS 59 -0.717 5.286 10.102 507 HD3 LYS 59 HD3 LYS 59 0.750 4.410 10.446 508 HE2 LYS 59 HE2 LYS 59 0.957 6.522 11.466 509 HE3 LYS 59 HE3 LYS 59 2.035 6.591 10.047 510 HZ1 LYS 59 HZ1 LYS 59 0.391 7.953 8.940 511 HZ2 LYS 59 HZ2 LYS 59 -0.741 7.623 10.123 512 HZ3 LYS 59 HZ3 LYS 59 0.542 8.559 10.446 513 H LEU 60 H LEU 60 4.343 3.766 6.109 514 HA LEU 60 HA LEU 60 4.837 0.814 6.320 515 HB2 LEU 60 HB2 LEU 60 5.926 2.862 4.358 516 HB3 LEU 60 HB3 LEU 60 6.582 1.238 4.549 517 HG LEU 60 HG LEU 60 3.659 1.718 3.817 518 HD11 LEU 60 HD11 LEU 60 6.063 1.345 2.011 519 HD12 LEU 60 HD12 LEU 60 4.369 1.203 1.482 520 HD13 LEU 60 HD13 LEU 60 4.982 2.749 2.085 521 HD21 LEU 60 HD21 LEU 60 4.218 -0.545 4.689 522 HD22 LEU 60 HD22 LEU 60 3.789 -0.590 2.976 523 HD23 LEU 60 HD23 LEU 60 5.493 -0.695 3.464 524 H GLU 61 H GLU 61 6.336 0.211 7.675 525 HA GLU 61 HA GLU 61 7.837 2.291 9.201 526 HB2 GLU 61 HB2 GLU 61 6.498 -0.305 10.026 527 HB3 GLU 61 HB3 GLU 61 7.695 0.520 11.024 528 HG2 GLU 61 HG2 GLU 61 6.237 2.552 11.038 529 HG3 GLU 61 HG3 GLU 61 5.023 1.654 10.123 530 H ASP 62 H ASP 62 9.968 1.804 9.979 531 HA ASP 62 HA ASP 62 11.605 -0.066 8.534 532 HB2 ASP 62 HB2 ASP 62 12.525 1.964 9.519 533 HB3 ASP 62 HB3 ASP 62 11.952 1.496 11.124 534 H LYS 63 H LYS 63 12.095 -2.122 9.022 535 HA LYS 63 HA LYS 63 10.214 -3.713 10.373 536 HB2 LYS 63 HB2 LYS 63 12.260 -4.095 8.554 537 HB3 LYS 63 HB3 LYS 63 12.945 -4.880 9.965 538 HG2 LYS 63 HG2 LYS 63 10.969 -6.342 10.148 539 HG3 LYS 63 HG3 LYS 63 10.175 -5.490 8.822 540 HD2 LYS 63 HD2 LYS 63 12.754 -7.105 8.587 541 HD3 LYS 63 HD3 LYS 63 11.139 -7.654 8.113 542 HE2 LYS 63 HE2 LYS 63 10.988 -5.792 6.470 543 HE3 LYS 63 HE3 LYS 63 12.634 -5.289 6.894 544 HZ1 LYS 63 HZ1 LYS 63 11.830 -7.846 5.637 545 HZ2 LYS 63 HZ2 LYS 63 12.699 -6.640 4.935 546 HZ3 LYS 63 HZ3 LYS 63 13.367 -7.529 6.138 547 H VAL 64 H VAL 64 12.801 -2.021 11.795 548 HA VAL 64 HA VAL 64 12.972 -3.811 14.185 549 HB VAL 64 HB VAL 64 14.992 -1.669 13.490 550 HG11 VAL 64 HG11 VAL 64 15.091 -2.780 15.683 551 HG12 VAL 64 HG12 VAL 64 15.217 -4.363 14.879 552 HG13 VAL 64 HG13 VAL 64 16.508 -3.154 14.694 553 HG21 VAL 64 HG21 VAL 64 14.922 -2.876 11.410 554 HG22 VAL 64 HG22 VAL 64 16.371 -3.352 12.296 555 HG23 VAL 64 HG23 VAL 64 14.964 -4.446 12.260 556 H SER 65 H SER 65 12.844 -0.407 13.123 557 HA SER 65 HA SER 65 12.641 0.403 15.958 558 HB2 SER 65 HB2 SER 65 14.484 1.121 14.359 559 HB3 SER 65 HB3 SER 65 13.278 2.133 13.549 560 HG SER 65 HG SER 65 14.508 3.228 15.203 561 H GLY 66 H GLY 66 10.524 0.172 13.264 562 HA2 GLY 66 HA2 GLY 66 8.337 0.853 13.010 563 HA3 GLY 66 HA3 GLY 66 8.374 1.625 14.593 564 H GLU 67 H GLU 67 10.897 2.625 12.441 565 HA GLU 67 HA GLU 67 9.918 5.360 12.461 566 HB2 GLU 67 HB2 GLU 67 12.338 4.009 11.227 567 HB3 GLU 67 HB3 GLU 67 12.003 5.721 10.975 568 HG2 GLU 67 HG2 GLU 67 12.106 4.567 13.771 569 HG3 GLU 67 HG3 GLU 67 13.580 5.005 12.910 570 H LEU 68 H LEU 68 9.182 6.639 10.853 571 HA LEU 68 HA LEU 68 7.566 5.231 8.920 572 HB2 LEU 68 HB2 LEU 68 6.872 7.204 10.280 573 HB3 LEU 68 HB3 LEU 68 7.899 8.232 9.296 574 HG LEU 68 HG LEU 68 5.405 8.246 8.848 575 HD11 LEU 68 HD11 LEU 68 5.560 8.456 6.451 576 HD12 LEU 68 HD12 LEU 68 6.982 9.173 7.223 577 HD13 LEU 68 HD13 LEU 68 7.107 7.595 6.430 578 HD21 LEU 68 HD21 LEU 68 4.357 6.555 7.554 579 HD22 LEU 68 HD22 LEU 68 5.857 5.638 7.387 580 HD23 LEU 68 HD23 LEU 68 5.066 5.773 8.976 581 H PHE 69 H PHE 69 8.125 4.572 7.010 582 HA PHE 69 HA PHE 69 10.325 5.785 5.414 583 HB2 PHE 69 HB2 PHE 69 10.399 3.434 5.496 584 HB3 PHE 69 HB3 PHE 69 8.665 3.269 5.263 585 HD1 PHE 69 HD1 PHE 69 11.437 5.013 3.350 586 HD2 PHE 69 HD2 PHE 69 8.120 2.264 3.259 587 HE1 PHE 69 HE1 PHE 69 11.713 4.756 0.914 588 HE2 PHE 69 HE2 PHE 69 8.433 1.959 0.835 589 HZ PHE 69 HZ PHE 69 10.188 3.231 -0.380 590 H ALA 70 H ALA 70 6.842 5.023 4.987 591 HA ALA 70 HA ALA 70 6.397 7.545 3.581 592 HB1 ALA 70 HB1 ALA 70 7.144 6.105 1.711 593 HB2 ALA 70 HB2 ALA 70 5.947 4.872 2.168 594 HB3 ALA 70 HB3 ALA 70 5.409 6.455 1.584 595 H GLN 71 H GLN 71 4.103 7.967 3.225 596 HA GLN 71 HA GLN 71 2.239 5.980 4.225 597 HB2 GLN 71 HB2 GLN 71 0.936 7.518 5.611 598 HB3 GLN 71 HB3 GLN 71 2.532 7.153 6.256 599 HG2 GLN 71 HG2 GLN 71 3.376 9.349 5.422 600 HG3 GLN 71 HG3 GLN 71 1.761 9.734 4.815 601 HE21 GLN 71 HE21 GLN 71 2.180 11.278 8.212 602 HE22 GLN 71 HE22 GLN 71 3.055 11.413 6.694 603 H ALA 72 H ALA 72 0.283 5.949 3.237 604 HA ALA 72 HA ALA 72 -0.308 8.041 1.183 605 HB1 ALA 72 HB1 ALA 72 -0.821 5.052 1.096 606 HB2 ALA 72 HB2 ALA 72 -1.426 6.220 -0.083 607 HB3 ALA 72 HB3 ALA 72 0.317 5.983 0.094 608 HA PRO 73 HA PRO 73 -4.191 8.079 3.684 609 HB2 PRO 73 HB2 PRO 73 -5.258 10.417 2.795 610 HB3 PRO 73 HB3 PRO 73 -3.892 10.355 3.950 611 HG2 PRO 73 HG2 PRO 73 -3.770 10.777 0.950 612 HG3 PRO 73 HG3 PRO 73 -2.937 11.703 2.234 613 HD2 PRO 73 HD2 PRO 73 -1.725 9.676 0.836 614 HD3 PRO 73 HD3 PRO 73 -1.335 10.017 2.547 615 H VAL 74 H VAL 74 -6.013 7.041 3.176 616 HA VAL 74 HA VAL 74 -6.962 6.775 0.348 617 HB VAL 74 HB VAL 74 -6.988 4.669 2.543 618 HG11 VAL 74 HG11 VAL 74 -7.816 4.464 -0.362 619 HG12 VAL 74 HG12 VAL 74 -7.738 3.120 0.801 620 HG13 VAL 74 HG13 VAL 74 -8.899 4.410 1.047 621 HG21 VAL 74 HG21 VAL 74 -5.392 3.378 1.462 622 HG22 VAL 74 HG22 VAL 74 -5.314 4.432 0.061 623 HG23 VAL 74 HG23 VAL 74 -4.680 4.986 1.628 624 H GLU 75 H GLU 75 -9.051 7.463 0.075 625 HA GLU 75 HA GLU 75 -10.898 7.432 2.437 626 HB2 GLU 75 HB2 GLU 75 -9.978 9.720 1.327 627 HB3 GLU 75 HB3 GLU 75 -11.328 9.404 0.233 628 HG2 GLU 75 HG2 GLU 75 -12.588 8.975 2.588 629 HG3 GLU 75 HG3 GLU 75 -11.307 10.005 3.195 630 H GLN 76 H GLN 76 -10.354 5.724 -0.227 631 HA GLN 76 HA GLN 76 -12.984 4.649 -0.325 632 HB2 GLN 76 HB2 GLN 76 -13.512 4.964 -2.621 633 HB3 GLN 76 HB3 GLN 76 -13.227 6.558 -1.947 634 HG2 GLN 76 HG2 GLN 76 -11.338 4.986 -3.750 635 HG3 GLN 76 HG3 GLN 76 -12.346 6.333 -4.221 636 HE21 GLN 76 HE21 GLN 76 -8.738 7.084 -2.488 637 HE22 GLN 76 HE22 GLN 76 -9.400 5.435 -2.449 638 H TYR 77 H TYR 77 -12.926 2.518 -1.122 639 HA TYR 77 HA TYR 77 -10.310 1.516 -2.093 640 HB2 TYR 77 HB2 TYR 77 -10.494 1.063 0.279 641 HB3 TYR 77 HB3 TYR 77 -11.985 0.120 0.010 642 HD1 TYR 77 HD1 TYR 77 -8.498 0.530 -0.922 643 HD2 TYR 77 HD2 TYR 77 -11.670 -2.309 -0.538 644 HE1 TYR 77 HE1 TYR 77 -6.934 -1.244 -1.667 645 HE2 TYR 77 HE2 TYR 77 -10.136 -4.121 -1.219 646 HH TYR 77 HH TYR 77 -6.717 -3.484 -2.153 647 HA PRO 78 HA PRO 78 -9.344 0.430 -3.607 648 HB2 PRO 78 HB2 PRO 78 -9.137 0.058 -6.276 649 HB3 PRO 78 HB3 PRO 78 -9.266 -1.309 -5.127 650 HG2 PRO 78 HG2 PRO 78 -11.502 -0.018 -6.733 651 HG3 PRO 78 HG3 PRO 78 -11.096 -1.761 -6.613 652 HD2 PRO 78 HD2 PRO 78 -13.028 -0.628 -5.062 653 HD3 PRO 78 HD3 PRO 78 -11.957 -1.907 -4.419 654 H GLY 79 H GLY 79 -8.185 2.122 -4.890 655 HA2 GLY 79 HA2 GLY 79 -9.688 4.156 -6.358 656 HA3 GLY 79 HA3 GLY 79 -9.177 4.693 -4.759 657 H ILE 80 H ILE 80 -7.858 6.325 -5.787 658 HA ILE 80 HA ILE 80 -5.547 5.474 -7.388 659 HB ILE 80 HB ILE 80 -6.712 7.624 -7.771 660 HG12 ILE 80 HG12 ILE 80 -4.787 9.089 -8.032 661 HG13 ILE 80 HG13 ILE 80 -3.828 8.118 -6.921 662 HG21 ILE 80 HG21 ILE 80 -7.213 8.269 -5.407 663 HG22 ILE 80 HG22 ILE 80 -5.476 8.579 -5.148 664 HG23 ILE 80 HG23 ILE 80 -6.392 9.550 -6.305 665 HD11 ILE 80 HD11 ILE 80 -3.766 6.269 -8.511 666 HD12 ILE 80 HD12 ILE 80 -4.930 7.101 -9.578 667 HD13 ILE 80 HD13 ILE 80 -3.299 7.760 -9.340 668 H ALA 81 H ALA 81 -6.298 6.099 -4.015 669 HA ALA 81 HA ALA 81 -3.560 6.365 -3.201 670 HB1 ALA 81 HB1 ALA 81 -6.021 5.791 -1.563 671 HB2 ALA 81 HB2 ALA 81 -4.390 6.245 -0.968 672 HB3 ALA 81 HB3 ALA 81 -5.359 7.395 -1.945 673 H VAL 82 H VAL 82 -5.803 3.555 -3.364 674 HA VAL 82 HA VAL 82 -3.439 1.772 -3.169 675 HB VAL 82 HB VAL 82 -4.330 1.939 -0.927 676 HG11 VAL 82 HG11 VAL 82 -6.962 1.168 -2.071 677 HG12 VAL 82 HG12 VAL 82 -6.529 1.279 -0.332 678 HG13 VAL 82 HG13 VAL 82 -6.544 2.716 -1.340 679 HG21 VAL 82 HG21 VAL 82 -3.415 -0.180 -1.705 680 HG22 VAL 82 HG22 VAL 82 -4.742 -0.441 -0.568 681 HG23 VAL 82 HG23 VAL 82 -4.986 -0.682 -2.317 682 H GLU 83 H GLU 83 -3.470 0.413 -4.841 683 HA GLU 83 HA GLU 83 -6.005 -0.484 -6.133 684 HB2 GLU 83 HB2 GLU 83 -4.286 1.544 -7.148 685 HB3 GLU 83 HB3 GLU 83 -3.855 0.104 -8.057 686 HG2 GLU 83 HG2 GLU 83 -6.707 1.126 -7.723 687 HG3 GLU 83 HG3 GLU 83 -5.643 1.583 -9.053 688 H THR 84 H THR 84 -5.776 -2.377 -7.503 689 HA THR 84 HA THR 84 -3.448 -4.137 -6.744 690 HB THR 84 HB THR 84 -5.982 -5.188 -7.861 691 HG1 THR 84 HG1 THR 84 -6.243 -3.874 -5.807 692 HG21 THR 84 HG21 THR 84 -4.004 -6.629 -7.696 693 HG22 THR 84 HG22 THR 84 -3.942 -6.335 -5.942 694 HG23 THR 84 HG23 THR 84 -5.320 -7.202 -6.667 695 H VAL 85 H VAL 85 -2.312 -3.116 -8.249 696 HA VAL 85 HA VAL 85 -1.282 -2.917 -10.390 697 HB VAL 85 HB VAL 85 -0.315 -5.272 -10.700 698 HG11 VAL 85 HG11 VAL 85 1.056 -4.934 -8.652 699 HG12 VAL 85 HG12 VAL 85 0.765 -3.418 -9.503 700 HG13 VAL 85 HG13 VAL 85 -0.142 -3.802 -8.026 701 HG21 VAL 85 HG21 VAL 85 -2.219 -6.499 -9.451 702 HG22 VAL 85 HG22 VAL 85 -0.568 -6.878 -8.984 703 HG23 VAL 85 HG23 VAL 85 -1.550 -5.803 -7.976 704 H THR 86 H THR 86 -2.952 -5.979 -10.890 705 HA THR 86 HA THR 86 -4.602 -4.775 -12.912 706 HB THR 86 HB THR 86 -4.511 -6.701 -14.481 707 HG1 THR 86 HG1 THR 86 -2.749 -8.016 -14.495 708 HG21 THR 86 HG21 THR 86 -1.797 -5.383 -14.210 709 HG22 THR 86 HG22 THR 86 -2.580 -5.919 -15.718 710 HG23 THR 86 HG23 THR 86 -3.217 -4.501 -14.837 711 H ASP 87 H ASP 87 -3.701 -7.824 -11.311 712 HA ASP 87 HA ASP 87 -6.462 -8.111 -10.254 713 HB2 ASP 87 HB2 ASP 87 -6.372 -9.071 -12.638 714 HB3 ASP 87 HB3 ASP 87 -5.346 -10.333 -11.978 715 H SER 88 H SER 88 -3.396 -10.041 -10.588 716 HA SER 88 HA SER 88 -3.760 -11.552 -8.240 717 HB2 SER 88 HB2 SER 88 -1.875 -12.229 -9.519 718 HB3 SER 88 HB3 SER 88 -1.058 -10.674 -9.268 719 HG SER 88 HG SER 88 -0.335 -12.372 -7.891 720 H SER 89 H SER 89 -3.631 -11.274 -6.233 721 HA SER 89 HA SER 89 -3.032 -8.588 -5.108 722 HB2 SER 89 HB2 SER 89 -5.315 -9.327 -5.238 723 HB3 SER 89 HB3 SER 89 -4.951 -10.764 -4.263 724 HG SER 89 HG SER 89 -4.254 -9.290 -2.590 725 H ARG 90 H ARG 90 -1.003 -10.635 -5.605 726 HA ARG 90 HA ARG 90 0.224 -10.788 -2.888 727 HB2 ARG 90 HB2 ARG 90 0.951 -12.417 -4.614 728 HB3 ARG 90 HB3 ARG 90 1.430 -11.087 -5.682 729 HG2 ARG 90 HG2 ARG 90 3.099 -10.341 -3.973 730 HG3 ARG 90 HG3 ARG 90 2.615 -11.689 -2.933 731 HD2 ARG 90 HD2 ARG 90 3.480 -13.262 -4.648 732 HD3 ARG 90 HD3 ARG 90 3.885 -11.881 -5.695 733 HE ARG 90 HE ARG 90 4.993 -11.815 -2.954 734 HH11 ARG 90 HH11 ARG 90 7.062 -11.617 -2.625 735 HH12 ARG 90 HH12 ARG 90 8.230 -11.887 -3.906 736 HH21 ARG 90 HH21 ARG 90 5.849 -12.423 -6.315 737 HH22 ARG 90 HH22 ARG 90 7.553 -12.355 -5.938 738 H TYR 91 H TYR 91 -0.131 -8.618 -5.607 739 HA TYR 91 HA TYR 91 1.741 -6.646 -4.396 740 HB2 TYR 91 HB2 TYR 91 0.851 -6.856 -7.282 741 HB3 TYR 91 HB3 TYR 91 2.102 -5.806 -6.650 742 HD1 TYR 91 HD1 TYR 91 4.313 -6.759 -5.946 743 HD2 TYR 91 HD2 TYR 91 1.291 -9.078 -7.979 744 HE1 TYR 91 HE1 TYR 91 6.021 -8.452 -6.566 745 HE2 TYR 91 HE2 TYR 91 3.003 -10.736 -8.661 746 HH TYR 91 HH TYR 91 6.463 -10.333 -7.709 747 H PHE 92 H PHE 92 1.320 -4.456 -4.699 748 HA PHE 92 HA PHE 92 -1.373 -3.572 -5.514 749 HB2 PHE 92 HB2 PHE 92 -0.168 -2.844 -2.815 750 HB3 PHE 92 HB3 PHE 92 -1.604 -2.113 -3.518 751 HD1 PHE 92 HD1 PHE 92 -3.643 -3.566 -4.027 752 HD2 PHE 92 HD2 PHE 92 -0.328 -4.908 -1.618 753 HE1 PHE 92 HE1 PHE 92 -5.030 -5.422 -3.155 754 HE2 PHE 92 HE2 PHE 92 -1.735 -6.724 -0.709 755 HZ PHE 92 HZ PHE 92 -4.063 -7.038 -1.524 756 H VAL 93 H VAL 93 -1.419 -1.155 -5.595 757 HA VAL 93 HA VAL 93 1.230 0.182 -5.635 758 HB VAL 93 HB VAL 93 -1.000 0.642 -7.657 759 HG11 VAL 93 HG11 VAL 93 0.488 2.446 -8.546 760 HG12 VAL 93 HG12 VAL 93 -0.218 2.840 -6.985 761 HG13 VAL 93 HG13 VAL 93 1.483 2.318 -7.087 762 HG21 VAL 93 HG21 VAL 93 0.515 -1.168 -8.276 763 HG22 VAL 93 HG22 VAL 93 0.878 0.248 -9.269 764 HG23 VAL 93 HG23 VAL 93 1.933 -0.159 -7.916 765 H ILE 94 H ILE 94 1.252 2.025 -4.411 766 HA ILE 94 HA ILE 94 -1.353 3.160 -3.624 767 HB ILE 94 HB ILE 94 -0.743 3.543 -1.326 768 HG12 ILE 94 HG12 ILE 94 1.813 1.921 -1.818 769 HG13 ILE 94 HG13 ILE 94 1.787 3.674 -1.785 770 HG21 ILE 94 HG21 ILE 94 -1.813 1.371 -1.929 771 HG22 ILE 94 HG22 ILE 94 -0.225 0.589 -1.937 772 HG23 ILE 94 HG23 ILE 94 -0.881 1.294 -0.449 773 HD11 ILE 94 HD11 ILE 94 2.465 2.893 0.398 774 HD12 ILE 94 HD12 ILE 94 0.849 3.611 0.531 775 HD13 ILE 94 HD13 ILE 94 1.041 1.853 0.515 776 H ARG 95 H ARG 95 -1.399 5.332 -3.114 777 HA ARG 95 HA ARG 95 0.762 6.973 -4.400 778 HB2 ARG 95 HB2 ARG 95 -1.455 7.106 -5.395 779 HB3 ARG 95 HB3 ARG 95 -2.160 7.600 -3.872 780 HG2 ARG 95 HG2 ARG 95 0.036 9.257 -5.089 781 HG3 ARG 95 HG3 ARG 95 -1.609 9.371 -5.713 782 HD2 ARG 95 HD2 ARG 95 -0.926 9.786 -2.790 783 HD3 ARG 95 HD3 ARG 95 -1.009 11.068 -3.986 784 HE ARG 95 HE ARG 95 -3.363 10.751 -4.214 785 HH11 ARG 95 HH11 ARG 95 -5.280 10.717 -3.076 786 HH12 ARG 95 HH12 ARG 95 -5.365 9.846 -1.570 787 HH21 ARG 95 HH21 ARG 95 -2.149 8.754 -1.563 788 HH22 ARG 95 HH22 ARG 95 -3.714 8.788 -0.761 789 H ILE 96 H ILE 96 2.231 7.472 -2.917 790 HA ILE 96 HA ILE 96 1.452 8.057 -0.110 791 HB ILE 96 HB ILE 96 3.878 7.874 0.357 792 HG12 ILE 96 HG12 ILE 96 4.221 6.741 -2.445 793 HG13 ILE 96 HG13 ILE 96 4.572 8.437 -2.072 794 HG21 ILE 96 HG21 ILE 96 2.571 5.492 -0.977 795 HG22 ILE 96 HG22 ILE 96 3.986 5.384 0.073 796 HG23 ILE 96 HG23 ILE 96 2.462 5.956 0.735 797 HD11 ILE 96 HD11 ILE 96 5.925 6.033 -0.838 798 HD12 ILE 96 HD12 ILE 96 6.606 7.191 -2.001 799 HD13 ILE 96 HD13 ILE 96 6.188 7.727 -0.356 800 H GLN 97 H GLN 97 2.434 9.796 1.039 801 HA GLN 97 HA GLN 97 3.391 12.161 -0.480 802 HB2 GLN 97 HB2 GLN 97 2.172 12.327 1.762 803 HB3 GLN 97 HB3 GLN 97 3.564 11.531 2.491 804 HG2 GLN 97 HG2 GLN 97 4.300 13.654 2.821 805 HG3 GLN 97 HG3 GLN 97 4.846 13.537 1.147 806 HE21 GLN 97 HE21 GLN 97 2.567 16.009 -0.002 807 HE22 GLN 97 HE22 GLN 97 3.848 14.861 -0.413 808 H ASP 98 H ASP 98 5.609 12.329 -1.081 809 HA ASP 98 HA ASP 98 7.222 9.917 -0.571 810 HB2 ASP 98 HB2 ASP 98 6.822 11.169 -2.818 811 HB3 ASP 98 HB3 ASP 98 8.070 12.267 -2.232 812 H GLY 99 H GLY 99 6.809 12.490 1.290 813 HA2 GLY 99 HA2 GLY 99 7.900 13.134 3.211 814 HA3 GLY 99 HA3 GLY 99 9.232 12.051 2.804 815 H THR 100 H THR 100 8.955 14.016 0.148 816 HA THR 100 HA THR 100 10.986 15.961 1.143 817 HB THR 100 HB THR 100 11.836 15.991 -1.151 818 HG1 THR 100 HG1 THR 100 10.990 14.514 -2.622 819 HG21 THR 100 HG21 THR 100 11.493 13.102 -0.234 820 HG22 THR 100 HG22 THR 100 12.783 13.770 -1.254 821 HG23 THR 100 HG23 THR 100 12.678 14.240 0.453 822 H GLY 101 H GLY 101 7.899 16.194 0.953 823 HA2 GLY 101 HA2 GLY 101 6.587 18.150 0.865 824 HA3 GLY 101 HA3 GLY 101 7.802 18.957 -0.127 825 H ARG 102 H ARG 102 6.952 15.767 -1.113 826 HA ARG 102 HA ARG 102 5.035 16.688 -3.213 827 HB2 ARG 102 HB2 ARG 102 6.292 15.710 -4.932 828 HB3 ARG 102 HB3 ARG 102 7.465 16.616 -3.951 829 HG2 ARG 102 HG2 ARG 102 8.072 14.437 -2.847 830 HG3 ARG 102 HG3 ARG 102 7.050 13.604 -4.034 831 HD2 ARG 102 HD2 ARG 102 8.390 14.578 -5.877 832 HD3 ARG 102 HD3 ARG 102 9.422 15.394 -4.684 833 HE ARG 102 HE ARG 102 9.308 12.521 -4.219 834 HH11 ARG 102 HH11 ARG 102 10.951 11.307 -4.491 835 HH12 ARG 102 HH12 ARG 102 12.347 11.779 -5.467 836 HH21 ARG 102 HH21 ARG 102 10.959 14.852 -6.270 837 HH22 ARG 102 HH22 ARG 102 12.327 13.790 -6.472 838 H SER 103 H SER 103 4.119 14.771 -4.451 839 HA SER 103 HA SER 103 3.724 12.400 -2.687 840 HB2 SER 103 HB2 SER 103 1.632 11.981 -3.933 841 HB3 SER 103 HB3 SER 103 1.614 13.494 -3.011 842 HG SER 103 HG SER 103 0.789 13.800 -5.125 843 H ALA 104 H ALA 104 3.754 10.358 -3.603 844 HA ALA 104 HA ALA 104 4.730 10.021 -6.394 845 HB1 ALA 104 HB1 ALA 104 6.191 8.916 -3.961 846 HB2 ALA 104 HB2 ALA 104 6.560 8.534 -5.655 847 HB3 ALA 104 HB3 ALA 104 6.785 10.187 -5.060 848 H PHE 105 H PHE 105 4.339 8.004 -7.339 849 HA PHE 105 HA PHE 105 2.571 6.158 -5.824 850 HB2 PHE 105 HB2 PHE 105 3.460 5.966 -8.707 851 HB3 PHE 105 HB3 PHE 105 2.213 5.023 -7.893 852 HD1 PHE 105 HD1 PHE 105 2.934 8.071 -9.709 853 HD2 PHE 105 HD2 PHE 105 0.133 6.252 -6.976 854 HE1 PHE 105 HE1 PHE 105 1.260 9.798 -10.274 855 HE2 PHE 105 HE2 PHE 105 -1.570 7.926 -7.622 856 HZ PHE 105 HZ PHE 105 -1.027 9.715 -9.246 857 H ILE 106 H ILE 106 3.225 4.285 -5.017 858 HA ILE 106 HA ILE 106 5.744 3.048 -6.023 859 HB ILE 106 HB ILE 106 6.275 2.076 -3.867 860 HG12 ILE 106 HG12 ILE 106 4.141 3.964 -2.707 861 HG13 ILE 106 HG13 ILE 106 3.987 2.212 -2.806 862 HG21 ILE 106 HG21 ILE 106 6.107 5.124 -3.599 863 HG22 ILE 106 HG22 ILE 106 7.367 4.041 -2.969 864 HG23 ILE 106 HG23 ILE 106 7.214 4.321 -4.710 865 HD11 ILE 106 HD11 ILE 106 4.555 2.993 -0.550 866 HD12 ILE 106 HD12 ILE 106 5.736 1.862 -1.204 867 HD13 ILE 106 HD13 ILE 106 6.104 3.606 -1.132 868 H GLY 107 H GLY 107 5.727 0.930 -6.421 869 HA2 GLY 107 HA2 GLY 107 3.248 -0.631 -6.187 870 HA3 GLY 107 HA3 GLY 107 4.797 -1.150 -6.858 871 H ILE 108 H ILE 108 3.097 -2.432 -4.845 872 HA ILE 108 HA ILE 108 5.195 -2.801 -2.776 873 HB ILE 108 HB ILE 108 2.197 -3.085 -2.213 874 HG12 ILE 108 HG12 ILE 108 4.190 -0.850 -1.598 875 HG13 ILE 108 HG13 ILE 108 2.656 -0.723 -2.460 876 HG21 ILE 108 HG21 ILE 108 4.649 -3.249 -0.424 877 HG22 ILE 108 HG22 ILE 108 2.957 -3.409 0.111 878 HG23 ILE 108 HG23 ILE 108 3.637 -4.627 -0.927 879 HD11 ILE 108 HD11 ILE 108 3.046 -1.207 0.513 880 HD12 ILE 108 HD12 ILE 108 2.403 0.221 -0.280 881 HD13 ILE 108 HD13 ILE 108 1.465 -1.295 -0.326 882 H GLY 109 H GLY 109 5.603 -5.015 -2.311 883 HA2 GLY 109 HA2 GLY 109 3.840 -7.117 -3.436 884 HA3 GLY 109 HA3 GLY 109 5.553 -7.181 -3.862 885 H PHE 110 H PHE 110 3.445 -8.588 -1.921 886 HA PHE 110 HA PHE 110 4.971 -8.541 0.609 887 HB2 PHE 110 HB2 PHE 110 2.375 -9.793 -0.276 888 HB3 PHE 110 HB3 PHE 110 3.093 -10.169 1.267 889 HD1 PHE 110 HD1 PHE 110 1.995 -7.131 -0.721 890 HD2 PHE 110 HD2 PHE 110 2.678 -8.899 3.157 891 HE1 PHE 110 HE1 PHE 110 0.985 -5.148 0.371 892 HE2 PHE 110 HE2 PHE 110 1.604 -6.953 4.233 893 HZ PHE 110 HZ PHE 110 0.796 -5.048 2.834 894 H THR 111 H THR 111 5.433 -10.490 1.783 895 HA THR 111 HA THR 111 7.067 -12.336 0.275 896 HB THR 111 HB THR 111 7.523 -11.423 2.542 897 HG1 THR 111 HG1 THR 111 8.728 -13.138 1.876 898 HG21 THR 111 HG21 THR 111 5.596 -13.552 3.530 899 HG22 THR 111 HG22 THR 111 6.651 -12.520 4.515 900 HG23 THR 111 HG23 THR 111 5.319 -11.796 3.602 901 H ASP 112 H ASP 112 3.797 -12.358 1.419 902 HA ASP 112 HA ASP 112 3.343 -15.019 0.176 903 HB2 ASP 112 HB2 ASP 112 3.514 -15.016 2.786 904 HB3 ASP 112 HB3 ASP 112 1.933 -14.228 2.740 905 H ARG 113 H ARG 113 1.404 -15.298 -0.880 906 HA ARG 113 HA ARG 113 -0.167 -13.108 -1.846 907 HB2 ARG 113 HB2 ARG 113 0.064 -15.377 -2.913 908 HB3 ARG 113 HB3 ARG 113 -0.829 -16.078 -1.572 909 HG2 ARG 113 HG2 ARG 113 -2.356 -15.918 -3.377 910 HG3 ARG 113 HG3 ARG 113 -2.827 -14.680 -2.226 911 HD2 ARG 113 HD2 ARG 113 -3.009 -13.669 -4.353 912 HD3 ARG 113 HD3 ARG 113 -1.540 -13.007 -3.656 913 HE ARG 113 HE ARG 113 -0.210 -14.403 -5.113 914 HH11 ARG 113 HH11 ARG 113 0.157 -15.121 -7.186 915 HH12 ARG 113 HH12 ARG 113 -1.190 -15.351 -8.281 916 HH21 ARG 113 HH21 ARG 113 -3.615 -14.606 -6.008 917 HH22 ARG 113 HH22 ARG 113 -3.209 -15.145 -7.636 918 H GLY 114 H GLY 114 -0.601 -15.230 0.987 919 HA2 GLY 114 HA2 GLY 114 -3.232 -14.288 1.725 920 HA3 GLY 114 HA3 GLY 114 -2.092 -15.187 2.730 921 H ASP 115 H ASP 115 0.087 -13.197 2.581 922 HA ASP 115 HA ASP 115 -0.797 -11.423 4.701 923 HB2 ASP 115 HB2 ASP 115 1.792 -11.558 3.137 924 HB3 ASP 115 HB3 ASP 115 1.473 -10.396 4.428 925 H ALA 116 H ALA 116 -0.248 -11.000 1.217 926 HA ALA 116 HA ALA 116 -1.002 -8.194 1.196 927 HB1 ALA 116 HB1 ALA 116 0.392 -9.047 -0.547 928 HB2 ALA 116 HB2 ALA 116 -0.725 -10.374 -0.895 929 HB3 ALA 116 HB3 ALA 116 -1.154 -8.692 -1.291 930 H PHE 117 H PHE 117 -2.848 -11.279 0.691 931 HA PHE 117 HA PHE 117 -5.318 -10.035 0.025 932 HB2 PHE 117 HB2 PHE 117 -4.753 -12.456 -0.184 933 HB3 PHE 117 HB3 PHE 117 -4.884 -12.613 1.563 934 HD1 PHE 117 HD1 PHE 117 -6.760 -12.017 -1.605 935 HD2 PHE 117 HD2 PHE 117 -7.061 -12.692 2.654 936 HE1 PHE 117 HE1 PHE 117 -9.184 -12.474 -1.841 937 HE2 PHE 117 HE2 PHE 117 -9.490 -13.174 2.392 938 HZ PHE 117 HZ PHE 117 -10.535 -13.088 0.154 939 H ASP 118 H ASP 118 -3.745 -10.389 3.208 940 HA ASP 118 HA ASP 118 -6.069 -9.475 4.723 941 HB2 ASP 118 HB2 ASP 118 -3.119 -9.734 5.389 942 HB3 ASP 118 HB3 ASP 118 -4.308 -9.094 6.515 943 H PHE 119 H PHE 119 -3.249 -7.860 3.172 944 HA PHE 119 HA PHE 119 -3.729 -5.259 4.205 945 HB2 PHE 119 HB2 PHE 119 -1.670 -5.767 3.096 946 HB3 PHE 119 HB3 PHE 119 -2.468 -6.279 1.637 947 HD1 PHE 119 HD1 PHE 119 -0.884 -3.537 3.244 948 HD2 PHE 119 HD2 PHE 119 -3.669 -4.566 0.159 949 HE1 PHE 119 HE1 PHE 119 -0.626 -1.296 2.283 950 HE2 PHE 119 HE2 PHE 119 -3.326 -2.337 -0.896 951 HZ PHE 119 HZ PHE 119 -1.839 -0.679 0.195 952 H ASN 120 H ASN 120 -5.011 -6.920 1.311 953 HA ASN 120 HA ASN 120 -6.786 -4.815 0.476 954 HB2 ASN 120 HB2 ASN 120 -6.361 -6.271 -1.211 955 HB3 ASN 120 HB3 ASN 120 -6.302 -7.701 -0.152 956 HD21 ASN 120 HD21 ASN 120 -9.837 -6.657 -1.851 957 HD22 ASN 120 HD22 ASN 120 -8.525 -5.470 -1.780 958 H VAL 121 H VAL 121 -7.528 -7.815 2.394 959 HA VAL 121 HA VAL 121 -10.276 -7.090 2.618 960 HB VAL 121 HB VAL 121 -8.531 -9.103 3.998 961 HG11 VAL 121 HG11 VAL 121 -11.519 -8.742 4.498 962 HG12 VAL 121 HG12 VAL 121 -10.572 -10.173 4.965 963 HG13 VAL 121 HG13 VAL 121 -10.221 -8.618 5.712 964 HG21 VAL 121 HG21 VAL 121 -9.171 -9.564 1.676 965 HG22 VAL 121 HG22 VAL 121 -9.952 -10.706 2.767 966 HG23 VAL 121 HG23 VAL 121 -10.891 -9.363 2.093 967 H SER 122 H SER 122 -7.548 -6.292 4.757 968 HA SER 122 HA SER 122 -9.037 -5.182 6.916 969 HB2 SER 122 HB2 SER 122 -6.568 -5.477 6.885 970 HB3 SER 122 HB3 SER 122 -6.438 -4.185 5.675 971 HG SER 122 HG SER 122 -7.457 -3.975 8.336 972 H LEU 123 H LEU 123 -8.328 -3.881 3.676 973 HA LEU 123 HA LEU 123 -9.587 -1.293 4.243 974 HB2 LEU 123 HB2 LEU 123 -8.502 -2.504 1.685 975 HB3 LEU 123 HB3 LEU 123 -9.078 -0.850 1.859 976 HG LEU 123 HG LEU 123 -6.811 -1.925 3.585 977 HD11 LEU 123 HD11 LEU 123 -5.238 -0.987 2.010 978 HD12 LEU 123 HD12 LEU 123 -6.224 -2.204 1.205 979 HD13 LEU 123 HD13 LEU 123 -6.572 -0.487 0.939 980 HD21 LEU 123 HD21 LEU 123 -7.893 0.174 4.349 981 HD22 LEU 123 HD22 LEU 123 -6.233 0.438 3.818 982 HD23 LEU 123 HD23 LEU 123 -7.583 0.904 2.759 983 H GLN 124 H GLN 124 -10.500 -4.293 2.451 984 HA GLN 124 HA GLN 124 -13.044 -3.423 1.525 985 HB2 GLN 124 HB2 GLN 124 -12.303 -6.171 2.634 986 HB3 GLN 124 HB3 GLN 124 -13.803 -5.770 1.815 987 HG2 GLN 124 HG2 GLN 124 -12.474 -5.135 -0.232 988 HG3 GLN 124 HG3 GLN 124 -11.030 -5.744 0.578 989 HE21 GLN 124 HE21 GLN 124 -11.781 -8.998 -0.652 990 HE22 GLN 124 HE22 GLN 124 -10.527 -7.881 -0.185 991 H ASP 125 H ASP 125 -12.275 -4.946 4.713 992 HA ASP 125 HA ASP 125 -14.948 -4.491 5.744 993 HB2 ASP 125 HB2 ASP 125 -13.298 -6.341 6.367 994 HB3 ASP 125 HB3 ASP 125 -12.387 -5.113 7.263 995 H HIS 126 H HIS 126 -12.375 -2.322 5.356 996 HA HIS 126 HA HIS 126 -13.186 -0.572 7.612 997 HB2 HIS 126 HB2 HIS 126 -10.825 -0.608 7.103 998 HB3 HIS 126 HB3 HIS 126 -11.143 -0.158 5.419 999 HD2 HIS 126 HD2 HIS 126 -11.951 1.349 8.953 1000 HE1 HIS 126 HE1 HIS 126 -11.151 4.579 6.295 1001 HE2 HIS 126 HE2 HIS 126 -11.786 3.971 8.676 1002 H PHE 127 H PHE 127 -13.432 -0.673 4.027 1003 HA PHE 127 HA PHE 127 -15.199 1.671 4.106 1004 HB2 PHE 127 HB2 PHE 127 -14.001 0.113 1.843 1005 HB3 PHE 127 HB3 PHE 127 -15.218 1.369 1.610 1006 HD1 PHE 127 HD1 PHE 127 -14.807 3.724 2.483 1007 HD2 PHE 127 HD2 PHE 127 -11.695 0.749 2.381 1008 HE1 PHE 127 HE1 PHE 127 -13.087 5.489 2.843 1009 HE2 PHE 127 HE2 PHE 127 -9.986 2.514 2.684 1010 HZ PHE 127 HZ PHE 127 -10.685 4.886 2.931 1011 H LYS 128 H LYS 128 -15.780 -1.726 4.329 1012 HA LYS 128 HA LYS 128 -18.275 -1.896 3.085 1013 HB2 LYS 128 HB2 LYS 128 -18.620 -3.943 4.103 1014 HB3 LYS 128 HB3 LYS 128 -16.900 -3.792 3.890 1015 HG2 LYS 128 HG2 LYS 128 -16.955 -4.680 5.982 1016 HG3 LYS 128 HG3 LYS 128 -16.955 -2.962 6.426 1017 HD2 LYS 128 HD2 LYS 128 -19.513 -3.204 6.535 1018 HD3 LYS 128 HD3 LYS 128 -19.267 -4.932 6.276 1019 HE2 LYS 128 HE2 LYS 128 -18.011 -3.385 8.571 1020 HE3 LYS 128 HE3 LYS 128 -19.635 -4.070 8.671 1021 HZ1 LYS 128 HZ1 LYS 128 -18.031 -5.611 9.584 1022 HZ2 LYS 128 HZ2 LYS 128 -18.658 -6.271 8.230 1023 HZ3 LYS 128 HZ3 LYS 128 -17.145 -5.635 8.218 1024 H TRP 129 H TRP 129 -17.670 -0.398 6.176 1025 HA TRP 129 HA TRP 129 -20.600 -0.219 6.749 1026 HB2 TRP 129 HB2 TRP 129 -19.881 0.340 9.031 1027 HB3 TRP 129 HB3 TRP 129 -19.363 -1.241 8.483 1028 HD1 TRP 129 HD1 TRP 129 -16.757 -1.719 8.312 1029 HE1 TRP 129 HE1 TRP 129 -14.685 -0.464 8.982 1030 HE3 TRP 129 HE3 TRP 129 -18.875 2.825 9.311 1031 HZ2 TRP 129 HZ2 TRP 129 -13.971 2.210 9.922 1032 HZ3 TRP 129 HZ3 TRP 129 -17.457 4.741 10.052 1033 HH2 TRP 129 HH2 TRP 129 -15.006 4.443 10.340 1034 H VAL 130 H VAL 130 -18.523 1.559 5.085 1035 HA VAL 130 HA VAL 130 -19.937 4.150 5.516 1036 HB VAL 130 HB VAL 130 -17.479 5.009 4.670 1037 HG11 VAL 130 HG11 VAL 130 -17.271 5.841 7.026 1038 HG12 VAL 130 HG12 VAL 130 -18.888 6.087 6.338 1039 HG13 VAL 130 HG13 VAL 130 -18.598 4.766 7.490 1040 HG21 VAL 130 HG21 VAL 130 -15.747 4.182 6.073 1041 HG22 VAL 130 HG22 VAL 130 -16.831 3.026 6.860 1042 HG23 VAL 130 HG23 VAL 130 -16.424 2.836 5.151 1043 H LYS 131 H LYS 131 -18.538 5.312 3.255 1044 HA LYS 131 HA LYS 131 -18.932 5.646 1.080 1045 HB2 LYS 131 HB2 LYS 131 -17.148 3.809 1.457 1046 HB3 LYS 131 HB3 LYS 131 -18.354 2.667 0.884 1047 HG2 LYS 131 HG2 LYS 131 -16.828 3.242 -0.860 1048 HG3 LYS 131 HG3 LYS 131 -18.431 3.861 -1.270 1049 HD2 LYS 131 HD2 LYS 131 -17.714 6.139 -0.570 1050 HD3 LYS 131 HD3 LYS 131 -16.099 5.494 -0.188 1051 HE2 LYS 131 HE2 LYS 131 -15.760 4.863 -2.529 1052 HE3 LYS 131 HE3 LYS 131 -17.451 5.180 -2.914 1053 HZ1 LYS 131 HZ1 LYS 131 -16.034 6.995 -3.663 1054 HZ2 LYS 131 HZ2 LYS 131 -17.075 7.538 -2.538 1055 HZ3 LYS 131 HZ3 LYS 131 -15.504 7.292 -2.147 1056 H GLN 132 H GLN 132 -21.352 4.991 2.524 1057 HA GLN 132 HA GLN 132 -23.531 4.519 2.280 1058 HB2 GLN 132 HB2 GLN 132 -23.171 5.349 -0.616 1059 HB3 GLN 132 HB3 GLN 132 -24.664 5.391 0.320 1060 HG2 GLN 132 HG2 GLN 132 -22.183 7.103 0.781 1061 HG3 GLN 132 HG3 GLN 132 -23.715 7.637 0.115 1062 HE21 GLN 132 HE21 GLN 132 -23.369 8.298 3.913 1063 HE22 GLN 132 HE22 GLN 132 -22.149 8.432 2.653 1064 H GLU 133 H GLU 133 -21.839 2.276 2.054 1065 HA GLU 133 HA GLU 133 -23.147 0.387 0.272 1066 HB2 GLU 133 HB2 GLU 133 -21.228 0.057 2.603 1067 HB3 GLU 133 HB3 GLU 133 -21.818 -1.295 1.642 1068 HG2 GLU 133 HG2 GLU 133 -20.267 1.065 0.479 1069 HG3 GLU 133 HG3 GLU 133 -19.534 -0.441 1.011 1070 H1 SER 149 H1 SER 149 10.127 -25.683 -17.074 1071 H2 SER 149 H2 SER 149 11.192 -26.169 -15.927 1072 H3 SER 149 H3 SER 149 11.533 -26.401 -17.516 1073 HA SER 149 HA SER 149 12.815 -24.581 -16.620 1074 HB2 SER 149 HB2 SER 149 10.738 -23.704 -18.664 1075 HB3 SER 149 HB3 SER 149 12.328 -22.965 -18.381 1076 HG SER 149 HG SER 149 12.377 -24.461 -20.119 1077 H GLN 150 H GLN 150 12.865 -22.414 -15.792 1078 HA GLN 150 HA GLN 150 10.736 -21.849 -13.860 1079 HB2 GLN 150 HB2 GLN 150 13.308 -20.353 -14.500 1080 HB3 GLN 150 HB3 GLN 150 12.238 -20.019 -13.142 1081 HG2 GLN 150 HG2 GLN 150 13.837 -22.583 -13.572 1082 HG3 GLN 150 HG3 GLN 150 14.192 -21.301 -12.422 1083 HE21 GLN 150 HE21 GLN 150 11.610 -22.316 -10.105 1084 HE22 GLN 150 HE22 GLN 150 12.534 -20.919 -10.637 1085 H ILE 151 H ILE 151 9.746 -19.763 -13.603 1086 HA ILE 151 HA ILE 151 9.615 -17.947 -15.893 1087 HB ILE 151 HB ILE 151 7.836 -19.694 -16.261 1088 HG12 ILE 151 HG12 ILE 151 5.992 -18.239 -16.811 1089 HG13 ILE 151 HG13 ILE 151 6.617 -16.943 -15.807 1090 HG21 ILE 151 HG21 ILE 151 6.490 -18.470 -13.815 1091 HG22 ILE 151 HG22 ILE 151 5.826 -19.720 -14.882 1092 HG23 ILE 151 HG23 ILE 151 7.232 -20.086 -13.876 1093 HD11 ILE 151 HD11 ILE 151 7.029 -16.620 -18.246 1094 HD12 ILE 151 HD12 ILE 151 8.538 -16.652 -17.324 1095 HD13 ILE 151 HD13 ILE 151 8.035 -18.083 -18.260 1096 H THR 152 H THR 152 8.541 -15.882 -15.333 1097 HA THR 152 HA THR 152 9.207 -15.018 -12.622 1098 HB THR 152 HB THR 152 8.325 -12.793 -13.532 1099 HG1 THR 152 HG1 THR 152 8.453 -12.756 -15.856 1100 HG21 THR 152 HG21 THR 152 10.651 -14.117 -14.985 1101 HG22 THR 152 HG22 THR 152 10.369 -12.369 -14.804 1102 HG23 THR 152 HG23 THR 152 10.730 -13.353 -13.381 1103 H SER 153 H SER 153 7.833 -14.061 -11.133 1104 HA SER 153 HA SER 153 5.261 -15.359 -10.881 1105 HB2 SER 153 HB2 SER 153 6.627 -13.385 -9.049 1106 HB3 SER 153 HB3 SER 153 5.267 -14.458 -8.642 1107 HG SER 153 HG SER 153 7.283 -15.346 -7.958 1108 H GLN 154 H GLN 154 4.868 -13.900 -12.927 1109 HA GLN 154 HA GLN 154 4.144 -11.213 -12.806 1110 HB2 GLN 154 HB2 GLN 154 2.951 -13.330 -14.635 1111 HB3 GLN 154 HB3 GLN 154 2.957 -11.584 -14.918 1112 HG2 GLN 154 HG2 GLN 154 5.454 -11.619 -15.007 1113 HG3 GLN 154 HG3 GLN 154 5.433 -13.354 -14.740 1114 HE21 GLN 154 HE21 GLN 154 5.768 -13.507 -18.265 1115 HE22 GLN 154 HE22 GLN 154 6.633 -13.568 -16.725 1116 H VAL 155 H VAL 155 2.036 -10.116 -12.946 1117 HA VAL 155 HA VAL 155 0.211 -10.886 -10.918 1118 HB VAL 155 HB VAL 155 -0.466 -8.963 -13.171 1119 HG11 VAL 155 HG11 VAL 155 -1.367 -8.934 -10.214 1120 HG12 VAL 155 HG12 VAL 155 -1.765 -7.760 -11.427 1121 HG13 VAL 155 HG13 VAL 155 -2.342 -9.404 -11.644 1122 HG21 VAL 155 HG21 VAL 155 1.060 -8.276 -10.642 1123 HG22 VAL 155 HG22 VAL 155 1.716 -8.243 -12.313 1124 HG23 VAL 155 HG23 VAL 155 0.414 -7.137 -11.852 1125 H TPO 156 H T2P 156 -1.623 -12.004 -11.047 1126 HA TPO 156 HA T2P 156 -2.113 -13.963 -13.017 1127 HB TPO 156 HB T2P 156 -2.986 -13.547 -10.463 1128 HG21 TPO 156 HG21 T2P 156 -5.075 -12.489 -11.353 1129 HG22 TPO 156 HG22 T2P 156 -5.284 -13.873 -10.287 1130 HG23 TPO 156 HG23 T2P 156 -5.497 -14.093 -12.026 1131 H GLY 157 H GLY 157 -4.141 -14.492 -13.868 1132 HA2 GLY 157 HA2 GLY 157 -5.984 -12.646 -15.015 1133 HA3 GLY 157 HA3 GLY 157 -4.698 -12.911 -16.203 1134 H GLN 158 H GLN 158 -4.355 -15.737 -15.185 1135 HA GLN 158 HA GLN 158 -6.148 -17.197 -16.809 1136 HB2 GLN 158 HB2 GLN 158 -5.126 -19.151 -15.782 1137 HB3 GLN 158 HB3 GLN 158 -3.908 -17.940 -16.178 1138 HG2 GLN 158 HG2 GLN 158 -3.860 -17.228 -13.760 1139 HG3 GLN 158 HG3 GLN 158 -5.042 -18.478 -13.388 1140 HE21 GLN 158 HE21 GLN 158 -1.735 -19.919 -12.552 1141 HE22 GLN 158 HE22 GLN 158 -2.736 -18.587 -11.952 1142 H ILE 159 H ILE 159 -6.753 -15.936 -13.628 1143 HA ILE 159 HA ILE 159 -9.127 -17.716 -13.347 1144 HB ILE 159 HB ILE 159 -7.345 -18.615 -12.035 1145 HG12 ILE 159 HG12 ILE 159 -8.325 -18.663 -9.778 1146 HG13 ILE 159 HG13 ILE 159 -9.391 -17.329 -10.200 1147 HG21 ILE 159 HG21 ILE 159 -6.379 -17.389 -10.074 1148 HG22 ILE 159 HG22 ILE 159 -5.870 -16.787 -11.646 1149 HG23 ILE 159 HG23 ILE 159 -7.098 -15.910 -10.727 1150 HD11 ILE 159 HD11 ILE 159 -10.507 -19.546 -10.315 1151 HD12 ILE 159 HD12 ILE 159 -10.520 -18.737 -11.888 1152 HD13 ILE 159 HD13 ILE 159 -9.364 -20.055 -11.573 1153 H GLY 160 H GLY 160 -7.778 -14.567 -12.338 1154 HA2 GLY 160 HA2 GLY 160 -8.819 -12.496 -12.412 1155 HA3 GLY 160 HA3 GLY 160 -10.192 -13.261 -13.202 1156 H TRP 161 H TRP 161 -8.678 -12.976 -9.970 1157 HA TRP 161 HA TRP 161 -11.353 -13.357 -8.661 1158 HB2 TRP 161 HB2 TRP 161 -10.650 -15.316 -7.568 1159 HB3 TRP 161 HB3 TRP 161 -10.176 -15.525 -9.232 1160 HD1 TRP 161 HD1 TRP 161 -7.387 -14.113 -9.286 1161 HE1 TRP 161 HE1 TRP 161 -5.391 -15.411 -8.322 1162 HE3 TRP 161 HE3 TRP 161 -9.801 -16.379 -5.432 1163 HZ2 TRP 161 HZ2 TRP 161 -4.901 -17.087 -6.045 1164 HZ3 TRP 161 HZ3 TRP 161 -8.523 -17.748 -3.783 1165 HH2 TRP 161 HH2 TRP 161 -6.087 -18.135 -4.088 1166 H ARG 162 H ARG 162 -11.321 -13.492 -6.408 1167 HA ARG 162 HA ARG 162 -9.105 -13.258 -4.687 1168 HB2 ARG 162 HB2 ARG 162 -10.231 -10.674 -5.432 1169 HB3 ARG 162 HB3 ARG 162 -10.493 -10.991 -3.707 1170 HG2 ARG 162 HG2 ARG 162 -7.959 -11.633 -3.673 1171 HG3 ARG 162 HG3 ARG 162 -7.869 -10.810 -5.232 1172 HD2 ARG 162 HD2 ARG 162 -8.981 -9.588 -2.664 1173 HD3 ARG 162 HD3 ARG 162 -7.320 -9.402 -3.184 1174 HE ARG 162 HE ARG 162 -9.688 -8.424 -4.760 1175 HH11 ARG 162 HH11 ARG 162 -9.466 -6.470 -5.839 1176 HH12 ARG 162 HH12 ARG 162 -7.933 -5.629 -5.728 1177 HH21 ARG 162 HH21 ARG 162 -6.313 -7.849 -3.800 1178 HH22 ARG 162 HH22 ARG 162 -6.318 -6.336 -4.692 1179 H ARG 163 H ARG 163 -12.558 -12.388 -4.824 1180 HA ARG 163 HA ARG 163 -13.254 -14.440 -2.774 1181 HB2 ARG 163 HB2 ARG 163 -14.094 -11.504 -2.747 1182 HB3 ARG 163 HB3 ARG 163 -14.869 -12.776 -1.796 1183 HG2 ARG 163 HG2 ARG 163 -12.719 -13.255 -0.653 1184 HG3 ARG 163 HG3 ARG 163 -11.936 -11.972 -1.590 1185 HD2 ARG 163 HD2 ARG 163 -12.417 -11.124 0.588 1186 HD3 ARG 163 HD3 ARG 163 -13.458 -10.305 -0.595 1187 HE ARG 163 HE ARG 163 -14.537 -12.647 0.886 1188 HH11 ARG 163 HH11 ARG 163 -16.418 -12.418 1.991 1189 HH12 ARG 163 HH12 ARG 163 -17.107 -10.841 2.236 1190 HH21 ARG 163 HH21 ARG 163 -14.666 -9.116 0.558 1191 HH22 ARG 163 HH22 ARG 163 -16.161 -9.052 1.446 Start of MODEL 7 1 H1 GLY -4 H1 GLY -4 13.527 27.497 23.517 2 H2 GLY -4 H2 GLY -4 13.695 27.168 25.114 3 H3 GLY -4 H3 GLY -4 13.046 28.593 24.637 4 HA2 GLY -4 HA2 GLY -4 11.128 27.490 23.702 5 HA3 GLY -4 HA3 GLY -4 11.835 25.940 24.194 6 H SER -3 H SER -3 9.268 27.112 24.961 7 HA SER -3 HA SER -3 9.532 27.044 27.921 8 HB2 SER -3 HB2 SER -3 7.902 29.107 26.384 9 HB3 SER -3 HB3 SER -3 7.940 28.918 28.143 10 HG SER -3 HG SER -3 10.168 29.455 28.097 11 HA PRO -2 HA PRO -2 6.034 24.346 27.776 12 HB2 PRO -2 HB2 PRO -2 4.820 25.949 30.026 13 HB3 PRO -2 HB3 PRO -2 5.031 24.175 29.888 14 HG2 PRO -2 HG2 PRO -2 6.733 25.623 31.411 15 HG3 PRO -2 HG3 PRO -2 7.383 24.354 30.319 16 HD2 PRO -2 HD2 PRO -2 7.242 27.347 29.845 17 HD3 PRO -2 HD3 PRO -2 8.612 26.221 29.598 18 H ASN -1 H ASN -1 4.054 24.138 26.803 19 HA ASN -1 HA ASN -1 2.160 26.345 26.523 20 HB2 ASN -1 HB2 ASN -1 3.944 26.660 24.696 21 HB3 ASN -1 HB3 ASN -1 3.417 25.119 24.023 22 HD21 ASN -1 HD21 ASN -1 1.518 27.418 22.010 23 HD22 ASN -1 HD22 ASN -1 3.060 26.580 22.096 24 H SER 0 H SER 0 0.138 25.609 25.464 25 HA SER 0 HA SER 0 -0.587 22.821 26.037 26 HB2 SER 0 HB2 SER 0 -2.141 25.054 24.678 27 HB3 SER 0 HB3 SER 0 -2.791 23.467 25.136 28 HG SER 0 HG SER 0 -3.214 25.088 26.723 29 H MET 1 H MET 1 -0.613 21.159 24.627 30 HA MET 1 HA MET 1 0.340 21.667 21.843 31 HB2 MET 1 HB2 MET 1 0.611 19.196 23.584 32 HB3 MET 1 HB3 MET 1 1.300 19.416 21.974 33 HG2 MET 1 HG2 MET 1 2.023 21.007 24.459 34 HG3 MET 1 HG3 MET 1 2.981 19.740 23.707 35 HE1 MET 1 HE1 MET 1 5.106 21.298 23.762 36 HE2 MET 1 HE2 MET 1 5.141 22.949 23.105 37 HE3 MET 1 HE3 MET 1 4.132 22.578 24.520 38 H ALA 2 H ALA 2 -2.563 20.781 23.299 39 HA ALA 2 HA ALA 2 -3.392 18.862 21.232 40 HB1 ALA 2 HB1 ALA 2 -4.028 18.511 23.593 41 HB2 ALA 2 HB2 ALA 2 -4.914 20.056 23.586 42 HB3 ALA 2 HB3 ALA 2 -5.454 18.712 22.555 43 H THR 3 H THR 3 -2.708 20.664 19.763 44 HA THR 3 HA THR 3 -4.437 22.878 19.299 45 HB THR 3 HB THR 3 -2.366 21.654 17.535 46 HG1 THR 3 HG1 THR 3 -0.937 23.052 18.591 47 HG21 THR 3 HG21 THR 3 -3.411 24.500 17.754 48 HG22 THR 3 HG22 THR 3 -1.969 24.030 16.814 49 HG23 THR 3 HG23 THR 3 -3.561 23.414 16.350 50 H GLU 4 H GLU 4 -4.492 19.670 18.063 51 HA GLU 4 HA GLU 4 -6.945 20.143 16.513 52 HB2 GLU 4 HB2 GLU 4 -5.085 20.656 14.923 53 HB3 GLU 4 HB3 GLU 4 -4.411 19.056 15.205 54 HG2 GLU 4 HG2 GLU 4 -5.593 19.182 13.074 55 HG3 GLU 4 HG3 GLU 4 -6.347 17.999 14.123 56 H LEU 5 H LEU 5 -7.971 18.179 15.829 57 HA LEU 5 HA LEU 5 -7.557 15.818 17.565 58 HB2 LEU 5 HB2 LEU 5 -9.668 16.469 15.472 59 HB3 LEU 5 HB3 LEU 5 -9.632 15.006 16.453 60 HG LEU 5 HG LEU 5 -10.006 17.837 17.524 61 HD11 LEU 5 HD11 LEU 5 -11.929 15.486 17.243 62 HD12 LEU 5 HD12 LEU 5 -12.299 17.060 17.991 63 HD13 LEU 5 HD13 LEU 5 -11.937 16.967 16.259 64 HD21 LEU 5 HD21 LEU 5 -8.899 16.454 19.223 65 HD22 LEU 5 HD22 LEU 5 -10.596 16.681 19.656 66 HD23 LEU 5 HD23 LEU 5 -10.065 15.136 18.949 67 H GLU 6 H GLU 6 -5.338 16.029 16.296 68 HA GLU 6 HA GLU 6 -5.333 14.464 13.793 69 HB2 GLU 6 HB2 GLU 6 -3.305 15.988 15.404 70 HB3 GLU 6 HB3 GLU 6 -2.728 14.693 14.343 71 HG2 GLU 6 HG2 GLU 6 -4.354 17.104 13.477 72 HG3 GLU 6 HG3 GLU 6 -2.626 16.887 13.249 73 H TYR 7 H TYR 7 -5.489 12.283 13.895 74 HA TYR 7 HA TYR 7 -3.846 10.710 15.691 75 HB2 TYR 7 HB2 TYR 7 -5.587 9.510 16.785 76 HB3 TYR 7 HB3 TYR 7 -5.921 11.206 17.055 77 HD1 TYR 7 HD1 TYR 7 -7.772 12.337 15.743 78 HD2 TYR 7 HD2 TYR 7 -7.180 8.067 15.700 79 HE1 TYR 7 HE1 TYR 7 -10.040 12.040 14.778 80 HE2 TYR 7 HE2 TYR 7 -9.447 7.758 14.744 81 HH TYR 7 HH TYR 7 -11.607 10.534 14.018 82 H GLU 8 H GLU 8 -4.557 8.294 15.366 83 HA GLU 8 HA GLU 8 -6.016 7.571 13.041 84 HB2 GLU 8 HB2 GLU 8 -4.303 6.313 11.856 85 HB3 GLU 8 HB3 GLU 8 -4.038 8.026 11.721 86 HG2 GLU 8 HG2 GLU 8 -2.525 6.416 13.805 87 HG3 GLU 8 HG3 GLU 8 -2.031 6.405 12.128 88 H SER 9 H SER 9 -6.926 5.665 13.394 89 HA SER 9 HA SER 9 -6.135 4.102 15.772 90 HB2 SER 9 HB2 SER 9 -8.601 4.153 14.018 91 HB3 SER 9 HB3 SER 9 -8.357 2.968 15.320 92 HG SER 9 HG SER 9 -9.528 4.816 16.044 93 H VAL 10 H VAL 10 -5.111 2.106 15.614 94 HA VAL 10 HA VAL 10 -4.187 1.249 13.034 95 HB VAL 10 HB VAL 10 -4.126 -0.283 15.618 96 HG11 VAL 10 HG11 VAL 10 -2.427 -0.552 13.092 97 HG12 VAL 10 HG12 VAL 10 -2.105 -1.388 14.629 98 HG13 VAL 10 HG13 VAL 10 -3.570 -1.756 13.732 99 HG21 VAL 10 HG21 VAL 10 -3.011 1.914 15.892 100 HG22 VAL 10 HG22 VAL 10 -1.838 0.605 15.906 101 HG23 VAL 10 HG23 VAL 10 -2.030 1.600 14.446 102 H LEU 11 H LEU 11 -4.738 -0.346 11.689 103 HA LEU 11 HA LEU 11 -7.284 -1.859 12.168 104 HB2 LEU 11 HB2 LEU 11 -6.150 -0.762 9.564 105 HB3 LEU 11 HB3 LEU 11 -7.564 -1.792 9.706 106 HG LEU 11 HG LEU 11 -7.314 1.062 10.736 107 HD11 LEU 11 HD11 LEU 11 -9.068 1.431 8.991 108 HD12 LEU 11 HD12 LEU 11 -7.528 0.893 8.312 109 HD13 LEU 11 HD13 LEU 11 -8.882 -0.250 8.471 110 HD21 LEU 11 HD21 LEU 11 -9.664 -0.886 10.874 111 HD22 LEU 11 HD22 LEU 11 -8.789 -0.170 12.254 112 HD23 LEU 11 HD23 LEU 11 -9.758 0.859 11.204 113 H CYS 12 H CYS 12 -4.084 -1.911 10.531 114 HA CYS 12 HA CYS 12 -3.944 -4.825 10.922 115 HB2 CYS 12 HB2 CYS 12 -4.977 -4.338 8.635 116 HB3 CYS 12 HB3 CYS 12 -3.399 -3.683 8.167 117 HG CYS 12 HG CYS 12 -3.762 -6.129 7.221 118 H VAL 13 H VAL 13 -1.905 -5.728 10.751 119 HA VAL 13 HA VAL 13 0.432 -4.030 10.358 120 HB VAL 13 HB VAL 13 0.107 -3.709 12.702 121 HG11 VAL 13 HG11 VAL 13 -1.248 -5.673 13.320 122 HG12 VAL 13 HG12 VAL 13 0.183 -6.714 13.153 123 HG13 VAL 13 HG13 VAL 13 0.137 -5.449 14.391 124 HG21 VAL 13 HG21 VAL 13 2.451 -4.035 11.874 125 HG22 VAL 13 HG22 VAL 13 2.244 -4.457 13.578 126 HG23 VAL 13 HG23 VAL 13 2.357 -5.740 12.357 127 H LYS 14 H LYS 14 1.821 -5.120 9.117 128 HA LYS 14 HA LYS 14 1.812 -8.082 9.319 129 HB2 LYS 14 HB2 LYS 14 1.952 -6.560 6.700 130 HB3 LYS 14 HB3 LYS 14 2.424 -8.232 6.853 131 HG2 LYS 14 HG2 LYS 14 -0.342 -7.170 7.553 132 HG3 LYS 14 HG3 LYS 14 0.111 -7.945 6.032 133 HD2 LYS 14 HD2 LYS 14 0.744 -10.019 7.282 134 HD3 LYS 14 HD3 LYS 14 0.176 -9.265 8.792 135 HE2 LYS 14 HE2 LYS 14 -2.027 -8.886 7.759 136 HE3 LYS 14 HE3 LYS 14 -1.466 -9.747 6.307 137 HZ1 LYS 14 HZ1 LYS 14 -1.567 -10.966 9.007 138 HZ2 LYS 14 HZ2 LYS 14 -2.759 -11.107 7.903 139 HZ3 LYS 14 HZ3 LYS 14 -1.238 -11.738 7.589 140 HA PRO 15 HA PRO 15 5.827 -7.966 10.572 141 HB2 PRO 15 HB2 PRO 15 6.678 -10.541 10.070 142 HB3 PRO 15 HB3 PRO 15 5.417 -10.128 11.269 143 HG2 PRO 15 HG2 PRO 15 4.983 -11.028 8.379 144 HG3 PRO 15 HG3 PRO 15 4.221 -11.690 9.867 145 HD2 PRO 15 HD2 PRO 15 2.963 -9.889 8.386 146 HD3 PRO 15 HD3 PRO 15 2.924 -9.770 10.172 147 H ASP 16 H ASP 16 5.483 -8.883 7.165 148 HA ASP 16 HA ASP 16 8.124 -7.716 6.540 149 HB2 ASP 16 HB2 ASP 16 8.526 -10.119 6.987 150 HB3 ASP 16 HB3 ASP 16 7.308 -10.543 5.784 151 H VAL 17 H VAL 17 8.031 -6.509 4.743 152 HA VAL 17 HA VAL 17 6.128 -7.036 2.574 153 HB VAL 17 HB VAL 17 4.761 -5.760 4.174 154 HG11 VAL 17 HG11 VAL 17 6.751 -3.490 3.858 155 HG12 VAL 17 HG12 VAL 17 5.181 -3.406 4.668 156 HG13 VAL 17 HG13 VAL 17 6.460 -4.435 5.332 157 HG21 VAL 17 HG21 VAL 17 5.450 -4.070 1.750 158 HG22 VAL 17 HG22 VAL 17 4.408 -5.516 1.735 159 HG23 VAL 17 HG23 VAL 17 3.930 -4.086 2.661 160 H SER 18 H SER 18 6.874 -6.204 0.637 161 HA SER 18 HA SER 18 9.441 -4.674 0.697 162 HB2 SER 18 HB2 SER 18 8.694 -6.846 -1.280 163 HB3 SER 18 HB3 SER 18 10.251 -6.015 -1.084 164 HG SER 18 HG SER 18 10.180 -8.125 -0.115 165 H VAL 19 H VAL 19 9.781 -3.109 -0.821 166 HA VAL 19 HA VAL 19 7.332 -2.155 -2.261 167 HB VAL 19 HB VAL 19 9.407 -0.773 -0.609 168 HG11 VAL 19 HG11 VAL 19 7.664 0.542 -2.708 169 HG12 VAL 19 HG12 VAL 19 8.487 1.408 -1.399 170 HG13 VAL 19 HG13 VAL 19 9.441 0.585 -2.617 171 HG21 VAL 19 HG21 VAL 19 7.394 0.131 0.443 172 HG22 VAL 19 HG22 VAL 19 6.370 -0.630 -0.782 173 HG23 VAL 19 HG23 VAL 19 7.277 -1.623 0.377 174 H TYR 20 H TYR 20 7.366 -1.500 -4.241 175 HA TYR 20 HA TYR 20 9.935 -1.402 -5.781 176 HB2 TYR 20 HB2 TYR 20 7.210 -2.149 -6.893 177 HB3 TYR 20 HB3 TYR 20 8.771 -2.277 -7.683 178 HD1 TYR 20 HD1 TYR 20 6.241 -4.198 -6.407 179 HD2 TYR 20 HD2 TYR 20 10.499 -3.739 -6.019 180 HE1 TYR 20 HE1 TYR 20 6.419 -6.543 -5.646 181 HE2 TYR 20 HE2 TYR 20 10.660 -6.089 -5.136 182 HH TYR 20 HH TYR 20 7.811 -8.205 -4.838 183 H ARG 21 H ARG 21 10.282 0.831 -5.828 184 HA ARG 21 HA ARG 21 8.358 2.869 -6.539 185 HB2 ARG 21 HB2 ARG 21 11.348 2.597 -7.058 186 HB3 ARG 21 HB3 ARG 21 10.421 4.045 -7.458 187 HG2 ARG 21 HG2 ARG 21 9.931 4.527 -5.179 188 HG3 ARG 21 HG3 ARG 21 10.436 2.930 -4.626 189 HD2 ARG 21 HD2 ARG 21 12.060 4.713 -4.066 190 HD3 ARG 21 HD3 ARG 21 12.752 3.405 -5.000 191 HE ARG 21 HE ARG 21 12.141 6.158 -5.978 192 HH11 ARG 21 HH11 ARG 21 13.342 6.953 -7.639 193 HH12 ARG 21 HH12 ARG 21 14.460 5.928 -8.488 194 HH21 ARG 21 HH21 ARG 21 13.837 3.092 -6.652 195 HH22 ARG 21 HH22 ARG 21 14.739 3.846 -7.933 196 H ILE 22 H ILE 22 7.396 3.408 -8.386 197 HA ILE 22 HA ILE 22 8.045 1.848 -10.844 198 HB ILE 22 HB ILE 22 5.750 1.604 -11.381 199 HG12 ILE 22 HG12 ILE 22 5.148 3.345 -8.964 200 HG13 ILE 22 HG13 ILE 22 4.718 3.631 -10.654 201 HG21 ILE 22 HG21 ILE 22 6.012 0.889 -8.476 202 HG22 ILE 22 HG22 ILE 22 5.064 0.063 -9.702 203 HG23 ILE 22 HG23 ILE 22 6.837 0.002 -9.778 204 HD11 ILE 22 HD11 ILE 22 3.516 1.587 -8.766 205 HD12 ILE 22 HD12 ILE 22 2.733 2.974 -9.533 206 HD13 ILE 22 HD13 ILE 22 3.222 1.587 -10.527 207 HA PRO 23 HA PRO 23 7.993 5.791 -12.912 208 HB2 PRO 23 HB2 PRO 23 7.880 4.934 -15.568 209 HB3 PRO 23 HB3 PRO 23 9.331 5.143 -14.555 210 HG2 PRO 23 HG2 PRO 23 7.930 2.619 -15.305 211 HG3 PRO 23 HG3 PRO 23 9.640 2.884 -14.895 212 HD2 PRO 23 HD2 PRO 23 7.698 1.793 -13.180 213 HD3 PRO 23 HD3 PRO 23 9.265 2.479 -12.674 214 HA PRO 24 HA PRO 24 3.871 5.822 -15.213 215 HB2 PRO 24 HB2 PRO 24 2.076 3.783 -15.243 216 HB3 PRO 24 HB3 PRO 24 3.530 3.796 -16.290 217 HG2 PRO 24 HG2 PRO 24 3.204 2.433 -13.588 218 HG3 PRO 24 HG3 PRO 24 3.784 1.711 -15.125 219 HD2 PRO 24 HD2 PRO 24 5.503 2.649 -13.251 220 HD3 PRO 24 HD3 PRO 24 5.834 2.857 -14.997 221 H ARG 25 H ARG 25 1.847 6.614 -14.681 222 HA ARG 25 HA ARG 25 0.824 6.283 -11.876 223 HB2 ARG 25 HB2 ARG 25 -0.311 8.372 -12.118 224 HB3 ARG 25 HB3 ARG 25 1.404 8.590 -12.471 225 HG2 ARG 25 HG2 ARG 25 0.894 8.625 -14.915 226 HG3 ARG 25 HG3 ARG 25 -0.811 8.323 -14.564 227 HD2 ARG 25 HD2 ARG 25 -0.526 10.673 -15.006 228 HD3 ARG 25 HD3 ARG 25 -0.935 10.446 -13.297 229 HE ARG 25 HE ARG 25 1.942 10.560 -13.771 230 HH11 ARG 25 HH11 ARG 25 3.121 12.291 -13.031 231 HH12 ARG 25 HH12 ARG 25 2.318 13.774 -12.610 232 HH21 ARG 25 HH21 ARG 25 -0.837 12.650 -13.346 233 HH22 ARG 25 HH22 ARG 25 0.135 13.979 -12.775 234 H ALA 26 H ALA 26 0.009 5.668 -15.166 235 HA ALA 26 HA ALA 26 -2.310 4.081 -14.414 236 HB1 ALA 26 HB1 ALA 26 -3.233 6.382 -14.273 237 HB2 ALA 26 HB2 ALA 26 -2.687 6.712 -15.924 238 HB3 ALA 26 HB3 ALA 26 -3.946 5.478 -15.631 239 H SER 27 H SER 27 -1.683 2.412 -15.445 240 HA SER 27 HA SER 27 -1.033 2.513 -18.347 241 HB2 SER 27 HB2 SER 27 0.405 1.127 -16.795 242 HB3 SER 27 HB3 SER 27 -1.002 0.075 -16.545 243 HG SER 27 HG SER 27 0.321 0.697 -19.004 244 H ASN 28 H ASN 28 -2.110 0.984 -19.694 245 HA ASN 28 HA ASN 28 -4.834 1.444 -19.907 246 HB2 ASN 28 HB2 ASN 28 -4.718 0.122 -21.871 247 HB3 ASN 28 HB3 ASN 28 -3.161 0.916 -21.716 248 HD21 ASN 28 HD21 ASN 28 -1.570 -2.347 -20.908 249 HD22 ASN 28 HD22 ASN 28 -1.582 -0.780 -20.134 250 H ARG 29 H ARG 29 -3.371 -1.228 -18.177 251 HA ARG 29 HA ARG 29 -6.071 -2.455 -17.675 252 HB2 ARG 29 HB2 ARG 29 -3.416 -3.747 -17.031 253 HB3 ARG 29 HB3 ARG 29 -4.996 -4.510 -17.170 254 HG2 ARG 29 HG2 ARG 29 -3.223 -3.461 -19.385 255 HG3 ARG 29 HG3 ARG 29 -3.625 -5.143 -19.038 256 HD2 ARG 29 HD2 ARG 29 -6.044 -4.612 -19.596 257 HD3 ARG 29 HD3 ARG 29 -5.515 -2.988 -20.054 258 HE ARG 29 HE ARG 29 -4.415 -3.769 -21.933 259 HH11 ARG 29 HH11 ARG 29 -4.219 -5.130 -23.653 260 HH12 ARG 29 HH12 ARG 29 -4.739 -6.788 -23.537 261 HH21 ARG 29 HH21 ARG 29 -5.819 -6.538 -20.287 262 HH22 ARG 29 HH22 ARG 29 -5.629 -7.570 -21.677 263 H GLY 30 H GLY 30 -4.193 -0.253 -16.284 264 HA2 GLY 30 HA2 GLY 30 -4.897 0.421 -13.927 265 HA3 GLY 30 HA3 GLY 30 -4.458 -1.238 -13.464 266 H TYR 31 H TYR 31 -2.303 -1.807 -13.303 267 HA TYR 31 HA TYR 31 -0.191 0.212 -14.025 268 HB2 TYR 31 HB2 TYR 31 -0.557 -1.224 -11.384 269 HB3 TYR 31 HB3 TYR 31 0.968 -0.528 -11.901 270 HD1 TYR 31 HD1 TYR 31 1.360 1.827 -12.098 271 HD2 TYR 31 HD2 TYR 31 -2.422 0.251 -10.734 272 HE1 TYR 31 HE1 TYR 31 0.853 3.997 -11.012 273 HE2 TYR 31 HE2 TYR 31 -2.966 2.458 -9.697 274 HH TYR 31 HH TYR 31 -0.683 5.209 -9.770 275 H ARG 32 H ARG 32 -0.986 -3.175 -13.420 276 HA ARG 32 HA ARG 32 0.039 -5.104 -13.449 277 HB2 ARG 32 HB2 ARG 32 1.464 -4.635 -15.980 278 HB3 ARG 32 HB3 ARG 32 0.327 -5.867 -15.469 279 HG2 ARG 32 HG2 ARG 32 -1.053 -4.966 -16.982 280 HG3 ARG 32 HG3 ARG 32 -1.386 -3.736 -15.780 281 HD2 ARG 32 HD2 ARG 32 -0.908 -2.547 -17.758 282 HD3 ARG 32 HD3 ARG 32 0.565 -2.411 -16.775 283 HE ARG 32 HE ARG 32 0.573 -4.697 -18.614 284 HH11 ARG 32 HH11 ARG 32 2.367 -4.813 -19.973 285 HH12 ARG 32 HH12 ARG 32 3.231 -3.345 -20.346 286 HH21 ARG 32 HH21 ARG 32 1.220 -1.263 -18.569 287 HH22 ARG 32 HH22 ARG 32 2.783 -1.493 -19.357 288 H ALA 33 H ALA 33 1.520 -5.659 -11.938 289 HA ALA 33 HA ALA 33 4.015 -4.499 -11.459 290 HB1 ALA 33 HB1 ALA 33 4.503 -6.482 -10.148 291 HB2 ALA 33 HB2 ALA 33 2.797 -6.077 -9.945 292 HB3 ALA 33 HB3 ALA 33 3.261 -7.420 -11.001 293 H SER 34 H SER 34 3.215 -6.807 -13.923 294 HA SER 34 HA SER 34 5.814 -7.742 -14.659 295 HB2 SER 34 HB2 SER 34 3.507 -8.693 -15.175 296 HB3 SER 34 HB3 SER 34 3.330 -7.415 -16.387 297 HG SER 34 HG SER 34 4.138 -9.297 -17.357 298 H ASP 35 H ASP 35 4.216 -4.650 -15.332 299 HA ASP 35 HA ASP 35 5.785 -3.980 -17.702 300 HB2 ASP 35 HB2 ASP 35 3.510 -3.099 -17.153 301 HB3 ASP 35 HB3 ASP 35 4.192 -2.227 -15.793 302 H TRP 36 H TRP 36 6.082 -3.469 -14.239 303 HA TRP 36 HA TRP 36 8.673 -2.018 -14.537 304 HB2 TRP 36 HB2 TRP 36 7.954 -1.118 -12.171 305 HB3 TRP 36 HB3 TRP 36 7.441 -0.412 -13.675 306 HD1 TRP 36 HD1 TRP 36 5.000 -0.391 -14.317 307 HE1 TRP 36 HE1 TRP 36 2.804 -1.023 -13.184 308 HE3 TRP 36 HE3 TRP 36 6.882 -2.857 -10.246 309 HZ2 TRP 36 HZ2 TRP 36 1.996 -1.975 -10.537 310 HZ3 TRP 36 HZ3 TRP 36 5.379 -3.600 -8.429 311 HH2 TRP 36 HH2 TRP 36 2.942 -3.131 -8.534 312 H LYS 37 H LYS 37 9.115 -2.326 -11.596 313 HA LYS 37 HA LYS 37 10.570 -4.877 -11.773 314 HB2 LYS 37 HB2 LYS 37 10.409 -2.914 -9.445 315 HB3 LYS 37 HB3 LYS 37 11.577 -4.218 -9.683 316 HG2 LYS 37 HG2 LYS 37 12.188 -2.976 -11.912 317 HG3 LYS 37 HG3 LYS 37 11.325 -1.601 -11.213 318 HD2 LYS 37 HD2 LYS 37 13.802 -3.005 -10.178 319 HD3 LYS 37 HD3 LYS 37 13.680 -1.342 -10.746 320 HE2 LYS 37 HE2 LYS 37 12.265 -2.446 -8.281 321 HE3 LYS 37 HE3 LYS 37 13.853 -1.705 -8.225 322 HZ1 LYS 37 HZ1 LYS 37 11.375 -0.287 -9.097 323 HZ2 LYS 37 HZ2 LYS 37 12.155 -0.105 -7.667 324 HZ3 LYS 37 HZ3 LYS 37 12.881 0.365 -9.050 325 H LEU 38 H LEU 38 9.666 -6.516 -11.684 326 HA LEU 38 HA LEU 38 7.245 -7.083 -10.265 327 HB2 LEU 38 HB2 LEU 38 7.751 -7.665 -12.611 328 HB3 LEU 38 HB3 LEU 38 9.165 -8.590 -12.100 329 HG LEU 38 HG LEU 38 7.736 -10.130 -10.916 330 HD11 LEU 38 HD11 LEU 38 5.295 -10.221 -11.380 331 HD12 LEU 38 HD12 LEU 38 5.696 -8.690 -10.605 332 HD13 LEU 38 HD13 LEU 38 5.417 -8.742 -12.357 333 HD21 LEU 38 HD21 LEU 38 8.503 -10.594 -13.204 334 HD22 LEU 38 HD22 LEU 38 6.905 -11.316 -12.925 335 HD23 LEU 38 HD23 LEU 38 7.056 -9.812 -13.865 336 H ASP 39 H ASP 39 10.636 -7.827 -9.550 337 HA ASP 39 HA ASP 39 9.751 -8.728 -6.917 338 HB2 ASP 39 HB2 ASP 39 9.814 -10.785 -8.525 339 HB3 ASP 39 HB3 ASP 39 11.560 -10.656 -8.388 340 H GLN 40 H GLN 40 11.405 -6.501 -8.058 341 HA GLN 40 HA GLN 40 14.041 -7.002 -6.692 342 HB2 GLN 40 HB2 GLN 40 13.545 -5.104 -9.000 343 HB3 GLN 40 HB3 GLN 40 15.076 -5.471 -8.205 344 HG2 GLN 40 HG2 GLN 40 14.736 -7.892 -8.949 345 HG3 GLN 40 HG3 GLN 40 13.376 -7.298 -9.925 346 HE21 GLN 40 HE21 GLN 40 15.503 -5.703 -12.355 347 HE22 GLN 40 HE22 GLN 40 13.875 -5.720 -11.697 348 HA PRO 41 HA PRO 41 11.835 -3.818 -4.320 349 HB2 PRO 41 HB2 PRO 41 12.845 -4.215 -1.824 350 HB3 PRO 41 HB3 PRO 41 11.626 -5.278 -2.596 351 HG2 PRO 41 HG2 PRO 41 14.634 -5.679 -2.487 352 HG3 PRO 41 HG3 PRO 41 13.349 -6.860 -2.078 353 HD2 PRO 41 HD2 PRO 41 14.551 -6.838 -4.521 354 HD3 PRO 41 HD3 PRO 41 12.804 -7.194 -4.351 355 H ASP 42 H ASP 42 12.166 -1.784 -3.705 356 HA ASP 42 HA ASP 42 14.890 -0.578 -3.779 357 HB2 ASP 42 HB2 ASP 42 12.111 0.656 -3.452 358 HB3 ASP 42 HB3 ASP 42 13.618 1.557 -3.562 359 H TRP 43 H TRP 43 12.268 -1.400 -1.608 360 HA TRP 43 HA TRP 43 13.948 -0.973 0.750 361 HB2 TRP 43 HB2 TRP 43 12.866 1.210 0.485 362 HB3 TRP 43 HB3 TRP 43 11.298 0.451 0.260 363 HD1 TRP 43 HD1 TRP 43 13.727 1.535 2.932 364 HE1 TRP 43 HE1 TRP 43 12.635 1.356 5.252 365 HE3 TRP 43 HE3 TRP 43 9.440 -0.946 1.630 366 HZ2 TRP 43 HZ2 TRP 43 10.171 0.369 6.365 367 HZ3 TRP 43 HZ3 TRP 43 7.738 -1.516 3.348 368 HH2 TRP 43 HH2 TRP 43 8.086 -0.848 5.717 369 H THR 44 H THR 44 13.281 -2.290 2.530 370 HA THR 44 HA THR 44 10.687 -3.653 2.398 371 HB THR 44 HB THR 44 11.522 -5.800 2.877 372 HG1 THR 44 HG1 THR 44 13.762 -6.235 3.020 373 HG21 THR 44 HG21 THR 44 12.697 -6.510 0.931 374 HG22 THR 44 HG22 THR 44 11.631 -5.185 0.460 375 HG23 THR 44 HG23 THR 44 13.367 -4.879 0.643 376 H GLY 45 H GLY 45 9.893 -4.364 4.371 377 HA2 GLY 45 HA2 GLY 45 11.162 -3.951 6.897 378 HA3 GLY 45 HA3 GLY 45 10.316 -2.480 6.441 379 H ARG 46 H ARG 46 8.558 -2.376 7.543 380 HA ARG 46 HA ARG 46 6.761 -4.732 8.017 381 HB2 ARG 46 HB2 ARG 46 8.155 -4.186 9.966 382 HB3 ARG 46 HB3 ARG 46 7.581 -2.516 9.949 383 HG2 ARG 46 HG2 ARG 46 5.282 -3.301 10.487 384 HG3 ARG 46 HG3 ARG 46 5.849 -4.978 10.381 385 HD2 ARG 46 HD2 ARG 46 5.746 -4.468 12.681 386 HD3 ARG 46 HD3 ARG 46 7.453 -4.530 12.234 387 HE ARG 46 HE ARG 46 6.064 -1.868 12.331 388 HH11 ARG 46 HH11 ARG 46 6.583 -0.455 13.762 389 HH12 ARG 46 HH12 ARG 46 7.790 -0.763 15.013 390 HH21 ARG 46 HH21 ARG 46 8.446 -3.957 13.880 391 HH22 ARG 46 HH22 ARG 46 8.850 -2.726 15.041 392 H LEU 47 H LEU 47 4.586 -4.381 7.973 393 HA LEU 47 HA LEU 47 3.633 -1.845 6.710 394 HB2 LEU 47 HB2 LEU 47 3.067 -4.038 5.642 395 HB3 LEU 47 HB3 LEU 47 2.368 -4.543 7.172 396 HG LEU 47 HG LEU 47 0.731 -2.523 6.889 397 HD11 LEU 47 HD11 LEU 47 0.245 -1.929 4.582 398 HD12 LEU 47 HD12 LEU 47 1.877 -1.430 5.022 399 HD13 LEU 47 HD13 LEU 47 1.640 -2.877 4.013 400 HD21 LEU 47 HD21 LEU 47 -0.792 -3.922 5.572 401 HD22 LEU 47 HD22 LEU 47 0.570 -4.979 5.123 402 HD23 LEU 47 HD23 LEU 47 0.043 -4.844 6.815 403 H ARG 48 H ARG 48 2.428 -0.384 7.859 404 HA ARG 48 HA ARG 48 0.535 -1.539 9.845 405 HB2 ARG 48 HB2 ARG 48 1.528 1.339 9.891 406 HB3 ARG 48 HB3 ARG 48 0.350 0.619 10.981 407 HG2 ARG 48 HG2 ARG 48 3.272 -0.206 10.776 408 HG3 ARG 48 HG3 ARG 48 2.628 0.919 11.961 409 HD2 ARG 48 HD2 ARG 48 1.375 -1.821 11.779 410 HD3 ARG 48 HD3 ARG 48 2.980 -1.683 12.493 411 HE ARG 48 HE ARG 48 0.452 -0.824 13.645 412 HH11 ARG 48 HH11 ARG 48 0.449 -0.215 15.786 413 HH12 ARG 48 HH12 ARG 48 1.927 0.288 16.548 414 HH21 ARG 48 HH21 ARG 48 3.914 -0.099 13.780 415 HH22 ARG 48 HH22 ARG 48 3.812 0.333 15.461 416 H ILE 49 H ILE 49 -1.519 -1.123 9.507 417 HA ILE 49 HA ILE 49 -2.296 0.979 7.537 418 HB ILE 49 HB ILE 49 -3.780 -1.621 7.995 419 HG12 ILE 49 HG12 ILE 49 -2.148 -0.565 5.642 420 HG13 ILE 49 HG13 ILE 49 -1.841 -2.019 6.595 421 HG21 ILE 49 HG21 ILE 49 -4.457 0.643 6.090 422 HG22 ILE 49 HG22 ILE 49 -5.389 -0.850 6.385 423 HG23 ILE 49 HG23 ILE 49 -5.272 0.353 7.650 424 HD11 ILE 49 HD11 ILE 49 -2.736 -2.702 4.510 425 HD12 ILE 49 HD12 ILE 49 -4.004 -2.976 5.715 426 HD13 ILE 49 HD13 ILE 49 -4.087 -1.565 4.610 427 H THR 50 H THR 50 -3.418 2.519 8.466 428 HA THR 50 HA THR 50 -4.792 2.058 11.087 429 HB THR 50 HB THR 50 -3.939 4.147 11.914 430 HG1 THR 50 HG1 THR 50 -2.284 5.209 10.645 431 HG21 THR 50 HG21 THR 50 -1.634 3.683 12.290 432 HG22 THR 50 HG22 THR 50 -2.416 2.103 12.142 433 HG23 THR 50 HG23 THR 50 -1.485 2.751 10.783 434 H SER 51 H SER 51 -6.327 4.041 11.501 435 HA SER 51 HA SER 51 -7.096 5.539 9.118 436 HB2 SER 51 HB2 SER 51 -9.467 4.931 9.247 437 HB3 SER 51 HB3 SER 51 -8.448 3.561 8.804 438 HG SER 51 HG SER 51 -9.302 4.086 11.476 439 H LYS 52 H LYS 52 -7.486 7.530 9.640 440 HA LYS 52 HA LYS 52 -8.379 8.351 12.361 441 HB2 LYS 52 HB2 LYS 52 -6.462 9.436 11.229 442 HB3 LYS 52 HB3 LYS 52 -7.577 10.014 9.967 443 HG2 LYS 52 HG2 LYS 52 -8.879 11.102 11.966 444 HG3 LYS 52 HG3 LYS 52 -7.396 10.815 12.876 445 HD2 LYS 52 HD2 LYS 52 -7.785 12.447 10.355 446 HD3 LYS 52 HD3 LYS 52 -7.333 13.045 11.972 447 HE2 LYS 52 HE2 LYS 52 -5.126 12.057 11.769 448 HE3 LYS 52 HE3 LYS 52 -5.583 11.202 10.294 449 HZ1 LYS 52 HZ1 LYS 52 -4.307 13.193 9.797 450 HZ2 LYS 52 HZ2 LYS 52 -5.819 13.363 9.193 451 HZ3 LYS 52 HZ3 LYS 52 -5.361 14.155 10.565 452 H GLY 53 H GLY 53 -10.245 6.994 11.799 453 HA2 GLY 53 HA2 GLY 53 -12.592 6.955 11.665 454 HA3 GLY 53 HA3 GLY 53 -12.583 8.614 11.071 455 H LYS 54 H LYS 54 -13.457 8.712 9.106 456 HA LYS 54 HA LYS 54 -13.614 6.495 7.217 457 HB2 LYS 54 HB2 LYS 54 -15.463 8.013 7.701 458 HB3 LYS 54 HB3 LYS 54 -14.540 9.395 7.149 459 HG2 LYS 54 HG2 LYS 54 -14.931 7.267 5.082 460 HG3 LYS 54 HG3 LYS 54 -16.416 7.951 5.738 461 HD2 LYS 54 HD2 LYS 54 -15.542 10.266 5.277 462 HD3 LYS 54 HD3 LYS 54 -14.189 9.530 4.399 463 HE2 LYS 54 HE2 LYS 54 -15.813 8.394 2.892 464 HE3 LYS 54 HE3 LYS 54 -17.153 9.120 3.801 465 HZ1 LYS 54 HZ1 LYS 54 -15.112 10.562 2.194 466 HZ2 LYS 54 HZ2 LYS 54 -16.716 10.479 1.882 467 HZ3 LYS 54 HZ3 LYS 54 -16.190 11.330 3.171 468 H THR 55 H THR 55 -10.944 7.668 7.846 469 HA THR 55 HA THR 55 -9.967 7.677 5.029 470 HB THR 55 HB THR 55 -8.696 9.377 7.202 471 HG1 THR 55 HG1 THR 55 -10.659 10.330 6.872 472 HG21 THR 55 HG21 THR 55 -7.340 8.748 5.207 473 HG22 THR 55 HG22 THR 55 -8.636 9.345 4.145 474 HG23 THR 55 HG23 THR 55 -7.724 10.482 5.175 475 H ALA 56 H ALA 56 -8.699 5.926 4.795 476 HA ALA 56 HA ALA 56 -7.293 4.745 7.122 477 HB1 ALA 56 HB1 ALA 56 -8.449 3.101 5.823 478 HB2 ALA 56 HB2 ALA 56 -7.746 3.701 4.309 479 HB3 ALA 56 HB3 ALA 56 -6.723 2.903 5.522 480 H TYR 57 H TYR 57 -4.986 4.267 6.928 481 HA TYR 57 HA TYR 57 -3.488 5.829 4.900 482 HB2 TYR 57 HB2 TYR 57 -2.925 5.884 7.882 483 HB3 TYR 57 HB3 TYR 57 -1.904 6.560 6.621 484 HD1 TYR 57 HD1 TYR 57 -2.250 8.785 5.819 485 HD2 TYR 57 HD2 TYR 57 -5.263 6.898 8.271 486 HE1 TYR 57 HE1 TYR 57 -3.448 10.953 6.038 487 HE2 TYR 57 HE2 TYR 57 -6.509 9.024 8.371 488 HH TYR 57 HH TYR 57 -5.304 12.028 6.828 489 H ILE 58 H ILE 58 -2.039 4.554 3.955 490 HA ILE 58 HA ILE 58 -1.207 1.990 5.242 491 HB ILE 58 HB ILE 58 -0.293 3.005 2.540 492 HG12 ILE 58 HG12 ILE 58 -2.674 3.011 2.298 493 HG13 ILE 58 HG13 ILE 58 -1.957 1.690 1.404 494 HG21 ILE 58 HG21 ILE 58 -0.428 0.270 3.846 495 HG22 ILE 58 HG22 ILE 58 0.094 0.587 2.175 496 HG23 ILE 58 HG23 ILE 58 1.031 1.228 3.525 497 HD11 ILE 58 HD11 ILE 58 -4.045 1.050 2.497 498 HD12 ILE 58 HD12 ILE 58 -2.690 0.075 3.102 499 HD13 ILE 58 HD13 ILE 58 -3.356 1.400 4.093 500 H LYS 59 H LYS 59 0.288 2.403 6.795 501 HA LYS 59 HA LYS 59 2.476 4.387 6.210 502 HB2 LYS 59 HB2 LYS 59 1.384 3.615 8.940 503 HB3 LYS 59 HB3 LYS 59 2.657 4.789 8.579 504 HG2 LYS 59 HG2 LYS 59 0.828 5.906 7.042 505 HG3 LYS 59 HG3 LYS 59 -0.315 4.963 8.003 506 HD2 LYS 59 HD2 LYS 59 0.515 6.090 10.071 507 HD3 LYS 59 HD3 LYS 59 1.696 6.989 9.084 508 HE2 LYS 59 HE2 LYS 59 -0.293 7.800 7.687 509 HE3 LYS 59 HE3 LYS 59 -1.349 7.156 8.956 510 HZ1 LYS 59 HZ1 LYS 59 0.744 9.225 9.330 511 HZ2 LYS 59 HZ2 LYS 59 -0.854 9.526 9.230 512 HZ3 LYS 59 HZ3 LYS 59 -0.312 8.703 10.517 513 H LEU 60 H LEU 60 4.405 3.631 5.881 514 HA LEU 60 HA LEU 60 4.948 0.759 6.491 515 HB2 LEU 60 HB2 LEU 60 6.161 2.729 4.518 516 HB3 LEU 60 HB3 LEU 60 6.707 1.068 4.730 517 HG LEU 60 HG LEU 60 3.886 1.840 3.847 518 HD11 LEU 60 HD11 LEU 60 4.611 1.065 1.620 519 HD12 LEU 60 HD12 LEU 60 5.560 2.458 2.161 520 HD13 LEU 60 HD13 LEU 60 6.258 0.825 2.249 521 HD21 LEU 60 HD21 LEU 60 3.959 -0.374 4.922 522 HD22 LEU 60 HD22 LEU 60 3.738 -0.550 3.179 523 HD23 LEU 60 HD23 LEU 60 5.335 -0.846 3.905 524 H GLU 61 H GLU 61 6.506 0.113 7.838 525 HA GLU 61 HA GLU 61 8.119 2.202 9.254 526 HB2 GLU 61 HB2 GLU 61 6.800 -0.302 10.360 527 HB3 GLU 61 HB3 GLU 61 7.848 0.797 11.258 528 HG2 GLU 61 HG2 GLU 61 6.203 2.648 10.794 529 HG3 GLU 61 HG3 GLU 61 5.105 1.434 10.121 530 H ASP 62 H ASP 62 10.205 1.581 10.120 531 HA ASP 62 HA ASP 62 11.654 -0.485 8.724 532 HB2 ASP 62 HB2 ASP 62 12.697 1.573 9.583 533 HB3 ASP 62 HB3 ASP 62 12.268 1.119 11.237 534 H LYS 63 H LYS 63 12.331 -2.505 9.544 535 HA LYS 63 HA LYS 63 10.176 -3.920 10.842 536 HB2 LYS 63 HB2 LYS 63 11.583 -4.686 8.915 537 HB3 LYS 63 HB3 LYS 63 12.953 -4.870 10.010 538 HG2 LYS 63 HG2 LYS 63 11.795 -6.629 11.237 539 HG3 LYS 63 HG3 LYS 63 10.303 -6.367 10.317 540 HD2 LYS 63 HD2 LYS 63 12.946 -7.178 9.023 541 HD3 LYS 63 HD3 LYS 63 11.768 -8.353 9.628 542 HE2 LYS 63 HE2 LYS 63 10.056 -7.525 8.104 543 HE3 LYS 63 HE3 LYS 63 11.116 -6.236 7.532 544 HZ1 LYS 63 HZ1 LYS 63 11.071 -8.204 6.052 545 HZ2 LYS 63 HZ2 LYS 63 12.589 -7.883 6.589 546 HZ3 LYS 63 HZ3 LYS 63 11.733 -9.121 7.228 547 H VAL 64 H VAL 64 12.953 -2.365 12.098 548 HA VAL 64 HA VAL 64 12.705 -3.801 14.718 549 HB VAL 64 HB VAL 64 15.190 -3.386 14.890 550 HG11 VAL 64 HG11 VAL 64 14.159 -5.633 14.690 551 HG12 VAL 64 HG12 VAL 64 14.240 -5.508 12.918 552 HG13 VAL 64 HG13 VAL 64 15.732 -5.569 13.882 553 HG21 VAL 64 HG21 VAL 64 15.626 -2.011 12.939 554 HG22 VAL 64 HG22 VAL 64 16.574 -3.499 12.904 555 HG23 VAL 64 HG23 VAL 64 15.147 -3.349 11.864 556 H SER 65 H SER 65 13.379 -0.730 13.088 557 HA SER 65 HA SER 65 13.573 0.557 15.777 558 HB2 SER 65 HB2 SER 65 14.294 1.591 13.017 559 HB3 SER 65 HB3 SER 65 14.462 2.499 14.536 560 HG SER 65 HG SER 65 16.416 1.454 13.916 561 H GLY 66 H GLY 66 11.232 -0.046 13.450 562 HA2 GLY 66 HA2 GLY 66 9.094 0.700 13.141 563 HA3 GLY 66 HA3 GLY 66 9.225 1.553 14.684 564 H GLU 67 H GLU 67 11.540 2.539 12.305 565 HA GLU 67 HA GLU 67 10.472 5.241 12.361 566 HB2 GLU 67 HB2 GLU 67 12.798 4.039 10.812 567 HB3 GLU 67 HB3 GLU 67 12.389 5.760 10.852 568 HG2 GLU 67 HG2 GLU 67 12.655 5.755 13.334 569 HG3 GLU 67 HG3 GLU 67 13.149 4.063 13.264 570 H LEU 68 H LEU 68 9.406 6.439 10.798 571 HA LEU 68 HA LEU 68 7.861 4.936 8.913 572 HB2 LEU 68 HB2 LEU 68 7.099 6.997 10.167 573 HB3 LEU 68 HB3 LEU 68 8.151 7.951 9.123 574 HG LEU 68 HG LEU 68 6.822 6.971 7.130 575 HD11 LEU 68 HD11 LEU 68 4.850 6.309 9.367 576 HD12 LEU 68 HD12 LEU 68 4.534 6.218 7.621 577 HD13 LEU 68 HD13 LEU 68 5.692 5.114 8.365 578 HD21 LEU 68 HD21 LEU 68 6.543 9.282 7.924 579 HD22 LEU 68 HD22 LEU 68 5.002 8.588 7.400 580 HD23 LEU 68 HD23 LEU 68 5.362 8.735 9.136 581 H PHE 69 H PHE 69 8.432 4.250 6.995 582 HA PHE 69 HA PHE 69 10.580 5.451 5.342 583 HB2 PHE 69 HB2 PHE 69 10.514 3.099 5.356 584 HB3 PHE 69 HB3 PHE 69 8.770 3.042 5.155 585 HD1 PHE 69 HD1 PHE 69 11.650 4.629 3.266 586 HD2 PHE 69 HD2 PHE 69 8.083 2.220 3.107 587 HE1 PHE 69 HE1 PHE 69 11.866 4.466 0.812 588 HE2 PHE 69 HE2 PHE 69 8.303 2.044 0.658 589 HZ PHE 69 HZ PHE 69 10.177 3.174 -0.522 590 H ALA 70 H ALA 70 7.042 4.894 5.049 591 HA ALA 70 HA ALA 70 6.648 7.421 3.644 592 HB1 ALA 70 HB1 ALA 70 6.128 4.773 2.203 593 HB2 ALA 70 HB2 ALA 70 5.734 6.397 1.605 594 HB3 ALA 70 HB3 ALA 70 7.426 5.919 1.801 595 H GLN 71 H GLN 71 4.357 7.832 3.202 596 HA GLN 71 HA GLN 71 2.419 6.004 4.424 597 HB2 GLN 71 HB2 GLN 71 1.265 7.808 5.650 598 HB3 GLN 71 HB3 GLN 71 2.846 7.371 6.295 599 HG2 GLN 71 HG2 GLN 71 3.824 9.396 5.154 600 HG3 GLN 71 HG3 GLN 71 2.194 9.864 4.663 601 HE21 GLN 71 HE21 GLN 71 3.088 11.657 7.836 602 HE22 GLN 71 HE22 GLN 71 3.783 11.588 6.225 603 H ALA 72 H ALA 72 0.629 5.761 3.220 604 HA ALA 72 HA ALA 72 0.038 7.784 1.094 605 HB1 ALA 72 HB1 ALA 72 -0.571 4.815 1.113 606 HB2 ALA 72 HB2 ALA 72 -1.054 5.976 -0.139 607 HB3 ALA 72 HB3 ALA 72 0.659 5.650 0.133 608 HA PRO 73 HA PRO 73 -3.800 8.103 3.586 609 HB2 PRO 73 HB2 PRO 73 -4.768 10.437 2.595 610 HB3 PRO 73 HB3 PRO 73 -3.358 10.378 3.694 611 HG2 PRO 73 HG2 PRO 73 -3.345 10.623 0.676 612 HG3 PRO 73 HG3 PRO 73 -2.401 11.560 1.873 613 HD2 PRO 73 HD2 PRO 73 -1.412 9.365 0.524 614 HD3 PRO 73 HD3 PRO 73 -0.868 9.821 2.167 615 H VAL 74 H VAL 74 -5.561 6.934 3.138 616 HA VAL 74 HA VAL 74 -6.586 6.682 0.336 617 HB VAL 74 HB VAL 74 -6.646 4.616 2.560 618 HG11 VAL 74 HG11 VAL 74 -7.522 4.398 -0.336 619 HG12 VAL 74 HG12 VAL 74 -7.502 3.081 0.861 620 HG13 VAL 74 HG13 VAL 74 -8.602 4.432 1.074 621 HG21 VAL 74 HG21 VAL 74 -5.114 3.270 1.365 622 HG22 VAL 74 HG22 VAL 74 -5.030 4.412 0.026 623 HG23 VAL 74 HG23 VAL 74 -4.359 4.846 1.613 624 H GLU 75 H GLU 75 -8.518 7.519 0.014 625 HA GLU 75 HA GLU 75 -10.483 7.721 2.268 626 HB2 GLU 75 HB2 GLU 75 -9.279 9.806 1.543 627 HB3 GLU 75 HB3 GLU 75 -10.084 9.699 -0.006 628 HG2 GLU 75 HG2 GLU 75 -11.689 9.704 2.580 629 HG3 GLU 75 HG3 GLU 75 -10.952 11.199 2.027 630 H GLN 76 H GLN 76 -9.951 5.888 -0.323 631 HA GLN 76 HA GLN 76 -12.646 5.034 -0.464 632 HB2 GLN 76 HB2 GLN 76 -13.144 5.290 -2.762 633 HB3 GLN 76 HB3 GLN 76 -12.710 6.885 -2.182 634 HG2 GLN 76 HG2 GLN 76 -10.968 5.052 -3.875 635 HG3 GLN 76 HG3 GLN 76 -11.866 6.443 -4.435 636 HE21 GLN 76 HE21 GLN 76 -8.238 7.047 -2.666 637 HE22 GLN 76 HE22 GLN 76 -9.011 5.451 -2.546 638 H TYR 77 H TYR 77 -12.744 2.871 -1.155 639 HA TYR 77 HA TYR 77 -10.252 1.662 -2.211 640 HB2 TYR 77 HB2 TYR 77 -10.368 1.227 0.186 641 HB3 TYR 77 HB3 TYR 77 -11.911 0.366 -0.037 642 HD1 TYR 77 HD1 TYR 77 -11.879 -1.882 -1.268 643 HD2 TYR 77 HD2 TYR 77 -8.347 0.442 -0.582 644 HE1 TYR 77 HE1 TYR 77 -10.502 -3.715 -2.199 645 HE2 TYR 77 HE2 TYR 77 -6.931 -1.385 -1.485 646 HH TYR 77 HH TYR 77 -8.370 -4.294 -3.000 647 HA PRO 78 HA PRO 78 -9.446 0.321 -3.642 648 HB2 PRO 78 HB2 PRO 78 -9.341 -0.176 -6.300 649 HB3 PRO 78 HB3 PRO 78 -9.602 -1.473 -5.093 650 HG2 PRO 78 HG2 PRO 78 -11.705 0.005 -6.718 651 HG3 PRO 78 HG3 PRO 78 -11.508 -1.768 -6.522 652 HD2 PRO 78 HD2 PRO 78 -13.259 -0.340 -4.997 653 HD3 PRO 78 HD3 PRO 78 -12.336 -1.709 -4.310 654 H GLY 79 H GLY 79 -8.113 1.892 -4.915 655 HA2 GLY 79 HA2 GLY 79 -9.443 4.045 -6.395 656 HA3 GLY 79 HA3 GLY 79 -8.941 4.504 -4.769 657 H ILE 80 H ILE 80 -7.587 6.095 -5.777 658 HA ILE 80 HA ILE 80 -5.322 5.219 -7.409 659 HB ILE 80 HB ILE 80 -6.466 7.368 -7.767 660 HG12 ILE 80 HG12 ILE 80 -4.538 8.827 -8.048 661 HG13 ILE 80 HG13 ILE 80 -3.572 7.846 -6.949 662 HG21 ILE 80 HG21 ILE 80 -5.234 8.311 -5.138 663 HG22 ILE 80 HG22 ILE 80 -6.137 9.293 -6.298 664 HG23 ILE 80 HG23 ILE 80 -6.968 8.013 -5.415 665 HD11 ILE 80 HD11 ILE 80 -4.726 6.829 -9.587 666 HD12 ILE 80 HD12 ILE 80 -3.086 7.475 -9.385 667 HD13 ILE 80 HD13 ILE 80 -3.550 5.995 -8.537 668 H ALA 81 H ALA 81 -5.991 5.841 -4.014 669 HA ALA 81 HA ALA 81 -3.180 5.925 -3.350 670 HB1 ALA 81 HB1 ALA 81 -5.609 5.948 -1.561 671 HB2 ALA 81 HB2 ALA 81 -3.905 6.177 -1.056 672 HB3 ALA 81 HB3 ALA 81 -4.685 7.359 -2.137 673 H VAL 82 H VAL 82 -5.652 3.326 -3.306 674 HA VAL 82 HA VAL 82 -3.340 1.484 -3.111 675 HB VAL 82 HB VAL 82 -4.149 1.664 -0.860 676 HG11 VAL 82 HG11 VAL 82 -6.855 1.001 -1.905 677 HG12 VAL 82 HG12 VAL 82 -6.352 1.117 -0.185 678 HG13 VAL 82 HG13 VAL 82 -6.342 2.534 -1.208 679 HG21 VAL 82 HG21 VAL 82 -4.581 -0.706 -0.484 680 HG22 VAL 82 HG22 VAL 82 -4.968 -0.937 -2.204 681 HG23 VAL 82 HG23 VAL 82 -3.337 -0.481 -1.718 682 H GLU 83 H GLU 83 -3.423 0.150 -4.780 683 HA GLU 83 HA GLU 83 -6.005 -0.765 -5.982 684 HB2 GLU 83 HB2 GLU 83 -4.310 1.247 -7.063 685 HB3 GLU 83 HB3 GLU 83 -3.906 -0.199 -7.972 686 HG2 GLU 83 HG2 GLU 83 -6.736 0.870 -7.586 687 HG3 GLU 83 HG3 GLU 83 -5.690 1.270 -8.949 688 H THR 84 H THR 84 -5.881 -2.695 -7.275 689 HA THR 84 HA THR 84 -3.484 -4.436 -6.719 690 HB THR 84 HB THR 84 -5.935 -5.486 -7.988 691 HG1 THR 84 HG1 THR 84 -6.333 -4.317 -5.806 692 HG21 THR 84 HG21 THR 84 -3.959 -6.910 -7.751 693 HG22 THR 84 HG22 THR 84 -3.918 -6.580 -6.002 694 HG23 THR 84 HG23 THR 84 -5.260 -7.503 -6.702 695 H VAL 85 H VAL 85 -2.196 -3.637 -8.094 696 HA VAL 85 HA VAL 85 -1.333 -3.080 -10.323 697 HB VAL 85 HB VAL 85 -0.355 -5.413 -10.848 698 HG11 VAL 85 HG11 VAL 85 0.783 -3.614 -9.625 699 HG12 VAL 85 HG12 VAL 85 -0.005 -4.101 -8.111 700 HG13 VAL 85 HG13 VAL 85 1.152 -5.177 -8.898 701 HG21 VAL 85 HG21 VAL 85 -2.176 -6.716 -9.513 702 HG22 VAL 85 HG22 VAL 85 -0.491 -7.118 -9.224 703 HG23 VAL 85 HG23 VAL 85 -1.380 -6.105 -8.070 704 H THR 86 H THR 86 -2.978 -6.148 -10.865 705 HA THR 86 HA THR 86 -4.774 -4.901 -12.754 706 HB THR 86 HB THR 86 -4.783 -6.808 -14.340 707 HG1 THR 86 HG1 THR 86 -3.114 -8.186 -14.435 708 HG21 THR 86 HG21 THR 86 -2.043 -5.515 -14.231 709 HG22 THR 86 HG22 THR 86 -2.933 -6.032 -15.686 710 HG23 THR 86 HG23 THR 86 -3.490 -4.618 -14.749 711 H ASP 87 H ASP 87 -3.742 -7.982 -11.262 712 HA ASP 87 HA ASP 87 -6.348 -8.189 -9.884 713 HB2 ASP 87 HB2 ASP 87 -6.617 -9.163 -12.268 714 HB3 ASP 87 HB3 ASP 87 -5.535 -10.447 -11.724 715 H SER 88 H SER 88 -3.525 -10.334 -10.681 716 HA SER 88 HA SER 88 -3.603 -11.816 -8.329 717 HB2 SER 88 HB2 SER 88 -1.959 -12.371 -10.026 718 HB3 SER 88 HB3 SER 88 -0.947 -10.997 -9.517 719 HG SER 88 HG SER 88 -1.329 -13.468 -8.480 720 H SER 89 H SER 89 -3.493 -11.429 -6.330 721 HA SER 89 HA SER 89 -2.885 -8.705 -5.472 722 HB2 SER 89 HB2 SER 89 -4.505 -9.213 -3.723 723 HB3 SER 89 HB3 SER 89 -5.087 -9.500 -5.383 724 HG SER 89 HG SER 89 -5.579 -11.215 -3.799 725 H ARG 90 H ARG 90 -0.925 -11.208 -5.488 726 HA ARG 90 HA ARG 90 0.422 -10.926 -2.904 727 HB2 ARG 90 HB2 ARG 90 0.934 -12.734 -4.525 728 HB3 ARG 90 HB3 ARG 90 1.510 -11.561 -5.699 729 HG2 ARG 90 HG2 ARG 90 2.796 -11.563 -2.966 730 HG3 ARG 90 HG3 ARG 90 3.109 -12.944 -4.010 731 HD2 ARG 90 HD2 ARG 90 4.025 -11.562 -5.760 732 HD3 ARG 90 HD3 ARG 90 3.614 -10.077 -4.895 733 HE ARG 90 HE ARG 90 5.159 -11.219 -3.032 734 HH11 ARG 90 HH11 ARG 90 7.362 -11.176 -2.778 735 HH12 ARG 90 HH12 ARG 90 8.379 -11.107 -4.229 736 HH21 ARG 90 HH21 ARG 90 5.950 -11.083 -6.502 737 HH22 ARG 90 HH22 ARG 90 7.669 -11.052 -6.089 738 H TYR 91 H TYR 91 0.002 -8.927 -5.709 739 HA TYR 91 HA TYR 91 1.872 -6.893 -4.616 740 HB2 TYR 91 HB2 TYR 91 0.761 -7.077 -7.421 741 HB3 TYR 91 HB3 TYR 91 2.024 -5.997 -6.862 742 HD1 TYR 91 HD1 TYR 91 4.270 -6.901 -6.296 743 HD2 TYR 91 HD2 TYR 91 1.222 -9.261 -8.227 744 HE1 TYR 91 HE1 TYR 91 6.005 -8.470 -7.121 745 HE2 TYR 91 HE2 TYR 91 2.953 -10.820 -9.092 746 HH TYR 91 HH TYR 91 6.448 -10.217 -8.492 747 H PHE 92 H PHE 92 1.334 -4.745 -4.772 748 HA PHE 92 HA PHE 92 -1.363 -3.906 -5.589 749 HB2 PHE 92 HB2 PHE 92 -0.224 -3.201 -2.852 750 HB3 PHE 92 HB3 PHE 92 -1.677 -2.507 -3.559 751 HD1 PHE 92 HD1 PHE 92 -3.625 -4.073 -4.187 752 HD2 PHE 92 HD2 PHE 92 -0.347 -5.244 -1.643 753 HE1 PHE 92 HE1 PHE 92 -4.943 -6.018 -3.399 754 HE2 PHE 92 HE2 PHE 92 -1.717 -7.118 -0.763 755 HZ PHE 92 HZ PHE 92 -3.972 -7.568 -1.708 756 H VAL 93 H VAL 93 -1.423 -1.431 -5.526 757 HA VAL 93 HA VAL 93 1.233 -0.110 -5.659 758 HB VAL 93 HB VAL 93 -1.052 0.404 -7.607 759 HG11 VAL 93 HG11 VAL 93 -0.068 2.543 -7.030 760 HG12 VAL 93 HG12 VAL 93 1.582 1.881 -7.179 761 HG13 VAL 93 HG13 VAL 93 0.556 2.058 -8.603 762 HG21 VAL 93 HG21 VAL 93 0.675 -0.150 -9.320 763 HG22 VAL 93 HG22 VAL 93 1.791 -0.616 -8.034 764 HG23 VAL 93 HG23 VAL 93 0.281 -1.525 -8.287 765 H ILE 94 H ILE 94 1.320 1.728 -4.470 766 HA ILE 94 HA ILE 94 -1.219 2.934 -3.587 767 HB ILE 94 HB ILE 94 -0.498 3.271 -1.323 768 HG12 ILE 94 HG12 ILE 94 1.970 1.549 -1.880 769 HG13 ILE 94 HG13 ILE 94 2.013 3.311 -1.835 770 HG21 ILE 94 HG21 ILE 94 -0.145 0.302 -1.990 771 HG22 ILE 94 HG22 ILE 94 -0.696 1.000 -0.460 772 HG23 ILE 94 HG23 ILE 94 -1.694 1.153 -1.888 773 HD11 ILE 94 HD11 ILE 94 1.228 1.502 0.463 774 HD12 ILE 94 HD12 ILE 94 2.698 2.479 0.325 775 HD13 ILE 94 HD13 ILE 94 1.115 3.267 0.489 776 H ARG 95 H ARG 95 -1.204 5.082 -3.114 777 HA ARG 95 HA ARG 95 0.993 6.675 -4.395 778 HB2 ARG 95 HB2 ARG 95 -1.272 6.799 -5.342 779 HB3 ARG 95 HB3 ARG 95 -1.885 7.461 -3.830 780 HG2 ARG 95 HG2 ARG 95 0.293 8.809 -5.473 781 HG3 ARG 95 HG3 ARG 95 -1.440 9.084 -5.703 782 HD2 ARG 95 HD2 ARG 95 -1.543 9.670 -3.202 783 HD3 ARG 95 HD3 ARG 95 0.211 9.727 -3.253 784 HE ARG 95 HE ARG 95 0.175 11.619 -4.690 785 HH11 ARG 95 HH11 ARG 95 -0.597 13.497 -5.259 786 HH12 ARG 95 HH12 ARG 95 -2.310 13.848 -5.204 787 HH21 ARG 95 HH21 ARG 95 -3.129 10.761 -3.883 788 HH22 ARG 95 HH22 ARG 95 -3.734 12.306 -4.412 789 H ILE 96 H ILE 96 2.479 6.938 -2.848 790 HA ILE 96 HA ILE 96 1.778 7.679 -0.076 791 HB ILE 96 HB ILE 96 4.217 7.619 0.307 792 HG12 ILE 96 HG12 ILE 96 4.515 6.358 -2.445 793 HG13 ILE 96 HG13 ILE 96 4.789 8.085 -2.178 794 HG21 ILE 96 HG21 ILE 96 2.968 5.111 -0.881 795 HG22 ILE 96 HG22 ILE 96 4.401 5.121 0.146 796 HG23 ILE 96 HG23 ILE 96 2.860 5.661 0.807 797 HD11 ILE 96 HD11 ILE 96 6.888 6.945 -2.110 798 HD12 ILE 96 HD12 ILE 96 6.499 7.588 -0.497 799 HD13 ILE 96 HD13 ILE 96 6.314 5.848 -0.833 800 H GLN 97 H GLN 97 2.550 9.554 0.992 801 HA GLN 97 HA GLN 97 3.310 11.845 -0.764 802 HB2 GLN 97 HB2 GLN 97 2.322 11.768 2.101 803 HB3 GLN 97 HB3 GLN 97 3.109 13.167 1.372 804 HG2 GLN 97 HG2 GLN 97 1.265 12.656 -0.572 805 HG3 GLN 97 HG3 GLN 97 0.391 12.040 0.830 806 HE21 GLN 97 HE21 GLN 97 1.291 16.073 0.536 807 HE22 GLN 97 HE22 GLN 97 2.311 14.894 -0.298 808 H ASP 98 H ASP 98 5.222 12.957 -0.511 809 HA ASP 98 HA ASP 98 7.411 11.438 0.786 810 HB2 ASP 98 HB2 ASP 98 7.503 12.379 -1.562 811 HB3 ASP 98 HB3 ASP 98 7.539 13.984 -0.824 812 H GLY 99 H GLY 99 5.237 13.595 1.959 813 HA2 GLY 99 HA2 GLY 99 5.120 14.614 4.026 814 HA3 GLY 99 HA3 GLY 99 6.791 14.149 4.339 815 H THR 100 H THR 100 6.406 15.985 1.455 816 HA THR 100 HA THR 100 6.994 18.569 2.811 817 HB THR 100 HB THR 100 9.102 17.464 2.376 818 HG1 THR 100 HG1 THR 100 8.604 19.783 0.845 819 HG21 THR 100 HG21 THR 100 8.422 17.791 -0.561 820 HG22 THR 100 HG22 THR 100 9.991 17.295 0.115 821 HG23 THR 100 HG23 THR 100 8.572 16.254 0.325 822 H GLY 101 H GLY 101 4.588 17.624 1.504 823 HA2 GLY 101 HA2 GLY 101 2.886 18.870 0.498 824 HA3 GLY 101 HA3 GLY 101 4.069 19.993 -0.174 825 H ARG 102 H ARG 102 4.647 16.608 -0.644 826 HA ARG 102 HA ARG 102 3.585 16.583 -3.417 827 HB2 ARG 102 HB2 ARG 102 5.689 16.230 -4.408 828 HB3 ARG 102 HB3 ARG 102 5.852 17.627 -3.326 829 HG2 ARG 102 HG2 ARG 102 6.942 16.127 -1.644 830 HG3 ARG 102 HG3 ARG 102 6.893 14.817 -2.852 831 HD2 ARG 102 HD2 ARG 102 8.222 16.189 -4.414 832 HD3 ARG 102 HD3 ARG 102 8.256 17.514 -3.232 833 HE ARG 102 HE ARG 102 9.307 15.117 -2.023 834 HH11 ARG 102 HH11 ARG 102 11.300 14.834 -1.613 835 HH12 ARG 102 HH12 ARG 102 12.587 15.745 -2.413 836 HH21 ARG 102 HH21 ARG 102 10.339 17.548 -4.346 837 HH22 ARG 102 HH22 ARG 102 12.019 17.282 -3.959 838 H SER 103 H SER 103 4.220 14.423 -4.519 839 HA SER 103 HA SER 103 4.001 12.127 -2.689 840 HB2 SER 103 HB2 SER 103 1.864 11.382 -3.659 841 HB3 SER 103 HB3 SER 103 1.705 12.918 -2.804 842 HG SER 103 HG SER 103 1.880 13.937 -4.922 843 H ALA 104 H ALA 104 3.866 10.053 -3.707 844 HA ALA 104 HA ALA 104 4.891 9.779 -6.468 845 HB1 ALA 104 HB1 ALA 104 6.352 8.720 -4.012 846 HB2 ALA 104 HB2 ALA 104 6.770 8.372 -5.702 847 HB3 ALA 104 HB3 ALA 104 6.916 10.027 -5.077 848 H PHE 105 H PHE 105 4.623 7.731 -7.382 849 HA PHE 105 HA PHE 105 2.780 5.884 -5.954 850 HB2 PHE 105 HB2 PHE 105 3.705 5.809 -8.839 851 HB3 PHE 105 HB3 PHE 105 2.459 4.815 -8.088 852 HD1 PHE 105 HD1 PHE 105 0.331 5.913 -7.215 853 HD2 PHE 105 HD2 PHE 105 3.209 8.024 -9.638 854 HE1 PHE 105 HE1 PHE 105 -1.350 7.664 -7.700 855 HE2 PHE 105 HE2 PHE 105 1.544 9.801 -10.070 856 HZ PHE 105 HZ PHE 105 -0.760 9.617 -9.119 857 H ILE 106 H ILE 106 3.408 4.038 -5.122 858 HA ILE 106 HA ILE 106 5.794 2.662 -6.238 859 HB ILE 106 HB ILE 106 6.487 1.722 -4.148 860 HG12 ILE 106 HG12 ILE 106 4.286 3.495 -2.910 861 HG13 ILE 106 HG13 ILE 106 4.324 1.732 -2.909 862 HG21 ILE 106 HG21 ILE 106 7.610 3.642 -3.235 863 HG22 ILE 106 HG22 ILE 106 7.393 3.965 -4.955 864 HG23 ILE 106 HG23 ILE 106 6.333 4.752 -3.781 865 HD11 ILE 106 HD11 ILE 106 4.845 2.657 -0.724 866 HD12 ILE 106 HD12 ILE 106 6.175 1.702 -1.371 867 HD13 ILE 106 HD13 ILE 106 6.269 3.481 -1.371 868 H GLY 107 H GLY 107 5.572 0.597 -6.604 869 HA2 GLY 107 HA2 GLY 107 3.076 -0.888 -6.196 870 HA3 GLY 107 HA3 GLY 107 4.565 -1.476 -6.932 871 H ILE 108 H ILE 108 3.088 -2.791 -4.920 872 HA ILE 108 HA ILE 108 5.234 -3.060 -2.884 873 HB ILE 108 HB ILE 108 2.234 -3.393 -2.322 874 HG12 ILE 108 HG12 ILE 108 4.325 -1.315 -1.529 875 HG13 ILE 108 HG13 ILE 108 2.812 -1.046 -2.392 876 HG21 ILE 108 HG21 ILE 108 4.655 -3.822 -0.539 877 HG22 ILE 108 HG22 ILE 108 2.953 -3.925 -0.026 878 HG23 ILE 108 HG23 ILE 108 3.574 -5.098 -1.155 879 HD11 ILE 108 HD11 ILE 108 1.570 -1.706 -0.309 880 HD12 ILE 108 HD12 ILE 108 3.146 -1.751 0.541 881 HD13 ILE 108 HD13 ILE 108 2.577 -0.241 -0.157 882 H GLY 109 H GLY 109 5.816 -5.218 -2.486 883 HA2 GLY 109 HA2 GLY 109 4.165 -7.421 -3.627 884 HA3 GLY 109 HA3 GLY 109 5.921 -7.477 -3.780 885 H PHE 110 H PHE 110 3.615 -8.845 -2.121 886 HA PHE 110 HA PHE 110 4.787 -8.688 0.595 887 HB2 PHE 110 HB2 PHE 110 2.320 -9.792 -0.676 888 HB3 PHE 110 HB3 PHE 110 2.811 -10.450 0.870 889 HD1 PHE 110 HD1 PHE 110 1.764 -7.294 -0.824 890 HD2 PHE 110 HD2 PHE 110 2.631 -9.251 2.922 891 HE1 PHE 110 HE1 PHE 110 0.763 -5.381 0.421 892 HE2 PHE 110 HE2 PHE 110 1.540 -7.401 4.148 893 HZ PHE 110 HZ PHE 110 0.671 -5.425 2.893 894 H THR 111 H THR 111 5.148 -10.545 1.867 895 HA THR 111 HA THR 111 6.856 -12.519 0.572 896 HB THR 111 HB THR 111 7.221 -11.300 2.761 897 HG1 THR 111 HG1 THR 111 8.530 -12.849 3.356 898 HG21 THR 111 HG21 THR 111 5.091 -11.809 3.896 899 HG22 THR 111 HG22 THR 111 5.491 -13.544 3.878 900 HG23 THR 111 HG23 THR 111 6.481 -12.418 4.812 901 H ASP 112 H ASP 112 3.570 -12.419 1.708 902 HA ASP 112 HA ASP 112 3.119 -15.222 0.824 903 HB2 ASP 112 HB2 ASP 112 3.336 -14.946 3.406 904 HB3 ASP 112 HB3 ASP 112 1.778 -14.112 3.311 905 H ARG 113 H ARG 113 1.243 -15.530 -0.316 906 HA ARG 113 HA ARG 113 -0.221 -13.292 -1.350 907 HB2 ARG 113 HB2 ARG 113 0.090 -15.465 -2.528 908 HB3 ARG 113 HB3 ARG 113 -0.904 -16.273 -1.318 909 HG2 ARG 113 HG2 ARG 113 -2.151 -15.879 -3.385 910 HG3 ARG 113 HG3 ARG 113 -2.889 -14.998 -2.047 911 HD2 ARG 113 HD2 ARG 113 -1.856 -12.903 -2.800 912 HD3 ARG 113 HD3 ARG 113 -0.960 -13.757 -4.055 913 HE ARG 113 HE ARG 113 -3.757 -12.913 -4.091 914 HH11 ARG 113 HH11 ARG 113 -4.912 -13.074 -5.951 915 HH12 ARG 113 HH12 ARG 113 -4.199 -13.875 -7.357 916 HH21 ARG 113 HH21 ARG 113 -1.419 -14.972 -5.728 917 HH22 ARG 113 HH22 ARG 113 -2.258 -14.818 -7.253 918 H GLY 114 H GLY 114 -0.856 -15.408 1.425 919 HA2 GLY 114 HA2 GLY 114 -3.580 -14.497 1.906 920 HA3 GLY 114 HA3 GLY 114 -2.524 -15.383 3.017 921 H ASP 115 H ASP 115 -0.329 -13.468 3.068 922 HA ASP 115 HA ASP 115 -1.377 -11.521 4.948 923 HB2 ASP 115 HB2 ASP 115 1.363 -11.864 3.725 924 HB3 ASP 115 HB3 ASP 115 0.953 -10.575 4.850 925 H ALA 116 H ALA 116 -0.494 -11.377 1.526 926 HA ALA 116 HA ALA 116 -0.976 -8.552 1.228 927 HB1 ALA 116 HB1 ALA 116 0.333 -10.279 -0.224 928 HB2 ALA 116 HB2 ALA 116 -1.222 -10.635 -0.948 929 HB3 ALA 116 HB3 ALA 116 -0.558 -8.974 -1.023 930 H PHE 117 H PHE 117 -3.061 -11.460 0.629 931 HA PHE 117 HA PHE 117 -5.373 -10.029 -0.207 932 HB2 PHE 117 HB2 PHE 117 -4.975 -12.467 -0.434 933 HB3 PHE 117 HB3 PHE 117 -5.165 -12.655 1.305 934 HD1 PHE 117 HD1 PHE 117 -6.945 -11.641 -1.854 935 HD2 PHE 117 HD2 PHE 117 -7.341 -12.855 2.278 936 HE1 PHE 117 HE1 PHE 117 -9.379 -11.820 -2.146 937 HE2 PHE 117 HE2 PHE 117 -9.791 -13.125 1.947 938 HZ PHE 117 HZ PHE 117 -10.803 -12.623 -0.253 939 H ASP 118 H ASP 118 -4.055 -10.552 3.054 940 HA ASP 118 HA ASP 118 -6.396 -9.520 4.431 941 HB2 ASP 118 HB2 ASP 118 -4.710 -11.230 5.255 942 HB3 ASP 118 HB3 ASP 118 -3.564 -9.906 5.449 943 H PHE 119 H PHE 119 -3.353 -8.105 3.148 944 HA PHE 119 HA PHE 119 -3.668 -5.485 4.213 945 HB2 PHE 119 HB2 PHE 119 -1.617 -5.982 3.211 946 HB3 PHE 119 HB3 PHE 119 -2.327 -6.559 1.733 947 HD1 PHE 119 HD1 PHE 119 -3.388 -4.943 0.086 948 HD2 PHE 119 HD2 PHE 119 -0.890 -3.695 3.337 949 HE1 PHE 119 HE1 PHE 119 -3.124 -2.695 -0.975 950 HE2 PHE 119 HE2 PHE 119 -0.665 -1.468 2.324 951 HZ PHE 119 HZ PHE 119 -1.780 -0.953 0.164 952 H ASN 120 H ASN 120 -4.982 -6.975 1.239 953 HA ASN 120 HA ASN 120 -6.538 -4.682 0.472 954 HB2 ASN 120 HB2 ASN 120 -6.328 -5.901 -1.354 955 HB3 ASN 120 HB3 ASN 120 -6.056 -7.417 -0.464 956 HD21 ASN 120 HD21 ASN 120 -9.872 -6.571 -1.621 957 HD22 ASN 120 HD22 ASN 120 -8.806 -5.218 -1.192 958 H VAL 121 H VAL 121 -7.632 -7.713 2.161 959 HA VAL 121 HA VAL 121 -10.301 -6.712 2.184 960 HB VAL 121 HB VAL 121 -9.026 -9.035 3.645 961 HG11 VAL 121 HG11 VAL 121 -11.991 -8.333 3.492 962 HG12 VAL 121 HG12 VAL 121 -11.339 -9.898 4.029 963 HG13 VAL 121 HG13 VAL 121 -11.005 -8.446 4.968 964 HG21 VAL 121 HG21 VAL 121 -9.179 -9.261 1.184 965 HG22 VAL 121 HG22 VAL 121 -10.300 -10.364 1.975 966 HG23 VAL 121 HG23 VAL 121 -10.907 -8.868 1.242 967 H SER 122 H SER 122 -7.720 -6.310 4.578 968 HA SER 122 HA SER 122 -9.285 -5.239 6.708 969 HB2 SER 122 HB2 SER 122 -6.852 -5.700 6.834 970 HB3 SER 122 HB3 SER 122 -6.542 -4.363 5.708 971 HG SER 122 HG SER 122 -7.711 -4.214 8.311 972 H LEU 123 H LEU 123 -8.292 -3.789 3.607 973 HA LEU 123 HA LEU 123 -9.409 -1.154 4.273 974 HB2 LEU 123 HB2 LEU 123 -8.233 -2.307 1.727 975 HB3 LEU 123 HB3 LEU 123 -8.768 -0.642 1.909 976 HG LEU 123 HG LEU 123 -6.704 -1.774 3.832 977 HD11 LEU 123 HD11 LEU 123 -5.925 -2.230 1.517 978 HD12 LEU 123 HD12 LEU 123 -6.120 -0.512 1.153 979 HD13 LEU 123 HD13 LEU 123 -4.930 -1.050 2.363 980 HD21 LEU 123 HD21 LEU 123 -6.005 0.561 3.980 981 HD22 LEU 123 HD22 LEU 123 -7.220 1.033 2.772 982 HD23 LEU 123 HD23 LEU 123 -7.725 0.417 4.361 983 H GLN 124 H GLN 124 -10.399 -3.976 2.232 984 HA GLN 124 HA GLN 124 -12.796 -2.853 1.209 985 HB2 GLN 124 HB2 GLN 124 -12.306 -5.721 2.127 986 HB3 GLN 124 HB3 GLN 124 -13.740 -5.163 1.263 987 HG2 GLN 124 HG2 GLN 124 -12.258 -4.342 -0.591 988 HG3 GLN 124 HG3 GLN 124 -10.893 -5.126 0.223 989 HE21 GLN 124 HE21 GLN 124 -12.354 -7.439 -2.380 990 HE22 GLN 124 HE22 GLN 124 -11.832 -5.772 -2.474 991 H ASP 125 H ASP 125 -12.299 -4.580 4.338 992 HA ASP 125 HA ASP 125 -14.988 -4.059 5.297 993 HB2 ASP 125 HB2 ASP 125 -13.451 -6.003 5.888 994 HB3 ASP 125 HB3 ASP 125 -12.501 -4.862 6.854 995 H HIS 126 H HIS 126 -12.324 -1.978 5.068 996 HA HIS 126 HA HIS 126 -13.145 -0.284 7.368 997 HB2 HIS 126 HB2 HIS 126 -10.761 -0.375 6.907 998 HB3 HIS 126 HB3 HIS 126 -11.030 0.184 5.251 999 HD2 HIS 126 HD2 HIS 126 -11.763 1.497 8.876 1000 HE1 HIS 126 HE1 HIS 126 -11.033 4.871 6.381 1001 HE2 HIS 126 HE2 HIS 126 -11.577 4.135 8.740 1002 H PHE 127 H PHE 127 -13.317 -0.297 3.785 1003 HA PHE 127 HA PHE 127 -15.007 2.112 3.875 1004 HB2 PHE 127 HB2 PHE 127 -13.807 0.542 1.606 1005 HB3 PHE 127 HB3 PHE 127 -14.969 1.845 1.363 1006 HD1 PHE 127 HD1 PHE 127 -14.481 4.184 2.109 1007 HD2 PHE 127 HD2 PHE 127 -11.513 1.072 2.347 1008 HE1 PHE 127 HE1 PHE 127 -12.724 5.879 2.555 1009 HE2 PHE 127 HE2 PHE 127 -9.753 2.754 2.745 1010 HZ PHE 127 HZ PHE 127 -10.361 5.172 2.864 1011 H LYS 128 H LYS 128 -15.685 -1.295 3.909 1012 HA LYS 128 HA LYS 128 -18.131 -1.326 2.581 1013 HB2 LYS 128 HB2 LYS 128 -18.589 -3.398 3.520 1014 HB3 LYS 128 HB3 LYS 128 -16.858 -3.297 3.374 1015 HG2 LYS 128 HG2 LYS 128 -17.018 -4.248 5.433 1016 HG3 LYS 128 HG3 LYS 128 -16.978 -2.545 5.932 1017 HD2 LYS 128 HD2 LYS 128 -19.551 -2.708 5.926 1018 HD3 LYS 128 HD3 LYS 128 -19.342 -4.436 5.639 1019 HE2 LYS 128 HE2 LYS 128 -18.151 -2.969 8.023 1020 HE3 LYS 128 HE3 LYS 128 -19.789 -3.626 8.035 1021 HZ1 LYS 128 HZ1 LYS 128 -17.311 -5.227 7.652 1022 HZ2 LYS 128 HZ2 LYS 128 -18.249 -5.214 8.982 1023 HZ3 LYS 128 HZ3 LYS 128 -18.835 -5.835 7.590 1024 H TRP 129 H TRP 129 -17.595 0.076 5.721 1025 HA TRP 129 HA TRP 129 -20.531 0.359 6.186 1026 HB2 TRP 129 HB2 TRP 129 -19.892 0.784 8.517 1027 HB3 TRP 129 HB3 TRP 129 -19.419 -0.793 7.924 1028 HD1 TRP 129 HD1 TRP 129 -16.828 -1.385 7.858 1029 HE1 TRP 129 HE1 TRP 129 -14.734 -0.248 8.665 1030 HE3 TRP 129 HE3 TRP 129 -18.805 3.181 8.996 1031 HZ2 TRP 129 HZ2 TRP 129 -13.943 2.365 9.701 1032 HZ3 TRP 129 HZ3 TRP 129 -17.341 5.014 9.862 1033 HH2 TRP 129 HH2 TRP 129 -14.908 4.623 10.174 1034 H VAL 130 H VAL 130 -18.395 2.128 4.585 1035 HA VAL 130 HA VAL 130 -19.674 4.725 5.234 1036 HB VAL 130 HB VAL 130 -17.111 5.567 4.687 1037 HG11 VAL 130 HG11 VAL 130 -18.469 5.078 7.362 1038 HG12 VAL 130 HG12 VAL 130 -17.063 6.128 7.125 1039 HG13 VAL 130 HG13 VAL 130 -18.607 6.526 6.347 1040 HG21 VAL 130 HG21 VAL 130 -16.134 3.371 4.944 1041 HG22 VAL 130 HG22 VAL 130 -15.539 4.537 6.128 1042 HG23 VAL 130 HG23 VAL 130 -16.703 3.294 6.619 1043 H LYS 131 H LYS 131 -18.316 6.293 3.349 1044 HA LYS 131 HA LYS 131 -18.570 6.972 1.231 1045 HB2 LYS 131 HB2 LYS 131 -16.682 5.081 1.354 1046 HB3 LYS 131 HB3 LYS 131 -17.785 4.210 0.306 1047 HG2 LYS 131 HG2 LYS 131 -16.386 5.298 -1.195 1048 HG3 LYS 131 HG3 LYS 131 -17.782 6.392 -1.138 1049 HD2 LYS 131 HD2 LYS 131 -16.561 7.812 0.519 1050 HD3 LYS 131 HD3 LYS 131 -15.167 6.715 0.384 1051 HE2 LYS 131 HE2 LYS 131 -15.204 7.151 -2.123 1052 HE3 LYS 131 HE3 LYS 131 -16.415 8.407 -1.834 1053 HZ1 LYS 131 HZ1 LYS 131 -14.726 9.538 -0.391 1054 HZ2 LYS 131 HZ2 LYS 131 -13.670 8.368 -0.679 1055 HZ3 LYS 131 HZ3 LYS 131 -14.153 9.344 -1.907 1056 H GLN 132 H GLN 132 -20.971 5.713 2.364 1057 HA GLN 132 HA GLN 132 -23.019 4.926 1.880 1058 HB2 GLN 132 HB2 GLN 132 -22.763 6.494 -0.708 1059 HB3 GLN 132 HB3 GLN 132 -24.258 6.022 0.096 1060 HG2 GLN 132 HG2 GLN 132 -22.189 8.008 1.121 1061 HG3 GLN 132 HG3 GLN 132 -23.793 8.378 0.515 1062 HE21 GLN 132 HE21 GLN 132 -23.526 7.938 4.405 1063 HE22 GLN 132 HE22 GLN 132 -22.273 8.532 3.325 1064 H GLU 133 H GLU 133 -20.896 3.158 1.199 1065 HA GLU 133 HA GLU 133 -21.849 1.543 -1.022 1066 HB2 GLU 133 HB2 GLU 133 -19.899 0.997 1.245 1067 HB3 GLU 133 HB3 GLU 133 -20.252 -0.171 -0.022 1068 HG2 GLU 133 HG2 GLU 133 -19.186 2.633 -0.581 1069 HG3 GLU 133 HG3 GLU 133 -18.161 1.222 -0.364 1070 H1 SER 149 H1 SER 149 15.079 -21.327 -18.218 1071 H2 SER 149 H2 SER 149 15.883 -20.546 -19.415 1072 H3 SER 149 H3 SER 149 15.078 -21.938 -19.739 1073 HA SER 149 HA SER 149 13.812 -20.087 -20.560 1074 HB2 SER 149 HB2 SER 149 11.683 -20.543 -19.373 1075 HB3 SER 149 HB3 SER 149 12.560 -22.029 -19.758 1076 HG SER 149 HG SER 149 11.816 -22.057 -17.606 1077 H GLN 150 H GLN 150 12.269 -18.295 -19.840 1078 HA GLN 150 HA GLN 150 13.483 -16.622 -17.685 1079 HB2 GLN 150 HB2 GLN 150 14.120 -16.111 -20.133 1080 HB3 GLN 150 HB3 GLN 150 12.470 -15.505 -20.311 1081 HG2 GLN 150 HG2 GLN 150 12.928 -13.878 -18.438 1082 HG3 GLN 150 HG3 GLN 150 14.552 -14.543 -18.283 1083 HE21 GLN 150 HE21 GLN 150 15.035 -11.515 -20.285 1084 HE22 GLN 150 HE22 GLN 150 14.710 -11.965 -18.616 1085 H ILE 151 H ILE 151 11.276 -18.312 -17.271 1086 HA ILE 151 HA ILE 151 8.782 -16.790 -17.400 1087 HB ILE 151 HB ILE 151 9.480 -19.382 -15.970 1088 HG12 ILE 151 HG12 ILE 151 7.979 -18.888 -18.591 1089 HG13 ILE 151 HG13 ILE 151 9.642 -19.458 -18.476 1090 HG21 ILE 151 HG21 ILE 151 6.744 -18.110 -16.476 1091 HG22 ILE 151 HG22 ILE 151 7.027 -19.711 -15.761 1092 HG23 ILE 151 HG23 ILE 151 7.534 -18.281 -14.891 1093 HD11 ILE 151 HD11 ILE 151 8.838 -21.491 -17.243 1094 HD12 ILE 151 HD12 ILE 151 7.168 -20.981 -17.603 1095 HD13 ILE 151 HD13 ILE 151 8.283 -21.354 -18.923 1096 H THR 152 H THR 152 7.856 -15.559 -15.850 1097 HA THR 152 HA THR 152 9.130 -15.266 -13.169 1098 HB THR 152 HB THR 152 8.844 -12.813 -13.362 1099 HG1 THR 152 HG1 THR 152 8.704 -11.960 -15.467 1100 HG21 THR 152 HG21 THR 152 10.820 -12.342 -14.644 1101 HG22 THR 152 HG22 THR 152 11.063 -13.862 -13.766 1102 HG23 THR 152 HG23 THR 152 10.703 -13.893 -15.507 1103 H SER 153 H SER 153 7.788 -14.031 -11.632 1104 HA SER 153 HA SER 153 5.210 -15.280 -11.510 1105 HB2 SER 153 HB2 SER 153 6.500 -13.344 -9.582 1106 HB3 SER 153 HB3 SER 153 5.160 -14.461 -9.237 1107 HG SER 153 HG SER 153 7.188 -15.316 -8.543 1108 H GLN 154 H GLN 154 4.914 -13.707 -13.517 1109 HA GLN 154 HA GLN 154 4.037 -11.066 -13.246 1110 HB2 GLN 154 HB2 GLN 154 3.232 -13.119 -15.338 1111 HB3 GLN 154 HB3 GLN 154 3.025 -11.366 -15.488 1112 HG2 GLN 154 HG2 GLN 154 5.473 -11.039 -15.356 1113 HG3 GLN 154 HG3 GLN 154 5.709 -12.761 -15.112 1114 HE21 GLN 154 HE21 GLN 154 6.464 -12.780 -18.565 1115 HE22 GLN 154 HE22 GLN 154 7.131 -12.775 -16.927 1116 H VAL 155 H VAL 155 1.945 -10.059 -13.321 1117 HA VAL 155 HA VAL 155 0.199 -11.048 -11.370 1118 HB VAL 155 HB VAL 155 -0.677 -8.982 -13.411 1119 HG11 VAL 155 HG11 VAL 155 -1.287 -9.196 -10.397 1120 HG12 VAL 155 HG12 VAL 155 -1.839 -7.953 -11.476 1121 HG13 VAL 155 HG13 VAL 155 -2.404 -9.597 -11.741 1122 HG21 VAL 155 HG21 VAL 155 1.554 -8.264 -12.735 1123 HG22 VAL 155 HG22 VAL 155 0.294 -7.236 -12.042 1124 HG23 VAL 155 HG23 VAL 155 1.090 -8.447 -11.008 1125 H TPO 156 H T2P 156 -1.428 -12.378 -11.462 1126 HA TPO 156 HA T2P 156 -2.618 -13.906 -13.418 1127 HB TPO 156 HB T2P 156 -3.812 -12.747 -10.946 1128 HG21 TPO 156 HG21 T2P 156 -5.212 -14.730 -12.741 1129 HG22 TPO 156 HG22 T2P 156 -5.757 -13.110 -12.192 1130 HG23 TPO 156 HG23 T2P 156 -5.635 -14.424 -11.052 1131 H GLY 157 H GLY 157 -4.356 -13.937 -14.466 1132 HA2 GLY 157 HA2 GLY 157 -6.265 -11.848 -14.971 1133 HA3 GLY 157 HA3 GLY 157 -5.172 -11.997 -16.356 1134 H GLN 158 H GLN 158 -5.009 -15.010 -15.516 1135 HA GLN 158 HA GLN 158 -6.874 -16.050 -17.368 1136 HB2 GLN 158 HB2 GLN 158 -5.861 -18.138 -16.904 1137 HB3 GLN 158 HB3 GLN 158 -4.594 -16.932 -16.902 1138 HG2 GLN 158 HG2 GLN 158 -5.860 -18.138 -14.387 1139 HG3 GLN 158 HG3 GLN 158 -4.401 -18.732 -15.152 1140 HE21 GLN 158 HE21 GLN 158 -3.438 -16.571 -12.255 1141 HE22 GLN 158 HE22 GLN 158 -4.276 -18.086 -12.488 1142 H ILE 159 H ILE 159 -7.362 -15.418 -14.005 1143 HA ILE 159 HA ILE 159 -9.810 -17.130 -14.013 1144 HB ILE 159 HB ILE 159 -8.143 -18.206 -12.704 1145 HG12 ILE 159 HG12 ILE 159 -10.292 -17.024 -10.907 1146 HG13 ILE 159 HG13 ILE 159 -10.542 -18.313 -12.083 1147 HG21 ILE 159 HG21 ILE 159 -6.659 -16.472 -12.019 1148 HG22 ILE 159 HG22 ILE 159 -7.933 -15.663 -11.092 1149 HG23 ILE 159 HG23 ILE 159 -7.265 -17.204 -10.546 1150 HD11 ILE 159 HD11 ILE 159 -8.869 -19.718 -10.831 1151 HD12 ILE 159 HD12 ILE 159 -8.831 -18.458 -9.570 1152 HD13 ILE 159 HD13 ILE 159 -10.337 -19.315 -9.918 1153 H GLY 160 H GLY 160 -8.436 -14.123 -12.687 1154 HA2 GLY 160 HA2 GLY 160 -9.453 -12.029 -12.546 1155 HA3 GLY 160 HA3 GLY 160 -10.873 -12.696 -13.344 1156 H TRP 161 H TRP 161 -9.181 -12.682 -10.202 1157 HA TRP 161 HA TRP 161 -11.769 -13.123 -8.743 1158 HB2 TRP 161 HB2 TRP 161 -11.042 -15.134 -7.786 1159 HB3 TRP 161 HB3 TRP 161 -10.640 -15.295 -9.480 1160 HD1 TRP 161 HD1 TRP 161 -7.841 -13.887 -9.599 1161 HE1 TRP 161 HE1 TRP 161 -5.785 -15.004 -8.596 1162 HE3 TRP 161 HE3 TRP 161 -10.090 -16.135 -5.659 1163 HZ2 TRP 161 HZ2 TRP 161 -5.274 -17.014 -6.606 1164 HZ3 TRP 161 HZ3 TRP 161 -8.764 -17.595 -4.116 1165 HH2 TRP 161 HH2 TRP 161 -6.371 -18.079 -4.595 1166 H ARG 162 H ARG 162 -11.679 -13.140 -6.512 1167 HA ARG 162 HA ARG 162 -9.386 -13.048 -4.853 1168 HB2 ARG 162 HB2 ARG 162 -10.333 -10.393 -5.668 1169 HB3 ARG 162 HB3 ARG 162 -10.436 -10.632 -3.921 1170 HG2 ARG 162 HG2 ARG 162 -8.065 -11.415 -3.913 1171 HG3 ARG 162 HG3 ARG 162 -7.884 -11.030 -5.595 1172 HD2 ARG 162 HD2 ARG 162 -8.812 -9.038 -3.506 1173 HD3 ARG 162 HD3 ARG 162 -7.120 -9.350 -3.783 1174 HE ARG 162 HE ARG 162 -7.779 -7.357 -4.971 1175 HH11 ARG 162 HH11 ARG 162 -7.703 -6.324 -6.796 1176 HH12 ARG 162 HH12 ARG 162 -8.252 -7.097 -8.271 1177 HH21 ARG 162 HH21 ARG 162 -8.612 -10.196 -6.999 1178 HH22 ARG 162 HH22 ARG 162 -8.529 -9.211 -8.402 1179 H ARG 163 H ARG 163 -12.749 -11.855 -4.962 1180 HA ARG 163 HA ARG 163 -13.617 -14.019 -3.133 1181 HB2 ARG 163 HB2 ARG 163 -14.444 -11.100 -2.781 1182 HB3 ARG 163 HB3 ARG 163 -15.200 -12.493 -1.994 1183 HG2 ARG 163 HG2 ARG 163 -12.903 -13.067 -1.047 1184 HG3 ARG 163 HG3 ARG 163 -12.367 -11.468 -1.592 1185 HD2 ARG 163 HD2 ARG 163 -14.593 -12.058 0.406 1186 HD3 ARG 163 HD3 ARG 163 -12.965 -11.521 0.795 1187 HE ARG 163 HE ARG 163 -13.415 -9.346 -0.044 1188 HH11 ARG 163 HH11 ARG 163 -14.694 -7.683 -0.151 1189 HH12 ARG 163 HH12 ARG 163 -16.440 -7.843 -0.279 1190 HH21 ARG 163 HH21 ARG 163 -16.351 -11.285 -0.160 1191 HH22 ARG 163 HH22 ARG 163 -17.355 -9.865 -0.274 Start of MODEL 8 1 H1 GLY -4 H1 GLY -4 -6.585 33.356 22.542 2 H2 GLY -4 H2 GLY -4 -5.093 33.171 23.194 3 H3 GLY -4 H3 GLY -4 -6.149 31.920 23.199 4 HA2 GLY -4 HA2 GLY -4 -6.093 31.771 20.801 5 HA3 GLY -4 HA3 GLY -4 -4.964 33.138 20.787 6 H SER -3 H SER -3 -4.733 30.250 19.911 7 HA SER -3 HA SER -3 -2.206 29.537 21.330 8 HB2 SER -3 HB2 SER -3 -4.481 27.632 20.649 9 HB3 SER -3 HB3 SER -3 -2.895 27.157 21.280 10 HG SER -3 HG SER -3 -4.481 27.334 22.936 11 HA PRO -2 HA PRO -2 -0.727 28.974 17.176 12 HB2 PRO -2 HB2 PRO -2 1.445 27.356 17.506 13 HB3 PRO -2 HB3 PRO -2 1.380 29.030 18.133 14 HG2 PRO -2 HG2 PRO -2 0.792 26.459 19.644 15 HG3 PRO -2 HG3 PRO -2 1.886 27.797 20.127 16 HD2 PRO -2 HD2 PRO -2 -0.664 27.646 21.050 17 HD3 PRO -2 HD3 PRO -2 0.073 29.221 20.638 18 H ASN -1 H ASN -1 -1.827 26.205 18.974 19 HA ASN -1 HA ASN -1 -2.720 24.875 16.506 20 HB2 ASN -1 HB2 ASN -1 -0.459 23.896 17.209 21 HB3 ASN -1 HB3 ASN -1 -1.233 23.356 18.699 22 HD21 ASN -1 HD21 ASN -1 -1.463 20.374 16.692 23 HD22 ASN -1 HD22 ASN -1 -0.418 21.215 17.830 24 H SER 0 H SER 0 -4.406 23.210 17.016 25 HA SER 0 HA SER 0 -5.748 23.402 19.637 26 HB2 SER 0 HB2 SER 0 -6.649 25.336 18.398 27 HB3 SER 0 HB3 SER 0 -7.142 24.264 17.072 28 HG SER 0 HG SER 0 -8.802 24.789 18.671 29 H MET 1 H MET 1 -7.216 21.781 20.030 30 HA MET 1 HA MET 1 -7.556 19.633 17.986 31 HB2 MET 1 HB2 MET 1 -7.241 19.289 20.987 32 HB3 MET 1 HB3 MET 1 -7.697 18.004 19.856 33 HG2 MET 1 HG2 MET 1 -5.592 18.331 18.609 34 HG3 MET 1 HG3 MET 1 -5.095 19.567 19.771 35 HE1 MET 1 HE1 MET 1 -3.323 17.049 18.936 36 HE2 MET 1 HE2 MET 1 -2.801 18.307 20.083 37 HE3 MET 1 HE3 MET 1 -2.663 16.590 20.521 38 H ALA 2 H ALA 2 -9.207 22.132 19.023 39 HA ALA 2 HA ALA 2 -11.681 20.885 19.946 40 HB1 ALA 2 HB1 ALA 2 -11.084 23.736 19.058 41 HB2 ALA 2 HB2 ALA 2 -12.520 23.183 19.943 42 HB3 ALA 2 HB3 ALA 2 -10.926 23.110 20.718 43 H THR 3 H THR 3 -10.415 21.911 16.818 44 HA THR 3 HA THR 3 -13.023 21.590 15.463 45 HB THR 3 HB THR 3 -11.740 22.369 13.453 46 HG1 THR 3 HG1 THR 3 -9.669 23.177 13.827 47 HG21 THR 3 HG21 THR 3 -11.498 24.689 14.185 48 HG22 THR 3 HG22 THR 3 -12.947 23.980 14.917 49 HG23 THR 3 HG23 THR 3 -11.474 24.189 15.891 50 H GLU 4 H GLU 4 -10.129 19.824 15.894 51 HA GLU 4 HA GLU 4 -11.253 17.436 14.649 52 HB2 GLU 4 HB2 GLU 4 -10.153 18.526 12.711 53 HB3 GLU 4 HB3 GLU 4 -8.645 18.642 13.614 54 HG2 GLU 4 HG2 GLU 4 -8.589 16.811 11.993 55 HG3 GLU 4 HG3 GLU 4 -8.412 16.208 13.630 56 H LEU 5 H LEU 5 -10.351 15.541 15.515 57 HA LEU 5 HA LEU 5 -8.930 15.958 18.075 58 HB2 LEU 5 HB2 LEU 5 -10.331 13.553 16.855 59 HB3 LEU 5 HB3 LEU 5 -9.561 13.541 18.441 60 HG LEU 5 HG LEU 5 -11.921 15.308 17.646 61 HD11 LEU 5 HD11 LEU 5 -11.787 12.820 19.400 62 HD12 LEU 5 HD12 LEU 5 -13.228 13.820 19.099 63 HD13 LEU 5 HD13 LEU 5 -12.491 12.911 17.770 64 HD21 LEU 5 HD21 LEU 5 -12.114 15.720 20.094 65 HD22 LEU 5 HD22 LEU 5 -10.583 14.853 20.353 66 HD23 LEU 5 HD23 LEU 5 -10.616 16.376 19.433 67 H GLU 6 H GLU 6 -8.066 15.213 14.987 68 HA GLU 6 HA GLU 6 -6.167 14.414 13.956 69 HB2 GLU 6 HB2 GLU 6 -5.276 16.152 16.241 70 HB3 GLU 6 HB3 GLU 6 -4.119 15.577 15.029 71 HG2 GLU 6 HG2 GLU 6 -6.586 17.221 14.376 72 HG3 GLU 6 HG3 GLU 6 -4.992 17.883 14.668 73 H TYR 7 H TYR 7 -7.124 12.318 15.142 74 HA TYR 7 HA TYR 7 -4.921 10.827 16.457 75 HB2 TYR 7 HB2 TYR 7 -6.633 9.363 17.269 76 HB3 TYR 7 HB3 TYR 7 -7.166 11.002 17.567 77 HD1 TYR 7 HD1 TYR 7 -8.876 12.059 15.950 78 HD2 TYR 7 HD2 TYR 7 -7.999 7.834 16.013 79 HE1 TYR 7 HE1 TYR 7 -10.936 11.619 14.644 80 HE2 TYR 7 HE2 TYR 7 -10.091 7.388 14.749 81 HH TYR 7 HH TYR 7 -12.308 10.020 13.737 82 H GLU 8 H GLU 8 -5.400 8.327 15.900 83 HA GLU 8 HA GLU 8 -6.513 7.622 13.425 84 HB2 GLU 8 HB2 GLU 8 -4.644 6.662 12.213 85 HB3 GLU 8 HB3 GLU 8 -4.499 8.397 12.327 86 HG2 GLU 8 HG2 GLU 8 -2.876 7.984 14.318 87 HG3 GLU 8 HG3 GLU 8 -2.846 6.302 13.761 88 H SER 9 H SER 9 -7.313 5.665 13.722 89 HA SER 9 HA SER 9 -6.530 4.112 16.093 90 HB2 SER 9 HB2 SER 9 -8.884 4.044 14.191 91 HB3 SER 9 HB3 SER 9 -8.648 2.845 15.488 92 HG SER 9 HG SER 9 -9.960 4.597 16.178 93 H VAL 10 H VAL 10 -5.617 2.012 16.030 94 HA VAL 10 HA VAL 10 -4.386 1.271 13.516 95 HB VAL 10 HB VAL 10 -3.254 0.970 15.649 96 HG11 VAL 10 HG11 VAL 10 -5.077 -1.423 16.119 97 HG12 VAL 10 HG12 VAL 10 -3.683 -0.930 17.097 98 HG13 VAL 10 HG13 VAL 10 -5.122 0.098 17.038 99 HG21 VAL 10 HG21 VAL 10 -2.185 -1.136 15.115 100 HG22 VAL 10 HG22 VAL 10 -3.555 -1.640 14.111 101 HG23 VAL 10 HG23 VAL 10 -2.545 -0.259 13.618 102 H LEU 11 H LEU 11 -4.806 -0.244 12.052 103 HA LEU 11 HA LEU 11 -7.330 -1.852 12.310 104 HB2 LEU 11 HB2 LEU 11 -6.025 -0.669 9.829 105 HB3 LEU 11 HB3 LEU 11 -7.423 -1.731 9.842 106 HG LEU 11 HG LEU 11 -7.309 1.107 10.945 107 HD11 LEU 11 HD11 LEU 11 -8.984 1.441 9.088 108 HD12 LEU 11 HD12 LEU 11 -7.364 1.021 8.523 109 HD13 LEU 11 HD13 LEU 11 -8.651 -0.207 8.541 110 HD21 LEU 11 HD21 LEU 11 -9.620 -0.889 10.896 111 HD22 LEU 11 HD22 LEU 11 -8.853 -0.178 12.340 112 HD23 LEU 11 HD23 LEU 11 -9.772 0.848 11.246 113 H CYS 12 H CYS 12 -4.007 -1.837 10.908 114 HA CYS 12 HA CYS 12 -3.898 -4.758 11.237 115 HB2 CYS 12 HB2 CYS 12 -4.952 -4.219 8.983 116 HB3 CYS 12 HB3 CYS 12 -3.363 -3.609 8.487 117 HG CYS 12 HG CYS 12 -4.057 -6.101 7.667 118 H VAL 13 H VAL 13 -1.906 -5.704 11.014 119 HA VAL 13 HA VAL 13 0.472 -4.089 10.567 120 HB VAL 13 HB VAL 13 0.189 -3.856 12.966 121 HG11 VAL 13 HG11 VAL 13 -1.057 -5.929 13.506 122 HG12 VAL 13 HG12 VAL 13 0.428 -6.874 13.247 123 HG13 VAL 13 HG13 VAL 13 0.346 -5.675 14.550 124 HG21 VAL 13 HG21 VAL 13 2.378 -4.604 13.703 125 HG22 VAL 13 HG22 VAL 13 2.504 -5.733 12.339 126 HG23 VAL 13 HG23 VAL 13 2.481 -3.978 12.055 127 H LYS 14 H LYS 14 1.862 -5.212 9.365 128 HA LYS 14 HA LYS 14 1.765 -8.179 9.478 129 HB2 LYS 14 HB2 LYS 14 1.747 -6.623 6.876 130 HB3 LYS 14 HB3 LYS 14 2.343 -8.253 6.957 131 HG2 LYS 14 HG2 LYS 14 -0.457 -7.435 7.829 132 HG3 LYS 14 HG3 LYS 14 -0.016 -8.051 6.234 133 HD2 LYS 14 HD2 LYS 14 0.870 -10.143 7.321 134 HD3 LYS 14 HD3 LYS 14 0.213 -9.575 8.876 135 HE2 LYS 14 HE2 LYS 14 -2.029 -9.498 7.972 136 HE3 LYS 14 HE3 LYS 14 -1.416 -9.843 6.343 137 HZ1 LYS 14 HZ1 LYS 14 -0.702 -12.025 7.129 138 HZ2 LYS 14 HZ2 LYS 14 -1.352 -11.744 8.616 139 HZ3 LYS 14 HZ3 LYS 14 -2.329 -11.826 7.291 140 HA PRO 15 HA PRO 15 5.823 -8.016 10.582 141 HB2 PRO 15 HB2 PRO 15 6.718 -10.565 10.081 142 HB3 PRO 15 HB3 PRO 15 5.452 -10.184 11.285 143 HG2 PRO 15 HG2 PRO 15 5.040 -11.095 8.402 144 HG3 PRO 15 HG3 PRO 15 4.298 -11.773 9.890 145 HD2 PRO 15 HD2 PRO 15 2.996 -9.988 8.389 146 HD3 PRO 15 HD3 PRO 15 2.925 -9.900 10.175 147 H ASP 16 H ASP 16 5.415 -8.924 7.178 148 HA ASP 16 HA ASP 16 8.011 -7.670 6.520 149 HB2 ASP 16 HB2 ASP 16 8.430 -10.106 6.792 150 HB3 ASP 16 HB3 ASP 16 7.224 -10.435 5.548 151 H VAL 17 H VAL 17 7.947 -6.482 4.684 152 HA VAL 17 HA VAL 17 6.034 -6.993 2.544 153 HB VAL 17 HB VAL 17 4.644 -5.650 4.036 154 HG11 VAL 17 HG11 VAL 17 6.711 -3.436 3.818 155 HG12 VAL 17 HG12 VAL 17 5.116 -3.326 4.581 156 HG13 VAL 17 HG13 VAL 17 6.351 -4.391 5.268 157 HG21 VAL 17 HG21 VAL 17 4.418 -5.386 1.583 158 HG22 VAL 17 HG22 VAL 17 3.944 -3.945 2.493 159 HG23 VAL 17 HG23 VAL 17 5.506 -3.976 1.654 160 H SER 18 H SER 18 6.815 -6.280 0.587 161 HA SER 18 HA SER 18 9.412 -4.793 0.611 162 HB2 SER 18 HB2 SER 18 8.547 -6.943 -1.339 163 HB3 SER 18 HB3 SER 18 10.094 -6.087 -1.278 164 HG SER 18 HG SER 18 9.033 -7.874 0.667 165 H VAL 19 H VAL 19 9.791 -3.251 -0.913 166 HA VAL 19 HA VAL 19 7.452 -2.300 -2.521 167 HB VAL 19 HB VAL 19 9.354 -0.668 -0.847 168 HG11 VAL 19 HG11 VAL 19 7.206 0.226 -2.804 169 HG12 VAL 19 HG12 VAL 19 8.025 1.283 -1.638 170 HG13 VAL 19 HG13 VAL 19 8.955 0.544 -2.932 171 HG21 VAL 19 HG21 VAL 19 6.323 -1.092 -0.817 172 HG22 VAL 19 HG22 VAL 19 7.459 -1.727 0.384 173 HG23 VAL 19 HG23 VAL 19 7.213 0.012 0.239 174 H TYR 20 H TYR 20 7.732 -1.696 -4.465 175 HA TYR 20 HA TYR 20 10.375 -2.150 -5.797 176 HB2 TYR 20 HB2 TYR 20 7.583 -2.997 -6.658 177 HB3 TYR 20 HB3 TYR 20 9.074 -3.292 -7.538 178 HD1 TYR 20 HD1 TYR 20 7.166 -4.191 -4.460 179 HD2 TYR 20 HD2 TYR 20 10.511 -5.131 -7.007 180 HE1 TYR 20 HE1 TYR 20 7.458 -6.364 -3.281 181 HE2 TYR 20 HE2 TYR 20 10.751 -7.335 -5.850 182 HH TYR 20 HH TYR 20 8.620 -8.354 -3.187 183 H ARG 21 H ARG 21 9.643 0.407 -5.117 184 HA ARG 21 HA ARG 21 8.136 2.191 -6.237 185 HB2 ARG 21 HB2 ARG 21 11.156 2.596 -6.263 186 HB3 ARG 21 HB3 ARG 21 9.922 3.861 -6.286 187 HG2 ARG 21 HG2 ARG 21 9.073 2.825 -4.064 188 HG3 ARG 21 HG3 ARG 21 10.605 1.957 -4.012 189 HD2 ARG 21 HD2 ARG 21 10.375 4.984 -4.273 190 HD3 ARG 21 HD3 ARG 21 10.511 4.142 -2.724 191 HE ARG 21 HE ARG 21 12.676 3.127 -4.000 192 HH11 ARG 21 HH11 ARG 21 14.604 3.766 -4.018 193 HH12 ARG 21 HH12 ARG 21 15.070 5.467 -3.883 194 HH21 ARG 21 HH21 ARG 21 11.770 6.507 -3.608 195 HH22 ARG 21 HH22 ARG 21 13.440 7.007 -3.648 196 H ILE 22 H ILE 22 7.339 2.928 -8.058 197 HA ILE 22 HA ILE 22 8.357 1.631 -10.509 198 HB ILE 22 HB ILE 22 6.067 1.455 -11.223 199 HG12 ILE 22 HG12 ILE 22 5.395 3.104 -8.766 200 HG13 ILE 22 HG13 ILE 22 5.039 3.446 -10.463 201 HG21 ILE 22 HG21 ILE 22 6.380 0.515 -8.358 202 HG22 ILE 22 HG22 ILE 22 5.273 -0.133 -9.573 203 HG23 ILE 22 HG23 ILE 22 7.013 -0.286 -9.809 204 HD11 ILE 22 HD11 ILE 22 3.720 1.377 -8.691 205 HD12 ILE 22 HD12 ILE 22 3.012 2.822 -9.426 206 HD13 ILE 22 HD13 ILE 22 3.488 1.456 -10.458 207 HA PRO 23 HA PRO 23 8.468 5.558 -12.614 208 HB2 PRO 23 HB2 PRO 23 8.434 4.668 -15.272 209 HB3 PRO 23 HB3 PRO 23 9.849 4.901 -14.212 210 HG2 PRO 23 HG2 PRO 23 8.502 2.362 -14.989 211 HG3 PRO 23 HG3 PRO 23 10.181 2.639 -14.475 212 HD2 PRO 23 HD2 PRO 23 8.128 1.560 -12.877 213 HD3 PRO 23 HD3 PRO 23 9.670 2.236 -12.284 214 HA PRO 24 HA PRO 24 4.461 5.666 -15.110 215 HB2 PRO 24 HB2 PRO 24 2.660 3.634 -15.278 216 HB3 PRO 24 HB3 PRO 24 4.169 3.664 -16.240 217 HG2 PRO 24 HG2 PRO 24 3.690 2.251 -13.587 218 HG3 PRO 24 HG3 PRO 24 4.355 1.552 -15.102 219 HD2 PRO 24 HD2 PRO 24 5.970 2.444 -13.127 220 HD3 PRO 24 HD3 PRO 24 6.390 2.699 -14.847 221 H ARG 25 H ARG 25 2.353 6.376 -14.732 222 HA ARG 25 HA ARG 25 1.100 5.952 -12.028 223 HB2 ARG 25 HB2 ARG 25 0.028 8.082 -12.237 224 HB3 ARG 25 HB3 ARG 25 1.779 8.274 -12.363 225 HG2 ARG 25 HG2 ARG 25 1.570 8.513 -14.842 226 HG3 ARG 25 HG3 ARG 25 -0.173 8.245 -14.718 227 HD2 ARG 25 HD2 ARG 25 0.206 10.603 -14.933 228 HD3 ARG 25 HD3 ARG 25 -0.382 10.269 -13.296 229 HE ARG 25 HE ARG 25 2.516 10.297 -13.402 230 HH11 ARG 25 HH11 ARG 25 3.671 11.968 -12.500 231 HH12 ARG 25 HH12 ARG 25 2.895 13.491 -12.185 232 HH21 ARG 25 HH21 ARG 25 -0.183 12.529 -13.352 233 HH22 ARG 25 HH22 ARG 25 0.770 13.807 -12.648 234 H ALA 26 H ALA 26 0.628 5.586 -15.411 235 HA ALA 26 HA ALA 26 -1.759 3.989 -15.063 236 HB1 ALA 26 HB1 ALA 26 -1.958 6.784 -16.298 237 HB2 ALA 26 HB2 ALA 26 -3.243 5.543 -16.348 238 HB3 ALA 26 HB3 ALA 26 -2.726 6.255 -14.799 239 H SER 27 H SER 27 -0.696 2.412 -16.233 240 HA SER 27 HA SER 27 0.972 3.160 -18.485 241 HB2 SER 27 HB2 SER 27 1.561 1.422 -16.821 242 HB3 SER 27 HB3 SER 27 0.282 0.381 -17.478 243 HG SER 27 HG SER 27 2.484 0.089 -18.355 244 H ASN 28 H ASN 28 -2.013 1.230 -18.191 245 HA ASN 28 HA ASN 28 -3.111 2.109 -20.677 246 HB2 ASN 28 HB2 ASN 28 -3.165 -0.240 -21.780 247 HB3 ASN 28 HB3 ASN 28 -1.752 0.766 -21.973 248 HD21 ASN 28 HD21 ASN 28 0.461 -1.396 -20.268 249 HD22 ASN 28 HD22 ASN 28 0.224 0.190 -20.956 250 H ARG 29 H ARG 29 -3.466 -1.167 -19.288 251 HA ARG 29 HA ARG 29 -6.301 -0.598 -18.581 252 HB2 ARG 29 HB2 ARG 29 -4.589 -3.130 -18.343 253 HB3 ARG 29 HB3 ARG 29 -6.287 -2.995 -17.885 254 HG2 ARG 29 HG2 ARG 29 -6.595 -3.801 -19.957 255 HG3 ARG 29 HG3 ARG 29 -6.584 -2.063 -20.335 256 HD2 ARG 29 HD2 ARG 29 -4.285 -2.211 -21.108 257 HD3 ARG 29 HD3 ARG 29 -4.184 -3.915 -20.613 258 HE ARG 29 HE ARG 29 -6.360 -3.740 -22.373 259 HH11 ARG 29 HH11 ARG 29 -6.265 -4.219 -24.543 260 HH12 ARG 29 HH12 ARG 29 -4.747 -4.136 -25.386 261 HH21 ARG 29 HH21 ARG 29 -2.920 -3.178 -22.645 262 HH22 ARG 29 HH22 ARG 29 -2.894 -3.558 -24.349 263 H GLY 30 H GLY 30 -3.283 -1.003 -17.032 264 HA2 GLY 30 HA2 GLY 30 -4.097 0.416 -14.646 265 HA3 GLY 30 HA3 GLY 30 -3.877 -1.313 -14.327 266 H TYR 31 H TYR 31 -1.960 -1.698 -13.479 267 HA TYR 31 HA TYR 31 0.422 -0.006 -14.221 268 HB2 TYR 31 HB2 TYR 31 -0.415 -1.310 -11.625 269 HB3 TYR 31 HB3 TYR 31 1.217 -0.751 -11.928 270 HD1 TYR 31 HD1 TYR 31 -2.235 0.303 -11.271 271 HD2 TYR 31 HD2 TYR 31 1.792 1.575 -12.171 272 HE1 TYR 31 HE1 TYR 31 -2.741 2.554 -10.334 273 HE2 TYR 31 HE2 TYR 31 1.308 3.799 -11.175 274 HH TYR 31 HH TYR 31 -1.881 4.599 -9.735 275 H ARG 32 H ARG 32 -0.673 -3.315 -13.624 276 HA ARG 32 HA ARG 32 0.259 -5.274 -13.310 277 HB2 ARG 32 HB2 ARG 32 2.100 -5.116 -15.595 278 HB3 ARG 32 HB3 ARG 32 0.829 -6.241 -15.158 279 HG2 ARG 32 HG2 ARG 32 0.060 -5.467 -17.115 280 HG3 ARG 32 HG3 ARG 32 -0.807 -4.385 -16.043 281 HD2 ARG 32 HD2 ARG 32 0.449 -2.519 -16.639 282 HD3 ARG 32 HD3 ARG 32 1.821 -3.464 -17.177 283 HE ARG 32 HE ARG 32 -0.654 -2.893 -18.694 284 HH11 ARG 32 HH11 ARG 32 -0.832 -3.498 -20.758 285 HH12 ARG 32 HH12 ARG 32 0.338 -4.573 -21.499 286 HH21 ARG 32 HH21 ARG 32 2.278 -4.843 -18.678 287 HH22 ARG 32 HH22 ARG 32 2.061 -5.313 -20.339 288 H ALA 33 H ALA 33 1.510 -5.871 -11.601 289 HA ALA 33 HA ALA 33 4.063 -4.889 -10.895 290 HB1 ALA 33 HB1 ALA 33 2.629 -6.391 -9.472 291 HB2 ALA 33 HB2 ALA 33 3.059 -7.756 -10.522 292 HB3 ALA 33 HB3 ALA 33 4.308 -6.922 -9.585 293 H SER 34 H SER 34 3.168 -7.353 -13.213 294 HA SER 34 HA SER 34 5.594 -8.441 -14.041 295 HB2 SER 34 HB2 SER 34 3.010 -7.707 -15.517 296 HB3 SER 34 HB3 SER 34 4.223 -8.860 -16.146 297 HG SER 34 HG SER 34 2.541 -9.926 -15.169 298 H ASP 35 H ASP 35 4.464 -5.154 -14.736 299 HA ASP 35 HA ASP 35 6.128 -4.889 -17.168 300 HB2 ASP 35 HB2 ASP 35 3.865 -3.918 -16.981 301 HB3 ASP 35 HB3 ASP 35 4.430 -2.862 -15.678 302 H TRP 36 H TRP 36 6.302 -4.162 -13.786 303 HA TRP 36 HA TRP 36 8.933 -2.785 -14.101 304 HB2 TRP 36 HB2 TRP 36 8.234 -1.976 -11.642 305 HB3 TRP 36 HB3 TRP 36 7.906 -1.110 -13.113 306 HD1 TRP 36 HD1 TRP 36 5.451 -0.931 -13.970 307 HE1 TRP 36 HE1 TRP 36 3.180 -1.298 -12.897 308 HE3 TRP 36 HE3 TRP 36 6.946 -3.377 -9.714 309 HZ2 TRP 36 HZ2 TRP 36 2.196 -1.992 -10.239 310 HZ3 TRP 36 HZ3 TRP 36 5.308 -3.856 -7.913 311 HH2 TRP 36 HH2 TRP 36 2.936 -3.152 -8.150 312 H LYS 37 H LYS 37 9.651 -3.113 -11.344 313 HA LYS 37 HA LYS 37 10.708 -5.851 -11.438 314 HB2 LYS 37 HB2 LYS 37 10.955 -3.522 -9.468 315 HB3 LYS 37 HB3 LYS 37 11.684 -5.110 -9.185 316 HG2 LYS 37 HG2 LYS 37 13.022 -4.966 -11.189 317 HG3 LYS 37 HG3 LYS 37 12.232 -3.474 -11.707 318 HD2 LYS 37 HD2 LYS 37 13.256 -2.174 -10.026 319 HD3 LYS 37 HD3 LYS 37 13.717 -3.590 -9.066 320 HE2 LYS 37 HE2 LYS 37 15.296 -4.328 -10.752 321 HE3 LYS 37 HE3 LYS 37 14.820 -3.008 -11.837 322 HZ1 LYS 37 HZ1 LYS 37 16.857 -2.470 -10.617 323 HZ2 LYS 37 HZ2 LYS 37 15.676 -1.432 -10.185 324 HZ3 LYS 37 HZ3 LYS 37 16.108 -2.646 -9.177 325 H LEU 38 H LEU 38 9.669 -7.438 -11.151 326 HA LEU 38 HA LEU 38 7.459 -7.632 -9.261 327 HB2 LEU 38 HB2 LEU 38 7.423 -8.383 -11.630 328 HB3 LEU 38 HB3 LEU 38 8.654 -9.598 -11.280 329 HG LEU 38 HG LEU 38 6.342 -9.532 -9.456 330 HD11 LEU 38 HD11 LEU 38 5.929 -10.477 -12.320 331 HD12 LEU 38 HD12 LEU 38 4.798 -10.716 -10.959 332 HD13 LEU 38 HD13 LEU 38 5.143 -9.088 -11.535 333 HD21 LEU 38 HD21 LEU 38 7.972 -11.387 -9.312 334 HD22 LEU 38 HD22 LEU 38 6.424 -12.052 -9.848 335 HD23 LEU 38 HD23 LEU 38 7.726 -11.765 -11.024 336 H ASP 39 H ASP 39 10.797 -8.753 -9.460 337 HA ASP 39 HA ASP 39 10.534 -10.212 -6.854 338 HB2 ASP 39 HB2 ASP 39 10.554 -11.682 -8.892 339 HB3 ASP 39 HB3 ASP 39 12.141 -11.034 -9.302 340 H GLN 40 H GLN 40 11.913 -7.589 -8.239 341 HA GLN 40 HA GLN 40 14.522 -7.755 -6.793 342 HB2 GLN 40 HB2 GLN 40 13.922 -5.933 -9.117 343 HB3 GLN 40 HB3 GLN 40 15.463 -6.398 -8.426 344 HG2 GLN 40 HG2 GLN 40 15.529 -7.728 -10.247 345 HG3 GLN 40 HG3 GLN 40 14.625 -8.854 -9.251 346 HE21 GLN 40 HE21 GLN 40 13.003 -7.676 -12.696 347 HE22 GLN 40 HE22 GLN 40 14.719 -7.641 -12.319 348 HA PRO 41 HA PRO 41 11.923 -4.564 -4.646 349 HB2 PRO 41 HB2 PRO 41 12.652 -4.999 -2.055 350 HB3 PRO 41 HB3 PRO 41 11.466 -6.013 -2.938 351 HG2 PRO 41 HG2 PRO 41 14.424 -6.562 -2.535 352 HG3 PRO 41 HG3 PRO 41 13.045 -7.666 -2.228 353 HD2 PRO 41 HD2 PRO 41 14.451 -7.768 -4.551 354 HD3 PRO 41 HD3 PRO 41 12.675 -8.001 -4.536 355 H ASP 42 H ASP 42 12.382 -2.541 -3.888 356 HA ASP 42 HA ASP 42 15.234 -1.648 -3.989 357 HB2 ASP 42 HB2 ASP 42 13.566 -0.676 -5.585 358 HB3 ASP 42 HB3 ASP 42 12.665 -0.041 -4.207 359 H TRP 43 H TRP 43 12.454 -1.935 -1.893 360 HA TRP 43 HA TRP 43 14.121 -1.403 0.468 361 HB2 TRP 43 HB2 TRP 43 13.119 0.790 0.078 362 HB3 TRP 43 HB3 TRP 43 11.532 0.076 -0.145 363 HD1 TRP 43 HD1 TRP 43 13.918 1.248 2.529 364 HE1 TRP 43 HE1 TRP 43 12.751 1.255 4.815 365 HE3 TRP 43 HE3 TRP 43 9.638 -1.266 1.275 366 HZ2 TRP 43 HZ2 TRP 43 10.240 0.373 5.927 367 HZ3 TRP 43 HZ3 TRP 43 7.863 -1.663 2.965 368 HH2 TRP 43 HH2 TRP 43 8.148 -0.836 5.294 369 H THR 44 H THR 44 13.401 -2.650 2.294 370 HA THR 44 HA THR 44 10.703 -3.768 2.210 371 HB THR 44 HB THR 44 11.188 -5.930 2.702 372 HG1 THR 44 HG1 THR 44 13.943 -5.375 2.994 373 HG21 THR 44 HG21 THR 44 12.548 -6.940 1.029 374 HG22 THR 44 HG22 THR 44 11.725 -5.546 0.324 375 HG23 THR 44 HG23 THR 44 13.447 -5.427 0.746 376 H GLY 45 H GLY 45 9.851 -4.364 4.168 377 HA2 GLY 45 HA2 GLY 45 11.139 -3.822 6.704 378 HA3 GLY 45 HA3 GLY 45 10.181 -2.458 6.155 379 H ARG 46 H ARG 46 8.489 -2.473 7.332 380 HA ARG 46 HA ARG 46 6.838 -4.913 7.886 381 HB2 ARG 46 HB2 ARG 46 8.353 -4.311 9.752 382 HB3 ARG 46 HB3 ARG 46 7.715 -2.675 9.767 383 HG2 ARG 46 HG2 ARG 46 5.458 -3.619 10.435 384 HG3 ARG 46 HG3 ARG 46 6.219 -5.228 10.486 385 HD2 ARG 46 HD2 ARG 46 7.922 -4.246 12.102 386 HD3 ARG 46 HD3 ARG 46 6.953 -2.781 12.156 387 HE ARG 46 HE ARG 46 6.148 -5.506 13.116 388 HH11 ARG 46 HH11 ARG 46 5.041 -5.625 15.005 389 HH12 ARG 46 HH12 ARG 46 4.356 -4.196 15.712 390 HH21 ARG 46 HH21 ARG 46 5.435 -2.030 13.271 391 HH22 ARG 46 HH22 ARG 46 4.626 -2.233 14.800 392 H LEU 47 H LEU 47 4.590 -4.540 8.044 393 HA LEU 47 HA LEU 47 3.635 -1.992 6.791 394 HB2 LEU 47 HB2 LEU 47 3.006 -4.168 5.716 395 HB3 LEU 47 HB3 LEU 47 2.302 -4.649 7.256 396 HG LEU 47 HG LEU 47 0.741 -2.566 7.004 397 HD11 LEU 47 HD11 LEU 47 0.292 -1.878 4.731 398 HD12 LEU 47 HD12 LEU 47 1.953 -1.483 5.170 399 HD13 LEU 47 HD13 LEU 47 1.629 -2.884 4.120 400 HD21 LEU 47 HD21 LEU 47 -0.015 -4.884 6.866 401 HD22 LEU 47 HD22 LEU 47 -0.848 -3.866 5.700 402 HD23 LEU 47 HD23 LEU 47 0.452 -4.948 5.153 403 H ARG 48 H ARG 48 2.500 -0.538 7.954 404 HA ARG 48 HA ARG 48 0.741 -1.552 10.134 405 HB2 ARG 48 HB2 ARG 48 2.802 0.214 10.605 406 HB3 ARG 48 HB3 ARG 48 1.542 1.333 10.146 407 HG2 ARG 48 HG2 ARG 48 1.458 1.170 12.496 408 HG3 ARG 48 HG3 ARG 48 0.059 0.243 11.931 409 HD2 ARG 48 HD2 ARG 48 1.245 -1.855 12.274 410 HD3 ARG 48 HD3 ARG 48 2.767 -1.023 12.581 411 HE ARG 48 HE ARG 48 0.532 -1.400 14.442 412 HH11 ARG 48 HH11 ARG 48 0.824 -0.879 16.576 413 HH12 ARG 48 HH12 ARG 48 2.171 0.106 17.058 414 HH21 ARG 48 HH21 ARG 48 3.467 0.536 13.902 415 HH22 ARG 48 HH22 ARG 48 3.608 0.866 15.605 416 H ILE 49 H ILE 49 -1.353 -1.054 9.901 417 HA ILE 49 HA ILE 49 -2.133 1.103 7.971 418 HB ILE 49 HB ILE 49 -3.606 -1.515 8.336 419 HG12 ILE 49 HG12 ILE 49 -1.976 -0.384 6.015 420 HG13 ILE 49 HG13 ILE 49 -1.643 -1.850 6.937 421 HG21 ILE 49 HG21 ILE 49 -5.104 0.475 7.997 422 HG22 ILE 49 HG22 ILE 49 -4.268 0.774 6.451 423 HG23 ILE 49 HG23 ILE 49 -5.199 -0.721 6.725 424 HD11 ILE 49 HD11 ILE 49 -3.748 -2.863 6.008 425 HD12 ILE 49 HD12 ILE 49 -3.913 -1.426 4.957 426 HD13 ILE 49 HD13 ILE 49 -2.513 -2.474 4.797 427 H THR 50 H THR 50 -3.242 2.641 8.854 428 HA THR 50 HA THR 50 -4.764 2.229 11.392 429 HB THR 50 HB THR 50 -4.027 4.533 12.033 430 HG1 THR 50 HG1 THR 50 -2.497 5.552 10.832 431 HG21 THR 50 HG21 THR 50 -2.752 2.631 12.980 432 HG22 THR 50 HG22 THR 50 -1.664 2.659 11.576 433 HG23 THR 50 HG23 THR 50 -1.723 4.039 12.691 434 H SER 51 H SER 51 -6.370 4.118 11.724 435 HA SER 51 HA SER 51 -7.110 5.608 9.317 436 HB2 SER 51 HB2 SER 51 -9.455 4.916 9.362 437 HB3 SER 51 HB3 SER 51 -8.372 3.584 8.948 438 HG SER 51 HG SER 51 -9.379 4.080 11.575 439 H LYS 52 H LYS 52 -7.542 7.576 9.823 440 HA LYS 52 HA LYS 52 -8.840 8.334 12.404 441 HB2 LYS 52 HB2 LYS 52 -6.735 9.471 11.693 442 HB3 LYS 52 HB3 LYS 52 -7.586 10.073 10.263 443 HG2 LYS 52 HG2 LYS 52 -9.314 10.993 12.068 444 HG3 LYS 52 HG3 LYS 52 -7.956 10.797 13.169 445 HD2 LYS 52 HD2 LYS 52 -8.074 12.421 10.610 446 HD3 LYS 52 HD3 LYS 52 -8.023 13.062 12.275 447 HE2 LYS 52 HE2 LYS 52 -5.726 12.327 12.534 448 HE3 LYS 52 HE3 LYS 52 -5.784 11.429 11.017 449 HZ1 LYS 52 HZ1 LYS 52 -5.883 14.398 11.279 450 HZ2 LYS 52 HZ2 LYS 52 -4.657 13.516 10.675 451 HZ3 LYS 52 HZ3 LYS 52 -6.066 13.589 9.858 452 H GLY 53 H GLY 53 -10.772 7.353 11.813 453 HA2 GLY 53 HA2 GLY 53 -13.046 7.564 11.293 454 HA3 GLY 53 HA3 GLY 53 -12.701 9.081 10.462 455 H LYS 54 H LYS 54 -13.724 8.751 8.521 456 HA LYS 54 HA LYS 54 -13.440 6.299 6.943 457 HB2 LYS 54 HB2 LYS 54 -15.522 7.803 7.043 458 HB3 LYS 54 HB3 LYS 54 -14.619 8.903 5.972 459 HG2 LYS 54 HG2 LYS 54 -14.258 6.586 4.608 460 HG3 LYS 54 HG3 LYS 54 -15.669 6.117 5.515 461 HD2 LYS 54 HD2 LYS 54 -15.449 8.519 3.641 462 HD3 LYS 54 HD3 LYS 54 -16.137 6.948 3.251 463 HE2 LYS 54 HE2 LYS 54 -18.056 8.109 3.664 464 HE3 LYS 54 HE3 LYS 54 -17.764 7.358 5.235 465 HZ1 LYS 54 HZ1 LYS 54 -17.053 10.166 4.519 466 HZ2 LYS 54 HZ2 LYS 54 -18.342 9.737 5.413 467 HZ3 LYS 54 HZ3 LYS 54 -16.844 9.501 5.998 468 H THR 55 H THR 55 -10.990 7.190 7.548 469 HA THR 55 HA THR 55 -9.721 7.455 4.890 470 HB THR 55 HB THR 55 -8.815 9.289 7.147 471 HG1 THR 55 HG1 THR 55 -10.686 9.842 5.092 472 HG21 THR 55 HG21 THR 55 -8.495 9.293 4.104 473 HG22 THR 55 HG22 THR 55 -7.748 10.469 5.217 474 HG23 THR 55 HG23 THR 55 -7.255 8.763 5.261 475 H ALA 56 H ALA 56 -8.458 5.753 4.874 476 HA ALA 56 HA ALA 56 -7.086 4.931 7.375 477 HB1 ALA 56 HB1 ALA 56 -7.491 3.384 4.815 478 HB2 ALA 56 HB2 ALA 56 -6.442 2.877 6.150 479 HB3 ALA 56 HB3 ALA 56 -8.177 3.070 6.413 480 H TYR 57 H TYR 57 -4.796 4.424 7.242 481 HA TYR 57 HA TYR 57 -3.261 6.068 5.302 482 HB2 TYR 57 HB2 TYR 57 -2.954 6.076 8.324 483 HB3 TYR 57 HB3 TYR 57 -1.831 6.801 7.192 484 HD1 TYR 57 HD1 TYR 57 -5.345 6.999 8.511 485 HD2 TYR 57 HD2 TYR 57 -2.176 9.028 6.404 486 HE1 TYR 57 HE1 TYR 57 -6.689 9.058 8.503 487 HE2 TYR 57 HE2 TYR 57 -3.501 11.143 6.481 488 HH TYR 57 HH TYR 57 -6.778 11.291 7.924 489 H ILE 58 H ILE 58 -2.148 4.553 4.242 490 HA ILE 58 HA ILE 58 -1.171 2.085 5.561 491 HB ILE 58 HB ILE 58 -0.132 3.205 2.947 492 HG12 ILE 58 HG12 ILE 58 -2.499 3.193 2.560 493 HG13 ILE 58 HG13 ILE 58 -1.709 1.909 1.667 494 HG21 ILE 58 HG21 ILE 58 -0.312 0.419 4.127 495 HG22 ILE 58 HG22 ILE 58 0.330 0.819 2.514 496 HG23 ILE 58 HG23 ILE 58 1.148 1.411 3.961 497 HD11 ILE 58 HD11 ILE 58 -3.855 1.222 2.591 498 HD12 ILE 58 HD12 ILE 58 -2.545 0.232 3.264 499 HD13 ILE 58 HD13 ILE 58 -3.289 1.521 4.245 500 H LYS 59 H LYS 59 0.419 2.301 6.999 501 HA LYS 59 HA LYS 59 2.575 4.394 6.673 502 HB2 LYS 59 HB2 LYS 59 1.166 3.208 9.053 503 HB3 LYS 59 HB3 LYS 59 2.837 3.779 9.208 504 HG2 LYS 59 HG2 LYS 59 2.233 6.000 8.490 505 HG3 LYS 59 HG3 LYS 59 0.570 5.506 8.113 506 HD2 LYS 59 HD2 LYS 59 -0.038 5.305 10.363 507 HD3 LYS 59 HD3 LYS 59 1.621 5.001 10.896 508 HE2 LYS 59 HE2 LYS 59 1.069 7.132 11.708 509 HE3 LYS 59 HE3 LYS 59 2.212 7.367 10.358 510 HZ1 LYS 59 HZ1 LYS 59 0.367 8.061 8.984 511 HZ2 LYS 59 HZ2 LYS 59 -0.735 7.612 10.176 512 HZ3 LYS 59 HZ3 LYS 59 0.248 8.877 10.395 513 H LEU 60 H LEU 60 4.321 3.494 5.735 514 HA LEU 60 HA LEU 60 4.951 0.624 6.221 515 HB2 LEU 60 HB2 LEU 60 6.059 2.689 4.291 516 HB3 LEU 60 HB3 LEU 60 6.682 1.048 4.449 517 HG LEU 60 HG LEU 60 3.789 1.671 3.697 518 HD11 LEU 60 HD11 LEU 60 5.308 2.520 1.978 519 HD12 LEU 60 HD12 LEU 60 6.172 0.970 1.952 520 HD13 LEU 60 HD13 LEU 60 4.484 1.062 1.399 521 HD21 LEU 60 HD21 LEU 60 4.115 -0.604 4.641 522 HD22 LEU 60 HD22 LEU 60 3.779 -0.677 2.911 523 HD23 LEU 60 HD23 LEU 60 5.442 -0.890 3.497 524 H GLU 61 H GLU 61 6.487 -0.043 7.535 525 HA GLU 61 HA GLU 61 8.062 1.979 9.072 526 HB2 GLU 61 HB2 GLU 61 6.782 -0.644 9.896 527 HB3 GLU 61 HB3 GLU 61 7.818 0.344 10.924 528 HG2 GLU 61 HG2 GLU 61 6.175 2.195 10.804 529 HG3 GLU 61 HG3 GLU 61 5.116 1.181 9.816 530 H ASP 62 H ASP 62 10.252 1.322 9.832 531 HA ASP 62 HA ASP 62 11.529 -0.588 8.056 532 HB2 ASP 62 HB2 ASP 62 13.496 0.279 8.703 533 HB3 ASP 62 HB3 ASP 62 12.463 1.659 9.068 534 H LYS 63 H LYS 63 12.739 -2.426 8.732 535 HA LYS 63 HA LYS 63 11.057 -4.136 10.350 536 HB2 LYS 63 HB2 LYS 63 12.674 -4.474 8.123 537 HB3 LYS 63 HB3 LYS 63 13.625 -5.272 9.365 538 HG2 LYS 63 HG2 LYS 63 11.678 -6.673 9.982 539 HG3 LYS 63 HG3 LYS 63 10.671 -5.833 8.797 540 HD2 LYS 63 HD2 LYS 63 13.118 -7.533 8.151 541 HD3 LYS 63 HD3 LYS 63 11.427 -8.035 7.980 542 HE2 LYS 63 HE2 LYS 63 11.048 -6.198 6.343 543 HE3 LYS 63 HE3 LYS 63 12.755 -5.737 6.474 544 HZ1 LYS 63 HZ1 LYS 63 11.657 -8.250 5.366 545 HZ2 LYS 63 HZ2 LYS 63 12.555 -7.106 4.587 546 HZ3 LYS 63 HZ3 LYS 63 13.261 -8.064 5.707 547 H VAL 64 H VAL 64 13.443 -2.143 11.429 548 HA VAL 64 HA VAL 64 14.411 -3.989 13.572 549 HB VAL 64 HB VAL 64 15.837 -1.492 12.595 550 HG11 VAL 64 HG11 VAL 64 16.797 -3.989 14.048 551 HG12 VAL 64 HG12 VAL 64 17.804 -2.605 13.562 552 HG13 VAL 64 HG13 VAL 64 16.539 -2.383 14.772 553 HG21 VAL 64 HG21 VAL 64 15.688 -2.873 10.607 554 HG22 VAL 64 HG22 VAL 64 17.322 -2.980 11.259 555 HG23 VAL 64 HG23 VAL 64 16.182 -4.322 11.524 556 H SER 65 H SER 65 13.427 -0.592 12.909 557 HA SER 65 HA SER 65 13.033 -0.263 15.857 558 HB2 SER 65 HB2 SER 65 13.948 1.801 13.824 559 HB3 SER 65 HB3 SER 65 13.633 2.109 15.537 560 HG SER 65 HG SER 65 15.862 1.712 15.112 561 H GLY 66 H GLY 66 11.337 -0.216 12.883 562 HA2 GLY 66 HA2 GLY 66 9.075 0.055 12.569 563 HA3 GLY 66 HA3 GLY 66 8.873 0.613 14.227 564 H GLU 67 H GLU 67 11.290 2.258 12.270 565 HA GLU 67 HA GLU 67 9.812 4.791 12.516 566 HB2 GLU 67 HB2 GLU 67 12.536 4.123 11.337 567 HB3 GLU 67 HB3 GLU 67 11.856 5.740 11.385 568 HG2 GLU 67 HG2 GLU 67 12.483 3.999 13.793 569 HG3 GLU 67 HG3 GLU 67 13.424 5.375 13.214 570 H LEU 68 H LEU 68 9.394 6.217 10.764 571 HA LEU 68 HA LEU 68 7.883 4.722 8.811 572 HB2 LEU 68 HB2 LEU 68 7.118 6.810 10.068 573 HB3 LEU 68 HB3 LEU 68 8.144 7.737 8.975 574 HG LEU 68 HG LEU 68 6.803 6.624 7.045 575 HD11 LEU 68 HD11 LEU 68 4.850 6.100 9.336 576 HD12 LEU 68 HD12 LEU 68 4.549 5.857 7.601 577 HD13 LEU 68 HD13 LEU 68 5.715 4.838 8.443 578 HD21 LEU 68 HD21 LEU 68 6.518 8.976 7.703 579 HD22 LEU 68 HD22 LEU 68 4.974 8.244 7.247 580 HD23 LEU 68 HD23 LEU 68 5.361 8.496 8.965 581 H PHE 69 H PHE 69 8.395 4.126 6.863 582 HA PHE 69 HA PHE 69 10.625 5.277 5.269 583 HB2 PHE 69 HB2 PHE 69 10.472 2.919 5.248 584 HB3 PHE 69 HB3 PHE 69 8.734 2.934 5.002 585 HD1 PHE 69 HD1 PHE 69 8.154 2.036 2.948 586 HD2 PHE 69 HD2 PHE 69 11.639 4.557 3.189 587 HE1 PHE 69 HE1 PHE 69 8.509 1.775 0.512 588 HE2 PHE 69 HE2 PHE 69 11.959 4.347 0.752 589 HZ PHE 69 HZ PHE 69 10.381 2.952 -0.612 590 H ALA 70 H ALA 70 7.086 4.791 4.920 591 HA ALA 70 HA ALA 70 6.727 7.379 3.623 592 HB1 ALA 70 HB1 ALA 70 5.722 6.427 1.571 593 HB2 ALA 70 HB2 ALA 70 7.427 5.961 1.695 594 HB3 ALA 70 HB3 ALA 70 6.150 4.790 2.096 595 H GLN 71 H GLN 71 4.388 7.848 3.284 596 HA GLN 71 HA GLN 71 2.560 5.835 4.291 597 HB2 GLN 71 HB2 GLN 71 1.298 7.301 5.768 598 HB3 GLN 71 HB3 GLN 71 2.951 7.064 6.328 599 HG2 GLN 71 HG2 GLN 71 3.593 9.290 5.435 600 HG3 GLN 71 HG3 GLN 71 1.944 9.547 4.858 601 HE21 GLN 71 HE21 GLN 71 2.436 11.133 8.272 602 HE22 GLN 71 HE22 GLN 71 3.396 11.217 6.803 603 H ALA 72 H ALA 72 0.500 5.870 3.539 604 HA ALA 72 HA ALA 72 -0.098 7.773 1.304 605 HB1 ALA 72 HB1 ALA 72 -0.597 4.789 1.476 606 HB2 ALA 72 HB2 ALA 72 -1.190 5.845 0.195 607 HB3 ALA 72 HB3 ALA 72 0.554 5.631 0.406 608 HA PRO 73 HA PRO 73 -3.962 7.979 3.836 609 HB2 PRO 73 HB2 PRO 73 -4.415 10.490 2.286 610 HB3 PRO 73 HB3 PRO 73 -4.465 10.223 4.051 611 HG2 PRO 73 HG2 PRO 73 -2.389 11.552 2.874 612 HG3 PRO 73 HG3 PRO 73 -2.100 10.411 4.226 613 HD2 PRO 73 HD2 PRO 73 -1.840 9.875 1.246 614 HD3 PRO 73 HD3 PRO 73 -0.676 9.527 2.562 615 H VAL 74 H VAL 74 -5.897 7.057 3.225 616 HA VAL 74 HA VAL 74 -6.795 7.223 0.374 617 HB VAL 74 HB VAL 74 -5.842 5.080 0.761 618 HG11 VAL 74 HG11 VAL 74 -7.846 4.517 2.926 619 HG12 VAL 74 HG12 VAL 74 -6.754 3.343 2.174 620 HG13 VAL 74 HG13 VAL 74 -6.075 4.669 3.111 621 HG21 VAL 74 HG21 VAL 74 -7.865 5.279 -0.723 622 HG22 VAL 74 HG22 VAL 74 -7.676 3.668 -0.027 623 HG23 VAL 74 HG23 VAL 74 -8.865 4.764 0.655 624 H GLU 75 H GLU 75 -8.840 7.781 0.006 625 HA GLU 75 HA GLU 75 -10.718 7.999 2.322 626 HB2 GLU 75 HB2 GLU 75 -10.426 9.686 -0.191 627 HB3 GLU 75 HB3 GLU 75 -11.729 9.869 0.988 628 HG2 GLU 75 HG2 GLU 75 -10.142 10.446 2.748 629 HG3 GLU 75 HG3 GLU 75 -8.774 10.185 1.662 630 H GLN 76 H GLN 76 -10.201 6.091 -0.361 631 HA GLN 76 HA GLN 76 -12.849 5.042 -0.410 632 HB2 GLN 76 HB2 GLN 76 -13.457 5.461 -2.667 633 HB3 GLN 76 HB3 GLN 76 -13.094 7.020 -1.953 634 HG2 GLN 76 HG2 GLN 76 -11.332 5.477 -3.895 635 HG3 GLN 76 HG3 GLN 76 -12.328 6.864 -4.261 636 HE21 GLN 76 HE21 GLN 76 -8.631 7.458 -2.663 637 HE22 GLN 76 HE22 GLN 76 -9.340 5.826 -2.655 638 H TYR 77 H TYR 77 -12.853 2.928 -1.162 639 HA TYR 77 HA TYR 77 -10.457 1.932 -2.578 640 HB2 TYR 77 HB2 TYR 77 -10.285 1.479 -0.120 641 HB3 TYR 77 HB3 TYR 77 -11.722 0.469 -0.243 642 HD1 TYR 77 HD1 TYR 77 -8.716 0.813 -2.483 643 HD2 TYR 77 HD2 TYR 77 -10.885 -1.757 0.209 644 HE1 TYR 77 HE1 TYR 77 -7.141 -0.977 -2.962 645 HE2 TYR 77 HE2 TYR 77 -9.286 -3.590 -0.299 646 HH TYR 77 HH TYR 77 -6.552 -3.175 -2.571 647 HA PRO 78 HA PRO 78 -9.853 0.474 -4.328 648 HB2 PRO 78 HB2 PRO 78 -11.276 0.693 -6.957 649 HB3 PRO 78 HB3 PRO 78 -9.819 -0.257 -6.527 650 HG2 PRO 78 HG2 PRO 78 -12.207 -1.497 -6.756 651 HG3 PRO 78 HG3 PRO 78 -11.145 -1.885 -5.359 652 HD2 PRO 78 HD2 PRO 78 -13.490 0.048 -5.449 653 HD3 PRO 78 HD3 PRO 78 -13.152 -1.248 -4.262 654 H GLY 79 H GLY 79 -8.542 2.161 -5.305 655 HA2 GLY 79 HA2 GLY 79 -9.685 4.555 -6.459 656 HA3 GLY 79 HA3 GLY 79 -9.167 4.816 -4.793 657 H ILE 80 H ILE 80 -7.730 6.399 -5.854 658 HA ILE 80 HA ILE 80 -5.470 5.420 -7.439 659 HB ILE 80 HB ILE 80 -6.469 7.620 -7.877 660 HG12 ILE 80 HG12 ILE 80 -4.480 9.005 -8.032 661 HG13 ILE 80 HG13 ILE 80 -3.619 7.998 -6.875 662 HG21 ILE 80 HG21 ILE 80 -5.376 8.499 -5.164 663 HG22 ILE 80 HG22 ILE 80 -6.129 9.534 -6.382 664 HG23 ILE 80 HG23 ILE 80 -7.099 8.304 -5.572 665 HD11 ILE 80 HD11 ILE 80 -4.611 7.056 -9.604 666 HD12 ILE 80 HD12 ILE 80 -2.958 7.595 -9.240 667 HD13 ILE 80 HD13 ILE 80 -3.589 6.130 -8.474 668 H ALA 81 H ALA 81 -6.202 5.888 -4.062 669 HA ALA 81 HA ALA 81 -3.399 5.977 -3.322 670 HB1 ALA 81 HB1 ALA 81 -5.912 5.952 -1.611 671 HB2 ALA 81 HB2 ALA 81 -4.254 6.219 -1.019 672 HB3 ALA 81 HB3 ALA 81 -5.016 7.399 -2.115 673 H VAL 82 H VAL 82 -5.561 3.478 -3.940 674 HA VAL 82 HA VAL 82 -3.466 1.593 -3.428 675 HB VAL 82 HB VAL 82 -4.146 1.532 -1.238 676 HG11 VAL 82 HG11 VAL 82 -6.058 2.310 -0.650 677 HG12 VAL 82 HG12 VAL 82 -6.875 1.856 -2.143 678 HG13 VAL 82 HG13 VAL 82 -6.654 0.660 -0.842 679 HG21 VAL 82 HG21 VAL 82 -4.744 -0.804 -0.944 680 HG22 VAL 82 HG22 VAL 82 -5.091 -0.930 -2.682 681 HG23 VAL 82 HG23 VAL 82 -3.473 -0.516 -2.149 682 H GLU 83 H GLU 83 -3.475 0.578 -5.247 683 HA GLU 83 HA GLU 83 -6.001 -0.309 -6.586 684 HB2 GLU 83 HB2 GLU 83 -4.174 1.656 -7.479 685 HB3 GLU 83 HB3 GLU 83 -3.709 0.211 -8.366 686 HG2 GLU 83 HG2 GLU 83 -6.534 1.359 -8.253 687 HG3 GLU 83 HG3 GLU 83 -5.357 1.700 -9.520 688 H THR 84 H THR 84 -5.854 -2.243 -7.863 689 HA THR 84 HA THR 84 -3.635 -4.092 -7.042 690 HB THR 84 HB THR 84 -6.142 -5.042 -8.301 691 HG1 THR 84 HG1 THR 84 -7.098 -5.257 -6.270 692 HG21 THR 84 HG21 THR 84 -4.310 -6.554 -7.992 693 HG22 THR 84 HG22 THR 84 -4.231 -6.181 -6.249 694 HG23 THR 84 HG23 THR 84 -5.648 -7.022 -6.929 695 H VAL 85 H VAL 85 -2.324 -3.266 -8.433 696 HA VAL 85 HA VAL 85 -1.241 -3.022 -10.578 697 HB VAL 85 HB VAL 85 -0.349 -5.437 -10.856 698 HG11 VAL 85 HG11 VAL 85 -0.137 -3.908 -8.213 699 HG12 VAL 85 HG12 VAL 85 1.037 -5.075 -8.830 700 HG13 VAL 85 HG13 VAL 85 0.770 -3.567 -9.699 701 HG21 VAL 85 HG21 VAL 85 -2.278 -6.581 -9.614 702 HG22 VAL 85 HG22 VAL 85 -0.655 -6.953 -9.050 703 HG23 VAL 85 HG23 VAL 85 -1.669 -5.823 -8.143 704 H THR 86 H THR 86 -2.959 -6.056 -11.085 705 HA THR 86 HA THR 86 -4.537 -4.823 -13.180 706 HB THR 86 HB THR 86 -4.476 -6.964 -14.576 707 HG1 THR 86 HG1 THR 86 -2.603 -8.150 -14.485 708 HG21 THR 86 HG21 THR 86 -1.899 -5.378 -14.458 709 HG22 THR 86 HG22 THR 86 -2.540 -6.234 -15.886 710 HG23 THR 86 HG23 THR 86 -3.379 -4.794 -15.265 711 H ASP 87 H ASP 87 -3.863 -7.833 -11.412 712 HA ASP 87 HA ASP 87 -6.745 -8.077 -10.706 713 HB2 ASP 87 HB2 ASP 87 -6.563 -9.028 -12.947 714 HB3 ASP 87 HB3 ASP 87 -5.244 -10.057 -12.422 715 H SER 88 H SER 88 -3.958 -10.395 -10.645 716 HA SER 88 HA SER 88 -4.308 -11.468 -8.144 717 HB2 SER 88 HB2 SER 88 -2.279 -11.840 -9.618 718 HB3 SER 88 HB3 SER 88 -1.536 -10.463 -8.831 719 HG SER 88 HG SER 88 -1.423 -12.807 -7.984 720 H SER 89 H SER 89 -4.122 -10.987 -6.114 721 HA SER 89 HA SER 89 -3.262 -8.267 -5.287 722 HB2 SER 89 HB2 SER 89 -4.975 -8.419 -3.596 723 HB3 SER 89 HB3 SER 89 -5.564 -8.624 -5.267 724 HG SER 89 HG SER 89 -6.547 -10.165 -3.928 725 H ARG 90 H ARG 90 -1.523 -10.593 -5.617 726 HA ARG 90 HA ARG 90 -0.179 -10.760 -2.990 727 HB2 ARG 90 HB2 ARG 90 0.142 -12.324 -5.018 728 HB3 ARG 90 HB3 ARG 90 1.070 -11.019 -5.743 729 HG2 ARG 90 HG2 ARG 90 2.600 -11.058 -3.733 730 HG3 ARG 90 HG3 ARG 90 1.692 -12.433 -3.102 731 HD2 ARG 90 HD2 ARG 90 3.243 -12.364 -5.733 732 HD3 ARG 90 HD3 ARG 90 3.827 -13.039 -4.223 733 HE ARG 90 HE ARG 90 2.500 -14.926 -4.487 734 HH11 ARG 90 HH11 ARG 90 1.252 -16.388 -5.683 735 HH12 ARG 90 HH12 ARG 90 0.474 -15.846 -7.158 736 HH21 ARG 90 HH21 ARG 90 1.712 -12.674 -7.044 737 HH22 ARG 90 HH22 ARG 90 0.641 -13.815 -7.838 738 H TYR 91 H TYR 91 -0.471 -8.531 -5.631 739 HA TYR 91 HA TYR 91 1.554 -6.681 -4.474 740 HB2 TYR 91 HB2 TYR 91 0.763 -6.860 -7.384 741 HB3 TYR 91 HB3 TYR 91 2.122 -5.990 -6.714 742 HD1 TYR 91 HD1 TYR 91 4.074 -7.342 -5.768 743 HD2 TYR 91 HD2 TYR 91 0.956 -9.048 -8.205 744 HE1 TYR 91 HE1 TYR 91 5.539 -9.308 -6.273 745 HE2 TYR 91 HE2 TYR 91 2.426 -10.972 -8.751 746 HH TYR 91 HH TYR 91 5.698 -11.329 -7.327 747 H PHE 92 H PHE 92 1.214 -4.446 -4.865 748 HA PHE 92 HA PHE 92 -1.448 -3.499 -5.735 749 HB2 PHE 92 HB2 PHE 92 -0.317 -2.829 -2.991 750 HB3 PHE 92 HB3 PHE 92 -1.750 -2.113 -3.715 751 HD1 PHE 92 HD1 PHE 92 -0.443 -4.918 -1.848 752 HD2 PHE 92 HD2 PHE 92 -3.761 -3.589 -4.265 753 HE1 PHE 92 HE1 PHE 92 -1.845 -6.757 -0.959 754 HE2 PHE 92 HE2 PHE 92 -5.139 -5.475 -3.419 755 HZ PHE 92 HZ PHE 92 -4.167 -7.080 -1.775 756 H VAL 93 H VAL 93 -1.475 -1.080 -5.809 757 HA VAL 93 HA VAL 93 1.195 0.220 -5.710 758 HB VAL 93 HB VAL 93 -0.916 0.829 -7.814 759 HG11 VAL 93 HG11 VAL 93 0.808 2.430 -8.657 760 HG12 VAL 93 HG12 VAL 93 0.160 2.904 -7.096 761 HG13 VAL 93 HG13 VAL 93 1.768 2.146 -7.202 762 HG21 VAL 93 HG21 VAL 93 0.345 -1.163 -8.429 763 HG22 VAL 93 HG22 VAL 93 0.921 0.197 -9.398 764 HG23 VAL 93 HG23 VAL 93 1.882 -0.365 -8.023 765 H ILE 94 H ILE 94 1.210 2.018 -4.427 766 HA ILE 94 HA ILE 94 -1.410 3.233 -3.686 767 HB ILE 94 HB ILE 94 -0.772 3.514 -1.398 768 HG12 ILE 94 HG12 ILE 94 1.758 1.915 -1.967 769 HG13 ILE 94 HG13 ILE 94 1.702 3.654 -1.680 770 HG21 ILE 94 HG21 ILE 94 -0.280 0.568 -2.007 771 HG22 ILE 94 HG22 ILE 94 -1.117 1.312 -0.621 772 HG23 ILE 94 HG23 ILE 94 -1.859 1.338 -2.203 773 HD11 ILE 94 HD11 ILE 94 0.916 1.494 0.309 774 HD12 ILE 94 HD12 ILE 94 2.321 2.575 0.396 775 HD13 ILE 94 HD13 ILE 94 0.679 3.220 0.566 776 H ARG 95 H ARG 95 -1.433 5.408 -3.171 777 HA ARG 95 HA ARG 95 0.866 6.992 -4.219 778 HB2 ARG 95 HB2 ARG 95 -0.526 8.800 -4.602 779 HB3 ARG 95 HB3 ARG 95 -1.423 7.387 -5.127 780 HG2 ARG 95 HG2 ARG 95 -3.126 8.412 -4.047 781 HG3 ARG 95 HG3 ARG 95 -2.440 7.580 -2.644 782 HD2 ARG 95 HD2 ARG 95 -1.141 9.635 -2.107 783 HD3 ARG 95 HD3 ARG 95 -2.010 10.459 -3.409 784 HE ARG 95 HE ARG 95 -3.260 9.192 -0.962 785 HH11 ARG 95 HH11 ARG 95 -5.113 9.919 -0.221 786 HH12 ARG 95 HH12 ARG 95 -5.878 11.346 -0.895 787 HH21 ARG 95 HH21 ARG 95 -3.495 11.765 -3.348 788 HH22 ARG 95 HH22 ARG 95 -4.985 12.350 -2.662 789 H ILE 96 H ILE 96 2.344 7.524 -2.845 790 HA ILE 96 HA ILE 96 1.695 7.938 0.036 791 HB ILE 96 HB ILE 96 4.156 7.804 0.377 792 HG12 ILE 96 HG12 ILE 96 4.331 6.579 -2.403 793 HG13 ILE 96 HG13 ILE 96 4.667 8.294 -2.131 794 HG21 ILE 96 HG21 ILE 96 2.733 5.405 -0.840 795 HG22 ILE 96 HG22 ILE 96 4.214 5.295 0.122 796 HG23 ILE 96 HG23 ILE 96 2.735 5.899 0.864 797 HD11 ILE 96 HD11 ILE 96 6.392 7.719 -0.489 798 HD12 ILE 96 HD12 ILE 96 6.152 5.993 -0.871 799 HD13 ILE 96 HD13 ILE 96 6.723 7.116 -2.134 800 H GLN 97 H GLN 97 2.360 9.786 1.151 801 HA GLN 97 HA GLN 97 2.772 12.251 -0.441 802 HB2 GLN 97 HB2 GLN 97 2.461 11.594 2.503 803 HB3 GLN 97 HB3 GLN 97 3.031 13.178 2.000 804 HG2 GLN 97 HG2 GLN 97 0.492 12.138 0.741 805 HG3 GLN 97 HG3 GLN 97 0.455 12.692 2.417 806 HE21 GLN 97 HE21 GLN 97 0.923 15.494 -0.528 807 HE22 GLN 97 HE22 GLN 97 1.067 13.797 -0.957 808 H ASP 98 H ASP 98 4.708 13.357 -0.692 809 HA ASP 98 HA ASP 98 7.180 12.075 0.309 810 HB2 ASP 98 HB2 ASP 98 6.874 12.957 -2.045 811 HB3 ASP 98 HB3 ASP 98 6.839 14.577 -1.341 812 H GLY 99 H GLY 99 4.966 14.073 1.689 813 HA2 GLY 99 HA2 GLY 99 5.000 15.117 3.748 814 HA3 GLY 99 HA3 GLY 99 6.741 14.862 3.850 815 H THR 100 H THR 100 5.752 16.521 0.999 816 HA THR 100 HA THR 100 6.163 19.212 2.186 817 HB THR 100 HB THR 100 8.345 18.308 1.606 818 HG1 THR 100 HG1 THR 100 9.037 20.175 0.614 819 HG21 THR 100 HG21 THR 100 7.761 17.045 -0.411 820 HG22 THR 100 HG22 THR 100 7.437 18.569 -1.273 821 HG23 THR 100 HG23 THR 100 9.078 18.193 -0.702 822 H GLY 101 H GLY 101 3.799 17.936 1.201 823 HA2 GLY 101 HA2 GLY 101 1.854 18.872 0.340 824 HA3 GLY 101 HA3 GLY 101 2.788 20.145 -0.450 825 H ARG 102 H ARG 102 3.747 16.842 -0.953 826 HA ARG 102 HA ARG 102 2.467 16.622 -3.618 827 HB2 ARG 102 HB2 ARG 102 4.509 16.536 -4.784 828 HB3 ARG 102 HB3 ARG 102 4.582 17.976 -3.734 829 HG2 ARG 102 HG2 ARG 102 6.004 16.665 -2.149 830 HG3 ARG 102 HG3 ARG 102 6.016 15.334 -3.334 831 HD2 ARG 102 HD2 ARG 102 7.010 16.842 -5.024 832 HD3 ARG 102 HD3 ARG 102 7.013 18.165 -3.839 833 HE ARG 102 HE ARG 102 8.412 15.885 -2.759 834 HH11 ARG 102 HH11 ARG 102 10.441 15.800 -2.524 835 HH12 ARG 102 HH12 ARG 102 11.563 16.841 -3.410 836 HH21 ARG 102 HH21 ARG 102 8.990 18.427 -5.119 837 HH22 ARG 102 HH22 ARG 102 10.715 18.330 -4.879 838 H SER 103 H SER 103 2.868 14.550 -4.677 839 HA SER 103 HA SER 103 3.350 12.334 -2.741 840 HB2 SER 103 HB2 SER 103 0.974 12.658 -4.608 841 HB3 SER 103 HB3 SER 103 1.346 11.179 -3.704 842 HG SER 103 HG SER 103 -0.176 12.630 -2.669 843 H ALA 104 H ALA 104 3.634 10.251 -3.621 844 HA ALA 104 HA ALA 104 4.568 9.986 -6.435 845 HB1 ALA 104 HB1 ALA 104 6.563 10.415 -5.054 846 HB2 ALA 104 HB2 ALA 104 6.096 9.094 -3.960 847 HB3 ALA 104 HB3 ALA 104 6.539 8.740 -5.645 848 H PHE 105 H PHE 105 4.380 7.882 -7.312 849 HA PHE 105 HA PHE 105 2.562 6.080 -5.799 850 HB2 PHE 105 HB2 PHE 105 3.320 5.914 -8.715 851 HB3 PHE 105 HB3 PHE 105 2.020 5.067 -7.884 852 HD1 PHE 105 HD1 PHE 105 2.902 7.981 -9.773 853 HD2 PHE 105 HD2 PHE 105 0.173 6.598 -6.727 854 HE1 PHE 105 HE1 PHE 105 1.419 9.912 -10.222 855 HE2 PHE 105 HE2 PHE 105 -1.329 8.512 -7.220 856 HZ PHE 105 HZ PHE 105 -0.724 10.166 -8.959 857 H ILE 106 H ILE 106 3.226 4.245 -4.932 858 HA ILE 106 HA ILE 106 5.739 2.973 -5.946 859 HB ILE 106 HB ILE 106 6.163 1.984 -3.757 860 HG12 ILE 106 HG12 ILE 106 4.118 3.973 -2.644 861 HG13 ILE 106 HG13 ILE 106 3.875 2.230 -2.765 862 HG21 ILE 106 HG21 ILE 106 7.249 4.122 -4.643 863 HG22 ILE 106 HG22 ILE 106 6.107 5.048 -3.662 864 HG23 ILE 106 HG23 ILE 106 7.282 3.971 -2.880 865 HD11 ILE 106 HD11 ILE 106 5.724 1.797 -1.231 866 HD12 ILE 106 HD12 ILE 106 6.007 3.548 -1.052 867 HD13 ILE 106 HD13 ILE 106 4.487 2.832 -0.505 868 H GLY 107 H GLY 107 5.746 0.925 -6.453 869 HA2 GLY 107 HA2 GLY 107 3.287 -0.699 -6.303 870 HA3 GLY 107 HA3 GLY 107 4.791 -1.125 -7.121 871 H ILE 108 H ILE 108 3.054 -2.406 -4.928 872 HA ILE 108 HA ILE 108 5.235 -2.960 -2.970 873 HB ILE 108 HB ILE 108 2.261 -3.184 -2.353 874 HG12 ILE 108 HG12 ILE 108 4.267 -0.926 -1.864 875 HG13 ILE 108 HG13 ILE 108 2.722 -0.822 -2.705 876 HG21 ILE 108 HG21 ILE 108 4.740 -3.252 -0.593 877 HG22 ILE 108 HG22 ILE 108 3.054 -3.411 -0.037 878 HG23 ILE 108 HG23 ILE 108 3.741 -4.661 -1.030 879 HD11 ILE 108 HD11 ILE 108 3.106 -1.220 0.286 880 HD12 ILE 108 HD12 ILE 108 2.571 0.221 -0.553 881 HD13 ILE 108 HD13 ILE 108 1.531 -1.229 -0.564 882 H GLY 109 H GLY 109 5.574 -5.158 -2.459 883 HA2 GLY 109 HA2 GLY 109 3.663 -7.208 -3.390 884 HA3 GLY 109 HA3 GLY 109 5.345 -7.410 -3.895 885 H PHE 110 H PHE 110 3.342 -8.707 -1.856 886 HA PHE 110 HA PHE 110 5.035 -8.645 0.595 887 HB2 PHE 110 HB2 PHE 110 2.358 -9.899 0.001 888 HB3 PHE 110 HB3 PHE 110 3.208 -10.115 1.497 889 HD1 PHE 110 HD1 PHE 110 2.780 -8.782 3.302 890 HD2 PHE 110 HD2 PHE 110 1.977 -7.184 -0.637 891 HE1 PHE 110 HE1 PHE 110 1.724 -6.800 4.316 892 HE2 PHE 110 HE2 PHE 110 0.988 -5.171 0.394 893 HZ PHE 110 HZ PHE 110 0.872 -4.958 2.859 894 H THR 111 H THR 111 5.622 -10.575 1.684 895 HA THR 111 HA THR 111 6.945 -12.498 -0.023 896 HB THR 111 HB THR 111 7.763 -11.531 2.121 897 HG1 THR 111 HG1 THR 111 8.846 -13.421 2.645 898 HG21 THR 111 HG21 THR 111 5.758 -11.912 3.539 899 HG22 THR 111 HG22 THR 111 6.037 -13.665 3.436 900 HG23 THR 111 HG23 THR 111 7.228 -12.616 4.230 901 H ASP 112 H ASP 112 3.893 -12.392 1.579 902 HA ASP 112 HA ASP 112 3.266 -15.161 0.672 903 HB2 ASP 112 HB2 ASP 112 3.543 -14.815 3.221 904 HB3 ASP 112 HB3 ASP 112 2.025 -13.911 3.134 905 H ARG 113 H ARG 113 1.394 -15.472 -0.416 906 HA ARG 113 HA ARG 113 -0.041 -13.328 -1.643 907 HB2 ARG 113 HB2 ARG 113 0.225 -15.714 -2.474 908 HB3 ARG 113 HB3 ARG 113 -0.882 -16.239 -1.212 909 HG2 ARG 113 HG2 ARG 113 -2.055 -16.125 -3.308 910 HG3 ARG 113 HG3 ARG 113 -2.695 -14.858 -2.254 911 HD2 ARG 113 HD2 ARG 113 -1.409 -13.153 -3.446 912 HD3 ARG 113 HD3 ARG 113 -0.537 -14.398 -4.346 913 HE ARG 113 HE ARG 113 -2.280 -14.561 -5.868 914 HH11 ARG 113 HH11 ARG 113 -3.922 -14.045 -6.847 915 HH12 ARG 113 HH12 ARG 113 -5.337 -13.266 -6.070 916 HH21 ARG 113 HH21 ARG 113 -3.553 -12.753 -3.136 917 HH22 ARG 113 HH22 ARG 113 -4.895 -12.169 -4.081 918 H GLY 114 H GLY 114 -0.677 -15.134 1.334 919 HA2 GLY 114 HA2 GLY 114 -3.345 -14.062 1.784 920 HA3 GLY 114 HA3 GLY 114 -2.340 -14.976 2.915 921 H ASP 115 H ASP 115 -0.037 -13.069 2.746 922 HA ASP 115 HA ASP 115 -0.937 -11.148 4.731 923 HB2 ASP 115 HB2 ASP 115 1.693 -11.418 3.256 924 HB3 ASP 115 HB3 ASP 115 1.355 -10.191 4.478 925 H ALA 116 H ALA 116 -0.236 -10.929 1.249 926 HA ALA 116 HA ALA 116 -0.930 -8.120 1.058 927 HB1 ALA 116 HB1 ALA 116 0.496 -9.237 -0.586 928 HB2 ALA 116 HB2 ALA 116 -0.809 -10.371 -0.982 929 HB3 ALA 116 HB3 ALA 116 -0.935 -8.636 -1.372 930 H PHE 117 H PHE 117 -2.824 -11.194 0.601 931 HA PHE 117 HA PHE 117 -5.240 -9.888 -0.168 932 HB2 PHE 117 HB2 PHE 117 -4.722 -12.325 -0.360 933 HB3 PHE 117 HB3 PHE 117 -4.923 -12.465 1.385 934 HD1 PHE 117 HD1 PHE 117 -7.113 -12.696 2.333 935 HD2 PHE 117 HD2 PHE 117 -6.685 -11.586 -1.812 936 HE1 PHE 117 HE1 PHE 117 -9.533 -13.129 1.962 937 HE2 PHE 117 HE2 PHE 117 -9.105 -11.890 -2.143 938 HZ PHE 117 HZ PHE 117 -10.545 -12.688 -0.268 939 H ASP 118 H ASP 118 -3.826 -10.374 3.073 940 HA ASP 118 HA ASP 118 -6.112 -9.328 4.532 941 HB2 ASP 118 HB2 ASP 118 -3.189 -9.808 5.194 942 HB3 ASP 118 HB3 ASP 118 -4.247 -8.944 6.304 943 H PHE 119 H PHE 119 -3.213 -7.833 2.998 944 HA PHE 119 HA PHE 119 -3.628 -5.239 4.052 945 HB2 PHE 119 HB2 PHE 119 -1.563 -5.827 3.003 946 HB3 PHE 119 HB3 PHE 119 -2.339 -6.228 1.493 947 HD1 PHE 119 HD1 PHE 119 -3.287 -4.469 -0.001 948 HD2 PHE 119 HD2 PHE 119 -0.928 -3.555 3.458 949 HE1 PHE 119 HE1 PHE 119 -2.807 -2.221 -0.933 950 HE2 PHE 119 HE2 PHE 119 -0.560 -1.263 2.610 951 HZ PHE 119 HZ PHE 119 -1.476 -0.592 0.399 952 H ASN 120 H ASN 120 -5.020 -6.832 1.174 953 HA ASN 120 HA ASN 120 -6.767 -4.663 0.404 954 HB2 ASN 120 HB2 ASN 120 -6.496 -6.207 -1.270 955 HB3 ASN 120 HB3 ASN 120 -6.519 -7.592 -0.179 956 HD21 ASN 120 HD21 ASN 120 -9.874 -8.293 -0.768 957 HD22 ASN 120 HD22 ASN 120 -8.346 -8.796 -0.067 958 H VAL 121 H VAL 121 -7.505 -7.618 2.393 959 HA VAL 121 HA VAL 121 -10.187 -6.836 2.864 960 HB VAL 121 HB VAL 121 -8.357 -8.723 4.387 961 HG11 VAL 121 HG11 VAL 121 -11.356 -8.328 4.783 962 HG12 VAL 121 HG12 VAL 121 -10.415 -9.705 5.397 963 HG13 VAL 121 HG13 VAL 121 -10.081 -8.085 6.001 964 HG21 VAL 121 HG21 VAL 121 -9.696 -10.458 3.261 965 HG22 VAL 121 HG22 VAL 121 -10.715 -9.215 2.501 966 HG23 VAL 121 HG23 VAL 121 -9.008 -9.372 2.056 967 H SER 122 H SER 122 -7.298 -5.953 4.701 968 HA SER 122 HA SER 122 -8.520 -4.731 6.955 969 HB2 SER 122 HB2 SER 122 -6.004 -3.886 5.457 970 HB3 SER 122 HB3 SER 122 -6.461 -3.382 7.096 971 HG SER 122 HG SER 122 -5.839 -5.994 6.164 972 H LEU 123 H LEU 123 -8.297 -3.570 3.622 973 HA LEU 123 HA LEU 123 -9.383 -0.906 4.395 974 HB2 LEU 123 HB2 LEU 123 -8.406 -1.955 1.735 975 HB3 LEU 123 HB3 LEU 123 -8.931 -0.300 2.063 976 HG LEU 123 HG LEU 123 -6.533 -1.702 3.311 977 HD11 LEU 123 HD11 LEU 123 -5.162 -0.412 1.905 978 HD12 LEU 123 HD12 LEU 123 -6.404 -1.093 0.860 979 HD13 LEU 123 HD13 LEU 123 -6.522 0.611 1.380 980 HD21 LEU 123 HD21 LEU 123 -7.476 1.178 3.591 981 HD22 LEU 123 HD22 LEU 123 -7.375 -0.033 4.888 982 HD23 LEU 123 HD23 LEU 123 -5.897 0.563 4.129 983 H GLN 124 H GLN 124 -10.323 -3.862 2.573 984 HA GLN 124 HA GLN 124 -12.854 -2.933 1.641 985 HB2 GLN 124 HB2 GLN 124 -12.127 -5.708 2.669 986 HB3 GLN 124 HB3 GLN 124 -13.582 -5.320 1.770 987 HG2 GLN 124 HG2 GLN 124 -10.754 -5.046 0.690 988 HG3 GLN 124 HG3 GLN 124 -11.813 -6.408 0.405 989 HE21 GLN 124 HE21 GLN 124 -12.010 -4.248 -2.588 990 HE22 GLN 124 HE22 GLN 124 -10.751 -5.163 -1.751 991 H ASP 125 H ASP 125 -12.073 -4.552 4.766 992 HA ASP 125 HA ASP 125 -14.733 -4.132 5.856 993 HB2 ASP 125 HB2 ASP 125 -13.105 -6.023 6.365 994 HB3 ASP 125 HB3 ASP 125 -12.131 -4.852 7.266 995 H HIS 126 H HIS 126 -12.216 -1.949 5.428 996 HA HIS 126 HA HIS 126 -12.910 -0.260 7.780 997 HB2 HIS 126 HB2 HIS 126 -10.578 -0.263 7.200 998 HB3 HIS 126 HB3 HIS 126 -10.941 0.154 5.523 999 HD2 HIS 126 HD2 HIS 126 -11.779 1.794 8.991 1000 HE1 HIS 126 HE1 HIS 126 -10.801 4.888 6.238 1001 HE2 HIS 126 HE2 HIS 126 -11.550 4.400 8.614 1002 H PHE 127 H PHE 127 -13.326 -0.291 4.198 1003 HA PHE 127 HA PHE 127 -15.117 2.026 4.452 1004 HB2 PHE 127 HB2 PHE 127 -14.138 0.549 2.024 1005 HB3 PHE 127 HB3 PHE 127 -15.278 1.887 1.977 1006 HD1 PHE 127 HD1 PHE 127 -14.578 4.190 3.005 1007 HD2 PHE 127 HD2 PHE 127 -11.791 1.000 2.144 1008 HE1 PHE 127 HE1 PHE 127 -12.679 5.797 3.066 1009 HE2 PHE 127 HE2 PHE 127 -9.908 2.601 2.254 1010 HZ PHE 127 HZ PHE 127 -10.359 5.010 2.709 1011 H LYS 128 H LYS 128 -15.626 -1.421 4.461 1012 HA LYS 128 HA LYS 128 -18.110 -1.566 3.237 1013 HB2 LYS 128 HB2 LYS 128 -18.430 -3.678 4.133 1014 HB3 LYS 128 HB3 LYS 128 -16.717 -3.487 3.920 1015 HG2 LYS 128 HG2 LYS 128 -16.749 -4.506 5.960 1016 HG3 LYS 128 HG3 LYS 128 -16.769 -2.819 6.511 1017 HD2 LYS 128 HD2 LYS 128 -19.334 -3.101 6.584 1018 HD3 LYS 128 HD3 LYS 128 -19.056 -4.808 6.245 1019 HE2 LYS 128 HE2 LYS 128 -17.870 -3.345 8.633 1020 HE3 LYS 128 HE3 LYS 128 -19.473 -4.084 8.666 1021 HZ1 LYS 128 HZ1 LYS 128 -16.916 -5.531 8.210 1022 HZ2 LYS 128 HZ2 LYS 128 -17.858 -5.627 9.533 1023 HZ3 LYS 128 HZ3 LYS 128 -18.402 -6.228 8.115 1024 H TRP 129 H TRP 129 -17.567 -0.308 6.440 1025 HA TRP 129 HA TRP 129 -20.487 -0.231 7.039 1026 HB2 TRP 129 HB2 TRP 129 -19.743 0.351 9.319 1027 HB3 TRP 129 HB3 TRP 129 -19.214 -1.213 8.740 1028 HD1 TRP 129 HD1 TRP 129 -16.616 -1.647 8.467 1029 HE1 TRP 129 HE1 TRP 129 -14.541 -0.406 9.151 1030 HE3 TRP 129 HE3 TRP 129 -18.744 2.850 9.612 1031 HZ2 TRP 129 HZ2 TRP 129 -13.823 2.250 10.120 1032 HZ3 TRP 129 HZ3 TRP 129 -17.300 4.788 10.273 1033 HH2 TRP 129 HH2 TRP 129 -14.854 4.482 10.557 1034 H VAL 130 H VAL 130 -18.660 1.665 5.273 1035 HA VAL 130 HA VAL 130 -20.083 4.196 5.916 1036 HB VAL 130 HB VAL 130 -17.608 5.138 5.214 1037 HG11 VAL 130 HG11 VAL 130 -17.453 5.865 7.558 1038 HG12 VAL 130 HG12 VAL 130 -19.090 6.069 6.909 1039 HG13 VAL 130 HG13 VAL 130 -18.734 4.713 7.992 1040 HG21 VAL 130 HG21 VAL 130 -15.920 4.200 6.656 1041 HG22 VAL 130 HG22 VAL 130 -17.016 2.925 7.180 1042 HG23 VAL 130 HG23 VAL 130 -16.507 3.003 5.493 1043 H LYS 131 H LYS 131 -18.790 5.704 3.891 1044 HA LYS 131 HA LYS 131 -19.058 6.281 1.743 1045 HB2 LYS 131 HB2 LYS 131 -17.218 4.331 1.938 1046 HB3 LYS 131 HB3 LYS 131 -18.359 3.467 0.923 1047 HG2 LYS 131 HG2 LYS 131 -16.863 4.488 -0.573 1048 HG3 LYS 131 HG3 LYS 131 -18.293 5.540 -0.619 1049 HD2 LYS 131 HD2 LYS 131 -17.176 7.087 0.986 1050 HD3 LYS 131 HD3 LYS 131 -15.741 6.032 0.975 1051 HE2 LYS 131 HE2 LYS 131 -15.523 6.379 -1.472 1052 HE3 LYS 131 HE3 LYS 131 -16.955 7.413 -1.460 1053 HZ1 LYS 131 HZ1 LYS 131 -14.416 7.990 -0.004 1054 HZ2 LYS 131 HZ2 LYS 131 -14.927 8.747 -1.367 1055 HZ3 LYS 131 HZ3 LYS 131 -15.751 8.945 0.024 1056 H GLN 132 H GLN 132 -21.456 5.214 3.000 1057 HA GLN 132 HA GLN 132 -23.562 4.549 2.608 1058 HB2 GLN 132 HB2 GLN 132 -23.226 6.000 -0.047 1059 HB3 GLN 132 HB3 GLN 132 -24.740 5.582 0.745 1060 HG2 GLN 132 HG2 GLN 132 -24.487 7.813 1.324 1061 HG3 GLN 132 HG3 GLN 132 -23.958 6.953 2.763 1062 HE21 GLN 132 HE21 GLN 132 -21.315 9.362 2.651 1063 HE22 GLN 132 HE22 GLN 132 -22.821 8.910 3.439 1064 H GLU 133 H GLU 133 -21.568 2.610 1.988 1065 HA GLU 133 HA GLU 133 -22.702 0.937 -0.117 1066 HB2 GLU 133 HB2 GLU 133 -20.571 0.450 1.996 1067 HB3 GLU 133 HB3 GLU 133 -21.044 -0.755 0.805 1068 HG2 GLU 133 HG2 GLU 133 -19.972 2.007 0.057 1069 HG3 GLU 133 HG3 GLU 133 -18.967 0.584 0.248 1070 H1 SER 149 H1 SER 149 9.085 -24.140 -13.329 1071 H2 SER 149 H2 SER 149 7.781 -23.145 -13.249 1072 H3 SER 149 H3 SER 149 7.654 -24.704 -12.771 1073 HA SER 149 HA SER 149 9.146 -24.357 -10.938 1074 HB2 SER 149 HB2 SER 149 10.507 -22.591 -11.995 1075 HB3 SER 149 HB3 SER 149 9.157 -21.448 -11.841 1076 HG SER 149 HG SER 149 10.828 -21.460 -10.132 1077 H GLN 150 H GLN 150 8.388 -23.686 -8.878 1078 HA GLN 150 HA GLN 150 5.502 -23.024 -8.714 1079 HB2 GLN 150 HB2 GLN 150 7.567 -23.748 -6.596 1080 HB3 GLN 150 HB3 GLN 150 5.860 -23.418 -6.279 1081 HG2 GLN 150 HG2 GLN 150 5.210 -25.313 -7.756 1082 HG3 GLN 150 HG3 GLN 150 6.916 -25.681 -8.036 1083 HE21 GLN 150 HE21 GLN 150 5.220 -26.684 -4.419 1084 HE22 GLN 150 HE22 GLN 150 4.380 -25.560 -5.477 1085 H ILE 151 H ILE 151 8.465 -21.287 -8.735 1086 HA ILE 151 HA ILE 151 7.660 -19.106 -6.966 1087 HB ILE 151 HB ILE 151 9.921 -19.321 -8.988 1088 HG12 ILE 151 HG12 ILE 151 9.919 -19.638 -5.945 1089 HG13 ILE 151 HG13 ILE 151 10.052 -20.960 -7.101 1090 HG21 ILE 151 HG21 ILE 151 9.440 -17.237 -6.804 1091 HG22 ILE 151 HG22 ILE 151 10.891 -17.353 -7.823 1092 HG23 ILE 151 HG23 ILE 151 9.358 -16.954 -8.559 1093 HD11 ILE 151 HD11 ILE 151 12.182 -19.955 -7.970 1094 HD12 ILE 151 HD12 ILE 151 12.117 -18.793 -6.619 1095 HD13 ILE 151 HD13 ILE 151 12.238 -20.524 -6.290 1096 H THR 152 H THR 152 6.738 -17.164 -7.494 1097 HA THR 152 HA THR 152 5.101 -16.982 -9.827 1098 HB THR 152 HB THR 152 5.796 -14.496 -8.349 1099 HG1 THR 152 HG1 THR 152 4.287 -16.603 -7.173 1100 HG21 THR 152 HG21 THR 152 3.064 -15.695 -8.910 1101 HG22 THR 152 HG22 THR 152 3.491 -14.026 -8.442 1102 HG23 THR 152 HG23 THR 152 3.923 -14.618 -10.028 1103 H SER 153 H SER 153 5.110 -15.460 -11.480 1104 HA SER 153 HA SER 153 7.391 -13.718 -11.948 1105 HB2 SER 153 HB2 SER 153 7.913 -14.654 -14.181 1106 HB3 SER 153 HB3 SER 153 8.201 -15.824 -12.876 1107 HG SER 153 HG SER 153 7.066 -16.764 -14.658 1108 H GLN 154 H GLN 154 4.626 -13.511 -11.636 1109 HA GLN 154 HA GLN 154 4.015 -11.385 -13.393 1110 HB2 GLN 154 HB2 GLN 154 2.084 -12.279 -14.610 1111 HB3 GLN 154 HB3 GLN 154 3.546 -13.171 -14.997 1112 HG2 GLN 154 HG2 GLN 154 2.866 -15.039 -13.560 1113 HG3 GLN 154 HG3 GLN 154 1.450 -14.146 -12.999 1114 HE21 GLN 154 HE21 GLN 154 -0.420 -14.666 -16.029 1115 HE22 GLN 154 HE22 GLN 154 -0.208 -13.534 -14.687 1116 H VAL 155 H VAL 155 1.855 -10.374 -13.106 1117 HA VAL 155 HA VAL 155 0.344 -10.888 -10.632 1118 HB VAL 155 HB VAL 155 -0.873 -9.585 -13.078 1119 HG11 VAL 155 HG11 VAL 155 -2.138 -8.256 -11.382 1120 HG12 VAL 155 HG12 VAL 155 -2.257 -9.970 -11.070 1121 HG13 VAL 155 HG13 VAL 155 -1.191 -8.934 -10.093 1122 HG21 VAL 155 HG21 VAL 155 1.211 -8.321 -12.950 1123 HG22 VAL 155 HG22 VAL 155 -0.171 -7.366 -12.392 1124 HG23 VAL 155 HG23 VAL 155 0.931 -8.075 -11.185 1125 H TPO 156 H T2P 156 -0.861 -12.754 -10.453 1126 HA TPO 156 HA T2P 156 -1.912 -14.534 -12.405 1127 HB TPO 156 HB T2P 156 -3.088 -13.567 -9.829 1128 HG21 TPO 156 HG21 T2P 156 -4.675 -15.390 -9.812 1129 HG22 TPO 156 HG22 T2P 156 -4.432 -15.563 -11.563 1130 HG23 TPO 156 HG23 T2P 156 -5.035 -14.019 -10.867 1131 H GLY 157 H GLY 157 -3.719 -14.665 -13.371 1132 HA2 GLY 157 HA2 GLY 157 -5.817 -12.686 -13.611 1133 HA3 GLY 157 HA3 GLY 157 -4.828 -12.722 -15.079 1134 H GLN 158 H GLN 158 -4.420 -15.733 -14.380 1135 HA GLN 158 HA GLN 158 -6.373 -16.846 -16.097 1136 HB2 GLN 158 HB2 GLN 158 -5.178 -18.872 -15.789 1137 HB3 GLN 158 HB3 GLN 158 -4.008 -17.576 -15.878 1138 HG2 GLN 158 HG2 GLN 158 -4.916 -18.933 -13.288 1139 HG3 GLN 158 HG3 GLN 158 -3.504 -19.390 -14.213 1140 HE21 GLN 158 HE21 GLN 158 -2.368 -17.222 -11.395 1141 HE22 GLN 158 HE22 GLN 158 -3.120 -18.801 -11.558 1142 H ILE 159 H ILE 159 -6.608 -16.314 -12.706 1143 HA ILE 159 HA ILE 159 -8.959 -18.139 -12.520 1144 HB ILE 159 HB ILE 159 -6.972 -19.353 -11.806 1145 HG12 ILE 159 HG12 ILE 159 -8.867 -18.799 -9.495 1146 HG13 ILE 159 HG13 ILE 159 -9.239 -19.809 -10.890 1147 HG21 ILE 159 HG21 ILE 159 -6.696 -17.355 -9.537 1148 HG22 ILE 159 HG22 ILE 159 -5.738 -18.824 -9.755 1149 HG23 ILE 159 HG23 ILE 159 -5.591 -17.520 -10.916 1150 HD11 ILE 159 HD11 ILE 159 -8.613 -21.233 -9.049 1151 HD12 ILE 159 HD12 ILE 159 -7.335 -21.318 -10.277 1152 HD13 ILE 159 HD13 ILE 159 -7.098 -20.358 -8.796 1153 H GLY 160 H GLY 160 -7.325 -15.336 -11.130 1154 HA2 GLY 160 HA2 GLY 160 -8.276 -13.413 -10.224 1155 HA3 GLY 160 HA3 GLY 160 -9.878 -14.061 -10.564 1156 H TRP 161 H TRP 161 -7.388 -15.554 -8.515 1157 HA TRP 161 HA TRP 161 -9.378 -15.817 -6.366 1158 HB2 TRP 161 HB2 TRP 161 -8.255 -17.779 -5.747 1159 HB3 TRP 161 HB3 TRP 161 -8.394 -17.792 -7.486 1160 HD1 TRP 161 HD1 TRP 161 -5.657 -15.614 -7.319 1161 HE1 TRP 161 HE1 TRP 161 -3.401 -16.735 -7.423 1162 HE3 TRP 161 HE3 TRP 161 -7.103 -20.216 -5.711 1163 HZ2 TRP 161 HZ2 TRP 161 -2.367 -19.461 -7.096 1164 HZ3 TRP 161 HZ3 TRP 161 -5.444 -22.088 -5.584 1165 HH2 TRP 161 HH2 TRP 161 -3.088 -21.724 -6.290 1166 H ARG 162 H ARG 162 -7.297 -16.646 -4.490 1167 HA ARG 162 HA ARG 162 -7.296 -13.985 -3.137 1168 HB2 ARG 162 HB2 ARG 162 -8.542 -16.626 -2.249 1169 HB3 ARG 162 HB3 ARG 162 -8.793 -15.046 -1.490 1170 HG2 ARG 162 HG2 ARG 162 -9.813 -16.006 -4.185 1171 HG3 ARG 162 HG3 ARG 162 -10.769 -15.744 -2.743 1172 HD2 ARG 162 HD2 ARG 162 -10.775 -13.418 -2.960 1173 HD3 ARG 162 HD3 ARG 162 -9.243 -13.376 -3.816 1174 HE ARG 162 HE ARG 162 -10.290 -13.648 -5.846 1175 HH11 ARG 162 HH11 ARG 162 -11.849 -13.918 -7.275 1176 HH12 ARG 162 HH12 ARG 162 -13.515 -14.138 -6.776 1177 HH21 ARG 162 HH21 ARG 162 -12.754 -14.249 -3.414 1178 HH22 ARG 162 HH22 ARG 162 -14.008 -14.362 -4.619 1179 H ARG 163 H ARG 163 -7.003 -14.982 -0.550 1180 HA ARG 163 HA ARG 163 -4.238 -15.555 -0.149 1181 HB2 ARG 163 HB2 ARG 163 -4.790 -15.966 2.129 1182 HB3 ARG 163 HB3 ARG 163 -5.728 -14.591 1.569 1183 HG2 ARG 163 HG2 ARG 163 -7.711 -16.193 1.277 1184 HG3 ARG 163 HG3 ARG 163 -6.722 -17.417 2.099 1185 HD2 ARG 163 HD2 ARG 163 -7.884 -14.851 3.164 1186 HD3 ARG 163 HD3 ARG 163 -8.118 -16.488 3.767 1187 HE ARG 163 HE ARG 163 -5.638 -16.388 4.428 1188 HH11 ARG 163 HH11 ARG 163 -4.205 -15.151 5.643 1189 HH12 ARG 163 HH12 ARG 163 -4.608 -13.488 6.015 1190 HH21 ARG 163 HH21 ARG 163 -7.705 -13.570 4.609 1191 HH22 ARG 163 HH22 ARG 163 -6.518 -12.656 5.523 Start of MODEL 9 1 H1 GLY -4 H1 GLY -4 12.831 22.654 29.627 2 H2 GLY -4 H2 GLY -4 12.277 24.148 30.007 3 H3 GLY -4 H3 GLY -4 13.876 23.912 29.737 4 HA2 GLY -4 HA2 GLY -4 12.873 24.997 27.839 5 HA3 GLY -4 HA3 GLY -4 13.491 23.386 27.427 6 H SER -3 H SER -3 11.523 24.713 25.916 7 HA SER -3 HA SER -3 8.851 23.976 26.554 8 HB2 SER -3 HB2 SER -3 10.089 24.560 23.837 9 HB3 SER -3 HB3 SER -3 8.358 24.580 24.220 10 HG SER -3 HG SER -3 9.305 26.684 24.297 11 HA PRO -2 HA PRO -2 8.645 19.707 25.179 12 HB2 PRO -2 HB2 PRO -2 6.006 19.428 24.526 13 HB3 PRO -2 HB3 PRO -2 6.574 19.643 26.209 14 HG2 PRO -2 HG2 PRO -2 5.540 21.776 24.311 15 HG3 PRO -2 HG3 PRO -2 5.018 21.455 25.996 16 HD2 PRO -2 HD2 PRO -2 6.847 23.373 25.416 17 HD3 PRO -2 HD3 PRO -2 7.013 22.363 26.883 18 H ASN -1 H ASN -1 8.087 18.349 23.273 19 HA ASN -1 HA ASN -1 9.159 19.501 20.874 20 HB2 ASN -1 HB2 ASN -1 7.844 16.798 21.412 21 HB3 ASN -1 HB3 ASN -1 8.723 17.213 19.943 22 HD21 ASN -1 HD21 ASN -1 11.950 17.008 21.470 23 HD22 ASN -1 HD22 ASN -1 11.063 17.704 20.121 24 H SER 0 H SER 0 5.872 19.295 21.942 25 HA SER 0 HA SER 0 4.901 20.344 19.319 26 HB2 SER 0 HB2 SER 0 3.477 18.292 21.057 27 HB3 SER 0 HB3 SER 0 2.785 19.108 19.643 28 HG SER 0 HG SER 0 3.647 17.030 19.136 29 H MET 1 H MET 1 3.711 22.139 19.479 30 HA MET 1 HA MET 1 3.133 23.219 22.202 31 HB2 MET 1 HB2 MET 1 3.619 24.656 19.566 32 HB3 MET 1 HB3 MET 1 3.344 25.433 21.122 33 HG2 MET 1 HG2 MET 1 5.702 23.667 20.384 34 HG3 MET 1 HG3 MET 1 5.717 25.414 20.555 35 HE1 MET 1 HE1 MET 1 4.073 25.951 23.295 36 HE2 MET 1 HE2 MET 1 5.446 25.961 24.420 37 HE3 MET 1 HE3 MET 1 5.606 26.723 22.823 38 H ALA 2 H ALA 2 1.323 21.747 19.909 39 HA ALA 2 HA ALA 2 -1.122 23.236 20.733 40 HB1 ALA 2 HB1 ALA 2 -0.489 22.269 17.915 41 HB2 ALA 2 HB2 ALA 2 -2.027 22.973 18.460 42 HB3 ALA 2 HB3 ALA 2 -0.554 23.962 18.457 43 H THR 3 H THR 3 -2.352 21.931 21.850 44 HA THR 3 HA THR 3 -2.150 19.041 21.792 45 HB THR 3 HB THR 3 -4.194 20.577 23.294 46 HG1 THR 3 HG1 THR 3 -2.663 20.827 24.929 47 HG21 THR 3 HG21 THR 3 -3.841 18.806 24.994 48 HG22 THR 3 HG22 THR 3 -4.287 18.083 23.445 49 HG23 THR 3 HG23 THR 3 -2.591 18.065 23.968 50 H GLU 4 H GLU 4 -2.778 19.429 19.329 51 HA GLU 4 HA GLU 4 -5.588 19.612 18.692 52 HB2 GLU 4 HB2 GLU 4 -3.780 20.295 17.147 53 HB3 GLU 4 HB3 GLU 4 -3.232 18.623 17.038 54 HG2 GLU 4 HG2 GLU 4 -4.498 19.216 15.061 55 HG3 GLU 4 HG3 GLU 4 -5.356 17.970 15.945 56 H LEU 5 H LEU 5 -6.999 18.065 17.967 57 HA LEU 5 HA LEU 5 -6.758 15.390 19.090 58 HB2 LEU 5 HB2 LEU 5 -8.830 17.207 18.718 59 HB3 LEU 5 HB3 LEU 5 -9.165 16.034 17.463 60 HG LEU 5 HG LEU 5 -8.738 15.464 20.422 61 HD11 LEU 5 HD11 LEU 5 -10.841 16.665 19.951 62 HD12 LEU 5 HD12 LEU 5 -11.291 15.429 18.755 63 HD13 LEU 5 HD13 LEU 5 -11.163 15.006 20.478 64 HD21 LEU 5 HD21 LEU 5 -8.121 13.471 19.104 65 HD22 LEU 5 HD22 LEU 5 -9.646 13.195 19.951 66 HD23 LEU 5 HD23 LEU 5 -9.654 13.567 18.212 67 H GLU 6 H GLU 6 -4.871 15.892 16.998 68 HA GLU 6 HA GLU 6 -5.739 14.537 14.565 69 HB2 GLU 6 HB2 GLU 6 -3.177 15.726 15.578 70 HB3 GLU 6 HB3 GLU 6 -3.062 14.492 14.325 71 HG2 GLU 6 HG2 GLU 6 -4.840 16.942 14.032 72 HG3 GLU 6 HG3 GLU 6 -3.155 16.898 13.518 73 H TYR 7 H TYR 7 -5.639 12.329 14.147 74 HA TYR 7 HA TYR 7 -3.911 10.554 15.685 75 HB2 TYR 7 HB2 TYR 7 -5.547 9.274 16.752 76 HB3 TYR 7 HB3 TYR 7 -6.024 10.920 17.098 77 HD1 TYR 7 HD1 TYR 7 -7.964 11.952 15.762 78 HD2 TYR 7 HD2 TYR 7 -7.024 7.741 15.666 79 HE1 TYR 7 HE1 TYR 7 -10.215 11.469 14.823 80 HE2 TYR 7 HE2 TYR 7 -9.264 7.260 14.716 81 HH TYR 7 HH TYR 7 -11.663 9.851 14.075 82 H GLU 8 H GLU 8 -4.438 8.230 15.173 83 HA GLU 8 HA GLU 8 -5.978 7.499 12.910 84 HB2 GLU 8 HB2 GLU 8 -4.229 6.477 11.527 85 HB3 GLU 8 HB3 GLU 8 -4.195 8.218 11.470 86 HG2 GLU 8 HG2 GLU 8 -2.343 6.765 13.375 87 HG3 GLU 8 HG3 GLU 8 -1.978 6.816 11.667 88 H SER 9 H SER 9 -6.648 5.495 13.274 89 HA SER 9 HA SER 9 -5.541 3.991 15.558 90 HB2 SER 9 HB2 SER 9 -8.199 3.951 14.123 91 HB3 SER 9 HB3 SER 9 -7.769 2.831 15.436 92 HG SER 9 HG SER 9 -8.872 4.682 16.236 93 H VAL 10 H VAL 10 -4.579 1.983 15.369 94 HA VAL 10 HA VAL 10 -3.908 1.002 12.780 95 HB VAL 10 HB VAL 10 -2.471 0.723 14.706 96 HG11 VAL 10 HG11 VAL 10 -4.134 0.072 16.437 97 HG12 VAL 10 HG12 VAL 10 -4.329 -1.501 15.636 98 HG13 VAL 10 HG13 VAL 10 -2.768 -1.047 16.338 99 HG21 VAL 10 HG21 VAL 10 -2.186 -0.681 12.683 100 HG22 VAL 10 HG22 VAL 10 -1.628 -1.479 14.163 101 HG23 VAL 10 HG23 VAL 10 -3.173 -1.952 13.438 102 H LEU 11 H LEU 11 -4.635 -0.452 11.445 103 HA LEU 11 HA LEU 11 -7.121 -1.992 12.118 104 HB2 LEU 11 HB2 LEU 11 -6.111 -0.997 9.424 105 HB3 LEU 11 HB3 LEU 11 -7.554 -1.966 9.697 106 HG LEU 11 HG LEU 11 -7.124 0.902 10.620 107 HD11 LEU 11 HD11 LEU 11 -8.869 -0.395 8.487 108 HD12 LEU 11 HD12 LEU 11 -8.958 1.306 8.967 109 HD13 LEU 11 HD13 LEU 11 -7.482 0.682 8.220 110 HD21 LEU 11 HD21 LEU 11 -8.544 -0.214 12.261 111 HD22 LEU 11 HD22 LEU 11 -9.556 0.796 11.231 112 HD23 LEU 11 HD23 LEU 11 -9.519 -0.961 10.967 113 H CYS 12 H CYS 12 -4.037 -2.112 10.291 114 HA CYS 12 HA CYS 12 -3.849 -5.017 10.742 115 HB2 CYS 12 HB2 CYS 12 -5.033 -4.950 8.658 116 HB3 CYS 12 HB3 CYS 12 -3.938 -3.734 7.992 117 HG CYS 12 HG CYS 12 -3.593 -6.088 6.847 118 H VAL 13 H VAL 13 -1.862 -5.715 11.076 119 HA VAL 13 HA VAL 13 0.450 -4.064 10.218 120 HB VAL 13 HB VAL 13 0.102 -3.852 12.650 121 HG11 VAL 13 HG11 VAL 13 0.774 -6.813 12.855 122 HG12 VAL 13 HG12 VAL 13 0.544 -5.668 14.189 123 HG13 VAL 13 HG13 VAL 13 -0.825 -6.098 13.158 124 HG21 VAL 13 HG21 VAL 13 2.349 -3.578 11.767 125 HG22 VAL 13 HG22 VAL 13 2.413 -4.367 13.342 126 HG23 VAL 13 HG23 VAL 13 2.648 -5.331 11.870 127 H LYS 14 H LYS 14 1.964 -5.169 9.077 128 HA LYS 14 HA LYS 14 1.947 -8.119 9.292 129 HB2 LYS 14 HB2 LYS 14 2.052 -6.677 6.620 130 HB3 LYS 14 HB3 LYS 14 2.508 -8.354 6.828 131 HG2 LYS 14 HG2 LYS 14 -0.237 -7.247 7.536 132 HG3 LYS 14 HG3 LYS 14 0.168 -8.020 6.008 133 HD2 LYS 14 HD2 LYS 14 0.719 -10.110 7.096 134 HD3 LYS 14 HD3 LYS 14 0.484 -9.444 8.704 135 HE2 LYS 14 HE2 LYS 14 -1.709 -9.546 6.621 136 HE3 LYS 14 HE3 LYS 14 -1.399 -10.833 7.808 137 HZ1 LYS 14 HZ1 LYS 14 -3.111 -9.176 8.497 138 HZ2 LYS 14 HZ2 LYS 14 -1.864 -9.291 9.579 139 HZ3 LYS 14 HZ3 LYS 14 -1.968 -8.017 8.557 140 HA PRO 15 HA PRO 15 5.949 -7.611 10.510 141 HB2 PRO 15 HB2 PRO 15 6.907 -10.173 10.500 142 HB3 PRO 15 HB3 PRO 15 5.552 -9.647 11.541 143 HG2 PRO 15 HG2 PRO 15 5.366 -11.014 8.821 144 HG3 PRO 15 HG3 PRO 15 4.544 -11.483 10.347 145 HD2 PRO 15 HD2 PRO 15 3.290 -9.985 8.504 146 HD3 PRO 15 HD3 PRO 15 3.097 -9.654 10.253 147 H ASP 16 H ASP 16 5.661 -8.964 7.264 148 HA ASP 16 HA ASP 16 8.308 -7.852 6.552 149 HB2 ASP 16 HB2 ASP 16 8.731 -10.197 7.150 150 HB3 ASP 16 HB3 ASP 16 7.486 -10.726 6.021 151 H VAL 17 H VAL 17 8.104 -6.629 4.840 152 HA VAL 17 HA VAL 17 6.377 -7.340 2.562 153 HB VAL 17 HB VAL 17 4.925 -6.060 4.135 154 HG11 VAL 17 HG11 VAL 17 5.199 -3.657 4.418 155 HG12 VAL 17 HG12 VAL 17 6.585 -4.519 5.107 156 HG13 VAL 17 HG13 VAL 17 6.734 -3.697 3.540 157 HG21 VAL 17 HG21 VAL 17 4.529 -6.076 1.686 158 HG22 VAL 17 HG22 VAL 17 3.965 -4.603 2.485 159 HG23 VAL 17 HG23 VAL 17 5.469 -4.570 1.549 160 H SER 18 H SER 18 7.010 -6.224 0.635 161 HA SER 18 HA SER 18 9.582 -4.712 0.752 162 HB2 SER 18 HB2 SER 18 10.443 -5.929 -1.075 163 HB3 SER 18 HB3 SER 18 9.882 -7.117 0.099 164 HG SER 18 HG SER 18 7.884 -7.153 -1.209 165 H VAL 19 H VAL 19 9.967 -3.202 -0.919 166 HA VAL 19 HA VAL 19 7.512 -2.270 -2.369 167 HB VAL 19 HB VAL 19 9.335 -0.741 -0.542 168 HG11 VAL 19 HG11 VAL 19 7.554 0.421 -2.697 169 HG12 VAL 19 HG12 VAL 19 8.258 1.352 -1.366 170 HG13 VAL 19 HG13 VAL 19 9.318 0.634 -2.560 171 HG21 VAL 19 HG21 VAL 19 7.193 0.012 0.366 172 HG22 VAL 19 HG22 VAL 19 6.317 -0.913 -0.864 173 HG23 VAL 19 HG23 VAL 19 7.274 -1.747 0.377 174 H TYR 20 H TYR 20 7.665 -1.508 -4.287 175 HA TYR 20 HA TYR 20 10.335 -1.049 -5.562 176 HB2 TYR 20 HB2 TYR 20 8.028 -1.924 -7.269 177 HB3 TYR 20 HB3 TYR 20 9.742 -2.135 -7.500 178 HD1 TYR 20 HD1 TYR 20 10.900 -4.062 -6.410 179 HD2 TYR 20 HD2 TYR 20 6.648 -3.502 -6.127 180 HE1 TYR 20 HE1 TYR 20 10.638 -6.439 -5.660 181 HE2 TYR 20 HE2 TYR 20 6.375 -5.889 -5.479 182 HH TYR 20 HH TYR 20 9.164 -8.087 -5.046 183 H ARG 21 H ARG 21 10.340 1.240 -5.497 184 HA ARG 21 HA ARG 21 8.192 2.981 -6.230 185 HB2 ARG 21 HB2 ARG 21 11.199 3.219 -6.622 186 HB3 ARG 21 HB3 ARG 21 10.076 4.552 -6.897 187 HG2 ARG 21 HG2 ARG 21 9.639 4.876 -4.635 188 HG3 ARG 21 HG3 ARG 21 9.932 3.191 -4.209 189 HD2 ARG 21 HD2 ARG 21 11.705 4.480 -3.268 190 HD3 ARG 21 HD3 ARG 21 12.343 3.488 -4.587 191 HE ARG 21 HE ARG 21 11.616 6.184 -5.432 192 HH11 ARG 21 HH11 ARG 21 13.207 7.635 -5.983 193 HH12 ARG 21 HH12 ARG 21 14.859 7.330 -5.536 194 HH21 ARG 21 HH21 ARG 21 14.248 4.311 -3.999 195 HH22 ARG 21 HH22 ARG 21 15.429 5.519 -4.440 196 H ILE 22 H ILE 22 7.297 3.632 -8.138 197 HA ILE 22 HA ILE 22 8.199 2.177 -10.586 198 HB ILE 22 HB ILE 22 5.925 1.788 -11.232 199 HG12 ILE 22 HG12 ILE 22 5.150 3.219 -8.666 200 HG13 ILE 22 HG13 ILE 22 4.716 3.647 -10.325 201 HG21 ILE 22 HG21 ILE 22 6.291 0.833 -8.410 202 HG22 ILE 22 HG22 ILE 22 5.409 0.042 -9.703 203 HG23 ILE 22 HG23 ILE 22 7.172 0.159 -9.801 204 HD11 ILE 22 HD11 ILE 22 3.688 1.312 -8.689 205 HD12 ILE 22 HD12 ILE 22 2.793 2.700 -9.320 206 HD13 ILE 22 HD13 ILE 22 3.418 1.473 -10.445 207 HA PRO 23 HA PRO 23 7.863 6.119 -12.609 208 HB2 PRO 23 HB2 PRO 23 8.149 5.346 -15.257 209 HB3 PRO 23 HB3 PRO 23 9.457 5.607 -14.072 210 HG2 PRO 23 HG2 PRO 23 8.283 3.018 -15.016 211 HG3 PRO 23 HG3 PRO 23 9.952 3.385 -14.522 212 HD2 PRO 23 HD2 PRO 23 8.063 2.103 -12.914 213 HD3 PRO 23 HD3 PRO 23 9.496 2.975 -12.305 214 HA PRO 24 HA PRO 24 3.966 5.651 -15.283 215 HB2 PRO 24 HB2 PRO 24 2.357 3.455 -15.253 216 HB3 PRO 24 HB3 PRO 24 3.840 3.550 -16.253 217 HG2 PRO 24 HG2 PRO 24 3.542 2.308 -13.490 218 HG3 PRO 24 HG3 PRO 24 4.238 1.560 -14.967 219 HD2 PRO 24 HD2 PRO 24 5.809 2.740 -13.115 220 HD3 PRO 24 HD3 PRO 24 6.164 2.916 -14.857 221 H ARG 25 H ARG 25 1.727 6.047 -14.930 222 HA ARG 25 HA ARG 25 0.676 5.849 -12.122 223 HB2 ARG 25 HB2 ARG 25 -0.315 8.011 -12.279 224 HB3 ARG 25 HB3 ARG 25 1.418 8.142 -12.574 225 HG2 ARG 25 HG2 ARG 25 0.961 8.286 -15.047 226 HG3 ARG 25 HG3 ARG 25 -0.770 8.148 -14.714 227 HD2 ARG 25 HD2 ARG 25 -0.275 10.459 -15.064 228 HD3 ARG 25 HD3 ARG 25 -0.660 10.230 -13.350 229 HE ARG 25 HE ARG 25 2.186 10.029 -13.785 230 HH11 ARG 25 HH11 ARG 25 3.570 11.659 -13.180 231 HH12 ARG 25 HH12 ARG 25 2.962 13.266 -12.921 232 HH21 ARG 25 HH21 ARG 25 -0.300 12.494 -13.646 233 HH22 ARG 25 HH22 ARG 25 0.828 13.736 -13.174 234 H ALA 26 H ALA 26 -0.075 5.483 -15.508 235 HA ALA 26 HA ALA 26 -2.498 4.015 -14.829 236 HB1 ALA 26 HB1 ALA 26 -2.692 6.716 -16.234 237 HB2 ALA 26 HB2 ALA 26 -4.028 5.551 -16.007 238 HB3 ALA 26 HB3 ALA 26 -3.275 6.341 -14.604 239 H SER 27 H SER 27 -1.915 2.330 -15.944 240 HA SER 27 HA SER 27 -1.833 2.441 -18.925 241 HB2 SER 27 HB2 SER 27 -0.392 0.740 -17.912 242 HB3 SER 27 HB3 SER 27 -1.742 0.128 -16.949 243 HG SER 27 HG SER 27 -1.460 0.052 -19.780 244 H ASN 28 H ASN 28 -3.643 1.269 -20.052 245 HA ASN 28 HA ASN 28 -6.264 1.782 -18.874 246 HB2 ASN 28 HB2 ASN 28 -7.147 0.881 -20.917 247 HB3 ASN 28 HB3 ASN 28 -5.795 1.930 -21.326 248 HD21 ASN 28 HD21 ASN 28 -5.436 -2.137 -21.869 249 HD22 ASN 28 HD22 ASN 28 -6.609 -1.511 -20.712 250 H ARG 29 H ARG 29 -3.977 -0.795 -18.680 251 HA ARG 29 HA ARG 29 -5.882 -2.829 -17.661 252 HB2 ARG 29 HB2 ARG 29 -2.833 -2.771 -17.622 253 HB3 ARG 29 HB3 ARG 29 -3.857 -4.178 -17.352 254 HG2 ARG 29 HG2 ARG 29 -3.479 -2.687 -19.982 255 HG3 ARG 29 HG3 ARG 29 -2.840 -4.278 -19.550 256 HD2 ARG 29 HD2 ARG 29 -5.183 -5.122 -19.313 257 HD3 ARG 29 HD3 ARG 29 -5.770 -3.532 -19.849 258 HE ARG 29 HE ARG 29 -3.900 -4.554 -21.764 259 HH11 ARG 29 HH11 ARG 29 -4.543 -5.429 -23.704 260 HH12 ARG 29 HH12 ARG 29 -6.158 -6.046 -23.885 261 HH21 ARG 29 HH21 ARG 29 -7.162 -5.275 -20.698 262 HH22 ARG 29 HH22 ARG 29 -7.608 -5.959 -22.237 263 H GLY 30 H GLY 30 -4.314 -0.124 -16.382 264 HA2 GLY 30 HA2 GLY 30 -4.790 0.480 -14.065 265 HA3 GLY 30 HA3 GLY 30 -4.402 -1.195 -13.603 266 H TYR 31 H TYR 31 -2.281 -1.723 -13.224 267 HA TYR 31 HA TYR 31 -0.097 0.229 -13.946 268 HB2 TYR 31 HB2 TYR 31 -0.687 -1.152 -11.316 269 HB3 TYR 31 HB3 TYR 31 0.932 -0.626 -11.731 270 HD1 TYR 31 HD1 TYR 31 -2.458 0.497 -10.948 271 HD2 TYR 31 HD2 TYR 31 1.581 1.655 -11.900 272 HE1 TYR 31 HE1 TYR 31 -2.904 2.789 -10.019 273 HE2 TYR 31 HE2 TYR 31 1.173 3.920 -10.913 274 HH TYR 31 HH TYR 31 -1.994 4.825 -9.504 275 H ARG 32 H ARG 32 -0.989 -3.132 -13.549 276 HA ARG 32 HA ARG 32 0.061 -5.087 -13.543 277 HB2 ARG 32 HB2 ARG 32 1.605 -4.731 -15.989 278 HB3 ARG 32 HB3 ARG 32 0.245 -5.750 -15.577 279 HG2 ARG 32 HG2 ARG 32 -0.605 -4.611 -17.354 280 HG3 ARG 32 HG3 ARG 32 -1.230 -3.660 -16.024 281 HD2 ARG 32 HD2 ARG 32 -0.496 -2.032 -17.501 282 HD3 ARG 32 HD3 ARG 32 0.872 -2.143 -16.408 283 HE ARG 32 HE ARG 32 2.156 -3.274 -18.048 284 HH11 ARG 32 HH11 ARG 32 2.906 -3.135 -20.056 285 HH12 ARG 32 HH12 ARG 32 1.809 -2.973 -21.411 286 HH21 ARG 32 HH21 ARG 32 -0.879 -2.162 -19.435 287 HH22 ARG 32 HH22 ARG 32 -0.289 -2.399 -21.058 288 H ALA 33 H ALA 33 1.421 -5.597 -11.934 289 HA ALA 33 HA ALA 33 3.900 -4.500 -11.318 290 HB1 ALA 33 HB1 ALA 33 3.200 -7.445 -10.997 291 HB2 ALA 33 HB2 ALA 33 4.293 -6.470 -10.001 292 HB3 ALA 33 HB3 ALA 33 2.554 -6.164 -9.954 293 H SER 34 H SER 34 3.216 -6.983 -13.705 294 HA SER 34 HA SER 34 5.839 -7.825 -14.374 295 HB2 SER 34 HB2 SER 34 3.501 -8.778 -14.936 296 HB3 SER 34 HB3 SER 34 3.499 -7.648 -16.297 297 HG SER 34 HG SER 34 5.468 -8.637 -17.007 298 H ASP 35 H ASP 35 4.336 -4.742 -15.058 299 HA ASP 35 HA ASP 35 5.989 -4.157 -17.409 300 HB2 ASP 35 HB2 ASP 35 3.535 -3.384 -16.765 301 HB3 ASP 35 HB3 ASP 35 4.377 -2.112 -15.888 302 H TRP 36 H TRP 36 6.481 -4.021 -14.012 303 HA TRP 36 HA TRP 36 8.879 -2.301 -14.323 304 HB2 TRP 36 HB2 TRP 36 8.197 -1.492 -11.876 305 HB3 TRP 36 HB3 TRP 36 7.765 -0.673 -13.346 306 HD1 TRP 36 HD1 TRP 36 5.306 -0.509 -14.049 307 HE1 TRP 36 HE1 TRP 36 3.067 -1.011 -12.928 308 HE3 TRP 36 HE3 TRP 36 6.996 -3.116 -9.980 309 HZ2 TRP 36 HZ2 TRP 36 2.183 -1.926 -10.326 310 HZ3 TRP 36 HZ3 TRP 36 5.423 -3.787 -8.183 311 HH2 TRP 36 HH2 TRP 36 3.019 -3.169 -8.321 312 H LYS 37 H LYS 37 9.888 -2.538 -11.755 313 HA LYS 37 HA LYS 37 10.897 -5.269 -11.661 314 HB2 LYS 37 HB2 LYS 37 11.145 -2.816 -9.882 315 HB3 LYS 37 HB3 LYS 37 11.770 -4.386 -9.370 316 HG2 LYS 37 HG2 LYS 37 13.224 -4.550 -11.291 317 HG3 LYS 37 HG3 LYS 37 12.562 -3.067 -12.002 318 HD2 LYS 37 HD2 LYS 37 13.512 -1.682 -10.326 319 HD3 LYS 37 HD3 LYS 37 13.848 -3.049 -9.245 320 HE2 LYS 37 HE2 LYS 37 15.510 -3.946 -10.794 321 HE3 LYS 37 HE3 LYS 37 15.163 -2.663 -11.966 322 HZ1 LYS 37 HZ1 LYS 37 15.977 -1.044 -10.339 323 HZ2 LYS 37 HZ2 LYS 37 16.277 -2.218 -9.241 324 HZ3 LYS 37 HZ3 LYS 37 17.136 -2.154 -10.628 325 H LEU 38 H LEU 38 9.555 -6.888 -11.150 326 HA LEU 38 HA LEU 38 7.888 -6.644 -8.704 327 HB2 LEU 38 HB2 LEU 38 6.393 -8.220 -9.484 328 HB3 LEU 38 HB3 LEU 38 6.613 -7.026 -10.731 329 HG LEU 38 HG LEU 38 7.944 -9.777 -10.786 330 HD11 LEU 38 HD11 LEU 38 6.188 -10.395 -12.406 331 HD12 LEU 38 HD12 LEU 38 5.505 -10.070 -10.812 332 HD13 LEU 38 HD13 LEU 38 5.348 -8.858 -12.093 333 HD21 LEU 38 HD21 LEU 38 9.086 -8.275 -12.300 334 HD22 LEU 38 HD22 LEU 38 8.010 -9.264 -13.286 335 HD23 LEU 38 HD23 LEU 38 7.552 -7.603 -12.880 336 H ASP 39 H ASP 39 10.857 -7.640 -9.240 337 HA ASP 39 HA ASP 39 10.774 -9.570 -6.995 338 HB2 ASP 39 HB2 ASP 39 10.663 -10.839 -9.169 339 HB3 ASP 39 HB3 ASP 39 12.237 -10.169 -9.593 340 H GLN 40 H GLN 40 11.919 -6.724 -7.845 341 HA GLN 40 HA GLN 40 14.630 -7.036 -6.605 342 HB2 GLN 40 HB2 GLN 40 13.927 -5.547 -9.145 343 HB3 GLN 40 HB3 GLN 40 15.429 -5.323 -8.237 344 HG2 GLN 40 HG2 GLN 40 15.980 -7.725 -8.545 345 HG3 GLN 40 HG3 GLN 40 14.507 -7.940 -9.497 346 HE21 GLN 40 HE21 GLN 40 15.894 -6.473 -12.440 347 HE22 GLN 40 HE22 GLN 40 14.434 -7.086 -11.679 348 HA PRO 41 HA PRO 41 11.989 -3.834 -4.525 349 HB2 PRO 41 HB2 PRO 41 12.579 -4.395 -1.911 350 HB3 PRO 41 HB3 PRO 41 11.388 -5.302 -2.895 351 HG2 PRO 41 HG2 PRO 41 14.290 -6.016 -2.363 352 HG3 PRO 41 HG3 PRO 41 12.845 -7.064 -2.185 353 HD2 PRO 41 HD2 PRO 41 14.396 -7.124 -4.418 354 HD3 PRO 41 HD3 PRO 41 12.621 -7.307 -4.524 355 H ASP 42 H ASP 42 12.460 -1.864 -3.708 356 HA ASP 42 HA ASP 42 15.327 -1.023 -3.608 357 HB2 ASP 42 HB2 ASP 42 13.740 0.148 -5.153 358 HB3 ASP 42 HB3 ASP 42 12.794 0.653 -3.750 359 H TRP 43 H TRP 43 12.503 -1.544 -1.641 360 HA TRP 43 HA TRP 43 14.061 -1.035 0.800 361 HB2 TRP 43 HB2 TRP 43 12.905 1.090 0.433 362 HB3 TRP 43 HB3 TRP 43 11.375 0.260 0.207 363 HD1 TRP 43 HD1 TRP 43 13.712 1.531 2.883 364 HE1 TRP 43 HE1 TRP 43 12.589 1.382 5.186 365 HE3 TRP 43 HE3 TRP 43 9.615 -1.273 1.612 366 HZ2 TRP 43 HZ2 TRP 43 10.138 0.332 6.291 367 HZ3 TRP 43 HZ3 TRP 43 7.903 -1.833 3.313 368 HH2 TRP 43 HH2 TRP 43 8.134 -1.012 5.646 369 H THR 44 H THR 44 13.393 -2.275 2.571 370 HA THR 44 HA THR 44 10.945 -3.903 2.420 371 HB THR 44 HB THR 44 12.124 -5.891 3.224 372 HG1 THR 44 HG1 THR 44 14.386 -5.999 3.066 373 HG21 THR 44 HG21 THR 44 11.739 -5.674 0.798 374 HG22 THR 44 HG22 THR 44 13.380 -5.024 0.601 375 HG23 THR 44 HG23 THR 44 13.133 -6.686 1.191 376 H GLY 45 H GLY 45 10.107 -4.542 4.369 377 HA2 GLY 45 HA2 GLY 45 11.204 -4.084 6.941 378 HA3 GLY 45 HA3 GLY 45 10.420 -2.594 6.431 379 H ARG 46 H ARG 46 8.608 -2.446 7.436 380 HA ARG 46 HA ARG 46 6.764 -4.774 7.880 381 HB2 ARG 46 HB2 ARG 46 8.113 -4.011 9.856 382 HB3 ARG 46 HB3 ARG 46 7.359 -2.421 9.735 383 HG2 ARG 46 HG2 ARG 46 5.126 -3.489 10.177 384 HG3 ARG 46 HG3 ARG 46 5.946 -5.060 10.266 385 HD2 ARG 46 HD2 ARG 46 5.621 -4.384 12.495 386 HD3 ARG 46 HD3 ARG 46 7.342 -4.171 12.147 387 HE ARG 46 HE ARG 46 5.659 -1.760 11.793 388 HH11 ARG 46 HH11 ARG 46 5.771 -0.108 13.195 389 HH12 ARG 46 HH12 ARG 46 6.672 -0.263 14.691 390 HH21 ARG 46 HH21 ARG 46 7.667 -3.495 14.090 391 HH22 ARG 46 HH22 ARG 46 7.750 -2.131 15.170 392 H LEU 47 H LEU 47 4.590 -4.424 7.720 393 HA LEU 47 HA LEU 47 3.603 -1.855 6.522 394 HB2 LEU 47 HB2 LEU 47 3.027 -4.020 5.378 395 HB3 LEU 47 HB3 LEU 47 2.366 -4.589 6.900 396 HG LEU 47 HG LEU 47 0.733 -2.505 6.707 397 HD11 LEU 47 HD11 LEU 47 0.205 -1.896 4.429 398 HD12 LEU 47 HD12 LEU 47 1.888 -1.483 4.778 399 HD13 LEU 47 HD13 LEU 47 1.517 -2.924 3.803 400 HD21 LEU 47 HD21 LEU 47 0.005 -4.798 6.721 401 HD22 LEU 47 HD22 LEU 47 -0.837 -3.929 5.443 402 HD23 LEU 47 HD23 LEU 47 0.509 -5.023 5.040 403 H ARG 48 H ARG 48 2.379 -0.477 7.794 404 HA ARG 48 HA ARG 48 0.632 -1.747 9.784 405 HB2 ARG 48 HB2 ARG 48 2.625 -0.945 11.053 406 HB3 ARG 48 HB3 ARG 48 2.184 0.716 10.621 407 HG2 ARG 48 HG2 ARG 48 0.069 0.520 11.819 408 HG3 ARG 48 HG3 ARG 48 0.251 -1.234 11.972 409 HD2 ARG 48 HD2 ARG 48 0.742 -0.179 14.104 410 HD3 ARG 48 HD3 ARG 48 2.173 -0.965 13.450 411 HE ARG 48 HE ARG 48 3.143 1.140 12.885 412 HH11 ARG 48 HH11 ARG 48 3.506 3.227 13.270 413 HH12 ARG 48 HH12 ARG 48 2.469 4.160 14.341 414 HH21 ARG 48 HH21 ARG 48 0.245 1.578 14.841 415 HH22 ARG 48 HH22 ARG 48 0.633 3.243 15.179 416 H ILE 49 H ILE 49 -1.161 -1.466 8.761 417 HA ILE 49 HA ILE 49 -1.982 1.038 7.443 418 HB ILE 49 HB ILE 49 -3.456 -1.569 7.965 419 HG12 ILE 49 HG12 ILE 49 -2.051 -0.463 5.490 420 HG13 ILE 49 HG13 ILE 49 -1.600 -1.889 6.425 421 HG21 ILE 49 HG21 ILE 49 -5.000 0.400 7.728 422 HG22 ILE 49 HG22 ILE 49 -4.276 0.707 6.123 423 HG23 ILE 49 HG23 ILE 49 -5.171 -0.794 6.462 424 HD11 ILE 49 HD11 ILE 49 -2.653 -2.651 4.446 425 HD12 ILE 49 HD12 ILE 49 -3.787 -2.952 5.768 426 HD13 ILE 49 HD13 ILE 49 -4.041 -1.573 4.649 427 H THR 50 H THR 50 -3.031 2.609 8.418 428 HA THR 50 HA THR 50 -4.396 2.176 11.036 429 HB THR 50 HB THR 50 -3.573 4.375 11.797 430 HG1 THR 50 HG1 THR 50 -1.858 4.165 9.552 431 HG21 THR 50 HG21 THR 50 -1.236 3.828 12.271 432 HG22 THR 50 HG22 THR 50 -2.275 2.429 12.549 433 HG23 THR 50 HG23 THR 50 -1.271 2.511 11.084 434 H SER 51 H SER 51 -5.940 4.109 11.523 435 HA SER 51 HA SER 51 -6.885 5.509 9.130 436 HB2 SER 51 HB2 SER 51 -9.167 4.658 9.264 437 HB3 SER 51 HB3 SER 51 -8.009 3.373 8.898 438 HG SER 51 HG SER 51 -8.042 2.939 11.241 439 H LYS 52 H LYS 52 -7.621 7.406 9.522 440 HA LYS 52 HA LYS 52 -8.655 8.223 12.208 441 HB2 LYS 52 HB2 LYS 52 -6.602 9.342 11.257 442 HB3 LYS 52 HB3 LYS 52 -7.639 9.961 9.950 443 HG2 LYS 52 HG2 LYS 52 -9.104 10.859 11.965 444 HG3 LYS 52 HG3 LYS 52 -7.610 10.635 12.877 445 HD2 LYS 52 HD2 LYS 52 -8.090 12.330 10.410 446 HD3 LYS 52 HD3 LYS 52 -7.705 12.904 12.055 447 HE2 LYS 52 HE2 LYS 52 -5.432 12.100 11.850 448 HE3 LYS 52 HE3 LYS 52 -5.788 11.301 10.312 449 HZ1 LYS 52 HZ1 LYS 52 -4.689 13.429 9.976 450 HZ2 LYS 52 HZ2 LYS 52 -6.209 13.524 9.368 451 HZ3 LYS 52 HZ3 LYS 52 -5.824 14.224 10.817 452 H GLY 53 H GLY 53 -10.647 7.321 11.878 453 HA2 GLY 53 HA2 GLY 53 -12.931 7.383 11.416 454 HA3 GLY 53 HA3 GLY 53 -12.686 8.924 10.593 455 H LYS 54 H LYS 54 -13.549 8.740 8.606 456 HA LYS 54 HA LYS 54 -13.597 6.372 6.921 457 HB2 LYS 54 HB2 LYS 54 -15.229 8.264 6.795 458 HB3 LYS 54 HB3 LYS 54 -13.925 9.321 6.226 459 HG2 LYS 54 HG2 LYS 54 -13.697 7.932 4.181 460 HG3 LYS 54 HG3 LYS 54 -14.954 6.833 4.799 461 HD2 LYS 54 HD2 LYS 54 -16.572 8.702 4.748 462 HD3 LYS 54 HD3 LYS 54 -15.318 9.812 4.198 463 HE2 LYS 54 HE2 LYS 54 -16.170 7.326 2.636 464 HE3 LYS 54 HE3 LYS 54 -16.924 8.909 2.429 465 HZ1 LYS 54 HZ1 LYS 54 -14.071 8.265 1.848 466 HZ2 LYS 54 HZ2 LYS 54 -15.222 8.673 0.784 467 HZ3 LYS 54 HZ3 LYS 54 -14.688 9.787 1.844 468 H THR 55 H THR 55 -10.986 8.411 7.623 469 HA THR 55 HA THR 55 -9.764 7.782 5.031 470 HB THR 55 HB THR 55 -8.558 9.396 7.293 471 HG1 THR 55 HG1 THR 55 -9.483 11.189 6.281 472 HG21 THR 55 HG21 THR 55 -8.354 9.276 4.242 473 HG22 THR 55 HG22 THR 55 -7.472 10.469 5.243 474 HG23 THR 55 HG23 THR 55 -7.106 8.733 5.380 475 H ALA 56 H ALA 56 -8.571 6.002 4.751 476 HA ALA 56 HA ALA 56 -7.149 4.749 7.043 477 HB1 ALA 56 HB1 ALA 56 -7.660 3.778 4.216 478 HB2 ALA 56 HB2 ALA 56 -6.597 2.952 5.379 479 HB3 ALA 56 HB3 ALA 56 -8.317 3.137 5.726 480 H TYR 57 H TYR 57 -4.902 4.372 6.912 481 HA TYR 57 HA TYR 57 -3.314 6.012 4.997 482 HB2 TYR 57 HB2 TYR 57 -2.950 5.890 8.006 483 HB3 TYR 57 HB3 TYR 57 -1.794 6.580 6.878 484 HD1 TYR 57 HD1 TYR 57 -2.070 8.821 6.028 485 HD2 TYR 57 HD2 TYR 57 -5.198 6.970 8.356 486 HE1 TYR 57 HE1 TYR 57 -3.249 11.009 6.201 487 HE2 TYR 57 HE2 TYR 57 -6.400 9.118 8.450 488 HH TYR 57 HH TYR 57 -5.104 12.116 6.970 489 H ILE 58 H ILE 58 -2.212 4.547 3.867 490 HA ILE 58 HA ILE 58 -1.363 1.966 5.053 491 HB ILE 58 HB ILE 58 -0.565 3.111 2.355 492 HG12 ILE 58 HG12 ILE 58 -2.978 3.052 2.315 493 HG13 ILE 58 HG13 ILE 58 -2.270 1.854 1.253 494 HG21 ILE 58 HG21 ILE 58 -0.518 0.335 3.586 495 HG22 ILE 58 HG22 ILE 58 -0.220 0.674 1.868 496 HG23 ILE 58 HG23 ILE 58 0.869 1.324 3.094 497 HD11 ILE 58 HD11 ILE 58 -3.460 1.270 3.991 498 HD12 ILE 58 HD12 ILE 58 -4.221 0.992 2.409 499 HD13 ILE 58 HD13 ILE 58 -2.779 0.064 2.869 500 H LYS 59 H LYS 59 0.167 2.386 6.666 501 HA LYS 59 HA LYS 59 2.484 4.104 5.903 502 HB2 LYS 59 HB2 LYS 59 1.858 3.216 8.720 503 HB3 LYS 59 HB3 LYS 59 3.016 4.407 8.152 504 HG2 LYS 59 HG2 LYS 59 0.914 5.601 7.097 505 HG3 LYS 59 HG3 LYS 59 -0.009 4.589 8.220 506 HD2 LYS 59 HD2 LYS 59 1.359 5.544 10.112 507 HD3 LYS 59 HD3 LYS 59 2.185 6.586 8.921 508 HE2 LYS 59 HE2 LYS 59 -0.155 7.368 8.220 509 HE3 LYS 59 HE3 LYS 59 -0.755 6.582 9.696 510 HZ1 LYS 59 HZ1 LYS 59 1.013 8.031 10.845 511 HZ2 LYS 59 HZ2 LYS 59 1.088 8.876 9.432 512 HZ3 LYS 59 HZ3 LYS 59 -0.316 8.807 10.311 513 H LEU 60 H LEU 60 4.506 3.443 5.962 514 HA LEU 60 HA LEU 60 5.065 0.510 6.233 515 HB2 LEU 60 HB2 LEU 60 6.048 2.557 4.213 516 HB3 LEU 60 HB3 LEU 60 6.747 0.949 4.401 517 HG LEU 60 HG LEU 60 3.783 1.314 3.781 518 HD11 LEU 60 HD11 LEU 60 4.442 0.883 1.401 519 HD12 LEU 60 HD12 LEU 60 4.946 2.463 2.023 520 HD13 LEU 60 HD13 LEU 60 6.136 1.158 1.882 521 HD21 LEU 60 HD21 LEU 60 4.540 -0.926 4.589 522 HD22 LEU 60 HD22 LEU 60 3.996 -0.967 2.906 523 HD23 LEU 60 HD23 LEU 60 5.733 -0.976 3.278 524 H GLU 61 H GLU 61 6.727 -0.026 7.505 525 HA GLU 61 HA GLU 61 8.217 2.179 8.862 526 HB2 GLU 61 HB2 GLU 61 6.696 -0.079 10.211 527 HB3 GLU 61 HB3 GLU 61 7.607 1.211 11.003 528 HG2 GLU 61 HG2 GLU 61 6.027 2.878 9.909 529 HG3 GLU 61 HG3 GLU 61 5.035 1.502 9.391 530 H ASP 62 H ASP 62 10.141 1.497 10.120 531 HA ASP 62 HA ASP 62 11.631 -0.598 8.835 532 HB2 ASP 62 HB2 ASP 62 12.639 1.457 9.740 533 HB3 ASP 62 HB3 ASP 62 12.154 0.990 11.374 534 H LYS 63 H LYS 63 12.239 -2.621 9.650 535 HA LYS 63 HA LYS 63 10.055 -4.043 10.888 536 HB2 LYS 63 HB2 LYS 63 11.523 -4.844 9.030 537 HB3 LYS 63 HB3 LYS 63 12.864 -4.988 10.169 538 HG2 LYS 63 HG2 LYS 63 11.645 -6.704 11.432 539 HG3 LYS 63 HG3 LYS 63 10.217 -6.501 10.405 540 HD2 LYS 63 HD2 LYS 63 12.956 -7.397 9.398 541 HD3 LYS 63 HD3 LYS 63 11.675 -8.506 9.906 542 HE2 LYS 63 HE2 LYS 63 10.164 -7.624 8.179 543 HE3 LYS 63 HE3 LYS 63 11.389 -6.469 7.648 544 HZ1 LYS 63 HZ1 LYS 63 11.302 -8.540 6.299 545 HZ2 LYS 63 HZ2 LYS 63 12.789 -8.294 6.958 546 HZ3 LYS 63 HZ3 LYS 63 11.777 -9.410 7.594 547 H VAL 64 H VAL 64 12.805 -2.493 12.229 548 HA VAL 64 HA VAL 64 12.438 -3.901 14.851 549 HB VAL 64 HB VAL 64 14.910 -3.469 15.120 550 HG11 VAL 64 HG11 VAL 64 14.041 -5.619 13.140 551 HG12 VAL 64 HG12 VAL 64 15.497 -5.667 14.158 552 HG13 VAL 64 HG13 VAL 64 13.896 -5.724 14.910 553 HG21 VAL 64 HG21 VAL 64 15.431 -2.121 13.178 554 HG22 VAL 64 HG22 VAL 64 16.376 -3.611 13.196 555 HG23 VAL 64 HG23 VAL 64 14.993 -3.469 12.097 556 H SER 65 H SER 65 13.147 -0.836 13.235 557 HA SER 65 HA SER 65 13.195 0.467 15.926 558 HB2 SER 65 HB2 SER 65 14.062 1.495 13.207 559 HB3 SER 65 HB3 SER 65 14.139 2.407 14.731 560 HG SER 65 HG SER 65 16.132 1.378 14.224 561 H GLY 66 H GLY 66 10.979 -0.176 13.492 562 HA2 GLY 66 HA2 GLY 66 8.864 0.575 13.036 563 HA3 GLY 66 HA3 GLY 66 8.901 1.424 14.586 564 H GLU 67 H GLU 67 11.345 2.390 12.314 565 HA GLU 67 HA GLU 67 10.329 5.105 12.352 566 HB2 GLU 67 HB2 GLU 67 12.686 3.865 10.881 567 HB3 GLU 67 HB3 GLU 67 12.304 5.593 10.895 568 HG2 GLU 67 HG2 GLU 67 12.472 5.604 13.384 569 HG3 GLU 67 HG3 GLU 67 12.939 3.904 13.347 570 H LEU 68 H LEU 68 9.275 6.298 10.840 571 HA LEU 68 HA LEU 68 7.732 4.906 8.893 572 HB2 LEU 68 HB2 LEU 68 7.085 6.889 10.283 573 HB3 LEU 68 HB3 LEU 68 8.107 7.904 9.284 574 HG LEU 68 HG LEU 68 5.650 8.025 8.880 575 HD11 LEU 68 HD11 LEU 68 7.215 8.794 7.163 576 HD12 LEU 68 HD12 LEU 68 7.186 7.186 6.418 577 HD13 LEU 68 HD13 LEU 68 5.707 8.159 6.481 578 HD21 LEU 68 HD21 LEU 68 5.149 5.596 9.112 579 HD22 LEU 68 HD22 LEU 68 4.445 6.364 7.680 580 HD23 LEU 68 HD23 LEU 68 5.879 5.341 7.508 581 H PHE 69 H PHE 69 8.260 4.288 6.956 582 HA PHE 69 HA PHE 69 10.489 5.469 5.381 583 HB2 PHE 69 HB2 PHE 69 10.537 3.120 5.427 584 HB3 PHE 69 HB3 PHE 69 8.804 2.976 5.178 585 HD1 PHE 69 HD1 PHE 69 8.294 1.979 3.153 586 HD2 PHE 69 HD2 PHE 69 11.577 4.765 3.308 587 HE1 PHE 69 HE1 PHE 69 8.590 1.753 0.720 588 HE2 PHE 69 HE2 PHE 69 11.850 4.573 0.864 589 HZ PHE 69 HZ PHE 69 10.339 3.073 -0.463 590 H ALA 70 H ALA 70 7.001 4.720 4.931 591 HA ALA 70 HA ALA 70 6.572 7.279 3.598 592 HB1 ALA 70 HB1 ALA 70 5.652 6.306 1.546 593 HB2 ALA 70 HB2 ALA 70 7.346 5.827 1.716 594 HB3 ALA 70 HB3 ALA 70 6.054 4.666 2.096 595 H GLN 71 H GLN 71 4.304 7.721 3.206 596 HA GLN 71 HA GLN 71 2.348 5.861 4.341 597 HB2 GLN 71 HB2 GLN 71 1.205 7.604 5.647 598 HB3 GLN 71 HB3 GLN 71 2.794 7.155 6.260 599 HG2 GLN 71 HG2 GLN 71 3.746 9.230 5.165 600 HG3 GLN 71 HG3 GLN 71 2.100 9.706 4.742 601 HE21 GLN 71 HE21 GLN 71 3.023 11.418 7.928 602 HE22 GLN 71 HE22 GLN 71 3.628 11.432 6.278 603 H ALA 72 H ALA 72 0.527 5.720 3.137 604 HA ALA 72 HA ALA 72 -0.014 7.857 1.111 605 HB1 ALA 72 HB1 ALA 72 -0.714 4.913 0.960 606 HB2 ALA 72 HB2 ALA 72 -1.119 6.153 -0.236 607 HB3 ALA 72 HB3 ALA 72 0.576 5.740 0.056 608 HA PRO 73 HA PRO 73 -3.880 8.108 3.560 609 HB2 PRO 73 HB2 PRO 73 -4.841 10.461 2.607 610 HB3 PRO 73 HB3 PRO 73 -3.468 10.376 3.753 611 HG2 PRO 73 HG2 PRO 73 -3.359 10.718 0.744 612 HG3 PRO 73 HG3 PRO 73 -2.456 11.619 1.999 613 HD2 PRO 73 HD2 PRO 73 -1.417 9.475 0.607 614 HD3 PRO 73 HD3 PRO 73 -0.924 9.875 2.281 615 H VAL 74 H VAL 74 -5.591 6.934 3.037 616 HA VAL 74 HA VAL 74 -6.624 6.785 0.231 617 HB VAL 74 HB VAL 74 -6.766 4.671 2.406 618 HG11 VAL 74 HG11 VAL 74 -7.633 3.199 0.656 619 HG12 VAL 74 HG12 VAL 74 -8.698 4.575 0.892 620 HG13 VAL 74 HG13 VAL 74 -7.601 4.544 -0.507 621 HG21 VAL 74 HG21 VAL 74 -5.252 3.307 1.207 622 HG22 VAL 74 HG22 VAL 74 -5.107 4.473 -0.105 623 HG23 VAL 74 HG23 VAL 74 -4.455 4.854 1.502 624 H GLU 75 H GLU 75 -8.582 7.674 -0.033 625 HA GLU 75 HA GLU 75 -10.416 8.007 2.319 626 HB2 GLU 75 HB2 GLU 75 -10.054 9.669 -0.206 627 HB3 GLU 75 HB3 GLU 75 -11.368 9.897 0.952 628 HG2 GLU 75 HG2 GLU 75 -9.766 10.384 2.744 629 HG3 GLU 75 HG3 GLU 75 -8.411 10.152 1.633 630 H GLN 76 H GLN 76 -10.031 6.078 -0.339 631 HA GLN 76 HA GLN 76 -12.728 5.134 -0.284 632 HB2 GLN 76 HB2 GLN 76 -13.324 5.473 -2.561 633 HB3 GLN 76 HB3 GLN 76 -12.894 7.043 -1.910 634 HG2 GLN 76 HG2 GLN 76 -11.209 5.331 -3.785 635 HG3 GLN 76 HG3 GLN 76 -12.136 6.750 -4.214 636 HE21 GLN 76 HE21 GLN 76 -8.410 7.237 -2.640 637 HE22 GLN 76 HE22 GLN 76 -9.190 5.641 -2.565 638 H TYR 77 H TYR 77 -12.807 2.984 -0.888 639 HA TYR 77 HA TYR 77 -10.402 1.772 -2.137 640 HB2 TYR 77 HB2 TYR 77 -10.412 1.361 0.268 641 HB3 TYR 77 HB3 TYR 77 -11.964 0.500 0.122 642 HD1 TYR 77 HD1 TYR 77 -11.887 -1.913 -0.621 643 HD2 TYR 77 HD2 TYR 77 -8.474 0.662 -0.853 644 HE1 TYR 77 HE1 TYR 77 -10.476 -3.844 -1.296 645 HE2 TYR 77 HE2 TYR 77 -7.041 -1.243 -1.563 646 HH TYR 77 HH TYR 77 -8.414 -4.554 -1.893 647 HA PRO 78 HA PRO 78 -9.722 0.446 -3.673 648 HB2 PRO 78 HB2 PRO 78 -9.832 0.073 -6.356 649 HB3 PRO 78 HB3 PRO 78 -10.033 -1.271 -5.190 650 HG2 PRO 78 HG2 PRO 78 -12.220 0.327 -6.573 651 HG3 PRO 78 HG3 PRO 78 -12.047 -1.457 -6.482 652 HD2 PRO 78 HD2 PRO 78 -13.641 -0.084 -4.754 653 HD3 PRO 78 HD3 PRO 78 -12.689 -1.495 -4.207 654 H GLY 79 H GLY 79 -8.442 2.019 -4.977 655 HA2 GLY 79 HA2 GLY 79 -9.759 4.245 -6.336 656 HA3 GLY 79 HA3 GLY 79 -9.127 4.674 -4.748 657 H ILE 80 H ILE 80 -7.719 6.186 -5.851 658 HA ILE 80 HA ILE 80 -5.535 5.105 -7.502 659 HB ILE 80 HB ILE 80 -6.520 7.294 -7.998 660 HG12 ILE 80 HG12 ILE 80 -4.515 8.621 -8.319 661 HG13 ILE 80 HG13 ILE 80 -3.627 7.684 -7.124 662 HG21 ILE 80 HG21 ILE 80 -5.281 8.300 -5.394 663 HG22 ILE 80 HG22 ILE 80 -6.099 9.273 -6.623 664 HG23 ILE 80 HG23 ILE 80 -7.027 8.096 -5.692 665 HD11 ILE 80 HD11 ILE 80 -3.649 5.721 -8.576 666 HD12 ILE 80 HD12 ILE 80 -4.721 6.550 -9.737 667 HD13 ILE 80 HD13 ILE 80 -3.057 7.120 -9.483 668 H ALA 81 H ALA 81 -6.114 5.916 -4.125 669 HA ALA 81 HA ALA 81 -3.311 6.061 -3.509 670 HB1 ALA 81 HB1 ALA 81 -5.727 5.974 -1.699 671 HB2 ALA 81 HB2 ALA 81 -4.028 6.250 -1.189 672 HB3 ALA 81 HB3 ALA 81 -4.850 7.420 -2.255 673 H VAL 82 H VAL 82 -5.636 3.390 -3.461 674 HA VAL 82 HA VAL 82 -3.303 1.575 -3.182 675 HB VAL 82 HB VAL 82 -4.209 1.762 -0.970 676 HG11 VAL 82 HG11 VAL 82 -6.872 1.060 -2.102 677 HG12 VAL 82 HG12 VAL 82 -6.428 1.223 -0.370 678 HG13 VAL 82 HG13 VAL 82 -6.403 2.620 -1.419 679 HG21 VAL 82 HG21 VAL 82 -3.387 -0.407 -1.808 680 HG22 VAL 82 HG22 VAL 82 -4.638 -0.585 -0.573 681 HG23 VAL 82 HG23 VAL 82 -5.026 -0.852 -2.288 682 H GLU 83 H GLU 83 -3.322 0.182 -4.837 683 HA GLU 83 HA GLU 83 -5.848 -0.748 -6.109 684 HB2 GLU 83 HB2 GLU 83 -4.136 1.256 -7.217 685 HB3 GLU 83 HB3 GLU 83 -3.755 -0.211 -8.098 686 HG2 GLU 83 HG2 GLU 83 -6.562 0.916 -7.737 687 HG3 GLU 83 HG3 GLU 83 -5.519 1.233 -9.122 688 H THR 84 H THR 84 -5.668 -2.666 -7.398 689 HA THR 84 HA THR 84 -3.321 -4.392 -6.670 690 HB THR 84 HB THR 84 -5.918 -5.470 -7.622 691 HG1 THR 84 HG1 THR 84 -6.323 -5.874 -5.306 692 HG21 THR 84 HG21 THR 84 -3.952 -6.911 -7.608 693 HG22 THR 84 HG22 THR 84 -3.688 -6.567 -5.880 694 HG23 THR 84 HG23 THR 84 -5.130 -7.462 -6.412 695 H VAL 85 H VAL 85 -2.424 -3.166 -8.336 696 HA VAL 85 HA VAL 85 -1.440 -2.996 -10.429 697 HB VAL 85 HB VAL 85 -0.407 -5.297 -10.878 698 HG11 VAL 85 HG11 VAL 85 1.094 -4.934 -8.916 699 HG12 VAL 85 HG12 VAL 85 0.670 -3.418 -9.709 700 HG13 VAL 85 HG13 VAL 85 -0.121 -3.882 -8.186 701 HG21 VAL 85 HG21 VAL 85 -2.103 -6.678 -9.613 702 HG22 VAL 85 HG22 VAL 85 -0.425 -6.917 -9.123 703 HG23 VAL 85 HG23 VAL 85 -1.502 -5.938 -8.122 704 H THR 86 H THR 86 -3.142 -6.038 -10.934 705 HA THR 86 HA THR 86 -4.732 -4.822 -12.988 706 HB THR 86 HB THR 86 -4.613 -6.768 -14.556 707 HG1 THR 86 HG1 THR 86 -2.846 -8.065 -14.550 708 HG21 THR 86 HG21 THR 86 -1.925 -5.412 -14.198 709 HG22 THR 86 HG22 THR 86 -2.630 -5.960 -15.742 710 HG23 THR 86 HG23 THR 86 -3.313 -4.554 -14.872 711 H ASP 87 H ASP 87 -3.881 -7.837 -11.361 712 HA ASP 87 HA ASP 87 -6.657 -8.104 -10.350 713 HB2 ASP 87 HB2 ASP 87 -6.762 -9.182 -12.584 714 HB3 ASP 87 HB3 ASP 87 -5.438 -10.242 -12.110 715 H SER 88 H SER 88 -3.871 -10.344 -10.719 716 HA SER 88 HA SER 88 -3.958 -11.558 -8.259 717 HB2 SER 88 HB2 SER 88 -2.221 -11.971 -10.025 718 HB3 SER 88 HB3 SER 88 -1.258 -10.687 -9.333 719 HG SER 88 HG SER 88 -1.126 -13.024 -8.667 720 H SER 89 H SER 89 -3.828 -11.021 -6.231 721 HA SER 89 HA SER 89 -2.502 -8.548 -5.386 722 HB2 SER 89 HB2 SER 89 -3.601 -8.884 -3.329 723 HB3 SER 89 HB3 SER 89 -4.673 -9.029 -4.744 724 HG SER 89 HG SER 89 -5.015 -10.670 -3.110 725 H ARG 90 H ARG 90 -0.936 -11.097 -6.267 726 HA ARG 90 HA ARG 90 0.936 -11.504 -4.088 727 HB2 ARG 90 HB2 ARG 90 0.906 -12.699 -6.299 728 HB3 ARG 90 HB3 ARG 90 1.485 -11.225 -7.080 729 HG2 ARG 90 HG2 ARG 90 3.550 -11.308 -5.688 730 HG3 ARG 90 HG3 ARG 90 2.954 -12.760 -4.878 731 HD2 ARG 90 HD2 ARG 90 3.615 -12.501 -7.842 732 HD3 ARG 90 HD3 ARG 90 4.642 -13.243 -6.624 733 HE ARG 90 HE ARG 90 3.061 -15.048 -6.356 734 HH11 ARG 90 HH11 ARG 90 1.437 -16.385 -7.156 735 HH12 ARG 90 HH12 ARG 90 0.613 -15.943 -8.642 736 HH21 ARG 90 HH21 ARG 90 2.467 -13.180 -9.301 737 HH22 ARG 90 HH22 ARG 90 0.951 -14.052 -9.566 738 H TYR 91 H TYR 91 0.124 -8.761 -6.047 739 HA TYR 91 HA TYR 91 2.018 -7.016 -4.567 740 HB2 TYR 91 HB2 TYR 91 1.335 -6.722 -7.510 741 HB3 TYR 91 HB3 TYR 91 2.586 -5.865 -6.630 742 HD1 TYR 91 HD1 TYR 91 4.551 -7.276 -5.708 743 HD2 TYR 91 HD2 TYR 91 1.744 -8.744 -8.612 744 HE1 TYR 91 HE1 TYR 91 6.206 -9.017 -6.419 745 HE2 TYR 91 HE2 TYR 91 3.347 -10.482 -9.323 746 HH TYR 91 HH TYR 91 6.648 -10.704 -7.851 747 H PHE 92 H PHE 92 1.524 -4.764 -4.749 748 HA PHE 92 HA PHE 92 -1.191 -3.923 -5.595 749 HB2 PHE 92 HB2 PHE 92 -0.016 -3.272 -2.865 750 HB3 PHE 92 HB3 PHE 92 -1.443 -2.521 -3.556 751 HD1 PHE 92 HD1 PHE 92 -0.220 -5.299 -1.658 752 HD2 PHE 92 HD2 PHE 92 -3.465 -3.991 -4.173 753 HE1 PHE 92 HE1 PHE 92 -1.701 -7.035 -0.679 754 HE2 PHE 92 HE2 PHE 92 -4.906 -5.797 -3.264 755 HZ PHE 92 HZ PHE 92 -4.022 -7.337 -1.543 756 H VAL 93 H VAL 93 -1.258 -1.469 -5.516 757 HA VAL 93 HA VAL 93 1.375 -0.108 -5.596 758 HB VAL 93 HB VAL 93 -0.894 0.360 -7.572 759 HG11 VAL 93 HG11 VAL 93 1.643 1.988 -7.116 760 HG12 VAL 93 HG12 VAL 93 0.565 2.141 -8.508 761 HG13 VAL 93 HG13 VAL 93 -0.035 2.550 -6.910 762 HG21 VAL 93 HG21 VAL 93 2.023 -0.444 -7.947 763 HG22 VAL 93 HG22 VAL 93 0.603 -1.472 -8.220 764 HG23 VAL 93 HG23 VAL 93 0.889 -0.068 -9.253 765 H ILE 94 H ILE 94 1.389 1.797 -4.456 766 HA ILE 94 HA ILE 94 -1.204 2.935 -3.649 767 HB ILE 94 HB ILE 94 -0.576 3.365 -1.366 768 HG12 ILE 94 HG12 ILE 94 1.971 1.732 -1.841 769 HG13 ILE 94 HG13 ILE 94 1.929 3.488 -1.806 770 HG21 ILE 94 HG21 ILE 94 -0.116 0.392 -1.919 771 HG22 ILE 94 HG22 ILE 94 -0.727 1.130 -0.431 772 HG23 ILE 94 HG23 ILE 94 -1.692 1.197 -1.889 773 HD11 ILE 94 HD11 ILE 94 1.240 1.646 0.491 774 HD12 ILE 94 HD12 ILE 94 2.615 2.750 0.375 775 HD13 ILE 94 HD13 ILE 94 0.969 3.392 0.510 776 H ARG 95 H ARG 95 -1.210 5.119 -3.133 777 HA ARG 95 HA ARG 95 0.950 6.715 -4.473 778 HB2 ARG 95 HB2 ARG 95 -1.338 6.755 -5.410 779 HB3 ARG 95 HB3 ARG 95 -1.929 7.481 -3.918 780 HG2 ARG 95 HG2 ARG 95 0.225 8.788 -5.613 781 HG3 ARG 95 HG3 ARG 95 -1.512 9.011 -5.883 782 HD2 ARG 95 HD2 ARG 95 -1.676 9.695 -3.412 783 HD3 ARG 95 HD3 ARG 95 0.079 9.787 -3.432 784 HE ARG 95 HE ARG 95 0.026 11.623 -4.938 785 HH11 ARG 95 HH11 ARG 95 -0.800 13.443 -5.663 786 HH12 ARG 95 HH12 ARG 95 -2.524 13.720 -5.679 787 HH21 ARG 95 HH21 ARG 95 -3.288 10.681 -4.243 788 HH22 ARG 95 HH22 ARG 95 -3.911 12.178 -4.879 789 H ILE 96 H ILE 96 2.427 6.963 -2.878 790 HA ILE 96 HA ILE 96 1.688 7.718 -0.129 791 HB ILE 96 HB ILE 96 4.108 7.682 0.304 792 HG12 ILE 96 HG12 ILE 96 4.503 6.547 -2.492 793 HG13 ILE 96 HG13 ILE 96 4.751 8.262 -2.133 794 HG21 ILE 96 HG21 ILE 96 2.778 5.676 0.682 795 HG22 ILE 96 HG22 ILE 96 2.956 5.206 -1.026 796 HG23 ILE 96 HG23 ILE 96 4.350 5.193 0.047 797 HD11 ILE 96 HD11 ILE 96 6.420 7.673 -0.417 798 HD12 ILE 96 HD12 ILE 96 6.265 5.959 -0.882 799 HD13 ILE 96 HD13 ILE 96 6.865 7.146 -2.056 800 H GLN 97 H GLN 97 2.498 9.569 0.976 801 HA GLN 97 HA GLN 97 3.231 11.893 -0.761 802 HB2 GLN 97 HB2 GLN 97 2.129 11.808 2.061 803 HB3 GLN 97 HB3 GLN 97 2.941 13.211 1.364 804 HG2 GLN 97 HG2 GLN 97 1.201 12.730 -0.658 805 HG3 GLN 97 HG3 GLN 97 0.263 12.048 0.674 806 HE21 GLN 97 HE21 GLN 97 1.095 16.103 0.541 807 HE22 GLN 97 HE22 GLN 97 2.163 14.958 -0.289 808 H ASP 98 H ASP 98 5.140 12.968 -0.511 809 HA ASP 98 HA ASP 98 7.278 11.516 0.895 810 HB2 ASP 98 HB2 ASP 98 7.469 12.605 -1.403 811 HB3 ASP 98 HB3 ASP 98 7.494 14.155 -0.550 812 H GLY 99 H GLY 99 5.004 13.685 1.938 813 HA2 GLY 99 HA2 GLY 99 4.729 14.603 4.054 814 HA3 GLY 99 HA3 GLY 99 6.412 14.251 4.440 815 H THR 100 H THR 100 6.315 15.969 1.529 816 HA THR 100 HA THR 100 6.900 18.576 2.884 817 HB THR 100 HB THR 100 8.336 19.019 0.912 818 HG1 THR 100 HG1 THR 100 8.768 17.236 -0.441 819 HG21 THR 100 HG21 THR 100 9.025 16.355 2.228 820 HG22 THR 100 HG22 THR 100 10.145 17.504 1.465 821 HG23 THR 100 HG23 THR 100 9.303 17.952 2.958 822 H GLY 101 H GLY 101 4.367 17.293 1.360 823 HA2 GLY 101 HA2 GLY 101 2.471 18.560 0.589 824 HA3 GLY 101 HA3 GLY 101 3.549 19.791 -0.066 825 H ARG 102 H ARG 102 4.909 16.835 -0.834 826 HA ARG 102 HA ARG 102 3.573 16.679 -3.503 827 HB2 ARG 102 HB2 ARG 102 5.507 16.200 -4.515 828 HB3 ARG 102 HB3 ARG 102 5.999 17.405 -3.323 829 HG2 ARG 102 HG2 ARG 102 7.245 15.908 -2.089 830 HG3 ARG 102 HG3 ARG 102 6.363 14.477 -2.631 831 HD2 ARG 102 HD2 ARG 102 8.034 16.159 -4.500 832 HD3 ARG 102 HD3 ARG 102 8.702 14.789 -3.579 833 HE ARG 102 HE ARG 102 6.456 13.735 -4.853 834 HH11 ARG 102 HH11 ARG 102 6.369 12.723 -6.732 835 HH12 ARG 102 HH12 ARG 102 7.635 12.919 -7.929 836 HH21 ARG 102 HH21 ARG 102 9.428 15.172 -6.031 837 HH22 ARG 102 HH22 ARG 102 9.339 14.300 -7.538 838 H SER 103 H SER 103 3.963 14.479 -4.573 839 HA SER 103 HA SER 103 3.725 12.210 -2.706 840 HB2 SER 103 HB2 SER 103 1.710 11.355 -3.828 841 HB3 SER 103 HB3 SER 103 1.422 12.897 -3.017 842 HG SER 103 HG SER 103 1.702 13.902 -5.114 843 H ALA 104 H ALA 104 3.716 10.102 -3.742 844 HA ALA 104 HA ALA 104 4.851 9.855 -6.453 845 HB1 ALA 104 HB1 ALA 104 6.855 10.152 -5.035 846 HB2 ALA 104 HB2 ALA 104 6.304 8.837 -3.972 847 HB3 ALA 104 HB3 ALA 104 6.755 8.491 -5.652 848 H PHE 105 H PHE 105 4.706 7.758 -7.346 849 HA PHE 105 HA PHE 105 2.822 5.917 -5.966 850 HB2 PHE 105 HB2 PHE 105 3.831 5.841 -8.820 851 HB3 PHE 105 HB3 PHE 105 2.571 4.837 -8.109 852 HD1 PHE 105 HD1 PHE 105 3.352 8.064 -9.615 853 HD2 PHE 105 HD2 PHE 105 0.398 5.911 -7.324 854 HE1 PHE 105 HE1 PHE 105 1.685 9.822 -10.113 855 HE2 PHE 105 HE2 PHE 105 -1.286 7.639 -7.883 856 HZ PHE 105 HZ PHE 105 -0.659 9.605 -9.264 857 H ILE 106 H ILE 106 3.425 4.080 -5.099 858 HA ILE 106 HA ILE 106 5.898 2.735 -6.075 859 HB ILE 106 HB ILE 106 6.484 1.831 -3.956 860 HG12 ILE 106 HG12 ILE 106 4.176 3.508 -2.807 861 HG13 ILE 106 HG13 ILE 106 4.254 1.745 -2.852 862 HG21 ILE 106 HG21 ILE 106 6.166 4.843 -3.538 863 HG22 ILE 106 HG22 ILE 106 7.484 3.789 -2.981 864 HG23 ILE 106 HG23 ILE 106 7.304 4.162 -4.698 865 HD11 ILE 106 HD11 ILE 106 4.665 2.614 -0.620 866 HD12 ILE 106 HD12 ILE 106 6.037 1.701 -1.234 867 HD13 ILE 106 HD13 ILE 106 6.097 3.483 -1.177 868 H GLY 107 H GLY 107 5.773 0.649 -6.462 869 HA2 GLY 107 HA2 GLY 107 3.280 -0.885 -6.144 870 HA3 GLY 107 HA3 GLY 107 4.774 -1.422 -6.910 871 H ILE 108 H ILE 108 3.247 -2.768 -4.860 872 HA ILE 108 HA ILE 108 5.348 -3.000 -2.760 873 HB ILE 108 HB ILE 108 2.369 -3.476 -2.245 874 HG12 ILE 108 HG12 ILE 108 4.138 -1.039 -1.737 875 HG13 ILE 108 HG13 ILE 108 2.591 -1.110 -2.588 876 HG21 ILE 108 HG21 ILE 108 4.775 -3.293 -0.393 877 HG22 ILE 108 HG22 ILE 108 3.100 -3.664 0.087 878 HG23 ILE 108 HG23 ILE 108 3.985 -4.812 -0.880 879 HD11 ILE 108 HD11 ILE 108 2.194 -0.126 -0.467 880 HD12 ILE 108 HD12 ILE 108 1.517 -1.771 -0.392 881 HD13 ILE 108 HD13 ILE 108 3.086 -1.382 0.389 882 H GLY 109 H GLY 109 5.980 -5.131 -2.319 883 HA2 GLY 109 HA2 GLY 109 4.457 -7.403 -3.535 884 HA3 GLY 109 HA3 GLY 109 6.222 -7.370 -3.545 885 H PHE 110 H PHE 110 3.879 -8.923 -2.150 886 HA PHE 110 HA PHE 110 4.696 -8.634 0.687 887 HB2 PHE 110 HB2 PHE 110 2.302 -9.610 -0.787 888 HB3 PHE 110 HB3 PHE 110 2.640 -10.371 0.756 889 HD1 PHE 110 HD1 PHE 110 1.699 -7.180 -0.859 890 HD2 PHE 110 HD2 PHE 110 2.646 -9.145 2.863 891 HE1 PHE 110 HE1 PHE 110 0.728 -5.266 0.414 892 HE2 PHE 110 HE2 PHE 110 1.563 -7.306 4.116 893 HZ PHE 110 HZ PHE 110 0.664 -5.331 2.878 894 H THR 111 H THR 111 4.954 -10.369 2.086 895 HA THR 111 HA THR 111 6.775 -12.403 1.117 896 HB THR 111 HB THR 111 6.801 -11.054 3.293 897 HG1 THR 111 HG1 THR 111 8.271 -12.338 3.740 898 HG21 THR 111 HG21 THR 111 4.552 -11.676 4.132 899 HG22 THR 111 HG22 THR 111 5.090 -13.365 4.287 900 HG23 THR 111 HG23 THR 111 5.843 -12.100 5.266 901 H ASP 112 H ASP 112 3.363 -12.317 1.837 902 HA ASP 112 HA ASP 112 3.046 -15.084 0.874 903 HB2 ASP 112 HB2 ASP 112 3.163 -15.017 3.468 904 HB3 ASP 112 HB3 ASP 112 1.609 -14.174 3.395 905 H ARG 113 H ARG 113 1.097 -15.434 -0.227 906 HA ARG 113 HA ARG 113 -0.331 -13.137 -1.218 907 HB2 ARG 113 HB2 ARG 113 0.019 -15.279 -2.463 908 HB3 ARG 113 HB3 ARG 113 -1.056 -16.101 -1.335 909 HG2 ARG 113 HG2 ARG 113 -2.184 -15.593 -3.431 910 HG3 ARG 113 HG3 ARG 113 -2.964 -14.730 -2.110 911 HD2 ARG 113 HD2 ARG 113 -1.962 -12.633 -2.756 912 HD3 ARG 113 HD3 ARG 113 -0.853 -13.420 -3.880 913 HE ARG 113 HE ARG 113 -3.583 -12.606 -4.374 914 HH11 ARG 113 HH11 ARG 113 -4.533 -13.084 -6.465 915 HH12 ARG 113 HH12 ARG 113 -3.532 -14.096 -7.537 916 HH21 ARG 113 HH21 ARG 113 -1.099 -14.888 -5.508 917 HH22 ARG 113 HH22 ARG 113 -1.930 -15.010 -7.070 918 H GLY 114 H GLY 114 -0.988 -15.315 1.499 919 HA2 GLY 114 HA2 GLY 114 -3.709 -14.394 1.999 920 HA3 GLY 114 HA3 GLY 114 -2.646 -15.281 3.102 921 H ASP 115 H ASP 115 -0.443 -13.394 3.105 922 HA ASP 115 HA ASP 115 -1.368 -11.401 4.998 923 HB2 ASP 115 HB2 ASP 115 1.279 -11.761 3.576 924 HB3 ASP 115 HB3 ASP 115 0.953 -10.480 4.732 925 H ALA 116 H ALA 116 -0.589 -11.299 1.524 926 HA ALA 116 HA ALA 116 -1.144 -8.492 1.237 927 HB1 ALA 116 HB1 ALA 116 0.234 -10.036 -0.275 928 HB2 ALA 116 HB2 ALA 116 -1.297 -10.640 -0.909 929 HB3 ALA 116 HB3 ALA 116 -0.861 -8.924 -1.089 930 H PHE 117 H PHE 117 -3.223 -11.427 0.686 931 HA PHE 117 HA PHE 117 -5.512 -9.982 -0.178 932 HB2 PHE 117 HB2 PHE 117 -5.120 -12.477 -0.265 933 HB3 PHE 117 HB3 PHE 117 -5.504 -12.547 1.451 934 HD1 PHE 117 HD1 PHE 117 -6.820 -11.590 -1.910 935 HD2 PHE 117 HD2 PHE 117 -7.829 -12.576 2.159 936 HE1 PHE 117 HE1 PHE 117 -9.217 -11.787 -2.558 937 HE2 PHE 117 HE2 PHE 117 -10.228 -12.727 1.526 938 HZ PHE 117 HZ PHE 117 -10.924 -12.344 -0.832 939 H ASP 118 H ASP 118 -4.201 -10.418 3.085 940 HA ASP 118 HA ASP 118 -6.543 -9.313 4.416 941 HB2 ASP 118 HB2 ASP 118 -4.979 -11.053 5.364 942 HB3 ASP 118 HB3 ASP 118 -3.756 -9.786 5.506 943 H PHE 119 H PHE 119 -3.494 -7.991 3.101 944 HA PHE 119 HA PHE 119 -3.743 -5.353 4.181 945 HB2 PHE 119 HB2 PHE 119 -1.714 -5.916 3.117 946 HB3 PHE 119 HB3 PHE 119 -2.487 -6.476 1.665 947 HD1 PHE 119 HD1 PHE 119 -3.579 -4.827 0.060 948 HD2 PHE 119 HD2 PHE 119 -0.888 -3.677 3.186 949 HE1 PHE 119 HE1 PHE 119 -3.235 -2.612 -1.046 950 HE2 PHE 119 HE2 PHE 119 -0.629 -1.461 2.172 951 HZ PHE 119 HZ PHE 119 -1.785 -0.917 0.034 952 H ASN 120 H ASN 120 -5.190 -6.925 1.313 953 HA ASN 120 HA ASN 120 -6.878 -4.696 0.588 954 HB2 ASN 120 HB2 ASN 120 -6.647 -6.069 -1.178 955 HB3 ASN 120 HB3 ASN 120 -6.532 -7.538 -0.199 956 HD21 ASN 120 HD21 ASN 120 -9.882 -8.413 -0.543 957 HD22 ASN 120 HD22 ASN 120 -8.311 -8.784 0.157 958 H VAL 121 H VAL 121 -7.698 -7.683 2.525 959 HA VAL 121 HA VAL 121 -10.379 -6.834 2.830 960 HB VAL 121 HB VAL 121 -8.746 -8.857 4.383 961 HG11 VAL 121 HG11 VAL 121 -11.728 -8.299 4.682 962 HG12 VAL 121 HG12 VAL 121 -10.894 -9.749 5.286 963 HG13 VAL 121 HG13 VAL 121 -10.490 -8.172 5.955 964 HG21 VAL 121 HG21 VAL 121 -11.040 -9.134 2.382 965 HG22 VAL 121 HG22 VAL 121 -9.328 -9.429 2.033 966 HG23 VAL 121 HG23 VAL 121 -10.173 -10.473 3.168 967 H SER 122 H SER 122 -7.568 -6.093 4.864 968 HA SER 122 HA SER 122 -8.837 -4.786 7.032 969 HB2 SER 122 HB2 SER 122 -6.391 -5.216 6.783 970 HB3 SER 122 HB3 SER 122 -6.309 -3.950 5.546 971 HG SER 122 HG SER 122 -7.171 -2.507 7.218 972 H LEU 123 H LEU 123 -8.464 -3.735 3.666 973 HA LEU 123 HA LEU 123 -9.485 -1.017 4.252 974 HB2 LEU 123 HB2 LEU 123 -8.515 -2.308 1.685 975 HB3 LEU 123 HB3 LEU 123 -8.972 -0.620 1.872 976 HG LEU 123 HG LEU 123 -6.753 -1.849 3.560 977 HD11 LEU 123 HD11 LEU 123 -5.144 -1.038 1.957 978 HD12 LEU 123 HD12 LEU 123 -6.221 -2.204 1.193 979 HD13 LEU 123 HD13 LEU 123 -6.463 -0.478 0.896 980 HD21 LEU 123 HD21 LEU 123 -7.701 0.332 4.310 981 HD22 LEU 123 HD22 LEU 123 -6.017 0.450 3.807 982 HD23 LEU 123 HD23 LEU 123 -7.303 1.024 2.721 983 H GLN 124 H GLN 124 -10.525 -4.025 2.567 984 HA GLN 124 HA GLN 124 -13.020 -3.069 1.608 985 HB2 GLN 124 HB2 GLN 124 -12.402 -5.834 2.741 986 HB3 GLN 124 HB3 GLN 124 -13.866 -5.370 1.873 987 HG2 GLN 124 HG2 GLN 124 -12.406 -4.731 -0.102 988 HG3 GLN 124 HG3 GLN 124 -11.046 -5.466 0.749 989 HE21 GLN 124 HE21 GLN 124 -12.202 -8.141 -1.448 990 HE22 GLN 124 HE22 GLN 124 -11.107 -6.747 -1.389 991 H ASP 125 H ASP 125 -12.400 -4.633 4.815 992 HA ASP 125 HA ASP 125 -15.052 -4.141 5.862 993 HB2 ASP 125 HB2 ASP 125 -13.299 -5.849 6.598 994 HB3 ASP 125 HB3 ASP 125 -12.412 -4.505 7.337 995 H HIS 126 H HIS 126 -12.377 -1.986 5.463 996 HA HIS 126 HA HIS 126 -13.260 -0.144 7.598 997 HB2 HIS 126 HB2 HIS 126 -10.894 -0.430 7.322 998 HB3 HIS 126 HB3 HIS 126 -10.990 0.009 5.611 999 HD2 HIS 126 HD2 HIS 126 -11.776 1.678 9.071 1000 HE1 HIS 126 HE1 HIS 126 -10.722 4.758 6.325 1001 HE2 HIS 126 HE2 HIS 126 -11.441 4.280 8.711 1002 H PHE 127 H PHE 127 -13.587 -0.481 4.092 1003 HA PHE 127 HA PHE 127 -14.948 2.168 3.987 1004 HB2 PHE 127 HB2 PHE 127 -13.643 0.507 1.858 1005 HB3 PHE 127 HB3 PHE 127 -14.783 1.795 1.477 1006 HD1 PHE 127 HD1 PHE 127 -14.378 4.163 2.349 1007 HD2 PHE 127 HD2 PHE 127 -11.357 1.091 2.516 1008 HE1 PHE 127 HE1 PHE 127 -12.636 5.874 2.770 1009 HE2 PHE 127 HE2 PHE 127 -9.617 2.818 2.867 1010 HZ PHE 127 HZ PHE 127 -10.265 5.212 3.011 1011 H LYS 128 H LYS 128 -15.614 -1.146 4.005 1012 HA LYS 128 HA LYS 128 -18.049 -1.619 2.848 1013 HB2 LYS 128 HB2 LYS 128 -16.782 -3.289 3.844 1014 HB3 LYS 128 HB3 LYS 128 -16.668 -2.473 5.401 1015 HG2 LYS 128 HG2 LYS 128 -19.345 -3.396 4.451 1016 HG3 LYS 128 HG3 LYS 128 -18.149 -4.608 4.921 1017 HD2 LYS 128 HD2 LYS 128 -18.852 -2.312 6.752 1018 HD3 LYS 128 HD3 LYS 128 -19.801 -3.800 6.748 1019 HE2 LYS 128 HE2 LYS 128 -16.798 -3.665 7.235 1020 HE3 LYS 128 HE3 LYS 128 -17.998 -3.624 8.523 1021 HZ1 LYS 128 HZ1 LYS 128 -18.682 -5.825 7.999 1022 HZ2 LYS 128 HZ2 LYS 128 -17.839 -5.868 6.591 1023 HZ3 LYS 128 HZ3 LYS 128 -17.031 -5.839 8.005 1024 H TRP 129 H TRP 129 -17.601 0.210 5.846 1025 HA TRP 129 HA TRP 129 -20.556 0.557 6.152 1026 HB2 TRP 129 HB2 TRP 129 -19.989 1.192 8.479 1027 HB3 TRP 129 HB3 TRP 129 -19.605 -0.455 8.031 1028 HD1 TRP 129 HD1 TRP 129 -17.045 -1.203 7.994 1029 HE1 TRP 129 HE1 TRP 129 -14.915 -0.165 8.746 1030 HE3 TRP 129 HE3 TRP 129 -18.744 3.564 8.785 1031 HZ2 TRP 129 HZ2 TRP 129 -13.943 2.483 9.564 1032 HZ3 TRP 129 HZ3 TRP 129 -17.117 5.384 9.349 1033 HH2 TRP 129 HH2 TRP 129 -14.733 4.842 9.760 1034 H VAL 130 H VAL 130 -18.446 2.199 4.461 1035 HA VAL 130 HA VAL 130 -19.663 4.860 5.053 1036 HB VAL 130 HB VAL 130 -16.991 5.264 4.006 1037 HG11 VAL 130 HG11 VAL 130 -18.342 5.882 6.678 1038 HG12 VAL 130 HG12 VAL 130 -16.859 6.640 6.100 1039 HG13 VAL 130 HG13 VAL 130 -18.384 6.911 5.230 1040 HG21 VAL 130 HG21 VAL 130 -16.336 3.164 5.101 1041 HG22 VAL 130 HG22 VAL 130 -15.572 4.600 5.797 1042 HG23 VAL 130 HG23 VAL 130 -16.913 3.801 6.631 1043 H LYS 131 H LYS 131 -18.535 6.298 2.967 1044 HA LYS 131 HA LYS 131 -18.376 6.639 0.702 1045 HB2 LYS 131 HB2 LYS 131 -16.704 4.801 1.410 1046 HB3 LYS 131 HB3 LYS 131 -17.789 3.679 0.614 1047 HG2 LYS 131 HG2 LYS 131 -17.396 5.240 -1.515 1048 HG3 LYS 131 HG3 LYS 131 -16.053 5.878 -0.554 1049 HD2 LYS 131 HD2 LYS 131 -15.095 4.074 -1.794 1050 HD3 LYS 131 HD3 LYS 131 -15.377 3.429 -0.158 1051 HE2 LYS 131 HE2 LYS 131 -17.734 2.737 -1.196 1052 HE3 LYS 131 HE3 LYS 131 -16.918 2.929 -2.741 1053 HZ1 LYS 131 HZ1 LYS 131 -15.338 1.198 -2.051 1054 HZ2 LYS 131 HZ2 LYS 131 -16.023 1.115 -0.562 1055 HZ3 LYS 131 HZ3 LYS 131 -16.897 0.658 -1.846 1056 H GLN 132 H GLN 132 -21.009 6.033 1.621 1057 HA GLN 132 HA GLN 132 -23.105 5.741 0.916 1058 HB2 GLN 132 HB2 GLN 132 -22.095 6.444 -1.853 1059 HB3 GLN 132 HB3 GLN 132 -23.709 6.663 -1.192 1060 HG2 GLN 132 HG2 GLN 132 -22.858 8.809 -1.024 1061 HG3 GLN 132 HG3 GLN 132 -22.615 8.183 0.601 1062 HE21 GLN 132 HE21 GLN 132 -19.284 9.395 0.320 1063 HE22 GLN 132 HE22 GLN 132 -20.788 9.405 1.232 1064 H GLU 133 H GLU 133 -21.506 3.256 0.881 1065 HA GLU 133 HA GLU 133 -23.280 1.599 -0.871 1066 HB2 GLU 133 HB2 GLU 133 -20.714 0.844 0.568 1067 HB3 GLU 133 HB3 GLU 133 -21.786 -0.276 -0.279 1068 HG2 GLU 133 HG2 GLU 133 -21.500 1.241 -2.351 1069 HG3 GLU 133 HG3 GLU 133 -20.166 1.994 -1.481 1070 H1 SER 149 H1 SER 149 17.449 -20.276 -5.814 1071 H2 SER 149 H2 SER 149 17.494 -19.190 -4.586 1072 H3 SER 149 H3 SER 149 18.857 -19.528 -5.436 1073 HA SER 149 HA SER 149 18.010 -17.411 -6.139 1074 HB2 SER 149 HB2 SER 149 17.747 -17.911 -8.580 1075 HB3 SER 149 HB3 SER 149 19.147 -18.697 -7.840 1076 HG SER 149 HG SER 149 17.936 -20.129 -9.171 1077 H GLN 150 H GLN 150 16.296 -16.344 -7.527 1078 HA GLN 150 HA GLN 150 13.542 -17.407 -7.204 1079 HB2 GLN 150 HB2 GLN 150 14.514 -14.663 -6.303 1080 HB3 GLN 150 HB3 GLN 150 12.817 -15.071 -6.521 1081 HG2 GLN 150 HG2 GLN 150 14.646 -16.479 -4.529 1082 HG3 GLN 150 HG3 GLN 150 13.600 -15.122 -4.154 1083 HE21 GLN 150 HE21 GLN 150 11.897 -18.828 -4.617 1084 HE22 GLN 150 HE22 GLN 150 13.566 -18.575 -5.135 1085 H ILE 151 H ILE 151 11.973 -16.094 -8.498 1086 HA ILE 151 HA ILE 151 13.089 -14.746 -10.865 1087 HB ILE 151 HB ILE 151 12.997 -17.218 -11.326 1088 HG12 ILE 151 HG12 ILE 151 11.179 -15.606 -13.155 1089 HG13 ILE 151 HG13 ILE 151 12.935 -15.412 -13.080 1090 HG21 ILE 151 HG21 ILE 151 10.877 -18.338 -11.705 1091 HG22 ILE 151 HG22 ILE 151 10.878 -17.695 -10.063 1092 HG23 ILE 151 HG23 ILE 151 9.969 -16.858 -11.338 1093 HD11 ILE 151 HD11 ILE 151 11.440 -17.936 -13.897 1094 HD12 ILE 151 HD12 ILE 151 12.370 -16.848 -14.938 1095 HD13 ILE 151 HD13 ILE 151 13.208 -17.814 -13.708 1096 H THR 152 H THR 152 11.437 -13.653 -12.164 1097 HA THR 152 HA THR 152 9.514 -12.204 -10.601 1098 HB THR 152 HB THR 152 8.765 -11.380 -12.885 1099 HG1 THR 152 HG1 THR 152 10.135 -11.904 -14.603 1100 HG21 THR 152 HG21 THR 152 10.811 -10.067 -13.277 1101 HG22 THR 152 HG22 THR 152 10.472 -10.180 -11.544 1102 HG23 THR 152 HG23 THR 152 11.750 -11.182 -12.261 1103 H SER 153 H SER 153 7.328 -12.282 -10.499 1104 HA SER 153 HA SER 153 5.943 -14.748 -11.507 1105 HB2 SER 153 HB2 SER 153 5.828 -13.472 -8.771 1106 HB3 SER 153 HB3 SER 153 4.794 -14.798 -9.349 1107 HG SER 153 HG SER 153 7.637 -14.858 -9.055 1108 H GLN 154 H GLN 154 5.381 -13.185 -13.161 1109 HA GLN 154 HA GLN 154 4.051 -10.808 -12.975 1110 HB2 GLN 154 HB2 GLN 154 3.183 -11.206 -15.227 1111 HB3 GLN 154 HB3 GLN 154 4.884 -11.646 -15.056 1112 HG2 GLN 154 HG2 GLN 154 4.281 -14.036 -14.919 1113 HG3 GLN 154 HG3 GLN 154 2.565 -13.627 -15.039 1114 HE21 GLN 154 HE21 GLN 154 2.724 -12.939 -18.575 1115 HE22 GLN 154 HE22 GLN 154 1.816 -12.577 -17.115 1116 H VAL 155 H VAL 155 2.004 -9.968 -13.012 1117 HA VAL 155 HA VAL 155 0.295 -11.000 -11.119 1118 HB VAL 155 HB VAL 155 -0.714 -9.117 -13.290 1119 HG11 VAL 155 HG11 VAL 155 -1.312 -8.980 -10.279 1120 HG12 VAL 155 HG12 VAL 155 -2.054 -8.068 -11.524 1121 HG13 VAL 155 HG13 VAL 155 -2.346 -9.804 -11.495 1122 HG21 VAL 155 HG21 VAL 155 1.446 -8.195 -12.646 1123 HG22 VAL 155 HG22 VAL 155 0.107 -7.218 -12.022 1124 HG23 VAL 155 HG23 VAL 155 0.976 -8.305 -10.914 1125 H TPO 156 H T2P 156 -1.078 -12.700 -11.239 1126 HA TPO 156 HA T2P 156 -2.078 -14.263 -13.283 1127 HB TPO 156 HB T2P 156 -3.195 -13.500 -10.631 1128 HG21 TPO 156 HG21 T2P 156 -5.213 -13.814 -11.634 1129 HG22 TPO 156 HG22 T2P 156 -4.839 -15.205 -10.619 1130 HG23 TPO 156 HG23 T2P 156 -4.688 -15.378 -12.381 1131 H GLY 157 H GLY 157 -4.104 -14.549 -14.087 1132 HA2 GLY 157 HA2 GLY 157 -6.105 -12.514 -14.350 1133 HA3 GLY 157 HA3 GLY 157 -5.207 -12.649 -15.867 1134 H GLN 158 H GLN 158 -4.815 -15.619 -15.540 1135 HA GLN 158 HA GLN 158 -7.160 -16.428 -16.914 1136 HB2 GLN 158 HB2 GLN 158 -6.108 -18.574 -17.128 1137 HB3 GLN 158 HB3 GLN 158 -4.932 -17.286 -17.390 1138 HG2 GLN 158 HG2 GLN 158 -4.055 -17.644 -15.064 1139 HG3 GLN 158 HG3 GLN 158 -5.215 -18.955 -14.845 1140 HE21 GLN 158 HE21 GLN 158 -2.104 -20.665 -15.744 1141 HE22 GLN 158 HE22 GLN 158 -2.787 -19.812 -14.367 1142 H ILE 159 H ILE 159 -6.372 -16.837 -13.509 1143 HA ILE 159 HA ILE 159 -8.841 -18.464 -13.103 1144 HB ILE 159 HB ILE 159 -6.803 -19.419 -12.252 1145 HG12 ILE 159 HG12 ILE 159 -8.693 -18.598 -10.010 1146 HG13 ILE 159 HG13 ILE 159 -9.013 -19.856 -11.206 1147 HG21 ILE 159 HG21 ILE 159 -5.482 -17.445 -11.701 1148 HG22 ILE 159 HG22 ILE 159 -6.600 -17.040 -10.375 1149 HG23 ILE 159 HG23 ILE 159 -5.598 -18.493 -10.306 1150 HD11 ILE 159 HD11 ILE 159 -6.846 -19.894 -9.067 1151 HD12 ILE 159 HD12 ILE 159 -8.285 -20.914 -9.180 1152 HD13 ILE 159 HD13 ILE 159 -6.986 -21.097 -10.375 1153 H GLY 160 H GLY 160 -7.390 -15.398 -12.139 1154 HA2 GLY 160 HA2 GLY 160 -8.441 -13.376 -11.776 1155 HA3 GLY 160 HA3 GLY 160 -9.969 -14.141 -12.199 1156 H TRP 161 H TRP 161 -7.889 -15.089 -9.472 1157 HA TRP 161 HA TRP 161 -10.214 -15.136 -7.733 1158 HB2 TRP 161 HB2 TRP 161 -8.986 -16.729 -6.496 1159 HB3 TRP 161 HB3 TRP 161 -8.988 -17.119 -8.204 1160 HD1 TRP 161 HD1 TRP 161 -6.271 -14.943 -8.517 1161 HE1 TRP 161 HE1 TRP 161 -4.016 -16.075 -8.182 1162 HE3 TRP 161 HE3 TRP 161 -7.806 -18.967 -5.743 1163 HZ2 TRP 161 HZ2 TRP 161 -2.985 -18.415 -6.872 1164 HZ3 TRP 161 HZ3 TRP 161 -6.137 -20.623 -4.920 1165 HH2 TRP 161 HH2 TRP 161 -3.730 -20.364 -5.483 1166 H ARG 162 H ARG 162 -7.332 -15.019 -6.188 1167 HA ARG 162 HA ARG 162 -8.250 -13.120 -4.275 1168 HB2 ARG 162 HB2 ARG 162 -5.485 -14.341 -4.619 1169 HB3 ARG 162 HB3 ARG 162 -6.055 -13.504 -3.165 1170 HG2 ARG 162 HG2 ARG 162 -7.306 -16.046 -4.320 1171 HG3 ARG 162 HG3 ARG 162 -6.065 -16.018 -3.063 1172 HD2 ARG 162 HD2 ARG 162 -7.544 -14.644 -1.615 1173 HD3 ARG 162 HD3 ARG 162 -8.834 -14.763 -2.833 1174 HE ARG 162 HE ARG 162 -8.149 -17.394 -2.340 1175 HH11 ARG 162 HH11 ARG 162 -9.103 -18.735 -0.846 1176 HH12 ARG 162 HH12 ARG 162 -9.886 -18.065 0.553 1177 HH21 ARG 162 HH21 ARG 162 -9.216 -14.793 -0.239 1178 HH22 ARG 162 HH22 ARG 162 -9.952 -15.895 0.893 1179 H ARG 163 H ARG 163 -7.949 -11.047 -3.978 1180 HA ARG 163 HA ARG 163 -6.486 -9.413 -5.982 1181 HB2 ARG 163 HB2 ARG 163 -8.529 -8.382 -6.677 1182 HB3 ARG 163 HB3 ARG 163 -8.743 -10.123 -6.769 1183 HG2 ARG 163 HG2 ARG 163 -9.677 -9.629 -4.206 1184 HG3 ARG 163 HG3 ARG 163 -10.069 -8.105 -4.996 1185 HD2 ARG 163 HD2 ARG 163 -10.950 -10.906 -5.791 1186 HD3 ARG 163 HD3 ARG 163 -11.947 -9.655 -5.073 1187 HE ARG 163 HE ARG 163 -11.877 -8.374 -7.114 1188 HH11 ARG 163 HH11 ARG 163 -12.137 -8.406 -9.325 1189 HH12 ARG 163 HH12 ARG 163 -11.589 -9.787 -10.234 1190 HH21 ARG 163 HH21 ARG 163 -10.506 -11.592 -7.555 1191 HH22 ARG 163 HH22 ARG 163 -10.816 -11.579 -9.258 Start of MODEL 10 1 H1 GLY -4 H1 GLY -4 8.071 23.664 6.240 2 H2 GLY -4 H2 GLY -4 7.876 22.053 6.469 3 H3 GLY -4 H3 GLY -4 8.874 22.907 7.450 4 HA2 GLY -4 HA2 GLY -4 5.949 23.242 7.287 5 HA3 GLY -4 HA3 GLY -4 6.810 22.401 8.590 6 H SER -3 H SER -3 5.052 24.725 8.801 7 HA SER -3 HA SER -3 6.517 27.145 9.141 8 HB2 SER -3 HB2 SER -3 3.913 26.282 10.458 9 HB3 SER -3 HB3 SER -3 4.499 27.945 10.302 10 HG SER -3 HG SER -3 4.317 27.764 8.046 11 HA PRO -2 HA PRO -2 8.322 26.594 13.219 12 HB2 PRO -2 HB2 PRO -2 8.540 29.169 14.112 13 HB3 PRO -2 HB3 PRO -2 9.551 28.508 12.789 14 HG2 PRO -2 HG2 PRO -2 6.994 30.132 12.540 15 HG3 PRO -2 HG3 PRO -2 8.561 30.405 11.711 16 HD2 PRO -2 HD2 PRO -2 6.526 29.072 10.507 17 HD3 PRO -2 HD3 PRO -2 8.225 28.564 10.266 18 H ASN -1 H ASN -1 7.788 26.657 15.441 19 HA ASN -1 HA ASN -1 6.377 26.196 17.140 20 HB2 ASN -1 HB2 ASN -1 6.717 28.690 17.221 21 HB3 ASN -1 HB3 ASN -1 5.150 28.882 16.436 22 HD21 ASN -1 HD21 ASN -1 4.157 29.268 19.862 23 HD22 ASN -1 HD22 ASN -1 4.654 30.151 18.424 24 H SER 0 H SER 0 5.602 24.697 15.084 25 HA SER 0 HA SER 0 2.866 24.922 14.284 26 HB2 SER 0 HB2 SER 0 4.661 23.653 13.087 27 HB3 SER 0 HB3 SER 0 4.567 22.407 14.348 28 HG SER 0 HG SER 0 3.238 21.953 12.502 29 H MET 1 H MET 1 1.113 23.470 14.747 30 HA MET 1 HA MET 1 0.657 23.285 17.631 31 HB2 MET 1 HB2 MET 1 -1.201 22.859 15.264 32 HB3 MET 1 HB3 MET 1 -1.683 22.811 16.967 33 HG2 MET 1 HG2 MET 1 -0.894 25.144 17.264 34 HG3 MET 1 HG3 MET 1 -0.440 25.203 15.562 35 HE1 MET 1 HE1 MET 1 -4.783 25.173 17.196 36 HE2 MET 1 HE2 MET 1 -3.764 23.728 17.335 37 HE3 MET 1 HE3 MET 1 -3.311 25.223 18.189 38 H ALA 2 H ALA 2 2.462 21.529 17.555 39 HA ALA 2 HA ALA 2 1.811 18.820 16.928 40 HB1 ALA 2 HB1 ALA 2 3.671 19.970 19.057 41 HB2 ALA 2 HB2 ALA 2 3.716 18.315 18.413 42 HB3 ALA 2 HB3 ALA 2 4.091 19.684 17.350 43 H THR 3 H THR 3 0.501 20.812 19.383 44 HA THR 3 HA THR 3 -0.263 18.747 21.298 45 HB THR 3 HB THR 3 -1.517 20.645 22.341 46 HG1 THR 3 HG1 THR 3 -1.261 22.685 21.413 47 HG21 THR 3 HG21 THR 3 0.901 20.253 22.844 48 HG22 THR 3 HG22 THR 3 1.329 21.393 21.549 49 HG23 THR 3 HG23 THR 3 0.432 21.960 22.977 50 H GLU 4 H GLU 4 -1.467 19.603 18.298 51 HA GLU 4 HA GLU 4 -4.280 19.500 18.623 52 HB2 GLU 4 HB2 GLU 4 -3.144 20.259 16.572 53 HB3 GLU 4 HB3 GLU 4 -2.565 18.620 16.268 54 HG2 GLU 4 HG2 GLU 4 -4.420 19.118 14.812 55 HG3 GLU 4 HG3 GLU 4 -4.896 17.843 15.913 56 H LEU 5 H LEU 5 -5.798 17.920 18.356 57 HA LEU 5 HA LEU 5 -5.165 15.266 19.352 58 HB2 LEU 5 HB2 LEU 5 -7.278 17.032 19.650 59 HB3 LEU 5 HB3 LEU 5 -7.969 15.867 18.539 60 HG LEU 5 HG LEU 5 -6.646 15.278 21.215 61 HD11 LEU 5 HD11 LEU 5 -9.586 15.211 20.413 62 HD12 LEU 5 HD12 LEU 5 -8.928 14.773 22.007 63 HD13 LEU 5 HD13 LEU 5 -8.808 16.443 21.432 64 HD21 LEU 5 HD21 LEU 5 -8.165 13.382 19.367 65 HD22 LEU 5 HD22 LEU 5 -6.432 13.307 19.747 66 HD23 LEU 5 HD23 LEU 5 -7.620 12.995 21.015 67 H GLU 6 H GLU 6 -3.974 15.711 16.868 68 HA GLU 6 HA GLU 6 -5.414 14.367 14.723 69 HB2 GLU 6 HB2 GLU 6 -2.651 15.445 15.183 70 HB3 GLU 6 HB3 GLU 6 -2.826 14.190 13.956 71 HG2 GLU 6 HG2 GLU 6 -4.526 16.711 13.966 72 HG3 GLU 6 HG3 GLU 6 -2.972 16.593 13.143 73 H TYR 7 H TYR 7 -5.373 12.117 14.227 74 HA TYR 7 HA TYR 7 -3.561 10.313 15.579 75 HB2 TYR 7 HB2 TYR 7 -5.064 9.131 16.910 76 HB3 TYR 7 HB3 TYR 7 -5.393 10.807 17.302 77 HD1 TYR 7 HD1 TYR 7 -6.777 7.665 16.178 78 HD2 TYR 7 HD2 TYR 7 -7.469 11.926 16.225 79 HE1 TYR 7 HE1 TYR 7 -9.170 7.273 15.686 80 HE2 TYR 7 HE2 TYR 7 -9.882 11.530 15.741 81 HH TYR 7 HH TYR 7 -11.235 8.228 15.368 82 H GLU 8 H GLU 8 -4.282 8.021 15.298 83 HA GLU 8 HA GLU 8 -6.013 7.254 13.161 84 HB2 GLU 8 HB2 GLU 8 -4.376 6.248 11.694 85 HB3 GLU 8 HB3 GLU 8 -4.183 7.973 11.696 86 HG2 GLU 8 HG2 GLU 8 -2.416 6.138 13.354 87 HG3 GLU 8 HG3 GLU 8 -2.066 6.580 11.697 88 H SER 9 H SER 9 -6.755 5.308 13.658 89 HA SER 9 HA SER 9 -5.540 3.800 15.883 90 HB2 SER 9 HB2 SER 9 -8.263 3.740 14.564 91 HB3 SER 9 HB3 SER 9 -7.766 2.614 15.846 92 HG SER 9 HG SER 9 -8.859 4.440 16.704 93 H VAL 10 H VAL 10 -4.696 1.698 15.651 94 HA VAL 10 HA VAL 10 -4.035 0.860 12.998 95 HB VAL 10 HB VAL 10 -2.579 0.433 14.870 96 HG11 VAL 10 HG11 VAL 10 -4.221 -0.229 16.613 97 HG12 VAL 10 HG12 VAL 10 -4.510 -1.754 15.749 98 HG13 VAL 10 HG13 VAL 10 -2.911 -1.404 16.430 99 HG21 VAL 10 HG21 VAL 10 -2.409 -0.905 12.776 100 HG22 VAL 10 HG22 VAL 10 -1.816 -1.761 14.211 101 HG23 VAL 10 HG23 VAL 10 -3.399 -2.175 13.531 102 H LEU 11 H LEU 11 -4.803 -0.509 11.589 103 HA LEU 11 HA LEU 11 -7.323 -2.017 12.197 104 HB2 LEU 11 HB2 LEU 11 -6.275 -0.964 9.543 105 HB3 LEU 11 HB3 LEU 11 -7.740 -1.907 9.785 106 HG LEU 11 HG LEU 11 -7.238 0.946 10.722 107 HD11 LEU 11 HD11 LEU 11 -9.017 -0.368 8.629 108 HD12 LEU 11 HD12 LEU 11 -9.186 1.314 9.125 109 HD13 LEU 11 HD13 LEU 11 -7.684 0.773 8.353 110 HD21 LEU 11 HD21 LEU 11 -8.628 -0.136 12.417 111 HD22 LEU 11 HD22 LEU 11 -9.629 0.925 11.428 112 HD23 LEU 11 HD23 LEU 11 -9.679 -0.832 11.155 113 H CYS 12 H CYS 12 -4.237 -2.144 10.359 114 HA CYS 12 HA CYS 12 -4.064 -5.034 10.844 115 HB2 CYS 12 HB2 CYS 12 -5.296 -4.870 8.742 116 HB3 CYS 12 HB3 CYS 12 -4.009 -3.875 8.039 117 HG CYS 12 HG CYS 12 -3.979 -6.346 7.075 118 H VAL 13 H VAL 13 -2.028 -5.773 11.049 119 HA VAL 13 HA VAL 13 0.243 -4.044 10.280 120 HB VAL 13 HB VAL 13 -0.174 -3.599 12.627 121 HG11 VAL 13 HG11 VAL 13 -1.212 -5.740 13.334 122 HG12 VAL 13 HG12 VAL 13 0.377 -6.532 13.219 123 HG13 VAL 13 HG13 VAL 13 0.108 -5.230 14.390 124 HG21 VAL 13 HG21 VAL 13 2.134 -3.501 11.861 125 HG22 VAL 13 HG22 VAL 13 2.051 -4.078 13.525 126 HG23 VAL 13 HG23 VAL 13 2.359 -5.232 12.212 127 H LYS 14 H LYS 14 1.753 -5.109 9.188 128 HA LYS 14 HA LYS 14 1.847 -8.067 9.438 129 HB2 LYS 14 HB2 LYS 14 1.848 -6.538 6.825 130 HB3 LYS 14 HB3 LYS 14 2.533 -8.139 6.941 131 HG2 LYS 14 HG2 LYS 14 -0.333 -7.461 7.717 132 HG3 LYS 14 HG3 LYS 14 0.183 -8.071 6.143 133 HD2 LYS 14 HD2 LYS 14 1.112 -10.119 7.252 134 HD3 LYS 14 HD3 LYS 14 0.438 -9.562 8.806 135 HE2 LYS 14 HE2 LYS 14 -1.802 -9.547 7.903 136 HE3 LYS 14 HE3 LYS 14 -1.181 -9.890 6.278 137 HZ1 LYS 14 HZ1 LYS 14 -0.423 -12.052 7.083 138 HZ2 LYS 14 HZ2 LYS 14 -1.090 -11.774 8.564 139 HZ3 LYS 14 HZ3 LYS 14 -2.051 -11.887 7.229 140 HA PRO 15 HA PRO 15 5.867 -7.656 10.690 141 HB2 PRO 15 HB2 PRO 15 6.873 -10.184 10.327 142 HB3 PRO 15 HB3 PRO 15 5.550 -9.810 11.472 143 HG2 PRO 15 HG2 PRO 15 5.276 -10.847 8.614 144 HG3 PRO 15 HG3 PRO 15 4.512 -11.502 10.102 145 HD2 PRO 15 HD2 PRO 15 3.191 -9.828 8.492 146 HD3 PRO 15 HD3 PRO 15 3.053 -9.684 10.271 147 H ASP 16 H ASP 16 5.557 -8.688 7.321 148 HA ASP 16 HA ASP 16 8.131 -7.394 6.658 149 HB2 ASP 16 HB2 ASP 16 8.594 -9.811 7.088 150 HB3 ASP 16 HB3 ASP 16 7.460 -10.230 5.804 151 H VAL 17 H VAL 17 7.964 -6.189 4.869 152 HA VAL 17 HA VAL 17 6.171 -6.869 2.655 153 HB VAL 17 HB VAL 17 4.683 -5.608 4.163 154 HG11 VAL 17 HG11 VAL 17 6.603 -3.274 3.853 155 HG12 VAL 17 HG12 VAL 17 5.002 -3.216 4.595 156 HG13 VAL 17 HG13 VAL 17 6.284 -4.183 5.341 157 HG21 VAL 17 HG21 VAL 17 4.418 -5.440 1.700 158 HG22 VAL 17 HG22 VAL 17 3.839 -4.017 2.575 159 HG23 VAL 17 HG23 VAL 17 5.390 -3.947 1.724 160 H SER 18 H SER 18 6.898 -6.042 0.715 161 HA SER 18 HA SER 18 9.423 -4.441 0.781 162 HB2 SER 18 HB2 SER 18 8.648 -6.619 -1.178 163 HB3 SER 18 HB3 SER 18 10.186 -5.743 -1.077 164 HG SER 18 HG SER 18 10.181 -7.859 -0.075 165 H VAL 19 H VAL 19 9.750 -2.848 -0.713 166 HA VAL 19 HA VAL 19 7.414 -2.019 -2.401 167 HB VAL 19 HB VAL 19 9.163 -0.309 -0.627 168 HG11 VAL 19 HG11 VAL 19 7.106 0.492 -2.711 169 HG12 VAL 19 HG12 VAL 19 7.762 1.587 -1.477 170 HG13 VAL 19 HG13 VAL 19 8.836 0.931 -2.701 171 HG21 VAL 19 HG21 VAL 19 6.160 -0.861 -0.740 172 HG22 VAL 19 HG22 VAL 19 7.272 -1.454 0.507 173 HG23 VAL 19 HG23 VAL 19 6.951 0.273 0.362 174 H TYR 20 H TYR 20 7.753 -1.419 -4.371 175 HA TYR 20 HA TYR 20 10.464 -2.009 -5.479 176 HB2 TYR 20 HB2 TYR 20 7.656 -2.574 -6.477 177 HB3 TYR 20 HB3 TYR 20 9.124 -2.916 -7.370 178 HD1 TYR 20 HD1 TYR 20 10.365 -4.893 -7.032 179 HD2 TYR 20 HD2 TYR 20 7.309 -3.786 -4.205 180 HE1 TYR 20 HE1 TYR 20 10.590 -7.111 -5.909 181 HE2 TYR 20 HE2 TYR 20 7.594 -5.981 -3.058 182 HH TYR 20 HH TYR 20 9.889 -8.462 -4.192 183 H ARG 21 H ARG 21 8.831 0.719 -5.179 184 HA ARG 21 HA ARG 21 8.461 2.706 -6.360 185 HB2 ARG 21 HB2 ARG 21 11.446 2.240 -6.652 186 HB3 ARG 21 HB3 ARG 21 10.619 3.789 -6.828 187 HG2 ARG 21 HG2 ARG 21 9.726 3.447 -4.443 188 HG3 ARG 21 HG3 ARG 21 10.894 2.128 -4.296 189 HD2 ARG 21 HD2 ARG 21 11.495 5.058 -4.908 190 HD3 ARG 21 HD3 ARG 21 11.771 4.230 -3.367 191 HE ARG 21 HE ARG 21 13.193 2.831 -5.423 192 HH11 ARG 21 HH11 ARG 21 15.264 2.862 -5.584 193 HH12 ARG 21 HH12 ARG 21 16.231 4.238 -5.050 194 HH21 ARG 21 HH21 ARG 21 13.479 5.924 -3.786 195 HH22 ARG 21 HH22 ARG 21 15.209 5.948 -4.008 196 H ILE 22 H ILE 22 7.214 2.704 -8.066 197 HA ILE 22 HA ILE 22 8.131 1.463 -10.560 198 HB ILE 22 HB ILE 22 5.810 1.276 -11.149 199 HG12 ILE 22 HG12 ILE 22 5.267 2.987 -8.686 200 HG13 ILE 22 HG13 ILE 22 4.858 3.330 -10.369 201 HG21 ILE 22 HG21 ILE 22 6.275 0.444 -8.262 202 HG22 ILE 22 HG22 ILE 22 5.138 -0.268 -9.416 203 HG23 ILE 22 HG23 ILE 22 6.878 -0.397 -9.699 204 HD11 ILE 22 HD11 ILE 22 3.589 1.268 -8.557 205 HD12 ILE 22 HD12 ILE 22 2.863 2.716 -9.273 206 HD13 ILE 22 HD13 ILE 22 3.303 1.342 -10.315 207 HA PRO 23 HA PRO 23 8.230 5.338 -12.743 208 HB2 PRO 23 HB2 PRO 23 8.220 4.421 -15.379 209 HB3 PRO 23 HB3 PRO 23 9.626 4.602 -14.298 210 HG2 PRO 23 HG2 PRO 23 8.170 2.111 -15.061 211 HG3 PRO 23 HG3 PRO 23 9.869 2.326 -14.582 212 HD2 PRO 23 HD2 PRO 23 7.815 1.346 -12.927 213 HD3 PRO 23 HD3 PRO 23 9.385 1.989 -12.371 214 HA PRO 24 HA PRO 24 4.218 5.435 -15.224 215 HB2 PRO 24 HB2 PRO 24 2.391 3.438 -15.342 216 HB3 PRO 24 HB3 PRO 24 3.922 3.372 -16.267 217 HG2 PRO 24 HG2 PRO 24 3.344 2.126 -13.550 218 HG3 PRO 24 HG3 PRO 24 4.005 1.322 -15.012 219 HD2 PRO 24 HD2 PRO 24 5.614 2.285 -13.048 220 HD3 PRO 24 HD3 PRO 24 6.082 2.390 -14.770 221 H ARG 25 H ARG 25 2.053 6.096 -14.877 222 HA ARG 25 HA ARG 25 0.808 5.679 -12.174 223 HB2 ARG 25 HB2 ARG 25 -0.176 7.866 -12.268 224 HB3 ARG 25 HB3 ARG 25 1.576 8.014 -12.404 225 HG2 ARG 25 HG2 ARG 25 1.421 8.410 -14.812 226 HG3 ARG 25 HG3 ARG 25 -0.322 8.074 -14.805 227 HD2 ARG 25 HD2 ARG 25 -0.750 9.998 -13.390 228 HD3 ARG 25 HD3 ARG 25 0.993 10.342 -13.269 229 HE ARG 25 HE ARG 25 0.275 10.269 -16.025 230 HH11 ARG 25 HH11 ARG 25 0.015 12.111 -17.239 231 HH12 ARG 25 HH12 ARG 25 -0.313 13.630 -16.457 232 HH21 ARG 25 HH21 ARG 25 -0.283 12.361 -13.270 233 HH22 ARG 25 HH22 ARG 25 -0.477 13.776 -14.269 234 H ALA 26 H ALA 26 0.325 5.522 -15.581 235 HA ALA 26 HA ALA 26 -2.199 4.098 -15.248 236 HB1 ALA 26 HB1 ALA 26 -2.905 6.460 -14.969 237 HB2 ALA 26 HB2 ALA 26 -2.135 6.884 -16.505 238 HB3 ALA 26 HB3 ALA 26 -3.531 5.767 -16.487 239 H SER 27 H SER 27 -1.717 2.488 -16.399 240 HA SER 27 HA SER 27 -1.129 2.883 -19.300 241 HB2 SER 27 HB2 SER 27 0.129 0.887 -19.407 242 HB3 SER 27 HB3 SER 27 0.786 1.841 -18.074 243 HG SER 27 HG SER 27 -0.630 0.522 -16.688 244 H ASN 28 H ASN 28 -1.915 1.076 -20.588 245 HA ASN 28 HA ASN 28 -4.588 1.260 -20.748 246 HB2 ASN 28 HB2 ASN 28 -4.496 -0.208 -22.593 247 HB3 ASN 28 HB3 ASN 28 -2.910 0.542 -22.519 248 HD21 ASN 28 HD21 ASN 28 -1.370 -2.623 -21.427 249 HD22 ASN 28 HD22 ASN 28 -1.351 -0.956 -20.900 250 H ARG 29 H ARG 29 -3.139 -1.288 -18.799 251 HA ARG 29 HA ARG 29 -5.866 -2.417 -18.233 252 HB2 ARG 29 HB2 ARG 29 -3.156 -3.724 -18.158 253 HB3 ARG 29 HB3 ARG 29 -4.582 -4.442 -17.393 254 HG2 ARG 29 HG2 ARG 29 -5.507 -5.083 -19.344 255 HG3 ARG 29 HG3 ARG 29 -5.245 -3.498 -20.074 256 HD2 ARG 29 HD2 ARG 29 -4.031 -5.020 -21.378 257 HD3 ARG 29 HD3 ARG 29 -2.889 -4.040 -20.433 258 HE ARG 29 HE ARG 29 -3.398 -6.414 -18.962 259 HH11 ARG 29 HH11 ARG 29 -2.002 -8.154 -18.923 260 HH12 ARG 29 HH12 ARG 29 -0.896 -8.407 -20.238 261 HH21 ARG 29 HH21 ARG 29 -1.908 -5.672 -22.040 262 HH22 ARG 29 HH22 ARG 29 -0.829 -7.039 -21.958 263 H GLY 30 H GLY 30 -3.926 -0.256 -16.993 264 HA2 GLY 30 HA2 GLY 30 -4.489 0.648 -14.702 265 HA3 GLY 30 HA3 GLY 30 -4.278 -1.014 -14.107 266 H TYR 31 H TYR 31 -2.315 -1.604 -13.437 267 HA TYR 31 HA TYR 31 0.053 0.138 -14.109 268 HB2 TYR 31 HB2 TYR 31 -0.779 -1.220 -11.541 269 HB3 TYR 31 HB3 TYR 31 0.883 -0.753 -11.853 270 HD1 TYR 31 HD1 TYR 31 1.617 1.512 -11.956 271 HD2 TYR 31 HD2 TYR 31 -2.518 0.514 -11.255 272 HE1 TYR 31 HE1 TYR 31 1.240 3.775 -10.983 273 HE2 TYR 31 HE2 TYR 31 -2.931 2.813 -10.372 274 HH TYR 31 HH TYR 31 -1.972 4.822 -9.783 275 H ARG 32 H ARG 32 -1.031 -3.184 -13.664 276 HA ARG 32 HA ARG 32 -0.057 -5.178 -13.630 277 HB2 ARG 32 HB2 ARG 32 1.386 -4.861 -16.155 278 HB3 ARG 32 HB3 ARG 32 0.106 -5.941 -15.638 279 HG2 ARG 32 HG2 ARG 32 -0.981 -4.884 -17.331 280 HG3 ARG 32 HG3 ARG 32 -1.454 -3.822 -16.016 281 HD2 ARG 32 HD2 ARG 32 -0.823 -2.359 -17.708 282 HD3 ARG 32 HD3 ARG 32 0.589 -2.396 -16.627 283 HE ARG 32 HE ARG 32 0.788 -4.344 -18.776 284 HH11 ARG 32 HH11 ARG 32 2.633 -4.128 -20.049 285 HH12 ARG 32 HH12 ARG 32 3.558 -2.654 -19.901 286 HH21 ARG 32 HH21 ARG 32 1.235 -0.936 -18.108 287 HH22 ARG 32 HH22 ARG 32 2.710 -0.862 -19.064 288 H ALA 33 H ALA 33 1.329 -5.704 -12.065 289 HA ALA 33 HA ALA 33 3.810 -4.630 -11.489 290 HB1 ALA 33 HB1 ALA 33 2.984 -7.543 -11.131 291 HB2 ALA 33 HB2 ALA 33 4.218 -6.660 -10.208 292 HB3 ALA 33 HB3 ALA 33 2.526 -6.206 -10.057 293 H SER 34 H SER 34 3.139 -7.059 -13.942 294 HA SER 34 HA SER 34 5.786 -7.937 -14.517 295 HB2 SER 34 HB2 SER 34 3.505 -8.923 -15.159 296 HB3 SER 34 HB3 SER 34 3.473 -7.736 -16.475 297 HG SER 34 HG SER 34 4.373 -9.779 -17.106 298 H ASP 35 H ASP 35 4.213 -4.873 -15.355 299 HA ASP 35 HA ASP 35 5.967 -4.199 -17.574 300 HB2 ASP 35 HB2 ASP 35 3.655 -3.301 -17.121 301 HB3 ASP 35 HB3 ASP 35 4.314 -2.408 -15.759 302 H TRP 36 H TRP 36 6.388 -4.134 -14.085 303 HA TRP 36 HA TRP 36 8.832 -2.467 -14.355 304 HB2 TRP 36 HB2 TRP 36 8.077 -1.519 -12.014 305 HB3 TRP 36 HB3 TRP 36 7.618 -0.831 -13.541 306 HD1 TRP 36 HD1 TRP 36 5.213 -0.703 -14.208 307 HE1 TRP 36 HE1 TRP 36 2.963 -1.192 -13.091 308 HE3 TRP 36 HE3 TRP 36 6.889 -3.253 -10.107 309 HZ2 TRP 36 HZ2 TRP 36 2.099 -1.959 -10.405 310 HZ3 TRP 36 HZ3 TRP 36 5.332 -3.836 -8.264 311 HH2 TRP 36 HH2 TRP 36 2.941 -3.166 -8.384 312 H LYS 37 H LYS 37 9.614 -2.568 -11.686 313 HA LYS 37 HA LYS 37 10.809 -5.213 -11.548 314 HB2 LYS 37 HB2 LYS 37 10.815 -3.038 -9.406 315 HB3 LYS 37 HB3 LYS 37 11.921 -4.408 -9.582 316 HG2 LYS 37 HG2 LYS 37 12.465 -3.347 -11.934 317 HG3 LYS 37 HG3 LYS 37 11.709 -1.895 -11.272 318 HD2 LYS 37 HD2 LYS 37 14.198 -3.338 -10.346 319 HD3 LYS 37 HD3 LYS 37 14.071 -1.684 -10.935 320 HE2 LYS 37 HE2 LYS 37 12.936 -2.757 -8.324 321 HE3 LYS 37 HE3 LYS 37 14.460 -1.898 -8.471 322 HZ1 LYS 37 HZ1 LYS 37 12.774 -0.406 -7.743 323 HZ2 LYS 37 HZ2 LYS 37 13.145 0.051 -9.277 324 HZ3 LYS 37 HZ3 LYS 37 11.746 -0.764 -8.929 325 H LEU 38 H LEU 38 9.341 -6.882 -11.166 326 HA LEU 38 HA LEU 38 7.744 -6.649 -8.665 327 HB2 LEU 38 HB2 LEU 38 6.351 -8.373 -9.332 328 HB3 LEU 38 HB3 LEU 38 6.460 -7.152 -10.575 329 HG LEU 38 HG LEU 38 7.868 -8.652 -11.951 330 HD11 LEU 38 HD11 LEU 38 7.845 -11.105 -11.430 331 HD12 LEU 38 HD12 LEU 38 8.929 -10.173 -10.408 332 HD13 LEU 38 HD13 LEU 38 7.357 -10.715 -9.775 333 HD21 LEU 38 HD21 LEU 38 5.252 -9.899 -10.952 334 HD22 LEU 38 HD22 LEU 38 5.366 -8.584 -12.126 335 HD23 LEU 38 HD23 LEU 38 6.017 -10.169 -12.546 336 H ASP 39 H ASP 39 10.724 -7.760 -9.535 337 HA ASP 39 HA ASP 39 10.777 -9.939 -7.500 338 HB2 ASP 39 HB2 ASP 39 11.129 -10.641 -9.837 339 HB3 ASP 39 HB3 ASP 39 12.464 -9.501 -9.991 340 H GLN 40 H GLN 40 12.157 -6.842 -8.369 341 HA GLN 40 HA GLN 40 14.354 -7.126 -6.366 342 HB2 GLN 40 HB2 GLN 40 14.214 -5.362 -8.836 343 HB3 GLN 40 HB3 GLN 40 15.524 -5.394 -7.647 344 HG2 GLN 40 HG2 GLN 40 15.885 -7.822 -8.197 345 HG3 GLN 40 HG3 GLN 40 14.673 -7.664 -9.481 346 HE21 GLN 40 HE21 GLN 40 16.856 -5.818 -11.662 347 HE22 GLN 40 HE22 GLN 40 15.172 -6.194 -11.327 348 HA PRO 41 HA PRO 41 11.801 -3.757 -4.585 349 HB2 PRO 41 HB2 PRO 41 12.236 -4.167 -1.947 350 HB3 PRO 41 HB3 PRO 41 11.133 -5.184 -2.926 351 HG2 PRO 41 HG2 PRO 41 14.017 -5.762 -2.170 352 HG3 PRO 41 HG3 PRO 41 12.599 -6.848 -2.017 353 HD2 PRO 41 HD2 PRO 41 14.329 -6.928 -4.155 354 HD3 PRO 41 HD3 PRO 41 12.589 -7.309 -4.320 355 H ASP 42 H ASP 42 12.314 -1.812 -3.570 356 HA ASP 42 HA ASP 42 15.174 -0.949 -3.589 357 HB2 ASP 42 HB2 ASP 42 12.526 0.569 -3.513 358 HB3 ASP 42 HB3 ASP 42 14.115 1.322 -3.456 359 H TRP 43 H TRP 43 12.375 -1.403 -1.526 360 HA TRP 43 HA TRP 43 13.990 -0.973 0.904 361 HB2 TRP 43 HB2 TRP 43 12.957 1.205 0.511 362 HB3 TRP 43 HB3 TRP 43 11.394 0.462 0.213 363 HD1 TRP 43 HD1 TRP 43 13.632 1.657 2.997 364 HE1 TRP 43 HE1 TRP 43 12.367 1.605 5.231 365 HE3 TRP 43 HE3 TRP 43 9.460 -0.928 1.525 366 HZ2 TRP 43 HZ2 TRP 43 9.840 0.652 6.224 367 HZ3 TRP 43 HZ3 TRP 43 7.640 -1.407 3.142 368 HH2 TRP 43 HH2 TRP 43 7.811 -0.612 5.493 369 H THR 44 H THR 44 13.283 -2.275 2.657 370 HA THR 44 HA THR 44 10.614 -3.452 2.520 371 HB THR 44 HB THR 44 11.157 -5.617 2.942 372 HG1 THR 44 HG1 THR 44 13.882 -4.994 3.348 373 HG21 THR 44 HG21 THR 44 12.633 -6.523 1.291 374 HG22 THR 44 HG22 THR 44 11.773 -5.144 0.594 375 HG23 THR 44 HG23 THR 44 13.469 -4.963 1.088 376 H GLY 45 H GLY 45 9.722 -4.034 4.446 377 HA2 GLY 45 HA2 GLY 45 10.935 -3.460 7.016 378 HA3 GLY 45 HA3 GLY 45 10.022 -2.092 6.409 379 H ARG 46 H ARG 46 8.362 -2.066 7.621 380 HA ARG 46 HA ARG 46 6.644 -4.464 8.171 381 HB2 ARG 46 HB2 ARG 46 7.935 -3.576 10.110 382 HB3 ARG 46 HB3 ARG 46 7.247 -1.984 9.834 383 HG2 ARG 46 HG2 ARG 46 4.935 -3.048 10.309 384 HG3 ARG 46 HG3 ARG 46 5.844 -4.478 10.842 385 HD2 ARG 46 HD2 ARG 46 7.162 -2.847 12.356 386 HD3 ARG 46 HD3 ARG 46 5.945 -1.637 11.941 387 HE ARG 46 HE ARG 46 5.222 -4.268 13.190 388 HH11 ARG 46 HH11 ARG 46 4.294 -4.262 15.185 389 HH12 ARG 46 HH12 ARG 46 3.801 -2.766 15.916 390 HH21 ARG 46 HH21 ARG 46 4.815 -0.743 13.340 391 HH22 ARG 46 HH22 ARG 46 4.209 -0.850 14.970 392 H LEU 47 H LEU 47 4.448 -4.228 7.908 393 HA LEU 47 HA LEU 47 3.396 -1.689 6.699 394 HB2 LEU 47 HB2 LEU 47 2.935 -3.846 5.483 395 HB3 LEU 47 HB3 LEU 47 2.228 -4.464 6.965 396 HG LEU 47 HG LEU 47 0.556 -2.447 6.788 397 HD11 LEU 47 HD11 LEU 47 0.118 -1.708 4.508 398 HD12 LEU 47 HD12 LEU 47 1.735 -1.224 5.022 399 HD13 LEU 47 HD13 LEU 47 1.536 -2.605 3.916 400 HD21 LEU 47 HD21 LEU 47 -0.086 -4.782 6.553 401 HD22 LEU 47 HD22 LEU 47 -0.917 -3.798 5.350 402 HD23 LEU 47 HD23 LEU 47 0.472 -4.794 4.871 403 H ARG 48 H ARG 48 2.171 -0.356 7.997 404 HA ARG 48 HA ARG 48 0.387 -1.696 9.928 405 HB2 ARG 48 HB2 ARG 48 2.352 -0.855 11.202 406 HB3 ARG 48 HB3 ARG 48 1.903 0.799 10.754 407 HG2 ARG 48 HG2 ARG 48 -0.174 0.645 11.978 408 HG3 ARG 48 HG3 ARG 48 -0.074 -1.121 12.067 409 HD2 ARG 48 HD2 ARG 48 0.459 -0.185 14.237 410 HD3 ARG 48 HD3 ARG 48 1.853 -1.005 13.548 411 HE ARG 48 HE ARG 48 2.923 1.094 13.087 412 HH11 ARG 48 HH11 ARG 48 3.362 3.149 13.578 413 HH12 ARG 48 HH12 ARG 48 2.322 4.080 14.648 414 HH21 ARG 48 HH21 ARG 48 -0.007 1.572 14.989 415 HH22 ARG 48 HH22 ARG 48 0.436 3.207 15.396 416 H ILE 49 H ILE 49 -1.361 -1.484 8.803 417 HA ILE 49 HA ILE 49 -2.242 1.026 7.527 418 HB ILE 49 HB ILE 49 -3.631 -1.654 7.900 419 HG12 ILE 49 HG12 ILE 49 -2.259 -0.370 5.491 420 HG13 ILE 49 HG13 ILE 49 -1.710 -1.789 6.386 421 HG21 ILE 49 HG21 ILE 49 -4.487 0.737 6.211 422 HG22 ILE 49 HG22 ILE 49 -5.320 -0.827 6.339 423 HG23 ILE 49 HG23 ILE 49 -5.266 0.210 7.737 424 HD11 ILE 49 HD11 ILE 49 -4.165 -1.597 4.614 425 HD12 ILE 49 HD12 ILE 49 -2.709 -2.563 4.382 426 HD13 ILE 49 HD13 ILE 49 -3.809 -2.983 5.699 427 H THR 50 H THR 50 -3.518 2.465 8.438 428 HA THR 50 HA THR 50 -4.767 1.944 11.095 429 HB THR 50 HB THR 50 -4.002 4.132 11.869 430 HG1 THR 50 HG1 THR 50 -2.511 4.141 9.451 431 HG21 THR 50 HG21 THR 50 -1.629 3.766 12.185 432 HG22 THR 50 HG22 THR 50 -2.490 2.238 12.393 433 HG23 THR 50 HG23 THR 50 -1.590 2.552 10.895 434 H SER 51 H SER 51 -6.332 3.812 11.666 435 HA SER 51 HA SER 51 -7.400 5.351 9.411 436 HB2 SER 51 HB2 SER 51 -8.724 3.470 9.002 437 HB3 SER 51 HB3 SER 51 -8.905 3.100 10.735 438 HG SER 51 HG SER 51 -10.796 3.963 9.911 439 H LYS 52 H LYS 52 -8.047 7.238 10.043 440 HA LYS 52 HA LYS 52 -8.613 7.898 12.895 441 HB2 LYS 52 HB2 LYS 52 -6.926 9.132 11.563 442 HB3 LYS 52 HB3 LYS 52 -8.236 9.696 10.495 443 HG2 LYS 52 HG2 LYS 52 -9.215 10.694 12.737 444 HG3 LYS 52 HG3 LYS 52 -7.601 10.417 13.358 445 HD2 LYS 52 HD2 LYS 52 -8.468 12.104 10.997 446 HD3 LYS 52 HD3 LYS 52 -7.794 12.679 12.540 447 HE2 LYS 52 HE2 LYS 52 -5.609 11.794 11.967 448 HE3 LYS 52 HE3 LYS 52 -6.243 11.026 10.503 449 HZ1 LYS 52 HZ1 LYS 52 -6.119 13.945 11.029 450 HZ2 LYS 52 HZ2 LYS 52 -5.153 13.136 10.010 451 HZ3 LYS 52 HZ3 LYS 52 -6.749 13.269 9.658 452 H GLY 53 H GLY 53 -10.425 6.296 11.167 453 HA2 GLY 53 HA2 GLY 53 -12.733 5.971 11.185 454 HA3 GLY 53 HA3 GLY 53 -12.998 7.617 11.754 455 H LYS 54 H LYS 54 -13.627 5.685 9.253 456 HA LYS 54 HA LYS 54 -13.990 5.710 7.022 457 HB2 LYS 54 HB2 LYS 54 -15.648 7.383 7.820 458 HB3 LYS 54 HB3 LYS 54 -14.499 8.670 7.413 459 HG2 LYS 54 HG2 LYS 54 -14.569 7.893 5.016 460 HG3 LYS 54 HG3 LYS 54 -15.774 6.674 5.494 461 HD2 LYS 54 HD2 LYS 54 -17.271 8.507 6.253 462 HD3 LYS 54 HD3 LYS 54 -16.022 9.696 5.806 463 HE2 LYS 54 HE2 LYS 54 -16.120 8.885 3.444 464 HE3 LYS 54 HE3 LYS 54 -17.413 7.767 3.887 465 HZ1 LYS 54 HZ1 LYS 54 -18.768 9.719 4.522 466 HZ2 LYS 54 HZ2 LYS 54 -17.562 10.735 4.101 467 HZ3 LYS 54 HZ3 LYS 54 -18.306 9.843 2.959 468 H THR 55 H THR 55 -11.374 7.724 7.929 469 HA THR 55 HA THR 55 -10.284 7.337 5.172 470 HB THR 55 HB THR 55 -9.097 9.229 7.222 471 HG1 THR 55 HG1 THR 55 -11.196 9.958 6.883 472 HG21 THR 55 HG21 THR 55 -9.148 8.948 4.194 473 HG22 THR 55 HG22 THR 55 -8.318 10.266 5.067 474 HG23 THR 55 HG23 THR 55 -7.767 8.582 5.247 475 H ALA 56 H ALA 56 -9.072 5.630 4.991 476 HA ALA 56 HA ALA 56 -7.566 4.544 7.287 477 HB1 ALA 56 HB1 ALA 56 -6.935 2.738 5.701 478 HB2 ALA 56 HB2 ALA 56 -8.689 2.906 5.879 479 HB3 ALA 56 HB3 ALA 56 -7.881 3.544 4.431 480 H TYR 57 H TYR 57 -5.255 4.335 7.177 481 HA TYR 57 HA TYR 57 -3.843 5.950 5.118 482 HB2 TYR 57 HB2 TYR 57 -3.269 6.060 8.095 483 HB3 TYR 57 HB3 TYR 57 -2.333 6.820 6.819 484 HD1 TYR 57 HD1 TYR 57 -2.908 9.003 6.020 485 HD2 TYR 57 HD2 TYR 57 -5.656 6.850 8.555 486 HE1 TYR 57 HE1 TYR 57 -4.304 11.051 6.263 487 HE2 TYR 57 HE2 TYR 57 -7.080 8.861 8.727 488 HH TYR 57 HH TYR 57 -6.220 11.957 7.133 489 H ILE 58 H ILE 58 -2.598 4.545 4.074 490 HA ILE 58 HA ILE 58 -1.583 2.076 5.352 491 HB ILE 58 HB ILE 58 -0.574 3.286 2.760 492 HG12 ILE 58 HG12 ILE 58 -2.923 3.183 2.356 493 HG13 ILE 58 HG13 ILE 58 -2.087 1.934 1.458 494 HG21 ILE 58 HG21 ILE 58 -0.622 0.461 3.861 495 HG22 ILE 58 HG22 ILE 58 0.025 0.957 2.280 496 HG23 ILE 58 HG23 ILE 58 0.788 1.532 3.756 497 HD11 ILE 58 HD11 ILE 58 -2.851 0.219 3.043 498 HD12 ILE 58 HD12 ILE 58 -3.646 1.471 4.031 499 HD13 ILE 58 HD13 ILE 58 -4.202 1.158 2.378 500 H LYS 59 H LYS 59 -0.022 2.418 6.929 501 HA LYS 59 HA LYS 59 2.163 4.360 6.241 502 HB2 LYS 59 HB2 LYS 59 1.343 3.563 9.053 503 HB3 LYS 59 HB3 LYS 59 2.552 4.754 8.557 504 HG2 LYS 59 HG2 LYS 59 0.586 5.865 7.229 505 HG3 LYS 59 HG3 LYS 59 -0.469 4.881 8.246 506 HD2 LYS 59 HD2 LYS 59 0.463 6.018 10.267 507 HD3 LYS 59 HD3 LYS 59 1.525 6.977 9.198 508 HE2 LYS 59 HE2 LYS 59 -0.649 7.589 7.921 509 HE3 LYS 59 HE3 LYS 59 -1.525 6.979 9.336 510 HZ1 LYS 59 HZ1 LYS 59 -1.120 9.398 9.370 511 HZ2 LYS 59 HZ2 LYS 59 -0.451 8.702 10.664 512 HZ3 LYS 59 HZ3 LYS 59 0.492 9.166 9.361 513 H LEU 60 H LEU 60 4.151 3.732 6.073 514 HA LEU 60 HA LEU 60 4.767 0.817 6.417 515 HB2 LEU 60 HB2 LEU 60 5.708 2.883 4.391 516 HB3 LEU 60 HB3 LEU 60 6.425 1.283 4.560 517 HG LEU 60 HG LEU 60 3.470 1.692 3.923 518 HD11 LEU 60 HD11 LEU 60 5.821 1.245 2.052 519 HD12 LEU 60 HD12 LEU 60 4.108 1.158 1.582 520 HD13 LEU 60 HD13 LEU 60 4.796 2.692 2.136 521 HD21 LEU 60 HD21 LEU 60 5.329 -0.706 3.578 522 HD22 LEU 60 HD22 LEU 60 4.081 -0.548 4.828 523 HD23 LEU 60 HD23 LEU 60 3.613 -0.636 3.126 524 H GLU 61 H GLU 61 6.463 0.270 7.650 525 HA GLU 61 HA GLU 61 7.945 2.486 9.011 526 HB2 GLU 61 HB2 GLU 61 6.630 0.096 10.338 527 HB3 GLU 61 HB3 GLU 61 7.459 1.440 11.121 528 HG2 GLU 61 HG2 GLU 61 5.693 2.979 10.143 529 HG3 GLU 61 HG3 GLU 61 4.811 1.536 9.619 530 H ASP 62 H ASP 62 9.964 1.913 10.103 531 HA ASP 62 HA ASP 62 11.552 0.052 8.639 532 HB2 ASP 62 HB2 ASP 62 12.441 2.131 9.501 533 HB3 ASP 62 HB3 ASP 62 11.988 1.701 11.154 534 H LYS 63 H LYS 63 12.247 -1.952 9.128 535 HA LYS 63 HA LYS 63 10.567 -3.618 10.709 536 HB2 LYS 63 HB2 LYS 63 12.336 -3.942 8.596 537 HB3 LYS 63 HB3 LYS 63 13.213 -4.733 9.892 538 HG2 LYS 63 HG2 LYS 63 11.240 -6.166 10.366 539 HG3 LYS 63 HG3 LYS 63 10.321 -5.345 9.099 540 HD2 LYS 63 HD2 LYS 63 12.859 -6.982 8.664 541 HD3 LYS 63 HD3 LYS 63 11.205 -7.542 8.366 542 HE2 LYS 63 HE2 LYS 63 10.883 -5.770 6.673 543 HE3 LYS 63 HE3 LYS 63 12.536 -5.186 6.953 544 HZ1 LYS 63 HZ1 LYS 63 11.743 -7.797 5.806 545 HZ2 LYS 63 HZ2 LYS 63 12.573 -6.590 5.058 546 HZ3 LYS 63 HZ3 LYS 63 13.293 -7.450 6.248 547 H VAL 64 H VAL 64 13.081 -1.724 11.840 548 HA VAL 64 HA VAL 64 13.775 -3.536 14.113 549 HB VAL 64 HB VAL 64 15.496 -1.220 13.210 550 HG11 VAL 64 HG11 VAL 64 16.129 -3.913 14.475 551 HG12 VAL 64 HG12 VAL 64 17.287 -2.607 14.139 552 HG13 VAL 64 HG13 VAL 64 16.008 -2.358 15.331 553 HG21 VAL 64 HG21 VAL 64 16.833 -2.762 11.792 554 HG22 VAL 64 HG22 VAL 64 15.540 -3.979 11.928 555 HG23 VAL 64 HG23 VAL 64 15.240 -2.415 11.122 556 H SER 65 H SER 65 13.034 -0.172 13.193 557 HA SER 65 HA SER 65 12.703 0.463 16.102 558 HB2 SER 65 HB2 SER 65 13.833 2.178 13.863 559 HB3 SER 65 HB3 SER 65 13.581 2.715 15.536 560 HG SER 65 HG SER 65 15.738 2.002 15.150 561 H GLY 66 H GLY 66 10.830 0.194 13.335 562 HA2 GLY 66 HA2 GLY 66 8.685 0.834 12.903 563 HA3 GLY 66 HA3 GLY 66 8.594 1.537 14.518 564 H GLU 67 H GLU 67 11.119 2.856 12.541 565 HA GLU 67 HA GLU 67 9.916 5.494 12.554 566 HB2 GLU 67 HB2 GLU 67 12.411 4.466 11.143 567 HB3 GLU 67 HB3 GLU 67 11.929 6.162 11.286 568 HG2 GLU 67 HG2 GLU 67 12.007 5.929 13.791 569 HG3 GLU 67 HG3 GLU 67 12.635 4.291 13.588 570 H LEU 68 H LEU 68 9.040 6.719 10.850 571 HA LEU 68 HA LEU 68 7.581 5.139 8.968 572 HB2 LEU 68 HB2 LEU 68 6.786 7.245 10.142 573 HB3 LEU 68 HB3 LEU 68 7.838 8.164 9.069 574 HG LEU 68 HG LEU 68 6.535 7.086 7.108 575 HD11 LEU 68 HD11 LEU 68 4.572 6.481 9.369 576 HD12 LEU 68 HD12 LEU 68 4.250 6.329 7.630 577 HD13 LEU 68 HD13 LEU 68 5.425 5.265 8.403 578 HD21 LEU 68 HD21 LEU 68 6.222 9.425 7.812 579 HD22 LEU 68 HD22 LEU 68 4.698 8.690 7.292 580 HD23 LEU 68 HD23 LEU 68 5.030 8.908 9.027 581 H PHE 69 H PHE 69 8.076 4.481 7.020 582 HA PHE 69 HA PHE 69 10.247 5.656 5.365 583 HB2 PHE 69 HB2 PHE 69 10.186 3.285 5.429 584 HB3 PHE 69 HB3 PHE 69 8.450 3.230 5.167 585 HD1 PHE 69 HD1 PHE 69 7.866 2.340 3.109 586 HD2 PHE 69 HD2 PHE 69 11.371 4.833 3.361 587 HE1 PHE 69 HE1 PHE 69 8.238 2.058 0.682 588 HE2 PHE 69 HE2 PHE 69 11.714 4.593 0.926 589 HZ PHE 69 HZ PHE 69 10.129 3.210 -0.440 590 H ALA 70 H ALA 70 6.709 5.045 5.115 591 HA ALA 70 HA ALA 70 6.275 7.547 3.668 592 HB1 ALA 70 HB1 ALA 70 5.787 4.857 2.300 593 HB2 ALA 70 HB2 ALA 70 5.306 6.450 1.685 594 HB3 ALA 70 HB3 ALA 70 7.024 6.048 1.836 595 H GLN 71 H GLN 71 3.979 7.965 3.273 596 HA GLN 71 HA GLN 71 2.071 6.108 4.474 597 HB2 GLN 71 HB2 GLN 71 0.910 7.842 5.776 598 HB3 GLN 71 HB3 GLN 71 2.528 7.468 6.365 599 HG2 GLN 71 HG2 GLN 71 3.382 9.539 5.194 600 HG3 GLN 71 HG3 GLN 71 1.716 9.942 4.777 601 HE21 GLN 71 HE21 GLN 71 2.659 11.761 7.918 602 HE22 GLN 71 HE22 GLN 71 3.274 11.734 6.272 603 H ALA 72 H ALA 72 0.135 5.991 3.479 604 HA ALA 72 HA ALA 72 -0.502 7.966 1.317 605 HB1 ALA 72 HB1 ALA 72 -0.892 4.962 1.292 606 HB2 ALA 72 HB2 ALA 72 -1.534 6.082 0.088 607 HB3 ALA 72 HB3 ALA 72 0.210 5.919 0.272 608 HA PRO 73 HA PRO 73 -4.381 8.013 3.853 609 HB2 PRO 73 HB2 PRO 73 -4.959 10.401 2.141 610 HB3 PRO 73 HB3 PRO 73 -5.048 10.235 3.911 611 HG2 PRO 73 HG2 PRO 73 -3.022 11.607 2.668 612 HG3 PRO 73 HG3 PRO 73 -2.717 10.625 4.140 613 HD2 PRO 73 HD2 PRO 73 -2.208 9.917 1.252 614 HD3 PRO 73 HD3 PRO 73 -1.177 9.650 2.686 615 H VAL 74 H VAL 74 -6.139 6.772 3.249 616 HA VAL 74 HA VAL 74 -7.010 6.698 0.386 617 HB VAL 74 HB VAL 74 -7.146 4.425 2.387 618 HG11 VAL 74 HG11 VAL 74 -7.838 4.462 -0.558 619 HG12 VAL 74 HG12 VAL 74 -7.912 3.066 0.552 620 HG13 VAL 74 HG13 VAL 74 -9.008 4.414 0.774 621 HG21 VAL 74 HG21 VAL 74 -4.811 4.774 1.621 622 HG22 VAL 74 HG22 VAL 74 -5.524 3.226 1.161 623 HG23 VAL 74 HG23 VAL 74 -5.373 4.505 -0.043 624 H GLU 75 H GLU 75 -8.980 7.439 0.043 625 HA GLU 75 HA GLU 75 -10.978 7.633 2.272 626 HB2 GLU 75 HB2 GLU 75 -10.530 9.319 -0.226 627 HB3 GLU 75 HB3 GLU 75 -11.926 9.485 0.840 628 HG2 GLU 75 HG2 GLU 75 -10.500 10.085 2.723 629 HG3 GLU 75 HG3 GLU 75 -9.045 9.864 1.742 630 H GLN 76 H GLN 76 -10.339 5.847 -0.533 631 HA GLN 76 HA GLN 76 -12.973 4.732 -0.614 632 HB2 GLN 76 HB2 GLN 76 -13.567 5.243 -2.862 633 HB3 GLN 76 HB3 GLN 76 -13.257 6.771 -2.061 634 HG2 GLN 76 HG2 GLN 76 -11.423 5.360 -4.044 635 HG3 GLN 76 HG3 GLN 76 -12.432 6.751 -4.364 636 HE21 GLN 76 HE21 GLN 76 -8.774 7.305 -2.655 637 HE22 GLN 76 HE22 GLN 76 -9.456 5.665 -2.748 638 H TYR 77 H TYR 77 -12.989 2.714 -1.573 639 HA TYR 77 HA TYR 77 -10.520 1.726 -2.865 640 HB2 TYR 77 HB2 TYR 77 -10.618 1.160 -0.412 641 HB3 TYR 77 HB3 TYR 77 -12.046 0.186 -0.732 642 HD1 TYR 77 HD1 TYR 77 -8.975 0.404 -2.855 643 HD2 TYR 77 HD2 TYR 77 -11.095 -1.929 0.069 644 HE1 TYR 77 HE1 TYR 77 -7.245 -1.293 -3.006 645 HE2 TYR 77 HE2 TYR 77 -9.415 -3.736 -0.193 646 HH TYR 77 HH TYR 77 -6.574 -3.399 -2.359 647 HA PRO 78 HA PRO 78 -9.852 0.587 -4.710 648 HB2 PRO 78 HB2 PRO 78 -10.142 0.735 -7.396 649 HB3 PRO 78 HB3 PRO 78 -10.245 -0.805 -6.489 650 HG2 PRO 78 HG2 PRO 78 -12.542 0.972 -7.390 651 HG3 PRO 78 HG3 PRO 78 -12.343 -0.793 -7.653 652 HD2 PRO 78 HD2 PRO 78 -13.823 0.165 -5.593 653 HD3 PRO 78 HD3 PRO 78 -12.786 -1.274 -5.377 654 H GLY 79 H GLY 79 -8.596 2.323 -5.669 655 HA2 GLY 79 HA2 GLY 79 -9.830 4.760 -6.670 656 HA3 GLY 79 HA3 GLY 79 -9.236 4.931 -5.017 657 H ILE 80 H ILE 80 -7.743 6.541 -5.838 658 HA ILE 80 HA ILE 80 -5.481 5.552 -7.469 659 HB ILE 80 HB ILE 80 -6.502 7.764 -7.922 660 HG12 ILE 80 HG12 ILE 80 -4.485 9.062 -8.206 661 HG13 ILE 80 HG13 ILE 80 -3.610 8.075 -7.041 662 HG21 ILE 80 HG21 ILE 80 -5.264 8.654 -5.274 663 HG22 ILE 80 HG22 ILE 80 -6.065 9.682 -6.468 664 HG23 ILE 80 HG23 ILE 80 -7.008 8.477 -5.583 665 HD11 ILE 80 HD11 ILE 80 -3.627 6.166 -8.551 666 HD12 ILE 80 HD12 ILE 80 -4.740 7.006 -9.665 667 HD13 ILE 80 HD13 ILE 80 -3.077 7.585 -9.449 668 H ALA 81 H ALA 81 -6.285 6.065 -4.115 669 HA ALA 81 HA ALA 81 -3.502 6.188 -3.262 670 HB1 ALA 81 HB1 ALA 81 -6.070 6.017 -1.651 671 HB2 ALA 81 HB2 ALA 81 -4.428 6.355 -1.034 672 HB3 ALA 81 HB3 ALA 81 -5.235 7.514 -2.128 673 H VAL 82 H VAL 82 -5.907 3.642 -3.600 674 HA VAL 82 HA VAL 82 -3.659 1.738 -3.310 675 HB VAL 82 HB VAL 82 -4.675 1.631 -1.166 676 HG11 VAL 82 HG11 VAL 82 -6.743 2.503 -1.279 677 HG12 VAL 82 HG12 VAL 82 -7.265 1.483 -2.591 678 HG13 VAL 82 HG13 VAL 82 -7.068 0.792 -0.970 679 HG21 VAL 82 HG21 VAL 82 -3.749 -0.357 -2.034 680 HG22 VAL 82 HG22 VAL 82 -5.212 -0.760 -1.116 681 HG23 VAL 82 HG23 VAL 82 -5.224 -0.783 -2.892 682 H GLU 83 H GLU 83 -3.593 0.418 -5.000 683 HA GLU 83 HA GLU 83 -6.059 -0.416 -6.435 684 HB2 GLU 83 HB2 GLU 83 -4.181 1.514 -7.437 685 HB3 GLU 83 HB3 GLU 83 -3.877 0.029 -8.325 686 HG2 GLU 83 HG2 GLU 83 -6.634 1.283 -7.993 687 HG3 GLU 83 HG3 GLU 83 -5.547 1.626 -9.340 688 H THR 84 H THR 84 -5.901 -2.352 -7.617 689 HA THR 84 HA THR 84 -3.611 -4.158 -6.846 690 HB THR 84 HB THR 84 -6.155 -5.167 -7.985 691 HG1 THR 84 HG1 THR 84 -6.813 -4.015 -6.132 692 HG21 THR 84 HG21 THR 84 -4.100 -6.309 -6.085 693 HG22 THR 84 HG22 THR 84 -5.551 -7.160 -6.666 694 HG23 THR 84 HG23 THR 84 -4.292 -6.676 -7.821 695 H VAL 85 H VAL 85 -2.379 -3.312 -8.290 696 HA VAL 85 HA VAL 85 -1.419 -2.984 -10.479 697 HB VAL 85 HB VAL 85 -0.523 -5.412 -10.875 698 HG11 VAL 85 HG11 VAL 85 -0.079 -3.857 -8.279 699 HG12 VAL 85 HG12 VAL 85 1.046 -5.016 -9.002 700 HG13 VAL 85 HG13 VAL 85 0.674 -3.519 -9.849 701 HG21 VAL 85 HG21 VAL 85 -2.338 -6.534 -9.444 702 HG22 VAL 85 HG22 VAL 85 -0.665 -6.921 -9.038 703 HG23 VAL 85 HG23 VAL 85 -1.577 -5.778 -8.043 704 H THR 86 H THR 86 -3.112 -6.034 -10.962 705 HA THR 86 HA THR 86 -4.801 -4.829 -12.988 706 HB THR 86 HB THR 86 -4.694 -6.915 -14.444 707 HG1 THR 86 HG1 THR 86 -2.797 -8.070 -14.390 708 HG21 THR 86 HG21 THR 86 -3.685 -4.661 -15.034 709 HG22 THR 86 HG22 THR 86 -2.160 -5.269 -14.374 710 HG23 THR 86 HG23 THR 86 -2.880 -6.059 -15.799 711 H ASP 87 H ASP 87 -3.935 -7.920 -11.481 712 HA ASP 87 HA ASP 87 -6.757 -8.322 -10.591 713 HB2 ASP 87 HB2 ASP 87 -5.433 -9.512 -12.916 714 HB3 ASP 87 HB3 ASP 87 -6.087 -10.738 -11.831 715 H SER 88 H SER 88 -3.790 -10.445 -10.790 716 HA SER 88 HA SER 88 -4.177 -11.682 -8.327 717 HB2 SER 88 HB2 SER 88 -2.236 -12.188 -9.770 718 HB3 SER 88 HB3 SER 88 -1.387 -10.796 -9.112 719 HG SER 88 HG SER 88 -1.475 -13.162 -8.215 720 H SER 89 H SER 89 -3.928 -11.299 -6.278 721 HA SER 89 HA SER 89 -3.554 -8.496 -5.420 722 HB2 SER 89 HB2 SER 89 -5.004 -9.140 -3.595 723 HB3 SER 89 HB3 SER 89 -5.663 -9.482 -5.221 724 HG SER 89 HG SER 89 -5.988 -11.240 -3.730 725 H ARG 90 H ARG 90 -1.484 -10.750 -5.803 726 HA ARG 90 HA ARG 90 0.047 -10.880 -3.337 727 HB2 ARG 90 HB2 ARG 90 0.126 -12.415 -5.329 728 HB3 ARG 90 HB3 ARG 90 0.848 -11.108 -6.277 729 HG2 ARG 90 HG2 ARG 90 2.783 -11.103 -4.610 730 HG3 ARG 90 HG3 ARG 90 2.061 -12.547 -3.881 731 HD2 ARG 90 HD2 ARG 90 3.036 -12.240 -6.764 732 HD3 ARG 90 HD3 ARG 90 3.878 -13.094 -5.477 733 HE ARG 90 HE ARG 90 2.177 -14.806 -5.467 734 HH11 ARG 90 HH11 ARG 90 0.521 -15.997 -6.514 735 HH12 ARG 90 HH12 ARG 90 -0.131 -15.302 -8.009 736 HH21 ARG 90 HH21 ARG 90 2.049 -12.897 -8.455 737 HH22 ARG 90 HH22 ARG 90 0.546 -13.726 -8.909 738 H TYR 91 H TYR 91 -0.315 -8.487 -5.843 739 HA TYR 91 HA TYR 91 1.618 -6.684 -4.452 740 HB2 TYR 91 HB2 TYR 91 0.833 -6.539 -7.363 741 HB3 TYR 91 HB3 TYR 91 2.129 -5.661 -6.583 742 HD1 TYR 91 HD1 TYR 91 4.141 -7.036 -5.704 743 HD2 TYR 91 HD2 TYR 91 1.202 -8.525 -8.478 744 HE1 TYR 91 HE1 TYR 91 5.733 -8.824 -6.438 745 HE2 TYR 91 HE2 TYR 91 2.777 -10.235 -9.286 746 HH TYR 91 HH TYR 91 6.074 -10.572 -7.772 747 H PHE 92 H PHE 92 1.207 -4.432 -4.698 748 HA PHE 92 HA PHE 92 -1.455 -3.534 -5.600 749 HB2 PHE 92 HB2 PHE 92 -0.359 -2.793 -2.861 750 HB3 PHE 92 HB3 PHE 92 -1.797 -2.112 -3.615 751 HD1 PHE 92 HD1 PHE 92 -3.769 -3.643 -4.179 752 HD2 PHE 92 HD2 PHE 92 -0.458 -4.850 -1.693 753 HE1 PHE 92 HE1 PHE 92 -5.110 -5.561 -3.347 754 HE2 PHE 92 HE2 PHE 92 -1.837 -6.705 -0.793 755 HZ PHE 92 HZ PHE 92 -4.128 -7.117 -1.666 756 H VAL 93 H VAL 93 -1.514 -1.135 -5.691 757 HA VAL 93 HA VAL 93 1.128 0.223 -5.627 758 HB VAL 93 HB VAL 93 -1.031 0.741 -7.711 759 HG11 VAL 93 HG11 VAL 93 1.602 2.166 -7.129 760 HG12 VAL 93 HG12 VAL 93 0.629 2.392 -8.586 761 HG13 VAL 93 HG13 VAL 93 -0.036 2.859 -7.033 762 HG21 VAL 93 HG21 VAL 93 1.805 -0.361 -7.940 763 HG22 VAL 93 HG22 VAL 93 0.294 -1.213 -8.319 764 HG23 VAL 93 HG23 VAL 93 0.810 0.152 -9.312 765 H ILE 94 H ILE 94 1.102 2.089 -4.427 766 HA ILE 94 HA ILE 94 -1.531 3.272 -3.740 767 HB ILE 94 HB ILE 94 -0.895 3.648 -1.432 768 HG12 ILE 94 HG12 ILE 94 1.623 2.009 -1.953 769 HG13 ILE 94 HG13 ILE 94 1.591 3.761 -1.780 770 HG21 ILE 94 HG21 ILE 94 -1.156 1.416 -0.575 771 HG22 ILE 94 HG22 ILE 94 -2.030 1.483 -2.085 772 HG23 ILE 94 HG23 ILE 94 -0.452 0.682 -2.028 773 HD11 ILE 94 HD11 ILE 94 0.623 3.512 0.502 774 HD12 ILE 94 HD12 ILE 94 0.800 1.761 0.355 775 HD13 ILE 94 HD13 ILE 94 2.236 2.795 0.343 776 H ARG 95 H ARG 95 -1.576 5.500 -3.583 777 HA ARG 95 HA ARG 95 0.921 6.922 -4.370 778 HB2 ARG 95 HB2 ARG 95 -0.183 8.698 -5.164 779 HB3 ARG 95 HB3 ARG 95 -1.242 7.367 -5.586 780 HG2 ARG 95 HG2 ARG 95 -2.709 9.013 -4.964 781 HG3 ARG 95 HG3 ARG 95 -2.629 8.005 -3.532 782 HD2 ARG 95 HD2 ARG 95 -0.984 9.701 -2.548 783 HD3 ARG 95 HD3 ARG 95 -1.259 10.684 -3.984 784 HE ARG 95 HE ARG 95 -3.323 11.324 -3.092 785 HH11 ARG 95 HH11 ARG 95 -5.084 11.251 -1.648 786 HH12 ARG 95 HH12 ARG 95 -5.131 9.967 -0.456 787 HH21 ARG 95 HH21 ARG 95 -2.194 8.509 -1.290 788 HH22 ARG 95 HH22 ARG 95 -3.645 8.521 -0.288 789 H ILE 96 H ILE 96 2.199 7.634 -2.885 790 HA ILE 96 HA ILE 96 1.262 8.039 -0.078 791 HB ILE 96 HB ILE 96 3.696 7.951 0.472 792 HG12 ILE 96 HG12 ILE 96 4.151 6.807 -2.308 793 HG13 ILE 96 HG13 ILE 96 4.420 8.518 -1.952 794 HG21 ILE 96 HG21 ILE 96 2.484 5.513 -0.864 795 HG22 ILE 96 HG22 ILE 96 3.898 5.459 0.189 796 HG23 ILE 96 HG23 ILE 96 2.356 5.986 0.847 797 HD11 ILE 96 HD11 ILE 96 5.850 6.190 -0.673 798 HD12 ILE 96 HD12 ILE 96 6.503 7.397 -1.803 799 HD13 ILE 96 HD13 ILE 96 6.003 7.894 -0.167 800 H GLN 97 H GLN 97 2.130 9.828 1.117 801 HA GLN 97 HA GLN 97 3.026 12.195 -0.452 802 HB2 GLN 97 HB2 GLN 97 1.394 12.258 1.560 803 HB3 GLN 97 HB3 GLN 97 2.817 12.031 2.568 804 HG2 GLN 97 HG2 GLN 97 2.562 14.246 0.466 805 HG3 GLN 97 HG3 GLN 97 1.947 14.423 2.101 806 HE21 GLN 97 HE21 GLN 97 5.206 16.008 2.310 807 HE22 GLN 97 HE22 GLN 97 3.694 16.319 1.462 808 H ASP 98 H ASP 98 5.224 12.598 -0.702 809 HA ASP 98 HA ASP 98 6.860 10.228 -0.253 810 HB2 ASP 98 HB2 ASP 98 6.529 11.541 -2.399 811 HB3 ASP 98 HB3 ASP 98 7.490 12.814 -1.641 812 H GLY 99 H GLY 99 6.393 12.769 1.746 813 HA2 GLY 99 HA2 GLY 99 7.452 13.322 3.719 814 HA3 GLY 99 HA3 GLY 99 8.816 12.288 3.291 815 H THR 100 H THR 100 8.447 14.334 0.686 816 HA THR 100 HA THR 100 10.465 16.283 1.711 817 HB THR 100 HB THR 100 11.323 16.273 -0.613 818 HG1 THR 100 HG1 THR 100 10.487 14.583 -1.948 819 HG21 THR 100 HG21 THR 100 12.340 14.081 -0.616 820 HG22 THR 100 HG22 THR 100 12.229 14.627 1.067 821 HG23 THR 100 HG23 THR 100 11.078 13.421 0.444 822 H GLY 101 H GLY 101 7.328 16.386 1.210 823 HA2 GLY 101 HA2 GLY 101 5.995 18.354 1.020 824 HA3 GLY 101 HA3 GLY 101 7.269 19.155 0.101 825 H ARG 102 H ARG 102 6.654 15.927 -0.910 826 HA ARG 102 HA ARG 102 4.788 16.750 -3.094 827 HB2 ARG 102 HB2 ARG 102 6.055 15.847 -4.743 828 HB3 ARG 102 HB3 ARG 102 7.269 16.639 -3.713 829 HG2 ARG 102 HG2 ARG 102 7.993 14.512 -2.851 830 HG3 ARG 102 HG3 ARG 102 6.682 13.661 -3.689 831 HD2 ARG 102 HD2 ARG 102 8.554 13.262 -5.016 832 HD3 ARG 102 HD3 ARG 102 7.615 14.487 -5.859 833 HE ARG 102 HE ARG 102 9.284 16.092 -5.447 834 HH11 ARG 102 HH11 ARG 102 11.411 16.642 -5.254 835 HH12 ARG 102 HH12 ARG 102 12.528 15.564 -4.472 836 HH21 ARG 102 HH21 ARG 102 10.225 13.116 -3.749 837 HH22 ARG 102 HH22 ARG 102 11.901 13.601 -3.747 838 H SER 103 H SER 103 4.044 14.730 -4.331 839 HA SER 103 HA SER 103 3.644 12.397 -2.516 840 HB2 SER 103 HB2 SER 103 1.655 13.449 -4.571 841 HB3 SER 103 HB3 SER 103 1.493 11.938 -3.663 842 HG SER 103 HG SER 103 1.529 14.596 -2.638 843 H ALA 104 H ALA 104 3.539 10.330 -3.570 844 HA ALA 104 HA ALA 104 4.661 10.091 -6.305 845 HB1 ALA 104 HB1 ALA 104 6.636 10.360 -4.851 846 HB2 ALA 104 HB2 ALA 104 6.064 9.033 -3.816 847 HB3 ALA 104 HB3 ALA 104 6.542 8.712 -5.496 848 H PHE 105 H PHE 105 4.417 8.035 -7.264 849 HA PHE 105 HA PHE 105 2.513 6.197 -5.905 850 HB2 PHE 105 HB2 PHE 105 3.530 6.101 -8.756 851 HB3 PHE 105 HB3 PHE 105 2.212 5.168 -8.057 852 HD1 PHE 105 HD1 PHE 105 3.148 8.267 -9.678 853 HD2 PHE 105 HD2 PHE 105 0.123 6.446 -7.195 854 HE1 PHE 105 HE1 PHE 105 1.591 10.113 -10.222 855 HE2 PHE 105 HE2 PHE 105 -1.438 8.282 -7.775 856 HZ PHE 105 HZ PHE 105 -0.728 10.115 -9.274 857 H ILE 106 H ILE 106 3.142 4.360 -4.990 858 HA ILE 106 HA ILE 106 5.678 3.069 -5.906 859 HB ILE 106 HB ILE 106 5.988 2.116 -3.648 860 HG12 ILE 106 HG12 ILE 106 4.179 4.358 -2.640 861 HG13 ILE 106 HG13 ILE 106 3.684 2.671 -2.756 862 HG21 ILE 106 HG21 ILE 106 6.232 5.160 -3.782 863 HG22 ILE 106 HG22 ILE 106 7.259 4.048 -2.853 864 HG23 ILE 106 HG23 ILE 106 7.314 4.030 -4.615 865 HD11 ILE 106 HD11 ILE 106 5.434 1.982 -1.191 866 HD12 ILE 106 HD12 ILE 106 5.975 3.673 -1.027 867 HD13 ILE 106 HD13 ILE 106 4.364 3.195 -0.481 868 H GLY 107 H GLY 107 5.676 1.029 -6.370 869 HA2 GLY 107 HA2 GLY 107 3.215 -0.599 -6.160 870 HA3 GLY 107 HA3 GLY 107 4.686 -1.031 -7.029 871 H ILE 108 H ILE 108 3.046 -2.325 -4.815 872 HA ILE 108 HA ILE 108 5.236 -2.818 -2.851 873 HB ILE 108 HB ILE 108 2.294 -3.147 -2.251 874 HG12 ILE 108 HG12 ILE 108 4.105 -0.732 -1.785 875 HG13 ILE 108 HG13 ILE 108 2.576 -0.776 -2.665 876 HG21 ILE 108 HG21 ILE 108 4.764 -2.982 -0.482 877 HG22 ILE 108 HG22 ILE 108 3.097 -3.275 0.075 878 HG23 ILE 108 HG23 ILE 108 3.898 -4.479 -0.894 879 HD11 ILE 108 HD11 ILE 108 1.393 -1.304 -0.523 880 HD12 ILE 108 HD12 ILE 108 2.943 -1.057 0.339 881 HD13 ILE 108 HD13 ILE 108 2.221 0.271 -0.552 882 H GLY 109 H GLY 109 5.691 -4.970 -2.397 883 HA2 GLY 109 HA2 GLY 109 3.884 -7.117 -3.365 884 HA3 GLY 109 HA3 GLY 109 5.599 -7.225 -3.777 885 H PHE 110 H PHE 110 3.597 -8.662 -1.897 886 HA PHE 110 HA PHE 110 5.070 -8.499 0.685 887 HB2 PHE 110 HB2 PHE 110 2.493 -9.819 -0.154 888 HB3 PHE 110 HB3 PHE 110 3.219 -10.073 1.412 889 HD1 PHE 110 HD1 PHE 110 2.018 -7.206 -0.772 890 HD2 PHE 110 HD2 PHE 110 2.755 -8.703 3.212 891 HE1 PHE 110 HE1 PHE 110 0.976 -5.177 0.194 892 HE2 PHE 110 HE2 PHE 110 1.628 -6.727 4.164 893 HZ PHE 110 HZ PHE 110 0.790 -4.921 2.646 894 H THR 111 H THR 111 5.677 -10.363 1.840 895 HA THR 111 HA THR 111 7.192 -12.271 0.288 896 HB THR 111 HB THR 111 7.804 -11.244 2.467 897 HG1 THR 111 HG1 THR 111 8.904 -13.083 3.107 898 HG21 THR 111 HG21 THR 111 5.714 -11.648 3.737 899 HG22 THR 111 HG22 THR 111 6.026 -13.399 3.677 900 HG23 THR 111 HG23 THR 111 7.135 -12.324 4.549 901 H ASP 112 H ASP 112 4.026 -12.252 1.672 902 HA ASP 112 HA ASP 112 3.483 -14.927 0.496 903 HB2 ASP 112 HB2 ASP 112 3.652 -14.889 3.097 904 HB3 ASP 112 HB3 ASP 112 2.119 -14.007 3.045 905 H ARG 113 H ARG 113 1.614 -15.040 -0.724 906 HA ARG 113 HA ARG 113 0.293 -12.592 -1.504 907 HB2 ARG 113 HB2 ARG 113 0.717 -14.676 -2.890 908 HB3 ARG 113 HB3 ARG 113 -0.625 -15.452 -2.061 909 HG2 ARG 113 HG2 ARG 113 -1.095 -12.762 -3.356 910 HG3 ARG 113 HG3 ARG 113 -0.831 -14.164 -4.405 911 HD2 ARG 113 HD2 ARG 113 -2.693 -15.319 -3.314 912 HD3 ARG 113 HD3 ARG 113 -2.986 -13.878 -2.315 913 HE ARG 113 HE ARG 113 -4.065 -12.860 -4.097 914 HH11 ARG 113 HH11 ARG 113 -5.200 -13.033 -6.142 915 HH12 ARG 113 HH12 ARG 113 -4.242 -13.824 -7.421 916 HH21 ARG 113 HH21 ARG 113 -2.212 -15.539 -5.526 917 HH22 ARG 113 HH22 ARG 113 -2.926 -15.156 -7.105 918 H GLY 114 H GLY 114 -0.409 -14.947 0.995 919 HA2 GLY 114 HA2 GLY 114 -3.106 -14.043 1.610 920 HA3 GLY 114 HA3 GLY 114 -2.013 -14.979 2.639 921 H ASP 115 H ASP 115 0.194 -12.994 2.624 922 HA ASP 115 HA ASP 115 -0.781 -11.200 4.692 923 HB2 ASP 115 HB2 ASP 115 1.861 -11.262 3.213 924 HB3 ASP 115 HB3 ASP 115 1.458 -10.142 4.511 925 H ALA 116 H ALA 116 -0.145 -10.860 1.220 926 HA ALA 116 HA ALA 116 -0.896 -8.080 1.087 927 HB1 ALA 116 HB1 ALA 116 -0.858 -8.484 -1.321 928 HB2 ALA 116 HB2 ALA 116 0.501 -9.302 -0.591 929 HB3 ALA 116 HB3 ALA 116 -0.918 -10.242 -1.067 930 H PHE 117 H PHE 117 -2.784 -11.144 0.669 931 HA PHE 117 HA PHE 117 -5.295 -9.990 0.030 932 HB2 PHE 117 HB2 PHE 117 -4.572 -12.423 0.084 933 HB3 PHE 117 HB3 PHE 117 -4.858 -12.394 1.816 934 HD1 PHE 117 HD1 PHE 117 -7.281 -11.592 2.581 935 HD2 PHE 117 HD2 PHE 117 -6.301 -13.018 -1.378 936 HE1 PHE 117 HE1 PHE 117 -9.639 -12.260 2.228 937 HE2 PHE 117 HE2 PHE 117 -8.643 -13.722 -1.683 938 HZ PHE 117 HZ PHE 117 -10.329 -13.339 0.100 939 H ASP 118 H ASP 118 -3.667 -10.254 3.213 940 HA ASP 118 HA ASP 118 -5.961 -9.274 4.725 941 HB2 ASP 118 HB2 ASP 118 -3.034 -9.685 5.398 942 HB3 ASP 118 HB3 ASP 118 -4.225 -9.097 6.558 943 H PHE 119 H PHE 119 -3.169 -7.742 3.121 944 HA PHE 119 HA PHE 119 -3.573 -5.120 4.182 945 HB2 PHE 119 HB2 PHE 119 -1.543 -5.572 3.050 946 HB3 PHE 119 HB3 PHE 119 -2.336 -6.181 1.627 947 HD1 PHE 119 HD1 PHE 119 -3.651 -4.580 0.110 948 HD2 PHE 119 HD2 PHE 119 -0.833 -3.300 3.079 949 HE1 PHE 119 HE1 PHE 119 -3.493 -2.353 -0.998 950 HE2 PHE 119 HE2 PHE 119 -0.780 -1.056 2.070 951 HZ PHE 119 HZ PHE 119 -2.100 -0.573 0.015 952 H ASN 120 H ASN 120 -4.988 -6.809 1.360 953 HA ASN 120 HA ASN 120 -6.806 -4.717 0.596 954 HB2 ASN 120 HB2 ASN 120 -6.499 -6.279 -1.059 955 HB3 ASN 120 HB3 ASN 120 -6.468 -7.642 0.055 956 HD21 ASN 120 HD21 ASN 120 -9.777 -8.501 -0.526 957 HD22 ASN 120 HD22 ASN 120 -8.226 -8.916 0.187 958 H VAL 121 H VAL 121 -7.421 -7.617 2.691 959 HA VAL 121 HA VAL 121 -10.124 -6.950 3.159 960 HB VAL 121 HB VAL 121 -8.173 -8.631 4.763 961 HG11 VAL 121 HG11 VAL 121 -10.145 -9.640 5.910 962 HG12 VAL 121 HG12 VAL 121 -9.869 -7.970 6.397 963 HG13 VAL 121 HG13 VAL 121 -11.171 -8.349 5.245 964 HG21 VAL 121 HG21 VAL 121 -9.447 -10.491 3.803 965 HG22 VAL 121 HG22 VAL 121 -10.576 -9.362 3.021 966 HG23 VAL 121 HG23 VAL 121 -8.889 -9.443 2.494 967 H SER 122 H SER 122 -7.256 -5.829 4.946 968 HA SER 122 HA SER 122 -8.515 -4.513 7.101 969 HB2 SER 122 HB2 SER 122 -6.032 -4.773 6.624 970 HB3 SER 122 HB3 SER 122 -6.179 -3.422 5.486 971 HG SER 122 HG SER 122 -7.103 -2.221 7.320 972 H LEU 123 H LEU 123 -8.419 -3.565 3.690 973 HA LEU 123 HA LEU 123 -9.586 -0.895 4.274 974 HB2 LEU 123 HB2 LEU 123 -8.654 -2.107 1.673 975 HB3 LEU 123 HB3 LEU 123 -9.167 -0.434 1.921 976 HG LEU 123 HG LEU 123 -6.735 -1.795 3.139 977 HD11 LEU 123 HD11 LEU 123 -6.777 0.491 1.178 978 HD12 LEU 123 HD12 LEU 123 -5.413 -0.552 1.651 979 HD13 LEU 123 HD13 LEU 123 -6.715 -1.218 0.667 980 HD21 LEU 123 HD21 LEU 123 -6.074 0.483 3.900 981 HD22 LEU 123 HD22 LEU 123 -7.661 1.097 3.387 982 HD23 LEU 123 HD23 LEU 123 -7.533 -0.085 4.708 983 H GLN 124 H GLN 124 -10.446 -4.011 2.725 984 HA GLN 124 HA GLN 124 -13.020 -3.251 1.759 985 HB2 GLN 124 HB2 GLN 124 -12.143 -5.923 2.930 986 HB3 GLN 124 HB3 GLN 124 -13.631 -5.657 2.037 987 HG2 GLN 124 HG2 GLN 124 -10.833 -5.294 0.900 988 HG3 GLN 124 HG3 GLN 124 -11.827 -6.719 0.694 989 HE21 GLN 124 HE21 GLN 124 -12.149 -4.672 -2.382 990 HE22 GLN 124 HE22 GLN 124 -10.827 -5.464 -1.517 991 H ASP 125 H ASP 125 -12.175 -4.710 4.948 992 HA ASP 125 HA ASP 125 -14.794 -4.424 6.149 993 HB2 ASP 125 HB2 ASP 125 -12.882 -6.004 6.752 994 HB3 ASP 125 HB3 ASP 125 -12.026 -4.606 7.418 995 H HIS 126 H HIS 126 -12.368 -2.068 5.515 996 HA HIS 126 HA HIS 126 -13.225 -0.238 7.680 997 HB2 HIS 126 HB2 HIS 126 -10.909 -0.200 7.292 998 HB3 HIS 126 HB3 HIS 126 -11.114 -0.097 5.545 999 HD2 HIS 126 HD2 HIS 126 -11.748 2.195 4.449 1000 HE1 HIS 126 HE1 HIS 126 -11.361 4.661 7.883 1001 HE2 HIS 126 HE2 HIS 126 -11.727 4.655 5.361 1002 H PHE 127 H PHE 127 -13.818 -0.718 4.193 1003 HA PHE 127 HA PHE 127 -15.372 1.825 4.154 1004 HB2 PHE 127 HB2 PHE 127 -14.328 0.101 1.907 1005 HB3 PHE 127 HB3 PHE 127 -15.479 1.412 1.670 1006 HD1 PHE 127 HD1 PHE 127 -14.816 3.755 2.825 1007 HD2 PHE 127 HD2 PHE 127 -12.026 0.666 1.679 1008 HE1 PHE 127 HE1 PHE 127 -12.971 5.394 2.879 1009 HE2 PHE 127 HE2 PHE 127 -10.178 2.318 1.731 1010 HZ PHE 127 HZ PHE 127 -10.650 4.688 2.367 1011 H LYS 128 H LYS 128 -15.779 -1.564 4.214 1012 HA LYS 128 HA LYS 128 -18.269 -2.250 3.398 1013 HB2 LYS 128 HB2 LYS 128 -16.717 -3.745 4.316 1014 HB3 LYS 128 HB3 LYS 128 -16.612 -2.896 5.855 1015 HG2 LYS 128 HG2 LYS 128 -19.242 -4.072 5.076 1016 HG3 LYS 128 HG3 LYS 128 -17.922 -5.187 5.432 1017 HD2 LYS 128 HD2 LYS 128 -18.676 -2.970 7.343 1018 HD3 LYS 128 HD3 LYS 128 -19.486 -4.539 7.393 1019 HE2 LYS 128 HE2 LYS 128 -16.480 -4.132 7.662 1020 HE3 LYS 128 HE3 LYS 128 -17.580 -4.210 9.033 1021 HZ1 LYS 128 HZ1 LYS 128 -17.353 -6.417 7.064 1022 HZ2 LYS 128 HZ2 LYS 128 -16.456 -6.321 8.422 1023 HZ3 LYS 128 HZ3 LYS 128 -18.098 -6.462 8.526 1024 H TRP 129 H TRP 129 -17.699 -0.297 6.302 1025 HA TRP 129 HA TRP 129 -20.636 -0.176 6.871 1026 HB2 TRP 129 HB2 TRP 129 -19.910 0.453 9.154 1027 HB3 TRP 129 HB3 TRP 129 -19.440 -1.151 8.639 1028 HD1 TRP 129 HD1 TRP 129 -16.840 -1.674 8.330 1029 HE1 TRP 129 HE1 TRP 129 -14.735 -0.476 8.932 1030 HE3 TRP 129 HE3 TRP 129 -18.849 2.892 9.439 1031 HZ2 TRP 129 HZ2 TRP 129 -13.926 2.195 9.837 1032 HZ3 TRP 129 HZ3 TRP 129 -17.359 4.796 10.091 1033 HH2 TRP 129 HH2 TRP 129 -14.916 4.444 10.319 1034 H VAL 130 H VAL 130 -18.745 1.655 5.076 1035 HA VAL 130 HA VAL 130 -20.130 4.201 5.761 1036 HB VAL 130 HB VAL 130 -17.672 5.118 4.865 1037 HG11 VAL 130 HG11 VAL 130 -17.448 5.935 7.193 1038 HG12 VAL 130 HG12 VAL 130 -19.091 6.150 6.565 1039 HG13 VAL 130 HG13 VAL 130 -18.735 4.826 7.694 1040 HG21 VAL 130 HG21 VAL 130 -16.602 2.962 5.254 1041 HG22 VAL 130 HG22 VAL 130 -15.943 4.268 6.243 1042 HG23 VAL 130 HG23 VAL 130 -17.018 3.062 6.968 1043 H LYS 131 H LYS 131 -18.954 5.685 3.634 1044 HA LYS 131 HA LYS 131 -19.398 6.270 1.533 1045 HB2 LYS 131 HB2 LYS 131 -17.678 4.223 1.518 1046 HB3 LYS 131 HB3 LYS 131 -18.985 3.403 0.684 1047 HG2 LYS 131 HG2 LYS 131 -17.650 4.264 -1.018 1048 HG3 LYS 131 HG3 LYS 131 -18.988 5.423 -0.924 1049 HD2 LYS 131 HD2 LYS 131 -17.559 6.981 0.375 1050 HD3 LYS 131 HD3 LYS 131 -16.261 5.779 0.382 1051 HE2 LYS 131 HE2 LYS 131 -15.690 7.312 -1.334 1052 HE3 LYS 131 HE3 LYS 131 -16.249 5.834 -2.133 1053 HZ1 LYS 131 HZ1 LYS 131 -17.200 7.831 -3.154 1054 HZ2 LYS 131 HZ2 LYS 131 -18.397 6.935 -2.507 1055 HZ3 LYS 131 HZ3 LYS 131 -17.885 8.292 -1.749 1056 H GLN 132 H GLN 132 -21.703 5.175 3.050 1057 HA GLN 132 HA GLN 132 -23.883 4.613 2.860 1058 HB2 GLN 132 HB2 GLN 132 -23.832 6.188 0.267 1059 HB3 GLN 132 HB3 GLN 132 -25.227 5.885 1.298 1060 HG2 GLN 132 HG2 GLN 132 -22.804 7.603 1.976 1061 HG3 GLN 132 HG3 GLN 132 -24.421 8.168 1.602 1062 HE21 GLN 132 HE21 GLN 132 -23.763 7.956 5.386 1063 HE22 GLN 132 HE22 GLN 132 -22.721 8.532 4.092 1064 H GLU 133 H GLU 133 -22.045 2.649 1.766 1065 HA GLU 133 HA GLU 133 -23.655 1.292 -0.299 1066 HB2 GLU 133 HB2 GLU 133 -21.045 0.491 1.039 1067 HB3 GLU 133 HB3 GLU 133 -21.891 -0.449 -0.195 1068 HG2 GLU 133 HG2 GLU 133 -21.740 1.592 -1.722 1069 HG3 GLU 133 HG3 GLU 133 -20.647 2.309 -0.542 1070 H1 SER 149 H1 SER 149 20.057 -19.502 -9.988 1071 H2 SER 149 H2 SER 149 18.898 -20.162 -9.030 1072 H3 SER 149 H3 SER 149 19.389 -18.624 -8.780 1073 HA SER 149 HA SER 149 18.507 -17.907 -10.878 1074 HB2 SER 149 HB2 SER 149 18.837 -20.170 -11.963 1075 HB3 SER 149 HB3 SER 149 17.352 -20.705 -11.150 1076 HG SER 149 HG SER 149 17.006 -19.887 -13.290 1077 H GLN 150 H GLN 150 16.168 -17.417 -11.217 1078 HA GLN 150 HA GLN 150 14.363 -17.982 -8.941 1079 HB2 GLN 150 HB2 GLN 150 15.225 -15.190 -9.813 1080 HB3 GLN 150 HB3 GLN 150 13.781 -15.494 -8.856 1081 HG2 GLN 150 HG2 GLN 150 16.620 -16.169 -7.975 1082 HG3 GLN 150 HG3 GLN 150 15.707 -14.751 -7.496 1083 HE21 GLN 150 HE21 GLN 150 15.333 -17.153 -4.711 1084 HE22 GLN 150 HE22 GLN 150 16.652 -16.251 -5.448 1085 H ILE 151 H ILE 151 12.158 -17.405 -9.349 1086 HA ILE 151 HA ILE 151 11.405 -17.265 -12.246 1087 HB ILE 151 HB ILE 151 10.028 -18.826 -10.031 1088 HG12 ILE 151 HG12 ILE 151 11.550 -19.796 -12.500 1089 HG13 ILE 151 HG13 ILE 151 12.128 -19.895 -10.838 1090 HG21 ILE 151 HG21 ILE 151 9.321 -18.576 -12.996 1091 HG22 ILE 151 HG22 ILE 151 8.493 -19.608 -11.810 1092 HG23 ILE 151 HG23 ILE 151 8.399 -17.870 -11.649 1093 HD11 ILE 151 HD11 ILE 151 10.181 -21.375 -10.271 1094 HD12 ILE 151 HD12 ILE 151 9.792 -21.432 -12.011 1095 HD13 ILE 151 HD13 ILE 151 11.340 -22.054 -11.431 1096 H THR 152 H THR 152 10.013 -15.691 -12.816 1097 HA THR 152 HA THR 152 9.336 -13.596 -10.934 1098 HB THR 152 HB THR 152 8.057 -12.694 -12.977 1099 HG1 THR 152 HG1 THR 152 7.922 -14.685 -14.099 1100 HG21 THR 152 HG21 THR 152 10.305 -11.906 -12.332 1101 HG22 THR 152 HG22 THR 152 11.045 -13.250 -13.232 1102 HG23 THR 152 HG23 THR 152 10.132 -11.991 -14.094 1103 H SER 153 H SER 153 7.530 -13.221 -9.836 1104 HA SER 153 HA SER 153 5.340 -15.205 -9.985 1105 HB2 SER 153 HB2 SER 153 6.015 -13.160 -7.871 1106 HB3 SER 153 HB3 SER 153 4.680 -14.329 -7.792 1107 HG SER 153 HG SER 153 7.458 -14.973 -7.994 1108 H GLN 154 H GLN 154 5.260 -13.689 -12.043 1109 HA GLN 154 HA GLN 154 4.110 -11.229 -12.221 1110 HB2 GLN 154 HB2 GLN 154 3.347 -11.779 -14.458 1111 HB3 GLN 154 HB3 GLN 154 4.973 -12.386 -14.137 1112 HG2 GLN 154 HG2 GLN 154 4.046 -14.672 -13.764 1113 HG3 GLN 154 HG3 GLN 154 2.422 -14.066 -14.098 1114 HE21 GLN 154 HE21 GLN 154 3.503 -15.591 -17.256 1115 HE22 GLN 154 HE22 GLN 154 3.022 -16.113 -15.646 1116 H VAL 155 H VAL 155 2.206 -10.175 -12.270 1117 HA VAL 155 HA VAL 155 0.195 -11.202 -10.601 1118 HB VAL 155 HB VAL 155 0.519 -8.869 -10.637 1119 HG11 VAL 155 HG11 VAL 155 -0.002 -7.381 -12.470 1120 HG12 VAL 155 HG12 VAL 155 1.301 -8.515 -12.889 1121 HG13 VAL 155 HG13 VAL 155 -0.354 -8.757 -13.521 1122 HG21 VAL 155 HG21 VAL 155 -2.282 -9.625 -11.498 1123 HG22 VAL 155 HG22 VAL 155 -1.700 -9.014 -9.931 1124 HG23 VAL 155 HG23 VAL 155 -1.863 -7.932 -11.252 1125 H TPO 156 H T2P 156 -1.212 -12.676 -10.999 1126 HA TPO 156 HA T2P 156 -2.186 -13.985 -13.295 1127 HB TPO 156 HB T2P 156 -3.546 -13.277 -10.728 1128 HG21 TPO 156 HG21 T2P 156 -5.388 -13.677 -11.974 1129 HG22 TPO 156 HG22 T2P 156 -5.090 -15.162 -11.050 1130 HG23 TPO 156 HG23 T2P 156 -4.677 -15.123 -12.773 1131 H GLY 157 H GLY 157 -3.979 -13.815 -14.424 1132 HA2 GLY 157 HA2 GLY 157 -5.811 -11.523 -14.389 1133 HA3 GLY 157 HA3 GLY 157 -4.788 -11.567 -15.829 1134 H GLN 158 H GLN 158 -4.878 -14.641 -15.606 1135 HA GLN 158 HA GLN 158 -7.083 -15.151 -17.333 1136 HB2 GLN 158 HB2 GLN 158 -6.218 -17.342 -17.466 1137 HB3 GLN 158 HB3 GLN 158 -4.852 -16.250 -17.435 1138 HG2 GLN 158 HG2 GLN 158 -5.836 -17.886 -15.041 1139 HG3 GLN 158 HG3 GLN 158 -4.581 -18.392 -16.150 1140 HE21 GLN 158 HE21 GLN 158 -2.833 -17.066 -13.185 1141 HE22 GLN 158 HE22 GLN 158 -3.843 -18.446 -13.581 1142 H ILE 159 H ILE 159 -7.041 -15.054 -13.923 1143 HA ILE 159 HA ILE 159 -9.738 -16.226 -13.801 1144 HB ILE 159 HB ILE 159 -8.232 -18.130 -13.471 1145 HG12 ILE 159 HG12 ILE 159 -9.116 -19.031 -11.355 1146 HG13 ILE 159 HG13 ILE 159 -9.722 -17.439 -10.911 1147 HG21 ILE 159 HG21 ILE 159 -7.198 -16.758 -10.968 1148 HG22 ILE 159 HG22 ILE 159 -6.822 -18.396 -11.508 1149 HG23 ILE 159 HG23 ILE 159 -6.280 -17.025 -12.469 1150 HD11 ILE 159 HD11 ILE 159 -11.294 -17.476 -12.810 1151 HD12 ILE 159 HD12 ILE 159 -10.592 -19.012 -13.378 1152 HD13 ILE 159 HD13 ILE 159 -11.475 -18.944 -11.839 1153 H GLY 160 H GLY 160 -7.206 -14.466 -12.066 1154 HA2 GLY 160 HA2 GLY 160 -7.383 -12.560 -10.738 1155 HA3 GLY 160 HA3 GLY 160 -9.110 -12.495 -11.103 1156 H TRP 161 H TRP 161 -7.238 -15.079 -9.489 1157 HA TRP 161 HA TRP 161 -9.298 -15.258 -7.411 1158 HB2 TRP 161 HB2 TRP 161 -8.572 -17.481 -7.091 1159 HB3 TRP 161 HB3 TRP 161 -8.802 -17.169 -8.790 1160 HD1 TRP 161 HD1 TRP 161 -5.561 -15.741 -8.348 1161 HE1 TRP 161 HE1 TRP 161 -3.687 -17.340 -8.990 1162 HE3 TRP 161 HE3 TRP 161 -8.155 -20.101 -7.926 1163 HZ2 TRP 161 HZ2 TRP 161 -3.416 -20.179 -9.487 1164 HZ3 TRP 161 HZ3 TRP 161 -7.058 -22.281 -8.489 1165 HH2 TRP 161 HH2 TRP 161 -4.703 -22.328 -9.284 1166 H ARG 162 H ARG 162 -7.186 -16.813 -5.836 1167 HA ARG 162 HA ARG 162 -6.994 -14.527 -3.929 1168 HB2 ARG 162 HB2 ARG 162 -8.446 -17.205 -3.632 1169 HB3 ARG 162 HB3 ARG 162 -8.476 -15.904 -2.444 1170 HG2 ARG 162 HG2 ARG 162 -9.718 -15.911 -5.215 1171 HG3 ARG 162 HG3 ARG 162 -10.568 -15.986 -3.691 1172 HD2 ARG 162 HD2 ARG 162 -10.481 -13.723 -3.340 1173 HD3 ARG 162 HD3 ARG 162 -8.852 -13.566 -3.958 1174 HE ARG 162 HE ARG 162 -9.611 -13.150 -6.090 1175 HH11 ARG 162 HH11 ARG 162 -11.033 -12.794 -7.697 1176 HH12 ARG 162 HH12 ARG 162 -12.755 -12.883 -7.398 1177 HH21 ARG 162 HH21 ARG 162 -12.418 -14.036 -4.174 1178 HH22 ARG 162 HH22 ARG 162 -13.521 -13.620 -5.458 1179 H ARG 163 H ARG 163 -6.533 -15.458 -1.648 1180 HA ARG 163 HA ARG 163 -3.800 -16.293 -1.494 1181 HB2 ARG 163 HB2 ARG 163 -4.082 -16.212 0.872 1182 HB3 ARG 163 HB3 ARG 163 -4.969 -14.862 0.170 1183 HG2 ARG 163 HG2 ARG 163 -7.079 -16.331 0.355 1184 HG3 ARG 163 HG3 ARG 163 -6.104 -17.447 1.327 1185 HD2 ARG 163 HD2 ARG 163 -6.832 -14.575 1.927 1186 HD3 ARG 163 HD3 ARG 163 -7.411 -16.009 2.768 1187 HE ARG 163 HE ARG 163 -4.738 -16.180 3.236 1188 HH11 ARG 163 HH11 ARG 163 -3.556 -15.142 4.895 1189 HH12 ARG 163 HH12 ARG 163 -4.113 -13.586 5.478 1190 HH21 ARG 163 HH21 ARG 163 -7.026 -13.588 3.736 1191 HH22 ARG 163 HH22 ARG 163 -6.035 -12.820 4.970 Start of MODEL 11 1 H1 GLY -4 H1 GLY -4 6.942 17.319 11.755 2 H2 GLY -4 H2 GLY -4 6.589 18.478 10.651 3 H3 GLY -4 H3 GLY -4 5.939 16.983 10.502 4 HA2 GLY -4 HA2 GLY -4 4.672 17.261 12.535 5 HA3 GLY -4 HA3 GLY -4 5.370 18.885 12.683 6 H SER -3 H SER -3 3.106 19.594 12.722 7 HA SER -3 HA SER -3 1.433 19.378 10.364 8 HB2 SER -3 HB2 SER -3 0.015 21.032 11.606 9 HB3 SER -3 HB3 SER -3 0.388 19.558 12.510 10 HG SER -3 HG SER -3 0.647 21.530 13.727 11 HA PRO -2 HA PRO -2 2.950 22.914 8.118 12 HB2 PRO -2 HB2 PRO -2 0.771 23.764 6.713 13 HB3 PRO -2 HB3 PRO -2 1.574 22.195 6.401 14 HG2 PRO -2 HG2 PRO -2 -0.885 22.716 8.112 15 HG3 PRO -2 HG3 PRO -2 -0.682 21.495 6.812 16 HD2 PRO -2 HD2 PRO -2 -0.341 20.853 9.426 17 HD3 PRO -2 HD3 PRO -2 0.710 20.148 8.164 18 H ASN -1 H ASN -1 0.336 23.357 10.406 19 HA ASN -1 HA ASN -1 1.295 26.055 11.070 20 HB2 ASN -1 HB2 ASN -1 -0.466 26.495 9.395 21 HB3 ASN -1 HB3 ASN -1 -1.596 25.460 10.274 22 HD21 ASN -1 HD21 ASN -1 -0.816 29.221 11.701 23 HD22 ASN -1 HD22 ASN -1 0.214 28.546 10.446 24 H SER 0 H SER 0 1.145 26.485 13.230 25 HA SER 0 HA SER 0 0.748 24.285 15.005 26 HB2 SER 0 HB2 SER 0 1.181 27.217 15.676 27 HB3 SER 0 HB3 SER 0 1.468 25.828 16.740 28 HG SER 0 HG SER 0 3.399 26.557 15.728 29 H MET 1 H MET 1 -1.621 26.436 13.849 30 HA MET 1 HA MET 1 -3.354 26.121 16.255 31 HB2 MET 1 HB2 MET 1 -3.549 28.251 14.093 32 HB3 MET 1 HB3 MET 1 -4.494 28.124 15.574 33 HG2 MET 1 HG2 MET 1 -2.976 29.754 16.114 34 HG3 MET 1 HG3 MET 1 -2.265 28.318 16.845 35 HE1 MET 1 HE1 MET 1 0.881 30.439 15.918 36 HE2 MET 1 HE2 MET 1 -0.684 31.015 16.530 37 HE3 MET 1 HE3 MET 1 0.033 29.525 17.185 38 H ALA 2 H ALA 2 -2.996 24.110 14.045 39 HA ALA 2 HA ALA 2 -5.553 23.902 12.751 40 HB1 ALA 2 HB1 ALA 2 -3.632 22.595 11.981 41 HB2 ALA 2 HB2 ALA 2 -3.585 21.729 13.543 42 HB3 ALA 2 HB3 ALA 2 -4.990 21.547 12.470 43 H THR 3 H THR 3 -7.358 23.214 13.419 44 HA THR 3 HA THR 3 -7.873 22.851 16.282 45 HB THR 3 HB THR 3 -10.192 23.383 15.607 46 HG1 THR 3 HG1 THR 3 -10.560 24.005 13.467 47 HG21 THR 3 HG21 THR 3 -8.537 25.190 16.137 48 HG22 THR 3 HG22 THR 3 -8.179 25.316 14.400 49 HG23 THR 3 HG23 THR 3 -9.805 25.707 15.005 50 H GLU 4 H GLU 4 -7.788 20.736 13.660 51 HA GLU 4 HA GLU 4 -10.040 19.085 14.345 52 HB2 GLU 4 HB2 GLU 4 -9.388 17.582 12.672 53 HB3 GLU 4 HB3 GLU 4 -9.078 19.202 12.063 54 HG2 GLU 4 HG2 GLU 4 -6.670 18.924 12.408 55 HG3 GLU 4 HG3 GLU 4 -6.916 17.385 13.233 56 H LEU 5 H LEU 5 -9.978 16.802 14.810 57 HA LEU 5 HA LEU 5 -8.213 16.030 17.063 58 HB2 LEU 5 HB2 LEU 5 -10.535 14.599 15.703 59 HB3 LEU 5 HB3 LEU 5 -9.623 13.979 17.077 60 HG LEU 5 HG LEU 5 -11.320 16.514 17.095 61 HD11 LEU 5 HD11 LEU 5 -11.800 13.775 18.342 62 HD12 LEU 5 HD12 LEU 5 -12.844 15.205 18.509 63 HD13 LEU 5 HD13 LEU 5 -12.646 14.438 16.925 64 HD21 LEU 5 HD21 LEU 5 -9.509 16.713 18.736 65 HD22 LEU 5 HD22 LEU 5 -11.033 16.400 19.567 66 HD23 LEU 5 HD23 LEU 5 -9.859 15.082 19.358 67 H GLU 6 H GLU 6 -6.243 15.962 16.070 68 HA GLU 6 HA GLU 6 -5.886 14.554 13.534 69 HB2 GLU 6 HB2 GLU 6 -4.861 16.830 14.609 70 HB3 GLU 6 HB3 GLU 6 -3.541 15.729 14.968 71 HG2 GLU 6 HG2 GLU 6 -4.781 16.361 12.262 72 HG3 GLU 6 HG3 GLU 6 -3.209 16.884 12.841 73 H TYR 7 H TYR 7 -6.202 12.353 13.970 74 HA TYR 7 HA TYR 7 -4.009 10.958 15.328 75 HB2 TYR 7 HB2 TYR 7 -5.404 9.660 16.751 76 HB3 TYR 7 HB3 TYR 7 -5.858 11.325 17.031 77 HD1 TYR 7 HD1 TYR 7 -8.030 12.199 16.093 78 HD2 TYR 7 HD2 TYR 7 -6.991 8.021 15.939 79 HE1 TYR 7 HE1 TYR 7 -10.382 11.641 15.508 80 HE2 TYR 7 HE2 TYR 7 -9.339 7.456 15.365 81 HH TYR 7 HH TYR 7 -11.876 9.965 15.008 82 H GLU 8 H GLU 8 -4.579 8.497 15.192 83 HA GLU 8 HA GLU 8 -6.277 7.548 13.123 84 HB2 GLU 8 HB2 GLU 8 -4.600 6.395 11.741 85 HB3 GLU 8 HB3 GLU 8 -4.601 8.120 11.497 86 HG2 GLU 8 HG2 GLU 8 -2.613 6.888 13.422 87 HG3 GLU 8 HG3 GLU 8 -2.351 6.784 11.699 88 H SER 9 H SER 9 -6.896 5.590 13.689 89 HA SER 9 HA SER 9 -5.593 4.207 15.955 90 HB2 SER 9 HB2 SER 9 -8.347 4.035 14.708 91 HB3 SER 9 HB3 SER 9 -7.795 2.974 16.023 92 HG SER 9 HG SER 9 -8.911 4.813 16.832 93 H VAL 10 H VAL 10 -4.659 2.173 15.778 94 HA VAL 10 HA VAL 10 -4.014 1.149 13.198 95 HB VAL 10 HB VAL 10 -3.852 -0.276 15.843 96 HG11 VAL 10 HG11 VAL 10 -2.410 -0.802 13.203 97 HG12 VAL 10 HG12 VAL 10 -1.996 -1.567 14.753 98 HG13 VAL 10 HG13 VAL 10 -3.563 -1.885 14.018 99 HG21 VAL 10 HG21 VAL 10 -1.701 1.340 14.408 100 HG22 VAL 10 HG22 VAL 10 -2.561 1.857 15.875 101 HG23 VAL 10 HG23 VAL 10 -1.507 0.446 15.925 102 H LEU 11 H LEU 11 -4.808 -0.309 11.906 103 HA LEU 11 HA LEU 11 -7.280 -1.842 12.612 104 HB2 LEU 11 HB2 LEU 11 -6.292 -0.918 9.882 105 HB3 LEU 11 HB3 LEU 11 -7.746 -1.848 10.202 106 HG LEU 11 HG LEU 11 -7.244 1.049 10.991 107 HD11 LEU 11 HD11 LEU 11 -7.690 0.695 8.613 108 HD12 LEU 11 HD12 LEU 11 -9.106 -0.309 8.992 109 HD13 LEU 11 HD13 LEU 11 -9.110 1.416 9.382 110 HD21 LEU 11 HD21 LEU 11 -9.644 1.044 11.688 111 HD22 LEU 11 HD22 LEU 11 -9.679 -0.723 11.496 112 HD23 LEU 11 HD23 LEU 11 -8.639 0.034 12.728 113 H CYS 12 H CYS 12 -4.138 -1.964 10.859 114 HA CYS 12 HA CYS 12 -4.005 -4.875 11.265 115 HB2 CYS 12 HB2 CYS 12 -5.201 -4.495 9.104 116 HB3 CYS 12 HB3 CYS 12 -3.734 -3.737 8.466 117 HG CYS 12 HG CYS 12 -4.016 -6.184 7.533 118 H VAL 13 H VAL 13 -1.991 -5.808 10.929 119 HA VAL 13 HA VAL 13 0.365 -4.125 10.512 120 HB VAL 13 HB VAL 13 0.100 -3.936 12.896 121 HG11 VAL 13 HG11 VAL 13 0.208 -6.964 13.142 122 HG12 VAL 13 HG12 VAL 13 0.186 -5.783 14.463 123 HG13 VAL 13 HG13 VAL 13 -1.228 -5.952 13.419 124 HG21 VAL 13 HG21 VAL 13 2.251 -4.746 13.658 125 HG22 VAL 13 HG22 VAL 13 2.354 -5.902 12.316 126 HG23 VAL 13 HG23 VAL 13 2.406 -4.153 12.000 127 H LYS 14 H LYS 14 1.742 -5.151 9.271 128 HA LYS 14 HA LYS 14 1.806 -8.144 9.251 129 HB2 LYS 14 HB2 LYS 14 2.125 -6.403 6.789 130 HB3 LYS 14 HB3 LYS 14 2.409 -8.114 6.837 131 HG2 LYS 14 HG2 LYS 14 -0.330 -6.961 7.565 132 HG3 LYS 14 HG3 LYS 14 0.180 -7.215 5.908 133 HD2 LYS 14 HD2 LYS 14 -0.904 -9.162 6.257 134 HD3 LYS 14 HD3 LYS 14 0.740 -9.645 6.640 135 HE2 LYS 14 HE2 LYS 14 0.174 -9.330 9.085 136 HE3 LYS 14 HE3 LYS 14 -1.493 -8.963 8.605 137 HZ1 LYS 14 HZ1 LYS 14 -1.762 -11.157 7.775 138 HZ2 LYS 14 HZ2 LYS 14 -0.161 -11.493 7.802 139 HZ3 LYS 14 HZ3 LYS 14 -1.013 -11.365 9.210 140 HA PRO 15 HA PRO 15 5.840 -7.274 10.612 141 HB2 PRO 15 HB2 PRO 15 6.956 -9.748 10.760 142 HB3 PRO 15 HB3 PRO 15 5.548 -9.267 11.755 143 HG2 PRO 15 HG2 PRO 15 5.521 -10.782 9.116 144 HG3 PRO 15 HG3 PRO 15 4.717 -11.234 10.656 145 HD2 PRO 15 HD2 PRO 15 3.377 -9.915 8.690 146 HD3 PRO 15 HD3 PRO 15 3.094 -9.544 10.419 147 H ASP 16 H ASP 16 5.545 -8.690 7.416 148 HA ASP 16 HA ASP 16 8.201 -7.615 6.658 149 HB2 ASP 16 HB2 ASP 16 8.519 -9.995 7.237 150 HB3 ASP 16 HB3 ASP 16 7.267 -10.447 6.076 151 H VAL 17 H VAL 17 8.104 -6.470 4.846 152 HA VAL 17 HA VAL 17 6.258 -7.084 2.654 153 HB VAL 17 HB VAL 17 4.849 -5.753 4.173 154 HG11 VAL 17 HG11 VAL 17 6.512 -4.384 5.315 155 HG12 VAL 17 HG12 VAL 17 6.858 -3.506 3.813 156 HG13 VAL 17 HG13 VAL 17 5.264 -3.372 4.576 157 HG21 VAL 17 HG21 VAL 17 4.543 -5.599 1.713 158 HG22 VAL 17 HG22 VAL 17 4.023 -4.157 2.594 159 HG23 VAL 17 HG23 VAL 17 5.557 -4.134 1.710 160 H SER 18 H SER 18 6.884 -6.079 0.694 161 HA SER 18 HA SER 18 9.463 -4.584 0.732 162 HB2 SER 18 HB2 SER 18 10.273 -5.863 -1.134 163 HB3 SER 18 HB3 SER 18 9.922 -6.917 0.234 164 HG SER 18 HG SER 18 7.763 -7.155 -0.960 165 H VAL 19 H VAL 19 9.804 -3.049 -0.836 166 HA VAL 19 HA VAL 19 7.343 -2.118 -2.276 167 HB VAL 19 HB VAL 19 9.319 -0.577 -0.617 168 HG11 VAL 19 HG11 VAL 19 7.309 0.507 -2.616 169 HG12 VAL 19 HG12 VAL 19 8.110 1.482 -1.375 170 HG13 VAL 19 HG13 VAL 19 9.074 0.754 -2.641 171 HG21 VAL 19 HG21 VAL 19 7.269 0.140 0.523 172 HG22 VAL 19 HG22 VAL 19 6.274 -0.757 -0.634 173 HG23 VAL 19 HG23 VAL 19 7.332 -1.618 0.498 174 H TYR 20 H TYR 20 7.476 -1.329 -4.201 175 HA TYR 20 HA TYR 20 10.058 -1.337 -5.715 176 HB2 TYR 20 HB2 TYR 20 7.390 -2.500 -6.638 177 HB3 TYR 20 HB3 TYR 20 8.915 -2.518 -7.506 178 HD1 TYR 20 HD1 TYR 20 7.140 -3.810 -4.471 179 HD2 TYR 20 HD2 TYR 20 10.406 -4.385 -7.221 180 HE1 TYR 20 HE1 TYR 20 7.699 -5.950 -3.361 181 HE2 TYR 20 HE2 TYR 20 10.881 -6.603 -6.161 182 HH TYR 20 HH TYR 20 9.183 -7.668 -3.217 183 H ARG 21 H ARG 21 10.048 1.014 -5.648 184 HA ARG 21 HA ARG 21 7.845 2.673 -6.376 185 HB2 ARG 21 HB2 ARG 21 10.806 3.272 -6.764 186 HB3 ARG 21 HB3 ARG 21 9.474 4.429 -6.768 187 HG2 ARG 21 HG2 ARG 21 9.045 3.259 -4.334 188 HG3 ARG 21 HG3 ARG 21 10.783 3.019 -4.458 189 HD2 ARG 21 HD2 ARG 21 11.154 5.415 -4.727 190 HD3 ARG 21 HD3 ARG 21 9.410 5.703 -4.890 191 HE ARG 21 HE ARG 21 10.079 4.446 -2.359 192 HH11 ARG 21 HH11 ARG 21 9.721 5.671 -0.430 193 HH12 ARG 21 HH12 ARG 21 9.598 7.421 -0.616 194 HH21 ARG 21 HH21 ARG 21 9.993 7.628 -3.900 195 HH22 ARG 21 HH22 ARG 21 9.727 8.395 -2.327 196 H ILE 22 H ILE 22 7.119 3.583 -8.271 197 HA ILE 22 HA ILE 22 7.926 2.100 -10.732 198 HB ILE 22 HB ILE 22 5.627 1.841 -11.348 199 HG12 ILE 22 HG12 ILE 22 4.983 3.404 -8.823 200 HG13 ILE 22 HG13 ILE 22 4.521 3.778 -10.485 201 HG21 ILE 22 HG21 ILE 22 5.928 0.949 -8.501 202 HG22 ILE 22 HG22 ILE 22 5.033 0.153 -9.779 203 HG23 ILE 22 HG23 ILE 22 6.801 0.189 -9.850 204 HD11 ILE 22 HD11 ILE 22 3.430 1.585 -8.698 205 HD12 ILE 22 HD12 ILE 22 2.582 2.975 -9.392 206 HD13 ILE 22 HD13 ILE 22 3.117 1.654 -10.454 207 HA PRO 23 HA PRO 23 7.744 6.047 -12.793 208 HB2 PRO 23 HB2 PRO 23 8.011 5.213 -15.430 209 HB3 PRO 23 HB3 PRO 23 9.320 5.492 -14.251 210 HG2 PRO 23 HG2 PRO 23 8.155 2.896 -15.164 211 HG3 PRO 23 HG3 PRO 23 9.804 3.262 -14.610 212 HD2 PRO 23 HD2 PRO 23 7.809 2.029 -13.066 213 HD3 PRO 23 HD3 PRO 23 9.269 2.832 -12.426 214 HA PRO 24 HA PRO 24 3.877 5.669 -15.502 215 HB2 PRO 24 HB2 PRO 24 2.262 3.489 -15.605 216 HB3 PRO 24 HB3 PRO 24 3.799 3.583 -16.519 217 HG2 PRO 24 HG2 PRO 24 3.337 2.302 -13.796 218 HG3 PRO 24 HG3 PRO 24 4.097 1.567 -15.247 219 HD2 PRO 24 HD2 PRO 24 5.585 2.705 -13.292 220 HD3 PRO 24 HD3 PRO 24 6.035 2.882 -15.011 221 H ARG 25 H ARG 25 1.613 6.055 -15.229 222 HA ARG 25 HA ARG 25 0.505 5.889 -12.437 223 HB2 ARG 25 HB2 ARG 25 1.001 8.188 -13.002 224 HB3 ARG 25 HB3 ARG 25 0.102 8.056 -14.525 225 HG2 ARG 25 HG2 ARG 25 -1.997 7.688 -13.315 226 HG3 ARG 25 HG3 ARG 25 -1.135 7.655 -11.764 227 HD2 ARG 25 HD2 ARG 25 -0.423 10.008 -12.124 228 HD3 ARG 25 HD3 ARG 25 -1.304 10.031 -13.668 229 HE ARG 25 HE ARG 25 -3.164 9.236 -11.718 230 HH11 ARG 25 HH11 ARG 25 -4.637 10.617 -10.781 231 HH12 ARG 25 HH12 ARG 25 -4.313 12.324 -10.723 232 HH21 ARG 25 HH21 ARG 25 -1.299 12.135 -12.345 233 HH22 ARG 25 HH22 ARG 25 -2.477 13.169 -11.585 234 H ALA 26 H ALA 26 -0.431 5.773 -15.895 235 HA ALA 26 HA ALA 26 -2.727 4.043 -15.144 236 HB1 ALA 26 HB1 ALA 26 -4.312 5.618 -16.165 237 HB2 ALA 26 HB2 ALA 26 -3.468 6.344 -14.778 238 HB3 ALA 26 HB3 ALA 26 -2.991 6.791 -16.430 239 H SER 27 H SER 27 -2.141 2.410 -16.255 240 HA SER 27 HA SER 27 -2.072 2.558 -19.244 241 HB2 SER 27 HB2 SER 27 -0.325 1.161 -18.271 242 HB3 SER 27 HB3 SER 27 -1.539 0.201 -17.403 243 HG SER 27 HG SER 27 -0.707 -0.538 -19.587 244 H ASN 28 H ASN 28 -3.478 1.097 -20.363 245 HA ASN 28 HA ASN 28 -6.213 1.377 -19.810 246 HB2 ASN 28 HB2 ASN 28 -6.530 0.126 -21.795 247 HB3 ASN 28 HB3 ASN 28 -5.048 1.036 -22.033 248 HD21 ASN 28 HD21 ASN 28 -3.079 -2.116 -21.789 249 HD22 ASN 28 HD22 ASN 28 -3.013 -0.606 -20.914 250 H ARG 29 H ARG 29 -4.081 -1.134 -18.628 251 HA ARG 29 HA ARG 29 -6.402 -2.710 -17.555 252 HB2 ARG 29 HB2 ARG 29 -3.490 -3.549 -17.493 253 HB3 ARG 29 HB3 ARG 29 -4.921 -4.548 -17.254 254 HG2 ARG 29 HG2 ARG 29 -3.892 -3.357 -19.837 255 HG3 ARG 29 HG3 ARG 29 -3.966 -5.060 -19.394 256 HD2 ARG 29 HD2 ARG 29 -6.474 -4.935 -19.413 257 HD3 ARG 29 HD3 ARG 29 -6.355 -3.236 -19.882 258 HE ARG 29 HE ARG 29 -5.690 -3.764 -22.016 259 HH11 ARG 29 HH11 ARG 29 -5.625 -5.035 -23.806 260 HH12 ARG 29 HH12 ARG 29 -5.703 -6.767 -23.669 261 HH21 ARG 29 HH21 ARG 29 -5.940 -6.787 -20.242 262 HH22 ARG 29 HH22 ARG 29 -5.880 -7.743 -21.698 263 H GLY 30 H GLY 30 -4.414 -0.278 -16.544 264 HA2 GLY 30 HA2 GLY 30 -4.777 0.498 -14.203 265 HA3 GLY 30 HA3 GLY 30 -4.399 -1.154 -13.679 266 H TYR 31 H TYR 31 -2.326 -1.632 -13.253 267 HA TYR 31 HA TYR 31 -0.149 0.288 -14.081 268 HB2 TYR 31 HB2 TYR 31 -0.664 -1.133 -11.456 269 HB3 TYR 31 HB3 TYR 31 0.915 -0.511 -11.889 270 HD1 TYR 31 HD1 TYR 31 1.404 1.828 -12.104 271 HD2 TYR 31 HD2 TYR 31 -2.498 0.401 -10.950 272 HE1 TYR 31 HE1 TYR 31 0.890 4.062 -11.108 273 HE2 TYR 31 HE2 TYR 31 -3.032 2.655 -9.967 274 HH TYR 31 HH TYR 31 -0.634 5.322 -9.954 275 H ARG 32 H ARG 32 -0.997 -3.093 -13.639 276 HA ARG 32 HA ARG 32 0.067 -5.020 -13.601 277 HB2 ARG 32 HB2 ARG 32 1.653 -4.575 -16.034 278 HB3 ARG 32 HB3 ARG 32 0.434 -5.755 -15.602 279 HG2 ARG 32 HG2 ARG 32 -0.626 -4.793 -17.337 280 HG3 ARG 32 HG3 ARG 32 -1.255 -3.772 -16.063 281 HD2 ARG 32 HD2 ARG 32 -0.681 -2.270 -17.766 282 HD3 ARG 32 HD3 ARG 32 0.639 -2.129 -16.610 283 HE ARG 32 HE ARG 32 2.108 -2.780 -18.232 284 HH11 ARG 32 HH11 ARG 32 2.839 -3.184 -20.114 285 HH12 ARG 32 HH12 ARG 32 1.860 -3.947 -21.364 286 HH21 ARG 32 HH21 ARG 32 -0.988 -3.967 -19.403 287 HH22 ARG 32 HH22 ARG 32 -0.298 -4.362 -20.955 288 H ALA 33 H ALA 33 1.493 -5.619 -12.030 289 HA ALA 33 HA ALA 33 3.992 -4.489 -11.459 290 HB1 ALA 33 HB1 ALA 33 3.323 -7.444 -11.130 291 HB2 ALA 33 HB2 ALA 33 4.430 -6.456 -10.167 292 HB3 ALA 33 HB3 ALA 33 2.694 -6.172 -10.063 293 H SER 34 H SER 34 3.199 -6.794 -13.974 294 HA SER 34 HA SER 34 5.811 -7.639 -14.765 295 HB2 SER 34 HB2 SER 34 3.548 -8.637 -15.332 296 HB3 SER 34 HB3 SER 34 3.319 -7.316 -16.484 297 HG SER 34 HG SER 34 5.264 -8.011 -17.530 298 H ASP 35 H ASP 35 4.256 -4.526 -15.208 299 HA ASP 35 HA ASP 35 5.790 -3.774 -17.584 300 HB2 ASP 35 HB2 ASP 35 3.368 -3.068 -16.732 301 HB3 ASP 35 HB3 ASP 35 4.259 -1.844 -15.842 302 H TRP 36 H TRP 36 6.399 -3.807 -14.189 303 HA TRP 36 HA TRP 36 8.779 -2.063 -14.472 304 HB2 TRP 36 HB2 TRP 36 8.092 -1.273 -12.026 305 HB3 TRP 36 HB3 TRP 36 7.620 -0.461 -13.487 306 HD1 TRP 36 HD1 TRP 36 5.159 -0.374 -14.168 307 HE1 TRP 36 HE1 TRP 36 2.944 -0.964 -13.048 308 HE3 TRP 36 HE3 TRP 36 6.962 -2.931 -10.114 309 HZ2 TRP 36 HZ2 TRP 36 2.105 -1.908 -10.435 310 HZ3 TRP 36 HZ3 TRP 36 5.425 -3.642 -8.302 311 HH2 TRP 36 HH2 TRP 36 2.999 -3.119 -8.433 312 H LYS 37 H LYS 37 9.613 -2.355 -11.773 313 HA LYS 37 HA LYS 37 10.791 -5.027 -11.891 314 HB2 LYS 37 HB2 LYS 37 10.969 -3.022 -9.625 315 HB3 LYS 37 HB3 LYS 37 12.045 -4.382 -9.975 316 HG2 LYS 37 HG2 LYS 37 12.582 -3.190 -12.200 317 HG3 LYS 37 HG3 LYS 37 11.737 -1.785 -11.540 318 HD2 LYS 37 HD2 LYS 37 14.272 -3.102 -10.550 319 HD3 LYS 37 HD3 LYS 37 14.078 -1.458 -11.143 320 HE2 LYS 37 HE2 LYS 37 12.828 -2.553 -8.588 321 HE3 LYS 37 HE3 LYS 37 14.375 -1.717 -8.635 322 HZ1 LYS 37 HZ1 LYS 37 12.553 -0.231 -8.021 323 HZ2 LYS 37 HZ2 LYS 37 13.248 0.270 -9.410 324 HZ3 LYS 37 HZ3 LYS 37 11.789 -0.482 -9.443 325 H LEU 38 H LEU 38 9.433 -6.738 -11.435 326 HA LEU 38 HA LEU 38 7.835 -6.578 -8.936 327 HB2 LEU 38 HB2 LEU 38 6.520 -8.372 -9.614 328 HB3 LEU 38 HB3 LEU 38 6.595 -7.160 -10.864 329 HG LEU 38 HG LEU 38 8.142 -8.636 -12.180 330 HD11 LEU 38 HD11 LEU 38 8.131 -11.076 -11.661 331 HD12 LEU 38 HD12 LEU 38 9.048 -10.165 -10.469 332 HD13 LEU 38 HD13 LEU 38 7.405 -10.728 -10.083 333 HD21 LEU 38 HD21 LEU 38 5.475 -9.855 -11.323 334 HD22 LEU 38 HD22 LEU 38 5.675 -8.571 -12.531 335 HD23 LEU 38 HD23 LEU 38 6.327 -10.182 -12.851 336 H ASP 39 H ASP 39 10.874 -7.509 -9.712 337 HA ASP 39 HA ASP 39 11.024 -9.731 -7.712 338 HB2 ASP 39 HB2 ASP 39 11.321 -10.385 -10.079 339 HB3 ASP 39 HB3 ASP 39 12.630 -9.218 -10.242 340 H GLN 40 H GLN 40 12.287 -6.586 -8.553 341 HA GLN 40 HA GLN 40 14.579 -6.860 -6.654 342 HB2 GLN 40 HB2 GLN 40 14.217 -5.017 -9.032 343 HB3 GLN 40 HB3 GLN 40 15.582 -4.999 -7.908 344 HG2 GLN 40 HG2 GLN 40 16.198 -7.293 -8.609 345 HG3 GLN 40 HG3 GLN 40 14.810 -7.341 -9.702 346 HE21 GLN 40 HE21 GLN 40 17.319 -6.391 -12.088 347 HE22 GLN 40 HE22 GLN 40 16.519 -7.791 -11.377 348 HA PRO 41 HA PRO 41 11.793 -3.840 -4.582 349 HB2 PRO 41 HB2 PRO 41 12.533 -4.264 -1.983 350 HB3 PRO 41 HB3 PRO 41 11.411 -5.325 -2.887 351 HG2 PRO 41 HG2 PRO 41 14.387 -5.715 -2.450 352 HG3 PRO 41 HG3 PRO 41 13.068 -6.905 -2.205 353 HD2 PRO 41 HD2 PRO 41 14.556 -6.839 -4.487 354 HD3 PRO 41 HD3 PRO 41 12.811 -7.238 -4.526 355 H ASP 42 H ASP 42 12.136 -1.812 -3.815 356 HA ASP 42 HA ASP 42 14.895 -0.689 -3.909 357 HB2 ASP 42 HB2 ASP 42 12.150 0.641 -3.875 358 HB3 ASP 42 HB3 ASP 42 13.692 1.489 -3.975 359 H TRP 43 H TRP 43 12.268 -1.417 -1.733 360 HA TRP 43 HA TRP 43 13.950 -0.838 0.589 361 HB2 TRP 43 HB2 TRP 43 12.807 1.295 0.311 362 HB3 TRP 43 HB3 TRP 43 11.258 0.494 0.125 363 HD1 TRP 43 HD1 TRP 43 13.701 1.681 2.755 364 HE1 TRP 43 HE1 TRP 43 12.613 1.556 5.077 365 HE3 TRP 43 HE3 TRP 43 9.503 -0.988 1.552 366 HZ2 TRP 43 HZ2 TRP 43 10.152 0.575 6.221 367 HZ3 TRP 43 HZ3 TRP 43 7.809 -1.528 3.281 368 HH2 TRP 43 HH2 TRP 43 8.110 -0.729 5.617 369 H THR 44 H THR 44 13.328 -2.027 2.446 370 HA THR 44 HA THR 44 10.919 -3.725 2.356 371 HB THR 44 HB THR 44 12.200 -5.665 3.171 372 HG1 THR 44 HG1 THR 44 14.452 -5.690 2.900 373 HG21 THR 44 HG21 THR 44 13.291 -4.773 0.473 374 HG22 THR 44 HG22 THR 44 13.111 -6.440 1.078 375 HG23 THR 44 HG23 THR 44 11.677 -5.458 0.754 376 H GLY 45 H GLY 45 10.112 -4.356 4.310 377 HA2 GLY 45 HA2 GLY 45 11.245 -3.799 6.861 378 HA3 GLY 45 HA3 GLY 45 10.373 -2.369 6.323 379 H ARG 46 H ARG 46 8.590 -2.289 7.373 380 HA ARG 46 HA ARG 46 6.831 -4.668 7.890 381 HB2 ARG 46 HB2 ARG 46 8.352 -4.146 9.766 382 HB3 ARG 46 HB3 ARG 46 7.773 -2.489 9.807 383 HG2 ARG 46 HG2 ARG 46 5.498 -3.331 10.479 384 HG3 ARG 46 HG3 ARG 46 6.152 -4.986 10.439 385 HD2 ARG 46 HD2 ARG 46 7.934 -4.181 12.083 386 HD3 ARG 46 HD3 ARG 46 7.027 -2.680 12.236 387 HE ARG 46 HE ARG 46 6.208 -5.414 13.122 388 HH11 ARG 46 HH11 ARG 46 5.017 -5.555 14.960 389 HH12 ARG 46 HH12 ARG 46 4.239 -4.148 15.611 390 HH21 ARG 46 HH21 ARG 46 5.312 -1.983 13.163 391 HH22 ARG 46 HH22 ARG 46 4.474 -2.183 14.676 392 H LEU 47 H LEU 47 4.608 -4.186 8.255 393 HA LEU 47 HA LEU 47 3.653 -1.641 6.977 394 HB2 LEU 47 HB2 LEU 47 3.158 -3.804 5.794 395 HB3 LEU 47 HB3 LEU 47 2.394 -4.362 7.275 396 HG LEU 47 HG LEU 47 0.765 -2.333 6.998 397 HD11 LEU 47 HD11 LEU 47 2.005 -1.162 5.229 398 HD12 LEU 47 HD12 LEU 47 1.823 -2.571 4.156 399 HD13 LEU 47 HD13 LEU 47 0.397 -1.650 4.684 400 HD21 LEU 47 HD21 LEU 47 0.122 -4.662 6.795 401 HD22 LEU 47 HD22 LEU 47 -0.695 -3.672 5.598 402 HD23 LEU 47 HD23 LEU 47 0.683 -4.694 5.108 403 H ARG 48 H ARG 48 2.326 -0.325 8.073 404 HA ARG 48 HA ARG 48 0.521 -1.537 10.105 405 HB2 ARG 48 HB2 ARG 48 2.285 0.660 10.656 406 HB3 ARG 48 HB3 ARG 48 0.690 1.357 10.425 407 HG2 ARG 48 HG2 ARG 48 1.003 0.930 12.738 408 HG3 ARG 48 HG3 ARG 48 -0.249 -0.166 12.139 409 HD2 ARG 48 HD2 ARG 48 1.270 -2.032 12.139 410 HD3 ARG 48 HD3 ARG 48 2.675 -0.999 12.395 411 HE ARG 48 HE ARG 48 0.722 -1.897 14.406 412 HH11 ARG 48 HH11 ARG 48 1.096 -1.475 16.550 413 HH12 ARG 48 HH12 ARG 48 2.342 -0.359 17.014 414 HH21 ARG 48 HH21 ARG 48 3.357 0.417 13.818 415 HH22 ARG 48 HH22 ARG 48 3.556 0.682 15.526 416 H ILE 49 H ILE 49 -1.580 -1.142 9.788 417 HA ILE 49 HA ILE 49 -2.359 0.993 7.837 418 HB ILE 49 HB ILE 49 -3.771 -1.656 8.238 419 HG12 ILE 49 HG12 ILE 49 -2.189 -0.440 5.929 420 HG13 ILE 49 HG13 ILE 49 -1.840 -1.929 6.809 421 HG21 ILE 49 HG21 ILE 49 -4.562 0.652 6.428 422 HG22 ILE 49 HG22 ILE 49 -5.417 -0.897 6.655 423 HG23 ILE 49 HG23 ILE 49 -5.358 0.243 7.979 424 HD11 ILE 49 HD11 ILE 49 -2.691 -2.529 4.682 425 HD12 ILE 49 HD12 ILE 49 -3.966 -2.908 5.854 426 HD13 ILE 49 HD13 ILE 49 -4.077 -1.449 4.818 427 H THR 50 H THR 50 -3.599 2.482 8.683 428 HA THR 50 HA THR 50 -4.762 2.151 11.418 429 HB THR 50 HB THR 50 -3.849 4.317 12.056 430 HG1 THR 50 HG1 THR 50 -2.601 4.210 9.501 431 HG21 THR 50 HG21 THR 50 -2.365 2.338 12.471 432 HG22 THR 50 HG22 THR 50 -1.524 2.688 10.950 433 HG23 THR 50 HG23 THR 50 -1.500 3.869 12.276 434 H SER 51 H SER 51 -6.422 4.019 11.842 435 HA SER 51 HA SER 51 -7.098 5.655 9.538 436 HB2 SER 51 HB2 SER 51 -9.260 4.924 9.077 437 HB3 SER 51 HB3 SER 51 -8.318 3.439 9.155 438 HG SER 51 HG SER 51 -9.089 3.302 11.405 439 H LYS 52 H LYS 52 -8.214 7.396 9.899 440 HA LYS 52 HA LYS 52 -9.053 8.117 12.674 441 HB2 LYS 52 HB2 LYS 52 -7.248 9.327 11.429 442 HB3 LYS 52 HB3 LYS 52 -8.488 9.876 10.280 443 HG2 LYS 52 HG2 LYS 52 -9.623 10.818 12.515 444 HG3 LYS 52 HG3 LYS 52 -7.997 10.653 13.154 445 HD2 LYS 52 HD2 LYS 52 -8.829 12.180 10.662 446 HD3 LYS 52 HD3 LYS 52 -8.456 12.888 12.253 447 HE2 LYS 52 HE2 LYS 52 -6.145 12.188 12.060 448 HE3 LYS 52 HE3 LYS 52 -6.469 11.368 10.532 449 HZ1 LYS 52 HZ1 LYS 52 -6.940 14.294 10.853 450 HZ2 LYS 52 HZ2 LYS 52 -5.464 13.699 10.521 451 HZ3 LYS 52 HZ3 LYS 52 -6.715 13.440 9.468 452 H GLY 53 H GLY 53 -10.610 6.467 10.780 453 HA2 GLY 53 HA2 GLY 53 -12.894 6.082 10.456 454 HA3 GLY 53 HA3 GLY 53 -13.266 7.704 11.029 455 H LYS 54 H LYS 54 -13.602 5.826 8.444 456 HA LYS 54 HA LYS 54 -13.591 5.791 6.211 457 HB2 LYS 54 HB2 LYS 54 -15.397 7.479 6.675 458 HB3 LYS 54 HB3 LYS 54 -14.217 8.754 6.309 459 HG2 LYS 54 HG2 LYS 54 -13.907 7.716 4.026 460 HG3 LYS 54 HG3 LYS 54 -15.153 6.522 4.452 461 HD2 LYS 54 HD2 LYS 54 -16.771 8.379 4.769 462 HD3 LYS 54 HD3 LYS 54 -15.533 9.548 4.308 463 HE2 LYS 54 HE2 LYS 54 -16.559 7.283 2.521 464 HE3 LYS 54 HE3 LYS 54 -17.152 8.946 2.477 465 HZ1 LYS 54 HZ1 LYS 54 -14.841 9.639 1.918 466 HZ2 LYS 54 HZ2 LYS 54 -14.395 8.062 1.762 467 HZ3 LYS 54 HZ3 LYS 54 -15.516 8.694 0.775 468 H THR 55 H THR 55 -11.353 8.300 7.271 469 HA THR 55 HA THR 55 -9.689 7.532 4.927 470 HB THR 55 HB THR 55 -8.696 9.465 7.006 471 HG1 THR 55 HG1 THR 55 -9.729 11.123 5.898 472 HG21 THR 55 HG21 THR 55 -8.608 9.175 3.966 473 HG22 THR 55 HG22 THR 55 -7.678 10.383 4.905 474 HG23 THR 55 HG23 THR 55 -7.330 8.644 5.072 475 H ALA 56 H ALA 56 -8.705 5.737 5.062 476 HA ALA 56 HA ALA 56 -7.285 4.984 7.550 477 HB1 ALA 56 HB1 ALA 56 -7.672 3.409 4.990 478 HB2 ALA 56 HB2 ALA 56 -6.705 2.889 6.377 479 HB3 ALA 56 HB3 ALA 56 -8.449 3.124 6.551 480 H TYR 57 H TYR 57 -4.968 4.567 7.427 481 HA TYR 57 HA TYR 57 -3.524 6.136 5.354 482 HB2 TYR 57 HB2 TYR 57 -3.064 6.304 8.353 483 HB3 TYR 57 HB3 TYR 57 -2.086 7.063 7.113 484 HD1 TYR 57 HD1 TYR 57 -2.683 9.231 6.260 485 HD2 TYR 57 HD2 TYR 57 -5.457 7.059 8.748 486 HE1 TYR 57 HE1 TYR 57 -4.124 11.254 6.434 487 HE2 TYR 57 HE2 TYR 57 -6.922 9.050 8.853 488 HH TYR 57 HH TYR 57 -6.083 12.129 7.223 489 H ILE 58 H ILE 58 -2.401 4.610 4.348 490 HA ILE 58 HA ILE 58 -1.410 2.180 5.675 491 HB ILE 58 HB ILE 58 -0.336 3.340 3.089 492 HG12 ILE 58 HG12 ILE 58 -2.693 3.299 2.655 493 HG13 ILE 58 HG13 ILE 58 -1.866 2.045 1.758 494 HG21 ILE 58 HG21 ILE 58 -0.496 0.522 4.200 495 HG22 ILE 58 HG22 ILE 58 0.163 0.970 2.609 496 HG23 ILE 58 HG23 ILE 58 0.954 1.533 4.080 497 HD11 ILE 58 HD11 ILE 58 -4.017 1.304 2.639 498 HD12 ILE 58 HD12 ILE 58 -2.695 0.326 3.307 499 HD13 ILE 58 HD13 ILE 58 -3.474 1.581 4.307 500 H LYS 59 H LYS 59 0.235 2.296 7.065 501 HA LYS 59 HA LYS 59 2.417 4.343 6.723 502 HB2 LYS 59 HB2 LYS 59 2.006 2.573 9.130 503 HB3 LYS 59 HB3 LYS 59 3.003 3.999 9.017 504 HG2 LYS 59 HG2 LYS 59 -0.056 3.982 8.984 505 HG3 LYS 59 HG3 LYS 59 0.961 4.278 10.388 506 HD2 LYS 59 HD2 LYS 59 1.930 6.282 9.290 507 HD3 LYS 59 HD3 LYS 59 0.842 6.037 7.900 508 HE2 LYS 59 HE2 LYS 59 -1.123 6.321 9.288 509 HE3 LYS 59 HE3 LYS 59 -0.171 6.247 10.767 510 HZ1 LYS 59 HZ1 LYS 59 0.836 8.353 10.213 511 HZ2 LYS 59 HZ2 LYS 59 0.083 8.443 8.775 512 HZ3 LYS 59 HZ3 LYS 59 -0.783 8.539 10.180 513 H LEU 60 H LEU 60 4.438 3.670 6.152 514 HA LEU 60 HA LEU 60 5.054 0.734 6.296 515 HB2 LEU 60 HB2 LEU 60 5.969 2.850 4.330 516 HB3 LEU 60 HB3 LEU 60 6.699 1.249 4.468 517 HG LEU 60 HG LEU 60 3.728 1.634 3.886 518 HD11 LEU 60 HD11 LEU 60 6.054 1.302 1.967 519 HD12 LEU 60 HD12 LEU 60 4.339 1.131 1.522 520 HD13 LEU 60 HD13 LEU 60 4.954 2.690 2.089 521 HD21 LEU 60 HD21 LEU 60 3.891 -0.676 3.038 522 HD22 LEU 60 HD22 LEU 60 5.614 -0.729 3.469 523 HD23 LEU 60 HD23 LEU 60 4.377 -0.616 4.735 524 H GLU 61 H GLU 61 6.614 0.117 7.559 525 HA GLU 61 HA GLU 61 8.025 2.199 9.179 526 HB2 GLU 61 HB2 GLU 61 6.819 -0.476 9.943 527 HB3 GLU 61 HB3 GLU 61 7.722 0.574 11.036 528 HG2 GLU 61 HG2 GLU 61 5.979 2.311 10.814 529 HG3 GLU 61 HG3 GLU 61 5.060 1.260 9.725 530 H ASP 62 H ASP 62 10.152 1.766 9.941 531 HA ASP 62 HA ASP 62 11.754 -0.237 8.609 532 HB2 ASP 62 HB2 ASP 62 12.679 1.914 9.260 533 HB3 ASP 62 HB3 ASP 62 12.204 1.662 10.943 534 H LYS 63 H LYS 63 12.185 -2.265 9.277 535 HA LYS 63 HA LYS 63 10.444 -3.544 11.143 536 HB2 LYS 63 HB2 LYS 63 11.500 -4.430 9.008 537 HB3 LYS 63 HB3 LYS 63 12.997 -4.662 9.914 538 HG2 LYS 63 HG2 LYS 63 11.790 -6.242 11.430 539 HG3 LYS 63 HG3 LYS 63 10.301 -5.985 10.511 540 HD2 LYS 63 HD2 LYS 63 12.906 -7.095 9.365 541 HD3 LYS 63 HD3 LYS 63 11.574 -8.088 9.968 542 HE2 LYS 63 HE2 LYS 63 10.052 -7.152 8.277 543 HE3 LYS 63 HE3 LYS 63 11.333 -6.104 7.662 544 HZ1 LYS 63 HZ1 LYS 63 12.575 -8.044 6.986 545 HZ2 LYS 63 HZ2 LYS 63 11.507 -9.064 7.688 546 HZ3 LYS 63 HZ3 LYS 63 11.057 -8.202 6.380 547 H VAL 64 H VAL 64 13.272 -1.821 11.865 548 HA VAL 64 HA VAL 64 13.989 -3.477 14.242 549 HB VAL 64 HB VAL 64 15.670 -1.220 13.133 550 HG11 VAL 64 HG11 VAL 64 16.352 -3.804 14.587 551 HG12 VAL 64 HG12 VAL 64 17.497 -2.533 14.102 552 HG13 VAL 64 HG13 VAL 64 16.262 -2.183 15.317 553 HG21 VAL 64 HG21 VAL 64 15.674 -4.077 12.080 554 HG22 VAL 64 HG22 VAL 64 15.345 -2.586 11.157 555 HG23 VAL 64 HG23 VAL 64 16.961 -2.877 11.798 556 H SER 65 H SER 65 13.175 -0.176 13.176 557 HA SER 65 HA SER 65 12.946 0.599 16.055 558 HB2 SER 65 HB2 SER 65 13.983 2.214 13.703 559 HB3 SER 65 HB3 SER 65 13.772 2.835 15.354 560 HG SER 65 HG SER 65 15.925 2.125 14.935 561 H GLY 66 H GLY 66 10.980 0.177 13.384 562 HA2 GLY 66 HA2 GLY 66 8.796 0.739 13.023 563 HA3 GLY 66 HA3 GLY 66 8.764 1.574 14.577 564 H GLU 67 H GLU 67 11.216 2.746 12.449 565 HA GLU 67 HA GLU 67 10.003 5.374 12.414 566 HB2 GLU 67 HB2 GLU 67 12.509 4.332 11.037 567 HB3 GLU 67 HB3 GLU 67 12.012 6.028 11.120 568 HG2 GLU 67 HG2 GLU 67 12.069 5.884 13.628 569 HG3 GLU 67 HG3 GLU 67 12.708 4.245 13.491 570 H LEU 68 H LEU 68 9.105 6.570 10.743 571 HA LEU 68 HA LEU 68 7.722 4.994 8.798 572 HB2 LEU 68 HB2 LEU 68 6.861 7.042 10.066 573 HB3 LEU 68 HB3 LEU 68 7.826 8.020 8.965 574 HG LEU 68 HG LEU 68 6.522 6.858 7.044 575 HD11 LEU 68 HD11 LEU 68 4.283 6.003 7.663 576 HD12 LEU 68 HD12 LEU 68 5.541 4.997 8.382 577 HD13 LEU 68 HD13 LEU 68 4.677 6.176 9.386 578 HD21 LEU 68 HD21 LEU 68 6.119 9.186 7.738 579 HD22 LEU 68 HD22 LEU 68 4.609 8.379 7.292 580 HD23 LEU 68 HD23 LEU 68 5.006 8.628 9.007 581 H PHE 69 H PHE 69 8.385 4.356 6.909 582 HA PHE 69 HA PHE 69 10.506 5.648 5.284 583 HB2 PHE 69 HB2 PHE 69 10.534 3.298 5.306 584 HB3 PHE 69 HB3 PHE 69 8.794 3.168 5.117 585 HD1 PHE 69 HD1 PHE 69 8.105 2.320 3.093 586 HD2 PHE 69 HD2 PHE 69 11.606 4.824 3.191 587 HE1 PHE 69 HE1 PHE 69 8.373 2.025 0.668 588 HE2 PHE 69 HE2 PHE 69 11.853 4.578 0.755 589 HZ PHE 69 HZ PHE 69 10.232 3.143 -0.543 590 H ALA 70 H ALA 70 6.996 4.987 5.022 591 HA ALA 70 HA ALA 70 6.502 7.472 3.568 592 HB1 ALA 70 HB1 ALA 70 6.061 4.753 2.233 593 HB2 ALA 70 HB2 ALA 70 5.455 6.301 1.628 594 HB3 ALA 70 HB3 ALA 70 7.204 6.007 1.702 595 H GLN 71 H GLN 71 4.170 7.790 3.186 596 HA GLN 71 HA GLN 71 2.391 5.790 4.308 597 HB2 GLN 71 HB2 GLN 71 1.055 7.376 5.641 598 HB3 GLN 71 HB3 GLN 71 2.678 7.152 6.281 599 HG2 GLN 71 HG2 GLN 71 3.391 9.307 5.263 600 HG3 GLN 71 HG3 GLN 71 1.769 9.546 4.608 601 HE21 GLN 71 HE21 GLN 71 2.178 11.360 7.919 602 HE22 GLN 71 HE22 GLN 71 3.190 11.322 6.485 603 H ALA 72 H ALA 72 0.272 5.831 3.506 604 HA ALA 72 HA ALA 72 -0.280 7.807 1.330 605 HB1 ALA 72 HB1 ALA 72 -0.818 4.826 1.226 606 HB2 ALA 72 HB2 ALA 72 -1.370 6.020 0.041 607 HB3 ALA 72 HB3 ALA 72 0.360 5.742 0.252 608 HA PRO 73 HA PRO 73 -4.142 7.853 3.892 609 HB2 PRO 73 HB2 PRO 73 -5.139 10.255 3.078 610 HB3 PRO 73 HB3 PRO 73 -3.791 10.114 4.241 611 HG2 PRO 73 HG2 PRO 73 -3.612 10.657 1.276 612 HG3 PRO 73 HG3 PRO 73 -2.773 11.497 2.613 613 HD2 PRO 73 HD2 PRO 73 -1.598 9.509 1.141 614 HD3 PRO 73 HD3 PRO 73 -1.229 9.751 2.872 615 H VAL 74 H VAL 74 -6.080 6.909 3.297 616 HA VAL 74 HA VAL 74 -6.938 7.056 0.429 617 HB VAL 74 HB VAL 74 -5.967 4.941 0.830 618 HG11 VAL 74 HG11 VAL 74 -6.847 3.194 2.255 619 HG12 VAL 74 HG12 VAL 74 -6.205 4.543 3.191 620 HG13 VAL 74 HG13 VAL 74 -7.967 4.351 2.995 621 HG21 VAL 74 HG21 VAL 74 -8.991 4.628 0.683 622 HG22 VAL 74 HG22 VAL 74 -7.948 5.086 -0.679 623 HG23 VAL 74 HG23 VAL 74 -7.805 3.491 0.065 624 H GLU 75 H GLU 75 -8.897 7.776 0.073 625 HA GLU 75 HA GLU 75 -10.870 7.874 2.316 626 HB2 GLU 75 HB2 GLU 75 -10.565 9.605 -0.169 627 HB3 GLU 75 HB3 GLU 75 -11.918 9.713 0.960 628 HG2 GLU 75 HG2 GLU 75 -10.385 10.286 2.797 629 HG3 GLU 75 HG3 GLU 75 -9.005 10.198 1.695 630 H GLN 76 H GLN 76 -10.250 6.135 -0.498 631 HA GLN 76 HA GLN 76 -12.749 4.823 -0.390 632 HB2 GLN 76 HB2 GLN 76 -13.084 5.136 -3.001 633 HB3 GLN 76 HB3 GLN 76 -13.845 6.178 -1.812 634 HG2 GLN 76 HG2 GLN 76 -13.067 7.459 -3.705 635 HG3 GLN 76 HG3 GLN 76 -12.254 7.964 -2.238 636 HE21 GLN 76 HE21 GLN 76 -9.036 7.264 -3.545 637 HE22 GLN 76 HE22 GLN 76 -9.994 7.948 -2.241 638 H TYR 77 H TYR 77 -12.688 2.833 -1.224 639 HA TYR 77 HA TYR 77 -10.269 1.872 -2.652 640 HB2 TYR 77 HB2 TYR 77 -10.171 1.429 -0.191 641 HB3 TYR 77 HB3 TYR 77 -11.640 0.465 -0.335 642 HD1 TYR 77 HD1 TYR 77 -10.894 -1.781 0.231 643 HD2 TYR 77 HD2 TYR 77 -8.538 0.635 -2.447 644 HE1 TYR 77 HE1 TYR 77 -9.386 -3.682 -0.184 645 HE2 TYR 77 HE2 TYR 77 -7.008 -1.212 -2.800 646 HH TYR 77 HH TYR 77 -6.554 -3.453 -2.364 647 HA PRO 78 HA PRO 78 -9.621 0.334 -4.275 648 HB2 PRO 78 HB2 PRO 78 -9.948 0.132 -6.957 649 HB3 PRO 78 HB3 PRO 78 -10.064 -1.270 -5.850 650 HG2 PRO 78 HG2 PRO 78 -12.340 0.410 -6.961 651 HG3 PRO 78 HG3 PRO 78 -12.182 -1.377 -6.966 652 HD2 PRO 78 HD2 PRO 78 -13.613 -0.099 -5.052 653 HD3 PRO 78 HD3 PRO 78 -12.602 -1.513 -4.638 654 H GLY 79 H GLY 79 -8.314 1.961 -5.275 655 HA2 GLY 79 HA2 GLY 79 -9.471 4.313 -6.554 656 HA3 GLY 79 HA3 GLY 79 -9.007 4.581 -4.873 657 H ILE 80 H ILE 80 -7.603 6.197 -5.969 658 HA ILE 80 HA ILE 80 -5.261 5.215 -7.428 659 HB ILE 80 HB ILE 80 -6.400 7.372 -7.961 660 HG12 ILE 80 HG12 ILE 80 -4.437 8.748 -8.321 661 HG13 ILE 80 HG13 ILE 80 -3.505 7.813 -7.156 662 HG21 ILE 80 HG21 ILE 80 -5.143 8.424 -5.382 663 HG22 ILE 80 HG22 ILE 80 -6.013 9.367 -6.599 664 HG23 ILE 80 HG23 ILE 80 -6.885 8.163 -5.645 665 HD11 ILE 80 HD11 ILE 80 -3.519 5.868 -8.615 666 HD12 ILE 80 HD12 ILE 80 -4.674 6.652 -9.725 667 HD13 ILE 80 HD13 ILE 80 -3.020 7.274 -9.563 668 H ALA 81 H ALA 81 -6.136 5.811 -4.129 669 HA ALA 81 HA ALA 81 -3.389 5.992 -3.203 670 HB1 ALA 81 HB1 ALA 81 -6.035 5.737 -1.692 671 HB2 ALA 81 HB2 ALA 81 -4.442 6.065 -0.964 672 HB3 ALA 81 HB3 ALA 81 -5.197 7.255 -2.061 673 H VAL 82 H VAL 82 -5.550 3.397 -3.925 674 HA VAL 82 HA VAL 82 -3.509 1.472 -3.351 675 HB VAL 82 HB VAL 82 -4.154 1.557 -1.145 676 HG11 VAL 82 HG11 VAL 82 -6.040 2.256 -0.458 677 HG12 VAL 82 HG12 VAL 82 -6.865 1.922 -1.980 678 HG13 VAL 82 HG13 VAL 82 -6.687 0.644 -0.747 679 HG21 VAL 82 HG21 VAL 82 -3.438 -0.498 -1.863 680 HG22 VAL 82 HG22 VAL 82 -4.761 -0.760 -0.714 681 HG23 VAL 82 HG23 VAL 82 -5.007 -0.984 -2.461 682 H GLU 83 H GLU 83 -3.571 0.245 -5.019 683 HA GLU 83 HA GLU 83 -6.109 -0.748 -6.243 684 HB2 GLU 83 HB2 GLU 83 -4.451 1.328 -7.270 685 HB3 GLU 83 HB3 GLU 83 -3.983 -0.094 -8.183 686 HG2 GLU 83 HG2 GLU 83 -6.844 0.913 -7.866 687 HG3 GLU 83 HG3 GLU 83 -5.772 1.306 -9.211 688 H THR 84 H THR 84 -5.893 -2.676 -7.527 689 HA THR 84 HA THR 84 -3.449 -4.324 -6.921 690 HB THR 84 HB THR 84 -5.939 -5.485 -8.027 691 HG1 THR 84 HG1 THR 84 -6.595 -5.926 -5.862 692 HG21 THR 84 HG21 THR 84 -5.139 -7.451 -6.799 693 HG22 THR 84 HG22 THR 84 -3.893 -6.830 -7.891 694 HG23 THR 84 HG23 THR 84 -3.792 -6.491 -6.144 695 H VAL 85 H VAL 85 -2.296 -3.397 -8.358 696 HA VAL 85 HA VAL 85 -1.364 -3.026 -10.547 697 HB VAL 85 HB VAL 85 -0.350 -5.351 -10.977 698 HG11 VAL 85 HG11 VAL 85 -0.065 -3.968 -8.267 699 HG12 VAL 85 HG12 VAL 85 1.131 -5.033 -9.017 700 HG13 VAL 85 HG13 VAL 85 0.733 -3.491 -9.779 701 HG21 VAL 85 HG21 VAL 85 -2.124 -6.681 -9.690 702 HG22 VAL 85 HG22 VAL 85 -0.445 -6.972 -9.233 703 HG23 VAL 85 HG23 VAL 85 -1.475 -5.956 -8.215 704 H THR 86 H THR 86 -2.969 -6.118 -11.080 705 HA THR 86 HA THR 86 -4.749 -4.902 -12.998 706 HB THR 86 HB THR 86 -4.665 -6.800 -14.604 707 HG1 THR 86 HG1 THR 86 -2.873 -8.043 -14.736 708 HG21 THR 86 HG21 THR 86 -1.990 -5.368 -14.448 709 HG22 THR 86 HG22 THR 86 -2.823 -5.916 -15.923 710 HG23 THR 86 HG23 THR 86 -3.462 -4.541 -14.985 711 H ASP 87 H ASP 87 -3.702 -7.971 -11.523 712 HA ASP 87 HA ASP 87 -6.387 -8.339 -10.309 713 HB2 ASP 87 HB2 ASP 87 -6.506 -9.320 -12.640 714 HB3 ASP 87 HB3 ASP 87 -5.267 -10.467 -12.138 715 H SER 88 H SER 88 -3.420 -10.357 -10.899 716 HA SER 88 HA SER 88 -3.409 -11.737 -8.511 717 HB2 SER 88 HB2 SER 88 -1.587 -12.092 -10.140 718 HB3 SER 88 HB3 SER 88 -0.773 -10.645 -9.534 719 HG SER 88 HG SER 88 -0.761 -13.095 -8.627 720 H SER 89 H SER 89 -3.496 -11.227 -6.485 721 HA SER 89 HA SER 89 -2.860 -8.480 -5.674 722 HB2 SER 89 HB2 SER 89 -4.507 -8.726 -4.047 723 HB3 SER 89 HB3 SER 89 -5.104 -9.395 -5.584 724 HG SER 89 HG SER 89 -5.525 -10.645 -3.647 725 H ARG 90 H ARG 90 -0.924 -11.005 -5.632 726 HA ARG 90 HA ARG 90 0.226 -10.698 -2.958 727 HB2 ARG 90 HB2 ARG 90 2.091 -11.829 -3.712 728 HB3 ARG 90 HB3 ARG 90 0.774 -12.606 -4.578 729 HG2 ARG 90 HG2 ARG 90 1.317 -11.303 -6.617 730 HG3 ARG 90 HG3 ARG 90 2.612 -10.479 -5.756 731 HD2 ARG 90 HD2 ARG 90 2.479 -13.383 -6.560 732 HD3 ARG 90 HD3 ARG 90 3.632 -12.172 -7.099 733 HE ARG 90 HE ARG 90 4.046 -13.939 -5.022 734 HH11 ARG 90 HH11 ARG 90 5.184 -13.838 -3.257 735 HH12 ARG 90 HH12 ARG 90 5.682 -12.287 -2.591 736 HH21 ARG 90 HH21 ARG 90 4.456 -10.438 -5.178 737 HH22 ARG 90 HH22 ARG 90 5.421 -10.471 -3.716 738 H TYR 91 H TYR 91 -0.028 -8.658 -5.661 739 HA TYR 91 HA TYR 91 1.834 -6.698 -4.440 740 HB2 TYR 91 HB2 TYR 91 0.957 -6.695 -7.340 741 HB3 TYR 91 HB3 TYR 91 2.234 -5.739 -6.625 742 HD1 TYR 91 HD1 TYR 91 4.381 -6.939 -5.873 743 HD2 TYR 91 HD2 TYR 91 1.341 -8.764 -8.331 744 HE1 TYR 91 HE1 TYR 91 6.029 -8.654 -6.647 745 HE2 TYR 91 HE2 TYR 91 2.947 -10.463 -9.089 746 HH TYR 91 HH TYR 91 6.379 -10.447 -7.929 747 H PHE 92 H PHE 92 1.274 -4.533 -4.640 748 HA PHE 92 HA PHE 92 -1.411 -3.764 -5.579 749 HB2 PHE 92 HB2 PHE 92 -0.386 -2.979 -2.822 750 HB3 PHE 92 HB3 PHE 92 -1.850 -2.377 -3.589 751 HD1 PHE 92 HD1 PHE 92 -3.735 -4.020 -4.160 752 HD2 PHE 92 HD2 PHE 92 -0.403 -5.028 -1.617 753 HE1 PHE 92 HE1 PHE 92 -5.010 -5.956 -3.265 754 HE2 PHE 92 HE2 PHE 92 -1.722 -6.903 -0.650 755 HZ PHE 92 HZ PHE 92 -3.993 -7.413 -1.523 756 H VAL 93 H VAL 93 -1.527 -1.314 -5.620 757 HA VAL 93 HA VAL 93 1.113 0.061 -5.681 758 HB VAL 93 HB VAL 93 -1.125 0.414 -7.714 759 HG11 VAL 93 HG11 VAL 93 1.384 2.076 -7.222 760 HG12 VAL 93 HG12 VAL 93 0.417 2.132 -8.700 761 HG13 VAL 93 HG13 VAL 93 -0.312 2.627 -7.180 762 HG21 VAL 93 HG21 VAL 93 0.376 -1.456 -8.242 763 HG22 VAL 93 HG22 VAL 93 0.673 -0.109 -9.342 764 HG23 VAL 93 HG23 VAL 93 1.796 -0.414 -8.008 765 H ILE 94 H ILE 94 1.132 1.854 -4.419 766 HA ILE 94 HA ILE 94 -1.457 3.118 -3.703 767 HB ILE 94 HB ILE 94 -0.823 3.462 -1.419 768 HG12 ILE 94 HG12 ILE 94 1.722 1.848 -1.911 769 HG13 ILE 94 HG13 ILE 94 1.651 3.596 -1.712 770 HG21 ILE 94 HG21 ILE 94 -1.137 1.271 -0.556 771 HG22 ILE 94 HG22 ILE 94 -1.894 1.251 -2.130 772 HG23 ILE 94 HG23 ILE 94 -0.313 0.496 -1.928 773 HD11 ILE 94 HD11 ILE 94 0.848 1.564 0.394 774 HD12 ILE 94 HD12 ILE 94 2.283 2.606 0.405 775 HD13 ILE 94 HD13 ILE 94 0.664 3.311 0.550 776 H ARG 95 H ARG 95 -1.478 5.329 -3.763 777 HA ARG 95 HA ARG 95 1.053 6.706 -4.498 778 HB2 ARG 95 HB2 ARG 95 -0.047 8.498 -5.280 779 HB3 ARG 95 HB3 ARG 95 -1.091 7.158 -5.710 780 HG2 ARG 95 HG2 ARG 95 -2.591 8.763 -5.102 781 HG3 ARG 95 HG3 ARG 95 -2.488 7.775 -3.654 782 HD2 ARG 95 HD2 ARG 95 -0.858 9.513 -2.714 783 HD3 ARG 95 HD3 ARG 95 -1.170 10.475 -4.158 784 HE ARG 95 HE ARG 95 -3.240 11.081 -3.268 785 HH11 ARG 95 HH11 ARG 95 -4.982 11.012 -1.809 786 HH12 ARG 95 HH12 ARG 95 -4.977 9.775 -0.565 787 HH21 ARG 95 HH21 ARG 95 -2.035 8.336 -1.407 788 HH22 ARG 95 HH22 ARG 95 -3.458 8.370 -0.365 789 H ILE 96 H ILE 96 2.366 7.332 -3.007 790 HA ILE 96 HA ILE 96 1.462 7.731 -0.196 791 HB ILE 96 HB ILE 96 3.851 7.640 0.370 792 HG12 ILE 96 HG12 ILE 96 4.473 6.712 -2.453 793 HG13 ILE 96 HG13 ILE 96 4.623 8.414 -2.001 794 HG21 ILE 96 HG21 ILE 96 2.921 5.244 -1.232 795 HG22 ILE 96 HG22 ILE 96 4.186 5.222 -0.002 796 HG23 ILE 96 HG23 ILE 96 2.535 5.584 0.477 797 HD11 ILE 96 HD11 ILE 96 6.131 6.115 -0.753 798 HD12 ILE 96 HD12 ILE 96 6.767 7.396 -1.807 799 HD13 ILE 96 HD13 ILE 96 6.166 7.802 -0.181 800 H GLN 97 H GLN 97 2.390 9.487 1.022 801 HA GLN 97 HA GLN 97 3.582 11.716 -0.561 802 HB2 GLN 97 HB2 GLN 97 2.607 11.644 2.310 803 HB3 GLN 97 HB3 GLN 97 3.778 12.820 1.715 804 HG2 GLN 97 HG2 GLN 97 1.902 13.067 -0.243 805 HG3 GLN 97 HG3 GLN 97 0.858 12.598 1.101 806 HE21 GLN 97 HE21 GLN 97 2.912 16.196 1.167 807 HE22 GLN 97 HE22 GLN 97 3.503 14.850 0.176 808 H ASP 98 H ASP 98 5.735 12.102 -0.448 809 HA ASP 98 HA ASP 98 7.387 9.941 0.686 810 HB2 ASP 98 HB2 ASP 98 7.661 11.078 -1.622 811 HB3 ASP 98 HB3 ASP 98 8.417 12.398 -0.722 812 H GLY 99 H GLY 99 6.064 12.649 1.991 813 HA2 GLY 99 HA2 GLY 99 6.285 13.458 4.161 814 HA3 GLY 99 HA3 GLY 99 7.796 12.568 4.350 815 H THR 100 H THR 100 7.914 14.463 1.547 816 HA THR 100 HA THR 100 9.421 16.657 2.921 817 HB THR 100 HB THR 100 10.914 16.682 0.969 818 HG1 THR 100 HG1 THR 100 10.774 14.916 -0.461 819 HG21 THR 100 HG21 THR 100 11.451 15.233 2.947 820 HG22 THR 100 HG22 THR 100 10.688 13.863 2.103 821 HG23 THR 100 HG23 THR 100 12.128 14.645 1.417 822 H GLY 101 H GLY 101 6.543 16.576 1.945 823 HA2 GLY 101 HA2 GLY 101 5.131 18.331 1.280 824 HA3 GLY 101 HA3 GLY 101 6.499 19.208 0.593 825 H ARG 102 H ARG 102 6.182 15.872 -0.269 826 HA ARG 102 HA ARG 102 4.987 16.473 -2.938 827 HB2 ARG 102 HB2 ARG 102 6.736 15.479 -4.091 828 HB3 ARG 102 HB3 ARG 102 7.493 16.552 -2.902 829 HG2 ARG 102 HG2 ARG 102 7.882 14.576 -1.427 830 HG3 ARG 102 HG3 ARG 102 7.253 13.507 -2.692 831 HD2 ARG 102 HD2 ARG 102 9.518 15.463 -3.129 832 HD3 ARG 102 HD3 ARG 102 9.778 13.781 -2.605 833 HE ARG 102 HE ARG 102 8.162 13.661 -4.912 834 HH11 ARG 102 HH11 ARG 102 8.939 13.226 -6.947 835 HH12 ARG 102 HH12 ARG 102 10.616 13.497 -7.313 836 HH21 ARG 102 HH21 ARG 102 11.441 14.648 -4.189 837 HH22 ARG 102 HH22 ARG 102 12.005 14.286 -5.797 838 H SER 103 H SER 103 4.589 14.458 -4.201 839 HA SER 103 HA SER 103 3.845 12.103 -2.544 840 HB2 SER 103 HB2 SER 103 2.184 13.253 -4.819 841 HB3 SER 103 HB3 SER 103 1.810 11.793 -3.885 842 HG SER 103 HG SER 103 0.682 13.691 -3.153 843 H ALA 104 H ALA 104 3.708 10.079 -3.705 844 HA ALA 104 HA ALA 104 4.878 9.867 -6.397 845 HB1 ALA 104 HB1 ALA 104 6.696 8.364 -5.661 846 HB2 ALA 104 HB2 ALA 104 6.891 9.980 -4.957 847 HB3 ALA 104 HB3 ALA 104 6.258 8.649 -3.964 848 H PHE 105 H PHE 105 4.482 7.849 -7.413 849 HA PHE 105 HA PHE 105 2.605 6.025 -5.998 850 HB2 PHE 105 HB2 PHE 105 3.582 5.857 -8.855 851 HB3 PHE 105 HB3 PHE 105 2.279 4.942 -8.104 852 HD1 PHE 105 HD1 PHE 105 3.192 8.006 -9.803 853 HD2 PHE 105 HD2 PHE 105 0.165 6.200 -7.296 854 HE1 PHE 105 HE1 PHE 105 1.620 9.824 -10.392 855 HE2 PHE 105 HE2 PHE 105 -1.400 8.014 -7.920 856 HZ PHE 105 HZ PHE 105 -0.699 9.826 -9.450 857 H ILE 106 H ILE 106 3.212 4.164 -5.126 858 HA ILE 106 HA ILE 106 5.696 2.853 -6.118 859 HB ILE 106 HB ILE 106 6.307 1.968 -4.004 860 HG12 ILE 106 HG12 ILE 106 3.900 3.509 -2.871 861 HG13 ILE 106 HG13 ILE 106 4.080 1.756 -2.923 862 HG21 ILE 106 HG21 ILE 106 5.842 4.967 -3.591 863 HG22 ILE 106 HG22 ILE 106 7.183 3.980 -2.980 864 HG23 ILE 106 HG23 ILE 106 7.044 4.321 -4.713 865 HD11 ILE 106 HD11 ILE 106 4.400 2.621 -0.679 866 HD12 ILE 106 HD12 ILE 106 5.849 1.819 -1.273 867 HD13 ILE 106 HD13 ILE 106 5.774 3.598 -1.205 868 H GLY 107 H GLY 107 5.632 0.756 -6.508 869 HA2 GLY 107 HA2 GLY 107 3.146 -0.794 -6.213 870 HA3 GLY 107 HA3 GLY 107 4.673 -1.334 -6.922 871 H ILE 108 H ILE 108 3.042 -2.537 -4.803 872 HA ILE 108 HA ILE 108 5.197 -2.838 -2.770 873 HB ILE 108 HB ILE 108 2.212 -3.171 -2.216 874 HG12 ILE 108 HG12 ILE 108 4.206 -0.943 -1.592 875 HG13 ILE 108 HG13 ILE 108 2.665 -0.811 -2.437 876 HG21 ILE 108 HG21 ILE 108 4.653 -3.340 -0.404 877 HG22 ILE 108 HG22 ILE 108 2.958 -3.524 0.113 878 HG23 ILE 108 HG23 ILE 108 3.664 -4.724 -0.931 879 HD11 ILE 108 HD11 ILE 108 3.071 -1.323 0.530 880 HD12 ILE 108 HD12 ILE 108 2.462 0.128 -0.247 881 HD13 ILE 108 HD13 ILE 108 1.486 -1.367 -0.303 882 H GLY 109 H GLY 109 5.717 -5.007 -2.323 883 HA2 GLY 109 HA2 GLY 109 4.063 -7.176 -3.518 884 HA3 GLY 109 HA3 GLY 109 5.818 -7.230 -3.683 885 H PHE 110 H PHE 110 3.524 -8.664 -2.080 886 HA PHE 110 HA PHE 110 4.676 -8.565 0.647 887 HB2 PHE 110 HB2 PHE 110 2.197 -9.674 -0.614 888 HB3 PHE 110 HB3 PHE 110 2.712 -10.290 0.946 889 HD1 PHE 110 HD1 PHE 110 1.591 -7.204 -0.823 890 HD2 PHE 110 HD2 PHE 110 2.650 -8.993 2.958 891 HE1 PHE 110 HE1 PHE 110 0.718 -5.204 0.385 892 HE2 PHE 110 HE2 PHE 110 1.708 -7.047 4.150 893 HZ PHE 110 HZ PHE 110 0.796 -5.114 2.853 894 H THR 111 H THR 111 5.065 -10.456 1.861 895 HA THR 111 HA THR 111 6.850 -12.319 0.520 896 HB THR 111 HB THR 111 7.152 -11.205 2.741 897 HG1 THR 111 HG1 THR 111 8.411 -12.790 3.380 898 HG21 THR 111 HG21 THR 111 5.393 -13.456 3.783 899 HG22 THR 111 HG22 THR 111 6.329 -12.300 4.749 900 HG23 THR 111 HG23 THR 111 4.965 -11.729 3.774 901 H ASP 112 H ASP 112 3.542 -12.368 1.544 902 HA ASP 112 HA ASP 112 3.156 -15.076 0.401 903 HB2 ASP 112 HB2 ASP 112 3.395 -15.079 3.005 904 HB3 ASP 112 HB3 ASP 112 1.814 -14.284 3.010 905 H ARG 113 H ARG 113 1.123 -15.374 -0.578 906 HA ARG 113 HA ARG 113 -0.376 -13.061 -1.422 907 HB2 ARG 113 HB2 ARG 113 -0.177 -15.217 -2.682 908 HB3 ARG 113 HB3 ARG 113 -1.149 -16.016 -1.448 909 HG2 ARG 113 HG2 ARG 113 -2.467 -15.530 -3.434 910 HG3 ARG 113 HG3 ARG 113 -3.105 -14.616 -2.065 911 HD2 ARG 113 HD2 ARG 113 -2.098 -12.567 -2.860 912 HD3 ARG 113 HD3 ARG 113 -1.140 -13.434 -4.060 913 HE ARG 113 HE ARG 113 -3.916 -12.571 -4.284 914 HH11 ARG 113 HH11 ARG 113 -4.975 -12.861 -6.318 915 HH12 ARG 113 HH12 ARG 113 -4.024 -13.704 -7.570 916 HH21 ARG 113 HH21 ARG 113 -1.423 -14.649 -5.780 917 HH22 ARG 113 HH22 ARG 113 -2.304 -14.530 -7.311 918 H GLY 114 H GLY 114 -0.784 -15.278 1.317 919 HA2 GLY 114 HA2 GLY 114 -3.409 -14.339 2.133 920 HA3 GLY 114 HA3 GLY 114 -2.245 -15.257 3.095 921 H ASP 115 H ASP 115 -0.046 -13.335 2.934 922 HA ASP 115 HA ASP 115 -0.849 -11.398 4.955 923 HB2 ASP 115 HB2 ASP 115 1.710 -11.804 3.395 924 HB3 ASP 115 HB3 ASP 115 1.470 -10.464 4.509 925 H ALA 116 H ALA 116 -0.373 -11.257 1.428 926 HA ALA 116 HA ALA 116 -0.957 -8.447 1.209 927 HB1 ALA 116 HB1 ALA 116 -0.826 -8.833 -1.063 928 HB2 ALA 116 HB2 ALA 116 0.133 -10.184 -0.455 929 HB3 ALA 116 HB3 ALA 116 -1.534 -10.465 -0.961 930 H PHE 117 H PHE 117 -3.045 -11.375 1.084 931 HA PHE 117 HA PHE 117 -5.490 -10.081 0.467 932 HB2 PHE 117 HB2 PHE 117 -4.891 -12.566 0.490 933 HB3 PHE 117 HB3 PHE 117 -5.158 -12.534 2.223 934 HD1 PHE 117 HD1 PHE 117 -6.724 -12.199 -1.130 935 HD2 PHE 117 HD2 PHE 117 -7.436 -12.523 3.113 936 HE1 PHE 117 HE1 PHE 117 -9.108 -12.735 -1.571 937 HE2 PHE 117 HE2 PHE 117 -9.822 -13.056 2.665 938 HZ PHE 117 HZ PHE 117 -10.662 -13.163 0.327 939 H ASP 118 H ASP 118 -3.760 -10.288 3.575 940 HA ASP 118 HA ASP 118 -5.949 -9.214 5.183 941 HB2 ASP 118 HB2 ASP 118 -2.972 -9.474 5.637 942 HB3 ASP 118 HB3 ASP 118 -4.064 -8.750 6.809 943 H PHE 119 H PHE 119 -3.157 -7.797 3.395 944 HA PHE 119 HA PHE 119 -3.515 -5.130 4.293 945 HB2 PHE 119 HB2 PHE 119 -1.494 -5.749 3.215 946 HB3 PHE 119 HB3 PHE 119 -2.314 -6.310 1.776 947 HD1 PHE 119 HD1 PHE 119 -0.907 -3.398 3.436 948 HD2 PHE 119 HD2 PHE 119 -3.341 -4.719 0.164 949 HE1 PHE 119 HE1 PHE 119 -0.808 -1.129 2.465 950 HE2 PHE 119 HE2 PHE 119 -3.113 -2.486 -0.908 951 HZ PHE 119 HZ PHE 119 -1.891 -0.671 0.271 952 H ASN 120 H ASN 120 -4.950 -6.885 1.535 953 HA ASN 120 HA ASN 120 -6.643 -4.726 0.649 954 HB2 ASN 120 HB2 ASN 120 -6.300 -6.277 -0.980 955 HB3 ASN 120 HB3 ASN 120 -6.358 -7.667 0.129 956 HD21 ASN 120 HD21 ASN 120 -9.805 -6.332 -1.546 957 HD22 ASN 120 HD22 ASN 120 -8.377 -5.284 -1.551 958 H VAL 121 H VAL 121 -7.520 -7.641 2.640 959 HA VAL 121 HA VAL 121 -10.226 -6.824 2.880 960 HB VAL 121 HB VAL 121 -8.505 -8.802 4.327 961 HG11 VAL 121 HG11 VAL 121 -10.552 -9.799 5.363 962 HG12 VAL 121 HG12 VAL 121 -10.162 -8.222 6.041 963 HG13 VAL 121 HG13 VAL 121 -11.478 -8.371 4.853 964 HG21 VAL 121 HG21 VAL 121 -9.197 -9.344 2.025 965 HG22 VAL 121 HG22 VAL 121 -9.929 -10.448 3.184 966 HG23 VAL 121 HG23 VAL 121 -10.906 -9.143 2.487 967 H SER 122 H SER 122 -7.461 -6.029 4.975 968 HA SER 122 HA SER 122 -8.854 -4.837 7.138 969 HB2 SER 122 HB2 SER 122 -6.412 -5.152 7.071 970 HB3 SER 122 HB3 SER 122 -6.278 -3.955 5.768 971 HG SER 122 HG SER 122 -7.320 -3.460 8.383 972 H LEU 123 H LEU 123 -8.212 -3.575 3.858 973 HA LEU 123 HA LEU 123 -9.504 -0.994 4.457 974 HB2 LEU 123 HB2 LEU 123 -8.446 -2.111 1.850 975 HB3 LEU 123 HB3 LEU 123 -8.965 -0.449 2.137 976 HG LEU 123 HG LEU 123 -6.600 -1.849 3.444 977 HD11 LEU 123 HD11 LEU 123 -6.404 -1.266 1.002 978 HD12 LEU 123 HD12 LEU 123 -6.579 0.443 1.478 979 HD13 LEU 123 HD13 LEU 123 -5.204 -0.528 2.062 980 HD21 LEU 123 HD21 LEU 123 -5.975 0.431 4.254 981 HD22 LEU 123 HD22 LEU 123 -7.546 1.040 3.688 982 HD23 LEU 123 HD23 LEU 123 -7.462 -0.163 4.995 983 H GLN 124 H GLN 124 -10.336 -4.012 2.637 984 HA GLN 124 HA GLN 124 -12.797 -3.064 1.571 985 HB2 GLN 124 HB2 GLN 124 -12.169 -5.874 2.574 986 HB3 GLN 124 HB3 GLN 124 -13.607 -5.404 1.678 987 HG2 GLN 124 HG2 GLN 124 -12.053 -4.574 -0.186 988 HG3 GLN 124 HG3 GLN 124 -10.760 -5.437 0.662 989 HE21 GLN 124 HE21 GLN 124 -12.062 -8.695 -0.184 990 HE22 GLN 124 HE22 GLN 124 -10.767 -7.810 0.581 991 H ASP 125 H ASP 125 -12.272 -4.635 4.798 992 HA ASP 125 HA ASP 125 -15.037 -4.158 5.595 993 HB2 ASP 125 HB2 ASP 125 -13.461 -5.998 6.412 994 HB3 ASP 125 HB3 ASP 125 -12.625 -4.747 7.350 995 H HIS 126 H HIS 126 -12.436 -2.007 5.350 996 HA HIS 126 HA HIS 126 -13.419 -0.183 7.475 997 HB2 HIS 126 HB2 HIS 126 -10.969 -0.409 7.034 998 HB3 HIS 126 HB3 HIS 126 -11.229 0.315 5.440 999 HD2 HIS 126 HD2 HIS 126 -11.780 1.128 9.206 1000 HE1 HIS 126 HE1 HIS 126 -11.036 4.813 7.209 1001 HE2 HIS 126 HE2 HIS 126 -11.331 3.687 9.485 1002 H PHE 127 H PHE 127 -13.403 -0.535 3.935 1003 HA PHE 127 HA PHE 127 -15.089 1.848 3.673 1004 HB2 PHE 127 HB2 PHE 127 -13.701 0.104 1.655 1005 HB3 PHE 127 HB3 PHE 127 -14.836 1.375 1.209 1006 HD1 PHE 127 HD1 PHE 127 -14.461 3.762 2.216 1007 HD2 PHE 127 HD2 PHE 127 -11.403 0.723 2.072 1008 HE1 PHE 127 HE1 PHE 127 -12.706 5.477 2.640 1009 HE2 PHE 127 HE2 PHE 127 -9.668 2.451 2.473 1010 HZ PHE 127 HZ PHE 127 -10.338 4.819 2.779 1011 H LYS 128 H LYS 128 -15.759 -1.512 4.024 1012 HA LYS 128 HA LYS 128 -18.099 -1.717 2.504 1013 HB2 LYS 128 HB2 LYS 128 -18.587 -3.711 3.595 1014 HB3 LYS 128 HB3 LYS 128 -16.854 -3.589 3.511 1015 HG2 LYS 128 HG2 LYS 128 -17.070 -4.361 5.636 1016 HG3 LYS 128 HG3 LYS 128 -17.107 -2.622 5.995 1017 HD2 LYS 128 HD2 LYS 128 -19.666 -2.867 5.883 1018 HD3 LYS 128 HD3 LYS 128 -19.396 -4.606 5.743 1019 HE2 LYS 128 HE2 LYS 128 -18.359 -2.930 8.056 1020 HE3 LYS 128 HE3 LYS 128 -19.982 -3.624 8.044 1021 HZ1 LYS 128 HZ1 LYS 128 -18.454 -5.100 9.179 1022 HZ2 LYS 128 HZ2 LYS 128 -18.962 -5.836 7.814 1023 HZ3 LYS 128 HZ3 LYS 128 -17.456 -5.191 7.896 1024 H TRP 129 H TRP 129 -17.780 -0.091 5.547 1025 HA TRP 129 HA TRP 129 -20.737 0.148 5.874 1026 HB2 TRP 129 HB2 TRP 129 -20.181 0.870 8.161 1027 HB3 TRP 129 HB3 TRP 129 -19.660 -0.751 7.756 1028 HD1 TRP 129 HD1 TRP 129 -17.084 -1.311 7.868 1029 HE1 TRP 129 HE1 TRP 129 -15.042 -0.076 8.644 1030 HE3 TRP 129 HE3 TRP 129 -19.085 3.396 8.260 1031 HZ2 TRP 129 HZ2 TRP 129 -14.307 2.623 9.447 1032 HZ3 TRP 129 HZ3 TRP 129 -17.628 5.317 8.913 1033 HH2 TRP 129 HH2 TRP 129 -15.271 4.930 9.566 1034 H VAL 130 H VAL 130 -18.611 1.853 4.194 1035 HA VAL 130 HA VAL 130 -19.988 4.470 4.602 1036 HB VAL 130 HB VAL 130 -17.419 5.118 3.619 1037 HG11 VAL 130 HG11 VAL 130 -18.641 5.340 6.404 1038 HG12 VAL 130 HG12 VAL 130 -17.240 6.256 5.834 1039 HG13 VAL 130 HG13 VAL 130 -18.823 6.507 5.076 1040 HG21 VAL 130 HG21 VAL 130 -15.820 4.361 5.199 1041 HG22 VAL 130 HG22 VAL 130 -17.023 3.402 6.073 1042 HG23 VAL 130 HG23 VAL 130 -16.569 2.958 4.428 1043 H LYS 131 H LYS 131 -19.021 5.866 2.489 1044 HA LYS 131 HA LYS 131 -18.713 6.113 0.250 1045 HB2 LYS 131 HB2 LYS 131 -16.960 4.413 1.168 1046 HB3 LYS 131 HB3 LYS 131 -17.872 3.219 0.267 1047 HG2 LYS 131 HG2 LYS 131 -17.387 4.878 -1.797 1048 HG3 LYS 131 HG3 LYS 131 -16.162 5.525 -0.697 1049 HD2 LYS 131 HD2 LYS 131 -15.026 3.798 -1.897 1050 HD3 LYS 131 HD3 LYS 131 -15.439 3.081 -0.319 1051 HE2 LYS 131 HE2 LYS 131 -17.653 2.330 -1.566 1052 HE3 LYS 131 HE3 LYS 131 -16.764 2.678 -3.043 1053 HZ1 LYS 131 HZ1 LYS 131 -16.640 0.362 -2.382 1054 HZ2 LYS 131 HZ2 LYS 131 -15.113 0.999 -2.354 1055 HZ3 LYS 131 HZ3 LYS 131 -15.937 0.725 -0.959 1056 H GLN 132 H GLN 132 -21.355 5.061 1.033 1057 HA GLN 132 HA GLN 132 -23.358 4.661 0.048 1058 HB2 GLN 132 HB2 GLN 132 -21.885 6.024 -2.218 1059 HB3 GLN 132 HB3 GLN 132 -23.635 5.834 -2.164 1060 HG2 GLN 132 HG2 GLN 132 -23.946 7.399 -0.520 1061 HG3 GLN 132 HG3 GLN 132 -22.410 7.093 0.270 1062 HE21 GLN 132 HE21 GLN 132 -20.596 9.515 -1.594 1063 HE22 GLN 132 HE22 GLN 132 -20.477 8.166 -0.474 1064 H GLU 133 H GLU 133 -21.611 2.332 -0.126 1065 HA GLU 133 HA GLU 133 -23.010 0.877 -2.346 1066 HB2 GLU 133 HB2 GLU 133 -20.514 0.078 -0.814 1067 HB3 GLU 133 HB3 GLU 133 -21.415 -0.958 -1.928 1068 HG2 GLU 133 HG2 GLU 133 -21.089 0.891 -3.695 1069 HG3 GLU 133 HG3 GLU 133 -19.902 1.589 -2.594 1070 H1 SER 149 H1 SER 149 0.628 -16.894 -9.533 1071 H2 SER 149 H2 SER 149 1.959 -16.521 -8.644 1072 H3 SER 149 H3 SER 149 0.654 -15.498 -8.719 1073 HA SER 149 HA SER 149 -0.743 -16.909 -7.556 1074 HB2 SER 149 HB2 SER 149 0.008 -19.149 -6.776 1075 HB3 SER 149 HB3 SER 149 -0.129 -18.995 -8.536 1076 HG SER 149 HG SER 149 1.830 -20.005 -7.989 1077 H GLN 150 H GLN 150 2.368 -17.908 -6.226 1078 HA GLN 150 HA GLN 150 2.042 -15.998 -3.921 1079 HB2 GLN 150 HB2 GLN 150 2.901 -18.922 -3.881 1080 HB3 GLN 150 HB3 GLN 150 2.900 -17.828 -2.491 1081 HG2 GLN 150 HG2 GLN 150 0.436 -17.562 -2.703 1082 HG3 GLN 150 HG3 GLN 150 0.427 -18.686 -4.063 1083 HE21 GLN 150 HE21 GLN 150 -0.537 -20.749 -1.189 1084 HE22 GLN 150 HE22 GLN 150 -1.239 -19.485 -2.189 1085 H ILE 151 H ILE 151 4.373 -17.937 -5.825 1086 HA ILE 151 HA ILE 151 6.739 -16.488 -4.967 1087 HB ILE 151 HB ILE 151 6.659 -18.809 -5.882 1088 HG12 ILE 151 HG12 ILE 151 8.511 -17.059 -7.536 1089 HG13 ILE 151 HG13 ILE 151 8.740 -17.376 -5.810 1090 HG21 ILE 151 HG21 ILE 151 5.018 -18.391 -7.739 1091 HG22 ILE 151 HG22 ILE 151 6.280 -17.509 -8.617 1092 HG23 ILE 151 HG23 ILE 151 6.467 -19.237 -8.269 1093 HD11 ILE 151 HD11 ILE 151 10.124 -18.882 -7.101 1094 HD12 ILE 151 HD12 ILE 151 8.851 -19.823 -6.299 1095 HD13 ILE 151 HD13 ILE 151 8.737 -19.455 -8.038 1096 H THR 152 H THR 152 8.057 -15.221 -6.786 1097 HA THR 152 HA THR 152 6.589 -12.913 -7.608 1098 HB THR 152 HB THR 152 8.646 -12.503 -9.082 1099 HG1 THR 152 HG1 THR 152 10.433 -13.796 -8.528 1100 HG21 THR 152 HG21 THR 152 8.370 -11.536 -6.818 1101 HG22 THR 152 HG22 THR 152 9.075 -13.000 -6.100 1102 HG23 THR 152 HG23 THR 152 10.056 -11.950 -7.148 1103 H SER 153 H SER 153 5.709 -12.260 -9.573 1104 HA SER 153 HA SER 153 4.849 -14.396 -11.439 1105 HB2 SER 153 HB2 SER 153 3.274 -13.119 -9.181 1106 HB3 SER 153 HB3 SER 153 2.500 -13.884 -10.576 1107 HG SER 153 HG SER 153 4.084 -15.105 -8.562 1108 H GLN 154 H GLN 154 5.180 -13.055 -13.204 1109 HA GLN 154 HA GLN 154 4.104 -10.514 -13.738 1110 HB2 GLN 154 HB2 GLN 154 3.971 -12.992 -15.500 1111 HB3 GLN 154 HB3 GLN 154 3.652 -11.335 -16.031 1112 HG2 GLN 154 HG2 GLN 154 5.982 -10.696 -15.406 1113 HG3 GLN 154 HG3 GLN 154 6.311 -12.367 -14.934 1114 HE21 GLN 154 HE21 GLN 154 6.048 -11.416 -18.939 1115 HE22 GLN 154 HE22 GLN 154 5.400 -10.308 -17.722 1116 H VAL 155 H VAL 155 2.133 -9.702 -13.380 1117 HA VAL 155 HA VAL 155 0.471 -10.844 -11.669 1118 HB VAL 155 HB VAL 155 -0.634 -8.811 -13.633 1119 HG11 VAL 155 HG11 VAL 155 -1.164 -9.023 -10.601 1120 HG12 VAL 155 HG12 VAL 155 -1.837 -7.873 -11.683 1121 HG13 VAL 155 HG13 VAL 155 -2.270 -9.562 -11.904 1122 HG21 VAL 155 HG21 VAL 155 0.251 -7.050 -12.252 1123 HG22 VAL 155 HG22 VAL 155 1.106 -8.226 -11.224 1124 HG23 VAL 155 HG23 VAL 155 1.570 -7.998 -12.946 1125 H TPO 156 H T2P 156 -1.018 -12.324 -11.626 1126 HA TPO 156 HA T2P 156 -2.038 -14.064 -13.428 1127 HB TPO 156 HB T2P 156 -3.203 -13.022 -10.916 1128 HG21 TPO 156 HG21 T2P 156 -5.217 -13.606 -12.004 1129 HG22 TPO 156 HG22 T2P 156 -4.839 -14.816 -10.789 1130 HG23 TPO 156 HG23 T2P 156 -4.560 -15.214 -12.490 1131 H GLY 157 H GLY 157 -3.816 -14.525 -14.295 1132 HA2 GLY 157 HA2 GLY 157 -6.058 -12.876 -14.965 1133 HA3 GLY 157 HA3 GLY 157 -4.966 -12.940 -16.358 1134 H GLN 158 H GLN 158 -4.251 -15.789 -15.240 1135 HA GLN 158 HA GLN 158 -5.871 -17.322 -16.972 1136 HB2 GLN 158 HB2 GLN 158 -4.519 -19.141 -16.286 1137 HB3 GLN 158 HB3 GLN 158 -3.480 -17.738 -16.407 1138 HG2 GLN 158 HG2 GLN 158 -4.577 -18.852 -13.773 1139 HG3 GLN 158 HG3 GLN 158 -3.036 -19.304 -14.473 1140 HE21 GLN 158 HE21 GLN 158 -2.391 -16.764 -11.831 1141 HE22 GLN 158 HE22 GLN 158 -2.958 -18.411 -11.930 1142 H ILE 159 H ILE 159 -6.455 -16.503 -13.653 1143 HA ILE 159 HA ILE 159 -8.616 -18.558 -13.486 1144 HB ILE 159 HB ILE 159 -6.602 -19.430 -12.435 1145 HG12 ILE 159 HG12 ILE 159 -8.831 -18.854 -10.446 1146 HG13 ILE 159 HG13 ILE 159 -8.861 -20.093 -11.700 1147 HG21 ILE 159 HG21 ILE 159 -5.649 -18.514 -10.390 1148 HG22 ILE 159 HG22 ILE 159 -5.579 -17.294 -11.649 1149 HG23 ILE 159 HG23 ILE 159 -6.828 -17.198 -10.391 1150 HD11 ILE 159 HD11 ILE 159 -8.314 -21.137 -9.602 1151 HD12 ILE 159 HD12 ILE 159 -6.866 -21.179 -10.628 1152 HD13 ILE 159 HD13 ILE 159 -6.994 -20.002 -9.296 1153 H GLY 160 H GLY 160 -7.450 -15.499 -12.077 1154 HA2 GLY 160 HA2 GLY 160 -8.672 -13.622 -11.463 1155 HA3 GLY 160 HA3 GLY 160 -10.112 -14.363 -12.161 1156 H TRP 161 H TRP 161 -8.034 -15.466 -9.465 1157 HA TRP 161 HA TRP 161 -10.354 -16.115 -7.819 1158 HB2 TRP 161 HB2 TRP 161 -8.847 -17.524 -6.640 1159 HB3 TRP 161 HB3 TRP 161 -8.788 -17.814 -8.363 1160 HD1 TRP 161 HD1 TRP 161 -6.508 -15.141 -8.509 1161 HE1 TRP 161 HE1 TRP 161 -4.104 -15.898 -8.329 1162 HE3 TRP 161 HE3 TRP 161 -7.264 -19.581 -6.062 1163 HZ2 TRP 161 HZ2 TRP 161 -2.653 -18.141 -7.263 1164 HZ3 TRP 161 HZ3 TRP 161 -5.316 -20.998 -5.430 1165 HH2 TRP 161 HH2 TRP 161 -3.008 -20.301 -6.033 1166 H ARG 162 H ARG 162 -7.563 -15.607 -6.218 1167 HA ARG 162 HA ARG 162 -8.650 -14.083 -4.105 1168 HB2 ARG 162 HB2 ARG 162 -5.763 -14.650 -4.885 1169 HB3 ARG 162 HB3 ARG 162 -6.242 -13.967 -3.324 1170 HG2 ARG 162 HG2 ARG 162 -7.150 -16.680 -4.403 1171 HG3 ARG 162 HG3 ARG 162 -5.762 -16.432 -3.338 1172 HD2 ARG 162 HD2 ARG 162 -7.244 -15.412 -1.622 1173 HD3 ARG 162 HD3 ARG 162 -8.653 -15.748 -2.651 1174 HE ARG 162 HE ARG 162 -7.370 -18.203 -2.379 1175 HH11 ARG 162 HH11 ARG 162 -7.926 -19.757 -0.891 1176 HH12 ARG 162 HH12 ARG 162 -8.725 -19.303 0.585 1177 HH21 ARG 162 HH21 ARG 162 -8.786 -15.942 -0.100 1178 HH22 ARG 162 HH22 ARG 162 -9.204 -17.203 1.026 1179 H ARG 163 H ARG 163 -9.271 -12.164 -4.114 1180 HA ARG 163 HA ARG 163 -8.432 -9.989 -5.838 1181 HB2 ARG 163 HB2 ARG 163 -10.244 -8.781 -4.766 1182 HB3 ARG 163 HB3 ARG 163 -10.771 -10.420 -5.148 1183 HG2 ARG 163 HG2 ARG 163 -10.092 -10.979 -2.675 1184 HG3 ARG 163 HG3 ARG 163 -10.088 -9.236 -2.423 1185 HD2 ARG 163 HD2 ARG 163 -12.456 -10.835 -3.510 1186 HD3 ARG 163 HD3 ARG 163 -12.188 -10.507 -1.808 1187 HE ARG 163 HE ARG 163 -12.660 -8.204 -2.105 1188 HH11 ARG 163 HH11 ARG 163 -13.915 -6.715 -2.838 1189 HH12 ARG 163 HH12 ARG 163 -14.563 -6.770 -4.467 1190 HH21 ARG 163 HH21 ARG 163 -13.144 -9.833 -5.180 1191 HH22 ARG 163 HH22 ARG 163 -14.141 -8.530 -5.766 Start of MODEL 12 1 H1 GLY -4 H1 GLY -4 -12.515 24.519 11.810 2 H2 GLY -4 H2 GLY -4 -12.945 25.766 12.783 3 H3 GLY -4 H3 GLY -4 -13.930 24.469 12.634 4 HA2 GLY -4 HA2 GLY -4 -12.303 23.029 13.681 5 HA3 GLY -4 HA3 GLY -4 -11.247 24.443 13.855 6 H SER -3 H SER -3 -11.292 23.894 16.167 7 HA SER -3 HA SER -3 -13.688 24.063 17.743 8 HB2 SER -3 HB2 SER -3 -11.773 22.879 18.553 9 HB3 SER -3 HB3 SER -3 -10.768 24.337 18.470 10 HG SER -3 HG SER -3 -11.576 23.802 20.575 11 HA PRO -2 HA PRO -2 -14.002 28.586 18.098 12 HB2 PRO -2 HB2 PRO -2 -15.379 27.890 20.687 13 HB3 PRO -2 HB3 PRO -2 -15.905 29.014 19.397 14 HG2 PRO -2 HG2 PRO -2 -17.047 26.572 19.623 15 HG3 PRO -2 HG3 PRO -2 -16.596 27.196 18.000 16 HD2 PRO -2 HD2 PRO -2 -15.046 25.271 19.766 17 HD3 PRO -2 HD3 PRO -2 -15.445 25.149 18.024 18 H ASN -1 H ASN -1 -12.433 26.471 20.355 19 HA ASN -1 HA ASN -1 -11.695 28.535 22.298 20 HB2 ASN -1 HB2 ASN -1 -10.890 25.602 22.081 21 HB3 ASN -1 HB3 ASN -1 -10.567 26.664 23.442 22 HD21 ASN -1 HD21 ASN -1 -14.284 25.035 23.034 23 HD22 ASN -1 HD22 ASN -1 -13.095 24.840 21.750 24 H SER 0 H SER 0 -9.851 26.461 20.009 25 HA SER 0 HA SER 0 -7.926 28.578 19.422 26 HB2 SER 0 HB2 SER 0 -7.037 27.693 21.552 27 HB3 SER 0 HB3 SER 0 -7.041 26.052 20.888 28 HG SER 0 HG SER 0 -4.998 27.332 20.819 29 H MET 1 H MET 1 -6.423 27.937 17.737 30 HA MET 1 HA MET 1 -7.385 25.986 15.781 31 HB2 MET 1 HB2 MET 1 -6.215 28.126 15.229 32 HB3 MET 1 HB3 MET 1 -4.734 27.481 15.949 33 HG2 MET 1 HG2 MET 1 -4.715 25.657 14.289 34 HG3 MET 1 HG3 MET 1 -6.228 26.243 13.596 35 HE1 MET 1 HE1 MET 1 -5.915 29.396 13.322 36 HE2 MET 1 HE2 MET 1 -5.194 29.475 11.703 37 HE3 MET 1 HE3 MET 1 -6.477 28.294 12.041 38 H ALA 2 H ALA 2 -5.219 25.916 18.550 39 HA ALA 2 HA ALA 2 -3.852 23.446 17.747 40 HB1 ALA 2 HB1 ALA 2 -3.768 25.062 20.328 41 HB2 ALA 2 HB2 ALA 2 -2.652 23.764 19.859 42 HB3 ALA 2 HB3 ALA 2 -2.686 25.274 18.930 43 H THR 3 H THR 3 -6.780 24.188 19.515 44 HA THR 3 HA THR 3 -6.823 21.625 20.976 45 HB THR 3 HB THR 3 -9.132 22.386 21.651 46 HG1 THR 3 HG1 THR 3 -9.273 23.933 19.900 47 HG21 THR 3 HG21 THR 3 -7.179 22.651 23.106 48 HG22 THR 3 HG22 THR 3 -6.770 24.190 22.320 49 HG23 THR 3 HG23 THR 3 -8.274 24.040 23.260 50 H GLU 4 H GLU 4 -6.637 20.206 19.290 51 HA GLU 4 HA GLU 4 -9.181 19.645 17.825 52 HB2 GLU 4 HB2 GLU 4 -7.509 20.680 16.323 53 HB3 GLU 4 HB3 GLU 4 -6.377 19.368 16.682 54 HG2 GLU 4 HG2 GLU 4 -7.845 17.736 15.618 55 HG3 GLU 4 HG3 GLU 4 -9.154 18.913 15.521 56 H LEU 5 H LEU 5 -9.621 17.479 17.376 57 HA LEU 5 HA LEU 5 -8.695 15.651 19.465 58 HB2 LEU 5 HB2 LEU 5 -10.741 14.387 19.030 59 HB3 LEU 5 HB3 LEU 5 -10.899 16.002 19.694 60 HG LEU 5 HG LEU 5 -11.609 16.923 17.601 61 HD11 LEU 5 HD11 LEU 5 -11.983 15.487 15.599 62 HD12 LEU 5 HD12 LEU 5 -10.270 15.623 16.047 63 HD13 LEU 5 HD13 LEU 5 -11.165 14.148 16.454 64 HD21 LEU 5 HD21 LEU 5 -13.733 15.701 17.338 65 HD22 LEU 5 HD22 LEU 5 -13.033 14.296 18.185 66 HD23 LEU 5 HD23 LEU 5 -13.275 15.830 19.050 67 H GLU 6 H GLU 6 -7.012 16.059 17.161 68 HA GLU 6 HA GLU 6 -7.064 14.231 15.121 69 HB2 GLU 6 HB2 GLU 6 -4.877 15.579 16.678 70 HB3 GLU 6 HB3 GLU 6 -4.400 14.344 15.508 71 HG2 GLU 6 HG2 GLU 6 -6.068 16.786 14.848 72 HG3 GLU 6 HG3 GLU 6 -4.326 16.675 14.642 73 H TYR 7 H TYR 7 -6.918 12.072 14.857 74 HA TYR 7 HA TYR 7 -5.395 10.352 16.678 75 HB2 TYR 7 HB2 TYR 7 -7.179 9.035 17.424 76 HB3 TYR 7 HB3 TYR 7 -7.734 10.673 17.664 77 HD1 TYR 7 HD1 TYR 7 -9.390 11.678 15.959 78 HD2 TYR 7 HD2 TYR 7 -8.432 7.474 16.124 79 HE1 TYR 7 HE1 TYR 7 -11.458 11.159 14.687 80 HE2 TYR 7 HE2 TYR 7 -10.499 6.955 14.844 81 HH TYR 7 HH TYR 7 -12.788 9.511 13.806 82 H GLU 8 H GLU 8 -5.831 7.980 16.024 83 HA GLU 8 HA GLU 8 -6.959 7.288 13.535 84 HB2 GLU 8 HB2 GLU 8 -5.120 6.392 12.291 85 HB3 GLU 8 HB3 GLU 8 -4.860 8.108 12.520 86 HG2 GLU 8 HG2 GLU 8 -3.339 7.439 14.523 87 HG3 GLU 8 HG3 GLU 8 -3.407 5.805 13.840 88 H SER 9 H SER 9 -7.762 5.311 13.783 89 HA SER 9 HA SER 9 -6.951 3.605 16.008 90 HB2 SER 9 HB2 SER 9 -9.074 3.504 13.861 91 HB3 SER 9 HB3 SER 9 -8.761 2.095 14.902 92 HG SER 9 HG SER 9 -10.399 3.477 15.754 93 H VAL 10 H VAL 10 -6.574 1.142 15.498 94 HA VAL 10 HA VAL 10 -4.743 0.935 13.137 95 HB VAL 10 HB VAL 10 -3.549 0.908 15.255 96 HG11 VAL 10 HG11 VAL 10 -3.610 -1.017 16.745 97 HG12 VAL 10 HG12 VAL 10 -5.197 -0.238 16.707 98 HG13 VAL 10 HG13 VAL 10 -4.927 -1.751 15.811 99 HG21 VAL 10 HG21 VAL 10 -2.657 -0.229 13.240 100 HG22 VAL 10 HG22 VAL 10 -2.126 -0.985 14.752 101 HG23 VAL 10 HG23 VAL 10 -3.395 -1.754 13.787 102 H LEU 11 H LEU 11 -4.835 -0.717 11.766 103 HA LEU 11 HA LEU 11 -7.169 -2.590 11.989 104 HB2 LEU 11 HB2 LEU 11 -6.160 -1.113 9.535 105 HB3 LEU 11 HB3 LEU 11 -7.478 -2.272 9.572 106 HG LEU 11 HG LEU 11 -7.468 0.473 10.896 107 HD11 LEU 11 HD11 LEU 11 -8.900 -0.698 8.473 108 HD12 LEU 11 HD12 LEU 11 -9.261 0.879 9.185 109 HD13 LEU 11 HD13 LEU 11 -7.668 0.584 8.475 110 HD21 LEU 11 HD21 LEU 11 -8.860 -1.064 12.232 111 HD22 LEU 11 HD22 LEU 11 -9.871 0.056 11.327 112 HD23 LEU 11 HD23 LEU 11 -9.688 -1.621 10.758 113 H CYS 12 H CYS 12 -3.883 -2.121 10.597 114 HA CYS 12 HA CYS 12 -3.527 -5.039 10.682 115 HB2 CYS 12 HB2 CYS 12 -4.354 -4.401 8.350 116 HB3 CYS 12 HB3 CYS 12 -2.801 -3.570 8.130 117 HG CYS 12 HG CYS 12 -2.828 -5.934 6.936 118 H VAL 13 H VAL 13 -1.397 -5.738 10.866 119 HA VAL 13 HA VAL 13 0.816 -3.840 10.771 120 HB VAL 13 HB VAL 13 0.038 -3.403 12.959 121 HG11 VAL 13 HG11 VAL 13 0.404 -6.322 13.709 122 HG12 VAL 13 HG12 VAL 13 0.020 -4.982 14.802 123 HG13 VAL 13 HG13 VAL 13 -1.141 -5.457 13.557 124 HG21 VAL 13 HG21 VAL 13 2.540 -3.529 12.443 125 HG22 VAL 13 HG22 VAL 13 2.054 -3.533 14.153 126 HG23 VAL 13 HG23 VAL 13 2.555 -5.037 13.367 127 H LYS 14 H LYS 14 0.715 -5.489 8.911 128 HA LYS 14 HA LYS 14 1.667 -8.144 9.400 129 HB2 LYS 14 HB2 LYS 14 0.457 -7.319 7.316 130 HB3 LYS 14 HB3 LYS 14 1.962 -6.559 6.822 131 HG2 LYS 14 HG2 LYS 14 1.818 -8.630 5.666 132 HG3 LYS 14 HG3 LYS 14 3.081 -8.799 6.871 133 HD2 LYS 14 HD2 LYS 14 1.821 -10.816 6.781 134 HD3 LYS 14 HD3 LYS 14 1.429 -10.068 8.325 135 HE2 LYS 14 HE2 LYS 14 -0.713 -9.301 7.494 136 HE3 LYS 14 HE3 LYS 14 -0.310 -9.838 5.852 137 HZ1 LYS 14 HZ1 LYS 14 -0.627 -11.623 8.212 138 HZ2 LYS 14 HZ2 LYS 14 -1.661 -11.528 6.943 139 HZ3 LYS 14 HZ3 LYS 14 -0.152 -12.123 6.721 140 HA PRO 15 HA PRO 15 5.663 -6.882 10.654 141 HB2 PRO 15 HB2 PRO 15 6.933 -9.253 11.085 142 HB3 PRO 15 HB3 PRO 15 5.508 -8.727 12.034 143 HG2 PRO 15 HG2 PRO 15 5.543 -10.562 9.606 144 HG3 PRO 15 HG3 PRO 15 4.764 -10.853 11.198 145 HD2 PRO 15 HD2 PRO 15 3.404 -9.876 9.075 146 HD3 PRO 15 HD3 PRO 15 3.048 -9.309 10.740 147 H ASP 16 H ASP 16 5.406 -8.497 7.597 148 HA ASP 16 HA ASP 16 7.998 -7.318 6.777 149 HB2 ASP 16 HB2 ASP 16 8.376 -9.731 7.144 150 HB3 ASP 16 HB3 ASP 16 7.089 -10.103 5.990 151 H VAL 17 H VAL 17 7.847 -6.105 5.019 152 HA VAL 17 HA VAL 17 6.040 -6.741 2.818 153 HB VAL 17 HB VAL 17 4.604 -5.376 4.317 154 HG11 VAL 17 HG11 VAL 17 6.519 -3.085 3.797 155 HG12 VAL 17 HG12 VAL 17 4.976 -3.013 4.661 156 HG13 VAL 17 HG13 VAL 17 6.328 -3.929 5.346 157 HG21 VAL 17 HG21 VAL 17 5.288 -3.882 1.763 158 HG22 VAL 17 HG22 VAL 17 4.287 -5.351 1.854 159 HG23 VAL 17 HG23 VAL 17 3.758 -3.866 2.655 160 H SER 18 H SER 18 6.771 -5.910 0.861 161 HA SER 18 HA SER 18 9.182 -4.136 0.929 162 HB2 SER 18 HB2 SER 18 10.115 -5.226 -0.898 163 HB3 SER 18 HB3 SER 18 9.644 -6.508 0.221 164 HG SER 18 HG SER 18 7.647 -6.600 -1.136 165 H VAL 19 H VAL 19 9.412 -2.552 -0.697 166 HA VAL 19 HA VAL 19 6.915 -1.999 -2.264 167 HB VAL 19 HB VAL 19 7.131 0.253 -2.225 168 HG11 VAL 19 HG11 VAL 19 5.956 -0.865 -0.362 169 HG12 VAL 19 HG12 VAL 19 7.425 -0.750 0.628 170 HG13 VAL 19 HG13 VAL 19 6.594 0.717 0.079 171 HG21 VAL 19 HG21 VAL 19 8.785 1.535 -1.136 172 HG22 VAL 19 HG22 VAL 19 9.574 0.071 -0.473 173 HG23 VAL 19 HG23 VAL 19 9.619 0.460 -2.210 174 H TYR 20 H TYR 20 7.048 -0.994 -4.213 175 HA TYR 20 HA TYR 20 9.673 -1.048 -5.653 176 HB2 TYR 20 HB2 TYR 20 6.979 -1.634 -6.922 177 HB3 TYR 20 HB3 TYR 20 8.577 -1.859 -7.610 178 HD1 TYR 20 HD1 TYR 20 10.129 -3.518 -6.133 179 HD2 TYR 20 HD2 TYR 20 5.830 -3.520 -6.192 180 HE1 TYR 20 HE1 TYR 20 10.120 -5.902 -5.362 181 HE2 TYR 20 HE2 TYR 20 5.824 -5.912 -5.537 182 HH TYR 20 HH TYR 20 8.831 -7.725 -4.846 183 H ARG 21 H ARG 21 10.162 1.120 -5.853 184 HA ARG 21 HA ARG 21 8.233 3.211 -6.542 185 HB2 ARG 21 HB2 ARG 21 11.244 3.114 -7.015 186 HB3 ARG 21 HB3 ARG 21 10.205 4.540 -7.140 187 HG2 ARG 21 HG2 ARG 21 9.646 4.305 -4.696 188 HG3 ARG 21 HG3 ARG 21 10.750 2.930 -4.603 189 HD2 ARG 21 HD2 ARG 21 12.017 4.731 -3.797 190 HD3 ARG 21 HD3 ARG 21 12.598 4.467 -5.432 191 HE ARG 21 HE ARG 21 11.737 6.540 -6.092 192 HH11 ARG 21 HH11 ARG 21 11.054 8.644 -5.690 193 HH12 ARG 21 HH12 ARG 21 10.378 9.042 -4.123 194 HH21 ARG 21 HH21 ARG 21 10.532 5.903 -2.844 195 HH22 ARG 21 HH22 ARG 21 9.993 7.567 -2.657 196 H ILE 22 H ILE 22 7.112 3.248 -8.315 197 HA ILE 22 HA ILE 22 7.985 1.670 -10.666 198 HB ILE 22 HB ILE 22 5.676 1.562 -11.347 199 HG12 ILE 22 HG12 ILE 22 5.127 3.365 -8.966 200 HG13 ILE 22 HG13 ILE 22 4.732 3.626 -10.671 201 HG21 ILE 22 HG21 ILE 22 5.914 0.799 -8.445 202 HG22 ILE 22 HG22 ILE 22 4.910 0.049 -9.679 203 HG23 ILE 22 HG23 ILE 22 6.671 -0.095 -9.781 204 HD11 ILE 22 HD11 ILE 22 3.422 1.661 -8.769 205 HD12 ILE 22 HD12 ILE 22 2.718 3.106 -9.507 206 HD13 ILE 22 HD13 ILE 22 3.116 1.703 -10.526 207 HA PRO 23 HA PRO 23 8.275 5.319 -13.182 208 HB2 PRO 23 HB2 PRO 23 8.077 4.131 -15.725 209 HB3 PRO 23 HB3 PRO 23 9.544 4.423 -14.757 210 HG2 PRO 23 HG2 PRO 23 8.069 1.874 -15.175 211 HG3 PRO 23 HG3 PRO 23 9.772 2.136 -14.737 212 HD2 PRO 23 HD2 PRO 23 7.717 1.351 -12.977 213 HD3 PRO 23 HD3 PRO 23 9.304 2.017 -12.503 214 HA PRO 24 HA PRO 24 4.228 5.440 -15.579 215 HB2 PRO 24 HB2 PRO 24 2.312 3.511 -15.563 216 HB3 PRO 24 HB3 PRO 24 3.805 3.382 -16.545 217 HG2 PRO 24 HG2 PRO 24 3.298 2.206 -13.784 218 HG3 PRO 24 HG3 PRO 24 3.890 1.361 -15.252 219 HD2 PRO 24 HD2 PRO 24 5.600 2.301 -13.377 220 HD3 PRO 24 HD3 PRO 24 5.992 2.413 -15.118 221 H ARG 25 H ARG 25 2.251 6.361 -15.241 222 HA ARG 25 HA ARG 25 0.981 6.420 -12.524 223 HB2 ARG 25 HB2 ARG 25 1.400 8.634 -13.340 224 HB3 ARG 25 HB3 ARG 25 0.866 8.216 -14.967 225 HG2 ARG 25 HG2 ARG 25 -0.811 9.595 -13.946 226 HG3 ARG 25 HG3 ARG 25 -1.461 7.980 -14.195 227 HD2 ARG 25 HD2 ARG 25 -0.951 7.505 -11.722 228 HD3 ARG 25 HD3 ARG 25 -0.483 9.195 -11.573 229 HE ARG 25 HE ARG 25 -2.714 9.850 -11.693 230 HH11 ARG 25 HH11 ARG 25 -4.908 9.574 -11.656 231 HH12 ARG 25 HH12 ARG 25 -5.601 8.010 -11.956 232 HH21 ARG 25 HH21 ARG 25 -2.603 6.398 -12.432 233 HH22 ARG 25 HH22 ARG 25 -4.340 6.265 -12.369 234 H ALA 26 H ALA 26 0.303 5.641 -15.907 235 HA ALA 26 HA ALA 26 -2.004 3.989 -15.085 236 HB1 ALA 26 HB1 ALA 26 -2.264 6.468 -16.841 237 HB2 ALA 26 HB2 ALA 26 -3.544 5.265 -16.512 238 HB3 ALA 26 HB3 ALA 26 -2.893 6.275 -15.190 239 H SER 27 H SER 27 -1.433 2.294 -15.841 240 HA SER 27 HA SER 27 -0.539 1.953 -18.674 241 HB2 SER 27 HB2 SER 27 0.851 1.021 -16.674 242 HB3 SER 27 HB3 SER 27 -0.422 -0.216 -16.579 243 HG SER 27 HG SER 27 1.252 0.470 -18.786 244 H ASN 28 H ASN 28 -1.291 -0.372 -19.358 245 HA ASN 28 HA ASN 28 -4.140 -0.101 -19.788 246 HB2 ASN 28 HB2 ASN 28 -3.903 -2.124 -21.229 247 HB3 ASN 28 HB3 ASN 28 -2.913 -0.749 -21.678 248 HD21 ASN 28 HD21 ASN 28 -0.945 -4.073 -20.269 249 HD22 ASN 28 HD22 ASN 28 -2.442 -3.611 -19.470 250 H ARG 29 H ARG 29 -5.662 -0.827 -18.642 251 HA ARG 29 HA ARG 29 -6.896 -1.731 -17.095 252 HB2 ARG 29 HB2 ARG 29 -5.310 -4.302 -17.373 253 HB3 ARG 29 HB3 ARG 29 -6.881 -4.111 -16.590 254 HG2 ARG 29 HG2 ARG 29 -7.780 -4.614 -18.585 255 HG3 ARG 29 HG3 ARG 29 -7.413 -2.926 -18.989 256 HD2 ARG 29 HD2 ARG 29 -5.219 -3.677 -19.923 257 HD3 ARG 29 HD3 ARG 29 -5.663 -5.357 -19.566 258 HE ARG 29 HE ARG 29 -7.724 -4.157 -21.141 259 HH11 ARG 29 HH11 ARG 29 -7.955 -4.557 -23.312 260 HH12 ARG 29 HH12 ARG 29 -6.621 -5.192 -24.228 261 HH21 ARG 29 HH21 ARG 29 -4.447 -5.330 -21.580 262 HH22 ARG 29 HH22 ARG 29 -4.684 -5.610 -23.282 263 H GLY 30 H GLY 30 -4.623 -0.295 -16.389 264 HA2 GLY 30 HA2 GLY 30 -4.876 0.598 -14.030 265 HA3 GLY 30 HA3 GLY 30 -4.399 -1.022 -13.484 266 H TYR 31 H TYR 31 -2.367 -1.676 -13.596 267 HA TYR 31 HA TYR 31 -0.158 0.273 -14.203 268 HB2 TYR 31 HB2 TYR 31 -0.811 -1.034 -11.544 269 HB3 TYR 31 HB3 TYR 31 0.809 -0.504 -11.947 270 HD1 TYR 31 HD1 TYR 31 1.387 1.834 -12.311 271 HD2 TYR 31 HD2 TYR 31 -2.521 0.597 -10.963 272 HE1 TYR 31 HE1 TYR 31 1.010 4.096 -11.365 273 HE2 TYR 31 HE2 TYR 31 -2.911 2.888 -10.015 274 HH TYR 31 HH TYR 31 -0.416 5.449 -10.167 275 H ARG 32 H ARG 32 -1.126 -3.032 -13.453 276 HA ARG 32 HA ARG 32 -0.153 -4.993 -13.279 277 HB2 ARG 32 HB2 ARG 32 1.324 -5.026 -15.756 278 HB3 ARG 32 HB3 ARG 32 -0.087 -5.896 -15.201 279 HG2 ARG 32 HG2 ARG 32 -1.082 -4.942 -16.965 280 HG3 ARG 32 HG3 ARG 32 -1.343 -3.591 -15.892 281 HD2 ARG 32 HD2 ARG 32 -0.506 -2.640 -17.846 282 HD3 ARG 32 HD3 ARG 32 0.899 -2.662 -16.771 283 HE ARG 32 HE ARG 32 0.858 -5.114 -18.241 284 HH11 ARG 32 HH11 ARG 32 2.352 -5.519 -19.848 285 HH12 ARG 32 HH12 ARG 32 3.120 -4.181 -20.650 286 HH21 ARG 32 HH21 ARG 32 1.445 -1.741 -18.940 287 HH22 ARG 32 HH22 ARG 32 2.701 -2.121 -20.098 288 H ALA 33 H ALA 33 1.227 -5.487 -11.716 289 HA ALA 33 HA ALA 33 3.791 -4.480 -11.237 290 HB1 ALA 33 HB1 ALA 33 4.123 -6.480 -9.893 291 HB2 ALA 33 HB2 ALA 33 2.452 -5.928 -9.704 292 HB3 ALA 33 HB3 ALA 33 2.801 -7.323 -10.734 293 H SER 34 H SER 34 2.846 -7.135 -13.290 294 HA SER 34 HA SER 34 5.101 -8.212 -14.389 295 HB2 SER 34 HB2 SER 34 2.429 -7.391 -15.602 296 HB3 SER 34 HB3 SER 34 3.532 -8.614 -16.310 297 HG SER 34 HG SER 34 1.866 -9.506 -15.050 298 H ASP 35 H ASP 35 4.054 -4.870 -14.979 299 HA ASP 35 HA ASP 35 5.630 -4.596 -17.463 300 HB2 ASP 35 HB2 ASP 35 3.404 -3.492 -17.092 301 HB3 ASP 35 HB3 ASP 35 4.135 -2.524 -15.817 302 H TRP 36 H TRP 36 6.017 -3.994 -14.040 303 HA TRP 36 HA TRP 36 8.543 -2.469 -14.492 304 HB2 TRP 36 HB2 TRP 36 7.874 -1.338 -12.223 305 HB3 TRP 36 HB3 TRP 36 7.348 -0.794 -13.782 306 HD1 TRP 36 HD1 TRP 36 4.956 -0.625 -14.314 307 HE1 TRP 36 HE1 TRP 36 2.745 -1.028 -13.099 308 HE3 TRP 36 HE3 TRP 36 6.739 -3.082 -10.188 309 HZ2 TRP 36 HZ2 TRP 36 1.935 -1.790 -10.400 310 HZ3 TRP 36 HZ3 TRP 36 5.215 -3.655 -8.327 311 HH2 TRP 36 HH2 TRP 36 2.825 -2.986 -8.389 312 H LYS 37 H LYS 37 8.919 -2.501 -11.511 313 HA LYS 37 HA LYS 37 10.529 -4.956 -11.418 314 HB2 LYS 37 HB2 LYS 37 10.184 -2.682 -9.390 315 HB3 LYS 37 HB3 LYS 37 11.397 -3.951 -9.341 316 HG2 LYS 37 HG2 LYS 37 11.996 -3.031 -11.787 317 HG3 LYS 37 HG3 LYS 37 11.190 -1.576 -11.198 318 HD2 LYS 37 HD2 LYS 37 13.653 -2.962 -10.106 319 HD3 LYS 37 HD3 LYS 37 13.574 -1.358 -10.821 320 HE2 LYS 37 HE2 LYS 37 12.203 -2.154 -8.217 321 HE3 LYS 37 HE3 LYS 37 13.833 -1.512 -8.284 322 HZ1 LYS 37 HZ1 LYS 37 11.419 -0.036 -9.236 323 HZ2 LYS 37 HZ2 LYS 37 12.185 0.195 -7.812 324 HZ3 LYS 37 HZ3 LYS 37 12.956 0.544 -9.210 325 H LEU 38 H LEU 38 8.663 -6.118 -11.724 326 HA LEU 38 HA LEU 38 6.858 -7.095 -9.867 327 HB2 LEU 38 HB2 LEU 38 7.134 -7.647 -12.292 328 HB3 LEU 38 HB3 LEU 38 8.682 -8.413 -11.945 329 HG LEU 38 HG LEU 38 7.543 -10.075 -10.577 330 HD11 LEU 38 HD11 LEU 38 5.073 -10.372 -10.813 331 HD12 LEU 38 HD12 LEU 38 5.429 -8.818 -10.065 332 HD13 LEU 38 HD13 LEU 38 4.980 -8.890 -11.783 333 HD21 LEU 38 HD21 LEU 38 6.558 -9.877 -13.455 334 HD22 LEU 38 HD22 LEU 38 8.114 -10.547 -12.918 335 HD23 LEU 38 HD23 LEU 38 6.600 -11.361 -12.480 336 H ASP 39 H ASP 39 10.371 -7.645 -9.927 337 HA ASP 39 HA ASP 39 10.221 -9.452 -7.560 338 HB2 ASP 39 HB2 ASP 39 11.778 -10.883 -8.636 339 HB3 ASP 39 HB3 ASP 39 10.506 -10.557 -9.804 340 H GLN 40 H GLN 40 11.204 -6.437 -8.102 341 HA GLN 40 HA GLN 40 13.913 -6.694 -6.809 342 HB2 GLN 40 HB2 GLN 40 13.066 -5.270 -9.321 343 HB3 GLN 40 HB3 GLN 40 14.443 -4.679 -8.380 344 HG2 GLN 40 HG2 GLN 40 15.672 -6.647 -8.702 345 HG3 GLN 40 HG3 GLN 40 14.258 -7.566 -9.244 346 HE21 GLN 40 HE21 GLN 40 14.466 -6.493 -12.623 347 HE22 GLN 40 HE22 GLN 40 13.514 -7.362 -11.408 348 HA PRO 41 HA PRO 41 11.401 -3.711 -4.380 349 HB2 PRO 41 HB2 PRO 41 12.276 -4.291 -1.870 350 HB3 PRO 41 HB3 PRO 41 11.113 -5.312 -2.778 351 HG2 PRO 41 HG2 PRO 41 14.113 -5.701 -2.550 352 HG3 PRO 41 HG3 PRO 41 12.817 -6.904 -2.250 353 HD2 PRO 41 HD2 PRO 41 14.112 -6.747 -4.641 354 HD3 PRO 41 HD3 PRO 41 12.366 -7.133 -4.559 355 H ASP 42 H ASP 42 11.810 -1.714 -3.561 356 HA ASP 42 HA ASP 42 14.601 -0.655 -3.775 357 HB2 ASP 42 HB2 ASP 42 11.896 0.730 -3.612 358 HB3 ASP 42 HB3 ASP 42 13.449 1.562 -3.675 359 H TRP 43 H TRP 43 11.987 -1.164 -1.474 360 HA TRP 43 HA TRP 43 13.831 -0.816 0.765 361 HB2 TRP 43 HB2 TRP 43 12.999 1.426 0.642 362 HB3 TRP 43 HB3 TRP 43 11.362 0.900 0.367 363 HD1 TRP 43 HD1 TRP 43 13.674 1.920 3.045 364 HE1 TRP 43 HE1 TRP 43 12.569 1.750 5.359 365 HE3 TRP 43 HE3 TRP 43 9.463 -0.706 1.756 366 HZ2 TRP 43 HZ2 TRP 43 10.125 0.712 6.474 367 HZ3 TRP 43 HZ3 TRP 43 7.757 -1.264 3.469 368 HH2 TRP 43 HH2 TRP 43 8.072 -0.555 5.831 369 H THR 44 H THR 44 13.173 -1.936 2.634 370 HA THR 44 HA THR 44 10.618 -3.409 2.628 371 HB THR 44 HB THR 44 11.666 -5.459 3.320 372 HG1 THR 44 HG1 THR 44 13.930 -5.703 3.245 373 HG21 THR 44 HG21 THR 44 11.439 -5.066 0.863 374 HG22 THR 44 HG22 THR 44 13.154 -4.628 0.805 375 HG23 THR 44 HG23 THR 44 12.660 -6.267 1.303 376 H GLY 45 H GLY 45 9.848 -4.044 4.578 377 HA2 GLY 45 HA2 GLY 45 11.089 -3.649 7.101 378 HA3 GLY 45 HA3 GLY 45 10.252 -2.160 6.667 379 H ARG 46 H ARG 46 8.532 -2.104 7.831 380 HA ARG 46 HA ARG 46 6.714 -4.467 8.229 381 HB2 ARG 46 HB2 ARG 46 7.956 -3.934 10.251 382 HB3 ARG 46 HB3 ARG 46 7.486 -2.234 10.152 383 HG2 ARG 46 HG2 ARG 46 5.135 -2.806 10.569 384 HG3 ARG 46 HG3 ARG 46 5.514 -4.533 10.476 385 HD2 ARG 46 HD2 ARG 46 5.297 -3.990 12.778 386 HD3 ARG 46 HD3 ARG 46 7.011 -4.263 12.461 387 HE ARG 46 HE ARG 46 5.866 -1.469 12.510 388 HH11 ARG 46 HH11 ARG 46 6.600 -0.071 13.849 389 HH12 ARG 46 HH12 ARG 46 7.874 -0.440 15.015 390 HH21 ARG 46 HH21 ARG 46 8.136 -3.724 13.989 391 HH22 ARG 46 HH22 ARG 46 8.759 -2.488 15.044 392 H LEU 47 H LEU 47 4.566 -4.192 8.004 393 HA LEU 47 HA LEU 47 3.570 -1.711 6.731 394 HB2 LEU 47 HB2 LEU 47 2.996 -3.995 5.832 395 HB3 LEU 47 HB3 LEU 47 2.253 -4.362 7.384 396 HG LEU 47 HG LEU 47 0.688 -2.350 6.947 397 HD11 LEU 47 HD11 LEU 47 1.923 -1.306 5.112 398 HD12 LEU 47 HD12 LEU 47 1.702 -2.763 4.114 399 HD13 LEU 47 HD13 LEU 47 0.303 -1.779 4.609 400 HD21 LEU 47 HD21 LEU 47 0.533 -4.804 5.165 401 HD22 LEU 47 HD22 LEU 47 -0.025 -4.697 6.846 402 HD23 LEU 47 HD23 LEU 47 -0.822 -3.739 5.603 403 H ARG 48 H ARG 48 2.206 -0.272 7.732 404 HA ARG 48 HA ARG 48 0.554 -1.283 9.982 405 HB2 ARG 48 HB2 ARG 48 1.676 1.530 9.763 406 HB3 ARG 48 HB3 ARG 48 0.455 1.028 10.930 407 HG2 ARG 48 HG2 ARG 48 3.298 -0.058 10.772 408 HG3 ARG 48 HG3 ARG 48 2.768 1.235 11.840 409 HD2 ARG 48 HD2 ARG 48 1.396 -1.465 11.937 410 HD3 ARG 48 HD3 ARG 48 2.949 -1.220 12.735 411 HE ARG 48 HE ARG 48 0.352 -0.192 13.569 412 HH11 ARG 48 HH11 ARG 48 0.203 0.741 15.584 413 HH12 ARG 48 HH12 ARG 48 1.637 1.291 16.394 414 HH21 ARG 48 HH21 ARG 48 3.818 0.464 13.878 415 HH22 ARG 48 HH22 ARG 48 3.605 1.134 15.467 416 H ILE 49 H ILE 49 -1.549 -1.036 9.640 417 HA ILE 49 HA ILE 49 -2.446 1.052 7.697 418 HB ILE 49 HB ILE 49 -3.758 -1.648 8.060 419 HG12 ILE 49 HG12 ILE 49 -2.272 -0.324 5.735 420 HG13 ILE 49 HG13 ILE 49 -1.779 -1.769 6.616 421 HG21 ILE 49 HG21 ILE 49 -4.601 0.639 6.248 422 HG22 ILE 49 HG22 ILE 49 -5.433 -0.917 6.512 423 HG23 ILE 49 HG23 ILE 49 -5.381 0.263 7.806 424 HD11 ILE 49 HD11 ILE 49 -2.661 -2.431 4.498 425 HD12 ILE 49 HD12 ILE 49 -3.800 -2.951 5.743 426 HD13 ILE 49 HD13 ILE 49 -4.148 -1.523 4.727 427 H THR 50 H THR 50 -3.471 2.565 8.656 428 HA THR 50 HA THR 50 -4.899 2.079 11.221 429 HB THR 50 HB THR 50 -4.139 4.416 11.861 430 HG1 THR 50 HG1 THR 50 -2.677 5.403 10.701 431 HG21 THR 50 HG21 THR 50 -1.908 3.773 12.608 432 HG22 THR 50 HG22 THR 50 -3.037 2.435 12.846 433 HG23 THR 50 HG23 THR 50 -1.890 2.391 11.487 434 H SER 51 H SER 51 -6.459 3.923 11.726 435 HA SER 51 HA SER 51 -7.608 5.198 9.331 436 HB2 SER 51 HB2 SER 51 -9.840 4.170 9.722 437 HB3 SER 51 HB3 SER 51 -8.602 3.031 9.176 438 HG SER 51 HG SER 51 -9.545 3.420 11.836 439 H LYS 52 H LYS 52 -7.843 7.194 9.903 440 HA LYS 52 HA LYS 52 -9.316 7.928 12.393 441 HB2 LYS 52 HB2 LYS 52 -7.170 9.090 11.844 442 HB3 LYS 52 HB3 LYS 52 -7.934 9.706 10.368 443 HG2 LYS 52 HG2 LYS 52 -9.795 10.538 12.103 444 HG3 LYS 52 HG3 LYS 52 -8.468 10.377 13.246 445 HD2 LYS 52 HD2 LYS 52 -8.585 12.046 10.709 446 HD3 LYS 52 HD3 LYS 52 -8.550 12.651 12.385 447 HE2 LYS 52 HE2 LYS 52 -6.242 11.946 12.638 448 HE3 LYS 52 HE3 LYS 52 -6.257 11.127 11.074 449 HZ1 LYS 52 HZ1 LYS 52 -6.590 13.334 10.034 450 HZ2 LYS 52 HZ2 LYS 52 -6.512 14.048 11.523 451 HZ3 LYS 52 HZ3 LYS 52 -5.210 13.302 10.921 452 H GLY 53 H GLY 53 -11.323 7.323 11.938 453 HA2 GLY 53 HA2 GLY 53 -13.535 7.674 11.323 454 HA3 GLY 53 HA3 GLY 53 -13.014 9.065 10.372 455 H LYS 54 H LYS 54 -14.016 8.735 8.454 456 HA LYS 54 HA LYS 54 -14.138 6.208 7.008 457 HB2 LYS 54 HB2 LYS 54 -15.774 8.120 6.848 458 HB3 LYS 54 HB3 LYS 54 -14.542 9.078 6.041 459 HG2 LYS 54 HG2 LYS 54 -15.139 6.418 4.789 460 HG3 LYS 54 HG3 LYS 54 -16.483 7.562 4.841 461 HD2 LYS 54 HD2 LYS 54 -15.015 9.274 3.726 462 HD3 LYS 54 HD3 LYS 54 -13.793 8.002 3.499 463 HE2 LYS 54 HE2 LYS 54 -15.505 6.619 2.301 464 HE3 LYS 54 HE3 LYS 54 -16.692 7.908 2.535 465 HZ1 LYS 54 HZ1 LYS 54 -15.145 9.379 1.245 466 HZ2 LYS 54 HZ2 LYS 54 -14.199 8.072 0.924 467 HZ3 LYS 54 HZ3 LYS 54 -15.727 8.144 0.351 468 H THR 55 H THR 55 -11.538 8.149 7.535 469 HA THR 55 HA THR 55 -10.294 7.421 4.979 470 HB THR 55 HB THR 55 -9.151 9.096 7.236 471 HG1 THR 55 HG1 THR 55 -10.027 10.876 6.154 472 HG21 THR 55 HG21 THR 55 -7.648 8.400 5.358 473 HG22 THR 55 HG22 THR 55 -8.839 9.026 4.197 474 HG23 THR 55 HG23 THR 55 -7.962 10.148 5.277 475 H ALA 56 H ALA 56 -8.834 5.853 4.757 476 HA ALA 56 HA ALA 56 -7.597 4.574 7.155 477 HB1 ALA 56 HB1 ALA 56 -7.896 3.544 4.311 478 HB2 ALA 56 HB2 ALA 56 -7.000 2.730 5.613 479 HB3 ALA 56 HB3 ALA 56 -8.749 2.967 5.755 480 H TYR 57 H TYR 57 -5.252 4.169 7.037 481 HA TYR 57 HA TYR 57 -3.732 5.929 5.182 482 HB2 TYR 57 HB2 TYR 57 -3.473 5.826 8.205 483 HB3 TYR 57 HB3 TYR 57 -2.331 6.606 7.127 484 HD1 TYR 57 HD1 TYR 57 -5.811 6.737 8.471 485 HD2 TYR 57 HD2 TYR 57 -2.738 8.830 6.284 486 HE1 TYR 57 HE1 TYR 57 -7.172 8.803 8.542 487 HE2 TYR 57 HE2 TYR 57 -4.068 10.934 6.452 488 HH TYR 57 HH TYR 57 -7.281 11.043 8.033 489 H ILE 58 H ILE 58 -2.318 4.667 4.160 490 HA ILE 58 HA ILE 58 -1.328 2.157 5.426 491 HB ILE 58 HB ILE 58 -0.387 3.231 2.765 492 HG12 ILE 58 HG12 ILE 58 -2.746 3.174 2.415 493 HG13 ILE 58 HG13 ILE 58 -1.968 1.861 1.560 494 HG21 ILE 58 HG21 ILE 58 -0.484 0.468 4.003 495 HG22 ILE 58 HG22 ILE 58 0.143 0.871 2.383 496 HG23 ILE 58 HG23 ILE 58 0.947 1.498 3.819 497 HD11 ILE 58 HD11 ILE 58 -2.757 0.241 3.231 498 HD12 ILE 58 HD12 ILE 58 -3.487 1.555 4.186 499 HD13 ILE 58 HD13 ILE 58 -4.096 1.192 2.563 500 H LYS 59 H LYS 59 0.141 2.610 6.962 501 HA LYS 59 HA LYS 59 2.327 4.593 6.357 502 HB2 LYS 59 HB2 LYS 59 1.453 3.545 9.060 503 HB3 LYS 59 HB3 LYS 59 2.750 4.704 8.749 504 HG2 LYS 59 HG2 LYS 59 0.969 6.215 7.691 505 HG3 LYS 59 HG3 LYS 59 -0.247 5.096 8.319 506 HD2 LYS 59 HD2 LYS 59 1.747 6.732 9.937 507 HD3 LYS 59 HD3 LYS 59 -0.002 6.996 9.827 508 HE2 LYS 59 HE2 LYS 59 -0.456 4.880 10.940 509 HE3 LYS 59 HE3 LYS 59 1.274 4.489 10.993 510 HZ1 LYS 59 HZ1 LYS 59 0.568 5.427 13.101 511 HZ2 LYS 59 HZ2 LYS 59 1.588 6.488 12.389 512 HZ3 LYS 59 HZ3 LYS 59 -0.029 6.771 12.387 513 H LEU 60 H LEU 60 4.445 3.949 6.384 514 HA LEU 60 HA LEU 60 4.936 0.989 6.662 515 HB2 LEU 60 HB2 LEU 60 6.062 3.007 4.681 516 HB3 LEU 60 HB3 LEU 60 6.649 1.355 4.865 517 HG LEU 60 HG LEU 60 3.795 2.074 4.046 518 HD11 LEU 60 HD11 LEU 60 4.475 1.359 1.797 519 HD12 LEU 60 HD12 LEU 60 5.436 2.745 2.335 520 HD13 LEU 60 HD13 LEU 60 6.140 1.110 2.370 521 HD21 LEU 60 HD21 LEU 60 3.694 -0.312 3.352 522 HD22 LEU 60 HD22 LEU 60 5.314 -0.575 4.037 523 HD23 LEU 60 HD23 LEU 60 3.950 -0.151 5.092 524 H GLU 61 H GLU 61 6.537 0.367 7.976 525 HA GLU 61 HA GLU 61 8.146 2.500 9.335 526 HB2 GLU 61 HB2 GLU 61 6.866 0.024 10.543 527 HB3 GLU 61 HB3 GLU 61 7.890 1.189 11.388 528 HG2 GLU 61 HG2 GLU 61 6.196 2.980 10.821 529 HG3 GLU 61 HG3 GLU 61 5.128 1.701 10.220 530 H ASP 62 H ASP 62 10.262 1.984 10.090 531 HA ASP 62 HA ASP 62 11.692 -0.093 8.694 532 HB2 ASP 62 HB2 ASP 62 12.707 2.053 9.227 533 HB3 ASP 62 HB3 ASP 62 12.384 1.829 10.948 534 H LYS 63 H LYS 63 12.127 -2.104 9.357 535 HA LYS 63 HA LYS 63 10.530 -3.365 11.345 536 HB2 LYS 63 HB2 LYS 63 11.438 -4.291 9.187 537 HB3 LYS 63 HB3 LYS 63 13.027 -4.417 9.946 538 HG2 LYS 63 HG2 LYS 63 12.077 -6.025 11.597 539 HG3 LYS 63 HG3 LYS 63 10.488 -5.878 10.831 540 HD2 LYS 63 HD2 LYS 63 13.025 -6.840 9.426 541 HD3 LYS 63 HD3 LYS 63 11.847 -7.910 10.197 542 HE2 LYS 63 HE2 LYS 63 10.081 -7.125 8.665 543 HE3 LYS 63 HE3 LYS 63 11.221 -6.023 7.884 544 HZ1 LYS 63 HZ1 LYS 63 11.536 -8.974 7.966 545 HZ2 LYS 63 HZ2 LYS 63 10.992 -8.146 6.673 546 HZ3 LYS 63 HZ3 LYS 63 12.532 -7.937 7.188 547 H VAL 64 H VAL 64 13.436 -1.648 11.841 548 HA VAL 64 HA VAL 64 14.285 -3.266 14.199 549 HB VAL 64 HB VAL 64 15.955 -1.113 12.885 550 HG11 VAL 64 HG11 VAL 64 16.654 -3.690 14.343 551 HG12 VAL 64 HG12 VAL 64 17.804 -2.481 13.728 552 HG13 VAL 64 HG13 VAL 64 16.695 -2.050 15.034 553 HG21 VAL 64 HG21 VAL 64 17.056 -2.855 11.488 554 HG22 VAL 64 HG22 VAL 64 15.747 -3.990 11.908 555 HG23 VAL 64 HG23 VAL 64 15.405 -2.505 10.980 556 H SER 65 H SER 65 13.518 0.035 13.098 557 HA SER 65 HA SER 65 13.582 0.905 15.960 558 HB2 SER 65 HB2 SER 65 14.455 2.404 13.468 559 HB3 SER 65 HB3 SER 65 14.420 3.083 15.108 560 HG SER 65 HG SER 65 16.498 2.277 14.521 561 H GLY 66 H GLY 66 11.374 0.489 13.473 562 HA2 GLY 66 HA2 GLY 66 9.203 1.144 13.254 563 HA3 GLY 66 HA3 GLY 66 9.312 1.976 14.810 564 H GLU 67 H GLU 67 11.619 3.027 12.445 565 HA GLU 67 HA GLU 67 10.507 5.712 12.451 566 HB2 GLU 67 HB2 GLU 67 12.808 4.525 10.847 567 HB3 GLU 67 HB3 GLU 67 12.385 6.241 10.929 568 HG2 GLU 67 HG2 GLU 67 12.721 6.165 13.421 569 HG3 GLU 67 HG3 GLU 67 13.283 4.499 13.263 570 H LEU 68 H LEU 68 9.412 6.845 10.843 571 HA LEU 68 HA LEU 68 7.863 5.223 9.049 572 HB2 LEU 68 HB2 LEU 68 7.068 7.311 10.254 573 HB3 LEU 68 HB3 LEU 68 8.053 8.251 9.133 574 HG LEU 68 HG LEU 68 6.701 7.058 7.240 575 HD11 LEU 68 HD11 LEU 68 4.440 6.331 7.871 576 HD12 LEU 68 HD12 LEU 68 5.639 5.316 8.681 577 HD13 LEU 68 HD13 LEU 68 4.809 6.590 9.590 578 HD21 LEU 68 HD21 LEU 68 6.417 9.431 7.826 579 HD22 LEU 68 HD22 LEU 68 4.886 8.663 7.378 580 HD23 LEU 68 HD23 LEU 68 5.255 8.981 9.096 581 H PHE 69 H PHE 69 8.314 4.568 7.094 582 HA PHE 69 HA PHE 69 10.439 5.731 5.383 583 HB2 PHE 69 HB2 PHE 69 10.344 3.377 5.445 584 HB3 PHE 69 HB3 PHE 69 8.597 3.339 5.258 585 HD1 PHE 69 HD1 PHE 69 11.434 4.933 3.314 586 HD2 PHE 69 HD2 PHE 69 7.948 2.406 3.246 587 HE1 PHE 69 HE1 PHE 69 11.648 4.696 0.865 588 HE2 PHE 69 HE2 PHE 69 8.163 2.140 0.802 589 HZ PHE 69 HZ PHE 69 10.009 3.318 -0.415 590 H ALA 70 H ALA 70 6.892 5.193 5.181 591 HA ALA 70 HA ALA 70 6.475 7.707 3.753 592 HB1 ALA 70 HB1 ALA 70 5.444 6.625 1.775 593 HB2 ALA 70 HB2 ALA 70 7.158 6.201 1.898 594 HB3 ALA 70 HB3 ALA 70 5.915 5.029 2.387 595 H GLN 71 H GLN 71 4.164 8.107 3.357 596 HA GLN 71 HA GLN 71 2.273 6.260 4.600 597 HB2 GLN 71 HB2 GLN 71 1.042 7.961 5.815 598 HB3 GLN 71 HB3 GLN 71 2.672 7.748 6.446 599 HG2 GLN 71 HG2 GLN 71 3.411 9.829 5.347 600 HG3 GLN 71 HG3 GLN 71 1.824 10.027 4.595 601 HE21 GLN 71 HE21 GLN 71 2.278 11.070 8.525 602 HE22 GLN 71 HE22 GLN 71 3.583 10.229 7.704 603 H ALA 72 H ALA 72 0.379 6.072 3.552 604 HA ALA 72 HA ALA 72 -0.274 7.965 1.333 605 HB1 ALA 72 HB1 ALA 72 -1.399 6.003 0.259 606 HB2 ALA 72 HB2 ALA 72 0.352 5.852 0.362 607 HB3 ALA 72 HB3 ALA 72 -0.691 4.960 1.493 608 HA PRO 73 HA PRO 73 -4.162 8.047 3.831 609 HB2 PRO 73 HB2 PRO 73 -5.228 10.354 2.868 610 HB3 PRO 73 HB3 PRO 73 -3.890 10.335 4.056 611 HG2 PRO 73 HG2 PRO 73 -3.709 10.739 1.065 612 HG3 PRO 73 HG3 PRO 73 -2.886 11.650 2.363 613 HD2 PRO 73 HD2 PRO 73 -1.718 9.580 0.942 614 HD3 PRO 73 HD3 PRO 73 -1.263 9.992 2.623 615 H VAL 74 H VAL 74 -5.911 6.882 3.241 616 HA VAL 74 HA VAL 74 -6.713 6.666 0.375 617 HB VAL 74 HB VAL 74 -6.923 4.508 2.496 618 HG11 VAL 74 HG11 VAL 74 -7.396 4.224 -0.477 619 HG12 VAL 74 HG12 VAL 74 -7.724 3.059 0.837 620 HG13 VAL 74 HG13 VAL 74 -8.701 4.487 0.696 621 HG21 VAL 74 HG21 VAL 74 -5.236 3.257 1.377 622 HG22 VAL 74 HG22 VAL 74 -5.015 4.527 0.166 623 HG23 VAL 74 HG23 VAL 74 -4.565 4.815 1.859 624 H GLU 75 H GLU 75 -8.682 7.254 -0.095 625 HA GLU 75 HA GLU 75 -10.688 7.821 2.070 626 HB2 GLU 75 HB2 GLU 75 -10.203 9.084 -0.668 627 HB3 GLU 75 HB3 GLU 75 -11.432 9.601 0.487 628 HG2 GLU 75 HG2 GLU 75 -9.796 10.453 2.014 629 HG3 GLU 75 HG3 GLU 75 -8.462 9.663 1.181 630 H GLN 76 H GLN 76 -10.114 5.682 -0.462 631 HA GLN 76 HA GLN 76 -12.712 4.565 -0.418 632 HB2 GLN 76 HB2 GLN 76 -13.412 4.860 -2.671 633 HB3 GLN 76 HB3 GLN 76 -13.129 6.464 -2.023 634 HG2 GLN 76 HG2 GLN 76 -11.327 4.941 -3.954 635 HG3 GLN 76 HG3 GLN 76 -12.407 6.256 -4.352 636 HE21 GLN 76 HE21 GLN 76 -8.721 7.124 -2.837 637 HE22 GLN 76 HE22 GLN 76 -9.329 5.456 -2.743 638 H TYR 77 H TYR 77 -12.698 2.461 -1.275 639 HA TYR 77 HA TYR 77 -10.281 1.535 -2.705 640 HB2 TYR 77 HB2 TYR 77 -10.113 1.034 -0.254 641 HB3 TYR 77 HB3 TYR 77 -11.541 0.009 -0.411 642 HD1 TYR 77 HD1 TYR 77 -8.548 0.357 -2.661 643 HD2 TYR 77 HD2 TYR 77 -10.598 -2.122 0.198 644 HE1 TYR 77 HE1 TYR 77 -6.873 -1.368 -2.995 645 HE2 TYR 77 HE2 TYR 77 -8.971 -3.946 -0.252 646 HH TYR 77 HH TYR 77 -6.237 -3.548 -2.526 647 HA PRO 78 HA PRO 78 -9.670 0.134 -4.443 648 HB2 PRO 78 HB2 PRO 78 -10.100 0.126 -7.120 649 HB3 PRO 78 HB3 PRO 78 -10.142 -1.355 -6.115 650 HG2 PRO 78 HG2 PRO 78 -12.497 0.349 -7.005 651 HG3 PRO 78 HG3 PRO 78 -12.301 -1.430 -7.152 652 HD2 PRO 78 HD2 PRO 78 -13.677 -0.336 -5.091 653 HD3 PRO 78 HD3 PRO 78 -12.613 -1.748 -4.824 654 H GLY 79 H GLY 79 -8.422 1.855 -5.359 655 HA2 GLY 79 HA2 GLY 79 -9.617 4.206 -6.559 656 HA3 GLY 79 HA3 GLY 79 -9.194 4.465 -4.865 657 H ILE 80 H ILE 80 -7.753 6.116 -5.816 658 HA ILE 80 HA ILE 80 -5.435 5.183 -7.367 659 HB ILE 80 HB ILE 80 -6.488 7.314 -7.928 660 HG12 ILE 80 HG12 ILE 80 -4.545 8.748 -8.103 661 HG13 ILE 80 HG13 ILE 80 -3.693 7.848 -6.853 662 HG21 ILE 80 HG21 ILE 80 -5.541 8.346 -5.213 663 HG22 ILE 80 HG22 ILE 80 -6.262 9.308 -6.510 664 HG23 ILE 80 HG23 ILE 80 -7.234 8.083 -5.695 665 HD11 ILE 80 HD11 ILE 80 -2.946 7.326 -9.183 666 HD12 ILE 80 HD12 ILE 80 -3.514 5.892 -8.322 667 HD13 ILE 80 HD13 ILE 80 -4.564 6.671 -9.528 668 H ALA 81 H ALA 81 -6.248 5.784 -4.032 669 HA ALA 81 HA ALA 81 -3.445 5.892 -3.258 670 HB1 ALA 81 HB1 ALA 81 -5.947 5.988 -1.550 671 HB2 ALA 81 HB2 ALA 81 -4.274 6.361 -1.036 672 HB3 ALA 81 HB3 ALA 81 -5.111 7.412 -2.208 673 H VAL 82 H VAL 82 -5.862 3.440 -3.451 674 HA VAL 82 HA VAL 82 -3.624 1.608 -3.142 675 HB VAL 82 HB VAL 82 -4.375 1.557 -0.932 676 HG11 VAL 82 HG11 VAL 82 -7.048 1.764 -1.835 677 HG12 VAL 82 HG12 VAL 82 -6.821 0.335 -0.770 678 HG13 VAL 82 HG13 VAL 82 -6.312 1.916 -0.244 679 HG21 VAL 82 HG21 VAL 82 -4.756 -0.852 -0.704 680 HG22 VAL 82 HG22 VAL 82 -4.919 -0.959 -2.469 681 HG23 VAL 82 HG23 VAL 82 -3.420 -0.383 -1.770 682 H GLU 83 H GLU 83 -3.632 0.614 -4.976 683 HA GLU 83 HA GLU 83 -6.164 -0.312 -6.281 684 HB2 GLU 83 HB2 GLU 83 -4.418 1.688 -7.215 685 HB3 GLU 83 HB3 GLU 83 -3.895 0.252 -8.087 686 HG2 GLU 83 HG2 GLU 83 -6.786 1.212 -7.952 687 HG3 GLU 83 HG3 GLU 83 -5.652 1.691 -9.213 688 H THR 84 H THR 84 -6.028 -2.227 -7.551 689 HA THR 84 HA THR 84 -3.764 -4.046 -6.787 690 HB THR 84 HB THR 84 -6.357 -5.001 -7.874 691 HG1 THR 84 HG1 THR 84 -7.104 -5.277 -5.767 692 HG21 THR 84 HG21 THR 84 -5.717 -7.033 -6.667 693 HG22 THR 84 HG22 THR 84 -4.473 -6.501 -7.807 694 HG23 THR 84 HG23 THR 84 -4.251 -6.204 -6.066 695 H VAL 85 H VAL 85 -2.631 -3.020 -8.308 696 HA VAL 85 HA VAL 85 -1.617 -2.796 -10.442 697 HB VAL 85 HB VAL 85 -0.687 -5.183 -10.821 698 HG11 VAL 85 HG11 VAL 85 0.794 -4.822 -8.854 699 HG12 VAL 85 HG12 VAL 85 0.459 -3.309 -9.688 700 HG13 VAL 85 HG13 VAL 85 -0.375 -3.691 -8.169 701 HG21 VAL 85 HG21 VAL 85 -2.504 -6.409 -9.532 702 HG22 VAL 85 HG22 VAL 85 -0.853 -6.740 -9.024 703 HG23 VAL 85 HG23 VAL 85 -1.873 -5.657 -8.068 704 H THR 86 H THR 86 -3.336 -5.832 -10.945 705 HA THR 86 HA THR 86 -4.919 -4.591 -13.016 706 HB THR 86 HB THR 86 -4.845 -6.708 -14.457 707 HG1 THR 86 HG1 THR 86 -2.959 -7.867 -14.404 708 HG21 THR 86 HG21 THR 86 -2.245 -5.148 -14.302 709 HG22 THR 86 HG22 THR 86 -2.958 -5.880 -15.767 710 HG23 THR 86 HG23 THR 86 -3.711 -4.450 -15.011 711 H ASP 87 H ASP 87 -4.202 -7.638 -11.346 712 HA ASP 87 HA ASP 87 -7.100 -7.966 -10.686 713 HB2 ASP 87 HB2 ASP 87 -5.561 -9.543 -12.706 714 HB3 ASP 87 HB3 ASP 87 -6.712 -10.417 -11.685 715 H SER 88 H SER 88 -4.449 -10.396 -10.693 716 HA SER 88 HA SER 88 -4.696 -11.382 -8.166 717 HB2 SER 88 HB2 SER 88 -2.832 -11.923 -9.737 718 HB3 SER 88 HB3 SER 88 -1.938 -10.561 -9.101 719 HG SER 88 HG SER 88 -1.820 -12.830 -8.184 720 H SER 89 H SER 89 -4.424 -10.886 -6.167 721 HA SER 89 HA SER 89 -3.344 -8.250 -5.363 722 HB2 SER 89 HB2 SER 89 -4.802 -8.494 -3.432 723 HB3 SER 89 HB3 SER 89 -5.621 -8.548 -5.011 724 HG SER 89 HG SER 89 -6.464 -10.165 -3.666 725 H ARG 90 H ARG 90 -1.643 -10.528 -5.999 726 HA ARG 90 HA ARG 90 -0.077 -10.942 -3.534 727 HB2 ARG 90 HB2 ARG 90 0.105 -12.319 -5.682 728 HB3 ARG 90 HB3 ARG 90 0.863 -10.925 -6.441 729 HG2 ARG 90 HG2 ARG 90 2.682 -10.990 -4.729 730 HG3 ARG 90 HG3 ARG 90 1.920 -12.390 -3.971 731 HD2 ARG 90 HD2 ARG 90 3.038 -12.278 -6.811 732 HD3 ARG 90 HD3 ARG 90 3.866 -12.944 -5.414 733 HE ARG 90 HE ARG 90 2.405 -14.803 -5.355 734 HH11 ARG 90 HH11 ARG 90 0.964 -16.258 -6.320 735 HH12 ARG 90 HH12 ARG 90 0.145 -15.797 -7.801 736 HH21 ARG 90 HH21 ARG 90 1.694 -12.789 -8.139 737 HH22 ARG 90 HH22 ARG 90 0.380 -13.848 -8.634 738 H TYR 91 H TYR 91 -0.412 -8.482 -6.003 739 HA TYR 91 HA TYR 91 1.518 -6.690 -4.599 740 HB2 TYR 91 HB2 TYR 91 0.815 -6.667 -7.539 741 HB3 TYR 91 HB3 TYR 91 2.083 -5.743 -6.751 742 HD1 TYR 91 HD1 TYR 91 3.993 -7.104 -5.637 743 HD2 TYR 91 HD2 TYR 91 1.292 -8.700 -8.583 744 HE1 TYR 91 HE1 TYR 91 5.621 -8.930 -6.131 745 HE2 TYR 91 HE2 TYR 91 2.899 -10.504 -9.100 746 HH TYR 91 HH TYR 91 6.065 -10.771 -7.382 747 H PHE 92 H PHE 92 1.125 -4.413 -4.872 748 HA PHE 92 HA PHE 92 -1.558 -3.504 -5.732 749 HB2 PHE 92 HB2 PHE 92 -0.424 -2.811 -2.994 750 HB3 PHE 92 HB3 PHE 92 -1.909 -2.180 -3.688 751 HD1 PHE 92 HD1 PHE 92 -3.831 -3.801 -4.225 752 HD2 PHE 92 HD2 PHE 92 -0.421 -4.864 -1.807 753 HE1 PHE 92 HE1 PHE 92 -5.075 -5.756 -3.331 754 HE2 PHE 92 HE2 PHE 92 -1.683 -6.764 -0.872 755 HZ PHE 92 HZ PHE 92 -3.988 -7.260 -1.663 756 H VAL 93 H VAL 93 -1.609 -1.026 -5.604 757 HA VAL 93 HA VAL 93 1.040 0.309 -5.625 758 HB VAL 93 HB VAL 93 -1.147 0.880 -7.668 759 HG11 VAL 93 HG11 VAL 93 -0.078 2.983 -7.006 760 HG12 VAL 93 HG12 VAL 93 1.535 2.250 -7.178 761 HG13 VAL 93 HG13 VAL 93 0.506 2.508 -8.595 762 HG21 VAL 93 HG21 VAL 93 0.605 0.277 -9.334 763 HG22 VAL 93 HG22 VAL 93 1.675 -0.226 -8.017 764 HG23 VAL 93 HG23 VAL 93 0.154 -1.093 -8.316 765 H ILE 94 H ILE 94 1.061 2.175 -4.424 766 HA ILE 94 HA ILE 94 -1.536 3.328 -3.564 767 HB ILE 94 HB ILE 94 -0.776 3.602 -1.288 768 HG12 ILE 94 HG12 ILE 94 1.691 1.918 -1.951 769 HG13 ILE 94 HG13 ILE 94 1.731 3.674 -1.841 770 HG21 ILE 94 HG21 ILE 94 -0.952 1.290 -0.518 771 HG22 ILE 94 HG22 ILE 94 -1.986 1.515 -1.901 772 HG23 ILE 94 HG23 ILE 94 -0.450 0.666 -2.098 773 HD11 ILE 94 HD11 ILE 94 2.457 2.682 0.266 774 HD12 ILE 94 HD12 ILE 94 0.952 3.602 0.478 775 HD13 ILE 94 HD13 ILE 94 0.901 1.844 0.431 776 H ARG 95 H ARG 95 -1.535 5.508 -3.028 777 HA ARG 95 HA ARG 95 0.718 7.122 -4.162 778 HB2 ARG 95 HB2 ARG 95 -0.735 8.919 -4.523 779 HB3 ARG 95 HB3 ARG 95 -1.542 7.469 -5.099 780 HG2 ARG 95 HG2 ARG 95 -3.336 8.308 -4.042 781 HG3 ARG 95 HG3 ARG 95 -2.594 7.581 -2.610 782 HD2 ARG 95 HD2 ARG 95 -1.523 9.744 -2.086 783 HD3 ARG 95 HD3 ARG 95 -2.419 10.474 -3.426 784 HE ARG 95 HE ARG 95 -3.594 9.191 -0.956 785 HH11 ARG 95 HH11 ARG 95 -5.555 9.642 -0.324 786 HH12 ARG 95 HH12 ARG 95 -6.554 10.853 -1.105 787 HH21 ARG 95 HH21 ARG 95 -4.181 11.496 -3.559 788 HH22 ARG 95 HH22 ARG 95 -5.777 11.844 -2.943 789 H ILE 96 H ILE 96 2.196 7.716 -2.814 790 HA ILE 96 HA ILE 96 1.533 8.206 0.057 791 HB ILE 96 HB ILE 96 3.938 7.904 0.482 792 HG12 ILE 96 HG12 ILE 96 4.256 6.743 -2.303 793 HG13 ILE 96 HG13 ILE 96 4.596 8.451 -1.984 794 HG21 ILE 96 HG21 ILE 96 2.486 5.595 -0.850 795 HG22 ILE 96 HG22 ILE 96 3.945 5.406 0.140 796 HG23 ILE 96 HG23 ILE 96 2.477 6.050 0.869 797 HD11 ILE 96 HD11 ILE 96 5.959 6.128 -0.615 798 HD12 ILE 96 HD12 ILE 96 6.639 7.196 -1.865 799 HD13 ILE 96 HD13 ILE 96 6.218 7.844 -0.261 800 H GLN 97 H GLN 97 2.725 9.909 1.168 801 HA GLN 97 HA GLN 97 3.840 12.017 -0.614 802 HB2 GLN 97 HB2 GLN 97 2.322 12.651 1.323 803 HB3 GLN 97 HB3 GLN 97 3.679 12.272 2.379 804 HG2 GLN 97 HG2 GLN 97 3.955 14.173 -0.017 805 HG3 GLN 97 HG3 GLN 97 3.279 14.719 1.502 806 HE21 GLN 97 HE21 GLN 97 6.341 14.632 3.307 807 HE22 GLN 97 HE22 GLN 97 4.606 14.359 3.481 808 H ASP 98 H ASP 98 6.025 12.150 -0.919 809 HA ASP 98 HA ASP 98 7.442 9.688 -0.325 810 HB2 ASP 98 HB2 ASP 98 7.265 11.035 -2.531 811 HB3 ASP 98 HB3 ASP 98 8.474 12.104 -1.819 812 H GLY 99 H GLY 99 7.133 12.378 1.477 813 HA2 GLY 99 HA2 GLY 99 8.066 12.679 3.614 814 HA3 GLY 99 HA3 GLY 99 9.421 11.633 3.192 815 H THR 100 H THR 100 8.832 14.100 0.875 816 HA THR 100 HA THR 100 10.705 16.017 2.130 817 HB THR 100 HB THR 100 12.034 14.377 0.876 818 HG1 THR 100 HG1 THR 100 12.916 16.364 1.204 819 HG21 THR 100 HG21 THR 100 10.545 13.936 -0.990 820 HG22 THR 100 HG22 THR 100 10.734 15.613 -1.564 821 HG23 THR 100 HG23 THR 100 12.126 14.505 -1.558 822 H GLY 101 H GLY 101 7.807 15.984 1.463 823 HA2 GLY 101 HA2 GLY 101 6.374 17.811 1.241 824 HA3 GLY 101 HA3 GLY 101 7.669 18.782 0.533 825 H ARG 102 H ARG 102 6.988 15.568 -0.668 826 HA ARG 102 HA ARG 102 5.496 16.564 -3.030 827 HB2 ARG 102 HB2 ARG 102 7.025 15.673 -4.599 828 HB3 ARG 102 HB3 ARG 102 8.004 16.610 -3.443 829 HG2 ARG 102 HG2 ARG 102 8.594 14.441 -2.314 830 HG3 ARG 102 HG3 ARG 102 7.742 13.583 -3.616 831 HD2 ARG 102 HD2 ARG 102 9.248 14.610 -5.287 832 HD3 ARG 102 HD3 ARG 102 10.126 15.423 -3.975 833 HE ARG 102 HE ARG 102 9.913 12.485 -3.702 834 HH11 ARG 102 HH11 ARG 102 11.604 11.301 -3.636 835 HH12 ARG 102 HH12 ARG 102 13.185 11.860 -4.189 836 HH21 ARG 102 HH21 ARG 102 11.984 15.000 -5.026 837 HH22 ARG 102 HH22 ARG 102 13.381 13.959 -4.967 838 H SER 103 H SER 103 4.172 15.001 -4.051 839 HA SER 103 HA SER 103 3.890 12.502 -2.493 840 HB2 SER 103 HB2 SER 103 2.099 13.622 -4.681 841 HB3 SER 103 HB3 SER 103 1.779 12.163 -3.722 842 HG SER 103 HG SER 103 0.733 14.050 -2.876 843 H ALA 104 H ALA 104 3.720 10.413 -3.542 844 HA ALA 104 HA ALA 104 4.807 10.074 -6.269 845 HB1 ALA 104 HB1 ALA 104 6.594 8.557 -5.485 846 HB2 ALA 104 HB2 ALA 104 6.832 10.202 -4.873 847 HB3 ALA 104 HB3 ALA 104 6.188 8.940 -3.799 848 H PHE 105 H PHE 105 4.405 8.025 -7.194 849 HA PHE 105 HA PHE 105 2.552 6.255 -5.666 850 HB2 PHE 105 HB2 PHE 105 3.185 6.116 -8.614 851 HB3 PHE 105 HB3 PHE 105 1.908 5.284 -7.739 852 HD1 PHE 105 HD1 PHE 105 2.885 8.315 -9.470 853 HD2 PHE 105 HD2 PHE 105 -0.010 6.697 -6.705 854 HE1 PHE 105 HE1 PHE 105 1.415 10.258 -9.876 855 HE2 PHE 105 HE2 PHE 105 -1.506 8.625 -7.170 856 HZ PHE 105 HZ PHE 105 -0.811 10.405 -8.742 857 H ILE 106 H ILE 106 3.218 4.374 -4.904 858 HA ILE 106 HA ILE 106 5.535 3.007 -6.187 859 HB ILE 106 HB ILE 106 6.374 2.060 -4.137 860 HG12 ILE 106 HG12 ILE 106 4.117 3.645 -2.789 861 HG13 ILE 106 HG13 ILE 106 4.388 1.898 -2.766 862 HG21 ILE 106 HG21 ILE 106 7.155 4.343 -4.987 863 HG22 ILE 106 HG22 ILE 106 6.132 5.087 -3.749 864 HG23 ILE 106 HG23 ILE 106 7.475 4.023 -3.279 865 HD11 ILE 106 HD11 ILE 106 6.545 2.355 -1.514 866 HD12 ILE 106 HD12 ILE 106 5.998 4.026 -1.337 867 HD13 ILE 106 HD13 ILE 106 5.035 2.712 -0.639 868 H GLY 107 H GLY 107 5.345 0.954 -6.552 869 HA2 GLY 107 HA2 GLY 107 2.866 -0.541 -6.164 870 HA3 GLY 107 HA3 GLY 107 4.368 -1.136 -6.867 871 H ILE 108 H ILE 108 2.903 -2.523 -4.918 872 HA ILE 108 HA ILE 108 4.933 -2.647 -2.741 873 HB ILE 108 HB ILE 108 1.971 -3.258 -2.369 874 HG12 ILE 108 HG12 ILE 108 3.522 -0.766 -1.528 875 HG13 ILE 108 HG13 ILE 108 2.165 -0.847 -2.659 876 HG21 ILE 108 HG21 ILE 108 4.250 -2.993 -0.360 877 HG22 ILE 108 HG22 ILE 108 2.570 -3.418 0.035 878 HG23 ILE 108 HG23 ILE 108 3.532 -4.534 -0.883 879 HD11 ILE 108 HD11 ILE 108 2.072 -1.279 0.345 880 HD12 ILE 108 HD12 ILE 108 1.279 -0.041 -0.622 881 HD13 ILE 108 HD13 ILE 108 0.730 -1.717 -0.750 882 H GLY 109 H GLY 109 5.547 -4.791 -2.202 883 HA2 GLY 109 HA2 GLY 109 4.003 -7.068 -3.338 884 HA3 GLY 109 HA3 GLY 109 5.756 -7.051 -3.538 885 H PHE 110 H PHE 110 3.625 -8.619 -1.904 886 HA PHE 110 HA PHE 110 5.052 -8.568 0.726 887 HB2 PHE 110 HB2 PHE 110 2.450 -9.855 -0.088 888 HB3 PHE 110 HB3 PHE 110 3.223 -10.114 1.444 889 HD1 PHE 110 HD1 PHE 110 2.755 -8.803 3.280 890 HD2 PHE 110 HD2 PHE 110 1.952 -7.213 -0.652 891 HE1 PHE 110 HE1 PHE 110 1.604 -6.875 4.294 892 HE2 PHE 110 HE2 PHE 110 0.886 -5.228 0.379 893 HZ PHE 110 HZ PHE 110 0.746 -5.031 2.844 894 H THR 111 H THR 111 5.558 -10.570 1.720 895 HA THR 111 HA THR 111 7.133 -12.278 -0.007 896 HB THR 111 HB THR 111 7.660 -11.308 2.240 897 HG1 THR 111 HG1 THR 111 8.981 -13.061 2.720 898 HG21 THR 111 HG21 THR 111 7.153 -12.601 4.240 899 HG22 THR 111 HG22 THR 111 5.644 -12.080 3.479 900 HG23 THR 111 HG23 THR 111 6.190 -13.760 3.298 901 H ASP 112 H ASP 112 3.946 -12.433 1.187 902 HA ASP 112 HA ASP 112 3.590 -15.105 -0.045 903 HB2 ASP 112 HB2 ASP 112 3.725 -15.212 2.537 904 HB3 ASP 112 HB3 ASP 112 2.165 -14.374 2.531 905 H ARG 113 H ARG 113 1.655 -15.449 -1.098 906 HA ARG 113 HA ARG 113 0.109 -13.306 -2.165 907 HB2 ARG 113 HB2 ARG 113 0.404 -15.622 -3.122 908 HB3 ARG 113 HB3 ARG 113 -0.576 -16.267 -1.814 909 HG2 ARG 113 HG2 ARG 113 -1.908 -16.162 -3.794 910 HG3 ARG 113 HG3 ARG 113 -2.543 -14.962 -2.668 911 HD2 ARG 113 HD2 ARG 113 -1.434 -13.157 -3.914 912 HD3 ARG 113 HD3 ARG 113 -0.592 -14.338 -4.921 913 HE ARG 113 HE ARG 113 -2.481 -14.609 -6.255 914 HH11 ARG 113 HH11 ARG 113 -4.259 -14.140 -7.073 915 HH12 ARG 113 HH12 ARG 113 -5.562 -13.301 -6.172 916 HH21 ARG 113 HH21 ARG 113 -3.489 -12.778 -3.440 917 HH22 ARG 113 HH22 ARG 113 -4.942 -12.235 -4.225 918 H GLY 114 H GLY 114 -0.436 -15.337 0.700 919 HA2 GLY 114 HA2 GLY 114 -3.084 -14.322 1.312 920 HA3 GLY 114 HA3 GLY 114 -2.033 -15.291 2.349 921 H ASP 115 H ASP 115 0.222 -13.307 2.155 922 HA ASP 115 HA ASP 115 -0.604 -11.542 4.338 923 HB2 ASP 115 HB2 ASP 115 1.995 -11.815 2.811 924 HB3 ASP 115 HB3 ASP 115 1.720 -10.660 4.115 925 H ALA 116 H ALA 116 0.074 -11.078 0.860 926 HA ALA 116 HA ALA 116 -0.623 -8.264 0.897 927 HB1 ALA 116 HB1 ALA 116 0.674 -9.225 -0.949 928 HB2 ALA 116 HB2 ALA 116 -0.626 -10.369 -1.312 929 HB3 ALA 116 HB3 ALA 116 -0.837 -8.619 -1.569 930 H PHE 117 H PHE 117 -2.574 -11.261 0.261 931 HA PHE 117 HA PHE 117 -5.016 -9.915 -0.233 932 HB2 PHE 117 HB2 PHE 117 -4.662 -12.251 -0.705 933 HB3 PHE 117 HB3 PHE 117 -4.449 -12.604 1.005 934 HD1 PHE 117 HD1 PHE 117 -6.948 -11.755 -1.626 935 HD2 PHE 117 HD2 PHE 117 -6.321 -12.644 2.553 936 HE1 PHE 117 HE1 PHE 117 -9.359 -12.145 -1.331 937 HE2 PHE 117 HE2 PHE 117 -8.684 -13.238 2.791 938 HZ PHE 117 HZ PHE 117 -10.259 -12.942 0.858 939 H ASP 118 H ASP 118 -3.406 -10.404 2.943 940 HA ASP 118 HA ASP 118 -5.787 -9.653 4.465 941 HB2 ASP 118 HB2 ASP 118 -2.842 -9.787 5.192 942 HB3 ASP 118 HB3 ASP 118 -4.135 -9.404 6.325 943 H PHE 119 H PHE 119 -3.029 -7.918 3.016 944 HA PHE 119 HA PHE 119 -3.626 -5.333 4.112 945 HB2 PHE 119 HB2 PHE 119 -1.492 -5.702 3.197 946 HB3 PHE 119 HB3 PHE 119 -2.108 -6.301 1.681 947 HD1 PHE 119 HD1 PHE 119 -3.355 -4.685 0.097 948 HD2 PHE 119 HD2 PHE 119 -0.880 -3.400 3.361 949 HE1 PHE 119 HE1 PHE 119 -3.098 -2.472 -0.969 950 HE2 PHE 119 HE2 PHE 119 -0.747 -1.150 2.377 951 HZ PHE 119 HZ PHE 119 -1.838 -0.670 0.192 952 H ASN 120 H ASN 120 -4.932 -7.166 1.375 953 HA ASN 120 HA ASN 120 -6.712 -5.056 0.454 954 HB2 ASN 120 HB2 ASN 120 -6.337 -6.627 -1.181 955 HB3 ASN 120 HB3 ASN 120 -6.379 -7.988 -0.077 956 HD21 ASN 120 HD21 ASN 120 -9.751 -8.688 -0.636 957 HD22 ASN 120 HD22 ASN 120 -8.250 -9.155 0.144 958 H VAL 121 H VAL 121 -7.390 -7.986 2.519 959 HA VAL 121 HA VAL 121 -10.106 -7.223 2.877 960 HB VAL 121 HB VAL 121 -8.350 -9.078 4.532 961 HG11 VAL 121 HG11 VAL 121 -11.382 -8.738 4.644 962 HG12 VAL 121 HG12 VAL 121 -10.477 -10.086 5.367 963 HG13 VAL 121 HG13 VAL 121 -10.233 -8.451 5.973 964 HG21 VAL 121 HG21 VAL 121 -9.622 -10.840 3.321 965 HG22 VAL 121 HG22 VAL 121 -10.485 -9.590 2.401 966 HG23 VAL 121 HG23 VAL 121 -8.735 -9.812 2.200 967 H SER 122 H SER 122 -7.315 -6.349 4.901 968 HA SER 122 HA SER 122 -8.856 -5.093 6.979 969 HB2 SER 122 HB2 SER 122 -6.728 -3.871 7.480 970 HB3 SER 122 HB3 SER 122 -6.589 -5.639 7.433 971 HG SER 122 HG SER 122 -5.576 -5.543 5.513 972 H LEU 123 H LEU 123 -8.311 -4.050 3.722 973 HA LEU 123 HA LEU 123 -9.311 -1.307 4.350 974 HB2 LEU 123 HB2 LEU 123 -8.159 -2.478 1.806 975 HB3 LEU 123 HB3 LEU 123 -8.727 -0.816 1.989 976 HG LEU 123 HG LEU 123 -6.468 -2.068 3.589 977 HD11 LEU 123 HD11 LEU 123 -4.922 -0.939 2.195 978 HD12 LEU 123 HD12 LEU 123 -6.016 -1.812 1.126 979 HD13 LEU 123 HD13 LEU 123 -6.216 -0.056 1.353 980 HD21 LEU 123 HD21 LEU 123 -7.402 0.827 3.354 981 HD22 LEU 123 HD22 LEU 123 -7.457 -0.191 4.812 982 HD23 LEU 123 HD23 LEU 123 -5.901 0.304 4.145 983 H GLN 124 H GLN 124 -10.211 -4.290 2.554 984 HA GLN 124 HA GLN 124 -12.662 -3.307 1.466 985 HB2 GLN 124 HB2 GLN 124 -12.028 -6.088 2.538 986 HB3 GLN 124 HB3 GLN 124 -13.451 -5.684 1.594 987 HG2 GLN 124 HG2 GLN 124 -10.589 -5.437 0.596 988 HG3 GLN 124 HG3 GLN 124 -11.653 -6.791 0.279 989 HE21 GLN 124 HE21 GLN 124 -11.728 -4.606 -2.708 990 HE22 GLN 124 HE22 GLN 124 -10.507 -5.540 -1.834 991 H ASP 125 H ASP 125 -12.048 -4.862 4.667 992 HA ASP 125 HA ASP 125 -14.732 -4.433 5.627 993 HB2 ASP 125 HB2 ASP 125 -13.071 -6.200 6.372 994 HB3 ASP 125 HB3 ASP 125 -12.236 -4.916 7.265 995 H HIS 126 H HIS 126 -12.211 -2.205 5.187 996 HA HIS 126 HA HIS 126 -13.082 -0.375 7.361 997 HB2 HIS 126 HB2 HIS 126 -10.732 -0.342 6.928 998 HB3 HIS 126 HB3 HIS 126 -10.988 -0.064 5.207 999 HD2 HIS 126 HD2 HIS 126 -11.940 2.324 4.431 1000 HE1 HIS 126 HE1 HIS 126 -11.188 4.424 8.033 1001 HE2 HIS 126 HE2 HIS 126 -11.835 4.669 5.579 1002 H PHE 127 H PHE 127 -13.531 -0.770 3.820 1003 HA PHE 127 HA PHE 127 -15.041 1.787 3.814 1004 HB2 PHE 127 HB2 PHE 127 -13.964 0.125 1.543 1005 HB3 PHE 127 HB3 PHE 127 -15.064 1.482 1.314 1006 HD1 PHE 127 HD1 PHE 127 -14.411 3.801 2.310 1007 HD2 PHE 127 HD2 PHE 127 -11.608 0.563 1.811 1008 HE1 PHE 127 HE1 PHE 127 -12.530 5.367 2.651 1009 HE2 PHE 127 HE2 PHE 127 -9.725 2.148 2.083 1010 HZ PHE 127 HZ PHE 127 -10.188 4.556 2.535 1011 H LYS 128 H LYS 128 -15.587 -1.561 3.780 1012 HA LYS 128 HA LYS 128 -18.114 -2.104 2.903 1013 HB2 LYS 128 HB2 LYS 128 -16.778 -3.788 3.642 1014 HB3 LYS 128 HB3 LYS 128 -16.281 -2.964 5.104 1015 HG2 LYS 128 HG2 LYS 128 -19.074 -4.056 4.908 1016 HG3 LYS 128 HG3 LYS 128 -17.665 -5.099 5.191 1017 HD2 LYS 128 HD2 LYS 128 -17.008 -3.659 7.137 1018 HD3 LYS 128 HD3 LYS 128 -18.514 -2.764 6.933 1019 HE2 LYS 128 HE2 LYS 128 -18.730 -4.314 8.726 1020 HE3 LYS 128 HE3 LYS 128 -19.812 -4.806 7.411 1021 HZ1 LYS 128 HZ1 LYS 128 -18.243 -6.537 6.826 1022 HZ2 LYS 128 HZ2 LYS 128 -17.108 -5.979 7.861 1023 HZ3 LYS 128 HZ3 LYS 128 -18.490 -6.659 8.436 1024 H TRP 129 H TRP 129 -17.485 -0.221 5.854 1025 HA TRP 129 HA TRP 129 -20.432 -0.073 6.391 1026 HB2 TRP 129 HB2 TRP 129 -19.758 0.593 8.673 1027 HB3 TRP 129 HB3 TRP 129 -19.293 -1.025 8.209 1028 HD1 TRP 129 HD1 TRP 129 -16.697 -1.591 8.028 1029 HE1 TRP 129 HE1 TRP 129 -14.596 -0.405 8.693 1030 HE3 TRP 129 HE3 TRP 129 -18.681 3.026 8.929 1031 HZ2 TRP 129 HZ2 TRP 129 -13.786 2.288 9.522 1032 HZ3 TRP 129 HZ3 TRP 129 -17.203 4.923 9.601 1033 HH2 TRP 129 HH2 TRP 129 -14.758 4.559 9.894 1034 H VAL 130 H VAL 130 -18.454 1.680 4.633 1035 HA VAL 130 HA VAL 130 -19.829 4.280 5.138 1036 HB VAL 130 HB VAL 130 -17.350 5.118 4.281 1037 HG11 VAL 130 HG11 VAL 130 -18.480 4.905 7.099 1038 HG12 VAL 130 HG12 VAL 130 -17.146 5.967 6.622 1039 HG13 VAL 130 HG13 VAL 130 -18.763 6.221 5.939 1040 HG21 VAL 130 HG21 VAL 130 -16.329 2.946 4.771 1041 HG22 VAL 130 HG22 VAL 130 -15.647 4.281 5.707 1042 HG23 VAL 130 HG23 VAL 130 -16.754 3.132 6.475 1043 H LYS 131 H LYS 131 -18.397 5.461 2.883 1044 HA LYS 131 HA LYS 131 -18.777 5.864 0.716 1045 HB2 LYS 131 HB2 LYS 131 -17.181 3.833 0.997 1046 HB3 LYS 131 HB3 LYS 131 -18.519 2.852 0.424 1047 HG2 LYS 131 HG2 LYS 131 -17.050 3.280 -1.369 1048 HG3 LYS 131 HG3 LYS 131 -18.533 4.190 -1.674 1049 HD2 LYS 131 HD2 LYS 131 -17.397 6.285 -0.949 1050 HD3 LYS 131 HD3 LYS 131 -15.947 5.343 -0.554 1051 HE2 LYS 131 HE2 LYS 131 -15.544 6.313 -2.697 1052 HE3 LYS 131 HE3 LYS 131 -15.851 4.590 -2.956 1053 HZ1 LYS 131 HZ1 LYS 131 -17.845 6.762 -3.377 1054 HZ2 LYS 131 HZ2 LYS 131 -17.052 5.972 -4.561 1055 HZ3 LYS 131 HZ3 LYS 131 -18.126 5.171 -3.635 1056 H GLN 132 H GLN 132 -21.210 5.299 2.253 1057 HA GLN 132 HA GLN 132 -23.435 4.992 2.067 1058 HB2 GLN 132 HB2 GLN 132 -23.142 5.972 -0.787 1059 HB3 GLN 132 HB3 GLN 132 -24.574 6.071 0.232 1060 HG2 GLN 132 HG2 GLN 132 -21.957 7.581 0.618 1061 HG3 GLN 132 HG3 GLN 132 -23.485 8.248 0.077 1062 HE21 GLN 132 HE21 GLN 132 -22.905 8.812 3.825 1063 HE22 GLN 132 HE22 GLN 132 -21.803 8.981 2.466 1064 H GLU 133 H GLU 133 -21.859 2.632 1.522 1065 HA GLU 133 HA GLU 133 -23.558 1.089 -0.336 1066 HB2 GLU 133 HB2 GLU 133 -21.116 0.249 1.269 1067 HB3 GLU 133 HB3 GLU 133 -22.031 -0.782 0.166 1068 HG2 GLU 133 HG2 GLU 133 -21.556 0.956 -1.665 1069 HG3 GLU 133 HG3 GLU 133 -20.389 1.677 -0.557 1070 H1 SER 149 H1 SER 149 14.927 -20.467 -20.034 1071 H2 SER 149 H2 SER 149 15.541 -19.540 -21.243 1072 H3 SER 149 H3 SER 149 14.272 -20.536 -21.536 1073 HA SER 149 HA SER 149 14.230 -18.218 -19.728 1074 HB2 SER 149 HB2 SER 149 12.987 -18.477 -22.494 1075 HB3 SER 149 HB3 SER 149 12.886 -17.074 -21.411 1076 HG SER 149 HG SER 149 14.557 -16.844 -22.967 1077 H GLN 150 H GLN 150 12.124 -17.652 -18.910 1078 HA GLN 150 HA GLN 150 9.903 -19.560 -19.241 1079 HB2 GLN 150 HB2 GLN 150 9.609 -19.943 -16.872 1080 HB3 GLN 150 HB3 GLN 150 11.187 -20.531 -17.368 1081 HG2 GLN 150 HG2 GLN 150 12.323 -18.690 -16.306 1082 HG3 GLN 150 HG3 GLN 150 10.825 -17.787 -16.076 1083 HE21 GLN 150 HE21 GLN 150 9.795 -19.607 -13.179 1084 HE22 GLN 150 HE22 GLN 150 9.219 -18.590 -14.502 1085 H ILE 151 H ILE 151 7.944 -18.818 -18.022 1086 HA ILE 151 HA ILE 151 7.512 -15.908 -18.171 1087 HB ILE 151 HB ILE 151 5.686 -18.182 -17.306 1088 HG12 ILE 151 HG12 ILE 151 5.772 -16.545 -19.890 1089 HG13 ILE 151 HG13 ILE 151 6.326 -18.209 -19.726 1090 HG21 ILE 151 HG21 ILE 151 5.037 -15.233 -17.786 1091 HG22 ILE 151 HG22 ILE 151 3.851 -16.510 -17.443 1092 HG23 ILE 151 HG23 ILE 151 5.012 -16.070 -16.218 1093 HD11 ILE 151 HD11 ILE 151 3.994 -18.896 -19.092 1094 HD12 ILE 151 HD12 ILE 151 3.457 -17.250 -19.520 1095 HD13 ILE 151 HD13 ILE 151 4.187 -18.288 -20.748 1096 H THR 152 H THR 152 7.332 -14.534 -16.443 1097 HA THR 152 HA THR 152 8.562 -15.314 -13.890 1098 HB THR 152 HB THR 152 8.297 -12.802 -13.472 1099 HG1 THR 152 HG1 THR 152 8.020 -11.590 -15.370 1100 HG21 THR 152 HG21 THR 152 10.168 -12.192 -14.868 1101 HG22 THR 152 HG22 THR 152 10.422 -13.819 -14.218 1102 HG23 THR 152 HG23 THR 152 9.914 -13.615 -15.912 1103 H SER 153 H SER 153 7.605 -14.217 -11.873 1104 HA SER 153 HA SER 153 5.058 -15.408 -11.325 1105 HB2 SER 153 HB2 SER 153 6.726 -13.586 -9.580 1106 HB3 SER 153 HB3 SER 153 5.453 -14.706 -9.044 1107 HG SER 153 HG SER 153 7.560 -15.609 -8.784 1108 H GLN 154 H GLN 154 4.503 -13.708 -13.163 1109 HA GLN 154 HA GLN 154 3.757 -11.060 -12.797 1110 HB2 GLN 154 HB2 GLN 154 2.756 -13.275 -14.626 1111 HB3 GLN 154 HB3 GLN 154 2.250 -11.602 -14.823 1112 HG2 GLN 154 HG2 GLN 154 4.624 -10.892 -15.069 1113 HG3 GLN 154 HG3 GLN 154 5.145 -12.548 -14.811 1114 HE21 GLN 154 HE21 GLN 154 5.404 -12.490 -18.357 1115 HE22 GLN 154 HE22 GLN 154 6.286 -12.297 -16.833 1116 H VAL 155 H VAL 155 1.587 -10.047 -12.866 1117 HA VAL 155 HA VAL 155 -0.179 -10.824 -10.758 1118 HB VAL 155 HB VAL 155 -1.276 -9.254 -13.090 1119 HG11 VAL 155 HG11 VAL 155 -1.533 -8.814 -10.061 1120 HG12 VAL 155 HG12 VAL 155 -2.456 -8.003 -11.298 1121 HG13 VAL 155 HG13 VAL 155 -2.660 -9.730 -11.082 1122 HG21 VAL 155 HG21 VAL 155 0.854 -8.125 -12.911 1123 HG22 VAL 155 HG22 VAL 155 -0.434 -7.143 -12.217 1124 HG23 VAL 155 HG23 VAL 155 0.665 -8.034 -11.121 1125 H TPO 156 H T2P 156 -1.381 -12.640 -10.732 1126 HA TPO 156 HA T2P 156 -2.519 -14.185 -12.873 1127 HB TPO 156 HB T2P 156 -3.666 -13.580 -10.160 1128 HG21 TPO 156 HG21 T2P 156 -5.520 -14.079 -11.314 1129 HG22 TPO 156 HG22 T2P 156 -5.085 -15.486 -10.344 1130 HG23 TPO 156 HG23 T2P 156 -4.772 -15.535 -12.107 1131 H GLY 157 H GLY 157 -4.348 -14.070 -13.847 1132 HA2 GLY 157 HA2 GLY 157 -6.434 -12.054 -13.470 1133 HA3 GLY 157 HA3 GLY 157 -5.587 -11.866 -15.013 1134 H GLN 158 H GLN 158 -5.149 -14.828 -15.135 1135 HA GLN 158 HA GLN 158 -7.508 -15.743 -16.450 1136 HB2 GLN 158 HB2 GLN 158 -6.227 -17.635 -16.970 1137 HB3 GLN 158 HB3 GLN 158 -5.121 -16.280 -17.029 1138 HG2 GLN 158 HG2 GLN 158 -5.334 -18.292 -14.743 1139 HG3 GLN 158 HG3 GLN 158 -4.185 -18.383 -16.055 1140 HE21 GLN 158 HE21 GLN 158 -2.287 -17.039 -13.224 1141 HE22 GLN 158 HE22 GLN 158 -3.011 -18.563 -13.709 1142 H ILE 159 H ILE 159 -6.828 -15.691 -13.129 1143 HA ILE 159 HA ILE 159 -8.842 -17.834 -12.556 1144 HB ILE 159 HB ILE 159 -6.577 -17.030 -10.711 1145 HG12 ILE 159 HG12 ILE 159 -6.784 -19.467 -12.519 1146 HG13 ILE 159 HG13 ILE 159 -5.603 -18.152 -12.607 1147 HG21 ILE 159 HG21 ILE 159 -8.605 -19.284 -10.560 1148 HG22 ILE 159 HG22 ILE 159 -7.294 -18.958 -9.401 1149 HG23 ILE 159 HG23 ILE 159 -8.590 -17.788 -9.590 1150 HD11 ILE 159 HD11 ILE 159 -4.714 -18.795 -10.374 1151 HD12 ILE 159 HD12 ILE 159 -5.759 -20.240 -10.422 1152 HD13 ILE 159 HD13 ILE 159 -4.499 -20.018 -11.641 1153 H GLY 160 H GLY 160 -7.423 -14.966 -10.996 1154 HA2 GLY 160 HA2 GLY 160 -8.452 -12.954 -10.359 1155 HA3 GLY 160 HA3 GLY 160 -10.024 -13.591 -10.844 1156 H TRP 161 H TRP 161 -7.748 -15.071 -8.561 1157 HA TRP 161 HA TRP 161 -9.864 -15.149 -6.491 1158 HB2 TRP 161 HB2 TRP 161 -8.968 -17.259 -5.847 1159 HB3 TRP 161 HB3 TRP 161 -9.234 -17.244 -7.561 1160 HD1 TRP 161 HD1 TRP 161 -6.183 -15.460 -7.523 1161 HE1 TRP 161 HE1 TRP 161 -4.123 -16.882 -7.820 1162 HE3 TRP 161 HE3 TRP 161 -8.229 -19.892 -6.115 1163 HZ2 TRP 161 HZ2 TRP 161 -3.503 -19.753 -7.700 1164 HZ3 TRP 161 HZ3 TRP 161 -6.869 -21.994 -6.192 1165 HH2 TRP 161 HH2 TRP 161 -4.518 -21.931 -6.997 1166 H ARG 162 H ARG 162 -7.915 -16.324 -4.628 1167 HA ARG 162 HA ARG 162 -7.749 -13.738 -3.152 1168 HB2 ARG 162 HB2 ARG 162 -9.167 -16.357 -2.485 1169 HB3 ARG 162 HB3 ARG 162 -9.329 -14.847 -1.579 1170 HG2 ARG 162 HG2 ARG 162 -10.347 -15.396 -4.387 1171 HG3 ARG 162 HG3 ARG 162 -11.316 -15.368 -2.943 1172 HD2 ARG 162 HD2 ARG 162 -9.724 -12.881 -3.617 1173 HD3 ARG 162 HD3 ARG 162 -11.163 -13.275 -4.576 1174 HE ARG 162 HE ARG 162 -11.844 -13.482 -1.819 1175 HH11 ARG 162 HH11 ARG 162 -13.112 -11.944 -0.835 1176 HH12 ARG 162 HH12 ARG 162 -13.244 -10.356 -1.524 1177 HH21 ARG 162 HH21 ARG 162 -11.156 -10.981 -4.172 1178 HH22 ARG 162 HH22 ARG 162 -12.170 -9.816 -3.368 1179 H ARG 163 H ARG 163 -7.700 -15.104 -0.622 1180 HA ARG 163 HA ARG 163 -4.976 -15.539 -0.021 1181 HB2 ARG 163 HB2 ARG 163 -7.406 -15.412 1.417 1182 HB3 ARG 163 HB3 ARG 163 -6.844 -17.053 1.710 1183 HG2 ARG 163 HG2 ARG 163 -4.620 -16.144 2.399 1184 HG3 ARG 163 HG3 ARG 163 -5.239 -14.510 2.114 1185 HD2 ARG 163 HD2 ARG 163 -6.933 -14.806 3.865 1186 HD3 ARG 163 HD3 ARG 163 -6.324 -16.430 4.199 1187 HE ARG 163 HE ARG 163 -5.105 -13.843 4.941 1188 HH11 ARG 163 HH11 ARG 163 -3.271 -13.774 6.107 1189 HH12 ARG 163 HH12 ARG 163 -2.356 -15.237 6.426 1190 HH21 ARG 163 HH21 ARG 163 -4.445 -17.291 4.648 1191 HH22 ARG 163 HH22 ARG 163 -2.998 -17.169 5.610 Start of MODEL 13 1 H1 GLY -4 H1 GLY -4 7.967 36.182 14.524 2 H2 GLY -4 H2 GLY -4 6.567 35.364 14.279 3 H3 GLY -4 H3 GLY -4 7.839 35.125 13.277 4 HA2 GLY -4 HA2 GLY -4 9.140 34.147 15.045 5 HA3 GLY -4 HA3 GLY -4 7.774 34.420 16.141 6 H SER -3 H SER -3 8.999 31.884 15.595 7 HA SER -3 HA SER -3 7.554 30.322 13.707 8 HB2 SER -3 HB2 SER -3 8.997 29.441 16.236 9 HB3 SER -3 HB3 SER -3 8.522 28.390 14.890 10 HG SER -3 HG SER -3 10.713 29.079 14.728 11 HA PRO -2 HA PRO -2 3.754 29.447 15.900 12 HB2 PRO -2 HB2 PRO -2 2.934 27.107 14.759 13 HB3 PRO -2 HB3 PRO -2 2.976 28.658 13.864 14 HG2 PRO -2 HG2 PRO -2 5.085 26.468 13.888 15 HG3 PRO -2 HG3 PRO -2 4.338 27.264 12.464 16 HD2 PRO -2 HD2 PRO -2 6.734 28.076 13.457 17 HD3 PRO -2 HD3 PRO -2 5.550 29.259 12.827 18 H ASN -1 H ASN -1 2.734 27.954 17.386 19 HA ASN -1 HA ASN -1 4.568 26.554 19.168 20 HB2 ASN -1 HB2 ASN -1 2.533 27.938 19.838 21 HB3 ASN -1 HB3 ASN -1 1.522 26.636 19.207 22 HD21 ASN -1 HD21 ASN -1 1.610 25.819 22.716 23 HD22 ASN -1 HD22 ASN -1 0.729 26.774 21.530 24 H SER 0 H SER 0 4.079 24.294 19.902 25 HA SER 0 HA SER 0 4.187 22.388 17.745 26 HB2 SER 0 HB2 SER 0 5.282 22.006 19.902 27 HB3 SER 0 HB3 SER 0 3.705 21.969 20.719 28 HG SER 0 HG SER 0 4.616 19.868 20.131 29 H MET 1 H MET 1 2.718 20.898 17.023 30 HA MET 1 HA MET 1 -0.131 21.596 17.263 31 HB2 MET 1 HB2 MET 1 1.250 19.503 15.544 32 HB3 MET 1 HB3 MET 1 -0.442 19.997 15.423 33 HG2 MET 1 HG2 MET 1 1.977 21.766 14.909 34 HG3 MET 1 HG3 MET 1 0.924 21.059 13.692 35 HE1 MET 1 HE1 MET 1 1.835 24.196 14.095 36 HE2 MET 1 HE2 MET 1 0.941 23.579 12.685 37 HE3 MET 1 HE3 MET 1 0.332 24.990 13.580 38 H ALA 2 H ALA 2 1.800 19.727 19.173 39 HA ALA 2 HA ALA 2 0.404 17.307 19.563 40 HB1 ALA 2 HB1 ALA 2 2.688 17.833 20.372 41 HB2 ALA 2 HB2 ALA 2 2.003 18.998 21.535 42 HB3 ALA 2 HB3 ALA 2 1.650 17.266 21.695 43 H THR 3 H THR 3 -0.744 20.450 20.351 44 HA THR 3 HA THR 3 -2.452 19.723 22.599 45 HB THR 3 HB THR 3 -3.419 21.973 22.235 46 HG1 THR 3 HG1 THR 3 -2.502 23.269 20.624 47 HG21 THR 3 HG21 THR 3 -1.444 23.282 22.780 48 HG22 THR 3 HG22 THR 3 -1.332 21.703 23.581 49 HG23 THR 3 HG23 THR 3 -0.373 22.026 22.119 50 H GLU 4 H GLU 4 -2.672 19.295 19.251 51 HA GLU 4 HA GLU 4 -5.620 18.807 19.302 52 HB2 GLU 4 HB2 GLU 4 -4.781 20.211 17.485 53 HB3 GLU 4 HB3 GLU 4 -3.678 18.930 16.963 54 HG2 GLU 4 HG2 GLU 4 -5.496 17.520 16.264 55 HG3 GLU 4 HG3 GLU 4 -6.681 18.509 17.121 56 H LEU 5 H LEU 5 -6.468 16.751 18.704 57 HA LEU 5 HA LEU 5 -5.103 14.541 19.836 58 HB2 LEU 5 HB2 LEU 5 -7.453 14.561 17.898 59 HB3 LEU 5 HB3 LEU 5 -6.941 13.173 18.849 60 HG LEU 5 HG LEU 5 -8.049 15.776 19.982 61 HD11 LEU 5 HD11 LEU 5 -9.710 14.383 18.783 62 HD12 LEU 5 HD12 LEU 5 -9.252 12.980 19.770 63 HD13 LEU 5 HD13 LEU 5 -10.011 14.399 20.530 64 HD21 LEU 5 HD21 LEU 5 -6.504 14.754 21.596 65 HD22 LEU 5 HD22 LEU 5 -8.172 14.514 22.123 66 HD23 LEU 5 HD23 LEU 5 -7.282 13.169 21.374 67 H GLU 6 H GLU 6 -5.560 15.394 16.543 68 HA GLU 6 HA GLU 6 -4.998 14.398 14.537 69 HB2 GLU 6 HB2 GLU 6 -2.510 15.165 16.003 70 HB3 GLU 6 HB3 GLU 6 -2.286 14.316 14.474 71 HG2 GLU 6 HG2 GLU 6 -4.057 16.758 14.707 72 HG3 GLU 6 HG3 GLU 6 -2.332 16.846 14.371 73 H TYR 7 H TYR 7 -6.088 12.438 15.861 74 HA TYR 7 HA TYR 7 -4.352 10.209 16.358 75 HB2 TYR 7 HB2 TYR 7 -6.192 9.174 17.320 76 HB3 TYR 7 HB3 TYR 7 -6.480 10.873 17.622 77 HD1 TYR 7 HD1 TYR 7 -7.691 7.830 16.015 78 HD2 TYR 7 HD2 TYR 7 -8.233 12.111 16.235 79 HE1 TYR 7 HE1 TYR 7 -9.874 7.602 14.880 80 HE2 TYR 7 HE2 TYR 7 -10.425 11.885 15.088 81 HH TYR 7 HH TYR 7 -11.739 8.696 14.086 82 H GLU 8 H GLU 8 -5.024 7.975 15.722 83 HA GLU 8 HA GLU 8 -6.307 7.460 13.235 84 HB2 GLU 8 HB2 GLU 8 -4.435 6.554 11.936 85 HB3 GLU 8 HB3 GLU 8 -4.294 8.271 12.182 86 HG2 GLU 8 HG2 GLU 8 -2.747 7.580 14.242 87 HG3 GLU 8 HG3 GLU 8 -2.670 6.038 13.403 88 H SER 9 H SER 9 -7.275 5.629 13.616 89 HA SER 9 HA SER 9 -6.534 3.950 15.872 90 HB2 SER 9 HB2 SER 9 -8.887 4.015 13.970 91 HB3 SER 9 HB3 SER 9 -8.717 2.808 15.263 92 HG SER 9 HG SER 9 -9.932 4.637 15.952 93 H VAL 10 H VAL 10 -5.430 2.003 15.738 94 HA VAL 10 HA VAL 10 -4.414 1.162 13.213 95 HB VAL 10 HB VAL 10 -3.188 0.883 15.286 96 HG11 VAL 10 HG11 VAL 10 -4.994 -1.492 15.895 97 HG12 VAL 10 HG12 VAL 10 -3.558 -0.979 16.797 98 HG13 VAL 10 HG13 VAL 10 -4.998 0.050 16.778 99 HG21 VAL 10 HG21 VAL 10 -2.577 -0.394 13.254 100 HG22 VAL 10 HG22 VAL 10 -2.157 -1.244 14.750 101 HG23 VAL 10 HG23 VAL 10 -3.575 -1.756 13.819 102 H LEU 11 H LEU 11 -4.914 -0.267 11.759 103 HA LEU 11 HA LEU 11 -7.386 -1.931 12.078 104 HB2 LEU 11 HB2 LEU 11 -6.124 -0.741 9.574 105 HB3 LEU 11 HB3 LEU 11 -7.519 -1.810 9.604 106 HG LEU 11 HG LEU 11 -7.396 1.017 10.734 107 HD11 LEU 11 HD11 LEU 11 -8.788 -0.236 8.330 108 HD12 LEU 11 HD12 LEU 11 -9.054 1.418 8.902 109 HD13 LEU 11 HD13 LEU 11 -7.461 0.946 8.302 110 HD21 LEU 11 HD21 LEU 11 -9.866 0.746 11.036 111 HD22 LEU 11 HD22 LEU 11 -9.702 -0.985 10.667 112 HD23 LEU 11 HD23 LEU 11 -8.934 -0.285 12.117 113 H CYS 12 H CYS 12 -4.059 -1.853 10.701 114 HA CYS 12 HA CYS 12 -3.887 -4.768 10.996 115 HB2 CYS 12 HB2 CYS 12 -4.932 -4.279 8.743 116 HB3 CYS 12 HB3 CYS 12 -3.387 -3.556 8.258 117 HG CYS 12 HG CYS 12 -3.925 -6.095 7.402 118 H VAL 13 H VAL 13 -1.887 -5.646 10.878 119 HA VAL 13 HA VAL 13 0.492 -4.023 10.459 120 HB VAL 13 HB VAL 13 0.146 -3.769 12.845 121 HG11 VAL 13 HG11 VAL 13 -1.139 -5.813 13.377 122 HG12 VAL 13 HG12 VAL 13 0.337 -6.783 13.174 123 HG13 VAL 13 HG13 VAL 13 0.238 -5.566 14.456 124 HG21 VAL 13 HG21 VAL 13 2.318 -4.527 13.654 125 HG22 VAL 13 HG22 VAL 13 2.454 -5.692 12.323 126 HG23 VAL 13 HG23 VAL 13 2.472 -3.946 11.993 127 H LYS 14 H LYS 14 1.893 -5.176 9.261 128 HA LYS 14 HA LYS 14 1.750 -8.134 9.384 129 HB2 LYS 14 HB2 LYS 14 1.773 -6.527 6.813 130 HB3 LYS 14 HB3 LYS 14 2.352 -8.173 6.862 131 HG2 LYS 14 HG2 LYS 14 -0.450 -7.327 7.709 132 HG3 LYS 14 HG3 LYS 14 0.006 -7.977 6.131 133 HD2 LYS 14 HD2 LYS 14 0.872 -10.050 7.289 134 HD3 LYS 14 HD3 LYS 14 0.170 -9.449 8.808 135 HE2 LYS 14 HE2 LYS 14 -2.044 -9.408 7.851 136 HE3 LYS 14 HE3 LYS 14 -1.392 -9.790 6.246 137 HZ1 LYS 14 HZ1 LYS 14 -0.677 -11.943 7.103 138 HZ2 LYS 14 HZ2 LYS 14 -1.349 -11.627 8.574 139 HZ3 LYS 14 HZ3 LYS 14 -2.306 -11.763 7.241 140 HA PRO 15 HA PRO 15 5.785 -7.978 10.582 141 HB2 PRO 15 HB2 PRO 15 6.667 -10.543 10.126 142 HB3 PRO 15 HB3 PRO 15 5.390 -10.135 11.310 143 HG2 PRO 15 HG2 PRO 15 5.003 -11.080 8.434 144 HG3 PRO 15 HG3 PRO 15 4.238 -11.732 9.922 145 HD2 PRO 15 HD2 PRO 15 2.967 -9.956 8.386 146 HD3 PRO 15 HD3 PRO 15 2.882 -9.840 10.171 147 H ASP 16 H ASP 16 5.399 -8.912 7.194 148 HA ASP 16 HA ASP 16 7.987 -7.645 6.542 149 HB2 ASP 16 HB2 ASP 16 8.408 -10.089 6.788 150 HB3 ASP 16 HB3 ASP 16 7.211 -10.399 5.529 151 H VAL 17 H VAL 17 7.851 -6.372 4.802 152 HA VAL 17 HA VAL 17 5.970 -6.873 2.616 153 HB VAL 17 HB VAL 17 4.561 -5.588 4.123 154 HG11 VAL 17 HG11 VAL 17 5.021 -3.274 4.751 155 HG12 VAL 17 HG12 VAL 17 6.222 -4.375 5.442 156 HG13 VAL 17 HG13 VAL 17 6.641 -3.375 4.038 157 HG21 VAL 17 HG21 VAL 17 5.454 -3.811 1.828 158 HG22 VAL 17 HG22 VAL 17 4.375 -5.222 1.680 159 HG23 VAL 17 HG23 VAL 17 3.878 -3.822 2.641 160 H SER 18 H SER 18 6.761 -6.119 0.681 161 HA SER 18 HA SER 18 9.391 -4.692 0.751 162 HB2 SER 18 HB2 SER 18 8.523 -6.892 -1.153 163 HB3 SER 18 HB3 SER 18 10.085 -6.063 -1.093 164 HG SER 18 HG SER 18 8.964 -7.762 0.891 165 H VAL 19 H VAL 19 9.810 -3.135 -0.747 166 HA VAL 19 HA VAL 19 7.522 -2.203 -2.442 167 HB VAL 19 HB VAL 19 9.389 -0.584 -0.715 168 HG11 VAL 19 HG11 VAL 19 7.370 0.319 -2.800 169 HG12 VAL 19 HG12 VAL 19 8.112 1.385 -1.586 170 HG13 VAL 19 HG13 VAL 19 9.124 0.639 -2.815 171 HG21 VAL 19 HG21 VAL 19 7.196 0.151 0.242 172 HG22 VAL 19 HG22 VAL 19 6.362 -0.991 -0.815 173 HG23 VAL 19 HG23 VAL 19 7.451 -1.580 0.454 174 H TYR 20 H TYR 20 7.839 -1.790 -4.431 175 HA TYR 20 HA TYR 20 10.504 -2.498 -5.561 176 HB2 TYR 20 HB2 TYR 20 7.665 -2.938 -6.531 177 HB3 TYR 20 HB3 TYR 20 9.106 -3.355 -7.437 178 HD1 TYR 20 HD1 TYR 20 10.237 -5.402 -7.098 179 HD2 TYR 20 HD2 TYR 20 7.312 -4.094 -4.219 180 HE1 TYR 20 HE1 TYR 20 10.333 -7.628 -5.976 181 HE2 TYR 20 HE2 TYR 20 7.482 -6.296 -3.066 182 HH TYR 20 HH TYR 20 9.587 -8.925 -4.242 183 H ARG 21 H ARG 21 8.835 0.258 -5.340 184 HA ARG 21 HA ARG 21 8.726 2.311 -6.411 185 HB2 ARG 21 HB2 ARG 21 11.645 1.589 -6.822 186 HB3 ARG 21 HB3 ARG 21 10.960 3.217 -6.837 187 HG2 ARG 21 HG2 ARG 21 10.224 2.902 -4.457 188 HG3 ARG 21 HG3 ARG 21 11.022 1.313 -4.454 189 HD2 ARG 21 HD2 ARG 21 13.169 2.450 -5.084 190 HD3 ARG 21 HD3 ARG 21 12.353 4.015 -4.910 191 HE ARG 21 HE ARG 21 11.912 2.635 -2.504 192 HH11 ARG 21 HH11 ARG 21 13.149 2.891 -0.657 193 HH12 ARG 21 HH12 ARG 21 14.766 3.510 -0.782 194 HH21 ARG 21 HH21 ARG 21 14.720 3.888 -4.183 195 HH22 ARG 21 HH22 ARG 21 15.637 4.063 -2.713 196 H ILE 22 H ILE 22 7.476 2.535 -8.115 197 HA ILE 22 HA ILE 22 8.218 1.176 -10.614 198 HB ILE 22 HB ILE 22 5.884 1.117 -11.130 199 HG12 ILE 22 HG12 ILE 22 5.495 2.882 -8.676 200 HG13 ILE 22 HG13 ILE 22 5.074 3.238 -10.356 201 HG21 ILE 22 HG21 ILE 22 6.395 0.320 -8.240 202 HG22 ILE 22 HG22 ILE 22 5.187 -0.354 -9.341 203 HG23 ILE 22 HG23 ILE 22 6.909 -0.581 -9.674 204 HD11 ILE 22 HD11 ILE 22 3.722 1.258 -8.513 205 HD12 ILE 22 HD12 ILE 22 3.067 2.740 -9.226 206 HD13 ILE 22 HD13 ILE 22 3.417 1.339 -10.266 207 HA PRO 23 HA PRO 23 8.381 5.011 -12.883 208 HB2 PRO 23 HB2 PRO 23 8.530 4.026 -15.477 209 HB3 PRO 23 HB3 PRO 23 9.873 4.225 -14.321 210 HG2 PRO 23 HG2 PRO 23 8.454 1.723 -15.114 211 HG3 PRO 23 HG3 PRO 23 10.125 1.946 -14.551 212 HD2 PRO 23 HD2 PRO 23 7.971 1.015 -12.984 213 HD3 PRO 23 HD3 PRO 23 9.527 1.635 -12.369 214 HA PRO 24 HA PRO 24 4.494 4.964 -15.558 215 HB2 PRO 24 HB2 PRO 24 2.704 2.942 -15.705 216 HB3 PRO 24 HB3 PRO 24 4.293 2.851 -16.526 217 HG2 PRO 24 HG2 PRO 24 3.548 1.721 -13.800 218 HG3 PRO 24 HG3 PRO 24 4.304 0.865 -15.185 219 HD2 PRO 24 HD2 PRO 24 5.777 1.934 -13.153 220 HD3 PRO 24 HD3 PRO 24 6.360 1.938 -14.844 221 H ARG 25 H ARG 25 2.168 5.403 -15.361 222 HA ARG 25 HA ARG 25 1.021 5.423 -12.588 223 HB2 ARG 25 HB2 ARG 25 1.831 7.652 -13.246 224 HB3 ARG 25 HB3 ARG 25 0.850 7.582 -14.717 225 HG2 ARG 25 HG2 ARG 25 -1.214 7.377 -13.292 226 HG3 ARG 25 HG3 ARG 25 -0.206 7.576 -11.847 227 HD2 ARG 25 HD2 ARG 25 -0.485 9.544 -14.154 228 HD3 ARG 25 HD3 ARG 25 -1.310 9.686 -12.586 229 HE ARG 25 HE ARG 25 1.433 9.521 -12.008 230 HH11 ARG 25 HH11 ARG 25 2.839 11.253 -11.807 231 HH12 ARG 25 HH12 ARG 25 2.340 12.831 -12.336 232 HH21 ARG 25 HH21 ARG 25 -0.666 11.811 -13.623 233 HH22 ARG 25 HH22 ARG 25 0.430 13.142 -13.368 234 H ALA 26 H ALA 26 0.111 5.560 -16.051 235 HA ALA 26 HA ALA 26 -2.380 4.074 -15.358 236 HB1 ALA 26 HB1 ALA 26 -2.807 6.447 -14.977 237 HB2 ALA 26 HB2 ALA 26 -2.260 6.832 -16.627 238 HB3 ALA 26 HB3 ALA 26 -3.722 5.839 -16.380 239 H SER 27 H SER 27 -2.172 2.428 -16.483 240 HA SER 27 HA SER 27 -2.232 2.688 -19.477 241 HB2 SER 27 HB2 SER 27 -1.607 0.448 -19.711 242 HB3 SER 27 HB3 SER 27 -0.520 1.088 -18.468 243 HG SER 27 HG SER 27 -1.765 0.109 -16.904 244 H ASN 28 H ASN 28 -3.823 1.232 -20.523 245 HA ASN 28 HA ASN 28 -6.454 1.590 -19.571 246 HB2 ASN 28 HB2 ASN 28 -7.148 0.549 -21.526 247 HB3 ASN 28 HB3 ASN 28 -5.593 1.233 -21.979 248 HD21 ASN 28 HD21 ASN 28 -4.109 -2.183 -21.974 249 HD22 ASN 28 HD22 ASN 28 -3.732 -0.680 -21.157 250 H ARG 29 H ARG 29 -4.255 -0.893 -18.600 251 HA ARG 29 HA ARG 29 -6.477 -2.512 -17.388 252 HB2 ARG 29 HB2 ARG 29 -3.543 -3.282 -17.579 253 HB3 ARG 29 HB3 ARG 29 -4.904 -4.299 -17.118 254 HG2 ARG 29 HG2 ARG 29 -4.197 -3.286 -19.878 255 HG3 ARG 29 HG3 ARG 29 -4.244 -4.950 -19.295 256 HD2 ARG 29 HD2 ARG 29 -6.749 -4.672 -18.964 257 HD3 ARG 29 HD3 ARG 29 -6.603 -3.095 -19.775 258 HE ARG 29 HE ARG 29 -5.432 -5.199 -21.368 259 HH11 ARG 29 HH11 ARG 29 -6.426 -5.880 -23.238 260 HH12 ARG 29 HH12 ARG 29 -8.113 -5.546 -23.497 261 HH21 ARG 29 HH21 ARG 29 -8.564 -3.860 -20.547 262 HH22 ARG 29 HH22 ARG 29 -9.299 -4.434 -22.019 263 H GLY 30 H GLY 30 -4.121 -0.199 -16.598 264 HA2 GLY 30 HA2 GLY 30 -4.464 0.763 -14.304 265 HA3 GLY 30 HA3 GLY 30 -4.219 -0.886 -13.693 266 H TYR 31 H TYR 31 -2.206 -1.444 -13.165 267 HA TYR 31 HA TYR 31 0.108 0.284 -14.027 268 HB2 TYR 31 HB2 TYR 31 -0.592 -1.082 -11.418 269 HB3 TYR 31 HB3 TYR 31 1.058 -0.640 -11.799 270 HD1 TYR 31 HD1 TYR 31 -2.277 0.647 -10.977 271 HD2 TYR 31 HD2 TYR 31 1.810 1.614 -11.971 272 HE1 TYR 31 HE1 TYR 31 -2.619 2.969 -10.110 273 HE2 TYR 31 HE2 TYR 31 1.512 3.894 -11.003 274 HH TYR 31 HH TYR 31 -1.632 4.996 -9.668 275 H ARG 32 H ARG 32 -0.969 -3.019 -13.594 276 HA ARG 32 HA ARG 32 -0.041 -5.021 -13.533 277 HB2 ARG 32 HB2 ARG 32 1.559 -4.817 -15.957 278 HB3 ARG 32 HB3 ARG 32 0.180 -5.795 -15.507 279 HG2 ARG 32 HG2 ARG 32 -0.682 -4.740 -17.310 280 HG3 ARG 32 HG3 ARG 32 -1.242 -3.662 -16.053 281 HD2 ARG 32 HD2 ARG 32 -0.459 -2.200 -17.686 282 HD3 ARG 32 HD3 ARG 32 0.880 -2.252 -16.549 283 HE ARG 32 HE ARG 32 2.229 -3.131 -18.187 284 HH11 ARG 32 HH11 ARG 32 2.861 -3.532 -20.116 285 HH12 ARG 32 HH12 ARG 32 1.748 -4.021 -21.390 286 HH21 ARG 32 HH21 ARG 32 -1.038 -3.614 -19.378 287 HH22 ARG 32 HH22 ARG 32 -0.452 -4.036 -20.966 288 H ALA 33 H ALA 33 1.269 -5.628 -11.906 289 HA ALA 33 HA ALA 33 3.841 -4.708 -11.287 290 HB1 ALA 33 HB1 ALA 33 2.808 -7.561 -10.961 291 HB2 ALA 33 HB2 ALA 33 4.104 -6.775 -10.036 292 HB3 ALA 33 HB3 ALA 33 2.444 -6.216 -9.861 293 H SER 34 H SER 34 2.913 -7.213 -13.584 294 HA SER 34 HA SER 34 5.365 -8.249 -14.444 295 HB2 SER 34 HB2 SER 34 2.767 -7.722 -15.943 296 HB3 SER 34 HB3 SER 34 4.020 -8.904 -16.419 297 HG SER 34 HG SER 34 2.241 -9.794 -15.248 298 H ASP 35 H ASP 35 4.150 -5.022 -15.044 299 HA ASP 35 HA ASP 35 5.732 -4.571 -17.476 300 HB2 ASP 35 HB2 ASP 35 3.405 -3.567 -16.713 301 HB3 ASP 35 HB3 ASP 35 4.396 -2.425 -15.816 302 H TRP 36 H TRP 36 6.259 -4.399 -14.040 303 HA TRP 36 HA TRP 36 8.783 -2.882 -14.407 304 HB2 TRP 36 HB2 TRP 36 8.187 -1.870 -12.052 305 HB3 TRP 36 HB3 TRP 36 7.710 -1.171 -13.565 306 HD1 TRP 36 HD1 TRP 36 5.301 -0.880 -14.131 307 HE1 TRP 36 HE1 TRP 36 3.078 -1.152 -12.905 308 HE3 TRP 36 HE3 TRP 36 6.948 -3.504 -10.064 309 HZ2 TRP 36 HZ2 TRP 36 2.257 -1.862 -10.206 310 HZ3 TRP 36 HZ3 TRP 36 5.420 -3.960 -8.163 311 HH2 TRP 36 HH2 TRP 36 3.079 -3.124 -8.205 312 H LYS 37 H LYS 37 9.525 -3.054 -11.657 313 HA LYS 37 HA LYS 37 10.633 -5.751 -11.616 314 HB2 LYS 37 HB2 LYS 37 10.788 -3.596 -9.465 315 HB3 LYS 37 HB3 LYS 37 11.814 -5.026 -9.657 316 HG2 LYS 37 HG2 LYS 37 12.375 -4.013 -12.021 317 HG3 LYS 37 HG3 LYS 37 11.707 -2.516 -11.364 318 HD2 LYS 37 HD2 LYS 37 14.121 -4.087 -10.431 319 HD3 LYS 37 HD3 LYS 37 14.099 -2.454 -11.086 320 HE2 LYS 37 HE2 LYS 37 12.897 -3.326 -8.430 321 HE3 LYS 37 HE3 LYS 37 14.492 -2.607 -8.618 322 HZ1 LYS 37 HZ1 LYS 37 13.270 -0.621 -9.591 323 HZ2 LYS 37 HZ2 LYS 37 11.868 -1.280 -9.003 324 HZ3 LYS 37 HZ3 LYS 37 13.063 -0.886 -7.989 325 H LEU 38 H LEU 38 9.113 -7.369 -11.227 326 HA LEU 38 HA LEU 38 7.531 -7.113 -8.722 327 HB2 LEU 38 HB2 LEU 38 6.144 -8.867 -9.414 328 HB3 LEU 38 HB3 LEU 38 6.252 -7.621 -10.634 329 HG LEU 38 HG LEU 38 7.747 -9.098 -11.991 330 HD11 LEU 38 HD11 LEU 38 7.662 -11.559 -11.484 331 HD12 LEU 38 HD12 LEU 38 8.688 -10.650 -10.392 332 HD13 LEU 38 HD13 LEU 38 7.069 -11.160 -9.859 333 HD21 LEU 38 HD21 LEU 38 5.262 -8.985 -12.312 334 HD22 LEU 38 HD22 LEU 38 5.923 -10.572 -12.730 335 HD23 LEU 38 HD23 LEU 38 5.059 -10.329 -11.191 336 H ASP 39 H ASP 39 10.517 -8.242 -9.536 337 HA ASP 39 HA ASP 39 10.543 -10.442 -7.516 338 HB2 ASP 39 HB2 ASP 39 10.901 -11.109 -9.867 339 HB3 ASP 39 HB3 ASP 39 12.253 -9.987 -9.985 340 H GLN 40 H GLN 40 11.965 -7.349 -8.347 341 HA GLN 40 HA GLN 40 14.111 -7.686 -6.297 342 HB2 GLN 40 HB2 GLN 40 14.122 -6.001 -8.823 343 HB3 GLN 40 HB3 GLN 40 15.392 -6.040 -7.592 344 HG2 GLN 40 HG2 GLN 40 15.683 -8.494 -8.039 345 HG3 GLN 40 HG3 GLN 40 14.512 -8.350 -9.361 346 HE21 GLN 40 HE21 GLN 40 16.811 -6.674 -11.557 347 HE22 GLN 40 HE22 GLN 40 15.108 -6.982 -11.255 348 HA PRO 41 HA PRO 41 11.765 -4.099 -4.660 349 HB2 PRO 41 HB2 PRO 41 12.091 -4.498 -2.007 350 HB3 PRO 41 HB3 PRO 41 10.920 -5.427 -2.995 351 HG2 PRO 41 HG2 PRO 41 13.714 -6.258 -2.142 352 HG3 PRO 41 HG3 PRO 41 12.199 -7.206 -2.024 353 HD2 PRO 41 HD2 PRO 41 13.995 -7.464 -4.101 354 HD3 PRO 41 HD3 PRO 41 12.238 -7.724 -4.310 355 H ASP 42 H ASP 42 12.476 -2.180 -3.632 356 HA ASP 42 HA ASP 42 15.446 -1.745 -3.522 357 HB2 ASP 42 HB2 ASP 42 13.118 0.151 -3.962 358 HB3 ASP 42 HB3 ASP 42 14.784 0.675 -3.714 359 H TRP 43 H TRP 43 12.559 -1.864 -1.609 360 HA TRP 43 HA TRP 43 14.110 -1.374 0.848 361 HB2 TRP 43 HB2 TRP 43 13.159 0.821 0.361 362 HB3 TRP 43 HB3 TRP 43 11.568 0.122 0.096 363 HD1 TRP 43 HD1 TRP 43 13.861 1.366 2.805 364 HE1 TRP 43 HE1 TRP 43 12.672 1.343 5.079 365 HE3 TRP 43 HE3 TRP 43 9.621 -1.185 1.486 366 HZ2 TRP 43 HZ2 TRP 43 10.178 0.386 6.171 367 HZ3 TRP 43 HZ3 TRP 43 7.851 -1.643 3.162 368 HH2 TRP 43 HH2 TRP 43 8.116 -0.857 5.509 369 H THR 44 H THR 44 13.355 -2.644 2.593 370 HA THR 44 HA THR 44 10.640 -3.720 2.463 371 HB THR 44 HB THR 44 11.101 -5.901 2.908 372 HG1 THR 44 HG1 THR 44 13.852 -5.378 3.282 373 HG21 THR 44 HG21 THR 44 12.513 -6.884 1.250 374 HG22 THR 44 HG22 THR 44 11.713 -5.473 0.547 375 HG23 THR 44 HG23 THR 44 13.420 -5.367 1.026 376 H GLY 45 H GLY 45 9.742 -4.296 4.389 377 HA2 GLY 45 HA2 GLY 45 10.990 -3.812 6.956 378 HA3 GLY 45 HA3 GLY 45 10.100 -2.410 6.396 379 H ARG 46 H ARG 46 8.420 -2.385 7.599 380 HA ARG 46 HA ARG 46 6.652 -4.772 8.034 381 HB2 ARG 46 HB2 ARG 46 8.061 -4.273 9.973 382 HB3 ARG 46 HB3 ARG 46 7.529 -2.592 9.979 383 HG2 ARG 46 HG2 ARG 46 5.224 -3.296 10.536 384 HG3 ARG 46 HG3 ARG 46 5.724 -4.996 10.489 385 HD2 ARG 46 HD2 ARG 46 6.864 -2.900 12.375 386 HD3 ARG 46 HD3 ARG 46 5.573 -4.026 12.788 387 HE ARG 46 HE ARG 46 7.108 -5.899 12.508 388 HH11 ARG 46 HH11 ARG 46 9.111 -6.758 12.971 389 HH12 ARG 46 HH12 ARG 46 10.481 -5.690 13.146 390 HH21 ARG 46 HH21 ARG 46 8.734 -2.792 12.787 391 HH22 ARG 46 HH22 ARG 46 10.231 -3.545 13.252 392 H LEU 47 H LEU 47 4.442 -4.401 8.015 393 HA LEU 47 HA LEU 47 3.529 -1.853 6.757 394 HB2 LEU 47 HB2 LEU 47 2.892 -4.082 5.779 395 HB3 LEU 47 HB3 LEU 47 2.138 -4.471 7.319 396 HG LEU 47 HG LEU 47 0.610 -2.395 6.915 397 HD11 LEU 47 HD11 LEU 47 0.261 -1.778 4.608 398 HD12 LEU 47 HD12 LEU 47 1.909 -1.390 5.095 399 HD13 LEU 47 HD13 LEU 47 1.607 -2.821 4.083 400 HD21 LEU 47 HD21 LEU 47 0.408 -4.857 5.148 401 HD22 LEU 47 HD22 LEU 47 -0.132 -4.732 6.834 402 HD23 LEU 47 HD23 LEU 47 -0.924 -3.768 5.596 403 H ARG 48 H ARG 48 2.179 -0.408 7.782 404 HA ARG 48 HA ARG 48 0.637 -1.312 10.149 405 HB2 ARG 48 HB2 ARG 48 2.918 0.181 10.545 406 HB3 ARG 48 HB3 ARG 48 1.778 1.478 10.287 407 HG2 ARG 48 HG2 ARG 48 1.933 1.082 12.629 408 HG3 ARG 48 HG3 ARG 48 0.340 0.484 12.133 409 HD2 ARG 48 HD2 ARG 48 1.110 -1.808 12.187 410 HD3 ARG 48 HD3 ARG 48 2.796 -1.324 12.345 411 HE ARG 48 HE ARG 48 0.735 -1.380 14.456 412 HH11 ARG 48 HH11 ARG 48 1.385 -1.219 16.564 413 HH12 ARG 48 HH12 ARG 48 3.002 -0.712 16.944 414 HH21 ARG 48 HH21 ARG 48 4.034 -0.293 13.692 415 HH22 ARG 48 HH22 ARG 48 4.437 -0.208 15.383 416 H ILE 49 H ILE 49 -1.388 -1.143 9.493 417 HA ILE 49 HA ILE 49 -2.227 1.188 7.798 418 HB ILE 49 HB ILE 49 -3.661 -1.439 8.228 419 HG12 ILE 49 HG12 ILE 49 -2.033 -0.351 5.882 420 HG13 ILE 49 HG13 ILE 49 -1.696 -1.795 6.840 421 HG21 ILE 49 HG21 ILE 49 -4.321 0.790 6.274 422 HG22 ILE 49 HG22 ILE 49 -5.260 -0.686 6.613 423 HG23 ILE 49 HG23 ILE 49 -5.150 0.564 7.836 424 HD11 ILE 49 HD11 ILE 49 -3.979 -1.427 4.861 425 HD12 ILE 49 HD12 ILE 49 -2.570 -2.466 4.708 426 HD13 ILE 49 HD13 ILE 49 -3.790 -2.844 5.937 427 H THR 50 H THR 50 -3.327 2.732 8.740 428 HA THR 50 HA THR 50 -4.800 2.248 11.292 429 HB THR 50 HB THR 50 -3.981 4.355 12.197 430 HG1 THR 50 HG1 THR 50 -2.192 4.366 9.999 431 HG21 THR 50 HG21 THR 50 -1.606 2.624 11.379 432 HG22 THR 50 HG22 THR 50 -1.657 3.812 12.694 433 HG23 THR 50 HG23 THR 50 -2.650 2.354 12.789 434 H SER 51 H SER 51 -6.356 4.166 11.762 435 HA SER 51 HA SER 51 -7.224 5.622 9.343 436 HB2 SER 51 HB2 SER 51 -9.513 4.769 9.475 437 HB3 SER 51 HB3 SER 51 -8.337 3.521 9.062 438 HG SER 51 HG SER 51 -8.358 2.995 11.387 439 H LYS 52 H LYS 52 -7.689 7.587 9.793 440 HA LYS 52 HA LYS 52 -8.785 8.389 12.455 441 HB2 LYS 52 HB2 LYS 52 -6.709 9.449 11.607 442 HB3 LYS 52 HB3 LYS 52 -7.653 10.131 10.261 443 HG2 LYS 52 HG2 LYS 52 -9.161 11.133 12.160 444 HG3 LYS 52 HG3 LYS 52 -7.819 10.735 13.223 445 HD2 LYS 52 HD2 LYS 52 -7.854 12.552 10.803 446 HD3 LYS 52 HD3 LYS 52 -7.577 13.014 12.507 447 HE2 LYS 52 HE2 LYS 52 -5.386 12.006 12.473 448 HE3 LYS 52 HE3 LYS 52 -5.689 11.265 10.898 449 HZ1 LYS 52 HZ1 LYS 52 -4.359 13.198 10.571 450 HZ2 LYS 52 HZ2 LYS 52 -5.839 13.586 10.002 451 HZ3 LYS 52 HZ3 LYS 52 -5.315 14.164 11.455 452 H GLY 53 H GLY 53 -10.550 7.048 11.518 453 HA2 GLY 53 HA2 GLY 53 -12.933 7.242 11.307 454 HA3 GLY 53 HA3 GLY 53 -12.736 8.794 10.497 455 H LYS 54 H LYS 54 -13.695 8.488 8.554 456 HA LYS 54 HA LYS 54 -13.505 6.072 6.937 457 HB2 LYS 54 HB2 LYS 54 -15.465 7.594 7.055 458 HB3 LYS 54 HB3 LYS 54 -14.539 8.875 6.294 459 HG2 LYS 54 HG2 LYS 54 -14.849 6.252 4.817 460 HG3 LYS 54 HG3 LYS 54 -16.267 7.276 5.032 461 HD2 LYS 54 HD2 LYS 54 -15.001 9.203 4.014 462 HD3 LYS 54 HD3 LYS 54 -13.724 8.053 3.566 463 HE2 LYS 54 HE2 LYS 54 -15.456 6.677 2.365 464 HE3 LYS 54 HE3 LYS 54 -16.669 7.897 2.780 465 HZ1 LYS 54 HZ1 LYS 54 -14.285 8.274 1.048 466 HZ2 LYS 54 HZ2 LYS 54 -15.850 8.377 0.584 467 HZ3 LYS 54 HZ3 LYS 54 -15.223 9.530 1.552 468 H THR 55 H THR 55 -11.197 8.325 7.449 469 HA THR 55 HA THR 55 -9.807 7.595 4.903 470 HB THR 55 HB THR 55 -8.715 9.452 7.031 471 HG1 THR 55 HG1 THR 55 -9.700 11.168 5.958 472 HG21 THR 55 HG21 THR 55 -8.621 9.284 3.984 473 HG22 THR 55 HG22 THR 55 -7.658 10.423 4.975 474 HG23 THR 55 HG23 THR 55 -7.355 8.672 5.065 475 H ALA 56 H ALA 56 -8.618 5.871 4.917 476 HA ALA 56 HA ALA 56 -7.229 5.031 7.406 477 HB1 ALA 56 HB1 ALA 56 -8.297 3.152 6.489 478 HB2 ALA 56 HB2 ALA 56 -7.714 3.490 4.855 479 HB3 ALA 56 HB3 ALA 56 -6.583 2.983 6.121 480 H TYR 57 H TYR 57 -4.944 4.456 7.176 481 HA TYR 57 HA TYR 57 -3.414 6.165 5.274 482 HB2 TYR 57 HB2 TYR 57 -3.076 6.002 8.294 483 HB3 TYR 57 HB3 TYR 57 -1.947 6.763 7.186 484 HD1 TYR 57 HD1 TYR 57 -2.208 9.052 6.579 485 HD2 TYR 57 HD2 TYR 57 -5.476 6.969 8.477 486 HE1 TYR 57 HE1 TYR 57 -3.458 11.189 6.795 487 HE2 TYR 57 HE2 TYR 57 -6.768 9.075 8.557 488 HH TYR 57 HH TYR 57 -5.423 12.193 7.415 489 H ILE 58 H ILE 58 -2.347 4.695 4.111 490 HA ILE 58 HA ILE 58 -1.423 2.119 5.241 491 HB ILE 58 HB ILE 58 -0.667 3.345 2.562 492 HG12 ILE 58 HG12 ILE 58 -3.086 3.241 2.522 493 HG13 ILE 58 HG13 ILE 58 -2.350 2.081 1.431 494 HG21 ILE 58 HG21 ILE 58 -0.548 0.555 3.736 495 HG22 ILE 58 HG22 ILE 58 -0.294 0.921 2.013 496 HG23 ILE 58 HG23 ILE 58 0.806 1.580 3.225 497 HD11 ILE 58 HD11 ILE 58 -2.824 0.241 2.944 498 HD12 ILE 58 HD12 ILE 58 -3.448 1.371 4.174 499 HD13 ILE 58 HD13 ILE 58 -4.292 1.192 2.622 500 H LYS 59 H LYS 59 0.206 2.384 6.728 501 HA LYS 59 HA LYS 59 2.501 4.141 5.948 502 HB2 LYS 59 HB2 LYS 59 1.831 3.275 8.770 503 HB3 LYS 59 HB3 LYS 59 3.030 4.449 8.225 504 HG2 LYS 59 HG2 LYS 59 0.983 5.683 7.132 505 HG3 LYS 59 HG3 LYS 59 0.004 4.672 8.204 506 HD2 LYS 59 HD2 LYS 59 1.273 5.592 10.163 507 HD3 LYS 59 HD3 LYS 59 2.187 6.630 9.036 508 HE2 LYS 59 HE2 LYS 59 -0.072 7.495 8.200 509 HE3 LYS 59 HE3 LYS 59 -0.817 6.631 9.563 510 HZ1 LYS 59 HZ1 LYS 59 -0.447 8.812 10.273 511 HZ2 LYS 59 HZ2 LYS 59 0.642 7.937 11.029 512 HZ3 LYS 59 HZ3 LYS 59 1.124 8.863 9.710 513 H LEU 60 H LEU 60 4.554 3.494 6.172 514 HA LEU 60 HA LEU 60 5.056 0.547 6.380 515 HB2 LEU 60 HB2 LEU 60 6.130 2.601 4.404 516 HB3 LEU 60 HB3 LEU 60 6.741 0.957 4.552 517 HG LEU 60 HG LEU 60 3.845 1.604 3.823 518 HD11 LEU 60 HD11 LEU 60 6.214 0.936 2.054 519 HD12 LEU 60 HD12 LEU 60 4.520 1.020 1.514 520 HD13 LEU 60 HD13 LEU 60 5.333 2.478 2.105 521 HD21 LEU 60 HD21 LEU 60 5.484 -0.959 3.560 522 HD22 LEU 60 HD22 LEU 60 4.197 -0.677 4.751 523 HD23 LEU 60 HD23 LEU 60 3.804 -0.728 3.030 524 H GLU 61 H GLU 61 6.667 -0.018 7.685 525 HA GLU 61 HA GLU 61 8.213 2.129 9.082 526 HB2 GLU 61 HB2 GLU 61 6.855 -0.327 10.247 527 HB3 GLU 61 HB3 GLU 61 7.812 0.858 11.138 528 HG2 GLU 61 HG2 GLU 61 6.164 2.629 10.484 529 HG3 GLU 61 HG3 GLU 61 5.154 1.381 9.745 530 H ASP 62 H ASP 62 10.291 1.529 10.012 531 HA ASP 62 HA ASP 62 11.785 -0.364 8.480 532 HB2 ASP 62 HB2 ASP 62 12.748 1.700 9.319 533 HB3 ASP 62 HB3 ASP 62 12.357 1.261 10.985 534 H LYS 63 H LYS 63 12.368 -2.412 8.921 535 HA LYS 63 HA LYS 63 10.702 -3.983 10.591 536 HB2 LYS 63 HB2 LYS 63 12.454 -4.412 8.456 537 HB3 LYS 63 HB3 LYS 63 13.264 -5.253 9.764 538 HG2 LYS 63 HG2 LYS 63 11.214 -6.552 10.235 539 HG3 LYS 63 HG3 LYS 63 10.339 -5.672 8.977 540 HD2 LYS 63 HD2 LYS 63 12.757 -7.476 8.517 541 HD3 LYS 63 HD3 LYS 63 11.066 -7.917 8.227 542 HE2 LYS 63 HE2 LYS 63 10.862 -6.121 6.539 543 HE3 LYS 63 HE3 LYS 63 12.551 -5.656 6.815 544 HZ1 LYS 63 HZ1 LYS 63 12.496 -7.035 4.919 545 HZ2 LYS 63 HZ2 LYS 63 13.138 -7.971 6.097 546 HZ3 LYS 63 HZ3 LYS 63 11.570 -8.186 5.635 547 H VAL 64 H VAL 64 13.446 -2.224 11.555 548 HA VAL 64 HA VAL 64 14.127 -4.063 13.805 549 HB VAL 64 HB VAL 64 15.865 -1.770 12.870 550 HG11 VAL 64 HG11 VAL 64 16.430 -2.943 14.959 551 HG12 VAL 64 HG12 VAL 64 16.485 -4.491 14.082 552 HG13 VAL 64 HG13 VAL 64 17.659 -3.206 13.716 553 HG21 VAL 64 HG21 VAL 64 15.504 -2.934 10.782 554 HG22 VAL 64 HG22 VAL 64 17.112 -3.328 11.387 555 HG23 VAL 64 HG23 VAL 64 15.793 -4.514 11.559 556 H SER 65 H SER 65 13.432 -0.671 12.955 557 HA SER 65 HA SER 65 13.237 -0.069 15.878 558 HB2 SER 65 HB2 SER 65 14.297 1.656 13.615 559 HB3 SER 65 HB3 SER 65 14.128 2.176 15.304 560 HG SER 65 HG SER 65 16.252 1.427 14.815 561 H GLY 66 H GLY 66 11.240 -0.264 13.197 562 HA2 GLY 66 HA2 GLY 66 9.071 0.382 12.902 563 HA3 GLY 66 HA3 GLY 66 9.079 1.098 14.514 564 H GLU 67 H GLU 67 11.524 2.372 12.431 565 HA GLU 67 HA GLU 67 10.360 5.025 12.545 566 HB2 GLU 67 HB2 GLU 67 12.801 4.003 11.037 567 HB3 GLU 67 HB3 GLU 67 12.344 5.701 11.235 568 HG2 GLU 67 HG2 GLU 67 12.484 5.406 13.730 569 HG3 GLU 67 HG3 GLU 67 13.089 3.768 13.471 570 H LEU 68 H LEU 68 9.452 6.310 10.916 571 HA LEU 68 HA LEU 68 7.914 4.843 9.013 572 HB2 LEU 68 HB2 LEU 68 7.202 6.926 10.251 573 HB3 LEU 68 HB3 LEU 68 8.299 7.851 9.229 574 HG LEU 68 HG LEU 68 6.968 6.976 7.210 575 HD11 LEU 68 HD11 LEU 68 4.651 6.246 7.675 576 HD12 LEU 68 HD12 LEU 68 5.809 5.080 8.317 577 HD13 LEU 68 HD13 LEU 68 4.998 6.212 9.417 578 HD21 LEU 68 HD21 LEU 68 5.167 8.602 7.513 579 HD22 LEU 68 HD22 LEU 68 5.486 8.667 9.262 580 HD23 LEU 68 HD23 LEU 68 6.700 9.257 8.104 581 H PHE 69 H PHE 69 8.391 4.188 7.054 582 HA PHE 69 HA PHE 69 10.552 5.372 5.395 583 HB2 PHE 69 HB2 PHE 69 10.460 2.999 5.408 584 HB3 PHE 69 HB3 PHE 69 8.723 2.974 5.150 585 HD1 PHE 69 HD1 PHE 69 8.171 2.075 3.083 586 HD2 PHE 69 HD2 PHE 69 11.616 4.646 3.363 587 HE1 PHE 69 HE1 PHE 69 8.534 1.849 0.644 588 HE2 PHE 69 HE2 PHE 69 11.948 4.465 0.924 589 HZ PHE 69 HZ PHE 69 10.379 3.081 -0.462 590 H ALA 70 H ALA 70 7.001 4.815 5.170 591 HA ALA 70 HA ALA 70 6.606 7.352 3.779 592 HB1 ALA 70 HB1 ALA 70 6.025 4.714 2.354 593 HB2 ALA 70 HB2 ALA 70 5.621 6.342 1.774 594 HB3 ALA 70 HB3 ALA 70 7.317 5.857 1.920 595 H GLN 71 H GLN 71 4.320 7.813 3.373 596 HA GLN 71 HA GLN 71 2.342 6.020 4.547 597 HB2 GLN 71 HB2 GLN 71 1.261 7.755 5.904 598 HB3 GLN 71 HB3 GLN 71 2.860 7.291 6.478 599 HG2 GLN 71 HG2 GLN 71 3.802 9.367 5.399 600 HG3 GLN 71 HG3 GLN 71 2.156 9.855 4.989 601 HE21 GLN 71 HE21 GLN 71 3.123 11.523 8.195 602 HE22 GLN 71 HE22 GLN 71 3.729 11.548 6.546 603 H ALA 72 H ALA 72 0.440 5.988 3.490 604 HA ALA 72 HA ALA 72 -0.138 8.098 1.450 605 HB1 ALA 72 HB1 ALA 72 -0.615 5.107 1.286 606 HB2 ALA 72 HB2 ALA 72 -1.224 6.294 0.132 607 HB3 ALA 72 HB3 ALA 72 0.516 6.072 0.316 608 HA PRO 73 HA PRO 73 -4.040 8.021 3.970 609 HB2 PRO 73 HB2 PRO 73 -5.037 10.459 3.276 610 HB3 PRO 73 HB3 PRO 73 -3.700 10.255 4.443 611 HG2 PRO 73 HG2 PRO 73 -3.492 10.945 1.505 612 HG3 PRO 73 HG3 PRO 73 -2.675 11.731 2.890 613 HD2 PRO 73 HD2 PRO 73 -1.454 9.826 1.354 614 HD3 PRO 73 HD3 PRO 73 -1.132 9.972 3.105 615 H VAL 74 H VAL 74 -6.010 7.169 3.341 616 HA VAL 74 HA VAL 74 -6.821 7.352 0.467 617 HB VAL 74 HB VAL 74 -5.790 5.254 0.870 618 HG11 VAL 74 HG11 VAL 74 -6.101 4.766 3.189 619 HG12 VAL 74 HG12 VAL 74 -7.857 4.559 2.931 620 HG13 VAL 74 HG13 VAL 74 -6.697 3.441 2.195 621 HG21 VAL 74 HG21 VAL 74 -8.790 4.823 0.614 622 HG22 VAL 74 HG22 VAL 74 -7.749 5.418 -0.702 623 HG23 VAL 74 HG23 VAL 74 -7.530 3.795 -0.044 624 H GLU 75 H GLU 75 -8.834 7.897 0.033 625 HA GLU 75 HA GLU 75 -10.824 7.941 2.249 626 HB2 GLU 75 HB2 GLU 75 -10.522 9.721 -0.199 627 HB3 GLU 75 HB3 GLU 75 -11.903 9.770 0.902 628 HG2 GLU 75 HG2 GLU 75 -10.427 10.346 2.785 629 HG3 GLU 75 HG3 GLU 75 -9.022 10.318 1.713 630 H GLN 76 H GLN 76 -10.091 6.111 -0.430 631 HA GLN 76 HA GLN 76 -12.703 4.970 -0.596 632 HB2 GLN 76 HB2 GLN 76 -13.181 5.356 -2.895 633 HB3 GLN 76 HB3 GLN 76 -12.942 6.924 -2.144 634 HG2 GLN 76 HG2 GLN 76 -11.019 5.473 -4.006 635 HG3 GLN 76 HG3 GLN 76 -12.032 6.842 -4.400 636 HE21 GLN 76 HE21 GLN 76 -8.436 7.492 -2.605 637 HE22 GLN 76 HE22 GLN 76 -9.109 5.845 -2.652 638 H TYR 77 H TYR 77 -12.607 2.847 -1.263 639 HA TYR 77 HA TYR 77 -10.120 1.881 -2.555 640 HB2 TYR 77 HB2 TYR 77 -10.106 1.404 -0.117 641 HB3 TYR 77 HB3 TYR 77 -11.549 0.407 -0.329 642 HD1 TYR 77 HD1 TYR 77 -8.323 0.821 -2.201 643 HD2 TYR 77 HD2 TYR 77 -10.872 -1.904 -0.047 644 HE1 TYR 77 HE1 TYR 77 -6.738 -0.966 -2.641 645 HE2 TYR 77 HE2 TYR 77 -9.295 -3.755 -0.564 646 HH TYR 77 HH TYR 77 -6.271 -3.218 -2.417 647 HA PRO 78 HA PRO 78 -9.348 0.483 -4.207 648 HB2 PRO 78 HB2 PRO 78 -10.511 0.574 -6.968 649 HB3 PRO 78 HB3 PRO 78 -9.076 -0.314 -6.364 650 HG2 PRO 78 HG2 PRO 78 -11.392 -1.638 -6.799 651 HG3 PRO 78 HG3 PRO 78 -10.461 -1.959 -5.296 652 HD2 PRO 78 HD2 PRO 78 -12.846 -0.107 -5.661 653 HD3 PRO 78 HD3 PRO 78 -12.586 -1.366 -4.417 654 H GLY 79 H GLY 79 -8.033 2.200 -5.124 655 HA2 GLY 79 HA2 GLY 79 -9.190 4.535 -6.392 656 HA3 GLY 79 HA3 GLY 79 -8.791 4.825 -4.697 657 H ILE 80 H ILE 80 -7.355 6.455 -5.796 658 HA ILE 80 HA ILE 80 -5.020 5.447 -7.237 659 HB ILE 80 HB ILE 80 -6.132 7.595 -7.806 660 HG12 ILE 80 HG12 ILE 80 -4.162 8.954 -8.168 661 HG13 ILE 80 HG13 ILE 80 -3.249 8.045 -6.969 662 HG21 ILE 80 HG21 ILE 80 -4.914 8.676 -5.219 663 HG22 ILE 80 HG22 ILE 80 -5.761 9.607 -6.461 664 HG23 ILE 80 HG23 ILE 80 -6.651 8.416 -5.509 665 HD11 ILE 80 HD11 ILE 80 -4.368 6.828 -9.531 666 HD12 ILE 80 HD12 ILE 80 -2.721 7.461 -9.358 667 HD13 ILE 80 HD13 ILE 80 -3.225 6.071 -8.390 668 H ALA 81 H ALA 81 -5.866 6.126 -3.939 669 HA ALA 81 HA ALA 81 -3.111 6.239 -3.047 670 HB1 ALA 81 HB1 ALA 81 -5.720 6.054 -1.478 671 HB2 ALA 81 HB2 ALA 81 -4.105 6.366 -0.796 672 HB3 ALA 81 HB3 ALA 81 -4.873 7.552 -1.892 673 H VAL 82 H VAL 82 -5.306 3.687 -3.742 674 HA VAL 82 HA VAL 82 -3.279 1.745 -3.186 675 HB VAL 82 HB VAL 82 -3.944 1.840 -0.970 676 HG11 VAL 82 HG11 VAL 82 -6.618 2.248 -1.776 677 HG12 VAL 82 HG12 VAL 82 -6.504 0.808 -0.735 678 HG13 VAL 82 HG13 VAL 82 -5.852 2.340 -0.181 679 HG21 VAL 82 HG21 VAL 82 -3.181 -0.208 -1.702 680 HG22 VAL 82 HG22 VAL 82 -4.507 -0.496 -0.567 681 HG23 VAL 82 HG23 VAL 82 -4.738 -0.708 -2.318 682 H GLU 83 H GLU 83 -3.372 0.638 -4.952 683 HA GLU 83 HA GLU 83 -5.942 -0.225 -6.216 684 HB2 GLU 83 HB2 GLU 83 -4.112 1.739 -7.159 685 HB3 GLU 83 HB3 GLU 83 -3.744 0.300 -8.093 686 HG2 GLU 83 HG2 GLU 83 -6.528 1.510 -7.800 687 HG3 GLU 83 HG3 GLU 83 -5.408 1.865 -9.112 688 H THR 84 H THR 84 -5.866 -2.142 -7.458 689 HA THR 84 HA THR 84 -3.586 -4.000 -6.843 690 HB THR 84 HB THR 84 -6.059 -4.898 -8.207 691 HG1 THR 84 HG1 THR 84 -7.029 -5.317 -6.222 692 HG21 THR 84 HG21 THR 84 -4.168 -6.416 -7.976 693 HG22 THR 84 HG22 THR 84 -4.156 -6.160 -6.214 694 HG23 THR 84 HG23 THR 84 -5.534 -6.972 -7.004 695 H VAL 85 H VAL 85 -2.215 -3.264 -8.141 696 HA VAL 85 HA VAL 85 -1.223 -2.811 -10.359 697 HB VAL 85 HB VAL 85 -0.386 -5.264 -10.726 698 HG11 VAL 85 HG11 VAL 85 0.010 -3.724 -8.109 699 HG12 VAL 85 HG12 VAL 85 1.132 -4.905 -8.793 700 HG13 VAL 85 HG13 VAL 85 0.823 -3.402 -9.652 701 HG21 VAL 85 HG21 VAL 85 -2.306 -6.307 -9.324 702 HG22 VAL 85 HG22 VAL 85 -0.664 -6.802 -8.944 703 HG23 VAL 85 HG23 VAL 85 -1.500 -5.624 -7.917 704 H THR 86 H THR 86 -2.950 -5.838 -10.846 705 HA THR 86 HA THR 86 -4.691 -4.610 -12.819 706 HB THR 86 HB THR 86 -4.582 -6.752 -14.259 707 HG1 THR 86 HG1 THR 86 -3.050 -8.082 -13.838 708 HG21 THR 86 HG21 THR 86 -2.867 -5.823 -15.714 709 HG22 THR 86 HG22 THR 86 -3.771 -4.471 -14.986 710 HG23 THR 86 HG23 THR 86 -2.177 -4.902 -14.359 711 H ASP 87 H ASP 87 -3.792 -7.759 -11.397 712 HA ASP 87 HA ASP 87 -6.525 -8.049 -10.225 713 HB2 ASP 87 HB2 ASP 87 -5.321 -9.719 -12.404 714 HB3 ASP 87 HB3 ASP 87 -6.553 -10.379 -11.325 715 H SER 88 H SER 88 -3.675 -10.377 -10.696 716 HA SER 88 HA SER 88 -4.073 -11.599 -8.258 717 HB2 SER 88 HB2 SER 88 -1.357 -11.252 -9.518 718 HB3 SER 88 HB3 SER 88 -1.785 -12.392 -8.252 719 HG SER 88 HG SER 88 -1.878 -13.421 -10.241 720 H SER 89 H SER 89 -4.459 -10.466 -6.443 721 HA SER 89 HA SER 89 -2.759 -8.358 -5.498 722 HB2 SER 89 HB2 SER 89 -4.363 -8.426 -3.549 723 HB3 SER 89 HB3 SER 89 -4.996 -8.095 -5.165 724 HG SER 89 HG SER 89 -6.370 -9.543 -4.242 725 H ARG 90 H ARG 90 -1.033 -10.386 -5.817 726 HA ARG 90 HA ARG 90 0.042 -10.685 -3.044 727 HB2 ARG 90 HB2 ARG 90 0.699 -12.345 -4.871 728 HB3 ARG 90 HB3 ARG 90 1.584 -11.024 -5.648 729 HG2 ARG 90 HG2 ARG 90 2.962 -10.745 -3.563 730 HG3 ARG 90 HG3 ARG 90 2.011 -12.009 -2.787 731 HD2 ARG 90 HD2 ARG 90 3.937 -13.128 -3.389 732 HD3 ARG 90 HD3 ARG 90 2.838 -13.552 -4.692 733 HE ARG 90 HE ARG 90 4.086 -12.208 -6.203 734 HH11 ARG 90 HH11 ARG 90 6.028 -11.507 -6.933 735 HH12 ARG 90 HH12 ARG 90 7.338 -11.195 -5.836 736 HH21 ARG 90 HH21 ARG 90 5.496 -11.741 -2.996 737 HH22 ARG 90 HH22 ARG 90 7.054 -11.369 -3.680 738 H TYR 91 H TYR 91 -0.206 -8.509 -5.715 739 HA TYR 91 HA TYR 91 1.688 -6.585 -4.467 740 HB2 TYR 91 HB2 TYR 91 0.775 -6.570 -7.329 741 HB3 TYR 91 HB3 TYR 91 2.169 -5.759 -6.659 742 HD1 TYR 91 HD1 TYR 91 0.912 -8.640 -8.367 743 HD2 TYR 91 HD2 TYR 91 4.115 -7.238 -5.837 744 HE1 TYR 91 HE1 TYR 91 2.319 -10.508 -9.171 745 HE2 TYR 91 HE2 TYR 91 5.548 -9.130 -6.634 746 HH TYR 91 HH TYR 91 4.380 -11.554 -9.007 747 H PHE 92 H PHE 92 1.279 -4.362 -4.766 748 HA PHE 92 HA PHE 92 -1.373 -3.435 -5.626 749 HB2 PHE 92 HB2 PHE 92 -0.288 -2.754 -2.861 750 HB3 PHE 92 HB3 PHE 92 -1.728 -2.064 -3.598 751 HD1 PHE 92 HD1 PHE 92 -0.375 -4.850 -1.737 752 HD2 PHE 92 HD2 PHE 92 -3.706 -3.573 -4.161 753 HE1 PHE 92 HE1 PHE 92 -1.733 -6.726 -0.877 754 HE2 PHE 92 HE2 PHE 92 -5.044 -5.499 -3.348 755 HZ PHE 92 HZ PHE 92 -4.047 -7.096 -1.713 756 H VAL 93 H VAL 93 -1.400 -0.989 -5.604 757 HA VAL 93 HA VAL 93 1.286 0.294 -5.557 758 HB VAL 93 HB VAL 93 -0.887 0.917 -7.599 759 HG11 VAL 93 HG11 VAL 93 1.821 2.210 -7.054 760 HG12 VAL 93 HG12 VAL 93 0.830 2.498 -8.490 761 HG13 VAL 93 HG13 VAL 93 0.218 2.976 -6.918 762 HG21 VAL 93 HG21 VAL 93 0.298 -1.077 -8.281 763 HG22 VAL 93 HG22 VAL 93 0.915 0.271 -9.236 764 HG23 VAL 93 HG23 VAL 93 1.872 -0.348 -7.885 765 H ILE 94 H ILE 94 1.335 2.068 -4.250 766 HA ILE 94 HA ILE 94 -1.250 3.339 -3.501 767 HB ILE 94 HB ILE 94 -0.583 3.624 -1.208 768 HG12 ILE 94 HG12 ILE 94 1.931 1.986 -1.770 769 HG13 ILE 94 HG13 ILE 94 1.925 3.744 -1.637 770 HG21 ILE 94 HG21 ILE 94 -0.104 0.677 -1.862 771 HG22 ILE 94 HG22 ILE 94 -0.811 1.382 -0.395 772 HG23 ILE 94 HG23 ILE 94 -1.684 1.465 -1.906 773 HD11 ILE 94 HD11 ILE 94 0.966 3.550 0.660 774 HD12 ILE 94 HD12 ILE 94 1.163 1.794 0.544 775 HD13 ILE 94 HD13 ILE 94 2.587 2.845 0.494 776 H ARG 95 H ARG 95 -1.244 5.579 -3.336 777 HA ARG 95 HA ARG 95 1.257 6.935 -4.208 778 HB2 ARG 95 HB2 ARG 95 0.175 8.696 -5.071 779 HB3 ARG 95 HB3 ARG 95 -0.858 7.340 -5.475 780 HG2 ARG 95 HG2 ARG 95 -2.380 8.959 -4.949 781 HG3 ARG 95 HG3 ARG 95 -2.289 8.050 -3.451 782 HD2 ARG 95 HD2 ARG 95 -0.672 9.843 -2.590 783 HD3 ARG 95 HD3 ARG 95 -0.995 10.731 -4.078 784 HE ARG 95 HE ARG 95 -3.075 11.351 -3.224 785 HH11 ARG 95 HH11 ARG 95 -4.825 11.334 -1.771 786 HH12 ARG 95 HH12 ARG 95 -4.820 10.153 -0.475 787 HH21 ARG 95 HH21 ARG 95 -1.847 8.722 -1.220 788 HH22 ARG 95 HH22 ARG 95 -3.288 8.774 -0.201 789 H ILE 96 H ILE 96 2.552 7.619 -2.734 790 HA ILE 96 HA ILE 96 1.629 8.080 0.061 791 HB ILE 96 HB ILE 96 4.061 7.945 0.600 792 HG12 ILE 96 HG12 ILE 96 4.473 6.819 -2.199 793 HG13 ILE 96 HG13 ILE 96 4.784 8.519 -1.823 794 HG21 ILE 96 HG21 ILE 96 2.780 5.552 -0.768 795 HG22 ILE 96 HG22 ILE 96 4.198 5.438 0.270 796 HG23 ILE 96 HG23 ILE 96 2.674 5.996 0.950 797 HD11 ILE 96 HD11 ILE 96 6.842 7.345 -1.699 798 HD12 ILE 96 HD12 ILE 96 6.361 7.835 -0.054 799 HD13 ILE 96 HD13 ILE 96 6.165 6.141 -0.581 800 H GLN 97 H GLN 97 2.424 9.866 1.259 801 HA GLN 97 HA GLN 97 3.051 12.338 -0.282 802 HB2 GLN 97 HB2 GLN 97 2.040 11.668 2.452 803 HB3 GLN 97 HB3 GLN 97 3.185 12.993 2.401 804 HG2 GLN 97 HG2 GLN 97 0.751 12.881 0.580 805 HG3 GLN 97 HG3 GLN 97 0.723 13.617 2.183 806 HE21 GLN 97 HE21 GLN 97 2.148 15.821 -0.828 807 HE22 GLN 97 HE22 GLN 97 1.290 14.321 -1.105 808 H ASP 98 H ASP 98 5.099 13.267 -0.351 809 HA ASP 98 HA ASP 98 7.312 11.894 1.045 810 HB2 ASP 98 HB2 ASP 98 7.429 12.774 -1.331 811 HB3 ASP 98 HB3 ASP 98 7.389 14.395 -0.630 812 H GLY 99 H GLY 99 5.016 14.133 1.937 813 HA2 GLY 99 HA2 GLY 99 4.735 15.076 4.035 814 HA3 GLY 99 HA3 GLY 99 6.427 14.766 4.422 815 H THR 100 H THR 100 6.517 16.376 1.511 816 HA THR 100 HA THR 100 6.840 19.046 2.799 817 HB THR 100 HB THR 100 8.419 19.552 1.023 818 HG1 THR 100 HG1 THR 100 8.979 17.947 -0.435 819 HG21 THR 100 HG21 THR 100 9.247 18.322 3.065 820 HG22 THR 100 HG22 THR 100 9.084 16.797 2.159 821 HG23 THR 100 HG23 THR 100 10.219 18.047 1.607 822 H GLY 101 H GLY 101 4.371 17.698 1.435 823 HA2 GLY 101 HA2 GLY 101 2.459 18.781 0.562 824 HA3 GLY 101 HA3 GLY 101 3.456 20.081 -0.092 825 H ARG 102 H ARG 102 4.669 16.913 -0.684 826 HA ARG 102 HA ARG 102 3.520 16.781 -3.442 827 HB2 ARG 102 HB2 ARG 102 5.645 16.487 -4.395 828 HB3 ARG 102 HB3 ARG 102 5.768 17.895 -3.308 829 HG2 ARG 102 HG2 ARG 102 6.820 16.360 -1.616 830 HG3 ARG 102 HG3 ARG 102 6.869 15.101 -2.865 831 HD2 ARG 102 HD2 ARG 102 8.219 16.562 -4.317 832 HD3 ARG 102 HD3 ARG 102 8.163 17.849 -3.093 833 HE ARG 102 HE ARG 102 9.204 15.575 -1.788 834 HH11 ARG 102 HH11 ARG 102 11.188 15.190 -1.410 835 HH12 ARG 102 HH12 ARG 102 12.508 15.940 -2.318 836 HH21 ARG 102 HH21 ARG 102 10.318 17.674 -4.379 837 HH22 ARG 102 HH22 ARG 102 11.990 17.343 -4.006 838 H SER 103 H SER 103 3.559 14.747 -4.469 839 HA SER 103 HA SER 103 3.637 12.439 -2.580 840 HB2 SER 103 HB2 SER 103 1.576 13.040 -4.727 841 HB3 SER 103 HB3 SER 103 1.643 11.554 -3.764 842 HG SER 103 HG SER 103 0.180 13.174 -2.948 843 H ALA 104 H ALA 104 3.853 10.341 -3.471 844 HA ALA 104 HA ALA 104 5.016 10.057 -6.195 845 HB1 ALA 104 HB1 ALA 104 6.338 9.063 -3.637 846 HB2 ALA 104 HB2 ALA 104 6.872 8.708 -5.290 847 HB3 ALA 104 HB3 ALA 104 6.935 10.374 -4.679 848 H PHE 105 H PHE 105 4.870 7.943 -7.077 849 HA PHE 105 HA PHE 105 2.829 6.201 -5.762 850 HB2 PHE 105 HB2 PHE 105 3.735 6.169 -8.650 851 HB3 PHE 105 HB3 PHE 105 2.396 5.281 -7.938 852 HD1 PHE 105 HD1 PHE 105 3.568 8.541 -9.175 853 HD2 PHE 105 HD2 PHE 105 0.283 6.485 -7.262 854 HE1 PHE 105 HE1 PHE 105 2.102 10.501 -9.580 855 HE2 PHE 105 HE2 PHE 105 -1.180 8.430 -7.732 856 HZ PHE 105 HZ PHE 105 -0.291 10.433 -8.884 857 H ILE 106 H ILE 106 3.442 4.350 -4.875 858 HA ILE 106 HA ILE 106 5.900 2.996 -5.902 859 HB ILE 106 HB ILE 106 6.241 2.003 -3.660 860 HG12 ILE 106 HG12 ILE 106 4.565 4.328 -2.598 861 HG13 ILE 106 HG13 ILE 106 3.994 2.663 -2.689 862 HG21 ILE 106 HG21 ILE 106 6.625 5.031 -3.832 863 HG22 ILE 106 HG22 ILE 106 7.615 3.888 -2.901 864 HG23 ILE 106 HG23 ILE 106 7.635 3.833 -4.662 865 HD11 ILE 106 HD11 ILE 106 5.791 1.914 -1.189 866 HD12 ILE 106 HD12 ILE 106 6.372 3.592 -1.036 867 HD13 ILE 106 HD13 ILE 106 4.766 3.148 -0.441 868 H GLY 107 H GLY 107 5.828 0.961 -6.384 869 HA2 GLY 107 HA2 GLY 107 3.330 -0.595 -6.139 870 HA3 GLY 107 HA3 GLY 107 4.780 -1.070 -7.021 871 H ILE 108 H ILE 108 3.092 -2.261 -4.761 872 HA ILE 108 HA ILE 108 5.297 -2.896 -2.859 873 HB ILE 108 HB ILE 108 2.325 -3.153 -2.250 874 HG12 ILE 108 HG12 ILE 108 4.273 -0.862 -1.713 875 HG13 ILE 108 HG13 ILE 108 2.717 -0.785 -2.535 876 HG21 ILE 108 HG21 ILE 108 4.814 -3.261 -0.519 877 HG22 ILE 108 HG22 ILE 108 3.134 -3.427 0.058 878 HG23 ILE 108 HG23 ILE 108 3.800 -4.650 -0.985 879 HD11 ILE 108 HD11 ILE 108 3.175 -1.214 0.441 880 HD12 ILE 108 HD12 ILE 108 2.512 0.200 -0.363 881 HD13 ILE 108 HD13 ILE 108 1.580 -1.316 -0.366 882 H GLY 109 H GLY 109 5.630 -5.107 -2.406 883 HA2 GLY 109 HA2 GLY 109 3.694 -7.116 -3.373 884 HA3 GLY 109 HA3 GLY 109 5.382 -7.352 -3.839 885 H PHE 110 H PHE 110 3.373 -8.698 -1.888 886 HA PHE 110 HA PHE 110 5.017 -8.636 0.605 887 HB2 PHE 110 HB2 PHE 110 2.324 -9.846 -0.005 888 HB3 PHE 110 HB3 PHE 110 3.179 -10.092 1.488 889 HD1 PHE 110 HD1 PHE 110 2.818 -8.734 3.305 890 HD2 PHE 110 HD2 PHE 110 1.964 -7.160 -0.628 891 HE1 PHE 110 HE1 PHE 110 1.782 -6.741 4.324 892 HE2 PHE 110 HE2 PHE 110 0.997 -5.130 0.405 893 HZ PHE 110 HZ PHE 110 0.914 -4.907 2.870 894 H THR 111 H THR 111 5.829 -10.454 1.607 895 HA THR 111 HA THR 111 7.025 -12.402 -0.148 896 HB THR 111 HB THR 111 8.024 -11.380 1.890 897 HG1 THR 111 HG1 THR 111 9.161 -13.254 2.361 898 HG21 THR 111 HG21 THR 111 7.688 -12.421 4.062 899 HG22 THR 111 HG22 THR 111 6.152 -11.750 3.492 900 HG23 THR 111 HG23 THR 111 6.446 -13.502 3.403 901 H ASP 112 H ASP 112 4.172 -12.361 1.825 902 HA ASP 112 HA ASP 112 3.495 -15.120 0.926 903 HB2 ASP 112 HB2 ASP 112 3.730 -14.667 3.474 904 HB3 ASP 112 HB3 ASP 112 2.202 -13.788 3.311 905 H ARG 113 H ARG 113 1.716 -15.373 -0.297 906 HA ARG 113 HA ARG 113 0.344 -13.170 -1.514 907 HB2 ARG 113 HB2 ARG 113 0.726 -15.764 -2.151 908 HB3 ARG 113 HB3 ARG 113 -0.841 -15.951 -1.387 909 HG2 ARG 113 HG2 ARG 113 -0.112 -14.299 -3.837 910 HG3 ARG 113 HG3 ARG 113 -1.104 -15.757 -3.765 911 HD2 ARG 113 HD2 ARG 113 -2.753 -14.434 -2.343 912 HD3 ARG 113 HD3 ARG 113 -1.795 -12.986 -2.740 913 HE ARG 113 HE ARG 113 -2.544 -14.426 -5.125 914 HH11 ARG 113 HH11 ARG 113 -4.286 -13.750 -6.370 915 HH12 ARG 113 HH12 ARG 113 -5.439 -12.616 -5.704 916 HH21 ARG 113 HH21 ARG 113 -3.794 -12.220 -2.757 917 HH22 ARG 113 HH22 ARG 113 -5.002 -11.588 -3.830 918 H GLY 114 H GLY 114 -0.409 -15.137 1.335 919 HA2 GLY 114 HA2 GLY 114 -3.109 -14.177 1.757 920 HA3 GLY 114 HA3 GLY 114 -2.062 -14.999 2.920 921 H ASP 115 H ASP 115 0.125 -12.958 2.715 922 HA ASP 115 HA ASP 115 -0.917 -11.076 4.671 923 HB2 ASP 115 HB2 ASP 115 1.774 -11.242 3.299 924 HB3 ASP 115 HB3 ASP 115 1.335 -10.033 4.506 925 H ALA 116 H ALA 116 -0.120 -10.844 1.203 926 HA ALA 116 HA ALA 116 -0.877 -8.059 0.972 927 HB1 ALA 116 HB1 ALA 116 -0.679 -10.358 -1.013 928 HB2 ALA 116 HB2 ALA 116 -1.015 -8.677 -1.480 929 HB3 ALA 116 HB3 ALA 116 0.514 -9.073 -0.728 930 H PHE 117 H PHE 117 -2.694 -11.156 0.450 931 HA PHE 117 HA PHE 117 -5.156 -9.920 -0.301 932 HB2 PHE 117 HB2 PHE 117 -4.637 -12.270 -0.640 933 HB3 PHE 117 HB3 PHE 117 -4.576 -12.538 1.095 934 HD1 PHE 117 HD1 PHE 117 -6.860 -11.822 -1.785 935 HD2 PHE 117 HD2 PHE 117 -6.552 -12.703 2.422 936 HE1 PHE 117 HE1 PHE 117 -9.273 -12.373 -1.715 937 HE2 PHE 117 HE2 PHE 117 -8.915 -13.400 2.460 938 HZ PHE 117 HZ PHE 117 -10.312 -13.202 0.391 939 H ASP 118 H ASP 118 -3.740 -10.406 2.946 940 HA ASP 118 HA ASP 118 -6.096 -9.473 4.389 941 HB2 ASP 118 HB2 ASP 118 -3.181 -9.889 5.123 942 HB3 ASP 118 HB3 ASP 118 -4.337 -9.172 6.241 943 H PHE 119 H PHE 119 -3.150 -7.873 3.036 944 HA PHE 119 HA PHE 119 -3.659 -5.307 4.115 945 HB2 PHE 119 HB2 PHE 119 -1.558 -5.761 3.111 946 HB3 PHE 119 HB3 PHE 119 -2.266 -6.260 1.601 947 HD1 PHE 119 HD1 PHE 119 -3.389 -4.549 0.077 948 HD2 PHE 119 HD2 PHE 119 -0.855 -3.487 3.365 949 HE1 PHE 119 HE1 PHE 119 -3.018 -2.319 -0.928 950 HE2 PHE 119 HE2 PHE 119 -0.561 -1.242 2.429 951 HZ PHE 119 HZ PHE 119 -1.632 -0.637 0.262 952 H ASN 120 H ASN 120 -4.937 -6.894 1.187 953 HA ASN 120 HA ASN 120 -6.699 -4.759 0.386 954 HB2 ASN 120 HB2 ASN 120 -6.323 -6.252 -1.301 955 HB3 ASN 120 HB3 ASN 120 -6.327 -7.661 -0.240 956 HD21 ASN 120 HD21 ASN 120 -9.661 -8.458 -0.839 957 HD22 ASN 120 HD22 ASN 120 -8.146 -8.882 -0.055 958 H VAL 121 H VAL 121 -7.473 -7.748 2.326 959 HA VAL 121 HA VAL 121 -10.196 -6.982 2.633 960 HB VAL 121 HB VAL 121 -8.471 -8.917 4.209 961 HG11 VAL 121 HG11 VAL 121 -10.592 -9.920 5.062 962 HG12 VAL 121 HG12 VAL 121 -10.296 -8.317 5.727 963 HG13 VAL 121 HG13 VAL 121 -11.488 -8.526 4.422 964 HG21 VAL 121 HG21 VAL 121 -9.774 -10.620 2.967 965 HG22 VAL 121 HG22 VAL 121 -10.686 -9.336 2.142 966 HG23 VAL 121 HG23 VAL 121 -8.950 -9.541 1.851 967 H SER 122 H SER 122 -7.402 -6.167 4.642 968 HA SER 122 HA SER 122 -8.757 -4.979 6.850 969 HB2 SER 122 HB2 SER 122 -6.134 -4.142 5.542 970 HB3 SER 122 HB3 SER 122 -6.694 -3.672 7.157 971 HG SER 122 HG SER 122 -6.009 -6.255 6.200 972 H LEU 123 H LEU 123 -8.419 -3.831 3.553 973 HA LEU 123 HA LEU 123 -9.473 -1.142 4.273 974 HB2 LEU 123 HB2 LEU 123 -8.400 -2.200 1.653 975 HB3 LEU 123 HB3 LEU 123 -8.902 -0.535 1.971 976 HG LEU 123 HG LEU 123 -6.617 -1.993 3.347 977 HD11 LEU 123 HD11 LEU 123 -5.116 -0.808 1.995 978 HD12 LEU 123 HD12 LEU 123 -6.329 -1.445 0.888 979 HD13 LEU 123 HD13 LEU 123 -6.396 0.268 1.378 980 HD21 LEU 123 HD21 LEU 123 -7.505 -0.254 4.829 981 HD22 LEU 123 HD22 LEU 123 -5.950 0.252 4.170 982 HD23 LEU 123 HD23 LEU 123 -7.452 0.931 3.505 983 H GLN 124 H GLN 124 -10.358 -4.091 2.391 984 HA GLN 124 HA GLN 124 -12.851 -3.131 1.406 985 HB2 GLN 124 HB2 GLN 124 -12.237 -5.940 2.430 986 HB3 GLN 124 HB3 GLN 124 -13.659 -5.441 1.514 987 HG2 GLN 124 HG2 GLN 124 -12.030 -4.675 -0.332 988 HG3 GLN 124 HG3 GLN 124 -10.789 -5.569 0.546 989 HE21 GLN 124 HE21 GLN 124 -11.972 -7.972 -1.942 990 HE22 GLN 124 HE22 GLN 124 -10.816 -6.646 -1.723 991 H ASP 125 H ASP 125 -12.171 -4.717 4.583 992 HA ASP 125 HA ASP 125 -14.868 -4.174 5.551 993 HB2 ASP 125 HB2 ASP 125 -13.422 -6.151 6.162 994 HB3 ASP 125 HB3 ASP 125 -12.352 -5.051 7.037 995 H HIS 126 H HIS 126 -12.317 -2.082 5.149 996 HA HIS 126 HA HIS 126 -13.081 -0.319 7.436 997 HB2 HIS 126 HB2 HIS 126 -10.704 -0.424 6.957 998 HB3 HIS 126 HB3 HIS 126 -10.995 0.060 5.281 999 HD2 HIS 126 HD2 HIS 126 -11.822 1.571 8.811 1000 HE1 HIS 126 HE1 HIS 126 -10.815 4.773 6.191 1001 HE2 HIS 126 HE2 HIS 126 -11.530 4.190 8.549 1002 H PHE 127 H PHE 127 -13.306 -0.504 3.864 1003 HA PHE 127 HA PHE 127 -15.007 1.894 3.851 1004 HB2 PHE 127 HB2 PHE 127 -13.789 0.254 1.648 1005 HB3 PHE 127 HB3 PHE 127 -14.944 1.554 1.365 1006 HD1 PHE 127 HD1 PHE 127 -11.459 0.815 2.059 1007 HD2 PHE 127 HD2 PHE 127 -14.458 3.898 2.318 1008 HE1 PHE 127 HE1 PHE 127 -9.678 2.514 2.349 1009 HE2 PHE 127 HE2 PHE 127 -12.659 5.599 2.628 1010 HZ PHE 127 HZ PHE 127 -10.289 4.906 2.640 1011 H LYS 128 H LYS 128 -15.652 -1.538 3.963 1012 HA LYS 128 HA LYS 128 -18.048 -1.595 2.563 1013 HB2 LYS 128 HB2 LYS 128 -18.531 -3.688 3.431 1014 HB3 LYS 128 HB3 LYS 128 -16.813 -3.556 3.193 1015 HG2 LYS 128 HG2 LYS 128 -16.887 -4.648 5.181 1016 HG3 LYS 128 HG3 LYS 128 -16.747 -2.977 5.772 1017 HD2 LYS 128 HD2 LYS 128 -19.212 -2.981 6.183 1018 HD3 LYS 128 HD3 LYS 128 -19.298 -4.628 5.510 1019 HE2 LYS 128 HE2 LYS 128 -17.753 -5.409 7.260 1020 HE3 LYS 128 HE3 LYS 128 -17.668 -3.778 7.930 1021 HZ1 LYS 128 HZ1 LYS 128 -19.269 -5.162 9.135 1022 HZ2 LYS 128 HZ2 LYS 128 -20.068 -3.936 8.412 1023 HZ3 LYS 128 HZ3 LYS 128 -20.131 -5.446 7.782 1024 H TRP 129 H TRP 129 -17.670 -0.245 5.708 1025 HA TRP 129 HA TRP 129 -20.628 -0.100 6.146 1026 HB2 TRP 129 HB2 TRP 129 -20.005 0.416 8.479 1027 HB3 TRP 129 HB3 TRP 129 -19.496 -1.163 7.918 1028 HD1 TRP 129 HD1 TRP 129 -16.900 -1.678 7.781 1029 HE1 TRP 129 HE1 TRP 129 -14.828 -0.508 8.594 1030 HE3 TRP 129 HE3 TRP 129 -18.969 2.861 8.882 1031 HZ2 TRP 129 HZ2 TRP 129 -14.090 2.141 9.604 1032 HZ3 TRP 129 HZ3 TRP 129 -17.536 4.734 9.698 1033 HH2 TRP 129 HH2 TRP 129 -15.100 4.382 10.055 1034 H VAL 130 H VAL 130 -18.540 1.710 4.577 1035 HA VAL 130 HA VAL 130 -19.925 4.299 5.079 1036 HB VAL 130 HB VAL 130 -17.399 5.136 4.346 1037 HG11 VAL 130 HG11 VAL 130 -18.630 4.845 7.116 1038 HG12 VAL 130 HG12 VAL 130 -17.273 5.911 6.718 1039 HG13 VAL 130 HG13 VAL 130 -18.863 6.199 5.990 1040 HG21 VAL 130 HG21 VAL 130 -16.901 3.083 6.505 1041 HG22 VAL 130 HG22 VAL 130 -16.430 2.920 4.810 1042 HG23 VAL 130 HG23 VAL 130 -15.756 4.228 5.790 1043 H LYS 131 H LYS 131 -18.464 5.566 2.964 1044 HA LYS 131 HA LYS 131 -18.493 5.977 0.824 1045 HB2 LYS 131 HB2 LYS 131 -16.771 4.208 1.339 1046 HB3 LYS 131 HB3 LYS 131 -17.891 2.986 0.750 1047 HG2 LYS 131 HG2 LYS 131 -16.170 3.478 -0.842 1048 HG3 LYS 131 HG3 LYS 131 -17.765 3.879 -1.476 1049 HD2 LYS 131 HD2 LYS 131 -17.268 6.324 -0.890 1050 HD3 LYS 131 HD3 LYS 131 -15.649 5.793 -0.415 1051 HE2 LYS 131 HE2 LYS 131 -15.532 6.671 -2.667 1052 HE3 LYS 131 HE3 LYS 131 -15.317 4.917 -2.762 1053 HZ1 LYS 131 HZ1 LYS 131 -16.880 5.817 -4.443 1054 HZ2 LYS 131 HZ2 LYS 131 -17.598 4.693 -3.516 1055 HZ3 LYS 131 HZ3 LYS 131 -17.912 6.282 -3.265 1056 H GLN 132 H GLN 132 -21.115 4.675 1.757 1057 HA GLN 132 HA GLN 132 -23.214 4.313 0.951 1058 HB2 GLN 132 HB2 GLN 132 -22.459 6.230 -1.271 1059 HB3 GLN 132 HB3 GLN 132 -24.063 5.930 -0.616 1060 HG2 GLN 132 HG2 GLN 132 -21.745 7.302 0.809 1061 HG3 GLN 132 HG3 GLN 132 -23.180 8.071 0.160 1062 HE21 GLN 132 HE21 GLN 132 -23.569 7.598 3.880 1063 HE22 GLN 132 HE22 GLN 132 -22.308 8.321 2.890 1064 H GLU 133 H GLU 133 -21.335 2.342 0.041 1065 HA GLU 133 HA GLU 133 -22.740 1.290 -2.381 1066 HB2 GLU 133 HB2 GLU 133 -19.742 1.454 -1.906 1067 HB3 GLU 133 HB3 GLU 133 -20.482 0.337 -3.058 1068 HG2 GLU 133 HG2 GLU 133 -21.492 2.206 -4.296 1069 HG3 GLU 133 HG3 GLU 133 -20.806 3.366 -3.164 1070 H1 SER 149 H1 SER 149 15.632 -19.468 -20.298 1071 H2 SER 149 H2 SER 149 15.906 -18.334 -21.453 1072 H3 SER 149 H3 SER 149 14.376 -18.830 -21.135 1073 HA SER 149 HA SER 149 16.121 -17.392 -19.256 1074 HB2 SER 149 HB2 SER 149 13.727 -16.322 -20.800 1075 HB3 SER 149 HB3 SER 149 14.718 -15.432 -19.625 1076 HG SER 149 HG SER 149 15.389 -15.039 -21.783 1077 H GLN 150 H GLN 150 15.103 -16.724 -17.277 1078 HA GLN 150 HA GLN 150 13.291 -18.681 -16.164 1079 HB2 GLN 150 HB2 GLN 150 15.145 -17.617 -14.934 1080 HB3 GLN 150 HB3 GLN 150 14.326 -16.051 -15.033 1081 HG2 GLN 150 HG2 GLN 150 12.453 -16.930 -13.683 1082 HG3 GLN 150 HG3 GLN 150 13.198 -18.531 -13.654 1083 HE21 GLN 150 HE21 GLN 150 14.047 -17.034 -10.404 1084 HE22 GLN 150 HE22 GLN 150 12.630 -17.684 -11.220 1085 H ILE 151 H ILE 151 11.150 -18.534 -15.628 1086 HA ILE 151 HA ILE 151 9.521 -16.427 -16.907 1087 HB ILE 151 HB ILE 151 8.720 -18.987 -15.481 1088 HG12 ILE 151 HG12 ILE 151 8.802 -18.279 -18.456 1089 HG13 ILE 151 HG13 ILE 151 9.951 -19.328 -17.632 1090 HG21 ILE 151 HG21 ILE 151 7.013 -17.018 -17.081 1091 HG22 ILE 151 HG22 ILE 151 6.459 -18.568 -16.413 1092 HG23 ILE 151 HG23 ILE 151 6.925 -17.283 -15.325 1093 HD11 ILE 151 HD11 ILE 151 8.431 -20.733 -18.794 1094 HD12 ILE 151 HD12 ILE 151 8.075 -20.896 -17.063 1095 HD13 ILE 151 HD13 ILE 151 7.015 -19.922 -18.116 1096 H THR 152 H THR 152 8.424 -14.849 -15.857 1097 HA THR 152 HA THR 152 9.160 -14.229 -13.098 1098 HB THR 152 HB THR 152 7.778 -12.143 -13.596 1099 HG1 THR 152 HG1 THR 152 7.367 -11.798 -15.806 1100 HG21 THR 152 HG21 THR 152 9.480 -11.151 -15.048 1101 HG22 THR 152 HG22 THR 152 10.238 -12.186 -13.828 1102 HG23 THR 152 HG23 THR 152 10.074 -12.766 -15.502 1103 H SER 153 H SER 153 7.757 -13.795 -11.384 1104 HA SER 153 HA SER 153 5.320 -15.365 -11.198 1105 HB2 SER 153 HB2 SER 153 6.524 -13.396 -9.247 1106 HB3 SER 153 HB3 SER 153 5.248 -14.587 -8.909 1107 HG SER 153 HG SER 153 7.333 -15.353 -8.274 1108 H GLN 154 H GLN 154 4.833 -13.834 -13.152 1109 HA GLN 154 HA GLN 154 3.896 -11.265 -13.121 1110 HB2 GLN 154 HB2 GLN 154 2.476 -11.926 -15.063 1111 HB3 GLN 154 HB3 GLN 154 4.174 -12.404 -15.156 1112 HG2 GLN 154 HG2 GLN 154 3.581 -14.707 -14.520 1113 HG3 GLN 154 HG3 GLN 154 1.888 -14.245 -14.340 1114 HE21 GLN 154 HE21 GLN 154 2.035 -15.814 -17.652 1115 HE22 GLN 154 HE22 GLN 154 2.065 -16.286 -15.958 1116 H VAL 155 H VAL 155 2.024 -10.125 -12.921 1117 HA VAL 155 HA VAL 155 -0.035 -11.157 -11.134 1118 HB VAL 155 HB VAL 155 0.669 -8.843 -10.860 1119 HG11 VAL 155 HG11 VAL 155 -0.414 -8.354 -13.650 1120 HG12 VAL 155 HG12 VAL 155 -0.010 -7.099 -12.478 1121 HG13 VAL 155 HG13 VAL 155 1.261 -8.174 -13.103 1122 HG21 VAL 155 HG21 VAL 155 -2.257 -9.191 -11.636 1123 HG22 VAL 155 HG22 VAL 155 -1.506 -9.188 -10.019 1124 HG23 VAL 155 HG23 VAL 155 -1.614 -7.713 -10.944 1125 H TPO 156 H T2P 156 -2.080 -11.716 -11.772 1126 HA TPO 156 HA T2P 156 -2.484 -12.612 -14.501 1127 HB TPO 156 HB T2P 156 -3.344 -13.702 -12.413 1128 HG21 TPO 156 HG21 T2P 156 -5.404 -13.217 -11.526 1129 HG22 TPO 156 HG22 T2P 156 -5.845 -12.138 -12.891 1130 HG23 TPO 156 HG23 T2P 156 -4.605 -11.678 -11.678 1131 H GLY 157 H GLY 157 -4.461 -12.338 -15.627 1132 HA2 GLY 157 HA2 GLY 157 -4.987 -9.384 -16.069 1133 HA3 GLY 157 HA3 GLY 157 -4.511 -10.470 -17.377 1134 H GLN 158 H GLN 158 -6.562 -12.048 -15.226 1135 HA GLN 158 HA GLN 158 -9.046 -11.446 -16.723 1136 HB2 GLN 158 HB2 GLN 158 -9.246 -13.764 -17.524 1137 HB3 GLN 158 HB3 GLN 158 -7.828 -12.951 -18.186 1138 HG2 GLN 158 HG2 GLN 158 -6.430 -14.096 -16.389 1139 HG3 GLN 158 HG3 GLN 158 -7.851 -15.027 -15.950 1140 HE21 GLN 158 HE21 GLN 158 -5.830 -17.101 -18.278 1141 HE22 GLN 158 HE22 GLN 158 -5.561 -16.312 -16.703 1142 H ILE 159 H ILE 159 -7.560 -13.433 -14.137 1143 HA ILE 159 HA ILE 159 -10.260 -14.412 -13.511 1144 HB ILE 159 HB ILE 159 -8.396 -15.921 -13.689 1145 HG12 ILE 159 HG12 ILE 159 -9.749 -15.970 -10.968 1146 HG13 ILE 159 HG13 ILE 159 -10.505 -16.442 -12.488 1147 HG21 ILE 159 HG21 ILE 159 -7.390 -14.754 -11.074 1148 HG22 ILE 159 HG22 ILE 159 -6.779 -16.231 -11.839 1149 HG23 ILE 159 HG23 ILE 159 -6.601 -14.706 -12.666 1150 HD11 ILE 159 HD11 ILE 159 -9.825 -18.438 -11.334 1151 HD12 ILE 159 HD12 ILE 159 -8.776 -18.245 -12.754 1152 HD13 ILE 159 HD13 ILE 159 -8.173 -17.845 -11.125 1153 H GLY 160 H GLY 160 -8.052 -12.264 -11.864 1154 HA2 GLY 160 HA2 GLY 160 -8.472 -10.675 -10.185 1155 HA3 GLY 160 HA3 GLY 160 -10.194 -10.952 -10.450 1156 H TRP 161 H TRP 161 -7.687 -13.208 -9.339 1157 HA TRP 161 HA TRP 161 -9.514 -14.189 -7.301 1158 HB2 TRP 161 HB2 TRP 161 -8.295 -16.233 -7.444 1159 HB3 TRP 161 HB3 TRP 161 -8.657 -15.648 -9.042 1160 HD1 TRP 161 HD1 TRP 161 -5.912 -13.561 -8.462 1161 HE1 TRP 161 HE1 TRP 161 -3.750 -14.511 -9.479 1162 HE3 TRP 161 HE3 TRP 161 -7.229 -18.458 -8.481 1163 HZ2 TRP 161 HZ2 TRP 161 -2.752 -17.133 -10.246 1164 HZ3 TRP 161 HZ3 TRP 161 -5.644 -20.206 -9.334 1165 HH2 TRP 161 HH2 TRP 161 -3.421 -19.546 -10.229 1166 H ARG 162 H ARG 162 -7.411 -15.649 -5.874 1167 HA ARG 162 HA ARG 162 -7.585 -13.584 -3.740 1168 HB2 ARG 162 HB2 ARG 162 -8.721 -16.398 -3.976 1169 HB3 ARG 162 HB3 ARG 162 -9.065 -15.284 -2.632 1170 HG2 ARG 162 HG2 ARG 162 -9.966 -15.091 -5.510 1171 HG3 ARG 162 HG3 ARG 162 -10.972 -15.433 -4.124 1172 HD2 ARG 162 HD2 ARG 162 -10.996 -13.209 -3.366 1173 HD3 ARG 162 HD3 ARG 162 -9.483 -12.798 -4.153 1174 HE ARG 162 HE ARG 162 -10.546 -12.331 -6.145 1175 HH11 ARG 162 HH11 ARG 162 -12.116 -11.995 -7.513 1176 HH12 ARG 162 HH12 ARG 162 -13.783 -12.375 -7.119 1177 HH21 ARG 162 HH21 ARG 162 -12.989 -13.756 -4.055 1178 HH22 ARG 162 HH22 ARG 162 -14.259 -13.388 -5.189 1179 H ARG 163 H ARG 163 -7.392 -14.861 -1.558 1180 HA ARG 163 HA ARG 163 -4.890 -14.980 -0.644 1181 HB2 ARG 163 HB2 ARG 163 -7.292 -15.413 0.488 1182 HB3 ARG 163 HB3 ARG 163 -6.768 -17.093 0.429 1183 HG2 ARG 163 HG2 ARG 163 -4.566 -16.214 1.540 1184 HG3 ARG 163 HG3 ARG 163 -5.503 -14.733 1.834 1185 HD2 ARG 163 HD2 ARG 163 -7.161 -16.056 3.131 1186 HD3 ARG 163 HD3 ARG 163 -6.193 -17.509 2.854 1187 HE ARG 163 HE ARG 163 -4.563 -16.764 4.354 1188 HH11 ARG 163 HH11 ARG 163 -3.540 -15.316 5.749 1189 HH12 ARG 163 HH12 ARG 163 -4.233 -13.722 5.980 1190 HH21 ARG 163 HH21 ARG 163 -7.018 -14.289 4.120 1191 HH22 ARG 163 HH22 ARG 163 -6.127 -13.181 5.153 Start of MODEL 14 1 H1 GLY -4 H1 GLY -4 -5.731 32.302 31.304 2 H2 GLY -4 H2 GLY -4 -4.378 31.393 31.480 3 H3 GLY -4 H3 GLY -4 -5.618 31.226 32.534 4 HA2 GLY -4 HA2 GLY -4 -7.057 30.358 30.815 5 HA3 GLY -4 HA3 GLY -4 -5.722 30.550 29.665 6 H SER -3 H SER -3 -6.901 28.097 29.925 7 HA SER -3 HA SER -3 -5.510 26.362 31.787 8 HB2 SER -3 HB2 SER -3 -6.638 24.554 30.447 9 HB3 SER -3 HB3 SER -3 -7.718 25.762 31.158 10 HG SER -3 HG SER -3 -8.239 25.297 28.964 11 HA PRO -2 HA PRO -2 -1.899 25.468 29.376 12 HB2 PRO -2 HB2 PRO -2 -1.214 22.939 30.149 13 HB3 PRO -2 HB3 PRO -2 -1.114 24.354 31.241 14 HG2 PRO -2 HG2 PRO -2 -3.371 22.332 31.024 15 HG3 PRO -2 HG3 PRO -2 -2.530 22.894 32.506 16 HD2 PRO -2 HD2 PRO -2 -4.893 23.970 31.719 17 HD3 PRO -2 HD3 PRO -2 -3.614 24.992 32.437 18 H ASN -1 H ASN -1 -1.103 24.376 27.543 19 HA ASN -1 HA ASN -1 -3.130 23.241 25.770 20 HB2 ASN -1 HB2 ASN -1 -1.362 24.936 25.108 21 HB3 ASN -1 HB3 ASN -1 -0.154 23.662 25.288 22 HD21 ASN -1 HD21 ASN -1 -0.759 23.478 21.751 23 HD22 ASN -1 HD22 ASN -1 0.257 24.248 22.963 24 H SER 0 H SER 0 -2.903 21.222 24.633 25 HA SER 0 HA SER 0 -1.095 19.136 25.606 26 HB2 SER 0 HB2 SER 0 -2.849 18.998 27.314 27 HB3 SER 0 HB3 SER 0 -4.102 18.911 26.058 28 HG SER 0 HG SER 0 -3.384 16.847 26.985 29 H MET 1 H MET 1 -0.904 17.435 24.151 30 HA MET 1 HA MET 1 -1.712 17.774 21.426 31 HB2 MET 1 HB2 MET 1 -0.702 15.299 22.904 32 HB3 MET 1 HB3 MET 1 -0.867 15.454 21.156 33 HG2 MET 1 HG2 MET 1 1.389 15.848 21.540 34 HG3 MET 1 HG3 MET 1 0.703 17.445 21.263 35 HE1 MET 1 HE1 MET 1 2.857 18.628 22.166 36 HE2 MET 1 HE2 MET 1 3.656 18.213 23.698 37 HE3 MET 1 HE3 MET 1 3.607 17.029 22.373 38 H ALA 2 H ALA 2 -3.443 16.428 24.123 39 HA ALA 2 HA ALA 2 -5.325 14.846 22.560 40 HB1 ALA 2 HB1 ALA 2 -6.434 14.553 24.725 41 HB2 ALA 2 HB2 ALA 2 -4.688 14.296 24.886 42 HB3 ALA 2 HB3 ALA 2 -5.419 15.820 25.444 43 H THR 3 H THR 3 -4.996 18.191 22.688 44 HA THR 3 HA THR 3 -7.737 18.953 23.100 45 HB THR 3 HB THR 3 -5.652 20.357 23.458 46 HG1 THR 3 HG1 THR 3 -7.863 21.416 22.047 47 HG21 THR 3 HG21 THR 3 -4.702 20.093 21.124 48 HG22 THR 3 HG22 THR 3 -6.024 21.113 20.524 49 HG23 THR 3 HG23 THR 3 -4.852 21.765 21.688 50 H GLU 4 H GLU 4 -6.421 17.453 20.408 51 HA GLU 4 HA GLU 4 -8.825 18.063 18.819 52 HB2 GLU 4 HB2 GLU 4 -7.718 18.642 16.816 53 HB3 GLU 4 HB3 GLU 4 -7.069 19.692 18.069 54 HG2 GLU 4 HG2 GLU 4 -5.059 18.152 18.222 55 HG3 GLU 4 HG3 GLU 4 -5.724 17.229 16.865 56 H LEU 5 H LEU 5 -8.974 16.630 16.868 57 HA LEU 5 HA LEU 5 -8.468 13.853 17.683 58 HB2 LEU 5 HB2 LEU 5 -10.055 15.046 15.379 59 HB3 LEU 5 HB3 LEU 5 -9.971 13.330 15.760 60 HG LEU 5 HG LEU 5 -11.158 15.470 17.575 61 HD11 LEU 5 HD11 LEU 5 -12.503 14.997 15.560 62 HD12 LEU 5 HD12 LEU 5 -12.471 13.260 15.941 63 HD13 LEU 5 HD13 LEU 5 -13.298 14.401 17.026 64 HD21 LEU 5 HD21 LEU 5 -10.269 13.643 18.946 65 HD22 LEU 5 HD22 LEU 5 -12.027 13.528 18.880 66 HD23 LEU 5 HD23 LEU 5 -11.037 12.436 17.886 67 H GLU 6 H GLU 6 -6.057 14.786 17.307 68 HA GLU 6 HA GLU 6 -5.097 14.477 14.578 69 HB2 GLU 6 HB2 GLU 6 -2.863 14.829 15.537 70 HB3 GLU 6 HB3 GLU 6 -4.021 16.104 15.865 71 HG2 GLU 6 HG2 GLU 6 -4.264 15.449 18.163 72 HG3 GLU 6 HG3 GLU 6 -3.434 13.914 17.893 73 H TYR 7 H TYR 7 -6.414 12.076 15.425 74 HA TYR 7 HA TYR 7 -4.266 10.216 16.215 75 HB2 TYR 7 HB2 TYR 7 -5.842 8.937 17.321 76 HB3 TYR 7 HB3 TYR 7 -6.350 10.581 17.632 77 HD1 TYR 7 HD1 TYR 7 -8.327 11.530 16.258 78 HD2 TYR 7 HD2 TYR 7 -7.307 7.338 16.342 79 HE1 TYR 7 HE1 TYR 7 -10.562 10.968 15.335 80 HE2 TYR 7 HE2 TYR 7 -9.560 6.775 15.462 81 HH TYR 7 HH TYR 7 -11.999 9.285 14.703 82 H GLU 8 H GLU 8 -4.838 7.870 15.722 83 HA GLU 8 HA GLU 8 -6.229 7.141 13.373 84 HB2 GLU 8 HB2 GLU 8 -4.462 6.266 11.970 85 HB3 GLU 8 HB3 GLU 8 -4.187 7.979 12.182 86 HG2 GLU 8 HG2 GLU 8 -2.559 7.304 14.106 87 HG3 GLU 8 HG3 GLU 8 -2.687 5.671 13.418 88 H SER 9 H SER 9 -6.983 5.176 13.767 89 HA SER 9 HA SER 9 -5.820 3.543 15.943 90 HB2 SER 9 HB2 SER 9 -8.532 3.617 14.599 91 HB3 SER 9 HB3 SER 9 -8.064 2.372 15.778 92 HG SER 9 HG SER 9 -9.133 4.127 16.796 93 H VAL 10 H VAL 10 -4.883 1.551 15.586 94 HA VAL 10 HA VAL 10 -4.209 0.794 12.914 95 HB VAL 10 HB VAL 10 -4.044 -0.907 15.388 96 HG11 VAL 10 HG11 VAL 10 -2.531 -1.058 12.737 97 HG12 VAL 10 HG12 VAL 10 -2.139 -2.012 14.184 98 HG13 VAL 10 HG13 VAL 10 -3.678 -2.262 13.372 99 HG21 VAL 10 HG21 VAL 10 -1.714 -0.150 15.584 100 HG22 VAL 10 HG22 VAL 10 -1.943 0.964 14.213 101 HG23 VAL 10 HG23 VAL 10 -2.816 1.213 15.741 102 H LEU 11 H LEU 11 -4.995 -0.569 11.499 103 HA LEU 11 HA LEU 11 -7.468 -2.162 12.081 104 HB2 LEU 11 HB2 LEU 11 -6.442 -1.098 9.416 105 HB3 LEU 11 HB3 LEU 11 -7.901 -2.040 9.675 106 HG LEU 11 HG LEU 11 -7.394 0.821 10.589 107 HD11 LEU 11 HD11 LEU 11 -7.827 0.558 8.200 108 HD12 LEU 11 HD12 LEU 11 -9.234 -0.475 8.531 109 HD13 LEU 11 HD13 LEU 11 -9.263 1.234 8.976 110 HD21 LEU 11 HD21 LEU 11 -8.795 -0.251 12.284 111 HD22 LEU 11 HD22 LEU 11 -9.795 0.801 11.282 112 HD23 LEU 11 HD23 LEU 11 -9.837 -0.957 11.022 113 H CYS 12 H CYS 12 -4.337 -2.111 10.345 114 HA CYS 12 HA CYS 12 -4.066 -5.016 10.680 115 HB2 CYS 12 HB2 CYS 12 -5.185 -4.618 8.458 116 HB3 CYS 12 HB3 CYS 12 -3.732 -3.762 7.930 117 HG CYS 12 HG CYS 12 -3.924 -6.240 6.954 118 H VAL 13 H VAL 13 -1.974 -5.779 10.561 119 HA VAL 13 HA VAL 13 0.280 -3.964 10.224 120 HB VAL 13 HB VAL 13 -0.186 -3.508 12.512 121 HG11 VAL 13 HG11 VAL 13 -0.235 -5.130 14.319 122 HG12 VAL 13 HG12 VAL 13 -1.543 -5.450 13.178 123 HG13 VAL 13 HG13 VAL 13 -0.089 -6.474 13.173 124 HG21 VAL 13 HG21 VAL 13 2.213 -3.814 11.891 125 HG22 VAL 13 HG22 VAL 13 1.889 -4.145 13.596 126 HG23 VAL 13 HG23 VAL 13 2.128 -5.490 12.466 127 H LYS 14 H LYS 14 1.773 -5.041 9.118 128 HA LYS 14 HA LYS 14 1.889 -7.991 9.435 129 HB2 LYS 14 HB2 LYS 14 1.934 -6.535 6.777 130 HB3 LYS 14 HB3 LYS 14 2.522 -8.169 6.959 131 HG2 LYS 14 HG2 LYS 14 -0.307 -7.280 7.651 132 HG3 LYS 14 HG3 LYS 14 0.192 -8.063 6.149 133 HD2 LYS 14 HD2 LYS 14 0.970 -10.058 7.450 134 HD3 LYS 14 HD3 LYS 14 0.350 -9.307 8.941 135 HE2 LYS 14 HE2 LYS 14 -1.882 -9.143 7.950 136 HE3 LYS 14 HE3 LYS 14 -1.276 -9.928 6.474 137 HZ1 LYS 14 HZ1 LYS 14 -2.391 -11.471 8.022 138 HZ2 LYS 14 HZ2 LYS 14 -0.825 -11.904 7.725 139 HZ3 LYS 14 HZ3 LYS 14 -1.249 -11.198 9.154 140 HA PRO 15 HA PRO 15 5.883 -7.637 10.680 141 HB2 PRO 15 HB2 PRO 15 6.854 -10.188 10.327 142 HB3 PRO 15 HB3 PRO 15 5.551 -9.778 11.479 143 HG2 PRO 15 HG2 PRO 15 5.225 -10.840 8.633 144 HG3 PRO 15 HG3 PRO 15 4.461 -11.461 10.136 145 HD2 PRO 15 HD2 PRO 15 3.157 -9.790 8.529 146 HD3 PRO 15 HD3 PRO 15 3.057 -9.605 10.308 147 H ASP 16 H ASP 16 5.615 -8.762 7.329 148 HA ASP 16 HA ASP 16 8.225 -7.543 6.651 149 HB2 ASP 16 HB2 ASP 16 8.699 -9.882 7.261 150 HB3 ASP 16 HB3 ASP 16 7.503 -10.441 6.098 151 H VAL 17 H VAL 17 7.999 -6.340 4.897 152 HA VAL 17 HA VAL 17 6.184 -7.031 2.679 153 HB VAL 17 HB VAL 17 4.737 -5.800 4.240 154 HG11 VAL 17 HG11 VAL 17 6.637 -3.452 3.920 155 HG12 VAL 17 HG12 VAL 17 5.040 -3.405 4.676 156 HG13 VAL 17 HG13 VAL 17 6.330 -4.373 5.405 157 HG21 VAL 17 HG21 VAL 17 4.410 -5.615 1.786 158 HG22 VAL 17 HG22 VAL 17 3.837 -4.206 2.687 159 HG23 VAL 17 HG23 VAL 17 5.367 -4.111 1.798 160 H SER 18 H SER 18 6.845 -6.017 0.718 161 HA SER 18 HA SER 18 9.439 -4.530 0.843 162 HB2 SER 18 HB2 SER 18 8.701 -6.671 -1.171 163 HB3 SER 18 HB3 SER 18 10.235 -5.798 -1.009 164 HG SER 18 HG SER 18 9.090 -7.693 0.772 165 H VAL 19 H VAL 19 9.768 -2.909 -0.597 166 HA VAL 19 HA VAL 19 7.509 -2.150 -2.408 167 HB VAL 19 HB VAL 19 9.192 -0.359 -0.648 168 HG11 VAL 19 HG11 VAL 19 7.299 0.396 -2.899 169 HG12 VAL 19 HG12 VAL 19 7.959 1.526 -1.693 170 HG13 VAL 19 HG13 VAL 19 9.047 0.746 -2.828 171 HG21 VAL 19 HG21 VAL 19 6.205 -0.898 -0.939 172 HG22 VAL 19 HG22 VAL 19 7.223 -1.353 0.438 173 HG23 VAL 19 HG23 VAL 19 6.903 0.351 0.096 174 H TYR 20 H TYR 20 7.909 -1.808 -4.381 175 HA TYR 20 HA TYR 20 10.662 -2.385 -5.349 176 HB2 TYR 20 HB2 TYR 20 7.910 -2.790 -6.569 177 HB3 TYR 20 HB3 TYR 20 9.420 -3.171 -7.377 178 HD1 TYR 20 HD1 TYR 20 10.274 -5.336 -7.221 179 HD2 TYR 20 HD2 TYR 20 7.551 -3.980 -4.170 180 HE1 TYR 20 HE1 TYR 20 10.307 -7.597 -6.165 181 HE2 TYR 20 HE2 TYR 20 7.704 -6.192 -3.064 182 HH TYR 20 HH TYR 20 9.598 -8.898 -4.409 183 H ARG 21 H ARG 21 8.515 0.136 -5.332 184 HA ARG 21 HA ARG 21 8.132 2.123 -6.371 185 HB2 ARG 21 HB2 ARG 21 11.017 2.080 -7.280 186 HB3 ARG 21 HB3 ARG 21 9.953 3.478 -7.130 187 HG2 ARG 21 HG2 ARG 21 9.826 3.017 -4.627 188 HG3 ARG 21 HG3 ARG 21 11.054 1.760 -4.872 189 HD2 ARG 21 HD2 ARG 21 12.460 3.588 -6.024 190 HD3 ARG 21 HD3 ARG 21 11.325 4.756 -5.350 191 HE ARG 21 HE ARG 21 13.235 2.979 -3.877 192 HH11 ARG 21 HH11 ARG 21 13.943 3.441 -2.060 193 HH12 ARG 21 HH12 ARG 21 13.353 4.802 -1.102 194 HH21 ARG 21 HH21 ARG 21 10.981 5.654 -3.498 195 HH22 ARG 21 HH22 ARG 21 11.629 6.028 -1.924 196 H ILE 22 H ILE 22 7.455 3.133 -8.243 197 HA ILE 22 HA ILE 22 7.785 1.560 -10.761 198 HB ILE 22 HB ILE 22 5.472 1.561 -11.249 199 HG12 ILE 22 HG12 ILE 22 5.093 3.200 -8.722 200 HG13 ILE 22 HG13 ILE 22 4.639 3.602 -10.387 201 HG21 ILE 22 HG21 ILE 22 5.872 0.578 -8.415 202 HG22 ILE 22 HG22 ILE 22 4.709 -0.023 -9.599 203 HG23 ILE 22 HG23 ILE 22 6.446 -0.240 -9.869 204 HD11 ILE 22 HD11 ILE 22 3.330 1.584 -8.558 205 HD12 ILE 22 HD12 ILE 22 2.643 3.061 -9.259 206 HD13 ILE 22 HD13 ILE 22 3.002 1.673 -10.310 207 HA PRO 23 HA PRO 23 8.086 5.617 -12.581 208 HB2 PRO 23 HB2 PRO 23 8.233 4.893 -15.262 209 HB3 PRO 23 HB3 PRO 23 9.580 4.979 -14.095 210 HG2 PRO 23 HG2 PRO 23 8.137 2.563 -15.105 211 HG3 PRO 23 HG3 PRO 23 9.826 2.729 -14.572 212 HD2 PRO 23 HD2 PRO 23 7.747 1.633 -13.043 213 HD3 PRO 23 HD3 PRO 23 9.285 2.262 -12.391 214 HA PRO 24 HA PRO 24 4.144 5.747 -15.194 215 HB2 PRO 24 HB2 PRO 24 2.298 3.756 -15.308 216 HB3 PRO 24 HB3 PRO 24 3.791 3.741 -16.297 217 HG2 PRO 24 HG2 PRO 24 3.319 2.361 -13.627 218 HG3 PRO 24 HG3 PRO 24 3.956 1.642 -15.143 219 HD2 PRO 24 HD2 PRO 24 5.601 2.525 -13.179 220 HD3 PRO 24 HD3 PRO 24 6.022 2.740 -14.903 221 H ARG 25 H ARG 25 2.176 6.648 -14.727 222 HA ARG 25 HA ARG 25 1.042 6.415 -11.960 223 HB2 ARG 25 HB2 ARG 25 -0.076 8.508 -12.367 224 HB3 ARG 25 HB3 ARG 25 1.657 8.694 -12.631 225 HG2 ARG 25 HG2 ARG 25 1.362 8.696 -15.051 226 HG3 ARG 25 HG3 ARG 25 -0.356 8.277 -14.897 227 HD2 ARG 25 HD2 ARG 25 -0.836 10.379 -13.791 228 HD3 ARG 25 HD3 ARG 25 0.888 10.828 -13.817 229 HE ARG 25 HE ARG 25 0.048 10.265 -16.485 230 HH11 ARG 25 HH11 ARG 25 -0.365 11.870 -17.964 231 HH12 ARG 25 HH12 ARG 25 -0.733 13.480 -17.422 232 HH21 ARG 25 HH21 ARG 25 -0.484 12.755 -14.079 233 HH22 ARG 25 HH22 ARG 25 -0.800 13.977 -15.281 234 H ALA 26 H ALA 26 0.305 5.680 -15.240 235 HA ALA 26 HA ALA 26 -2.064 4.152 -14.524 236 HB1 ALA 26 HB1 ALA 26 -3.627 5.564 -15.837 237 HB2 ALA 26 HB2 ALA 26 -2.959 6.470 -14.459 238 HB3 ALA 26 HB3 ALA 26 -2.332 6.773 -16.084 239 H SER 27 H SER 27 -1.386 2.446 -15.499 240 HA SER 27 HA SER 27 -0.548 2.510 -18.347 241 HB2 SER 27 HB2 SER 27 0.751 1.137 -16.661 242 HB3 SER 27 HB3 SER 27 -0.674 0.085 -16.534 243 HG SER 27 HG SER 27 0.878 0.698 -18.855 244 H ASN 28 H ASN 28 -1.507 1.006 -19.754 245 HA ASN 28 HA ASN 28 -4.173 1.431 -20.262 246 HB2 ASN 28 HB2 ASN 28 -3.863 0.014 -22.139 247 HB3 ASN 28 HB3 ASN 28 -2.301 0.755 -21.837 248 HD21 ASN 28 HD21 ASN 28 -0.937 -2.491 -20.687 249 HD22 ASN 28 HD22 ASN 28 -0.927 -0.849 -20.078 250 H ARG 29 H ARG 29 -3.016 -1.154 -18.207 251 HA ARG 29 HA ARG 29 -5.821 -2.224 -17.942 252 HB2 ARG 29 HB2 ARG 29 -3.343 -3.743 -17.139 253 HB3 ARG 29 HB3 ARG 29 -4.966 -4.363 -17.384 254 HG2 ARG 29 HG2 ARG 29 -2.950 -3.493 -19.459 255 HG3 ARG 29 HG3 ARG 29 -3.510 -5.128 -19.137 256 HD2 ARG 29 HD2 ARG 29 -5.043 -2.875 -20.471 257 HD3 ARG 29 HD3 ARG 29 -4.497 -4.368 -21.190 258 HE ARG 29 HE ARG 29 -6.119 -5.604 -19.811 259 HH11 ARG 29 HH11 ARG 29 -8.289 -5.807 -19.486 260 HH12 ARG 29 HH12 ARG 29 -9.313 -4.403 -19.503 261 HH21 ARG 29 HH21 ARG 29 -6.800 -2.141 -20.081 262 HH22 ARG 29 HH22 ARG 29 -8.508 -2.408 -19.867 263 H GLY 30 H GLY 30 -3.871 -0.176 -16.443 264 HA2 GLY 30 HA2 GLY 30 -4.706 0.532 -14.123 265 HA3 GLY 30 HA3 GLY 30 -4.343 -1.140 -13.643 266 H TYR 31 H TYR 31 -2.231 -1.751 -13.306 267 HA TYR 31 HA TYR 31 -0.020 0.157 -14.019 268 HB2 TYR 31 HB2 TYR 31 -0.446 -1.218 -11.353 269 HB3 TYR 31 HB3 TYR 31 1.078 -0.515 -11.864 270 HD1 TYR 31 HD1 TYR 31 1.407 1.872 -12.160 271 HD2 TYR 31 HD2 TYR 31 -2.314 0.222 -10.704 272 HE1 TYR 31 HE1 TYR 31 0.818 4.069 -11.160 273 HE2 TYR 31 HE2 TYR 31 -2.926 2.444 -9.747 274 HH TYR 31 HH TYR 31 -0.772 5.285 -9.995 275 H ARG 32 H ARG 32 -0.990 -3.188 -13.430 276 HA ARG 32 HA ARG 32 -0.040 -5.158 -13.428 277 HB2 ARG 32 HB2 ARG 32 1.441 -4.853 -15.926 278 HB3 ARG 32 HB3 ARG 32 0.145 -5.920 -15.432 279 HG2 ARG 32 HG2 ARG 32 -1.030 -4.890 -17.033 280 HG3 ARG 32 HG3 ARG 32 -1.325 -3.657 -15.829 281 HD2 ARG 32 HD2 ARG 32 -0.640 -2.478 -17.747 282 HD3 ARG 32 HD3 ARG 32 0.801 -2.497 -16.709 283 HE ARG 32 HE ARG 32 0.697 -4.764 -18.550 284 HH11 ARG 32 HH11 ARG 32 2.484 -5.000 -19.894 285 HH12 ARG 32 HH12 ARG 32 3.433 -3.590 -20.285 286 HH21 ARG 32 HH21 ARG 32 1.548 -1.375 -18.526 287 HH22 ARG 32 HH22 ARG 32 3.099 -1.707 -19.294 288 H ALA 33 H ALA 33 1.344 -5.738 -11.882 289 HA ALA 33 HA ALA 33 3.842 -4.644 -11.309 290 HB1 ALA 33 HB1 ALA 33 4.219 -6.665 -9.982 291 HB2 ALA 33 HB2 ALA 33 2.555 -6.108 -9.799 292 HB3 ALA 33 HB3 ALA 33 2.907 -7.506 -10.838 293 H SER 34 H SER 34 3.128 -6.996 -13.787 294 HA SER 34 HA SER 34 5.826 -7.895 -14.276 295 HB2 SER 34 HB2 SER 34 3.584 -9.026 -14.827 296 HB3 SER 34 HB3 SER 34 3.500 -7.941 -16.223 297 HG SER 34 HG SER 34 5.626 -8.780 -16.806 298 H ASP 35 H ASP 35 4.272 -4.872 -15.096 299 HA ASP 35 HA ASP 35 5.854 -4.316 -17.502 300 HB2 ASP 35 HB2 ASP 35 3.626 -3.319 -17.021 301 HB3 ASP 35 HB3 ASP 35 4.309 -2.473 -15.641 302 H TRP 36 H TRP 36 6.072 -3.605 -14.057 303 HA TRP 36 HA TRP 36 8.718 -2.272 -14.352 304 HB2 TRP 36 HB2 TRP 36 8.000 -1.518 -11.896 305 HB3 TRP 36 HB3 TRP 36 7.570 -0.683 -13.359 306 HD1 TRP 36 HD1 TRP 36 5.113 -0.562 -14.098 307 HE1 TRP 36 HE1 TRP 36 2.885 -1.112 -13.009 308 HE3 TRP 36 HE3 TRP 36 6.827 -3.192 -10.040 309 HZ2 TRP 36 HZ2 TRP 36 2.016 -1.971 -10.361 310 HZ3 TRP 36 HZ3 TRP 36 5.270 -3.799 -8.207 311 HH2 TRP 36 HH2 TRP 36 2.870 -3.171 -8.335 312 H LYS 37 H LYS 37 9.490 -2.623 -11.614 313 HA LYS 37 HA LYS 37 10.637 -5.328 -11.673 314 HB2 LYS 37 HB2 LYS 37 10.716 -2.992 -9.705 315 HB3 LYS 37 HB3 LYS 37 11.435 -4.566 -9.339 316 HG2 LYS 37 HG2 LYS 37 12.902 -4.453 -11.255 317 HG3 LYS 37 HG3 LYS 37 12.157 -2.955 -11.826 318 HD2 LYS 37 HD2 LYS 37 13.046 -1.670 -10.046 319 HD3 LYS 37 HD3 LYS 37 13.450 -3.102 -9.083 320 HE2 LYS 37 HE2 LYS 37 15.146 -3.796 -10.686 321 HE3 LYS 37 HE3 LYS 37 14.740 -2.443 -11.757 322 HZ1 LYS 37 HZ1 LYS 37 15.839 -2.163 -9.006 323 HZ2 LYS 37 HZ2 LYS 37 16.684 -1.939 -10.384 324 HZ3 LYS 37 HZ3 LYS 37 15.471 -0.919 -10.001 325 H LEU 38 H LEU 38 9.337 -6.760 -11.717 326 HA LEU 38 HA LEU 38 7.187 -7.327 -9.892 327 HB2 LEU 38 HB2 LEU 38 7.373 -8.021 -12.290 328 HB3 LEU 38 HB3 LEU 38 8.846 -8.916 -11.916 329 HG LEU 38 HG LEU 38 7.542 -10.325 -10.378 330 HD11 LEU 38 HD11 LEU 38 5.144 -9.032 -11.784 331 HD12 LEU 38 HD12 LEU 38 5.059 -10.451 -10.718 332 HD13 LEU 38 HD13 LEU 38 5.535 -8.883 -10.057 333 HD21 LEU 38 HD21 LEU 38 8.135 -11.063 -12.654 334 HD22 LEU 38 HD22 LEU 38 6.576 -11.742 -12.152 335 HD23 LEU 38 HD23 LEU 38 6.627 -10.365 -13.283 336 H ASP 39 H ASP 39 10.639 -8.191 -10.016 337 HA ASP 39 HA ASP 39 10.390 -9.823 -7.522 338 HB2 ASP 39 HB2 ASP 39 10.423 -11.092 -9.699 339 HB3 ASP 39 HB3 ASP 39 12.035 -10.447 -9.996 340 H GLN 40 H GLN 40 11.652 -7.009 -8.390 341 HA GLN 40 HA GLN 40 14.219 -7.340 -6.874 342 HB2 GLN 40 HB2 GLN 40 13.704 -5.698 -9.356 343 HB3 GLN 40 HB3 GLN 40 15.126 -5.531 -8.319 344 HG2 GLN 40 HG2 GLN 40 15.697 -7.922 -8.722 345 HG3 GLN 40 HG3 GLN 40 14.316 -8.060 -9.818 346 HE21 GLN 40 HE21 GLN 40 15.940 -6.302 -12.490 347 HE22 GLN 40 HE22 GLN 40 14.385 -6.853 -11.885 348 HA PRO 41 HA PRO 41 11.729 -4.127 -4.693 349 HB2 PRO 41 HB2 PRO 41 12.344 -4.752 -2.119 350 HB3 PRO 41 HB3 PRO 41 11.119 -5.639 -3.078 351 HG2 PRO 41 HG2 PRO 41 14.017 -6.401 -2.605 352 HG3 PRO 41 HG3 PRO 41 12.561 -7.432 -2.433 353 HD2 PRO 41 HD2 PRO 41 14.116 -7.435 -4.686 354 HD3 PRO 41 HD3 PRO 41 12.346 -7.677 -4.764 355 H ASP 42 H ASP 42 12.384 -2.208 -3.648 356 HA ASP 42 HA ASP 42 15.325 -1.615 -3.662 357 HB2 ASP 42 HB2 ASP 42 13.919 -0.286 -5.206 358 HB3 ASP 42 HB3 ASP 42 12.928 0.244 -3.845 359 H TRP 43 H TRP 43 12.417 -1.645 -1.678 360 HA TRP 43 HA TRP 43 14.054 -1.190 0.764 361 HB2 TRP 43 HB2 TRP 43 12.987 0.948 0.270 362 HB3 TRP 43 HB3 TRP 43 11.435 0.167 0.018 363 HD1 TRP 43 HD1 TRP 43 13.696 1.492 2.726 364 HE1 TRP 43 HE1 TRP 43 12.483 1.484 4.989 365 HE3 TRP 43 HE3 TRP 43 9.519 -1.173 1.413 366 HZ2 TRP 43 HZ2 TRP 43 9.990 0.524 6.062 367 HZ3 TRP 43 HZ3 TRP 43 7.747 -1.647 3.089 368 HH2 TRP 43 HH2 TRP 43 7.966 -0.790 5.414 369 H THR 44 H THR 44 13.363 -2.432 2.575 370 HA THR 44 HA THR 44 10.705 -3.638 2.481 371 HB THR 44 HB THR 44 11.250 -5.778 2.987 372 HG1 THR 44 HG1 THR 44 13.977 -5.132 3.359 373 HG21 THR 44 HG21 THR 44 13.558 -5.227 1.104 374 HG22 THR 44 HG22 THR 44 12.697 -6.764 1.375 375 HG23 THR 44 HG23 THR 44 11.858 -5.405 0.622 376 H GLY 45 H GLY 45 9.828 -4.198 4.421 377 HA2 GLY 45 HA2 GLY 45 11.023 -3.571 6.976 378 HA3 GLY 45 HA3 GLY 45 10.110 -2.211 6.353 379 H ARG 46 H ARG 46 8.430 -2.180 7.557 380 HA ARG 46 HA ARG 46 6.706 -4.587 8.047 381 HB2 ARG 46 HB2 ARG 46 8.088 -4.038 9.979 382 HB3 ARG 46 HB3 ARG 46 7.564 -2.357 9.940 383 HG2 ARG 46 HG2 ARG 46 5.249 -3.046 10.503 384 HG3 ARG 46 HG3 ARG 46 5.757 -4.745 10.520 385 HD2 ARG 46 HD2 ARG 46 6.878 -2.577 12.335 386 HD3 ARG 46 HD3 ARG 46 5.592 -3.696 12.783 387 HE ARG 46 HE ARG 46 7.137 -5.567 12.579 388 HH11 ARG 46 HH11 ARG 46 9.146 -6.399 13.062 389 HH12 ARG 46 HH12 ARG 46 10.511 -5.319 13.198 390 HH21 ARG 46 HH21 ARG 46 8.745 -2.446 12.743 391 HH22 ARG 46 HH22 ARG 46 10.250 -3.171 13.225 392 H LEU 47 H LEU 47 4.505 -4.273 8.017 393 HA LEU 47 HA LEU 47 3.526 -1.781 6.698 394 HB2 LEU 47 HB2 LEU 47 3.005 -4.036 5.701 395 HB3 LEU 47 HB3 LEU 47 2.240 -4.462 7.225 396 HG LEU 47 HG LEU 47 0.665 -2.411 6.786 397 HD11 LEU 47 HD11 LEU 47 1.644 -2.932 3.962 398 HD12 LEU 47 HD12 LEU 47 0.293 -1.880 4.459 399 HD13 LEU 47 HD13 LEU 47 1.941 -1.460 4.916 400 HD21 LEU 47 HD21 LEU 47 -0.097 -4.706 6.812 401 HD22 LEU 47 HD22 LEU 47 -0.835 -3.856 5.455 402 HD23 LEU 47 HD23 LEU 47 0.522 -4.974 5.174 403 H ARG 48 H ARG 48 2.219 -0.345 7.725 404 HA ARG 48 HA ARG 48 0.401 -1.390 9.841 405 HB2 ARG 48 HB2 ARG 48 1.495 1.452 9.701 406 HB3 ARG 48 HB3 ARG 48 0.293 0.868 10.850 407 HG2 ARG 48 HG2 ARG 48 3.160 -0.146 10.674 408 HG3 ARG 48 HG3 ARG 48 2.618 1.124 11.759 409 HD2 ARG 48 HD2 ARG 48 1.188 -1.534 11.853 410 HD3 ARG 48 HD3 ARG 48 2.810 -1.425 12.535 411 HE ARG 48 HE ARG 48 0.360 -0.271 13.614 412 HH11 ARG 48 HH11 ARG 48 0.430 0.611 15.663 413 HH12 ARG 48 HH12 ARG 48 1.958 1.019 16.378 414 HH21 ARG 48 HH21 ARG 48 3.881 0.167 13.677 415 HH22 ARG 48 HH22 ARG 48 3.827 0.756 15.308 416 H ILE 49 H ILE 49 -1.662 -1.113 9.401 417 HA ILE 49 HA ILE 49 -2.502 1.022 7.479 418 HB ILE 49 HB ILE 49 -3.829 -1.674 7.858 419 HG12 ILE 49 HG12 ILE 49 -2.275 -0.451 5.531 420 HG13 ILE 49 HG13 ILE 49 -1.850 -1.889 6.461 421 HG21 ILE 49 HG21 ILE 49 -4.636 0.595 6.006 422 HG22 ILE 49 HG22 ILE 49 -5.474 -0.957 6.244 423 HG23 ILE 49 HG23 ILE 49 -5.446 0.212 7.550 424 HD11 ILE 49 HD11 ILE 49 -3.922 -3.008 5.587 425 HD12 ILE 49 HD12 ILE 49 -4.147 -1.602 4.500 426 HD13 ILE 49 HD13 ILE 49 -2.702 -2.613 4.373 427 H THR 50 H THR 50 -3.463 2.547 8.583 428 HA THR 50 HA THR 50 -4.838 1.919 11.175 429 HB THR 50 HB THR 50 -4.001 4.012 12.042 430 HG1 THR 50 HG1 THR 50 -2.391 5.119 10.735 431 HG21 THR 50 HG21 THR 50 -1.593 2.637 10.782 432 HG22 THR 50 HG22 THR 50 -1.674 3.531 12.313 433 HG23 THR 50 HG23 THR 50 -2.480 1.961 12.161 434 H SER 51 H SER 51 -6.422 3.723 11.764 435 HA SER 51 HA SER 51 -7.538 5.256 9.506 436 HB2 SER 51 HB2 SER 51 -8.781 3.310 9.181 437 HB3 SER 51 HB3 SER 51 -8.896 2.967 10.920 438 HG SER 51 HG SER 51 -10.744 3.911 10.834 439 H LYS 52 H LYS 52 -8.028 7.160 10.129 440 HA LYS 52 HA LYS 52 -8.785 7.815 12.941 441 HB2 LYS 52 HB2 LYS 52 -6.985 9.042 11.761 442 HB3 LYS 52 HB3 LYS 52 -8.196 9.621 10.592 443 HG2 LYS 52 HG2 LYS 52 -9.347 10.595 12.793 444 HG3 LYS 52 HG3 LYS 52 -7.765 10.336 13.494 445 HD2 LYS 52 HD2 LYS 52 -8.452 11.940 11.009 446 HD3 LYS 52 HD3 LYS 52 -8.056 12.604 12.609 447 HE2 LYS 52 HE2 LYS 52 -5.772 11.857 12.432 448 HE3 LYS 52 HE3 LYS 52 -6.126 10.920 10.974 449 HZ1 LYS 52 HZ1 LYS 52 -6.559 12.984 9.796 450 HZ2 LYS 52 HZ2 LYS 52 -6.293 13.882 11.140 451 HZ3 LYS 52 HZ3 LYS 52 -5.065 13.052 10.449 452 H GLY 53 H GLY 53 -10.479 6.256 11.126 453 HA2 GLY 53 HA2 GLY 53 -12.780 5.932 10.990 454 HA3 GLY 53 HA3 GLY 53 -13.068 7.556 11.612 455 H LYS 54 H LYS 54 -13.504 5.680 8.974 456 HA LYS 54 HA LYS 54 -13.841 5.867 6.752 457 HB2 LYS 54 HB2 LYS 54 -15.581 7.302 7.845 458 HB3 LYS 54 HB3 LYS 54 -14.638 8.719 7.434 459 HG2 LYS 54 HG2 LYS 54 -15.268 6.892 5.136 460 HG3 LYS 54 HG3 LYS 54 -16.665 7.592 5.961 461 HD2 LYS 54 HD2 LYS 54 -15.605 9.874 5.710 462 HD3 LYS 54 HD3 LYS 54 -14.403 9.122 4.641 463 HE2 LYS 54 HE2 LYS 54 -16.263 8.292 3.187 464 HE3 LYS 54 HE3 LYS 54 -17.440 9.048 4.272 465 HZ1 LYS 54 HZ1 LYS 54 -16.324 11.213 3.752 466 HZ2 LYS 54 HZ2 LYS 54 -15.384 10.449 2.640 467 HZ3 LYS 54 HZ3 LYS 54 -17.001 10.533 2.430 468 H THR 55 H THR 55 -11.248 7.522 7.890 469 HA THR 55 HA THR 55 -10.102 7.471 5.137 470 HB THR 55 HB THR 55 -8.920 9.228 7.297 471 HG1 THR 55 HG1 THR 55 -11.016 10.005 6.990 472 HG21 THR 55 HG21 THR 55 -7.621 8.647 5.254 473 HG22 THR 55 HG22 THR 55 -8.961 9.242 4.249 474 HG23 THR 55 HG23 THR 55 -8.044 10.373 5.279 475 H ALA 56 H ALA 56 -8.802 5.800 4.948 476 HA ALA 56 HA ALA 56 -7.434 4.657 7.318 477 HB1 ALA 56 HB1 ALA 56 -6.818 2.788 5.776 478 HB2 ALA 56 HB2 ALA 56 -8.562 2.976 5.989 479 HB3 ALA 56 HB3 ALA 56 -7.785 3.557 4.503 480 H TYR 57 H TYR 57 -5.105 4.355 7.227 481 HA TYR 57 HA TYR 57 -3.670 5.967 5.167 482 HB2 TYR 57 HB2 TYR 57 -3.103 5.987 8.145 483 HB3 TYR 57 HB3 TYR 57 -2.172 6.789 6.895 484 HD1 TYR 57 HD1 TYR 57 -2.788 8.968 6.095 485 HD2 TYR 57 HD2 TYR 57 -5.505 6.779 8.642 486 HE1 TYR 57 HE1 TYR 57 -4.197 11.002 6.362 487 HE2 TYR 57 HE2 TYR 57 -6.936 8.787 8.840 488 HH TYR 57 HH TYR 57 -6.095 11.897 7.272 489 H ILE 58 H ILE 58 -2.386 4.654 4.081 490 HA ILE 58 HA ILE 58 -1.415 2.103 5.263 491 HB ILE 58 HB ILE 58 -0.632 3.241 2.568 492 HG12 ILE 58 HG12 ILE 58 -3.045 3.154 2.468 493 HG13 ILE 58 HG13 ILE 58 -2.289 1.974 1.421 494 HG21 ILE 58 HG21 ILE 58 -0.601 0.457 3.769 495 HG22 ILE 58 HG22 ILE 58 -0.193 0.855 2.083 496 HG23 ILE 58 HG23 ILE 58 0.798 1.485 3.399 497 HD11 ILE 58 HD11 ILE 58 -2.839 0.158 2.971 498 HD12 ILE 58 HD12 ILE 58 -3.520 1.332 4.128 499 HD13 ILE 58 HD13 ILE 58 -4.276 1.100 2.540 500 H LYS 59 H LYS 59 0.175 2.446 6.717 501 HA LYS 59 HA LYS 59 2.383 4.361 6.000 502 HB2 LYS 59 HB2 LYS 59 1.549 3.602 8.814 503 HB3 LYS 59 HB3 LYS 59 2.775 4.773 8.315 504 HG2 LYS 59 HG2 LYS 59 0.760 5.880 6.986 505 HG3 LYS 59 HG3 LYS 59 -0.241 4.946 8.104 506 HD2 LYS 59 HD2 LYS 59 0.975 6.075 10.016 507 HD3 LYS 59 HD3 LYS 59 1.848 7.051 8.809 508 HE2 LYS 59 HE2 LYS 59 -0.449 7.702 7.876 509 HE3 LYS 59 HE3 LYS 59 -1.156 6.963 9.342 510 HZ1 LYS 59 HZ1 LYS 59 -0.072 8.534 10.679 511 HZ2 LYS 59 HZ2 LYS 59 0.836 9.149 9.401 512 HZ3 LYS 59 HZ3 LYS 59 -0.780 9.387 9.498 513 H LEU 60 H LEU 60 4.436 3.739 6.007 514 HA LEU 60 HA LEU 60 4.960 0.807 6.412 515 HB2 LEU 60 HB2 LEU 60 6.084 2.806 4.415 516 HB3 LEU 60 HB3 LEU 60 6.681 1.163 4.617 517 HG LEU 60 HG LEU 60 3.815 1.837 3.802 518 HD11 LEU 60 HD11 LEU 60 6.194 0.960 2.132 519 HD12 LEU 60 HD12 LEU 60 4.521 1.125 1.546 520 HD13 LEU 60 HD13 LEU 60 5.413 2.557 2.084 521 HD21 LEU 60 HD21 LEU 60 3.740 -0.541 3.110 522 HD22 LEU 60 HD22 LEU 60 5.378 -0.788 3.755 523 HD23 LEU 60 HD23 LEU 60 4.034 -0.395 4.846 524 H GLU 61 H GLU 61 6.572 0.202 7.713 525 HA GLU 61 HA GLU 61 8.158 2.339 9.085 526 HB2 GLU 61 HB2 GLU 61 6.912 -0.157 10.283 527 HB3 GLU 61 HB3 GLU 61 7.873 1.056 11.130 528 HG2 GLU 61 HG2 GLU 61 6.114 2.770 10.489 529 HG3 GLU 61 HG3 GLU 61 5.109 1.428 9.920 530 H ASP 62 H ASP 62 10.275 1.780 9.912 531 HA ASP 62 HA ASP 62 11.746 -0.136 8.373 532 HB2 ASP 62 HB2 ASP 62 12.726 1.948 9.139 533 HB3 ASP 62 HB3 ASP 62 12.369 1.553 10.823 534 H LYS 63 H LYS 63 12.352 -2.170 8.863 535 HA LYS 63 HA LYS 63 10.717 -3.712 10.588 536 HB2 LYS 63 HB2 LYS 63 12.498 -4.170 8.468 537 HB3 LYS 63 HB3 LYS 63 13.281 -4.991 9.803 538 HG2 LYS 63 HG2 LYS 63 11.229 -6.278 10.267 539 HG3 LYS 63 HG3 LYS 63 10.364 -5.411 8.993 540 HD2 LYS 63 HD2 LYS 63 12.765 -7.249 8.582 541 HD3 LYS 63 HD3 LYS 63 11.072 -7.656 8.255 542 HE2 LYS 63 HE2 LYS 63 10.950 -5.843 6.568 543 HE3 LYS 63 HE3 LYS 63 12.651 -5.439 6.872 544 HZ1 LYS 63 HZ1 LYS 63 13.134 -7.803 6.170 545 HZ2 LYS 63 HZ2 LYS 63 11.573 -7.891 5.632 546 HZ3 LYS 63 HZ3 LYS 63 12.611 -6.802 4.985 547 H VAL 64 H VAL 64 13.476 -1.916 11.470 548 HA VAL 64 HA VAL 64 14.185 -3.700 13.754 549 HB VAL 64 HB VAL 64 15.931 -1.457 12.714 550 HG11 VAL 64 HG11 VAL 64 16.534 -2.585 14.818 551 HG12 VAL 64 HG12 VAL 64 16.544 -4.155 13.981 552 HG13 VAL 64 HG13 VAL 64 17.726 -2.897 13.551 553 HG21 VAL 64 HG21 VAL 64 15.500 -2.669 10.667 554 HG22 VAL 64 HG22 VAL 64 17.116 -3.072 11.240 555 HG23 VAL 64 HG23 VAL 64 15.787 -4.233 11.477 556 H SER 65 H SER 65 13.505 -0.328 12.825 557 HA SER 65 HA SER 65 13.402 0.367 15.731 558 HB2 SER 65 HB2 SER 65 14.384 2.016 13.378 559 HB3 SER 65 HB3 SER 65 14.268 2.593 15.053 560 HG SER 65 HG SER 65 16.376 1.829 14.522 561 H GLY 66 H GLY 66 11.319 0.082 13.126 562 HA2 GLY 66 HA2 GLY 66 9.135 0.707 12.893 563 HA3 GLY 66 HA3 GLY 66 9.199 1.474 14.479 564 H GLU 67 H GLU 67 11.555 2.694 12.261 565 HA GLU 67 HA GLU 67 10.384 5.343 12.362 566 HB2 GLU 67 HB2 GLU 67 12.764 4.302 10.773 567 HB3 GLU 67 HB3 GLU 67 12.312 6.001 10.966 568 HG2 GLU 67 HG2 GLU 67 12.559 5.738 13.458 569 HG3 GLU 67 HG3 GLU 67 13.156 4.098 13.192 570 H LEU 68 H LEU 68 9.358 6.573 10.769 571 HA LEU 68 HA LEU 68 7.821 5.064 8.894 572 HB2 LEU 68 HB2 LEU 68 7.075 7.134 10.135 573 HB3 LEU 68 HB3 LEU 68 8.127 8.082 9.086 574 HG LEU 68 HG LEU 68 6.783 7.127 7.098 575 HD11 LEU 68 HD11 LEU 68 5.664 5.250 8.297 576 HD12 LEU 68 HD12 LEU 68 4.839 6.419 9.347 577 HD13 LEU 68 HD13 LEU 68 4.492 6.374 7.606 578 HD21 LEU 68 HD21 LEU 68 6.498 9.427 7.931 579 HD22 LEU 68 HD22 LEU 68 4.959 8.734 7.399 580 HD23 LEU 68 HD23 LEU 68 5.321 8.855 9.135 581 H PHE 69 H PHE 69 8.332 4.382 6.958 582 HA PHE 69 HA PHE 69 10.469 5.559 5.272 583 HB2 PHE 69 HB2 PHE 69 10.381 3.188 5.332 584 HB3 PHE 69 HB3 PHE 69 8.642 3.156 5.090 585 HD1 PHE 69 HD1 PHE 69 8.099 2.174 3.061 586 HD2 PHE 69 HD2 PHE 69 11.494 4.819 3.226 587 HE1 PHE 69 HE1 PHE 69 8.434 1.890 0.631 588 HE2 PHE 69 HE2 PHE 69 11.806 4.565 0.792 589 HZ PHE 69 HZ PHE 69 10.252 3.110 -0.538 590 H ALA 70 H ALA 70 6.924 4.988 5.033 591 HA ALA 70 HA ALA 70 6.521 7.508 3.620 592 HB1 ALA 70 HB1 ALA 70 5.939 4.865 2.201 593 HB2 ALA 70 HB2 ALA 70 5.558 6.496 1.612 594 HB3 ALA 70 HB3 ALA 70 7.247 5.993 1.772 595 H GLN 71 H GLN 71 4.215 7.912 3.167 596 HA GLN 71 HA GLN 71 2.272 6.119 4.405 597 HB2 GLN 71 HB2 GLN 71 1.159 7.896 5.698 598 HB3 GLN 71 HB3 GLN 71 2.757 7.458 6.295 599 HG2 GLN 71 HG2 GLN 71 3.698 9.502 5.158 600 HG3 GLN 71 HG3 GLN 71 2.055 9.969 4.712 601 HE21 GLN 71 HE21 GLN 71 3.010 11.735 7.880 602 HE22 GLN 71 HE22 GLN 71 3.652 11.695 6.245 603 H ALA 72 H ALA 72 0.374 6.015 3.375 604 HA ALA 72 HA ALA 72 -0.247 7.995 1.224 605 HB1 ALA 72 HB1 ALA 72 -0.695 4.996 1.271 606 HB2 ALA 72 HB2 ALA 72 -1.325 6.088 0.040 607 HB3 ALA 72 HB3 ALA 72 0.422 5.897 0.225 608 HA PRO 73 HA PRO 73 -4.090 8.076 3.765 609 HB2 PRO 73 HB2 PRO 73 -5.136 10.427 2.915 610 HB3 PRO 73 HB3 PRO 73 -3.706 10.353 3.988 611 HG2 PRO 73 HG2 PRO 73 -3.754 10.759 0.987 612 HG3 PRO 73 HG3 PRO 73 -2.814 11.656 2.217 613 HD2 PRO 73 HD2 PRO 73 -1.799 9.556 0.728 614 HD3 PRO 73 HD3 PRO 73 -1.221 9.958 2.373 615 H VAL 74 H VAL 74 -5.828 6.882 3.271 616 HA VAL 74 HA VAL 74 -6.873 6.747 0.469 617 HB VAL 74 HB VAL 74 -6.944 4.591 2.607 618 HG11 VAL 74 HG11 VAL 74 -7.757 4.494 -0.314 619 HG12 VAL 74 HG12 VAL 74 -7.752 3.126 0.824 620 HG13 VAL 74 HG13 VAL 74 -8.863 4.460 1.075 621 HG21 VAL 74 HG21 VAL 74 -5.374 3.306 1.387 622 HG22 VAL 74 HG22 VAL 74 -5.268 4.505 0.100 623 HG23 VAL 74 HG23 VAL 74 -4.634 4.875 1.717 624 H GLU 75 H GLU 75 -8.796 7.602 0.199 625 HA GLU 75 HA GLU 75 -10.781 7.646 2.442 626 HB2 GLU 75 HB2 GLU 75 -9.610 9.791 1.818 627 HB3 GLU 75 HB3 GLU 75 -10.416 9.741 0.266 628 HG2 GLU 75 HG2 GLU 75 -11.993 9.609 2.868 629 HG3 GLU 75 HG3 GLU 75 -11.316 11.140 2.336 630 H GLN 76 H GLN 76 -10.195 6.008 -0.296 631 HA GLN 76 HA GLN 76 -12.884 5.104 -0.473 632 HB2 GLN 76 HB2 GLN 76 -13.372 5.471 -2.756 633 HB3 GLN 76 HB3 GLN 76 -12.965 7.040 -2.095 634 HG2 GLN 76 HG2 GLN 76 -11.184 5.313 -3.867 635 HG3 GLN 76 HG3 GLN 76 -12.099 6.717 -4.365 636 HE21 GLN 76 HE21 GLN 76 -8.485 7.275 -2.553 637 HE22 GLN 76 HE22 GLN 76 -9.242 5.668 -2.510 638 H TYR 77 H TYR 77 -12.943 2.981 -1.256 639 HA TYR 77 HA TYR 77 -10.406 1.836 -2.273 640 HB2 TYR 77 HB2 TYR 77 -10.547 1.387 0.112 641 HB3 TYR 77 HB3 TYR 77 -12.080 0.507 -0.132 642 HD1 TYR 77 HD1 TYR 77 -12.002 -1.759 -1.294 643 HD2 TYR 77 HD2 TYR 77 -8.517 0.665 -0.696 644 HE1 TYR 77 HE1 TYR 77 -10.572 -3.588 -2.207 645 HE2 TYR 77 HE2 TYR 77 -7.066 -1.151 -1.595 646 HH TYR 77 HH TYR 77 -8.472 -4.189 -2.894 647 HA PRO 78 HA PRO 78 -9.548 0.548 -3.725 648 HB2 PRO 78 HB2 PRO 78 -9.400 0.137 -6.400 649 HB3 PRO 78 HB3 PRO 78 -9.637 -1.200 -5.233 650 HG2 PRO 78 HG2 PRO 78 -11.766 0.265 -6.833 651 HG3 PRO 78 HG3 PRO 78 -11.519 -1.506 -6.689 652 HD2 PRO 78 HD2 PRO 78 -13.325 -0.183 -5.139 653 HD3 PRO 78 HD3 PRO 78 -12.361 -1.537 -4.480 654 H GLY 79 H GLY 79 -8.233 2.164 -4.959 655 HA2 GLY 79 HA2 GLY 79 -9.580 4.337 -6.393 656 HA3 GLY 79 HA3 GLY 79 -9.063 4.775 -4.765 657 H ILE 80 H ILE 80 -7.675 6.368 -5.731 658 HA ILE 80 HA ILE 80 -5.378 5.430 -7.311 659 HB ILE 80 HB ILE 80 -6.508 7.560 -7.805 660 HG12 ILE 80 HG12 ILE 80 -4.557 8.992 -8.103 661 HG13 ILE 80 HG13 ILE 80 -3.627 8.040 -6.951 662 HG21 ILE 80 HG21 ILE 80 -7.060 8.332 -5.510 663 HG22 ILE 80 HG22 ILE 80 -5.329 8.613 -5.195 664 HG23 ILE 80 HG23 ILE 80 -6.178 9.556 -6.427 665 HD11 ILE 80 HD11 ILE 80 -3.099 7.571 -9.359 666 HD12 ILE 80 HD12 ILE 80 -3.612 6.128 -8.476 667 HD13 ILE 80 HD13 ILE 80 -4.748 6.953 -9.576 668 H ALA 81 H ALA 81 -6.148 6.110 -3.953 669 HA ALA 81 HA ALA 81 -3.370 6.262 -3.172 670 HB1 ALA 81 HB1 ALA 81 -5.857 6.043 -1.475 671 HB2 ALA 81 HB2 ALA 81 -4.184 6.325 -0.904 672 HB3 ALA 81 HB3 ALA 81 -4.993 7.536 -1.931 673 H VAL 82 H VAL 82 -5.757 3.573 -3.298 674 HA VAL 82 HA VAL 82 -3.420 1.748 -3.092 675 HB VAL 82 HB VAL 82 -4.300 1.888 -0.863 676 HG11 VAL 82 HG11 VAL 82 -6.964 1.181 -1.990 677 HG12 VAL 82 HG12 VAL 82 -6.505 1.303 -0.257 678 HG13 VAL 82 HG13 VAL 82 -6.504 2.725 -1.275 679 HG21 VAL 82 HG21 VAL 82 -3.443 -0.241 -1.744 680 HG22 VAL 82 HG22 VAL 82 -4.695 -0.481 -0.523 681 HG23 VAL 82 HG23 VAL 82 -5.066 -0.708 -2.248 682 H GLU 83 H GLU 83 -3.470 0.343 -4.724 683 HA GLU 83 HA GLU 83 -6.000 -0.497 -6.040 684 HB2 GLU 83 HB2 GLU 83 -4.282 1.531 -7.049 685 HB3 GLU 83 HB3 GLU 83 -3.842 0.094 -7.960 686 HG2 GLU 83 HG2 GLU 83 -6.704 1.096 -7.633 687 HG3 GLU 83 HG3 GLU 83 -5.639 1.579 -8.953 688 H THR 84 H THR 84 -5.817 -2.366 -7.416 689 HA THR 84 HA THR 84 -3.524 -4.159 -6.684 690 HB THR 84 HB THR 84 -6.143 -5.147 -7.684 691 HG1 THR 84 HG1 THR 84 -6.817 -5.432 -5.567 692 HG21 THR 84 HG21 THR 84 -3.908 -6.331 -6.029 693 HG22 THR 84 HG22 THR 84 -5.425 -7.177 -6.432 694 HG23 THR 84 HG23 THR 84 -4.315 -6.690 -7.723 695 H VAL 85 H VAL 85 -2.467 -3.106 -8.256 696 HA VAL 85 HA VAL 85 -1.486 -2.938 -10.406 697 HB VAL 85 HB VAL 85 -0.551 -5.340 -10.731 698 HG11 VAL 85 HG11 VAL 85 0.577 -3.410 -9.662 699 HG12 VAL 85 HG12 VAL 85 -0.192 -3.800 -8.112 700 HG13 VAL 85 HG13 VAL 85 0.976 -4.914 -8.839 701 HG21 VAL 85 HG21 VAL 85 -2.366 -6.493 -9.343 702 HG22 VAL 85 HG22 VAL 85 -0.697 -6.840 -8.886 703 HG23 VAL 85 HG23 VAL 85 -1.664 -5.713 -7.928 704 H THR 86 H THR 86 -3.203 -5.989 -10.825 705 HA THR 86 HA THR 86 -4.825 -4.821 -12.896 706 HB THR 86 HB THR 86 -4.663 -6.907 -14.370 707 HG1 THR 86 HG1 THR 86 -2.848 -8.110 -14.239 708 HG21 THR 86 HG21 THR 86 -2.137 -5.248 -14.250 709 HG22 THR 86 HG22 THR 86 -2.839 -6.032 -15.687 710 HG23 THR 86 HG23 THR 86 -3.658 -4.640 -14.925 711 H ASP 87 H ASP 87 -3.978 -7.868 -11.267 712 HA ASP 87 HA ASP 87 -6.791 -8.094 -10.301 713 HB2 ASP 87 HB2 ASP 87 -6.554 -9.235 -12.605 714 HB3 ASP 87 HB3 ASP 87 -5.539 -10.410 -11.770 715 H SER 88 H SER 88 -3.845 -10.182 -10.459 716 HA SER 88 HA SER 88 -4.205 -11.408 -7.987 717 HB2 SER 88 HB2 SER 88 -2.360 -11.953 -9.587 718 HB3 SER 88 HB3 SER 88 -1.406 -10.658 -8.857 719 HG SER 88 HG SER 88 -1.684 -13.078 -8.093 720 H SER 89 H SER 89 -3.896 -11.000 -5.981 721 HA SER 89 HA SER 89 -3.249 -8.260 -5.122 722 HB2 SER 89 HB2 SER 89 -4.578 -8.881 -3.198 723 HB3 SER 89 HB3 SER 89 -5.379 -9.158 -4.775 724 HG SER 89 HG SER 89 -5.589 -10.912 -3.186 725 H ARG 90 H ARG 90 -1.450 -10.858 -5.609 726 HA ARG 90 HA ARG 90 0.324 -10.997 -3.335 727 HB2 ARG 90 HB2 ARG 90 0.107 -12.525 -5.344 728 HB3 ARG 90 HB3 ARG 90 0.870 -11.266 -6.328 729 HG2 ARG 90 HG2 ARG 90 2.896 -11.436 -4.774 730 HG3 ARG 90 HG3 ARG 90 2.105 -12.832 -4.023 731 HD2 ARG 90 HD2 ARG 90 2.965 -12.552 -6.941 732 HD3 ARG 90 HD3 ARG 90 3.768 -13.515 -5.710 733 HE ARG 90 HE ARG 90 1.941 -15.078 -5.698 734 HH11 ARG 90 HH11 ARG 90 0.213 -16.143 -6.762 735 HH12 ARG 90 HH12 ARG 90 -0.486 -15.317 -8.164 736 HH21 ARG 90 HH21 ARG 90 1.690 -12.858 -8.454 737 HH22 ARG 90 HH22 ARG 90 0.219 -13.699 -8.988 738 H TYR 91 H TYR 91 -0.210 -8.568 -5.758 739 HA TYR 91 HA TYR 91 1.823 -6.812 -4.486 740 HB2 TYR 91 HB2 TYR 91 1.046 -6.638 -7.398 741 HB3 TYR 91 HB3 TYR 91 2.380 -5.824 -6.611 742 HD1 TYR 91 HD1 TYR 91 4.332 -7.314 -5.730 743 HD2 TYR 91 HD2 TYR 91 1.306 -8.636 -8.492 744 HE1 TYR 91 HE1 TYR 91 5.743 -9.293 -6.351 745 HE2 TYR 91 HE2 TYR 91 2.717 -10.510 -9.217 746 HH TYR 91 HH TYR 91 4.669 -11.722 -8.731 747 H PHE 92 H PHE 92 1.386 -4.543 -4.752 748 HA PHE 92 HA PHE 92 -1.325 -3.661 -5.542 749 HB2 PHE 92 HB2 PHE 92 -0.135 -3.004 -2.817 750 HB3 PHE 92 HB3 PHE 92 -1.611 -2.322 -3.488 751 HD1 PHE 92 HD1 PHE 92 -3.533 -3.950 -4.129 752 HD2 PHE 92 HD2 PHE 92 -0.230 -5.006 -1.562 753 HE1 PHE 92 HE1 PHE 92 -4.814 -5.903 -3.293 754 HE2 PHE 92 HE2 PHE 92 -1.554 -6.902 -0.662 755 HZ PHE 92 HZ PHE 92 -3.805 -7.402 -1.575 756 H VAL 93 H VAL 93 -1.404 -1.246 -5.533 757 HA VAL 93 HA VAL 93 1.237 0.118 -5.573 758 HB VAL 93 HB VAL 93 -1.008 0.571 -7.576 759 HG11 VAL 93 HG11 VAL 93 1.500 2.216 -7.030 760 HG12 VAL 93 HG12 VAL 93 0.507 2.347 -8.490 761 HG13 VAL 93 HG13 VAL 93 -0.192 2.762 -6.932 762 HG21 VAL 93 HG21 VAL 93 0.836 0.139 -9.220 763 HG22 VAL 93 HG22 VAL 93 1.908 -0.278 -7.877 764 HG23 VAL 93 HG23 VAL 93 0.472 -1.266 -8.212 765 H ILE 94 H ILE 94 1.267 1.980 -4.366 766 HA ILE 94 HA ILE 94 -1.336 3.128 -3.566 767 HB ILE 94 HB ILE 94 -0.675 3.528 -1.277 768 HG12 ILE 94 HG12 ILE 94 1.875 1.934 -1.830 769 HG13 ILE 94 HG13 ILE 94 1.819 3.687 -1.733 770 HG21 ILE 94 HG21 ILE 94 -0.186 0.572 -1.877 771 HG22 ILE 94 HG22 ILE 94 -0.828 1.291 -0.388 772 HG23 ILE 94 HG23 ILE 94 -1.774 1.356 -1.859 773 HD11 ILE 94 HD11 ILE 94 1.136 1.773 0.514 774 HD12 ILE 94 HD12 ILE 94 2.549 2.833 0.405 775 HD13 ILE 94 HD13 ILE 94 0.926 3.526 0.589 776 H ARG 95 H ARG 95 -1.393 5.322 -3.187 777 HA ARG 95 HA ARG 95 0.859 6.920 -4.358 778 HB2 ARG 95 HB2 ARG 95 -1.304 7.213 -5.432 779 HB3 ARG 95 HB3 ARG 95 -2.053 7.672 -3.919 780 HG2 ARG 95 HG2 ARG 95 0.255 9.277 -5.082 781 HG3 ARG 95 HG3 ARG 95 -1.425 9.518 -5.576 782 HD2 ARG 95 HD2 ARG 95 -2.011 9.809 -3.103 783 HD3 ARG 95 HD3 ARG 95 -0.277 9.893 -2.800 784 HE ARG 95 HE ARG 95 -0.187 12.027 -3.593 785 HH11 ARG 95 HH11 ARG 95 -0.845 13.900 -4.298 786 HH12 ARG 95 HH12 ARG 95 -2.442 14.126 -4.986 787 HH21 ARG 95 HH21 ARG 95 -3.323 10.810 -4.619 788 HH22 ARG 95 HH22 ARG 95 -3.821 12.386 -5.167 789 H ILE 96 H ILE 96 2.277 7.342 -2.861 790 HA ILE 96 HA ILE 96 1.493 8.031 -0.079 791 HB ILE 96 HB ILE 96 3.912 7.960 0.392 792 HG12 ILE 96 HG12 ILE 96 4.320 6.786 -2.386 793 HG13 ILE 96 HG13 ILE 96 4.599 8.497 -2.030 794 HG21 ILE 96 HG21 ILE 96 2.743 5.461 -0.880 795 HG22 ILE 96 HG22 ILE 96 4.144 5.467 0.185 796 HG23 ILE 96 HG23 ILE 96 2.585 5.977 0.815 797 HD11 ILE 96 HD11 ILE 96 6.049 6.160 -0.770 798 HD12 ILE 96 HD12 ILE 96 6.690 7.343 -1.925 799 HD13 ILE 96 HD13 ILE 96 6.232 7.868 -0.287 800 H GLN 97 H GLN 97 2.540 9.892 0.943 801 HA GLN 97 HA GLN 97 3.367 12.045 -0.956 802 HB2 GLN 97 HB2 GLN 97 2.619 12.195 1.969 803 HB3 GLN 97 HB3 GLN 97 3.624 13.408 1.173 804 HG2 GLN 97 HG2 GLN 97 1.685 13.369 -0.667 805 HG3 GLN 97 HG3 GLN 97 0.720 12.768 0.688 806 HE21 GLN 97 HE21 GLN 97 2.222 16.627 0.693 807 HE22 GLN 97 HE22 GLN 97 2.998 15.372 -0.286 808 H ASP 98 H ASP 98 5.423 12.872 -0.967 809 HA ASP 98 HA ASP 98 7.499 11.032 0.065 810 HB2 ASP 98 HB2 ASP 98 7.457 11.989 -2.275 811 HB3 ASP 98 HB3 ASP 98 7.810 13.560 -1.552 812 H GLY 99 H GLY 99 5.825 13.544 1.390 813 HA2 GLY 99 HA2 GLY 99 6.046 14.446 3.519 814 HA3 GLY 99 HA3 GLY 99 7.674 13.780 3.638 815 H THR 100 H THR 100 7.519 15.574 0.808 816 HA THR 100 HA THR 100 8.683 18.014 2.093 817 HB THR 100 HB THR 100 9.986 18.298 0.043 818 HG1 THR 100 HG1 THR 100 9.958 16.665 -1.488 819 HG21 THR 100 HG21 THR 100 10.287 15.443 1.064 820 HG22 THR 100 HG22 THR 100 11.524 16.451 0.288 821 HG23 THR 100 HG23 THR 100 10.917 16.886 1.897 822 H GLY 101 H GLY 101 5.786 17.353 1.194 823 HA2 GLY 101 HA2 GLY 101 4.047 18.875 0.661 824 HA3 GLY 101 HA3 GLY 101 5.192 19.939 -0.154 825 H ARG 102 H ARG 102 5.531 16.611 -0.963 826 HA ARG 102 HA ARG 102 3.923 16.857 -3.467 827 HB2 ARG 102 HB2 ARG 102 5.741 16.239 -4.815 828 HB3 ARG 102 HB3 ARG 102 6.347 17.494 -3.720 829 HG2 ARG 102 HG2 ARG 102 7.340 15.663 -2.310 830 HG3 ARG 102 HG3 ARG 102 6.884 14.504 -3.577 831 HD2 ARG 102 HD2 ARG 102 8.212 15.751 -5.230 832 HD3 ARG 102 HD3 ARG 102 8.657 16.948 -3.996 833 HE ARG 102 HE ARG 102 9.474 14.471 -2.953 834 HH11 ARG 102 HH11 ARG 102 11.392 13.687 -3.028 835 HH12 ARG 102 HH12 ARG 102 12.589 14.193 -4.225 836 HH21 ARG 102 HH21 ARG 102 10.386 16.384 -5.760 837 HH22 ARG 102 HH22 ARG 102 11.996 15.715 -5.768 838 H SER 103 H SER 103 3.972 14.760 -4.719 839 HA SER 103 HA SER 103 3.354 12.461 -2.911 840 HB2 SER 103 HB2 SER 103 1.929 13.352 -5.444 841 HB3 SER 103 HB3 SER 103 1.603 11.850 -4.568 842 HG SER 103 HG SER 103 1.405 14.471 -3.451 843 H ALA 104 H ALA 104 3.518 10.337 -3.810 844 HA ALA 104 HA ALA 104 4.806 9.948 -6.422 845 HB1 ALA 104 HB1 ALA 104 6.108 8.957 -3.850 846 HB2 ALA 104 HB2 ALA 104 6.614 8.542 -5.501 847 HB3 ALA 104 HB3 ALA 104 6.753 10.215 -4.926 848 H PHE 105 H PHE 105 4.448 7.935 -7.328 849 HA PHE 105 HA PHE 105 2.581 6.115 -5.893 850 HB2 PHE 105 HB2 PHE 105 3.480 5.999 -8.782 851 HB3 PHE 105 HB3 PHE 105 2.185 5.083 -8.020 852 HD1 PHE 105 HD1 PHE 105 0.153 6.372 -7.080 853 HD2 PHE 105 HD2 PHE 105 3.076 8.173 -9.692 854 HE1 PHE 105 HE1 PHE 105 -1.433 8.203 -7.607 855 HE2 PHE 105 HE2 PHE 105 1.506 10.024 -10.174 856 HZ PHE 105 HZ PHE 105 -0.777 10.032 -9.142 857 H ILE 106 H ILE 106 3.221 4.231 -5.081 858 HA ILE 106 HA ILE 106 5.737 2.983 -6.086 859 HB ILE 106 HB ILE 106 6.171 2.044 -3.846 860 HG12 ILE 106 HG12 ILE 106 4.384 4.294 -2.783 861 HG13 ILE 106 HG13 ILE 106 3.893 2.606 -2.851 862 HG21 ILE 106 HG21 ILE 106 7.445 3.956 -4.868 863 HG22 ILE 106 HG22 ILE 106 6.399 5.088 -3.993 864 HG23 ILE 106 HG23 ILE 106 7.464 3.979 -3.105 865 HD11 ILE 106 HD11 ILE 106 6.239 3.641 -1.219 866 HD12 ILE 106 HD12 ILE 106 4.640 3.196 -0.611 867 HD13 ILE 106 HD13 ILE 106 5.673 1.952 -1.320 868 H GLY 107 H GLY 107 5.784 0.897 -6.411 869 HA2 GLY 107 HA2 GLY 107 3.320 -0.715 -6.157 870 HA3 GLY 107 HA3 GLY 107 4.770 -1.150 -7.058 871 H ILE 108 H ILE 108 3.126 -2.342 -4.751 872 HA ILE 108 HA ILE 108 5.341 -2.871 -2.835 873 HB ILE 108 HB ILE 108 2.386 -3.308 -2.275 874 HG12 ILE 108 HG12 ILE 108 4.108 -0.846 -1.760 875 HG13 ILE 108 HG13 ILE 108 2.571 -0.938 -2.616 876 HG21 ILE 108 HG21 ILE 108 4.826 -3.160 -0.471 877 HG22 ILE 108 HG22 ILE 108 3.153 -3.482 0.054 878 HG23 ILE 108 HG23 ILE 108 3.976 -4.650 -0.947 879 HD11 ILE 108 HD11 ILE 108 2.179 0.057 -0.488 880 HD12 ILE 108 HD12 ILE 108 1.457 -1.564 -0.442 881 HD13 ILE 108 HD13 ILE 108 3.013 -1.227 0.376 882 H GLY 109 H GLY 109 5.818 -5.055 -2.405 883 HA2 GLY 109 HA2 GLY 109 4.044 -7.200 -3.427 884 HA3 GLY 109 HA3 GLY 109 5.768 -7.320 -3.776 885 H PHE 110 H PHE 110 3.768 -8.808 -2.028 886 HA PHE 110 HA PHE 110 4.795 -8.379 0.704 887 HB2 PHE 110 HB2 PHE 110 2.407 -9.582 -0.589 888 HB3 PHE 110 HB3 PHE 110 2.869 -10.258 0.959 889 HD1 PHE 110 HD1 PHE 110 1.953 -7.041 -0.716 890 HD2 PHE 110 HD2 PHE 110 2.564 -9.123 3.013 891 HE1 PHE 110 HE1 PHE 110 0.946 -5.130 0.527 892 HE2 PHE 110 HE2 PHE 110 1.449 -7.283 4.231 893 HZ PHE 110 HZ PHE 110 0.717 -5.242 2.984 894 H THR 111 H THR 111 5.146 -10.064 2.191 895 HA THR 111 HA THR 111 7.096 -12.006 1.344 896 HB THR 111 HB THR 111 6.944 -10.741 3.534 897 HG1 THR 111 HG1 THR 111 8.382 -12.050 3.996 898 HG21 THR 111 HG21 THR 111 5.110 -13.024 4.354 899 HG22 THR 111 HG22 THR 111 5.782 -11.766 5.400 900 HG23 THR 111 HG23 THR 111 4.609 -11.327 4.150 901 H ASP 112 H ASP 112 3.642 -12.127 1.928 902 HA ASP 112 HA ASP 112 3.482 -14.804 0.725 903 HB2 ASP 112 HB2 ASP 112 3.529 -14.959 3.330 904 HB3 ASP 112 HB3 ASP 112 1.930 -14.201 3.272 905 H ARG 113 H ARG 113 1.599 -15.048 -0.523 906 HA ARG 113 HA ARG 113 0.129 -12.659 -1.206 907 HB2 ARG 113 HB2 ARG 113 0.737 -14.674 -2.661 908 HB3 ARG 113 HB3 ARG 113 -0.629 -15.520 -1.946 909 HG2 ARG 113 HG2 ARG 113 -1.026 -12.777 -3.184 910 HG3 ARG 113 HG3 ARG 113 -0.784 -14.184 -4.234 911 HD2 ARG 113 HD2 ARG 113 -2.701 -15.288 -3.300 912 HD3 ARG 113 HD3 ARG 113 -2.963 -13.956 -2.161 913 HE ARG 113 HE ARG 113 -3.907 -12.657 -3.835 914 HH11 ARG 113 HH11 ARG 113 -5.088 -12.519 -5.787 915 HH12 ARG 113 HH12 ARG 113 -4.454 -13.484 -7.153 916 HH21 ARG 113 HH21 ARG 113 -2.386 -15.415 -5.488 917 HH22 ARG 113 HH22 ARG 113 -3.230 -14.961 -6.980 918 H GLY 114 H GLY 114 -0.482 -15.194 1.148 919 HA2 GLY 114 HA2 GLY 114 -3.247 -14.466 1.730 920 HA3 GLY 114 HA3 GLY 114 -2.151 -15.442 2.716 921 H ASP 115 H ASP 115 -0.043 -13.317 2.852 922 HA ASP 115 HA ASP 115 -1.172 -11.616 4.964 923 HB2 ASP 115 HB2 ASP 115 1.581 -11.764 3.719 924 HB3 ASP 115 HB3 ASP 115 1.112 -10.556 4.909 925 H ALA 116 H ALA 116 -0.303 -11.244 1.553 926 HA ALA 116 HA ALA 116 -0.921 -8.451 1.373 927 HB1 ALA 116 HB1 ALA 116 -1.199 -10.413 -0.899 928 HB2 ALA 116 HB2 ALA 116 -0.539 -8.756 -0.887 929 HB3 ALA 116 HB3 ALA 116 0.384 -10.099 -0.198 930 H PHE 117 H PHE 117 -2.957 -11.394 0.840 931 HA PHE 117 HA PHE 117 -5.331 -10.083 0.065 932 HB2 PHE 117 HB2 PHE 117 -4.906 -12.512 -0.005 933 HB3 PHE 117 HB3 PHE 117 -4.985 -12.580 1.748 934 HD1 PHE 117 HD1 PHE 117 -7.043 -13.087 2.784 935 HD2 PHE 117 HD2 PHE 117 -7.066 -11.548 -1.252 936 HE1 PHE 117 HE1 PHE 117 -9.452 -13.650 2.569 937 HE2 PHE 117 HE2 PHE 117 -9.444 -12.130 -1.468 938 HZ PHE 117 HZ PHE 117 -10.655 -13.192 0.439 939 H ASP 118 H ASP 118 -3.846 -10.310 3.249 940 HA ASP 118 HA ASP 118 -6.187 -9.280 4.668 941 HB2 ASP 118 HB2 ASP 118 -4.438 -10.989 5.496 942 HB3 ASP 118 HB3 ASP 118 -3.371 -9.608 5.728 943 H PHE 119 H PHE 119 -3.379 -7.908 3.058 944 HA PHE 119 HA PHE 119 -3.577 -5.246 4.205 945 HB2 PHE 119 HB2 PHE 119 -1.550 -5.792 3.119 946 HB3 PHE 119 HB3 PHE 119 -2.332 -6.363 1.674 947 HD1 PHE 119 HD1 PHE 119 -0.782 -3.529 3.190 948 HD2 PHE 119 HD2 PHE 119 -3.492 -4.726 0.096 949 HE1 PHE 119 HE1 PHE 119 -0.628 -1.286 2.211 950 HE2 PHE 119 HE2 PHE 119 -3.283 -2.459 -0.954 951 HZ PHE 119 HZ PHE 119 -1.870 -0.738 0.125 952 H ASN 120 H ASN 120 -5.137 -6.932 1.435 953 HA ASN 120 HA ASN 120 -6.633 -4.490 0.792 954 HB2 ASN 120 HB2 ASN 120 -7.265 -5.434 -1.113 955 HB3 ASN 120 HB3 ASN 120 -5.688 -6.178 -0.853 956 HD21 ASN 120 HD21 ASN 120 -9.113 -8.387 -1.055 957 HD22 ASN 120 HD22 ASN 120 -9.210 -6.708 -0.578 958 H VAL 121 H VAL 121 -7.525 -7.593 2.386 959 HA VAL 121 HA VAL 121 -10.296 -6.866 2.390 960 HB VAL 121 HB VAL 121 -8.733 -8.952 3.922 961 HG11 VAL 121 HG11 VAL 121 -11.756 -8.550 3.952 962 HG12 VAL 121 HG12 VAL 121 -10.915 -10.011 4.515 963 HG13 VAL 121 HG13 VAL 121 -10.662 -8.482 5.354 964 HG21 VAL 121 HG21 VAL 121 -9.054 -9.301 1.464 965 HG22 VAL 121 HG22 VAL 121 -9.920 -10.507 2.412 966 HG23 VAL 121 HG23 VAL 121 -10.805 -9.151 1.679 967 H SER 122 H SER 122 -7.726 -6.143 4.728 968 HA SER 122 HA SER 122 -9.438 -5.039 6.762 969 HB2 SER 122 HB2 SER 122 -7.426 -3.662 7.370 970 HB3 SER 122 HB3 SER 122 -7.158 -5.416 7.340 971 HG SER 122 HG SER 122 -5.940 -5.233 5.596 972 H LEU 123 H LEU 123 -8.446 -3.778 3.614 973 HA LEU 123 HA LEU 123 -9.594 -1.114 4.164 974 HB2 LEU 123 HB2 LEU 123 -8.446 -2.367 1.654 975 HB3 LEU 123 HB3 LEU 123 -9.016 -0.708 1.772 976 HG LEU 123 HG LEU 123 -6.848 -1.739 3.644 977 HD11 LEU 123 HD11 LEU 123 -5.190 -0.897 2.077 978 HD12 LEU 123 HD12 LEU 123 -6.149 -2.158 1.312 979 HD13 LEU 123 HD13 LEU 123 -6.484 -0.469 0.924 980 HD21 LEU 123 HD21 LEU 123 -7.941 0.413 4.230 981 HD22 LEU 123 HD22 LEU 123 -6.247 0.624 3.785 982 HD23 LEU 123 HD23 LEU 123 -7.523 1.052 2.625 983 H GLN 124 H GLN 124 -10.492 -4.004 2.191 984 HA GLN 124 HA GLN 124 -12.935 -3.039 1.140 985 HB2 GLN 124 HB2 GLN 124 -12.188 -5.814 2.142 986 HB3 GLN 124 HB3 GLN 124 -13.687 -5.478 1.303 987 HG2 GLN 124 HG2 GLN 124 -10.987 -4.902 0.026 988 HG3 GLN 124 HG3 GLN 124 -11.776 -6.472 -0.053 989 HE21 GLN 124 HE21 GLN 124 -13.050 -5.180 -3.127 990 HE22 GLN 124 HE22 GLN 124 -11.813 -6.226 -2.427 991 H ASP 125 H ASP 125 -12.432 -4.719 4.298 992 HA ASP 125 HA ASP 125 -15.165 -4.246 5.174 993 HB2 ASP 125 HB2 ASP 125 -13.629 -6.189 5.778 994 HB3 ASP 125 HB3 ASP 125 -12.710 -5.059 6.782 995 H HIS 126 H HIS 126 -12.559 -2.111 5.015 996 HA HIS 126 HA HIS 126 -13.409 -0.472 7.351 997 HB2 HIS 126 HB2 HIS 126 -11.044 -0.521 6.947 998 HB3 HIS 126 HB3 HIS 126 -11.263 -0.033 5.263 999 HD2 HIS 126 HD2 HIS 126 -11.765 1.401 8.851 1000 HE1 HIS 126 HE1 HIS 126 -11.034 4.667 6.215 1001 HE2 HIS 126 HE2 HIS 126 -11.273 3.977 8.651 1002 H PHE 127 H PHE 127 -13.538 -0.416 3.765 1003 HA PHE 127 HA PHE 127 -15.253 1.972 3.877 1004 HB2 PHE 127 HB2 PHE 127 -14.020 0.434 1.601 1005 HB3 PHE 127 HB3 PHE 127 -15.208 1.712 1.354 1006 HD1 PHE 127 HD1 PHE 127 -14.775 4.061 2.119 1007 HD2 PHE 127 HD2 PHE 127 -11.735 1.011 2.322 1008 HE1 PHE 127 HE1 PHE 127 -13.056 5.788 2.587 1009 HE2 PHE 127 HE2 PHE 127 -10.012 2.735 2.723 1010 HZ PHE 127 HZ PHE 127 -10.676 5.133 2.878 1011 H LYS 128 H LYS 128 -15.882 -1.459 3.808 1012 HA LYS 128 HA LYS 128 -18.298 -1.490 2.443 1013 HB2 LYS 128 HB2 LYS 128 -18.750 -3.593 3.304 1014 HB3 LYS 128 HB3 LYS 128 -17.019 -3.464 3.194 1015 HG2 LYS 128 HG2 LYS 128 -17.202 -4.485 5.221 1016 HG3 LYS 128 HG3 LYS 128 -17.200 -2.800 5.777 1017 HD2 LYS 128 HD2 LYS 128 -19.771 -2.998 5.698 1018 HD3 LYS 128 HD3 LYS 128 -19.527 -4.713 5.364 1019 HE2 LYS 128 HE2 LYS 128 -18.428 -3.308 7.828 1020 HE3 LYS 128 HE3 LYS 128 -20.059 -3.980 7.767 1021 HZ1 LYS 128 HZ1 LYS 128 -17.549 -5.538 7.421 1022 HZ2 LYS 128 HZ2 LYS 128 -18.542 -5.587 8.711 1023 HZ3 LYS 128 HZ3 LYS 128 -19.061 -6.163 7.274 1024 H TRP 129 H TRP 129 -17.873 -0.181 5.643 1025 HA TRP 129 HA TRP 129 -20.823 0.036 6.041 1026 HB2 TRP 129 HB2 TRP 129 -20.240 0.397 8.399 1027 HB3 TRP 129 HB3 TRP 129 -19.725 -1.151 7.766 1028 HD1 TRP 129 HD1 TRP 129 -17.117 -1.677 7.708 1029 HE1 TRP 129 HE1 TRP 129 -15.060 -0.526 8.600 1030 HE3 TRP 129 HE3 TRP 129 -19.225 2.777 9.009 1031 HZ2 TRP 129 HZ2 TRP 129 -14.353 2.055 9.763 1032 HZ3 TRP 129 HZ3 TRP 129 -17.828 4.601 10.002 1033 HH2 TRP 129 HH2 TRP 129 -15.393 4.257 10.347 1034 H VAL 130 H VAL 130 -18.686 1.902 4.546 1035 HA VAL 130 HA VAL 130 -20.001 4.460 5.290 1036 HB VAL 130 HB VAL 130 -17.427 5.333 4.826 1037 HG11 VAL 130 HG11 VAL 130 -18.851 4.729 7.441 1038 HG12 VAL 130 HG12 VAL 130 -17.435 5.780 7.292 1039 HG13 VAL 130 HG13 VAL 130 -18.955 6.224 6.492 1040 HG21 VAL 130 HG21 VAL 130 -15.886 4.238 6.247 1041 HG22 VAL 130 HG22 VAL 130 -17.062 2.987 6.675 1042 HG23 VAL 130 HG23 VAL 130 -16.464 3.112 5.015 1043 H LYS 131 H LYS 131 -18.551 6.102 3.525 1044 HA LYS 131 HA LYS 131 -18.851 6.980 1.529 1045 HB2 LYS 131 HB2 LYS 131 -17.313 4.779 1.132 1046 HB3 LYS 131 HB3 LYS 131 -18.671 4.346 0.102 1047 HG2 LYS 131 HG2 LYS 131 -17.164 5.462 -1.311 1048 HG3 LYS 131 HG3 LYS 131 -18.404 6.682 -0.954 1049 HD2 LYS 131 HD2 LYS 131 -16.920 7.690 0.757 1050 HD3 LYS 131 HD3 LYS 131 -15.691 6.450 0.415 1051 HE2 LYS 131 HE2 LYS 131 -15.634 7.213 -1.963 1052 HE3 LYS 131 HE3 LYS 131 -16.798 8.489 -1.577 1053 HZ1 LYS 131 HZ1 LYS 131 -15.105 9.412 -0.010 1054 HZ2 LYS 131 HZ2 LYS 131 -14.084 8.231 -0.380 1055 HZ3 LYS 131 HZ3 LYS 131 -14.504 9.329 -1.521 1056 H GLN 132 H GLN 132 -21.193 5.791 2.885 1057 HA GLN 132 HA GLN 132 -23.431 5.559 2.665 1058 HB2 GLN 132 HB2 GLN 132 -23.023 7.804 0.657 1059 HB3 GLN 132 HB3 GLN 132 -24.531 7.393 1.466 1060 HG2 GLN 132 HG2 GLN 132 -23.694 9.224 2.667 1061 HG3 GLN 132 HG3 GLN 132 -23.409 7.823 3.694 1062 HE21 GLN 132 HE21 GLN 132 -20.189 9.860 2.098 1063 HE22 GLN 132 HE22 GLN 132 -21.760 10.017 1.325 1064 H GLU 133 H GLU 133 -21.940 3.736 0.934 1065 HA GLU 133 HA GLU 133 -23.840 3.150 -1.226 1066 HB2 GLU 133 HB2 GLU 133 -21.466 1.552 -0.189 1067 HB3 GLU 133 HB3 GLU 133 -22.466 1.123 -1.582 1068 HG2 GLU 133 HG2 GLU 133 -21.856 3.364 -2.614 1069 HG3 GLU 133 HG3 GLU 133 -20.687 3.578 -1.309 1070 H1 SER 149 H1 SER 149 14.925 -21.078 -14.630 1071 H2 SER 149 H2 SER 149 14.009 -22.172 -13.812 1072 H3 SER 149 H3 SER 149 15.068 -21.215 -13.009 1073 HA SER 149 HA SER 149 12.875 -20.400 -12.640 1074 HB2 SER 149 HB2 SER 149 13.160 -18.066 -13.523 1075 HB3 SER 149 HB3 SER 149 14.550 -18.702 -12.627 1076 HG SER 149 HG SER 149 15.207 -17.700 -14.572 1077 H GLN 150 H GLN 150 13.430 -19.456 -16.032 1078 HA GLN 150 HA GLN 150 12.231 -19.442 -17.894 1079 HB2 GLN 150 HB2 GLN 150 12.288 -21.897 -17.549 1080 HB3 GLN 150 HB3 GLN 150 10.675 -21.811 -16.824 1081 HG2 GLN 150 HG2 GLN 150 9.769 -20.895 -18.949 1082 HG3 GLN 150 HG3 GLN 150 11.386 -20.931 -19.658 1083 HE21 GLN 150 HE21 GLN 150 9.771 -23.968 -20.936 1084 HE22 GLN 150 HE22 GLN 150 9.705 -22.229 -21.190 1085 H ILE 151 H ILE 151 9.975 -19.681 -15.125 1086 HA ILE 151 HA ILE 151 8.254 -17.579 -16.384 1087 HB ILE 151 HB ILE 151 7.298 -20.011 -14.823 1088 HG12 ILE 151 HG12 ILE 151 7.019 -19.339 -17.791 1089 HG13 ILE 151 HG13 ILE 151 8.014 -20.625 -17.107 1090 HG21 ILE 151 HG21 ILE 151 5.714 -17.762 -16.158 1091 HG22 ILE 151 HG22 ILE 151 5.021 -19.182 -15.345 1092 HG23 ILE 151 HG23 ILE 151 5.903 -18.003 -14.406 1093 HD11 ILE 151 HD11 ILE 151 4.986 -20.537 -17.141 1094 HD12 ILE 151 HD12 ILE 151 6.069 -21.654 -17.978 1095 HD13 ILE 151 HD13 ILE 151 5.944 -21.719 -16.209 1096 H THR 152 H THR 152 7.739 -15.901 -15.100 1097 HA THR 152 HA THR 152 8.791 -15.801 -12.318 1098 HB THR 152 HB THR 152 8.461 -13.337 -12.596 1099 HG1 THR 152 HG1 THR 152 8.220 -12.626 -14.766 1100 HG21 THR 152 HG21 THR 152 10.387 -12.954 -14.008 1101 HG22 THR 152 HG22 THR 152 10.669 -14.388 -13.007 1102 HG23 THR 152 HG23 THR 152 10.246 -14.578 -14.725 1103 H SER 153 H SER 153 7.532 -14.500 -10.738 1104 HA SER 153 HA SER 153 4.892 -15.624 -10.497 1105 HB2 SER 153 HB2 SER 153 6.347 -13.712 -8.668 1106 HB3 SER 153 HB3 SER 153 4.930 -14.706 -8.255 1107 HG SER 153 HG SER 153 6.918 -15.675 -7.561 1108 H GLN 154 H GLN 154 4.659 -14.117 -12.563 1109 HA GLN 154 HA GLN 154 3.927 -11.440 -12.473 1110 HB2 GLN 154 HB2 GLN 154 2.717 -13.607 -14.229 1111 HB3 GLN 154 HB3 GLN 154 2.627 -11.868 -14.531 1112 HG2 GLN 154 HG2 GLN 154 5.102 -11.770 -14.733 1113 HG3 GLN 154 HG3 GLN 154 5.194 -13.512 -14.457 1114 HE21 GLN 154 HE21 GLN 154 4.222 -12.159 -18.165 1115 HE22 GLN 154 HE22 GLN 154 4.558 -11.038 -16.843 1116 H VAL 155 H VAL 155 2.006 -10.263 -12.227 1117 HA VAL 155 HA VAL 155 -0.050 -11.250 -10.486 1118 HB VAL 155 HB VAL 155 0.405 -8.936 -10.459 1119 HG11 VAL 155 HG11 VAL 155 -0.302 -8.742 -13.380 1120 HG12 VAL 155 HG12 VAL 155 0.009 -7.384 -12.291 1121 HG13 VAL 155 HG13 VAL 155 1.310 -8.544 -12.624 1122 HG21 VAL 155 HG21 VAL 155 -1.805 -8.931 -9.807 1123 HG22 VAL 155 HG22 VAL 155 -1.892 -7.863 -11.145 1124 HG23 VAL 155 HG23 VAL 155 -2.410 -9.532 -11.376 1125 H TPO 156 H T2P 156 -1.555 -12.561 -10.909 1126 HA TPO 156 HA T2P 156 -2.586 -13.828 -13.106 1127 HB TPO 156 HB T2P 156 -3.866 -12.882 -10.565 1128 HG21 TPO 156 HG21 T2P 156 -5.790 -13.115 -11.924 1129 HG22 TPO 156 HG22 T2P 156 -5.676 -14.434 -10.781 1130 HG23 TPO 156 HG23 T2P 156 -5.246 -14.741 -12.484 1131 H GLY 157 H GLY 157 -4.619 -13.685 -14.090 1132 HA2 GLY 157 HA2 GLY 157 -6.094 -11.263 -14.471 1133 HA3 GLY 157 HA3 GLY 157 -5.069 -11.534 -15.887 1134 H GLN 158 H GLN 158 -5.251 -14.448 -15.853 1135 HA GLN 158 HA GLN 158 -7.720 -14.831 -17.251 1136 HB2 GLN 158 HB2 GLN 158 -6.917 -17.045 -17.676 1137 HB3 GLN 158 HB3 GLN 158 -5.557 -15.927 -17.801 1138 HG2 GLN 158 HG2 GLN 158 -4.811 -16.602 -15.503 1139 HG3 GLN 158 HG3 GLN 158 -6.196 -17.690 -15.390 1140 HE21 GLN 158 HE21 GLN 158 -3.690 -20.075 -16.252 1141 HE22 GLN 158 HE22 GLN 158 -4.452 -19.271 -14.883 1142 H ILE 159 H ILE 159 -7.083 -15.154 -13.864 1143 HA ILE 159 HA ILE 159 -9.039 -17.327 -13.436 1144 HB ILE 159 HB ILE 159 -7.267 -15.834 -11.490 1145 HG12 ILE 159 HG12 ILE 159 -5.862 -17.103 -13.038 1146 HG13 ILE 159 HG13 ILE 159 -5.816 -17.773 -11.425 1147 HG21 ILE 159 HG21 ILE 159 -8.944 -18.321 -11.092 1148 HG22 ILE 159 HG22 ILE 159 -7.718 -17.707 -9.950 1149 HG23 ILE 159 HG23 ILE 159 -9.138 -16.724 -10.334 1150 HD11 ILE 159 HD11 ILE 159 -5.881 -19.535 -13.144 1151 HD12 ILE 159 HD12 ILE 159 -7.304 -19.627 -12.101 1152 HD13 ILE 159 HD13 ILE 159 -7.442 -18.937 -13.735 1153 H GLY 160 H GLY 160 -8.541 -14.021 -12.227 1154 HA2 GLY 160 HA2 GLY 160 -10.040 -12.266 -11.959 1155 HA3 GLY 160 HA3 GLY 160 -11.312 -13.254 -12.684 1156 H TRP 161 H TRP 161 -9.304 -13.351 -9.679 1157 HA TRP 161 HA TRP 161 -11.724 -13.909 -8.034 1158 HB2 TRP 161 HB2 TRP 161 -10.584 -15.700 -6.967 1159 HB3 TRP 161 HB3 TRP 161 -10.510 -15.985 -8.677 1160 HD1 TRP 161 HD1 TRP 161 -7.776 -13.782 -8.687 1161 HE1 TRP 161 HE1 TRP 161 -5.520 -14.976 -8.354 1162 HE3 TRP 161 HE3 TRP 161 -9.431 -17.861 -6.134 1163 HZ2 TRP 161 HZ2 TRP 161 -4.582 -17.393 -7.145 1164 HZ3 TRP 161 HZ3 TRP 161 -7.817 -19.579 -5.308 1165 HH2 TRP 161 HH2 TRP 161 -5.392 -19.362 -5.822 1166 H ARG 162 H ARG 162 -10.319 -14.273 -5.709 1167 HA ARG 162 HA ARG 162 -9.588 -13.191 -3.922 1168 HB2 ARG 162 HB2 ARG 162 -7.419 -12.891 -5.937 1169 HB3 ARG 162 HB3 ARG 162 -7.176 -12.301 -4.279 1170 HG2 ARG 162 HG2 ARG 162 -8.097 -15.137 -4.849 1171 HG3 ARG 162 HG3 ARG 162 -6.392 -14.686 -4.810 1172 HD2 ARG 162 HD2 ARG 162 -6.650 -13.842 -2.499 1173 HD3 ARG 162 HD3 ARG 162 -8.360 -14.324 -2.518 1174 HE ARG 162 HE ARG 162 -6.737 -16.571 -3.207 1175 HH11 ARG 162 HH11 ARG 162 -6.346 -18.210 -1.760 1176 HH12 ARG 162 HH12 ARG 162 -6.578 -17.945 -0.058 1177 HH21 ARG 162 HH21 ARG 162 -7.579 -14.677 -0.367 1178 HH22 ARG 162 HH22 ARG 162 -7.260 -16.003 0.712 1179 H ARG 163 H ARG 163 -11.479 -11.836 -4.300 1180 HA ARG 163 HA ARG 163 -11.635 -9.111 -4.734 1181 HB2 ARG 163 HB2 ARG 163 -13.445 -9.065 -3.151 1182 HB3 ARG 163 HB3 ARG 163 -13.564 -10.514 -4.125 1183 HG2 ARG 163 HG2 ARG 163 -12.325 -10.573 -1.324 1184 HG3 ARG 163 HG3 ARG 163 -14.066 -10.618 -1.584 1185 HD2 ARG 163 HD2 ARG 163 -13.802 -12.656 -2.980 1186 HD3 ARG 163 HD3 ARG 163 -12.065 -12.665 -2.600 1187 HE ARG 163 HE ARG 163 -13.390 -12.539 -0.142 1188 HH11 ARG 163 HH11 ARG 163 -13.775 -14.292 1.156 1189 HH12 ARG 163 HH12 ARG 163 -13.848 -15.886 0.466 1190 HH21 ARG 163 HH21 ARG 163 -13.286 -14.874 -2.756 1191 HH22 ARG 163 HH22 ARG 163 -13.578 -16.213 -1.682 Start of MODEL 15 1 H1 GLY -4 H1 GLY -4 9.076 30.028 7.450 2 H2 GLY -4 H2 GLY -4 7.831 31.089 7.486 3 H3 GLY -4 H3 GLY -4 9.018 31.258 6.369 4 HA2 GLY -4 HA2 GLY -4 7.041 30.346 5.342 5 HA3 GLY -4 HA3 GLY -4 8.400 29.209 5.286 6 H SER -3 H SER -3 5.641 28.491 5.088 7 HA SER -3 HA SER -3 4.539 27.525 7.527 8 HB2 SER -3 HB2 SER -3 4.082 26.544 4.684 9 HB3 SER -3 HB3 SER -3 3.036 26.219 6.077 10 HG SER -3 HG SER -3 2.293 28.002 4.819 11 HA PRO -2 HA PRO -2 6.820 23.734 8.172 12 HB2 PRO -2 HB2 PRO -2 5.078 22.216 9.623 13 HB3 PRO -2 HB3 PRO -2 5.845 23.697 10.273 14 HG2 PRO -2 HG2 PRO -2 3.092 23.435 9.012 15 HG3 PRO -2 HG3 PRO -2 3.521 24.201 10.576 16 HD2 PRO -2 HD2 PRO -2 3.220 25.667 8.308 17 HD3 PRO -2 HD3 PRO -2 4.492 26.070 9.499 18 H ASN -1 H ASN -1 6.975 21.537 7.516 19 HA ASN -1 HA ASN -1 5.583 20.909 5.026 20 HB2 ASN -1 HB2 ASN -1 7.731 19.447 6.621 21 HB3 ASN -1 HB3 ASN -1 7.149 18.954 5.037 22 HD21 ASN -1 HD21 ASN -1 8.827 21.599 3.287 23 HD22 ASN -1 HD22 ASN -1 7.445 20.509 3.195 24 H SER 0 H SER 0 4.804 20.241 8.265 25 HA SER 0 HA SER 0 2.829 18.174 7.485 26 HB2 SER 0 HB2 SER 0 3.424 16.764 9.390 27 HB3 SER 0 HB3 SER 0 4.796 16.939 8.286 28 HG SER 0 HG SER 0 5.442 17.206 10.461 29 H MET 1 H MET 1 1.185 17.812 9.131 30 HA MET 1 HA MET 1 0.244 20.353 10.251 31 HB2 MET 1 HB2 MET 1 -1.061 17.626 9.963 32 HB3 MET 1 HB3 MET 1 -1.865 19.069 10.606 33 HG2 MET 1 HG2 MET 1 -1.555 20.252 8.498 34 HG3 MET 1 HG3 MET 1 -0.649 18.896 7.830 35 HE1 MET 1 HE1 MET 1 -4.058 18.752 9.987 36 HE2 MET 1 HE2 MET 1 -4.157 20.219 8.985 37 HE3 MET 1 HE3 MET 1 -5.223 18.837 8.653 38 H ALA 2 H ALA 2 2.471 19.553 11.685 39 HA ALA 2 HA ALA 2 2.002 17.879 13.917 40 HB1 ALA 2 HB1 ALA 2 4.131 18.820 14.731 41 HB2 ALA 2 HB2 ALA 2 4.215 18.465 12.996 42 HB3 ALA 2 HB3 ALA 2 4.013 20.143 13.551 43 H THR 3 H THR 3 0.907 21.138 13.498 44 HA THR 3 HA THR 3 0.598 21.736 16.366 45 HB THR 3 HB THR 3 -0.420 23.846 15.507 46 HG1 THR 3 HG1 THR 3 -0.353 24.202 13.282 47 HG21 THR 3 HG21 THR 3 2.049 23.649 15.839 48 HG22 THR 3 HG22 THR 3 2.217 23.163 14.137 49 HG23 THR 3 HG23 THR 3 1.614 24.786 14.549 50 H GLU 4 H GLU 4 -1.181 20.030 14.097 51 HA GLU 4 HA GLU 4 -3.855 20.728 15.183 52 HB2 GLU 4 HB2 GLU 4 -3.453 20.720 12.737 53 HB3 GLU 4 HB3 GLU 4 -3.026 19.015 12.815 54 HG2 GLU 4 HG2 GLU 4 -5.266 19.310 11.938 55 HG3 GLU 4 HG3 GLU 4 -5.318 18.414 13.438 56 H LEU 5 H LEU 5 -5.386 19.111 15.736 57 HA LEU 5 HA LEU 5 -4.433 16.929 17.383 58 HB2 LEU 5 HB2 LEU 5 -6.568 18.666 17.462 59 HB3 LEU 5 HB3 LEU 5 -7.359 17.243 16.813 60 HG LEU 5 HG LEU 5 -5.684 17.423 19.342 61 HD11 LEU 5 HD11 LEU 5 -7.829 17.159 20.543 62 HD12 LEU 5 HD12 LEU 5 -7.846 18.598 19.513 63 HD13 LEU 5 HD13 LEU 5 -8.699 17.128 18.993 64 HD21 LEU 5 HD21 LEU 5 -5.585 15.114 18.476 65 HD22 LEU 5 HD22 LEU 5 -6.598 15.173 19.921 66 HD23 LEU 5 HD23 LEU 5 -7.354 15.079 18.314 67 H GLU 6 H GLU 6 -3.575 16.536 14.819 68 HA GLU 6 HA GLU 6 -5.236 14.758 13.239 69 HB2 GLU 6 HB2 GLU 6 -2.389 15.747 13.237 70 HB3 GLU 6 HB3 GLU 6 -2.783 14.327 12.255 71 HG2 GLU 6 HG2 GLU 6 -4.148 17.033 12.030 72 HG3 GLU 6 HG3 GLU 6 -2.827 16.483 11.011 73 H TYR 7 H TYR 7 -5.330 12.515 13.266 74 HA TYR 7 HA TYR 7 -3.329 10.904 14.586 75 HB2 TYR 7 HB2 TYR 7 -4.661 9.896 16.247 76 HB3 TYR 7 HB3 TYR 7 -4.886 11.618 16.479 77 HD1 TYR 7 HD1 TYR 7 -7.073 12.694 15.698 78 HD2 TYR 7 HD2 TYR 7 -6.475 8.420 15.808 79 HE1 TYR 7 HE1 TYR 7 -9.532 12.345 15.626 80 HE2 TYR 7 HE2 TYR 7 -8.923 8.067 15.704 81 HH TYR 7 HH TYR 7 -11.243 10.812 15.592 82 H GLU 8 H GLU 8 -4.079 8.584 14.666 83 HA GLU 8 HA GLU 8 -6.062 7.614 12.837 84 HB2 GLU 8 HB2 GLU 8 -4.592 6.376 11.357 85 HB3 GLU 8 HB3 GLU 8 -4.429 8.092 11.100 86 HG2 GLU 8 HG2 GLU 8 -2.450 6.536 12.805 87 HG3 GLU 8 HG3 GLU 8 -2.307 6.655 11.069 88 H SER 9 H SER 9 -6.777 5.776 13.607 89 HA SER 9 HA SER 9 -5.416 4.436 15.843 90 HB2 SER 9 HB2 SER 9 -8.203 4.245 14.678 91 HB3 SER 9 HB3 SER 9 -7.626 3.234 16.018 92 HG SER 9 HG SER 9 -8.710 5.118 16.775 93 H VAL 10 H VAL 10 -4.517 2.364 15.695 94 HA VAL 10 HA VAL 10 -3.977 1.318 13.096 95 HB VAL 10 HB VAL 10 -3.674 -0.061 15.747 96 HG11 VAL 10 HG11 VAL 10 -1.868 -1.367 14.589 97 HG12 VAL 10 HG12 VAL 10 -3.468 -1.704 13.938 98 HG13 VAL 10 HG13 VAL 10 -2.362 -0.631 13.049 99 HG21 VAL 10 HG21 VAL 10 -2.397 2.066 15.695 100 HG22 VAL 10 HG22 VAL 10 -1.317 0.674 15.668 101 HG23 VAL 10 HG23 VAL 10 -1.633 1.568 14.170 102 H LEU 11 H LEU 11 -4.810 -0.171 11.858 103 HA LEU 11 HA LEU 11 -7.264 -1.670 12.689 104 HB2 LEU 11 HB2 LEU 11 -6.308 -0.939 9.891 105 HB3 LEU 11 HB3 LEU 11 -7.769 -1.822 10.301 106 HG LEU 11 HG LEU 11 -7.205 1.120 10.837 107 HD11 LEU 11 HD11 LEU 11 -9.166 -0.374 9.040 108 HD12 LEU 11 HD12 LEU 11 -9.120 1.381 9.251 109 HD13 LEU 11 HD13 LEU 11 -7.743 0.548 8.514 110 HD21 LEU 11 HD21 LEU 11 -8.530 0.305 12.711 111 HD22 LEU 11 HD22 LEU 11 -9.570 1.226 11.629 112 HD23 LEU 11 HD23 LEU 11 -9.636 -0.551 11.605 113 H CYS 12 H CYS 12 -4.157 -1.881 10.892 114 HA CYS 12 HA CYS 12 -3.979 -4.761 11.458 115 HB2 CYS 12 HB2 CYS 12 -5.253 -4.525 9.316 116 HB3 CYS 12 HB3 CYS 12 -3.823 -3.775 8.592 117 HG CYS 12 HG CYS 12 -4.110 -6.316 7.845 118 H VAL 13 H VAL 13 -1.991 -5.697 11.111 119 HA VAL 13 HA VAL 13 0.344 -4.024 10.551 120 HB VAL 13 HB VAL 13 0.190 -3.827 12.943 121 HG11 VAL 13 HG11 VAL 13 -1.115 -5.836 13.535 122 HG12 VAL 13 HG12 VAL 13 0.303 -6.854 13.199 123 HG13 VAL 13 HG13 VAL 13 0.347 -5.666 14.512 124 HG21 VAL 13 HG21 VAL 13 2.456 -4.074 11.923 125 HG22 VAL 13 HG22 VAL 13 2.385 -4.629 13.600 126 HG23 VAL 13 HG23 VAL 13 2.407 -5.812 12.279 127 H LYS 14 H LYS 14 1.698 -5.079 9.262 128 HA LYS 14 HA LYS 14 1.753 -8.037 9.397 129 HB2 LYS 14 HB2 LYS 14 1.611 -6.456 6.824 130 HB3 LYS 14 HB3 LYS 14 2.337 -8.045 6.860 131 HG2 LYS 14 HG2 LYS 14 -0.504 -7.474 7.804 132 HG3 LYS 14 HG3 LYS 14 -0.066 -8.020 6.182 133 HD2 LYS 14 HD2 LYS 14 0.965 -10.067 7.120 134 HD3 LYS 14 HD3 LYS 14 0.490 -9.575 8.759 135 HE2 LYS 14 HE2 LYS 14 -1.850 -9.603 8.164 136 HE3 LYS 14 HE3 LYS 14 -1.452 -9.979 6.477 137 HZ1 LYS 14 HZ1 LYS 14 -0.471 -12.073 7.241 138 HZ2 LYS 14 HZ2 LYS 14 -0.880 -11.745 8.796 139 HZ3 LYS 14 HZ3 LYS 14 -2.053 -11.992 7.686 140 HA PRO 15 HA PRO 15 5.732 -7.575 10.578 141 HB2 PRO 15 HB2 PRO 15 6.787 -10.090 10.268 142 HB3 PRO 15 HB3 PRO 15 5.441 -9.717 11.385 143 HG2 PRO 15 HG2 PRO 15 5.233 -10.810 8.546 144 HG3 PRO 15 HG3 PRO 15 4.449 -11.442 10.032 145 HD2 PRO 15 HD2 PRO 15 3.137 -9.812 8.356 146 HD3 PRO 15 HD3 PRO 15 2.957 -9.652 10.131 147 H ASP 16 H ASP 16 5.533 -8.697 7.223 148 HA ASP 16 HA ASP 16 8.113 -7.384 6.599 149 HB2 ASP 16 HB2 ASP 16 8.569 -9.793 7.047 150 HB3 ASP 16 HB3 ASP 16 7.444 -10.225 5.760 151 H VAL 17 H VAL 17 8.027 -6.234 4.750 152 HA VAL 17 HA VAL 17 6.182 -6.887 2.568 153 HB VAL 17 HB VAL 17 4.743 -5.580 4.049 154 HG11 VAL 17 HG11 VAL 17 6.726 -3.296 3.789 155 HG12 VAL 17 HG12 VAL 17 5.119 -3.218 4.530 156 HG13 VAL 17 HG13 VAL 17 6.376 -4.224 5.260 157 HG21 VAL 17 HG21 VAL 17 3.963 -3.938 2.478 158 HG22 VAL 17 HG22 VAL 17 5.521 -3.921 1.633 159 HG23 VAL 17 HG23 VAL 17 4.493 -5.377 1.595 160 H SER 18 H SER 18 6.932 -6.186 0.607 161 HA SER 18 HA SER 18 9.499 -4.644 0.580 162 HB2 SER 18 HB2 SER 18 8.579 -6.740 -1.410 163 HB3 SER 18 HB3 SER 18 10.138 -5.904 -1.338 164 HG SER 18 HG SER 18 9.090 -7.741 0.565 165 H VAL 19 H VAL 19 9.826 -3.065 -0.957 166 HA VAL 19 HA VAL 19 7.440 -2.169 -2.534 167 HB VAL 19 HB VAL 19 9.303 -0.523 -0.833 168 HG11 VAL 19 HG11 VAL 19 9.013 0.735 -2.877 169 HG12 VAL 19 HG12 VAL 19 7.268 0.366 -2.892 170 HG13 VAL 19 HG13 VAL 19 7.959 1.433 -1.654 171 HG21 VAL 19 HG21 VAL 19 6.276 -0.934 -0.894 172 HG22 VAL 19 HG22 VAL 19 7.377 -1.595 0.327 173 HG23 VAL 19 HG23 VAL 19 7.143 0.148 0.205 174 H TYR 20 H TYR 20 7.673 -1.634 -4.513 175 HA TYR 20 HA TYR 20 10.285 -2.198 -5.796 176 HB2 TYR 20 HB2 TYR 20 7.440 -2.242 -6.857 177 HB3 TYR 20 HB3 TYR 20 8.863 -2.727 -7.764 178 HD1 TYR 20 HD1 TYR 20 6.163 -4.139 -6.274 179 HD2 TYR 20 HD2 TYR 20 10.457 -4.395 -6.168 180 HE1 TYR 20 HE1 TYR 20 6.009 -6.514 -5.589 181 HE2 TYR 20 HE2 TYR 20 10.298 -6.753 -5.361 182 HH TYR 20 HH TYR 20 7.181 -8.418 -4.942 183 H ARG 21 H ARG 21 8.625 0.582 -5.244 184 HA ARG 21 HA ARG 21 8.472 2.720 -6.258 185 HB2 ARG 21 HB2 ARG 21 11.357 1.888 -6.026 186 HB3 ARG 21 HB3 ARG 21 10.976 3.462 -6.732 187 HG2 ARG 21 HG2 ARG 21 9.854 4.239 -4.804 188 HG3 ARG 21 HG3 ARG 21 9.818 2.633 -4.048 189 HD2 ARG 21 HD2 ARG 21 12.124 2.627 -3.622 190 HD3 ARG 21 HD3 ARG 21 12.448 3.955 -4.758 191 HE ARG 21 HE ARG 21 10.755 5.016 -2.790 192 HH11 ARG 21 HH11 ARG 21 11.562 6.382 -1.226 193 HH12 ARG 21 HH12 ARG 21 13.224 6.255 -0.734 194 HH21 ARG 21 HH21 ARG 21 13.996 3.636 -2.832 195 HH22 ARG 21 HH22 ARG 21 14.565 4.750 -1.610 196 H ILE 22 H ILE 22 7.185 2.311 -7.967 197 HA ILE 22 HA ILE 22 8.182 1.277 -10.450 198 HB ILE 22 HB ILE 22 5.854 1.251 -11.144 199 HG12 ILE 22 HG12 ILE 22 5.365 2.963 -8.675 200 HG13 ILE 22 HG13 ILE 22 4.987 3.321 -10.360 201 HG21 ILE 22 HG21 ILE 22 6.198 0.322 -8.269 202 HG22 ILE 22 HG22 ILE 22 5.034 -0.281 -9.456 203 HG23 ILE 22 HG23 ILE 22 6.767 -0.522 -9.716 204 HD11 ILE 22 HD11 ILE 22 3.305 1.445 -10.308 205 HD12 ILE 22 HD12 ILE 22 3.603 1.328 -8.550 206 HD13 ILE 22 HD13 ILE 22 2.960 2.826 -9.239 207 HA PRO 23 HA PRO 23 8.533 5.094 -12.716 208 HB2 PRO 23 HB2 PRO 23 8.239 4.092 -15.337 209 HB3 PRO 23 HB3 PRO 23 9.736 4.302 -14.393 210 HG2 PRO 23 HG2 PRO 23 8.241 1.805 -14.968 211 HG3 PRO 23 HG3 PRO 23 9.940 2.019 -14.490 212 HD2 PRO 23 HD2 PRO 23 7.827 1.148 -12.821 213 HD3 PRO 23 HD3 PRO 23 9.440 1.697 -12.291 214 HA PRO 24 HA PRO 24 4.441 5.562 -14.999 215 HB2 PRO 24 HB2 PRO 24 2.514 3.661 -15.215 216 HB3 PRO 24 HB3 PRO 24 4.013 3.616 -16.196 217 HG2 PRO 24 HG2 PRO 24 3.468 2.153 -13.582 218 HG3 PRO 24 HG3 PRO 24 4.060 1.463 -15.129 219 HD2 PRO 24 HD2 PRO 24 5.756 2.179 -13.139 220 HD3 PRO 24 HD3 PRO 24 6.178 2.438 -14.859 221 H ARG 25 H ARG 25 2.454 6.487 -14.481 222 HA ARG 25 HA ARG 25 1.288 6.016 -11.757 223 HB2 ARG 25 HB2 ARG 25 0.283 8.125 -11.842 224 HB3 ARG 25 HB3 ARG 25 1.978 8.356 -12.275 225 HG2 ARG 25 HG2 ARG 25 1.372 8.525 -14.664 226 HG3 ARG 25 HG3 ARG 25 -0.327 8.198 -14.295 227 HD2 ARG 25 HD2 ARG 25 1.248 10.576 -13.291 228 HD3 ARG 25 HD3 ARG 25 0.121 10.570 -14.673 229 HE ARG 25 HE ARG 25 -1.404 9.601 -12.586 230 HH11 ARG 25 HH11 ARG 25 -2.747 10.801 -11.290 231 HH12 ARG 25 HH12 ARG 25 -2.436 12.494 -11.047 232 HH21 ARG 25 HH21 ARG 25 0.340 12.601 -13.055 233 HH22 ARG 25 HH22 ARG 25 -0.734 13.493 -12.013 234 H ALA 26 H ALA 26 0.620 5.539 -15.079 235 HA ALA 26 HA ALA 26 -1.893 4.168 -14.534 236 HB1 ALA 26 HB1 ALA 26 -2.591 6.536 -14.380 237 HB2 ALA 26 HB2 ALA 26 -1.866 6.878 -15.955 238 HB3 ALA 26 HB3 ALA 26 -3.269 5.764 -15.831 239 H SER 27 H SER 27 -1.420 2.471 -15.580 240 HA SER 27 HA SER 27 -0.405 2.536 -18.372 241 HB2 SER 27 HB2 SER 27 0.615 0.939 -16.708 242 HB3 SER 27 HB3 SER 27 -0.956 0.119 -16.623 243 HG SER 27 HG SER 27 0.935 0.206 -18.681 244 H ASN 28 H ASN 28 -1.473 1.270 -19.901 245 HA ASN 28 HA ASN 28 -4.139 1.733 -20.476 246 HB2 ASN 28 HB2 ASN 28 -3.857 0.198 -22.261 247 HB3 ASN 28 HB3 ASN 28 -2.277 0.936 -22.015 248 HD21 ASN 28 HD21 ASN 28 -1.044 -2.316 -20.646 249 HD22 ASN 28 HD22 ASN 28 -1.036 -0.683 -20.020 250 H ARG 29 H ARG 29 -2.952 -0.932 -18.510 251 HA ARG 29 HA ARG 29 -5.730 -1.448 -17.644 252 HB2 ARG 29 HB2 ARG 29 -3.689 -3.612 -18.337 253 HB3 ARG 29 HB3 ARG 29 -5.013 -3.853 -17.200 254 HG2 ARG 29 HG2 ARG 29 -6.005 -4.646 -19.069 255 HG3 ARG 29 HG3 ARG 29 -6.559 -2.963 -19.107 256 HD2 ARG 29 HD2 ARG 29 -4.930 -2.412 -20.804 257 HD3 ARG 29 HD3 ARG 29 -4.184 -4.019 -20.684 258 HE ARG 29 HE ARG 29 -6.934 -4.368 -21.281 259 HH11 ARG 29 HH11 ARG 29 -7.670 -4.875 -23.309 260 HH12 ARG 29 HH12 ARG 29 -6.709 -4.490 -24.706 261 HH21 ARG 29 HH21 ARG 29 -4.126 -3.064 -22.943 262 HH22 ARG 29 HH22 ARG 29 -4.754 -3.510 -24.513 263 H GLY 30 H GLY 30 -5.255 0.056 -16.122 264 HA2 GLY 30 HA2 GLY 30 -4.782 0.795 -14.019 265 HA3 GLY 30 HA3 GLY 30 -4.438 -0.908 -13.607 266 H TYR 31 H TYR 31 -2.375 -1.603 -13.564 267 HA TYR 31 HA TYR 31 -0.109 0.300 -14.070 268 HB2 TYR 31 HB2 TYR 31 -0.688 -1.188 -11.497 269 HB3 TYR 31 HB3 TYR 31 0.914 -0.625 -11.924 270 HD1 TYR 31 HD1 TYR 31 1.518 1.699 -12.038 271 HD2 TYR 31 HD2 TYR 31 -2.424 0.408 -10.846 272 HE1 TYR 31 HE1 TYR 31 1.160 3.868 -10.897 273 HE2 TYR 31 HE2 TYR 31 -2.812 2.621 -9.738 274 HH TYR 31 HH TYR 31 -0.324 5.184 -9.679 275 H ARG 32 H ARG 32 -1.191 -3.041 -13.697 276 HA ARG 32 HA ARG 32 -0.239 -5.009 -13.553 277 HB2 ARG 32 HB2 ARG 32 1.441 -4.773 -15.948 278 HB3 ARG 32 HB3 ARG 32 0.189 -5.900 -15.465 279 HG2 ARG 32 HG2 ARG 32 -0.779 -5.032 -17.312 280 HG3 ARG 32 HG3 ARG 32 -1.458 -3.972 -16.104 281 HD2 ARG 32 HD2 ARG 32 -0.833 -2.501 -17.801 282 HD3 ARG 32 HD3 ARG 32 0.474 -2.348 -16.632 283 HE ARG 32 HE ARG 32 1.942 -3.018 -18.246 284 HH11 ARG 32 HH11 ARG 32 2.691 -3.537 -20.093 285 HH12 ARG 32 HH12 ARG 32 1.719 -4.361 -21.312 286 HH21 ARG 32 HH21 ARG 32 -1.101 -4.419 -19.309 287 HH22 ARG 32 HH22 ARG 32 -0.415 -4.855 -20.849 288 H ALA 33 H ALA 33 1.087 -5.611 -11.928 289 HA ALA 33 HA ALA 33 3.660 -4.619 -11.352 290 HB1 ALA 33 HB1 ALA 33 2.681 -7.472 -10.927 291 HB2 ALA 33 HB2 ALA 33 3.940 -6.605 -10.017 292 HB3 ALA 33 HB3 ALA 33 2.263 -6.095 -9.882 293 H SER 34 H SER 34 2.708 -7.117 -13.632 294 HA SER 34 HA SER 34 5.135 -8.134 -14.561 295 HB2 SER 34 HB2 SER 34 2.525 -7.524 -16.009 296 HB3 SER 34 HB3 SER 34 3.754 -8.707 -16.543 297 HG SER 34 HG SER 34 1.954 -9.584 -15.365 298 H ASP 35 H ASP 35 3.914 -4.883 -15.081 299 HA ASP 35 HA ASP 35 5.451 -4.399 -17.536 300 HB2 ASP 35 HB2 ASP 35 3.136 -3.418 -16.734 301 HB3 ASP 35 HB3 ASP 35 4.123 -2.288 -15.824 302 H TRP 36 H TRP 36 6.027 -4.246 -14.112 303 HA TRP 36 HA TRP 36 8.549 -2.733 -14.492 304 HB2 TRP 36 HB2 TRP 36 7.944 -1.685 -12.152 305 HB3 TRP 36 HB3 TRP 36 7.469 -1.006 -13.677 306 HD1 TRP 36 HD1 TRP 36 5.056 -0.696 -14.225 307 HE1 TRP 36 HE1 TRP 36 2.818 -1.103 -13.058 308 HE3 TRP 36 HE3 TRP 36 6.732 -3.362 -10.214 309 HZ2 TRP 36 HZ2 TRP 36 1.978 -1.919 -10.369 310 HZ3 TRP 36 HZ3 TRP 36 5.198 -3.963 -8.363 311 HH2 TRP 36 HH2 TRP 36 2.830 -3.238 -8.404 312 H LYS 37 H LYS 37 9.251 -2.880 -11.706 313 HA LYS 37 HA LYS 37 10.366 -5.566 -11.558 314 HB2 LYS 37 HB2 LYS 37 10.384 -3.120 -9.728 315 HB3 LYS 37 HB3 LYS 37 11.144 -4.651 -9.284 316 HG2 LYS 37 HG2 LYS 37 12.600 -4.584 -11.236 317 HG3 LYS 37 HG3 LYS 37 11.832 -3.106 -11.830 318 HD2 LYS 37 HD2 LYS 37 12.704 -1.786 -10.068 319 HD3 LYS 37 HD3 LYS 37 13.109 -3.199 -9.079 320 HE2 LYS 37 HE2 LYS 37 14.831 -3.901 -10.641 321 HE3 LYS 37 HE3 LYS 37 14.424 -2.576 -11.748 322 HZ1 LYS 37 HZ1 LYS 37 16.345 -2.020 -10.361 323 HZ2 LYS 37 HZ2 LYS 37 15.116 -1.007 -10.014 324 HZ3 LYS 37 HZ3 LYS 37 15.485 -2.226 -8.989 325 H LEU 38 H LEU 38 8.805 -7.179 -11.261 326 HA LEU 38 HA LEU 38 7.171 -6.953 -8.783 327 HB2 LEU 38 HB2 LEU 38 5.779 -8.693 -9.501 328 HB3 LEU 38 HB3 LEU 38 5.923 -7.458 -10.730 329 HG LEU 38 HG LEU 38 7.446 -8.947 -12.031 330 HD11 LEU 38 HD11 LEU 38 7.350 -11.389 -11.556 331 HD12 LEU 38 HD12 LEU 38 8.313 -10.496 -10.400 332 HD13 LEU 38 HD13 LEU 38 6.675 -11.028 -9.955 333 HD21 LEU 38 HD21 LEU 38 5.628 -10.375 -12.854 334 HD22 LEU 38 HD22 LEU 38 4.747 -10.219 -11.314 335 HD23 LEU 38 HD23 LEU 38 4.934 -8.828 -12.380 336 H ASP 39 H ASP 39 10.190 -8.039 -9.528 337 HA ASP 39 HA ASP 39 10.170 -10.130 -7.402 338 HB2 ASP 39 HB2 ASP 39 10.336 -10.980 -9.765 339 HB3 ASP 39 HB3 ASP 39 11.828 -10.071 -9.949 340 H GLN 40 H GLN 40 11.335 -7.074 -8.110 341 HA GLN 40 HA GLN 40 14.010 -7.454 -6.810 342 HB2 GLN 40 HB2 GLN 40 13.423 -5.540 -9.073 343 HB3 GLN 40 HB3 GLN 40 14.966 -6.023 -8.396 344 HG2 GLN 40 HG2 GLN 40 15.047 -7.310 -10.235 345 HG3 GLN 40 HG3 GLN 40 14.120 -8.456 -9.287 346 HE21 GLN 40 HE21 GLN 40 12.564 -7.233 -12.724 347 HE22 GLN 40 HE22 GLN 40 14.275 -7.302 -12.326 348 HA PRO 41 HA PRO 41 11.770 -4.233 -4.332 349 HB2 PRO 41 HB2 PRO 41 13.669 -5.257 -2.238 350 HB3 PRO 41 HB3 PRO 41 11.944 -4.811 -2.088 351 HG2 PRO 41 HG2 PRO 41 12.684 -7.422 -2.212 352 HG3 PRO 41 HG3 PRO 41 11.260 -6.858 -3.146 353 HD2 PRO 41 HD2 PRO 41 14.095 -7.291 -4.135 354 HD3 PRO 41 HD3 PRO 41 12.549 -7.820 -4.862 355 H ASP 42 H ASP 42 12.365 -2.148 -3.851 356 HA ASP 42 HA ASP 42 15.268 -1.398 -3.929 357 HB2 ASP 42 HB2 ASP 42 13.673 -0.244 -5.495 358 HB3 ASP 42 HB3 ASP 42 12.837 0.410 -4.085 359 H TRP 43 H TRP 43 12.454 -1.633 -1.872 360 HA TRP 43 HA TRP 43 14.110 -1.168 0.526 361 HB2 TRP 43 HB2 TRP 43 13.079 1.014 0.158 362 HB3 TRP 43 HB3 TRP 43 11.506 0.278 -0.097 363 HD1 TRP 43 HD1 TRP 43 13.876 1.373 2.640 364 HE1 TRP 43 HE1 TRP 43 12.659 1.376 4.901 365 HE3 TRP 43 HE3 TRP 43 9.572 -1.049 1.276 366 HZ2 TRP 43 HZ2 TRP 43 10.115 0.540 5.951 367 HZ3 TRP 43 HZ3 TRP 43 7.766 -1.442 2.932 368 HH2 TRP 43 HH2 TRP 43 8.016 -0.632 5.271 369 H THR 44 H THR 44 13.396 -2.433 2.321 370 HA THR 44 HA THR 44 10.700 -3.538 2.238 371 HB THR 44 HB THR 44 11.165 -5.710 2.693 372 HG1 THR 44 HG1 THR 44 13.919 -5.179 3.051 373 HG21 THR 44 HG21 THR 44 13.468 -5.201 0.794 374 HG22 THR 44 HG22 THR 44 12.580 -6.722 1.064 375 HG23 THR 44 HG23 THR 44 11.756 -5.341 0.339 376 H GLY 45 H GLY 45 9.830 -4.075 4.189 377 HA2 GLY 45 HA2 GLY 45 11.112 -3.516 6.729 378 HA3 GLY 45 HA3 GLY 45 10.172 -2.151 6.156 379 H ARG 46 H ARG 46 8.465 -2.143 7.345 380 HA ARG 46 HA ARG 46 6.786 -4.583 7.807 381 HB2 ARG 46 HB2 ARG 46 8.283 -4.025 9.713 382 HB3 ARG 46 HB3 ARG 46 7.551 -2.425 9.827 383 HG2 ARG 46 HG2 ARG 46 5.370 -3.436 10.399 384 HG3 ARG 46 HG3 ARG 46 6.054 -5.059 10.182 385 HD2 ARG 46 HD2 ARG 46 7.007 -3.041 12.246 386 HD3 ARG 46 HD3 ARG 46 5.856 -4.336 12.564 387 HE ARG 46 HE ARG 46 7.581 -5.993 12.014 388 HH11 ARG 46 HH11 ARG 46 9.643 -6.691 12.432 389 HH12 ARG 46 HH12 ARG 46 10.892 -5.520 12.782 390 HH21 ARG 46 HH21 ARG 46 8.853 -2.796 12.743 391 HH22 ARG 46 HH22 ARG 46 10.422 -3.444 13.136 392 H LEU 47 H LEU 47 4.547 -4.218 8.070 393 HA LEU 47 HA LEU 47 3.533 -1.686 6.829 394 HB2 LEU 47 HB2 LEU 47 3.052 -3.842 5.656 395 HB3 LEU 47 HB3 LEU 47 2.334 -4.443 7.141 396 HG LEU 47 HG LEU 47 0.687 -2.390 6.916 397 HD11 LEU 47 HD11 LEU 47 0.231 -1.740 4.617 398 HD12 LEU 47 HD12 LEU 47 1.860 -1.254 5.093 399 HD13 LEU 47 HD13 LEU 47 1.631 -2.676 4.045 400 HD21 LEU 47 HD21 LEU 47 -0.008 -4.709 6.780 401 HD22 LEU 47 HD22 LEU 47 -0.826 -3.747 5.556 402 HD23 LEU 47 HD23 LEU 47 0.530 -4.797 5.088 403 H ARG 48 H ARG 48 2.341 -0.312 8.004 404 HA ARG 48 HA ARG 48 0.461 -1.469 10.005 405 HB2 ARG 48 HB2 ARG 48 2.296 0.740 10.429 406 HB3 ARG 48 HB3 ARG 48 0.671 1.395 10.336 407 HG2 ARG 48 HG2 ARG 48 1.316 0.909 12.630 408 HG3 ARG 48 HG3 ARG 48 -0.094 -0.042 12.144 409 HD2 ARG 48 HD2 ARG 48 1.211 -2.035 11.916 410 HD3 ARG 48 HD3 ARG 48 2.733 -1.165 12.029 411 HE ARG 48 HE ARG 48 0.839 -1.787 14.243 412 HH11 ARG 48 HH11 ARG 48 1.601 -1.757 16.316 413 HH12 ARG 48 HH12 ARG 48 3.190 -1.140 16.651 414 HH21 ARG 48 HH21 ARG 48 3.982 -0.359 13.399 415 HH22 ARG 48 HH22 ARG 48 4.475 -0.371 15.070 416 H ILE 49 H ILE 49 -1.605 -1.112 9.662 417 HA ILE 49 HA ILE 49 -2.442 0.967 7.686 418 HB ILE 49 HB ILE 49 -3.721 -1.750 8.094 419 HG12 ILE 49 HG12 ILE 49 -2.300 -0.408 5.751 420 HG13 ILE 49 HG13 ILE 49 -1.819 -1.872 6.610 421 HG21 ILE 49 HG21 ILE 49 -5.444 0.042 7.899 422 HG22 ILE 49 HG22 ILE 49 -4.713 0.527 6.339 423 HG23 ILE 49 HG23 ILE 49 -5.461 -1.073 6.561 424 HD11 ILE 49 HD11 ILE 49 -4.166 -1.531 4.717 425 HD12 ILE 49 HD12 ILE 49 -2.729 -2.531 4.524 426 HD13 ILE 49 HD13 ILE 49 -3.928 -2.978 5.750 427 H THR 50 H THR 50 -3.855 2.351 8.456 428 HA THR 50 HA THR 50 -4.908 2.072 11.239 429 HB THR 50 HB THR 50 -3.961 4.234 11.807 430 HG1 THR 50 HG1 THR 50 -2.800 4.112 9.211 431 HG21 THR 50 HG21 THR 50 -1.644 2.709 10.539 432 HG22 THR 50 HG22 THR 50 -1.607 3.831 11.912 433 HG23 THR 50 HG23 THR 50 -2.378 2.247 12.081 434 H SER 51 H SER 51 -6.484 3.979 11.681 435 HA SER 51 HA SER 51 -7.494 5.465 9.364 436 HB2 SER 51 HB2 SER 51 -8.867 3.626 8.968 437 HB3 SER 51 HB3 SER 51 -9.071 3.285 10.710 438 HG SER 51 HG SER 51 -10.903 4.276 10.293 439 H LYS 52 H LYS 52 -8.288 7.320 9.863 440 HA LYS 52 HA LYS 52 -8.825 8.136 12.692 441 HB2 LYS 52 HB2 LYS 52 -7.163 9.304 11.200 442 HB3 LYS 52 HB3 LYS 52 -8.526 9.788 10.171 443 HG2 LYS 52 HG2 LYS 52 -9.406 10.879 12.444 444 HG3 LYS 52 HG3 LYS 52 -7.727 10.712 12.934 445 HD2 LYS 52 HD2 LYS 52 -8.882 12.200 10.565 446 HD3 LYS 52 HD3 LYS 52 -8.077 12.899 11.988 447 HE2 LYS 52 HE2 LYS 52 -5.928 12.095 11.238 448 HE3 LYS 52 HE3 LYS 52 -6.658 11.151 9.938 449 HZ1 LYS 52 HZ1 LYS 52 -7.329 13.199 8.868 450 HZ2 LYS 52 HZ2 LYS 52 -6.753 14.114 10.130 451 HZ3 LYS 52 HZ3 LYS 52 -5.722 13.310 9.218 452 H GLY 53 H GLY 53 -10.630 6.879 10.160 453 HA2 GLY 53 HA2 GLY 53 -13.178 7.199 11.107 454 HA3 GLY 53 HA3 GLY 53 -12.939 8.709 10.228 455 H LYS 54 H LYS 54 -13.789 8.631 8.217 456 HA LYS 54 HA LYS 54 -13.916 6.182 6.569 457 HB2 LYS 54 HB2 LYS 54 -15.643 7.987 6.478 458 HB3 LYS 54 HB3 LYS 54 -14.418 9.091 5.834 459 HG2 LYS 54 HG2 LYS 54 -14.209 7.639 3.819 460 HG3 LYS 54 HG3 LYS 54 -15.397 6.520 4.514 461 HD2 LYS 54 HD2 LYS 54 -17.105 8.264 4.415 462 HD3 LYS 54 HD3 LYS 54 -15.921 9.472 3.913 463 HE2 LYS 54 HE2 LYS 54 -16.668 7.004 2.276 464 HE3 LYS 54 HE3 LYS 54 -17.377 8.607 2.067 465 HZ1 LYS 54 HZ1 LYS 54 -15.037 9.425 1.630 466 HZ2 LYS 54 HZ2 LYS 54 -14.534 7.872 1.562 467 HZ3 LYS 54 HZ3 LYS 54 -15.627 8.414 0.490 468 H THR 55 H THR 55 -11.316 7.902 7.516 469 HA THR 55 HA THR 55 -9.938 7.471 4.911 470 HB THR 55 HB THR 55 -8.767 9.340 6.949 471 HG1 THR 55 HG1 THR 55 -9.971 11.042 6.110 472 HG21 THR 55 HG21 THR 55 -9.043 9.321 3.915 473 HG22 THR 55 HG22 THR 55 -8.060 10.477 4.854 474 HG23 THR 55 HG23 THR 55 -7.624 8.753 4.823 475 H ALA 56 H ALA 56 -8.646 5.843 4.907 476 HA ALA 56 HA ALA 56 -7.321 4.964 7.403 477 HB1 ALA 56 HB1 ALA 56 -6.662 2.934 5.945 478 HB2 ALA 56 HB2 ALA 56 -8.308 3.051 6.564 479 HB3 ALA 56 HB3 ALA 56 -7.982 3.458 4.877 480 H TYR 57 H TYR 57 -5.033 4.566 7.356 481 HA TYR 57 HA TYR 57 -3.557 6.060 5.243 482 HB2 TYR 57 HB2 TYR 57 -2.992 6.299 8.211 483 HB3 TYR 57 HB3 TYR 57 -2.082 7.022 6.905 484 HD1 TYR 57 HD1 TYR 57 -2.702 9.153 6.039 485 HD2 TYR 57 HD2 TYR 57 -5.412 7.043 8.649 486 HE1 TYR 57 HE1 TYR 57 -4.226 11.131 6.079 487 HE2 TYR 57 HE2 TYR 57 -6.945 8.982 8.634 488 HH TYR 57 HH TYR 57 -6.254 11.938 6.722 489 H ILE 58 H ILE 58 -2.272 4.706 4.263 490 HA ILE 58 HA ILE 58 -1.381 2.178 5.531 491 HB ILE 58 HB ILE 58 -0.443 3.289 2.874 492 HG12 ILE 58 HG12 ILE 58 -2.847 3.271 2.631 493 HG13 ILE 58 HG13 ILE 58 -2.073 2.053 1.646 494 HG21 ILE 58 HG21 ILE 58 -0.548 0.503 4.065 495 HG22 ILE 58 HG22 ILE 58 -0.033 0.891 2.407 496 HG23 ILE 58 HG23 ILE 58 0.895 1.493 3.780 497 HD11 ILE 58 HD11 ILE 58 -4.142 1.243 2.638 498 HD12 ILE 58 HD12 ILE 58 -2.765 0.281 3.202 499 HD13 ILE 58 HD13 ILE 58 -3.502 1.501 4.277 500 H LYS 59 H LYS 59 0.168 2.471 7.032 501 HA LYS 59 HA LYS 59 2.326 4.519 6.626 502 HB2 LYS 59 HB2 LYS 59 1.808 3.001 9.182 503 HB3 LYS 59 HB3 LYS 59 2.664 4.510 8.984 504 HG2 LYS 59 HG2 LYS 59 -0.353 4.186 8.599 505 HG3 LYS 59 HG3 LYS 59 0.383 4.545 10.134 506 HD2 LYS 59 HD2 LYS 59 0.718 6.377 7.729 507 HD3 LYS 59 HD3 LYS 59 -0.625 6.476 8.882 508 HE2 LYS 59 HE2 LYS 59 1.131 6.558 10.742 509 HE3 LYS 59 HE3 LYS 59 2.324 6.871 9.469 510 HZ1 LYS 59 HZ1 LYS 59 0.996 8.856 8.866 511 HZ2 LYS 59 HZ2 LYS 59 -0.069 8.554 10.089 512 HZ3 LYS 59 HZ3 LYS 59 1.479 8.932 10.420 513 H LEU 60 H LEU 60 4.239 3.748 5.850 514 HA LEU 60 HA LEU 60 4.899 0.850 6.260 515 HB2 LEU 60 HB2 LEU 60 5.868 2.892 4.235 516 HB3 LEU 60 HB3 LEU 60 6.583 1.294 4.442 517 HG LEU 60 HG LEU 60 3.654 1.741 3.710 518 HD11 LEU 60 HD11 LEU 60 6.048 1.035 1.973 519 HD12 LEU 60 HD12 LEU 60 4.353 1.061 1.436 520 HD13 LEU 60 HD13 LEU 60 5.144 2.563 1.939 521 HD21 LEU 60 HD21 LEU 60 4.088 -0.470 4.757 522 HD22 LEU 60 HD22 LEU 60 3.753 -0.645 3.032 523 HD23 LEU 60 HD23 LEU 60 5.424 -0.750 3.625 524 H GLU 61 H GLU 61 6.580 0.240 7.449 525 HA GLU 61 HA GLU 61 8.077 2.373 8.922 526 HB2 GLU 61 HB2 GLU 61 6.767 -0.142 10.006 527 HB3 GLU 61 HB3 GLU 61 7.670 1.056 10.938 528 HG2 GLU 61 HG2 GLU 61 5.977 2.787 10.293 529 HG3 GLU 61 HG3 GLU 61 5.024 1.528 9.497 530 H ASP 62 H ASP 62 10.168 1.828 9.806 531 HA ASP 62 HA ASP 62 11.698 -0.009 8.240 532 HB2 ASP 62 HB2 ASP 62 12.606 2.092 9.019 533 HB3 ASP 62 HB3 ASP 62 12.252 1.684 10.700 534 H LYS 63 H LYS 63 12.469 -1.999 8.708 535 HA LYS 63 HA LYS 63 10.909 -3.649 10.418 536 HB2 LYS 63 HB2 LYS 63 12.603 -4.014 8.236 537 HB3 LYS 63 HB3 LYS 63 13.505 -4.791 9.525 538 HG2 LYS 63 HG2 LYS 63 11.529 -6.178 10.096 539 HG3 LYS 63 HG3 LYS 63 10.580 -5.374 8.840 540 HD2 LYS 63 HD2 LYS 63 13.075 -7.065 8.363 541 HD3 LYS 63 HD3 LYS 63 11.401 -7.601 8.138 542 HE2 LYS 63 HE2 LYS 63 11.056 -5.852 6.416 543 HE3 LYS 63 HE3 LYS 63 12.738 -5.320 6.612 544 HZ1 LYS 63 HZ1 LYS 63 13.388 -7.620 5.936 545 HZ2 LYS 63 HZ2 LYS 63 11.808 -7.937 5.590 546 HZ3 LYS 63 HZ3 LYS 63 12.632 -6.776 4.758 547 H VAL 64 H VAL 64 13.557 -1.731 11.319 548 HA VAL 64 HA VAL 64 14.398 -3.518 13.557 549 HB VAL 64 HB VAL 64 15.962 -1.118 12.588 550 HG11 VAL 64 HG11 VAL 64 16.640 -2.242 14.671 551 HG12 VAL 64 HG12 VAL 64 16.781 -3.787 13.798 552 HG13 VAL 64 HG13 VAL 64 17.862 -2.430 13.407 553 HG21 VAL 64 HG21 VAL 64 15.644 -2.315 10.510 554 HG22 VAL 64 HG22 VAL 64 17.285 -2.599 11.088 555 HG23 VAL 64 HG23 VAL 64 16.050 -3.868 11.289 556 H SER 65 H SER 65 13.462 -0.179 12.725 557 HA SER 65 HA SER 65 13.241 0.392 15.653 558 HB2 SER 65 HB2 SER 65 14.224 2.191 13.413 559 HB3 SER 65 HB3 SER 65 14.022 2.684 15.107 560 HG SER 65 HG SER 65 16.183 2.052 14.619 561 H GLY 66 H GLY 66 11.270 0.107 12.966 562 HA2 GLY 66 HA2 GLY 66 9.085 0.668 12.634 563 HA3 GLY 66 HA3 GLY 66 9.036 1.366 14.253 564 H GLU 67 H GLU 67 11.452 2.768 12.221 565 HA GLU 67 HA GLU 67 10.169 5.368 12.306 566 HB2 GLU 67 HB2 GLU 67 12.672 4.433 10.843 567 HB3 GLU 67 HB3 GLU 67 12.140 6.113 11.000 568 HG2 GLU 67 HG2 GLU 67 12.261 5.884 13.498 569 HG3 GLU 67 HG3 GLU 67 12.925 4.261 13.290 570 H LEU 68 H LEU 68 9.286 6.626 10.621 571 HA LEU 68 HA LEU 68 7.793 5.055 8.761 572 HB2 LEU 68 HB2 LEU 68 7.054 7.184 9.965 573 HB3 LEU 68 HB3 LEU 68 8.042 8.079 8.814 574 HG LEU 68 HG LEU 68 6.641 6.895 6.963 575 HD11 LEU 68 HD11 LEU 68 4.379 6.194 7.647 576 HD12 LEU 68 HD12 LEU 68 5.583 5.170 8.431 577 HD13 LEU 68 HD13 LEU 68 4.791 6.456 9.358 578 HD21 LEU 68 HD21 LEU 68 4.836 8.543 7.163 579 HD22 LEU 68 HD22 LEU 68 5.278 8.851 8.858 580 HD23 LEU 68 HD23 LEU 68 6.399 9.274 7.545 581 H PHE 69 H PHE 69 8.343 4.330 6.854 582 HA PHE 69 HA PHE 69 10.506 5.454 5.168 583 HB2 PHE 69 HB2 PHE 69 10.344 3.084 5.259 584 HB3 PHE 69 HB3 PHE 69 8.607 3.101 4.986 585 HD1 PHE 69 HD1 PHE 69 11.656 4.482 3.218 586 HD2 PHE 69 HD2 PHE 69 7.952 2.308 2.903 587 HE1 PHE 69 HE1 PHE 69 12.032 4.186 0.799 588 HE2 PHE 69 HE2 PHE 69 8.355 1.964 0.486 589 HZ PHE 69 HZ PHE 69 10.367 2.932 -0.596 590 H ALA 70 H ALA 70 6.958 4.980 4.973 591 HA ALA 70 HA ALA 70 6.567 7.483 3.540 592 HB1 ALA 70 HB1 ALA 70 5.932 4.827 2.162 593 HB2 ALA 70 HB2 ALA 70 5.526 6.450 1.569 594 HB3 ALA 70 HB3 ALA 70 7.220 5.953 1.679 595 H GLN 71 H GLN 71 4.235 7.908 3.179 596 HA GLN 71 HA GLN 71 2.369 6.056 4.460 597 HB2 GLN 71 HB2 GLN 71 1.188 7.818 5.705 598 HB3 GLN 71 HB3 GLN 71 2.806 7.495 6.311 599 HG2 GLN 71 HG2 GLN 71 3.657 9.520 5.080 600 HG3 GLN 71 HG3 GLN 71 2.009 9.872 4.556 601 HE21 GLN 71 HE21 GLN 71 2.846 11.842 7.669 602 HE22 GLN 71 HE22 GLN 71 3.673 11.661 6.129 603 H ALA 72 H ALA 72 0.417 5.901 3.422 604 HA ALA 72 HA ALA 72 -0.179 7.919 1.291 605 HB1 ALA 72 HB1 ALA 72 -0.775 4.954 1.245 606 HB2 ALA 72 HB2 ALA 72 -1.338 6.148 0.061 607 HB3 ALA 72 HB3 ALA 72 0.390 5.849 0.228 608 HA PRO 73 HA PRO 73 -4.038 8.150 3.793 609 HB2 PRO 73 HB2 PRO 73 -4.992 10.512 2.851 610 HB3 PRO 73 HB3 PRO 73 -3.609 10.429 3.983 611 HG2 PRO 73 HG2 PRO 73 -3.504 10.759 0.981 612 HG3 PRO 73 HG3 PRO 73 -2.625 11.684 2.235 613 HD2 PRO 73 HD2 PRO 73 -1.516 9.561 0.891 614 HD3 PRO 73 HD3 PRO 73 -1.090 9.950 2.582 615 H VAL 74 H VAL 74 -5.867 7.064 3.243 616 HA VAL 74 HA VAL 74 -6.839 7.124 0.424 617 HB VAL 74 HB VAL 74 -7.193 4.907 0.284 618 HG11 VAL 74 HG11 VAL 74 -5.164 3.688 0.759 619 HG12 VAL 74 HG12 VAL 74 -4.662 5.353 0.496 620 HG13 VAL 74 HG13 VAL 74 -4.775 4.742 2.136 621 HG21 VAL 74 HG21 VAL 74 -8.399 4.355 2.276 622 HG22 VAL 74 HG22 VAL 74 -7.111 3.187 2.010 623 HG23 VAL 74 HG23 VAL 74 -6.901 4.458 3.237 624 H GLU 75 H GLU 75 -8.958 7.643 0.146 625 HA GLU 75 HA GLU 75 -10.751 7.465 2.525 626 HB2 GLU 75 HB2 GLU 75 -9.939 9.832 1.596 627 HB3 GLU 75 HB3 GLU 75 -11.215 9.541 0.412 628 HG2 GLU 75 HG2 GLU 75 -12.595 8.942 2.679 629 HG3 GLU 75 HG3 GLU 75 -11.380 9.980 3.394 630 H GLN 76 H GLN 76 -10.220 5.830 -0.121 631 HA GLN 76 HA GLN 76 -12.868 4.815 -0.334 632 HB2 GLN 76 HB2 GLN 76 -13.300 5.173 -2.639 633 HB3 GLN 76 HB3 GLN 76 -12.984 6.749 -1.948 634 HG2 GLN 76 HG2 GLN 76 -11.085 5.105 -3.676 635 HG3 GLN 76 HG3 GLN 76 -12.020 6.492 -4.186 636 HE21 GLN 76 HE21 GLN 76 -8.454 7.105 -2.320 637 HE22 GLN 76 HE22 GLN 76 -9.177 5.483 -2.291 638 H TYR 77 H TYR 77 -12.841 2.715 -1.201 639 HA TYR 77 HA TYR 77 -10.268 1.649 -2.197 640 HB2 TYR 77 HB2 TYR 77 -10.381 1.183 0.185 641 HB3 TYR 77 HB3 TYR 77 -11.893 0.264 -0.047 642 HD1 TYR 77 HD1 TYR 77 -11.684 -2.127 -0.813 643 HD2 TYR 77 HD2 TYR 77 -8.378 0.589 -0.884 644 HE1 TYR 77 HE1 TYR 77 -10.183 -3.972 -1.521 645 HE2 TYR 77 HE2 TYR 77 -6.866 -1.210 -1.645 646 HH TYR 77 HH TYR 77 -8.084 -4.575 -2.111 647 HA PRO 78 HA PRO 78 -9.393 0.389 -3.726 648 HB2 PRO 78 HB2 PRO 78 -10.293 0.159 -6.578 649 HB3 PRO 78 HB3 PRO 78 -8.895 -0.607 -5.760 650 HG2 PRO 78 HG2 PRO 78 -11.109 -2.066 -6.312 651 HG3 PRO 78 HG3 PRO 78 -10.311 -2.233 -4.711 652 HD2 PRO 78 HD2 PRO 78 -12.719 -0.517 -5.428 653 HD3 PRO 78 HD3 PRO 78 -12.535 -1.678 -4.077 654 H GLY 79 H GLY 79 -8.170 2.091 -4.991 655 HA2 GLY 79 HA2 GLY 79 -9.657 4.300 -6.232 656 HA3 GLY 79 HA3 GLY 79 -9.010 4.678 -4.636 657 H ILE 80 H ILE 80 -7.737 6.327 -5.626 658 HA ILE 80 HA ILE 80 -5.510 5.512 -7.401 659 HB ILE 80 HB ILE 80 -6.638 7.693 -7.745 660 HG12 ILE 80 HG12 ILE 80 -4.704 9.133 -7.988 661 HG13 ILE 80 HG13 ILE 80 -3.756 8.158 -6.871 662 HG21 ILE 80 HG21 ILE 80 -5.379 8.583 -5.103 663 HG22 ILE 80 HG22 ILE 80 -6.289 9.584 -6.240 664 HG23 ILE 80 HG23 ILE 80 -7.123 8.300 -5.361 665 HD11 ILE 80 HD11 ILE 80 -3.672 6.316 -8.463 666 HD12 ILE 80 HD12 ILE 80 -4.827 7.147 -9.541 667 HD13 ILE 80 HD13 ILE 80 -3.200 7.812 -9.281 668 H ALA 81 H ALA 81 -6.181 6.095 -4.017 669 HA ALA 81 HA ALA 81 -3.394 6.279 -3.279 670 HB1 ALA 81 HB1 ALA 81 -5.775 5.938 -1.469 671 HB2 ALA 81 HB2 ALA 81 -4.123 6.553 -1.116 672 HB3 ALA 81 HB3 ALA 81 -5.238 7.499 -2.132 673 H VAL 82 H VAL 82 -5.715 3.550 -3.489 674 HA VAL 82 HA VAL 82 -3.401 1.762 -3.199 675 HB VAL 82 HB VAL 82 -4.190 1.911 -0.961 676 HG11 VAL 82 HG11 VAL 82 -6.438 1.368 -0.282 677 HG12 VAL 82 HG12 VAL 82 -6.335 2.863 -1.181 678 HG13 VAL 82 HG13 VAL 82 -6.930 1.429 -2.012 679 HG21 VAL 82 HG21 VAL 82 -4.736 -0.452 -0.601 680 HG22 VAL 82 HG22 VAL 82 -4.994 -0.654 -2.352 681 HG23 VAL 82 HG23 VAL 82 -3.410 -0.214 -1.741 682 H GLU 83 H GLU 83 -3.464 0.421 -4.862 683 HA GLU 83 HA GLU 83 -6.023 -0.452 -6.134 684 HB2 GLU 83 HB2 GLU 83 -4.275 1.531 -7.159 685 HB3 GLU 83 HB3 GLU 83 -3.805 0.075 -8.020 686 HG2 GLU 83 HG2 GLU 83 -6.646 1.160 -7.835 687 HG3 GLU 83 HG3 GLU 83 -5.519 1.487 -9.153 688 H THR 84 H THR 84 -5.926 -2.393 -7.319 689 HA THR 84 HA THR 84 -3.574 -4.167 -6.711 690 HB THR 84 HB THR 84 -6.136 -5.193 -7.793 691 HG1 THR 84 HG1 THR 84 -6.698 -4.121 -5.842 692 HG21 THR 84 HG21 THR 84 -4.200 -6.658 -7.772 693 HG22 THR 84 HG22 THR 84 -3.972 -6.359 -6.029 694 HG23 THR 84 HG23 THR 84 -5.415 -7.222 -6.617 695 H VAL 85 H VAL 85 -2.505 -3.047 -8.213 696 HA VAL 85 HA VAL 85 -1.494 -2.844 -10.361 697 HB VAL 85 HB VAL 85 -0.549 -5.229 -10.676 698 HG11 VAL 85 HG11 VAL 85 -0.303 -3.737 -8.021 699 HG12 VAL 85 HG12 VAL 85 0.887 -4.855 -8.698 700 HG13 VAL 85 HG13 VAL 85 0.543 -3.338 -9.525 701 HG21 VAL 85 HG21 VAL 85 -2.469 -6.372 -9.336 702 HG22 VAL 85 HG22 VAL 85 -0.813 -6.803 -8.918 703 HG23 VAL 85 HG23 VAL 85 -1.723 -5.672 -7.904 704 H THR 86 H THR 86 -3.093 -5.929 -10.892 705 HA THR 86 HA THR 86 -4.927 -4.713 -12.773 706 HB THR 86 HB THR 86 -4.878 -6.787 -14.273 707 HG1 THR 86 HG1 THR 86 -3.402 -8.169 -13.934 708 HG21 THR 86 HG21 THR 86 -2.471 -4.952 -14.385 709 HG22 THR 86 HG22 THR 86 -3.199 -5.827 -15.753 710 HG23 THR 86 HG23 THR 86 -4.091 -4.506 -14.951 711 H ASP 87 H ASP 87 -3.892 -7.785 -11.273 712 HA ASP 87 HA ASP 87 -6.598 -8.094 -10.100 713 HB2 ASP 87 HB2 ASP 87 -6.548 -9.009 -12.508 714 HB3 ASP 87 HB3 ASP 87 -5.473 -10.256 -11.881 715 H SER 88 H SER 88 -3.697 -10.229 -10.618 716 HA SER 88 HA SER 88 -4.109 -11.735 -8.329 717 HB2 SER 88 HB2 SER 88 -1.342 -11.245 -9.441 718 HB3 SER 88 HB3 SER 88 -1.905 -12.598 -8.469 719 HG SER 88 HG SER 88 -1.943 -13.218 -10.605 720 H SER 89 H SER 89 -4.376 -11.013 -6.344 721 HA SER 89 HA SER 89 -3.014 -8.647 -5.421 722 HB2 SER 89 HB2 SER 89 -4.636 -8.653 -3.668 723 HB3 SER 89 HB3 SER 89 -5.386 -8.994 -5.239 724 HG SER 89 HG SER 89 -4.743 -10.864 -3.191 725 H ARG 90 H ARG 90 -1.087 -10.518 -5.725 726 HA ARG 90 HA ARG 90 -0.011 -10.719 -2.940 727 HB2 ARG 90 HB2 ARG 90 0.631 -12.536 -4.498 728 HB3 ARG 90 HB3 ARG 90 1.387 -11.343 -5.574 729 HG2 ARG 90 HG2 ARG 90 3.000 -10.740 -3.847 730 HG3 ARG 90 HG3 ARG 90 2.142 -11.713 -2.636 731 HD2 ARG 90 HD2 ARG 90 2.744 -13.764 -3.858 732 HD3 ARG 90 HD3 ARG 90 3.566 -12.787 -5.101 733 HE ARG 90 HE ARG 90 4.604 -12.046 -2.555 734 HH11 ARG 90 HH11 ARG 90 6.498 -12.594 -1.849 735 HH12 ARG 90 HH12 ARG 90 7.324 -14.037 -2.408 736 HH21 ARG 90 HH21 ARG 90 4.799 -14.881 -4.615 737 HH22 ARG 90 HH22 ARG 90 6.366 -15.311 -3.984 738 H TYR 91 H TYR 91 -0.227 -8.655 -5.713 739 HA TYR 91 HA TYR 91 1.678 -6.715 -4.499 740 HB2 TYR 91 HB2 TYR 91 0.749 -6.689 -7.360 741 HB3 TYR 91 HB3 TYR 91 2.159 -5.900 -6.684 742 HD1 TYR 91 HD1 TYR 91 3.935 -7.583 -5.626 743 HD2 TYR 91 HD2 TYR 91 1.006 -8.585 -8.616 744 HE1 TYR 91 HE1 TYR 91 5.299 -9.587 -6.302 745 HE2 TYR 91 HE2 TYR 91 2.338 -10.542 -9.324 746 HH TYR 91 HH TYR 91 5.449 -11.380 -7.651 747 H PHE 92 H PHE 92 1.259 -4.509 -4.759 748 HA PHE 92 HA PHE 92 -1.412 -3.600 -5.592 749 HB2 PHE 92 HB2 PHE 92 -0.273 -2.902 -2.855 750 HB3 PHE 92 HB3 PHE 92 -1.718 -2.199 -3.572 751 HD1 PHE 92 HD1 PHE 92 -3.708 -3.714 -4.134 752 HD2 PHE 92 HD2 PHE 92 -0.386 -4.970 -1.687 753 HE1 PHE 92 HE1 PHE 92 -5.041 -5.641 -3.328 754 HE2 PHE 92 HE2 PHE 92 -1.750 -6.837 -0.817 755 HZ PHE 92 HZ PHE 92 -4.051 -7.235 -1.691 756 H VAL 93 H VAL 93 -1.444 -1.161 -5.590 757 HA VAL 93 HA VAL 93 1.228 0.132 -5.570 758 HB VAL 93 HB VAL 93 -0.978 0.823 -7.554 759 HG11 VAL 93 HG11 VAL 93 1.758 2.059 -7.018 760 HG12 VAL 93 HG12 VAL 93 0.769 2.393 -8.438 761 HG13 VAL 93 HG13 VAL 93 0.166 2.846 -6.853 762 HG21 VAL 93 HG21 VAL 93 0.773 0.205 -9.253 763 HG22 VAL 93 HG22 VAL 93 1.753 -0.474 -7.946 764 HG23 VAL 93 HG23 VAL 93 0.154 -1.162 -8.326 765 H ILE 94 H ILE 94 1.265 1.945 -4.295 766 HA ILE 94 HA ILE 94 -1.338 3.141 -3.557 767 HB ILE 94 HB ILE 94 -0.729 3.541 -1.264 768 HG12 ILE 94 HG12 ILE 94 1.800 1.903 -1.766 769 HG13 ILE 94 HG13 ILE 94 1.765 3.654 -1.617 770 HG21 ILE 94 HG21 ILE 94 -0.975 1.324 -0.380 771 HG22 ILE 94 HG22 ILE 94 -1.838 1.382 -1.902 772 HG23 ILE 94 HG23 ILE 94 -0.266 0.575 -1.828 773 HD11 ILE 94 HD11 ILE 94 0.790 3.413 0.682 774 HD12 ILE 94 HD12 ILE 94 1.022 1.664 0.547 775 HD13 ILE 94 HD13 ILE 94 2.424 2.743 0.520 776 H ARG 95 H ARG 95 -1.372 5.309 -3.092 777 HA ARG 95 HA ARG 95 0.835 6.913 -4.336 778 HB2 ARG 95 HB2 ARG 95 -1.372 7.111 -5.356 779 HB3 ARG 95 HB3 ARG 95 -2.072 7.623 -3.832 780 HG2 ARG 95 HG2 ARG 95 0.181 9.214 -5.021 781 HG3 ARG 95 HG3 ARG 95 -1.462 9.392 -5.645 782 HD2 ARG 95 HD2 ARG 95 -0.792 9.700 -2.710 783 HD3 ARG 95 HD3 ARG 95 -0.798 11.026 -3.872 784 HE ARG 95 HE ARG 95 -3.167 10.791 -4.155 785 HH11 ARG 95 HH11 ARG 95 -5.086 10.843 -3.016 786 HH12 ARG 95 HH12 ARG 95 -5.204 9.994 -1.499 787 HH21 ARG 95 HH21 ARG 95 -2.032 8.770 -1.490 788 HH22 ARG 95 HH22 ARG 95 -3.585 8.879 -0.679 789 H ILE 96 H ILE 96 2.287 7.459 -2.872 790 HA ILE 96 HA ILE 96 1.522 7.965 -0.048 791 HB ILE 96 HB ILE 96 3.966 7.866 0.382 792 HG12 ILE 96 HG12 ILE 96 4.281 6.758 -2.436 793 HG13 ILE 96 HG13 ILE 96 4.602 8.453 -2.054 794 HG21 ILE 96 HG21 ILE 96 2.712 5.445 -0.943 795 HG22 ILE 96 HG22 ILE 96 4.126 5.383 0.107 796 HG23 ILE 96 HG23 ILE 96 2.584 5.908 0.769 797 HD11 ILE 96 HD11 ILE 96 6.040 6.074 -0.868 798 HD12 ILE 96 HD12 ILE 96 6.665 7.259 -2.035 799 HD13 ILE 96 HD13 ILE 96 6.270 7.773 -0.378 800 H GLN 97 H GLN 97 2.330 9.724 1.107 801 HA GLN 97 HA GLN 97 3.245 12.190 -0.300 802 HB2 GLN 97 HB2 GLN 97 2.701 11.383 2.577 803 HB3 GLN 97 HB3 GLN 97 3.654 12.813 2.211 804 HG2 GLN 97 HG2 GLN 97 0.943 12.513 0.909 805 HG3 GLN 97 HG3 GLN 97 1.062 12.995 2.605 806 HE21 GLN 97 HE21 GLN 97 2.188 15.692 -0.259 807 HE22 GLN 97 HE22 GLN 97 1.880 14.029 -0.735 808 H ASP 98 H ASP 98 5.379 12.740 -0.442 809 HA ASP 98 HA ASP 98 7.483 10.875 0.404 810 HB2 ASP 98 HB2 ASP 98 7.419 12.211 -1.749 811 HB3 ASP 98 HB3 ASP 98 7.611 13.650 -0.740 812 H GLY 99 H GLY 99 5.634 13.082 2.007 813 HA2 GLY 99 HA2 GLY 99 5.682 13.686 4.221 814 HA3 GLY 99 HA3 GLY 99 7.374 13.186 4.350 815 H THR 100 H THR 100 7.214 15.289 1.732 816 HA THR 100 HA THR 100 8.007 17.664 3.346 817 HB THR 100 HB THR 100 8.835 18.559 1.252 818 HG1 THR 100 HG1 THR 100 8.593 17.396 -0.627 819 HG21 THR 100 HG21 THR 100 9.677 15.626 1.361 820 HG22 THR 100 HG22 THR 100 10.608 17.012 0.752 821 HG23 THR 100 HG23 THR 100 10.274 16.871 2.486 822 H GLY 101 H GLY 101 5.279 16.432 1.765 823 HA2 GLY 101 HA2 GLY 101 3.178 17.797 1.577 824 HA3 GLY 101 HA3 GLY 101 4.193 19.083 0.914 825 H ARG 102 H ARG 102 5.828 16.790 -0.506 826 HA ARG 102 HA ARG 102 4.161 16.737 -2.950 827 HB2 ARG 102 HB2 ARG 102 6.018 16.343 -4.167 828 HB3 ARG 102 HB3 ARG 102 6.621 17.393 -2.869 829 HG2 ARG 102 HG2 ARG 102 7.667 15.482 -1.785 830 HG3 ARG 102 HG3 ARG 102 6.956 14.370 -2.970 831 HD2 ARG 102 HD2 ARG 102 9.204 14.679 -3.625 832 HD3 ARG 102 HD3 ARG 102 8.185 15.553 -4.767 833 HE ARG 102 HE ARG 102 9.007 17.605 -3.988 834 HH11 ARG 102 HH11 ARG 102 10.633 18.865 -3.209 835 HH12 ARG 102 HH12 ARG 102 11.789 18.214 -2.086 836 HH21 ARG 102 HH21 ARG 102 10.410 15.072 -1.916 837 HH22 ARG 102 HH22 ARG 102 11.693 16.140 -1.429 838 H SER 103 H SER 103 3.911 14.781 -4.236 839 HA SER 103 HA SER 103 3.692 12.318 -2.561 840 HB2 SER 103 HB2 SER 103 1.647 13.428 -4.505 841 HB3 SER 103 HB3 SER 103 1.576 11.806 -3.791 842 HG SER 103 HG SER 103 0.364 13.433 -2.634 843 H ALA 104 H ALA 104 3.620 10.311 -3.619 844 HA ALA 104 HA ALA 104 4.640 10.057 -6.384 845 HB1 ALA 104 HB1 ALA 104 6.568 8.705 -5.642 846 HB2 ALA 104 HB2 ALA 104 6.675 10.356 -5.006 847 HB3 ALA 104 HB3 ALA 104 6.153 9.029 -3.945 848 H PHE 105 H PHE 105 4.511 7.915 -7.241 849 HA PHE 105 HA PHE 105 2.609 6.127 -5.801 850 HB2 PHE 105 HB2 PHE 105 3.500 6.020 -8.693 851 HB3 PHE 105 HB3 PHE 105 2.228 5.071 -7.931 852 HD1 PHE 105 HD1 PHE 105 0.134 6.260 -7.050 853 HD2 PHE 105 HD2 PHE 105 3.093 8.266 -9.465 854 HE1 PHE 105 HE1 PHE 105 -1.499 8.033 -7.594 855 HE2 PHE 105 HE2 PHE 105 1.488 10.091 -9.915 856 HZ PHE 105 HZ PHE 105 -0.840 9.969 -8.995 857 H ILE 106 H ILE 106 3.240 4.300 -4.915 858 HA ILE 106 HA ILE 106 5.742 2.975 -5.877 859 HB ILE 106 HB ILE 106 6.064 2.007 -3.628 860 HG12 ILE 106 HG12 ILE 106 4.315 4.272 -2.576 861 HG13 ILE 106 HG13 ILE 106 3.788 2.595 -2.698 862 HG21 ILE 106 HG21 ILE 106 6.345 5.052 -3.738 863 HG22 ILE 106 HG22 ILE 106 7.379 3.916 -2.845 864 HG23 ILE 106 HG23 ILE 106 7.395 3.926 -4.609 865 HD11 ILE 106 HD11 ILE 106 4.515 3.055 -0.437 866 HD12 ILE 106 HD12 ILE 106 5.585 1.863 -1.190 867 HD13 ILE 106 HD13 ILE 106 6.116 3.554 -0.996 868 H GLY 107 H GLY 107 5.679 0.947 -6.397 869 HA2 GLY 107 HA2 GLY 107 3.204 -0.648 -6.156 870 HA3 GLY 107 HA3 GLY 107 4.664 -1.105 -7.029 871 H ILE 108 H ILE 108 3.067 -2.473 -4.879 872 HA ILE 108 HA ILE 108 5.246 -2.933 -2.897 873 HB ILE 108 HB ILE 108 2.268 -3.245 -2.297 874 HG12 ILE 108 HG12 ILE 108 4.183 -0.916 -1.814 875 HG13 ILE 108 HG13 ILE 108 2.624 -0.882 -2.635 876 HG21 ILE 108 HG21 ILE 108 4.755 -3.255 -0.561 877 HG22 ILE 108 HG22 ILE 108 3.079 -3.455 0.016 878 HG23 ILE 108 HG23 ILE 108 3.783 -4.686 -0.992 879 HD11 ILE 108 HD11 ILE 108 1.503 -1.394 -0.452 880 HD12 ILE 108 HD12 ILE 108 3.098 -1.241 0.346 881 HD13 ILE 108 HD13 ILE 108 2.405 0.140 -0.480 882 H GLY 109 H GLY 109 5.693 -5.109 -2.397 883 HA2 GLY 109 HA2 GLY 109 3.814 -7.214 -3.292 884 HA3 GLY 109 HA3 GLY 109 5.519 -7.435 -3.684 885 H PHE 110 H PHE 110 3.487 -8.741 -1.805 886 HA PHE 110 HA PHE 110 4.935 -8.552 0.785 887 HB2 PHE 110 HB2 PHE 110 2.354 -9.849 -0.078 888 HB3 PHE 110 HB3 PHE 110 3.065 -10.147 1.483 889 HD1 PHE 110 HD1 PHE 110 1.921 -7.227 -0.649 890 HD2 PHE 110 HD2 PHE 110 2.683 -8.775 3.308 891 HE1 PHE 110 HE1 PHE 110 0.932 -5.184 0.352 892 HE2 PHE 110 HE2 PHE 110 1.613 -6.785 4.296 893 HZ PHE 110 HZ PHE 110 0.790 -4.950 2.812 894 H THR 111 H THR 111 5.454 -10.430 1.998 895 HA THR 111 HA THR 111 7.089 -12.314 0.546 896 HB THR 111 HB THR 111 7.530 -11.284 2.763 897 HG1 THR 111 HG1 THR 111 8.612 -13.116 3.469 898 HG21 THR 111 HG21 THR 111 6.742 -12.383 4.791 899 HG22 THR 111 HG22 THR 111 5.370 -11.725 3.886 900 HG23 THR 111 HG23 THR 111 5.710 -13.471 3.842 901 H ASP 112 H ASP 112 3.827 -12.333 1.691 902 HA ASP 112 HA ASP 112 3.407 -15.040 0.543 903 HB2 ASP 112 HB2 ASP 112 3.492 -14.896 3.168 904 HB3 ASP 112 HB3 ASP 112 1.899 -14.143 3.018 905 H ARG 113 H ARG 113 1.493 -15.330 -0.592 906 HA ARG 113 HA ARG 113 -0.073 -13.142 -1.603 907 HB2 ARG 113 HB2 ARG 113 0.019 -15.273 -2.780 908 HB3 ARG 113 HB3 ARG 113 -0.564 -16.141 -1.365 909 HG2 ARG 113 HG2 ARG 113 -2.337 -16.019 -2.981 910 HG3 ARG 113 HG3 ARG 113 -2.784 -15.086 -1.571 911 HD2 ARG 113 HD2 ARG 113 -3.489 -13.802 -3.438 912 HD3 ARG 113 HD3 ARG 113 -2.060 -12.987 -2.829 913 HE ARG 113 HE ARG 113 -0.878 -13.573 -4.759 914 HH11 ARG 113 HH11 ARG 113 -0.581 -14.370 -6.815 915 HH12 ARG 113 HH12 ARG 113 -1.849 -15.305 -7.556 916 HH21 ARG 113 HH21 ARG 113 -3.930 -15.308 -4.870 917 HH22 ARG 113 HH22 ARG 113 -3.652 -15.849 -6.505 918 H GLY 114 H GLY 114 -0.550 -15.263 1.241 919 HA2 GLY 114 HA2 GLY 114 -3.188 -14.325 1.915 920 HA3 GLY 114 HA3 GLY 114 -2.049 -15.163 2.976 921 H ASP 115 H ASP 115 0.060 -13.049 2.665 922 HA ASP 115 HA ASP 115 -0.888 -11.225 4.737 923 HB2 ASP 115 HB2 ASP 115 1.724 -11.347 3.218 924 HB3 ASP 115 HB3 ASP 115 1.351 -10.196 4.507 925 H ALA 116 H ALA 116 -0.223 -10.954 1.246 926 HA ALA 116 HA ALA 116 -0.989 -8.170 1.056 927 HB1 ALA 116 HB1 ALA 116 -0.758 -10.460 -0.932 928 HB2 ALA 116 HB2 ALA 116 -1.092 -8.782 -1.408 929 HB3 ALA 116 HB3 ALA 116 0.429 -9.176 -0.631 930 H PHE 117 H PHE 117 -2.799 -11.251 0.519 931 HA PHE 117 HA PHE 117 -5.245 -10.108 -0.297 932 HB2 PHE 117 HB2 PHE 117 -4.513 -12.535 -0.280 933 HB3 PHE 117 HB3 PHE 117 -4.875 -12.577 1.442 934 HD1 PHE 117 HD1 PHE 117 -6.222 -12.669 -1.988 935 HD2 PHE 117 HD2 PHE 117 -7.274 -12.314 2.203 936 HE1 PHE 117 HE1 PHE 117 -8.516 -13.218 -2.514 937 HE2 PHE 117 HE2 PHE 117 -9.616 -12.928 1.646 938 HZ PHE 117 HZ PHE 117 -10.248 -13.405 -0.715 939 H ASP 118 H ASP 118 -3.854 -10.365 2.958 940 HA ASP 118 HA ASP 118 -6.254 -9.432 4.321 941 HB2 ASP 118 HB2 ASP 118 -4.576 -11.073 5.231 942 HB3 ASP 118 HB3 ASP 118 -3.414 -9.747 5.335 943 H PHE 119 H PHE 119 -3.276 -7.906 3.024 944 HA PHE 119 HA PHE 119 -3.676 -5.306 4.137 945 HB2 PHE 119 HB2 PHE 119 -1.613 -5.801 3.052 946 HB3 PHE 119 HB3 PHE 119 -2.391 -6.299 1.575 947 HD1 PHE 119 HD1 PHE 119 -3.470 -4.618 0.039 948 HD2 PHE 119 HD2 PHE 119 -0.953 -3.503 3.323 949 HE1 PHE 119 HE1 PHE 119 -3.203 -2.340 -0.939 950 HE2 PHE 119 HE2 PHE 119 -0.796 -1.210 2.438 951 HZ PHE 119 HZ PHE 119 -1.908 -0.621 0.293 952 H ASN 120 H ASN 120 -4.993 -6.893 1.215 953 HA ASN 120 HA ASN 120 -6.783 -4.754 0.484 954 HB2 ASN 120 HB2 ASN 120 -6.376 -6.163 -1.249 955 HB3 ASN 120 HB3 ASN 120 -6.384 -7.628 -0.252 956 HD21 ASN 120 HD21 ASN 120 -9.759 -8.336 -0.838 957 HD22 ASN 120 HD22 ASN 120 -8.283 -8.787 0.011 958 H VAL 121 H VAL 121 -7.508 -7.794 2.390 959 HA VAL 121 HA VAL 121 -10.239 -7.027 2.661 960 HB VAL 121 HB VAL 121 -8.572 -9.050 4.169 961 HG11 VAL 121 HG11 VAL 121 -10.710 -10.044 4.985 962 HG12 VAL 121 HG12 VAL 121 -10.379 -8.479 5.717 963 HG13 VAL 121 HG13 VAL 121 -11.578 -8.605 4.408 964 HG21 VAL 121 HG21 VAL 121 -9.920 -10.666 2.861 965 HG22 VAL 121 HG22 VAL 121 -10.804 -9.328 2.097 966 HG23 VAL 121 HG23 VAL 121 -9.074 -9.561 1.788 967 H SER 122 H SER 122 -7.483 -6.265 4.776 968 HA SER 122 HA SER 122 -8.907 -5.095 6.938 969 HB2 SER 122 HB2 SER 122 -6.461 -5.446 6.894 970 HB3 SER 122 HB3 SER 122 -6.299 -4.211 5.633 971 HG SER 122 HG SER 122 -7.357 -3.794 8.255 972 H LEU 123 H LEU 123 -8.241 -3.839 3.674 973 HA LEU 123 HA LEU 123 -9.453 -1.223 4.248 974 HB2 LEU 123 HB2 LEU 123 -8.362 -2.452 1.699 975 HB3 LEU 123 HB3 LEU 123 -8.963 -0.805 1.846 976 HG LEU 123 HG LEU 123 -6.676 -1.847 3.572 977 HD11 LEU 123 HD11 LEU 123 -6.055 -2.079 1.224 978 HD12 LEU 123 HD12 LEU 123 -6.527 -0.397 0.933 979 HD13 LEU 123 HD13 LEU 123 -5.150 -0.777 1.998 980 HD21 LEU 123 HD21 LEU 123 -7.561 0.967 2.823 981 HD22 LEU 123 HD22 LEU 123 -7.768 0.201 4.411 982 HD23 LEU 123 HD23 LEU 123 -6.146 0.545 3.813 983 H GLN 124 H GLN 124 -10.401 -4.229 2.479 984 HA GLN 124 HA GLN 124 -12.884 -3.230 1.516 985 HB2 GLN 124 HB2 GLN 124 -12.276 -6.075 2.434 986 HB3 GLN 124 HB3 GLN 124 -13.707 -5.542 1.549 987 HG2 GLN 124 HG2 GLN 124 -12.083 -4.642 -0.243 988 HG3 GLN 124 HG3 GLN 124 -10.841 -5.606 0.559 989 HE21 GLN 124 HE21 GLN 124 -12.053 -7.703 -2.182 990 HE22 GLN 124 HE22 GLN 124 -10.852 -6.479 -1.780 991 H ASP 125 H ASP 125 -12.218 -4.808 4.713 992 HA ASP 125 HA ASP 125 -14.942 -4.289 5.634 993 HB2 ASP 125 HB2 ASP 125 -13.425 -6.194 6.346 994 HB3 ASP 125 HB3 ASP 125 -12.467 -5.005 7.245 995 H HIS 126 H HIS 126 -12.330 -2.203 5.291 996 HA HIS 126 HA HIS 126 -13.160 -0.368 7.484 997 HB2 HIS 126 HB2 HIS 126 -10.777 -0.492 7.096 998 HB3 HIS 126 HB3 HIS 126 -10.997 -0.130 5.380 999 HD2 HIS 126 HD2 HIS 126 -11.971 1.649 8.740 1000 HE1 HIS 126 HE1 HIS 126 -10.829 4.644 5.934 1001 HE2 HIS 126 HE2 HIS 126 -11.694 4.242 8.278 1002 H PHE 127 H PHE 127 -13.359 -0.717 3.935 1003 HA PHE 127 HA PHE 127 -15.048 1.680 3.818 1004 HB2 PHE 127 HB2 PHE 127 -13.688 0.060 1.709 1005 HB3 PHE 127 HB3 PHE 127 -14.914 1.272 1.332 1006 HD1 PHE 127 HD1 PHE 127 -14.664 3.653 2.239 1007 HD2 PHE 127 HD2 PHE 127 -11.441 0.796 2.332 1008 HE1 PHE 127 HE1 PHE 127 -13.039 5.478 2.681 1009 HE2 PHE 127 HE2 PHE 127 -9.824 2.620 2.715 1010 HZ PHE 127 HZ PHE 127 -10.623 4.973 2.902 1011 H LYS 128 H LYS 128 -15.719 -1.703 4.048 1012 HA LYS 128 HA LYS 128 -18.100 -1.813 2.599 1013 HB2 LYS 128 HB2 LYS 128 -18.618 -3.844 3.618 1014 HB3 LYS 128 HB3 LYS 128 -16.897 -3.748 3.365 1015 HG2 LYS 128 HG2 LYS 128 -16.991 -4.714 5.415 1016 HG3 LYS 128 HG3 LYS 128 -16.788 -3.011 5.885 1017 HD2 LYS 128 HD2 LYS 128 -19.227 -2.898 6.351 1018 HD3 LYS 128 HD3 LYS 128 -19.401 -4.575 5.771 1019 HE2 LYS 128 HE2 LYS 128 -17.859 -5.335 7.525 1020 HE3 LYS 128 HE3 LYS 128 -17.668 -3.678 8.100 1021 HZ1 LYS 128 HZ1 LYS 128 -20.058 -3.680 8.657 1022 HZ2 LYS 128 HZ2 LYS 128 -20.220 -5.214 8.113 1023 HZ3 LYS 128 HZ3 LYS 128 -19.303 -4.906 9.425 1024 H TRP 129 H TRP 129 -17.699 -0.243 5.619 1025 HA TRP 129 HA TRP 129 -20.657 -0.001 6.021 1026 HB2 TRP 129 HB2 TRP 129 -20.064 0.643 8.328 1027 HB3 TRP 129 HB3 TRP 129 -19.594 -0.980 7.873 1028 HD1 TRP 129 HD1 TRP 129 -17.022 -1.609 7.902 1029 HE1 TRP 129 HE1 TRP 129 -14.930 -0.434 8.636 1030 HE3 TRP 129 HE3 TRP 129 -18.930 3.117 8.518 1031 HZ2 TRP 129 HZ2 TRP 129 -14.097 2.270 9.370 1032 HZ3 TRP 129 HZ3 TRP 129 -17.406 5.011 9.074 1033 HH2 TRP 129 HH2 TRP 129 -14.999 4.595 9.497 1034 H VAL 130 H VAL 130 -18.559 1.692 4.328 1035 HA VAL 130 HA VAL 130 -19.901 4.315 4.792 1036 HB VAL 130 HB VAL 130 -17.324 4.995 3.858 1037 HG11 VAL 130 HG11 VAL 130 -18.552 5.144 6.644 1038 HG12 VAL 130 HG12 VAL 130 -17.169 6.098 6.085 1039 HG13 VAL 130 HG13 VAL 130 -18.760 6.333 5.339 1040 HG21 VAL 130 HG21 VAL 130 -15.731 4.224 5.427 1041 HG22 VAL 130 HG22 VAL 130 -16.927 3.218 6.260 1042 HG23 VAL 130 HG23 VAL 130 -16.456 2.837 4.605 1043 H LYS 131 H LYS 131 -18.801 5.685 2.657 1044 HA LYS 131 HA LYS 131 -18.584 5.944 0.436 1045 HB2 LYS 131 HB2 LYS 131 -16.998 4.021 1.042 1046 HB3 LYS 131 HB3 LYS 131 -18.146 2.943 0.253 1047 HG2 LYS 131 HG2 LYS 131 -17.724 3.978 -1.912 1048 HG3 LYS 131 HG3 LYS 131 -16.828 5.302 -1.141 1049 HD2 LYS 131 HD2 LYS 131 -15.187 3.797 -2.014 1050 HD3 LYS 131 HD3 LYS 131 -15.202 3.641 -0.253 1051 HE2 LYS 131 HE2 LYS 131 -15.029 1.426 -0.968 1052 HE3 LYS 131 HE3 LYS 131 -16.746 1.588 -0.603 1053 HZ1 LYS 131 HZ1 LYS 131 -15.534 1.755 -3.317 1054 HZ2 LYS 131 HZ2 LYS 131 -16.340 0.475 -2.728 1055 HZ3 LYS 131 HZ3 LYS 131 -17.147 1.861 -3.020 1056 H GLN 132 H GLN 132 -21.200 4.881 1.529 1057 HA GLN 132 HA GLN 132 -23.344 4.541 0.855 1058 HB2 GLN 132 HB2 GLN 132 -22.475 6.378 -1.404 1059 HB3 GLN 132 HB3 GLN 132 -24.122 6.090 -0.859 1060 HG2 GLN 132 HG2 GLN 132 -23.542 8.135 0.113 1061 HG3 GLN 132 HG3 GLN 132 -23.465 6.970 1.430 1062 HE21 GLN 132 HE21 GLN 132 -19.987 8.776 0.113 1063 HE22 GLN 132 HE22 GLN 132 -21.361 8.688 -0.981 1064 H GLU 133 H GLU 133 -21.517 2.455 -0.150 1065 HA GLU 133 HA GLU 133 -23.242 1.351 -2.346 1066 HB2 GLU 133 HB2 GLU 133 -20.260 1.023 -1.887 1067 HB3 GLU 133 HB3 GLU 133 -21.212 -0.008 -2.961 1068 HG2 GLU 133 HG2 GLU 133 -21.890 1.948 -4.302 1069 HG3 GLU 133 HG3 GLU 133 -20.944 3.013 -3.265 1070 H1 SER 149 H1 SER 149 14.164 -13.402 -10.053 1071 H2 SER 149 H2 SER 149 15.730 -13.872 -10.211 1072 H3 SER 149 H3 SER 149 14.806 -14.475 -9.001 1073 HA SER 149 HA SER 149 15.036 -16.157 -10.638 1074 HB2 SER 149 HB2 SER 149 12.830 -15.947 -9.485 1075 HB3 SER 149 HB3 SER 149 12.250 -14.947 -10.834 1076 HG SER 149 HG SER 149 11.708 -17.153 -11.100 1077 H GLN 150 H GLN 150 14.694 -16.908 -12.803 1078 HA GLN 150 HA GLN 150 15.298 -14.909 -14.894 1079 HB2 GLN 150 HB2 GLN 150 15.055 -17.944 -14.954 1080 HB3 GLN 150 HB3 GLN 150 15.500 -16.932 -16.335 1081 HG2 GLN 150 HG2 GLN 150 17.480 -16.086 -15.090 1082 HG3 GLN 150 HG3 GLN 150 17.080 -17.145 -13.736 1083 HE21 GLN 150 HE21 GLN 150 19.643 -18.996 -15.604 1084 HE22 GLN 150 HE22 GLN 150 19.541 -17.579 -14.565 1085 H ILE 151 H ILE 151 12.458 -16.455 -13.656 1086 HA ILE 151 HA ILE 151 10.843 -15.480 -15.976 1087 HB ILE 151 HB ILE 151 10.384 -18.060 -14.432 1088 HG12 ILE 151 HG12 ILE 151 11.217 -17.601 -17.337 1089 HG13 ILE 151 HG13 ILE 151 12.244 -18.251 -16.059 1090 HG21 ILE 151 HG21 ILE 151 8.804 -16.832 -16.747 1091 HG22 ILE 151 HG22 ILE 151 8.478 -18.401 -15.980 1092 HG23 ILE 151 HG23 ILE 151 8.252 -16.934 -15.059 1093 HD11 ILE 151 HD11 ILE 151 9.839 -19.623 -17.294 1094 HD12 ILE 151 HD12 ILE 151 11.541 -20.087 -17.387 1095 HD13 ILE 151 HD13 ILE 151 10.686 -20.206 -15.837 1096 H THR 152 H THR 152 9.141 -14.216 -15.442 1097 HA THR 152 HA THR 152 8.957 -13.323 -12.667 1098 HB THR 152 HB THR 152 7.334 -11.631 -13.783 1099 HG1 THR 152 HG1 THR 152 8.053 -11.390 -16.041 1100 HG21 THR 152 HG21 THR 152 9.220 -10.278 -14.569 1101 HG22 THR 152 HG22 THR 152 9.649 -11.107 -13.067 1102 HG23 THR 152 HG23 THR 152 10.264 -11.719 -14.620 1103 H SER 153 H SER 153 7.330 -13.489 -11.275 1104 HA SER 153 HA SER 153 5.127 -15.349 -11.719 1105 HB2 SER 153 HB2 SER 153 5.817 -13.616 -9.342 1106 HB3 SER 153 HB3 SER 153 4.614 -14.926 -9.389 1107 HG SER 153 HG SER 153 6.642 -15.641 -8.538 1108 H GLN 154 H GLN 154 4.615 -13.754 -13.504 1109 HA GLN 154 HA GLN 154 3.659 -11.202 -13.320 1110 HB2 GLN 154 HB2 GLN 154 2.846 -13.412 -15.216 1111 HB3 GLN 154 HB3 GLN 154 2.404 -11.715 -15.448 1112 HG2 GLN 154 HG2 GLN 154 4.762 -11.049 -15.538 1113 HG3 GLN 154 HG3 GLN 154 5.271 -12.687 -15.157 1114 HE21 GLN 154 HE21 GLN 154 5.816 -12.948 -18.645 1115 HE22 GLN 154 HE22 GLN 154 6.570 -12.714 -17.063 1116 H VAL 155 H VAL 155 1.807 -10.065 -13.105 1117 HA VAL 155 HA VAL 155 -0.320 -11.216 -11.495 1118 HB VAL 155 HB VAL 155 0.533 -8.981 -11.005 1119 HG11 VAL 155 HG11 VAL 155 1.064 -8.079 -13.160 1120 HG12 VAL 155 HG12 VAL 155 -0.626 -8.145 -13.675 1121 HG13 VAL 155 HG13 VAL 155 -0.152 -7.044 -12.381 1122 HG21 VAL 155 HG21 VAL 155 -1.555 -9.250 -10.046 1123 HG22 VAL 155 HG22 VAL 155 -1.751 -7.765 -10.936 1124 HG23 VAL 155 HG23 VAL 155 -2.426 -9.240 -11.607 1125 H TPO 156 H T2P 156 -2.344 -11.627 -12.132 1126 HA TPO 156 HA T2P 156 -2.715 -12.414 -14.895 1127 HB TPO 156 HB T2P 156 -3.818 -13.063 -12.391 1128 HG21 TPO 156 HG21 T2P 156 -5.962 -13.490 -12.429 1129 HG22 TPO 156 HG22 T2P 156 -6.111 -13.378 -14.203 1130 HG23 TPO 156 HG23 T2P 156 -5.906 -11.932 -13.201 1131 H GLY 157 H GLY 157 -4.742 -12.372 -15.883 1132 HA2 GLY 157 HA2 GLY 157 -6.278 -9.848 -15.799 1133 HA3 GLY 157 HA3 GLY 157 -5.464 -10.193 -17.328 1134 H GLN 158 H GLN 158 -6.182 -13.274 -16.438 1135 HA GLN 158 HA GLN 158 -8.926 -13.122 -17.634 1136 HB2 GLN 158 HB2 GLN 158 -8.408 -14.855 -19.118 1137 HB3 GLN 158 HB3 GLN 158 -7.095 -13.694 -19.206 1138 HG2 GLN 158 HG2 GLN 158 -6.247 -15.559 -17.247 1139 HG3 GLN 158 HG3 GLN 158 -7.064 -16.543 -18.449 1140 HE21 GLN 158 HE21 GLN 158 -3.467 -14.765 -19.299 1141 HE22 GLN 158 HE22 GLN 158 -4.328 -14.478 -17.770 1142 H ILE 159 H ILE 159 -7.092 -14.874 -15.133 1143 HA ILE 159 HA ILE 159 -9.240 -16.838 -14.880 1144 HB ILE 159 HB ILE 159 -6.967 -17.454 -14.373 1145 HG12 ILE 159 HG12 ILE 159 -8.821 -17.766 -11.978 1146 HG13 ILE 159 HG13 ILE 159 -8.973 -18.653 -13.495 1147 HG21 ILE 159 HG21 ILE 159 -5.907 -16.879 -12.179 1148 HG22 ILE 159 HG22 ILE 159 -6.044 -15.551 -13.288 1149 HG23 ILE 159 HG23 ILE 159 -7.172 -15.668 -11.914 1150 HD11 ILE 159 HD11 ILE 159 -6.683 -18.861 -11.501 1151 HD12 ILE 159 HD12 ILE 159 -7.892 -20.084 -11.907 1152 HD13 ILE 159 HD13 ILE 159 -6.679 -19.617 -13.116 1153 H GLY 160 H GLY 160 -8.480 -13.836 -13.229 1154 HA2 GLY 160 HA2 GLY 160 -9.811 -12.423 -11.949 1155 HA3 GLY 160 HA3 GLY 160 -11.212 -13.289 -12.592 1156 H TRP 161 H TRP 161 -8.506 -14.151 -10.377 1157 HA TRP 161 HA TRP 161 -10.258 -15.898 -8.814 1158 HB2 TRP 161 HB2 TRP 161 -8.168 -16.944 -8.212 1159 HB3 TRP 161 HB3 TRP 161 -8.252 -16.741 -9.927 1160 HD1 TRP 161 HD1 TRP 161 -7.072 -13.509 -9.576 1161 HE1 TRP 161 HE1 TRP 161 -4.531 -13.451 -9.937 1162 HE3 TRP 161 HE3 TRP 161 -5.953 -17.932 -7.525 1163 HZ2 TRP 161 HZ2 TRP 161 -2.357 -15.362 -9.800 1164 HZ3 TRP 161 HZ3 TRP 161 -3.593 -18.824 -7.527 1165 HH2 TRP 161 HH2 TRP 161 -1.807 -17.573 -8.729 1166 H ARG 162 H ARG 162 -8.237 -15.886 -6.754 1167 HA ARG 162 HA ARG 162 -7.934 -15.269 -4.718 1168 HB2 ARG 162 HB2 ARG 162 -7.125 -13.082 -4.148 1169 HB3 ARG 162 HB3 ARG 162 -6.353 -13.998 -5.403 1170 HG2 ARG 162 HG2 ARG 162 -6.260 -11.819 -6.115 1171 HG3 ARG 162 HG3 ARG 162 -7.450 -12.595 -7.128 1172 HD2 ARG 162 HD2 ARG 162 -9.272 -11.572 -5.697 1173 HD3 ARG 162 HD3 ARG 162 -8.054 -10.954 -4.590 1174 HE ARG 162 HE ARG 162 -7.777 -9.140 -6.004 1175 HH11 ARG 162 HH11 ARG 162 -8.082 -7.859 -7.845 1176 HH12 ARG 162 HH12 ARG 162 -8.742 -8.636 -9.282 1177 HH21 ARG 162 HH21 ARG 162 -9.342 -11.643 -7.972 1178 HH22 ARG 162 HH22 ARG 162 -9.243 -10.588 -9.380 1179 H ARG 163 H ARG 163 -10.488 -12.955 -5.651 1180 HA ARG 163 HA ARG 163 -11.616 -13.298 -2.915 1181 HB2 ARG 163 HB2 ARG 163 -11.443 -10.996 -4.818 1182 HB3 ARG 163 HB3 ARG 163 -12.940 -11.107 -3.918 1183 HG2 ARG 163 HG2 ARG 163 -10.199 -11.194 -2.610 1184 HG3 ARG 163 HG3 ARG 163 -11.127 -9.716 -2.821 1185 HD2 ARG 163 HD2 ARG 163 -12.289 -12.111 -1.318 1186 HD3 ARG 163 HD3 ARG 163 -11.252 -10.926 -0.543 1187 HE ARG 163 HE ARG 163 -12.892 -9.294 -0.667 1188 HH11 ARG 163 HH11 ARG 163 -14.827 -8.588 -0.581 1189 HH12 ARG 163 HH12 ARG 163 -16.196 -9.534 -1.138 1190 HH21 ARG 163 HH21 ARG 163 -14.285 -12.164 -2.301 1191 HH22 ARG 163 HH22 ARG 163 -15.871 -11.509 -2.047 Start of MODEL 16 1 H1 GLY -4 H1 GLY -4 3.325 27.528 25.815 2 H2 GLY -4 H2 GLY -4 2.392 28.377 26.856 3 H3 GLY -4 H3 GLY -4 3.972 28.768 26.679 4 HA2 GLY -4 HA2 GLY -4 1.908 29.017 24.583 5 HA3 GLY -4 HA3 GLY -4 2.558 30.362 25.534 6 H SER -3 H SER -3 3.464 27.778 23.254 7 HA SER -3 HA SER -3 5.305 29.559 21.798 8 HB2 SER -3 HB2 SER -3 7.224 28.123 22.009 9 HB3 SER -3 HB3 SER -3 6.661 28.438 23.643 10 HG SER -3 HG SER -3 5.727 26.414 23.713 11 HA PRO -2 HA PRO -2 4.039 26.949 18.330 12 HB2 PRO -2 HB2 PRO -2 6.911 26.092 17.923 13 HB3 PRO -2 HB3 PRO -2 5.712 26.629 16.703 14 HG2 PRO -2 HG2 PRO -2 7.591 28.363 17.555 15 HG3 PRO -2 HG3 PRO -2 5.884 28.915 17.447 16 HD2 PRO -2 HD2 PRO -2 7.398 27.947 19.887 17 HD3 PRO -2 HD3 PRO -2 6.380 29.413 19.713 18 H ASN -1 H ASN -1 6.037 25.481 20.838 19 HA ASN -1 HA ASN -1 5.446 22.704 20.210 20 HB2 ASN -1 HB2 ASN -1 6.227 23.891 22.905 21 HB3 ASN -1 HB3 ASN -1 6.414 22.230 22.373 22 HD21 ASN -1 HD21 ASN -1 9.263 24.975 21.456 23 HD22 ASN -1 HD22 ASN -1 7.786 25.433 22.312 24 H SER 0 H SER 0 3.742 25.260 21.957 25 HA SER 0 HA SER 0 1.938 23.579 23.447 26 HB2 SER 0 HB2 SER 0 1.521 26.471 22.623 27 HB3 SER 0 HB3 SER 0 0.782 25.617 23.982 28 HG SER 0 HG SER 0 2.969 25.351 24.814 29 H MET 1 H MET 1 2.031 24.225 20.100 30 HA MET 1 HA MET 1 -0.840 24.177 19.587 31 HB2 MET 1 HB2 MET 1 1.495 23.736 17.688 32 HB3 MET 1 HB3 MET 1 -0.188 24.040 17.238 33 HG2 MET 1 HG2 MET 1 -0.025 26.237 18.507 34 HG3 MET 1 HG3 MET 1 1.713 25.967 18.616 35 HE1 MET 1 HE1 MET 1 2.763 26.092 14.780 36 HE2 MET 1 HE2 MET 1 3.321 25.786 16.436 37 HE3 MET 1 HE3 MET 1 2.260 24.614 15.622 38 H ALA 2 H ALA 2 1.311 21.699 20.483 39 HA ALA 2 HA ALA 2 0.376 19.583 18.779 40 HB1 ALA 2 HB1 ALA 2 1.903 19.518 21.416 41 HB2 ALA 2 HB2 ALA 2 1.776 18.189 20.243 42 HB3 ALA 2 HB3 ALA 2 2.623 19.681 19.796 43 H THR 3 H THR 3 -1.148 20.968 21.550 44 HA THR 3 HA THR 3 -2.448 18.512 22.473 45 HB THR 3 HB THR 3 -3.687 20.054 24.003 46 HG1 THR 3 HG1 THR 3 -3.504 21.968 22.824 47 HG21 THR 3 HG21 THR 3 -1.606 18.880 24.629 48 HG22 THR 3 HG22 THR 3 -0.646 20.251 24.033 49 HG23 THR 3 HG23 THR 3 -1.740 20.463 25.421 50 H GLU 4 H GLU 4 -3.252 17.930 20.439 51 HA GLU 4 HA GLU 4 -5.969 19.049 19.849 52 HB2 GLU 4 HB2 GLU 4 -4.314 19.679 18.114 53 HB3 GLU 4 HB3 GLU 4 -3.907 17.983 17.878 54 HG2 GLU 4 HG2 GLU 4 -5.344 18.778 16.094 55 HG3 GLU 4 HG3 GLU 4 -6.166 17.524 16.998 56 H LEU 5 H LEU 5 -7.533 17.572 19.088 57 HA LEU 5 HA LEU 5 -7.423 14.889 20.180 58 HB2 LEU 5 HB2 LEU 5 -9.385 16.794 19.840 59 HB3 LEU 5 HB3 LEU 5 -9.747 15.732 18.494 60 HG LEU 5 HG LEU 5 -9.456 14.954 21.418 61 HD11 LEU 5 HD11 LEU 5 -11.905 14.635 21.372 62 HD12 LEU 5 HD12 LEU 5 -11.470 16.300 20.958 63 HD13 LEU 5 HD13 LEU 5 -11.949 15.165 19.675 64 HD21 LEU 5 HD21 LEU 5 -10.482 12.772 20.784 65 HD22 LEU 5 HD22 LEU 5 -10.399 13.241 19.071 66 HD23 LEU 5 HD23 LEU 5 -8.910 13.002 20.012 67 H GLU 6 H GLU 6 -5.458 15.221 18.223 68 HA GLU 6 HA GLU 6 -6.261 14.070 15.674 69 HB2 GLU 6 HB2 GLU 6 -3.698 14.900 17.000 70 HB3 GLU 6 HB3 GLU 6 -3.586 13.728 15.685 71 HG2 GLU 6 HG2 GLU 6 -5.006 16.402 15.409 72 HG3 GLU 6 HG3 GLU 6 -3.308 16.149 15.021 73 H TYR 7 H TYR 7 -6.437 11.909 15.180 74 HA TYR 7 HA TYR 7 -5.061 9.866 16.776 75 HB2 TYR 7 HB2 TYR 7 -6.938 8.727 17.541 76 HB3 TYR 7 HB3 TYR 7 -7.318 10.399 17.892 77 HD1 TYR 7 HD1 TYR 7 -8.331 7.375 16.160 78 HD2 TYR 7 HD2 TYR 7 -8.960 11.643 16.364 79 HE1 TYR 7 HE1 TYR 7 -10.449 7.108 14.915 80 HE2 TYR 7 HE2 TYR 7 -11.103 11.376 15.121 81 HH TYR 7 HH TYR 7 -12.307 8.169 14.055 82 H GLU 8 H GLU 8 -5.728 7.640 16.015 83 HA GLU 8 HA GLU 8 -6.850 7.161 13.468 84 HB2 GLU 8 HB2 GLU 8 -4.937 6.308 12.218 85 HB3 GLU 8 HB3 GLU 8 -4.749 8.011 12.529 86 HG2 GLU 8 HG2 GLU 8 -3.299 7.226 14.616 87 HG3 GLU 8 HG3 GLU 8 -3.222 5.700 13.727 88 H SER 9 H SER 9 -7.749 5.234 13.644 89 HA SER 9 HA SER 9 -7.072 3.481 15.879 90 HB2 SER 9 HB2 SER 9 -9.284 3.546 13.819 91 HB3 SER 9 HB3 SER 9 -9.127 2.243 15.022 92 HG SER 9 HG SER 9 -10.502 3.933 15.759 93 H VAL 10 H VAL 10 -6.027 1.429 15.709 94 HA VAL 10 HA VAL 10 -4.735 0.888 13.175 95 HB VAL 10 HB VAL 10 -3.600 0.496 15.281 96 HG11 VAL 10 HG11 VAL 10 -3.975 -1.495 16.623 97 HG12 VAL 10 HG12 VAL 10 -5.442 -0.507 16.618 98 HG13 VAL 10 HG13 VAL 10 -5.354 -1.971 15.616 99 HG21 VAL 10 HG21 VAL 10 -2.856 -0.603 13.186 100 HG22 VAL 10 HG22 VAL 10 -2.455 -1.529 14.640 101 HG23 VAL 10 HG23 VAL 10 -3.809 -2.041 13.619 102 H LEU 11 H LEU 11 -5.084 -0.505 11.604 103 HA LEU 11 HA LEU 11 -7.518 -2.256 11.686 104 HB2 LEU 11 HB2 LEU 11 -6.207 -0.837 9.337 105 HB3 LEU 11 HB3 LEU 11 -7.567 -1.943 9.231 106 HG LEU 11 HG LEU 11 -7.584 0.794 10.568 107 HD11 LEU 11 HD11 LEU 11 -9.206 1.237 8.687 108 HD12 LEU 11 HD12 LEU 11 -7.550 0.935 8.153 109 HD13 LEU 11 HD13 LEU 11 -8.783 -0.337 8.003 110 HD21 LEU 11 HD21 LEU 11 -10.042 0.432 10.757 111 HD22 LEU 11 HD22 LEU 11 -9.824 -1.257 10.244 112 HD23 LEU 11 HD23 LEU 11 -9.130 -0.672 11.780 113 H CYS 12 H CYS 12 -4.133 -2.005 10.493 114 HA CYS 12 HA CYS 12 -3.914 -4.937 10.564 115 HB2 CYS 12 HB2 CYS 12 -4.767 -4.264 8.244 116 HB3 CYS 12 HB3 CYS 12 -3.186 -3.499 7.997 117 HG CYS 12 HG CYS 12 -3.386 -5.837 6.782 118 H VAL 13 H VAL 13 -1.892 -5.753 10.626 119 HA VAL 13 HA VAL 13 0.437 -4.006 10.340 120 HB VAL 13 HB VAL 13 -0.026 -4.041 12.759 121 HG11 VAL 13 HG11 VAL 13 0.553 -7.025 12.712 122 HG12 VAL 13 HG12 VAL 13 0.280 -6.004 14.135 123 HG13 VAL 13 HG13 VAL 13 -1.041 -6.288 12.994 124 HG21 VAL 13 HG21 VAL 13 2.292 -3.790 11.962 125 HG22 VAL 13 HG22 VAL 13 2.239 -4.666 13.501 126 HG23 VAL 13 HG23 VAL 13 2.511 -5.552 11.992 127 H LYS 14 H LYS 14 1.997 -5.023 9.176 128 HA LYS 14 HA LYS 14 1.997 -7.978 9.179 129 HB2 LYS 14 HB2 LYS 14 2.138 -6.357 6.616 130 HB3 LYS 14 HB3 LYS 14 2.623 -8.035 6.701 131 HG2 LYS 14 HG2 LYS 14 -0.154 -7.036 7.440 132 HG3 LYS 14 HG3 LYS 14 0.294 -7.690 5.873 133 HD2 LYS 14 HD2 LYS 14 0.846 -9.843 6.801 134 HD3 LYS 14 HD3 LYS 14 0.596 -9.311 8.455 135 HE2 LYS 14 HE2 LYS 14 -1.600 -9.192 6.373 136 HE3 LYS 14 HE3 LYS 14 -1.286 -10.631 7.367 137 HZ1 LYS 14 HZ1 LYS 14 -1.851 -7.950 8.505 138 HZ2 LYS 14 HZ2 LYS 14 -2.988 -9.104 8.299 139 HZ3 LYS 14 HZ3 LYS 14 -1.729 -9.351 9.340 140 HA PRO 15 HA PRO 15 5.997 -7.615 10.453 141 HB2 PRO 15 HB2 PRO 15 6.834 -10.194 10.473 142 HB3 PRO 15 HB3 PRO 15 5.393 -9.663 11.392 143 HG2 PRO 15 HG2 PRO 15 5.451 -10.923 8.614 144 HG3 PRO 15 HG3 PRO 15 4.486 -11.443 10.037 145 HD2 PRO 15 HD2 PRO 15 3.441 -9.820 8.138 146 HD3 PRO 15 HD3 PRO 15 3.059 -9.619 9.876 147 H ASP 16 H ASP 16 5.740 -8.646 7.132 148 HA ASP 16 HA ASP 16 8.404 -7.577 6.551 149 HB2 ASP 16 HB2 ASP 16 8.889 -9.941 7.073 150 HB3 ASP 16 HB3 ASP 16 7.676 -10.460 5.907 151 H VAL 17 H VAL 17 8.185 -6.321 4.809 152 HA VAL 17 HA VAL 17 6.453 -7.074 2.546 153 HB VAL 17 HB VAL 17 4.985 -5.820 4.109 154 HG11 VAL 17 HG11 VAL 17 5.211 -3.423 4.421 155 HG12 VAL 17 HG12 VAL 17 6.622 -4.260 5.085 156 HG13 VAL 17 HG13 VAL 17 6.743 -3.417 3.529 157 HG21 VAL 17 HG21 VAL 17 4.585 -5.819 1.657 158 HG22 VAL 17 HG22 VAL 17 3.996 -4.367 2.475 159 HG23 VAL 17 HG23 VAL 17 5.496 -4.293 1.537 160 H SER 18 H SER 18 6.985 -5.978 0.603 161 HA SER 18 HA SER 18 9.538 -4.439 0.621 162 HB2 SER 18 HB2 SER 18 10.272 -5.646 -1.355 163 HB3 SER 18 HB3 SER 18 10.058 -6.720 0.032 164 HG SER 18 HG SER 18 7.806 -6.977 -1.043 165 H VAL 19 H VAL 19 9.824 -2.875 -0.920 166 HA VAL 19 HA VAL 19 7.345 -1.966 -2.339 167 HB VAL 19 HB VAL 19 9.287 -0.391 -0.668 168 HG11 VAL 19 HG11 VAL 19 7.231 0.645 -2.645 169 HG12 VAL 19 HG12 VAL 19 7.977 1.634 -1.387 170 HG13 VAL 19 HG13 VAL 19 8.982 0.965 -2.658 171 HG21 VAL 19 HG21 VAL 19 7.340 -1.504 0.458 172 HG22 VAL 19 HG22 VAL 19 7.244 0.252 0.505 173 HG23 VAL 19 HG23 VAL 19 6.248 -0.652 -0.650 174 H TYR 20 H TYR 20 7.473 -1.139 -4.234 175 HA TYR 20 HA TYR 20 10.047 -1.113 -5.761 176 HB2 TYR 20 HB2 TYR 20 7.408 -2.323 -6.697 177 HB3 TYR 20 HB3 TYR 20 8.959 -2.356 -7.514 178 HD1 TYR 20 HD1 TYR 20 7.076 -3.589 -4.521 179 HD2 TYR 20 HD2 TYR 20 10.435 -4.228 -7.145 180 HE1 TYR 20 HE1 TYR 20 7.513 -5.777 -3.436 181 HE2 TYR 20 HE2 TYR 20 10.773 -6.489 -6.117 182 HH TYR 20 HH TYR 20 8.967 -7.501 -3.253 183 H ARG 21 H ARG 21 9.857 1.288 -5.534 184 HA ARG 21 HA ARG 21 7.572 2.738 -6.365 185 HB2 ARG 21 HB2 ARG 21 8.907 4.716 -6.358 186 HB3 ARG 21 HB3 ARG 21 9.313 3.703 -4.973 187 HG2 ARG 21 HG2 ARG 21 11.348 2.896 -6.228 188 HG3 ARG 21 HG3 ARG 21 10.976 4.071 -7.502 189 HD2 ARG 21 HD2 ARG 21 11.528 4.698 -4.568 190 HD3 ARG 21 HD3 ARG 21 12.668 4.903 -5.891 191 HE ARG 21 HE ARG 21 11.202 6.634 -6.851 192 HH11 ARG 21 HH11 ARG 21 10.344 8.639 -6.386 193 HH12 ARG 21 HH12 ARG 21 9.921 9.027 -4.729 194 HH21 ARG 21 HH21 ARG 21 10.656 5.993 -3.424 195 HH22 ARG 21 HH22 ARG 21 9.935 7.582 -3.188 196 H ILE 22 H ILE 22 6.912 3.812 -8.208 197 HA ILE 22 HA ILE 22 7.842 2.399 -10.664 198 HB ILE 22 HB ILE 22 5.573 2.088 -11.337 199 HG12 ILE 22 HG12 ILE 22 4.844 3.733 -8.897 200 HG13 ILE 22 HG13 ILE 22 4.384 3.989 -10.580 201 HG21 ILE 22 HG21 ILE 22 5.798 1.240 -8.467 202 HG22 ILE 22 HG22 ILE 22 4.949 0.417 -9.765 203 HG23 ILE 22 HG23 ILE 22 6.717 0.475 -9.785 204 HD11 ILE 22 HD11 ILE 22 3.340 1.877 -8.670 205 HD12 ILE 22 HD12 ILE 22 2.462 3.218 -9.422 206 HD13 ILE 22 HD13 ILE 22 3.017 1.857 -10.423 207 HA PRO 23 HA PRO 23 7.641 6.341 -12.745 208 HB2 PRO 23 HB2 PRO 23 7.965 5.492 -15.374 209 HB3 PRO 23 HB3 PRO 23 9.249 5.814 -14.179 210 HG2 PRO 23 HG2 PRO 23 8.165 3.183 -15.088 211 HG3 PRO 23 HG3 PRO 23 9.793 3.594 -14.504 212 HD2 PRO 23 HD2 PRO 23 7.797 2.323 -12.991 213 HD3 PRO 23 HD3 PRO 23 9.225 3.163 -12.327 214 HA PRO 24 HA PRO 24 3.828 5.874 -15.520 215 HB2 PRO 24 HB2 PRO 24 2.258 3.660 -15.633 216 HB3 PRO 24 HB3 PRO 24 3.801 3.786 -16.533 217 HG2 PRO 24 HG2 PRO 24 3.341 2.497 -13.814 218 HG3 PRO 24 HG3 PRO 24 4.136 1.777 -15.254 219 HD2 PRO 24 HD2 PRO 24 5.575 2.950 -13.287 220 HD3 PRO 24 HD3 PRO 24 6.038 3.141 -15.002 221 H ARG 25 H ARG 25 1.594 6.314 -15.255 222 HA ARG 25 HA ARG 25 0.425 6.034 -12.498 223 HB2 ARG 25 HB2 ARG 25 -0.759 8.090 -12.810 224 HB3 ARG 25 HB3 ARG 25 0.968 8.370 -13.024 225 HG2 ARG 25 HG2 ARG 25 0.700 8.452 -15.468 226 HG3 ARG 25 HG3 ARG 25 -1.015 8.022 -15.330 227 HD2 ARG 25 HD2 ARG 25 -1.484 10.070 -14.097 228 HD3 ARG 25 HD3 ARG 25 0.217 10.540 -14.138 229 HE ARG 25 HE ARG 25 -1.756 10.675 -16.322 230 HH11 ARG 25 HH11 ARG 25 -1.243 11.737 -18.195 231 HH12 ARG 25 HH12 ARG 25 0.407 12.178 -18.525 232 HH21 ARG 25 HH21 ARG 25 1.678 10.870 -15.623 233 HH22 ARG 25 HH22 ARG 25 2.019 11.703 -17.114 234 H ALA 26 H ALA 26 -0.201 5.464 -15.877 235 HA ALA 26 HA ALA 26 -2.590 3.909 -15.215 236 HB1 ALA 26 HB1 ALA 26 -2.814 6.542 -16.747 237 HB2 ALA 26 HB2 ALA 26 -4.122 5.349 -16.504 238 HB3 ALA 26 HB3 ALA 26 -3.437 6.230 -15.119 239 H SER 27 H SER 27 -1.930 2.197 -16.225 240 HA SER 27 HA SER 27 -1.625 2.256 -19.198 241 HB2 SER 27 HB2 SER 27 0.080 0.935 -18.058 242 HB3 SER 27 HB3 SER 27 -1.172 -0.023 -17.242 243 HG SER 27 HG SER 27 -0.163 -0.802 -19.346 244 H ASN 28 H ASN 28 -2.909 0.704 -20.346 245 HA ASN 28 HA ASN 28 -5.681 0.967 -20.029 246 HB2 ASN 28 HB2 ASN 28 -5.824 -0.386 -21.968 247 HB3 ASN 28 HB3 ASN 28 -4.338 0.536 -22.131 248 HD21 ASN 28 HD21 ASN 28 -2.356 -2.567 -21.578 249 HD22 ASN 28 HD22 ASN 28 -2.378 -1.013 -20.779 250 H ARG 29 H ARG 29 -3.633 -1.458 -18.556 251 HA ARG 29 HA ARG 29 -6.025 -3.000 -17.589 252 HB2 ARG 29 HB2 ARG 29 -3.127 -3.830 -17.277 253 HB3 ARG 29 HB3 ARG 29 -4.573 -4.822 -17.110 254 HG2 ARG 29 HG2 ARG 29 -3.351 -3.725 -19.650 255 HG3 ARG 29 HG3 ARG 29 -3.445 -5.411 -19.146 256 HD2 ARG 29 HD2 ARG 29 -5.950 -5.303 -19.355 257 HD3 ARG 29 HD3 ARG 29 -5.796 -3.629 -19.901 258 HE ARG 29 HE ARG 29 -4.961 -4.268 -21.946 259 HH11 ARG 29 HH11 ARG 29 -4.751 -5.633 -23.655 260 HH12 ARG 29 HH12 ARG 29 -4.838 -7.357 -23.430 261 HH21 ARG 29 HH21 ARG 29 -5.355 -7.194 -20.039 262 HH22 ARG 29 HH22 ARG 29 -5.174 -8.225 -21.431 263 H GLY 30 H GLY 30 -4.181 -0.495 -16.560 264 HA2 GLY 30 HA2 GLY 30 -4.685 0.363 -14.272 265 HA3 GLY 30 HA3 GLY 30 -4.292 -1.257 -13.661 266 H TYR 31 H TYR 31 -2.217 -1.687 -13.149 267 HA TYR 31 HA TYR 31 -0.043 0.228 -13.995 268 HB2 TYR 31 HB2 TYR 31 -0.603 -1.079 -11.316 269 HB3 TYR 31 HB3 TYR 31 0.966 -0.419 -11.742 270 HD1 TYR 31 HD1 TYR 31 -2.487 0.417 -10.873 271 HD2 TYR 31 HD2 TYR 31 1.363 1.927 -12.104 272 HE1 TYR 31 HE1 TYR 31 -3.122 2.694 -10.045 273 HE2 TYR 31 HE2 TYR 31 0.746 4.195 -11.235 274 HH TYR 31 HH TYR 31 -2.420 4.848 -9.704 275 H ARG 32 H ARG 32 -0.871 -3.133 -13.388 276 HA ARG 32 HA ARG 32 0.174 -5.087 -13.372 277 HB2 ARG 32 HB2 ARG 32 1.898 -4.244 -15.666 278 HB3 ARG 32 HB3 ARG 32 1.015 -5.734 -15.366 279 HG2 ARG 32 HG2 ARG 32 -0.323 -5.015 -17.012 280 HG3 ARG 32 HG3 ARG 32 -1.055 -3.999 -15.785 281 HD2 ARG 32 HD2 ARG 32 -0.670 -2.567 -17.613 282 HD3 ARG 32 HD3 ARG 32 0.560 -2.164 -16.416 283 HE ARG 32 HE ARG 32 2.187 -2.700 -17.913 284 HH11 ARG 32 HH11 ARG 32 3.103 -3.175 -19.774 285 HH12 ARG 32 HH12 ARG 32 2.259 -4.138 -20.974 286 HH21 ARG 32 HH21 ARG 32 -0.644 -4.373 -19.139 287 HH22 ARG 32 HH22 ARG 32 0.173 -4.793 -20.620 288 H ALA 33 H ALA 33 1.366 -5.454 -11.557 289 HA ALA 33 HA ALA 33 4.219 -4.801 -11.376 290 HB1 ALA 33 HB1 ALA 33 3.108 -5.322 -9.310 291 HB2 ALA 33 HB2 ALA 33 2.508 -6.872 -9.951 292 HB3 ALA 33 HB3 ALA 33 4.241 -6.625 -9.687 293 H SER 34 H SER 34 4.599 -5.196 -13.512 294 HA SER 34 HA SER 34 5.752 -7.697 -14.318 295 HB2 SER 34 HB2 SER 34 3.320 -8.225 -14.680 296 HB3 SER 34 HB3 SER 34 3.166 -6.769 -15.675 297 HG SER 34 HG SER 34 3.458 -8.489 -17.032 298 H ASP 35 H ASP 35 4.303 -4.530 -15.198 299 HA ASP 35 HA ASP 35 6.041 -3.949 -17.439 300 HB2 ASP 35 HB2 ASP 35 3.638 -3.129 -16.799 301 HB3 ASP 35 HB3 ASP 35 4.456 -1.953 -15.785 302 H TRP 36 H TRP 36 6.197 -3.448 -13.968 303 HA TRP 36 HA TRP 36 8.813 -2.059 -14.155 304 HB2 TRP 36 HB2 TRP 36 8.087 -1.245 -11.761 305 HB3 TRP 36 HB3 TRP 36 7.646 -0.381 -13.218 306 HD1 TRP 36 HD1 TRP 36 5.165 -0.372 -13.986 307 HE1 TRP 36 HE1 TRP 36 2.943 -0.955 -12.891 308 HE3 TRP 36 HE3 TRP 36 6.933 -2.717 -9.796 309 HZ2 TRP 36 HZ2 TRP 36 2.055 -1.877 -10.282 310 HZ3 TRP 36 HZ3 TRP 36 5.370 -3.422 -8.003 311 HH2 TRP 36 HH2 TRP 36 2.934 -2.975 -8.213 312 H LYS 37 H LYS 37 10.081 -2.476 -12.083 313 HA LYS 37 HA LYS 37 10.777 -5.179 -11.657 314 HB2 LYS 37 HB2 LYS 37 11.098 -2.687 -9.938 315 HB3 LYS 37 HB3 LYS 37 11.706 -4.275 -9.446 316 HG2 LYS 37 HG2 LYS 37 13.021 -4.486 -11.493 317 HG3 LYS 37 HG3 LYS 37 12.446 -2.910 -12.071 318 HD2 LYS 37 HD2 LYS 37 13.632 -1.731 -10.336 319 HD3 LYS 37 HD3 LYS 37 13.889 -3.213 -9.413 320 HE2 LYS 37 HE2 LYS 37 15.974 -2.780 -10.415 321 HE3 LYS 37 HE3 LYS 37 15.255 -4.128 -11.305 322 HZ1 LYS 37 HZ1 LYS 37 16.223 -2.462 -12.799 323 HZ2 LYS 37 HZ2 LYS 37 14.615 -2.540 -13.050 324 HZ3 LYS 37 HZ3 LYS 37 15.256 -1.290 -12.211 325 H LEU 38 H LEU 38 9.393 -6.708 -11.103 326 HA LEU 38 HA LEU 38 7.586 -6.349 -8.773 327 HB2 LEU 38 HB2 LEU 38 6.210 -7.989 -9.592 328 HB3 LEU 38 HB3 LEU 38 6.638 -7.044 -10.998 329 HG LEU 38 HG LEU 38 7.853 -9.758 -10.261 330 HD11 LEU 38 HD11 LEU 38 5.906 -9.124 -12.484 331 HD12 LEU 38 HD12 LEU 38 6.499 -10.702 -11.973 332 HD13 LEU 38 HD13 LEU 38 5.388 -9.787 -10.928 333 HD21 LEU 38 HD21 LEU 38 8.150 -8.002 -12.733 334 HD22 LEU 38 HD22 LEU 38 9.443 -8.575 -11.645 335 HD23 LEU 38 HD23 LEU 38 8.593 -9.716 -12.684 336 H ASP 39 H ASP 39 10.583 -7.351 -9.353 337 HA ASP 39 HA ASP 39 10.742 -9.695 -7.529 338 HB2 ASP 39 HB2 ASP 39 12.309 -10.563 -9.178 339 HB3 ASP 39 HB3 ASP 39 10.783 -10.170 -9.963 340 H GLN 40 H GLN 40 12.085 -6.589 -8.315 341 HA GLN 40 HA GLN 40 14.474 -6.971 -6.546 342 HB2 GLN 40 HB2 GLN 40 14.116 -5.519 -9.174 343 HB3 GLN 40 HB3 GLN 40 15.487 -5.221 -8.094 344 HG2 GLN 40 HG2 GLN 40 16.294 -7.470 -8.335 345 HG3 GLN 40 HG3 GLN 40 14.802 -8.005 -9.103 346 HE21 GLN 40 HE21 GLN 40 15.889 -7.172 -12.348 347 HE22 GLN 40 HE22 GLN 40 14.730 -8.035 -11.322 348 HA PRO 41 HA PRO 41 11.850 -3.771 -4.560 349 HB2 PRO 41 HB2 PRO 41 13.638 -4.395 -2.225 350 HB3 PRO 41 HB3 PRO 41 11.860 -4.218 -2.273 351 HG2 PRO 41 HG2 PRO 41 13.015 -6.677 -2.127 352 HG3 PRO 41 HG3 PRO 41 11.597 -6.401 -3.185 353 HD2 PRO 41 HD2 PRO 41 14.521 -6.490 -3.963 354 HD3 PRO 41 HD3 PRO 41 13.110 -7.261 -4.750 355 H ASP 42 H ASP 42 12.156 -1.684 -3.826 356 HA ASP 42 HA ASP 42 14.888 -0.478 -3.974 357 HB2 ASP 42 HB2 ASP 42 13.123 0.495 -5.430 358 HB3 ASP 42 HB3 ASP 42 12.131 0.812 -4.007 359 H TRP 43 H TRP 43 12.207 -1.179 -1.814 360 HA TRP 43 HA TRP 43 13.901 -0.586 0.523 361 HB2 TRP 43 HB2 TRP 43 12.714 1.515 0.239 362 HB3 TRP 43 HB3 TRP 43 11.183 0.684 0.045 363 HD1 TRP 43 HD1 TRP 43 13.548 1.979 2.674 364 HE1 TRP 43 HE1 TRP 43 12.471 1.807 4.999 365 HE3 TRP 43 HE3 TRP 43 9.485 -0.893 1.481 366 HZ2 TRP 43 HZ2 TRP 43 10.044 0.721 6.146 367 HZ3 TRP 43 HZ3 TRP 43 7.806 -1.488 3.209 368 HH2 TRP 43 HH2 TRP 43 8.063 -0.663 5.536 369 H THR 44 H THR 44 13.294 -1.768 2.392 370 HA THR 44 HA THR 44 10.930 -3.529 2.306 371 HB THR 44 HB THR 44 12.260 -5.430 3.155 372 HG1 THR 44 HG1 THR 44 14.513 -5.399 2.863 373 HG21 THR 44 HG21 THR 44 11.727 -5.284 0.727 374 HG22 THR 44 HG22 THR 44 13.314 -4.541 0.434 375 HG23 THR 44 HG23 THR 44 13.200 -6.204 1.062 376 H GLY 45 H GLY 45 10.133 -4.171 4.252 377 HA2 GLY 45 HA2 GLY 45 11.220 -3.631 6.816 378 HA3 GLY 45 HA3 GLY 45 10.352 -2.193 6.292 379 H ARG 46 H ARG 46 8.528 -2.142 7.312 380 HA ARG 46 HA ARG 46 6.681 -4.495 7.488 381 HB2 ARG 46 HB2 ARG 46 7.669 -2.718 9.762 382 HB3 ARG 46 HB3 ARG 46 6.152 -3.631 9.857 383 HG2 ARG 46 HG2 ARG 46 7.386 -5.697 9.251 384 HG3 ARG 46 HG3 ARG 46 8.916 -4.818 9.385 385 HD2 ARG 46 HD2 ARG 46 8.499 -4.400 11.755 386 HD3 ARG 46 HD3 ARG 46 6.882 -5.129 11.634 387 HE ARG 46 HE ARG 46 8.533 -7.119 10.689 388 HH11 ARG 46 HH11 ARG 46 9.412 -8.771 11.839 389 HH12 ARG 46 HH12 ARG 46 9.683 -8.611 13.550 390 HH21 ARG 46 HH21 ARG 46 8.480 -5.400 13.749 391 HH22 ARG 46 HH22 ARG 46 9.180 -6.742 14.611 392 H LEU 47 H LEU 47 4.538 -4.005 8.068 393 HA LEU 47 HA LEU 47 3.526 -1.481 6.795 394 HB2 LEU 47 HB2 LEU 47 3.029 -3.630 5.616 395 HB3 LEU 47 HB3 LEU 47 2.367 -4.256 7.116 396 HG LEU 47 HG LEU 47 0.663 -2.244 6.945 397 HD11 LEU 47 HD11 LEU 47 0.128 -1.608 4.674 398 HD12 LEU 47 HD12 LEU 47 1.777 -1.106 5.070 399 HD13 LEU 47 HD13 LEU 47 1.510 -2.536 4.045 400 HD21 LEU 47 HD21 LEU 47 -0.839 -3.685 5.647 401 HD22 LEU 47 HD22 LEU 47 0.545 -4.682 5.148 402 HD23 LEU 47 HD23 LEU 47 0.058 -4.595 6.853 403 H ARG 48 H ARG 48 2.244 -0.167 7.968 404 HA ARG 48 HA ARG 48 0.489 -1.379 10.031 405 HB2 ARG 48 HB2 ARG 48 2.194 1.089 10.379 406 HB3 ARG 48 HB3 ARG 48 0.567 1.115 11.042 407 HG2 ARG 48 HG2 ARG 48 2.618 -1.030 11.729 408 HG3 ARG 48 HG3 ARG 48 2.314 0.433 12.675 409 HD2 ARG 48 HD2 ARG 48 -0.123 -0.281 12.867 410 HD3 ARG 48 HD3 ARG 48 0.331 -1.808 12.126 411 HE ARG 48 HE ARG 48 1.493 -2.457 14.054 412 HH11 ARG 48 HH11 ARG 48 1.831 -2.468 16.244 413 HH12 ARG 48 HH12 ARG 48 1.442 -1.062 17.188 414 HH21 ARG 48 HH21 ARG 48 0.337 0.817 14.549 415 HH22 ARG 48 HH22 ARG 48 0.619 0.744 16.265 416 H ILE 49 H ILE 49 -1.533 -1.181 9.437 417 HA ILE 49 HA ILE 49 -2.351 1.151 7.728 418 HB ILE 49 HB ILE 49 -3.800 -1.479 8.056 419 HG12 ILE 49 HG12 ILE 49 -2.163 -0.342 5.735 420 HG13 ILE 49 HG13 ILE 49 -1.764 -1.759 6.707 421 HG21 ILE 49 HG21 ILE 49 -5.348 -0.666 6.404 422 HG22 ILE 49 HG22 ILE 49 -5.279 0.517 7.696 423 HG23 ILE 49 HG23 ILE 49 -4.408 0.833 6.182 424 HD11 ILE 49 HD11 ILE 49 -2.620 -2.534 4.637 425 HD12 ILE 49 HD12 ILE 49 -3.845 -2.879 5.856 426 HD13 ILE 49 HD13 ILE 49 -4.055 -1.508 4.728 427 H THR 50 H THR 50 -3.441 2.661 8.714 428 HA THR 50 HA THR 50 -5.030 2.045 11.161 429 HB THR 50 HB THR 50 -4.355 4.210 12.096 430 HG1 THR 50 HG1 THR 50 -2.617 5.329 11.109 431 HG21 THR 50 HG21 THR 50 -2.086 3.693 12.771 432 HG22 THR 50 HG22 THR 50 -3.023 2.197 12.724 433 HG23 THR 50 HG23 THR 50 -1.884 2.563 11.413 434 H SER 51 H SER 51 -6.718 3.776 11.581 435 HA SER 51 HA SER 51 -7.446 5.408 9.243 436 HB2 SER 51 HB2 SER 51 -9.771 4.616 9.262 437 HB3 SER 51 HB3 SER 51 -8.621 3.370 8.771 438 HG SER 51 HG SER 51 -9.663 3.668 11.413 439 H LYS 52 H LYS 52 -7.819 7.362 9.909 440 HA LYS 52 HA LYS 52 -9.081 7.941 12.550 441 HB2 LYS 52 HB2 LYS 52 -7.035 9.144 11.877 442 HB3 LYS 52 HB3 LYS 52 -7.906 9.807 10.476 443 HG2 LYS 52 HG2 LYS 52 -9.612 10.665 12.310 444 HG3 LYS 52 HG3 LYS 52 -8.286 10.363 13.423 445 HD2 LYS 52 HD2 LYS 52 -8.328 12.169 10.984 446 HD3 LYS 52 HD3 LYS 52 -8.227 12.673 12.694 447 HE2 LYS 52 HE2 LYS 52 -5.974 11.773 12.853 448 HE3 LYS 52 HE3 LYS 52 -6.077 11.102 11.220 449 HZ1 LYS 52 HZ1 LYS 52 -6.290 13.433 10.412 450 HZ2 LYS 52 HZ2 LYS 52 -6.077 13.979 11.959 451 HZ3 LYS 52 HZ3 LYS 52 -4.877 13.196 11.215 452 H GLY 53 H GLY 53 -10.933 6.801 11.816 453 HA2 GLY 53 HA2 GLY 53 -13.268 6.997 11.507 454 HA3 GLY 53 HA3 GLY 53 -13.039 8.602 10.813 455 H LYS 54 H LYS 54 -13.969 8.520 8.847 456 HA LYS 54 HA LYS 54 -13.970 6.206 7.076 457 HB2 LYS 54 HB2 LYS 54 -15.873 7.759 7.384 458 HB3 LYS 54 HB3 LYS 54 -14.940 9.071 6.689 459 HG2 LYS 54 HG2 LYS 54 -15.151 6.705 4.899 460 HG3 LYS 54 HG3 LYS 54 -16.712 7.350 5.390 461 HD2 LYS 54 HD2 LYS 54 -16.212 9.558 4.586 462 HD3 LYS 54 HD3 LYS 54 -14.544 9.112 4.194 463 HE2 LYS 54 HE2 LYS 54 -15.313 7.499 2.523 464 HE3 LYS 54 HE3 LYS 54 -17.006 7.808 2.954 465 HZ1 LYS 54 HZ1 LYS 54 -16.255 9.091 0.966 466 HZ2 LYS 54 HZ2 LYS 54 -16.732 10.090 2.167 467 HZ3 LYS 54 HZ3 LYS 54 -15.144 9.885 1.865 468 H THR 55 H THR 55 -11.355 7.326 7.766 469 HA THR 55 HA THR 55 -10.256 7.461 5.004 470 HB THR 55 HB THR 55 -9.144 9.137 7.278 471 HG1 THR 55 HG1 THR 55 -10.225 10.889 6.383 472 HG21 THR 55 HG21 THR 55 -9.011 9.236 4.219 473 HG22 THR 55 HG22 THR 55 -8.182 10.380 5.310 474 HG23 THR 55 HG23 THR 55 -7.708 8.670 5.288 475 H ALA 56 H ALA 56 -8.769 5.919 4.737 476 HA ALA 56 HA ALA 56 -7.440 4.684 7.093 477 HB1 ALA 56 HB1 ALA 56 -7.789 3.653 4.257 478 HB2 ALA 56 HB2 ALA 56 -6.831 2.855 5.521 479 HB3 ALA 56 HB3 ALA 56 -8.574 3.048 5.724 480 H TYR 57 H TYR 57 -5.172 4.360 7.041 481 HA TYR 57 HA TYR 57 -3.585 6.096 5.213 482 HB2 TYR 57 HB2 TYR 57 -3.371 5.915 8.237 483 HB3 TYR 57 HB3 TYR 57 -2.236 6.746 7.187 484 HD1 TYR 57 HD1 TYR 57 -2.770 8.917 6.203 485 HD2 TYR 57 HD2 TYR 57 -5.665 6.825 8.621 486 HE1 TYR 57 HE1 TYR 57 -4.177 10.969 6.305 487 HE2 TYR 57 HE2 TYR 57 -7.109 8.844 8.636 488 HH TYR 57 HH TYR 57 -6.124 11.912 7.078 489 H ILE 58 H ILE 58 -2.362 4.715 4.096 490 HA ILE 58 HA ILE 58 -1.437 2.155 5.287 491 HB ILE 58 HB ILE 58 -0.627 3.257 2.589 492 HG12 ILE 58 HG12 ILE 58 -3.059 3.200 2.509 493 HG13 ILE 58 HG13 ILE 58 -2.314 2.013 1.456 494 HG21 ILE 58 HG21 ILE 58 -0.629 0.498 3.829 495 HG22 ILE 58 HG22 ILE 58 -0.256 0.846 2.124 496 HG23 ILE 58 HG23 ILE 58 0.779 1.491 3.400 497 HD11 ILE 58 HD11 ILE 58 -4.300 1.145 2.590 498 HD12 ILE 58 HD12 ILE 58 -2.859 0.200 3.014 499 HD13 ILE 58 HD13 ILE 58 -3.528 1.377 4.172 500 H LYS 59 H LYS 59 0.092 2.551 6.820 501 HA LYS 59 HA LYS 59 2.367 4.383 6.175 502 HB2 LYS 59 HB2 LYS 59 1.596 3.124 8.825 503 HB3 LYS 59 HB3 LYS 59 2.910 4.263 8.547 504 HG2 LYS 59 HG2 LYS 59 1.229 5.960 7.748 505 HG3 LYS 59 HG3 LYS 59 -0.073 4.844 8.188 506 HD2 LYS 59 HD2 LYS 59 1.992 6.015 10.097 507 HD3 LYS 59 HD3 LYS 59 0.313 6.553 9.922 508 HE2 LYS 59 HE2 LYS 59 -0.524 4.377 10.655 509 HE3 LYS 59 HE3 LYS 59 1.141 3.747 10.789 510 HZ1 LYS 59 HZ1 LYS 59 1.510 5.568 12.454 511 HZ2 LYS 59 HZ2 LYS 59 -0.104 5.919 12.337 512 HZ3 LYS 59 HZ3 LYS 59 0.387 4.477 12.945 513 H LEU 60 H LEU 60 4.389 3.716 5.996 514 HA LEU 60 HA LEU 60 4.990 0.785 6.220 515 HB2 LEU 60 HB2 LEU 60 5.891 2.850 4.180 516 HB3 LEU 60 HB3 LEU 60 6.616 1.251 4.341 517 HG LEU 60 HG LEU 60 3.635 1.620 3.795 518 HD11 LEU 60 HD11 LEU 60 5.945 1.340 1.858 519 HD12 LEU 60 HD12 LEU 60 4.233 1.118 1.422 520 HD13 LEU 60 HD13 LEU 60 4.808 2.693 1.988 521 HD21 LEU 60 HD21 LEU 60 3.812 -0.695 2.959 522 HD22 LEU 60 HD22 LEU 60 5.540 -0.725 3.372 523 HD23 LEU 60 HD23 LEU 60 4.314 -0.613 4.650 524 H GLU 61 H GLU 61 6.675 0.243 7.438 525 HA GLU 61 HA GLU 61 8.160 2.437 8.823 526 HB2 GLU 61 HB2 GLU 61 6.703 0.108 10.121 527 HB3 GLU 61 HB3 GLU 61 7.621 1.382 10.936 528 HG2 GLU 61 HG2 GLU 61 5.991 3.064 9.959 529 HG3 GLU 61 HG3 GLU 61 5.000 1.700 9.416 530 H ASP 62 H ASP 62 10.115 1.829 9.971 531 HA ASP 62 HA ASP 62 11.682 -0.146 8.617 532 HB2 ASP 62 HB2 ASP 62 12.612 1.958 9.368 533 HB3 ASP 62 HB3 ASP 62 12.116 1.643 11.034 534 H LYS 63 H LYS 63 12.255 -2.150 9.211 535 HA LYS 63 HA LYS 63 10.553 -3.689 10.885 536 HB2 LYS 63 HB2 LYS 63 11.753 -4.405 8.826 537 HB3 LYS 63 HB3 LYS 63 13.283 -4.373 9.704 538 HG2 LYS 63 HG2 LYS 63 12.535 -6.196 11.151 539 HG3 LYS 63 HG3 LYS 63 10.920 -6.163 10.430 540 HD2 LYS 63 HD2 LYS 63 13.473 -6.766 8.882 541 HD3 LYS 63 HD3 LYS 63 12.464 -8.005 9.640 542 HE2 LYS 63 HE2 LYS 63 10.538 -7.371 8.257 543 HE3 LYS 63 HE3 LYS 63 11.459 -6.058 7.514 544 HZ1 LYS 63 HZ1 LYS 63 12.192 -8.927 7.308 545 HZ2 LYS 63 HZ2 LYS 63 11.425 -8.086 6.137 546 HZ3 LYS 63 HZ3 LYS 63 12.961 -7.692 6.560 547 H VAL 64 H VAL 64 13.228 -1.804 11.871 548 HA VAL 64 HA VAL 64 13.861 -3.525 14.225 549 HB VAL 64 HB VAL 64 15.567 -1.217 13.269 550 HG11 VAL 64 HG11 VAL 64 16.074 -2.275 15.434 551 HG12 VAL 64 HG12 VAL 64 16.211 -3.859 14.636 552 HG13 VAL 64 HG13 VAL 64 17.363 -2.557 14.259 553 HG21 VAL 64 HG21 VAL 64 15.337 -2.494 11.224 554 HG22 VAL 64 HG22 VAL 64 16.926 -2.807 11.920 555 HG23 VAL 64 HG23 VAL 64 15.637 -4.024 12.093 556 H SER 65 H SER 65 13.070 -0.199 13.220 557 HA SER 65 HA SER 65 12.714 0.492 16.108 558 HB2 SER 65 HB2 SER 65 13.866 2.173 13.857 559 HB3 SER 65 HB3 SER 65 13.585 2.741 15.516 560 HG SER 65 HG SER 65 15.751 2.033 15.172 561 H GLY 66 H GLY 66 10.867 0.158 13.339 562 HA2 GLY 66 HA2 GLY 66 8.726 0.789 12.860 563 HA3 GLY 66 HA3 GLY 66 8.610 1.528 14.458 564 H GLU 67 H GLU 67 11.177 2.769 12.485 565 HA GLU 67 HA GLU 67 10.004 5.426 12.477 566 HB2 GLU 67 HB2 GLU 67 12.530 4.359 11.151 567 HB3 GLU 67 HB3 GLU 67 12.053 6.061 11.227 568 HG2 GLU 67 HG2 GLU 67 12.048 5.918 13.732 569 HG3 GLU 67 HG3 GLU 67 12.657 4.265 13.613 570 H LEU 68 H LEU 68 9.128 6.633 10.797 571 HA LEU 68 HA LEU 68 7.741 5.053 8.854 572 HB2 LEU 68 HB2 LEU 68 6.866 7.098 10.094 573 HB3 LEU 68 HB3 LEU 68 7.880 8.080 9.039 574 HG LEU 68 HG LEU 68 6.618 6.950 7.061 575 HD11 LEU 68 HD11 LEU 68 5.553 5.109 8.352 576 HD12 LEU 68 HD12 LEU 68 4.684 6.303 9.334 577 HD13 LEU 68 HD13 LEU 68 4.342 6.151 7.598 578 HD21 LEU 68 HD21 LEU 68 4.759 8.502 7.207 579 HD22 LEU 68 HD22 LEU 68 5.051 8.740 8.953 580 HD23 LEU 68 HD23 LEU 68 6.250 9.285 7.755 581 H PHE 69 H PHE 69 8.219 4.538 6.872 582 HA PHE 69 HA PHE 69 10.375 5.838 5.277 583 HB2 PHE 69 HB2 PHE 69 10.469 3.490 5.267 584 HB3 PHE 69 HB3 PHE 69 8.731 3.316 5.082 585 HD1 PHE 69 HD1 PHE 69 11.406 5.181 3.149 586 HD2 PHE 69 HD2 PHE 69 8.149 2.358 3.070 587 HE1 PHE 69 HE1 PHE 69 11.611 5.008 0.697 588 HE2 PHE 69 HE2 PHE 69 8.388 2.142 0.633 589 HZ PHE 69 HZ PHE 69 10.084 3.491 -0.596 590 H ALA 70 H ALA 70 6.866 5.084 5.001 591 HA ALA 70 HA ALA 70 6.366 7.582 3.541 592 HB1 ALA 70 HB1 ALA 70 7.077 6.051 1.726 593 HB2 ALA 70 HB2 ALA 70 5.883 4.848 2.259 594 HB3 ALA 70 HB3 ALA 70 5.347 6.407 1.608 595 H GLN 71 H GLN 71 4.099 8.035 3.289 596 HA GLN 71 HA GLN 71 2.204 6.142 4.478 597 HB2 GLN 71 HB2 GLN 71 0.978 7.804 5.729 598 HB3 GLN 71 HB3 GLN 71 2.616 7.608 6.342 599 HG2 GLN 71 HG2 GLN 71 3.313 9.717 5.268 600 HG3 GLN 71 HG3 GLN 71 1.720 9.899 4.528 601 HE21 GLN 71 HE21 GLN 71 2.177 10.909 8.463 602 HE22 GLN 71 HE22 GLN 71 3.495 10.109 7.622 603 H ALA 72 H ALA 72 0.302 5.970 3.400 604 HA ALA 72 HA ALA 72 -0.279 7.920 1.207 605 HB1 ALA 72 HB1 ALA 72 -0.884 4.955 1.355 606 HB2 ALA 72 HB2 ALA 72 -1.479 6.041 0.106 607 HB3 ALA 72 HB3 ALA 72 0.260 5.773 0.263 608 HA PRO 73 HA PRO 73 -4.178 8.210 3.634 609 HB2 PRO 73 HB2 PRO 73 -5.120 10.566 2.675 610 HB3 PRO 73 HB3 PRO 73 -3.759 10.473 3.833 611 HG2 PRO 73 HG2 PRO 73 -3.627 10.849 0.835 612 HG3 PRO 73 HG3 PRO 73 -2.713 11.710 2.106 613 HD2 PRO 73 HD2 PRO 73 -1.728 9.550 0.665 614 HD3 PRO 73 HD3 PRO 73 -1.186 9.964 2.318 615 H VAL 74 H VAL 74 -5.886 7.042 3.102 616 HA VAL 74 HA VAL 74 -6.892 6.846 0.285 617 HB VAL 74 HB VAL 74 -6.873 4.723 2.467 618 HG11 VAL 74 HG11 VAL 74 -7.751 4.509 -0.425 619 HG12 VAL 74 HG12 VAL 74 -7.664 3.179 0.757 620 HG13 VAL 74 HG13 VAL 74 -8.818 4.473 0.998 621 HG21 VAL 74 HG21 VAL 74 -4.591 5.045 1.524 622 HG22 VAL 74 HG22 VAL 74 -5.295 3.448 1.260 623 HG23 VAL 74 HG23 VAL 74 -5.248 4.605 -0.067 624 H GLU 75 H GLU 75 -9.012 7.486 0.031 625 HA GLU 75 HA GLU 75 -10.800 7.418 2.426 626 HB2 GLU 75 HB2 GLU 75 -9.966 9.734 1.393 627 HB3 GLU 75 HB3 GLU 75 -11.285 9.421 0.259 628 HG2 GLU 75 HG2 GLU 75 -12.674 8.945 2.481 629 HG3 GLU 75 HG3 GLU 75 -11.365 9.809 3.271 630 H GLN 76 H GLN 76 -10.290 5.700 -0.221 631 HA GLN 76 HA GLN 76 -12.937 4.656 -0.312 632 HB2 GLN 76 HB2 GLN 76 -13.471 4.959 -2.608 633 HB3 GLN 76 HB3 GLN 76 -13.176 6.553 -1.942 634 HG2 GLN 76 HG2 GLN 76 -11.320 4.959 -3.758 635 HG3 GLN 76 HG3 GLN 76 -12.306 6.329 -4.212 636 HE21 GLN 76 HE21 GLN 76 -8.666 6.996 -2.514 637 HE22 GLN 76 HE22 GLN 76 -9.365 5.362 -2.465 638 H TYR 77 H TYR 77 -12.917 2.527 -1.011 639 HA TYR 77 HA TYR 77 -10.373 1.445 -2.095 640 HB2 TYR 77 HB2 TYR 77 -10.529 1.001 0.289 641 HB3 TYR 77 HB3 TYR 77 -12.037 0.084 0.037 642 HD1 TYR 77 HD1 TYR 77 -11.843 -2.278 -0.849 643 HD2 TYR 77 HD2 TYR 77 -8.512 0.398 -0.712 644 HE1 TYR 77 HE1 TYR 77 -10.348 -4.105 -1.626 645 HE2 TYR 77 HE2 TYR 77 -6.993 -1.385 -1.542 646 HH TYR 77 HH TYR 77 -8.250 -4.711 -2.164 647 HA PRO 78 HA PRO 78 -9.488 0.259 -3.622 648 HB2 PRO 78 HB2 PRO 78 -10.335 -0.057 -6.479 649 HB3 PRO 78 HB3 PRO 78 -8.936 -0.774 -5.619 650 HG2 PRO 78 HG2 PRO 78 -11.109 -2.291 -6.180 651 HG3 PRO 78 HG3 PRO 78 -10.335 -2.410 -4.562 652 HD2 PRO 78 HD2 PRO 78 -12.765 -0.758 -5.355 653 HD3 PRO 78 HD3 PRO 78 -12.581 -1.891 -3.979 654 H GLY 79 H GLY 79 -8.295 1.948 -4.907 655 HA2 GLY 79 HA2 GLY 79 -9.778 4.022 -6.337 656 HA3 GLY 79 HA3 GLY 79 -9.203 4.542 -4.752 657 H ILE 80 H ILE 80 -7.944 6.141 -5.935 658 HA ILE 80 HA ILE 80 -5.656 5.258 -7.533 659 HB ILE 80 HB ILE 80 -6.768 7.403 -7.938 660 HG12 ILE 80 HG12 ILE 80 -4.838 8.859 -8.179 661 HG13 ILE 80 HG13 ILE 80 -3.914 7.926 -7.008 662 HG21 ILE 80 HG21 ILE 80 -5.607 8.371 -5.283 663 HG22 ILE 80 HG22 ILE 80 -6.474 9.344 -6.475 664 HG23 ILE 80 HG23 ILE 80 -7.337 8.075 -5.602 665 HD11 ILE 80 HD11 ILE 80 -3.800 6.026 -8.546 666 HD12 ILE 80 HD12 ILE 80 -4.884 6.856 -9.695 667 HD13 ILE 80 HD13 ILE 80 -3.257 7.494 -9.365 668 H ALA 81 H ALA 81 -6.372 5.891 -4.156 669 HA ALA 81 HA ALA 81 -3.562 6.017 -3.484 670 HB1 ALA 81 HB1 ALA 81 -6.003 6.063 -1.674 671 HB2 ALA 81 HB2 ALA 81 -4.313 6.408 -1.200 672 HB3 ALA 81 HB3 ALA 81 -5.170 7.492 -2.326 673 H VAL 82 H VAL 82 -5.972 3.394 -3.430 674 HA VAL 82 HA VAL 82 -3.585 1.678 -3.207 675 HB VAL 82 HB VAL 82 -4.393 1.811 -0.955 676 HG11 VAL 82 HG11 VAL 82 -7.075 1.051 -2.010 677 HG12 VAL 82 HG12 VAL 82 -6.584 1.183 -0.290 678 HG13 VAL 82 HG13 VAL 82 -6.621 2.603 -1.306 679 HG21 VAL 82 HG21 VAL 82 -3.502 -0.295 -1.747 680 HG22 VAL 82 HG22 VAL 82 -4.795 -0.574 -0.571 681 HG23 VAL 82 HG23 VAL 82 -5.087 -0.818 -2.310 682 H GLU 83 H GLU 83 -3.573 0.402 -4.877 683 HA GLU 83 HA GLU 83 -6.084 -0.650 -6.123 684 HB2 GLU 83 HB2 GLU 83 -4.433 1.400 -7.195 685 HB3 GLU 83 HB3 GLU 83 -3.954 -0.050 -8.063 686 HG2 GLU 83 HG2 GLU 83 -6.837 0.896 -7.753 687 HG3 GLU 83 HG3 GLU 83 -5.792 1.331 -9.105 688 H THR 84 H THR 84 -5.847 -2.593 -7.368 689 HA THR 84 HA THR 84 -3.446 -4.233 -6.576 690 HB THR 84 HB THR 84 -5.993 -5.401 -7.559 691 HG1 THR 84 HG1 THR 84 -6.183 -4.132 -5.495 692 HG21 THR 84 HG21 THR 84 -3.714 -6.429 -5.851 693 HG22 THR 84 HG22 THR 84 -5.102 -7.390 -6.429 694 HG23 THR 84 HG23 THR 84 -3.939 -6.753 -7.582 695 H VAL 85 H VAL 85 -2.445 -3.132 -8.140 696 HA VAL 85 HA VAL 85 -1.401 -2.936 -10.237 697 HB VAL 85 HB VAL 85 -0.401 -5.264 -10.613 698 HG11 VAL 85 HG11 VAL 85 -0.166 -3.853 -7.920 699 HG12 VAL 85 HG12 VAL 85 1.029 -4.949 -8.627 700 HG13 VAL 85 HG13 VAL 85 0.681 -3.412 -9.417 701 HG21 VAL 85 HG21 VAL 85 -2.232 -6.554 -9.344 702 HG22 VAL 85 HG22 VAL 85 -0.563 -6.899 -8.906 703 HG23 VAL 85 HG23 VAL 85 -1.553 -5.861 -7.869 704 H THR 86 H THR 86 -3.060 -6.000 -10.777 705 HA THR 86 HA THR 86 -4.612 -4.796 -12.886 706 HB THR 86 HB THR 86 -4.500 -6.811 -14.375 707 HG1 THR 86 HG1 THR 86 -2.726 -8.129 -14.232 708 HG21 THR 86 HG21 THR 86 -1.776 -5.524 -14.071 709 HG22 THR 86 HG22 THR 86 -2.523 -6.114 -15.575 710 HG23 THR 86 HG23 THR 86 -3.150 -4.646 -14.773 711 H ASP 87 H ASP 87 -3.850 -7.785 -11.194 712 HA ASP 87 HA ASP 87 -6.684 -8.026 -10.291 713 HB2 ASP 87 HB2 ASP 87 -6.571 -9.131 -12.532 714 HB3 ASP 87 HB3 ASP 87 -5.367 -10.250 -11.900 715 H SER 88 H SER 88 -3.725 -10.102 -10.362 716 HA SER 88 HA SER 88 -4.329 -11.266 -7.870 717 HB2 SER 88 HB2 SER 88 -2.541 -11.764 -9.827 718 HB3 SER 88 HB3 SER 88 -1.448 -11.250 -8.548 719 HG SER 88 HG SER 88 -2.018 -13.534 -8.584 720 H SER 89 H SER 89 -3.757 -10.988 -5.798 721 HA SER 89 HA SER 89 -1.856 -8.793 -5.131 722 HB2 SER 89 HB2 SER 89 -3.016 -8.658 -2.957 723 HB3 SER 89 HB3 SER 89 -3.868 -8.094 -4.397 724 HG SER 89 HG SER 89 -4.260 -10.598 -3.095 725 H ARG 90 H ARG 90 -0.290 -10.620 -5.672 726 HA ARG 90 HA ARG 90 0.835 -10.876 -2.906 727 HB2 ARG 90 HB2 ARG 90 1.953 -12.322 -4.536 728 HB3 ARG 90 HB3 ARG 90 2.182 -10.966 -5.650 729 HG2 ARG 90 HG2 ARG 90 3.682 -9.857 -4.055 730 HG3 ARG 90 HG3 ARG 90 3.368 -11.114 -2.844 731 HD2 ARG 90 HD2 ARG 90 4.525 -12.754 -4.273 732 HD3 ARG 90 HD3 ARG 90 4.746 -11.519 -5.526 733 HE ARG 90 HE ARG 90 5.834 -11.238 -2.731 734 HH11 ARG 90 HH11 ARG 90 7.676 -10.114 -2.456 735 HH12 ARG 90 HH12 ARG 90 8.613 -9.592 -3.833 736 HH21 ARG 90 HH21 ARG 90 6.519 -10.981 -6.158 737 HH22 ARG 90 HH22 ARG 90 7.955 -10.028 -5.890 738 H TYR 91 H TYR 91 0.209 -8.678 -5.555 739 HA TYR 91 HA TYR 91 1.872 -6.569 -4.324 740 HB2 TYR 91 HB2 TYR 91 0.896 -6.794 -7.181 741 HB3 TYR 91 HB3 TYR 91 2.128 -5.704 -6.582 742 HD1 TYR 91 HD1 TYR 91 4.365 -6.636 -5.859 743 HD2 TYR 91 HD2 TYR 91 1.408 -8.950 -7.984 744 HE1 TYR 91 HE1 TYR 91 6.137 -8.192 -6.637 745 HE2 TYR 91 HE2 TYR 91 3.164 -10.506 -8.766 746 HH TYR 91 HH TYR 91 6.642 -9.936 -8.016 747 H PHE 92 H PHE 92 1.338 -4.402 -4.668 748 HA PHE 92 HA PHE 92 -1.380 -3.627 -5.471 749 HB2 PHE 92 HB2 PHE 92 -0.221 -2.887 -2.750 750 HB3 PHE 92 HB3 PHE 92 -1.642 -2.141 -3.465 751 HD1 PHE 92 HD1 PHE 92 -3.740 -3.431 -3.833 752 HD2 PHE 92 HD2 PHE 92 -0.348 -5.088 -1.748 753 HE1 PHE 92 HE1 PHE 92 -5.176 -5.243 -2.956 754 HE2 PHE 92 HE2 PHE 92 -1.795 -6.886 -0.853 755 HZ PHE 92 HZ PHE 92 -4.197 -7.014 -1.502 756 H VAL 93 H VAL 93 -1.501 -1.178 -5.519 757 HA VAL 93 HA VAL 93 1.108 0.224 -5.625 758 HB VAL 93 HB VAL 93 -1.145 0.573 -7.642 759 HG11 VAL 93 HG11 VAL 93 1.342 2.280 -7.184 760 HG12 VAL 93 HG12 VAL 93 0.311 2.350 -8.624 761 HG13 VAL 93 HG13 VAL 93 -0.356 2.805 -7.063 762 HG21 VAL 93 HG21 VAL 93 0.687 0.121 -9.273 763 HG22 VAL 93 HG22 VAL 93 1.793 -0.200 -7.932 764 HG23 VAL 93 HG23 VAL 93 0.387 -1.253 -8.204 765 H ILE 94 H ILE 94 1.095 2.111 -4.450 766 HA ILE 94 HA ILE 94 -1.523 3.228 -3.637 767 HB ILE 94 HB ILE 94 -0.860 3.562 -1.335 768 HG12 ILE 94 HG12 ILE 94 1.664 1.928 -1.902 769 HG13 ILE 94 HG13 ILE 94 1.654 3.681 -1.803 770 HG21 ILE 94 HG21 ILE 94 -1.965 1.399 -1.982 771 HG22 ILE 94 HG22 ILE 94 -0.381 0.612 -1.986 772 HG23 ILE 94 HG23 ILE 94 -1.046 1.316 -0.499 773 HD11 ILE 94 HD11 ILE 94 0.894 1.782 0.435 774 HD12 ILE 94 HD12 ILE 94 2.339 2.804 0.346 775 HD13 ILE 94 HD13 ILE 94 0.734 3.536 0.517 776 H ARG 95 H ARG 95 -1.569 5.422 -3.115 777 HA ARG 95 HA ARG 95 0.673 7.034 -4.280 778 HB2 ARG 95 HB2 ARG 95 -0.742 8.790 -4.732 779 HB3 ARG 95 HB3 ARG 95 -1.604 7.335 -5.201 780 HG2 ARG 95 HG2 ARG 95 -3.335 8.342 -4.175 781 HG3 ARG 95 HG3 ARG 95 -2.622 7.617 -2.726 782 HD2 ARG 95 HD2 ARG 95 -1.438 9.746 -2.267 783 HD3 ARG 95 HD3 ARG 95 -2.283 10.469 -3.640 784 HE ARG 95 HE ARG 95 -3.561 9.323 -1.153 785 HH11 ARG 95 HH11 ARG 95 -5.535 9.913 -0.597 786 HH12 ARG 95 HH12 ARG 95 -6.387 11.175 -1.469 787 HH21 ARG 95 HH21 ARG 95 -3.897 11.599 -3.810 788 HH22 ARG 95 HH22 ARG 95 -5.486 12.079 -3.285 789 H ILE 96 H ILE 96 2.158 7.667 -2.934 790 HA ILE 96 HA ILE 96 1.508 8.119 -0.052 791 HB ILE 96 HB ILE 96 3.922 7.776 0.350 792 HG12 ILE 96 HG12 ILE 96 4.136 6.665 -2.468 793 HG13 ILE 96 HG13 ILE 96 4.588 8.335 -2.091 794 HG21 ILE 96 HG21 ILE 96 2.402 5.521 -0.968 795 HG22 ILE 96 HG22 ILE 96 3.859 5.290 0.016 796 HG23 ILE 96 HG23 ILE 96 2.411 5.967 0.752 797 HD11 ILE 96 HD11 ILE 96 6.211 7.538 -0.430 798 HD12 ILE 96 HD12 ILE 96 5.843 5.861 -0.896 799 HD13 ILE 96 HD13 ILE 96 6.551 6.984 -2.083 800 H GLN 97 H GLN 97 2.626 9.772 1.118 801 HA GLN 97 HA GLN 97 3.822 12.015 -0.428 802 HB2 GLN 97 HB2 GLN 97 3.370 11.479 2.511 803 HB3 GLN 97 HB3 GLN 97 4.711 12.504 1.997 804 HG2 GLN 97 HG2 GLN 97 2.982 13.797 0.561 805 HG3 GLN 97 HG3 GLN 97 1.750 12.972 1.531 806 HE21 GLN 97 HE21 GLN 97 4.294 15.730 3.312 807 HE22 GLN 97 HE22 GLN 97 4.823 14.841 1.884 808 H ASP 98 H ASP 98 5.980 12.144 -0.900 809 HA ASP 98 HA ASP 98 7.479 9.640 -0.518 810 HB2 ASP 98 HB2 ASP 98 7.054 10.906 -2.737 811 HB3 ASP 98 HB3 ASP 98 8.316 12.002 -2.181 812 H GLY 99 H GLY 99 7.200 12.093 1.448 813 HA2 GLY 99 HA2 GLY 99 8.366 12.568 3.383 814 HA3 GLY 99 HA3 GLY 99 9.668 11.509 2.844 815 H THR 100 H THR 100 9.262 13.714 0.391 816 HA THR 100 HA THR 100 11.387 15.537 1.437 817 HB THR 100 HB THR 100 12.235 15.640 -0.853 818 HG1 THR 100 HG1 THR 100 11.350 14.252 -2.386 819 HG21 THR 100 HG21 THR 100 13.125 13.405 -1.059 820 HG22 THR 100 HG22 THR 100 13.032 13.794 0.670 821 HG23 THR 100 HG23 THR 100 11.818 12.722 -0.072 822 H GLY 101 H GLY 101 8.323 15.880 1.302 823 HA2 GLY 101 HA2 GLY 101 7.059 17.868 1.278 824 HA3 GLY 101 HA3 GLY 101 8.294 18.676 0.310 825 H ARG 102 H ARG 102 7.312 15.539 -0.757 826 HA ARG 102 HA ARG 102 5.417 16.580 -2.814 827 HB2 ARG 102 HB2 ARG 102 6.654 15.682 -4.593 828 HB3 ARG 102 HB3 ARG 102 7.851 16.511 -3.577 829 HG2 ARG 102 HG2 ARG 102 8.411 14.254 -2.584 830 HG3 ARG 102 HG3 ARG 102 7.372 13.516 -3.817 831 HD2 ARG 102 HD2 ARG 102 8.738 14.552 -5.603 832 HD3 ARG 102 HD3 ARG 102 9.786 15.277 -4.365 833 HE ARG 102 HE ARG 102 9.564 12.367 -4.109 834 HH11 ARG 102 HH11 ARG 102 11.209 11.143 -4.370 835 HH12 ARG 102 HH12 ARG 102 12.668 11.664 -5.219 836 HH21 ARG 102 HH21 ARG 102 11.387 14.821 -5.846 837 HH22 ARG 102 HH22 ARG 102 12.749 13.749 -6.048 838 H SER 103 H SER 103 4.528 14.718 -4.156 839 HA SER 103 HA SER 103 4.075 12.279 -2.516 840 HB2 SER 103 HB2 SER 103 1.929 12.008 -3.735 841 HB3 SER 103 HB3 SER 103 1.994 13.469 -2.735 842 HG SER 103 HG SER 103 1.143 13.904 -4.823 843 H ALA 104 H ALA 104 3.757 10.290 -3.654 844 HA ALA 104 HA ALA 104 4.760 10.013 -6.405 845 HB1 ALA 104 HB1 ALA 104 6.507 8.391 -5.754 846 HB2 ALA 104 HB2 ALA 104 6.849 10.000 -5.095 847 HB3 ALA 104 HB3 ALA 104 6.190 8.728 -4.040 848 H PHE 105 H PHE 105 4.227 8.007 -7.375 849 HA PHE 105 HA PHE 105 2.415 6.236 -5.813 850 HB2 PHE 105 HB2 PHE 105 3.163 6.024 -8.733 851 HB3 PHE 105 HB3 PHE 105 1.896 5.152 -7.877 852 HD1 PHE 105 HD1 PHE 105 -0.053 6.556 -6.831 853 HD2 PHE 105 HD2 PHE 105 2.731 8.132 -9.729 854 HE1 PHE 105 HE1 PHE 105 -1.627 8.401 -7.356 855 HE2 PHE 105 HE2 PHE 105 1.177 9.993 -10.211 856 HZ PHE 105 HZ PHE 105 -1.032 10.119 -9.039 857 H ILE 106 H ILE 106 3.058 4.339 -5.024 858 HA ILE 106 HA ILE 106 5.549 3.104 -6.093 859 HB ILE 106 HB ILE 106 6.144 2.150 -3.951 860 HG12 ILE 106 HG12 ILE 106 4.038 4.009 -2.705 861 HG13 ILE 106 HG13 ILE 106 3.838 2.267 -2.871 862 HG21 ILE 106 HG21 ILE 106 5.916 5.188 -3.680 863 HG22 ILE 106 HG22 ILE 106 7.209 4.134 -3.064 864 HG23 ILE 106 HG23 ILE 106 7.025 4.408 -4.800 865 HD11 ILE 106 HD11 ILE 106 6.054 3.514 -1.215 866 HD12 ILE 106 HD12 ILE 106 4.497 2.943 -0.601 867 HD13 ILE 106 HD13 ILE 106 5.609 1.794 -1.344 868 H GLY 107 H GLY 107 5.585 0.988 -6.478 869 HA2 GLY 107 HA2 GLY 107 3.146 -0.626 -6.189 870 HA3 GLY 107 HA3 GLY 107 4.689 -1.116 -6.895 871 H ILE 108 H ILE 108 3.049 -2.384 -4.801 872 HA ILE 108 HA ILE 108 5.194 -2.698 -2.761 873 HB ILE 108 HB ILE 108 2.213 -3.026 -2.171 874 HG12 ILE 108 HG12 ILE 108 4.175 -0.748 -1.625 875 HG13 ILE 108 HG13 ILE 108 2.626 -0.662 -2.463 876 HG21 ILE 108 HG21 ILE 108 3.004 -3.288 0.159 877 HG22 ILE 108 HG22 ILE 108 3.703 -4.512 -0.855 878 HG23 ILE 108 HG23 ILE 108 4.688 -3.099 -0.395 879 HD11 ILE 108 HD11 ILE 108 3.050 -1.098 0.515 880 HD12 ILE 108 HD12 ILE 108 2.433 0.327 -0.294 881 HD13 ILE 108 HD13 ILE 108 1.464 -1.170 -0.312 882 H GLY 109 H GLY 109 5.635 -4.890 -2.240 883 HA2 GLY 109 HA2 GLY 109 3.904 -7.034 -3.330 884 HA3 GLY 109 HA3 GLY 109 5.633 -7.127 -3.665 885 H PHE 110 H PHE 110 3.489 -8.516 -1.808 886 HA PHE 110 HA PHE 110 4.831 -8.300 0.812 887 HB2 PHE 110 HB2 PHE 110 2.335 -9.627 -0.219 888 HB3 PHE 110 HB3 PHE 110 2.964 -10.029 1.359 889 HD1 PHE 110 HD1 PHE 110 1.832 -7.049 -0.657 890 HD2 PHE 110 HD2 PHE 110 2.715 -8.672 3.243 891 HE1 PHE 110 HE1 PHE 110 0.866 -5.025 0.412 892 HE2 PHE 110 HE2 PHE 110 1.670 -6.701 4.298 893 HZ PHE 110 HZ PHE 110 0.812 -4.838 2.880 894 H THR 111 H THR 111 5.260 -10.166 2.121 895 HA THR 111 HA THR 111 7.058 -12.033 0.810 896 HB THR 111 HB THR 111 7.216 -10.878 3.109 897 HG1 THR 111 HG1 THR 111 8.749 -12.163 3.452 898 HG21 THR 111 HG21 THR 111 5.728 -13.382 3.986 899 HG22 THR 111 HG22 THR 111 6.537 -12.213 5.034 900 HG23 THR 111 HG23 THR 111 5.122 -11.711 4.096 901 H ASP 112 H ASP 112 3.716 -12.073 1.718 902 HA ASP 112 HA ASP 112 3.411 -14.853 0.751 903 HB2 ASP 112 HB2 ASP 112 3.578 -14.710 3.331 904 HB3 ASP 112 HB3 ASP 112 2.010 -13.897 3.271 905 H ARG 113 H ARG 113 1.443 -15.319 -0.211 906 HA ARG 113 HA ARG 113 -0.126 -13.187 -1.377 907 HB2 ARG 113 HB2 ARG 113 -0.327 -16.220 -1.212 908 HB3 ARG 113 HB3 ARG 113 -1.639 -15.288 -1.928 909 HG2 ARG 113 HG2 ARG 113 1.214 -14.810 -2.848 910 HG3 ARG 113 HG3 ARG 113 0.309 -16.191 -3.468 911 HD2 ARG 113 HD2 ARG 113 -1.052 -13.498 -3.482 912 HD3 ARG 113 HD3 ARG 113 0.238 -13.777 -4.650 913 HE ARG 113 HE ARG 113 -2.282 -15.385 -4.426 914 HH11 ARG 113 HH11 ARG 113 -3.021 -16.393 -6.285 915 HH12 ARG 113 HH12 ARG 113 -2.064 -16.289 -7.760 916 HH21 ARG 113 HH21 ARG 113 0.347 -14.293 -6.496 917 HH22 ARG 113 HH22 ARG 113 -0.486 -14.914 -7.910 918 H GLY 114 H GLY 114 -0.630 -15.157 1.537 919 HA2 GLY 114 HA2 GLY 114 -3.348 -14.204 2.026 920 HA3 GLY 114 HA3 GLY 114 -2.270 -15.032 3.163 921 H ASP 115 H ASP 115 -0.062 -13.099 2.930 922 HA ASP 115 HA ASP 115 -0.935 -11.092 4.830 923 HB2 ASP 115 HB2 ASP 115 1.646 -11.402 3.281 924 HB3 ASP 115 HB3 ASP 115 1.334 -10.126 4.451 925 H ALA 116 H ALA 116 -0.265 -10.974 1.311 926 HA ALA 116 HA ALA 116 -1.045 -8.196 1.099 927 HB1 ALA 116 HB1 ALA 116 -0.563 -10.462 -0.853 928 HB2 ALA 116 HB2 ALA 116 -1.239 -8.909 -1.404 929 HB3 ALA 116 HB3 ALA 116 0.338 -8.948 -0.636 930 H PHE 117 H PHE 117 -2.906 -11.282 0.358 931 HA PHE 117 HA PHE 117 -5.264 -9.912 -0.336 932 HB2 PHE 117 HB2 PHE 117 -4.874 -12.336 -0.624 933 HB3 PHE 117 HB3 PHE 117 -5.089 -12.571 1.111 934 HD1 PHE 117 HD1 PHE 117 -6.808 -11.119 -1.915 935 HD2 PHE 117 HD2 PHE 117 -7.289 -12.974 1.949 936 HE1 PHE 117 HE1 PHE 117 -9.276 -11.098 -2.212 937 HE2 PHE 117 HE2 PHE 117 -9.749 -12.981 1.636 938 HZ PHE 117 HZ PHE 117 -10.739 -12.010 -0.420 939 H ASP 118 H ASP 118 -3.960 -10.362 2.933 940 HA ASP 118 HA ASP 118 -6.382 -9.399 4.243 941 HB2 ASP 118 HB2 ASP 118 -4.722 -11.039 5.212 942 HB3 ASP 118 HB3 ASP 118 -3.583 -9.695 5.363 943 H PHE 119 H PHE 119 -3.388 -7.898 2.989 944 HA PHE 119 HA PHE 119 -3.835 -5.285 4.087 945 HB2 PHE 119 HB2 PHE 119 -1.710 -5.817 3.132 946 HB3 PHE 119 HB3 PHE 119 -2.409 -6.296 1.609 947 HD1 PHE 119 HD1 PHE 119 -0.933 -3.565 3.382 948 HD2 PHE 119 HD2 PHE 119 -3.503 -4.551 0.103 949 HE1 PHE 119 HE1 PHE 119 -0.569 -1.329 2.442 950 HE2 PHE 119 HE2 PHE 119 -3.111 -2.311 -0.884 951 HZ PHE 119 HZ PHE 119 -1.659 -0.678 0.297 952 H ASN 120 H ASN 120 -5.173 -7.020 1.286 953 HA ASN 120 HA ASN 120 -6.890 -4.834 0.415 954 HB2 ASN 120 HB2 ASN 120 -6.531 -6.301 -1.278 955 HB3 ASN 120 HB3 ASN 120 -6.537 -7.730 -0.246 956 HD21 ASN 120 HD21 ASN 120 -9.934 -8.416 -0.766 957 HD22 ASN 120 HD22 ASN 120 -8.448 -8.878 0.059 958 H VAL 121 H VAL 121 -7.656 -7.810 2.386 959 HA VAL 121 HA VAL 121 -10.367 -6.999 2.672 960 HB VAL 121 HB VAL 121 -8.720 -9.011 4.231 961 HG11 VAL 121 HG11 VAL 121 -11.731 -8.548 4.396 962 HG12 VAL 121 HG12 VAL 121 -10.883 -9.979 5.022 963 HG13 VAL 121 HG13 VAL 121 -10.560 -8.399 5.728 964 HG21 VAL 121 HG21 VAL 121 -9.157 -9.588 1.868 965 HG22 VAL 121 HG22 VAL 121 -10.069 -10.645 2.934 966 HG23 VAL 121 HG23 VAL 121 -10.892 -9.308 2.101 967 H SER 122 H SER 122 -7.617 -6.274 4.817 968 HA SER 122 HA SER 122 -9.164 -5.084 6.920 969 HB2 SER 122 HB2 SER 122 -7.079 -3.826 7.452 970 HB3 SER 122 HB3 SER 122 -6.853 -5.581 7.319 971 HG SER 122 HG SER 122 -5.885 -5.334 5.386 972 H LEU 123 H LEU 123 -8.477 -3.914 3.699 973 HA LEU 123 HA LEU 123 -9.519 -1.209 4.348 974 HB2 LEU 123 HB2 LEU 123 -8.397 -2.368 1.782 975 HB3 LEU 123 HB3 LEU 123 -8.928 -0.702 2.001 976 HG LEU 123 HG LEU 123 -6.716 -1.959 3.680 977 HD11 LEU 123 HD11 LEU 123 -5.099 -0.992 2.259 978 HD12 LEU 123 HD12 LEU 123 -6.185 -1.911 1.220 979 HD13 LEU 123 HD13 LEU 123 -6.341 -0.145 1.310 980 HD21 LEU 123 HD21 LEU 123 -7.718 0.031 4.713 981 HD22 LEU 123 HD22 LEU 123 -6.093 0.386 4.128 982 HD23 LEU 123 HD23 LEU 123 -7.503 0.943 3.201 983 H GLN 124 H GLN 124 -10.463 -4.138 2.453 984 HA GLN 124 HA GLN 124 -12.925 -3.144 1.459 985 HB2 GLN 124 HB2 GLN 124 -12.359 -5.962 2.496 986 HB3 GLN 124 HB3 GLN 124 -13.788 -5.448 1.601 987 HG2 GLN 124 HG2 GLN 124 -12.218 -4.713 -0.274 988 HG3 GLN 124 HG3 GLN 124 -10.937 -5.583 0.575 989 HE21 GLN 124 HE21 GLN 124 -12.215 -7.944 -1.942 990 HE22 GLN 124 HE22 GLN 124 -11.011 -6.666 -1.687 991 H ASP 125 H ASP 125 -12.363 -4.791 4.632 992 HA ASP 125 HA ASP 125 -15.062 -4.323 5.537 993 HB2 ASP 125 HB2 ASP 125 -13.501 -6.189 6.234 994 HB3 ASP 125 HB3 ASP 125 -12.641 -4.994 7.217 995 H HIS 126 H HIS 126 -12.505 -2.145 5.263 996 HA HIS 126 HA HIS 126 -13.368 -0.427 7.528 997 HB2 HIS 126 HB2 HIS 126 -11.001 -0.528 7.168 998 HB3 HIS 126 HB3 HIS 126 -11.184 -0.076 5.468 999 HD2 HIS 126 HD2 HIS 126 -12.119 1.511 8.935 1000 HE1 HIS 126 HE1 HIS 126 -11.167 4.672 6.243 1001 HE2 HIS 126 HE2 HIS 126 -11.908 4.127 8.606 1002 H PHE 127 H PHE 127 -13.740 -0.632 4.003 1003 HA PHE 127 HA PHE 127 -15.253 1.936 4.035 1004 HB2 PHE 127 HB2 PHE 127 -14.032 0.363 1.783 1005 HB3 PHE 127 HB3 PHE 127 -15.147 1.707 1.537 1006 HD1 PHE 127 HD1 PHE 127 -14.617 3.982 2.642 1007 HD2 PHE 127 HD2 PHE 127 -11.709 0.834 2.292 1008 HE1 PHE 127 HE1 PHE 127 -12.796 5.620 3.006 1009 HE2 PHE 127 HE2 PHE 127 -9.880 2.468 2.612 1010 HZ PHE 127 HZ PHE 127 -10.422 4.873 2.956 1011 H LYS 128 H LYS 128 -15.788 -1.435 3.850 1012 HA LYS 128 HA LYS 128 -18.251 -2.012 2.870 1013 HB2 LYS 128 HB2 LYS 128 -16.813 -3.558 3.892 1014 HB3 LYS 128 HB3 LYS 128 -16.793 -2.716 5.434 1015 HG2 LYS 128 HG2 LYS 128 -19.214 -4.157 4.328 1016 HG3 LYS 128 HG3 LYS 128 -17.925 -4.904 5.289 1017 HD2 LYS 128 HD2 LYS 128 -18.523 -2.863 6.946 1018 HD3 LYS 128 HD3 LYS 128 -20.110 -3.060 6.200 1019 HE2 LYS 128 HE2 LYS 128 -18.444 -5.236 7.532 1020 HE3 LYS 128 HE3 LYS 128 -19.742 -4.339 8.323 1021 HZ1 LYS 128 HZ1 LYS 128 -20.550 -6.467 7.480 1022 HZ2 LYS 128 HZ2 LYS 128 -21.301 -5.261 6.679 1023 HZ3 LYS 128 HZ3 LYS 128 -20.103 -6.107 5.955 1024 H TRP 129 H TRP 129 -17.814 -0.274 5.951 1025 HA TRP 129 HA TRP 129 -20.765 -0.063 6.308 1026 HB2 TRP 129 HB2 TRP 129 -20.167 0.507 8.640 1027 HB3 TRP 129 HB3 TRP 129 -19.665 -1.084 8.116 1028 HD1 TRP 129 HD1 TRP 129 -17.054 -1.617 8.027 1029 HE1 TRP 129 HE1 TRP 129 -14.996 -0.426 8.828 1030 HE3 TRP 129 HE3 TRP 129 -19.138 2.937 9.024 1031 HZ2 TRP 129 HZ2 TRP 129 -14.260 2.252 9.769 1032 HZ3 TRP 129 HZ3 TRP 129 -17.717 4.832 9.813 1033 HH2 TRP 129 HH2 TRP 129 -15.277 4.500 10.168 1034 H VAL 130 H VAL 130 -18.742 1.759 4.682 1035 HA VAL 130 HA VAL 130 -20.127 4.341 5.210 1036 HB VAL 130 HB VAL 130 -17.621 5.243 4.598 1037 HG11 VAL 130 HG11 VAL 130 -18.909 4.789 7.315 1038 HG12 VAL 130 HG12 VAL 130 -17.548 5.881 7.021 1039 HG13 VAL 130 HG13 VAL 130 -19.117 6.201 6.261 1040 HG21 VAL 130 HG21 VAL 130 -15.974 4.320 6.010 1041 HG22 VAL 130 HG22 VAL 130 -17.086 3.088 6.634 1042 HG23 VAL 130 HG23 VAL 130 -16.595 3.060 4.936 1043 H LYS 131 H LYS 131 -18.638 5.671 3.163 1044 HA LYS 131 HA LYS 131 -18.768 6.153 0.973 1045 HB2 LYS 131 HB2 LYS 131 -18.162 3.184 0.960 1046 HB3 LYS 131 HB3 LYS 131 -18.414 3.966 -0.566 1047 HG2 LYS 131 HG2 LYS 131 -16.385 4.864 1.489 1048 HG3 LYS 131 HG3 LYS 131 -16.019 3.789 0.141 1049 HD2 LYS 131 HD2 LYS 131 -17.068 6.636 -0.205 1050 HD3 LYS 131 HD3 LYS 131 -15.374 6.191 -0.130 1051 HE2 LYS 131 HE2 LYS 131 -15.833 6.452 -2.402 1052 HE3 LYS 131 HE3 LYS 131 -15.691 4.713 -2.147 1053 HZ1 LYS 131 HZ1 LYS 131 -18.017 4.457 -2.440 1054 HZ2 LYS 131 HZ2 LYS 131 -18.341 6.062 -2.229 1055 HZ3 LYS 131 HZ3 LYS 131 -17.599 5.520 -3.578 1056 H GLN 132 H GLN 132 -21.331 5.113 2.243 1057 HA GLN 132 HA GLN 132 -23.537 4.935 1.736 1058 HB2 GLN 132 HB2 GLN 132 -22.921 6.857 -0.524 1059 HB3 GLN 132 HB3 GLN 132 -24.450 6.666 0.326 1060 HG2 GLN 132 HG2 GLN 132 -21.861 7.793 1.468 1061 HG3 GLN 132 HG3 GLN 132 -23.307 8.692 1.055 1062 HE21 GLN 132 HE21 GLN 132 -23.168 7.981 4.787 1063 HE22 GLN 132 HE22 GLN 132 -21.963 8.608 3.671 1064 H GLU 133 H GLU 133 -21.892 2.894 0.427 1065 HA GLU 133 HA GLU 133 -23.782 2.053 -1.732 1066 HB2 GLU 133 HB2 GLU 133 -21.982 1.204 -3.052 1067 HB3 GLU 133 HB3 GLU 133 -21.710 2.910 -2.715 1068 HG2 GLU 133 HG2 GLU 133 -20.091 2.236 -0.890 1069 HG3 GLU 133 HG3 GLU 133 -20.310 0.554 -1.372 1070 H1 SER 149 H1 SER 149 17.974 -13.479 -16.060 1071 H2 SER 149 H2 SER 149 16.960 -12.850 -14.943 1072 H3 SER 149 H3 SER 149 16.700 -14.362 -15.528 1073 HA SER 149 HA SER 149 18.709 -15.186 -14.584 1074 HB2 SER 149 HB2 SER 149 19.082 -12.415 -13.399 1075 HB3 SER 149 HB3 SER 149 20.108 -13.843 -13.138 1076 HG SER 149 HG SER 149 20.930 -12.482 -14.791 1077 H GLN 150 H GLN 150 17.087 -12.734 -12.425 1078 HA GLN 150 HA GLN 150 16.464 -14.816 -10.467 1079 HB2 GLN 150 HB2 GLN 150 15.759 -11.861 -10.641 1080 HB3 GLN 150 HB3 GLN 150 15.318 -12.921 -9.293 1081 HG2 GLN 150 HG2 GLN 150 17.707 -13.421 -8.871 1082 HG3 GLN 150 HG3 GLN 150 18.180 -12.348 -10.190 1083 HE21 GLN 150 HE21 GLN 150 18.574 -10.378 -7.090 1084 HE22 GLN 150 HE22 GLN 150 19.328 -11.792 -7.813 1085 H ILE 151 H ILE 151 14.305 -15.279 -9.700 1086 HA ILE 151 HA ILE 151 12.487 -15.890 -11.865 1087 HB ILE 151 HB ILE 151 13.002 -17.327 -9.850 1088 HG12 ILE 151 HG12 ILE 151 10.036 -16.896 -10.386 1089 HG13 ILE 151 HG13 ILE 151 11.145 -17.719 -11.490 1090 HG21 ILE 151 HG21 ILE 151 10.923 -15.595 -8.443 1091 HG22 ILE 151 HG22 ILE 151 11.791 -16.993 -7.777 1092 HG23 ILE 151 HG23 ILE 151 12.670 -15.504 -8.128 1093 HD11 ILE 151 HD11 ILE 151 9.940 -19.367 -10.201 1094 HD12 ILE 151 HD12 ILE 151 11.643 -19.397 -9.704 1095 HD13 ILE 151 HD13 ILE 151 10.418 -18.617 -8.672 1096 H THR 152 H THR 152 10.248 -15.320 -12.008 1097 HA THR 152 HA THR 152 9.417 -12.741 -10.772 1098 HB THR 152 HB THR 152 8.458 -12.044 -12.953 1099 HG1 THR 152 HG1 THR 152 9.278 -13.051 -14.822 1100 HG21 THR 152 HG21 THR 152 11.474 -12.464 -13.111 1101 HG22 THR 152 HG22 THR 152 10.513 -11.228 -13.952 1102 HG23 THR 152 HG23 THR 152 10.673 -11.174 -12.190 1103 H SER 153 H SER 153 7.227 -12.409 -10.563 1104 HA SER 153 HA SER 153 5.413 -14.758 -10.963 1105 HB2 SER 153 HB2 SER 153 5.607 -12.974 -8.531 1106 HB3 SER 153 HB3 SER 153 4.459 -14.307 -8.782 1107 HG SER 153 HG SER 153 6.269 -14.968 -7.519 1108 H GLN 154 H GLN 154 5.343 -13.063 -12.836 1109 HA GLN 154 HA GLN 154 4.083 -10.602 -12.772 1110 HB2 GLN 154 HB2 GLN 154 3.917 -12.722 -14.941 1111 HB3 GLN 154 HB3 GLN 154 3.461 -11.028 -15.155 1112 HG2 GLN 154 HG2 GLN 154 5.745 -10.284 -14.717 1113 HG3 GLN 154 HG3 GLN 154 6.261 -11.924 -14.319 1114 HE21 GLN 154 HE21 GLN 154 5.958 -10.849 -18.253 1115 HE22 GLN 154 HE22 GLN 154 5.351 -9.766 -17.000 1116 H VAL 155 H VAL 155 2.073 -9.767 -12.639 1117 HA VAL 155 HA VAL 155 0.391 -10.954 -11.000 1118 HB VAL 155 HB VAL 155 -0.743 -8.984 -13.019 1119 HG11 VAL 155 HG11 VAL 155 -2.022 -8.104 -11.033 1120 HG12 VAL 155 HG12 VAL 155 -2.414 -9.771 -11.399 1121 HG13 VAL 155 HG13 VAL 155 -1.345 -9.378 -10.023 1122 HG21 VAL 155 HG21 VAL 155 1.363 -8.034 -12.286 1123 HG22 VAL 155 HG22 VAL 155 -0.007 -7.161 -11.611 1124 HG23 VAL 155 HG23 VAL 155 0.910 -8.302 -10.578 1125 H TPO 156 H T2P 156 -1.433 -12.140 -11.042 1126 HA TPO 156 HA T2P 156 -1.508 -14.215 -12.600 1127 HB TPO 156 HB T2P 156 -2.989 -13.565 -10.416 1128 HG21 TPO 156 HG21 T2P 156 -4.993 -14.927 -12.136 1129 HG22 TPO 156 HG22 T2P 156 -5.005 -13.169 -11.815 1130 HG23 TPO 156 HG23 T2P 156 -5.134 -14.308 -10.482 1131 H GLY 157 H GLY 157 -2.884 -15.463 -13.600 1132 HA2 GLY 157 HA2 GLY 157 -5.067 -14.541 -15.275 1133 HA3 GLY 157 HA3 GLY 157 -3.637 -14.945 -16.239 1134 H GLN 158 H GLN 158 -4.353 -16.665 -13.248 1135 HA GLN 158 HA GLN 158 -5.132 -19.120 -14.726 1136 HB2 GLN 158 HB2 GLN 158 -3.240 -20.359 -13.741 1137 HB3 GLN 158 HB3 GLN 158 -2.743 -19.106 -14.877 1138 HG2 GLN 158 HG2 GLN 158 -2.169 -17.600 -12.971 1139 HG3 GLN 158 HG3 GLN 158 -2.611 -18.871 -11.834 1140 HE21 GLN 158 HE21 GLN 158 1.108 -18.914 -12.389 1141 HE22 GLN 158 HE22 GLN 158 -0.049 -17.650 -11.916 1142 H ILE 159 H ILE 159 -4.652 -17.686 -11.476 1143 HA ILE 159 HA ILE 159 -5.838 -20.010 -10.219 1144 HB ILE 159 HB ILE 159 -4.067 -18.678 -9.161 1145 HG12 ILE 159 HG12 ILE 159 -5.001 -18.584 -6.865 1146 HG13 ILE 159 HG13 ILE 159 -6.623 -18.806 -7.517 1147 HG21 ILE 159 HG21 ILE 159 -6.213 -16.577 -8.732 1148 HG22 ILE 159 HG22 ILE 159 -4.607 -16.535 -7.998 1149 HG23 ILE 159 HG23 ILE 159 -4.767 -16.408 -9.743 1150 HD11 ILE 159 HD11 ILE 159 -6.033 -21.065 -8.296 1151 HD12 ILE 159 HD12 ILE 159 -4.337 -20.809 -7.815 1152 HD13 ILE 159 HD13 ILE 159 -5.615 -20.894 -6.587 1153 H GLY 160 H GLY 160 -7.103 -16.871 -11.130 1154 HA2 GLY 160 HA2 GLY 160 -9.276 -16.143 -11.492 1155 HA3 GLY 160 HA3 GLY 160 -9.794 -17.829 -11.387 1156 H TRP 161 H TRP 161 -8.422 -15.474 -9.027 1157 HA TRP 161 HA TRP 161 -10.309 -16.489 -6.973 1158 HB2 TRP 161 HB2 TRP 161 -8.582 -16.218 -5.426 1159 HB3 TRP 161 HB3 TRP 161 -7.888 -17.008 -6.807 1160 HD1 TRP 161 HD1 TRP 161 -7.113 -14.377 -8.539 1161 HE1 TRP 161 HE1 TRP 161 -4.864 -13.338 -7.895 1162 HE3 TRP 161 HE3 TRP 161 -7.385 -15.031 -3.525 1163 HZ2 TRP 161 HZ2 TRP 161 -3.308 -13.044 -5.567 1164 HZ3 TRP 161 HZ3 TRP 161 -5.546 -14.206 -2.047 1165 HH2 TRP 161 HH2 TRP 161 -3.482 -13.234 -3.039 1166 H ARG 162 H ARG 162 -8.964 -14.300 -5.399 1167 HA ARG 162 HA ARG 162 -9.470 -12.526 -4.318 1168 HB2 ARG 162 HB2 ARG 162 -10.206 -11.495 -7.034 1169 HB3 ARG 162 HB3 ARG 162 -10.312 -10.471 -5.610 1170 HG2 ARG 162 HG2 ARG 162 -7.742 -11.924 -6.330 1171 HG3 ARG 162 HG3 ARG 162 -8.164 -10.374 -7.043 1172 HD2 ARG 162 HD2 ARG 162 -7.873 -10.865 -4.051 1173 HD3 ARG 162 HD3 ARG 162 -6.651 -10.167 -5.115 1174 HE ARG 162 HE ARG 162 -9.326 -8.860 -4.995 1175 HH11 ARG 162 HH11 ARG 162 -9.289 -6.628 -5.094 1176 HH12 ARG 162 HH12 ARG 162 -7.776 -5.809 -4.794 1177 HH21 ARG 162 HH21 ARG 162 -5.948 -8.553 -4.064 1178 HH22 ARG 162 HH22 ARG 162 -6.008 -6.813 -4.352 1179 H ARG 163 H ARG 163 -11.281 -10.887 -3.659 1180 HA ARG 163 HA ARG 163 -14.029 -11.987 -3.852 1181 HB2 ARG 163 HB2 ARG 163 -12.736 -11.243 -1.197 1182 HB3 ARG 163 HB3 ARG 163 -14.408 -11.726 -1.466 1183 HG2 ARG 163 HG2 ARG 163 -13.588 -13.978 -2.270 1184 HG3 ARG 163 HG3 ARG 163 -11.943 -13.486 -1.843 1185 HD2 ARG 163 HD2 ARG 163 -12.785 -14.818 -0.036 1186 HD3 ARG 163 HD3 ARG 163 -12.668 -13.154 0.518 1187 HE ARG 163 HE ARG 163 -14.972 -13.036 0.746 1188 HH11 ARG 163 HH11 ARG 163 -17.026 -13.832 0.920 1189 HH12 ARG 163 HH12 ARG 163 -17.417 -15.393 0.257 1190 HH21 ARG 163 HH21 ARG 163 -14.273 -16.031 -0.941 1191 HH22 ARG 163 HH22 ARG 163 -15.909 -16.605 -0.768 Start of MODEL 17 1 H1 GLY -4 H1 GLY -4 -1.964 27.088 26.555 2 H2 GLY -4 H2 GLY -4 -3.195 27.456 25.539 3 H3 GLY -4 H3 GLY -4 -2.021 28.560 25.839 4 HA2 GLY -4 HA2 GLY -4 -1.685 27.606 23.664 5 HA3 GLY -4 HA3 GLY -4 -0.362 27.185 24.766 6 H SER -3 H SER -3 0.093 25.357 23.415 7 HA SER -3 HA SER -3 -1.507 22.953 24.058 8 HB2 SER -3 HB2 SER -3 -1.469 22.224 21.690 9 HB3 SER -3 HB3 SER -3 -2.424 23.692 21.926 10 HG SER -3 HG SER -3 -0.961 23.734 20.093 11 HA PRO -2 HA PRO -2 2.565 21.183 24.378 12 HB2 PRO -2 HB2 PRO -2 2.118 18.507 24.106 13 HB3 PRO -2 HB3 PRO -2 1.516 19.452 25.502 14 HG2 PRO -2 HG2 PRO -2 -0.002 18.689 22.983 15 HG3 PRO -2 HG3 PRO -2 -0.515 18.475 24.688 16 HD2 PRO -2 HD2 PRO -2 -1.324 20.613 23.218 17 HD3 PRO -2 HD3 PRO -2 -0.936 20.781 24.953 18 H ASN -1 H ASN -1 0.734 20.640 21.433 19 HA ASN -1 HA ASN -1 3.141 20.764 19.783 20 HB2 ASN -1 HB2 ASN -1 2.782 18.298 20.346 21 HB3 ASN -1 HB3 ASN -1 1.222 18.394 19.536 22 HD21 ASN -1 HD21 ASN -1 3.390 17.007 16.985 23 HD22 ASN -1 HD22 ASN -1 2.448 16.530 18.390 24 H SER 0 H SER 0 2.615 21.399 17.592 25 HA SER 0 HA SER 0 0.509 23.264 17.397 26 HB2 SER 0 HB2 SER 0 2.088 21.960 15.148 27 HB3 SER 0 HB3 SER 0 1.189 23.486 15.051 28 HG SER 0 HG SER 0 3.429 23.826 15.449 29 H MET 1 H MET 1 0.404 19.865 16.655 30 HA MET 1 HA MET 1 -2.144 20.076 15.143 31 HB2 MET 1 HB2 MET 1 -0.191 17.810 15.679 32 HB3 MET 1 HB3 MET 1 -1.787 17.539 14.999 33 HG2 MET 1 HG2 MET 1 -0.257 17.644 13.189 34 HG3 MET 1 HG3 MET 1 -1.321 19.036 13.126 35 HE1 MET 1 HE1 MET 1 2.321 17.705 13.684 36 HE2 MET 1 HE2 MET 1 3.209 19.169 14.159 37 HE3 MET 1 HE3 MET 1 2.029 18.452 15.271 38 H ALA 2 H ALA 2 -1.319 19.847 18.441 39 HA ALA 2 HA ALA 2 -3.142 17.783 19.267 40 HB1 ALA 2 HB1 ALA 2 -1.124 18.478 20.527 41 HB2 ALA 2 HB2 ALA 2 -1.886 20.055 20.857 42 HB3 ALA 2 HB3 ALA 2 -2.589 18.568 21.522 43 H THR 3 H THR 3 -3.781 21.033 18.333 44 HA THR 3 HA THR 3 -6.288 21.342 19.836 45 HB THR 3 HB THR 3 -6.506 23.422 18.504 46 HG1 THR 3 HG1 THR 3 -4.799 23.979 17.134 47 HG21 THR 3 HG21 THR 3 -5.166 23.397 20.617 48 HG22 THR 3 HG22 THR 3 -3.702 23.093 19.654 49 HG23 THR 3 HG23 THR 3 -4.604 24.612 19.452 50 H GLU 4 H GLU 4 -5.393 19.660 17.094 51 HA GLU 4 HA GLU 4 -8.113 19.732 15.856 52 HB2 GLU 4 HB2 GLU 4 -6.218 20.455 14.430 53 HB3 GLU 4 HB3 GLU 4 -5.430 18.904 14.684 54 HG2 GLU 4 HG2 GLU 4 -6.478 19.017 12.493 55 HG3 GLU 4 HG3 GLU 4 -7.206 17.745 13.450 56 H LEU 5 H LEU 5 -8.960 17.718 15.040 57 HA LEU 5 HA LEU 5 -8.580 15.388 16.794 58 HB2 LEU 5 HB2 LEU 5 -10.381 15.823 14.382 59 HB3 LEU 5 HB3 LEU 5 -10.430 14.431 15.461 60 HG LEU 5 HG LEU 5 -11.085 17.304 16.250 61 HD11 LEU 5 HD11 LEU 5 -12.859 14.852 15.905 62 HD12 LEU 5 HD12 LEU 5 -13.382 16.464 16.444 63 HD13 LEU 5 HD13 LEU 5 -12.771 16.239 14.797 64 HD21 LEU 5 HD21 LEU 5 -10.175 16.113 18.193 65 HD22 LEU 5 HD22 LEU 5 -11.923 16.286 18.362 66 HD23 LEU 5 HD23 LEU 5 -11.238 14.721 17.868 67 H GLU 6 H GLU 6 -6.208 15.802 15.766 68 HA GLU 6 HA GLU 6 -5.717 14.397 13.267 69 HB2 GLU 6 HB2 GLU 6 -4.152 16.027 15.211 70 HB3 GLU 6 HB3 GLU 6 -3.221 14.909 14.219 71 HG2 GLU 6 HG2 GLU 6 -5.201 16.790 12.935 72 HG3 GLU 6 HG3 GLU 6 -3.576 17.312 13.362 73 H TYR 7 H TYR 7 -7.011 12.609 14.840 74 HA TYR 7 HA TYR 7 -5.035 10.736 15.995 75 HB2 TYR 7 HB2 TYR 7 -6.785 9.574 16.957 76 HB3 TYR 7 HB3 TYR 7 -7.243 11.251 17.130 77 HD1 TYR 7 HD1 TYR 7 -9.122 12.185 15.705 78 HD2 TYR 7 HD2 TYR 7 -8.106 7.989 15.729 79 HE1 TYR 7 HE1 TYR 7 -11.305 11.645 14.643 80 HE2 TYR 7 HE2 TYR 7 -10.274 7.452 14.660 81 HH TYR 7 HH TYR 7 -12.673 9.995 13.833 82 H GLU 8 H GLU 8 -5.597 8.378 15.526 83 HA GLU 8 HA GLU 8 -6.790 7.535 13.127 84 HB2 GLU 8 HB2 GLU 8 -4.906 6.523 11.930 85 HB3 GLU 8 HB3 GLU 8 -4.793 8.266 11.935 86 HG2 GLU 8 HG2 GLU 8 -3.144 8.016 13.931 87 HG3 GLU 8 HG3 GLU 8 -3.134 6.289 13.530 88 H SER 9 H SER 9 -7.569 5.602 13.525 89 HA SER 9 HA SER 9 -6.722 4.098 15.896 90 HB2 SER 9 HB2 SER 9 -9.050 3.866 13.979 91 HB3 SER 9 HB3 SER 9 -8.777 2.741 15.330 92 HG SER 9 HG SER 9 -10.181 4.463 15.920 93 H VAL 10 H VAL 10 -5.799 1.962 15.862 94 HA VAL 10 HA VAL 10 -4.502 1.257 13.365 95 HB VAL 10 HB VAL 10 -3.397 0.970 15.509 96 HG11 VAL 10 HG11 VAL 10 -5.274 0.079 16.876 97 HG12 VAL 10 HG12 VAL 10 -5.198 -1.444 15.964 98 HG13 VAL 10 HG13 VAL 10 -3.824 -0.930 16.960 99 HG21 VAL 10 HG21 VAL 10 -2.638 -0.261 13.499 100 HG22 VAL 10 HG22 VAL 10 -2.300 -1.131 15.005 101 HG23 VAL 10 HG23 VAL 10 -3.645 -1.649 13.978 102 H LEU 11 H LEU 11 -4.878 -0.268 11.873 103 HA LEU 11 HA LEU 11 -7.349 -1.954 12.129 104 HB2 LEU 11 HB2 LEU 11 -6.114 -0.705 9.647 105 HB3 LEU 11 HB3 LEU 11 -7.452 -1.842 9.661 106 HG LEU 11 HG LEU 11 -7.478 1.007 10.726 107 HD11 LEU 11 HD11 LEU 11 -8.853 -0.448 8.418 108 HD12 LEU 11 HD12 LEU 11 -9.222 1.205 8.918 109 HD13 LEU 11 HD13 LEU 11 -7.611 0.819 8.300 110 HD21 LEU 11 HD21 LEU 11 -9.921 0.612 11.108 111 HD22 LEU 11 HD22 LEU 11 -9.663 -1.125 10.829 112 HD23 LEU 11 HD23 LEU 11 -8.901 -0.296 12.214 113 H CYS 12 H CYS 12 -4.041 -1.859 10.670 114 HA CYS 12 HA CYS 12 -3.913 -4.796 10.932 115 HB2 CYS 12 HB2 CYS 12 -4.933 -4.147 8.658 116 HB3 CYS 12 HB3 CYS 12 -3.314 -3.569 8.230 117 HG CYS 12 HG CYS 12 -3.801 -5.957 7.207 118 H VAL 13 H VAL 13 -1.896 -5.690 10.861 119 HA VAL 13 HA VAL 13 0.482 -4.080 10.388 120 HB VAL 13 HB VAL 13 0.064 -3.745 12.785 121 HG11 VAL 13 HG11 VAL 13 0.269 -5.477 14.439 122 HG12 VAL 13 HG12 VAL 13 -1.054 -5.894 13.343 123 HG13 VAL 13 HG13 VAL 13 0.516 -6.720 13.200 124 HG21 VAL 13 HG21 VAL 13 2.281 -4.382 13.630 125 HG22 VAL 13 HG22 VAL 13 2.528 -5.431 12.215 126 HG23 VAL 13 HG23 VAL 13 2.358 -3.667 12.020 127 H LYS 14 H LYS 14 1.855 -5.259 9.209 128 HA LYS 14 HA LYS 14 1.663 -8.249 9.255 129 HB2 LYS 14 HB2 LYS 14 2.113 -6.562 6.776 130 HB3 LYS 14 HB3 LYS 14 2.129 -8.298 6.828 131 HG2 LYS 14 HG2 LYS 14 -0.387 -6.769 7.643 132 HG3 LYS 14 HG3 LYS 14 0.044 -7.034 5.959 133 HD2 LYS 14 HD2 LYS 14 -1.387 -8.749 6.362 134 HD3 LYS 14 HD3 LYS 14 0.197 -9.500 6.475 135 HE2 LYS 14 HE2 LYS 14 -0.071 -9.159 9.048 136 HE3 LYS 14 HE3 LYS 14 -1.774 -8.833 8.685 137 HZ1 LYS 14 HZ1 LYS 14 -2.005 -11.035 7.795 138 HZ2 LYS 14 HZ2 LYS 14 -0.380 -11.311 7.802 139 HZ3 LYS 14 HZ3 LYS 14 -1.222 -11.216 9.212 140 HA PRO 15 HA PRO 15 5.698 -7.891 10.587 141 HB2 PRO 15 HB2 PRO 15 6.704 -10.422 10.330 142 HB3 PRO 15 HB3 PRO 15 5.349 -10.008 11.425 143 HG2 PRO 15 HG2 PRO 15 5.173 -11.120 8.598 144 HG3 PRO 15 HG3 PRO 15 4.373 -11.742 10.081 145 HD2 PRO 15 HD2 PRO 15 3.059 -10.097 8.383 146 HD3 PRO 15 HD3 PRO 15 2.879 -9.910 10.156 147 H ASP 16 H ASP 16 5.430 -8.836 7.210 148 HA ASP 16 HA ASP 16 8.018 -7.549 6.638 149 HB2 ASP 16 HB2 ASP 16 8.545 -9.948 6.947 150 HB3 ASP 16 HB3 ASP 16 7.343 -10.366 5.727 151 H VAL 17 H VAL 17 7.938 -6.345 4.836 152 HA VAL 17 HA VAL 17 6.078 -6.869 2.642 153 HB VAL 17 HB VAL 17 4.647 -5.608 4.202 154 HG11 VAL 17 HG11 VAL 17 6.588 -3.294 3.918 155 HG12 VAL 17 HG12 VAL 17 5.018 -3.276 4.738 156 HG13 VAL 17 HG13 VAL 17 6.337 -4.269 5.377 157 HG21 VAL 17 HG21 VAL 17 4.355 -5.364 1.748 158 HG22 VAL 17 HG22 VAL 17 3.827 -3.949 2.671 159 HG23 VAL 17 HG23 VAL 17 5.367 -3.898 1.799 160 H SER 18 H SER 18 6.773 -5.959 0.721 161 HA SER 18 HA SER 18 9.368 -4.478 0.798 162 HB2 SER 18 HB2 SER 18 8.560 -6.640 -1.161 163 HB3 SER 18 HB3 SER 18 10.121 -5.800 -1.040 164 HG SER 18 HG SER 18 10.056 -7.917 -0.046 165 H VAL 19 H VAL 19 9.752 -2.945 -0.765 166 HA VAL 19 HA VAL 19 7.411 -2.068 -2.412 167 HB VAL 19 HB VAL 19 9.202 -0.384 -0.663 168 HG11 VAL 19 HG11 VAL 19 7.221 0.494 -2.787 169 HG12 VAL 19 HG12 VAL 19 7.909 1.560 -1.546 170 HG13 VAL 19 HG13 VAL 19 8.972 0.838 -2.748 171 HG21 VAL 19 HG21 VAL 19 6.957 0.298 0.240 172 HG22 VAL 19 HG22 VAL 19 6.195 -0.883 -0.827 173 HG23 VAL 19 HG23 VAL 19 7.274 -1.422 0.470 174 H TYR 20 H TYR 20 7.699 -1.490 -4.355 175 HA TYR 20 HA TYR 20 10.329 -2.163 -5.582 176 HB2 TYR 20 HB2 TYR 20 7.467 -2.614 -6.487 177 HB3 TYR 20 HB3 TYR 20 8.887 -3.035 -7.429 178 HD1 TYR 20 HD1 TYR 20 10.017 -5.084 -7.104 179 HD2 TYR 20 HD2 TYR 20 7.180 -3.758 -4.153 180 HE1 TYR 20 HE1 TYR 20 10.195 -7.278 -5.922 181 HE2 TYR 20 HE2 TYR 20 7.456 -5.919 -2.944 182 HH TYR 20 HH TYR 20 9.538 -8.547 -4.131 183 H ARG 21 H ARG 21 8.673 0.581 -5.176 184 HA ARG 21 HA ARG 21 8.501 2.667 -6.240 185 HB2 ARG 21 HB2 ARG 21 11.361 1.764 -6.048 186 HB3 ARG 21 HB3 ARG 21 11.015 3.329 -6.792 187 HG2 ARG 21 HG2 ARG 21 9.891 4.160 -4.863 188 HG3 ARG 21 HG3 ARG 21 9.907 2.578 -4.061 189 HD2 ARG 21 HD2 ARG 21 12.242 2.620 -3.740 190 HD3 ARG 21 HD3 ARG 21 12.477 3.975 -4.866 191 HE ARG 21 HE ARG 21 10.840 5.041 -2.925 192 HH11 ARG 21 HH11 ARG 21 11.593 6.320 -1.282 193 HH12 ARG 21 HH12 ARG 21 13.196 6.084 -0.656 194 HH21 ARG 21 HH21 ARG 21 13.993 3.460 -2.737 195 HH22 ARG 21 HH22 ARG 21 14.510 4.514 -1.445 196 H ILE 22 H ILE 22 7.274 2.808 -7.941 197 HA ILE 22 HA ILE 22 8.146 1.614 -10.470 198 HB ILE 22 HB ILE 22 5.822 1.486 -11.043 199 HG12 ILE 22 HG12 ILE 22 5.316 3.167 -8.554 200 HG13 ILE 22 HG13 ILE 22 4.916 3.549 -10.232 201 HG21 ILE 22 HG21 ILE 22 6.271 0.616 -8.163 202 HG22 ILE 22 HG22 ILE 22 5.124 -0.062 -9.324 203 HG23 ILE 22 HG23 ILE 22 6.864 -0.220 -9.608 204 HD11 ILE 22 HD11 ILE 22 3.594 1.471 -8.470 205 HD12 ILE 22 HD12 ILE 22 2.905 2.960 -9.131 206 HD13 ILE 22 HD13 ILE 22 3.307 1.614 -10.222 207 HA PRO 23 HA PRO 23 8.331 5.532 -12.566 208 HB2 PRO 23 HB2 PRO 23 8.248 4.664 -15.222 209 HB3 PRO 23 HB3 PRO 23 9.678 4.807 -14.167 210 HG2 PRO 23 HG2 PRO 23 8.183 2.352 -14.954 211 HG3 PRO 23 HG3 PRO 23 9.884 2.535 -14.474 212 HD2 PRO 23 HD2 PRO 23 7.811 1.557 -12.836 213 HD3 PRO 23 HD3 PRO 23 9.399 2.147 -12.274 214 HA PRO 24 HA PRO 24 4.292 5.795 -14.988 215 HB2 PRO 24 HB2 PRO 24 2.419 3.843 -15.149 216 HB3 PRO 24 HB3 PRO 24 3.936 3.784 -16.100 217 HG2 PRO 24 HG2 PRO 24 3.371 2.439 -13.430 218 HG3 PRO 24 HG3 PRO 24 4.005 1.685 -14.930 219 HD2 PRO 24 HD2 PRO 24 5.645 2.542 -12.941 220 HD3 PRO 24 HD3 PRO 24 6.101 2.705 -14.664 221 H ARG 25 H ARG 25 2.186 6.555 -14.578 222 HA ARG 25 HA ARG 25 1.011 6.182 -11.832 223 HB2 ARG 25 HB2 ARG 25 -0.045 8.323 -12.043 224 HB3 ARG 25 HB3 ARG 25 1.694 8.512 -12.265 225 HG2 ARG 25 HG2 ARG 25 1.428 8.744 -14.683 226 HG3 ARG 25 HG3 ARG 25 -0.299 8.343 -14.583 227 HD2 ARG 25 HD2 ARG 25 -0.745 10.339 -13.273 228 HD3 ARG 25 HD3 ARG 25 0.985 10.760 -13.263 229 HE ARG 25 HE ARG 25 0.159 10.471 -15.968 230 HH11 ARG 25 HH11 ARG 25 -0.267 12.207 -17.289 231 HH12 ARG 25 HH12 ARG 25 -0.662 13.753 -16.595 232 HH21 ARG 25 HH21 ARG 25 -0.425 12.708 -13.336 233 HH22 ARG 25 HH22 ARG 25 -0.751 14.036 -14.416 234 H ALA 26 H ALA 26 0.407 5.738 -15.194 235 HA ALA 26 HA ALA 26 -2.060 4.283 -14.666 236 HB1 ALA 26 HB1 ALA 26 -2.829 6.639 -14.518 237 HB2 ALA 26 HB2 ALA 26 -2.146 6.974 -16.116 238 HB3 ALA 26 HB3 ALA 26 -3.502 5.819 -15.945 239 H SER 27 H SER 27 -1.498 2.609 -15.703 240 HA SER 27 HA SER 27 -0.707 2.731 -18.575 241 HB2 SER 27 HB2 SER 27 0.792 1.445 -17.087 242 HB3 SER 27 HB3 SER 27 -0.558 0.364 -16.682 243 HG SER 27 HG SER 27 1.005 -0.106 -18.565 244 H ASN 28 H ASN 28 -1.638 1.136 -19.883 245 HA ASN 28 HA ASN 28 -4.263 1.531 -20.447 246 HB2 ASN 28 HB2 ASN 28 -4.009 -0.119 -22.153 247 HB3 ASN 28 HB3 ASN 28 -2.465 0.694 -21.956 248 HD21 ASN 28 HD21 ASN 28 -0.953 -2.373 -20.584 249 HD22 ASN 28 HD22 ASN 28 -0.988 -0.691 -20.099 250 H ARG 29 H ARG 29 -3.241 -1.076 -18.266 251 HA ARG 29 HA ARG 29 -6.123 -1.572 -17.663 252 HB2 ARG 29 HB2 ARG 29 -4.017 -3.684 -18.247 253 HB3 ARG 29 HB3 ARG 29 -5.350 -4.034 -17.153 254 HG2 ARG 29 HG2 ARG 29 -6.439 -4.660 -18.976 255 HG3 ARG 29 HG3 ARG 29 -6.812 -2.928 -19.073 256 HD2 ARG 29 HD2 ARG 29 -5.069 -2.595 -20.718 257 HD3 ARG 29 HD3 ARG 29 -4.490 -4.264 -20.526 258 HE ARG 29 HE ARG 29 -7.215 -4.389 -21.268 259 HH11 ARG 29 HH11 ARG 29 -7.867 -4.852 -23.344 260 HH12 ARG 29 HH12 ARG 29 -6.800 -4.541 -24.682 261 HH21 ARG 29 HH21 ARG 29 -4.231 -3.296 -22.766 262 HH22 ARG 29 HH22 ARG 29 -4.793 -3.701 -24.371 263 H GLY 30 H GLY 30 -4.277 0.119 -16.480 264 HA2 GLY 30 HA2 GLY 30 -4.632 0.793 -14.084 265 HA3 GLY 30 HA3 GLY 30 -4.280 -0.885 -13.627 266 H TYR 31 H TYR 31 -2.193 -1.525 -13.361 267 HA TYR 31 HA TYR 31 0.031 0.423 -13.964 268 HB2 TYR 31 HB2 TYR 31 -0.657 -1.010 -11.387 269 HB3 TYR 31 HB3 TYR 31 0.977 -0.487 -11.737 270 HD1 TYR 31 HD1 TYR 31 -2.396 0.628 -10.862 271 HD2 TYR 31 HD2 TYR 31 1.614 1.820 -11.916 272 HE1 TYR 31 HE1 TYR 31 -2.806 2.883 -9.862 273 HE2 TYR 31 HE2 TYR 31 1.239 4.039 -10.847 274 HH TYR 31 HH TYR 31 -1.874 4.904 -9.295 275 H ARG 32 H ARG 32 -0.901 -2.936 -13.505 276 HA ARG 32 HA ARG 32 0.114 -4.877 -13.431 277 HB2 ARG 32 HB2 ARG 32 1.715 -4.596 -15.857 278 HB3 ARG 32 HB3 ARG 32 0.427 -5.683 -15.389 279 HG2 ARG 32 HG2 ARG 32 -0.584 -4.740 -17.153 280 HG3 ARG 32 HG3 ARG 32 -1.140 -3.615 -15.939 281 HD2 ARG 32 HD2 ARG 32 -0.479 -2.247 -17.712 282 HD3 ARG 32 HD3 ARG 32 0.844 -2.128 -16.553 283 HE ARG 32 HE ARG 32 2.257 -2.860 -18.186 284 HH11 ARG 32 HH11 ARG 32 2.968 -3.456 -20.007 285 HH12 ARG 32 HH12 ARG 32 1.989 -4.355 -21.164 286 HH21 ARG 32 HH21 ARG 32 -0.806 -4.320 -19.125 287 HH22 ARG 32 HH22 ARG 32 -0.135 -4.837 -20.645 288 H ALA 33 H ALA 33 1.440 -5.405 -11.797 289 HA ALA 33 HA ALA 33 3.994 -4.411 -11.212 290 HB1 ALA 33 HB1 ALA 33 4.314 -6.502 -9.967 291 HB2 ALA 33 HB2 ALA 33 2.691 -5.865 -9.710 292 HB3 ALA 33 HB3 ALA 33 2.934 -7.243 -10.811 293 H SER 34 H SER 34 3.113 -6.937 -13.491 294 HA SER 34 HA SER 34 5.599 -7.908 -14.334 295 HB2 SER 34 HB2 SER 34 2.996 -7.502 -15.856 296 HB3 SER 34 HB3 SER 34 4.286 -8.658 -16.284 297 HG SER 34 HG SER 34 2.512 -9.558 -15.109 298 H ASP 35 H ASP 35 4.248 -4.732 -15.014 299 HA ASP 35 HA ASP 35 5.743 -4.288 -17.496 300 HB2 ASP 35 HB2 ASP 35 3.455 -3.298 -16.684 301 HB3 ASP 35 HB3 ASP 35 4.441 -2.163 -15.774 302 H TRP 36 H TRP 36 6.110 -3.634 -14.076 303 HA TRP 36 HA TRP 36 8.748 -2.297 -14.458 304 HB2 TRP 36 HB2 TRP 36 8.155 -1.400 -12.048 305 HB3 TRP 36 HB3 TRP 36 7.644 -0.647 -13.523 306 HD1 TRP 36 HD1 TRP 36 5.201 -0.475 -14.106 307 HE1 TRP 36 HE1 TRP 36 3.002 -0.912 -12.895 308 HE3 TRP 36 HE3 TRP 36 6.999 -3.074 -10.071 309 HZ2 TRP 36 HZ2 TRP 36 2.210 -1.728 -10.211 310 HZ3 TRP 36 HZ3 TRP 36 5.494 -3.650 -8.188 311 HH2 TRP 36 HH2 TRP 36 3.104 -2.964 -8.229 312 H LYS 37 H LYS 37 9.340 -2.645 -11.591 313 HA LYS 37 HA LYS 37 10.511 -5.353 -11.632 314 HB2 LYS 37 HB2 LYS 37 10.535 -2.999 -9.670 315 HB3 LYS 37 HB3 LYS 37 11.255 -4.569 -9.298 316 HG2 LYS 37 HG2 LYS 37 12.744 -4.442 -11.217 317 HG3 LYS 37 HG3 LYS 37 12.010 -2.931 -11.762 318 HD2 LYS 37 HD2 LYS 37 12.907 -1.678 -9.978 319 HD3 LYS 37 HD3 LYS 37 13.271 -3.119 -9.013 320 HE2 LYS 37 HE2 LYS 37 14.985 -3.841 -10.570 321 HE3 LYS 37 HE3 LYS 37 14.624 -2.488 -11.659 322 HZ1 LYS 37 HZ1 LYS 37 16.546 -2.007 -10.248 323 HZ2 LYS 37 HZ2 LYS 37 15.342 -0.965 -9.896 324 HZ3 LYS 37 HZ3 LYS 37 15.667 -2.210 -8.886 325 H LEU 38 H LEU 38 8.940 -6.607 -11.891 326 HA LEU 38 HA LEU 38 6.761 -7.143 -10.207 327 HB2 LEU 38 HB2 LEU 38 7.105 -7.977 -12.511 328 HB3 LEU 38 HB3 LEU 38 8.557 -8.840 -12.006 329 HG LEU 38 HG LEU 38 7.195 -10.228 -10.526 330 HD11 LEU 38 HD11 LEU 38 4.830 -8.998 -12.048 331 HD12 LEU 38 HD12 LEU 38 4.724 -10.373 -10.942 332 HD13 LEU 38 HD13 LEU 38 5.165 -8.790 -10.310 333 HD21 LEU 38 HD21 LEU 38 7.877 -10.968 -12.805 334 HD22 LEU 38 HD22 LEU 38 6.373 -11.712 -12.273 335 HD23 LEU 38 HD23 LEU 38 6.325 -10.377 -13.446 336 H ASP 39 H ASP 39 10.131 -8.377 -9.962 337 HA ASP 39 HA ASP 39 9.563 -9.194 -7.161 338 HB2 ASP 39 HB2 ASP 39 9.214 -11.084 -8.863 339 HB3 ASP 39 HB3 ASP 39 10.963 -11.071 -9.080 340 H GLN 40 H GLN 40 11.147 -6.988 -8.340 341 HA GLN 40 HA GLN 40 13.773 -7.522 -6.963 342 HB2 GLN 40 HB2 GLN 40 13.260 -5.859 -9.431 343 HB3 GLN 40 HB3 GLN 40 14.752 -5.830 -8.482 344 HG2 GLN 40 HG2 GLN 40 15.053 -8.269 -8.902 345 HG3 GLN 40 HG3 GLN 40 13.601 -8.266 -9.909 346 HE21 GLN 40 HE21 GLN 40 15.227 -6.683 -12.690 347 HE22 GLN 40 HE22 GLN 40 13.665 -7.076 -11.987 348 HA PRO 41 HA PRO 41 11.595 -4.151 -4.710 349 HB2 PRO 41 HB2 PRO 41 12.324 -4.732 -2.156 350 HB3 PRO 41 HB3 PRO 41 11.058 -5.636 -3.042 351 HG2 PRO 41 HG2 PRO 41 13.975 -6.392 -2.689 352 HG3 PRO 41 HG3 PRO 41 12.530 -7.416 -2.419 353 HD2 PRO 41 HD2 PRO 41 13.967 -7.476 -4.749 354 HD3 PRO 41 HD3 PRO 41 12.195 -7.712 -4.730 355 H ASP 42 H ASP 42 12.275 -2.243 -3.697 356 HA ASP 42 HA ASP 42 15.211 -1.641 -3.772 357 HB2 ASP 42 HB2 ASP 42 13.706 -0.399 -5.352 358 HB3 ASP 42 HB3 ASP 42 12.862 0.274 -3.955 359 H TRP 43 H TRP 43 12.369 -1.725 -1.726 360 HA TRP 43 HA TRP 43 14.047 -1.249 0.670 361 HB2 TRP 43 HB2 TRP 43 13.032 0.927 0.240 362 HB3 TRP 43 HB3 TRP 43 11.452 0.197 0.011 363 HD1 TRP 43 HD1 TRP 43 13.850 1.328 2.713 364 HE1 TRP 43 HE1 TRP 43 12.671 1.347 4.992 365 HE3 TRP 43 HE3 TRP 43 9.509 -1.067 1.416 366 HZ2 TRP 43 HZ2 TRP 43 10.140 0.508 6.089 367 HZ3 TRP 43 HZ3 TRP 43 7.744 -1.489 3.113 368 HH2 TRP 43 HH2 TRP 43 8.041 -0.681 5.447 369 H THR 44 H THR 44 13.324 -2.440 2.513 370 HA THR 44 HA THR 44 10.656 -3.628 2.437 371 HB THR 44 HB THR 44 11.199 -5.770 2.956 372 HG1 THR 44 HG1 THR 44 13.931 -5.116 3.296 373 HG21 THR 44 HG21 THR 44 13.486 -5.225 1.044 374 HG22 THR 44 HG22 THR 44 12.634 -6.762 1.328 375 HG23 THR 44 HG23 THR 44 11.782 -5.407 0.581 376 H GLY 45 H GLY 45 9.771 -4.153 4.373 377 HA2 GLY 45 HA2 GLY 45 11.002 -3.491 6.925 378 HA3 GLY 45 HA3 GLY 45 9.987 -2.203 6.314 379 H ARG 46 H ARG 46 8.269 -2.272 7.492 380 HA ARG 46 HA ARG 46 6.647 -4.761 7.849 381 HB2 ARG 46 HB2 ARG 46 8.210 -4.035 9.830 382 HB3 ARG 46 HB3 ARG 46 7.036 -2.737 10.077 383 HG2 ARG 46 HG2 ARG 46 5.239 -4.475 10.343 384 HG3 ARG 46 HG3 ARG 46 6.454 -5.720 10.024 385 HD2 ARG 46 HD2 ARG 46 6.412 -5.841 12.286 386 HD3 ARG 46 HD3 ARG 46 7.709 -4.669 12.104 387 HE ARG 46 HE ARG 46 4.962 -4.249 13.120 388 HH11 ARG 46 HH11 ARG 46 4.400 -2.292 14.075 389 HH12 ARG 46 HH12 ARG 46 5.482 -0.920 13.830 390 HH21 ARG 46 HH21 ARG 46 7.941 -2.533 12.254 391 HH22 ARG 46 HH22 ARG 46 7.278 -1.043 12.941 392 H LEU 47 H LEU 47 4.402 -4.444 7.880 393 HA LEU 47 HA LEU 47 3.467 -1.868 6.730 394 HB2 LEU 47 HB2 LEU 47 2.791 -4.091 5.757 395 HB3 LEU 47 HB3 LEU 47 2.030 -4.462 7.303 396 HG LEU 47 HG LEU 47 0.544 -2.386 6.932 397 HD11 LEU 47 HD11 LEU 47 0.192 -1.737 4.597 398 HD12 LEU 47 HD12 LEU 47 1.816 -1.312 5.135 399 HD13 LEU 47 HD13 LEU 47 1.576 -2.735 4.093 400 HD21 LEU 47 HD21 LEU 47 0.322 -4.800 5.119 401 HD22 LEU 47 HD22 LEU 47 -0.271 -4.642 6.792 402 HD23 LEU 47 HD23 LEU 47 -0.994 -3.675 5.525 403 H ARG 48 H ARG 48 2.112 -0.420 7.772 404 HA ARG 48 HA ARG 48 0.623 -1.329 10.174 405 HB2 ARG 48 HB2 ARG 48 2.856 -0.017 10.710 406 HB3 ARG 48 HB3 ARG 48 1.991 1.394 10.148 407 HG2 ARG 48 HG2 ARG 48 1.652 1.416 12.459 408 HG3 ARG 48 HG3 ARG 48 0.140 0.704 11.875 409 HD2 ARG 48 HD2 ARG 48 0.943 -1.543 12.402 410 HD3 ARG 48 HD3 ARG 48 2.551 -0.933 12.793 411 HE ARG 48 HE ARG 48 0.193 -0.923 14.499 412 HH11 ARG 48 HH11 ARG 48 0.387 -0.273 16.610 413 HH12 ARG 48 HH12 ARG 48 1.765 0.658 17.112 414 HH21 ARG 48 HH21 ARG 48 3.281 0.765 14.029 415 HH22 ARG 48 HH22 ARG 48 3.344 1.207 15.714 416 H ILE 49 H ILE 49 -1.388 -1.247 9.334 417 HA ILE 49 HA ILE 49 -2.247 1.149 7.757 418 HB ILE 49 HB ILE 49 -3.671 -1.487 8.138 419 HG12 ILE 49 HG12 ILE 49 -2.203 -0.276 5.745 420 HG13 ILE 49 HG13 ILE 49 -1.697 -1.684 6.675 421 HG21 ILE 49 HG21 ILE 49 -4.422 0.825 6.313 422 HG22 ILE 49 HG22 ILE 49 -5.321 -0.691 6.575 423 HG23 ILE 49 HG23 ILE 49 -5.221 0.484 7.863 424 HD11 ILE 49 HD11 ILE 49 -4.155 -1.522 4.884 425 HD12 ILE 49 HD12 ILE 49 -2.662 -2.407 4.586 426 HD13 ILE 49 HD13 ILE 49 -3.715 -2.916 5.915 427 H THR 50 H THR 50 -3.417 2.659 8.660 428 HA THR 50 HA THR 50 -4.948 2.125 11.160 429 HB THR 50 HB THR 50 -4.297 4.299 12.044 430 HG1 THR 50 HG1 THR 50 -2.518 5.369 10.950 431 HG21 THR 50 HG21 THR 50 -2.000 3.913 12.638 432 HG22 THR 50 HG22 THR 50 -2.788 2.332 12.554 433 HG23 THR 50 HG23 THR 50 -1.735 2.866 11.231 434 H SER 51 H SER 51 -6.576 4.016 11.535 435 HA SER 51 HA SER 51 -7.416 5.424 9.118 436 HB2 SER 51 HB2 SER 51 -9.734 4.621 9.210 437 HB3 SER 51 HB3 SER 51 -8.595 3.338 8.796 438 HG SER 51 HG SER 51 -9.556 3.824 11.440 439 H LYS 52 H LYS 52 -7.973 7.391 9.629 440 HA LYS 52 HA LYS 52 -9.064 8.106 12.312 441 HB2 LYS 52 HB2 LYS 52 -7.178 9.385 11.351 442 HB3 LYS 52 HB3 LYS 52 -8.227 9.863 10.000 443 HG2 LYS 52 HG2 LYS 52 -9.837 10.715 11.929 444 HG3 LYS 52 HG3 LYS 52 -8.374 10.663 12.913 445 HD2 LYS 52 HD2 LYS 52 -8.772 12.137 10.288 446 HD3 LYS 52 HD3 LYS 52 -8.754 12.870 11.912 447 HE2 LYS 52 HE2 LYS 52 -6.429 12.374 12.194 448 HE3 LYS 52 HE3 LYS 52 -6.376 11.413 10.714 449 HZ1 LYS 52 HZ1 LYS 52 -5.556 13.822 10.559 450 HZ2 LYS 52 HZ2 LYS 52 -6.640 13.357 9.407 451 HZ3 LYS 52 HZ3 LYS 52 -7.105 14.284 10.675 452 H GLY 53 H GLY 53 -10.861 6.800 11.844 453 HA2 GLY 53 HA2 GLY 53 -13.178 6.641 11.595 454 HA3 GLY 53 HA3 GLY 53 -13.197 8.326 11.077 455 H LYS 54 H LYS 54 -13.829 8.644 9.041 456 HA LYS 54 HA LYS 54 -14.226 6.490 7.117 457 HB2 LYS 54 HB2 LYS 54 -15.815 8.377 7.615 458 HB3 LYS 54 HB3 LYS 54 -14.677 9.497 6.879 459 HG2 LYS 54 HG2 LYS 54 -15.344 7.275 5.072 460 HG3 LYS 54 HG3 LYS 54 -16.799 8.058 5.673 461 HD2 LYS 54 HD2 LYS 54 -16.021 10.244 4.903 462 HD3 LYS 54 HD3 LYS 54 -14.482 9.547 4.360 463 HE2 LYS 54 HE2 LYS 54 -15.636 8.150 2.713 464 HE3 LYS 54 HE3 LYS 54 -17.215 8.696 3.299 465 HZ1 LYS 54 HZ1 LYS 54 -16.492 9.928 1.306 466 HZ2 LYS 54 HZ2 LYS 54 -16.655 10.942 2.574 467 HZ3 LYS 54 HZ3 LYS 54 -15.165 10.492 2.083 468 H THR 55 H THR 55 -11.420 7.539 7.841 469 HA THR 55 HA THR 55 -10.399 7.466 5.038 470 HB THR 55 HB THR 55 -9.244 9.201 7.249 471 HG1 THR 55 HG1 THR 55 -10.302 10.929 6.276 472 HG21 THR 55 HG21 THR 55 -9.100 9.187 4.190 473 HG22 THR 55 HG22 THR 55 -8.263 10.366 5.240 474 HG23 THR 55 HG23 THR 55 -7.801 8.652 5.280 475 H ALA 56 H ALA 56 -8.922 5.882 4.763 476 HA ALA 56 HA ALA 56 -7.547 4.683 7.110 477 HB1 ALA 56 HB1 ALA 56 -6.886 2.886 5.514 478 HB2 ALA 56 HB2 ALA 56 -8.628 3.030 5.750 479 HB3 ALA 56 HB3 ALA 56 -7.888 3.668 4.272 480 H TYR 57 H TYR 57 -5.254 4.301 6.989 481 HA TYR 57 HA TYR 57 -3.706 6.025 5.141 482 HB2 TYR 57 HB2 TYR 57 -3.390 5.919 8.153 483 HB3 TYR 57 HB3 TYR 57 -2.249 6.658 7.045 484 HD1 TYR 57 HD1 TYR 57 -2.566 8.900 6.257 485 HD2 TYR 57 HD2 TYR 57 -5.740 6.885 8.371 486 HE1 TYR 57 HE1 TYR 57 -3.851 11.031 6.376 487 HE2 TYR 57 HE2 TYR 57 -7.055 8.980 8.398 488 HH TYR 57 HH TYR 57 -5.800 12.045 7.027 489 H ILE 58 H ILE 58 -2.423 4.669 4.068 490 HA ILE 58 HA ILE 58 -1.527 2.105 5.294 491 HB ILE 58 HB ILE 58 -0.690 3.189 2.594 492 HG12 ILE 58 HG12 ILE 58 -3.097 3.121 2.461 493 HG13 ILE 58 HG13 ILE 58 -2.361 1.876 1.475 494 HG21 ILE 58 HG21 ILE 58 -0.684 0.436 3.860 495 HG22 ILE 58 HG22 ILE 58 -0.264 0.791 2.167 496 HG23 ILE 58 HG23 ILE 58 0.722 1.446 3.470 497 HD11 ILE 58 HD11 ILE 58 -3.596 1.382 4.215 498 HD12 ILE 58 HD12 ILE 58 -4.375 1.115 2.648 499 HD13 ILE 58 HD13 ILE 58 -2.955 0.146 3.100 500 H LYS 59 H LYS 59 0.024 2.488 6.824 501 HA LYS 59 HA LYS 59 2.309 4.260 6.041 502 HB2 LYS 59 HB2 LYS 59 1.591 3.460 8.870 503 HB3 LYS 59 HB3 LYS 59 2.780 4.643 8.316 504 HG2 LYS 59 HG2 LYS 59 0.749 5.811 7.142 505 HG3 LYS 59 HG3 LYS 59 -0.254 4.808 8.202 506 HD2 LYS 59 HD2 LYS 59 0.886 5.801 10.187 507 HD3 LYS 59 HD3 LYS 59 1.882 6.795 9.083 508 HE2 LYS 59 HE2 LYS 59 -0.385 7.620 8.114 509 HE3 LYS 59 HE3 LYS 59 -1.116 6.869 9.551 510 HZ1 LYS 59 HZ1 LYS 59 -0.729 8.958 10.295 511 HZ2 LYS 59 HZ2 LYS 59 0.630 8.256 10.790 512 HZ3 LYS 59 HZ3 LYS 59 0.685 9.183 9.417 513 H LEU 60 H LEU 60 4.388 3.631 6.311 514 HA LEU 60 HA LEU 60 4.882 0.680 6.531 515 HB2 LEU 60 HB2 LEU 60 5.956 2.731 4.555 516 HB3 LEU 60 HB3 LEU 60 6.609 1.107 4.731 517 HG LEU 60 HG LEU 60 3.712 1.679 3.949 518 HD11 LEU 60 HD11 LEU 60 4.414 1.061 1.669 519 HD12 LEU 60 HD12 LEU 60 5.253 2.514 2.233 520 HD13 LEU 60 HD13 LEU 60 6.101 0.951 2.223 521 HD21 LEU 60 HD21 LEU 60 5.395 -0.864 3.796 522 HD22 LEU 60 HD22 LEU 60 4.065 -0.570 4.933 523 HD23 LEU 60 HD23 LEU 60 3.731 -0.677 3.202 524 H GLU 61 H GLU 61 6.375 0.099 7.923 525 HA GLU 61 HA GLU 61 8.070 2.189 9.227 526 HB2 GLU 61 HB2 GLU 61 6.837 -0.348 10.341 527 HB3 GLU 61 HB3 GLU 61 8.049 0.631 11.170 528 HG2 GLU 61 HG2 GLU 61 6.494 2.577 11.138 529 HG3 GLU 61 HG3 GLU 61 5.270 1.569 10.349 530 H ASP 62 H ASP 62 10.256 1.704 9.728 531 HA ASP 62 HA ASP 62 11.605 -0.280 8.118 532 HB2 ASP 62 HB2 ASP 62 12.606 1.872 8.592 533 HB3 ASP 62 HB3 ASP 62 12.436 1.629 10.333 534 H LYS 63 H LYS 63 12.217 -2.294 8.673 535 HA LYS 63 HA LYS 63 10.955 -3.575 10.935 536 HB2 LYS 63 HB2 LYS 63 11.922 -5.656 10.033 537 HB3 LYS 63 HB3 LYS 63 11.022 -4.719 8.852 538 HG2 LYS 63 HG2 LYS 63 13.130 -3.890 7.851 539 HG3 LYS 63 HG3 LYS 63 14.068 -4.689 9.112 540 HD2 LYS 63 HD2 LYS 63 14.111 -5.907 6.979 541 HD3 LYS 63 HD3 LYS 63 13.433 -6.883 8.291 542 HE2 LYS 63 HE2 LYS 63 11.182 -6.602 7.464 543 HE3 LYS 63 HE3 LYS 63 11.682 -5.342 6.335 544 HZ1 LYS 63 HZ1 LYS 63 12.771 -6.887 4.986 545 HZ2 LYS 63 HZ2 LYS 63 12.700 -8.103 6.103 546 HZ3 LYS 63 HZ3 LYS 63 11.339 -7.599 5.352 547 H VAL 64 H VAL 64 13.709 -1.809 11.055 548 HA VAL 64 HA VAL 64 14.969 -3.458 13.206 549 HB VAL 64 HB VAL 64 16.326 -1.128 11.840 550 HG11 VAL 64 HG11 VAL 64 17.366 -3.688 13.109 551 HG12 VAL 64 HG12 VAL 64 18.350 -2.363 12.448 552 HG13 VAL 64 HG13 VAL 64 17.338 -2.079 13.867 553 HG21 VAL 64 HG21 VAL 64 17.426 -2.713 10.270 554 HG22 VAL 64 HG22 VAL 64 16.262 -3.971 10.754 555 HG23 VAL 64 HG23 VAL 64 15.712 -2.486 9.931 556 H SER 65 H SER 65 13.812 -0.197 12.347 557 HA SER 65 HA SER 65 14.179 0.593 15.209 558 HB2 SER 65 HB2 SER 65 14.269 2.344 12.727 559 HB3 SER 65 HB3 SER 65 14.573 2.858 14.395 560 HG SER 65 HG SER 65 16.115 1.109 12.774 561 H GLY 66 H GLY 66 11.646 0.073 12.964 562 HA2 GLY 66 HA2 GLY 66 9.410 0.575 13.031 563 HA3 GLY 66 HA3 GLY 66 9.620 1.303 14.626 564 H GLU 67 H GLU 67 11.653 2.605 12.138 565 HA GLU 67 HA GLU 67 10.404 5.232 12.394 566 HB2 GLU 67 HB2 GLU 67 12.804 4.184 10.858 567 HB3 GLU 67 HB3 GLU 67 12.261 5.856 10.723 568 HG2 GLU 67 HG2 GLU 67 12.912 4.577 13.397 569 HG3 GLU 67 HG3 GLU 67 14.127 5.361 12.391 570 H LEU 68 H LEU 68 9.537 6.515 10.784 571 HA LEU 68 HA LEU 68 7.801 5.037 9.001 572 HB2 LEU 68 HB2 LEU 68 7.124 7.094 10.266 573 HB3 LEU 68 HB3 LEU 68 8.194 8.041 9.233 574 HG LEU 68 HG LEU 68 6.822 7.260 7.231 575 HD11 LEU 68 HD11 LEU 68 4.924 6.297 9.423 576 HD12 LEU 68 HD12 LEU 68 4.526 6.448 7.699 577 HD13 LEU 68 HD13 LEU 68 5.730 5.272 8.219 578 HD21 LEU 68 HD21 LEU 68 4.977 8.813 7.669 579 HD22 LEU 68 HD22 LEU 68 5.335 8.782 9.410 580 HD23 LEU 68 HD23 LEU 68 6.505 9.475 8.264 581 H PHE 69 H PHE 69 8.269 4.317 7.061 582 HA PHE 69 HA PHE 69 10.382 5.481 5.337 583 HB2 PHE 69 HB2 PHE 69 10.297 3.109 5.447 584 HB3 PHE 69 HB3 PHE 69 8.561 3.072 5.178 585 HD1 PHE 69 HD1 PHE 69 7.914 2.281 3.100 586 HD2 PHE 69 HD2 PHE 69 11.574 4.529 3.404 587 HE1 PHE 69 HE1 PHE 69 8.304 1.971 0.677 588 HE2 PHE 69 HE2 PHE 69 11.939 4.260 0.976 589 HZ PHE 69 HZ PHE 69 10.287 2.987 -0.415 590 H ALA 70 H ALA 70 6.832 4.917 5.151 591 HA ALA 70 HA ALA 70 6.418 7.425 3.726 592 HB1 ALA 70 HB1 ALA 70 7.117 5.910 1.873 593 HB2 ALA 70 HB2 ALA 70 5.827 4.776 2.323 594 HB3 ALA 70 HB3 ALA 70 5.425 6.399 1.728 595 H GLN 71 H GLN 71 4.125 7.863 3.342 596 HA GLN 71 HA GLN 71 2.164 6.095 4.591 597 HB2 GLN 71 HB2 GLN 71 1.095 7.886 5.894 598 HB3 GLN 71 HB3 GLN 71 2.688 7.418 6.484 599 HG2 GLN 71 HG2 GLN 71 3.673 9.441 5.386 600 HG3 GLN 71 HG3 GLN 71 2.054 9.937 4.886 601 HE21 GLN 71 HE21 GLN 71 2.961 11.690 8.085 602 HE22 GLN 71 HE22 GLN 71 3.692 11.606 6.490 603 H ALA 72 H ALA 72 0.274 6.020 3.545 604 HA ALA 72 HA ALA 72 -0.285 7.988 1.362 605 HB1 ALA 72 HB1 ALA 72 -0.825 5.008 1.522 606 HB2 ALA 72 HB2 ALA 72 -1.439 6.060 0.255 607 HB3 ALA 72 HB3 ALA 72 0.305 5.837 0.428 608 HA PRO 73 HA PRO 73 -4.249 8.188 3.701 609 HB2 PRO 73 HB2 PRO 73 -5.233 10.516 2.717 610 HB3 PRO 73 HB3 PRO 73 -3.889 10.461 3.897 611 HG2 PRO 73 HG2 PRO 73 -3.715 10.823 0.899 612 HG3 PRO 73 HG3 PRO 73 -2.850 11.720 2.180 613 HD2 PRO 73 HD2 PRO 73 -1.772 9.582 0.777 614 HD3 PRO 73 HD3 PRO 73 -1.283 10.014 2.443 615 H VAL 74 H VAL 74 -5.946 6.996 3.148 616 HA VAL 74 HA VAL 74 -6.911 6.797 0.317 617 HB VAL 74 HB VAL 74 -6.971 4.655 2.475 618 HG11 VAL 74 HG11 VAL 74 -7.826 3.152 0.870 619 HG12 VAL 74 HG12 VAL 74 -8.859 4.550 0.820 620 HG13 VAL 74 HG13 VAL 74 -7.640 4.330 -0.455 621 HG21 VAL 74 HG21 VAL 74 -4.653 4.978 1.651 622 HG22 VAL 74 HG22 VAL 74 -5.354 3.384 1.368 623 HG23 VAL 74 HG23 VAL 74 -5.237 4.530 0.033 624 H GLU 75 H GLU 75 -9.001 7.469 0.029 625 HA GLU 75 HA GLU 75 -10.861 7.366 2.372 626 HB2 GLU 75 HB2 GLU 75 -9.983 9.684 1.374 627 HB3 GLU 75 HB3 GLU 75 -11.290 9.395 0.218 628 HG2 GLU 75 HG2 GLU 75 -12.790 8.991 2.302 629 HG3 GLU 75 HG3 GLU 75 -11.451 9.611 3.257 630 H GLN 76 H GLN 76 -10.260 5.705 -0.319 631 HA GLN 76 HA GLN 76 -12.877 4.605 -0.475 632 HB2 GLN 76 HB2 GLN 76 -13.424 4.997 -2.748 633 HB3 GLN 76 HB3 GLN 76 -13.141 6.569 -2.027 634 HG2 GLN 76 HG2 GLN 76 -11.265 5.074 -3.902 635 HG3 GLN 76 HG3 GLN 76 -12.284 6.436 -4.307 636 HE21 GLN 76 HE21 GLN 76 -8.658 7.126 -2.581 637 HE22 GLN 76 HE22 GLN 76 -9.325 5.478 -2.578 638 H TYR 77 H TYR 77 -12.799 2.496 -1.229 639 HA TYR 77 HA TYR 77 -10.353 1.568 -2.612 640 HB2 TYR 77 HB2 TYR 77 -10.151 1.140 -0.168 641 HB3 TYR 77 HB3 TYR 77 -11.579 0.111 -0.259 642 HD1 TYR 77 HD1 TYR 77 -8.635 0.389 -2.595 643 HD2 TYR 77 HD2 TYR 77 -10.635 -2.024 0.358 644 HE1 TYR 77 HE1 TYR 77 -6.974 -1.344 -2.925 645 HE2 TYR 77 HE2 TYR 77 -9.013 -3.846 -0.078 646 HH TYR 77 HH TYR 77 -6.361 -3.545 -2.445 647 HA PRO 78 HA PRO 78 -9.723 0.103 -4.397 648 HB2 PRO 78 HB2 PRO 78 -11.220 0.325 -6.987 649 HB3 PRO 78 HB3 PRO 78 -9.716 -0.577 -6.612 650 HG2 PRO 78 HG2 PRO 78 -12.059 -1.905 -6.795 651 HG3 PRO 78 HG3 PRO 78 -10.949 -2.267 -5.428 652 HD2 PRO 78 HD2 PRO 78 -13.369 -0.428 -5.440 653 HD3 PRO 78 HD3 PRO 78 -12.949 -1.717 -4.274 654 H GLY 79 H GLY 79 -8.466 1.847 -5.317 655 HA2 GLY 79 HA2 GLY 79 -9.690 4.244 -6.399 656 HA3 GLY 79 HA3 GLY 79 -9.151 4.458 -4.732 657 H ILE 80 H ILE 80 -7.784 6.112 -5.788 658 HA ILE 80 HA ILE 80 -5.493 5.183 -7.380 659 HB ILE 80 HB ILE 80 -6.557 7.335 -7.885 660 HG12 ILE 80 HG12 ILE 80 -4.605 8.773 -8.061 661 HG13 ILE 80 HG13 ILE 80 -3.727 7.816 -6.875 662 HG21 ILE 80 HG21 ILE 80 -5.522 8.321 -5.186 663 HG22 ILE 80 HG22 ILE 80 -6.286 9.301 -6.443 664 HG23 ILE 80 HG23 ILE 80 -7.232 8.066 -5.611 665 HD11 ILE 80 HD11 ILE 80 -3.037 7.366 -9.222 666 HD12 ILE 80 HD12 ILE 80 -3.647 5.909 -8.428 667 HD13 ILE 80 HD13 ILE 80 -4.676 6.788 -9.588 668 H ALA 81 H ALA 81 -6.265 5.751 -4.031 669 HA ALA 81 HA ALA 81 -3.455 5.872 -3.275 670 HB1 ALA 81 HB1 ALA 81 -5.968 6.040 -1.580 671 HB2 ALA 81 HB2 ALA 81 -4.292 6.382 -1.051 672 HB3 ALA 81 HB3 ALA 81 -5.089 7.426 -2.254 673 H VAL 82 H VAL 82 -5.875 3.406 -3.426 674 HA VAL 82 HA VAL 82 -3.639 1.567 -3.037 675 HB VAL 82 HB VAL 82 -4.443 1.566 -0.850 676 HG11 VAL 82 HG11 VAL 82 -7.105 1.721 -1.851 677 HG12 VAL 82 HG12 VAL 82 -6.888 0.408 -0.647 678 HG13 VAL 82 HG13 VAL 82 -6.403 2.049 -0.279 679 HG21 VAL 82 HG21 VAL 82 -4.816 -0.818 -0.548 680 HG22 VAL 82 HG22 VAL 82 -5.031 -0.994 -2.300 681 HG23 VAL 82 HG23 VAL 82 -3.502 -0.416 -1.664 682 H GLU 83 H GLU 83 -3.589 0.492 -4.816 683 HA GLU 83 HA GLU 83 -6.069 -0.502 -6.180 684 HB2 GLU 83 HB2 GLU 83 -4.363 1.555 -7.082 685 HB3 GLU 83 HB3 GLU 83 -3.788 0.135 -7.945 686 HG2 GLU 83 HG2 GLU 83 -6.696 1.048 -7.861 687 HG3 GLU 83 HG3 GLU 83 -5.545 1.518 -9.111 688 H THR 84 H THR 84 -5.844 -2.422 -7.440 689 HA THR 84 HA THR 84 -3.471 -4.125 -6.730 690 HB THR 84 HB THR 84 -6.005 -5.229 -7.801 691 HG1 THR 84 HG1 THR 84 -6.696 -5.602 -5.674 692 HG21 THR 84 HG21 THR 84 -3.823 -6.315 -6.008 693 HG22 THR 84 HG22 THR 84 -5.233 -7.234 -6.596 694 HG23 THR 84 HG23 THR 84 -4.025 -6.640 -7.747 695 H VAL 85 H VAL 85 -2.445 -2.969 -8.252 696 HA VAL 85 HA VAL 85 -1.406 -2.741 -10.360 697 HB VAL 85 HB VAL 85 -0.413 -5.113 -10.718 698 HG11 VAL 85 HG11 VAL 85 -0.133 -3.619 -8.071 699 HG12 VAL 85 HG12 VAL 85 1.064 -4.705 -8.792 700 HG13 VAL 85 HG13 VAL 85 0.665 -3.192 -9.600 701 HG21 VAL 85 HG21 VAL 85 -2.295 -6.284 -9.370 702 HG22 VAL 85 HG22 VAL 85 -0.631 -6.693 -8.961 703 HG23 VAL 85 HG23 VAL 85 -1.550 -5.575 -7.940 704 H THR 86 H THR 86 -3.007 -5.828 -10.909 705 HA THR 86 HA THR 86 -4.679 -4.640 -12.933 706 HB THR 86 HB THR 86 -4.516 -6.628 -14.473 707 HG1 THR 86 HG1 THR 86 -3.064 -8.088 -14.144 708 HG21 THR 86 HG21 THR 86 -1.944 -5.049 -14.270 709 HG22 THR 86 HG22 THR 86 -2.658 -5.751 -15.743 710 HG23 THR 86 HG23 THR 86 -3.434 -4.367 -14.926 711 H ASP 87 H ASP 87 -3.736 -7.696 -11.366 712 HA ASP 87 HA ASP 87 -6.527 -8.127 -10.444 713 HB2 ASP 87 HB2 ASP 87 -6.259 -8.998 -12.823 714 HB3 ASP 87 HB3 ASP 87 -5.087 -10.149 -12.192 715 H SER 88 H SER 88 -3.489 -10.008 -10.743 716 HA SER 88 HA SER 88 -3.991 -11.549 -8.432 717 HB2 SER 88 HB2 SER 88 -2.216 -11.766 -10.457 718 HB3 SER 88 HB3 SER 88 -1.129 -11.313 -9.127 719 HG SER 88 HG SER 88 -1.863 -13.665 -9.578 720 H SER 89 H SER 89 -3.832 -11.169 -6.336 721 HA SER 89 HA SER 89 -2.945 -8.517 -5.616 722 HB2 SER 89 HB2 SER 89 -4.408 -8.755 -3.765 723 HB3 SER 89 HB3 SER 89 -5.173 -9.328 -5.265 724 HG SER 89 HG SER 89 -5.356 -10.703 -3.289 725 H ARG 90 H ARG 90 -0.889 -10.921 -5.640 726 HA ARG 90 HA ARG 90 0.431 -10.664 -3.051 727 HB2 ARG 90 HB2 ARG 90 1.207 -12.309 -4.723 728 HB3 ARG 90 HB3 ARG 90 1.619 -11.008 -5.851 729 HG2 ARG 90 HG2 ARG 90 3.325 -10.158 -4.275 730 HG3 ARG 90 HG3 ARG 90 2.861 -11.386 -3.086 731 HD2 ARG 90 HD2 ARG 90 3.675 -13.147 -4.599 732 HD3 ARG 90 HD3 ARG 90 4.028 -11.937 -5.841 733 HE ARG 90 HE ARG 90 5.304 -11.759 -3.135 734 HH11 ARG 90 HH11 ARG 90 7.542 -11.577 -3.033 735 HH12 ARG 90 HH12 ARG 90 8.448 -11.597 -4.551 736 HH21 ARG 90 HH21 ARG 90 5.896 -11.818 -6.653 737 HH22 ARG 90 HH22 ARG 90 7.630 -11.754 -6.339 738 H TYR 91 H TYR 91 0.086 -8.575 -5.845 739 HA TYR 91 HA TYR 91 1.833 -6.529 -4.581 740 HB2 TYR 91 HB2 TYR 91 0.945 -6.513 -7.449 741 HB3 TYR 91 HB3 TYR 91 2.327 -5.700 -6.750 742 HD1 TYR 91 HD1 TYR 91 1.173 -8.496 -8.594 743 HD2 TYR 91 HD2 TYR 91 4.210 -7.272 -5.790 744 HE1 TYR 91 HE1 TYR 91 2.535 -10.428 -9.289 745 HE2 TYR 91 HE2 TYR 91 5.577 -9.273 -6.424 746 HH TYR 91 HH TYR 91 4.555 -11.622 -8.908 747 H PHE 92 H PHE 92 1.318 -4.356 -4.790 748 HA PHE 92 HA PHE 92 -1.396 -3.537 -5.566 749 HB2 PHE 92 HB2 PHE 92 -0.283 -2.953 -2.789 750 HB3 PHE 92 HB3 PHE 92 -1.765 -2.288 -3.459 751 HD1 PHE 92 HD1 PHE 92 -3.689 -3.868 -4.069 752 HD2 PHE 92 HD2 PHE 92 -0.288 -5.091 -1.716 753 HE1 PHE 92 HE1 PHE 92 -4.963 -5.836 -3.249 754 HE2 PHE 92 HE2 PHE 92 -1.598 -7.010 -0.836 755 HZ PHE 92 HZ PHE 92 -3.906 -7.423 -1.650 756 H VAL 93 H VAL 93 -1.527 -1.079 -5.477 757 HA VAL 93 HA VAL 93 1.110 0.299 -5.451 758 HB VAL 93 HB VAL 93 -1.052 0.859 -7.521 759 HG11 VAL 93 HG11 VAL 93 1.624 2.209 -6.944 760 HG12 VAL 93 HG12 VAL 93 0.667 2.464 -8.401 761 HG13 VAL 93 HG13 VAL 93 0.006 2.949 -6.848 762 HG21 VAL 93 HG21 VAL 93 0.746 0.255 -9.152 763 HG22 VAL 93 HG22 VAL 93 1.761 -0.286 -7.811 764 HG23 VAL 93 HG23 VAL 93 0.229 -1.114 -8.168 765 H ILE 94 H ILE 94 1.103 2.140 -4.266 766 HA ILE 94 HA ILE 94 -1.510 3.291 -3.455 767 HB ILE 94 HB ILE 94 -0.858 3.554 -1.162 768 HG12 ILE 94 HG12 ILE 94 1.690 1.980 -1.750 769 HG13 ILE 94 HG13 ILE 94 1.641 3.736 -1.577 770 HG21 ILE 94 HG21 ILE 94 -1.941 1.389 -1.865 771 HG22 ILE 94 HG22 ILE 94 -0.346 0.623 -1.887 772 HG23 ILE 94 HG23 ILE 94 -1.023 1.266 -0.382 773 HD11 ILE 94 HD11 ILE 94 0.693 3.476 0.706 774 HD12 ILE 94 HD12 ILE 94 0.906 1.729 0.559 775 HD13 ILE 94 HD13 ILE 94 2.322 2.791 0.535 776 H ARG 95 H ARG 95 -1.546 5.474 -2.982 777 HA ARG 95 HA ARG 95 0.741 7.056 -4.084 778 HB2 ARG 95 HB2 ARG 95 -0.678 8.836 -4.562 779 HB3 ARG 95 HB3 ARG 95 -1.491 7.372 -5.091 780 HG2 ARG 95 HG2 ARG 95 -3.289 8.311 -4.116 781 HG3 ARG 95 HG3 ARG 95 -2.609 7.590 -2.651 782 HD2 ARG 95 HD2 ARG 95 -1.493 9.745 -2.132 783 HD3 ARG 95 HD3 ARG 95 -2.313 10.462 -3.521 784 HE ARG 95 HE ARG 95 -3.625 9.283 -1.071 785 HH11 ARG 95 HH11 ARG 95 -5.618 9.833 -0.556 786 HH12 ARG 95 HH12 ARG 95 -6.493 11.051 -1.465 787 HH21 ARG 95 HH21 ARG 95 -3.979 11.500 -3.775 788 HH22 ARG 95 HH22 ARG 95 -5.589 11.946 -3.284 789 H ILE 96 H ILE 96 2.177 7.726 -2.727 790 HA ILE 96 HA ILE 96 1.487 8.191 0.137 791 HB ILE 96 HB ILE 96 3.910 7.947 0.559 792 HG12 ILE 96 HG12 ILE 96 4.184 6.862 -2.267 793 HG13 ILE 96 HG13 ILE 96 4.578 8.540 -1.863 794 HG21 ILE 96 HG21 ILE 96 2.485 5.630 -0.792 795 HG22 ILE 96 HG22 ILE 96 3.929 5.452 0.215 796 HG23 ILE 96 HG23 ILE 96 2.445 6.072 0.929 797 HD11 ILE 96 HD11 ILE 96 5.901 6.083 -0.701 798 HD12 ILE 96 HD12 ILE 96 6.584 7.246 -1.859 799 HD13 ILE 96 HD13 ILE 96 6.214 7.765 -0.198 800 H GLN 97 H GLN 97 2.532 9.908 1.287 801 HA GLN 97 HA GLN 97 3.245 12.339 -0.246 802 HB2 GLN 97 HB2 GLN 97 2.156 12.293 2.103 803 HB3 GLN 97 HB3 GLN 97 3.720 11.741 2.694 804 HG2 GLN 97 HG2 GLN 97 4.089 13.976 2.971 805 HG3 GLN 97 HG3 GLN 97 4.544 13.907 1.266 806 HE21 GLN 97 HE21 GLN 97 1.800 15.922 0.227 807 HE22 GLN 97 HE22 GLN 97 3.224 14.991 -0.256 808 H ASP 98 H ASP 98 5.424 12.832 -0.869 809 HA ASP 98 HA ASP 98 7.414 10.682 -0.421 810 HB2 ASP 98 HB2 ASP 98 6.895 11.760 -2.659 811 HB3 ASP 98 HB3 ASP 98 7.699 13.201 -2.037 812 H GLY 99 H GLY 99 6.521 13.176 1.456 813 HA2 GLY 99 HA2 GLY 99 7.455 13.925 3.428 814 HA3 GLY 99 HA3 GLY 99 8.958 13.097 3.027 815 H THR 100 H THR 100 8.394 15.041 0.400 816 HA THR 100 HA THR 100 10.030 17.290 1.482 817 HB THR 100 HB THR 100 10.948 17.513 -0.760 818 HG1 THR 100 HG1 THR 100 10.403 15.985 -2.314 819 HG21 THR 100 HG21 THR 100 12.243 15.479 -0.891 820 HG22 THR 100 HG22 THR 100 11.996 15.853 0.826 821 HG23 THR 100 HG23 THR 100 11.038 14.571 0.044 822 H GLY 101 H GLY 101 6.963 16.992 1.206 823 HA2 GLY 101 HA2 GLY 101 5.331 18.690 1.097 824 HA3 GLY 101 HA3 GLY 101 6.406 19.704 0.134 825 H ARG 102 H ARG 102 6.152 16.419 -0.881 826 HA ARG 102 HA ARG 102 4.145 17.003 -3.015 827 HB2 ARG 102 HB2 ARG 102 5.595 16.315 -4.720 828 HB3 ARG 102 HB3 ARG 102 6.550 17.415 -3.700 829 HG2 ARG 102 HG2 ARG 102 7.554 15.379 -2.620 830 HG3 ARG 102 HG3 ARG 102 6.738 14.387 -3.847 831 HD2 ARG 102 HD2 ARG 102 7.894 15.633 -5.639 832 HD3 ARG 102 HD3 ARG 102 8.725 16.623 -4.419 833 HE ARG 102 HE ARG 102 9.265 13.908 -3.794 834 HH11 ARG 102 HH11 ARG 102 10.995 12.898 -4.226 835 HH12 ARG 102 HH12 ARG 102 12.127 13.410 -5.485 836 HH21 ARG 102 HH21 ARG 102 10.143 16.111 -6.389 837 HH22 ARG 102 HH22 ARG 102 11.619 15.237 -6.708 838 H SER 103 H SER 103 3.711 14.935 -4.339 839 HA SER 103 HA SER 103 3.531 12.576 -2.525 840 HB2 SER 103 HB2 SER 103 1.464 11.954 -3.724 841 HB3 SER 103 HB3 SER 103 1.333 13.483 -2.839 842 HG SER 103 HG SER 103 0.455 13.651 -4.953 843 H ALA 104 H ALA 104 3.662 10.531 -3.396 844 HA ALA 104 HA ALA 104 4.671 10.175 -6.178 845 HB1 ALA 104 HB1 ALA 104 6.090 9.141 -3.692 846 HB2 ALA 104 HB2 ALA 104 6.513 8.745 -5.370 847 HB3 ALA 104 HB3 ALA 104 6.681 10.411 -4.787 848 H PHE 105 H PHE 105 4.341 8.112 -7.095 849 HA PHE 105 HA PHE 105 2.474 6.325 -5.609 850 HB2 PHE 105 HB2 PHE 105 3.297 6.166 -8.516 851 HB3 PHE 105 HB3 PHE 105 2.003 5.284 -7.713 852 HD1 PHE 105 HD1 PHE 105 2.908 8.308 -9.472 853 HD2 PHE 105 HD2 PHE 105 0.024 6.658 -6.719 854 HE1 PHE 105 HE1 PHE 105 1.380 10.195 -9.942 855 HE2 PHE 105 HE2 PHE 105 -1.523 8.530 -7.233 856 HZ PHE 105 HZ PHE 105 -0.864 10.297 -8.837 857 H ILE 106 H ILE 106 3.134 4.472 -4.742 858 HA ILE 106 HA ILE 106 5.645 3.207 -5.760 859 HB ILE 106 HB ILE 106 6.017 2.193 -3.540 860 HG12 ILE 106 HG12 ILE 106 4.251 4.408 -2.409 861 HG13 ILE 106 HG13 ILE 106 3.730 2.735 -2.578 862 HG21 ILE 106 HG21 ILE 106 6.258 5.239 -3.638 863 HG22 ILE 106 HG22 ILE 106 7.291 4.124 -2.720 864 HG23 ILE 106 HG23 ILE 106 7.330 4.109 -4.484 865 HD11 ILE 106 HD11 ILE 106 6.078 3.635 -0.870 866 HD12 ILE 106 HD12 ILE 106 4.478 3.144 -0.303 867 HD13 ILE 106 HD13 ILE 106 5.522 1.958 -1.097 868 H GLY 107 H GLY 107 5.632 1.197 -6.308 869 HA2 GLY 107 HA2 GLY 107 3.194 -0.456 -6.094 870 HA3 GLY 107 HA3 GLY 107 4.669 -0.864 -6.974 871 H ILE 108 H ILE 108 3.016 -2.160 -4.756 872 HA ILE 108 HA ILE 108 5.212 -2.726 -2.821 873 HB ILE 108 HB ILE 108 2.230 -3.077 -2.295 874 HG12 ILE 108 HG12 ILE 108 4.114 -0.764 -1.664 875 HG13 ILE 108 HG13 ILE 108 2.571 -0.706 -2.510 876 HG21 ILE 108 HG21 ILE 108 4.674 -3.185 -0.500 877 HG22 ILE 108 HG22 ILE 108 2.987 -3.390 0.038 878 HG23 ILE 108 HG23 ILE 108 3.692 -4.581 -1.014 879 HD11 ILE 108 HD11 ILE 108 2.991 -1.194 0.461 880 HD12 ILE 108 HD12 ILE 108 2.307 0.219 -0.322 881 HD13 ILE 108 HD13 ILE 108 1.413 -1.320 -0.377 882 H GLY 109 H GLY 109 5.576 -4.931 -2.337 883 HA2 GLY 109 HA2 GLY 109 3.822 -7.007 -3.496 884 HA3 GLY 109 HA3 GLY 109 5.549 -7.132 -3.848 885 H PHE 110 H PHE 110 3.435 -8.583 -2.102 886 HA PHE 110 HA PHE 110 4.768 -8.548 0.545 887 HB2 PHE 110 HB2 PHE 110 2.183 -9.573 -0.566 888 HB3 PHE 110 HB3 PHE 110 2.763 -10.182 0.976 889 HD1 PHE 110 HD1 PHE 110 1.643 -7.086 -0.797 890 HD2 PHE 110 HD2 PHE 110 2.749 -8.867 2.976 891 HE1 PHE 110 HE1 PHE 110 0.813 -5.074 0.408 892 HE2 PHE 110 HE2 PHE 110 1.879 -6.881 4.170 893 HZ PHE 110 HZ PHE 110 0.954 -4.960 2.877 894 H THR 111 H THR 111 5.268 -10.425 1.705 895 HA THR 111 HA THR 111 6.822 -12.348 0.160 896 HB THR 111 HB THR 111 7.498 -11.203 2.284 897 HG1 THR 111 HG1 THR 111 8.723 -12.925 2.870 898 HG21 THR 111 HG21 THR 111 6.973 -12.268 4.415 899 HG22 THR 111 HG22 THR 111 5.492 -11.645 3.667 900 HG23 THR 111 HG23 THR 111 5.853 -13.387 3.624 901 H ASP 112 H ASP 112 3.722 -12.333 1.720 902 HA ASP 112 HA ASP 112 3.246 -15.171 0.940 903 HB2 ASP 112 HB2 ASP 112 3.675 -14.759 3.470 904 HB3 ASP 112 HB3 ASP 112 2.097 -13.956 3.470 905 H ARG 113 H ARG 113 1.233 -15.635 0.097 906 HA ARG 113 HA ARG 113 -0.399 -13.510 -0.974 907 HB2 ARG 113 HB2 ARG 113 -0.747 -16.524 -0.667 908 HB3 ARG 113 HB3 ARG 113 -2.055 -15.529 -1.297 909 HG2 ARG 113 HG2 ARG 113 0.731 -15.530 -2.519 910 HG3 ARG 113 HG3 ARG 113 -0.575 -16.606 -3.038 911 HD2 ARG 113 HD2 ARG 113 -2.004 -14.684 -3.573 912 HD3 ARG 113 HD3 ARG 113 -0.744 -13.556 -3.057 913 HE ARG 113 HE ARG 113 0.598 -15.054 -4.890 914 HH11 ARG 113 HH11 ARG 113 0.789 -14.699 -7.077 915 HH12 ARG 113 HH12 ARG 113 -0.485 -13.851 -7.914 916 HH21 ARG 113 HH21 ARG 113 -2.510 -13.452 -5.223 917 HH22 ARG 113 HH22 ARG 113 -2.300 -13.318 -6.968 918 H GLY 114 H GLY 114 -0.691 -15.379 2.040 919 HA2 GLY 114 HA2 GLY 114 -3.340 -14.370 2.706 920 HA3 GLY 114 HA3 GLY 114 -2.173 -15.137 3.800 921 H ASP 115 H ASP 115 0.013 -13.239 3.330 922 HA ASP 115 HA ASP 115 -0.804 -11.099 5.098 923 HB2 ASP 115 HB2 ASP 115 1.757 -11.592 3.567 924 HB3 ASP 115 HB3 ASP 115 1.491 -10.173 4.569 925 H ALA 116 H ALA 116 -0.323 -11.288 1.565 926 HA ALA 116 HA ALA 116 -0.920 -8.493 1.128 927 HB1 ALA 116 HB1 ALA 116 -1.402 -10.561 -0.988 928 HB2 ALA 116 HB2 ALA 116 -0.599 -8.969 -1.062 929 HB3 ALA 116 HB3 ALA 116 0.240 -10.378 -0.378 930 H PHE 117 H PHE 117 -2.942 -11.486 0.914 931 HA PHE 117 HA PHE 117 -5.364 -10.169 0.246 932 HB2 PHE 117 HB2 PHE 117 -4.744 -12.656 0.211 933 HB3 PHE 117 HB3 PHE 117 -5.164 -12.683 1.917 934 HD1 PHE 117 HD1 PHE 117 -7.550 -12.521 2.581 935 HD2 PHE 117 HD2 PHE 117 -6.376 -12.304 -1.569 936 HE1 PHE 117 HE1 PHE 117 -9.882 -13.036 1.881 937 HE2 PHE 117 HE2 PHE 117 -8.699 -12.799 -2.259 938 HZ PHE 117 HZ PHE 117 -10.453 -13.201 -0.534 939 H ASP 118 H ASP 118 -3.749 -10.439 3.396 940 HA ASP 118 HA ASP 118 -5.975 -9.367 4.951 941 HB2 ASP 118 HB2 ASP 118 -3.032 -9.809 5.430 942 HB3 ASP 118 HB3 ASP 118 -4.013 -8.889 6.570 943 H PHE 119 H PHE 119 -3.076 -7.949 3.296 944 HA PHE 119 HA PHE 119 -3.491 -5.282 4.141 945 HB2 PHE 119 HB2 PHE 119 -1.444 -5.880 3.092 946 HB3 PHE 119 HB3 PHE 119 -2.242 -6.451 1.644 947 HD1 PHE 119 HD1 PHE 119 -0.905 -3.519 3.322 948 HD2 PHE 119 HD2 PHE 119 -3.327 -4.859 0.060 949 HE1 PHE 119 HE1 PHE 119 -0.804 -1.274 2.353 950 HE2 PHE 119 HE2 PHE 119 -3.164 -2.598 -0.988 951 HZ PHE 119 HZ PHE 119 -1.917 -0.791 0.175 952 H ASN 120 H ASN 120 -4.947 -7.121 1.467 953 HA ASN 120 HA ASN 120 -6.651 -4.964 0.549 954 HB2 ASN 120 HB2 ASN 120 -6.263 -6.610 -1.035 955 HB3 ASN 120 HB3 ASN 120 -6.497 -7.948 0.104 956 HD21 ASN 120 HD21 ASN 120 -9.747 -6.267 -1.674 957 HD22 ASN 120 HD22 ASN 120 -8.214 -5.383 -1.653 958 H VAL 121 H VAL 121 -7.518 -7.895 2.519 959 HA VAL 121 HA VAL 121 -10.197 -7.033 2.771 960 HB VAL 121 HB VAL 121 -8.542 -9.120 4.103 961 HG11 VAL 121 HG11 VAL 121 -11.508 -8.656 4.651 962 HG12 VAL 121 HG12 VAL 121 -10.610 -10.129 5.082 963 HG13 VAL 121 HG13 VAL 121 -10.193 -8.600 5.851 964 HG21 VAL 121 HG21 VAL 121 -9.203 -9.537 1.799 965 HG22 VAL 121 HG22 VAL 121 -10.064 -10.644 2.861 966 HG23 VAL 121 HG23 VAL 121 -10.908 -9.229 2.193 967 H SER 122 H SER 122 -7.478 -6.300 4.937 968 HA SER 122 HA SER 122 -9.060 -5.188 7.068 969 HB2 SER 122 HB2 SER 122 -7.034 -3.873 7.616 970 HB3 SER 122 HB3 SER 122 -6.717 -5.609 7.430 971 HG SER 122 HG SER 122 -5.761 -5.255 5.510 972 H LEU 123 H LEU 123 -8.220 -3.896 3.881 973 HA LEU 123 HA LEU 123 -9.448 -1.274 4.497 974 HB2 LEU 123 HB2 LEU 123 -8.312 -2.412 1.933 975 HB3 LEU 123 HB3 LEU 123 -8.858 -0.752 2.154 976 HG LEU 123 HG LEU 123 -6.579 -2.038 3.717 977 HD11 LEU 123 HD11 LEU 123 -6.324 -0.049 1.465 978 HD12 LEU 123 HD12 LEU 123 -5.053 -1.007 2.265 979 HD13 LEU 123 HD13 LEU 123 -6.213 -1.810 1.220 980 HD21 LEU 123 HD21 LEU 123 -7.571 -0.137 4.920 981 HD22 LEU 123 HD22 LEU 123 -5.986 0.297 4.283 982 HD23 LEU 123 HD23 LEU 123 -7.452 0.870 3.460 983 H GLN 124 H GLN 124 -10.271 -4.260 2.665 984 HA GLN 124 HA GLN 124 -12.711 -3.349 1.504 985 HB2 GLN 124 HB2 GLN 124 -12.092 -6.095 2.658 986 HB3 GLN 124 HB3 GLN 124 -13.468 -5.730 1.647 987 HG2 GLN 124 HG2 GLN 124 -10.646 -5.265 0.635 988 HG3 GLN 124 HG3 GLN 124 -11.403 -6.846 0.574 989 HE21 GLN 124 HE21 GLN 124 -12.474 -4.132 -2.223 990 HE22 GLN 124 HE22 GLN 124 -11.239 -3.732 -1.043 991 H ASP 125 H ASP 125 -12.224 -4.892 4.746 992 HA ASP 125 HA ASP 125 -14.981 -4.411 5.548 993 HB2 ASP 125 HB2 ASP 125 -13.422 -6.268 6.328 994 HB3 ASP 125 HB3 ASP 125 -12.558 -5.042 7.272 995 H HIS 126 H HIS 126 -12.363 -2.261 5.339 996 HA HIS 126 HA HIS 126 -13.347 -0.463 7.483 997 HB2 HIS 126 HB2 HIS 126 -10.942 -0.542 7.156 998 HB3 HIS 126 HB3 HIS 126 -11.128 -0.095 5.455 999 HD2 HIS 126 HD2 HIS 126 -12.100 1.432 8.931 1000 HE1 HIS 126 HE1 HIS 126 -11.266 4.653 6.271 1001 HE2 HIS 126 HE2 HIS 126 -11.986 4.057 8.626 1002 H PHE 127 H PHE 127 -13.355 -0.729 3.908 1003 HA PHE 127 HA PHE 127 -15.128 1.616 3.763 1004 HB2 PHE 127 HB2 PHE 127 -13.731 -0.009 1.645 1005 HB3 PHE 127 HB3 PHE 127 -14.893 1.263 1.279 1006 HD1 PHE 127 HD1 PHE 127 -11.437 0.611 2.110 1007 HD2 PHE 127 HD2 PHE 127 -14.521 3.616 2.285 1008 HE1 PHE 127 HE1 PHE 127 -9.717 2.347 2.498 1009 HE2 PHE 127 HE2 PHE 127 -12.804 5.346 2.736 1010 HZ PHE 127 HZ PHE 127 -10.398 4.718 2.827 1011 H LYS 128 H LYS 128 -15.694 -1.790 3.975 1012 HA LYS 128 HA LYS 128 -18.049 -1.976 2.480 1013 HB2 LYS 128 HB2 LYS 128 -18.512 -4.007 3.509 1014 HB3 LYS 128 HB3 LYS 128 -16.779 -3.867 3.446 1015 HG2 LYS 128 HG2 LYS 128 -17.013 -4.701 5.548 1016 HG3 LYS 128 HG3 LYS 128 -17.061 -2.974 5.953 1017 HD2 LYS 128 HD2 LYS 128 -19.624 -3.230 5.799 1018 HD3 LYS 128 HD3 LYS 128 -19.338 -4.963 5.633 1019 HE2 LYS 128 HE2 LYS 128 -18.360 -3.312 7.993 1020 HE3 LYS 128 HE3 LYS 128 -19.967 -4.039 7.940 1021 HZ1 LYS 128 HZ1 LYS 128 -17.404 -5.545 7.816 1022 HZ2 LYS 128 HZ2 LYS 128 -18.434 -5.504 9.076 1023 HZ3 LYS 128 HZ3 LYS 128 -18.892 -6.225 7.684 1024 H TRP 129 H TRP 129 -17.727 -0.441 5.582 1025 HA TRP 129 HA TRP 129 -20.678 -0.045 5.808 1026 HB2 TRP 129 HB2 TRP 129 -20.164 0.571 8.131 1027 HB3 TRP 129 HB3 TRP 129 -19.685 -1.063 7.718 1028 HD1 TRP 129 HD1 TRP 129 -17.083 -1.675 7.819 1029 HE1 TRP 129 HE1 TRP 129 -15.040 -0.495 8.681 1030 HE3 TRP 129 HE3 TRP 129 -19.069 2.995 8.445 1031 HZ2 TRP 129 HZ2 TRP 129 -14.316 2.155 9.675 1032 HZ3 TRP 129 HZ3 TRP 129 -17.661 4.855 9.343 1033 HH2 TRP 129 HH2 TRP 129 -15.285 4.441 9.947 1034 H VAL 130 H VAL 130 -18.286 1.468 4.288 1035 HA VAL 130 HA VAL 130 -19.073 4.289 4.915 1036 HB VAL 130 HB VAL 130 -16.599 3.105 3.625 1037 HG11 VAL 130 HG11 VAL 130 -17.202 6.025 4.142 1038 HG12 VAL 130 HG12 VAL 130 -15.568 5.372 3.878 1039 HG13 VAL 130 HG13 VAL 130 -16.732 5.249 2.594 1040 HG21 VAL 130 HG21 VAL 130 -15.413 3.933 5.630 1041 HG22 VAL 130 HG22 VAL 130 -16.943 4.560 6.285 1042 HG23 VAL 130 HG23 VAL 130 -16.683 2.816 6.100 1043 H LYS 131 H LYS 131 -18.745 5.623 2.733 1044 HA LYS 131 HA LYS 131 -19.330 6.184 0.674 1045 HB2 LYS 131 HB2 LYS 131 -17.637 4.007 0.573 1046 HB3 LYS 131 HB3 LYS 131 -18.972 3.406 -0.388 1047 HG2 LYS 131 HG2 LYS 131 -17.474 4.385 -1.912 1048 HG3 LYS 131 HG3 LYS 131 -18.782 5.574 -1.754 1049 HD2 LYS 131 HD2 LYS 131 -17.397 6.924 -0.217 1050 HD3 LYS 131 HD3 LYS 131 -16.160 5.662 -0.196 1051 HE2 LYS 131 HE2 LYS 131 -15.383 7.394 -1.650 1052 HE3 LYS 131 HE3 LYS 131 -15.781 5.978 -2.630 1053 HZ1 LYS 131 HZ1 LYS 131 -17.531 8.368 -2.311 1054 HZ2 LYS 131 HZ2 LYS 131 -16.625 8.038 -3.624 1055 HZ3 LYS 131 HZ3 LYS 131 -17.876 7.067 -3.243 1056 H GLN 132 H GLN 132 -21.424 4.658 2.270 1057 HA GLN 132 HA GLN 132 -23.597 4.046 2.164 1058 HB2 GLN 132 HB2 GLN 132 -23.873 6.235 0.086 1059 HB3 GLN 132 HB3 GLN 132 -25.092 5.663 1.224 1060 HG2 GLN 132 HG2 GLN 132 -22.585 7.276 1.834 1061 HG3 GLN 132 HG3 GLN 132 -24.256 7.771 2.037 1062 HE21 GLN 132 HE21 GLN 132 -22.424 6.080 5.164 1063 HE22 GLN 132 HE22 GLN 132 -21.588 6.810 3.803 1064 H GLU 133 H GLU 133 -21.961 2.440 0.570 1065 HA GLU 133 HA GLU 133 -23.562 1.585 -1.723 1066 HB2 GLU 133 HB2 GLU 133 -21.091 0.445 -0.370 1067 HB3 GLU 133 HB3 GLU 133 -21.867 -0.319 -1.755 1068 HG2 GLU 133 HG2 GLU 133 -20.784 2.535 -1.790 1069 HG3 GLU 133 HG3 GLU 133 -19.867 1.127 -2.287 1070 H1 SER 149 H1 SER 149 2.229 -22.233 -22.053 1071 H2 SER 149 H2 SER 149 3.589 -21.870 -22.892 1072 H3 SER 149 H3 SER 149 2.187 -21.077 -23.214 1073 HA SER 149 HA SER 149 3.696 -19.686 -21.966 1074 HB2 SER 149 HB2 SER 149 1.206 -20.483 -20.405 1075 HB3 SER 149 HB3 SER 149 2.095 -18.949 -20.280 1076 HG SER 149 HG SER 149 0.291 -18.786 -21.690 1077 H GLN 150 H GLN 150 4.704 -19.216 -19.912 1078 HA GLN 150 HA GLN 150 5.143 -21.504 -18.051 1079 HB2 GLN 150 HB2 GLN 150 7.310 -19.748 -19.277 1080 HB3 GLN 150 HB3 GLN 150 7.542 -20.834 -17.900 1081 HG2 GLN 150 HG2 GLN 150 6.870 -22.772 -19.323 1082 HG3 GLN 150 HG3 GLN 150 6.734 -21.691 -20.712 1083 HE21 GLN 150 HE21 GLN 150 10.063 -23.198 -21.060 1084 HE22 GLN 150 HE22 GLN 150 8.380 -23.683 -21.224 1085 H ILE 151 H ILE 151 5.741 -20.889 -15.915 1086 HA ILE 151 HA ILE 151 4.386 -18.459 -15.050 1087 HB ILE 151 HB ILE 151 5.828 -20.605 -13.457 1088 HG12 ILE 151 HG12 ILE 151 2.849 -20.111 -13.952 1089 HG13 ILE 151 HG13 ILE 151 3.805 -21.375 -14.720 1090 HG21 ILE 151 HG21 ILE 151 4.027 -18.324 -12.496 1091 HG22 ILE 151 HG22 ILE 151 4.658 -19.637 -11.481 1092 HG23 ILE 151 HG23 ILE 151 5.775 -18.490 -12.177 1093 HD11 ILE 151 HD11 ILE 151 4.267 -22.365 -12.458 1094 HD12 ILE 151 HD12 ILE 151 3.093 -21.209 -11.776 1095 HD13 ILE 151 HD13 ILE 151 2.568 -22.400 -12.970 1096 H THR 152 H THR 152 5.186 -16.573 -14.631 1097 HA THR 152 HA THR 152 8.106 -16.136 -14.312 1098 HB THR 152 HB THR 152 5.870 -14.515 -15.559 1099 HG1 THR 152 HG1 THR 152 6.737 -16.111 -16.872 1100 HG21 THR 152 HG21 THR 152 8.723 -13.610 -15.138 1101 HG22 THR 152 HG22 THR 152 7.631 -12.891 -16.356 1102 HG23 THR 152 HG23 THR 152 7.205 -12.817 -14.641 1103 H SER 153 H SER 153 5.609 -16.251 -12.751 1104 HA SER 153 HA SER 153 4.571 -15.629 -10.794 1105 HB2 SER 153 HB2 SER 153 7.187 -14.343 -9.990 1106 HB3 SER 153 HB3 SER 153 5.815 -14.674 -8.916 1107 HG SER 153 HG SER 153 7.439 -16.324 -8.817 1108 H GLN 154 H GLN 154 4.339 -14.217 -13.004 1109 HA GLN 154 HA GLN 154 4.207 -11.419 -12.879 1110 HB2 GLN 154 HB2 GLN 154 2.960 -11.596 -14.894 1111 HB3 GLN 154 HB3 GLN 154 4.211 -12.816 -14.922 1112 HG2 GLN 154 HG2 GLN 154 1.289 -13.304 -14.208 1113 HG3 GLN 154 HG3 GLN 154 1.961 -13.487 -15.816 1114 HE21 GLN 154 HE21 GLN 154 1.774 -16.871 -14.229 1115 HE22 GLN 154 HE22 GLN 154 0.587 -15.593 -14.544 1116 H VAL 155 H VAL 155 2.271 -10.016 -12.930 1117 HA VAL 155 HA VAL 155 0.034 -10.945 -11.229 1118 HB VAL 155 HB VAL 155 0.794 -8.644 -10.888 1119 HG11 VAL 155 HG11 VAL 155 1.381 -7.909 -13.102 1120 HG12 VAL 155 HG12 VAL 155 -0.295 -8.102 -13.659 1121 HG13 VAL 155 HG13 VAL 155 0.087 -6.885 -12.436 1122 HG21 VAL 155 HG21 VAL 155 -1.359 -9.178 -10.100 1123 HG22 VAL 155 HG22 VAL 155 -1.543 -7.643 -10.920 1124 HG23 VAL 155 HG23 VAL 155 -2.110 -9.092 -11.713 1125 H TPO 156 H T2P 156 -1.882 -11.395 -11.986 1126 HA TPO 156 HA T2P 156 -1.945 -12.655 -14.598 1127 HB TPO 156 HB T2P 156 -3.173 -12.980 -12.059 1128 HG21 TPO 156 HG21 T2P 156 -5.227 -13.761 -12.220 1129 HG22 TPO 156 HG22 T2P 156 -5.201 -13.878 -14.008 1130 HG23 TPO 156 HG23 T2P 156 -5.279 -12.301 -13.172 1131 H GLY 157 H GLY 157 -3.871 -12.940 -15.670 1132 HA2 GLY 157 HA2 GLY 157 -5.790 -10.755 -15.966 1133 HA3 GLY 157 HA3 GLY 157 -4.802 -11.030 -17.406 1134 H GLN 158 H GLN 158 -4.945 -14.144 -16.373 1135 HA GLN 158 HA GLN 158 -7.471 -14.603 -17.898 1136 HB2 GLN 158 HB2 GLN 158 -6.570 -16.587 -18.782 1137 HB3 GLN 158 HB3 GLN 158 -5.418 -15.283 -18.992 1138 HG2 GLN 158 HG2 GLN 158 -4.049 -17.055 -18.368 1139 HG3 GLN 158 HG3 GLN 158 -4.264 -16.165 -16.876 1140 HE21 GLN 158 HE21 GLN 158 -4.938 -19.230 -15.305 1141 HE22 GLN 158 HE22 GLN 158 -3.991 -17.734 -15.315 1142 H ILE 159 H ILE 159 -6.060 -15.549 -14.769 1143 HA ILE 159 HA ILE 159 -8.227 -17.513 -14.426 1144 HB ILE 159 HB ILE 159 -6.074 -18.021 -13.473 1145 HG12 ILE 159 HG12 ILE 159 -6.783 -18.753 -11.223 1146 HG13 ILE 159 HG13 ILE 159 -8.220 -17.744 -11.343 1147 HG21 ILE 159 HG21 ILE 159 -5.192 -15.942 -12.753 1148 HG22 ILE 159 HG22 ILE 159 -6.508 -15.703 -11.567 1149 HG23 ILE 159 HG23 ILE 159 -5.301 -16.977 -11.346 1150 HD11 ILE 159 HD11 ILE 159 -7.550 -20.058 -13.220 1151 HD12 ILE 159 HD12 ILE 159 -8.636 -20.158 -11.819 1152 HD13 ILE 159 HD13 ILE 159 -9.073 -19.132 -13.192 1153 H GLY 160 H GLY 160 -7.585 -14.236 -13.346 1154 HA2 GLY 160 HA2 GLY 160 -9.042 -12.550 -12.706 1155 HA3 GLY 160 HA3 GLY 160 -10.350 -13.531 -13.375 1156 H TRP 161 H TRP 161 -8.147 -13.808 -10.526 1157 HA TRP 161 HA TRP 161 -10.374 -14.839 -8.864 1158 HB2 TRP 161 HB2 TRP 161 -8.699 -16.176 -7.799 1159 HB3 TRP 161 HB3 TRP 161 -8.567 -16.413 -9.515 1160 HD1 TRP 161 HD1 TRP 161 -6.677 -13.453 -9.528 1161 HE1 TRP 161 HE1 TRP 161 -4.172 -13.849 -9.205 1162 HE3 TRP 161 HE3 TRP 161 -6.908 -17.787 -6.922 1163 HZ2 TRP 161 HZ2 TRP 161 -2.473 -15.907 -8.157 1164 HZ3 TRP 161 HZ3 TRP 161 -4.816 -18.939 -6.166 1165 HH2 TRP 161 HH2 TRP 161 -2.591 -18.014 -6.799 1166 H ARG 162 H ARG 162 -9.067 -14.751 -6.513 1167 HA ARG 162 HA ARG 162 -8.565 -13.562 -4.731 1168 HB2 ARG 162 HB2 ARG 162 -6.786 -12.310 -6.782 1169 HB3 ARG 162 HB3 ARG 162 -6.644 -11.888 -5.072 1170 HG2 ARG 162 HG2 ARG 162 -6.540 -14.745 -6.033 1171 HG3 ARG 162 HG3 ARG 162 -5.110 -13.708 -5.996 1172 HD2 ARG 162 HD2 ARG 162 -5.329 -13.453 -3.573 1173 HD3 ARG 162 HD3 ARG 162 -6.828 -14.411 -3.586 1174 HE ARG 162 HE ARG 162 -4.779 -15.935 -4.842 1175 HH11 ARG 162 HH11 ARG 162 -3.808 -17.645 -3.838 1176 HH12 ARG 162 HH12 ARG 162 -3.885 -17.806 -2.110 1177 HH21 ARG 162 HH21 ARG 162 -5.680 -14.925 -1.608 1178 HH22 ARG 162 HH22 ARG 162 -4.916 -16.303 -0.870 1179 H ARG 163 H ARG 163 -7.926 -10.804 -4.260 1180 HA ARG 163 HA ARG 163 -10.391 -9.272 -4.869 1181 HB2 ARG 163 HB2 ARG 163 -9.362 -9.853 -2.065 1182 HB3 ARG 163 HB3 ARG 163 -10.527 -8.584 -2.467 1183 HG2 ARG 163 HG2 ARG 163 -12.108 -10.327 -3.321 1184 HG3 ARG 163 HG3 ARG 163 -10.943 -11.572 -2.854 1185 HD2 ARG 163 HD2 ARG 163 -12.486 -11.520 -1.104 1186 HD3 ARG 163 HD3 ARG 163 -11.063 -10.672 -0.475 1187 HE ARG 163 HE ARG 163 -12.644 -8.633 -1.469 1188 HH11 ARG 163 HH11 ARG 163 -14.158 -7.498 -0.377 1189 HH12 ARG 163 HH12 ARG 163 -15.033 -8.230 0.953 1190 HH21 ARG 163 HH21 ARG 163 -13.288 -11.180 0.855 1191 HH22 ARG 163 HH22 ARG 163 -14.519 -10.248 1.659 Start of MODEL 18 1 H1 GLY -4 H1 GLY -4 -21.594 24.966 29.337 2 H2 GLY -4 H2 GLY -4 -19.984 25.243 29.208 3 H3 GLY -4 H3 GLY -4 -20.586 23.757 28.882 4 HA2 GLY -4 HA2 GLY -4 -21.783 24.580 26.969 5 HA3 GLY -4 HA3 GLY -4 -21.153 26.199 27.328 6 H SER -3 H SER -3 -20.807 24.647 24.883 7 HA SER -3 HA SER -3 -18.226 23.458 24.723 8 HB2 SER -3 HB2 SER -3 -19.917 24.707 22.525 9 HB3 SER -3 HB3 SER -3 -18.550 23.604 22.284 10 HG SER -3 HG SER -3 -20.571 22.501 22.250 11 HA PRO -2 HA PRO -2 -15.559 27.055 24.227 12 HB2 PRO -2 HB2 PRO -2 -13.414 25.994 22.927 13 HB3 PRO -2 HB3 PRO -2 -13.820 25.550 24.613 14 HG2 PRO -2 HG2 PRO -2 -14.558 24.052 22.071 15 HG3 PRO -2 HG3 PRO -2 -13.768 23.400 23.544 16 HD2 PRO -2 HD2 PRO -2 -16.453 23.205 23.152 17 HD3 PRO -2 HD3 PRO -2 -15.779 23.506 24.781 18 H ASN -1 H ASN -1 -14.528 28.400 22.503 19 HA ASN -1 HA ASN -1 -16.205 28.847 20.239 20 HB2 ASN -1 HB2 ASN -1 -14.796 30.561 21.360 21 HB3 ASN -1 HB3 ASN -1 -13.336 29.743 20.794 22 HD21 ASN -1 HD21 ASN -1 -15.570 31.953 18.139 23 HD22 ASN -1 HD22 ASN -1 -16.305 31.423 19.645 24 H SER 0 H SER 0 -13.307 26.855 20.583 25 HA SER 0 HA SER 0 -13.056 26.170 17.758 26 HB2 SER 0 HB2 SER 0 -11.905 24.833 20.237 27 HB3 SER 0 HB3 SER 0 -11.442 24.507 18.554 28 HG SER 0 HG SER 0 -10.019 26.002 19.576 29 H MET 1 H MET 1 -15.411 25.732 17.526 30 HA MET 1 HA MET 1 -16.722 23.532 18.751 31 HB2 MET 1 HB2 MET 1 -17.184 24.933 16.085 32 HB3 MET 1 HB3 MET 1 -18.280 23.715 16.729 33 HG2 MET 1 HG2 MET 1 -17.551 26.317 18.126 34 HG3 MET 1 HG3 MET 1 -19.015 26.043 17.194 35 HE1 MET 1 HE1 MET 1 -21.046 24.601 17.923 36 HE2 MET 1 HE2 MET 1 -20.056 23.131 18.084 37 HE3 MET 1 HE3 MET 1 -21.123 23.632 19.409 38 H ALA 2 H ALA 2 -14.428 23.462 16.151 39 HA ALA 2 HA ALA 2 -14.330 20.571 16.741 40 HB1 ALA 2 HB1 ALA 2 -13.294 20.090 14.583 41 HB2 ALA 2 HB2 ALA 2 -14.972 20.656 14.376 42 HB3 ALA 2 HB3 ALA 2 -13.603 21.752 14.036 43 H THR 3 H THR 3 -12.463 19.982 17.588 44 HA THR 3 HA THR 3 -10.328 21.983 17.966 45 HB THR 3 HB THR 3 -9.549 20.275 19.651 46 HG1 THR 3 HG1 THR 3 -11.076 18.710 20.235 47 HG21 THR 3 HG21 THR 3 -11.275 20.822 21.310 48 HG22 THR 3 HG22 THR 3 -10.923 22.240 20.308 49 HG23 THR 3 HG23 THR 3 -12.401 21.297 20.017 50 H GLU 4 H GLU 4 -10.751 18.940 16.434 51 HA GLU 4 HA GLU 4 -9.510 17.404 15.414 52 HB2 GLU 4 HB2 GLU 4 -8.682 19.160 13.945 53 HB3 GLU 4 HB3 GLU 4 -7.365 19.514 15.062 54 HG2 GLU 4 HG2 GLU 4 -6.540 18.193 13.212 55 HG3 GLU 4 HG3 GLU 4 -6.410 17.295 14.713 56 H LEU 5 H LEU 5 -8.299 15.698 15.975 57 HA LEU 5 HA LEU 5 -6.864 15.819 18.599 58 HB2 LEU 5 HB2 LEU 5 -8.576 13.604 17.422 59 HB3 LEU 5 HB3 LEU 5 -7.633 13.458 18.905 60 HG LEU 5 HG LEU 5 -9.967 15.379 18.474 61 HD11 LEU 5 HD11 LEU 5 -11.167 13.896 20.015 62 HD12 LEU 5 HD12 LEU 5 -10.637 13.007 18.578 63 HD13 LEU 5 HD13 LEU 5 -9.755 12.818 20.109 64 HD21 LEU 5 HD21 LEU 5 -8.410 16.312 20.126 65 HD22 LEU 5 HD22 LEU 5 -9.848 15.697 20.939 66 HD23 LEU 5 HD23 LEU 5 -8.342 14.753 20.980 67 H GLU 6 H GLU 6 -6.450 15.364 15.369 68 HA GLU 6 HA GLU 6 -4.739 14.583 14.033 69 HB2 GLU 6 HB2 GLU 6 -3.094 15.488 16.412 70 HB3 GLU 6 HB3 GLU 6 -2.512 15.247 14.754 71 HG2 GLU 6 HG2 GLU 6 -4.132 17.027 14.011 72 HG3 GLU 6 HG3 GLU 6 -4.455 17.354 15.727 73 H TYR 7 H TYR 7 -5.781 12.332 14.610 74 HA TYR 7 HA TYR 7 -3.701 10.501 15.692 75 HB2 TYR 7 HB2 TYR 7 -5.298 9.320 16.917 76 HB3 TYR 7 HB3 TYR 7 -5.652 11.000 17.261 77 HD1 TYR 7 HD1 TYR 7 -6.946 7.850 16.023 78 HD2 TYR 7 HD2 TYR 7 -7.625 12.111 16.011 79 HE1 TYR 7 HE1 TYR 7 -9.274 7.469 15.274 80 HE2 TYR 7 HE2 TYR 7 -9.982 11.726 15.287 81 HH TYR 7 HH TYR 7 -11.285 8.432 14.724 82 H GLU 8 H GLU 8 -4.421 8.187 15.272 83 HA GLU 8 HA GLU 8 -6.105 7.515 13.102 84 HB2 GLU 8 HB2 GLU 8 -4.439 6.424 11.634 85 HB3 GLU 8 HB3 GLU 8 -4.418 8.159 11.533 86 HG2 GLU 8 HG2 GLU 8 -2.482 6.845 13.432 87 HG3 GLU 8 HG3 GLU 8 -2.183 6.709 11.717 88 H SER 9 H SER 9 -6.815 5.546 13.518 89 HA SER 9 HA SER 9 -5.655 4.015 15.748 90 HB2 SER 9 HB2 SER 9 -8.340 4.000 14.363 91 HB3 SER 9 HB3 SER 9 -7.900 2.871 15.664 92 HG SER 9 HG SER 9 -8.972 4.727 16.491 93 H VAL 10 H VAL 10 -4.676 2.030 15.514 94 HA VAL 10 HA VAL 10 -3.979 1.024 12.959 95 HB VAL 10 HB VAL 10 -3.954 -0.468 15.576 96 HG11 VAL 10 HG11 VAL 10 -2.370 -0.942 13.007 97 HG12 VAL 10 HG12 VAL 10 -2.103 -1.783 14.552 98 HG13 VAL 10 HG13 VAL 10 -3.615 -2.017 13.688 99 HG21 VAL 10 HG21 VAL 10 -2.635 1.654 15.701 100 HG22 VAL 10 HG22 VAL 10 -1.617 0.221 15.788 101 HG23 VAL 10 HG23 VAL 10 -1.711 1.137 14.273 102 H LEU 11 H LEU 11 -4.812 -0.318 11.570 103 HA LEU 11 HA LEU 11 -7.299 -1.869 12.191 104 HB2 LEU 11 HB2 LEU 11 -6.236 -0.835 9.533 105 HB3 LEU 11 HB3 LEU 11 -7.687 -1.802 9.752 106 HG LEU 11 HG LEU 11 -7.259 1.054 10.723 107 HD11 LEU 11 HD11 LEU 11 -9.006 -0.220 8.578 108 HD12 LEU 11 HD12 LEU 11 -9.086 1.477 9.072 109 HD13 LEU 11 HD13 LEU 11 -7.611 0.852 8.321 110 HD21 LEU 11 HD21 LEU 11 -9.700 0.947 11.319 111 HD22 LEU 11 HD22 LEU 11 -9.655 -0.808 11.058 112 HD23 LEU 11 HD23 LEU 11 -8.686 -0.057 12.353 113 H CYS 12 H CYS 12 -4.081 -2.015 10.608 114 HA CYS 12 HA CYS 12 -4.084 -4.946 10.837 115 HB2 CYS 12 HB2 CYS 12 -5.172 -4.343 8.631 116 HB3 CYS 12 HB3 CYS 12 -3.612 -3.678 8.118 117 HG CYS 12 HG CYS 12 -4.023 -6.053 7.059 118 H VAL 13 H VAL 13 -2.099 -5.894 10.754 119 HA VAL 13 HA VAL 13 0.316 -4.291 10.338 120 HB VAL 13 HB VAL 13 -0.086 -4.032 12.710 121 HG11 VAL 13 HG11 VAL 13 -1.407 -6.069 13.202 122 HG12 VAL 13 HG12 VAL 13 0.066 -7.050 13.039 123 HG13 VAL 13 HG13 VAL 13 -0.060 -5.835 14.320 124 HG21 VAL 13 HG21 VAL 13 2.031 -4.831 13.596 125 HG22 VAL 13 HG22 VAL 13 2.225 -5.958 12.238 126 HG23 VAL 13 HG23 VAL 13 2.251 -4.199 11.964 127 H LYS 14 H LYS 14 1.734 -5.409 9.172 128 HA LYS 14 HA LYS 14 1.641 -8.367 9.268 129 HB2 LYS 14 HB2 LYS 14 1.668 -6.748 6.704 130 HB3 LYS 14 HB3 LYS 14 2.290 -8.378 6.749 131 HG2 LYS 14 HG2 LYS 14 -0.536 -7.615 7.588 132 HG3 LYS 14 HG3 LYS 14 -0.062 -8.215 5.997 133 HD2 LYS 14 HD2 LYS 14 0.802 -10.316 7.054 134 HD3 LYS 14 HD3 LYS 14 0.181 -9.764 8.629 135 HE2 LYS 14 HE2 LYS 14 -2.076 -9.641 7.769 136 HE3 LYS 14 HE3 LYS 14 -1.498 -10.015 6.133 137 HZ1 LYS 14 HZ1 LYS 14 -0.801 -12.199 6.940 138 HZ2 LYS 14 HZ2 LYS 14 -1.425 -11.886 8.433 139 HZ3 LYS 14 HZ3 LYS 14 -2.419 -11.976 7.121 140 HA PRO 15 HA PRO 15 5.612 -8.177 10.572 141 HB2 PRO 15 HB2 PRO 15 6.542 -10.727 10.146 142 HB3 PRO 15 HB3 PRO 15 5.200 -10.341 11.263 143 HG2 PRO 15 HG2 PRO 15 4.978 -11.272 8.366 144 HG3 PRO 15 HG3 PRO 15 4.140 -11.941 9.807 145 HD2 PRO 15 HD2 PRO 15 2.937 -10.167 8.210 146 HD3 PRO 15 HD3 PRO 15 2.749 -10.075 9.989 147 H ASP 16 H ASP 16 5.415 -9.100 7.162 148 HA ASP 16 HA ASP 16 8.029 -7.821 6.639 149 HB2 ASP 16 HB2 ASP 16 8.517 -10.221 6.961 150 HB3 ASP 16 HB3 ASP 16 7.316 -10.633 5.734 151 H VAL 17 H VAL 17 7.981 -6.597 4.841 152 HA VAL 17 HA VAL 17 6.120 -7.089 2.644 153 HB VAL 17 HB VAL 17 4.696 -5.840 4.226 154 HG11 VAL 17 HG11 VAL 17 6.635 -3.526 3.943 155 HG12 VAL 17 HG12 VAL 17 5.060 -3.502 4.752 156 HG13 VAL 17 HG13 VAL 17 6.370 -4.498 5.404 157 HG21 VAL 17 HG21 VAL 17 5.420 -4.149 1.816 158 HG22 VAL 17 HG22 VAL 17 4.390 -5.603 1.779 159 HG23 VAL 17 HG23 VAL 17 3.879 -4.176 2.692 160 H SER 18 H SER 18 6.881 -6.286 0.745 161 HA SER 18 HA SER 18 9.451 -4.757 0.829 162 HB2 SER 18 HB2 SER 18 8.568 -6.868 -1.161 163 HB3 SER 18 HB3 SER 18 10.120 -6.004 -1.119 164 HG SER 18 HG SER 18 10.167 -8.127 -0.151 165 H VAL 19 H VAL 19 9.775 -3.114 -0.597 166 HA VAL 19 HA VAL 19 7.386 -2.119 -2.105 167 HB VAL 19 HB VAL 19 9.382 -0.686 -0.389 168 HG11 VAL 19 HG11 VAL 19 7.580 0.550 -2.488 169 HG12 VAL 19 HG12 VAL 19 8.395 1.452 -1.195 170 HG13 VAL 19 HG13 VAL 19 9.357 0.651 -2.420 171 HG21 VAL 19 HG21 VAL 19 7.269 -1.602 0.596 172 HG22 VAL 19 HG22 VAL 19 7.304 0.157 0.626 173 HG23 VAL 19 HG23 VAL 19 6.337 -0.675 -0.595 174 H TYR 20 H TYR 20 7.574 -1.375 -4.044 175 HA TYR 20 HA TYR 20 10.159 -1.592 -5.532 176 HB2 TYR 20 HB2 TYR 20 7.437 -2.685 -6.370 177 HB3 TYR 20 HB3 TYR 20 8.938 -2.779 -7.271 178 HD1 TYR 20 HD1 TYR 20 10.433 -4.633 -6.921 179 HD2 TYR 20 HD2 TYR 20 7.175 -3.956 -4.189 180 HE1 TYR 20 HE1 TYR 20 10.842 -6.859 -5.868 181 HE2 TYR 20 HE2 TYR 20 7.638 -6.151 -3.102 182 HH TYR 20 HH TYR 20 10.222 -8.340 -4.228 183 H ARG 21 H ARG 21 10.276 0.716 -5.568 184 HA ARG 21 HA ARG 21 8.332 2.588 -6.422 185 HB2 ARG 21 HB2 ARG 21 11.325 2.596 -7.016 186 HB3 ARG 21 HB3 ARG 21 10.243 3.990 -7.094 187 HG2 ARG 21 HG2 ARG 21 9.815 3.779 -4.642 188 HG3 ARG 21 HG3 ARG 21 10.945 2.418 -4.568 189 HD2 ARG 21 HD2 ARG 21 12.760 3.873 -5.419 190 HD3 ARG 21 HD3 ARG 21 11.656 5.245 -5.473 191 HE ARG 21 HE ARG 21 12.966 4.086 -3.131 192 HH11 ARG 21 HH11 ARG 21 12.829 5.119 -1.185 193 HH12 ARG 21 HH12 ARG 21 11.588 6.304 -0.909 194 HH21 ARG 21 HH21 ARG 21 10.250 6.107 -4.054 195 HH22 ARG 21 HH22 ARG 21 10.171 6.859 -2.486 196 H ILE 22 H ILE 22 7.508 3.227 -8.330 197 HA ILE 22 HA ILE 22 8.183 1.592 -10.732 198 HB ILE 22 HB ILE 22 5.876 1.534 -11.341 199 HG12 ILE 22 HG12 ILE 22 5.416 3.363 -8.962 200 HG13 ILE 22 HG13 ILE 22 4.964 3.603 -10.652 201 HG21 ILE 22 HG21 ILE 22 6.068 0.785 -8.438 202 HG22 ILE 22 HG22 ILE 22 5.095 0.021 -9.685 203 HG23 ILE 22 HG23 ILE 22 6.858 -0.135 -9.737 204 HD11 ILE 22 HD11 ILE 22 3.696 1.710 -8.653 205 HD12 ILE 22 HD12 ILE 22 2.979 3.128 -9.436 206 HD13 ILE 22 HD13 ILE 22 3.342 1.678 -10.402 207 HA PRO 23 HA PRO 23 8.406 5.429 -12.995 208 HB2 PRO 23 HB2 PRO 23 8.409 4.413 -15.600 209 HB3 PRO 23 HB3 PRO 23 9.810 4.661 -14.524 210 HG2 PRO 23 HG2 PRO 23 8.415 2.119 -15.210 211 HG3 PRO 23 HG3 PRO 23 10.095 2.384 -14.690 212 HD2 PRO 23 HD2 PRO 23 7.994 1.432 -13.067 213 HD3 PRO 23 HD3 PRO 23 9.552 2.085 -12.491 214 HA PRO 24 HA PRO 24 4.427 5.433 -15.542 215 HB2 PRO 24 HB2 PRO 24 2.601 3.425 -15.604 216 HB3 PRO 24 HB3 PRO 24 4.123 3.362 -16.546 217 HG2 PRO 24 HG2 PRO 24 3.587 2.141 -13.809 218 HG3 PRO 24 HG3 PRO 24 4.247 1.330 -15.268 219 HD2 PRO 24 HD2 PRO 24 5.870 2.322 -13.343 220 HD3 PRO 24 HD3 PRO 24 6.308 2.449 -15.072 221 H ARG 25 H ARG 25 2.298 6.162 -15.216 222 HA ARG 25 HA ARG 25 1.156 6.031 -12.439 223 HB2 ARG 25 HB2 ARG 25 0.113 8.157 -12.811 224 HB3 ARG 25 HB3 ARG 25 1.853 8.306 -13.048 225 HG2 ARG 25 HG2 ARG 25 1.590 8.379 -15.471 226 HG3 ARG 25 HG3 ARG 25 -0.139 7.994 -15.350 227 HD2 ARG 25 HD2 ARG 25 -0.582 10.073 -14.177 228 HD3 ARG 25 HD3 ARG 25 1.149 10.492 -14.198 229 HE ARG 25 HE ARG 25 0.341 10.024 -16.876 230 HH11 ARG 25 HH11 ARG 25 -0.112 11.661 -18.311 231 HH12 ARG 25 HH12 ARG 25 -0.541 13.240 -17.723 232 HH21 ARG 25 HH21 ARG 25 -0.308 12.418 -14.401 233 HH22 ARG 25 HH22 ARG 25 -0.653 13.665 -15.569 234 H ALA 26 H ALA 26 0.418 5.421 -15.787 235 HA ALA 26 HA ALA 26 -1.975 3.954 -15.023 236 HB1 ALA 26 HB1 ALA 26 -2.804 6.279 -14.923 237 HB2 ALA 26 HB2 ALA 26 -2.241 6.569 -16.576 238 HB3 ALA 26 HB3 ALA 26 -3.546 5.384 -16.268 239 H SER 27 H SER 27 -1.428 2.232 -16.057 240 HA SER 27 HA SER 27 -1.229 2.230 -19.045 241 HB2 SER 27 HB2 SER 27 0.315 0.706 -17.844 242 HB3 SER 27 HB3 SER 27 -1.067 -0.060 -17.044 243 HG SER 27 HG SER 27 -0.651 0.069 -19.874 244 H ASN 28 H ASN 28 -2.922 1.072 -20.221 245 HA ASN 28 HA ASN 28 -5.535 1.698 -19.236 246 HB2 ASN 28 HB2 ASN 28 -6.342 0.902 -21.292 247 HB3 ASN 28 HB3 ASN 28 -4.762 1.574 -21.663 248 HD21 ASN 28 HD21 ASN 28 -5.429 -2.478 -21.933 249 HD22 ASN 28 HD22 ASN 28 -6.434 -1.487 -20.881 250 H ARG 29 H ARG 29 -3.599 -1.124 -18.712 251 HA ARG 29 HA ARG 29 -5.875 -2.774 -17.729 252 HB2 ARG 29 HB2 ARG 29 -2.887 -3.391 -17.825 253 HB3 ARG 29 HB3 ARG 29 -4.176 -4.497 -17.329 254 HG2 ARG 29 HG2 ARG 29 -4.279 -5.146 -19.483 255 HG3 ARG 29 HG3 ARG 29 -5.163 -3.640 -19.719 256 HD2 ARG 29 HD2 ARG 29 -3.576 -3.570 -21.404 257 HD3 ARG 29 HD3 ARG 29 -2.850 -2.548 -20.152 258 HE ARG 29 HE ARG 29 -1.935 -5.220 -19.775 259 HH11 ARG 29 HH11 ARG 29 -0.125 -6.121 -20.708 260 HH12 ARG 29 HH12 ARG 29 0.681 -5.301 -22.010 261 HH21 ARG 29 HH21 ARG 29 -1.551 -2.701 -22.177 262 HH22 ARG 29 HH22 ARG 29 -0.118 -3.429 -22.850 263 H GLY 30 H GLY 30 -3.972 -0.396 -16.566 264 HA2 GLY 30 HA2 GLY 30 -4.571 0.398 -14.283 265 HA3 GLY 30 HA3 GLY 30 -4.165 -1.242 -13.705 266 H TYR 31 H TYR 31 -2.067 -1.735 -13.287 267 HA TYR 31 HA TYR 31 0.122 0.166 -14.112 268 HB2 TYR 31 HB2 TYR 31 -0.369 -1.157 -11.427 269 HB3 TYR 31 HB3 TYR 31 1.200 -0.543 -11.914 270 HD1 TYR 31 HD1 TYR 31 -2.227 0.406 -10.993 271 HD2 TYR 31 HD2 TYR 31 1.694 1.783 -12.154 272 HE1 TYR 31 HE1 TYR 31 -2.774 2.678 -10.112 273 HE2 TYR 31 HE2 TYR 31 1.165 4.052 -11.245 274 HH TYR 31 HH TYR 31 -1.982 4.788 -9.684 275 H ARG 32 H ARG 32 -0.820 -3.170 -13.507 276 HA ARG 32 HA ARG 32 0.191 -5.126 -13.370 277 HB2 ARG 32 HB2 ARG 32 1.805 -4.852 -15.795 278 HB3 ARG 32 HB3 ARG 32 0.540 -5.967 -15.326 279 HG2 ARG 32 HG2 ARG 32 -0.565 -5.070 -17.060 280 HG3 ARG 32 HG3 ARG 32 -1.030 -3.834 -15.912 281 HD2 ARG 32 HD2 ARG 32 -0.338 -2.661 -17.797 282 HD3 ARG 32 HD3 ARG 32 1.050 -2.527 -16.699 283 HE ARG 32 HE ARG 32 1.642 -4.767 -18.186 284 HH11 ARG 32 HH11 ARG 32 3.057 -4.725 -19.902 285 HH12 ARG 32 HH12 ARG 32 3.181 -3.302 -20.880 286 HH21 ARG 32 HH21 ARG 32 0.750 -1.545 -19.222 287 HH22 ARG 32 HH22 ARG 32 1.904 -1.552 -20.532 288 H ALA 33 H ALA 33 1.493 -5.584 -11.707 289 HA ALA 33 HA ALA 33 4.062 -4.584 -11.139 290 HB1 ALA 33 HB1 ALA 33 2.951 -7.395 -10.712 291 HB2 ALA 33 HB2 ALA 33 4.375 -6.699 -9.900 292 HB3 ALA 33 HB3 ALA 33 2.785 -6.012 -9.606 293 H SER 34 H SER 34 3.124 -7.184 -13.297 294 HA SER 34 HA SER 34 5.577 -8.172 -14.195 295 HB2 SER 34 HB2 SER 34 2.816 -7.912 -15.459 296 HB3 SER 34 HB3 SER 34 4.111 -8.983 -16.081 297 HG SER 34 HG SER 34 2.604 -10.013 -14.683 298 H ASP 35 H ASP 35 4.386 -4.980 -14.858 299 HA ASP 35 HA ASP 35 5.940 -4.670 -17.365 300 HB2 ASP 35 HB2 ASP 35 3.680 -3.645 -17.070 301 HB3 ASP 35 HB3 ASP 35 4.328 -2.660 -15.758 302 H TRP 36 H TRP 36 6.333 -4.133 -13.916 303 HA TRP 36 HA TRP 36 8.835 -2.574 -14.380 304 HB2 TRP 36 HB2 TRP 36 8.175 -1.549 -12.028 305 HB3 TRP 36 HB3 TRP 36 7.711 -0.883 -13.564 306 HD1 TRP 36 HD1 TRP 36 5.273 -0.715 -14.189 307 HE1 TRP 36 HE1 TRP 36 3.057 -1.126 -13.009 308 HE3 TRP 36 HE3 TRP 36 7.022 -3.118 -10.016 309 HZ2 TRP 36 HZ2 TRP 36 2.215 -1.870 -10.320 310 HZ3 TRP 36 HZ3 TRP 36 5.487 -3.635 -8.137 311 HH2 TRP 36 HH2 TRP 36 3.086 -2.998 -8.262 312 H LYS 37 H LYS 37 9.655 -2.604 -11.673 313 HA LYS 37 HA LYS 37 10.878 -5.242 -11.544 314 HB2 LYS 37 HB2 LYS 37 10.923 -3.111 -9.382 315 HB3 LYS 37 HB3 LYS 37 12.063 -4.432 -9.661 316 HG2 LYS 37 HG2 LYS 37 12.541 -3.270 -11.944 317 HG3 LYS 37 HG3 LYS 37 11.680 -1.879 -11.270 318 HD2 LYS 37 HD2 LYS 37 14.237 -3.172 -10.319 319 HD3 LYS 37 HD3 LYS 37 14.024 -1.524 -10.903 320 HE2 LYS 37 HE2 LYS 37 12.851 -2.652 -8.322 321 HE3 LYS 37 HE3 LYS 37 14.379 -1.788 -8.408 322 HZ1 LYS 37 HZ1 LYS 37 12.562 -0.338 -7.724 323 HZ2 LYS 37 HZ2 LYS 37 13.183 0.185 -9.140 324 HZ3 LYS 37 HZ3 LYS 37 11.738 -0.593 -9.112 325 H LEU 38 H LEU 38 9.372 -6.876 -11.161 326 HA LEU 38 HA LEU 38 7.865 -6.680 -8.603 327 HB2 LEU 38 HB2 LEU 38 6.521 -8.465 -9.236 328 HB3 LEU 38 HB3 LEU 38 6.552 -7.249 -10.484 329 HG LEU 38 HG LEU 38 7.966 -8.692 -11.895 330 HD11 LEU 38 HD11 LEU 38 8.095 -11.142 -11.341 331 HD12 LEU 38 HD12 LEU 38 9.168 -10.128 -10.391 332 HD13 LEU 38 HD13 LEU 38 7.659 -10.742 -9.671 333 HD21 LEU 38 HD21 LEU 38 6.188 -10.274 -12.460 334 HD22 LEU 38 HD22 LEU 38 5.486 -10.139 -10.828 335 HD23 LEU 38 HD23 LEU 38 5.429 -8.769 -11.934 336 H ASP 39 H ASP 39 10.860 -7.704 -9.530 337 HA ASP 39 HA ASP 39 11.018 -9.887 -7.508 338 HB2 ASP 39 HB2 ASP 39 11.365 -10.550 -9.857 339 HB3 ASP 39 HB3 ASP 39 12.658 -9.363 -10.011 340 H GLN 40 H GLN 40 12.301 -6.746 -8.381 341 HA GLN 40 HA GLN 40 14.571 -6.992 -6.462 342 HB2 GLN 40 HB2 GLN 40 14.209 -5.133 -8.829 343 HB3 GLN 40 HB3 GLN 40 15.579 -5.141 -7.714 344 HG2 GLN 40 HG2 GLN 40 16.162 -7.437 -8.448 345 HG3 GLN 40 HG3 GLN 40 14.772 -7.440 -9.542 346 HE21 GLN 40 HE21 GLN 40 17.273 -6.468 -11.923 347 HE22 GLN 40 HE22 GLN 40 16.438 -7.867 -11.252 348 HA PRO 41 HA PRO 41 11.838 -3.911 -4.421 349 HB2 PRO 41 HB2 PRO 41 12.480 -4.360 -1.821 350 HB3 PRO 41 HB3 PRO 41 11.390 -5.426 -2.763 351 HG2 PRO 41 HG2 PRO 41 14.353 -5.809 -2.225 352 HG3 PRO 41 HG3 PRO 41 13.031 -7.002 -2.016 353 HD2 PRO 41 HD2 PRO 41 14.594 -6.915 -4.262 354 HD3 PRO 41 HD3 PRO 41 12.862 -7.361 -4.336 355 H ASP 42 H ASP 42 12.221 -1.923 -3.515 356 HA ASP 42 HA ASP 42 15.015 -0.875 -3.568 357 HB2 ASP 42 HB2 ASP 42 12.320 0.549 -3.548 358 HB3 ASP 42 HB3 ASP 42 13.895 1.336 -3.654 359 H TRP 43 H TRP 43 12.360 -1.586 -1.445 360 HA TRP 43 HA TRP 43 13.999 -1.110 0.926 361 HB2 TRP 43 HB2 TRP 43 12.929 1.075 0.682 362 HB3 TRP 43 HB3 TRP 43 11.363 0.330 0.413 363 HD1 TRP 43 HD1 TRP 43 13.758 1.328 3.159 364 HE1 TRP 43 HE1 TRP 43 12.589 1.192 5.440 365 HE3 TRP 43 HE3 TRP 43 9.453 -1.057 1.739 366 HZ2 TRP 43 HZ2 TRP 43 10.045 0.320 6.471 367 HZ3 TRP 43 HZ3 TRP 43 7.680 -1.569 3.403 368 HH2 TRP 43 HH2 TRP 43 7.954 -0.851 5.768 369 H THR 44 H THR 44 13.284 -2.454 2.708 370 HA THR 44 HA THR 44 10.632 -3.662 2.511 371 HB THR 44 HB THR 44 11.188 -5.831 2.891 372 HG1 THR 44 HG1 THR 44 13.918 -5.198 3.263 373 HG21 THR 44 HG21 THR 44 12.643 -6.681 1.188 374 HG22 THR 44 HG22 THR 44 11.721 -5.315 0.552 375 HG23 THR 44 HG23 THR 44 13.429 -5.093 0.982 376 H GLY 45 H GLY 45 9.736 -4.319 4.421 377 HA2 GLY 45 HA2 GLY 45 10.954 -3.780 7.009 378 HA3 GLY 45 HA3 GLY 45 9.958 -2.459 6.451 379 H ARG 46 H ARG 46 8.243 -2.540 7.584 380 HA ARG 46 HA ARG 46 6.591 -5.009 7.974 381 HB2 ARG 46 HB2 ARG 46 8.042 -4.525 9.918 382 HB3 ARG 46 HB3 ARG 46 7.419 -2.883 9.998 383 HG2 ARG 46 HG2 ARG 46 5.132 -3.835 10.540 384 HG3 ARG 46 HG3 ARG 46 5.880 -5.451 10.546 385 HD2 ARG 46 HD2 ARG 46 7.525 -4.585 12.263 386 HD3 ARG 46 HD3 ARG 46 6.603 -3.090 12.336 387 HE ARG 46 HE ARG 46 5.631 -5.820 13.128 388 HH11 ARG 46 HH11 ARG 46 4.509 -5.987 15.006 389 HH12 ARG 46 HH12 ARG 46 3.929 -4.562 15.810 390 HH21 ARG 46 HH21 ARG 46 5.187 -2.319 13.531 391 HH22 ARG 46 HH22 ARG 46 4.362 -2.566 15.046 392 H LEU 47 H LEU 47 4.352 -4.645 7.970 393 HA LEU 47 HA LEU 47 3.443 -2.050 6.806 394 HB2 LEU 47 HB2 LEU 47 2.815 -4.223 5.721 395 HB3 LEU 47 HB3 LEU 47 2.066 -4.703 7.240 396 HG LEU 47 HG LEU 47 0.538 -2.613 6.962 397 HD11 LEU 47 HD11 LEU 47 0.154 -1.911 4.659 398 HD12 LEU 47 HD12 LEU 47 1.790 -1.504 5.179 399 HD13 LEU 47 HD13 LEU 47 1.528 -2.898 4.105 400 HD21 LEU 47 HD21 LEU 47 -0.235 -4.927 6.766 401 HD22 LEU 47 HD22 LEU 47 -1.017 -3.901 5.568 402 HD23 LEU 47 HD23 LEU 47 0.304 -4.981 5.077 403 H ARG 48 H ARG 48 2.116 -0.615 7.915 404 HA ARG 48 HA ARG 48 0.547 -1.616 10.234 405 HB2 ARG 48 HB2 ARG 48 2.834 -0.507 10.900 406 HB3 ARG 48 HB3 ARG 48 2.094 0.997 10.431 407 HG2 ARG 48 HG2 ARG 48 1.629 0.973 12.687 408 HG3 ARG 48 HG3 ARG 48 0.141 0.233 12.083 409 HD2 ARG 48 HD2 ARG 48 1.030 -2.006 12.546 410 HD3 ARG 48 HD3 ARG 48 2.608 -1.349 12.973 411 HE ARG 48 HE ARG 48 0.246 -1.481 14.662 412 HH11 ARG 48 HH11 ARG 48 0.450 -0.958 16.810 413 HH12 ARG 48 HH12 ARG 48 1.789 0.008 17.344 414 HH21 ARG 48 HH21 ARG 48 3.268 0.356 14.265 415 HH22 ARG 48 HH22 ARG 48 3.327 0.694 15.969 416 H ILE 49 H ILE 49 -1.345 -1.472 9.110 417 HA ILE 49 HA ILE 49 -2.122 1.045 7.726 418 HB ILE 49 HB ILE 49 -3.640 -1.548 8.112 419 HG12 ILE 49 HG12 ILE 49 -2.155 -0.362 5.721 420 HG13 ILE 49 HG13 ILE 49 -1.698 -1.802 6.629 421 HG21 ILE 49 HG21 ILE 49 -4.365 0.808 6.326 422 HG22 ILE 49 HG22 ILE 49 -5.286 -0.699 6.556 423 HG23 ILE 49 HG23 ILE 49 -5.163 0.438 7.875 424 HD11 ILE 49 HD11 ILE 49 -2.683 -2.499 4.573 425 HD12 ILE 49 HD12 ILE 49 -3.797 -2.918 5.877 426 HD13 ILE 49 HD13 ILE 49 -4.122 -1.511 4.820 427 H THR 50 H THR 50 -3.440 2.525 8.561 428 HA THR 50 HA THR 50 -4.679 2.147 11.253 429 HB THR 50 HB THR 50 -3.844 4.341 11.931 430 HG1 THR 50 HG1 THR 50 -2.492 4.215 9.437 431 HG21 THR 50 HG21 THR 50 -1.472 2.688 10.977 432 HG22 THR 50 HG22 THR 50 -1.485 3.934 12.240 433 HG23 THR 50 HG23 THR 50 -2.371 2.424 12.485 434 H SER 51 H SER 51 -6.292 4.065 11.693 435 HA SER 51 HA SER 51 -7.090 5.635 9.351 436 HB2 SER 51 HB2 SER 51 -9.394 4.941 9.292 437 HB3 SER 51 HB3 SER 51 -8.341 3.558 8.993 438 HG SER 51 HG SER 51 -8.604 3.091 11.308 439 H LYS 52 H LYS 52 -7.881 7.525 9.785 440 HA LYS 52 HA LYS 52 -8.704 8.291 12.556 441 HB2 LYS 52 HB2 LYS 52 -6.722 9.387 11.464 442 HB3 LYS 52 HB3 LYS 52 -7.845 10.062 10.265 443 HG2 LYS 52 HG2 LYS 52 -9.087 10.974 12.450 444 HG3 LYS 52 HG3 LYS 52 -7.514 10.707 13.187 445 HD2 LYS 52 HD2 LYS 52 -8.197 12.422 10.782 446 HD3 LYS 52 HD3 LYS 52 -7.659 12.994 12.383 447 HE2 LYS 52 HE2 LYS 52 -5.434 12.172 12.003 448 HE3 LYS 52 HE3 LYS 52 -5.929 11.289 10.556 449 HZ1 LYS 52 HZ1 LYS 52 -6.356 13.384 9.451 450 HZ2 LYS 52 HZ2 LYS 52 -5.992 14.252 10.789 451 HZ3 LYS 52 HZ3 LYS 52 -4.826 13.402 10.016 452 H GLY 53 H GLY 53 -10.476 6.834 11.376 453 HA2 GLY 53 HA2 GLY 53 -12.905 7.004 11.335 454 HA3 GLY 53 HA3 GLY 53 -12.768 8.624 10.654 455 H LYS 54 H LYS 54 -13.651 8.502 8.653 456 HA LYS 54 HA LYS 54 -13.563 6.174 6.920 457 HB2 LYS 54 HB2 LYS 54 -15.396 7.888 7.154 458 HB3 LYS 54 HB3 LYS 54 -14.387 9.058 6.327 459 HG2 LYS 54 HG2 LYS 54 -15.126 6.427 4.994 460 HG3 LYS 54 HG3 LYS 54 -16.311 7.724 5.148 461 HD2 LYS 54 HD2 LYS 54 -14.555 9.255 4.013 462 HD3 LYS 54 HD3 LYS 54 -13.769 7.735 3.531 463 HE2 LYS 54 HE2 LYS 54 -15.923 6.983 2.510 464 HE3 LYS 54 HE3 LYS 54 -16.644 8.538 2.945 465 HZ1 LYS 54 HZ1 LYS 54 -14.353 8.139 1.086 466 HZ2 LYS 54 HZ2 LYS 54 -15.855 8.667 0.675 467 HZ3 LYS 54 HZ3 LYS 54 -14.855 9.611 1.565 468 H THR 55 H THR 55 -11.185 8.432 7.445 469 HA THR 55 HA THR 55 -9.784 7.627 4.925 470 HB THR 55 HB THR 55 -8.607 9.438 7.031 471 HG1 THR 55 HG1 THR 55 -9.610 11.209 6.062 472 HG21 THR 55 HG21 THR 55 -8.694 9.408 3.980 473 HG22 THR 55 HG22 THR 55 -7.640 10.460 4.971 474 HG23 THR 55 HG23 THR 55 -7.390 8.698 4.954 475 H ALA 56 H ALA 56 -8.633 5.898 4.944 476 HA ALA 56 HA ALA 56 -7.251 5.037 7.428 477 HB1 ALA 56 HB1 ALA 56 -6.576 3.010 6.054 478 HB2 ALA 56 HB2 ALA 56 -8.257 3.132 6.564 479 HB3 ALA 56 HB3 ALA 56 -7.823 3.504 4.896 480 H TYR 57 H TYR 57 -4.990 4.515 7.248 481 HA TYR 57 HA TYR 57 -3.464 6.035 5.210 482 HB2 TYR 57 HB2 TYR 57 -2.953 6.226 8.195 483 HB3 TYR 57 HB3 TYR 57 -1.980 6.932 6.921 484 HD1 TYR 57 HD1 TYR 57 -2.504 9.118 6.072 485 HD2 TYR 57 HD2 TYR 57 -5.326 7.058 8.604 486 HE1 TYR 57 HE1 TYR 57 -3.870 11.190 6.252 487 HE2 TYR 57 HE2 TYR 57 -6.749 9.080 8.658 488 HH TYR 57 HH TYR 57 -5.804 12.132 7.036 489 H ILE 58 H ILE 58 -2.239 4.540 4.262 490 HA ILE 58 HA ILE 58 -1.348 2.082 5.648 491 HB ILE 58 HB ILE 58 -0.216 3.166 3.051 492 HG12 ILE 58 HG12 ILE 58 -2.554 3.199 2.570 493 HG13 ILE 58 HG13 ILE 58 -1.769 1.883 1.727 494 HG21 ILE 58 HG21 ILE 58 -0.494 0.357 4.159 495 HG22 ILE 58 HG22 ILE 58 0.265 0.816 2.617 496 HG23 ILE 58 HG23 ILE 58 0.985 1.334 4.140 497 HD11 ILE 58 HD11 ILE 58 -2.719 0.246 3.293 498 HD12 ILE 58 HD12 ILE 58 -3.448 1.562 4.250 499 HD13 ILE 58 HD13 ILE 58 -3.978 1.272 2.585 500 H LYS 59 H LYS 59 0.137 2.483 7.316 501 HA LYS 59 HA LYS 59 2.419 4.329 6.732 502 HB2 LYS 59 HB2 LYS 59 2.081 2.848 9.318 503 HB3 LYS 59 HB3 LYS 59 3.008 4.285 8.989 504 HG2 LYS 59 HG2 LYS 59 -0.031 4.096 9.191 505 HG3 LYS 59 HG3 LYS 59 1.079 4.702 10.413 506 HD2 LYS 59 HD2 LYS 59 1.772 6.527 8.789 507 HD3 LYS 59 HD3 LYS 59 0.443 5.986 7.725 508 HE2 LYS 59 HE2 LYS 59 -1.157 6.283 9.629 509 HE3 LYS 59 HE3 LYS 59 0.180 6.802 10.655 510 HZ1 LYS 59 HZ1 LYS 59 -0.916 8.729 9.902 511 HZ2 LYS 59 HZ2 LYS 59 0.500 8.689 9.055 512 HZ3 LYS 59 HZ3 LYS 59 -0.903 8.276 8.328 513 H LEU 60 H LEU 60 4.475 3.533 6.523 514 HA LEU 60 HA LEU 60 4.861 0.556 6.612 515 HB2 LEU 60 HB2 LEU 60 6.007 2.641 4.715 516 HB3 LEU 60 HB3 LEU 60 6.602 0.989 4.833 517 HG LEU 60 HG LEU 60 3.733 1.701 4.068 518 HD11 LEU 60 HD11 LEU 60 6.106 0.905 2.348 519 HD12 LEU 60 HD12 LEU 60 4.432 1.084 1.776 520 HD13 LEU 60 HD13 LEU 60 5.316 2.497 2.371 521 HD21 LEU 60 HD21 LEU 60 3.658 -0.644 3.263 522 HD22 LEU 60 HD22 LEU 60 5.298 -0.918 3.891 523 HD23 LEU 60 HD23 LEU 60 3.956 -0.581 5.001 524 H GLU 61 H GLU 61 6.346 -0.147 7.960 525 HA GLU 61 HA GLU 61 7.962 1.843 9.494 526 HB2 GLU 61 HB2 GLU 61 6.722 -0.797 10.323 527 HB3 GLU 61 HB3 GLU 61 7.743 0.210 11.353 528 HG2 GLU 61 HG2 GLU 61 6.066 2.021 11.257 529 HG3 GLU 61 HG3 GLU 61 5.030 1.019 10.230 530 H ASP 62 H ASP 62 10.143 1.325 10.058 531 HA ASP 62 HA ASP 62 11.534 -0.568 8.392 532 HB2 ASP 62 HB2 ASP 62 12.514 1.551 9.002 533 HB3 ASP 62 HB3 ASP 62 12.295 1.224 10.723 534 H LYS 63 H LYS 63 12.162 -2.609 8.841 535 HA LYS 63 HA LYS 63 10.861 -4.020 11.004 536 HB2 LYS 63 HB2 LYS 63 11.848 -6.051 10.010 537 HB3 LYS 63 HB3 LYS 63 10.951 -5.058 8.876 538 HG2 LYS 63 HG2 LYS 63 13.058 -4.170 7.927 539 HG3 LYS 63 HG3 LYS 63 13.994 -5.028 9.150 540 HD2 LYS 63 HD2 LYS 63 14.049 -6.134 6.955 541 HD3 LYS 63 HD3 LYS 63 13.382 -7.179 8.216 542 HE2 LYS 63 HE2 LYS 63 11.127 -6.891 7.402 543 HE3 LYS 63 HE3 LYS 63 11.608 -5.568 6.342 544 HZ1 LYS 63 HZ1 LYS 63 11.303 -7.798 5.259 545 HZ2 LYS 63 HZ2 LYS 63 12.708 -7.017 4.901 546 HZ3 LYS 63 HZ3 LYS 63 12.692 -8.283 5.961 547 H VAL 64 H VAL 64 13.573 -2.238 11.306 548 HA VAL 64 HA VAL 64 14.806 -4.006 13.377 549 HB VAL 64 HB VAL 64 16.144 -1.549 12.230 550 HG11 VAL 64 HG11 VAL 64 17.206 -4.159 13.376 551 HG12 VAL 64 HG12 VAL 64 18.179 -2.769 12.841 552 HG13 VAL 64 HG13 VAL 64 17.104 -2.604 14.233 553 HG21 VAL 64 HG21 VAL 64 17.353 -3.002 10.609 554 HG22 VAL 64 HG22 VAL 64 16.211 -4.321 10.969 555 HG23 VAL 64 HG23 VAL 64 15.645 -2.806 10.215 556 H SER 65 H SER 65 13.615 -0.704 12.715 557 HA SER 65 HA SER 65 13.730 -0.181 15.664 558 HB2 SER 65 HB2 SER 65 14.248 1.726 13.357 559 HB3 SER 65 HB3 SER 65 14.269 2.158 15.077 560 HG SER 65 HG SER 65 16.373 1.709 14.267 561 H GLY 66 H GLY 66 11.438 -0.499 13.207 562 HA2 GLY 66 HA2 GLY 66 9.203 -0.017 13.139 563 HA3 GLY 66 HA3 GLY 66 9.304 0.668 14.762 564 H GLU 67 H GLU 67 11.488 2.121 12.527 565 HA GLU 67 HA GLU 67 10.167 4.696 12.808 566 HB2 GLU 67 HB2 GLU 67 12.677 3.763 11.377 567 HB3 GLU 67 HB3 GLU 67 12.123 5.434 11.294 568 HG2 GLU 67 HG2 GLU 67 12.609 4.030 13.941 569 HG3 GLU 67 HG3 GLU 67 13.883 4.858 13.053 570 H LEU 68 H LEU 68 9.418 6.085 11.209 571 HA LEU 68 HA LEU 68 7.790 4.721 9.256 572 HB2 LEU 68 HB2 LEU 68 7.090 6.754 10.570 573 HB3 LEU 68 HB3 LEU 68 8.216 7.709 9.605 574 HG LEU 68 HG LEU 68 6.915 6.969 7.529 575 HD11 LEU 68 HD11 LEU 68 5.742 5.000 8.464 576 HD12 LEU 68 HD12 LEU 68 4.913 6.039 9.641 577 HD13 LEU 68 HD13 LEU 68 4.584 6.204 7.903 578 HD21 LEU 68 HD21 LEU 68 5.380 8.512 9.659 579 HD22 LEU 68 HD22 LEU 68 6.610 9.185 8.566 580 HD23 LEU 68 HD23 LEU 68 5.091 8.562 7.905 581 H PHE 69 H PHE 69 8.371 4.061 7.329 582 HA PHE 69 HA PHE 69 10.564 5.264 5.733 583 HB2 PHE 69 HB2 PHE 69 10.452 2.914 5.678 584 HB3 PHE 69 HB3 PHE 69 8.709 2.898 5.453 585 HD1 PHE 69 HD1 PHE 69 8.036 2.143 3.372 586 HD2 PHE 69 HD2 PHE 69 11.643 4.481 3.650 587 HE1 PHE 69 HE1 PHE 69 8.316 1.996 0.926 588 HE2 PHE 69 HE2 PHE 69 11.903 4.368 1.201 589 HZ PHE 69 HZ PHE 69 10.215 3.131 -0.198 590 H ALA 70 H ALA 70 7.023 4.770 5.389 591 HA ALA 70 HA ALA 70 6.685 7.340 4.041 592 HB1 ALA 70 HB1 ALA 70 5.781 6.382 1.964 593 HB2 ALA 70 HB2 ALA 70 7.463 5.875 2.171 594 HB3 ALA 70 HB3 ALA 70 6.144 4.738 2.528 595 H GLN 71 H GLN 71 4.390 7.780 3.543 596 HA GLN 71 HA GLN 71 2.442 5.946 4.697 597 HB2 GLN 71 HB2 GLN 71 1.282 7.694 5.994 598 HB3 GLN 71 HB3 GLN 71 2.870 7.250 6.617 599 HG2 GLN 71 HG2 GLN 71 3.841 9.307 5.554 600 HG3 GLN 71 HG3 GLN 71 2.218 9.784 5.049 601 HE21 GLN 71 HE21 GLN 71 3.097 11.446 8.324 602 HE22 GLN 71 HE22 GLN 71 3.867 11.409 6.745 603 H ALA 72 H ALA 72 0.516 5.873 3.697 604 HA ALA 72 HA ALA 72 -0.013 7.804 1.465 605 HB1 ALA 72 HB1 ALA 72 -0.482 4.814 1.573 606 HB2 ALA 72 HB2 ALA 72 -1.072 5.888 0.302 607 HB3 ALA 72 HB3 ALA 72 0.666 5.707 0.539 608 HA PRO 73 HA PRO 73 -3.949 8.061 3.897 609 HB2 PRO 73 HB2 PRO 73 -4.371 10.501 2.231 610 HB3 PRO 73 HB3 PRO 73 -4.472 10.315 3.995 611 HG2 PRO 73 HG2 PRO 73 -2.365 11.599 2.807 612 HG3 PRO 73 HG3 PRO 73 -2.113 10.548 4.235 613 HD2 PRO 73 HD2 PRO 73 -1.711 9.852 1.310 614 HD3 PRO 73 HD3 PRO 73 -0.633 9.555 2.708 615 H VAL 74 H VAL 74 -5.912 7.185 3.305 616 HA VAL 74 HA VAL 74 -6.790 7.258 0.452 617 HB VAL 74 HB VAL 74 -5.789 5.143 0.877 618 HG11 VAL 74 HG11 VAL 74 -6.043 4.730 3.221 619 HG12 VAL 74 HG12 VAL 74 -7.807 4.541 3.004 620 HG13 VAL 74 HG13 VAL 74 -6.676 3.387 2.277 621 HG21 VAL 74 HG21 VAL 74 -7.757 5.258 -0.655 622 HG22 VAL 74 HG22 VAL 74 -7.617 3.671 0.112 623 HG23 VAL 74 HG23 VAL 74 -8.809 4.808 0.709 624 H GLU 75 H GLU 75 -8.838 7.829 0.106 625 HA GLU 75 HA GLU 75 -10.737 7.710 2.393 626 HB2 GLU 75 HB2 GLU 75 -9.849 10.025 1.292 627 HB3 GLU 75 HB3 GLU 75 -11.186 9.680 0.190 628 HG2 GLU 75 HG2 GLU 75 -12.454 9.236 2.535 629 HG3 GLU 75 HG3 GLU 75 -11.197 10.290 3.149 630 H GLN 76 H GLN 76 -10.102 6.082 -0.349 631 HA GLN 76 HA GLN 76 -12.723 4.967 -0.501 632 HB2 GLN 76 HB2 GLN 76 -13.243 5.373 -2.783 633 HB3 GLN 76 HB3 GLN 76 -12.986 6.935 -2.030 634 HG2 GLN 76 HG2 GLN 76 -11.097 5.486 -3.931 635 HG3 GLN 76 HG3 GLN 76 -12.110 6.860 -4.302 636 HE21 GLN 76 HE21 GLN 76 -8.479 7.489 -2.569 637 HE22 GLN 76 HE22 GLN 76 -9.155 5.844 -2.626 638 H TYR 77 H TYR 77 -12.626 2.844 -1.172 639 HA TYR 77 HA TYR 77 -10.116 1.873 -2.408 640 HB2 TYR 77 HB2 TYR 77 -10.126 1.412 0.015 641 HB3 TYR 77 HB3 TYR 77 -11.607 0.455 -0.181 642 HD1 TYR 77 HD1 TYR 77 -11.034 -1.908 0.054 643 HD2 TYR 77 HD2 TYR 77 -8.357 0.768 -1.972 644 HE1 TYR 77 HE1 TYR 77 -9.561 -3.801 -0.537 645 HE2 TYR 77 HE2 TYR 77 -6.871 -1.085 -2.531 646 HH TYR 77 HH TYR 77 -7.798 -4.494 -1.788 647 HA PRO 78 HA PRO 78 -9.308 0.610 -4.017 648 HB2 PRO 78 HB2 PRO 78 -9.388 0.414 -6.715 649 HB3 PRO 78 HB3 PRO 78 -9.510 -1.010 -5.636 650 HG2 PRO 78 HG2 PRO 78 -11.786 0.541 -6.925 651 HG3 PRO 78 HG3 PRO 78 -11.508 -1.231 -6.945 652 HD2 PRO 78 HD2 PRO 78 -13.182 -0.078 -5.142 653 HD3 PRO 78 HD3 PRO 78 -12.135 -1.448 -4.673 654 H GLY 79 H GLY 79 -8.063 2.279 -5.111 655 HA2 GLY 79 HA2 GLY 79 -9.325 4.498 -6.494 656 HA3 GLY 79 HA3 GLY 79 -8.883 4.913 -4.838 657 H ILE 80 H ILE 80 -7.461 6.510 -5.867 658 HA ILE 80 HA ILE 80 -5.138 5.596 -7.384 659 HB ILE 80 HB ILE 80 -6.195 7.789 -7.795 660 HG12 ILE 80 HG12 ILE 80 -4.219 9.194 -7.940 661 HG13 ILE 80 HG13 ILE 80 -3.344 8.179 -6.801 662 HG21 ILE 80 HG21 ILE 80 -5.076 8.651 -5.084 663 HG22 ILE 80 HG22 ILE 80 -5.884 9.681 -6.272 664 HG23 ILE 80 HG23 ILE 80 -6.803 8.415 -5.454 665 HD11 ILE 80 HD11 ILE 80 -2.697 7.819 -9.183 666 HD12 ILE 80 HD12 ILE 80 -3.292 6.339 -8.421 667 HD13 ILE 80 HD13 ILE 80 -4.344 7.254 -9.533 668 H ALA 81 H ALA 81 -5.957 6.075 -4.017 669 HA ALA 81 HA ALA 81 -3.205 6.203 -3.168 670 HB1 ALA 81 HB1 ALA 81 -5.765 5.879 -1.560 671 HB2 ALA 81 HB2 ALA 81 -4.141 6.173 -0.896 672 HB3 ALA 81 HB3 ALA 81 -4.934 7.411 -1.907 673 H VAL 82 H VAL 82 -5.300 3.606 -3.932 674 HA VAL 82 HA VAL 82 -3.242 1.662 -3.350 675 HB VAL 82 HB VAL 82 -3.979 1.726 -1.159 676 HG11 VAL 82 HG11 VAL 82 -6.708 2.006 -2.168 677 HG12 VAL 82 HG12 VAL 82 -6.448 1.094 -0.655 678 HG13 VAL 82 HG13 VAL 82 -5.856 2.748 -0.826 679 HG21 VAL 82 HG21 VAL 82 -4.865 -0.729 -2.620 680 HG22 VAL 82 HG22 VAL 82 -3.342 -0.348 -1.854 681 HG23 VAL 82 HG23 VAL 82 -4.781 -0.584 -0.844 682 H GLU 83 H GLU 83 -3.293 0.582 -5.150 683 HA GLU 83 HA GLU 83 -5.849 -0.361 -6.388 684 HB2 GLU 83 HB2 GLU 83 -4.042 1.573 -7.433 685 HB3 GLU 83 HB3 GLU 83 -3.650 0.089 -8.287 686 HG2 GLU 83 HG2 GLU 83 -6.458 1.258 -8.061 687 HG3 GLU 83 HG3 GLU 83 -5.344 1.582 -9.387 688 H THR 84 H THR 84 -5.706 -2.329 -7.612 689 HA THR 84 HA THR 84 -3.458 -4.126 -6.745 690 HB THR 84 HB THR 84 -6.027 -5.120 -7.854 691 HG1 THR 84 HG1 THR 84 -6.811 -5.355 -5.759 692 HG21 THR 84 HG21 THR 84 -5.392 -7.121 -6.550 693 HG22 THR 84 HG22 THR 84 -4.156 -6.633 -7.723 694 HG23 THR 84 HG23 THR 84 -3.929 -6.264 -5.996 695 H VAL 85 H VAL 85 -2.317 -3.105 -8.272 696 HA VAL 85 HA VAL 85 -1.277 -2.917 -10.393 697 HB VAL 85 HB VAL 85 -0.338 -5.328 -10.718 698 HG11 VAL 85 HG11 VAL 85 -0.010 -3.761 -8.108 699 HG12 VAL 85 HG12 VAL 85 1.184 -4.843 -8.832 700 HG13 VAL 85 HG13 VAL 85 0.757 -3.357 -9.657 701 HG21 VAL 85 HG21 VAL 85 -2.151 -6.495 -9.357 702 HG22 VAL 85 HG22 VAL 85 -0.487 -6.824 -8.872 703 HG23 VAL 85 HG23 VAL 85 -1.484 -5.701 -7.933 704 H THR 86 H THR 86 -2.917 -6.002 -10.885 705 HA THR 86 HA THR 86 -4.443 -4.801 -13.033 706 HB THR 86 HB THR 86 -4.311 -6.994 -14.383 707 HG1 THR 86 HG1 THR 86 -2.392 -8.113 -14.170 708 HG21 THR 86 HG21 THR 86 -3.256 -4.737 -14.990 709 HG22 THR 86 HG22 THR 86 -1.786 -5.326 -14.218 710 HG23 THR 86 HG23 THR 86 -2.411 -6.163 -15.665 711 H ASP 87 H ASP 87 -3.808 -7.828 -11.370 712 HA ASP 87 HA ASP 87 -6.721 -8.134 -10.776 713 HB2 ASP 87 HB2 ASP 87 -5.021 -9.792 -12.597 714 HB3 ASP 87 HB3 ASP 87 -6.265 -10.611 -11.640 715 H SER 88 H SER 88 -4.010 -10.469 -10.489 716 HA SER 88 HA SER 88 -4.637 -11.406 -8.039 717 HB2 SER 88 HB2 SER 88 -2.621 -11.911 -9.542 718 HB3 SER 88 HB3 SER 88 -1.701 -10.890 -8.447 719 HG SER 88 HG SER 88 -1.838 -13.158 -7.876 720 H SER 89 H SER 89 -4.648 -10.947 -6.086 721 HA SER 89 HA SER 89 -3.522 -8.525 -4.844 722 HB2 SER 89 HB2 SER 89 -5.711 -9.245 -4.417 723 HB3 SER 89 HB3 SER 89 -5.175 -10.881 -3.990 724 HG SER 89 HG SER 89 -4.039 -9.954 -2.213 725 H ARG 90 H ARG 90 -1.581 -9.645 -5.968 726 HA ARG 90 HA ARG 90 0.141 -11.108 -3.985 727 HB2 ARG 90 HB2 ARG 90 -0.158 -12.050 -6.318 728 HB3 ARG 90 HB3 ARG 90 0.506 -10.568 -6.978 729 HG2 ARG 90 HG2 ARG 90 2.658 -10.977 -5.893 730 HG3 ARG 90 HG3 ARG 90 2.026 -12.405 -5.067 731 HD2 ARG 90 HD2 ARG 90 2.053 -12.117 -8.104 732 HD3 ARG 90 HD3 ARG 90 3.413 -12.779 -7.212 733 HE ARG 90 HE ARG 90 0.810 -14.066 -7.752 734 HH11 ARG 90 HH11 ARG 90 0.727 -16.258 -7.489 735 HH12 ARG 90 HH12 ARG 90 1.837 -17.055 -6.395 736 HH21 ARG 90 HH21 ARG 90 3.663 -14.237 -5.693 737 HH22 ARG 90 HH22 ARG 90 3.481 -15.951 -5.439 738 H TYR 91 H TYR 91 -0.212 -8.283 -5.992 739 HA TYR 91 HA TYR 91 1.740 -6.720 -4.385 740 HB2 TYR 91 HB2 TYR 91 1.157 -6.422 -7.347 741 HB3 TYR 91 HB3 TYR 91 2.404 -5.574 -6.467 742 HD1 TYR 91 HD1 TYR 91 4.450 -6.880 -5.687 743 HD2 TYR 91 HD2 TYR 91 1.485 -8.490 -8.355 744 HE1 TYR 91 HE1 TYR 91 6.020 -8.713 -6.322 745 HE2 TYR 91 HE2 TYR 91 3.054 -10.239 -9.096 746 HH TYR 91 HH TYR 91 6.335 -10.556 -7.538 747 H PHE 92 H PHE 92 1.374 -4.400 -4.639 748 HA PHE 92 HA PHE 92 -1.272 -3.507 -5.586 749 HB2 PHE 92 HB2 PHE 92 -0.234 -2.817 -2.806 750 HB3 PHE 92 HB3 PHE 92 -1.653 -2.114 -3.574 751 HD1 PHE 92 HD1 PHE 92 -3.665 -3.551 -4.104 752 HD2 PHE 92 HD2 PHE 92 -0.342 -4.976 -1.752 753 HE1 PHE 92 HE1 PHE 92 -5.052 -5.441 -3.291 754 HE2 PHE 92 HE2 PHE 92 -1.746 -6.828 -0.905 755 HZ PHE 92 HZ PHE 92 -4.089 -7.094 -1.703 756 H VAL 93 H VAL 93 -1.312 -1.069 -5.612 757 HA VAL 93 HA VAL 93 1.364 0.234 -5.624 758 HB VAL 93 HB VAL 93 -0.820 0.690 -7.698 759 HG11 VAL 93 HG11 VAL 93 1.781 2.197 -7.189 760 HG12 VAL 93 HG12 VAL 93 0.793 2.345 -8.653 761 HG13 VAL 93 HG13 VAL 93 0.128 2.854 -7.106 762 HG21 VAL 93 HG21 VAL 93 2.050 -0.315 -7.927 763 HG22 VAL 93 HG22 VAL 93 0.570 -1.254 -8.217 764 HG23 VAL 93 HG23 VAL 93 0.993 0.081 -9.295 765 H ILE 94 H ILE 94 1.393 2.003 -4.300 766 HA ILE 94 HA ILE 94 -1.215 3.229 -3.571 767 HB ILE 94 HB ILE 94 -0.584 3.491 -1.270 768 HG12 ILE 94 HG12 ILE 94 1.945 1.865 -1.817 769 HG13 ILE 94 HG13 ILE 94 1.928 3.618 -1.640 770 HG21 ILE 94 HG21 ILE 94 -0.854 1.239 -0.509 771 HG22 ILE 94 HG22 ILE 94 -1.680 1.340 -2.045 772 HG23 ILE 94 HG23 ILE 94 -0.099 0.555 -1.964 773 HD11 ILE 94 HD11 ILE 94 1.036 1.657 0.503 774 HD12 ILE 94 HD12 ILE 94 2.550 2.584 0.478 775 HD13 ILE 94 HD13 ILE 94 0.990 3.410 0.631 776 H ARG 95 H ARG 95 -1.230 5.412 -3.082 777 HA ARG 95 HA ARG 95 1.119 6.956 -4.081 778 HB2 ARG 95 HB2 ARG 95 -0.162 8.723 -4.631 779 HB3 ARG 95 HB3 ARG 95 -1.197 7.370 -5.016 780 HG2 ARG 95 HG2 ARG 95 -2.726 8.768 -4.055 781 HG3 ARG 95 HG3 ARG 95 -2.238 7.877 -2.609 782 HD2 ARG 95 HD2 ARG 95 -0.611 9.691 -2.085 783 HD3 ARG 95 HD3 ARG 95 -1.244 10.602 -3.473 784 HE ARG 95 HE ARG 95 -3.461 9.898 -1.877 785 HH11 ARG 95 HH11 ARG 95 -4.344 11.125 -0.255 786 HH12 ARG 95 HH12 ARG 95 -3.422 12.425 0.451 787 HH21 ARG 95 HH21 ARG 95 -0.623 11.927 -1.449 788 HH22 ARG 95 HH22 ARG 95 -1.315 12.756 -0.080 789 H ILE 96 H ILE 96 2.589 7.350 -2.618 790 HA ILE 96 HA ILE 96 1.820 7.828 0.229 791 HB ILE 96 HB ILE 96 4.265 7.747 0.662 792 HG12 ILE 96 HG12 ILE 96 4.576 6.425 -2.062 793 HG13 ILE 96 HG13 ILE 96 4.858 8.157 -1.846 794 HG21 ILE 96 HG21 ILE 96 2.930 5.284 -0.526 795 HG22 ILE 96 HG22 ILE 96 4.374 5.230 0.487 796 HG23 ILE 96 HG23 ILE 96 2.862 5.832 1.163 797 HD11 ILE 96 HD11 ILE 96 6.338 5.953 -0.420 798 HD12 ILE 96 HD12 ILE 96 6.945 7.033 -1.702 799 HD13 ILE 96 HD13 ILE 96 6.515 7.699 -0.104 800 H GLN 97 H GLN 97 2.333 9.771 1.297 801 HA GLN 97 HA GLN 97 2.583 12.107 -0.485 802 HB2 GLN 97 HB2 GLN 97 1.147 11.905 1.694 803 HB3 GLN 97 HB3 GLN 97 2.673 12.183 2.532 804 HG2 GLN 97 HG2 GLN 97 2.035 14.373 2.315 805 HG3 GLN 97 HG3 GLN 97 2.853 14.197 0.764 806 HE21 GLN 97 HE21 GLN 97 -0.049 15.331 -0.870 807 HE22 GLN 97 HE22 GLN 97 1.714 15.233 -0.802 808 H ASP 98 H ASP 98 4.485 13.318 -0.866 809 HA ASP 98 HA ASP 98 7.031 12.114 -0.018 810 HB2 ASP 98 HB2 ASP 98 6.571 12.963 -2.291 811 HB3 ASP 98 HB3 ASP 98 6.306 14.566 -1.602 812 H GLY 99 H GLY 99 4.986 14.594 1.245 813 HA2 GLY 99 HA2 GLY 99 5.218 15.771 3.251 814 HA3 GLY 99 HA3 GLY 99 6.920 15.325 3.339 815 H THR 100 H THR 100 6.527 16.564 0.267 816 HA THR 100 HA THR 100 7.250 19.344 1.086 817 HB THR 100 HB THR 100 8.411 19.559 -1.018 818 HG1 THR 100 HG1 THR 100 8.258 16.859 -1.597 819 HG21 THR 100 HG21 THR 100 10.234 17.978 -0.705 820 HG22 THR 100 HG22 THR 100 9.686 18.596 0.867 821 HG23 THR 100 HG23 THR 100 9.226 16.959 0.344 822 H GLY 101 H GLY 101 4.482 18.086 0.559 823 HA2 GLY 101 HA2 GLY 101 2.473 19.152 -0.053 824 HA3 GLY 101 HA3 GLY 101 3.352 20.303 -1.060 825 H ARG 102 H ARG 102 4.199 16.973 -1.446 826 HA ARG 102 HA ARG 102 2.480 16.574 -3.851 827 HB2 ARG 102 HB2 ARG 102 4.239 16.180 -5.262 828 HB3 ARG 102 HB3 ARG 102 4.715 17.636 -4.352 829 HG2 ARG 102 HG2 ARG 102 6.187 16.194 -2.958 830 HG3 ARG 102 HG3 ARG 102 5.785 14.817 -4.013 831 HD2 ARG 102 HD2 ARG 102 7.787 15.622 -4.917 832 HD3 ARG 102 HD3 ARG 102 6.529 16.319 -5.959 833 HE ARG 102 HE ARG 102 7.595 17.859 -3.625 834 HH11 ARG 102 HH11 ARG 102 8.297 19.894 -3.928 835 HH12 ARG 102 HH12 ARG 102 8.549 20.529 -5.532 836 HH21 ARG 102 HH21 ARG 102 7.506 17.669 -7.133 837 HH22 ARG 102 HH22 ARG 102 8.096 19.299 -7.315 838 H SER 103 H SER 103 2.931 14.287 -4.782 839 HA SER 103 HA SER 103 3.419 12.294 -2.627 840 HB2 SER 103 HB2 SER 103 1.062 12.220 -4.540 841 HB3 SER 103 HB3 SER 103 1.547 10.914 -3.443 842 HG SER 103 HG SER 103 0.715 13.528 -2.718 843 H ALA 104 H ALA 104 4.040 10.261 -3.289 844 HA ALA 104 HA ALA 104 5.029 9.925 -6.097 845 HB1 ALA 104 HB1 ALA 104 6.328 8.945 -3.533 846 HB2 ALA 104 HB2 ALA 104 6.864 8.574 -5.183 847 HB3 ALA 104 HB3 ALA 104 6.925 10.249 -4.586 848 H PHE 105 H PHE 105 4.735 7.933 -7.072 849 HA PHE 105 HA PHE 105 2.865 6.059 -5.710 850 HB2 PHE 105 HB2 PHE 105 3.692 6.072 -8.617 851 HB3 PHE 105 HB3 PHE 105 2.376 5.173 -7.870 852 HD1 PHE 105 HD1 PHE 105 3.345 8.265 -9.459 853 HD2 PHE 105 HD2 PHE 105 0.441 6.549 -6.769 854 HE1 PHE 105 HE1 PHE 105 1.851 10.204 -9.836 855 HE2 PHE 105 HE2 PHE 105 -1.063 8.480 -7.176 856 HZ PHE 105 HZ PHE 105 -0.374 10.308 -8.702 857 H ILE 106 H ILE 106 3.525 4.191 -4.927 858 HA ILE 106 HA ILE 106 5.959 2.896 -6.066 859 HB ILE 106 HB ILE 106 6.563 1.895 -3.951 860 HG12 ILE 106 HG12 ILE 106 4.385 3.740 -2.769 861 HG13 ILE 106 HG13 ILE 106 4.338 1.981 -2.791 862 HG21 ILE 106 HG21 ILE 106 6.441 4.937 -3.642 863 HG22 ILE 106 HG22 ILE 106 7.690 3.825 -3.039 864 HG23 ILE 106 HG23 ILE 106 7.518 4.108 -4.777 865 HD11 ILE 106 HD11 ILE 106 6.112 1.831 -1.174 866 HD12 ILE 106 HD12 ILE 106 6.340 3.600 -1.182 867 HD13 ILE 106 HD13 ILE 106 4.837 2.889 -0.578 868 H GLY 107 H GLY 107 5.874 0.746 -6.400 869 HA2 GLY 107 HA2 GLY 107 3.346 -0.719 -6.106 870 HA3 GLY 107 HA3 GLY 107 4.859 -1.317 -6.789 871 H ILE 108 H ILE 108 3.199 -2.541 -4.752 872 HA ILE 108 HA ILE 108 5.303 -2.900 -2.677 873 HB ILE 108 HB ILE 108 2.301 -3.161 -2.157 874 HG12 ILE 108 HG12 ILE 108 4.278 -0.919 -1.536 875 HG13 ILE 108 HG13 ILE 108 2.756 -0.808 -2.422 876 HG21 ILE 108 HG21 ILE 108 4.690 -3.259 -0.265 877 HG22 ILE 108 HG22 ILE 108 2.982 -3.461 0.193 878 HG23 ILE 108 HG23 ILE 108 3.747 -4.675 -0.784 879 HD11 ILE 108 HD11 ILE 108 1.534 -1.352 -0.307 880 HD12 ILE 108 HD12 ILE 108 3.098 -1.263 0.563 881 HD13 ILE 108 HD13 ILE 108 2.485 0.157 -0.258 882 H GLY 109 H GLY 109 5.713 -5.116 -2.228 883 HA2 GLY 109 HA2 GLY 109 3.915 -7.203 -3.363 884 HA3 GLY 109 HA3 GLY 109 5.656 -7.338 -3.616 885 H PHE 110 H PHE 110 3.418 -8.720 -1.939 886 HA PHE 110 HA PHE 110 4.700 -8.703 0.745 887 HB2 PHE 110 HB2 PHE 110 2.102 -9.801 -0.322 888 HB3 PHE 110 HB3 PHE 110 2.714 -10.249 1.249 889 HD1 PHE 110 HD1 PHE 110 2.486 -8.903 3.148 890 HD2 PHE 110 HD2 PHE 110 1.727 -7.199 -0.743 891 HE1 PHE 110 HE1 PHE 110 1.532 -6.897 4.218 892 HE2 PHE 110 HE2 PHE 110 0.847 -5.144 0.341 893 HZ PHE 110 HZ PHE 110 0.770 -4.979 2.810 894 H THR 111 H THR 111 5.116 -10.638 1.880 895 HA THR 111 HA THR 111 6.725 -12.508 0.356 896 HB THR 111 HB THR 111 7.206 -11.494 2.595 897 HG1 THR 111 HG1 THR 111 8.413 -13.221 3.148 898 HG21 THR 111 HG21 THR 111 5.083 -12.006 3.754 899 HG22 THR 111 HG22 THR 111 5.455 -13.743 3.657 900 HG23 THR 111 HG23 THR 111 6.490 -12.660 4.607 901 H ASP 112 H ASP 112 3.485 -12.499 1.518 902 HA ASP 112 HA ASP 112 3.032 -15.214 0.404 903 HB2 ASP 112 HB2 ASP 112 3.196 -15.176 2.985 904 HB3 ASP 112 HB3 ASP 112 1.672 -14.278 2.951 905 H ARG 113 H ARG 113 1.042 -15.534 -0.617 906 HA ARG 113 HA ARG 113 -0.376 -13.241 -1.649 907 HB2 ARG 113 HB2 ARG 113 -0.832 -16.253 -1.668 908 HB3 ARG 113 HB3 ARG 113 -2.081 -15.182 -2.284 909 HG2 ARG 113 HG2 ARG 113 0.789 -15.084 -3.276 910 HG3 ARG 113 HG3 ARG 113 -0.443 -16.104 -4.017 911 HD2 ARG 113 HD2 ARG 113 -0.966 -13.129 -3.654 912 HD3 ARG 113 HD3 ARG 113 0.060 -13.724 -4.966 913 HE ARG 113 HE ARG 113 -1.779 -14.773 -6.021 914 HH11 ARG 113 HH11 ARG 113 -3.713 -14.966 -6.535 915 HH12 ARG 113 HH12 ARG 113 -5.049 -14.223 -5.624 916 HH21 ARG 113 HH21 ARG 113 -2.916 -12.891 -3.271 917 HH22 ARG 113 HH22 ARG 113 -4.541 -13.474 -3.490 918 H GLY 114 H GLY 114 -1.013 -15.314 1.145 919 HA2 GLY 114 HA2 GLY 114 -3.640 -14.224 1.742 920 HA3 GLY 114 HA3 GLY 114 -2.562 -15.112 2.831 921 H ASP 115 H ASP 115 -0.275 -13.260 2.557 922 HA ASP 115 HA ASP 115 -1.072 -11.289 4.530 923 HB2 ASP 115 HB2 ASP 115 1.532 -11.648 3.030 924 HB3 ASP 115 HB3 ASP 115 1.239 -10.430 4.273 925 H ALA 116 H ALA 116 -0.369 -11.084 1.018 926 HA ALA 116 HA ALA 116 -1.026 -8.269 0.865 927 HB1 ALA 116 HB1 ALA 116 0.187 -9.108 -0.987 928 HB2 ALA 116 HB2 ALA 116 -0.858 -10.536 -1.152 929 HB3 ALA 116 HB3 ALA 116 -1.441 -8.921 -1.614 930 H PHE 117 H PHE 117 -3.049 -11.258 0.266 931 HA PHE 117 HA PHE 117 -5.436 -9.834 -0.197 932 HB2 PHE 117 HB2 PHE 117 -4.979 -12.291 -0.509 933 HB3 PHE 117 HB3 PHE 117 -5.270 -12.498 1.217 934 HD1 PHE 117 HD1 PHE 117 -7.539 -12.559 2.054 935 HD2 PHE 117 HD2 PHE 117 -6.803 -11.405 -2.032 936 HE1 PHE 117 HE1 PHE 117 -9.966 -12.757 1.556 937 HE2 PHE 117 HE2 PHE 117 -9.217 -11.504 -2.498 938 HZ PHE 117 HZ PHE 117 -10.818 -12.200 -0.714 939 H ASP 118 H ASP 118 -3.894 -10.347 2.959 940 HA ASP 118 HA ASP 118 -6.194 -9.364 4.483 941 HB2 ASP 118 HB2 ASP 118 -3.279 -9.880 5.127 942 HB3 ASP 118 HB3 ASP 118 -4.375 -9.131 6.286 943 H PHE 119 H PHE 119 -3.287 -7.872 2.989 944 HA PHE 119 HA PHE 119 -3.740 -5.246 4.033 945 HB2 PHE 119 HB2 PHE 119 -1.631 -5.764 3.072 946 HB3 PHE 119 HB3 PHE 119 -2.331 -6.289 1.563 947 HD1 PHE 119 HD1 PHE 119 -0.938 -3.479 3.304 948 HD2 PHE 119 HD2 PHE 119 -3.463 -4.606 0.029 949 HE1 PHE 119 HE1 PHE 119 -0.724 -1.199 2.366 950 HE2 PHE 119 HE2 PHE 119 -3.164 -2.358 -0.980 951 HZ PHE 119 HZ PHE 119 -1.834 -0.633 0.215 952 H ASN 120 H ASN 120 -5.141 -7.022 1.289 953 HA ASN 120 HA ASN 120 -6.845 -4.832 0.419 954 HB2 ASN 120 HB2 ASN 120 -6.463 -6.375 -1.240 955 HB3 ASN 120 HB3 ASN 120 -6.610 -7.770 -0.170 956 HD21 ASN 120 HD21 ASN 120 -9.974 -8.291 -0.957 957 HD22 ASN 120 HD22 ASN 120 -8.527 -8.884 -0.165 958 H VAL 121 H VAL 121 -7.645 -7.790 2.388 959 HA VAL 121 HA VAL 121 -10.348 -6.998 2.725 960 HB VAL 121 HB VAL 121 -8.616 -8.946 4.273 961 HG11 VAL 121 HG11 VAL 121 -10.728 -9.929 5.169 962 HG12 VAL 121 HG12 VAL 121 -10.396 -8.335 5.838 963 HG13 VAL 121 HG13 VAL 121 -11.623 -8.519 4.563 964 HG21 VAL 121 HG21 VAL 121 -9.187 -9.515 1.899 965 HG22 VAL 121 HG22 VAL 121 -9.940 -10.623 3.044 966 HG23 VAL 121 HG23 VAL 121 -10.906 -9.340 2.283 967 H SER 122 H SER 122 -7.556 -6.198 4.788 968 HA SER 122 HA SER 122 -9.095 -4.986 6.891 969 HB2 SER 122 HB2 SER 122 -7.004 -3.750 7.415 970 HB3 SER 122 HB3 SER 122 -6.804 -5.510 7.304 971 HG SER 122 HG SER 122 -5.815 -5.299 5.372 972 H LEU 123 H LEU 123 -8.423 -3.835 3.652 973 HA LEU 123 HA LEU 123 -9.491 -1.142 4.328 974 HB2 LEU 123 HB2 LEU 123 -8.424 -2.234 1.718 975 HB3 LEU 123 HB3 LEU 123 -8.967 -0.578 2.005 976 HG LEU 123 HG LEU 123 -6.599 -1.945 3.341 977 HD11 LEU 123 HD11 LEU 123 -6.633 0.350 1.376 978 HD12 LEU 123 HD12 LEU 123 -5.219 -0.545 1.989 979 HD13 LEU 123 HD13 LEU 123 -6.362 -1.350 0.912 980 HD21 LEU 123 HD21 LEU 123 -7.504 -0.286 4.893 981 HD22 LEU 123 HD22 LEU 123 -6.024 0.341 4.168 982 HD23 LEU 123 HD23 LEU 123 -7.601 0.924 3.594 983 H GLN 124 H GLN 124 -10.424 -4.093 2.480 984 HA GLN 124 HA GLN 124 -12.898 -3.130 1.455 985 HB2 GLN 124 HB2 GLN 124 -12.270 -5.902 2.554 986 HB3 GLN 124 HB3 GLN 124 -13.696 -5.499 1.619 987 HG2 GLN 124 HG2 GLN 124 -10.845 -5.304 0.582 988 HG3 GLN 124 HG3 GLN 124 -11.923 -6.654 0.315 989 HE21 GLN 124 HE21 GLN 124 -12.060 -4.548 -2.728 990 HE22 GLN 124 HE22 GLN 124 -10.800 -5.432 -1.865 991 H ASP 125 H ASP 125 -12.287 -4.709 4.640 992 HA ASP 125 HA ASP 125 -14.978 -4.175 5.606 993 HB2 ASP 125 HB2 ASP 125 -13.434 -6.105 6.231 994 HB3 ASP 125 HB3 ASP 125 -12.471 -4.940 7.154 995 H HIS 126 H HIS 126 -12.362 -2.086 5.252 996 HA HIS 126 HA HIS 126 -13.115 -0.326 7.532 997 HB2 HIS 126 HB2 HIS 126 -10.748 -0.463 7.032 998 HB3 HIS 126 HB3 HIS 126 -11.039 0.025 5.358 999 HD2 HIS 126 HD2 HIS 126 -11.839 1.537 8.889 1000 HE1 HIS 126 HE1 HIS 126 -10.758 4.737 6.295 1001 HE2 HIS 126 HE2 HIS 126 -11.490 4.149 8.639 1002 H PHE 127 H PHE 127 -13.341 -0.456 3.959 1003 HA PHE 127 HA PHE 127 -15.019 1.959 3.972 1004 HB2 PHE 127 HB2 PHE 127 -13.839 0.299 1.761 1005 HB3 PHE 127 HB3 PHE 127 -14.984 1.608 1.481 1006 HD1 PHE 127 HD1 PHE 127 -11.495 0.845 2.176 1007 HD2 PHE 127 HD2 PHE 127 -14.472 3.944 2.429 1008 HE1 PHE 127 HE1 PHE 127 -9.705 2.537 2.447 1009 HE2 PHE 127 HE2 PHE 127 -12.674 5.635 2.718 1010 HZ PHE 127 HZ PHE 127 -10.299 4.935 2.731 1011 H LYS 128 H LYS 128 -15.706 -1.446 4.151 1012 HA LYS 128 HA LYS 128 -18.152 -1.518 2.824 1013 HB2 LYS 128 HB2 LYS 128 -18.605 -3.568 3.804 1014 HB3 LYS 128 HB3 LYS 128 -16.878 -3.467 3.636 1015 HG2 LYS 128 HG2 LYS 128 -17.012 -4.391 5.710 1016 HG3 LYS 128 HG3 LYS 128 -16.966 -2.681 6.186 1017 HD2 LYS 128 HD2 LYS 128 -19.538 -2.839 6.208 1018 HD3 LYS 128 HD3 LYS 128 -19.338 -4.570 5.939 1019 HE2 LYS 128 HE2 LYS 128 -18.121 -3.083 8.296 1020 HE3 LYS 128 HE3 LYS 128 -19.764 -3.728 8.327 1021 HZ1 LYS 128 HZ1 LYS 128 -18.246 -5.324 9.280 1022 HZ2 LYS 128 HZ2 LYS 128 -18.818 -5.949 7.885 1023 HZ3 LYS 128 HZ3 LYS 128 -17.293 -5.342 7.961 1024 H TRP 129 H TRP 129 -17.642 -0.114 5.980 1025 HA TRP 129 HA TRP 129 -20.578 0.112 6.465 1026 HB2 TRP 129 HB2 TRP 129 -19.900 0.647 8.770 1027 HB3 TRP 129 HB3 TRP 129 -19.397 -0.936 8.218 1028 HD1 TRP 129 HD1 TRP 129 -16.799 -1.453 8.080 1029 HE1 TRP 129 HE1 TRP 129 -14.719 -0.250 8.819 1030 HE3 TRP 129 HE3 TRP 129 -18.861 3.102 9.116 1031 HZ2 TRP 129 HZ2 TRP 129 -13.971 2.412 9.763 1032 HZ3 TRP 129 HZ3 TRP 129 -17.423 4.991 9.899 1033 HH2 TRP 129 HH2 TRP 129 -14.978 4.657 10.197 1034 H VAL 130 H VAL 130 -18.524 1.886 4.806 1035 HA VAL 130 HA VAL 130 -19.844 4.500 5.347 1036 HB VAL 130 HB VAL 130 -17.302 5.256 4.499 1037 HG11 VAL 130 HG11 VAL 130 -17.095 6.094 6.846 1038 HG12 VAL 130 HG12 VAL 130 -18.690 6.416 6.142 1039 HG13 VAL 130 HG13 VAL 130 -18.479 5.089 7.306 1040 HG21 VAL 130 HG21 VAL 130 -16.391 3.020 5.006 1041 HG22 VAL 130 HG22 VAL 130 -15.655 4.329 5.939 1042 HG23 VAL 130 HG23 VAL 130 -16.822 3.244 6.705 1043 H LYS 131 H LYS 131 -18.548 5.829 3.247 1044 HA LYS 131 HA LYS 131 -18.391 6.154 1.066 1045 HB2 LYS 131 HB2 LYS 131 -16.519 4.834 1.863 1046 HB3 LYS 131 HB3 LYS 131 -17.383 3.329 1.601 1047 HG2 LYS 131 HG2 LYS 131 -15.649 3.628 -0.004 1048 HG3 LYS 131 HG3 LYS 131 -17.246 3.540 -0.731 1049 HD2 LYS 131 HD2 LYS 131 -17.105 6.193 -0.687 1050 HD3 LYS 131 HD3 LYS 131 -15.388 5.906 -0.432 1051 HE2 LYS 131 HE2 LYS 131 -15.881 6.251 -2.828 1052 HE3 LYS 131 HE3 LYS 131 -15.309 4.597 -2.569 1053 HZ1 LYS 131 HZ1 LYS 131 -17.536 3.774 -2.784 1054 HZ2 LYS 131 HZ2 LYS 131 -18.201 5.250 -2.688 1055 HZ3 LYS 131 HZ3 LYS 131 -17.342 4.820 -4.023 1056 H GLN 132 H GLN 132 -20.988 4.778 1.769 1057 HA GLN 132 HA GLN 132 -22.902 4.074 0.772 1058 HB2 GLN 132 HB2 GLN 132 -21.999 5.740 -1.598 1059 HB3 GLN 132 HB3 GLN 132 -23.654 5.324 -1.155 1060 HG2 GLN 132 HG2 GLN 132 -21.756 7.158 0.368 1061 HG3 GLN 132 HG3 GLN 132 -23.179 7.636 -0.540 1062 HE21 GLN 132 HE21 GLN 132 -23.814 7.228 3.263 1063 HE22 GLN 132 HE22 GLN 132 -22.390 7.865 2.452 1064 H GLU 133 H GLU 133 -20.940 2.176 0.647 1065 HA GLU 133 HA GLU 133 -21.104 0.836 -1.952 1066 HB2 GLU 133 HB2 GLU 133 -19.932 -0.071 0.702 1067 HB3 GLU 133 HB3 GLU 133 -19.829 -0.979 -0.800 1068 HG2 GLU 133 HG2 GLU 133 -18.620 1.764 -0.266 1069 HG3 GLU 133 HG3 GLU 133 -17.750 0.242 -0.318 1070 H1 SER 149 H1 SER 149 14.831 -23.771 -10.421 1071 H2 SER 149 H2 SER 149 14.553 -22.502 -9.422 1072 H3 SER 149 H3 SER 149 15.886 -22.514 -10.376 1073 HA SER 149 HA SER 149 14.589 -22.377 -12.359 1074 HB2 SER 149 HB2 SER 149 12.180 -22.302 -10.500 1075 HB3 SER 149 HB3 SER 149 12.160 -22.162 -12.271 1076 HG SER 149 HG SER 149 11.743 -24.308 -11.571 1077 H GLN 150 H GLN 150 13.935 -20.357 -13.273 1078 HA GLN 150 HA GLN 150 14.203 -17.981 -11.467 1079 HB2 GLN 150 HB2 GLN 150 15.389 -18.392 -14.235 1080 HB3 GLN 150 HB3 GLN 150 15.444 -16.889 -13.301 1081 HG2 GLN 150 HG2 GLN 150 16.687 -18.064 -11.488 1082 HG3 GLN 150 HG3 GLN 150 16.737 -19.521 -12.484 1083 HE21 GLN 150 HE21 GLN 150 19.984 -17.875 -13.039 1084 HE22 GLN 150 HE22 GLN 150 19.159 -18.710 -11.728 1085 H ILE 151 H ILE 151 11.725 -19.310 -12.542 1086 HA ILE 151 HA ILE 151 10.564 -17.554 -14.538 1087 HB ILE 151 HB ILE 151 9.250 -19.498 -12.601 1088 HG12 ILE 151 HG12 ILE 151 9.997 -19.834 -15.548 1089 HG13 ILE 151 HG13 ILE 151 10.879 -20.546 -14.199 1090 HG21 ILE 151 HG21 ILE 151 7.286 -19.381 -14.113 1091 HG22 ILE 151 HG22 ILE 151 7.621 -17.813 -13.420 1092 HG23 ILE 151 HG23 ILE 151 8.106 -18.152 -15.098 1093 HD11 ILE 151 HD11 ILE 151 9.516 -22.257 -15.123 1094 HD12 ILE 151 HD12 ILE 151 8.817 -21.822 -13.551 1095 HD13 ILE 151 HD13 ILE 151 8.060 -21.258 -15.063 1096 H THR 152 H THR 152 9.443 -15.671 -14.292 1097 HA THR 152 HA THR 152 9.630 -14.273 -11.747 1098 HB THR 152 HB THR 152 8.525 -12.407 -13.088 1099 HG1 THR 152 HG1 THR 152 8.858 -12.777 -15.392 1100 HG21 THR 152 HG21 THR 152 10.580 -11.901 -14.323 1101 HG22 THR 152 HG22 THR 152 10.971 -12.563 -12.729 1102 HG23 THR 152 HG23 THR 152 11.117 -13.591 -14.173 1103 H SER 153 H SER 153 8.065 -13.615 -10.380 1104 HA SER 153 HA SER 153 5.676 -15.234 -10.288 1105 HB2 SER 153 HB2 SER 153 6.658 -13.086 -8.402 1106 HB3 SER 153 HB3 SER 153 5.399 -14.296 -8.062 1107 HG SER 153 HG SER 153 7.468 -14.920 -7.230 1108 H GLN 154 H GLN 154 5.335 -13.776 -12.379 1109 HA GLN 154 HA GLN 154 4.179 -11.280 -12.511 1110 HB2 GLN 154 HB2 GLN 154 3.471 -13.798 -14.052 1111 HB3 GLN 154 HB3 GLN 154 2.948 -12.178 -14.521 1112 HG2 GLN 154 HG2 GLN 154 5.255 -11.449 -14.850 1113 HG3 GLN 154 HG3 GLN 154 5.878 -12.948 -14.176 1114 HE21 GLN 154 HE21 GLN 154 6.178 -14.197 -17.454 1115 HE22 GLN 154 HE22 GLN 154 6.963 -13.844 -15.912 1116 H VAL 155 H VAL 155 2.242 -10.285 -12.133 1117 HA VAL 155 HA VAL 155 0.501 -11.296 -10.156 1118 HB VAL 155 HB VAL 155 0.647 -8.977 -10.334 1119 HG11 VAL 155 HG11 VAL 155 -0.280 -9.056 -13.194 1120 HG12 VAL 155 HG12 VAL 155 -0.093 -7.594 -12.219 1121 HG13 VAL 155 HG13 VAL 155 1.328 -8.596 -12.578 1122 HG21 VAL 155 HG21 VAL 155 -2.144 -9.936 -10.924 1123 HG22 VAL 155 HG22 VAL 155 -1.491 -9.161 -9.472 1124 HG23 VAL 155 HG23 VAL 155 -1.857 -8.207 -10.876 1125 H TPO 156 H T2P 156 -0.875 -12.853 -10.237 1126 HA TPO 156 HA T2P 156 -1.908 -14.381 -12.355 1127 HB TPO 156 HB T2P 156 -3.056 -13.769 -9.673 1128 HG21 TPO 156 HG21 T2P 156 -5.009 -14.134 -10.691 1129 HG22 TPO 156 HG22 T2P 156 -4.595 -15.624 -9.825 1130 HG23 TPO 156 HG23 T2P 156 -4.402 -15.568 -11.589 1131 H GLY 157 H GLY 157 -3.684 -14.469 -13.360 1132 HA2 GLY 157 HA2 GLY 157 -5.858 -12.527 -13.403 1133 HA3 GLY 157 HA3 GLY 157 -4.823 -12.375 -14.830 1134 H GLN 158 H GLN 158 -4.374 -15.440 -14.535 1135 HA GLN 158 HA GLN 158 -6.331 -16.424 -16.325 1136 HB2 GLN 158 HB2 GLN 158 -5.171 -18.480 -16.140 1137 HB3 GLN 158 HB3 GLN 158 -3.974 -17.205 -16.120 1138 HG2 GLN 158 HG2 GLN 158 -4.954 -18.727 -13.649 1139 HG3 GLN 158 HG3 GLN 158 -3.534 -19.141 -14.583 1140 HE21 GLN 158 HE21 GLN 158 -2.359 -17.234 -11.615 1141 HE22 GLN 158 HE22 GLN 158 -3.129 -18.786 -11.917 1142 H ILE 159 H ILE 159 -6.585 -16.055 -12.942 1143 HA ILE 159 HA ILE 159 -9.094 -17.624 -12.878 1144 HB ILE 159 HB ILE 159 -7.321 -19.140 -12.165 1145 HG12 ILE 159 HG12 ILE 159 -9.195 -18.395 -9.889 1146 HG13 ILE 159 HG13 ILE 159 -9.643 -19.318 -11.322 1147 HG21 ILE 159 HG21 ILE 159 -6.820 -17.291 -9.808 1148 HG22 ILE 159 HG22 ILE 159 -6.071 -18.869 -10.077 1149 HG23 ILE 159 HG23 ILE 159 -5.715 -17.551 -11.176 1150 HD11 ILE 159 HD11 ILE 159 -7.970 -21.074 -10.679 1151 HD12 ILE 159 HD12 ILE 159 -7.678 -20.184 -9.163 1152 HD13 ILE 159 HD13 ILE 159 -9.280 -20.852 -9.502 1153 H GLY 160 H GLY 160 -7.088 -15.169 -11.318 1154 HA2 GLY 160 HA2 GLY 160 -7.736 -13.127 -10.404 1155 HA3 GLY 160 HA3 GLY 160 -9.409 -13.483 -10.840 1156 H TRP 161 H TRP 161 -7.424 -15.542 -8.788 1157 HA TRP 161 HA TRP 161 -9.464 -15.458 -6.690 1158 HB2 TRP 161 HB2 TRP 161 -8.661 -17.576 -6.058 1159 HB3 TRP 161 HB3 TRP 161 -8.721 -17.547 -7.805 1160 HD1 TRP 161 HD1 TRP 161 -5.741 -15.771 -7.496 1161 HE1 TRP 161 HE1 TRP 161 -3.644 -17.189 -7.543 1162 HE3 TRP 161 HE3 TRP 161 -7.840 -20.122 -5.952 1163 HZ2 TRP 161 HZ2 TRP 161 -3.013 -20.041 -7.223 1164 HZ3 TRP 161 HZ3 TRP 161 -6.463 -22.214 -5.797 1165 HH2 TRP 161 HH2 TRP 161 -4.065 -22.183 -6.450 1166 H ARG 162 H ARG 162 -7.788 -16.536 -4.638 1167 HA ARG 162 HA ARG 162 -7.649 -13.785 -3.519 1168 HB2 ARG 162 HB2 ARG 162 -9.024 -16.325 -2.578 1169 HB3 ARG 162 HB3 ARG 162 -9.189 -14.725 -1.819 1170 HG2 ARG 162 HG2 ARG 162 -10.099 -15.599 -4.592 1171 HG3 ARG 162 HG3 ARG 162 -11.142 -15.287 -3.223 1172 HD2 ARG 162 HD2 ARG 162 -11.013 -12.970 -3.440 1173 HD3 ARG 162 HD3 ARG 162 -9.403 -12.999 -4.131 1174 HE ARG 162 HE ARG 162 -10.231 -13.200 -6.260 1175 HH11 ARG 162 HH11 ARG 162 -11.628 -13.309 -7.848 1176 HH12 ARG 162 HH12 ARG 162 -13.349 -13.468 -7.548 1177 HH21 ARG 162 HH21 ARG 162 -12.975 -13.719 -4.126 1178 HH22 ARG 162 HH22 ARG 162 -14.092 -13.728 -5.463 1179 H ARG 163 H ARG 163 -7.031 -17.026 -2.104 1180 HA ARG 163 HA ARG 163 -4.559 -15.939 -0.811 1181 HB2 ARG 163 HB2 ARG 163 -6.622 -17.719 0.547 1182 HB3 ARG 163 HB3 ARG 163 -5.105 -17.134 1.233 1183 HG2 ARG 163 HG2 ARG 163 -5.993 -14.769 1.016 1184 HG3 ARG 163 HG3 ARG 163 -7.536 -15.451 0.486 1185 HD2 ARG 163 HD2 ARG 163 -7.895 -15.107 2.752 1186 HD3 ARG 163 HD3 ARG 163 -7.512 -16.818 2.675 1187 HE ARG 163 HE ARG 163 -5.288 -16.360 3.544 1188 HH11 ARG 163 HH11 ARG 163 -4.027 -15.235 5.036 1189 HH12 ARG 163 HH12 ARG 163 -4.524 -13.630 5.531 1190 HH21 ARG 163 HH21 ARG 163 -7.529 -13.699 3.956 1191 HH22 ARG 163 HH22 ARG 163 -6.439 -12.840 5.028 Start of MODEL 19 1 H1 GLY -4 H1 GLY -4 -0.883 28.475 30.341 2 H2 GLY -4 H2 GLY -4 -0.551 26.922 30.738 3 H3 GLY -4 H3 GLY -4 -1.791 27.706 31.468 4 HA2 GLY -4 HA2 GLY -4 -2.641 26.165 29.827 5 HA3 GLY -4 HA3 GLY -4 -3.020 27.848 29.414 6 H SER -3 H SER -3 -2.772 25.495 27.646 7 HA SER -3 HA SER -3 -0.331 25.549 26.184 8 HB2 SER -3 HB2 SER -3 -3.095 24.662 25.280 9 HB3 SER -3 HB3 SER -3 -1.558 24.249 24.496 10 HG SER -3 HG SER -3 -2.280 22.597 25.932 11 HA PRO -2 HA PRO -2 -0.933 29.096 23.508 12 HB2 PRO -2 HB2 PRO -2 0.722 28.535 21.418 13 HB3 PRO -2 HB3 PRO -2 1.334 28.903 23.059 14 HG2 PRO -2 HG2 PRO -2 0.873 26.167 21.820 15 HG3 PRO -2 HG3 PRO -2 2.346 26.769 22.646 16 HD2 PRO -2 HD2 PRO -2 0.477 25.282 23.950 17 HD3 PRO -2 HD3 PRO -2 1.325 26.626 24.771 18 H ASN -1 H ASN -1 -1.821 29.752 21.450 19 HA ASN -1 HA ASN -1 -3.893 27.996 20.403 20 HB2 ASN -1 HB2 ASN -1 -4.558 29.907 19.086 21 HB3 ASN -1 HB3 ASN -1 -4.233 30.429 20.731 22 HD21 ASN -1 HD21 ASN -1 -2.132 32.070 17.687 23 HD22 ASN -1 HD22 ASN -1 -3.431 30.925 17.395 24 H SER 0 H SER 0 -4.145 27.291 18.238 25 HA SER 0 HA SER 0 -1.890 27.366 16.354 26 HB2 SER 0 HB2 SER 0 -1.278 25.509 17.869 27 HB3 SER 0 HB3 SER 0 -2.843 24.733 17.560 28 HG SER 0 HG SER 0 -0.966 24.020 16.255 29 H MET 1 H MET 1 -2.419 26.542 14.281 30 HA MET 1 HA MET 1 -5.265 26.644 13.508 31 HB2 MET 1 HB2 MET 1 -2.725 26.204 11.890 32 HB3 MET 1 HB3 MET 1 -4.355 26.324 11.212 33 HG2 MET 1 HG2 MET 1 -4.598 28.588 12.198 34 HG3 MET 1 HG3 MET 1 -2.935 28.515 12.778 35 HE1 MET 1 HE1 MET 1 -0.805 28.697 11.306 36 HE2 MET 1 HE2 MET 1 -1.253 27.240 10.387 37 HE3 MET 1 HE3 MET 1 -0.802 28.727 9.530 38 H ALA 2 H ALA 2 -3.137 24.194 14.596 39 HA ALA 2 HA ALA 2 -4.290 21.956 13.135 40 HB1 ALA 2 HB1 ALA 2 -2.490 22.056 15.590 41 HB2 ALA 2 HB2 ALA 2 -2.840 20.625 14.596 42 HB3 ALA 2 HB3 ALA 2 -1.950 21.990 13.895 43 H THR 3 H THR 3 -6.492 22.985 13.793 44 HA THR 3 HA THR 3 -7.430 22.390 16.498 45 HB THR 3 HB THR 3 -7.860 24.496 15.243 46 HG1 THR 3 HG1 THR 3 -10.070 23.033 16.227 47 HG21 THR 3 HG21 THR 3 -9.971 22.889 13.743 48 HG22 THR 3 HG22 THR 3 -9.737 24.648 13.705 49 HG23 THR 3 HG23 THR 3 -8.494 23.582 13.034 50 H GLU 4 H GLU 4 -7.289 20.428 13.828 51 HA GLU 4 HA GLU 4 -9.886 19.140 14.009 52 HB2 GLU 4 HB2 GLU 4 -9.067 17.557 12.426 53 HB3 GLU 4 HB3 GLU 4 -8.604 19.175 11.917 54 HG2 GLU 4 HG2 GLU 4 -6.288 18.790 12.643 55 HG3 GLU 4 HG3 GLU 4 -6.720 17.222 13.324 56 H LEU 5 H LEU 5 -10.159 16.832 14.408 57 HA LEU 5 HA LEU 5 -8.874 15.845 16.883 58 HB2 LEU 5 HB2 LEU 5 -10.987 14.624 15.060 59 HB3 LEU 5 HB3 LEU 5 -10.410 13.921 16.570 60 HG LEU 5 HG LEU 5 -11.903 16.569 16.311 61 HD11 LEU 5 HD11 LEU 5 -12.780 13.868 17.415 62 HD12 LEU 5 HD12 LEU 5 -13.744 15.364 17.398 63 HD13 LEU 5 HD13 LEU 5 -13.301 14.583 15.872 64 HD21 LEU 5 HD21 LEU 5 -10.422 16.654 18.263 65 HD22 LEU 5 HD22 LEU 5 -12.091 16.435 18.792 66 HD23 LEU 5 HD23 LEU 5 -10.981 15.046 18.790 67 H GLU 6 H GLU 6 -6.762 15.771 16.165 68 HA GLU 6 HA GLU 6 -6.062 14.602 13.656 69 HB2 GLU 6 HB2 GLU 6 -5.106 16.648 15.023 70 HB3 GLU 6 HB3 GLU 6 -4.008 15.445 15.693 71 HG2 GLU 6 HG2 GLU 6 -3.414 14.822 13.278 72 HG3 GLU 6 HG3 GLU 6 -4.470 16.140 12.757 73 H TYR 7 H TYR 7 -7.177 12.523 15.081 74 HA TYR 7 HA TYR 7 -5.020 10.788 16.105 75 HB2 TYR 7 HB2 TYR 7 -6.665 9.448 17.046 76 HB3 TYR 7 HB3 TYR 7 -7.258 11.076 17.271 77 HD1 TYR 7 HD1 TYR 7 -9.153 11.926 15.798 78 HD2 TYR 7 HD2 TYR 7 -7.908 7.796 15.812 79 HE1 TYR 7 HE1 TYR 7 -11.240 11.297 14.611 80 HE2 TYR 7 HE2 TYR 7 -10.009 7.159 14.656 81 HH TYR 7 HH TYR 7 -12.500 9.578 13.753 82 H GLU 8 H GLU 8 -5.432 8.394 15.545 83 HA GLU 8 HA GLU 8 -6.592 7.548 13.123 84 HB2 GLU 8 HB2 GLU 8 -4.692 6.737 11.856 85 HB3 GLU 8 HB3 GLU 8 -4.623 8.474 11.979 86 HG2 GLU 8 HG2 GLU 8 -2.952 8.134 13.938 87 HG3 GLU 8 HG3 GLU 8 -2.866 6.448 13.400 88 H SER 9 H SER 9 -7.265 5.552 13.564 89 HA SER 9 HA SER 9 -6.184 4.156 15.924 90 HB2 SER 9 HB2 SER 9 -8.754 3.937 14.344 91 HB3 SER 9 HB3 SER 9 -8.336 2.847 15.688 92 HG SER 9 HG SER 9 -9.585 4.632 16.407 93 H VAL 10 H VAL 10 -5.146 2.135 15.833 94 HA VAL 10 HA VAL 10 -4.311 1.202 13.238 95 HB VAL 10 HB VAL 10 -2.846 1.059 15.144 96 HG11 VAL 10 HG11 VAL 10 -3.035 -0.681 16.838 97 HG12 VAL 10 HG12 VAL 10 -4.447 0.382 16.923 98 HG13 VAL 10 HG13 VAL 10 -4.586 -1.222 16.172 99 HG21 VAL 10 HG21 VAL 10 -2.498 -0.399 13.173 100 HG22 VAL 10 HG22 VAL 10 -1.885 -1.109 14.676 101 HG23 VAL 10 HG23 VAL 10 -3.404 -1.697 13.985 102 H LEU 11 H LEU 11 -4.900 -0.357 11.947 103 HA LEU 11 HA LEU 11 -7.311 -2.016 12.598 104 HB2 LEU 11 HB2 LEU 11 -6.274 -1.025 9.911 105 HB3 LEU 11 HB3 LEU 11 -7.668 -2.067 10.156 106 HG LEU 11 HG LEU 11 -7.421 0.850 11.005 107 HD11 LEU 11 HD11 LEU 11 -7.727 0.506 8.602 108 HD12 LEU 11 HD12 LEU 11 -9.076 -0.614 8.900 109 HD13 LEU 11 HD13 LEU 11 -9.235 1.102 9.306 110 HD21 LEU 11 HD21 LEU 11 -9.841 0.649 11.587 111 HD22 LEU 11 HD22 LEU 11 -9.737 -1.113 11.363 112 HD23 LEU 11 HD23 LEU 11 -8.815 -0.302 12.657 113 H CYS 12 H CYS 12 -4.138 -2.025 10.908 114 HA CYS 12 HA CYS 12 -3.907 -4.940 11.300 115 HB2 CYS 12 HB2 CYS 12 -5.154 -4.562 9.162 116 HB3 CYS 12 HB3 CYS 12 -3.724 -3.739 8.517 117 HG CYS 12 HG CYS 12 -4.140 -6.284 7.695 118 H VAL 13 H VAL 13 -1.856 -5.782 11.097 119 HA VAL 13 HA VAL 13 0.398 -4.039 10.432 120 HB VAL 13 HB VAL 13 0.160 -3.739 12.842 121 HG11 VAL 13 HG11 VAL 13 0.684 -6.716 13.190 122 HG12 VAL 13 HG12 VAL 13 0.526 -5.494 14.464 123 HG13 VAL 13 HG13 VAL 13 -0.875 -5.909 13.471 124 HG21 VAL 13 HG21 VAL 13 2.615 -5.386 12.124 125 HG22 VAL 13 HG22 VAL 13 2.403 -3.629 11.912 126 HG23 VAL 13 HG23 VAL 13 2.428 -4.324 13.533 127 H LYS 14 H LYS 14 1.861 -5.105 9.267 128 HA LYS 14 HA LYS 14 1.900 -8.064 9.374 129 HB2 LYS 14 HB2 LYS 14 1.709 -6.483 6.800 130 HB3 LYS 14 HB3 LYS 14 2.426 -8.073 6.820 131 HG2 LYS 14 HG2 LYS 14 -0.383 -7.465 7.825 132 HG3 LYS 14 HG3 LYS 14 0.022 -8.017 6.198 133 HD2 LYS 14 HD2 LYS 14 1.030 -10.094 7.135 134 HD3 LYS 14 HD3 LYS 14 0.539 -9.592 8.773 135 HE2 LYS 14 HE2 LYS 14 -1.794 -9.515 8.105 136 HE3 LYS 14 HE3 LYS 14 -1.346 -9.888 6.428 137 HZ1 LYS 14 HZ1 LYS 14 -2.133 -11.849 7.506 138 HZ2 LYS 14 HZ2 LYS 14 -0.541 -12.045 7.176 139 HZ3 LYS 14 HZ3 LYS 14 -1.026 -11.736 8.726 140 HA PRO 15 HA PRO 15 5.886 -7.684 10.483 141 HB2 PRO 15 HB2 PRO 15 6.887 -10.214 10.155 142 HB3 PRO 15 HB3 PRO 15 5.533 -9.831 11.259 143 HG2 PRO 15 HG2 PRO 15 5.343 -10.883 8.401 144 HG3 PRO 15 HG3 PRO 15 4.525 -11.519 9.868 145 HD2 PRO 15 HD2 PRO 15 3.273 -9.839 8.195 146 HD3 PRO 15 HD3 PRO 15 3.067 -9.716 9.970 147 H ASP 16 H ASP 16 5.711 -8.811 7.119 148 HA ASP 16 HA ASP 16 8.336 -7.576 6.509 149 HB2 ASP 16 HB2 ASP 16 8.824 -9.897 7.144 150 HB3 ASP 16 HB3 ASP 16 7.637 -10.482 5.982 151 H VAL 17 H VAL 17 8.166 -6.395 4.712 152 HA VAL 17 HA VAL 17 6.331 -7.086 2.518 153 HB VAL 17 HB VAL 17 4.918 -5.854 4.148 154 HG11 VAL 17 HG11 VAL 17 5.188 -3.451 4.501 155 HG12 VAL 17 HG12 VAL 17 6.551 -4.357 5.173 156 HG13 VAL 17 HG13 VAL 17 6.732 -3.475 3.642 157 HG21 VAL 17 HG21 VAL 17 3.922 -4.331 2.579 158 HG22 VAL 17 HG22 VAL 17 5.410 -4.252 1.621 159 HG23 VAL 17 HG23 VAL 17 4.475 -5.765 1.706 160 H SER 18 H SER 18 6.924 -6.109 0.578 161 HA SER 18 HA SER 18 9.498 -4.592 0.573 162 HB2 SER 18 HB2 SER 18 8.544 -6.641 -1.451 163 HB3 SER 18 HB3 SER 18 10.100 -5.794 -1.400 164 HG SER 18 HG SER 18 10.128 -7.973 -0.522 165 H VAL 19 H VAL 19 9.768 -2.982 -0.937 166 HA VAL 19 HA VAL 19 7.291 -1.986 -2.305 167 HB VAL 19 HB VAL 19 9.321 -0.528 -0.635 168 HG11 VAL 19 HG11 VAL 19 7.307 0.644 -2.560 169 HG12 VAL 19 HG12 VAL 19 8.132 1.572 -1.296 170 HG13 VAL 19 HG13 VAL 19 9.074 0.872 -2.597 171 HG21 VAL 19 HG21 VAL 19 6.270 -0.634 -0.598 172 HG22 VAL 19 HG22 VAL 19 7.319 -1.573 0.478 173 HG23 VAL 19 HG23 VAL 19 7.314 0.182 0.578 174 H TYR 20 H TYR 20 7.424 -1.171 -4.232 175 HA TYR 20 HA TYR 20 10.077 -0.951 -5.608 176 HB2 TYR 20 HB2 TYR 20 7.512 -1.599 -7.072 177 HB3 TYR 20 HB3 TYR 20 9.169 -1.824 -7.583 178 HD1 TYR 20 HD1 TYR 20 10.514 -3.731 -6.504 179 HD2 TYR 20 HD2 TYR 20 6.268 -3.273 -5.990 180 HE1 TYR 20 HE1 TYR 20 10.344 -6.109 -5.738 181 HE2 TYR 20 HE2 TYR 20 6.088 -5.666 -5.333 182 HH TYR 20 HH TYR 20 8.947 -7.790 -5.029 183 H ARG 21 H ARG 21 10.298 1.393 -5.491 184 HA ARG 21 HA ARG 21 8.330 3.270 -6.445 185 HB2 ARG 21 HB2 ARG 21 11.368 3.216 -6.705 186 HB3 ARG 21 HB3 ARG 21 10.362 4.545 -7.293 187 HG2 ARG 21 HG2 ARG 21 9.478 4.928 -5.023 188 HG3 ARG 21 HG3 ARG 21 10.492 3.618 -4.385 189 HD2 ARG 21 HD2 ARG 21 12.524 4.841 -5.004 190 HD3 ARG 21 HD3 ARG 21 11.577 6.051 -5.859 191 HE ARG 21 HE ARG 21 10.871 7.023 -3.855 192 HH11 ARG 21 HH11 ARG 21 11.289 7.702 -1.810 193 HH12 ARG 21 HH12 ARG 21 12.315 6.766 -0.768 194 HH21 ARG 21 HH21 ARG 21 12.917 4.249 -3.037 195 HH22 ARG 21 HH22 ARG 21 13.221 4.887 -1.445 196 H ILE 22 H ILE 22 7.276 3.361 -8.311 197 HA ILE 22 HA ILE 22 8.219 1.657 -10.557 198 HB ILE 22 HB ILE 22 5.917 1.462 -11.273 199 HG12 ILE 22 HG12 ILE 22 5.286 3.265 -8.908 200 HG13 ILE 22 HG13 ILE 22 4.900 3.504 -10.617 201 HG21 ILE 22 HG21 ILE 22 6.168 0.756 -8.360 202 HG22 ILE 22 HG22 ILE 22 5.204 -0.057 -9.580 203 HG23 ILE 22 HG23 ILE 22 6.969 -0.136 -9.671 204 HD11 ILE 22 HD11 ILE 22 2.892 2.913 -9.488 205 HD12 ILE 22 HD12 ILE 22 3.364 1.507 -10.472 206 HD13 ILE 22 HD13 ILE 22 3.639 1.509 -8.711 207 HA PRO 23 HA PRO 23 8.422 5.198 -13.214 208 HB2 PRO 23 HB2 PRO 23 8.341 3.914 -15.710 209 HB3 PRO 23 HB3 PRO 23 9.767 4.275 -14.706 210 HG2 PRO 23 HG2 PRO 23 8.361 1.678 -15.075 211 HG3 PRO 23 HG3 PRO 23 10.047 1.994 -14.607 212 HD2 PRO 23 HD2 PRO 23 7.971 1.224 -12.867 213 HD3 PRO 23 HD3 PRO 23 9.528 1.949 -12.382 214 HA PRO 24 HA PRO 24 4.401 5.112 -15.684 215 HB2 PRO 24 HB2 PRO 24 2.557 3.115 -15.620 216 HB3 PRO 24 HB3 PRO 24 4.063 2.999 -16.584 217 HG2 PRO 24 HG2 PRO 24 3.565 1.908 -13.786 218 HG3 PRO 24 HG3 PRO 24 4.197 1.029 -15.219 219 HD2 PRO 24 HD2 PRO 24 5.856 2.096 -13.359 220 HD3 PRO 24 HD3 PRO 24 6.269 2.141 -15.099 221 H ARG 25 H ARG 25 2.276 5.863 -15.360 222 HA ARG 25 HA ARG 25 1.147 5.825 -12.575 223 HB2 ARG 25 HB2 ARG 25 0.226 8.019 -12.946 224 HB3 ARG 25 HB3 ARG 25 1.979 8.052 -13.122 225 HG2 ARG 25 HG2 ARG 25 1.799 8.156 -15.559 226 HG3 ARG 25 HG3 ARG 25 0.038 7.930 -15.484 227 HD2 ARG 25 HD2 ARG 25 -0.241 10.035 -14.309 228 HD3 ARG 25 HD3 ARG 25 1.522 10.279 -14.255 229 HE ARG 25 HE ARG 25 0.721 9.920 -16.971 230 HH11 ARG 25 HH11 ARG 25 0.573 11.621 -18.394 231 HH12 ARG 25 HH12 ARG 25 0.395 13.243 -17.796 232 HH21 ARG 25 HH21 ARG 25 0.425 12.365 -14.480 233 HH22 ARG 25 HH22 ARG 25 0.314 13.662 -15.638 234 H ALA 26 H ALA 26 0.379 5.341 -15.947 235 HA ALA 26 HA ALA 26 -2.126 4.022 -15.235 236 HB1 ALA 26 HB1 ALA 26 -2.768 6.403 -15.067 237 HB2 ALA 26 HB2 ALA 26 -2.158 6.704 -16.700 238 HB3 ALA 26 HB3 ALA 26 -3.560 5.622 -16.452 239 H SER 27 H SER 27 -1.613 2.275 -16.298 240 HA SER 27 HA SER 27 -1.366 2.378 -19.271 241 HB2 SER 27 HB2 SER 27 0.235 0.894 -18.167 242 HB3 SER 27 HB3 SER 27 -1.091 0.014 -17.383 243 HG SER 27 HG SER 27 -0.169 -0.801 -19.491 244 H ASN 28 H ASN 28 -2.785 0.964 -20.428 245 HA ASN 28 HA ASN 28 -5.528 1.446 -20.078 246 HB2 ASN 28 HB2 ASN 28 -5.770 0.161 -22.057 247 HB3 ASN 28 HB3 ASN 28 -4.208 0.951 -22.198 248 HD21 ASN 28 HD21 ASN 28 -2.491 -2.304 -21.724 249 HD22 ASN 28 HD22 ASN 28 -2.340 -0.734 -20.975 250 H ARG 29 H ARG 29 -3.649 -1.184 -18.729 251 HA ARG 29 HA ARG 29 -6.130 -2.558 -17.741 252 HB2 ARG 29 HB2 ARG 29 -3.267 -3.568 -17.574 253 HB3 ARG 29 HB3 ARG 29 -4.748 -4.474 -17.278 254 HG2 ARG 29 HG2 ARG 29 -3.686 -3.487 -19.933 255 HG3 ARG 29 HG3 ARG 29 -3.834 -5.151 -19.373 256 HD2 ARG 29 HD2 ARG 29 -6.451 -4.233 -19.184 257 HD3 ARG 29 HD3 ARG 29 -5.866 -3.349 -20.585 258 HE ARG 29 HE ARG 29 -6.161 -6.300 -20.226 259 HH11 ARG 29 HH11 ARG 29 -6.275 -7.620 -21.972 260 HH12 ARG 29 HH12 ARG 29 -5.935 -7.000 -23.561 261 HH21 ARG 29 HH21 ARG 29 -5.270 -3.792 -22.553 262 HH22 ARG 29 HH22 ARG 29 -5.395 -4.914 -23.881 263 H GLY 30 H GLY 30 -4.013 -0.264 -16.696 264 HA2 GLY 30 HA2 GLY 30 -4.476 0.610 -14.391 265 HA3 GLY 30 HA3 GLY 30 -4.211 -1.047 -13.805 266 H TYR 31 H TYR 31 -2.184 -1.628 -13.272 267 HA TYR 31 HA TYR 31 0.130 0.132 -14.076 268 HB2 TYR 31 HB2 TYR 31 -0.583 -1.122 -11.413 269 HB3 TYR 31 HB3 TYR 31 1.049 -0.617 -11.804 270 HD1 TYR 31 HD1 TYR 31 -2.332 0.552 -11.033 271 HD2 TYR 31 HD2 TYR 31 1.683 1.678 -12.125 272 HE1 TYR 31 HE1 TYR 31 -2.764 2.873 -10.202 273 HE2 TYR 31 HE2 TYR 31 1.284 3.978 -11.242 274 HH TYR 31 HH TYR 31 -1.856 4.942 -9.795 275 H ARG 32 H ARG 32 -0.923 -3.167 -13.471 276 HA ARG 32 HA ARG 32 0.048 -5.154 -13.309 277 HB2 ARG 32 HB2 ARG 32 1.676 -5.029 -15.719 278 HB3 ARG 32 HB3 ARG 32 0.299 -5.997 -15.251 279 HG2 ARG 32 HG2 ARG 32 -0.563 -5.044 -17.093 280 HG3 ARG 32 HG3 ARG 32 -1.116 -3.878 -15.916 281 HD2 ARG 32 HD2 ARG 32 -0.334 -2.538 -17.642 282 HD3 ARG 32 HD3 ARG 32 1.001 -2.517 -16.497 283 HE ARG 32 HE ARG 32 2.356 -3.420 -18.097 284 HH11 ARG 32 HH11 ARG 32 3.015 -4.008 -19.947 285 HH12 ARG 32 HH12 ARG 32 1.941 -4.702 -21.160 286 HH21 ARG 32 HH21 ARG 32 -0.873 -4.277 -19.192 287 HH22 ARG 32 HH22 ARG 32 -0.250 -4.834 -20.723 288 H ALA 33 H ALA 33 1.341 -5.614 -11.622 289 HA ALA 33 HA ALA 33 3.923 -4.643 -11.073 290 HB1 ALA 33 HB1 ALA 33 4.184 -6.743 -9.755 291 HB2 ALA 33 HB2 ALA 33 2.655 -5.924 -9.450 292 HB3 ALA 33 HB3 ALA 33 2.685 -7.368 -10.494 293 H SER 34 H SER 34 2.983 -7.287 -13.181 294 HA SER 34 HA SER 34 5.472 -8.359 -13.924 295 HB2 SER 34 HB2 SER 34 2.821 -8.072 -15.395 296 HB3 SER 34 HB3 SER 34 4.129 -9.195 -15.864 297 HG SER 34 HG SER 34 2.460 -10.129 -14.573 298 H ASP 35 H ASP 35 4.247 -5.196 -14.758 299 HA ASP 35 HA ASP 35 5.785 -4.927 -17.247 300 HB2 ASP 35 HB2 ASP 35 3.494 -3.873 -16.584 301 HB3 ASP 35 HB3 ASP 35 4.453 -2.700 -15.693 302 H TRP 36 H TRP 36 6.119 -4.088 -13.852 303 HA TRP 36 HA TRP 36 8.744 -2.751 -14.328 304 HB2 TRP 36 HB2 TRP 36 8.134 -1.683 -11.981 305 HB3 TRP 36 HB3 TRP 36 7.656 -1.031 -13.516 306 HD1 TRP 36 HD1 TRP 36 5.225 -0.859 -14.130 307 HE1 TRP 36 HE1 TRP 36 3.013 -1.163 -12.904 308 HE3 TRP 36 HE3 TRP 36 6.941 -3.249 -9.932 309 HZ2 TRP 36 HZ2 TRP 36 2.163 -1.892 -10.227 310 HZ3 TRP 36 HZ3 TRP 36 5.385 -3.774 -8.080 311 HH2 TRP 36 HH2 TRP 36 3.004 -3.066 -8.187 312 H LYS 37 H LYS 37 9.307 -2.867 -11.398 313 HA LYS 37 HA LYS 37 10.587 -5.509 -11.269 314 HB2 LYS 37 HB2 LYS 37 10.239 -3.360 -9.114 315 HB3 LYS 37 HB3 LYS 37 11.304 -4.753 -9.042 316 HG2 LYS 37 HG2 LYS 37 11.583 -2.276 -10.773 317 HG3 LYS 37 HG3 LYS 37 12.623 -2.840 -9.473 318 HD2 LYS 37 HD2 LYS 37 12.931 -4.955 -11.130 319 HD3 LYS 37 HD3 LYS 37 12.452 -3.759 -12.336 320 HE2 LYS 37 HE2 LYS 37 14.246 -2.232 -11.511 321 HE3 LYS 37 HE3 LYS 37 14.699 -3.434 -10.289 322 HZ1 LYS 37 HZ1 LYS 37 14.839 -3.932 -13.216 323 HZ2 LYS 37 HZ2 LYS 37 16.117 -3.514 -12.291 324 HZ3 LYS 37 HZ3 LYS 37 15.372 -4.938 -12.026 325 H LEU 38 H LEU 38 9.216 -6.949 -11.480 326 HA LEU 38 HA LEU 38 7.009 -7.530 -9.740 327 HB2 LEU 38 HB2 LEU 38 7.273 -8.277 -12.090 328 HB3 LEU 38 HB3 LEU 38 8.785 -9.092 -11.680 329 HG LEU 38 HG LEU 38 7.559 -10.581 -10.185 330 HD11 LEU 38 HD11 LEU 38 5.070 -9.394 -11.537 331 HD12 LEU 38 HD12 LEU 38 5.084 -10.808 -10.461 332 HD13 LEU 38 HD13 LEU 38 5.490 -9.216 -9.821 333 HD21 LEU 38 HD21 LEU 38 6.625 -10.584 -13.080 334 HD22 LEU 38 HD22 LEU 38 8.146 -11.264 -12.473 335 HD23 LEU 38 HD23 LEU 38 6.602 -11.989 -11.989 336 H ASP 39 H ASP 39 10.464 -8.291 -9.636 337 HA ASP 39 HA ASP 39 10.160 -9.764 -7.057 338 HB2 ASP 39 HB2 ASP 39 11.588 -11.465 -7.918 339 HB3 ASP 39 HB3 ASP 39 10.329 -11.201 -9.115 340 H GLN 40 H GLN 40 11.398 -6.963 -8.005 341 HA GLN 40 HA GLN 40 14.092 -7.242 -6.669 342 HB2 GLN 40 HB2 GLN 40 13.316 -5.954 -9.269 343 HB3 GLN 40 HB3 GLN 40 14.839 -5.589 -8.455 344 HG2 GLN 40 HG2 GLN 40 15.698 -7.761 -8.787 345 HG3 GLN 40 HG3 GLN 40 14.114 -8.456 -9.102 346 HE21 GLN 40 HE21 GLN 40 14.292 -7.897 -12.581 347 HE22 GLN 40 HE22 GLN 40 13.446 -8.667 -11.234 348 HA PRO 41 HA PRO 41 11.661 -3.888 -4.603 349 HB2 PRO 41 HB2 PRO 41 13.347 -4.731 -2.267 350 HB3 PRO 41 HB3 PRO 41 11.598 -4.359 -2.334 351 HG2 PRO 41 HG2 PRO 41 12.450 -6.935 -2.214 352 HG3 PRO 41 HG3 PRO 41 11.118 -6.489 -3.335 353 HD2 PRO 41 HD2 PRO 41 14.063 -6.824 -3.976 354 HD3 PRO 41 HD3 PRO 41 12.638 -7.502 -4.814 355 H ASP 42 H ASP 42 12.106 -1.875 -3.881 356 HA ASP 42 HA ASP 42 14.897 -0.833 -4.075 357 HB2 ASP 42 HB2 ASP 42 13.148 0.175 -5.533 358 HB3 ASP 42 HB3 ASP 42 12.195 0.574 -4.103 359 H TRP 43 H TRP 43 12.274 -1.449 -1.867 360 HA TRP 43 HA TRP 43 14.007 -0.944 0.448 361 HB2 TRP 43 HB2 TRP 43 12.902 1.217 0.216 362 HB3 TRP 43 HB3 TRP 43 11.339 0.454 -0.000 363 HD1 TRP 43 HD1 TRP 43 13.732 1.626 2.650 364 HE1 TRP 43 HE1 TRP 43 12.607 1.533 4.955 365 HE3 TRP 43 HE3 TRP 43 9.561 -1.087 1.431 366 HZ2 TRP 43 HZ2 TRP 43 10.119 0.595 6.067 367 HZ3 TRP 43 HZ3 TRP 43 7.829 -1.581 3.137 368 HH2 TRP 43 HH2 TRP 43 8.078 -0.708 5.451 369 H THR 44 H THR 44 13.365 -2.280 2.267 370 HA THR 44 HA THR 44 10.714 -3.495 2.185 371 HB THR 44 HB THR 44 11.275 -5.656 2.576 372 HG1 THR 44 HG1 THR 44 14.017 -5.043 2.853 373 HG21 THR 44 HG21 THR 44 11.736 -5.190 0.219 374 HG22 THR 44 HG22 THR 44 13.459 -4.977 0.590 375 HG23 THR 44 HG23 THR 44 12.661 -6.552 0.854 376 H GLY 45 H GLY 45 9.918 -4.182 4.151 377 HA2 GLY 45 HA2 GLY 45 11.184 -3.626 6.684 378 HA3 GLY 45 HA3 GLY 45 10.253 -2.249 6.138 379 H ARG 46 H ARG 46 8.582 -2.245 7.345 380 HA ARG 46 HA ARG 46 6.879 -4.657 7.871 381 HB2 ARG 46 HB2 ARG 46 8.293 -3.973 9.777 382 HB3 ARG 46 HB3 ARG 46 7.686 -2.331 9.666 383 HG2 ARG 46 HG2 ARG 46 5.369 -3.242 10.267 384 HG3 ARG 46 HG3 ARG 46 6.163 -4.811 10.539 385 HD2 ARG 46 HD2 ARG 46 7.776 -3.524 12.089 386 HD3 ARG 46 HD3 ARG 46 6.674 -2.159 11.960 387 HE ARG 46 HE ARG 46 6.048 -4.850 13.136 388 HH11 ARG 46 HH11 ARG 46 4.989 -4.890 15.053 389 HH12 ARG 46 HH12 ARG 46 4.225 -3.455 15.664 390 HH21 ARG 46 HH21 ARG 46 5.126 -1.412 13.056 391 HH22 ARG 46 HH22 ARG 46 4.360 -1.557 14.610 392 H LEU 47 H LEU 47 4.644 -4.312 7.917 393 HA LEU 47 HA LEU 47 3.622 -1.739 6.743 394 HB2 LEU 47 HB2 LEU 47 3.114 -3.862 5.486 395 HB3 LEU 47 HB3 LEU 47 2.418 -4.501 6.963 396 HG LEU 47 HG LEU 47 0.811 -2.367 6.800 397 HD11 LEU 47 HD11 LEU 47 1.981 -1.343 4.895 398 HD12 LEU 47 HD12 LEU 47 1.622 -2.776 3.904 399 HD13 LEU 47 HD13 LEU 47 0.303 -1.750 4.515 400 HD21 LEU 47 HD21 LEU 47 0.049 -4.660 6.782 401 HD22 LEU 47 HD22 LEU 47 -0.792 -3.719 5.555 402 HD23 LEU 47 HD23 LEU 47 0.510 -4.830 5.078 403 H ARG 48 H ARG 48 2.322 -0.468 7.989 404 HA ARG 48 HA ARG 48 0.531 -1.872 9.859 405 HB2 ARG 48 HB2 ARG 48 2.265 -0.884 11.290 406 HB3 ARG 48 HB3 ARG 48 1.895 0.721 10.649 407 HG2 ARG 48 HG2 ARG 48 -0.301 0.705 11.657 408 HG3 ARG 48 HG3 ARG 48 -0.207 -1.031 11.992 409 HD2 ARG 48 HD2 ARG 48 0.121 0.280 14.034 410 HD3 ARG 48 HD3 ARG 48 1.511 -0.726 13.639 411 HE ARG 48 HE ARG 48 2.707 1.256 12.815 412 HH11 ARG 48 HH11 ARG 48 3.375 3.135 13.125 413 HH12 ARG 48 HH12 ARG 48 2.524 4.322 14.125 414 HH21 ARG 48 HH21 ARG 48 -0.074 2.121 14.797 415 HH22 ARG 48 HH22 ARG 48 0.551 3.729 15.043 416 H ILE 49 H ILE 49 -1.537 -1.170 9.810 417 HA ILE 49 HA ILE 49 -2.234 1.054 7.918 418 HB ILE 49 HB ILE 49 -3.600 -1.624 8.289 419 HG12 ILE 49 HG12 ILE 49 -2.149 -0.304 5.948 420 HG13 ILE 49 HG13 ILE 49 -1.664 -1.758 6.821 421 HG21 ILE 49 HG21 ILE 49 -4.514 0.667 6.513 422 HG22 ILE 49 HG22 ILE 49 -5.302 -0.916 6.743 423 HG23 ILE 49 HG23 ILE 49 -5.273 0.221 8.072 424 HD11 ILE 49 HD11 ILE 49 -2.557 -2.416 4.710 425 HD12 ILE 49 HD12 ILE 49 -3.730 -2.912 5.944 426 HD13 ILE 49 HD13 ILE 49 -4.022 -1.472 4.921 427 H THR 50 H THR 50 -3.277 2.628 8.813 428 HA THR 50 HA THR 50 -4.782 2.247 11.365 429 HB THR 50 HB THR 50 -4.106 4.627 11.870 430 HG1 THR 50 HG1 THR 50 -2.515 5.549 10.647 431 HG21 THR 50 HG21 THR 50 -2.869 2.851 13.010 432 HG22 THR 50 HG22 THR 50 -1.792 2.661 11.605 433 HG23 THR 50 HG23 THR 50 -1.775 4.160 12.555 434 H SER 51 H SER 51 -6.487 4.001 11.684 435 HA SER 51 HA SER 51 -7.342 5.403 9.249 436 HB2 SER 51 HB2 SER 51 -9.637 4.584 9.370 437 HB3 SER 51 HB3 SER 51 -8.497 3.284 9.004 438 HG SER 51 HG SER 51 -9.475 3.865 11.627 439 H LYS 52 H LYS 52 -7.993 7.318 9.633 440 HA LYS 52 HA LYS 52 -9.274 8.104 12.222 441 HB2 LYS 52 HB2 LYS 52 -7.166 9.289 11.525 442 HB3 LYS 52 HB3 LYS 52 -8.024 9.853 10.087 443 HG2 LYS 52 HG2 LYS 52 -9.787 10.697 11.942 444 HG3 LYS 52 HG3 LYS 52 -8.349 10.646 12.963 445 HD2 LYS 52 HD2 LYS 52 -8.705 12.108 10.330 446 HD3 LYS 52 HD3 LYS 52 -8.667 12.851 11.952 447 HE2 LYS 52 HE2 LYS 52 -6.325 12.382 12.191 448 HE3 LYS 52 HE3 LYS 52 -6.319 11.332 10.771 449 HZ1 LYS 52 HZ1 LYS 52 -5.403 13.489 10.220 450 HZ2 LYS 52 HZ2 LYS 52 -6.801 13.292 9.402 451 HZ3 LYS 52 HZ3 LYS 52 -6.740 14.285 10.709 452 H GLY 53 H GLY 53 -11.262 7.273 11.741 453 HA2 GLY 53 HA2 GLY 53 -13.484 7.388 11.062 454 HA3 GLY 53 HA3 GLY 53 -13.110 8.899 10.237 455 H LYS 54 H LYS 54 -13.930 8.655 8.238 456 HA LYS 54 HA LYS 54 -13.834 6.197 6.662 457 HB2 LYS 54 HB2 LYS 54 -15.725 7.863 6.737 458 HB3 LYS 54 HB3 LYS 54 -14.715 9.014 5.879 459 HG2 LYS 54 HG2 LYS 54 -15.003 6.373 4.520 460 HG3 LYS 54 HG3 LYS 54 -16.527 7.205 4.814 461 HD2 LYS 54 HD2 LYS 54 -15.702 9.238 3.668 462 HD3 LYS 54 HD3 LYS 54 -14.181 8.418 3.310 463 HE2 LYS 54 HE2 LYS 54 -15.642 6.593 2.181 464 HE3 LYS 54 HE3 LYS 54 -16.960 7.777 2.261 465 HZ1 LYS 54 HZ1 LYS 54 -15.784 7.980 0.151 466 HZ2 LYS 54 HZ2 LYS 54 -15.449 9.322 1.023 467 HZ3 LYS 54 HZ3 LYS 54 -14.333 8.123 0.892 468 H THR 55 H THR 55 -11.296 7.401 7.478 469 HA THR 55 HA THR 55 -9.949 7.352 4.810 470 HB THR 55 HB THR 55 -9.097 9.128 7.137 471 HG1 THR 55 HG1 THR 55 -10.073 10.835 6.067 472 HG21 THR 55 HG21 THR 55 -8.621 9.191 4.119 473 HG22 THR 55 HG22 THR 55 -7.873 10.288 5.311 474 HG23 THR 55 HG23 THR 55 -7.461 8.560 5.309 475 H ALA 56 H ALA 56 -8.619 5.690 4.775 476 HA ALA 56 HA ALA 56 -7.330 4.725 7.277 477 HB1 ALA 56 HB1 ALA 56 -7.875 3.315 4.664 478 HB2 ALA 56 HB2 ALA 56 -6.673 2.738 5.843 479 HB3 ALA 56 HB3 ALA 56 -8.371 2.878 6.299 480 H TYR 57 H TYR 57 -5.000 4.294 7.168 481 HA TYR 57 HA TYR 57 -3.521 5.964 5.204 482 HB2 TYR 57 HB2 TYR 57 -3.178 6.004 8.216 483 HB3 TYR 57 HB3 TYR 57 -2.088 6.747 7.065 484 HD1 TYR 57 HD1 TYR 57 -2.463 8.976 6.332 485 HD2 TYR 57 HD2 TYR 57 -5.601 6.858 8.398 486 HE1 TYR 57 HE1 TYR 57 -3.796 11.075 6.478 487 HE2 TYR 57 HE2 TYR 57 -6.955 8.918 8.464 488 HH TYR 57 HH TYR 57 -5.763 12.035 7.142 489 H ILE 58 H ILE 58 -2.176 4.641 4.207 490 HA ILE 58 HA ILE 58 -1.323 2.089 5.448 491 HB ILE 58 HB ILE 58 -0.290 3.246 2.854 492 HG12 ILE 58 HG12 ILE 58 -2.674 3.263 2.507 493 HG13 ILE 58 HG13 ILE 58 -1.936 1.970 1.591 494 HG21 ILE 58 HG21 ILE 58 -0.455 0.446 3.995 495 HG22 ILE 58 HG22 ILE 58 0.130 0.858 2.364 496 HG23 ILE 58 HG23 ILE 58 1.001 1.431 3.782 497 HD11 ILE 58 HD11 ILE 58 -2.734 0.312 3.249 498 HD12 ILE 58 HD12 ILE 58 -3.464 1.625 4.206 499 HD13 ILE 58 HD13 ILE 58 -4.052 1.285 2.567 500 H LYS 59 H LYS 59 0.238 2.232 6.928 501 HA LYS 59 HA LYS 59 2.426 4.254 6.704 502 HB2 LYS 59 HB2 LYS 59 1.980 2.437 9.070 503 HB3 LYS 59 HB3 LYS 59 2.769 3.998 9.035 504 HG2 LYS 59 HG2 LYS 59 -0.238 3.560 8.680 505 HG3 LYS 59 HG3 LYS 59 0.525 3.853 10.216 506 HD2 LYS 59 HD2 LYS 59 0.898 5.870 7.984 507 HD3 LYS 59 HD3 LYS 59 -0.622 5.782 8.886 508 HE2 LYS 59 HE2 LYS 59 0.724 5.875 11.032 509 HE3 LYS 59 HE3 LYS 59 2.143 6.305 10.042 510 HZ1 LYS 59 HZ1 LYS 59 0.989 8.275 10.871 511 HZ2 LYS 59 HZ2 LYS 59 0.778 8.229 9.242 512 HZ3 LYS 59 HZ3 LYS 59 -0.429 7.755 10.278 513 H LEU 60 H LEU 60 4.439 3.617 6.092 514 HA LEU 60 HA LEU 60 5.115 0.695 6.186 515 HB2 LEU 60 HB2 LEU 60 5.970 2.865 4.246 516 HB3 LEU 60 HB3 LEU 60 6.686 1.254 4.327 517 HG LEU 60 HG LEU 60 3.708 1.657 3.823 518 HD11 LEU 60 HD11 LEU 60 4.871 2.800 2.045 519 HD12 LEU 60 HD12 LEU 60 5.999 1.447 1.844 520 HD13 LEU 60 HD13 LEU 60 4.282 1.251 1.423 521 HD21 LEU 60 HD21 LEU 60 5.601 -0.670 3.258 522 HD22 LEU 60 HD22 LEU 60 4.406 -0.616 4.571 523 HD23 LEU 60 HD23 LEU 60 3.864 -0.616 2.889 524 H GLU 61 H GLU 61 6.745 0.107 7.394 525 HA GLU 61 HA GLU 61 8.185 2.223 8.941 526 HB2 GLU 61 HB2 GLU 61 6.853 -0.300 9.967 527 HB3 GLU 61 HB3 GLU 61 7.644 0.948 10.929 528 HG2 GLU 61 HG2 GLU 61 5.893 2.578 10.151 529 HG3 GLU 61 HG3 GLU 61 5.056 1.241 9.342 530 H ASP 62 H ASP 62 10.205 1.580 10.010 531 HA ASP 62 HA ASP 62 11.811 -0.213 8.479 532 HB2 ASP 62 HB2 ASP 62 12.696 1.806 9.474 533 HB3 ASP 62 HB3 ASP 62 12.205 1.288 11.090 534 H LYS 63 H LYS 63 12.499 -2.250 8.876 535 HA LYS 63 HA LYS 63 10.770 -3.982 10.341 536 HB2 LYS 63 HB2 LYS 63 12.552 -4.229 8.231 537 HB3 LYS 63 HB3 LYS 63 13.408 -5.090 9.494 538 HG2 LYS 63 HG2 LYS 63 11.424 -6.525 9.886 539 HG3 LYS 63 HG3 LYS 63 10.511 -5.626 8.673 540 HD2 LYS 63 HD2 LYS 63 13.006 -7.297 8.137 541 HD3 LYS 63 HD3 LYS 63 11.334 -7.782 7.808 542 HE2 LYS 63 HE2 LYS 63 11.092 -5.849 6.253 543 HE3 LYS 63 HE3 LYS 63 12.798 -5.436 6.517 544 HZ1 LYS 63 HZ1 LYS 63 11.705 -7.853 5.215 545 HZ2 LYS 63 HZ2 LYS 63 12.671 -6.706 4.543 546 HZ3 LYS 63 HZ3 LYS 63 13.292 -7.737 5.652 547 H VAL 64 H VAL 64 13.268 -2.169 11.609 548 HA VAL 64 HA VAL 64 13.915 -4.101 13.797 549 HB VAL 64 HB VAL 64 15.651 -1.737 13.061 550 HG11 VAL 64 HG11 VAL 64 16.261 -4.495 14.194 551 HG12 VAL 64 HG12 VAL 64 17.423 -3.170 13.955 552 HG13 VAL 64 HG13 VAL 64 16.115 -2.988 15.129 553 HG21 VAL 64 HG21 VAL 64 15.447 -2.820 10.906 554 HG22 VAL 64 HG22 VAL 64 17.025 -3.200 11.593 555 HG23 VAL 64 HG23 VAL 64 15.731 -4.424 11.634 556 H SER 65 H SER 65 13.191 -0.692 13.044 557 HA SER 65 HA SER 65 12.770 -0.221 15.972 558 HB2 SER 65 HB2 SER 65 13.964 1.619 13.870 559 HB3 SER 65 HB3 SER 65 13.659 2.060 15.562 560 HG SER 65 HG SER 65 15.828 1.373 15.201 561 H GLY 66 H GLY 66 10.981 -0.343 13.144 562 HA2 GLY 66 HA2 GLY 66 8.844 0.304 12.688 563 HA3 GLY 66 HA3 GLY 66 8.708 0.936 14.329 564 H GLU 67 H GLU 67 11.283 2.366 12.524 565 HA GLU 67 HA GLU 67 10.067 4.989 12.640 566 HB2 GLU 67 HB2 GLU 67 12.616 4.053 11.261 567 HB3 GLU 67 HB3 GLU 67 12.124 5.737 11.491 568 HG2 GLU 67 HG2 GLU 67 12.112 5.352 13.977 569 HG3 GLU 67 HG3 GLU 67 12.752 3.730 13.698 570 H LEU 68 H LEU 68 9.242 6.316 10.983 571 HA LEU 68 HA LEU 68 7.877 4.802 8.972 572 HB2 LEU 68 HB2 LEU 68 7.000 6.808 10.302 573 HB3 LEU 68 HB3 LEU 68 7.960 7.822 9.228 574 HG LEU 68 HG LEU 68 6.666 6.676 7.278 575 HD11 LEU 68 HD11 LEU 68 4.434 5.811 7.864 576 HD12 LEU 68 HD12 LEU 68 5.676 4.809 8.617 577 HD13 LEU 68 HD13 LEU 68 4.793 5.992 9.597 578 HD21 LEU 68 HD21 LEU 68 6.275 8.998 7.992 579 HD22 LEU 68 HD22 LEU 68 4.764 8.203 7.533 580 HD23 LEU 68 HD23 LEU 68 5.154 8.435 9.253 581 H PHE 69 H PHE 69 8.458 4.288 7.029 582 HA PHE 69 HA PHE 69 10.629 5.595 5.475 583 HB2 PHE 69 HB2 PHE 69 10.658 3.251 5.400 584 HB3 PHE 69 HB3 PHE 69 8.915 3.125 5.232 585 HD1 PHE 69 HD1 PHE 69 11.633 4.926 3.303 586 HD2 PHE 69 HD2 PHE 69 8.264 2.245 3.209 587 HE1 PHE 69 HE1 PHE 69 11.818 4.775 0.855 588 HE2 PHE 69 HE2 PHE 69 8.499 2.019 0.768 589 HZ PHE 69 HZ PHE 69 10.231 3.322 -0.456 590 H ALA 70 H ALA 70 7.118 4.934 5.141 591 HA ALA 70 HA ALA 70 6.655 7.486 3.788 592 HB1 ALA 70 HB1 ALA 70 6.167 4.831 2.345 593 HB2 ALA 70 HB2 ALA 70 5.656 6.430 1.776 594 HB3 ALA 70 HB3 ALA 70 7.382 6.048 1.893 595 H GLN 71 H GLN 71 4.337 7.874 3.443 596 HA GLN 71 HA GLN 71 2.525 5.856 4.460 597 HB2 GLN 71 HB2 GLN 71 1.205 7.362 5.884 598 HB3 GLN 71 HB3 GLN 71 2.825 7.088 6.501 599 HG2 GLN 71 HG2 GLN 71 3.560 9.292 5.534 600 HG3 GLN 71 HG3 GLN 71 1.911 9.585 4.978 601 HE21 GLN 71 HE21 GLN 71 2.488 11.273 8.307 602 HE22 GLN 71 HE22 GLN 71 3.363 11.319 6.785 603 H ALA 72 H ALA 72 0.497 5.868 3.574 604 HA ALA 72 HA ALA 72 -0.054 7.863 1.405 605 HB1 ALA 72 HB1 ALA 72 -0.600 4.882 1.449 606 HB2 ALA 72 HB2 ALA 72 -1.190 6.002 0.225 607 HB3 ALA 72 HB3 ALA 72 0.552 5.760 0.409 608 HA PRO 73 HA PRO 73 -3.934 8.076 3.907 609 HB2 PRO 73 HB2 PRO 73 -4.346 10.549 2.268 610 HB3 PRO 73 HB3 PRO 73 -4.487 10.326 4.032 611 HG2 PRO 73 HG2 PRO 73 -2.360 11.639 2.941 612 HG3 PRO 73 HG3 PRO 73 -2.126 10.516 4.319 613 HD2 PRO 73 HD2 PRO 73 -1.727 9.950 1.360 614 HD3 PRO 73 HD3 PRO 73 -0.627 9.609 2.734 615 H VAL 74 H VAL 74 -5.703 6.938 3.240 616 HA VAL 74 HA VAL 74 -6.602 7.114 0.408 617 HB VAL 74 HB VAL 74 -7.055 4.913 0.193 618 HG11 VAL 74 HG11 VAL 74 -4.508 4.793 1.873 619 HG12 VAL 74 HG12 VAL 74 -4.992 3.638 0.625 620 HG13 VAL 74 HG13 VAL 74 -4.567 5.286 0.182 621 HG21 VAL 74 HG21 VAL 74 -6.570 4.239 3.078 622 HG22 VAL 74 HG22 VAL 74 -8.154 4.304 2.259 623 HG23 VAL 74 HG23 VAL 74 -6.973 3.105 1.759 624 H GLU 75 H GLU 75 -8.689 7.626 0.078 625 HA GLU 75 HA GLU 75 -10.516 7.680 2.442 626 HB2 GLU 75 HB2 GLU 75 -9.484 9.875 1.443 627 HB3 GLU 75 HB3 GLU 75 -10.657 9.640 0.145 628 HG2 GLU 75 HG2 GLU 75 -12.474 9.613 1.935 629 HG3 GLU 75 HG3 GLU 75 -11.229 9.962 3.126 630 H GLN 76 H GLN 76 -10.056 5.901 -0.150 631 HA GLN 76 HA GLN 76 -12.720 4.938 -0.248 632 HB2 GLN 76 HB2 GLN 76 -13.236 5.229 -2.550 633 HB3 GLN 76 HB3 GLN 76 -12.881 6.822 -1.914 634 HG2 GLN 76 HG2 GLN 76 -11.054 5.126 -3.662 635 HG3 GLN 76 HG3 GLN 76 -12.005 6.498 -4.179 636 HE21 GLN 76 HE21 GLN 76 -8.377 7.154 -2.453 637 HE22 GLN 76 HE22 GLN 76 -9.097 5.534 -2.368 638 H TYR 77 H TYR 77 -12.746 2.801 -1.024 639 HA TYR 77 HA TYR 77 -10.260 1.724 -2.174 640 HB2 TYR 77 HB2 TYR 77 -10.297 1.281 0.272 641 HB3 TYR 77 HB3 TYR 77 -11.765 0.308 0.054 642 HD1 TYR 77 HD1 TYR 77 -8.502 0.728 -1.627 643 HD2 TYR 77 HD2 TYR 77 -11.110 -2.052 0.303 644 HE1 TYR 77 HE1 TYR 77 -6.966 -1.070 -2.255 645 HE2 TYR 77 HE2 TYR 77 -9.554 -3.895 -0.288 646 HH TYR 77 HH TYR 77 -6.604 -3.373 -2.232 647 HA PRO 78 HA PRO 78 -9.492 0.481 -3.780 648 HB2 PRO 78 HB2 PRO 78 -9.602 0.193 -6.465 649 HB3 PRO 78 HB3 PRO 78 -9.744 -1.196 -5.345 650 HG2 PRO 78 HG2 PRO 78 -12.000 0.362 -6.662 651 HG3 PRO 78 HG3 PRO 78 -11.755 -1.415 -6.640 652 HD2 PRO 78 HD2 PRO 78 -13.393 -0.179 -4.855 653 HD3 PRO 78 HD3 PRO 78 -12.380 -1.567 -4.365 654 H GLY 79 H GLY 79 -8.272 2.126 -5.045 655 HA2 GLY 79 HA2 GLY 79 -9.679 4.349 -6.328 656 HA3 GLY 79 HA3 GLY 79 -9.037 4.752 -4.738 657 H ILE 80 H ILE 80 -7.708 6.344 -5.773 658 HA ILE 80 HA ILE 80 -5.526 5.473 -7.559 659 HB ILE 80 HB ILE 80 -6.536 7.687 -7.892 660 HG12 ILE 80 HG12 ILE 80 -4.561 9.074 -8.053 661 HG13 ILE 80 HG13 ILE 80 -3.684 8.085 -6.893 662 HG21 ILE 80 HG21 ILE 80 -7.088 8.273 -5.512 663 HG22 ILE 80 HG22 ILE 80 -5.346 8.505 -5.194 664 HG23 ILE 80 HG23 ILE 80 -6.190 9.546 -6.343 665 HD11 ILE 80 HD11 ILE 80 -4.615 7.124 -9.628 666 HD12 ILE 80 HD12 ILE 80 -2.980 7.707 -9.232 667 HD13 ILE 80 HD13 ILE 80 -3.585 6.227 -8.481 668 H ALA 81 H ALA 81 -6.112 6.114 -4.153 669 HA ALA 81 HA ALA 81 -3.286 6.144 -3.546 670 HB1 ALA 81 HB1 ALA 81 -5.676 6.236 -1.652 671 HB2 ALA 81 HB2 ALA 81 -3.974 6.680 -1.308 672 HB3 ALA 81 HB3 ALA 81 -4.946 7.661 -2.424 673 H VAL 82 H VAL 82 -5.567 3.628 -3.830 674 HA VAL 82 HA VAL 82 -3.429 1.737 -3.276 675 HB VAL 82 HB VAL 82 -4.214 1.906 -1.070 676 HG11 VAL 82 HG11 VAL 82 -6.610 1.352 -0.493 677 HG12 VAL 82 HG12 VAL 82 -6.231 2.964 -1.092 678 HG13 VAL 82 HG13 VAL 82 -6.952 1.833 -2.188 679 HG21 VAL 82 HG21 VAL 82 -3.503 -0.192 -1.674 680 HG22 VAL 82 HG22 VAL 82 -4.975 -0.438 -0.724 681 HG23 VAL 82 HG23 VAL 82 -4.983 -0.619 -2.497 682 H GLU 83 H GLU 83 -3.457 0.587 -5.035 683 HA GLU 83 HA GLU 83 -6.003 -0.349 -6.312 684 HB2 GLU 83 HB2 GLU 83 -4.268 1.615 -7.342 685 HB3 GLU 83 HB3 GLU 83 -3.732 0.144 -8.143 686 HG2 GLU 83 HG2 GLU 83 -6.610 1.157 -8.093 687 HG3 GLU 83 HG3 GLU 83 -5.451 1.491 -9.377 688 H THR 84 H THR 84 -5.840 -2.318 -7.523 689 HA THR 84 HA THR 84 -3.551 -4.081 -6.681 690 HB THR 84 HB THR 84 -6.148 -5.115 -7.687 691 HG1 THR 84 HG1 THR 84 -6.650 -3.945 -5.803 692 HG21 THR 84 HG21 THR 84 -4.240 -6.617 -7.667 693 HG22 THR 84 HG22 THR 84 -3.926 -6.230 -5.958 694 HG23 THR 84 HG23 THR 84 -5.402 -7.109 -6.417 695 H VAL 85 H VAL 85 -2.502 -3.005 -8.255 696 HA VAL 85 HA VAL 85 -1.445 -2.863 -10.346 697 HB VAL 85 HB VAL 85 -0.519 -5.261 -10.686 698 HG11 VAL 85 HG11 VAL 85 0.623 -3.368 -9.595 699 HG12 VAL 85 HG12 VAL 85 -0.222 -3.707 -8.070 700 HG13 VAL 85 HG13 VAL 85 0.949 -4.858 -8.718 701 HG21 VAL 85 HG21 VAL 85 -2.365 -6.434 -9.354 702 HG22 VAL 85 HG22 VAL 85 -0.704 -6.799 -8.885 703 HG23 VAL 85 HG23 VAL 85 -1.677 -5.685 -7.912 704 H THR 86 H THR 86 -3.162 -5.894 -10.861 705 HA THR 86 HA THR 86 -4.695 -4.676 -12.984 706 HB THR 86 HB THR 86 -4.588 -6.791 -14.408 707 HG1 THR 86 HG1 THR 86 -2.795 -8.048 -14.205 708 HG21 THR 86 HG21 THR 86 -3.483 -4.588 -14.981 709 HG22 THR 86 HG22 THR 86 -2.022 -5.198 -14.198 710 HG23 THR 86 HG23 THR 86 -2.646 -6.015 -15.656 711 H ASP 87 H ASP 87 -4.033 -7.685 -11.215 712 HA ASP 87 HA ASP 87 -6.854 -7.752 -10.300 713 HB2 ASP 87 HB2 ASP 87 -6.903 -8.845 -12.538 714 HB3 ASP 87 HB3 ASP 87 -5.652 -9.948 -11.971 715 H SER 88 H SER 88 -4.204 -10.175 -10.518 716 HA SER 88 HA SER 88 -4.647 -11.427 -8.151 717 HB2 SER 88 HB2 SER 88 -2.840 -11.846 -9.915 718 HB3 SER 88 HB3 SER 88 -1.756 -10.941 -8.856 719 HG SER 88 HG SER 88 -2.090 -13.346 -8.619 720 H SER 89 H SER 89 -4.748 -10.937 -6.164 721 HA SER 89 HA SER 89 -3.627 -8.496 -5.026 722 HB2 SER 89 HB2 SER 89 -5.870 -9.084 -4.776 723 HB3 SER 89 HB3 SER 89 -5.475 -10.667 -4.080 724 HG SER 89 HG SER 89 -4.454 -9.511 -2.336 725 H ARG 90 H ARG 90 -1.630 -9.976 -5.834 726 HA ARG 90 HA ARG 90 -0.133 -10.963 -3.435 727 HB2 ARG 90 HB2 ARG 90 -0.193 -12.277 -5.601 728 HB3 ARG 90 HB3 ARG 90 0.618 -10.935 -6.398 729 HG2 ARG 90 HG2 ARG 90 2.573 -11.218 -4.869 730 HG3 ARG 90 HG3 ARG 90 1.754 -12.572 -4.080 731 HD2 ARG 90 HD2 ARG 90 2.611 -12.419 -6.999 732 HD3 ARG 90 HD3 ARG 90 3.434 -13.323 -5.733 733 HE ARG 90 HE ARG 90 1.523 -14.828 -5.587 734 HH11 ARG 90 HH11 ARG 90 -0.244 -15.883 -6.598 735 HH12 ARG 90 HH12 ARG 90 -0.744 -15.249 -8.171 736 HH21 ARG 90 HH21 ARG 90 1.658 -13.075 -8.671 737 HH22 ARG 90 HH22 ARG 90 0.143 -13.844 -9.171 738 H TYR 91 H TYR 91 -0.512 -8.330 -5.654 739 HA TYR 91 HA TYR 91 1.566 -6.691 -4.300 740 HB2 TYR 91 HB2 TYR 91 0.877 -6.522 -7.243 741 HB3 TYR 91 HB3 TYR 91 2.227 -5.755 -6.443 742 HD1 TYR 91 HD1 TYR 91 1.027 -8.591 -8.259 743 HD2 TYR 91 HD2 TYR 91 4.152 -7.251 -5.616 744 HE1 TYR 91 HE1 TYR 91 2.389 -10.517 -8.950 745 HE2 TYR 91 HE2 TYR 91 5.516 -9.263 -6.217 746 HH TYR 91 HH TYR 91 4.312 -11.733 -8.489 747 H PHE 92 H PHE 92 1.242 -4.393 -4.638 748 HA PHE 92 HA PHE 92 -1.419 -3.481 -5.543 749 HB2 PHE 92 HB2 PHE 92 -0.292 -2.722 -2.819 750 HB3 PHE 92 HB3 PHE 92 -1.739 -2.044 -3.560 751 HD1 PHE 92 HD1 PHE 92 -0.376 -4.810 -1.663 752 HD2 PHE 92 HD2 PHE 92 -3.728 -3.557 -4.072 753 HE1 PHE 92 HE1 PHE 92 -1.708 -6.704 -0.807 754 HE2 PHE 92 HE2 PHE 92 -5.042 -5.498 -3.251 755 HZ PHE 92 HZ PHE 92 -4.028 -7.082 -1.631 756 H VAL 93 H VAL 93 -1.451 -1.045 -5.593 757 HA VAL 93 HA VAL 93 1.208 0.264 -5.623 758 HB VAL 93 HB VAL 93 -0.966 0.774 -7.694 759 HG11 VAL 93 HG11 VAL 93 1.696 2.186 -7.213 760 HG12 VAL 93 HG12 VAL 93 0.665 2.403 -8.634 761 HG13 VAL 93 HG13 VAL 93 0.073 2.901 -7.056 762 HG21 VAL 93 HG21 VAL 93 0.358 -1.197 -8.266 763 HG22 VAL 93 HG22 VAL 93 0.839 0.147 -9.306 764 HG23 VAL 93 HG23 VAL 93 1.870 -0.321 -7.947 765 H ILE 94 H ILE 94 1.227 2.086 -4.380 766 HA ILE 94 HA ILE 94 -1.376 3.285 -3.609 767 HB ILE 94 HB ILE 94 -0.713 3.585 -1.314 768 HG12 ILE 94 HG12 ILE 94 1.774 1.897 -1.884 769 HG13 ILE 94 HG13 ILE 94 1.800 3.653 -1.732 770 HG21 ILE 94 HG21 ILE 94 -1.875 1.462 -1.984 771 HG22 ILE 94 HG22 ILE 94 -0.314 0.631 -2.016 772 HG23 ILE 94 HG23 ILE 94 -0.953 1.311 -0.509 773 HD11 ILE 94 HD11 ILE 94 0.978 1.703 0.439 774 HD12 ILE 94 HD12 ILE 94 2.454 2.685 0.383 775 HD13 ILE 94 HD13 ILE 94 0.871 3.455 0.570 776 H ARG 95 H ARG 95 -1.365 5.470 -3.074 777 HA ARG 95 HA ARG 95 0.934 7.022 -4.193 778 HB2 ARG 95 HB2 ARG 95 -0.400 8.823 -4.647 779 HB3 ARG 95 HB3 ARG 95 -1.344 7.415 -5.110 780 HG2 ARG 95 HG2 ARG 95 -2.997 8.574 -4.076 781 HG3 ARG 95 HG3 ARG 95 -2.353 7.718 -2.667 782 HD2 ARG 95 HD2 ARG 95 -0.930 9.742 -2.191 783 HD3 ARG 95 HD3 ARG 95 -1.858 10.579 -3.448 784 HE ARG 95 HE ARG 95 -3.031 9.283 -0.978 785 HH11 ARG 95 HH11 ARG 95 -4.844 10.044 -0.144 786 HH12 ARG 95 HH12 ARG 95 -5.526 11.564 -0.691 787 HH21 ARG 95 HH21 ARG 95 -3.179 12.025 -3.167 788 HH22 ARG 95 HH22 ARG 95 -4.615 12.645 -2.402 789 H ILE 96 H ILE 96 2.440 7.529 -2.772 790 HA ILE 96 HA ILE 96 1.729 7.956 0.098 791 HB ILE 96 HB ILE 96 4.161 7.790 0.514 792 HG12 ILE 96 HG12 ILE 96 4.462 6.635 -2.280 793 HG13 ILE 96 HG13 ILE 96 4.769 8.348 -1.955 794 HG21 ILE 96 HG21 ILE 96 2.804 5.416 -0.810 795 HG22 ILE 96 HG22 ILE 96 4.241 5.298 0.217 796 HG23 ILE 96 HG23 ILE 96 2.726 5.882 0.903 797 HD11 ILE 96 HD11 ILE 96 6.211 6.030 -0.664 798 HD12 ILE 96 HD12 ILE 96 6.838 7.159 -1.891 799 HD13 ILE 96 HD13 ILE 96 6.433 7.751 -0.260 800 H GLN 97 H GLN 97 2.647 9.715 1.271 801 HA GLN 97 HA GLN 97 3.355 12.142 -0.312 802 HB2 GLN 97 HB2 GLN 97 2.912 11.633 2.649 803 HB3 GLN 97 HB3 GLN 97 3.724 13.077 2.035 804 HG2 GLN 97 HG2 GLN 97 1.698 13.491 0.546 805 HG3 GLN 97 HG3 GLN 97 0.869 12.202 1.439 806 HE21 GLN 97 HE21 GLN 97 1.836 15.723 3.415 807 HE22 GLN 97 HE22 GLN 97 2.853 15.165 2.091 808 H ASP 98 H ASP 98 5.425 13.036 -0.358 809 HA ASP 98 HA ASP 98 7.614 11.264 0.594 810 HB2 ASP 98 HB2 ASP 98 7.432 12.053 -1.808 811 HB3 ASP 98 HB3 ASP 98 7.769 13.676 -1.204 812 H GLY 99 H GLY 99 5.916 13.625 1.998 813 HA2 GLY 99 HA2 GLY 99 6.250 14.674 4.025 814 HA3 GLY 99 HA3 GLY 99 7.884 14.015 4.068 815 H THR 100 H THR 100 7.498 15.820 1.243 816 HA THR 100 HA THR 100 8.452 18.361 2.470 817 HB THR 100 HB THR 100 10.322 16.997 1.738 818 HG1 THR 100 HG1 THR 100 11.365 18.683 0.727 819 HG21 THR 100 HG21 THR 100 9.314 17.534 -1.072 820 HG22 THR 100 HG22 THR 100 10.867 16.793 -0.623 821 HG23 THR 100 HG23 THR 100 9.352 15.953 -0.253 822 H GLY 101 H GLY 101 5.807 17.695 1.648 823 HA2 GLY 101 HA2 GLY 101 4.071 19.069 0.931 824 HA3 GLY 101 HA3 GLY 101 5.213 20.099 0.063 825 H ARG 102 H ARG 102 5.336 16.662 -0.485 826 HA ARG 102 HA ARG 102 3.863 16.802 -3.056 827 HB2 ARG 102 HB2 ARG 102 5.741 16.271 -4.369 828 HB3 ARG 102 HB3 ARG 102 6.223 17.622 -3.318 829 HG2 ARG 102 HG2 ARG 102 7.392 15.961 -1.840 830 HG3 ARG 102 HG3 ARG 102 7.007 14.704 -3.044 831 HD2 ARG 102 HD2 ARG 102 8.229 15.972 -4.774 832 HD3 ARG 102 HD3 ARG 102 8.623 17.226 -3.578 833 HE ARG 102 HE ARG 102 9.502 14.652 -2.616 834 HH11 ARG 102 HH11 ARG 102 11.469 14.084 -2.521 835 HH12 ARG 102 HH12 ARG 102 12.741 14.849 -3.479 836 HH21 ARG 102 HH21 ARG 102 10.513 17.035 -4.995 837 HH22 ARG 102 HH22 ARG 102 12.177 16.526 -4.876 838 H SER 103 H SER 103 3.956 14.699 -4.247 839 HA SER 103 HA SER 103 3.877 12.350 -2.430 840 HB2 SER 103 HB2 SER 103 1.762 11.656 -3.566 841 HB3 SER 103 HB3 SER 103 1.607 13.153 -2.633 842 HG SER 103 HG SER 103 0.638 13.337 -4.704 843 H ALA 104 H ALA 104 3.780 10.273 -3.507 844 HA ALA 104 HA ALA 104 4.866 10.049 -6.245 845 HB1 ALA 104 HB1 ALA 104 6.305 8.950 -3.795 846 HB2 ALA 104 HB2 ALA 104 6.742 8.641 -5.488 847 HB3 ALA 104 HB3 ALA 104 6.875 10.282 -4.827 848 H PHE 105 H PHE 105 4.532 8.007 -7.212 849 HA PHE 105 HA PHE 105 2.696 6.182 -5.742 850 HB2 PHE 105 HB2 PHE 105 3.440 6.103 -8.668 851 HB3 PHE 105 HB3 PHE 105 2.156 5.216 -7.856 852 HD1 PHE 105 HD1 PHE 105 3.058 8.273 -9.550 853 HD2 PHE 105 HD2 PHE 105 0.220 6.598 -6.763 854 HE1 PHE 105 HE1 PHE 105 1.536 10.179 -9.955 855 HE2 PHE 105 HE2 PHE 105 -1.328 8.483 -7.223 856 HZ PHE 105 HZ PHE 105 -0.685 10.276 -8.805 857 H ILE 106 H ILE 106 3.334 4.320 -4.948 858 HA ILE 106 HA ILE 106 5.744 2.962 -6.079 859 HB ILE 106 HB ILE 106 6.381 2.018 -3.964 860 HG12 ILE 106 HG12 ILE 106 4.183 3.830 -2.770 861 HG13 ILE 106 HG13 ILE 106 4.139 2.071 -2.807 862 HG21 ILE 106 HG21 ILE 106 7.270 4.258 -4.789 863 HG22 ILE 106 HG22 ILE 106 6.193 5.050 -3.633 864 HG23 ILE 106 HG23 ILE 106 7.473 3.958 -3.060 865 HD11 ILE 106 HD11 ILE 106 6.179 3.638 -1.201 866 HD12 ILE 106 HD12 ILE 106 4.647 2.999 -0.593 867 HD13 ILE 106 HD13 ILE 106 5.867 1.880 -1.184 868 H GLY 107 H GLY 107 5.610 0.884 -6.443 869 HA2 GLY 107 HA2 GLY 107 3.105 -0.623 -6.123 870 HA3 GLY 107 HA3 GLY 107 4.597 -1.189 -6.878 871 H ILE 108 H ILE 108 3.064 -2.531 -4.841 872 HA ILE 108 HA ILE 108 5.210 -2.827 -2.800 873 HB ILE 108 HB ILE 108 2.220 -3.113 -2.195 874 HG12 ILE 108 HG12 ILE 108 4.219 -0.871 -1.634 875 HG13 ILE 108 HG13 ILE 108 2.683 -0.754 -2.492 876 HG21 ILE 108 HG21 ILE 108 4.665 -3.192 -0.387 877 HG22 ILE 108 HG22 ILE 108 2.973 -3.396 0.129 878 HG23 ILE 108 HG23 ILE 108 3.708 -4.615 -0.870 879 HD11 ILE 108 HD11 ILE 108 2.480 0.235 -0.326 880 HD12 ILE 108 HD12 ILE 108 1.484 -1.244 -0.359 881 HD13 ILE 108 HD13 ILE 108 3.061 -1.200 0.491 882 H GLY 109 H GLY 109 5.695 -5.005 -2.320 883 HA2 GLY 109 HA2 GLY 109 3.920 -7.179 -3.317 884 HA3 GLY 109 HA3 GLY 109 5.656 -7.271 -3.636 885 H PHE 110 H PHE 110 3.497 -8.631 -1.784 886 HA PHE 110 HA PHE 110 4.805 -8.360 0.855 887 HB2 PHE 110 HB2 PHE 110 2.314 -9.715 -0.154 888 HB3 PHE 110 HB3 PHE 110 2.950 -10.081 1.429 889 HD1 PHE 110 HD1 PHE 110 1.855 -7.118 -0.642 890 HD2 PHE 110 HD2 PHE 110 2.602 -8.735 3.287 891 HE1 PHE 110 HE1 PHE 110 0.845 -5.097 0.391 892 HE2 PHE 110 HE2 PHE 110 1.487 -6.787 4.306 893 HZ PHE 110 HZ PHE 110 0.676 -4.917 2.848 894 H THR 111 H THR 111 5.298 -10.163 2.190 895 HA THR 111 HA THR 111 7.124 -12.025 0.959 896 HB THR 111 HB THR 111 7.190 -10.893 3.255 897 HG1 THR 111 HG1 THR 111 8.699 -12.177 3.640 898 HG21 THR 111 HG21 THR 111 5.036 -11.674 4.146 899 HG22 THR 111 HG22 THR 111 5.609 -13.357 4.075 900 HG23 THR 111 HG23 THR 111 6.392 -12.197 5.155 901 H ASP 112 H ASP 112 3.753 -12.144 1.759 902 HA ASP 112 HA ASP 112 3.552 -14.851 0.598 903 HB2 ASP 112 HB2 ASP 112 3.514 -14.856 3.206 904 HB3 ASP 112 HB3 ASP 112 1.920 -14.110 3.047 905 H ARG 113 H ARG 113 1.698 -15.217 -0.601 906 HA ARG 113 HA ARG 113 0.206 -13.030 -1.705 907 HB2 ARG 113 HB2 ARG 113 0.749 -15.499 -2.510 908 HB3 ARG 113 HB3 ARG 113 -0.755 -15.922 -1.713 909 HG2 ARG 113 HG2 ARG 113 -0.516 -13.751 -3.844 910 HG3 ARG 113 HG3 ARG 113 -0.724 -15.453 -4.229 911 HD2 ARG 113 HD2 ARG 113 -2.889 -15.444 -2.942 912 HD3 ARG 113 HD3 ARG 113 -2.702 -13.696 -2.750 913 HE ARG 113 HE ARG 113 -3.173 -13.356 -5.003 914 HH11 ARG 113 HH11 ARG 113 -3.568 -13.857 -7.093 915 HH12 ARG 113 HH12 ARG 113 -3.694 -15.474 -7.633 916 HH21 ARG 113 HH21 ARG 113 -3.053 -16.852 -4.554 917 HH22 ARG 113 HH22 ARG 113 -3.553 -17.118 -6.200 918 H GLY 114 H GLY 114 -0.435 -15.192 1.020 919 HA2 GLY 114 HA2 GLY 114 -3.147 -14.322 1.547 920 HA3 GLY 114 HA3 GLY 114 -2.073 -15.219 2.625 921 H ASP 115 H ASP 115 0.022 -12.978 2.378 922 HA ASP 115 HA ASP 115 -1.024 -11.258 4.531 923 HB2 ASP 115 HB2 ASP 115 1.683 -11.380 3.182 924 HB3 ASP 115 HB3 ASP 115 1.234 -10.235 4.445 925 H ALA 116 H ALA 116 -0.137 -10.889 1.076 926 HA ALA 116 HA ALA 116 -0.909 -8.115 0.936 927 HB1 ALA 116 HB1 ALA 116 0.403 -9.033 -0.870 928 HB2 ALA 116 HB2 ALA 116 -0.743 -10.363 -1.124 929 HB3 ALA 116 HB3 ALA 116 -1.183 -8.698 -1.550 930 H PHE 117 H PHE 117 -2.767 -11.171 0.384 931 HA PHE 117 HA PHE 117 -5.294 -9.979 -0.148 932 HB2 PHE 117 HB2 PHE 117 -4.661 -12.316 -0.504 933 HB3 PHE 117 HB3 PHE 117 -4.588 -12.565 1.235 934 HD1 PHE 117 HD1 PHE 117 -6.800 -12.306 -1.706 935 HD2 PHE 117 HD2 PHE 117 -6.664 -12.452 2.608 936 HE1 PHE 117 HE1 PHE 117 -9.165 -12.958 -1.640 937 HE2 PHE 117 HE2 PHE 117 -8.984 -13.245 2.660 938 HZ PHE 117 HZ PHE 117 -10.285 -13.479 0.530 939 H ASP 118 H ASP 118 -3.632 -10.372 3.015 940 HA ASP 118 HA ASP 118 -5.975 -9.521 4.558 941 HB2 ASP 118 HB2 ASP 118 -3.047 -9.935 5.194 942 HB3 ASP 118 HB3 ASP 118 -4.096 -9.076 6.311 943 H PHE 119 H PHE 119 -3.130 -7.856 3.077 944 HA PHE 119 HA PHE 119 -3.681 -5.290 4.157 945 HB2 PHE 119 HB2 PHE 119 -1.605 -5.678 3.089 946 HB3 PHE 119 HB3 PHE 119 -2.336 -6.225 1.606 947 HD1 PHE 119 HD1 PHE 119 -3.550 -4.585 0.090 948 HD2 PHE 119 HD2 PHE 119 -0.985 -3.378 3.302 949 HE1 PHE 119 HE1 PHE 119 -3.360 -2.313 -0.918 950 HE2 PHE 119 HE2 PHE 119 -0.889 -1.096 2.375 951 HZ PHE 119 HZ PHE 119 -2.068 -0.551 0.259 952 H ASN 120 H ASN 120 -4.958 -6.909 1.235 953 HA ASN 120 HA ASN 120 -6.761 -4.821 0.455 954 HB2 ASN 120 HB2 ASN 120 -6.367 -6.337 -1.212 955 HB3 ASN 120 HB3 ASN 120 -6.405 -7.747 -0.134 956 HD21 ASN 120 HD21 ASN 120 -9.906 -6.387 -1.711 957 HD22 ASN 120 HD22 ASN 120 -8.507 -5.294 -1.629 958 H VAL 121 H VAL 121 -7.497 -7.808 2.387 959 HA VAL 121 HA VAL 121 -10.211 -7.029 2.736 960 HB VAL 121 HB VAL 121 -8.437 -9.057 4.047 961 HG11 VAL 121 HG11 VAL 121 -11.414 -8.682 4.606 962 HG12 VAL 121 HG12 VAL 121 -10.468 -10.121 5.049 963 HG13 VAL 121 HG13 VAL 121 -10.094 -8.570 5.795 964 HG21 VAL 121 HG21 VAL 121 -10.828 -9.293 2.173 965 HG22 VAL 121 HG22 VAL 121 -9.120 -9.492 1.729 966 HG23 VAL 121 HG23 VAL 121 -9.878 -10.650 2.817 967 H SER 122 H SER 122 -7.389 -6.250 4.723 968 HA SER 122 HA SER 122 -8.771 -5.129 6.969 969 HB2 SER 122 HB2 SER 122 -6.141 -4.249 5.705 970 HB3 SER 122 HB3 SER 122 -6.726 -3.815 7.323 971 HG SER 122 HG SER 122 -6.003 -6.366 6.320 972 H LEU 123 H LEU 123 -8.298 -3.903 3.702 973 HA LEU 123 HA LEU 123 -9.395 -1.235 4.401 974 HB2 LEU 123 HB2 LEU 123 -8.324 -2.377 1.809 975 HB3 LEU 123 HB3 LEU 123 -8.904 -0.722 2.023 976 HG LEU 123 HG LEU 123 -6.574 -1.927 3.560 977 HD11 LEU 123 HD11 LEU 123 -6.526 -0.099 1.154 978 HD12 LEU 123 HD12 LEU 123 -5.116 -0.709 2.055 979 HD13 LEU 123 HD13 LEU 123 -6.126 -1.830 1.140 980 HD21 LEU 123 HD21 LEU 123 -7.573 -0.004 4.728 981 HD22 LEU 123 HD22 LEU 123 -6.001 0.431 4.053 982 HD23 LEU 123 HD23 LEU 123 -7.488 0.961 3.236 983 H GLN 124 H GLN 124 -10.342 -4.222 2.626 984 HA GLN 124 HA GLN 124 -12.878 -3.309 1.688 985 HB2 GLN 124 HB2 GLN 124 -12.074 -6.043 2.750 986 HB3 GLN 124 HB3 GLN 124 -13.638 -5.705 2.048 987 HG2 GLN 124 HG2 GLN 124 -11.030 -5.311 0.538 988 HG3 GLN 124 HG3 GLN 124 -11.990 -6.777 0.480 989 HE21 GLN 124 HE21 GLN 124 -13.069 -3.806 -1.979 990 HE22 GLN 124 HE22 GLN 124 -11.524 -3.810 -1.150 991 H ASP 125 H ASP 125 -12.171 -4.903 4.877 992 HA ASP 125 HA ASP 125 -14.822 -4.344 5.902 993 HB2 ASP 125 HB2 ASP 125 -13.458 -6.229 6.643 994 HB3 ASP 125 HB3 ASP 125 -12.191 -5.139 7.214 995 H HIS 126 H HIS 126 -12.322 -2.180 5.356 996 HA HIS 126 HA HIS 126 -13.160 -0.349 7.554 997 HB2 HIS 126 HB2 HIS 126 -10.770 -0.493 7.213 998 HB3 HIS 126 HB3 HIS 126 -10.954 -0.058 5.510 999 HD2 HIS 126 HD2 HIS 126 -11.897 1.557 8.964 1000 HE1 HIS 126 HE1 HIS 126 -11.052 4.698 6.217 1001 HE2 HIS 126 HE2 HIS 126 -11.782 4.175 8.585 1002 H PHE 127 H PHE 127 -13.554 -0.822 4.081 1003 HA PHE 127 HA PHE 127 -15.010 1.780 3.851 1004 HB2 PHE 127 HB2 PHE 127 -13.500 0.116 1.875 1005 HB3 PHE 127 HB3 PHE 127 -14.667 1.322 1.376 1006 HD1 PHE 127 HD1 PHE 127 -11.273 0.832 2.509 1007 HD2 PHE 127 HD2 PHE 127 -14.435 3.752 2.330 1008 HE1 PHE 127 HE1 PHE 127 -9.626 2.629 2.852 1009 HE2 PHE 127 HE2 PHE 127 -12.779 5.556 2.697 1010 HZ PHE 127 HZ PHE 127 -10.372 5.008 2.946 1011 H LYS 128 H LYS 128 -15.541 -1.561 3.903 1012 HA LYS 128 HA LYS 128 -17.886 -2.139 2.614 1013 HB2 LYS 128 HB2 LYS 128 -16.561 -3.739 3.621 1014 HB3 LYS 128 HB3 LYS 128 -16.605 -2.977 5.208 1015 HG2 LYS 128 HG2 LYS 128 -19.191 -3.969 4.097 1016 HG3 LYS 128 HG3 LYS 128 -17.951 -5.177 4.445 1017 HD2 LYS 128 HD2 LYS 128 -18.808 -3.138 6.518 1018 HD3 LYS 128 HD3 LYS 128 -19.596 -4.724 6.335 1019 HE2 LYS 128 HE2 LYS 128 -17.352 -5.824 6.562 1020 HE3 LYS 128 HE3 LYS 128 -16.632 -4.244 6.864 1021 HZ1 LYS 128 HZ1 LYS 128 -16.991 -5.322 8.886 1022 HZ2 LYS 128 HZ2 LYS 128 -18.066 -4.084 8.862 1023 HZ3 LYS 128 HZ3 LYS 128 -18.586 -5.621 8.606 1024 H TRP 129 H TRP 129 -17.677 -0.369 5.670 1025 HA TRP 129 HA TRP 129 -20.657 -0.223 5.900 1026 HB2 TRP 129 HB2 TRP 129 -20.159 0.331 8.274 1027 HB3 TRP 129 HB3 TRP 129 -19.666 -1.268 7.756 1028 HD1 TRP 129 HD1 TRP 129 -17.056 -1.830 7.683 1029 HE1 TRP 129 HE1 TRP 129 -15.001 -0.695 8.515 1030 HE3 TRP 129 HE3 TRP 129 -19.099 2.742 8.730 1031 HZ2 TRP 129 HZ2 TRP 129 -14.215 2.006 9.399 1032 HZ3 TRP 129 HZ3 TRP 129 -17.634 4.631 9.459 1033 HH2 TRP 129 HH2 TRP 129 -15.195 4.279 9.753 1034 H VAL 130 H VAL 130 -18.524 1.591 4.426 1035 HA VAL 130 HA VAL 130 -19.928 4.174 4.931 1036 HB VAL 130 HB VAL 130 -17.378 5.007 4.228 1037 HG11 VAL 130 HG11 VAL 130 -18.696 4.774 6.965 1038 HG12 VAL 130 HG12 VAL 130 -17.318 5.823 6.593 1039 HG13 VAL 130 HG13 VAL 130 -18.884 6.111 5.811 1040 HG21 VAL 130 HG21 VAL 130 -16.950 3.002 6.438 1041 HG22 VAL 130 HG22 VAL 130 -16.448 2.793 4.762 1042 HG23 VAL 130 HG23 VAL 130 -15.780 4.122 5.721 1043 H LYS 131 H LYS 131 -18.437 5.501 2.849 1044 HA LYS 131 HA LYS 131 -18.717 5.998 0.617 1045 HB2 LYS 131 HB2 LYS 131 -18.172 3.021 0.576 1046 HB3 LYS 131 HB3 LYS 131 -18.406 3.915 -0.929 1047 HG2 LYS 131 HG2 LYS 131 -16.487 5.350 -0.440 1048 HG3 LYS 131 HG3 LYS 131 -16.323 4.611 1.167 1049 HD2 LYS 131 HD2 LYS 131 -14.714 3.524 -0.237 1050 HD3 LYS 131 HD3 LYS 131 -16.034 2.393 0.078 1051 HE2 LYS 131 HE2 LYS 131 -16.915 3.543 -2.255 1052 HE3 LYS 131 HE3 LYS 131 -15.176 3.672 -2.496 1053 HZ1 LYS 131 HZ1 LYS 131 -15.049 1.231 -2.118 1054 HZ2 LYS 131 HZ2 LYS 131 -16.691 1.181 -1.881 1055 HZ3 LYS 131 HZ3 LYS 131 -16.077 1.570 -3.341 1056 H GLN 132 H GLN 132 -21.122 5.345 2.185 1057 HA GLN 132 HA GLN 132 -23.342 5.032 2.024 1058 HB2 GLN 132 HB2 GLN 132 -23.230 6.144 -0.789 1059 HB3 GLN 132 HB3 GLN 132 -24.533 6.233 0.388 1060 HG2 GLN 132 HG2 GLN 132 -23.686 8.368 0.568 1061 HG3 GLN 132 HG3 GLN 132 -22.799 7.572 1.864 1062 HE21 GLN 132 HE21 GLN 132 -19.763 8.713 0.432 1063 HE22 GLN 132 HE22 GLN 132 -20.683 8.354 1.888 1064 H GLU 133 H GLU 133 -21.755 2.740 1.375 1065 HA GLU 133 HA GLU 133 -23.298 1.258 -0.627 1066 HB2 GLU 133 HB2 GLU 133 -20.985 0.422 1.167 1067 HB3 GLU 133 HB3 GLU 133 -21.792 -0.631 0.001 1068 HG2 GLU 133 HG2 GLU 133 -21.186 0.970 -1.832 1069 HG3 GLU 133 HG3 GLU 133 -20.293 1.939 -0.660 1070 H1 SER 149 H1 SER 149 16.404 -11.853 -9.172 1071 H2 SER 149 H2 SER 149 14.778 -12.009 -9.023 1072 H3 SER 149 H3 SER 149 15.695 -13.321 -9.386 1073 HA SER 149 HA SER 149 16.776 -13.276 -7.271 1074 HB2 SER 149 HB2 SER 149 15.002 -10.874 -6.698 1075 HB3 SER 149 HB3 SER 149 16.126 -11.654 -5.565 1076 HG SER 149 HG SER 149 17.103 -9.857 -6.577 1077 H GLN 150 H GLN 150 15.978 -14.602 -5.661 1078 HA GLN 150 HA GLN 150 14.711 -16.269 -4.889 1079 HB2 GLN 150 HB2 GLN 150 13.913 -14.332 -3.582 1080 HB3 GLN 150 HB3 GLN 150 12.561 -14.138 -4.688 1081 HG2 GLN 150 HG2 GLN 150 11.822 -15.302 -2.698 1082 HG3 GLN 150 HG3 GLN 150 11.734 -16.419 -4.052 1083 HE21 GLN 150 HE21 GLN 150 14.422 -17.136 -1.008 1084 HE22 GLN 150 HE22 GLN 150 13.687 -15.544 -1.150 1085 H ILE 151 H ILE 151 11.721 -15.041 -6.298 1086 HA ILE 151 HA ILE 151 11.892 -16.681 -8.660 1087 HB ILE 151 HB ILE 151 11.123 -18.299 -6.864 1088 HG12 ILE 151 HG12 ILE 151 9.326 -19.354 -8.099 1089 HG13 ILE 151 HG13 ILE 151 9.051 -17.908 -9.059 1090 HG21 ILE 151 HG21 ILE 151 8.531 -16.703 -6.923 1091 HG22 ILE 151 HG22 ILE 151 8.852 -18.188 -6.012 1092 HG23 ILE 151 HG23 ILE 151 9.698 -16.694 -5.582 1093 HD11 ILE 151 HD11 ILE 151 11.250 -18.172 -10.140 1094 HD12 ILE 151 HD12 ILE 151 11.643 -19.525 -9.048 1095 HD13 ILE 151 HD13 ILE 151 10.343 -19.686 -10.246 1096 H THR 152 H THR 152 10.161 -16.225 -10.170 1097 HA THR 152 HA THR 152 8.918 -13.542 -9.795 1098 HB THR 152 HB THR 152 8.520 -13.734 -12.305 1099 HG1 THR 152 HG1 THR 152 8.949 -15.942 -12.550 1100 HG21 THR 152 HG21 THR 152 10.260 -12.295 -11.347 1101 HG22 THR 152 HG22 THR 152 11.392 -13.666 -11.284 1102 HG23 THR 152 HG23 THR 152 10.820 -13.046 -12.850 1103 H SER 153 H SER 153 6.810 -13.275 -9.640 1104 HA SER 153 HA SER 153 4.921 -15.540 -10.186 1105 HB2 SER 153 HB2 SER 153 5.084 -13.852 -7.684 1106 HB3 SER 153 HB3 SER 153 3.833 -15.058 -8.057 1107 HG SER 153 HG SER 153 5.456 -16.670 -8.038 1108 H GLN 154 H GLN 154 4.747 -14.099 -12.061 1109 HA GLN 154 HA GLN 154 3.869 -11.514 -12.306 1110 HB2 GLN 154 HB2 GLN 154 3.064 -13.973 -13.903 1111 HB3 GLN 154 HB3 GLN 154 2.637 -12.331 -14.385 1112 HG2 GLN 154 HG2 GLN 154 5.032 -11.705 -14.460 1113 HG3 GLN 154 HG3 GLN 154 5.489 -13.350 -14.008 1114 HE21 GLN 154 HE21 GLN 154 5.869 -13.253 -17.661 1115 HE22 GLN 154 HE22 GLN 154 6.679 -12.601 -16.243 1116 H VAL 155 H VAL 155 1.976 -10.325 -12.179 1117 HA VAL 155 HA VAL 155 -0.150 -11.322 -10.504 1118 HB VAL 155 HB VAL 155 0.349 -9.018 -10.403 1119 HG11 VAL 155 HG11 VAL 155 -0.438 -8.688 -13.292 1120 HG12 VAL 155 HG12 VAL 155 -0.099 -7.386 -12.143 1121 HG13 VAL 155 HG13 VAL 155 1.190 -8.517 -12.587 1122 HG21 VAL 155 HG21 VAL 155 -1.830 -9.057 -9.688 1123 HG22 VAL 155 HG22 VAL 155 -2.023 -7.969 -11.019 1124 HG23 VAL 155 HG23 VAL 155 -2.476 -9.653 -11.233 1125 H TPO 156 H T2P 156 -1.552 -12.714 -11.015 1126 HA TPO 156 HA T2P 156 -2.559 -13.760 -13.425 1127 HB TPO 156 HB T2P 156 -3.618 -13.496 -10.638 1128 HG21 TPO 156 HG21 T2P 156 -5.390 -15.031 -10.983 1129 HG22 TPO 156 HG22 T2P 156 -5.192 -14.906 -12.751 1130 HG23 TPO 156 HG23 T2P 156 -5.653 -13.468 -11.752 1131 H GLY 157 H GLY 157 -4.823 -13.571 -14.133 1132 HA2 GLY 157 HA2 GLY 157 -6.142 -10.980 -14.061 1133 HA3 GLY 157 HA3 GLY 157 -5.314 -11.229 -15.599 1134 H GLN 158 H GLN 158 -5.838 -14.034 -15.938 1135 HA GLN 158 HA GLN 158 -8.535 -13.897 -16.935 1136 HB2 GLN 158 HB2 GLN 158 -8.086 -15.992 -17.965 1137 HB3 GLN 158 HB3 GLN 158 -6.637 -14.995 -18.093 1138 HG2 GLN 158 HG2 GLN 158 -5.635 -16.262 -16.163 1139 HG3 GLN 158 HG3 GLN 158 -7.093 -17.255 -16.087 1140 HE21 GLN 158 HE21 GLN 158 -4.895 -19.425 -17.941 1141 HE22 GLN 158 HE22 GLN 158 -5.290 -18.950 -16.293 1142 H ILE 159 H ILE 159 -7.428 -14.885 -13.856 1143 HA ILE 159 HA ILE 159 -9.495 -16.973 -13.511 1144 HB ILE 159 HB ILE 159 -7.258 -16.226 -11.611 1145 HG12 ILE 159 HG12 ILE 159 -7.304 -18.419 -13.734 1146 HG13 ILE 159 HG13 ILE 159 -6.308 -16.962 -13.780 1147 HG21 ILE 159 HG21 ILE 159 -9.044 -18.684 -11.828 1148 HG22 ILE 159 HG22 ILE 159 -7.744 -18.440 -10.643 1149 HG23 ILE 159 HG23 ILE 159 -9.158 -17.396 -10.601 1150 HD11 ILE 159 HD11 ILE 159 -4.900 -18.738 -13.078 1151 HD12 ILE 159 HD12 ILE 159 -5.172 -17.692 -11.669 1152 HD13 ILE 159 HD13 ILE 159 -6.024 -19.252 -11.814 1153 H GLY 160 H GLY 160 -8.353 -14.250 -11.522 1154 HA2 GLY 160 HA2 GLY 160 -9.617 -12.484 -10.617 1155 HA3 GLY 160 HA3 GLY 160 -11.117 -13.317 -11.014 1156 H TRP 161 H TRP 161 -8.580 -14.955 -9.256 1157 HA TRP 161 HA TRP 161 -10.455 -15.340 -7.002 1158 HB2 TRP 161 HB2 TRP 161 -9.544 -17.472 -6.726 1159 HB3 TRP 161 HB3 TRP 161 -9.859 -17.239 -8.425 1160 HD1 TRP 161 HD1 TRP 161 -6.795 -15.507 -8.340 1161 HE1 TRP 161 HE1 TRP 161 -4.785 -16.979 -8.919 1162 HE3 TRP 161 HE3 TRP 161 -8.841 -20.030 -7.179 1163 HZ2 TRP 161 HZ2 TRP 161 -4.172 -19.815 -8.921 1164 HZ3 TRP 161 HZ3 TRP 161 -7.505 -22.126 -7.445 1165 HH2 TRP 161 HH2 TRP 161 -5.182 -22.028 -8.325 1166 H ARG 162 H ARG 162 -8.149 -16.656 -5.565 1167 HA ARG 162 HA ARG 162 -7.698 -14.304 -3.782 1168 HB2 ARG 162 HB2 ARG 162 -9.213 -16.867 -3.121 1169 HB3 ARG 162 HB3 ARG 162 -9.109 -15.429 -2.106 1170 HG2 ARG 162 HG2 ARG 162 -10.601 -15.730 -4.738 1171 HG3 ARG 162 HG3 ARG 162 -11.325 -15.672 -3.145 1172 HD2 ARG 162 HD2 ARG 162 -11.122 -13.374 -2.940 1173 HD3 ARG 162 HD3 ARG 162 -9.637 -13.300 -3.869 1174 HE ARG 162 HE ARG 162 -10.802 -13.095 -5.855 1175 HH11 ARG 162 HH11 ARG 162 -12.513 -12.984 -7.206 1176 HH12 ARG 162 HH12 ARG 162 -14.141 -12.994 -6.570 1177 HH21 ARG 162 HH21 ARG 162 -13.181 -13.704 -3.346 1178 HH22 ARG 162 HH22 ARG 162 -14.513 -13.457 -4.440 1179 H ARG 163 H ARG 163 -6.965 -15.306 -1.516 1180 HA ARG 163 HA ARG 163 -4.468 -16.752 -1.874 1181 HB2 ARG 163 HB2 ARG 163 -4.155 -16.565 0.454 1182 HB3 ARG 163 HB3 ARG 163 -4.808 -15.034 -0.121 1183 HG2 ARG 163 HG2 ARG 163 -7.064 -15.686 0.770 1184 HG3 ARG 163 HG3 ARG 163 -6.368 -17.214 1.365 1185 HD2 ARG 163 HD2 ARG 163 -4.748 -15.936 2.745 1186 HD3 ARG 163 HD3 ARG 163 -5.468 -14.429 2.141 1187 HE ARG 163 HE ARG 163 -7.436 -16.101 3.423 1188 HH11 ARG 163 HH11 ARG 163 -8.383 -15.247 5.294 1189 HH12 ARG 163 HH12 ARG 163 -7.552 -13.986 6.166 1190 HH21 ARG 163 HH21 ARG 163 -4.849 -13.810 4.117 1191 HH22 ARG 163 HH22 ARG 163 -5.724 -13.097 5.441 Start of MODEL 20 1 H1 GLY -4 H1 GLY -4 3.941 29.386 20.494 2 H2 GLY -4 H2 GLY -4 2.712 29.160 19.438 3 H3 GLY -4 H3 GLY -4 4.124 28.351 19.236 4 HA2 GLY -4 HA2 GLY -4 2.463 26.860 20.117 5 HA3 GLY -4 HA3 GLY -4 3.786 27.114 21.270 6 H SER -3 H SER -3 2.047 26.306 22.760 7 HA SER -3 HA SER -3 0.714 28.583 24.077 8 HB2 SER -3 HB2 SER -3 -0.994 27.742 22.545 9 HB3 SER -3 HB3 SER -3 -0.807 26.106 23.201 10 HG SER -3 HG SER -3 -2.568 27.443 24.045 11 HA PRO -2 HA PRO -2 2.005 26.023 27.615 12 HB2 PRO -2 HB2 PRO -2 0.070 27.756 29.130 13 HB3 PRO -2 HB3 PRO -2 1.775 27.368 29.510 14 HG2 PRO -2 HG2 PRO -2 1.110 29.794 28.503 15 HG3 PRO -2 HG3 PRO -2 2.567 28.939 27.891 16 HD2 PRO -2 HD2 PRO -2 -0.208 29.027 26.655 17 HD3 PRO -2 HD3 PRO -2 1.387 29.319 25.893 18 H ASN -1 H ASN -1 -1.195 26.311 26.375 19 HA ASN -1 HA ASN -1 -2.558 24.731 28.417 20 HB2 ASN -1 HB2 ASN -1 -3.500 25.807 25.727 21 HB3 ASN -1 HB3 ASN -1 -4.526 25.050 26.939 22 HD21 ASN -1 HD21 ASN -1 -3.395 28.931 27.467 23 HD22 ASN -1 HD22 ASN -1 -2.702 27.988 26.151 24 H SER 0 H SER 0 -3.659 22.743 28.082 25 HA SER 0 HA SER 0 -2.073 20.708 26.920 26 HB2 SER 0 HB2 SER 0 -4.982 20.576 27.797 27 HB3 SER 0 HB3 SER 0 -3.897 19.195 27.542 28 HG SER 0 HG SER 0 -4.009 19.826 29.756 29 H MET 1 H MET 1 -1.944 19.867 24.950 30 HA MET 1 HA MET 1 -3.737 20.824 22.818 31 HB2 MET 1 HB2 MET 1 -1.133 19.260 22.710 32 HB3 MET 1 HB3 MET 1 -2.021 19.884 21.310 33 HG2 MET 1 HG2 MET 1 -1.806 22.191 22.199 34 HG3 MET 1 HG3 MET 1 -0.864 21.575 23.559 35 HE1 MET 1 HE1 MET 1 0.110 23.964 21.783 36 HE2 MET 1 HE2 MET 1 1.030 23.282 23.143 37 HE3 MET 1 HE3 MET 1 1.823 23.538 21.572 38 H ALA 2 H ALA 2 -3.832 18.125 24.787 39 HA ALA 2 HA ALA 2 -4.505 16.029 22.990 40 HB1 ALA 2 HB1 ALA 2 -3.767 15.725 25.326 41 HB2 ALA 2 HB2 ALA 2 -5.284 16.457 25.907 42 HB3 ALA 2 HB3 ALA 2 -5.314 14.912 25.030 43 H THR 3 H THR 3 -6.329 18.815 23.580 44 HA THR 3 HA THR 3 -8.988 17.707 23.198 45 HB THR 3 HB THR 3 -8.474 19.845 24.376 46 HG1 THR 3 HG1 THR 3 -10.267 20.894 23.575 47 HG21 THR 3 HG21 THR 3 -8.120 21.017 21.581 48 HG22 THR 3 HG22 THR 3 -8.161 21.906 23.118 49 HG23 THR 3 HG23 THR 3 -6.820 20.806 22.776 50 H GLU 4 H GLU 4 -6.401 18.216 21.055 51 HA GLU 4 HA GLU 4 -7.909 18.718 18.634 52 HB2 GLU 4 HB2 GLU 4 -5.518 19.307 18.889 53 HB3 GLU 4 HB3 GLU 4 -5.107 17.597 19.026 54 HG2 GLU 4 HG2 GLU 4 -4.591 18.409 16.799 55 HG3 GLU 4 HG3 GLU 4 -5.852 17.204 16.697 56 H LEU 5 H LEU 5 -8.428 17.340 16.981 57 HA LEU 5 HA LEU 5 -8.954 14.503 17.700 58 HB2 LEU 5 HB2 LEU 5 -10.009 16.180 15.399 59 HB3 LEU 5 HB3 LEU 5 -10.499 14.533 15.793 60 HG LEU 5 HG LEU 5 -10.986 16.990 17.533 61 HD11 LEU 5 HD11 LEU 5 -12.370 16.890 15.494 62 HD12 LEU 5 HD12 LEU 5 -12.894 15.246 15.924 63 HD13 LEU 5 HD13 LEU 5 -13.339 16.628 16.953 64 HD21 LEU 5 HD21 LEU 5 -11.835 14.086 17.935 65 HD22 LEU 5 HD22 LEU 5 -10.732 15.022 18.974 66 HD23 LEU 5 HD23 LEU 5 -12.435 15.473 18.873 67 H GLU 6 H GLU 6 -6.255 15.181 17.217 68 HA GLU 6 HA GLU 6 -5.629 14.093 14.549 69 HB2 GLU 6 HB2 GLU 6 -4.022 15.581 16.590 70 HB3 GLU 6 HB3 GLU 6 -3.200 14.567 15.408 71 HG2 GLU 6 HG2 GLU 6 -5.205 16.692 14.564 72 HG3 GLU 6 HG3 GLU 6 -3.491 17.026 14.795 73 H TYR 7 H TYR 7 -5.759 11.879 14.475 74 HA TYR 7 HA TYR 7 -4.097 10.223 16.175 75 HB2 TYR 7 HB2 TYR 7 -5.829 8.906 17.152 76 HB3 TYR 7 HB3 TYR 7 -6.200 10.569 17.544 77 HD1 TYR 7 HD1 TYR 7 -8.022 11.781 16.232 78 HD2 TYR 7 HD2 TYR 7 -7.425 7.517 16.001 79 HE1 TYR 7 HE1 TYR 7 -10.270 11.527 15.204 80 HE2 TYR 7 HE2 TYR 7 -9.682 7.257 14.994 81 HH TYR 7 HH TYR 7 -11.828 10.061 14.369 82 H GLU 8 H GLU 8 -4.780 7.817 15.677 83 HA GLU 8 HA GLU 8 -6.242 7.247 13.321 84 HB2 GLU 8 HB2 GLU 8 -4.543 6.077 12.030 85 HB3 GLU 8 HB3 GLU 8 -4.275 7.796 12.021 86 HG2 GLU 8 HG2 GLU 8 -2.752 6.027 13.955 87 HG3 GLU 8 HG3 GLU 8 -2.267 6.162 12.278 88 H SER 9 H SER 9 -7.159 5.317 13.587 89 HA SER 9 HA SER 9 -6.393 3.699 15.929 90 HB2 SER 9 HB2 SER 9 -8.797 3.758 14.095 91 HB3 SER 9 HB3 SER 9 -8.574 2.523 15.356 92 HG SER 9 HG SER 9 -9.800 4.314 16.117 93 H VAL 10 H VAL 10 -5.477 1.622 15.795 94 HA VAL 10 HA VAL 10 -4.406 0.855 13.229 95 HB VAL 10 HB VAL 10 -3.195 0.494 15.311 96 HG11 VAL 10 HG11 VAL 10 -5.083 -1.839 15.837 97 HG12 VAL 10 HG12 VAL 10 -3.633 -1.406 16.762 98 HG13 VAL 10 HG13 VAL 10 -5.035 -0.327 16.769 99 HG21 VAL 10 HG21 VAL 10 -2.217 -1.641 14.722 100 HG22 VAL 10 HG22 VAL 10 -3.643 -2.097 13.779 101 HG23 VAL 10 HG23 VAL 10 -2.614 -0.748 13.242 102 H LEU 11 H LEU 11 -4.890 -0.696 11.798 103 HA LEU 11 HA LEU 11 -7.454 -2.221 12.155 104 HB2 LEU 11 HB2 LEU 11 -6.310 -0.994 9.619 105 HB3 LEU 11 HB3 LEU 11 -7.730 -2.024 9.714 106 HG LEU 11 HG LEU 11 -7.485 0.763 10.922 107 HD11 LEU 11 HD11 LEU 11 -8.916 -0.379 8.486 108 HD12 LEU 11 HD12 LEU 11 -9.208 1.238 9.140 109 HD13 LEU 11 HD13 LEU 11 -7.610 0.828 8.507 110 HD21 LEU 11 HD21 LEU 11 -9.857 -1.160 10.806 111 HD22 LEU 11 HD22 LEU 11 -9.024 -0.596 12.276 112 HD23 LEU 11 HD23 LEU 11 -9.934 0.549 11.295 113 H CYS 12 H CYS 12 -4.273 -2.183 10.465 114 HA CYS 12 HA CYS 12 -4.051 -5.069 10.931 115 HB2 CYS 12 HB2 CYS 12 -5.186 -4.808 8.723 116 HB3 CYS 12 HB3 CYS 12 -3.749 -3.972 8.116 117 HG CYS 12 HG CYS 12 -4.122 -7.062 9.274 118 H VAL 13 H VAL 13 -2.000 -5.929 10.763 119 HA VAL 13 HA VAL 13 0.289 -4.187 10.254 120 HB VAL 13 HB VAL 13 0.012 -3.860 12.605 121 HG11 VAL 13 HG11 VAL 13 -1.263 -5.865 13.264 122 HG12 VAL 13 HG12 VAL 13 0.194 -6.864 13.056 123 HG13 VAL 13 HG13 VAL 13 0.145 -5.599 14.296 124 HG21 VAL 13 HG21 VAL 13 2.194 -4.545 13.424 125 HG22 VAL 13 HG22 VAL 13 2.317 -5.817 12.194 126 HG23 VAL 13 HG23 VAL 13 2.338 -4.107 11.717 127 H LYS 14 H LYS 14 1.664 -5.228 8.999 128 HA LYS 14 HA LYS 14 1.730 -8.227 9.063 129 HB2 LYS 14 HB2 LYS 14 2.129 -6.530 6.589 130 HB3 LYS 14 HB3 LYS 14 2.281 -8.257 6.668 131 HG2 LYS 14 HG2 LYS 14 -0.367 -6.899 7.383 132 HG3 LYS 14 HG3 LYS 14 0.122 -7.197 5.724 133 HD2 LYS 14 HD2 LYS 14 -1.139 -9.030 6.117 134 HD3 LYS 14 HD3 LYS 14 0.482 -9.638 6.422 135 HE2 LYS 14 HE2 LYS 14 0.008 -9.256 8.907 136 HE3 LYS 14 HE3 LYS 14 -1.670 -8.902 8.444 137 HZ1 LYS 14 HZ1 LYS 14 -0.324 -11.433 7.657 138 HZ2 LYS 14 HZ2 LYS 14 -1.168 -11.294 9.067 139 HZ3 LYS 14 HZ3 LYS 14 -1.932 -11.109 7.637 140 HA PRO 15 HA PRO 15 5.750 -7.451 10.479 141 HB2 PRO 15 HB2 PRO 15 6.845 -9.949 10.546 142 HB3 PRO 15 HB3 PRO 15 5.452 -9.475 11.565 143 HG2 PRO 15 HG2 PRO 15 5.380 -10.912 8.883 144 HG3 PRO 15 HG3 PRO 15 4.580 -11.397 10.415 145 HD2 PRO 15 HD2 PRO 15 3.240 -10.010 8.510 146 HD3 PRO 15 HD3 PRO 15 2.995 -9.658 10.248 147 H ASP 16 H ASP 16 5.471 -8.778 7.244 148 HA ASP 16 HA ASP 16 8.007 -7.436 6.547 149 HB2 ASP 16 HB2 ASP 16 8.543 -9.849 6.795 150 HB3 ASP 16 HB3 ASP 16 7.339 -10.223 5.558 151 H VAL 17 H VAL 17 7.829 -6.185 4.841 152 HA VAL 17 HA VAL 17 6.040 -6.799 2.598 153 HB VAL 17 HB VAL 17 4.595 -5.485 4.100 154 HG11 VAL 17 HG11 VAL 17 5.004 -3.117 4.547 155 HG12 VAL 17 HG12 VAL 17 6.271 -4.120 5.269 156 HG13 VAL 17 HG13 VAL 17 6.595 -3.220 3.778 157 HG21 VAL 17 HG21 VAL 17 3.822 -3.861 2.506 158 HG22 VAL 17 HG22 VAL 17 5.376 -3.864 1.657 159 HG23 VAL 17 HG23 VAL 17 4.341 -5.314 1.641 160 H SER 18 H SER 18 6.794 -5.962 0.673 161 HA SER 18 HA SER 18 9.358 -4.416 0.743 162 HB2 SER 18 HB2 SER 18 9.732 -6.745 0.169 163 HB3 SER 18 HB3 SER 18 8.505 -6.652 -1.113 164 HG SER 18 HG SER 18 10.458 -6.339 -2.056 165 H VAL 19 H VAL 19 9.665 -2.827 -0.724 166 HA VAL 19 HA VAL 19 7.333 -1.963 -2.386 167 HB VAL 19 HB VAL 19 9.081 -0.287 -0.599 168 HG11 VAL 19 HG11 VAL 19 7.242 0.613 -2.831 169 HG12 VAL 19 HG12 VAL 19 7.853 1.679 -1.553 170 HG13 VAL 19 HG13 VAL 19 8.985 0.951 -2.682 171 HG21 VAL 19 HG21 VAL 19 6.857 0.427 0.242 172 HG22 VAL 19 HG22 VAL 19 6.071 -0.674 -0.898 173 HG23 VAL 19 HG23 VAL 19 7.074 -1.315 0.418 174 H TYR 20 H TYR 20 7.640 -1.327 -4.318 175 HA TYR 20 HA TYR 20 10.332 -1.651 -5.594 176 HB2 TYR 20 HB2 TYR 20 7.612 -2.655 -6.525 177 HB3 TYR 20 HB3 TYR 20 9.138 -2.853 -7.369 178 HD1 TYR 20 HD1 TYR 20 10.551 -4.700 -6.928 179 HD2 TYR 20 HD2 TYR 20 7.273 -3.832 -4.276 180 HE1 TYR 20 HE1 TYR 20 10.881 -6.903 -5.793 181 HE2 TYR 20 HE2 TYR 20 7.649 -6.006 -3.119 182 HH TYR 20 HH TYR 20 10.159 -8.325 -4.142 183 H ARG 21 H ARG 21 9.658 0.908 -5.036 184 HA ARG 21 HA ARG 21 8.088 2.661 -6.168 185 HB2 ARG 21 HB2 ARG 21 11.112 2.943 -6.410 186 HB3 ARG 21 HB3 ARG 21 9.939 4.255 -6.528 187 HG2 ARG 21 HG2 ARG 21 9.214 3.736 -4.153 188 HG3 ARG 21 HG3 ARG 21 10.517 2.552 -4.069 189 HD2 ARG 21 HD2 ARG 21 11.300 4.582 -3.046 190 HD3 ARG 21 HD3 ARG 21 12.164 4.353 -4.559 191 HE ARG 21 HE ARG 21 11.098 6.203 -5.514 192 HH11 ARG 21 HH11 ARG 21 10.254 8.266 -5.348 193 HH12 ARG 21 HH12 ARG 21 9.484 8.752 -3.848 194 HH21 ARG 21 HH21 ARG 21 9.773 5.790 -2.259 195 HH22 ARG 21 HH22 ARG 21 9.146 7.443 -2.288 196 H ILE 22 H ILE 22 7.211 3.330 -8.016 197 HA ILE 22 HA ILE 22 8.128 1.918 -10.450 198 HB ILE 22 HB ILE 22 5.821 1.775 -11.122 199 HG12 ILE 22 HG12 ILE 22 5.194 3.361 -8.607 200 HG13 ILE 22 HG13 ILE 22 4.845 3.797 -10.284 201 HG21 ILE 22 HG21 ILE 22 6.227 0.858 -8.265 202 HG22 ILE 22 HG22 ILE 22 5.094 0.181 -9.441 203 HG23 ILE 22 HG23 ILE 22 6.834 0.048 -9.715 204 HD11 ILE 22 HD11 ILE 22 3.506 1.645 -8.624 205 HD12 ILE 22 HD12 ILE 22 2.802 3.119 -9.301 206 HD13 ILE 22 HD13 ILE 22 3.293 1.801 -10.387 207 HA PRO 23 HA PRO 23 8.253 5.784 -12.667 208 HB2 PRO 23 HB2 PRO 23 8.317 4.791 -15.285 209 HB3 PRO 23 HB3 PRO 23 9.696 5.094 -14.197 210 HG2 PRO 23 HG2 PRO 23 8.421 2.498 -14.908 211 HG3 PRO 23 HG3 PRO 23 10.082 2.831 -14.367 212 HD2 PRO 23 HD2 PRO 23 8.011 1.776 -12.776 213 HD3 PRO 23 HD3 PRO 23 9.524 2.505 -12.174 214 HA PRO 24 HA PRO 24 4.303 5.693 -15.251 215 HB2 PRO 24 HB2 PRO 24 2.555 3.617 -15.377 216 HB3 PRO 24 HB3 PRO 24 4.081 3.643 -16.313 217 HG2 PRO 24 HG2 PRO 24 3.585 2.321 -13.616 218 HG3 PRO 24 HG3 PRO 24 4.288 1.582 -15.094 219 HD2 PRO 24 HD2 PRO 24 5.855 2.584 -13.127 220 HD3 PRO 24 HD3 PRO 24 6.298 2.781 -14.848 221 H ARG 25 H ARG 25 2.187 6.391 -14.912 222 HA ARG 25 HA ARG 25 0.955 6.071 -12.186 223 HB2 ARG 25 HB2 ARG 25 -0.112 8.200 -12.476 224 HB3 ARG 25 HB3 ARG 25 1.632 8.388 -12.650 225 HG2 ARG 25 HG2 ARG 25 1.429 8.543 -15.089 226 HG3 ARG 25 HG3 ARG 25 -0.303 8.176 -15.012 227 HD2 ARG 25 HD2 ARG 25 -0.748 10.214 -13.773 228 HD3 ARG 25 HD3 ARG 25 0.970 10.617 -13.710 229 HE ARG 25 HE ARG 25 -0.873 10.887 -15.992 230 HH11 ARG 25 HH11 ARG 25 -0.212 11.971 -17.808 231 HH12 ARG 25 HH12 ARG 25 1.470 12.349 -18.035 232 HH21 ARG 25 HH21 ARG 25 2.523 10.921 -15.102 233 HH22 ARG 25 HH22 ARG 25 2.980 11.774 -16.551 234 H ALA 26 H ALA 26 0.395 5.574 -15.562 235 HA ALA 26 HA ALA 26 -2.079 4.124 -15.023 236 HB1 ALA 26 HB1 ALA 26 -2.144 6.783 -16.526 237 HB2 ALA 26 HB2 ALA 26 -3.506 5.638 -16.341 238 HB3 ALA 26 HB3 ALA 26 -2.836 6.482 -14.925 239 H SER 27 H SER 27 -1.516 2.424 -16.025 240 HA SER 27 HA SER 27 -0.831 2.489 -18.929 241 HB2 SER 27 HB2 SER 27 0.765 1.257 -17.518 242 HB3 SER 27 HB3 SER 27 -0.541 0.188 -16.971 243 HG SER 27 HG SER 27 0.876 -0.387 -18.920 244 H ASN 28 H ASN 28 -1.818 0.876 -20.173 245 HA ASN 28 HA ASN 28 -4.513 1.204 -20.490 246 HB2 ASN 28 HB2 ASN 28 -4.343 -0.330 -22.302 247 HB3 ASN 28 HB3 ASN 28 -2.834 0.565 -22.202 248 HD21 ASN 28 HD21 ASN 28 -1.078 -2.518 -21.073 249 HD22 ASN 28 HD22 ASN 28 -1.234 -0.918 -20.392 250 H ARG 29 H ARG 29 -3.224 -1.333 -18.407 251 HA ARG 29 HA ARG 29 -6.052 -2.035 -17.723 252 HB2 ARG 29 HB2 ARG 29 -3.763 -4.040 -17.944 253 HB3 ARG 29 HB3 ARG 29 -5.306 -4.367 -17.148 254 HG2 ARG 29 HG2 ARG 29 -6.098 -5.023 -19.130 255 HG3 ARG 29 HG3 ARG 29 -6.201 -3.299 -19.478 256 HD2 ARG 29 HD2 ARG 29 -5.083 -4.130 -21.343 257 HD3 ARG 29 HD3 ARG 29 -3.776 -3.497 -20.322 258 HE ARG 29 HE ARG 29 -4.139 -6.248 -19.703 259 HH11 ARG 29 HH11 ARG 29 -2.907 -7.884 -20.583 260 HH12 ARG 29 HH12 ARG 29 -1.994 -7.603 -22.033 261 HH21 ARG 29 HH21 ARG 29 -2.962 -4.319 -22.393 262 HH22 ARG 29 HH22 ARG 29 -2.060 -5.658 -23.065 263 H GLY 30 H GLY 30 -4.155 -0.153 -16.649 264 HA2 GLY 30 HA2 GLY 30 -4.514 0.643 -14.308 265 HA3 GLY 30 HA3 GLY 30 -4.169 -1.008 -13.753 266 H TYR 31 H TYR 31 -2.097 -1.622 -13.408 267 HA TYR 31 HA TYR 31 0.135 0.310 -14.034 268 HB2 TYR 31 HB2 TYR 31 -0.601 -1.053 -11.431 269 HB3 TYR 31 HB3 TYR 31 1.023 -0.484 -11.756 270 HD1 TYR 31 HD1 TYR 31 -2.391 0.537 -10.968 271 HD2 TYR 31 HD2 TYR 31 1.574 1.853 -12.031 272 HE1 TYR 31 HE1 TYR 31 -2.895 2.803 -10.030 273 HE2 TYR 31 HE2 TYR 31 1.098 4.094 -11.050 274 HH TYR 31 HH TYR 31 -2.063 4.882 -9.548 275 H ARG 32 H ARG 32 -0.786 -3.043 -13.521 276 HA ARG 32 HA ARG 32 0.231 -4.994 -13.396 277 HB2 ARG 32 HB2 ARG 32 1.926 -4.679 -15.769 278 HB3 ARG 32 HB3 ARG 32 0.643 -5.794 -15.354 279 HG2 ARG 32 HG2 ARG 32 -0.319 -4.863 -17.153 280 HG3 ARG 32 HG3 ARG 32 -0.935 -3.747 -15.958 281 HD2 ARG 32 HD2 ARG 32 -0.236 -2.357 -17.686 282 HD3 ARG 32 HD3 ARG 32 1.068 -2.243 -16.504 283 HE ARG 32 HE ARG 32 2.516 -2.962 -18.104 284 HH11 ARG 32 HH11 ARG 32 3.269 -3.523 -19.914 285 HH12 ARG 32 HH12 ARG 32 2.316 -4.384 -21.120 286 HH21 ARG 32 HH21 ARG 32 -0.546 -4.324 -19.170 287 HH22 ARG 32 HH22 ARG 32 0.175 -4.863 -20.665 288 H ALA 33 H ALA 33 1.516 -5.540 -11.745 289 HA ALA 33 HA ALA 33 3.992 -4.448 -11.037 290 HB1 ALA 33 HB1 ALA 33 3.165 -7.354 -10.629 291 HB2 ALA 33 HB2 ALA 33 4.272 -6.383 -9.641 292 HB3 ALA 33 HB3 ALA 33 2.544 -6.000 -9.666 293 H SER 34 H SER 34 3.336 -6.795 -13.517 294 HA SER 34 HA SER 34 6.050 -7.713 -13.914 295 HB2 SER 34 HB2 SER 34 3.718 -8.808 -14.416 296 HB3 SER 34 HB3 SER 34 3.817 -7.922 -15.943 297 HG SER 34 HG SER 34 5.829 -8.976 -16.333 298 H ASP 35 H ASP 35 4.504 -4.751 -14.833 299 HA ASP 35 HA ASP 35 6.052 -4.293 -17.276 300 HB2 ASP 35 HB2 ASP 35 3.711 -3.388 -16.562 301 HB3 ASP 35 HB3 ASP 35 4.611 -2.197 -15.633 302 H TRP 36 H TRP 36 6.246 -3.412 -13.873 303 HA TRP 36 HA TRP 36 8.885 -2.062 -14.198 304 HB2 TRP 36 HB2 TRP 36 8.171 -1.388 -11.694 305 HB3 TRP 36 HB3 TRP 36 7.757 -0.496 -13.128 306 HD1 TRP 36 HD1 TRP 36 5.291 -0.455 -13.937 307 HE1 TRP 36 HE1 TRP 36 3.064 -0.943 -12.807 308 HE3 TRP 36 HE3 TRP 36 7.002 -2.971 -9.802 309 HZ2 TRP 36 HZ2 TRP 36 2.175 -1.826 -10.193 310 HZ3 TRP 36 HZ3 TRP 36 5.426 -3.611 -7.996 311 HH2 TRP 36 HH2 TRP 36 3.015 -3.024 -8.161 312 H LYS 37 H LYS 37 9.776 -2.377 -11.571 313 HA LYS 37 HA LYS 37 10.958 -5.052 -11.551 314 HB2 LYS 37 HB2 LYS 37 10.914 -2.696 -9.597 315 HB3 LYS 37 HB3 LYS 37 11.706 -4.233 -9.225 316 HG2 LYS 37 HG2 LYS 37 13.175 -4.040 -11.151 317 HG3 LYS 37 HG3 LYS 37 12.372 -2.557 -11.689 318 HD2 LYS 37 HD2 LYS 37 13.188 -1.289 -9.861 319 HD3 LYS 37 HD3 LYS 37 13.656 -2.733 -8.940 320 HE2 LYS 37 HE2 LYS 37 15.381 -3.296 -10.573 321 HE3 LYS 37 HE3 LYS 37 14.916 -1.921 -11.589 322 HZ1 LYS 37 HZ1 LYS 37 16.006 -1.701 -8.828 323 HZ2 LYS 37 HZ2 LYS 37 16.840 -1.390 -10.196 324 HZ3 LYS 37 HZ3 LYS 37 15.586 -0.437 -9.776 325 H LEU 38 H LEU 38 9.662 -6.501 -11.607 326 HA LEU 38 HA LEU 38 7.505 -7.050 -9.800 327 HB2 LEU 38 HB2 LEU 38 7.738 -7.753 -12.194 328 HB3 LEU 38 HB3 LEU 38 9.177 -8.682 -11.774 329 HG LEU 38 HG LEU 38 7.800 -10.026 -10.247 330 HD11 LEU 38 HD11 LEU 38 5.457 -8.709 -11.725 331 HD12 LEU 38 HD12 LEU 38 5.316 -10.084 -10.622 332 HD13 LEU 38 HD13 LEU 38 5.820 -8.516 -9.997 333 HD21 LEU 38 HD21 LEU 38 6.965 -10.079 -13.179 334 HD22 LEU 38 HD22 LEU 38 8.431 -10.817 -12.497 335 HD23 LEU 38 HD23 LEU 38 6.840 -11.435 -12.036 336 H ASP 39 H ASP 39 10.954 -7.914 -9.874 337 HA ASP 39 HA ASP 39 10.724 -9.359 -7.273 338 HB2 ASP 39 HB2 ASP 39 10.599 -10.847 -9.307 339 HB3 ASP 39 HB3 ASP 39 12.227 -10.323 -9.732 340 H GLN 40 H GLN 40 11.901 -6.652 -8.147 341 HA GLN 40 HA GLN 40 14.597 -6.972 -6.863 342 HB2 GLN 40 HB2 GLN 40 13.869 -5.272 -9.248 343 HB3 GLN 40 HB3 GLN 40 15.339 -5.066 -8.288 344 HG2 GLN 40 HG2 GLN 40 15.996 -7.413 -8.799 345 HG3 GLN 40 HG3 GLN 40 14.557 -7.590 -9.810 346 HE21 GLN 40 HE21 GLN 40 15.944 -5.740 -12.543 347 HE22 GLN 40 HE22 GLN 40 14.473 -6.427 -11.875 348 HA PRO 41 HA PRO 41 12.055 -4.255 -4.154 349 HB2 PRO 41 HB2 PRO 41 14.369 -4.987 -2.340 350 HB3 PRO 41 HB3 PRO 41 12.643 -4.839 -1.927 351 HG2 PRO 41 HG2 PRO 41 13.733 -7.283 -2.312 352 HG3 PRO 41 HG3 PRO 41 12.148 -6.917 -3.072 353 HD2 PRO 41 HD2 PRO 41 14.896 -6.850 -4.346 354 HD3 PRO 41 HD3 PRO 41 13.378 -7.570 -4.963 355 H ASP 42 H ASP 42 12.264 -2.147 -3.509 356 HA ASP 42 HA ASP 42 14.931 -0.794 -3.740 357 HB2 ASP 42 HB2 ASP 42 13.125 0.064 -5.230 358 HB3 ASP 42 HB3 ASP 42 12.147 0.424 -3.806 359 H TRP 43 H TRP 43 12.177 -1.446 -1.592 360 HA TRP 43 HA TRP 43 13.858 -0.842 0.747 361 HB2 TRP 43 HB2 TRP 43 12.778 1.309 0.422 362 HB3 TRP 43 HB3 TRP 43 11.213 0.546 0.183 363 HD1 TRP 43 HD1 TRP 43 13.623 1.605 2.928 364 HE1 TRP 43 HE1 TRP 43 12.463 1.446 5.235 365 HE3 TRP 43 HE3 TRP 43 9.312 -0.793 1.529 366 HZ2 TRP 43 HZ2 TRP 43 9.949 0.573 6.261 367 HZ3 TRP 43 HZ3 TRP 43 7.545 -1.273 3.197 368 HH2 TRP 43 HH2 TRP 43 7.845 -0.598 5.575 369 H THR 44 H THR 44 13.248 -2.048 2.577 370 HA THR 44 HA THR 44 10.752 -3.631 2.502 371 HB THR 44 HB THR 44 11.922 -5.624 3.306 372 HG1 THR 44 HG1 THR 44 14.183 -5.741 3.139 373 HG21 THR 44 HG21 THR 44 13.180 -4.757 0.675 374 HG22 THR 44 HG22 THR 44 12.918 -6.419 1.257 375 HG23 THR 44 HG23 THR 44 11.535 -5.389 0.867 376 H GLY 45 H GLY 45 9.868 -4.160 4.398 377 HA2 GLY 45 HA2 GLY 45 10.996 -3.596 6.967 378 HA3 GLY 45 HA3 GLY 45 10.097 -2.197 6.397 379 H ARG 46 H ARG 46 8.360 -2.174 7.539 380 HA ARG 46 HA ARG 46 6.608 -4.586 7.936 381 HB2 ARG 46 HB2 ARG 46 7.930 -4.018 9.948 382 HB3 ARG 46 HB3 ARG 46 7.302 -2.372 9.911 383 HG2 ARG 46 HG2 ARG 46 4.977 -3.304 10.249 384 HG3 ARG 46 HG3 ARG 46 5.691 -4.916 10.400 385 HD2 ARG 46 HD2 ARG 46 6.251 -2.513 12.189 386 HD3 ARG 46 HD3 ARG 46 5.177 -3.849 12.577 387 HE ARG 46 HE ARG 46 7.070 -5.372 12.648 388 HH11 ARG 46 HH11 ARG 46 9.106 -5.757 13.433 389 HH12 ARG 46 HH12 ARG 46 10.233 -4.437 13.607 390 HH21 ARG 46 HH21 ARG 46 7.991 -1.992 12.762 391 HH22 ARG 46 HH22 ARG 46 9.569 -2.360 13.405 392 H LEU 47 H LEU 47 4.429 -4.292 7.812 393 HA LEU 47 HA LEU 47 3.427 -1.732 6.643 394 HB2 LEU 47 HB2 LEU 47 2.912 -3.914 5.498 395 HB3 LEU 47 HB3 LEU 47 2.176 -4.457 7.001 396 HG LEU 47 HG LEU 47 0.549 -2.442 6.751 397 HD11 LEU 47 HD11 LEU 47 1.564 -2.654 3.893 398 HD12 LEU 47 HD12 LEU 47 0.117 -1.773 4.437 399 HD13 LEU 47 HD13 LEU 47 1.712 -1.244 4.971 400 HD21 LEU 47 HD21 LEU 47 0.446 -4.818 4.879 401 HD22 LEU 47 HD22 LEU 47 -0.135 -4.738 6.559 402 HD23 LEU 47 HD23 LEU 47 -0.930 -3.781 5.324 403 H ARG 48 H ARG 48 2.206 -0.341 7.850 404 HA ARG 48 HA ARG 48 0.348 -1.587 9.822 405 HB2 ARG 48 HB2 ARG 48 1.280 1.311 9.906 406 HB3 ARG 48 HB3 ARG 48 0.154 0.537 11.015 407 HG2 ARG 48 HG2 ARG 48 3.091 -0.211 10.703 408 HG3 ARG 48 HG3 ARG 48 2.463 0.882 11.925 409 HD2 ARG 48 HD2 ARG 48 1.278 -1.891 11.735 410 HD3 ARG 48 HD3 ARG 48 2.891 -1.708 12.421 411 HE ARG 48 HE ARG 48 0.355 -0.911 13.620 412 HH11 ARG 48 HH11 ARG 48 0.361 -0.279 15.750 413 HH12 ARG 48 HH12 ARG 48 1.845 0.208 16.509 414 HH21 ARG 48 HH21 ARG 48 3.826 -0.185 13.735 415 HH22 ARG 48 HH22 ARG 48 3.729 0.240 15.417 416 H ILE 49 H ILE 49 -1.722 -1.272 9.436 417 HA ILE 49 HA ILE 49 -2.558 0.871 7.527 418 HB ILE 49 HB ILE 49 -3.872 -1.841 7.860 419 HG12 ILE 49 HG12 ILE 49 -2.392 -0.480 5.559 420 HG13 ILE 49 HG13 ILE 49 -1.917 -1.947 6.416 421 HG21 ILE 49 HG21 ILE 49 -5.543 -1.068 6.276 422 HG22 ILE 49 HG22 ILE 49 -5.539 -0.006 7.661 423 HG23 ILE 49 HG23 ILE 49 -4.746 0.518 6.143 424 HD11 ILE 49 HD11 ILE 49 -4.263 -1.621 4.511 425 HD12 ILE 49 HD12 ILE 49 -2.796 -2.579 4.298 426 HD13 ILE 49 HD13 ILE 49 -3.975 -3.078 5.519 427 H THR 50 H THR 50 -3.788 2.323 8.405 428 HA THR 50 HA THR 50 -5.102 1.836 11.031 429 HB THR 50 HB THR 50 -4.231 3.916 11.914 430 HG1 THR 50 HG1 THR 50 -2.724 4.051 9.512 431 HG21 THR 50 HG21 THR 50 -1.836 2.381 10.828 432 HG22 THR 50 HG22 THR 50 -1.896 3.446 12.245 433 HG23 THR 50 HG23 THR 50 -2.772 1.909 12.259 434 H SER 51 H SER 51 -6.583 3.786 11.587 435 HA SER 51 HA SER 51 -7.477 5.350 9.265 436 HB2 SER 51 HB2 SER 51 -9.837 4.740 9.569 437 HB3 SER 51 HB3 SER 51 -8.841 3.410 8.977 438 HG SER 51 HG SER 51 -9.554 3.806 11.716 439 H LYS 52 H LYS 52 -7.684 7.359 9.912 440 HA LYS 52 HA LYS 52 -8.589 8.074 12.656 441 HB2 LYS 52 HB2 LYS 52 -6.638 9.182 11.618 442 HB3 LYS 52 HB3 LYS 52 -7.716 9.849 10.371 443 HG2 LYS 52 HG2 LYS 52 -9.047 10.825 12.429 444 HG3 LYS 52 HG3 LYS 52 -7.570 10.485 13.320 445 HD2 LYS 52 HD2 LYS 52 -7.950 12.274 10.904 446 HD3 LYS 52 HD3 LYS 52 -7.512 12.769 12.555 447 HE2 LYS 52 HE2 LYS 52 -5.310 11.755 12.314 448 HE3 LYS 52 HE3 LYS 52 -5.756 11.053 10.756 449 HZ1 LYS 52 HZ1 LYS 52 -5.404 13.944 11.361 450 HZ2 LYS 52 HZ2 LYS 52 -4.478 13.034 10.386 451 HZ3 LYS 52 HZ3 LYS 52 -6.007 13.386 9.931 452 H GLY 53 H GLY 53 -10.486 6.785 11.987 453 HA2 GLY 53 HA2 GLY 53 -12.837 6.873 11.921 454 HA3 GLY 53 HA3 GLY 53 -12.759 8.553 11.397 455 H LYS 54 H LYS 54 -13.701 8.769 9.471 456 HA LYS 54 HA LYS 54 -14.057 6.624 7.529 457 HB2 LYS 54 HB2 LYS 54 -15.731 8.442 8.209 458 HB3 LYS 54 HB3 LYS 54 -14.755 9.553 7.241 459 HG2 LYS 54 HG2 LYS 54 -15.203 7.612 5.377 460 HG3 LYS 54 HG3 LYS 54 -16.570 7.292 6.451 461 HD2 LYS 54 HD2 LYS 54 -17.289 9.651 6.239 462 HD3 LYS 54 HD3 LYS 54 -15.868 9.994 5.226 463 HE2 LYS 54 HE2 LYS 54 -16.682 8.295 3.564 464 HE3 LYS 54 HE3 LYS 54 -18.136 8.077 4.547 465 HZ1 LYS 54 HZ1 LYS 54 -17.326 10.653 3.295 466 HZ2 LYS 54 HZ2 LYS 54 -18.539 9.695 2.768 467 HZ3 LYS 54 HZ3 LYS 54 -18.657 10.439 4.213 468 H THR 55 H THR 55 -11.351 7.111 7.922 469 HA THR 55 HA THR 55 -10.444 7.434 5.142 470 HB THR 55 HB THR 55 -9.107 9.100 7.315 471 HG1 THR 55 HG1 THR 55 -11.157 9.840 5.525 472 HG21 THR 55 HG21 THR 55 -7.763 8.543 5.306 473 HG22 THR 55 HG22 THR 55 -9.066 9.149 4.258 474 HG23 THR 55 HG23 THR 55 -8.166 10.269 5.312 475 H ALA 56 H ALA 56 -9.008 5.796 4.830 476 HA ALA 56 HA ALA 56 -7.633 4.569 7.160 477 HB1 ALA 56 HB1 ALA 56 -8.709 2.930 5.770 478 HB2 ALA 56 HB2 ALA 56 -7.964 3.591 4.304 479 HB3 ALA 56 HB3 ALA 56 -6.967 2.788 5.533 480 H TYR 57 H TYR 57 -5.293 4.191 7.008 481 HA TYR 57 HA TYR 57 -3.812 5.869 5.069 482 HB2 TYR 57 HB2 TYR 57 -3.329 5.883 8.068 483 HB3 TYR 57 HB3 TYR 57 -2.313 6.632 6.847 484 HD1 TYR 57 HD1 TYR 57 -5.715 6.750 8.409 485 HD2 TYR 57 HD2 TYR 57 -2.730 8.872 6.130 486 HE1 TYR 57 HE1 TYR 57 -7.080 8.805 8.545 487 HE2 TYR 57 HE2 TYR 57 -4.052 10.973 6.378 488 HH TYR 57 HH TYR 57 -7.214 11.060 8.055 489 H ILE 58 H ILE 58 -2.488 4.526 4.060 490 HA ILE 58 HA ILE 58 -1.496 2.039 5.350 491 HB ILE 58 HB ILE 58 -0.503 3.180 2.728 492 HG12 ILE 58 HG12 ILE 58 -2.864 3.129 2.339 493 HG13 ILE 58 HG13 ILE 58 -2.062 1.850 1.456 494 HG21 ILE 58 HG21 ILE 58 -0.626 0.388 3.901 495 HG22 ILE 58 HG22 ILE 58 0.011 0.810 2.294 496 HG23 ILE 58 HG23 ILE 58 0.814 1.410 3.743 497 HD11 ILE 58 HD11 ILE 58 -2.863 0.172 3.066 498 HD12 ILE 58 HD12 ILE 58 -3.635 1.455 4.035 499 HD13 ILE 58 HD13 ILE 58 -4.193 1.125 2.383 500 H LYS 59 H LYS 59 0.049 2.380 6.864 501 HA LYS 59 HA LYS 59 2.154 4.475 6.344 502 HB2 LYS 59 HB2 LYS 59 1.119 3.582 9.061 503 HB3 LYS 59 HB3 LYS 59 2.368 4.793 8.728 504 HG2 LYS 59 HG2 LYS 59 0.522 5.952 7.267 505 HG3 LYS 59 HG3 LYS 59 -0.612 4.930 8.156 506 HD2 LYS 59 HD2 LYS 59 0.184 5.953 10.298 507 HD3 LYS 59 HD3 LYS 59 1.326 6.953 9.360 508 HE2 LYS 59 HE2 LYS 59 -0.741 7.705 7.996 509 HE3 LYS 59 HE3 LYS 59 -1.723 7.008 9.298 510 HZ1 LYS 59 HZ1 LYS 59 -0.675 8.570 10.834 511 HZ2 LYS 59 HZ2 LYS 59 0.317 9.142 9.617 512 HZ3 LYS 59 HZ3 LYS 59 -1.293 9.393 9.580 513 H LEU 60 H LEU 60 4.070 3.751 5.899 514 HA LEU 60 HA LEU 60 4.715 0.888 6.450 515 HB2 LEU 60 HB2 LEU 60 5.820 2.932 4.489 516 HB3 LEU 60 HB3 LEU 60 6.447 1.297 4.669 517 HG LEU 60 HG LEU 60 3.567 1.923 3.862 518 HD11 LEU 60 HD11 LEU 60 5.962 1.132 2.170 519 HD12 LEU 60 HD12 LEU 60 4.284 1.265 1.593 520 HD13 LEU 60 HD13 LEU 60 5.142 2.710 2.152 521 HD21 LEU 60 HD21 LEU 60 5.195 -0.658 3.754 522 HD22 LEU 60 HD22 LEU 60 3.852 -0.325 4.865 523 HD23 LEU 60 HD23 LEU 60 3.546 -0.441 3.129 524 H GLU 61 H GLU 61 6.306 0.277 7.791 525 HA GLU 61 HA GLU 61 7.889 2.423 9.156 526 HB2 GLU 61 HB2 GLU 61 6.813 -0.162 10.322 527 HB3 GLU 61 HB3 GLU 61 7.770 1.056 11.167 528 HG2 GLU 61 HG2 GLU 61 5.922 2.717 10.724 529 HG3 GLU 61 HG3 GLU 61 4.943 1.388 10.087 530 H ASP 62 H ASP 62 10.081 2.085 9.588 531 HA ASP 62 HA ASP 62 11.483 -0.069 8.213 532 HB2 ASP 62 HB2 ASP 62 12.356 2.020 10.245 533 HB3 ASP 62 HB3 ASP 62 13.438 0.804 9.573 534 H LYS 63 H LYS 63 12.063 -2.018 9.003 535 HA LYS 63 HA LYS 63 10.409 -3.114 11.037 536 HB2 LYS 63 HB2 LYS 63 11.349 -4.201 8.958 537 HB3 LYS 63 HB3 LYS 63 12.894 -4.368 9.797 538 HG2 LYS 63 HG2 LYS 63 11.729 -5.777 11.522 539 HG3 LYS 63 HG3 LYS 63 10.218 -5.608 10.615 540 HD2 LYS 63 HD2 LYS 63 12.796 -6.849 9.547 541 HD3 LYS 63 HD3 LYS 63 11.439 -7.757 10.228 542 HE2 LYS 63 HE2 LYS 63 9.952 -6.886 8.437 543 HE3 LYS 63 HE3 LYS 63 11.314 -6.002 7.736 544 HZ1 LYS 63 HZ1 LYS 63 12.443 -8.126 7.387 545 HZ2 LYS 63 HZ2 LYS 63 11.199 -8.950 8.057 546 HZ3 LYS 63 HZ3 LYS 63 10.985 -8.159 6.646 547 H VAL 64 H VAL 64 13.371 -1.533 11.362 548 HA VAL 64 HA VAL 64 14.296 -3.001 13.780 549 HB VAL 64 HB VAL 64 16.380 -1.617 13.268 550 HG11 VAL 64 HG11 VAL 64 15.540 -3.799 11.310 551 HG12 VAL 64 HG12 VAL 64 17.213 -3.313 11.670 552 HG13 VAL 64 HG13 VAL 64 16.222 -4.062 12.931 553 HG21 VAL 64 HG21 VAL 64 16.847 -0.964 10.997 554 HG22 VAL 64 HG22 VAL 64 15.228 -1.428 10.462 555 HG23 VAL 64 HG23 VAL 64 15.454 -0.057 11.582 556 H SER 65 H SER 65 13.297 0.204 12.662 557 HA SER 65 HA SER 65 13.828 1.219 15.416 558 HB2 SER 65 HB2 SER 65 13.956 2.774 12.813 559 HB3 SER 65 HB3 SER 65 14.300 3.401 14.438 560 HG SER 65 HG SER 65 16.212 2.820 13.326 561 H GLY 66 H GLY 66 11.372 0.526 13.244 562 HA2 GLY 66 HA2 GLY 66 9.118 1.000 13.176 563 HA3 GLY 66 HA3 GLY 66 9.257 1.767 14.763 564 H GLU 67 H GLU 67 11.282 3.017 12.198 565 HA GLU 67 HA GLU 67 9.932 5.634 12.416 566 HB2 GLU 67 HB2 GLU 67 12.470 4.750 10.998 567 HB3 GLU 67 HB3 GLU 67 11.814 6.393 10.927 568 HG2 GLU 67 HG2 GLU 67 11.924 6.536 13.415 569 HG3 GLU 67 HG3 GLU 67 12.667 4.937 13.464 570 H LEU 68 H LEU 68 9.003 6.825 10.712 571 HA LEU 68 HA LEU 68 7.513 5.175 8.890 572 HB2 LEU 68 HB2 LEU 68 6.683 7.266 10.068 573 HB3 LEU 68 HB3 LEU 68 7.694 8.206 8.973 574 HG LEU 68 HG LEU 68 6.393 7.059 7.042 575 HD11 LEU 68 HD11 LEU 68 5.333 5.249 8.398 576 HD12 LEU 68 HD12 LEU 68 4.464 6.475 9.339 577 HD13 LEU 68 HD13 LEU 68 4.131 6.268 7.607 578 HD21 LEU 68 HD21 LEU 68 6.054 9.408 7.702 579 HD22 LEU 68 HD22 LEU 68 4.534 8.640 7.222 580 HD23 LEU 68 HD23 LEU 68 4.888 8.898 8.945 581 H PHE 69 H PHE 69 8.123 4.445 6.990 582 HA PHE 69 HA PHE 69 10.250 5.650 5.324 583 HB2 PHE 69 HB2 PHE 69 10.163 3.281 5.373 584 HB3 PHE 69 HB3 PHE 69 8.427 3.246 5.106 585 HD1 PHE 69 HD1 PHE 69 7.812 2.433 3.025 586 HD2 PHE 69 HD2 PHE 69 11.400 4.795 3.338 587 HE1 PHE 69 HE1 PHE 69 8.178 2.191 0.592 588 HE2 PHE 69 HE2 PHE 69 11.749 4.586 0.900 589 HZ PHE 69 HZ PHE 69 10.128 3.281 -0.496 590 H ALA 70 H ALA 70 6.710 5.091 5.059 591 HA ALA 70 HA ALA 70 6.296 7.623 3.679 592 HB1 ALA 70 HB1 ALA 70 5.320 6.603 1.660 593 HB2 ALA 70 HB2 ALA 70 7.034 6.177 1.796 594 HB3 ALA 70 HB3 ALA 70 5.784 4.985 2.221 595 H GLN 71 H GLN 71 3.981 8.045 3.293 596 HA GLN 71 HA GLN 71 2.105 6.115 4.427 597 HB2 GLN 71 HB2 GLN 71 0.861 7.767 5.736 598 HB3 GLN 71 HB3 GLN 71 2.480 7.453 6.353 599 HG2 GLN 71 HG2 GLN 71 3.264 9.584 5.250 600 HG3 GLN 71 HG3 GLN 71 1.593 9.919 4.792 601 HE21 GLN 71 HE21 GLN 71 2.362 11.710 7.999 602 HE22 GLN 71 HE22 GLN 71 3.044 11.737 6.380 603 H ALA 72 H ALA 72 0.193 5.963 3.430 604 HA ALA 72 HA ALA 72 -0.475 7.909 1.250 605 HB1 ALA 72 HB1 ALA 72 -0.851 4.900 1.316 606 HB2 ALA 72 HB2 ALA 72 -1.529 5.980 0.094 607 HB3 ALA 72 HB3 ALA 72 0.220 5.838 0.243 608 HA PRO 73 HA PRO 73 -4.311 7.990 3.832 609 HB2 PRO 73 HB2 PRO 73 -4.839 10.426 2.174 610 HB3 PRO 73 HB3 PRO 73 -4.956 10.215 3.943 611 HG2 PRO 73 HG2 PRO 73 -2.887 11.594 2.823 612 HG3 PRO 73 HG3 PRO 73 -2.600 10.489 4.206 613 HD2 PRO 73 HD2 PRO 73 -2.206 9.921 1.248 614 HD3 PRO 73 HD3 PRO 73 -1.085 9.624 2.615 615 H VAL 74 H VAL 74 -6.122 6.907 3.248 616 HA VAL 74 HA VAL 74 -6.989 6.740 0.385 617 HB VAL 74 HB VAL 74 -7.060 4.545 2.481 618 HG11 VAL 74 HG11 VAL 74 -7.900 4.477 -0.428 619 HG12 VAL 74 HG12 VAL 74 -7.843 3.087 0.681 620 HG13 VAL 74 HG13 VAL 74 -8.984 4.386 0.979 621 HG21 VAL 74 HG21 VAL 74 -4.760 4.879 1.587 622 HG22 VAL 74 HG22 VAL 74 -5.475 3.299 1.261 623 HG23 VAL 74 HG23 VAL 74 -5.396 4.498 -0.028 624 H GLU 75 H GLU 75 -9.023 7.440 0.051 625 HA GLU 75 HA GLU 75 -10.939 7.593 2.348 626 HB2 GLU 75 HB2 GLU 75 -9.873 9.731 1.252 627 HB3 GLU 75 HB3 GLU 75 -11.036 9.429 -0.041 628 HG2 GLU 75 HG2 GLU 75 -12.860 9.453 1.760 629 HG3 GLU 75 HG3 GLU 75 -11.615 9.897 2.923 630 H GLN 76 H GLN 76 -10.386 5.783 -0.325 631 HA GLN 76 HA GLN 76 -13.030 4.736 -0.400 632 HB2 GLN 76 HB2 GLN 76 -13.583 5.053 -2.689 633 HB3 GLN 76 HB3 GLN 76 -13.264 6.645 -2.028 634 HG2 GLN 76 HG2 GLN 76 -11.415 5.040 -3.842 635 HG3 GLN 76 HG3 GLN 76 -12.415 6.396 -4.309 636 HE21 GLN 76 HE21 GLN 76 -8.789 7.122 -2.597 637 HE22 GLN 76 HE22 GLN 76 -9.463 5.478 -2.555 638 H TYR 77 H TYR 77 -13.000 2.603 -1.155 639 HA TYR 77 HA TYR 77 -10.407 1.556 -2.141 640 HB2 TYR 77 HB2 TYR 77 -10.587 1.118 0.240 641 HB3 TYR 77 HB3 TYR 77 -12.093 0.199 -0.020 642 HD1 TYR 77 HD1 TYR 77 -8.593 0.536 -0.951 643 HD2 TYR 77 HD2 TYR 77 -11.847 -2.222 -0.661 644 HE1 TYR 77 HE1 TYR 77 -7.074 -1.264 -1.716 645 HE2 TYR 77 HE2 TYR 77 -10.372 -4.048 -1.405 646 HH TYR 77 HH TYR 77 -6.920 -3.513 -2.241 647 HA PRO 78 HA PRO 78 -9.467 0.451 -3.654 648 HB2 PRO 78 HB2 PRO 78 -9.280 0.052 -6.321 649 HB3 PRO 78 HB3 PRO 78 -9.421 -1.302 -5.160 650 HG2 PRO 78 HG2 PRO 78 -11.648 0.003 -6.765 651 HG3 PRO 78 HG3 PRO 78 -11.263 -1.744 -6.632 652 HD2 PRO 78 HD2 PRO 78 -13.172 -0.571 -5.080 653 HD3 PRO 78 HD3 PRO 78 -12.115 -1.858 -4.431 654 H GLY 79 H GLY 79 -8.294 2.117 -4.962 655 HA2 GLY 79 HA2 GLY 79 -9.785 4.160 -6.432 656 HA3 GLY 79 HA3 GLY 79 -9.256 4.700 -4.840 657 H ILE 80 H ILE 80 -7.925 6.311 -5.876 658 HA ILE 80 HA ILE 80 -5.622 5.419 -7.471 659 HB ILE 80 HB ILE 80 -6.762 7.563 -7.912 660 HG12 ILE 80 HG12 ILE 80 -4.829 9.009 -8.191 661 HG13 ILE 80 HG13 ILE 80 -3.892 8.075 -7.030 662 HG21 ILE 80 HG21 ILE 80 -5.556 8.563 -5.290 663 HG22 ILE 80 HG22 ILE 80 -6.443 9.521 -6.481 664 HG23 ILE 80 HG23 ILE 80 -7.292 8.266 -5.572 665 HD11 ILE 80 HD11 ILE 80 -4.932 6.981 -9.681 666 HD12 ILE 80 HD12 ILE 80 -3.301 7.631 -9.412 667 HD13 ILE 80 HD13 ILE 80 -3.810 6.170 -8.556 668 H ALA 81 H ALA 81 -6.375 6.072 -4.104 669 HA ALA 81 HA ALA 81 -3.604 6.281 -3.343 670 HB1 ALA 81 HB1 ALA 81 -6.079 5.981 -1.638 671 HB2 ALA 81 HB2 ALA 81 -4.412 6.306 -1.071 672 HB3 ALA 81 HB3 ALA 81 -5.259 7.502 -2.086 673 H VAL 82 H VAL 82 -5.919 3.530 -3.459 674 HA VAL 82 HA VAL 82 -3.542 1.765 -3.271 675 HB VAL 82 HB VAL 82 -4.424 1.883 -1.032 676 HG11 VAL 82 HG11 VAL 82 -7.070 1.131 -2.171 677 HG12 VAL 82 HG12 VAL 82 -6.622 1.260 -0.435 678 HG13 VAL 82 HG13 VAL 82 -6.645 2.684 -1.448 679 HG21 VAL 82 HG21 VAL 82 -3.531 -0.234 -1.886 680 HG22 VAL 82 HG22 VAL 82 -4.814 -0.496 -0.699 681 HG23 VAL 82 HG23 VAL 82 -5.132 -0.719 -2.437 682 H GLU 83 H GLU 83 -3.542 0.377 -4.901 683 HA GLU 83 HA GLU 83 -6.040 -0.503 -6.259 684 HB2 GLU 83 HB2 GLU 83 -4.283 1.517 -7.230 685 HB3 GLU 83 HB3 GLU 83 -3.845 0.074 -8.131 686 HG2 GLU 83 HG2 GLU 83 -6.694 1.121 -7.856 687 HG3 GLU 83 HG3 GLU 83 -5.600 1.569 -9.165 688 H THR 84 H THR 84 -5.837 -2.388 -7.590 689 HA THR 84 HA THR 84 -3.572 -4.170 -6.752 690 HB THR 84 HB THR 84 -6.134 -5.173 -7.878 691 HG1 THR 84 HG1 THR 84 -6.543 -4.015 -5.871 692 HG21 THR 84 HG21 THR 84 -3.978 -6.373 -6.124 693 HG22 THR 84 HG22 THR 84 -5.428 -7.228 -6.722 694 HG23 THR 84 HG23 THR 84 -4.215 -6.649 -7.865 695 H VAL 85 H VAL 85 -2.488 -3.031 -8.302 696 HA VAL 85 HA VAL 85 -1.411 -2.821 -10.382 697 HB VAL 85 HB VAL 85 -0.415 -5.168 -10.753 698 HG11 VAL 85 HG11 VAL 85 -0.231 -3.705 -8.079 699 HG12 VAL 85 HG12 VAL 85 0.991 -4.800 -8.728 700 HG13 VAL 85 HG13 VAL 85 0.648 -3.292 -9.566 701 HG21 VAL 85 HG21 VAL 85 -2.238 -6.462 -9.549 702 HG22 VAL 85 HG22 VAL 85 -0.599 -6.761 -8.981 703 HG23 VAL 85 HG23 VAL 85 -1.680 -5.719 -8.050 704 H THR 86 H THR 86 -3.107 -5.857 -10.971 705 HA THR 86 HA THR 86 -4.572 -4.619 -13.113 706 HB THR 86 HB THR 86 -4.409 -6.650 -14.624 707 HG1 THR 86 HG1 THR 86 -2.612 -7.918 -14.468 708 HG21 THR 86 HG21 THR 86 -1.745 -5.258 -14.265 709 HG22 THR 86 HG22 THR 86 -2.436 -5.876 -15.787 710 HG23 THR 86 HG23 THR 86 -3.135 -4.436 -14.998 711 H ASP 87 H ASP 87 -3.882 -7.657 -11.446 712 HA ASP 87 HA ASP 87 -6.756 -7.925 -10.698 713 HB2 ASP 87 HB2 ASP 87 -6.652 -8.947 -12.935 714 HB3 ASP 87 HB3 ASP 87 -5.333 -9.985 -12.401 715 H SER 88 H SER 88 -4.000 -10.235 -10.816 716 HA SER 88 HA SER 88 -4.371 -11.398 -8.370 717 HB2 SER 88 HB2 SER 88 -2.515 -11.854 -10.043 718 HB3 SER 88 HB3 SER 88 -1.534 -10.711 -9.135 719 HG SER 88 HG SER 88 -1.622 -13.062 -8.597 720 H SER 89 H SER 89 -3.965 -11.152 -6.381 721 HA SER 89 HA SER 89 -3.525 -8.482 -5.274 722 HB2 SER 89 HB2 SER 89 -5.384 -10.039 -4.895 723 HB3 SER 89 HB3 SER 89 -4.281 -11.128 -4.036 724 HG SER 89 HG SER 89 -3.882 -9.368 -2.554 725 H ARG 90 H ARG 90 -1.367 -10.952 -5.993 726 HA ARG 90 HA ARG 90 0.331 -11.117 -3.700 727 HB2 ARG 90 HB2 ARG 90 0.387 -12.503 -5.818 728 HB3 ARG 90 HB3 ARG 90 1.129 -11.131 -6.648 729 HG2 ARG 90 HG2 ARG 90 3.042 -11.248 -5.012 730 HG3 ARG 90 HG3 ARG 90 2.294 -12.669 -4.279 731 HD2 ARG 90 HD2 ARG 90 3.295 -12.424 -7.154 732 HD3 ARG 90 HD3 ARG 90 4.134 -13.221 -5.838 733 HE ARG 90 HE ARG 90 2.607 -15.028 -5.881 734 HH11 ARG 90 HH11 ARG 90 1.254 -16.429 -7.051 735 HH12 ARG 90 HH12 ARG 90 0.431 -15.827 -8.481 736 HH21 ARG 90 HH21 ARG 90 1.844 -12.754 -8.457 737 HH22 ARG 90 HH22 ARG 90 0.594 -13.811 -9.090 738 H TYR 91 H TYR 91 -0.118 -8.571 -6.021 739 HA TYR 91 HA TYR 91 1.808 -6.796 -4.601 740 HB2 TYR 91 HB2 TYR 91 1.165 -6.708 -7.560 741 HB3 TYR 91 HB3 TYR 91 2.395 -5.774 -6.733 742 HD1 TYR 91 HD1 TYR 91 1.573 -8.832 -8.457 743 HD2 TYR 91 HD2 TYR 91 4.463 -6.985 -5.843 744 HE1 TYR 91 HE1 TYR 91 3.189 -10.608 -9.015 745 HE2 TYR 91 HE2 TYR 91 6.080 -8.830 -6.347 746 HH TYR 91 HH TYR 91 5.263 -11.483 -8.611 747 H PHE 92 H PHE 92 1.380 -4.526 -4.920 748 HA PHE 92 HA PHE 92 -1.360 -3.647 -5.657 749 HB2 PHE 92 HB2 PHE 92 -0.074 -3.125 -2.943 750 HB3 PHE 92 HB3 PHE 92 -1.468 -2.260 -3.564 751 HD1 PHE 92 HD1 PHE 92 -3.639 -3.402 -3.959 752 HD2 PHE 92 HD2 PHE 92 -0.323 -5.345 -2.005 753 HE1 PHE 92 HE1 PHE 92 -5.182 -5.112 -3.062 754 HE2 PHE 92 HE2 PHE 92 -1.894 -7.047 -1.082 755 HZ PHE 92 HZ PHE 92 -4.293 -6.989 -1.669 756 H VAL 93 H VAL 93 -1.442 -1.229 -5.645 757 HA VAL 93 HA VAL 93 1.182 0.152 -5.642 758 HB VAL 93 HB VAL 93 -1.028 0.693 -7.666 759 HG11 VAL 93 HG11 VAL 93 1.549 2.221 -7.086 760 HG12 VAL 93 HG12 VAL 93 0.554 2.434 -8.531 761 HG13 VAL 93 HG13 VAL 93 -0.118 2.836 -6.959 762 HG21 VAL 93 HG21 VAL 93 1.855 -0.252 -7.980 763 HG22 VAL 93 HG22 VAL 93 0.378 -1.171 -8.356 764 HG23 VAL 93 HG23 VAL 93 0.807 0.251 -9.310 765 H ILE 94 H ILE 94 1.153 2.032 -4.420 766 HA ILE 94 HA ILE 94 -1.492 3.131 -3.690 767 HB ILE 94 HB ILE 94 -0.858 3.569 -1.390 768 HG12 ILE 94 HG12 ILE 94 1.679 1.948 -1.908 769 HG13 ILE 94 HG13 ILE 94 1.637 3.700 -1.788 770 HG21 ILE 94 HG21 ILE 94 -1.039 1.319 -0.503 771 HG22 ILE 94 HG22 ILE 94 -1.968 1.406 -1.979 772 HG23 ILE 94 HG23 ILE 94 -0.391 0.603 -1.989 773 HD11 ILE 94 HD11 ILE 94 2.333 2.775 0.353 774 HD12 ILE 94 HD12 ILE 94 0.740 3.528 0.523 775 HD13 ILE 94 HD13 ILE 94 0.880 1.771 0.434 776 H ARG 95 H ARG 95 -1.579 5.335 -3.236 777 HA ARG 95 HA ARG 95 0.669 6.973 -4.360 778 HB2 ARG 95 HB2 ARG 95 -1.512 7.324 -5.398 779 HB3 ARG 95 HB3 ARG 95 -2.225 7.746 -3.855 780 HG2 ARG 95 HG2 ARG 95 0.156 9.330 -4.871 781 HG3 ARG 95 HG3 ARG 95 -1.462 9.620 -5.522 782 HD2 ARG 95 HD2 ARG 95 -2.331 9.964 -3.208 783 HD3 ARG 95 HD3 ARG 95 -0.696 9.804 -2.586 784 HE ARG 95 HE ARG 95 -0.162 11.930 -3.245 785 HH11 ARG 95 HH11 ARG 95 -0.495 13.930 -3.869 786 HH12 ARG 95 HH12 ARG 95 -1.933 14.393 -4.758 787 HH21 ARG 95 HH21 ARG 95 -3.235 11.201 -4.796 788 HH22 ARG 95 HH22 ARG 95 -3.458 12.861 -5.273 789 H ILE 96 H ILE 96 2.091 7.471 -2.879 790 HA ILE 96 HA ILE 96 1.290 8.011 -0.060 791 HB ILE 96 HB ILE 96 3.736 7.925 0.397 792 HG12 ILE 96 HG12 ILE 96 4.047 6.711 -2.378 793 HG13 ILE 96 HG13 ILE 96 4.418 8.407 -2.030 794 HG21 ILE 96 HG21 ILE 96 2.470 5.447 -0.807 795 HG22 ILE 96 HG22 ILE 96 3.883 5.428 0.248 796 HG23 ILE 96 HG23 ILE 96 2.350 6.001 0.879 797 HD11 ILE 96 HD11 ILE 96 5.758 6.011 -0.757 798 HD12 ILE 96 HD12 ILE 96 6.439 7.114 -1.964 799 HD13 ILE 96 HD13 ILE 96 6.052 7.714 -0.331 800 H GLN 97 H GLN 97 2.151 9.813 1.048 801 HA GLN 97 HA GLN 97 3.096 12.124 -0.566 802 HB2 GLN 97 HB2 GLN 97 1.542 12.290 1.501 803 HB3 GLN 97 HB3 GLN 97 2.985 11.987 2.463 804 HG2 GLN 97 HG2 GLN 97 2.787 14.214 0.373 805 HG3 GLN 97 HG3 GLN 97 2.233 14.418 2.026 806 HE21 GLN 97 HE21 GLN 97 5.558 15.814 2.204 807 HE22 GLN 97 HE22 GLN 97 4.034 16.228 1.425 808 H ASP 98 H ASP 98 5.318 12.381 -0.899 809 HA ASP 98 HA ASP 98 6.789 9.918 -0.328 810 HB2 ASP 98 HB2 ASP 98 6.431 11.032 -2.607 811 HB3 ASP 98 HB3 ASP 98 7.651 12.199 -2.091 812 H GLY 99 H GLY 99 6.571 12.434 1.552 813 HA2 GLY 99 HA2 GLY 99 7.761 12.950 3.455 814 HA3 GLY 99 HA3 GLY 99 9.030 11.832 2.958 815 H THR 100 H THR 100 8.597 14.045 0.470 816 HA THR 100 HA THR 100 10.559 16.003 1.550 817 HB THR 100 HB THR 100 11.739 14.270 0.341 818 HG1 THR 100 HG1 THR 100 11.749 16.827 -0.859 819 HG21 THR 100 HG21 THR 100 10.286 15.308 -2.111 820 HG22 THR 100 HG22 THR 100 11.648 14.163 -2.094 821 HG23 THR 100 HG23 THR 100 10.098 13.699 -1.372 822 H GLY 101 H GLY 101 7.675 16.225 1.219 823 HA2 GLY 101 HA2 GLY 101 6.393 18.169 0.972 824 HA3 GLY 101 HA3 GLY 101 7.675 18.919 0.020 825 H ARG 102 H ARG 102 6.577 15.739 -0.837 826 HA ARG 102 HA ARG 102 4.878 16.670 -3.094 827 HB2 ARG 102 HB2 ARG 102 6.235 15.687 -4.746 828 HB3 ARG 102 HB3 ARG 102 7.342 16.619 -3.717 829 HG2 ARG 102 HG2 ARG 102 7.983 14.485 -2.575 830 HG3 ARG 102 HG3 ARG 102 6.959 13.604 -3.733 831 HD2 ARG 102 HD2 ARG 102 8.299 14.498 -5.610 832 HD3 ARG 102 HD3 ARG 102 9.341 15.344 -4.448 833 HE ARG 102 HE ARG 102 9.101 12.436 -3.993 834 HH11 ARG 102 HH11 ARG 102 10.740 11.207 -4.082 835 HH12 ARG 102 HH12 ARG 102 12.253 11.673 -4.871 836 HH21 ARG 102 HH21 ARG 102 11.037 14.805 -5.729 837 HH22 ARG 102 HH22 ARG 102 12.398 13.719 -5.796 838 H SER 103 H SER 103 4.133 14.695 -4.399 839 HA SER 103 HA SER 103 3.602 12.339 -2.623 840 HB2 SER 103 HB2 SER 103 1.990 13.408 -4.982 841 HB3 SER 103 HB3 SER 103 1.699 11.851 -4.196 842 HG SER 103 HG SER 103 1.697 14.333 -2.800 843 H ALA 104 H ALA 104 3.558 10.257 -3.664 844 HA ALA 104 HA ALA 104 4.673 9.966 -6.367 845 HB1 ALA 104 HB1 ALA 104 6.718 10.023 -4.989 846 HB2 ALA 104 HB2 ALA 104 6.060 8.742 -3.943 847 HB3 ALA 104 HB3 ALA 104 6.442 8.399 -5.642 848 H PHE 105 H PHE 105 4.209 7.970 -7.337 849 HA PHE 105 HA PHE 105 2.366 6.159 -5.865 850 HB2 PHE 105 HB2 PHE 105 3.264 5.993 -8.749 851 HB3 PHE 105 HB3 PHE 105 1.971 5.086 -7.971 852 HD1 PHE 105 HD1 PHE 105 -0.038 6.439 -6.991 853 HD2 PHE 105 HD2 PHE 105 2.827 8.106 -9.752 854 HE1 PHE 105 HE1 PHE 105 -1.634 8.247 -7.572 855 HE2 PHE 105 HE2 PHE 105 1.256 9.946 -10.272 856 HZ PHE 105 HZ PHE 105 -1.005 10.006 -9.193 857 H ILE 106 H ILE 106 3.027 4.282 -5.021 858 HA ILE 106 HA ILE 106 5.605 3.099 -5.957 859 HB ILE 106 HB ILE 106 6.035 2.173 -3.735 860 HG12 ILE 106 HG12 ILE 106 4.039 4.215 -2.644 861 HG13 ILE 106 HG13 ILE 106 3.719 2.487 -2.768 862 HG21 ILE 106 HG21 ILE 106 5.958 5.239 -3.729 863 HG22 ILE 106 HG22 ILE 106 7.154 4.195 -2.937 864 HG23 ILE 106 HG23 ILE 106 7.091 4.302 -4.704 865 HD11 ILE 106 HD11 ILE 106 4.405 3.110 -0.499 866 HD12 ILE 106 HD12 ILE 106 5.506 1.943 -1.236 867 HD13 ILE 106 HD13 ILE 106 5.972 3.656 -1.097 868 H GLY 107 H GLY 107 5.654 1.068 -6.457 869 HA2 GLY 107 HA2 GLY 107 3.263 -0.638 -6.289 870 HA3 GLY 107 HA3 GLY 107 4.814 -1.042 -7.030 871 H ILE 108 H ILE 108 3.084 -2.388 -4.937 872 HA ILE 108 HA ILE 108 5.196 -2.786 -2.872 873 HB ILE 108 HB ILE 108 2.239 -3.231 -2.367 874 HG12 ILE 108 HG12 ILE 108 3.960 -0.767 -1.846 875 HG13 ILE 108 HG13 ILE 108 2.427 -0.860 -2.716 876 HG21 ILE 108 HG21 ILE 108 3.842 -4.546 -0.992 877 HG22 ILE 108 HG22 ILE 108 4.634 -3.028 -0.510 878 HG23 ILE 108 HG23 ILE 108 2.959 -3.394 -0.030 879 HD11 ILE 108 HD11 ILE 108 2.866 -1.135 0.275 880 HD12 ILE 108 HD12 ILE 108 2.001 0.124 -0.595 881 HD13 ILE 108 HD13 ILE 108 1.315 -1.515 -0.543 882 H GLY 109 H GLY 109 5.697 -4.952 -2.421 883 HA2 GLY 109 HA2 GLY 109 4.021 -7.126 -3.576 884 HA3 GLY 109 HA3 GLY 109 5.773 -7.202 -3.764 885 H PHE 110 H PHE 110 3.606 -8.716 -2.222 886 HA PHE 110 HA PHE 110 4.643 -8.558 0.559 887 HB2 PHE 110 HB2 PHE 110 2.146 -9.557 -0.758 888 HB3 PHE 110 HB3 PHE 110 2.584 -10.176 0.828 889 HD1 PHE 110 HD1 PHE 110 1.630 -7.089 -1.028 890 HD2 PHE 110 HD2 PHE 110 2.517 -8.832 2.817 891 HE1 PHE 110 HE1 PHE 110 0.803 -5.031 0.108 892 HE2 PHE 110 HE2 PHE 110 1.651 -6.811 3.941 893 HZ PHE 110 HZ PHE 110 0.847 -4.879 2.579 894 H THR 111 H THR 111 5.036 -10.401 1.797 895 HA THR 111 HA THR 111 6.762 -12.320 0.472 896 HB THR 111 HB THR 111 7.136 -11.144 2.655 897 HG1 THR 111 HG1 THR 111 8.472 -12.807 2.125 898 HG21 THR 111 HG21 THR 111 6.347 -12.180 4.712 899 HG22 THR 111 HG22 THR 111 4.976 -11.587 3.760 900 HG23 THR 111 HG23 THR 111 5.355 -13.326 3.798 901 H ASP 112 H ASP 112 3.487 -12.362 1.596 902 HA ASP 112 HA ASP 112 3.149 -15.156 0.656 903 HB2 ASP 112 HB2 ASP 112 3.397 -14.982 3.228 904 HB3 ASP 112 HB3 ASP 112 1.829 -14.159 3.206 905 H ARG 113 H ARG 113 1.123 -15.643 -0.219 906 HA ARG 113 HA ARG 113 -0.500 -13.617 -1.398 907 HB2 ARG 113 HB2 ARG 113 -0.380 -16.034 -2.111 908 HB3 ARG 113 HB3 ARG 113 -1.214 -16.487 -0.628 909 HG2 ARG 113 HG2 ARG 113 -2.925 -16.493 -2.226 910 HG3 ARG 113 HG3 ARG 113 -3.152 -14.957 -1.414 911 HD2 ARG 113 HD2 ARG 113 -3.400 -14.436 -3.658 912 HD3 ARG 113 HD3 ARG 113 -1.739 -13.919 -3.329 913 HE ARG 113 HE ARG 113 -1.403 -16.516 -4.177 914 HH11 ARG 113 HH11 ARG 113 -1.408 -17.409 -6.285 915 HH12 ARG 113 HH12 ARG 113 -2.122 -16.413 -7.565 916 HH21 ARG 113 HH21 ARG 113 -3.047 -13.816 -5.765 917 HH22 ARG 113 HH22 ARG 113 -2.933 -14.654 -7.317 918 H GLY 114 H GLY 114 -0.910 -15.384 1.691 919 HA2 GLY 114 HA2 GLY 114 -3.492 -14.267 2.354 920 HA3 GLY 114 HA3 GLY 114 -2.364 -15.085 3.445 921 H ASP 115 H ASP 115 -0.121 -13.262 3.062 922 HA ASP 115 HA ASP 115 -0.861 -11.142 4.883 923 HB2 ASP 115 HB2 ASP 115 1.670 -11.694 3.321 924 HB3 ASP 115 HB3 ASP 115 1.473 -10.305 4.382 925 H ALA 116 H ALA 116 -0.532 -11.276 1.346 926 HA ALA 116 HA ALA 116 -1.045 -8.423 1.028 927 HB1 ALA 116 HB1 ALA 116 0.143 -10.225 -0.540 928 HB2 ALA 116 HB2 ALA 116 -1.491 -10.417 -1.165 929 HB3 ALA 116 HB3 ALA 116 -0.711 -8.810 -1.183 930 H PHE 117 H PHE 117 -3.072 -11.405 0.812 931 HA PHE 117 HA PHE 117 -5.492 -10.057 0.120 932 HB2 PHE 117 HB2 PHE 117 -4.887 -12.566 0.087 933 HB3 PHE 117 HB3 PHE 117 -5.323 -12.577 1.790 934 HD1 PHE 117 HD1 PHE 117 -6.525 -12.486 -1.694 935 HD2 PHE 117 HD2 PHE 117 -7.720 -12.090 2.445 936 HE1 PHE 117 HE1 PHE 117 -8.866 -12.851 -2.333 937 HE2 PHE 117 HE2 PHE 117 -10.092 -12.404 1.772 938 HZ PHE 117 HZ PHE 117 -10.676 -12.729 -0.616 939 H ASP 118 H ASP 118 -3.863 -10.406 3.259 940 HA ASP 118 HA ASP 118 -6.015 -9.303 4.868 941 HB2 ASP 118 HB2 ASP 118 -3.044 -9.677 5.242 942 HB3 ASP 118 HB3 ASP 118 -4.018 -8.809 6.422 943 H PHE 119 H PHE 119 -3.244 -7.874 3.049 944 HA PHE 119 HA PHE 119 -3.607 -5.226 3.964 945 HB2 PHE 119 HB2 PHE 119 -1.598 -5.851 2.837 946 HB3 PHE 119 HB3 PHE 119 -2.451 -6.341 1.394 947 HD1 PHE 119 HD1 PHE 119 -3.526 -4.683 -0.089 948 HD2 PHE 119 HD2 PHE 119 -0.938 -3.543 3.109 949 HE1 PHE 119 HE1 PHE 119 -3.327 -2.382 -1.080 950 HE2 PHE 119 HE2 PHE 119 -0.824 -1.242 2.223 951 HZ PHE 119 HZ PHE 119 -2.004 -0.657 0.112 952 H ASN 120 H ASN 120 -5.084 -6.942 1.196 953 HA ASN 120 HA ASN 120 -6.860 -4.817 0.395 954 HB2 ASN 120 HB2 ASN 120 -6.616 -6.343 -1.250 955 HB3 ASN 120 HB3 ASN 120 -6.519 -7.739 -0.149 956 HD21 ASN 120 HD21 ASN 120 -10.138 -6.581 -1.588 957 HD22 ASN 120 HD22 ASN 120 -8.779 -5.444 -1.634 958 H VAL 121 H VAL 121 -7.555 -7.706 2.482 959 HA VAL 121 HA VAL 121 -10.251 -6.926 2.856 960 HB VAL 121 HB VAL 121 -8.441 -8.879 4.228 961 HG11 VAL 121 HG11 VAL 121 -10.415 -9.860 5.401 962 HG12 VAL 121 HG12 VAL 121 -9.988 -8.274 6.037 963 HG13 VAL 121 HG13 VAL 121 -11.376 -8.440 4.934 964 HG21 VAL 121 HG21 VAL 121 -10.949 -9.192 2.524 965 HG22 VAL 121 HG22 VAL 121 -9.276 -9.422 1.976 966 HG23 VAL 121 HG23 VAL 121 -9.961 -10.514 3.183 967 H SER 122 H SER 122 -7.403 -6.030 4.784 968 HA SER 122 HA SER 122 -8.721 -4.809 6.987 969 HB2 SER 122 HB2 SER 122 -6.247 -5.117 6.700 970 HB3 SER 122 HB3 SER 122 -6.255 -3.799 5.514 971 HG SER 122 HG SER 122 -7.240 -2.503 7.263 972 H LEU 123 H LEU 123 -8.406 -3.716 3.628 973 HA LEU 123 HA LEU 123 -9.557 -1.055 4.235 974 HB2 LEU 123 HB2 LEU 123 -8.552 -2.324 1.668 975 HB3 LEU 123 HB3 LEU 123 -9.123 -0.667 1.820 976 HG LEU 123 HG LEU 123 -6.824 -1.671 3.553 977 HD11 LEU 123 HD11 LEU 123 -6.630 -0.480 0.789 978 HD12 LEU 123 HD12 LEU 123 -5.268 -0.832 1.883 979 HD13 LEU 123 HD13 LEU 123 -6.241 -2.146 1.222 980 HD21 LEU 123 HD21 LEU 123 -7.566 1.098 2.524 981 HD22 LEU 123 HD22 LEU 123 -7.892 0.488 4.162 982 HD23 LEU 123 HD23 LEU 123 -6.225 0.691 3.617 983 H GLN 124 H GLN 124 -10.476 -4.090 2.537 984 HA GLN 124 HA GLN 124 -13.052 -3.323 1.636 985 HB2 GLN 124 HB2 GLN 124 -12.192 -5.978 2.856 986 HB3 GLN 124 HB3 GLN 124 -13.692 -5.729 1.994 987 HG2 GLN 124 HG2 GLN 124 -11.017 -5.235 0.642 988 HG3 GLN 124 HG3 GLN 124 -11.731 -6.834 0.762 989 HE21 GLN 124 HE21 GLN 124 -13.471 -6.223 -2.238 990 HE22 GLN 124 HE22 GLN 124 -12.494 -7.328 -1.287 991 H ASP 125 H ASP 125 -12.208 -4.745 4.860 992 HA ASP 125 HA ASP 125 -14.894 -4.316 5.892 993 HB2 ASP 125 HB2 ASP 125 -13.239 -6.144 6.536 994 HB3 ASP 125 HB3 ASP 125 -12.324 -4.899 7.406 995 H HIS 126 H HIS 126 -12.332 -2.123 5.471 996 HA HIS 126 HA HIS 126 -13.177 -0.350 7.696 997 HB2 HIS 126 HB2 HIS 126 -10.813 -0.343 7.132 998 HB3 HIS 126 HB3 HIS 126 -11.183 0.125 5.467 999 HD2 HIS 126 HD2 HIS 126 -11.888 1.534 9.063 1000 HE1 HIS 126 HE1 HIS 126 -11.411 4.848 6.437 1001 HE2 HIS 126 HE2 HIS 126 -11.883 4.170 8.831 1002 H PHE 127 H PHE 127 -13.478 -0.556 4.114 1003 HA PHE 127 HA PHE 127 -15.339 1.714 4.227 1004 HB2 PHE 127 HB2 PHE 127 -14.101 0.267 1.901 1005 HB3 PHE 127 HB3 PHE 127 -15.343 1.501 1.722 1006 HD1 PHE 127 HD1 PHE 127 -11.812 0.915 2.389 1007 HD2 PHE 127 HD2 PHE 127 -14.948 3.880 2.590 1008 HE1 PHE 127 HE1 PHE 127 -10.110 2.692 2.639 1009 HE2 PHE 127 HE2 PHE 127 -13.241 5.648 2.860 1010 HZ PHE 127 HZ PHE 127 -10.825 5.063 2.885 1011 H LYS 128 H LYS 128 -15.789 -1.693 4.405 1012 HA LYS 128 HA LYS 128 -18.271 -1.926 3.128 1013 HB2 LYS 128 HB2 LYS 128 -18.599 -3.963 4.184 1014 HB3 LYS 128 HB3 LYS 128 -16.881 -3.794 3.972 1015 HG2 LYS 128 HG2 LYS 128 -16.912 -4.630 6.085 1016 HG3 LYS 128 HG3 LYS 128 -16.968 -2.905 6.498 1017 HD2 LYS 128 HD2 LYS 128 -19.528 -3.225 6.557 1018 HD3 LYS 128 HD3 LYS 128 -19.213 -4.950 6.363 1019 HE2 LYS 128 HE2 LYS 128 -18.086 -3.278 8.641 1020 HE3 LYS 128 HE3 LYS 128 -19.672 -4.047 8.719 1021 HZ1 LYS 128 HZ1 LYS 128 -18.569 -6.204 8.368 1022 HZ2 LYS 128 HZ2 LYS 128 -17.092 -5.488 8.368 1023 HZ3 LYS 128 HZ3 LYS 128 -18.007 -5.473 9.715 1024 H TRP 129 H TRP 129 -17.679 -0.350 6.164 1025 HA TRP 129 HA TRP 129 -20.602 0.013 6.656 1026 HB2 TRP 129 HB2 TRP 129 -19.902 0.624 8.929 1027 HB3 TRP 129 HB3 TRP 129 -19.463 -1.007 8.469 1028 HD1 TRP 129 HD1 TRP 129 -16.856 -1.626 8.352 1029 HE1 TRP 129 HE1 TRP 129 -14.756 -0.463 9.087 1030 HE3 TRP 129 HE3 TRP 129 -18.783 3.029 9.201 1031 HZ2 TRP 129 HZ2 TRP 129 -13.968 2.154 10.120 1032 HZ3 TRP 129 HZ3 TRP 129 -17.318 4.867 10.056 1033 HH2 TRP 129 HH2 TRP 129 -14.911 4.433 10.510 1034 H VAL 130 H VAL 130 -18.501 1.514 4.832 1035 HA VAL 130 HA VAL 130 -19.178 4.351 5.553 1036 HB VAL 130 HB VAL 130 -16.759 3.182 4.162 1037 HG11 VAL 130 HG11 VAL 130 -17.424 6.059 4.746 1038 HG12 VAL 130 HG12 VAL 130 -15.762 5.489 4.464 1039 HG13 VAL 130 HG13 VAL 130 -16.939 5.330 3.185 1040 HG21 VAL 130 HG21 VAL 130 -17.009 4.574 6.869 1041 HG22 VAL 130 HG22 VAL 130 -16.731 2.839 6.634 1042 HG23 VAL 130 HG23 VAL 130 -15.498 3.985 6.140 1043 H LYS 131 H LYS 131 -19.049 5.717 3.440 1044 HA LYS 131 HA LYS 131 -19.690 6.317 1.396 1045 HB2 LYS 131 HB2 LYS 131 -17.941 4.113 1.159 1046 HB3 LYS 131 HB3 LYS 131 -19.246 3.711 0.069 1047 HG2 LYS 131 HG2 LYS 131 -17.661 4.853 -1.239 1048 HG3 LYS 131 HG3 LYS 131 -18.941 6.048 -0.963 1049 HD2 LYS 131 HD2 LYS 131 -17.587 7.076 0.844 1050 HD3 LYS 131 HD3 LYS 131 -16.335 5.833 0.624 1051 HE2 LYS 131 HE2 LYS 131 -16.002 6.583 -1.721 1052 HE3 LYS 131 HE3 LYS 131 -17.242 7.823 -1.506 1053 HZ1 LYS 131 HZ1 LYS 131 -15.825 8.842 0.209 1054 HZ2 LYS 131 HZ2 LYS 131 -14.665 7.700 -0.002 1055 HZ3 LYS 131 HZ3 LYS 131 -15.023 8.748 -1.203 1056 H GLN 132 H GLN 132 -21.645 4.549 2.946 1057 HA GLN 132 HA GLN 132 -23.784 3.812 2.841 1058 HB2 GLN 132 HB2 GLN 132 -24.224 6.163 0.977 1059 HB3 GLN 132 HB3 GLN 132 -25.394 5.411 2.063 1060 HG2 GLN 132 HG2 GLN 132 -22.984 7.104 2.810 1061 HG3 GLN 132 HG3 GLN 132 -24.679 7.472 3.073 1062 HE21 GLN 132 HE21 GLN 132 -22.715 5.627 6.019 1063 HE22 GLN 132 HE22 GLN 132 -21.951 6.555 4.739 1064 H GLU 133 H GLU 133 -22.102 2.465 0.963 1065 HA GLU 133 HA GLU 133 -23.897 1.716 -1.241 1066 HB2 GLU 133 HB2 GLU 133 -21.210 0.584 -0.378 1067 HB3 GLU 133 HB3 GLU 133 -22.148 0.025 -1.767 1068 HG2 GLU 133 HG2 GLU 133 -22.072 2.375 -2.697 1069 HG3 GLU 133 HG3 GLU 133 -20.959 2.805 -1.397 1070 H1 SER 149 H1 SER 149 15.657 -21.047 -13.090 1071 H2 SER 149 H2 SER 149 15.996 -19.674 -12.268 1072 H3 SER 149 H3 SER 149 16.247 -19.750 -13.889 1073 HA SER 149 HA SER 149 13.631 -19.905 -12.554 1074 HB2 SER 149 HB2 SER 149 14.716 -17.628 -12.532 1075 HB3 SER 149 HB3 SER 149 14.663 -17.645 -14.307 1076 HG SER 149 HG SER 149 12.835 -16.618 -13.308 1077 H GLN 150 H GLN 150 11.835 -19.555 -14.162 1078 HA GLN 150 HA GLN 150 12.317 -20.530 -16.905 1079 HB2 GLN 150 HB2 GLN 150 12.100 -22.589 -15.469 1080 HB3 GLN 150 HB3 GLN 150 10.464 -22.072 -15.037 1081 HG2 GLN 150 HG2 GLN 150 9.824 -22.177 -17.457 1082 HG3 GLN 150 HG3 GLN 150 11.469 -22.666 -17.861 1083 HE21 GLN 150 HE21 GLN 150 9.596 -25.817 -17.797 1084 HE22 GLN 150 HE22 GLN 150 9.777 -24.404 -18.829 1085 H ILE 151 H ILE 151 9.835 -19.641 -14.464 1086 HA ILE 151 HA ILE 151 8.470 -17.917 -16.472 1087 HB ILE 151 HB ILE 151 7.020 -19.726 -14.498 1088 HG12 ILE 151 HG12 ILE 151 7.279 -20.004 -17.528 1089 HG13 ILE 151 HG13 ILE 151 7.968 -21.085 -16.314 1090 HG21 ILE 151 HG21 ILE 151 5.946 -17.909 -16.711 1091 HG22 ILE 151 HG22 ILE 151 4.971 -18.927 -15.628 1092 HG23 ILE 151 HG23 ILE 151 5.855 -17.575 -14.966 1093 HD11 ILE 151 HD11 ILE 151 6.056 -22.169 -17.193 1094 HD12 ILE 151 HD12 ILE 151 5.655 -21.659 -15.542 1095 HD13 ILE 151 HD13 ILE 151 5.025 -20.756 -16.945 1096 H THR 152 H THR 152 7.923 -15.916 -15.679 1097 HA THR 152 HA THR 152 8.966 -15.100 -13.084 1098 HB THR 152 HB THR 152 7.957 -12.860 -13.777 1099 HG1 THR 152 HG1 THR 152 7.433 -12.697 -15.967 1100 HG21 THR 152 HG21 THR 152 9.708 -12.399 -15.420 1101 HG22 THR 152 HG22 THR 152 10.340 -13.402 -14.108 1102 HG23 THR 152 HG23 THR 152 9.962 -14.142 -15.680 1103 H SER 153 H SER 153 7.870 -14.284 -11.328 1104 HA SER 153 HA SER 153 5.212 -15.352 -10.827 1105 HB2 SER 153 HB2 SER 153 6.984 -13.637 -9.081 1106 HB3 SER 153 HB3 SER 153 5.550 -14.554 -8.566 1107 HG SER 153 HG SER 153 7.521 -15.691 -8.136 1108 H GLN 154 H GLN 154 4.831 -13.747 -12.775 1109 HA GLN 154 HA GLN 154 4.316 -11.018 -12.476 1110 HB2 GLN 154 HB2 GLN 154 2.984 -11.212 -14.508 1111 HB3 GLN 154 HB3 GLN 154 4.477 -12.134 -14.639 1112 HG2 GLN 154 HG2 GLN 154 3.324 -14.234 -14.401 1113 HG3 GLN 154 HG3 GLN 154 1.840 -13.455 -13.854 1114 HE21 GLN 154 HE21 GLN 154 0.709 -12.596 -17.125 1115 HE22 GLN 154 HE22 GLN 154 0.528 -12.237 -15.406 1116 H VAL 155 H VAL 155 2.074 -9.938 -12.754 1117 HA VAL 155 HA VAL 155 0.146 -10.803 -10.757 1118 HB VAL 155 HB VAL 155 -0.675 -9.053 -13.074 1119 HG11 VAL 155 HG11 VAL 155 -1.385 -8.930 -10.081 1120 HG12 VAL 155 HG12 VAL 155 -2.095 -7.967 -11.344 1121 HG13 VAL 155 HG13 VAL 155 -2.345 -9.706 -11.369 1122 HG21 VAL 155 HG21 VAL 155 1.442 -8.022 -12.408 1123 HG22 VAL 155 HG22 VAL 155 0.024 -7.043 -11.983 1124 HG23 VAL 155 HG23 VAL 155 0.862 -7.971 -10.706 1125 H TPO 156 H T2P 156 -1.093 -12.582 -11.055 1126 HA TPO 156 HA T2P 156 -1.801 -14.051 -13.316 1127 HB TPO 156 HB T2P 156 -3.205 -13.480 -10.771 1128 HG21 TPO 156 HG21 T2P 156 -5.097 -13.673 -12.004 1129 HG22 TPO 156 HG22 T2P 156 -4.846 -15.152 -11.077 1130 HG23 TPO 156 HG23 T2P 156 -4.521 -15.174 -12.820 1131 H GLY 157 H GLY 157 -3.540 -14.251 -14.428 1132 HA2 GLY 157 HA2 GLY 157 -5.621 -12.291 -14.876 1133 HA3 GLY 157 HA3 GLY 157 -4.466 -12.286 -16.219 1134 H GLN 158 H GLN 158 -4.077 -15.305 -15.580 1135 HA GLN 158 HA GLN 158 -5.848 -16.414 -17.483 1136 HB2 GLN 158 HB2 GLN 158 -4.698 -18.440 -17.083 1137 HB3 GLN 158 HB3 GLN 158 -3.516 -17.151 -17.016 1138 HG2 GLN 158 HG2 GLN 158 -4.721 -18.561 -14.580 1139 HG3 GLN 158 HG3 GLN 158 -3.203 -18.989 -15.339 1140 HE21 GLN 158 HE21 GLN 158 -2.453 -16.867 -12.354 1141 HE22 GLN 158 HE22 GLN 158 -3.163 -18.454 -12.642 1142 H ILE 159 H ILE 159 -6.406 -15.917 -14.111 1143 HA ILE 159 HA ILE 159 -8.854 -17.603 -14.305 1144 HB ILE 159 HB ILE 159 -7.258 -18.747 -12.919 1145 HG12 ILE 159 HG12 ILE 159 -8.581 -19.080 -10.861 1146 HG13 ILE 159 HG13 ILE 159 -9.553 -17.663 -11.241 1147 HG21 ILE 159 HG21 ILE 159 -6.577 -17.874 -10.672 1148 HG22 ILE 159 HG22 ILE 159 -5.860 -17.033 -12.038 1149 HG23 ILE 159 HG23 ILE 159 -7.214 -16.297 -11.148 1150 HD11 ILE 159 HD11 ILE 159 -9.345 -20.164 -12.982 1151 HD12 ILE 159 HD12 ILE 159 -10.656 -19.813 -11.838 1152 HD13 ILE 159 HD13 ILE 159 -10.435 -18.782 -13.257 1153 H GLY 160 H GLY 160 -7.493 -14.663 -12.829 1154 HA2 GLY 160 HA2 GLY 160 -8.476 -12.550 -12.827 1155 HA3 GLY 160 HA3 GLY 160 -9.902 -13.221 -13.602 1156 H TRP 161 H TRP 161 -8.247 -13.059 -10.418 1157 HA TRP 161 HA TRP 161 -10.821 -13.787 -9.059 1158 HB2 TRP 161 HB2 TRP 161 -9.976 -15.797 -8.272 1159 HB3 TRP 161 HB3 TRP 161 -9.413 -15.762 -9.920 1160 HD1 TRP 161 HD1 TRP 161 -6.751 -14.122 -9.639 1161 HE1 TRP 161 HE1 TRP 161 -4.687 -15.411 -8.702 1162 HE3 TRP 161 HE3 TRP 161 -9.116 -16.838 -6.114 1163 HZ2 TRP 161 HZ2 TRP 161 -4.269 -17.614 -6.910 1164 HZ3 TRP 161 HZ3 TRP 161 -7.869 -18.468 -4.685 1165 HH2 TRP 161 HH2 TRP 161 -5.455 -18.902 -5.107 1166 H ARG 162 H ARG 162 -10.553 -14.293 -6.829 1167 HA ARG 162 HA ARG 162 -8.312 -13.568 -5.184 1168 HB2 ARG 162 HB2 ARG 162 -10.324 -11.509 -5.611 1169 HB3 ARG 162 HB3 ARG 162 -10.330 -12.028 -3.910 1170 HG2 ARG 162 HG2 ARG 162 -7.740 -11.790 -4.064 1171 HG3 ARG 162 HG3 ARG 162 -8.036 -10.954 -5.590 1172 HD2 ARG 162 HD2 ARG 162 -9.609 -9.386 -4.307 1173 HD3 ARG 162 HD3 ARG 162 -9.073 -10.174 -2.820 1174 HE ARG 162 HE ARG 162 -6.806 -9.352 -3.212 1175 HH11 ARG 162 HH11 ARG 162 -5.541 -7.705 -3.668 1176 HH12 ARG 162 HH12 ARG 162 -6.118 -6.357 -4.650 1177 HH21 ARG 162 HH21 ARG 162 -9.200 -7.660 -5.207 1178 HH22 ARG 162 HH22 ARG 162 -8.086 -6.330 -5.439 1179 H ARG 163 H ARG 163 -11.813 -14.206 -5.180 1180 HA ARG 163 HA ARG 163 -11.307 -16.779 -3.809 1181 HB2 ARG 163 HB2 ARG 163 -13.400 -14.754 -2.906 1182 HB3 ARG 163 HB3 ARG 163 -13.475 -16.480 -2.530 1183 HG2 ARG 163 HG2 ARG 163 -11.268 -16.345 -1.389 1184 HG3 ARG 163 HG3 ARG 163 -11.208 -14.616 -1.740 1185 HD2 ARG 163 HD2 ARG 163 -11.934 -14.877 0.539 1186 HD3 ARG 163 HD3 ARG 163 -13.280 -14.269 -0.415 1187 HE ARG 163 HE ARG 163 -14.462 -16.231 -0.051 1188 HH11 ARG 163 HH11 ARG 163 -14.934 -18.151 0.936 1189 HH12 ARG 163 HH12 ARG 163 -13.689 -19.036 1.768 1190 HH21 ARG 163 HH21 ARG 163 -11.195 -16.789 1.096 1191 HH22 ARG 163 HH22 ARG 163 -11.630 -18.294 1.857 Start of MODEL 21 1 H1 GLY -4 H1 GLY -4 13.434 20.898 14.306 2 H2 GLY -4 H2 GLY -4 13.975 21.010 15.849 3 H3 GLY -4 H3 GLY -4 13.266 22.302 15.135 4 HA2 GLY -4 HA2 GLY -4 11.151 21.165 15.017 5 HA3 GLY -4 HA3 GLY -4 11.918 19.755 15.773 6 H SER -3 H SER -3 9.633 21.168 16.786 7 HA SER -3 HA SER -3 10.280 23.000 18.864 8 HB2 SER -3 HB2 SER -3 7.866 21.170 18.582 9 HB3 SER -3 HB3 SER -3 7.980 22.585 19.645 10 HG SER -3 HG SER -3 6.954 23.078 17.642 11 HA PRO -2 HA PRO -2 11.584 20.236 22.134 12 HB2 PRO -2 HB2 PRO -2 11.166 21.734 24.372 13 HB3 PRO -2 HB3 PRO -2 12.407 22.144 23.151 14 HG2 PRO -2 HG2 PRO -2 9.599 23.277 23.398 15 HG3 PRO -2 HG3 PRO -2 11.142 24.174 23.221 16 HD2 PRO -2 HD2 PRO -2 9.543 23.625 21.083 17 HD3 PRO -2 HD3 PRO -2 11.325 23.602 20.943 18 H ASN -1 H ASN -1 8.286 21.469 22.118 19 HA ASN -1 HA ASN -1 7.314 19.344 23.942 20 HB2 ASN -1 HB2 ASN -1 6.560 21.761 24.140 21 HB3 ASN -1 HB3 ASN -1 5.761 21.576 22.578 22 HD21 ASN -1 HD21 ASN -1 3.007 20.920 24.791 23 HD22 ASN -1 HD22 ASN -1 3.830 22.204 23.916 24 H SER 0 H SER 0 5.592 17.913 23.272 25 HA SER 0 HA SER 0 5.982 16.843 20.557 26 HB2 SER 0 HB2 SER 0 4.763 14.922 21.359 27 HB3 SER 0 HB3 SER 0 5.989 15.378 22.551 28 HG SER 0 HG SER 0 4.018 14.975 23.586 29 H MET 1 H MET 1 3.975 15.951 19.442 30 HA MET 1 HA MET 1 2.160 18.136 18.838 31 HB2 MET 1 HB2 MET 1 3.261 16.528 17.210 32 HB3 MET 1 HB3 MET 1 2.101 15.304 17.739 33 HG2 MET 1 HG2 MET 1 0.246 16.701 16.934 34 HG3 MET 1 HG3 MET 1 1.363 18.025 16.579 35 HE1 MET 1 HE1 MET 1 0.273 18.257 14.187 36 HE2 MET 1 HE2 MET 1 0.068 16.897 13.060 37 HE3 MET 1 HE3 MET 1 -0.834 16.926 14.592 38 H ALA 2 H ALA 2 2.002 16.168 21.445 39 HA ALA 2 HA ALA 2 -0.566 15.000 21.444 40 HB1 ALA 2 HB1 ALA 2 1.272 14.477 23.017 41 HB2 ALA 2 HB2 ALA 2 1.096 16.089 23.758 42 HB3 ALA 2 HB3 ALA 2 -0.216 14.899 23.885 43 H THR 3 H THR 3 0.138 18.372 21.575 44 HA THR 3 HA THR 3 -2.269 19.221 22.991 45 HB THR 3 HB THR 3 -1.580 21.480 22.236 46 HG1 THR 3 HG1 THR 3 0.356 21.668 21.091 47 HG21 THR 3 HG21 THR 3 -0.586 20.480 24.301 48 HG22 THR 3 HG22 THR 3 0.779 19.887 23.327 49 HG23 THR 3 HG23 THR 3 0.493 21.634 23.495 50 H GLU 4 H GLU 4 -1.657 18.150 19.842 51 HA GLU 4 HA GLU 4 -3.961 19.574 18.626 52 HB2 GLU 4 HB2 GLU 4 -1.804 19.402 17.395 53 HB3 GLU 4 HB3 GLU 4 -1.964 17.647 17.385 54 HG2 GLU 4 HG2 GLU 4 -2.585 18.608 15.232 55 HG3 GLU 4 HG3 GLU 4 -3.947 17.782 15.951 56 H LEU 5 H LEU 5 -5.695 18.493 17.634 57 HA LEU 5 HA LEU 5 -6.571 16.031 18.975 58 HB2 LEU 5 HB2 LEU 5 -7.828 18.375 18.001 59 HB3 LEU 5 HB3 LEU 5 -8.406 17.100 16.944 60 HG LEU 5 HG LEU 5 -8.461 17.021 19.989 61 HD11 LEU 5 HD11 LEU 5 -10.885 17.453 19.776 62 HD12 LEU 5 HD12 LEU 5 -9.938 18.782 19.089 63 HD13 LEU 5 HD13 LEU 5 -10.712 17.597 18.011 64 HD21 LEU 5 HD21 LEU 5 -8.515 14.746 19.042 65 HD22 LEU 5 HD22 LEU 5 -10.098 15.169 19.701 66 HD23 LEU 5 HD23 LEU 5 -9.829 15.214 17.943 67 H GLU 6 H GLU 6 -4.480 16.239 16.656 68 HA GLU 6 HA GLU 6 -5.573 14.714 14.486 69 HB2 GLU 6 HB2 GLU 6 -2.817 15.637 15.239 70 HB3 GLU 6 HB3 GLU 6 -2.990 14.397 14.003 71 HG2 GLU 6 HG2 GLU 6 -4.493 17.038 13.842 72 HG3 GLU 6 HG3 GLU 6 -2.876 16.805 13.179 73 H TYR 7 H TYR 7 -5.636 12.499 14.146 74 HA TYR 7 HA TYR 7 -3.977 10.668 15.690 75 HB2 TYR 7 HB2 TYR 7 -5.655 9.509 16.826 76 HB3 TYR 7 HB3 TYR 7 -6.024 11.190 17.149 77 HD1 TYR 7 HD1 TYR 7 -7.954 12.300 15.869 78 HD2 TYR 7 HD2 TYR 7 -7.230 8.044 15.798 79 HE1 TYR 7 HE1 TYR 7 -10.257 11.918 15.006 80 HE2 TYR 7 HE2 TYR 7 -9.512 7.665 14.908 81 HH TYR 7 HH TYR 7 -11.790 10.370 14.281 82 H GLU 8 H GLU 8 -4.635 8.381 15.265 83 HA GLU 8 HA GLU 8 -6.260 7.636 13.068 84 HB2 GLU 8 HB2 GLU 8 -4.577 6.479 11.701 85 HB3 GLU 8 HB3 GLU 8 -4.490 8.217 11.556 86 HG2 GLU 8 HG2 GLU 8 -2.642 6.741 13.458 87 HG3 GLU 8 HG3 GLU 8 -2.302 6.814 11.743 88 H SER 9 H SER 9 -6.993 5.655 13.471 89 HA SER 9 HA SER 9 -5.961 4.217 15.827 90 HB2 SER 9 HB2 SER 9 -8.526 4.079 14.231 91 HB3 SER 9 HB3 SER 9 -8.149 2.980 15.582 92 HG SER 9 HG SER 9 -9.353 4.811 16.280 93 H VAL 10 H VAL 10 -4.974 2.158 15.722 94 HA VAL 10 HA VAL 10 -4.159 1.250 13.118 95 HB VAL 10 HB VAL 10 -2.695 1.001 15.009 96 HG11 VAL 10 HG11 VAL 10 -2.962 -0.747 16.685 97 HG12 VAL 10 HG12 VAL 10 -4.322 0.379 16.784 98 HG13 VAL 10 HG13 VAL 10 -4.539 -1.208 16.016 99 HG21 VAL 10 HG21 VAL 10 -2.410 -0.451 13.025 100 HG22 VAL 10 HG22 VAL 10 -1.841 -1.209 14.523 101 HG23 VAL 10 HG23 VAL 10 -3.384 -1.713 13.819 102 H LEU 11 H LEU 11 -4.798 -0.244 11.774 103 HA LEU 11 HA LEU 11 -7.259 -1.846 12.379 104 HB2 LEU 11 HB2 LEU 11 -6.183 -0.818 9.722 105 HB3 LEU 11 HB3 LEU 11 -7.598 -1.839 9.932 106 HG LEU 11 HG LEU 11 -7.305 1.048 10.859 107 HD11 LEU 11 HD11 LEU 11 -7.604 0.792 8.452 108 HD12 LEU 11 HD12 LEU 11 -8.957 -0.335 8.700 109 HD13 LEU 11 HD13 LEU 11 -9.116 1.365 9.164 110 HD21 LEU 11 HD21 LEU 11 -9.735 0.869 11.421 111 HD22 LEU 11 HD22 LEU 11 -9.646 -0.889 11.167 112 HD23 LEU 11 HD23 LEU 11 -8.721 -0.108 12.478 113 H CYS 12 H CYS 12 -4.075 -1.917 10.701 114 HA CYS 12 HA CYS 12 -3.930 -4.821 11.144 115 HB2 CYS 12 HB2 CYS 12 -5.128 -4.477 8.987 116 HB3 CYS 12 HB3 CYS 12 -3.668 -3.716 8.332 117 HG CYS 12 HG CYS 12 -4.113 -6.267 7.570 118 H VAL 13 H VAL 13 -1.894 -5.705 11.038 119 HA VAL 13 HA VAL 13 0.399 -4.037 10.331 120 HB VAL 13 HB VAL 13 0.089 -3.659 12.751 121 HG11 VAL 13 HG11 VAL 13 0.501 -5.332 14.418 122 HG12 VAL 13 HG12 VAL 13 -0.843 -5.873 13.406 123 HG13 VAL 13 HG13 VAL 13 0.774 -6.583 13.194 124 HG21 VAL 13 HG21 VAL 13 2.619 -5.147 11.973 125 HG22 VAL 13 HG22 VAL 13 2.301 -3.392 11.905 126 HG23 VAL 13 HG23 VAL 13 2.412 -4.207 13.462 127 H LYS 14 H LYS 14 1.763 -5.193 9.107 128 HA LYS 14 HA LYS 14 1.680 -8.167 9.323 129 HB2 LYS 14 HB2 LYS 14 1.792 -6.547 6.773 130 HB3 LYS 14 HB3 LYS 14 2.372 -8.190 6.822 131 HG2 LYS 14 HG2 LYS 14 -0.451 -7.379 7.634 132 HG3 LYS 14 HG3 LYS 14 0.029 -7.943 6.031 133 HD2 LYS 14 HD2 LYS 14 0.874 -10.080 7.083 134 HD3 LYS 14 HD3 LYS 14 0.155 -9.555 8.625 135 HE2 LYS 14 HE2 LYS 14 -2.053 -9.425 7.590 136 HE3 LYS 14 HE3 LYS 14 -1.349 -9.806 6.007 137 HZ1 LYS 14 HZ1 LYS 14 -1.447 -11.656 8.325 138 HZ2 LYS 14 HZ2 LYS 14 -2.326 -11.785 6.941 139 HZ3 LYS 14 HZ3 LYS 14 -0.690 -11.979 6.903 140 HA PRO 15 HA PRO 15 5.680 -8.117 10.604 141 HB2 PRO 15 HB2 PRO 15 6.467 -10.715 10.297 142 HB3 PRO 15 HB3 PRO 15 5.093 -10.238 11.338 143 HG2 PRO 15 HG2 PRO 15 4.967 -11.209 8.447 144 HG3 PRO 15 HG3 PRO 15 4.044 -11.829 9.858 145 HD2 PRO 15 HD2 PRO 15 2.985 -10.015 8.187 146 HD3 PRO 15 HD3 PRO 15 2.708 -9.921 9.954 147 H ASP 16 H ASP 16 5.428 -8.874 7.197 148 HA ASP 16 HA ASP 16 8.065 -7.695 6.707 149 HB2 ASP 16 HB2 ASP 16 8.555 -10.124 6.972 150 HB3 ASP 16 HB3 ASP 16 7.389 -10.491 5.701 151 H VAL 17 H VAL 17 8.045 -6.506 4.821 152 HA VAL 17 HA VAL 17 6.240 -7.140 2.624 153 HB VAL 17 HB VAL 17 4.777 -5.806 4.139 154 HG11 VAL 17 HG11 VAL 17 5.082 -3.442 4.472 155 HG12 VAL 17 HG12 VAL 17 6.480 -4.308 5.131 156 HG13 VAL 17 HG13 VAL 17 6.611 -3.461 3.579 157 HG21 VAL 17 HG21 VAL 17 4.442 -5.816 1.685 158 HG22 VAL 17 HG22 VAL 17 3.911 -4.316 2.457 159 HG23 VAL 17 HG23 VAL 17 5.443 -4.349 1.565 160 H SER 18 H SER 18 6.998 -6.351 0.673 161 HA SER 18 HA SER 18 9.522 -4.742 0.750 162 HB2 SER 18 HB2 SER 18 8.730 -6.805 -1.321 163 HB3 SER 18 HB3 SER 18 10.252 -5.903 -1.202 164 HG SER 18 HG SER 18 9.251 -7.839 0.628 165 H VAL 19 H VAL 19 9.842 -3.131 -0.736 166 HA VAL 19 HA VAL 19 7.422 -2.154 -2.201 167 HB VAL 19 HB VAL 19 9.376 -0.637 -0.492 168 HG11 VAL 19 HG11 VAL 19 7.349 0.471 -2.464 169 HG12 VAL 19 HG12 VAL 19 8.159 1.421 -1.208 170 HG13 VAL 19 HG13 VAL 19 9.114 0.726 -2.500 171 HG21 VAL 19 HG21 VAL 19 7.288 0.048 0.626 172 HG22 VAL 19 HG22 VAL 19 6.331 -0.879 -0.538 173 HG23 VAL 19 HG23 VAL 19 7.403 -1.708 0.607 174 H TYR 20 H TYR 20 7.568 -1.324 -4.070 175 HA TYR 20 HA TYR 20 10.110 -1.432 -5.644 176 HB2 TYR 20 HB2 TYR 20 7.380 -2.557 -6.415 177 HB3 TYR 20 HB3 TYR 20 8.860 -2.636 -7.349 178 HD1 TYR 20 HD1 TYR 20 10.441 -4.438 -6.975 179 HD2 TYR 20 HD2 TYR 20 7.114 -3.876 -4.291 180 HE1 TYR 20 HE1 TYR 20 10.824 -6.697 -5.978 181 HE2 TYR 20 HE2 TYR 20 7.581 -6.091 -3.253 182 HH TYR 20 HH TYR 20 8.855 -8.014 -3.331 183 H ARG 21 H ARG 21 10.034 0.972 -5.450 184 HA ARG 21 HA ARG 21 7.963 2.658 -6.267 185 HB2 ARG 21 HB2 ARG 21 10.845 3.244 -6.995 186 HB3 ARG 21 HB3 ARG 21 9.553 4.379 -6.602 187 HG2 ARG 21 HG2 ARG 21 9.594 3.376 -4.219 188 HG3 ARG 21 HG3 ARG 21 11.061 2.522 -4.725 189 HD2 ARG 21 HD2 ARG 21 11.937 4.864 -5.444 190 HD3 ARG 21 HD3 ARG 21 10.612 5.507 -4.461 191 HE ARG 21 HE ARG 21 12.654 3.577 -3.363 192 HH11 ARG 21 HH11 ARG 21 13.697 3.954 -1.692 193 HH12 ARG 21 HH12 ARG 21 13.552 5.452 -0.768 194 HH21 ARG 21 HH21 ARG 21 11.192 6.755 -2.960 195 HH22 ARG 21 HH22 ARG 21 12.098 7.026 -1.497 196 H ILE 22 H ILE 22 7.162 3.514 -8.167 197 HA ILE 22 HA ILE 22 7.920 2.003 -10.632 198 HB ILE 22 HB ILE 22 5.615 1.843 -11.248 199 HG12 ILE 22 HG12 ILE 22 5.062 3.484 -8.756 200 HG13 ILE 22 HG13 ILE 22 4.565 3.796 -10.422 201 HG21 ILE 22 HG21 ILE 22 5.919 0.924 -8.408 202 HG22 ILE 22 HG22 ILE 22 4.965 0.181 -9.678 203 HG23 ILE 22 HG23 ILE 22 6.730 0.144 -9.782 204 HD11 ILE 22 HD11 ILE 22 3.468 1.711 -8.515 205 HD12 ILE 22 HD12 ILE 22 2.640 3.099 -9.241 206 HD13 ILE 22 HD13 ILE 22 3.104 1.721 -10.261 207 HA PRO 23 HA PRO 23 7.854 5.953 -12.721 208 HB2 PRO 23 HB2 PRO 23 8.355 5.122 -15.307 209 HB3 PRO 23 HB3 PRO 23 9.566 5.371 -14.020 210 HG2 PRO 23 HG2 PRO 23 8.412 2.796 -15.026 211 HG3 PRO 23 HG3 PRO 23 10.044 3.133 -14.404 212 HD2 PRO 23 HD2 PRO 23 7.984 1.927 -12.937 213 HD3 PRO 23 HD3 PRO 23 9.405 2.744 -12.233 214 HA PRO 24 HA PRO 24 4.177 5.415 -15.677 215 HB2 PRO 24 HB2 PRO 24 2.561 3.234 -15.731 216 HB3 PRO 24 HB3 PRO 24 4.145 3.268 -16.566 217 HG2 PRO 24 HG2 PRO 24 3.537 2.167 -13.793 218 HG3 PRO 24 HG3 PRO 24 4.360 1.335 -15.155 219 HD2 PRO 24 HD2 PRO 24 5.765 2.587 -13.213 220 HD3 PRO 24 HD3 PRO 24 6.294 2.659 -14.917 221 H ARG 25 H ARG 25 1.855 5.721 -15.546 222 HA ARG 25 HA ARG 25 0.653 5.794 -12.794 223 HB2 ARG 25 HB2 ARG 25 1.236 8.049 -13.484 224 HB3 ARG 25 HB3 ARG 25 0.371 7.844 -15.017 225 HG2 ARG 25 HG2 ARG 25 -1.763 7.594 -13.830 226 HG3 ARG 25 HG3 ARG 25 -0.935 7.656 -12.264 227 HD2 ARG 25 HD2 ARG 25 -0.182 9.960 -12.737 228 HD3 ARG 25 HD3 ARG 25 -0.956 9.915 -14.320 229 HE ARG 25 HE ARG 25 -2.241 10.222 -11.685 230 HH11 ARG 25 HH11 ARG 25 -4.391 10.753 -11.574 231 HH12 ARG 25 HH12 ARG 25 -5.389 10.649 -12.994 232 HH21 ARG 25 HH21 ARG 25 -2.885 9.591 -15.077 233 HH22 ARG 25 HH22 ARG 25 -4.568 10.009 -14.924 234 H ALA 26 H ALA 26 -0.195 5.571 -16.269 235 HA ALA 26 HA ALA 26 -2.553 3.935 -15.479 236 HB1 ALA 26 HB1 ALA 26 -3.220 6.268 -15.306 237 HB2 ALA 26 HB2 ALA 26 -2.673 6.581 -16.969 238 HB3 ALA 26 HB3 ALA 26 -4.039 5.470 -16.674 239 H SER 27 H SER 27 -2.072 2.201 -16.481 240 HA SER 27 HA SER 27 -1.985 2.166 -19.473 241 HB2 SER 27 HB2 SER 27 -0.269 0.830 -18.177 242 HB3 SER 27 HB3 SER 27 -1.604 -0.193 -17.618 243 HG SER 27 HG SER 27 -0.673 0.272 -20.266 244 H ASN 28 H ASN 28 -3.272 -0.575 -19.338 245 HA ASN 28 HA ASN 28 -5.986 0.599 -19.744 246 HB2 ASN 28 HB2 ASN 28 -4.586 -1.846 -20.921 247 HB3 ASN 28 HB3 ASN 28 -6.239 -1.355 -21.285 248 HD21 ASN 28 HD21 ASN 28 -3.176 1.001 -22.722 249 HD22 ASN 28 HD22 ASN 28 -2.933 0.111 -21.223 250 H ARG 29 H ARG 29 -4.466 -2.333 -18.403 251 HA ARG 29 HA ARG 29 -6.845 -3.062 -16.816 252 HB2 ARG 29 HB2 ARG 29 -4.119 -4.223 -17.070 253 HB3 ARG 29 HB3 ARG 29 -5.338 -4.801 -15.904 254 HG2 ARG 29 HG2 ARG 29 -6.872 -5.469 -17.571 255 HG3 ARG 29 HG3 ARG 29 -6.080 -4.495 -18.826 256 HD2 ARG 29 HD2 ARG 29 -5.449 -6.698 -19.241 257 HD3 ARG 29 HD3 ARG 29 -4.061 -5.797 -18.577 258 HE ARG 29 HE ARG 29 -5.667 -7.331 -16.611 259 HH11 ARG 29 HH11 ARG 29 -4.823 -8.860 -15.429 260 HH12 ARG 29 HH12 ARG 29 -3.308 -9.634 -15.818 261 HH21 ARG 29 HH21 ARG 29 -2.843 -7.683 -18.673 262 HH22 ARG 29 HH22 ARG 29 -2.199 -8.953 -17.666 263 H GLY 30 H GLY 30 -3.975 -1.172 -16.473 264 HA2 GLY 30 HA2 GLY 30 -4.491 0.538 -14.648 265 HA3 GLY 30 HA3 GLY 30 -4.265 -0.822 -13.526 266 H TYR 31 H TYR 31 -2.163 -1.452 -13.019 267 HA TYR 31 HA TYR 31 0.058 0.310 -14.042 268 HB2 TYR 31 HB2 TYR 31 -0.472 -1.022 -11.365 269 HB3 TYR 31 HB3 TYR 31 1.106 -0.403 -11.811 270 HD1 TYR 31 HD1 TYR 31 1.582 1.929 -12.099 271 HD2 TYR 31 HD2 TYR 31 -2.316 0.528 -10.858 272 HE1 TYR 31 HE1 TYR 31 1.031 4.210 -11.231 273 HE2 TYR 31 HE2 TYR 31 -2.892 2.823 -10.067 274 HH TYR 31 HH TYR 31 -0.539 5.528 -10.188 275 H ARG 32 H ARG 32 -0.850 -2.998 -13.521 276 HA ARG 32 HA ARG 32 0.168 -4.922 -13.360 277 HB2 ARG 32 HB2 ARG 32 1.684 -4.984 -15.783 278 HB3 ARG 32 HB3 ARG 32 0.198 -5.762 -15.305 279 HG2 ARG 32 HG2 ARG 32 -0.358 -4.765 -17.262 280 HG3 ARG 32 HG3 ARG 32 -1.042 -3.642 -16.101 281 HD2 ARG 32 HD2 ARG 32 0.600 -1.999 -16.544 282 HD3 ARG 32 HD3 ARG 32 1.736 -3.166 -17.206 283 HE ARG 32 HE ARG 32 -0.388 -1.778 -18.629 284 HH11 ARG 32 HH11 ARG 32 -0.627 -1.986 -20.739 285 HH12 ARG 32 HH12 ARG 32 0.152 -3.277 -21.622 286 HH21 ARG 32 HH21 ARG 32 1.649 -4.635 -18.837 287 HH22 ARG 32 HH22 ARG 32 1.423 -4.746 -20.559 288 H ALA 33 H ALA 33 1.521 -5.538 -11.849 289 HA ALA 33 HA ALA 33 4.021 -4.560 -11.171 290 HB1 ALA 33 HB1 ALA 33 4.354 -6.646 -10.004 291 HB2 ALA 33 HB2 ALA 33 2.633 -6.277 -9.919 292 HB3 ALA 33 HB3 ALA 33 3.217 -7.500 -11.064 293 H SER 34 H SER 34 3.310 -7.041 -13.604 294 HA SER 34 HA SER 34 5.834 -7.884 -14.402 295 HB2 SER 34 HB2 SER 34 3.314 -7.400 -16.050 296 HB3 SER 34 HB3 SER 34 4.653 -8.487 -16.500 297 HG SER 34 HG SER 34 2.938 -9.612 -15.563 298 H ASP 35 H ASP 35 4.438 -4.695 -15.041 299 HA ASP 35 HA ASP 35 6.173 -4.170 -17.368 300 HB2 ASP 35 HB2 ASP 35 3.823 -3.374 -17.179 301 HB3 ASP 35 HB3 ASP 35 4.306 -2.320 -15.844 302 H TRP 36 H TRP 36 6.484 -3.947 -13.953 303 HA TRP 36 HA TRP 36 8.928 -2.279 -14.212 304 HB2 TRP 36 HB2 TRP 36 8.221 -1.546 -11.744 305 HB3 TRP 36 HB3 TRP 36 7.829 -0.673 -13.195 306 HD1 TRP 36 HD1 TRP 36 5.357 -0.492 -13.956 307 HE1 TRP 36 HE1 TRP 36 3.117 -0.968 -12.852 308 HE3 TRP 36 HE3 TRP 36 7.013 -3.080 -9.854 309 HZ2 TRP 36 HZ2 TRP 36 2.219 -1.813 -10.232 310 HZ3 TRP 36 HZ3 TRP 36 5.434 -3.661 -8.031 311 HH2 TRP 36 HH2 TRP 36 3.040 -3.018 -8.190 312 H LYS 37 H LYS 37 9.917 -2.585 -11.659 313 HA LYS 37 HA LYS 37 10.875 -5.352 -11.603 314 HB2 LYS 37 HB2 LYS 37 11.235 -2.911 -9.818 315 HB3 LYS 37 HB3 LYS 37 11.880 -4.498 -9.393 316 HG2 LYS 37 HG2 LYS 37 13.222 -4.595 -11.406 317 HG3 LYS 37 HG3 LYS 37 12.528 -3.091 -12.023 318 HD2 LYS 37 HD2 LYS 37 13.622 -1.759 -10.415 319 HD3 LYS 37 HD3 LYS 37 13.948 -3.131 -9.342 320 HE2 LYS 37 HE2 LYS 37 15.529 -4.091 -10.917 321 HE3 LYS 37 HE3 LYS 37 15.178 -2.825 -12.108 322 HZ1 LYS 37 HZ1 LYS 37 16.403 -2.355 -9.435 323 HZ2 LYS 37 HZ2 LYS 37 17.207 -2.333 -10.856 324 HZ3 LYS 37 HZ3 LYS 37 16.086 -1.192 -10.541 325 H LEU 38 H LEU 38 9.459 -6.920 -11.044 326 HA LEU 38 HA LEU 38 7.779 -6.531 -8.623 327 HB2 LEU 38 HB2 LEU 38 6.308 -8.156 -9.330 328 HB3 LEU 38 HB3 LEU 38 6.612 -7.106 -10.698 329 HG LEU 38 HG LEU 38 7.777 -9.907 -10.323 330 HD11 LEU 38 HD11 LEU 38 5.372 -8.839 -11.850 331 HD12 LEU 38 HD12 LEU 38 6.209 -10.303 -12.344 332 HD13 LEU 38 HD13 LEU 38 5.476 -10.236 -10.742 333 HD21 LEU 38 HD21 LEU 38 9.276 -8.641 -11.750 334 HD22 LEU 38 HD22 LEU 38 8.332 -9.723 -12.758 335 HD23 LEU 38 HD23 LEU 38 7.902 -7.999 -12.694 336 H ASP 39 H ASP 39 10.740 -7.884 -9.327 337 HA ASP 39 HA ASP 39 10.614 -9.696 -6.942 338 HB2 ASP 39 HB2 ASP 39 10.594 -10.903 -9.135 339 HB3 ASP 39 HB3 ASP 39 12.127 -10.134 -9.544 340 H GLN 40 H GLN 40 12.005 -6.945 -8.226 341 HA GLN 40 HA GLN 40 14.569 -7.166 -6.721 342 HB2 GLN 40 HB2 GLN 40 14.064 -5.379 -9.097 343 HB3 GLN 40 HB3 GLN 40 15.579 -5.883 -8.376 344 HG2 GLN 40 HG2 GLN 40 15.600 -7.201 -10.215 345 HG3 GLN 40 HG3 GLN 40 14.727 -8.315 -9.178 346 HE21 GLN 40 HE21 GLN 40 13.041 -7.421 -12.619 347 HE22 GLN 40 HE22 GLN 40 14.760 -7.526 -12.264 348 HA PRO 41 HA PRO 41 11.949 -3.864 -4.751 349 HB2 PRO 41 HB2 PRO 41 12.455 -4.333 -2.108 350 HB3 PRO 41 HB3 PRO 41 11.302 -5.294 -3.080 351 HG2 PRO 41 HG2 PRO 41 14.199 -5.949 -2.444 352 HG3 PRO 41 HG3 PRO 41 12.763 -7.010 -2.269 353 HD2 PRO 41 HD2 PRO 41 14.380 -7.131 -4.459 354 HD3 PRO 41 HD3 PRO 41 12.608 -7.342 -4.595 355 H ASP 42 H ASP 42 12.377 -1.943 -3.622 356 HA ASP 42 HA ASP 42 15.233 -1.038 -3.621 357 HB2 ASP 42 HB2 ASP 42 13.671 0.233 -5.037 358 HB3 ASP 42 HB3 ASP 42 12.608 0.498 -3.654 359 H TRP 43 H TRP 43 12.411 -1.495 -1.573 360 HA TRP 43 HA TRP 43 14.055 -1.124 0.850 361 HB2 TRP 43 HB2 TRP 43 13.011 1.063 0.503 362 HB3 TRP 43 HB3 TRP 43 11.441 0.320 0.254 363 HD1 TRP 43 HD1 TRP 43 13.776 1.508 2.951 364 HE1 TRP 43 HE1 TRP 43 12.609 1.437 5.236 365 HE3 TRP 43 HE3 TRP 43 9.575 -1.117 1.649 366 HZ2 TRP 43 HZ2 TRP 43 10.107 0.492 6.318 367 HZ3 TRP 43 HZ3 TRP 43 7.807 -1.587 3.328 368 HH2 TRP 43 HH2 TRP 43 8.055 -0.768 5.660 369 H THR 44 H THR 44 13.358 -2.455 2.594 370 HA THR 44 HA THR 44 10.688 -3.630 2.440 371 HB THR 44 HB THR 44 11.216 -5.797 2.827 372 HG1 THR 44 HG1 THR 44 13.946 -5.207 3.238 373 HG21 THR 44 HG21 THR 44 13.520 -5.141 0.972 374 HG22 THR 44 HG22 THR 44 12.666 -6.695 1.165 375 HG23 THR 44 HG23 THR 44 11.818 -5.300 0.490 376 H GLY 45 H GLY 45 9.824 -4.279 4.373 377 HA2 GLY 45 HA2 GLY 45 11.024 -3.784 6.949 378 HA3 GLY 45 HA3 GLY 45 10.129 -2.379 6.396 379 H ARG 46 H ARG 46 8.342 -2.375 7.494 380 HA ARG 46 HA ARG 46 6.539 -4.758 7.569 381 HB2 ARG 46 HB2 ARG 46 7.528 -3.055 9.882 382 HB3 ARG 46 HB3 ARG 46 5.928 -3.828 9.963 383 HG2 ARG 46 HG2 ARG 46 6.871 -6.001 9.514 384 HG3 ARG 46 HG3 ARG 46 8.482 -5.322 9.280 385 HD2 ARG 46 HD2 ARG 46 8.543 -4.638 11.649 386 HD3 ARG 46 HD3 ARG 46 6.933 -5.361 11.891 387 HE ARG 46 HE ARG 46 8.416 -7.388 10.717 388 HH11 ARG 46 HH11 ARG 46 9.541 -8.973 11.735 389 HH12 ARG 46 HH12 ARG 46 10.103 -8.753 13.368 390 HH21 ARG 46 HH21 ARG 46 8.840 -5.574 13.691 391 HH22 ARG 46 HH22 ARG 46 9.737 -6.860 14.449 392 H LEU 47 H LEU 47 4.344 -4.323 7.887 393 HA LEU 47 HA LEU 47 3.419 -1.766 6.633 394 HB2 LEU 47 HB2 LEU 47 2.827 -3.938 5.532 395 HB3 LEU 47 HB3 LEU 47 2.134 -4.468 7.060 396 HG LEU 47 HG LEU 47 0.506 -2.446 6.841 397 HD11 LEU 47 HD11 LEU 47 0.048 -1.732 4.566 398 HD12 LEU 47 HD12 LEU 47 1.687 -1.277 5.034 399 HD13 LEU 47 HD13 LEU 47 1.433 -2.670 3.957 400 HD21 LEU 47 HD21 LEU 47 -0.159 -4.784 6.661 401 HD22 LEU 47 HD22 LEU 47 -1.008 -3.814 5.464 402 HD23 LEU 47 HD23 LEU 47 0.365 -4.830 4.967 403 H ARG 48 H ARG 48 2.119 -0.372 7.764 404 HA ARG 48 HA ARG 48 0.518 -1.414 10.048 405 HB2 ARG 48 HB2 ARG 48 2.590 -0.170 10.880 406 HB3 ARG 48 HB3 ARG 48 1.962 1.269 10.102 407 HG2 ARG 48 HG2 ARG 48 1.122 1.609 12.219 408 HG3 ARG 48 HG3 ARG 48 -0.236 0.721 11.532 409 HD2 ARG 48 HD2 ARG 48 0.238 -0.152 13.721 410 HD3 ARG 48 HD3 ARG 48 0.696 -1.386 12.527 411 HE ARG 48 HE ARG 48 2.970 0.252 13.069 412 HH11 ARG 48 HH11 ARG 48 4.675 -0.576 14.098 413 HH12 ARG 48 HH12 ARG 48 4.458 -1.658 15.463 414 HH21 ARG 48 HH21 ARG 48 1.051 -1.955 15.006 415 HH22 ARG 48 HH22 ARG 48 2.434 -2.465 15.935 416 H ILE 49 H ILE 49 -1.436 -1.349 9.159 417 HA ILE 49 HA ILE 49 -2.318 1.030 7.577 418 HB ILE 49 HB ILE 49 -3.688 -1.623 8.053 419 HG12 ILE 49 HG12 ILE 49 -2.244 -0.395 5.657 420 HG13 ILE 49 HG13 ILE 49 -1.795 -1.849 6.550 421 HG21 ILE 49 HG21 ILE 49 -5.411 -0.905 6.541 422 HG22 ILE 49 HG22 ILE 49 -5.301 0.295 7.808 423 HG23 ILE 49 HG23 ILE 49 -4.567 0.629 6.212 424 HD11 ILE 49 HD11 ILE 49 -4.182 -1.503 4.705 425 HD12 ILE 49 HD12 ILE 49 -2.754 -2.515 4.476 426 HD13 ILE 49 HD13 ILE 49 -3.910 -2.938 5.749 427 H THR 50 H THR 50 -3.478 2.550 8.465 428 HA THR 50 HA THR 50 -4.809 2.136 11.102 429 HB THR 50 HB THR 50 -3.993 4.287 11.894 430 HG1 THR 50 HG1 THR 50 -2.465 4.305 9.505 431 HG21 THR 50 HG21 THR 50 -2.481 2.333 12.357 432 HG22 THR 50 HG22 THR 50 -1.563 2.741 10.894 433 HG23 THR 50 HG23 THR 50 -1.641 3.885 12.248 434 H SER 51 H SER 51 -6.360 4.070 11.565 435 HA SER 51 HA SER 51 -7.212 5.550 9.199 436 HB2 SER 51 HB2 SER 51 -9.563 4.865 9.343 437 HB3 SER 51 HB3 SER 51 -8.508 3.518 8.906 438 HG SER 51 HG SER 51 -9.377 4.053 11.575 439 H LYS 52 H LYS 52 -7.788 7.499 9.674 440 HA LYS 52 HA LYS 52 -8.743 8.299 12.391 441 HB2 LYS 52 HB2 LYS 52 -6.785 9.445 11.338 442 HB3 LYS 52 HB3 LYS 52 -7.874 10.003 10.047 443 HG2 LYS 52 HG2 LYS 52 -9.290 10.973 12.055 444 HG3 LYS 52 HG3 LYS 52 -7.783 10.787 12.953 445 HD2 LYS 52 HD2 LYS 52 -8.303 12.400 10.440 446 HD3 LYS 52 HD3 LYS 52 -7.881 13.023 12.058 447 HE2 LYS 52 HE2 LYS 52 -5.625 12.153 11.837 448 HE3 LYS 52 HE3 LYS 52 -6.029 11.357 10.309 449 HZ1 LYS 52 HZ1 LYS 52 -5.973 14.286 10.808 450 HZ2 LYS 52 HZ2 LYS 52 -4.893 13.459 9.931 451 HZ3 LYS 52 HZ3 LYS 52 -6.429 13.597 9.374 452 H GLY 53 H GLY 53 -10.621 7.050 11.905 453 HA2 GLY 53 HA2 GLY 53 -12.958 7.039 11.638 454 HA3 GLY 53 HA3 GLY 53 -12.872 8.633 10.892 455 H LYS 54 H LYS 54 -13.790 8.490 8.923 456 HA LYS 54 HA LYS 54 -13.781 6.144 7.204 457 HB2 LYS 54 HB2 LYS 54 -15.586 7.861 7.358 458 HB3 LYS 54 HB3 LYS 54 -14.525 9.056 6.631 459 HG2 LYS 54 HG2 LYS 54 -15.155 6.493 5.138 460 HG3 LYS 54 HG3 LYS 54 -16.393 7.738 5.313 461 HD2 LYS 54 HD2 LYS 54 -14.739 9.404 4.299 462 HD3 LYS 54 HD3 LYS 54 -13.777 7.990 3.830 463 HE2 LYS 54 HE2 LYS 54 -15.861 7.057 2.706 464 HE3 LYS 54 HE3 LYS 54 -16.666 8.589 3.052 465 HZ1 LYS 54 HZ1 LYS 54 -14.256 8.205 1.345 466 HZ2 LYS 54 HZ2 LYS 54 -15.732 8.707 0.844 467 HZ3 LYS 54 HZ3 LYS 54 -14.785 9.680 1.769 468 H THR 55 H THR 55 -11.316 8.302 7.747 469 HA THR 55 HA THR 55 -10.126 7.704 5.110 470 HB THR 55 HB THR 55 -8.924 9.385 7.321 471 HG1 THR 55 HG1 THR 55 -9.915 11.154 6.326 472 HG21 THR 55 HG21 THR 55 -7.896 10.476 5.283 473 HG22 THR 55 HG22 THR 55 -7.528 8.738 5.357 474 HG23 THR 55 HG23 THR 55 -8.803 9.317 4.265 475 H ALA 56 H ALA 56 -8.883 5.944 4.891 476 HA ALA 56 HA ALA 56 -7.447 4.757 7.195 477 HB1 ALA 56 HB1 ALA 56 -7.836 3.795 4.340 478 HB2 ALA 56 HB2 ALA 56 -6.799 2.987 5.537 479 HB3 ALA 56 HB3 ALA 56 -8.535 3.117 5.817 480 H TYR 57 H TYR 57 -5.133 4.375 7.008 481 HA TYR 57 HA TYR 57 -3.639 6.027 5.048 482 HB2 TYR 57 HB2 TYR 57 -3.110 6.016 8.039 483 HB3 TYR 57 HB3 TYR 57 -2.063 6.713 6.819 484 HD1 TYR 57 HD1 TYR 57 -2.374 8.967 6.112 485 HD2 TYR 57 HD2 TYR 57 -5.456 6.991 8.393 486 HE1 TYR 57 HE1 TYR 57 -3.627 11.114 6.299 487 HE2 TYR 57 HE2 TYR 57 -6.739 9.090 8.488 488 HH TYR 57 HH TYR 57 -5.538 12.143 7.033 489 H ILE 58 H ILE 58 -2.401 4.632 3.988 490 HA ILE 58 HA ILE 58 -1.494 2.090 5.232 491 HB ILE 58 HB ILE 58 -0.566 3.234 2.581 492 HG12 ILE 58 HG12 ILE 58 -2.941 3.167 2.312 493 HG13 ILE 58 HG13 ILE 58 -2.169 1.907 1.375 494 HG21 ILE 58 HG21 ILE 58 -0.589 0.461 3.800 495 HG22 ILE 58 HG22 ILE 58 -0.103 0.842 2.130 496 HG23 ILE 58 HG23 ILE 58 0.824 1.486 3.483 497 HD11 ILE 58 HD11 ILE 58 -3.608 1.483 4.025 498 HD12 ILE 58 HD12 ILE 58 -4.226 1.133 2.397 499 HD13 ILE 58 HD13 ILE 58 -2.849 0.210 3.033 500 H LYS 59 H LYS 59 0.069 2.414 6.775 501 HA LYS 59 HA LYS 59 2.324 4.262 6.086 502 HB2 LYS 59 HB2 LYS 59 1.605 3.334 8.874 503 HB3 LYS 59 HB3 LYS 59 2.787 4.547 8.375 504 HG2 LYS 59 HG2 LYS 59 0.692 5.710 7.228 505 HG3 LYS 59 HG3 LYS 59 -0.239 4.697 8.343 506 HD2 LYS 59 HD2 LYS 59 1.109 5.708 10.242 507 HD3 LYS 59 HD3 LYS 59 1.881 6.769 9.033 508 HE2 LYS 59 HE2 LYS 59 -0.530 7.406 8.340 509 HE3 LYS 59 HE3 LYS 59 -1.043 6.650 9.859 510 HZ1 LYS 59 HZ1 LYS 59 0.692 9.014 9.466 511 HZ2 LYS 59 HZ2 LYS 59 -0.690 8.914 10.382 512 HZ3 LYS 59 HZ3 LYS 59 0.682 8.216 10.906 513 H LEU 60 H LEU 60 4.418 3.594 6.318 514 HA LEU 60 HA LEU 60 4.874 0.634 6.493 515 HB2 LEU 60 HB2 LEU 60 6.020 2.694 4.570 516 HB3 LEU 60 HB3 LEU 60 6.618 1.043 4.724 517 HG LEU 60 HG LEU 60 3.743 1.702 3.929 518 HD11 LEU 60 HD11 LEU 60 4.473 1.135 1.630 519 HD12 LEU 60 HD12 LEU 60 5.275 2.587 2.249 520 HD13 LEU 60 HD13 LEU 60 6.153 1.046 2.210 521 HD21 LEU 60 HD21 LEU 60 3.744 -0.630 3.100 522 HD22 LEU 60 HD22 LEU 60 5.400 -0.855 3.709 523 HD23 LEU 60 HD23 LEU 60 4.057 -0.581 4.836 524 H GLU 61 H GLU 61 6.538 -0.033 7.702 525 HA GLU 61 HA GLU 61 8.040 2.034 9.263 526 HB2 GLU 61 HB2 GLU 61 6.630 -0.489 10.201 527 HB3 GLU 61 HB3 GLU 61 7.734 0.480 11.181 528 HG2 GLU 61 HG2 GLU 61 6.244 2.456 10.908 529 HG3 GLU 61 HG3 GLU 61 5.108 1.453 10.001 530 H ASP 62 H ASP 62 10.108 1.463 10.134 531 HA ASP 62 HA ASP 62 11.696 -0.356 8.601 532 HB2 ASP 62 HB2 ASP 62 12.605 1.687 9.524 533 HB3 ASP 62 HB3 ASP 62 12.125 1.226 11.160 534 H LYS 63 H LYS 63 12.397 -2.371 9.057 535 HA LYS 63 HA LYS 63 10.680 -4.088 10.523 536 HB2 LYS 63 HB2 LYS 63 12.430 -4.365 8.455 537 HB3 LYS 63 HB3 LYS 63 13.425 -5.046 9.727 538 HG2 LYS 63 HG2 LYS 63 11.677 -6.702 10.258 539 HG3 LYS 63 HG3 LYS 63 10.576 -5.951 9.101 540 HD2 LYS 63 HD2 LYS 63 13.203 -7.297 8.375 541 HD3 LYS 63 HD3 LYS 63 11.592 -8.022 8.231 542 HE2 LYS 63 HE2 LYS 63 10.918 -6.199 6.659 543 HE3 LYS 63 HE3 LYS 63 12.561 -5.534 6.754 544 HZ1 LYS 63 HZ1 LYS 63 13.315 -7.790 5.934 545 HZ2 LYS 63 HZ2 LYS 63 11.735 -8.117 5.589 546 HZ3 LYS 63 HZ3 LYS 63 12.517 -6.873 4.844 547 H VAL 64 H VAL 64 13.187 -2.235 11.787 548 HA VAL 64 HA VAL 64 13.820 -4.115 14.025 549 HB VAL 64 HB VAL 64 15.579 -1.800 13.189 550 HG11 VAL 64 HG11 VAL 64 16.166 -4.522 14.416 551 HG12 VAL 64 HG12 VAL 64 17.344 -3.224 14.112 552 HG13 VAL 64 HG13 VAL 64 16.055 -2.979 15.296 553 HG21 VAL 64 HG21 VAL 64 15.602 -4.537 11.859 554 HG22 VAL 64 HG22 VAL 64 15.333 -2.954 11.079 555 HG23 VAL 64 HG23 VAL 64 16.913 -3.335 11.759 556 H SER 65 H SER 65 13.148 -0.716 13.185 557 HA SER 65 HA SER 65 12.845 -0.142 16.106 558 HB2 SER 65 HB2 SER 65 13.944 1.610 13.884 559 HB3 SER 65 HB3 SER 65 13.722 2.116 15.570 560 HG SER 65 HG SER 65 15.868 1.397 15.135 561 H GLY 66 H GLY 66 10.914 -0.359 13.385 562 HA2 GLY 66 HA2 GLY 66 8.737 0.254 13.059 563 HA3 GLY 66 HA3 GLY 66 8.717 0.980 14.661 564 H GLU 67 H GLU 67 11.170 2.299 12.628 565 HA GLU 67 HA GLU 67 9.960 4.924 12.758 566 HB2 GLU 67 HB2 GLU 67 12.470 3.977 11.321 567 HB3 GLU 67 HB3 GLU 67 11.983 5.662 11.547 568 HG2 GLU 67 HG2 GLU 67 12.032 5.300 14.036 569 HG3 GLU 67 HG3 GLU 67 12.669 3.677 13.754 570 H LEU 68 H LEU 68 9.130 6.258 11.127 571 HA LEU 68 HA LEU 68 7.653 4.852 9.136 572 HB2 LEU 68 HB2 LEU 68 6.901 6.903 10.393 573 HB3 LEU 68 HB3 LEU 68 8.047 7.850 9.449 574 HG LEU 68 HG LEU 68 6.797 7.057 7.348 575 HD11 LEU 68 HD11 LEU 68 4.721 6.239 9.434 576 HD12 LEU 68 HD12 LEU 68 4.462 6.324 7.678 577 HD13 LEU 68 HD13 LEU 68 5.580 5.134 8.344 578 HD21 LEU 68 HD21 LEU 68 4.987 8.684 7.637 579 HD22 LEU 68 HD22 LEU 68 5.242 8.686 9.397 580 HD23 LEU 68 HD23 LEU 68 6.502 9.306 8.307 581 H PHE 69 H PHE 69 8.172 4.261 7.176 582 HA PHE 69 HA PHE 69 10.415 5.442 5.617 583 HB2 PHE 69 HB2 PHE 69 10.357 3.091 5.603 584 HB3 PHE 69 HB3 PHE 69 8.620 3.032 5.353 585 HD1 PHE 69 HD1 PHE 69 8.068 2.119 3.305 586 HD2 PHE 69 HD2 PHE 69 11.484 4.732 3.535 587 HE1 PHE 69 HE1 PHE 69 8.386 1.906 0.873 588 HE2 PHE 69 HE2 PHE 69 11.782 4.550 1.093 589 HZ PHE 69 HZ PHE 69 10.207 3.148 -0.276 590 H ALA 70 H ALA 70 6.888 4.866 5.181 591 HA ALA 70 HA ALA 70 6.540 7.450 3.865 592 HB1 ALA 70 HB1 ALA 70 6.018 4.860 2.325 593 HB2 ALA 70 HB2 ALA 70 5.620 6.502 1.784 594 HB3 ALA 70 HB3 ALA 70 7.315 6.024 1.972 595 H GLN 71 H GLN 71 4.260 7.901 3.393 596 HA GLN 71 HA GLN 71 2.291 6.028 4.452 597 HB2 GLN 71 HB2 GLN 71 1.091 7.723 5.772 598 HB3 GLN 71 HB3 GLN 71 2.673 7.295 6.419 599 HG2 GLN 71 HG2 GLN 71 3.618 9.396 5.399 600 HG3 GLN 71 HG3 GLN 71 1.987 9.851 4.901 601 HE21 GLN 71 HE21 GLN 71 2.824 11.481 8.194 602 HE22 GLN 71 HE22 GLN 71 3.579 11.487 6.607 603 H ALA 72 H ALA 72 0.398 5.993 3.420 604 HA ALA 72 HA ALA 72 -0.163 7.999 1.268 605 HB1 ALA 72 HB1 ALA 72 -0.633 5.000 1.272 606 HB2 ALA 72 HB2 ALA 72 -1.214 6.115 0.037 607 HB3 ALA 72 HB3 ALA 72 0.524 5.897 0.266 608 HA PRO 73 HA PRO 73 -4.007 8.161 3.815 609 HB2 PRO 73 HB2 PRO 73 -4.501 10.578 2.112 610 HB3 PRO 73 HB3 PRO 73 -4.632 10.395 3.883 611 HG2 PRO 73 HG2 PRO 73 -2.534 11.722 2.762 612 HG3 PRO 73 HG3 PRO 73 -2.269 10.622 4.154 613 HD2 PRO 73 HD2 PRO 73 -1.880 10.026 1.202 614 HD3 PRO 73 HD3 PRO 73 -0.769 9.717 2.574 615 H VAL 74 H VAL 74 -5.786 7.030 3.269 616 HA VAL 74 HA VAL 74 -6.740 6.855 0.432 617 HB VAL 74 HB VAL 74 -6.778 4.688 2.567 618 HG11 VAL 74 HG11 VAL 74 -8.756 4.545 1.114 619 HG12 VAL 74 HG12 VAL 74 -7.706 4.588 -0.321 620 HG13 VAL 74 HG13 VAL 74 -7.648 3.219 0.812 621 HG21 VAL 74 HG21 VAL 74 -5.218 4.553 -0.005 622 HG22 VAL 74 HG22 VAL 74 -4.506 4.982 1.566 623 HG23 VAL 74 HG23 VAL 74 -5.256 3.401 1.325 624 H GLU 75 H GLU 75 -8.728 7.793 0.225 625 HA GLU 75 HA GLU 75 -10.584 7.725 2.574 626 HB2 GLU 75 HB2 GLU 75 -9.624 10.001 1.523 627 HB3 GLU 75 HB3 GLU 75 -10.937 9.726 0.375 628 HG2 GLU 75 HG2 GLU 75 -12.249 9.283 2.748 629 HG3 GLU 75 HG3 GLU 75 -11.004 10.380 3.308 630 H GLN 76 H GLN 76 -10.084 6.072 -0.156 631 HA GLN 76 HA GLN 76 -12.761 5.093 -0.221 632 HB2 GLN 76 HB2 GLN 76 -13.328 5.495 -2.496 633 HB3 GLN 76 HB3 GLN 76 -12.948 7.046 -1.785 634 HG2 GLN 76 HG2 GLN 76 -11.193 5.439 -3.690 635 HG3 GLN 76 HG3 GLN 76 -12.138 6.858 -4.080 636 HE21 GLN 76 HE21 GLN 76 -8.451 7.345 -2.409 637 HE22 GLN 76 HE22 GLN 76 -9.206 5.735 -2.412 638 H TYR 77 H TYR 77 -12.771 2.943 -0.777 639 HA TYR 77 HA TYR 77 -10.341 1.809 -2.047 640 HB2 TYR 77 HB2 TYR 77 -10.446 1.267 0.328 641 HB3 TYR 77 HB3 TYR 77 -12.001 0.432 0.076 642 HD1 TYR 77 HD1 TYR 77 -11.966 -1.862 -0.973 643 HD2 TYR 77 HD2 TYR 77 -8.460 0.582 -0.728 644 HE1 TYR 77 HE1 TYR 77 -10.641 -3.686 -1.972 645 HE2 TYR 77 HE2 TYR 77 -7.084 -1.213 -1.734 646 HH TYR 77 HH TYR 77 -8.589 -4.191 -3.049 647 HA PRO 78 HA PRO 78 -9.571 0.609 -3.606 648 HB2 PRO 78 HB2 PRO 78 -9.542 0.274 -6.291 649 HB3 PRO 78 HB3 PRO 78 -9.756 -1.095 -5.158 650 HG2 PRO 78 HG2 PRO 78 -11.922 0.456 -6.623 651 HG3 PRO 78 HG3 PRO 78 -11.698 -1.323 -6.549 652 HD2 PRO 78 HD2 PRO 78 -13.417 -0.022 -4.883 653 HD3 PRO 78 HD3 PRO 78 -12.457 -1.418 -4.313 654 H GLY 79 H GLY 79 -8.301 2.247 -4.843 655 HA2 GLY 79 HA2 GLY 79 -9.681 4.433 -6.225 656 HA3 GLY 79 HA3 GLY 79 -9.078 4.872 -4.629 657 H ILE 80 H ILE 80 -7.731 6.442 -5.713 658 HA ILE 80 HA ILE 80 -5.497 5.492 -7.367 659 HB ILE 80 HB ILE 80 -6.561 7.666 -7.762 660 HG12 ILE 80 HG12 ILE 80 -4.593 9.073 -8.028 661 HG13 ILE 80 HG13 ILE 80 -3.672 8.091 -6.894 662 HG21 ILE 80 HG21 ILE 80 -7.078 8.357 -5.427 663 HG22 ILE 80 HG22 ILE 80 -5.338 8.596 -5.124 664 HG23 ILE 80 HG23 ILE 80 -6.187 9.599 -6.307 665 HD11 ILE 80 HD11 ILE 80 -3.113 7.677 -9.289 666 HD12 ILE 80 HD12 ILE 80 -3.660 6.212 -8.463 667 HD13 ILE 80 HD13 ILE 80 -4.766 7.084 -9.559 668 H ALA 81 H ALA 81 -6.155 6.114 -3.975 669 HA ALA 81 HA ALA 81 -3.353 6.221 -3.288 670 HB1 ALA 81 HB1 ALA 81 -5.807 6.128 -1.531 671 HB2 ALA 81 HB2 ALA 81 -4.113 6.361 -0.994 672 HB3 ALA 81 HB3 ALA 81 -4.898 7.573 -2.036 673 H VAL 82 H VAL 82 -5.778 3.572 -3.335 674 HA VAL 82 HA VAL 82 -3.436 1.752 -3.170 675 HB VAL 82 HB VAL 82 -4.299 1.847 -0.943 676 HG11 VAL 82 HG11 VAL 82 -6.498 2.727 -1.313 677 HG12 VAL 82 HG12 VAL 82 -6.989 1.197 -2.045 678 HG13 VAL 82 HG13 VAL 82 -6.498 1.291 -0.316 679 HG21 VAL 82 HG21 VAL 82 -4.753 -0.516 -0.642 680 HG22 VAL 82 HG22 VAL 82 -5.098 -0.708 -2.376 681 HG23 VAL 82 HG23 VAL 82 -3.476 -0.267 -1.841 682 H GLU 83 H GLU 83 -3.460 0.425 -4.855 683 HA GLU 83 HA GLU 83 -5.990 -0.513 -6.131 684 HB2 GLU 83 HB2 GLU 83 -4.261 1.506 -7.198 685 HB3 GLU 83 HB3 GLU 83 -3.926 0.053 -8.122 686 HG2 GLU 83 HG2 GLU 83 -6.720 1.180 -7.654 687 HG3 GLU 83 HG3 GLU 83 -5.704 1.577 -9.039 688 H THR 84 H THR 84 -5.806 -2.432 -7.392 689 HA THR 84 HA THR 84 -3.415 -4.171 -6.788 690 HB THR 84 HB THR 84 -5.822 -5.229 -8.137 691 HG1 THR 84 HG1 THR 84 -6.720 -4.232 -6.295 692 HG21 THR 84 HG21 THR 84 -3.849 -6.636 -7.834 693 HG22 THR 84 HG22 THR 84 -3.907 -6.356 -6.077 694 HG23 THR 84 HG23 THR 84 -5.211 -7.253 -6.890 695 H VAL 85 H VAL 85 -2.092 -3.375 -8.100 696 HA VAL 85 HA VAL 85 -1.144 -2.894 -10.332 697 HB VAL 85 HB VAL 85 -0.250 -5.322 -10.731 698 HG11 VAL 85 HG11 VAL 85 0.949 -3.469 -9.656 699 HG12 VAL 85 HG12 VAL 85 0.159 -3.808 -8.103 700 HG13 VAL 85 HG13 VAL 85 1.282 -4.977 -8.809 701 HG21 VAL 85 HG21 VAL 85 -2.094 -6.455 -9.332 702 HG22 VAL 85 HG22 VAL 85 -0.433 -6.855 -8.924 703 HG23 VAL 85 HG23 VAL 85 -1.343 -5.721 -7.914 704 H THR 86 H THR 86 -2.810 -5.966 -10.808 705 HA THR 86 HA THR 86 -4.619 -4.824 -12.734 706 HB THR 86 HB THR 86 -4.344 -6.673 -14.403 707 HG1 THR 86 HG1 THR 86 -2.333 -7.684 -14.477 708 HG21 THR 86 HG21 THR 86 -3.392 -4.315 -14.727 709 HG22 THR 86 HG22 THR 86 -1.847 -4.993 -14.230 710 HG23 THR 86 HG23 THR 86 -2.636 -5.616 -15.691 711 H ASP 87 H ASP 87 -3.418 -8.018 -11.735 712 HA ASP 87 HA ASP 87 -6.172 -8.830 -10.843 713 HB2 ASP 87 HB2 ASP 87 -4.483 -9.887 -13.103 714 HB3 ASP 87 HB3 ASP 87 -5.708 -10.896 -12.352 715 H SER 88 H SER 88 -2.727 -10.084 -10.926 716 HA SER 88 HA SER 88 -3.257 -11.879 -8.702 717 HB2 SER 88 HB2 SER 88 -1.202 -12.330 -9.901 718 HB3 SER 88 HB3 SER 88 -0.562 -10.739 -9.456 719 HG SER 88 HG SER 88 0.258 -12.102 -7.993 720 H SER 89 H SER 89 -3.537 -11.433 -6.646 721 HA SER 89 HA SER 89 -3.108 -8.663 -5.704 722 HB2 SER 89 HB2 SER 89 -4.852 -9.160 -4.115 723 HB3 SER 89 HB3 SER 89 -5.318 -9.480 -5.806 724 HG SER 89 HG SER 89 -5.988 -11.214 -4.500 725 H ARG 90 H ARG 90 -0.990 -10.801 -5.838 726 HA ARG 90 HA ARG 90 0.068 -10.857 -3.084 727 HB2 ARG 90 HB2 ARG 90 0.787 -12.500 -4.823 728 HB3 ARG 90 HB3 ARG 90 1.478 -11.180 -5.779 729 HG2 ARG 90 HG2 ARG 90 3.067 -10.665 -3.984 730 HG3 ARG 90 HG3 ARG 90 2.313 -11.870 -2.929 731 HD2 ARG 90 HD2 ARG 90 3.106 -13.663 -4.433 732 HD3 ARG 90 HD3 ARG 90 3.796 -12.441 -5.530 733 HE ARG 90 HE ARG 90 4.743 -11.964 -2.876 734 HH11 ARG 90 HH11 ARG 90 6.688 -12.276 -2.245 735 HH12 ARG 90 HH12 ARG 90 7.758 -13.427 -3.025 736 HH21 ARG 90 HH21 ARG 90 5.446 -14.321 -5.440 737 HH22 ARG 90 HH22 ARG 90 7.043 -14.562 -4.796 738 H TYR 91 H TYR 91 -0.208 -8.547 -5.629 739 HA TYR 91 HA TYR 91 1.704 -6.684 -4.306 740 HB2 TYR 91 HB2 TYR 91 0.887 -6.571 -7.199 741 HB3 TYR 91 HB3 TYR 91 2.258 -5.794 -6.462 742 HD1 TYR 91 HD1 TYR 91 1.011 -8.646 -8.238 743 HD2 TYR 91 HD2 TYR 91 4.225 -7.261 -5.720 744 HE1 TYR 91 HE1 TYR 91 2.428 -10.482 -9.076 745 HE2 TYR 91 HE2 TYR 91 5.655 -9.163 -6.520 746 HH TYR 91 HH TYR 91 4.435 -11.523 -8.921 747 H PHE 92 H PHE 92 1.296 -4.453 -4.598 748 HA PHE 92 HA PHE 92 -1.353 -3.573 -5.527 749 HB2 PHE 92 HB2 PHE 92 -0.297 -2.816 -2.776 750 HB3 PHE 92 HB3 PHE 92 -1.708 -2.109 -3.556 751 HD1 PHE 92 HD1 PHE 92 -0.457 -4.894 -1.627 752 HD2 PHE 92 HD2 PHE 92 -3.706 -3.590 -4.142 753 HE1 PHE 92 HE1 PHE 92 -1.865 -6.748 -0.796 754 HE2 PHE 92 HE2 PHE 92 -5.082 -5.504 -3.378 755 HZ PHE 92 HZ PHE 92 -4.148 -7.117 -1.721 756 H VAL 93 H VAL 93 -1.405 -1.148 -5.574 757 HA VAL 93 HA VAL 93 1.248 0.189 -5.644 758 HB VAL 93 HB VAL 93 -1.022 0.592 -7.633 759 HG11 VAL 93 HG11 VAL 93 -0.241 2.804 -7.030 760 HG12 VAL 93 HG12 VAL 93 1.460 2.286 -7.134 761 HG13 VAL 93 HG13 VAL 93 0.447 2.378 -8.590 762 HG21 VAL 93 HG21 VAL 93 0.478 -1.234 -8.237 763 HG22 VAL 93 HG22 VAL 93 0.814 0.155 -9.277 764 HG23 VAL 93 HG23 VAL 93 1.904 -0.218 -7.932 765 H ILE 94 H ILE 94 1.292 2.020 -4.404 766 HA ILE 94 HA ILE 94 -1.297 3.192 -3.603 767 HB ILE 94 HB ILE 94 -0.653 3.528 -1.311 768 HG12 ILE 94 HG12 ILE 94 1.867 1.875 -1.833 769 HG13 ILE 94 HG13 ILE 94 1.859 3.634 -1.737 770 HG21 ILE 94 HG21 ILE 94 -1.788 1.385 -1.942 771 HG22 ILE 94 HG22 ILE 94 -0.215 0.573 -1.974 772 HG23 ILE 94 HG23 ILE 94 -0.849 1.263 -0.471 773 HD11 ILE 94 HD11 ILE 94 0.899 3.495 0.560 774 HD12 ILE 94 HD12 ILE 94 1.071 1.739 0.486 775 HD13 ILE 94 HD13 ILE 94 2.510 2.767 0.421 776 H ARG 95 H ARG 95 -1.333 5.346 -3.141 777 HA ARG 95 HA ARG 95 0.893 6.980 -4.314 778 HB2 ARG 95 HB2 ARG 95 -1.327 7.207 -5.317 779 HB3 ARG 95 HB3 ARG 95 -2.009 7.702 -3.781 780 HG2 ARG 95 HG2 ARG 95 0.234 9.288 -5.088 781 HG3 ARG 95 HG3 ARG 95 -1.470 9.507 -5.513 782 HD2 ARG 95 HD2 ARG 95 -1.939 9.831 -3.016 783 HD3 ARG 95 HD3 ARG 95 -0.192 9.944 -2.807 784 HE ARG 95 HE ARG 95 -0.184 12.069 -3.640 785 HH11 ARG 95 HH11 ARG 95 -0.901 13.913 -4.351 786 HH12 ARG 95 HH12 ARG 95 -2.534 14.105 -4.958 787 HH21 ARG 95 HH21 ARG 95 -3.348 10.785 -4.472 788 HH22 ARG 95 HH22 ARG 95 -3.899 12.342 -5.029 789 H ILE 96 H ILE 96 2.351 7.238 -2.764 790 HA ILE 96 HA ILE 96 1.592 7.981 0.008 791 HB ILE 96 HB ILE 96 4.000 7.872 0.484 792 HG12 ILE 96 HG12 ILE 96 4.436 6.672 -2.271 793 HG13 ILE 96 HG13 ILE 96 4.685 8.397 -1.949 794 HG21 ILE 96 HG21 ILE 96 2.831 5.376 -0.790 795 HG22 ILE 96 HG22 ILE 96 4.231 5.386 0.279 796 HG23 ILE 96 HG23 ILE 96 2.669 5.895 0.903 797 HD11 ILE 96 HD11 ILE 96 6.792 7.278 -1.800 798 HD12 ILE 96 HD12 ILE 96 6.309 7.843 -0.184 799 HD13 ILE 96 HD13 ILE 96 6.160 6.118 -0.614 800 H GLN 97 H GLN 97 2.756 9.805 1.020 801 HA GLN 97 HA GLN 97 3.592 11.940 -0.906 802 HB2 GLN 97 HB2 GLN 97 2.700 12.176 1.979 803 HB3 GLN 97 HB3 GLN 97 3.693 13.389 1.170 804 HG2 GLN 97 HG2 GLN 97 1.845 13.259 -0.727 805 HG3 GLN 97 HG3 GLN 97 0.838 12.606 0.572 806 HE21 GLN 97 HE21 GLN 97 2.166 16.531 0.690 807 HE22 GLN 97 HE22 GLN 97 3.054 15.311 -0.243 808 H ASP 98 H ASP 98 5.622 12.810 -0.822 809 HA ASP 98 HA ASP 98 7.674 11.115 0.460 810 HB2 ASP 98 HB2 ASP 98 7.822 12.082 -1.902 811 HB3 ASP 98 HB3 ASP 98 8.106 13.646 -1.127 812 H GLY 99 H GLY 99 5.782 13.664 1.464 813 HA2 GLY 99 HA2 GLY 99 5.717 14.647 3.571 814 HA3 GLY 99 HA3 GLY 99 7.323 14.012 3.926 815 H THR 100 H THR 100 7.516 15.680 1.016 816 HA THR 100 HA THR 100 8.554 18.161 2.320 817 HB THR 100 HB THR 100 9.897 18.426 0.261 818 HG1 THR 100 HG1 THR 100 9.952 16.646 -1.156 819 HG21 THR 100 HG21 THR 100 11.471 16.625 0.639 820 HG22 THR 100 HG22 THR 100 10.828 17.156 2.203 821 HG23 THR 100 HG23 THR 100 10.241 15.647 1.466 822 H GLY 101 H GLY 101 5.714 17.385 1.146 823 HA2 GLY 101 HA2 GLY 101 3.998 18.952 0.548 824 HA3 GLY 101 HA3 GLY 101 5.186 19.966 -0.268 825 H ARG 102 H ARG 102 5.732 16.693 -1.008 826 HA ARG 102 HA ARG 102 4.167 16.836 -3.552 827 HB2 ARG 102 HB2 ARG 102 5.899 16.005 -4.768 828 HB3 ARG 102 HB3 ARG 102 6.642 17.219 -3.722 829 HG2 ARG 102 HG2 ARG 102 7.748 15.621 -2.418 830 HG3 ARG 102 HG3 ARG 102 6.734 14.276 -2.947 831 HD2 ARG 102 HD2 ARG 102 8.467 15.823 -4.873 832 HD3 ARG 102 HD3 ARG 102 9.075 14.418 -3.960 833 HE ARG 102 HE ARG 102 6.683 13.554 -5.137 834 HH11 ARG 102 HH11 ARG 102 6.452 12.478 -6.929 835 HH12 ARG 102 HH12 ARG 102 7.681 12.489 -8.182 836 HH21 ARG 102 HH21 ARG 102 9.759 14.630 -6.433 837 HH22 ARG 102 HH22 ARG 102 9.539 13.709 -7.898 838 H SER 103 H SER 103 3.949 14.757 -4.658 839 HA SER 103 HA SER 103 3.296 12.490 -2.824 840 HB2 SER 103 HB2 SER 103 2.011 13.278 -5.467 841 HB3 SER 103 HB3 SER 103 1.636 11.815 -4.541 842 HG SER 103 HG SER 103 1.389 14.486 -3.555 843 H ALA 104 H ALA 104 3.536 10.333 -3.723 844 HA ALA 104 HA ALA 104 4.933 9.967 -6.271 845 HB1 ALA 104 HB1 ALA 104 6.194 9.024 -3.659 846 HB2 ALA 104 HB2 ALA 104 6.747 8.600 -5.292 847 HB3 ALA 104 HB3 ALA 104 6.839 10.281 -4.735 848 H PHE 105 H PHE 105 4.598 7.949 -7.190 849 HA PHE 105 HA PHE 105 2.738 6.123 -5.756 850 HB2 PHE 105 HB2 PHE 105 3.605 6.035 -8.652 851 HB3 PHE 105 HB3 PHE 105 2.336 5.091 -7.881 852 HD1 PHE 105 HD1 PHE 105 3.189 8.254 -9.458 853 HD2 PHE 105 HD2 PHE 105 0.256 6.296 -6.973 854 HE1 PHE 105 HE1 PHE 105 1.581 10.074 -9.923 855 HE2 PHE 105 HE2 PHE 105 -1.377 8.082 -7.507 856 HZ PHE 105 HZ PHE 105 -0.729 9.983 -8.961 857 H ILE 106 H ILE 106 3.355 4.249 -4.955 858 HA ILE 106 HA ILE 106 5.827 2.947 -5.993 859 HB ILE 106 HB ILE 106 6.362 1.973 -3.841 860 HG12 ILE 106 HG12 ILE 106 4.218 3.863 -2.701 861 HG13 ILE 106 HG13 ILE 106 4.098 2.106 -2.764 862 HG21 ILE 106 HG21 ILE 106 6.245 5.021 -3.586 863 HG22 ILE 106 HG22 ILE 106 7.471 3.920 -2.925 864 HG23 ILE 106 HG23 ILE 106 7.359 4.179 -4.669 865 HD11 ILE 106 HD11 ILE 106 6.146 3.610 -1.098 866 HD12 ILE 106 HD12 ILE 106 4.633 2.910 -0.521 867 HD13 ILE 106 HD13 ILE 106 5.884 1.845 -1.156 868 H GLY 107 H GLY 107 5.775 0.829 -6.375 869 HA2 GLY 107 HA2 GLY 107 3.265 -0.684 -6.131 870 HA3 GLY 107 HA3 GLY 107 4.790 -1.230 -6.837 871 H ILE 108 H ILE 108 3.117 -2.489 -4.792 872 HA ILE 108 HA ILE 108 5.217 -2.869 -2.719 873 HB ILE 108 HB ILE 108 2.215 -3.120 -2.202 874 HG12 ILE 108 HG12 ILE 108 4.258 -0.939 -1.555 875 HG13 ILE 108 HG13 ILE 108 2.726 -0.766 -2.410 876 HG21 ILE 108 HG21 ILE 108 4.648 -3.366 -0.395 877 HG22 ILE 108 HG22 ILE 108 2.950 -3.481 0.136 878 HG23 ILE 108 HG23 ILE 108 3.598 -4.709 -0.914 879 HD11 ILE 108 HD11 ILE 108 2.535 0.178 -0.219 880 HD12 ILE 108 HD12 ILE 108 1.520 -1.288 -0.280 881 HD13 ILE 108 HD13 ILE 108 3.102 -1.289 0.560 882 H GLY 109 H GLY 109 5.666 -5.069 -2.279 883 HA2 GLY 109 HA2 GLY 109 3.896 -7.172 -3.399 884 HA3 GLY 109 HA3 GLY 109 5.611 -7.243 -3.812 885 H PHE 110 H PHE 110 3.462 -8.619 -1.903 886 HA PHE 110 HA PHE 110 4.955 -8.619 0.649 887 HB2 PHE 110 HB2 PHE 110 2.364 -9.850 -0.285 888 HB3 PHE 110 HB3 PHE 110 3.044 -10.200 1.280 889 HD1 PHE 110 HD1 PHE 110 1.938 -7.211 -0.783 890 HD2 PHE 110 HD2 PHE 110 2.644 -8.880 3.140 891 HE1 PHE 110 HE1 PHE 110 0.930 -5.206 0.266 892 HE2 PHE 110 HE2 PHE 110 1.564 -6.914 4.169 893 HZ PHE 110 HZ PHE 110 0.756 -5.041 2.727 894 H THR 111 H THR 111 5.364 -10.605 1.791 895 HA THR 111 HA THR 111 6.975 -12.452 0.259 896 HB THR 111 HB THR 111 7.397 -11.565 2.547 897 HG1 THR 111 HG1 THR 111 7.467 -14.384 2.180 898 HG21 THR 111 HG21 THR 111 5.513 -13.763 3.471 899 HG22 THR 111 HG22 THR 111 6.561 -12.752 4.486 900 HG23 THR 111 HG23 THR 111 5.216 -12.016 3.603 901 H ASP 112 H ASP 112 3.684 -12.385 1.222 902 HA ASP 112 HA ASP 112 3.214 -15.059 0.031 903 HB2 ASP 112 HB2 ASP 112 3.332 -15.022 2.653 904 HB3 ASP 112 HB3 ASP 112 1.756 -14.229 2.560 905 H ARG 113 H ARG 113 1.277 -15.307 -1.063 906 HA ARG 113 HA ARG 113 -0.326 -13.139 -2.036 907 HB2 ARG 113 HB2 ARG 113 -0.433 -16.131 -1.963 908 HB3 ARG 113 HB3 ARG 113 -2.005 -15.374 -2.022 909 HG2 ARG 113 HG2 ARG 113 0.165 -14.669 -4.018 910 HG3 ARG 113 HG3 ARG 113 -0.943 -16.027 -4.234 911 HD2 ARG 113 HD2 ARG 113 -2.895 -14.487 -4.087 912 HD3 ARG 113 HD3 ARG 113 -1.797 -13.122 -3.914 913 HE ARG 113 HE ARG 113 -1.207 -13.266 -6.186 914 HH11 ARG 113 HH11 ARG 113 -1.257 -13.894 -8.173 915 HH12 ARG 113 HH12 ARG 113 -2.107 -15.297 -8.745 916 HH21 ARG 113 HH21 ARG 113 -3.490 -15.900 -5.565 917 HH22 ARG 113 HH22 ARG 113 -3.403 -16.401 -7.234 918 H GLY 114 H GLY 114 -0.726 -15.209 0.839 919 HA2 GLY 114 HA2 GLY 114 -3.323 -14.235 1.607 920 HA3 GLY 114 HA3 GLY 114 -2.158 -15.109 2.613 921 H ASP 115 H ASP 115 0.007 -13.190 2.505 922 HA ASP 115 HA ASP 115 -0.905 -11.367 4.550 923 HB2 ASP 115 HB2 ASP 115 1.720 -11.545 3.057 924 HB3 ASP 115 HB3 ASP 115 1.386 -10.384 4.348 925 H ALA 116 H ALA 116 -0.322 -10.990 1.078 926 HA ALA 116 HA ALA 116 -1.000 -8.173 1.030 927 HB1 ALA 116 HB1 ALA 116 0.391 -9.244 -0.686 928 HB2 ALA 116 HB2 ALA 116 -0.930 -10.342 -1.111 929 HB3 ALA 116 HB3 ALA 116 -1.056 -8.599 -1.431 930 H PHE 117 H PHE 117 -2.909 -11.197 0.433 931 HA PHE 117 HA PHE 117 -5.383 -9.991 -0.231 932 HB2 PHE 117 HB2 PHE 117 -4.760 -12.404 -0.308 933 HB3 PHE 117 HB3 PHE 117 -4.906 -12.475 1.443 934 HD1 PHE 117 HD1 PHE 117 -7.207 -11.983 2.502 935 HD2 PHE 117 HD2 PHE 117 -6.655 -12.629 -1.743 936 HE1 PHE 117 HE1 PHE 117 -9.604 -12.563 2.266 937 HE2 PHE 117 HE2 PHE 117 -9.004 -13.226 -1.947 938 HZ PHE 117 HZ PHE 117 -10.520 -13.204 0.040 939 H ASP 118 H ASP 118 -3.858 -10.388 2.998 940 HA ASP 118 HA ASP 118 -6.201 -9.418 4.425 941 HB2 ASP 118 HB2 ASP 118 -3.327 -9.826 5.249 942 HB3 ASP 118 HB3 ASP 118 -4.618 -9.283 6.338 943 H PHE 119 H PHE 119 -3.272 -7.878 3.051 944 HA PHE 119 HA PHE 119 -3.642 -5.305 4.211 945 HB2 PHE 119 HB2 PHE 119 -1.606 -5.744 3.089 946 HB3 PHE 119 HB3 PHE 119 -2.388 -6.285 1.633 947 HD1 PHE 119 HD1 PHE 119 -3.614 -4.609 0.125 948 HD2 PHE 119 HD2 PHE 119 -0.886 -3.477 3.232 949 HE1 PHE 119 HE1 PHE 119 -3.347 -2.371 -0.923 950 HE2 PHE 119 HE2 PHE 119 -0.732 -1.221 2.285 951 HZ PHE 119 HZ PHE 119 -1.946 -0.650 0.186 952 H ASN 120 H ASN 120 -5.078 -6.855 1.356 953 HA ASN 120 HA ASN 120 -6.744 -4.607 0.590 954 HB2 ASN 120 HB2 ASN 120 -6.478 -5.943 -1.193 955 HB3 ASN 120 HB3 ASN 120 -6.300 -7.431 -0.227 956 HD21 ASN 120 HD21 ASN 120 -10.017 -6.380 -1.502 957 HD22 ASN 120 HD22 ASN 120 -8.801 -5.105 -1.282 958 H VAL 121 H VAL 121 -7.453 -7.612 2.480 959 HA VAL 121 HA VAL 121 -10.171 -6.923 2.732 960 HB VAL 121 HB VAL 121 -8.801 -9.149 3.193 961 HG11 VAL 121 HG11 VAL 121 -9.470 -8.372 6.040 962 HG12 VAL 121 HG12 VAL 121 -8.732 -9.876 5.449 963 HG13 VAL 121 HG13 VAL 121 -7.833 -8.354 5.351 964 HG21 VAL 121 HG21 VAL 121 -10.858 -10.121 4.108 965 HG22 VAL 121 HG22 VAL 121 -11.471 -8.487 4.467 966 HG23 VAL 121 HG23 VAL 121 -11.189 -8.993 2.784 967 H SER 122 H SER 122 -7.465 -6.006 4.752 968 HA SER 122 HA SER 122 -8.895 -4.847 6.947 969 HB2 SER 122 HB2 SER 122 -6.205 -4.061 5.751 970 HB3 SER 122 HB3 SER 122 -6.808 -3.627 7.364 971 HG SER 122 HG SER 122 -6.116 -6.185 6.339 972 H LEU 123 H LEU 123 -8.486 -3.769 3.672 973 HA LEU 123 HA LEU 123 -9.436 -1.013 4.278 974 HB2 LEU 123 HB2 LEU 123 -8.410 -2.302 1.729 975 HB3 LEU 123 HB3 LEU 123 -8.928 -0.627 1.875 976 HG LEU 123 HG LEU 123 -6.704 -1.730 3.644 977 HD11 LEU 123 HD11 LEU 123 -5.094 -0.917 2.013 978 HD12 LEU 123 HD12 LEU 123 -6.110 -2.164 1.298 979 HD13 LEU 123 HD13 LEU 123 -6.426 -0.467 0.914 980 HD21 LEU 123 HD21 LEU 123 -7.736 0.449 4.277 981 HD22 LEU 123 HD22 LEU 123 -6.046 0.601 3.804 982 HD23 LEU 123 HD23 LEU 123 -7.327 1.087 2.669 983 H GLN 124 H GLN 124 -10.388 -3.970 2.437 984 HA GLN 124 HA GLN 124 -12.893 -3.047 1.505 985 HB2 GLN 124 HB2 GLN 124 -12.037 -5.812 2.428 986 HB3 GLN 124 HB3 GLN 124 -13.628 -5.467 1.740 987 HG2 GLN 124 HG2 GLN 124 -12.589 -4.584 -0.313 988 HG3 GLN 124 HG3 GLN 124 -10.989 -4.960 0.330 989 HE21 GLN 124 HE21 GLN 124 -12.256 -7.755 -1.913 990 HE22 GLN 124 HE22 GLN 124 -12.249 -6.017 -2.154 991 H ASP 125 H ASP 125 -12.270 -4.817 4.621 992 HA ASP 125 HA ASP 125 -14.916 -4.426 5.709 993 HB2 ASP 125 HB2 ASP 125 -13.156 -6.135 6.349 994 HB3 ASP 125 HB3 ASP 125 -12.242 -4.825 7.115 995 H HIS 126 H HIS 126 -12.348 -2.145 5.352 996 HA HIS 126 HA HIS 126 -13.275 -0.445 7.588 997 HB2 HIS 126 HB2 HIS 126 -10.900 -0.540 7.297 998 HB3 HIS 126 HB3 HIS 126 -11.034 -0.082 5.595 999 HD2 HIS 126 HD2 HIS 126 -11.899 1.482 9.086 1000 HE1 HIS 126 HE1 HIS 126 -11.032 4.674 6.397 1001 HE2 HIS 126 HE2 HIS 126 -11.674 4.102 8.782 1002 H PHE 127 H PHE 127 -13.628 -0.668 4.074 1003 HA PHE 127 HA PHE 127 -15.099 1.924 4.057 1004 HB2 PHE 127 HB2 PHE 127 -13.759 0.348 1.879 1005 HB3 PHE 127 HB3 PHE 127 -14.950 1.597 1.532 1006 HD1 PHE 127 HD1 PHE 127 -14.626 3.957 2.446 1007 HD2 PHE 127 HD2 PHE 127 -11.487 1.009 2.501 1008 HE1 PHE 127 HE1 PHE 127 -12.943 5.737 2.845 1009 HE2 PHE 127 HE2 PHE 127 -9.808 2.787 2.859 1010 HZ PHE 127 HZ PHE 127 -10.541 5.159 3.046 1011 H LYS 128 H LYS 128 -15.621 -1.427 3.931 1012 HA LYS 128 HA LYS 128 -18.021 -1.973 2.754 1013 HB2 LYS 128 HB2 LYS 128 -16.651 -3.605 3.692 1014 HB3 LYS 128 HB3 LYS 128 -16.627 -2.866 5.291 1015 HG2 LYS 128 HG2 LYS 128 -19.220 -3.895 4.223 1016 HG3 LYS 128 HG3 LYS 128 -17.965 -5.062 4.649 1017 HD2 LYS 128 HD2 LYS 128 -18.864 -2.924 6.586 1018 HD3 LYS 128 HD3 LYS 128 -19.688 -4.482 6.482 1019 HE2 LYS 128 HE2 LYS 128 -16.718 -4.129 7.058 1020 HE3 LYS 128 HE3 LYS 128 -17.948 -4.260 8.309 1021 HZ1 LYS 128 HZ1 LYS 128 -17.539 -6.371 6.267 1022 HZ2 LYS 128 HZ2 LYS 128 -16.791 -6.351 7.715 1023 HZ3 LYS 128 HZ3 LYS 128 -18.435 -6.477 7.638 1024 H TRP 129 H TRP 129 -17.697 -0.274 5.847 1025 HA TRP 129 HA TRP 129 -20.669 -0.066 6.122 1026 HB2 TRP 129 HB2 TRP 129 -20.150 0.433 8.492 1027 HB3 TRP 129 HB3 TRP 129 -19.686 -1.164 7.949 1028 HD1 TRP 129 HD1 TRP 129 -17.060 -1.759 7.845 1029 HE1 TRP 129 HE1 TRP 129 -14.999 -0.650 8.699 1030 HE3 TRP 129 HE3 TRP 129 -19.080 2.777 9.052 1031 HZ2 TRP 129 HZ2 TRP 129 -14.204 1.994 9.718 1032 HZ3 TRP 129 HZ3 TRP 129 -17.609 4.638 9.857 1033 HH2 TRP 129 HH2 TRP 129 -15.175 4.254 10.165 1034 H VAL 130 H VAL 130 -18.634 1.695 4.525 1035 HA VAL 130 HA VAL 130 -19.805 4.352 5.219 1036 HB VAL 130 HB VAL 130 -17.097 4.779 4.349 1037 HG11 VAL 130 HG11 VAL 130 -17.053 5.922 6.616 1038 HG12 VAL 130 HG12 VAL 130 -18.481 6.355 5.647 1039 HG13 VAL 130 HG13 VAL 130 -18.608 5.188 6.982 1040 HG21 VAL 130 HG21 VAL 130 -15.753 3.950 6.107 1041 HG22 VAL 130 HG22 VAL 130 -17.135 3.179 6.899 1042 HG23 VAL 130 HG23 VAL 130 -16.555 2.558 5.363 1043 H LYS 131 H LYS 131 -18.298 5.679 3.163 1044 HA LYS 131 HA LYS 131 -18.316 6.174 0.955 1045 HB2 LYS 131 HB2 LYS 131 -16.792 4.253 1.367 1046 HB3 LYS 131 HB3 LYS 131 -18.031 3.147 0.779 1047 HG2 LYS 131 HG2 LYS 131 -17.838 3.935 -1.444 1048 HG3 LYS 131 HG3 LYS 131 -16.966 5.406 -0.947 1049 HD2 LYS 131 HD2 LYS 131 -15.028 4.181 -0.326 1050 HD3 LYS 131 HD3 LYS 131 -15.852 2.615 -0.421 1051 HE2 LYS 131 HE2 LYS 131 -15.900 4.358 -2.856 1052 HE3 LYS 131 HE3 LYS 131 -14.342 3.611 -2.460 1053 HZ1 LYS 131 HZ1 LYS 131 -15.271 1.465 -2.628 1054 HZ2 LYS 131 HZ2 LYS 131 -16.829 1.992 -2.672 1055 HZ3 LYS 131 HZ3 LYS 131 -15.828 2.246 -3.950 1056 H GLN 132 H GLN 132 -20.980 5.583 2.078 1057 HA GLN 132 HA GLN 132 -23.155 5.492 1.481 1058 HB2 GLN 132 HB2 GLN 132 -22.283 6.782 -1.125 1059 HB3 GLN 132 HB3 GLN 132 -23.844 6.886 -0.324 1060 HG2 GLN 132 HG2 GLN 132 -22.894 8.922 0.252 1061 HG3 GLN 132 HG3 GLN 132 -22.584 7.947 1.681 1062 HE21 GLN 132 HE21 GLN 132 -19.260 9.175 1.463 1063 HE22 GLN 132 HE22 GLN 132 -20.726 9.054 2.425 1064 H GLU 133 H GLU 133 -21.773 3.067 0.988 1065 HA GLU 133 HA GLU 133 -23.319 1.854 -1.260 1066 HB2 GLU 133 HB2 GLU 133 -20.800 0.961 0.182 1067 HB3 GLU 133 HB3 GLU 133 -21.755 -0.109 -0.851 1068 HG2 GLU 133 HG2 GLU 133 -21.465 1.426 -2.767 1069 HG3 GLU 133 HG3 GLU 133 -20.515 2.519 -1.765 1070 H1 SER 149 H1 SER 149 9.067 -23.920 -1.125 1071 H2 SER 149 H2 SER 149 10.627 -24.435 -1.005 1072 H3 SER 149 H3 SER 149 9.724 -24.849 -2.309 1073 HA SER 149 HA SER 149 10.546 -22.120 -1.592 1074 HB2 SER 149 HB2 SER 149 11.569 -23.868 -3.863 1075 HB3 SER 149 HB3 SER 149 12.047 -22.193 -3.510 1076 HG SER 149 HG SER 149 13.519 -23.707 -2.616 1077 H GLN 150 H GLN 150 9.417 -20.526 -2.540 1078 HA GLN 150 HA GLN 150 7.354 -21.259 -4.583 1079 HB2 GLN 150 HB2 GLN 150 7.201 -19.191 -2.353 1080 HB3 GLN 150 HB3 GLN 150 5.997 -19.459 -3.609 1081 HG2 GLN 150 HG2 GLN 150 5.117 -20.596 -1.778 1082 HG3 GLN 150 HG3 GLN 150 5.800 -21.878 -2.771 1083 HE21 GLN 150 HE21 GLN 150 7.475 -21.031 0.914 1084 HE22 GLN 150 HE22 GLN 150 6.476 -19.815 0.130 1085 H ILE 151 H ILE 151 6.937 -19.863 -6.270 1086 HA ILE 151 HA ILE 151 8.952 -17.727 -6.837 1087 HB ILE 151 HB ILE 151 8.210 -20.040 -8.675 1088 HG12 ILE 151 HG12 ILE 151 10.847 -19.435 -7.256 1089 HG13 ILE 151 HG13 ILE 151 9.742 -20.755 -6.869 1090 HG21 ILE 151 HG21 ILE 151 10.158 -17.726 -9.120 1091 HG22 ILE 151 HG22 ILE 151 9.901 -19.091 -10.227 1092 HG23 ILE 151 HG23 ILE 151 8.605 -17.959 -9.957 1093 HD11 ILE 151 HD11 ILE 151 10.108 -21.705 -9.160 1094 HD12 ILE 151 HD12 ILE 151 11.409 -20.507 -9.382 1095 HD13 ILE 151 HD13 ILE 151 11.524 -21.706 -8.091 1096 H THR 152 H THR 152 8.227 -16.018 -7.969 1097 HA THR 152 HA THR 152 5.830 -16.237 -9.661 1098 HB THR 152 HB THR 152 6.163 -13.740 -8.033 1099 HG1 THR 152 HG1 THR 152 4.565 -15.994 -7.389 1100 HG21 THR 152 HG21 THR 152 4.764 -13.294 -9.826 1101 HG22 THR 152 HG22 THR 152 3.899 -14.856 -9.683 1102 HG23 THR 152 HG23 THR 152 3.660 -13.573 -8.482 1103 H SER 153 H SER 153 5.823 -14.706 -11.304 1104 HA SER 153 HA SER 153 7.849 -12.710 -11.701 1105 HB2 SER 153 HB2 SER 153 7.974 -15.213 -13.441 1106 HB3 SER 153 HB3 SER 153 8.770 -13.691 -13.879 1107 HG SER 153 HG SER 153 9.321 -14.671 -11.337 1108 H GLN 154 H GLN 154 5.140 -12.823 -11.615 1109 HA GLN 154 HA GLN 154 4.532 -10.995 -13.657 1110 HB2 GLN 154 HB2 GLN 154 2.710 -12.024 -14.825 1111 HB3 GLN 154 HB3 GLN 154 4.114 -13.071 -14.961 1112 HG2 GLN 154 HG2 GLN 154 3.194 -14.521 -13.141 1113 HG3 GLN 154 HG3 GLN 154 1.782 -13.475 -13.031 1114 HE21 GLN 154 HE21 GLN 154 0.372 -15.998 -15.153 1115 HE22 GLN 154 HE22 GLN 154 0.485 -15.443 -13.477 1116 H VAL 155 H VAL 155 2.462 -9.894 -13.354 1117 HA VAL 155 HA VAL 155 0.810 -10.762 -11.045 1118 HB VAL 155 HB VAL 155 1.133 -8.373 -11.079 1119 HG11 VAL 155 HG11 VAL 155 1.614 -7.917 -13.390 1120 HG12 VAL 155 HG12 VAL 155 -0.020 -8.430 -13.880 1121 HG13 VAL 155 HG13 VAL 155 0.187 -6.982 -12.897 1122 HG21 VAL 155 HG21 VAL 155 -1.034 -8.923 -10.168 1123 HG22 VAL 155 HG22 VAL 155 -1.240 -7.546 -11.186 1124 HG23 VAL 155 HG23 VAL 155 -1.716 -9.114 -11.814 1125 H TPO 156 H T2P 156 -1.165 -11.675 -11.474 1126 HA TPO 156 HA T2P 156 -1.180 -13.461 -13.695 1127 HB TPO 156 HB T2P 156 -2.173 -13.582 -11.256 1128 HG21 TPO 156 HG21 T2P 156 -4.277 -12.476 -11.683 1129 HG22 TPO 156 HG22 T2P 156 -4.472 -14.195 -11.288 1130 HG23 TPO 156 HG23 T2P 156 -4.654 -13.657 -12.968 1131 H GLY 157 H GLY 157 -3.130 -14.085 -14.786 1132 HA2 GLY 157 HA2 GLY 157 -4.667 -11.950 -16.101 1133 HA3 GLY 157 HA3 GLY 157 -3.367 -12.587 -17.117 1134 H GLN 158 H GLN 158 -3.774 -15.361 -15.899 1135 HA GLN 158 HA GLN 158 -5.821 -16.302 -17.684 1136 HB2 GLN 158 HB2 GLN 158 -5.304 -18.494 -16.827 1137 HB3 GLN 158 HB3 GLN 158 -3.832 -17.604 -17.203 1138 HG2 GLN 158 HG2 GLN 158 -3.493 -17.130 -14.778 1139 HG3 GLN 158 HG3 GLN 158 -4.966 -18.021 -14.398 1140 HE21 GLN 158 HE21 GLN 158 -1.925 -20.259 -14.014 1141 HE22 GLN 158 HE22 GLN 158 -2.254 -18.619 -13.427 1142 H ILE 159 H ILE 159 -6.038 -15.183 -14.370 1143 HA ILE 159 HA ILE 159 -8.902 -15.954 -14.393 1144 HB ILE 159 HB ILE 159 -7.774 -17.933 -13.561 1145 HG12 ILE 159 HG12 ILE 159 -8.958 -18.295 -11.433 1146 HG13 ILE 159 HG13 ILE 159 -9.353 -16.581 -11.339 1147 HG21 ILE 159 HG21 ILE 159 -6.547 -18.056 -11.526 1148 HG22 ILE 159 HG22 ILE 159 -5.767 -16.842 -12.531 1149 HG23 ILE 159 HG23 ILE 159 -6.799 -16.338 -11.179 1150 HD11 ILE 159 HD11 ILE 159 -10.732 -16.767 -13.382 1151 HD12 ILE 159 HD12 ILE 159 -10.235 -18.465 -13.575 1152 HD13 ILE 159 HD13 ILE 159 -11.228 -17.976 -12.188 1153 H GLY 160 H GLY 160 -6.487 -14.313 -12.334 1154 HA2 GLY 160 HA2 GLY 160 -6.703 -12.340 -11.093 1155 HA3 GLY 160 HA3 GLY 160 -8.294 -12.066 -11.809 1156 H TRP 161 H TRP 161 -6.788 -14.503 -9.697 1157 HA TRP 161 HA TRP 161 -9.180 -14.724 -7.983 1158 HB2 TRP 161 HB2 TRP 161 -8.330 -16.913 -7.418 1159 HB3 TRP 161 HB3 TRP 161 -8.528 -16.681 -9.125 1160 HD1 TRP 161 HD1 TRP 161 -5.345 -15.067 -8.566 1161 HE1 TRP 161 HE1 TRP 161 -3.533 -16.574 -9.612 1162 HE3 TRP 161 HE3 TRP 161 -7.796 -19.530 -8.345 1163 HZ2 TRP 161 HZ2 TRP 161 -3.142 -19.337 -10.127 1164 HZ3 TRP 161 HZ3 TRP 161 -6.660 -21.633 -9.099 1165 HH2 TRP 161 HH2 TRP 161 -4.345 -21.547 -10.007 1166 H ARG 162 H ARG 162 -7.106 -16.165 -6.194 1167 HA ARG 162 HA ARG 162 -7.224 -13.954 -4.169 1168 HB2 ARG 162 HB2 ARG 162 -8.426 -16.761 -4.052 1169 HB3 ARG 162 HB3 ARG 162 -8.637 -15.506 -2.836 1170 HG2 ARG 162 HG2 ARG 162 -9.709 -15.399 -5.690 1171 HG3 ARG 162 HG3 ARG 162 -10.628 -15.850 -4.266 1172 HD2 ARG 162 HD2 ARG 162 -10.471 -13.658 -3.318 1173 HD3 ARG 162 HD3 ARG 162 -9.309 -13.110 -4.521 1174 HE ARG 162 HE ARG 162 -12.238 -13.587 -4.851 1175 HH11 ARG 162 HH11 ARG 162 -13.282 -12.831 -6.655 1176 HH12 ARG 162 HH12 ARG 162 -12.373 -12.057 -7.920 1177 HH21 ARG 162 HH21 ARG 162 -9.309 -12.456 -6.459 1178 HH22 ARG 162 HH22 ARG 162 -10.183 -12.052 -7.901 1179 H ARG 163 H ARG 163 -6.821 -15.289 -1.901 1180 HA ARG 163 HA ARG 163 -4.037 -16.213 -1.913 1181 HB2 ARG 163 HB2 ARG 163 -4.189 -16.297 0.466 1182 HB3 ARG 163 HB3 ARG 163 -4.863 -14.773 -0.102 1183 HG2 ARG 163 HG2 ARG 163 -7.173 -15.720 0.188 1184 HG3 ARG 163 HG3 ARG 163 -6.461 -17.203 0.847 1185 HD2 ARG 163 HD2 ARG 163 -6.155 -14.414 2.006 1186 HD3 ARG 163 HD3 ARG 163 -7.282 -15.638 2.594 1187 HE ARG 163 HE ARG 163 -4.935 -16.960 2.835 1188 HH11 ARG 163 HH11 ARG 163 -3.463 -16.896 4.535 1189 HH12 ARG 163 HH12 ARG 163 -3.404 -15.485 5.556 1190 HH21 ARG 163 HH21 ARG 163 -5.857 -13.769 3.954 1191 HH22 ARG 163 HH22 ARG 163 -4.611 -13.696 5.151 Start of MODEL 22 1 H1 GLY -4 H1 GLY -4 17.305 18.928 17.414 2 H2 GLY -4 H2 GLY -4 17.635 20.510 17.146 3 H3 GLY -4 H3 GLY -4 17.295 19.522 15.887 4 HA2 GLY -4 HA2 GLY -4 15.039 19.190 16.669 5 HA3 GLY -4 HA3 GLY -4 15.408 20.275 18.022 6 H SER -3 H SER -3 13.561 21.514 17.225 7 HA SER -3 HA SER -3 14.378 23.621 15.328 8 HB2 SER -3 HB2 SER -3 13.227 21.987 13.899 9 HB3 SER -3 HB3 SER -3 11.831 21.987 14.992 10 HG SER -3 HG SER -3 11.540 23.370 13.181 11 HA PRO -2 HA PRO -2 11.973 25.946 18.387 12 HB2 PRO -2 HB2 PRO -2 11.856 28.399 17.213 13 HB3 PRO -2 HB3 PRO -2 13.382 27.715 17.848 14 HG2 PRO -2 HG2 PRO -2 12.371 27.645 14.980 15 HG3 PRO -2 HG3 PRO -2 13.975 28.195 15.570 16 HD2 PRO -2 HD2 PRO -2 13.591 25.677 14.633 17 HD3 PRO -2 HD3 PRO -2 14.671 25.986 16.022 18 H ASN -1 H ASN -1 10.820 25.020 15.296 19 HA ASN -1 HA ASN -1 8.043 25.936 15.923 20 HB2 ASN -1 HB2 ASN -1 9.073 27.298 14.126 21 HB3 ASN -1 HB3 ASN -1 9.431 25.832 13.210 22 HD21 ASN -1 HD21 ASN -1 5.566 27.224 13.356 23 HD22 ASN -1 HD22 ASN -1 6.731 27.796 14.540 24 H SER 0 H SER 0 6.349 24.572 15.402 25 HA SER 0 HA SER 0 6.805 22.020 14.035 26 HB2 SER 0 HB2 SER 0 7.296 21.439 16.383 27 HB3 SER 0 HB3 SER 0 5.718 22.081 16.878 28 HG SER 0 HG SER 0 5.818 19.754 16.506 29 H MET 1 H MET 1 4.938 21.103 13.233 30 HA MET 1 HA MET 1 2.366 22.619 13.495 31 HB2 MET 1 HB2 MET 1 3.447 21.160 11.053 32 HB3 MET 1 HB3 MET 1 1.844 21.900 11.189 33 HG2 MET 1 HG2 MET 1 2.896 24.110 11.589 34 HG3 MET 1 HG3 MET 1 4.492 23.381 11.381 35 HE1 MET 1 HE1 MET 1 3.560 25.955 9.817 36 HE2 MET 1 HE2 MET 1 5.151 25.184 9.619 37 HE3 MET 1 HE3 MET 1 4.174 25.588 8.190 38 H ALA 2 H ALA 2 3.800 19.903 14.592 39 HA ALA 2 HA ALA 2 1.673 17.950 14.052 40 HB1 ALA 2 HB1 ALA 2 4.087 17.355 14.051 41 HB2 ALA 2 HB2 ALA 2 4.178 17.796 15.775 42 HB3 ALA 2 HB3 ALA 2 3.169 16.431 15.255 43 H THR 3 H THR 3 1.554 20.513 16.008 44 HA THR 3 HA THR 3 1.138 19.317 18.617 45 HB THR 3 HB THR 3 0.887 21.661 19.344 46 HG1 THR 3 HG1 THR 3 1.091 23.289 17.796 47 HG21 THR 3 HG21 THR 3 3.193 21.356 17.375 48 HG22 THR 3 HG22 THR 3 3.122 22.430 18.789 49 HG23 THR 3 HG23 THR 3 3.164 20.671 19.015 50 H GLU 4 H GLU 4 -0.980 19.860 16.085 51 HA GLU 4 HA GLU 4 -3.378 20.442 17.670 52 HB2 GLU 4 HB2 GLU 4 -4.562 20.524 15.670 53 HB3 GLU 4 HB3 GLU 4 -2.991 21.223 15.302 54 HG2 GLU 4 HG2 GLU 4 -2.304 19.006 14.298 55 HG3 GLU 4 HG3 GLU 4 -3.935 18.400 14.598 56 H LEU 5 H LEU 5 -5.387 18.979 17.027 57 HA LEU 5 HA LEU 5 -4.993 16.445 18.342 58 HB2 LEU 5 HB2 LEU 5 -6.996 18.334 18.269 59 HB3 LEU 5 HB3 LEU 5 -7.684 17.104 17.229 60 HG LEU 5 HG LEU 5 -6.615 16.728 20.052 61 HD11 LEU 5 HD11 LEU 5 -8.983 16.463 20.699 62 HD12 LEU 5 HD12 LEU 5 -8.697 18.047 19.962 63 HD13 LEU 5 HD13 LEU 5 -9.482 16.761 19.018 64 HD21 LEU 5 HD21 LEU 5 -6.433 14.595 18.831 65 HD22 LEU 5 HD22 LEU 5 -7.736 14.507 20.020 66 HD23 LEU 5 HD23 LEU 5 -8.122 14.737 18.300 67 H GLU 6 H GLU 6 -3.577 16.413 15.978 68 HA GLU 6 HA GLU 6 -4.958 14.894 13.906 69 HB2 GLU 6 HB2 GLU 6 -2.202 15.934 14.405 70 HB3 GLU 6 HB3 GLU 6 -2.316 14.495 13.386 71 HG2 GLU 6 HG2 GLU 6 -3.879 17.049 12.858 72 HG3 GLU 6 HG3 GLU 6 -2.308 16.688 12.148 73 H TYR 7 H TYR 7 -5.114 12.624 13.770 74 HA TYR 7 HA TYR 7 -3.377 10.900 15.342 75 HB2 TYR 7 HB2 TYR 7 -4.966 9.926 16.755 76 HB3 TYR 7 HB3 TYR 7 -5.234 11.645 16.939 77 HD1 TYR 7 HD1 TYR 7 -6.691 8.445 16.115 78 HD2 TYR 7 HD2 TYR 7 -7.246 12.708 15.714 79 HE1 TYR 7 HE1 TYR 7 -9.088 8.074 15.631 80 HE2 TYR 7 HE2 TYR 7 -9.665 12.336 15.230 81 HH TYR 7 HH TYR 7 -11.121 9.058 15.189 82 H GLU 8 H GLU 8 -4.178 8.582 15.273 83 HA GLU 8 HA GLU 8 -5.940 7.698 13.220 84 HB2 GLU 8 HB2 GLU 8 -4.348 6.351 11.935 85 HB3 GLU 8 HB3 GLU 8 -4.181 8.053 11.620 86 HG2 GLU 8 HG2 GLU 8 -2.353 6.687 13.629 87 HG3 GLU 8 HG3 GLU 8 -2.055 6.569 11.918 88 H SER 9 H SER 9 -6.760 5.851 13.822 89 HA SER 9 HA SER 9 -5.695 4.384 16.138 90 HB2 SER 9 HB2 SER 9 -8.287 4.254 14.578 91 HB3 SER 9 HB3 SER 9 -7.885 3.127 15.895 92 HG SER 9 HG SER 9 -9.095 4.933 16.648 93 H VAL 10 H VAL 10 -4.933 2.199 16.033 94 HA VAL 10 HA VAL 10 -4.030 1.369 13.404 95 HB VAL 10 HB VAL 10 -2.644 1.087 15.379 96 HG11 VAL 10 HG11 VAL 10 -4.468 -1.223 16.163 97 HG12 VAL 10 HG12 VAL 10 -2.944 -0.752 16.936 98 HG13 VAL 10 HG13 VAL 10 -4.344 0.326 17.026 99 HG21 VAL 10 HG21 VAL 10 -3.218 -1.561 13.993 100 HG22 VAL 10 HG22 VAL 10 -2.242 -0.234 13.319 101 HG23 VAL 10 HG23 VAL 10 -1.716 -1.066 14.791 102 H LEU 11 H LEU 11 -4.673 -0.158 12.045 103 HA LEU 11 HA LEU 11 -7.170 -1.704 12.655 104 HB2 LEU 11 HB2 LEU 11 -6.087 -0.808 9.956 105 HB3 LEU 11 HB3 LEU 11 -7.546 -1.741 10.242 106 HG LEU 11 HG LEU 11 -7.076 1.175 10.972 107 HD11 LEU 11 HD11 LEU 11 -8.909 -0.258 8.993 108 HD12 LEU 11 HD12 LEU 11 -8.928 1.479 9.323 109 HD13 LEU 11 HD13 LEU 11 -7.496 0.742 8.598 110 HD21 LEU 11 HD21 LEU 11 -8.493 0.211 12.721 111 HD22 LEU 11 HD22 LEU 11 -9.477 1.198 11.642 112 HD23 LEU 11 HD23 LEU 11 -9.520 -0.574 11.496 113 H CYS 12 H CYS 12 -4.003 -1.858 10.932 114 HA CYS 12 HA CYS 12 -3.901 -4.768 11.403 115 HB2 CYS 12 HB2 CYS 12 -5.137 -4.280 9.208 116 HB3 CYS 12 HB3 CYS 12 -3.562 -3.773 8.569 117 HG CYS 12 HG CYS 12 -4.351 -6.240 7.890 118 H VAL 13 H VAL 13 -1.951 -5.767 11.037 119 HA VAL 13 HA VAL 13 0.435 -4.182 10.444 120 HB VAL 13 HB VAL 13 0.305 -4.019 12.867 121 HG11 VAL 13 HG11 VAL 13 0.504 -5.892 14.380 122 HG12 VAL 13 HG12 VAL 13 -0.970 -6.064 13.420 123 HG13 VAL 13 HG13 VAL 13 0.460 -7.048 13.038 124 HG21 VAL 13 HG21 VAL 13 2.520 -4.838 13.446 125 HG22 VAL 13 HG22 VAL 13 2.521 -5.950 12.065 126 HG23 VAL 13 HG23 VAL 13 2.540 -4.193 11.801 127 H LYS 14 H LYS 14 1.769 -5.306 9.184 128 HA LYS 14 HA LYS 14 1.642 -8.268 9.285 129 HB2 LYS 14 HB2 LYS 14 1.703 -6.676 6.713 130 HB3 LYS 14 HB3 LYS 14 2.312 -8.309 6.781 131 HG2 LYS 14 HG2 LYS 14 -0.518 -7.528 7.594 132 HG3 LYS 14 HG3 LYS 14 -0.038 -8.124 6.002 133 HD2 LYS 14 HD2 LYS 14 0.829 -10.225 7.062 134 HD3 LYS 14 HD3 LYS 14 0.188 -9.676 8.630 135 HE2 LYS 14 HE2 LYS 14 -2.064 -9.560 7.725 136 HE3 LYS 14 HE3 LYS 14 -1.456 -9.976 6.110 137 HZ1 LYS 14 HZ1 LYS 14 -2.381 -11.915 7.162 138 HZ2 LYS 14 HZ2 LYS 14 -0.758 -12.132 6.991 139 HZ3 LYS 14 HZ3 LYS 14 -1.390 -11.774 8.468 140 HA PRO 15 HA PRO 15 5.647 -8.085 10.587 141 HB2 PRO 15 HB2 PRO 15 6.540 -10.654 10.197 142 HB3 PRO 15 HB3 PRO 15 5.228 -10.230 11.335 143 HG2 PRO 15 HG2 PRO 15 4.931 -11.215 8.463 144 HG3 PRO 15 HG3 PRO 15 4.123 -11.851 9.935 145 HD2 PRO 15 HD2 PRO 15 2.891 -10.097 8.340 146 HD3 PRO 15 HD3 PRO 15 2.755 -9.958 10.120 147 H ASP 16 H ASP 16 5.347 -9.023 7.197 148 HA ASP 16 HA ASP 16 7.944 -7.734 6.632 149 HB2 ASP 16 HB2 ASP 16 8.430 -10.152 6.758 150 HB3 ASP 16 HB3 ASP 16 7.179 -10.470 5.553 151 H VAL 17 H VAL 17 7.885 -6.450 4.899 152 HA VAL 17 HA VAL 17 6.094 -6.965 2.653 153 HB VAL 17 HB VAL 17 4.677 -5.624 4.197 154 HG11 VAL 17 HG11 VAL 17 6.629 -3.353 3.726 155 HG12 VAL 17 HG12 VAL 17 5.093 -3.277 4.604 156 HG13 VAL 17 HG13 VAL 17 6.437 -4.234 5.252 157 HG21 VAL 17 HG21 VAL 17 4.354 -5.537 1.745 158 HG22 VAL 17 HG22 VAL 17 3.873 -4.047 2.568 159 HG23 VAL 17 HG23 VAL 17 5.404 -4.101 1.676 160 H SER 18 H SER 18 6.879 -6.146 0.755 161 HA SER 18 HA SER 18 9.361 -4.467 0.863 162 HB2 SER 18 HB2 SER 18 10.223 -5.585 -0.999 163 HB3 SER 18 HB3 SER 18 9.712 -6.845 0.125 164 HG SER 18 HG SER 18 7.705 -6.889 -1.175 165 H VAL 19 H VAL 19 9.643 -2.844 -0.733 166 HA VAL 19 HA VAL 19 7.200 -2.256 -2.363 167 HB VAL 19 HB VAL 19 7.379 -0.010 -2.308 168 HG11 VAL 19 HG11 VAL 19 7.627 -0.996 0.551 169 HG12 VAL 19 HG12 VAL 19 6.806 0.467 -0.022 170 HG13 VAL 19 HG13 VAL 19 6.178 -1.118 -0.469 171 HG21 VAL 19 HG21 VAL 19 9.785 -0.116 -0.508 172 HG22 VAL 19 HG22 VAL 19 9.861 0.243 -2.250 173 HG23 VAL 19 HG23 VAL 19 8.976 1.318 -1.217 174 H TYR 20 H TYR 20 7.405 -1.268 -4.285 175 HA TYR 20 HA TYR 20 10.106 -1.194 -5.591 176 HB2 TYR 20 HB2 TYR 20 7.517 -1.830 -7.047 177 HB3 TYR 20 HB3 TYR 20 9.163 -2.005 -7.622 178 HD1 TYR 20 HD1 TYR 20 6.349 -3.652 -6.132 179 HD2 TYR 20 HD2 TYR 20 10.644 -3.780 -6.404 180 HE1 TYR 20 HE1 TYR 20 6.311 -6.042 -5.469 181 HE2 TYR 20 HE2 TYR 20 10.604 -6.166 -5.627 182 HH TYR 20 HH TYR 20 7.588 -7.922 -4.981 183 H ARG 21 H ARG 21 10.462 1.116 -5.659 184 HA ARG 21 HA ARG 21 8.434 3.042 -6.401 185 HB2 ARG 21 HB2 ARG 21 11.457 3.051 -6.800 186 HB3 ARG 21 HB3 ARG 21 10.405 4.391 -7.271 187 HG2 ARG 21 HG2 ARG 21 9.608 4.610 -4.930 188 HG3 ARG 21 HG3 ARG 21 10.724 3.333 -4.426 189 HD2 ARG 21 HD2 ARG 21 11.517 5.969 -5.747 190 HD3 ARG 21 HD3 ARG 21 11.542 5.667 -4.008 191 HE ARG 21 HE ARG 21 13.191 3.835 -4.426 192 HH11 ARG 21 HH11 ARG 21 15.135 3.390 -5.274 193 HH12 ARG 21 HH12 ARG 21 15.905 4.517 -6.376 194 HH21 ARG 21 HH21 ARG 21 13.167 6.586 -6.617 195 HH22 ARG 21 HH22 ARG 21 14.789 6.259 -7.163 196 H ILE 22 H ILE 22 7.447 3.478 -8.231 197 HA ILE 22 HA ILE 22 8.313 2.053 -10.713 198 HB ILE 22 HB ILE 22 6.045 1.604 -11.301 199 HG12 ILE 22 HG12 ILE 22 5.276 3.075 -8.753 200 HG13 ILE 22 HG13 ILE 22 4.841 3.488 -10.416 201 HG21 ILE 22 HG21 ILE 22 6.456 0.697 -8.467 202 HG22 ILE 22 HG22 ILE 22 5.540 -0.104 -9.728 203 HG23 ILE 22 HG23 ILE 22 7.301 0.005 -9.871 204 HD11 ILE 22 HD11 ILE 22 3.811 1.159 -8.776 205 HD12 ILE 22 HD12 ILE 22 2.926 2.560 -9.394 206 HD13 ILE 22 HD13 ILE 22 3.535 1.332 -10.528 207 HA PRO 23 HA PRO 23 7.854 6.015 -12.664 208 HB2 PRO 23 HB2 PRO 23 8.235 5.367 -15.308 209 HB3 PRO 23 HB3 PRO 23 9.512 5.483 -14.067 210 HG2 PRO 23 HG2 PRO 23 8.206 3.016 -15.176 211 HG3 PRO 23 HG3 PRO 23 9.902 3.273 -14.699 212 HD2 PRO 23 HD2 PRO 23 7.999 1.999 -13.105 213 HD3 PRO 23 HD3 PRO 23 9.469 2.804 -12.488 214 HA PRO 24 HA PRO 24 3.998 5.583 -15.399 215 HB2 PRO 24 HB2 PRO 24 2.395 3.407 -15.458 216 HB3 PRO 24 HB3 PRO 24 3.954 3.445 -16.336 217 HG2 PRO 24 HG2 PRO 24 3.412 2.288 -13.576 218 HG3 PRO 24 HG3 PRO 24 4.199 1.483 -14.973 219 HD2 PRO 24 HD2 PRO 24 5.619 2.724 -13.006 220 HD3 PRO 24 HD3 PRO 24 6.158 2.740 -14.711 221 H ARG 25 H ARG 25 1.652 5.801 -15.111 222 HA ARG 25 HA ARG 25 0.595 5.643 -12.302 223 HB2 ARG 25 HB2 ARG 25 1.150 7.966 -12.749 224 HB3 ARG 25 HB3 ARG 25 0.218 7.936 -14.256 225 HG2 ARG 25 HG2 ARG 25 -1.860 7.518 -13.001 226 HG3 ARG 25 HG3 ARG 25 -0.952 7.444 -11.479 227 HD2 ARG 25 HD2 ARG 25 -0.259 9.794 -11.760 228 HD3 ARG 25 HD3 ARG 25 -1.089 9.887 -13.313 229 HE ARG 25 HE ARG 25 -2.280 9.971 -10.629 230 HH11 ARG 25 HH11 ARG 25 -4.431 10.475 -10.405 231 HH12 ARG 25 HH12 ARG 25 -5.486 10.410 -11.784 232 HH21 ARG 25 HH21 ARG 25 -3.053 9.517 -14.021 233 HH22 ARG 25 HH22 ARG 25 -4.736 9.890 -13.775 234 H ALA 26 H ALA 26 -0.357 5.778 -15.759 235 HA ALA 26 HA ALA 26 -2.688 4.051 -15.097 236 HB1 ALA 26 HB1 ALA 26 -3.361 6.347 -14.616 237 HB2 ALA 26 HB2 ALA 26 -2.879 6.860 -16.250 238 HB3 ALA 26 HB3 ALA 26 -4.227 5.710 -16.034 239 H SER 27 H SER 27 -1.985 2.462 -16.267 240 HA SER 27 HA SER 27 -1.997 2.715 -19.247 241 HB2 SER 27 HB2 SER 27 -0.236 1.297 -18.342 242 HB3 SER 27 HB3 SER 27 -1.431 0.312 -17.479 243 HG SER 27 HG SER 27 -0.649 -0.414 -19.661 244 H ASN 28 H ASN 28 -3.422 1.279 -20.394 245 HA ASN 28 HA ASN 28 -6.149 1.511 -19.773 246 HB2 ASN 28 HB2 ASN 28 -6.495 0.336 -21.792 247 HB3 ASN 28 HB3 ASN 28 -5.007 1.240 -22.030 248 HD21 ASN 28 HD21 ASN 28 -3.064 -1.936 -21.886 249 HD22 ASN 28 HD22 ASN 28 -2.971 -0.439 -20.987 250 H ARG 29 H ARG 29 -3.969 -0.994 -18.683 251 HA ARG 29 HA ARG 29 -6.255 -2.631 -17.620 252 HB2 ARG 29 HB2 ARG 29 -3.317 -3.401 -17.627 253 HB3 ARG 29 HB3 ARG 29 -4.711 -4.437 -17.340 254 HG2 ARG 29 HG2 ARG 29 -3.796 -3.240 -19.960 255 HG3 ARG 29 HG3 ARG 29 -3.839 -4.943 -19.495 256 HD2 ARG 29 HD2 ARG 29 -6.375 -4.733 -19.340 257 HD3 ARG 29 HD3 ARG 29 -6.198 -3.112 -20.053 258 HE ARG 29 HE ARG 29 -4.867 -5.114 -21.654 259 HH11 ARG 29 HH11 ARG 29 -5.681 -5.666 -23.647 260 HH12 ARG 29 HH12 ARG 29 -7.337 -5.309 -24.040 261 HH21 ARG 29 HH21 ARG 29 -8.068 -3.833 -21.032 262 HH22 ARG 29 HH22 ARG 29 -8.659 -4.296 -22.605 263 H GLY 30 H GLY 30 -4.241 -0.210 -16.585 264 HA2 GLY 30 HA2 GLY 30 -4.587 0.518 -14.208 265 HA3 GLY 30 HA3 GLY 30 -4.208 -1.150 -13.742 266 H TYR 31 H TYR 31 -2.172 -1.611 -13.292 267 HA TYR 31 HA TYR 31 0.047 0.265 -14.100 268 HB2 TYR 31 HB2 TYR 31 -0.563 -1.177 -11.507 269 HB3 TYR 31 HB3 TYR 31 1.060 -0.653 -11.906 270 HD1 TYR 31 HD1 TYR 31 -2.321 0.489 -11.055 271 HD2 TYR 31 HD2 TYR 31 1.730 1.618 -12.003 272 HE1 TYR 31 HE1 TYR 31 -2.733 2.757 -10.081 273 HE2 TYR 31 HE2 TYR 31 1.357 3.856 -10.956 274 HH TYR 31 HH TYR 31 -1.799 4.782 -9.526 275 H ARG 32 H ARG 32 -0.887 -3.096 -13.688 276 HA ARG 32 HA ARG 32 0.132 -5.056 -13.631 277 HB2 ARG 32 HB2 ARG 32 1.755 -4.765 -16.034 278 HB3 ARG 32 HB3 ARG 32 0.424 -5.815 -15.607 279 HG2 ARG 32 HG2 ARG 32 -0.479 -4.814 -17.411 280 HG3 ARG 32 HG3 ARG 32 -1.090 -3.740 -16.174 281 HD2 ARG 32 HD2 ARG 32 -0.352 -2.271 -17.826 282 HD3 ARG 32 HD3 ARG 32 0.973 -2.258 -16.670 283 HE ARG 32 HE ARG 32 2.379 -3.049 -18.288 284 HH11 ARG 32 HH11 ARG 32 3.070 -3.504 -20.179 285 HH12 ARG 32 HH12 ARG 32 2.017 -4.143 -21.440 286 HH21 ARG 32 HH21 ARG 32 -0.820 -3.885 -19.482 287 HH22 ARG 32 HH22 ARG 32 -0.173 -4.327 -21.039 288 H ALA 33 H ALA 33 1.430 -5.586 -11.989 289 HA ALA 33 HA ALA 33 3.951 -4.548 -11.335 290 HB1 ALA 33 HB1 ALA 33 2.635 -6.116 -9.918 291 HB2 ALA 33 HB2 ALA 33 3.025 -7.442 -11.032 292 HB3 ALA 33 HB3 ALA 33 4.305 -6.626 -10.109 293 H SER 34 H SER 34 3.176 -7.178 -13.531 294 HA SER 34 HA SER 34 5.607 -8.069 -14.489 295 HB2 SER 34 HB2 SER 34 2.906 -7.633 -15.835 296 HB3 SER 34 HB3 SER 34 4.177 -8.740 -16.437 297 HG SER 34 HG SER 34 2.536 -9.743 -15.166 298 H ASP 35 H ASP 35 4.357 -4.847 -15.067 299 HA ASP 35 HA ASP 35 5.900 -4.422 -17.538 300 HB2 ASP 35 HB2 ASP 35 3.567 -3.444 -16.802 301 HB3 ASP 35 HB3 ASP 35 4.527 -2.281 -15.900 302 H TRP 36 H TRP 36 6.346 -4.039 -14.107 303 HA TRP 36 HA TRP 36 8.901 -2.543 -14.457 304 HB2 TRP 36 HB2 TRP 36 8.249 -1.634 -12.056 305 HB3 TRP 36 HB3 TRP 36 7.820 -0.861 -13.549 306 HD1 TRP 36 HD1 TRP 36 5.376 -0.615 -14.201 307 HE1 TRP 36 HE1 TRP 36 3.132 -1.019 -13.047 308 HE3 TRP 36 HE3 TRP 36 7.028 -3.221 -10.126 309 HZ2 TRP 36 HZ2 TRP 36 2.249 -1.873 -10.406 310 HZ3 TRP 36 HZ3 TRP 36 5.465 -3.806 -8.292 311 HH2 TRP 36 HH2 TRP 36 3.083 -3.105 -8.398 312 H LYS 37 H LYS 37 9.834 -2.738 -11.842 313 HA LYS 37 HA LYS 37 10.774 -5.502 -11.665 314 HB2 LYS 37 HB2 LYS 37 11.153 -2.966 -10.040 315 HB3 LYS 37 HB3 LYS 37 11.671 -4.526 -9.401 316 HG2 LYS 37 HG2 LYS 37 13.126 -4.931 -11.295 317 HG3 LYS 37 HG3 LYS 37 12.578 -3.452 -12.107 318 HD2 LYS 37 HD2 LYS 37 13.601 -2.037 -10.502 319 HD3 LYS 37 HD3 LYS 37 13.822 -3.356 -9.332 320 HE2 LYS 37 HE2 LYS 37 15.445 -4.458 -10.786 321 HE3 LYS 37 HE3 LYS 37 15.211 -3.230 -12.040 322 HZ1 LYS 37 HZ1 LYS 37 16.308 -2.703 -9.325 323 HZ2 LYS 37 HZ2 LYS 37 17.187 -2.777 -10.697 324 HZ3 LYS 37 HZ3 LYS 37 16.105 -1.574 -10.492 325 H LEU 38 H LEU 38 9.258 -6.978 -11.191 326 HA LEU 38 HA LEU 38 7.491 -6.593 -8.850 327 HB2 LEU 38 HB2 LEU 38 6.090 -8.218 -9.731 328 HB3 LEU 38 HB3 LEU 38 6.524 -7.153 -11.040 329 HG LEU 38 HG LEU 38 7.759 -9.915 -10.603 330 HD11 LEU 38 HD11 LEU 38 6.325 -10.614 -12.469 331 HD12 LEU 38 HD12 LEU 38 5.361 -10.082 -11.084 332 HD13 LEU 38 HD13 LEU 38 5.538 -9.017 -12.482 333 HD21 LEU 38 HD21 LEU 38 9.267 -8.632 -11.974 334 HD22 LEU 38 HD22 LEU 38 8.335 -9.630 -13.075 335 HD23 LEU 38 HD23 LEU 38 7.916 -7.923 -12.904 336 H ASP 39 H ASP 39 10.505 -7.891 -9.116 337 HA ASP 39 HA ASP 39 10.060 -9.235 -6.549 338 HB2 ASP 39 HB2 ASP 39 9.848 -10.932 -8.569 339 HB3 ASP 39 HB3 ASP 39 11.604 -10.854 -8.579 340 H GLN 40 H GLN 40 11.572 -6.879 -7.759 341 HA GLN 40 HA GLN 40 14.265 -7.345 -6.522 342 HB2 GLN 40 HB2 GLN 40 13.589 -5.896 -9.088 343 HB3 GLN 40 HB3 GLN 40 15.131 -5.748 -8.233 344 HG2 GLN 40 HG2 GLN 40 15.527 -8.177 -8.490 345 HG3 GLN 40 HG3 GLN 40 13.982 -8.352 -9.327 346 HE21 GLN 40 HE21 GLN 40 15.383 -7.435 -12.451 347 HE22 GLN 40 HE22 GLN 40 14.050 -8.183 -11.584 348 HA PRO 41 HA PRO 41 11.773 -4.026 -4.522 349 HB2 PRO 41 HB2 PRO 41 12.335 -4.482 -1.893 350 HB3 PRO 41 HB3 PRO 41 11.224 -5.496 -2.871 351 HG2 PRO 41 HG2 PRO 41 14.158 -6.014 -2.287 352 HG3 PRO 41 HG3 PRO 41 12.773 -7.131 -2.054 353 HD2 PRO 41 HD2 PRO 41 14.303 -7.220 -4.296 354 HD3 PRO 41 HD3 PRO 41 12.532 -7.466 -4.382 355 H ASP 42 H ASP 42 12.108 -2.084 -3.579 356 HA ASP 42 HA ASP 42 14.873 -0.982 -3.767 357 HB2 ASP 42 HB2 ASP 42 13.063 -0.009 -5.144 358 HB3 ASP 42 HB3 ASP 42 12.137 0.347 -3.684 359 H TRP 43 H TRP 43 12.217 -1.461 -1.499 360 HA TRP 43 HA TRP 43 14.044 -1.139 0.757 361 HB2 TRP 43 HB2 TRP 43 13.236 1.104 0.692 362 HB3 TRP 43 HB3 TRP 43 11.600 0.607 0.364 363 HD1 TRP 43 HD1 TRP 43 13.848 1.534 3.133 364 HE1 TRP 43 HE1 TRP 43 12.670 1.322 5.407 365 HE3 TRP 43 HE3 TRP 43 9.661 -1.022 1.654 366 HZ2 TRP 43 HZ2 TRP 43 10.177 0.283 6.423 367 HZ3 TRP 43 HZ3 TRP 43 7.893 -1.593 3.291 368 HH2 TRP 43 HH2 TRP 43 8.135 -0.945 5.681 369 H THR 44 H THR 44 13.312 -2.243 2.643 370 HA THR 44 HA THR 44 10.785 -3.752 2.534 371 HB THR 44 HB THR 44 11.838 -5.800 3.266 372 HG1 THR 44 HG1 THR 44 14.333 -4.595 2.673 373 HG21 THR 44 HG21 THR 44 11.534 -5.514 0.842 374 HG22 THR 44 HG22 THR 44 13.207 -4.950 0.688 375 HG23 THR 44 HG23 THR 44 12.864 -6.607 1.243 376 H GLY 45 H GLY 45 9.955 -4.394 4.466 377 HA2 GLY 45 HA2 GLY 45 11.151 -4.045 7.026 378 HA3 GLY 45 HA3 GLY 45 10.320 -2.554 6.594 379 H ARG 46 H ARG 46 8.525 -2.489 7.646 380 HA ARG 46 HA ARG 46 6.731 -4.874 7.998 381 HB2 ARG 46 HB2 ARG 46 8.067 -4.280 10.015 382 HB3 ARG 46 HB3 ARG 46 7.379 -2.657 9.993 383 HG2 ARG 46 HG2 ARG 46 5.105 -3.626 10.379 384 HG3 ARG 46 HG3 ARG 46 5.819 -5.249 10.323 385 HD2 ARG 46 HD2 ARG 46 5.509 -4.720 12.609 386 HD3 ARG 46 HD3 ARG 46 7.245 -4.666 12.274 387 HE ARG 46 HE ARG 46 5.757 -2.079 12.172 388 HH11 ARG 46 HH11 ARG 46 6.124 -0.581 13.585 389 HH12 ARG 46 HH12 ARG 46 7.142 -0.846 15.005 390 HH21 ARG 46 HH21 ARG 46 7.807 -4.123 14.175 391 HH22 ARG 46 HH22 ARG 46 8.108 -2.830 15.299 392 H LEU 47 H LEU 47 4.539 -4.547 7.865 393 HA LEU 47 HA LEU 47 3.604 -1.995 6.629 394 HB2 LEU 47 HB2 LEU 47 3.024 -4.201 5.562 395 HB3 LEU 47 HB3 LEU 47 2.268 -4.662 7.079 396 HG LEU 47 HG LEU 47 0.728 -2.554 6.717 397 HD11 LEU 47 HD11 LEU 47 1.667 -3.033 3.871 398 HD12 LEU 47 HD12 LEU 47 0.342 -1.969 4.404 399 HD13 LEU 47 HD13 LEU 47 2.003 -1.588 4.853 400 HD21 LEU 47 HD21 LEU 47 -0.035 -4.880 6.675 401 HD22 LEU 47 HD22 LEU 47 -0.842 -3.909 5.452 402 HD23 LEU 47 HD23 LEU 47 0.464 -5.023 4.977 403 H ARG 48 H ARG 48 2.296 -0.582 7.709 404 HA ARG 48 HA ARG 48 0.640 -1.627 9.943 405 HB2 ARG 48 HB2 ARG 48 2.745 0.117 10.434 406 HB3 ARG 48 HB3 ARG 48 1.435 1.243 10.148 407 HG2 ARG 48 HG2 ARG 48 1.532 0.846 12.483 408 HG3 ARG 48 HG3 ARG 48 0.082 0.010 11.908 409 HD2 ARG 48 HD2 ARG 48 1.225 -2.134 11.965 410 HD3 ARG 48 HD3 ARG 48 2.784 -1.377 12.262 411 HE ARG 48 HE ARG 48 0.636 -1.873 14.205 412 HH11 ARG 48 HH11 ARG 48 1.018 -1.507 16.361 413 HH12 ARG 48 HH12 ARG 48 2.435 -0.633 16.857 414 HH21 ARG 48 HH21 ARG 48 3.664 -0.112 13.689 415 HH22 ARG 48 HH22 ARG 48 3.844 0.177 15.400 416 H ILE 49 H ILE 49 -1.467 -1.219 9.678 417 HA ILE 49 HA ILE 49 -2.272 0.944 7.746 418 HB ILE 49 HB ILE 49 -3.651 -1.709 8.185 419 HG12 ILE 49 HG12 ILE 49 -2.116 -0.467 5.856 420 HG13 ILE 49 HG13 ILE 49 -1.731 -1.951 6.729 421 HG21 ILE 49 HG21 ILE 49 -5.268 0.183 7.920 422 HG22 ILE 49 HG22 ILE 49 -4.493 0.564 6.352 423 HG23 ILE 49 HG23 ILE 49 -5.331 -0.985 6.620 424 HD11 ILE 49 HD11 ILE 49 -2.610 -2.528 4.585 425 HD12 ILE 49 HD12 ILE 49 -3.827 -2.983 5.792 426 HD13 ILE 49 HD13 ILE 49 -4.032 -1.514 4.788 427 H THR 50 H THR 50 -3.461 2.475 8.524 428 HA THR 50 HA THR 50 -4.689 2.229 11.231 429 HB THR 50 HB THR 50 -3.713 4.339 11.910 430 HG1 THR 50 HG1 THR 50 -2.406 4.194 9.396 431 HG21 THR 50 HG21 THR 50 -1.401 3.789 12.214 432 HG22 THR 50 HG22 THR 50 -2.349 2.307 12.389 433 HG23 THR 50 HG23 THR 50 -1.436 2.599 10.894 434 H SER 51 H SER 51 -6.148 4.125 11.720 435 HA SER 51 HA SER 51 -7.260 5.555 9.390 436 HB2 SER 51 HB2 SER 51 -8.544 3.644 9.139 437 HB3 SER 51 HB3 SER 51 -8.692 3.378 10.892 438 HG SER 51 HG SER 51 -10.487 4.413 10.773 439 H LYS 52 H LYS 52 -7.721 7.509 9.958 440 HA LYS 52 HA LYS 52 -8.349 8.340 12.751 441 HB2 LYS 52 HB2 LYS 52 -6.646 9.449 11.344 442 HB3 LYS 52 HB3 LYS 52 -7.938 9.949 10.227 443 HG2 LYS 52 HG2 LYS 52 -8.906 11.152 12.381 444 HG3 LYS 52 HG3 LYS 52 -7.306 10.881 13.034 445 HD2 LYS 52 HD2 LYS 52 -8.097 12.375 10.514 446 HD3 LYS 52 HD3 LYS 52 -7.424 13.080 12.001 447 HE2 LYS 52 HE2 LYS 52 -5.255 12.096 11.549 448 HE3 LYS 52 HE3 LYS 52 -5.893 11.154 10.197 449 HZ1 LYS 52 HZ1 LYS 52 -4.743 13.133 9.438 450 HZ2 LYS 52 HZ2 LYS 52 -6.329 13.253 9.037 451 HZ3 LYS 52 HZ3 LYS 52 -5.695 14.107 10.311 452 H GLY 53 H GLY 53 -10.156 6.714 10.918 453 HA2 GLY 53 HA2 GLY 53 -12.480 6.425 10.881 454 HA3 GLY 53 HA3 GLY 53 -12.729 8.075 11.450 455 H LYS 54 H LYS 54 -13.274 6.161 8.904 456 HA LYS 54 HA LYS 54 -13.591 6.243 6.670 457 HB2 LYS 54 HB2 LYS 54 -15.193 7.983 7.512 458 HB3 LYS 54 HB3 LYS 54 -14.011 9.220 7.053 459 HG2 LYS 54 HG2 LYS 54 -14.179 8.420 4.673 460 HG3 LYS 54 HG3 LYS 54 -15.379 7.221 5.204 461 HD2 LYS 54 HD2 LYS 54 -16.808 9.118 6.012 462 HD3 LYS 54 HD3 LYS 54 -15.568 10.256 5.421 463 HE2 LYS 54 HE2 LYS 54 -15.847 9.345 3.120 464 HE3 LYS 54 HE3 LYS 54 -17.094 8.240 3.703 465 HZ1 LYS 54 HZ1 LYS 54 -17.266 11.214 3.792 466 HZ2 LYS 54 HZ2 LYS 54 -18.080 10.262 2.749 467 HZ3 LYS 54 HZ3 LYS 54 -18.423 10.206 4.344 468 H THR 55 H THR 55 -10.880 7.953 7.745 469 HA THR 55 HA THR 55 -9.736 7.666 5.000 470 HB THR 55 HB THR 55 -8.455 9.471 7.042 471 HG1 THR 55 HG1 THR 55 -10.565 10.268 6.853 472 HG21 THR 55 HG21 THR 55 -8.682 9.345 4.019 473 HG22 THR 55 HG22 THR 55 -7.754 10.576 4.914 474 HG23 THR 55 HG23 THR 55 -7.267 8.864 4.977 475 H ALA 56 H ALA 56 -8.531 5.952 4.838 476 HA ALA 56 HA ALA 56 -7.149 4.835 7.204 477 HB1 ALA 56 HB1 ALA 56 -7.548 3.738 4.397 478 HB2 ALA 56 HB2 ALA 56 -6.567 2.957 5.656 479 HB3 ALA 56 HB3 ALA 56 -8.301 3.171 5.901 480 H TYR 57 H TYR 57 -4.875 4.537 7.186 481 HA TYR 57 HA TYR 57 -3.328 6.020 5.106 482 HB2 TYR 57 HB2 TYR 57 -2.822 6.068 8.088 483 HB3 TYR 57 HB3 TYR 57 -1.793 6.777 6.854 484 HD1 TYR 57 HD1 TYR 57 -2.278 8.947 5.946 485 HD2 TYR 57 HD2 TYR 57 -5.106 7.013 8.563 486 HE1 TYR 57 HE1 TYR 57 -3.642 11.037 6.030 487 HE2 TYR 57 HE2 TYR 57 -6.500 9.067 8.581 488 HH TYR 57 HH TYR 57 -5.577 12.009 6.752 489 H ILE 58 H ILE 58 -2.225 4.547 4.039 490 HA ILE 58 HA ILE 58 -1.317 2.016 5.274 491 HB ILE 58 HB ILE 58 -0.354 3.166 2.636 492 HG12 ILE 58 HG12 ILE 58 -2.738 3.156 2.358 493 HG13 ILE 58 HG13 ILE 58 -1.979 1.902 1.399 494 HG21 ILE 58 HG21 ILE 58 -0.444 0.382 3.834 495 HG22 ILE 58 HG22 ILE 58 0.043 0.752 2.162 496 HG23 ILE 58 HG23 ILE 58 0.989 1.375 3.514 497 HD11 ILE 58 HD11 ILE 58 -3.456 1.452 4.025 498 HD12 ILE 58 HD12 ILE 58 -4.049 1.126 2.381 499 HD13 ILE 58 HD13 ILE 58 -2.692 0.186 3.031 500 H LYS 59 H LYS 59 0.220 2.282 6.774 501 HA LYS 59 HA LYS 59 2.454 4.250 6.391 502 HB2 LYS 59 HB2 LYS 59 1.188 2.953 8.802 503 HB3 LYS 59 HB3 LYS 59 2.804 3.677 8.877 504 HG2 LYS 59 HG2 LYS 59 1.965 5.836 8.241 505 HG3 LYS 59 HG3 LYS 59 0.356 5.195 7.856 506 HD2 LYS 59 HD2 LYS 59 -0.134 4.748 10.152 507 HD3 LYS 59 HD3 LYS 59 1.563 4.951 10.630 508 HE2 LYS 59 HE2 LYS 59 0.512 6.913 11.340 509 HE3 LYS 59 HE3 LYS 59 1.406 7.350 9.870 510 HZ1 LYS 59 HZ1 LYS 59 -1.453 6.613 9.726 511 HZ2 LYS 59 HZ2 LYS 59 -1.012 8.128 10.168 512 HZ3 LYS 59 HZ3 LYS 59 -0.553 7.576 8.694 513 H LEU 60 H LEU 60 4.532 3.547 6.249 514 HA LEU 60 HA LEU 60 5.050 0.587 6.406 515 HB2 LEU 60 HB2 LEU 60 6.173 2.674 4.505 516 HB3 LEU 60 HB3 LEU 60 6.777 1.023 4.655 517 HG LEU 60 HG LEU 60 3.920 1.714 3.822 518 HD11 LEU 60 HD11 LEU 60 4.665 1.079 1.558 519 HD12 LEU 60 HD12 LEU 60 5.550 2.492 2.157 520 HD13 LEU 60 HD13 LEU 60 6.327 0.892 2.165 521 HD21 LEU 60 HD21 LEU 60 4.131 -0.553 4.793 522 HD22 LEU 60 HD22 LEU 60 3.877 -0.645 3.048 523 HD23 LEU 60 HD23 LEU 60 5.504 -0.896 3.721 524 H GLU 61 H GLU 61 6.591 -0.051 7.735 525 HA GLU 61 HA GLU 61 8.061 2.052 9.279 526 HB2 GLU 61 HB2 GLU 61 6.645 -0.444 10.276 527 HB3 GLU 61 HB3 GLU 61 7.565 0.696 11.264 528 HG2 GLU 61 HG2 GLU 61 5.962 2.505 10.608 529 HG3 GLU 61 HG3 GLU 61 4.987 1.299 9.757 530 H ASP 62 H ASP 62 10.085 1.486 10.252 531 HA ASP 62 HA ASP 62 11.643 -0.546 8.935 532 HB2 ASP 62 HB2 ASP 62 12.610 1.561 9.675 533 HB3 ASP 62 HB3 ASP 62 12.103 1.257 11.340 534 H LYS 63 H LYS 63 12.009 -2.587 9.554 535 HA LYS 63 HA LYS 63 10.193 -3.921 11.289 536 HB2 LYS 63 HB2 LYS 63 11.329 -4.750 9.199 537 HB3 LYS 63 HB3 LYS 63 12.821 -4.936 10.124 538 HG2 LYS 63 HG2 LYS 63 11.703 -6.614 11.570 539 HG3 LYS 63 HG3 LYS 63 10.189 -6.397 10.676 540 HD2 LYS 63 HD2 LYS 63 12.821 -7.317 9.428 541 HD3 LYS 63 HD3 LYS 63 11.588 -8.417 10.058 542 HE2 LYS 63 HE2 LYS 63 9.939 -7.552 8.447 543 HE3 LYS 63 HE3 LYS 63 11.126 -6.406 7.812 544 HZ1 LYS 63 HZ1 LYS 63 11.452 -9.356 7.750 545 HZ2 LYS 63 HZ2 LYS 63 10.989 -8.456 6.473 546 HZ3 LYS 63 HZ3 LYS 63 12.491 -8.272 7.100 547 H VAL 64 H VAL 64 13.003 -2.238 12.199 548 HA VAL 64 HA VAL 64 13.554 -3.944 14.586 549 HB VAL 64 HB VAL 64 15.400 -1.783 13.554 550 HG11 VAL 64 HG11 VAL 64 15.857 -2.808 15.744 551 HG12 VAL 64 HG12 VAL 64 15.881 -4.421 14.994 552 HG13 VAL 64 HG13 VAL 64 17.113 -3.209 14.569 553 HG21 VAL 64 HG21 VAL 64 15.067 -3.099 11.548 554 HG22 VAL 64 HG22 VAL 64 16.639 -3.496 12.240 555 HG23 VAL 64 HG23 VAL 64 15.275 -4.620 12.458 556 H SER 65 H SER 65 12.991 -0.597 13.502 557 HA SER 65 HA SER 65 12.699 0.191 16.373 558 HB2 SER 65 HB2 SER 65 13.908 1.744 14.060 559 HB3 SER 65 HB3 SER 65 13.677 2.374 15.704 560 HG SER 65 HG SER 65 15.798 1.543 15.362 561 H GLY 66 H GLY 66 10.817 -0.126 13.628 562 HA2 GLY 66 HA2 GLY 66 8.691 0.547 13.182 563 HA3 GLY 66 HA3 GLY 66 8.632 1.363 14.748 564 H GLU 67 H GLU 67 11.197 2.458 12.711 565 HA GLU 67 HA GLU 67 10.091 5.134 12.641 566 HB2 GLU 67 HB2 GLU 67 12.560 3.989 11.275 567 HB3 GLU 67 HB3 GLU 67 12.138 5.704 11.381 568 HG2 GLU 67 HG2 GLU 67 12.178 5.510 13.892 569 HG3 GLU 67 HG3 GLU 67 12.756 3.851 13.722 570 H LEU 68 H LEU 68 9.197 6.329 10.951 571 HA LEU 68 HA LEU 68 7.820 4.721 9.016 572 HB2 LEU 68 HB2 LEU 68 6.925 6.775 10.251 573 HB3 LEU 68 HB3 LEU 68 7.887 7.747 9.141 574 HG LEU 68 HG LEU 68 6.615 6.492 7.238 575 HD11 LEU 68 HD11 LEU 68 4.396 5.648 7.826 576 HD12 LEU 68 HD12 LEU 68 5.608 4.716 8.707 577 HD13 LEU 68 HD13 LEU 68 4.685 5.971 9.549 578 HD21 LEU 68 HD21 LEU 68 5.090 8.372 9.084 579 HD22 LEU 68 HD22 LEU 68 6.217 8.851 7.795 580 HD23 LEU 68 HD23 LEU 68 4.704 8.030 7.381 581 H PHE 69 H PHE 69 8.406 4.130 7.088 582 HA PHE 69 HA PHE 69 10.599 5.338 5.509 583 HB2 PHE 69 HB2 PHE 69 10.478 2.986 5.485 584 HB3 PHE 69 HB3 PHE 69 8.738 2.972 5.250 585 HD1 PHE 69 HD1 PHE 69 8.142 2.077 3.205 586 HD2 PHE 69 HD2 PHE 69 11.624 4.600 3.415 587 HE1 PHE 69 HE1 PHE 69 8.425 1.847 0.768 588 HE2 PHE 69 HE2 PHE 69 11.908 4.402 0.974 589 HZ PHE 69 HZ PHE 69 10.301 3.046 -0.380 590 H ALA 70 H ALA 70 7.068 4.837 5.131 591 HA ALA 70 HA ALA 70 6.704 7.418 3.826 592 HB1 ALA 70 HB1 ALA 70 6.164 4.819 2.299 593 HB2 ALA 70 HB2 ALA 70 5.711 6.446 1.769 594 HB3 ALA 70 HB3 ALA 70 7.425 6.008 1.900 595 H GLN 71 H GLN 71 4.360 7.810 3.371 596 HA GLN 71 HA GLN 71 2.595 5.676 4.098 597 HB2 GLN 71 HB2 GLN 71 1.089 6.856 5.565 598 HB3 GLN 71 HB3 GLN 71 2.705 6.779 6.264 599 HG2 GLN 71 HG2 GLN 71 3.128 9.122 5.646 600 HG3 GLN 71 HG3 GLN 71 1.545 9.236 4.870 601 HE21 GLN 71 HE21 GLN 71 1.505 10.430 8.534 602 HE22 GLN 71 HE22 GLN 71 2.746 10.674 7.316 603 H ALA 72 H ALA 72 0.508 5.770 3.278 604 HA ALA 72 HA ALA 72 0.021 7.792 1.131 605 HB1 ALA 72 HB1 ALA 72 -0.551 4.813 1.125 606 HB2 ALA 72 HB2 ALA 72 -1.086 5.952 -0.115 607 HB3 ALA 72 HB3 ALA 72 0.648 5.683 0.141 608 HA PRO 73 HA PRO 73 -3.854 8.051 3.581 609 HB2 PRO 73 HB2 PRO 73 -4.802 10.414 2.659 610 HB3 PRO 73 HB3 PRO 73 -3.385 10.315 3.748 611 HG2 PRO 73 HG2 PRO 73 -3.385 10.645 0.738 612 HG3 PRO 73 HG3 PRO 73 -2.428 11.540 1.956 613 HD2 PRO 73 HD2 PRO 73 -1.472 9.365 0.539 614 HD3 PRO 73 HD3 PRO 73 -0.903 9.790 2.181 615 H VAL 74 H VAL 74 -5.593 6.867 3.080 616 HA VAL 74 HA VAL 74 -6.602 6.707 0.268 617 HB VAL 74 HB VAL 74 -6.743 4.598 2.439 618 HG11 VAL 74 HG11 VAL 74 -7.559 4.478 -0.476 619 HG12 VAL 74 HG12 VAL 74 -7.562 3.117 0.670 620 HG13 VAL 74 HG13 VAL 74 -8.659 4.464 0.920 621 HG21 VAL 74 HG21 VAL 74 -5.192 3.267 1.238 622 HG22 VAL 74 HG22 VAL 74 -5.062 4.451 -0.061 623 HG23 VAL 74 HG23 VAL 74 -4.427 4.825 1.555 624 H GLU 75 H GLU 75 -8.552 7.488 -0.093 625 HA GLU 75 HA GLU 75 -10.510 7.915 2.144 626 HB2 GLU 75 HB2 GLU 75 -9.981 9.459 -0.433 627 HB3 GLU 75 HB3 GLU 75 -11.368 9.748 0.618 628 HG2 GLU 75 HG2 GLU 75 -9.929 10.379 2.468 629 HG3 GLU 75 HG3 GLU 75 -8.476 10.033 1.517 630 H GLN 76 H GLN 76 -9.987 5.852 -0.393 631 HA GLN 76 HA GLN 76 -12.655 4.899 -0.476 632 HB2 GLN 76 HB2 GLN 76 -13.193 5.203 -2.775 633 HB3 GLN 76 HB3 GLN 76 -12.829 6.793 -2.134 634 HG2 GLN 76 HG2 GLN 76 -11.017 5.114 -3.915 635 HG3 GLN 76 HG3 GLN 76 -11.980 6.487 -4.407 636 HE21 GLN 76 HE21 GLN 76 -8.347 7.150 -2.688 637 HE22 GLN 76 HE22 GLN 76 -9.060 5.522 -2.629 638 H TYR 77 H TYR 77 -12.694 2.757 -1.264 639 HA TYR 77 HA TYR 77 -10.122 1.641 -2.231 640 HB2 TYR 77 HB2 TYR 77 -10.346 1.196 0.144 641 HB3 TYR 77 HB3 TYR 77 -11.865 0.307 -0.145 642 HD1 TYR 77 HD1 TYR 77 -11.647 -2.116 -0.792 643 HD2 TYR 77 HD2 TYR 77 -8.349 0.597 -0.991 644 HE1 TYR 77 HE1 TYR 77 -10.150 -3.976 -1.476 645 HE2 TYR 77 HE2 TYR 77 -6.832 -1.238 -1.723 646 HH TYR 77 HH TYR 77 -8.092 -4.598 -2.122 647 HA PRO 78 HA PRO 78 -9.197 0.527 -3.739 648 HB2 PRO 78 HB2 PRO 78 -8.986 0.123 -6.403 649 HB3 PRO 78 HB3 PRO 78 -9.176 -1.228 -5.244 650 HG2 PRO 78 HG2 PRO 78 -11.349 0.135 -6.878 651 HG3 PRO 78 HG3 PRO 78 -11.012 -1.621 -6.740 652 HD2 PRO 78 HD2 PRO 78 -12.910 -0.396 -5.214 653 HD3 PRO 78 HD3 PRO 78 -11.898 -1.713 -4.552 654 H GLY 79 H GLY 79 -7.969 2.168 -5.025 655 HA2 GLY 79 HA2 GLY 79 -9.387 4.237 -6.527 656 HA3 GLY 79 HA3 GLY 79 -8.880 4.772 -4.926 657 H ILE 80 H ILE 80 -7.486 6.352 -5.928 658 HA ILE 80 HA ILE 80 -5.194 5.412 -7.506 659 HB ILE 80 HB ILE 80 -6.269 7.581 -7.947 660 HG12 ILE 80 HG12 ILE 80 -4.293 8.995 -8.168 661 HG13 ILE 80 HG13 ILE 80 -3.396 8.004 -7.024 662 HG21 ILE 80 HG21 ILE 80 -6.830 8.287 -5.623 663 HG22 ILE 80 HG22 ILE 80 -5.095 8.540 -5.296 664 HG23 ILE 80 HG23 ILE 80 -5.931 9.526 -6.502 665 HD11 ILE 80 HD11 ILE 80 -2.795 7.592 -9.407 666 HD12 ILE 80 HD12 ILE 80 -3.376 6.130 -8.598 667 HD13 ILE 80 HD13 ILE 80 -4.448 7.019 -9.714 668 H ALA 81 H ALA 81 -5.950 6.085 -4.139 669 HA ALA 81 HA ALA 81 -3.179 6.192 -3.361 670 HB1 ALA 81 HB1 ALA 81 -5.667 5.979 -1.670 671 HB2 ALA 81 HB2 ALA 81 -3.993 6.261 -1.093 672 HB3 ALA 81 HB3 ALA 81 -4.802 7.473 -2.123 673 H VAL 82 H VAL 82 -5.579 3.524 -3.484 674 HA VAL 82 HA VAL 82 -3.259 1.687 -3.275 675 HB VAL 82 HB VAL 82 -4.146 1.858 -1.044 676 HG11 VAL 82 HG11 VAL 82 -6.348 2.693 -1.470 677 HG12 VAL 82 HG12 VAL 82 -6.798 1.146 -2.186 678 HG13 VAL 82 HG13 VAL 82 -6.359 1.271 -0.449 679 HG21 VAL 82 HG21 VAL 82 -3.284 -0.275 -1.865 680 HG22 VAL 82 HG22 VAL 82 -4.591 -0.512 -0.696 681 HG23 VAL 82 HG23 VAL 82 -4.883 -0.742 -2.437 682 H GLU 83 H GLU 83 -3.331 0.289 -4.934 683 HA GLU 83 HA GLU 83 -5.884 -0.521 -6.255 684 HB2 GLU 83 HB2 GLU 83 -4.104 1.464 -7.239 685 HB3 GLU 83 HB3 GLU 83 -3.699 0.021 -8.154 686 HG2 GLU 83 HG2 GLU 83 -6.525 1.118 -7.843 687 HG3 GLU 83 HG3 GLU 83 -5.434 1.547 -9.161 688 H THR 84 H THR 84 -5.745 -2.450 -7.578 689 HA THR 84 HA THR 84 -3.441 -4.268 -6.902 690 HB THR 84 HB THR 84 -5.952 -5.243 -8.119 691 HG1 THR 84 HG1 THR 84 -6.839 -5.584 -6.075 692 HG21 THR 84 HG21 THR 84 -5.354 -7.260 -6.808 693 HG22 THR 84 HG22 THR 84 -4.072 -6.735 -7.916 694 HG23 THR 84 HG23 THR 84 -3.938 -6.396 -6.171 695 H VAL 85 H VAL 85 -2.208 -3.309 -8.277 696 HA VAL 85 HA VAL 85 -1.151 -3.000 -10.420 697 HB VAL 85 HB VAL 85 -0.287 -5.424 -10.806 698 HG11 VAL 85 HG11 VAL 85 0.013 -3.914 -8.162 699 HG12 VAL 85 HG12 VAL 85 1.145 -5.111 -8.782 700 HG13 VAL 85 HG13 VAL 85 0.910 -3.605 -9.664 701 HG21 VAL 85 HG21 VAL 85 -2.229 -6.530 -9.496 702 HG22 VAL 85 HG22 VAL 85 -0.587 -7.010 -9.084 703 HG23 VAL 85 HG23 VAL 85 -1.469 -5.879 -8.044 704 H THR 86 H THR 86 -2.803 -6.049 -11.062 705 HA THR 86 HA THR 86 -4.454 -4.722 -13.056 706 HB THR 86 HB THR 86 -4.391 -6.847 -14.515 707 HG1 THR 86 HG1 THR 86 -2.464 -7.972 -14.456 708 HG21 THR 86 HG21 THR 86 -1.896 -5.126 -14.417 709 HG22 THR 86 HG22 THR 86 -2.521 -5.985 -15.848 710 HG23 THR 86 HG23 THR 86 -3.414 -4.606 -15.148 711 H ASP 87 H ASP 87 -3.755 -7.844 -11.512 712 HA ASP 87 HA ASP 87 -6.571 -7.989 -10.589 713 HB2 ASP 87 HB2 ASP 87 -6.322 -8.827 -13.007 714 HB3 ASP 87 HB3 ASP 87 -5.430 -10.163 -12.325 715 H SER 88 H SER 88 -3.994 -10.570 -10.911 716 HA SER 88 HA SER 88 -4.390 -11.711 -8.498 717 HB2 SER 88 HB2 SER 88 -2.568 -12.063 -10.332 718 HB3 SER 88 HB3 SER 88 -1.501 -11.296 -9.142 719 HG SER 88 HG SER 88 -1.695 -13.596 -8.942 720 H SER 89 H SER 89 -3.427 -11.818 -6.525 721 HA SER 89 HA SER 89 -2.984 -9.124 -5.321 722 HB2 SER 89 HB2 SER 89 -5.239 -10.000 -5.243 723 HB3 SER 89 HB3 SER 89 -4.679 -11.444 -4.383 724 HG SER 89 HG SER 89 -3.899 -9.992 -2.736 725 H ARG 90 H ARG 90 -0.758 -10.838 -5.960 726 HA ARG 90 HA ARG 90 0.470 -11.112 -3.240 727 HB2 ARG 90 HB2 ARG 90 1.357 -12.545 -5.084 728 HB3 ARG 90 HB3 ARG 90 1.769 -11.092 -6.009 729 HG2 ARG 90 HG2 ARG 90 3.322 -10.390 -4.179 730 HG3 ARG 90 HG3 ARG 90 2.898 -11.852 -3.273 731 HD2 ARG 90 HD2 ARG 90 3.927 -13.222 -5.044 732 HD3 ARG 90 HD3 ARG 90 4.210 -11.764 -6.018 733 HE ARG 90 HE ARG 90 5.363 -11.791 -3.285 734 HH11 ARG 90 HH11 ARG 90 7.589 -11.544 -3.067 735 HH12 ARG 90 HH12 ARG 90 8.584 -11.636 -4.529 736 HH21 ARG 90 HH21 ARG 90 6.141 -12.095 -6.733 737 HH22 ARG 90 HH22 ARG 90 7.863 -11.903 -6.358 738 H TYR 91 H TYR 91 -0.020 -8.797 -5.823 739 HA TYR 91 HA TYR 91 1.763 -6.825 -4.496 740 HB2 TYR 91 HB2 TYR 91 0.795 -6.839 -7.348 741 HB3 TYR 91 HB3 TYR 91 2.087 -5.861 -6.675 742 HD1 TYR 91 HD1 TYR 91 4.103 -7.233 -5.652 743 HD2 TYR 91 HD2 TYR 91 1.335 -8.684 -8.613 744 HE1 TYR 91 HE1 TYR 91 5.798 -8.884 -6.432 745 HE2 TYR 91 HE2 TYR 91 3.028 -10.256 -9.476 746 HH TYR 91 HH TYR 91 6.369 -10.279 -8.062 747 H PHE 92 H PHE 92 1.293 -4.635 -4.697 748 HA PHE 92 HA PHE 92 -1.352 -3.762 -5.628 749 HB2 PHE 92 HB2 PHE 92 -0.295 -3.012 -2.873 750 HB3 PHE 92 HB3 PHE 92 -1.702 -2.293 -3.651 751 HD1 PHE 92 HD1 PHE 92 -0.453 -5.119 -1.755 752 HD2 PHE 92 HD2 PHE 92 -3.732 -3.727 -4.186 753 HE1 PHE 92 HE1 PHE 92 -1.861 -6.968 -0.930 754 HE2 PHE 92 HE2 PHE 92 -5.126 -5.620 -3.397 755 HZ PHE 92 HZ PHE 92 -4.183 -7.272 -1.791 756 H VAL 93 H VAL 93 -1.352 -1.286 -5.614 757 HA VAL 93 HA VAL 93 1.341 -0.035 -5.653 758 HB VAL 93 HB VAL 93 -0.883 0.561 -7.652 759 HG11 VAL 93 HG11 VAL 93 1.793 1.945 -7.175 760 HG12 VAL 93 HG12 VAL 93 0.751 2.198 -8.577 761 HG13 VAL 93 HG13 VAL 93 0.170 2.660 -6.988 762 HG21 VAL 93 HG21 VAL 93 0.424 -1.404 -8.315 763 HG22 VAL 93 HG22 VAL 93 0.853 -0.029 -9.336 764 HG23 VAL 93 HG23 VAL 93 1.942 -0.524 -8.034 765 H ILE 94 H ILE 94 1.410 1.825 -4.463 766 HA ILE 94 HA ILE 94 -1.159 3.052 -3.683 767 HB ILE 94 HB ILE 94 -0.468 3.466 -1.387 768 HG12 ILE 94 HG12 ILE 94 1.940 1.642 -1.910 769 HG13 ILE 94 HG13 ILE 94 2.046 3.399 -1.879 770 HG21 ILE 94 HG21 ILE 94 -0.709 1.186 -0.489 771 HG22 ILE 94 HG22 ILE 94 -1.781 1.468 -1.836 772 HG23 ILE 94 HG23 ILE 94 -0.327 0.490 -2.073 773 HD11 ILE 94 HD11 ILE 94 2.724 2.539 0.272 774 HD12 ILE 94 HD12 ILE 94 1.191 3.419 0.447 775 HD13 ILE 94 HD13 ILE 94 1.199 1.656 0.450 776 H ARG 95 H ARG 95 -1.175 5.218 -3.316 777 HA ARG 95 HA ARG 95 1.099 6.799 -4.467 778 HB2 ARG 95 HB2 ARG 95 -1.094 7.106 -5.489 779 HB3 ARG 95 HB3 ARG 95 -1.794 7.572 -3.954 780 HG2 ARG 95 HG2 ARG 95 0.472 9.162 -5.212 781 HG3 ARG 95 HG3 ARG 95 -1.233 9.416 -5.612 782 HD2 ARG 95 HD2 ARG 95 -1.651 9.656 -3.083 783 HD3 ARG 95 HD3 ARG 95 0.100 9.795 -2.930 784 HE ARG 95 HE ARG 95 0.060 11.924 -3.782 785 HH11 ARG 95 HH11 ARG 95 -0.729 13.773 -4.401 786 HH12 ARG 95 HH12 ARG 95 -2.411 13.960 -4.857 787 HH21 ARG 95 HH21 ARG 95 -3.158 10.629 -4.343 788 HH22 ARG 95 HH22 ARG 95 -3.766 12.189 -4.825 789 H ILE 96 H ILE 96 2.559 7.006 -2.899 790 HA ILE 96 HA ILE 96 1.776 7.723 -0.136 791 HB ILE 96 HB ILE 96 4.152 7.673 0.385 792 HG12 ILE 96 HG12 ILE 96 4.728 6.529 -2.366 793 HG13 ILE 96 HG13 ILE 96 4.903 8.257 -2.019 794 HG21 ILE 96 HG21 ILE 96 3.139 5.155 -0.990 795 HG22 ILE 96 HG22 ILE 96 4.454 5.207 0.185 796 HG23 ILE 96 HG23 ILE 96 2.829 5.646 0.692 797 HD11 ILE 96 HD11 ILE 96 7.048 7.178 -1.791 798 HD12 ILE 96 HD12 ILE 96 6.487 7.764 -0.208 799 HD13 ILE 96 HD13 ILE 96 6.396 6.032 -0.608 800 H GLN 97 H GLN 97 2.746 9.588 0.911 801 HA GLN 97 HA GLN 97 3.533 11.783 -0.964 802 HB2 GLN 97 HB2 GLN 97 1.983 12.010 1.634 803 HB3 GLN 97 HB3 GLN 97 2.890 13.342 0.914 804 HG2 GLN 97 HG2 GLN 97 1.552 12.692 -1.288 805 HG3 GLN 97 HG3 GLN 97 0.419 11.963 -0.145 806 HE21 GLN 97 HE21 GLN 97 0.991 16.069 -0.222 807 HE22 GLN 97 HE22 GLN 97 2.273 14.977 -0.779 808 H ASP 98 H ASP 98 5.308 13.018 -0.516 809 HA ASP 98 HA ASP 98 7.251 11.715 1.250 810 HB2 ASP 98 HB2 ASP 98 7.769 12.672 -1.053 811 HB3 ASP 98 HB3 ASP 98 7.650 14.267 -0.298 812 H GLY 99 H GLY 99 4.831 13.955 1.712 813 HA2 GLY 99 HA2 GLY 99 4.160 14.947 3.712 814 HA3 GLY 99 HA3 GLY 99 5.750 14.650 4.411 815 H THR 100 H THR 100 6.152 16.219 1.458 816 HA THR 100 HA THR 100 6.456 18.897 2.756 817 HB THR 100 HB THR 100 8.275 19.284 1.144 818 HG1 THR 100 HG1 THR 100 9.021 17.455 -0.008 819 HG21 THR 100 HG21 THR 100 9.925 17.803 2.104 820 HG22 THR 100 HG22 THR 100 8.773 18.254 3.374 821 HG23 THR 100 HG23 THR 100 8.679 16.646 2.616 822 H GLY 101 H GLY 101 4.112 17.701 1.122 823 HA2 GLY 101 HA2 GLY 101 2.425 18.864 -0.067 824 HA3 GLY 101 HA3 GLY 101 3.593 20.071 -0.601 825 H ARG 102 H ARG 102 4.631 16.809 -0.920 826 HA ARG 102 HA ARG 102 3.942 16.667 -3.821 827 HB2 ARG 102 HB2 ARG 102 6.119 16.119 -4.420 828 HB3 ARG 102 HB3 ARG 102 6.222 17.536 -3.359 829 HG2 ARG 102 HG2 ARG 102 6.773 15.996 -1.462 830 HG3 ARG 102 HG3 ARG 102 6.861 14.645 -2.607 831 HD2 ARG 102 HD2 ARG 102 8.452 17.209 -2.885 832 HD3 ARG 102 HD3 ARG 102 9.061 15.777 -2.024 833 HE ARG 102 HE ARG 102 8.231 14.941 -4.607 834 HH11 ARG 102 HH11 ARG 102 9.663 14.554 -6.265 835 HH12 ARG 102 HH12 ARG 102 11.251 15.260 -6.222 836 HH21 ARG 102 HH21 ARG 102 10.796 16.888 -3.238 837 HH22 ARG 102 HH22 ARG 102 11.885 16.552 -4.558 838 H SER 103 H SER 103 4.333 14.504 -4.764 839 HA SER 103 HA SER 103 3.558 12.282 -2.923 840 HB2 SER 103 HB2 SER 103 2.290 12.936 -5.613 841 HB3 SER 103 HB3 SER 103 1.895 11.558 -4.573 842 HG SER 103 HG SER 103 1.593 14.323 -3.913 843 H ALA 104 H ALA 104 3.994 10.153 -3.653 844 HA ALA 104 HA ALA 104 5.234 9.777 -6.314 845 HB1 ALA 104 HB1 ALA 104 7.017 8.337 -5.401 846 HB2 ALA 104 HB2 ALA 104 7.166 10.001 -4.802 847 HB3 ALA 104 HB3 ALA 104 6.503 8.733 -3.748 848 H PHE 105 H PHE 105 4.880 7.774 -7.259 849 HA PHE 105 HA PHE 105 2.928 5.984 -5.896 850 HB2 PHE 105 HB2 PHE 105 3.830 5.965 -8.787 851 HB3 PHE 105 HB3 PHE 105 2.528 5.024 -8.069 852 HD1 PHE 105 HD1 PHE 105 0.448 6.224 -7.188 853 HD2 PHE 105 HD2 PHE 105 3.497 8.249 -9.472 854 HE1 PHE 105 HE1 PHE 105 -1.122 8.083 -7.654 855 HE2 PHE 105 HE2 PHE 105 1.952 10.140 -9.861 856 HZ PHE 105 HZ PHE 105 -0.381 10.060 -8.953 857 H ILE 106 H ILE 106 3.509 4.096 -5.079 858 HA ILE 106 HA ILE 106 5.902 2.707 -6.178 859 HB ILE 106 HB ILE 106 6.628 1.827 -4.076 860 HG12 ILE 106 HG12 ILE 106 4.269 3.356 -2.864 861 HG13 ILE 106 HG13 ILE 106 4.586 1.616 -2.814 862 HG21 ILE 106 HG21 ILE 106 6.287 4.838 -3.671 863 HG22 ILE 106 HG22 ILE 106 7.651 3.807 -3.188 864 HG23 ILE 106 HG23 ILE 106 7.361 4.159 -4.895 865 HD11 ILE 106 HD11 ILE 106 6.684 2.160 -1.483 866 HD12 ILE 106 HD12 ILE 106 6.040 3.801 -1.309 867 HD13 ILE 106 HD13 ILE 106 5.125 2.427 -0.666 868 H GLY 107 H GLY 107 5.707 0.657 -6.557 869 HA2 GLY 107 HA2 GLY 107 3.205 -0.847 -6.243 870 HA3 GLY 107 HA3 GLY 107 4.738 -1.438 -6.887 871 H ILE 108 H ILE 108 3.097 -2.673 -4.873 872 HA ILE 108 HA ILE 108 5.124 -2.850 -2.702 873 HB ILE 108 HB ILE 108 2.163 -3.462 -2.314 874 HG12 ILE 108 HG12 ILE 108 3.661 -0.924 -1.519 875 HG13 ILE 108 HG13 ILE 108 2.314 -1.050 -2.659 876 HG21 ILE 108 HG21 ILE 108 4.493 -3.102 -0.385 877 HG22 ILE 108 HG22 ILE 108 2.839 -3.572 0.075 878 HG23 ILE 108 HG23 ILE 108 3.811 -4.671 -0.864 879 HD11 ILE 108 HD11 ILE 108 0.887 -1.950 -0.752 880 HD12 ILE 108 HD12 ILE 108 2.206 -1.466 0.348 881 HD13 ILE 108 HD13 ILE 108 1.382 -0.259 -0.629 882 H GLY 109 H GLY 109 5.758 -4.996 -2.241 883 HA2 GLY 109 HA2 GLY 109 4.238 -7.252 -3.480 884 HA3 GLY 109 HA3 GLY 109 6.003 -7.232 -3.532 885 H PHE 110 H PHE 110 3.674 -8.783 -2.096 886 HA PHE 110 HA PHE 110 4.882 -8.811 0.631 887 HB2 PHE 110 HB2 PHE 110 2.292 -9.882 -0.477 888 HB3 PHE 110 HB3 PHE 110 2.900 -10.338 1.095 889 HD1 PHE 110 HD1 PHE 110 1.922 -7.271 -0.874 890 HD2 PHE 110 HD2 PHE 110 2.569 -9.032 3.010 891 HE1 PHE 110 HE1 PHE 110 0.939 -5.263 0.209 892 HE2 PHE 110 HE2 PHE 110 1.538 -7.058 4.080 893 HZ PHE 110 HZ PHE 110 0.754 -5.147 2.675 894 H THR 111 H THR 111 5.364 -10.733 1.644 895 HA THR 111 HA THR 111 6.862 -12.610 0.006 896 HB THR 111 HB THR 111 7.493 -11.543 2.182 897 HG1 THR 111 HG1 THR 111 8.713 -13.339 2.744 898 HG21 THR 111 HG21 THR 111 5.465 -12.098 3.506 899 HG22 THR 111 HG22 THR 111 5.890 -13.823 3.412 900 HG23 THR 111 HG23 THR 111 6.952 -12.685 4.264 901 H ASP 112 H ASP 112 3.706 -12.545 1.336 902 HA ASP 112 HA ASP 112 3.184 -15.303 0.355 903 HB2 ASP 112 HB2 ASP 112 3.411 -15.120 2.930 904 HB3 ASP 112 HB3 ASP 112 1.877 -14.240 2.875 905 H ARG 113 H ARG 113 1.279 -15.620 -0.691 906 HA ARG 113 HA ARG 113 -0.216 -13.484 -1.860 907 HB2 ARG 113 HB2 ARG 113 0.057 -15.777 -2.795 908 HB3 ARG 113 HB3 ARG 113 -0.854 -16.446 -1.452 909 HG2 ARG 113 HG2 ARG 113 -2.223 -16.377 -3.452 910 HG3 ARG 113 HG3 ARG 113 -2.896 -15.327 -2.212 911 HD2 ARG 113 HD2 ARG 113 -3.075 -14.256 -4.386 912 HD3 ARG 113 HD3 ARG 113 -1.983 -13.354 -3.347 913 HE ARG 113 HE ARG 113 -0.141 -13.975 -4.662 914 HH11 ARG 113 HH11 ARG 113 0.728 -14.218 -6.683 915 HH12 ARG 113 HH12 ARG 113 -0.286 -14.793 -7.978 916 HH21 ARG 113 HH21 ARG 113 -2.974 -15.566 -6.049 917 HH22 ARG 113 HH22 ARG 113 -2.178 -15.718 -7.617 918 H GLY 114 H GLY 114 -0.818 -15.387 1.090 919 HA2 GLY 114 HA2 GLY 114 -3.474 -14.311 1.607 920 HA3 GLY 114 HA3 GLY 114 -2.437 -15.214 2.720 921 H ASP 115 H ASP 115 -0.141 -13.355 2.564 922 HA ASP 115 HA ASP 115 -1.005 -11.440 4.555 923 HB2 ASP 115 HB2 ASP 115 1.622 -11.746 3.080 924 HB3 ASP 115 HB3 ASP 115 1.311 -10.509 4.298 925 H ALA 116 H ALA 116 -0.289 -11.148 1.069 926 HA ALA 116 HA ALA 116 -0.974 -8.329 0.944 927 HB1 ALA 116 HB1 ALA 116 0.322 -9.128 -0.839 928 HB2 ALA 116 HB2 ALA 116 -0.675 -10.576 -1.061 929 HB3 ALA 116 HB3 ALA 116 -1.272 -8.967 -1.543 930 H PHE 117 H PHE 117 -2.944 -11.368 0.415 931 HA PHE 117 HA PHE 117 -5.272 -9.908 -0.305 932 HB2 PHE 117 HB2 PHE 117 -4.836 -12.410 -0.528 933 HB3 PHE 117 HB3 PHE 117 -5.331 -12.550 1.161 934 HD1 PHE 117 HD1 PHE 117 -7.708 -12.195 1.779 935 HD2 PHE 117 HD2 PHE 117 -6.391 -11.634 -2.300 936 HE1 PHE 117 HE1 PHE 117 -10.071 -12.121 1.013 937 HE2 PHE 117 HE2 PHE 117 -8.713 -11.509 -3.032 938 HZ PHE 117 HZ PHE 117 -10.587 -11.770 -1.397 939 H ASP 118 H ASP 118 -3.920 -10.507 2.915 940 HA ASP 118 HA ASP 118 -6.229 -9.506 4.384 941 HB2 ASP 118 HB2 ASP 118 -3.319 -9.977 5.098 942 HB3 ASP 118 HB3 ASP 118 -4.482 -9.296 6.230 943 H PHE 119 H PHE 119 -3.347 -7.988 2.878 944 HA PHE 119 HA PHE 119 -3.729 -5.405 4.039 945 HB2 PHE 119 HB2 PHE 119 -1.658 -5.866 2.984 946 HB3 PHE 119 HB3 PHE 119 -2.401 -6.367 1.491 947 HD1 PHE 119 HD1 PHE 119 -3.520 -4.684 -0.033 948 HD2 PHE 119 HD2 PHE 119 -1.000 -3.581 3.255 949 HE1 PHE 119 HE1 PHE 119 -3.207 -2.422 -1.029 950 HE2 PHE 119 HE2 PHE 119 -0.793 -1.300 2.343 951 HZ PHE 119 HZ PHE 119 -1.879 -0.713 0.184 952 H ASN 120 H ASN 120 -5.058 -6.946 1.102 953 HA ASN 120 HA ASN 120 -6.834 -4.809 0.358 954 HB2 ASN 120 HB2 ASN 120 -6.554 -6.294 -1.339 955 HB3 ASN 120 HB3 ASN 120 -6.494 -7.706 -0.279 956 HD21 ASN 120 HD21 ASN 120 -9.804 -8.587 -0.834 957 HD22 ASN 120 HD22 ASN 120 -8.274 -8.974 -0.070 958 H VAL 121 H VAL 121 -7.534 -7.756 2.385 959 HA VAL 121 HA VAL 121 -10.223 -6.977 2.801 960 HB VAL 121 HB VAL 121 -8.435 -8.836 4.391 961 HG11 VAL 121 HG11 VAL 121 -10.177 -8.163 5.967 962 HG12 VAL 121 HG12 VAL 121 -11.435 -8.417 4.734 963 HG13 VAL 121 HG13 VAL 121 -10.515 -9.790 5.387 964 HG21 VAL 121 HG21 VAL 121 -9.071 -9.515 2.054 965 HG22 VAL 121 HG22 VAL 121 -9.755 -10.589 3.275 966 HG23 VAL 121 HG23 VAL 121 -10.778 -9.363 2.494 967 H SER 122 H SER 122 -7.350 -6.065 4.648 968 HA SER 122 HA SER 122 -8.604 -4.752 6.843 969 HB2 SER 122 HB2 SER 122 -6.041 -3.997 5.378 970 HB3 SER 122 HB3 SER 122 -6.525 -3.438 6.987 971 HG SER 122 HG SER 122 -5.911 -6.087 6.156 972 H LEU 123 H LEU 123 -8.516 -3.820 3.489 973 HA LEU 123 HA LEU 123 -9.473 -1.058 4.093 974 HB2 LEU 123 HB2 LEU 123 -8.359 -2.317 1.570 975 HB3 LEU 123 HB3 LEU 123 -8.913 -0.650 1.709 976 HG LEU 123 HG LEU 123 -6.715 -1.703 3.535 977 HD11 LEU 123 HD11 LEU 123 -6.366 -0.462 0.808 978 HD12 LEU 123 HD12 LEU 123 -5.068 -0.874 1.958 979 HD13 LEU 123 HD13 LEU 123 -6.036 -2.150 1.220 980 HD21 LEU 123 HD21 LEU 123 -6.086 0.650 3.658 981 HD22 LEU 123 HD22 LEU 123 -7.377 1.089 2.518 982 HD23 LEU 123 HD23 LEU 123 -7.776 0.459 4.132 983 H GLN 124 H GLN 124 -10.384 -4.064 2.360 984 HA GLN 124 HA GLN 124 -12.923 -3.272 1.357 985 HB2 GLN 124 HB2 GLN 124 -12.085 -5.904 2.638 986 HB3 GLN 124 HB3 GLN 124 -13.577 -5.682 1.757 987 HG2 GLN 124 HG2 GLN 124 -10.863 -5.216 0.464 988 HG3 GLN 124 HG3 GLN 124 -11.622 -6.795 0.535 989 HE21 GLN 124 HE21 GLN 124 -12.515 -5.552 -2.767 990 HE22 GLN 124 HE22 GLN 124 -11.071 -6.099 -1.907 991 H ASP 125 H ASP 125 -12.115 -4.585 4.632 992 HA ASP 125 HA ASP 125 -14.802 -4.101 5.664 993 HB2 ASP 125 HB2 ASP 125 -13.163 -5.919 6.368 994 HB3 ASP 125 HB3 ASP 125 -12.209 -4.652 7.158 995 H HIS 126 H HIS 126 -12.254 -1.946 5.077 996 HA HIS 126 HA HIS 126 -12.958 -0.095 7.296 997 HB2 HIS 126 HB2 HIS 126 -10.607 -0.259 6.605 998 HB3 HIS 126 HB3 HIS 126 -11.046 0.300 4.983 999 HD2 HIS 126 HD2 HIS 126 -11.223 1.575 8.674 1000 HE1 HIS 126 HE1 HIS 126 -10.781 4.963 6.129 1001 HE2 HIS 126 HE2 HIS 126 -10.847 4.182 8.550 1002 H PHE 127 H PHE 127 -13.352 -0.330 3.740 1003 HA PHE 127 HA PHE 127 -15.314 1.903 3.866 1004 HB2 PHE 127 HB2 PHE 127 -13.945 0.625 1.492 1005 HB3 PHE 127 HB3 PHE 127 -15.120 1.931 1.403 1006 HD1 PHE 127 HD1 PHE 127 -14.603 4.220 2.367 1007 HD2 PHE 127 HD2 PHE 127 -11.649 1.080 2.168 1008 HE1 PHE 127 HE1 PHE 127 -12.800 5.878 2.713 1009 HE2 PHE 127 HE2 PHE 127 -9.848 2.748 2.483 1010 HZ PHE 127 HZ PHE 127 -10.427 5.154 2.764 1011 H LYS 128 H LYS 128 -15.763 -1.151 4.607 1012 HA LYS 128 HA LYS 128 -18.208 -1.611 3.056 1013 HB2 LYS 128 HB2 LYS 128 -18.539 -3.583 4.202 1014 HB3 LYS 128 HB3 LYS 128 -16.826 -3.463 3.923 1015 HG2 LYS 128 HG2 LYS 128 -16.806 -4.214 6.070 1016 HG3 LYS 128 HG3 LYS 128 -16.800 -2.471 6.407 1017 HD2 LYS 128 HD2 LYS 128 -19.346 -2.690 6.591 1018 HD3 LYS 128 HD3 LYS 128 -19.117 -4.435 6.415 1019 HE2 LYS 128 HE2 LYS 128 -17.822 -2.778 8.613 1020 HE3 LYS 128 HE3 LYS 128 -19.433 -3.478 8.774 1021 HZ1 LYS 128 HZ1 LYS 128 -16.936 -5.037 8.329 1022 HZ2 LYS 128 HZ2 LYS 128 -17.779 -4.954 9.720 1023 HZ3 LYS 128 HZ3 LYS 128 -18.440 -5.684 8.420 1024 H TRP 129 H TRP 129 -17.457 0.080 6.011 1025 HA TRP 129 HA TRP 129 -20.352 0.448 6.634 1026 HB2 TRP 129 HB2 TRP 129 -19.558 0.997 8.887 1027 HB3 TRP 129 HB3 TRP 129 -19.114 -0.616 8.371 1028 HD1 TRP 129 HD1 TRP 129 -16.525 -1.206 8.216 1029 HE1 TRP 129 HE1 TRP 129 -14.391 0.005 8.793 1030 HE3 TRP 129 HE3 TRP 129 -18.462 3.434 9.110 1031 HZ2 TRP 129 HZ2 TRP 129 -13.567 2.672 9.626 1032 HZ3 TRP 129 HZ3 TRP 129 -16.968 5.324 9.759 1033 HH2 TRP 129 HH2 TRP 129 -14.530 4.951 10.019 1034 H VAL 130 H VAL 130 -18.144 2.046 4.892 1035 HA VAL 130 HA VAL 130 -19.451 4.664 5.218 1036 HB VAL 130 HB VAL 130 -17.003 5.591 4.649 1037 HG11 VAL 130 HG11 VAL 130 -18.217 5.184 7.395 1038 HG12 VAL 130 HG12 VAL 130 -16.923 6.338 7.027 1039 HG13 VAL 130 HG13 VAL 130 -18.517 6.532 6.284 1040 HG21 VAL 130 HG21 VAL 130 -16.352 3.395 6.611 1041 HG22 VAL 130 HG22 VAL 130 -15.724 3.607 4.959 1042 HG23 VAL 130 HG23 VAL 130 -15.333 4.780 6.208 1043 H LYS 131 H LYS 131 -18.462 6.092 3.253 1044 HA LYS 131 HA LYS 131 -18.720 6.540 1.130 1045 HB2 LYS 131 HB2 LYS 131 -16.712 4.650 1.193 1046 HB3 LYS 131 HB3 LYS 131 -17.840 3.885 0.083 1047 HG2 LYS 131 HG2 LYS 131 -16.417 5.127 -1.304 1048 HG3 LYS 131 HG3 LYS 131 -17.862 6.153 -1.175 1049 HD2 LYS 131 HD2 LYS 131 -16.727 7.499 0.587 1050 HD3 LYS 131 HD3 LYS 131 -15.295 6.455 0.442 1051 HE2 LYS 131 HE2 LYS 131 -15.126 7.091 -1.978 1052 HE3 LYS 131 HE3 LYS 131 -16.491 8.195 -1.768 1053 HZ1 LYS 131 HZ1 LYS 131 -13.911 8.380 -0.294 1054 HZ2 LYS 131 HZ2 LYS 131 -14.334 9.333 -1.562 1055 HZ3 LYS 131 HZ3 LYS 131 -15.158 9.441 -0.158 1056 H GLN 132 H GLN 132 -20.557 4.271 2.321 1057 HA GLN 132 HA GLN 132 -22.619 3.367 1.894 1058 HB2 GLN 132 HB2 GLN 132 -22.916 6.077 0.564 1059 HB3 GLN 132 HB3 GLN 132 -24.267 5.021 1.000 1060 HG2 GLN 132 HG2 GLN 132 -23.762 5.160 3.353 1061 HG3 GLN 132 HG3 GLN 132 -22.221 5.955 3.057 1062 HE21 GLN 132 HE21 GLN 132 -23.657 9.142 3.324 1063 HE22 GLN 132 HE22 GLN 132 -22.254 8.102 3.545 1064 H GLU 133 H GLU 133 -20.661 2.448 0.071 1065 HA GLU 133 HA GLU 133 -22.351 1.709 -2.301 1066 HB2 GLU 133 HB2 GLU 133 -19.327 1.747 -2.016 1067 HB3 GLU 133 HB3 GLU 133 -20.203 0.978 -3.345 1068 HG2 GLU 133 HG2 GLU 133 -21.292 3.193 -3.856 1069 HG3 GLU 133 HG3 GLU 133 -20.244 3.941 -2.652 1070 H1 SER 149 H1 SER 149 17.102 -19.599 -17.436 1071 H2 SER 149 H2 SER 149 17.444 -20.748 -16.319 1072 H3 SER 149 H3 SER 149 18.534 -19.562 -16.639 1073 HA SER 149 HA SER 149 17.427 -19.170 -14.546 1074 HB2 SER 149 HB2 SER 149 16.721 -17.126 -16.688 1075 HB3 SER 149 HB3 SER 149 16.846 -16.833 -14.941 1076 HG SER 149 HG SER 149 18.779 -16.272 -16.044 1077 H GLN 150 H GLN 150 15.481 -18.568 -13.417 1078 HA GLN 150 HA GLN 150 13.076 -19.940 -14.356 1079 HB2 GLN 150 HB2 GLN 150 13.640 -18.260 -11.880 1080 HB3 GLN 150 HB3 GLN 150 12.130 -19.126 -12.196 1081 HG2 GLN 150 HG2 GLN 150 13.369 -21.278 -12.278 1082 HG3 GLN 150 HG3 GLN 150 14.873 -20.432 -11.913 1083 HE21 GLN 150 HE21 GLN 150 13.785 -21.749 -8.668 1084 HE22 GLN 150 HE22 GLN 150 14.466 -22.354 -10.174 1085 H ILE 151 H ILE 151 10.977 -18.971 -14.538 1086 HA ILE 151 HA ILE 151 10.934 -16.453 -15.978 1087 HB ILE 151 HB ILE 151 9.516 -18.453 -16.511 1088 HG12 ILE 151 HG12 ILE 151 7.483 -17.304 -17.130 1089 HG13 ILE 151 HG13 ILE 151 7.823 -15.965 -16.045 1090 HG21 ILE 151 HG21 ILE 151 7.463 -18.878 -15.266 1091 HG22 ILE 151 HG22 ILE 151 8.846 -19.033 -14.173 1092 HG23 ILE 151 HG23 ILE 151 7.833 -17.572 -14.125 1093 HD11 ILE 151 HD11 ILE 151 9.744 -15.287 -17.428 1094 HD12 ILE 151 HD12 ILE 151 9.554 -16.743 -18.438 1095 HD13 ILE 151 HD13 ILE 151 8.311 -15.477 -18.445 1096 H THR 152 H THR 152 9.520 -14.625 -15.424 1097 HA THR 152 HA THR 152 9.870 -13.722 -12.678 1098 HB THR 152 HB THR 152 8.566 -11.715 -13.580 1099 HG1 THR 152 HG1 THR 152 8.715 -11.607 -15.903 1100 HG21 THR 152 HG21 THR 152 11.150 -12.495 -14.999 1101 HG22 THR 152 HG22 THR 152 10.506 -10.848 -14.805 1102 HG23 THR 152 HG23 THR 152 11.036 -11.758 -13.384 1103 H SER 153 H SER 153 8.280 -13.127 -11.216 1104 HA SER 153 HA SER 153 6.065 -14.958 -11.077 1105 HB2 SER 153 HB2 SER 153 6.901 -12.770 -9.171 1106 HB3 SER 153 HB3 SER 153 5.809 -14.128 -8.812 1107 HG SER 153 HG SER 153 7.938 -14.586 -8.093 1108 H GLN 154 H GLN 154 5.478 -13.512 -13.101 1109 HA GLN 154 HA GLN 154 4.244 -11.069 -13.135 1110 HB2 GLN 154 HB2 GLN 154 3.577 -13.550 -14.739 1111 HB3 GLN 154 HB3 GLN 154 2.991 -11.930 -15.141 1112 HG2 GLN 154 HG2 GLN 154 5.269 -11.106 -15.458 1113 HG3 GLN 154 HG3 GLN 154 5.947 -12.612 -14.859 1114 HE21 GLN 154 HE21 GLN 154 6.367 -13.467 -18.258 1115 HE22 GLN 154 HE22 GLN 154 7.155 -13.004 -16.744 1116 H VAL 155 H VAL 155 2.312 -10.106 -12.731 1117 HA VAL 155 HA VAL 155 0.486 -11.291 -10.858 1118 HB VAL 155 HB VAL 155 0.656 -8.971 -10.774 1119 HG11 VAL 155 HG11 VAL 155 -0.148 -8.744 -13.668 1120 HG12 VAL 155 HG12 VAL 155 -0.013 -7.397 -12.530 1121 HG13 VAL 155 HG13 VAL 155 1.426 -8.358 -12.933 1122 HG21 VAL 155 HG21 VAL 155 -1.524 -9.458 -10.069 1123 HG22 VAL 155 HG22 VAL 155 -1.743 -8.108 -11.131 1124 HG23 VAL 155 HG23 VAL 155 -2.154 -9.722 -11.706 1125 H TPO 156 H T2P 156 -0.822 -12.811 -11.182 1126 HA TPO 156 HA T2P 156 -1.743 -14.059 -13.555 1127 HB TPO 156 HB T2P 156 -2.832 -13.945 -10.779 1128 HG21 TPO 156 HG21 T2P 156 -4.786 -14.205 -11.854 1129 HG22 TPO 156 HG22 T2P 156 -4.322 -15.784 -11.197 1130 HG23 TPO 156 HG23 T2P 156 -4.126 -15.502 -12.944 1131 H GLY 157 H GLY 157 -3.686 -14.091 -14.482 1132 HA2 GLY 157 HA2 GLY 157 -5.732 -12.033 -14.236 1133 HA3 GLY 157 HA3 GLY 157 -4.701 -11.753 -15.643 1134 H GLN 158 H GLN 158 -4.325 -14.572 -16.372 1135 HA GLN 158 HA GLN 158 -6.730 -15.192 -17.773 1136 HB2 GLN 158 HB2 GLN 158 -5.657 -17.368 -18.241 1137 HB3 GLN 158 HB3 GLN 158 -4.641 -15.985 -18.621 1138 HG2 GLN 158 HG2 GLN 158 -3.171 -16.390 -16.795 1139 HG3 GLN 158 HG3 GLN 158 -4.321 -17.437 -15.971 1140 HE21 GLN 158 HE21 GLN 158 -3.395 -20.372 -17.745 1141 HE22 GLN 158 HE22 GLN 158 -4.567 -19.654 -16.650 1142 H ILE 159 H ILE 159 -5.730 -16.077 -14.544 1143 HA ILE 159 HA ILE 159 -8.179 -17.739 -14.116 1144 HB ILE 159 HB ILE 159 -5.725 -17.302 -12.380 1145 HG12 ILE 159 HG12 ILE 159 -5.125 -18.714 -14.225 1146 HG13 ILE 159 HG13 ILE 159 -5.204 -19.653 -12.753 1147 HG21 ILE 159 HG21 ILE 159 -8.197 -18.978 -11.873 1148 HG22 ILE 159 HG22 ILE 159 -6.674 -19.110 -10.961 1149 HG23 ILE 159 HG23 ILE 159 -7.576 -17.596 -10.934 1150 HD11 ILE 159 HD11 ILE 159 -6.131 -20.924 -14.614 1151 HD12 ILE 159 HD12 ILE 159 -7.424 -20.571 -13.458 1152 HD13 ILE 159 HD13 ILE 159 -7.299 -19.645 -14.976 1153 H GLY 160 H GLY 160 -6.390 -15.045 -12.669 1154 HA2 GLY 160 HA2 GLY 160 -7.081 -12.942 -11.982 1155 HA3 GLY 160 HA3 GLY 160 -8.686 -13.284 -12.634 1156 H TRP 161 H TRP 161 -6.579 -14.291 -9.916 1157 HA TRP 161 HA TRP 161 -8.937 -14.305 -8.107 1158 HB2 TRP 161 HB2 TRP 161 -8.622 -16.532 -7.453 1159 HB3 TRP 161 HB3 TRP 161 -8.643 -16.501 -9.192 1160 HD1 TRP 161 HD1 TRP 161 -5.329 -15.445 -8.791 1161 HE1 TRP 161 HE1 TRP 161 -3.617 -17.315 -8.817 1162 HE3 TRP 161 HE3 TRP 161 -8.463 -19.262 -7.565 1163 HZ2 TRP 161 HZ2 TRP 161 -3.617 -20.201 -8.306 1164 HZ3 TRP 161 HZ3 TRP 161 -7.582 -21.590 -7.314 1165 HH2 TRP 161 HH2 TRP 161 -5.171 -22.064 -7.688 1166 H ARG 162 H ARG 162 -7.447 -15.819 -6.098 1167 HA ARG 162 HA ARG 162 -6.896 -13.283 -4.572 1168 HB2 ARG 162 HB2 ARG 162 -8.985 -15.459 -4.153 1169 HB3 ARG 162 HB3 ARG 162 -8.872 -13.953 -3.256 1170 HG2 ARG 162 HG2 ARG 162 -9.690 -14.353 -6.146 1171 HG3 ARG 162 HG3 ARG 162 -10.715 -13.843 -4.830 1172 HD2 ARG 162 HD2 ARG 162 -9.866 -11.662 -4.779 1173 HD3 ARG 162 HD3 ARG 162 -8.361 -12.081 -5.571 1174 HE ARG 162 HE ARG 162 -11.042 -12.004 -6.939 1175 HH11 ARG 162 HH11 ARG 162 -11.109 -11.098 -9.026 1176 HH12 ARG 162 HH12 ARG 162 -9.578 -10.599 -9.739 1177 HH21 ARG 162 HH21 ARG 162 -7.548 -11.470 -7.316 1178 HH22 ARG 162 HH22 ARG 162 -7.833 -10.649 -8.834 1179 H ARG 163 H ARG 163 -7.384 -14.543 -2.071 1180 HA ARG 163 HA ARG 163 -4.938 -15.912 -1.374 1181 HB2 ARG 163 HB2 ARG 163 -6.032 -16.381 0.764 1182 HB3 ARG 163 HB3 ARG 163 -6.135 -14.685 0.316 1183 HG2 ARG 163 HG2 ARG 163 -8.490 -14.967 -0.364 1184 HG3 ARG 163 HG3 ARG 163 -8.404 -16.704 -0.013 1185 HD2 ARG 163 HD2 ARG 163 -7.992 -16.260 2.347 1186 HD3 ARG 163 HD3 ARG 163 -7.932 -14.515 2.041 1187 HE ARG 163 HE ARG 163 -10.424 -15.593 1.110 1188 HH11 ARG 163 HH11 ARG 163 -12.316 -15.242 2.206 1189 HH12 ARG 163 HH12 ARG 163 -12.280 -14.769 3.878 1190 HH21 ARG 163 HH21 ARG 163 -8.863 -14.772 4.136 1191 HH22 ARG 163 HH22 ARG 163 -10.382 -14.507 4.948 Start of MODEL 23 1 H1 GLY -4 H1 GLY -4 0.986 27.880 25.527 2 H2 GLY -4 H2 GLY -4 0.980 27.339 23.983 3 H3 GLY -4 H3 GLY -4 1.821 26.526 25.132 4 HA2 GLY -4 HA2 GLY -4 -0.209 25.345 24.612 5 HA3 GLY -4 HA3 GLY -4 -0.194 25.922 26.289 6 H SER -3 H SER -3 -2.588 25.285 25.092 7 HA SER -3 HA SER -3 -3.917 27.637 23.999 8 HB2 SER -3 HB2 SER -3 -5.888 26.215 23.971 9 HB3 SER -3 HB3 SER -3 -4.497 25.326 23.338 10 HG SER -3 HG SER -3 -5.669 24.060 24.805 11 HA PRO -2 HA PRO -2 -5.666 29.356 27.796 12 HB2 PRO -2 HB2 PRO -2 -8.364 29.125 26.461 13 HB3 PRO -2 HB3 PRO -2 -7.643 30.527 27.315 14 HG2 PRO -2 HG2 PRO -2 -7.686 30.478 24.614 15 HG3 PRO -2 HG3 PRO -2 -6.187 30.990 25.462 16 HD2 PRO -2 HD2 PRO -2 -6.848 28.268 24.295 17 HD3 PRO -2 HD3 PRO -2 -5.359 29.247 24.105 18 H ASN -1 H ASN -1 -6.950 26.402 26.441 19 HA ASN -1 HA ASN -1 -8.337 25.473 28.850 20 HB2 ASN -1 HB2 ASN -1 -9.099 24.991 26.531 21 HB3 ASN -1 HB3 ASN -1 -7.594 24.140 26.209 22 HD21 ASN -1 HD21 ASN -1 -9.046 21.129 27.261 23 HD22 ASN -1 HD22 ASN -1 -7.927 21.962 26.189 24 H SER 0 H SER 0 -5.063 25.701 28.034 25 HA SER 0 HA SER 0 -3.138 24.698 28.536 26 HB2 SER 0 HB2 SER 0 -4.539 23.637 31.011 27 HB3 SER 0 HB3 SER 0 -2.790 23.720 30.747 28 HG SER 0 HG SER 0 -4.594 25.930 30.817 29 H MET 1 H MET 1 -5.174 23.168 26.990 30 HA MET 1 HA MET 1 -3.549 20.834 26.468 31 HB2 MET 1 HB2 MET 1 -4.886 19.897 28.302 32 HB3 MET 1 HB3 MET 1 -6.382 20.446 27.546 33 HG2 MET 1 HG2 MET 1 -5.997 18.938 25.638 34 HG3 MET 1 HG3 MET 1 -4.452 18.429 26.334 35 HE1 MET 1 HE1 MET 1 -6.888 16.565 25.303 36 HE2 MET 1 HE2 MET 1 -5.329 15.927 25.876 37 HE3 MET 1 HE3 MET 1 -6.851 15.289 26.539 38 H ALA 2 H ALA 2 -3.536 20.701 24.302 39 HA ALA 2 HA ALA 2 -5.657 21.963 22.673 40 HB1 ALA 2 HB1 ALA 2 -3.010 20.677 21.902 41 HB2 ALA 2 HB2 ALA 2 -4.124 21.533 20.811 42 HB3 ALA 2 HB3 ALA 2 -3.320 22.418 22.125 43 H THR 3 H THR 3 -7.378 20.619 23.144 44 HA THR 3 HA THR 3 -7.361 17.775 22.742 45 HB THR 3 HB THR 3 -9.774 19.479 22.980 46 HG1 THR 3 HG1 THR 3 -9.500 19.331 25.223 47 HG21 THR 3 HG21 THR 3 -9.077 16.718 24.091 48 HG22 THR 3 HG22 THR 3 -10.633 17.554 24.303 49 HG23 THR 3 HG23 THR 3 -10.133 17.013 22.695 50 H GLU 4 H GLU 4 -6.395 18.450 20.443 51 HA GLU 4 HA GLU 4 -8.363 18.875 18.331 52 HB2 GLU 4 HB2 GLU 4 -6.045 19.739 18.209 53 HB3 GLU 4 HB3 GLU 4 -5.424 18.090 18.214 54 HG2 GLU 4 HG2 GLU 4 -5.380 19.009 15.968 55 HG3 GLU 4 HG3 GLU 4 -6.480 17.651 16.023 56 H LEU 5 H LEU 5 -8.919 17.447 16.692 57 HA LEU 5 HA LEU 5 -9.043 14.571 17.417 58 HB2 LEU 5 HB2 LEU 5 -10.445 16.115 15.210 59 HB3 LEU 5 HB3 LEU 5 -10.722 14.426 15.631 60 HG LEU 5 HG LEU 5 -11.341 16.823 17.414 61 HD11 LEU 5 HD11 LEU 5 -12.855 16.566 15.483 62 HD12 LEU 5 HD12 LEU 5 -13.164 14.876 15.942 63 HD13 LEU 5 HD13 LEU 5 -13.679 16.204 17.008 64 HD21 LEU 5 HD21 LEU 5 -10.770 14.898 18.822 65 HD22 LEU 5 HD22 LEU 5 -12.514 15.163 18.851 66 HD23 LEU 5 HD23 LEU 5 -11.840 13.845 17.863 67 H GLU 6 H GLU 6 -6.479 15.578 16.704 68 HA GLU 6 HA GLU 6 -5.951 14.498 14.004 69 HB2 GLU 6 HB2 GLU 6 -4.416 16.308 15.833 70 HB3 GLU 6 HB3 GLU 6 -3.555 15.374 14.613 71 HG2 GLU 6 HG2 GLU 6 -5.933 17.119 13.875 72 HG3 GLU 6 HG3 GLU 6 -4.284 17.736 13.961 73 H TYR 7 H TYR 7 -5.871 12.269 14.108 74 HA TYR 7 HA TYR 7 -3.795 10.945 15.652 75 HB2 TYR 7 HB2 TYR 7 -5.210 9.547 16.966 76 HB3 TYR 7 HB3 TYR 7 -5.759 11.179 17.263 77 HD1 TYR 7 HD1 TYR 7 -7.835 12.019 15.962 78 HD2 TYR 7 HD2 TYR 7 -6.741 7.858 16.248 79 HE1 TYR 7 HE1 TYR 7 -10.105 11.379 15.195 80 HE2 TYR 7 HE2 TYR 7 -9.034 7.211 15.539 81 HH TYR 7 HH TYR 7 -11.548 9.636 14.750 82 H GLU 8 H GLU 8 -4.274 8.428 15.425 83 HA GLU 8 HA GLU 8 -5.924 7.572 13.287 84 HB2 GLU 8 HB2 GLU 8 -4.247 6.438 11.896 85 HB3 GLU 8 HB3 GLU 8 -4.221 8.174 11.717 86 HG2 GLU 8 HG2 GLU 8 -2.270 6.784 13.578 87 HG3 GLU 8 HG3 GLU 8 -1.987 6.859 11.852 88 H SER 9 H SER 9 -6.582 5.599 13.718 89 HA SER 9 HA SER 9 -5.362 4.097 15.963 90 HB2 SER 9 HB2 SER 9 -8.092 4.052 14.661 91 HB3 SER 9 HB3 SER 9 -7.582 2.883 15.900 92 HG SER 9 HG SER 9 -8.668 4.663 16.844 93 H VAL 10 H VAL 10 -4.601 1.953 15.761 94 HA VAL 10 HA VAL 10 -3.889 1.132 13.108 95 HB VAL 10 HB VAL 10 -2.483 0.697 15.039 96 HG11 VAL 10 HG11 VAL 10 -2.851 -1.176 16.537 97 HG12 VAL 10 HG12 VAL 10 -4.195 -0.037 16.690 98 HG13 VAL 10 HG13 VAL 10 -4.407 -1.546 15.775 99 HG21 VAL 10 HG21 VAL 10 -3.233 -1.854 13.556 100 HG22 VAL 10 HG22 VAL 10 -2.178 -0.562 12.931 101 HG23 VAL 10 HG23 VAL 10 -1.697 -1.495 14.358 102 H LEU 11 H LEU 11 -4.639 -0.250 11.689 103 HA LEU 11 HA LEU 11 -7.184 -1.732 12.259 104 HB2 LEU 11 HB2 LEU 11 -6.066 -0.785 9.593 105 HB3 LEU 11 HB3 LEU 11 -7.560 -1.671 9.846 106 HG LEU 11 HG LEU 11 -6.975 1.203 10.654 107 HD11 LEU 11 HD11 LEU 11 -8.888 -0.121 8.674 108 HD12 LEU 11 HD12 LEU 11 -8.837 1.606 9.038 109 HD13 LEU 11 HD13 LEU 11 -7.444 0.834 8.277 110 HD21 LEU 11 HD21 LEU 11 -9.361 1.304 11.359 111 HD22 LEU 11 HD22 LEU 11 -9.477 -0.462 11.178 112 HD23 LEU 11 HD23 LEU 11 -8.401 0.258 12.404 113 H CYS 12 H CYS 12 -4.010 -1.930 10.562 114 HA CYS 12 HA CYS 12 -4.010 -4.851 10.919 115 HB2 CYS 12 HB2 CYS 12 -5.227 -4.371 8.776 116 HB3 CYS 12 HB3 CYS 12 -3.739 -3.657 8.136 117 HG CYS 12 HG CYS 12 -4.097 -6.054 7.145 118 H VAL 13 H VAL 13 -2.088 -5.802 10.908 119 HA VAL 13 HA VAL 13 0.370 -4.327 10.258 120 HB VAL 13 HB VAL 13 0.107 -4.078 12.658 121 HG11 VAL 13 HG11 VAL 13 0.185 -5.905 14.241 122 HG12 VAL 13 HG12 VAL 13 -1.242 -6.073 13.213 123 HG13 VAL 13 HG13 VAL 13 0.180 -7.103 12.935 124 HG21 VAL 13 HG21 VAL 13 2.272 -4.937 13.382 125 HG22 VAL 13 HG22 VAL 13 2.316 -6.083 12.028 126 HG23 VAL 13 HG23 VAL 13 2.391 -4.333 11.727 127 H LYS 14 H LYS 14 1.692 -5.513 9.056 128 HA LYS 14 HA LYS 14 1.391 -8.489 8.989 129 HB2 LYS 14 HB2 LYS 14 1.908 -6.732 6.571 130 HB3 LYS 14 HB3 LYS 14 1.907 -8.473 6.565 131 HG2 LYS 14 HG2 LYS 14 -0.600 -6.923 7.392 132 HG3 LYS 14 HG3 LYS 14 -0.164 -7.171 5.712 133 HD2 LYS 14 HD2 LYS 14 -1.603 -8.879 6.050 134 HD3 LYS 14 HD3 LYS 14 -0.039 -9.659 6.220 135 HE2 LYS 14 HE2 LYS 14 -0.387 -9.336 8.776 136 HE3 LYS 14 HE3 LYS 14 -2.068 -8.954 8.364 137 HZ1 LYS 14 HZ1 LYS 14 -0.727 -11.465 7.492 138 HZ2 LYS 14 HZ2 LYS 14 -1.601 -11.361 8.883 139 HZ3 LYS 14 HZ3 LYS 14 -2.335 -11.145 7.442 140 HA PRO 15 HA PRO 15 5.142 -8.258 10.714 141 HB2 PRO 15 HB2 PRO 15 6.348 -10.709 10.253 142 HB3 PRO 15 HB3 PRO 15 4.900 -10.466 11.276 143 HG2 PRO 15 HG2 PRO 15 4.991 -11.293 8.352 144 HG3 PRO 15 HG3 PRO 15 4.074 -12.058 9.692 145 HD2 PRO 15 HD2 PRO 15 2.869 -10.308 8.036 146 HD3 PRO 15 HD3 PRO 15 2.546 -10.246 9.798 147 H ASP 16 H ASP 16 5.649 -9.233 7.304 148 HA ASP 16 HA ASP 16 7.525 -7.075 7.162 149 HB2 ASP 16 HB2 ASP 16 9.395 -8.161 6.164 150 HB3 ASP 16 HB3 ASP 16 9.082 -8.895 7.722 151 H VAL 17 H VAL 17 8.023 -6.330 5.002 152 HA VAL 17 HA VAL 17 6.305 -7.213 2.799 153 HB VAL 17 HB VAL 17 4.787 -5.889 4.295 154 HG11 VAL 17 HG11 VAL 17 6.453 -3.473 3.535 155 HG12 VAL 17 HG12 VAL 17 4.958 -3.494 4.481 156 HG13 VAL 17 HG13 VAL 17 6.432 -4.225 5.143 157 HG21 VAL 17 HG21 VAL 17 4.397 -6.069 1.850 158 HG22 VAL 17 HG22 VAL 17 3.785 -4.565 2.551 159 HG23 VAL 17 HG23 VAL 17 5.291 -4.548 1.619 160 H SER 18 H SER 18 6.945 -6.326 0.808 161 HA SER 18 HA SER 18 9.458 -4.710 0.850 162 HB2 SER 18 HB2 SER 18 8.654 -6.822 -1.165 163 HB3 SER 18 HB3 SER 18 10.179 -5.920 -1.088 164 HG SER 18 HG SER 18 10.281 -8.058 -0.159 165 H VAL 19 H VAL 19 9.715 -3.065 -0.549 166 HA VAL 19 HA VAL 19 7.325 -2.164 -2.111 167 HB VAL 19 HB VAL 19 9.222 -0.647 -0.345 168 HG11 VAL 19 HG11 VAL 19 7.432 0.508 -2.496 169 HG12 VAL 19 HG12 VAL 19 8.185 1.450 -1.198 170 HG13 VAL 19 HG13 VAL 19 9.203 0.674 -2.391 171 HG21 VAL 19 HG21 VAL 19 6.189 -0.761 -0.615 172 HG22 VAL 19 HG22 VAL 19 7.144 -1.609 0.618 173 HG23 VAL 19 HG23 VAL 19 7.100 0.151 0.597 174 H TYR 20 H TYR 20 7.528 -1.334 -4.016 175 HA TYR 20 HA TYR 20 10.126 -1.515 -5.488 176 HB2 TYR 20 HB2 TYR 20 7.392 -2.590 -6.319 177 HB3 TYR 20 HB3 TYR 20 8.877 -2.684 -7.251 178 HD1 TYR 20 HD1 TYR 20 7.024 -4.021 -4.323 179 HD2 TYR 20 HD2 TYR 20 10.613 -4.290 -6.674 180 HE1 TYR 20 HE1 TYR 20 7.555 -6.218 -3.263 181 HE2 TYR 20 HE2 TYR 20 11.054 -6.564 -5.713 182 HH TYR 20 HH TYR 20 8.945 -8.053 -3.258 183 H ARG 21 H ARG 21 10.278 0.792 -5.564 184 HA ARG 21 HA ARG 21 8.365 2.680 -6.491 185 HB2 ARG 21 HB2 ARG 21 11.358 2.574 -7.055 186 HB3 ARG 21 HB3 ARG 21 10.324 3.981 -7.301 187 HG2 ARG 21 HG2 ARG 21 9.821 4.063 -4.876 188 HG3 ARG 21 HG3 ARG 21 10.878 2.675 -4.594 189 HD2 ARG 21 HD2 ARG 21 11.750 5.347 -5.782 190 HD3 ARG 21 HD3 ARG 21 11.952 4.862 -4.089 191 HE ARG 21 HE ARG 21 13.144 2.858 -5.744 192 HH11 ARG 21 HH11 ARG 21 15.180 2.567 -5.889 193 HH12 ARG 21 HH12 ARG 21 16.343 3.873 -5.655 194 HH21 ARG 21 HH21 ARG 21 13.875 6.175 -4.858 195 HH22 ARG 21 HH22 ARG 21 15.587 5.908 -5.048 196 H ILE 22 H ILE 22 7.476 3.164 -8.382 197 HA ILE 22 HA ILE 22 8.154 1.460 -10.732 198 HB ILE 22 HB ILE 22 5.841 1.416 -11.343 199 HG12 ILE 22 HG12 ILE 22 5.393 3.281 -8.982 200 HG13 ILE 22 HG13 ILE 22 4.961 3.530 -10.677 201 HG21 ILE 22 HG21 ILE 22 6.047 0.765 -8.420 202 HG22 ILE 22 HG22 ILE 22 5.072 -0.050 -9.631 203 HG23 ILE 22 HG23 ILE 22 6.837 -0.205 -9.680 204 HD11 ILE 22 HD11 ILE 22 3.652 1.642 -8.698 205 HD12 ILE 22 HD12 ILE 22 2.953 3.059 -9.497 206 HD13 ILE 22 HD13 ILE 22 3.330 1.603 -10.449 207 HA PRO 23 HA PRO 23 8.385 5.213 -13.151 208 HB2 PRO 23 HB2 PRO 23 8.510 4.070 -15.698 209 HB3 PRO 23 HB3 PRO 23 9.864 4.420 -14.594 210 HG2 PRO 23 HG2 PRO 23 8.586 1.800 -15.196 211 HG3 PRO 23 HG3 PRO 23 10.233 2.151 -14.625 212 HD2 PRO 23 HD2 PRO 23 8.093 1.211 -13.041 213 HD3 PRO 23 HD3 PRO 23 9.611 1.928 -12.440 214 HA PRO 24 HA PRO 24 4.507 4.964 -15.824 215 HB2 PRO 24 HB2 PRO 24 2.755 2.892 -15.878 216 HB3 PRO 24 HB3 PRO 24 4.320 2.846 -16.746 217 HG2 PRO 24 HG2 PRO 24 3.698 1.725 -13.987 218 HG3 PRO 24 HG3 PRO 24 4.450 0.882 -15.384 219 HD2 PRO 24 HD2 PRO 24 5.948 2.009 -13.421 220 HD3 PRO 24 HD3 PRO 24 6.465 2.069 -15.131 221 H ARG 25 H ARG 25 2.234 5.410 -15.667 222 HA ARG 25 HA ARG 25 1.077 5.655 -12.905 223 HB2 ARG 25 HB2 ARG 25 1.764 7.842 -13.593 224 HB3 ARG 25 HB3 ARG 25 1.140 7.606 -15.224 225 HG2 ARG 25 HG2 ARG 25 -0.331 9.093 -14.036 226 HG3 ARG 25 HG3 ARG 25 -1.171 7.590 -14.390 227 HD2 ARG 25 HD2 ARG 25 -0.641 6.860 -11.976 228 HD3 ARG 25 HD3 ARG 25 -0.016 8.482 -11.711 229 HE ARG 25 HE ARG 25 -2.185 9.360 -11.785 230 HH11 ARG 25 HH11 ARG 25 -4.396 9.284 -11.753 231 HH12 ARG 25 HH12 ARG 25 -5.225 7.791 -12.071 232 HH21 ARG 25 HH21 ARG 25 -2.384 5.937 -12.619 233 HH22 ARG 25 HH22 ARG 25 -4.126 5.948 -12.520 234 H ALA 26 H ALA 26 0.219 5.311 -16.366 235 HA ALA 26 HA ALA 26 -2.229 3.838 -15.604 236 HB1 ALA 26 HB1 ALA 26 -3.672 5.499 -16.733 237 HB2 ALA 26 HB2 ALA 26 -2.854 6.178 -15.313 238 HB3 ALA 26 HB3 ALA 26 -2.263 6.576 -16.939 239 H SER 27 H SER 27 -1.629 2.157 -16.667 240 HA SER 27 HA SER 27 -1.582 2.228 -19.658 241 HB2 SER 27 HB2 SER 27 0.157 0.842 -18.634 242 HB3 SER 27 HB3 SER 27 -1.078 -0.102 -17.779 243 HG SER 27 HG SER 27 -0.206 -0.846 -19.957 244 H ASN 28 H ASN 28 -2.976 0.663 -20.696 245 HA ASN 28 HA ASN 28 -5.713 1.090 -20.238 246 HB2 ASN 28 HB2 ASN 28 -6.007 -0.268 -22.160 247 HB3 ASN 28 HB3 ASN 28 -4.476 0.560 -22.400 248 HD21 ASN 28 HD21 ASN 28 -2.642 -2.623 -21.913 249 HD22 ASN 28 HD22 ASN 28 -2.495 -1.015 -21.245 250 H ARG 29 H ARG 29 -3.701 -1.460 -18.917 251 HA ARG 29 HA ARG 29 -6.097 -2.850 -17.756 252 HB2 ARG 29 HB2 ARG 29 -3.212 -3.811 -17.748 253 HB3 ARG 29 HB3 ARG 29 -4.654 -4.730 -17.324 254 HG2 ARG 29 HG2 ARG 29 -3.786 -3.811 -20.071 255 HG3 ARG 29 HG3 ARG 29 -3.885 -5.458 -19.456 256 HD2 ARG 29 HD2 ARG 29 -6.491 -4.546 -19.120 257 HD3 ARG 29 HD3 ARG 29 -6.005 -3.698 -20.580 258 HE ARG 29 HE ARG 29 -6.285 -6.633 -20.125 259 HH11 ARG 29 HH11 ARG 29 -6.494 -8.002 -21.823 260 HH12 ARG 29 HH12 ARG 29 -6.221 -7.435 -23.443 261 HH21 ARG 29 HH21 ARG 29 -5.471 -4.206 -22.561 262 HH22 ARG 29 HH22 ARG 29 -5.669 -5.365 -23.849 263 H GLY 30 H GLY 30 -3.908 -0.525 -16.885 264 HA2 GLY 30 HA2 GLY 30 -4.351 0.433 -14.606 265 HA3 GLY 30 HA3 GLY 30 -4.028 -1.189 -13.965 266 H TYR 31 H TYR 31 -2.017 -1.623 -13.370 267 HA TYR 31 HA TYR 31 0.244 0.177 -14.226 268 HB2 TYR 31 HB2 TYR 31 -0.370 -1.171 -11.581 269 HB3 TYR 31 HB3 TYR 31 1.231 -0.587 -11.987 270 HD1 TYR 31 HD1 TYR 31 -2.205 0.413 -11.201 271 HD2 TYR 31 HD2 TYR 31 1.768 1.743 -12.213 272 HE1 TYR 31 HE1 TYR 31 -2.762 2.705 -10.349 273 HE2 TYR 31 HE2 TYR 31 1.231 4.026 -11.339 274 HH TYR 31 HH TYR 31 -1.977 4.813 -9.931 275 H ARG 32 H ARG 32 -0.736 -3.162 -13.771 276 HA ARG 32 HA ARG 32 0.277 -5.134 -13.680 277 HB2 ARG 32 HB2 ARG 32 1.925 -4.833 -16.068 278 HB3 ARG 32 HB3 ARG 32 0.587 -5.883 -15.662 279 HG2 ARG 32 HG2 ARG 32 -0.311 -4.873 -17.456 280 HG3 ARG 32 HG3 ARG 32 -0.903 -3.775 -16.229 281 HD2 ARG 32 HD2 ARG 32 -0.132 -2.363 -17.926 282 HD3 ARG 32 HD3 ARG 32 1.159 -2.318 -16.732 283 HE ARG 32 HE ARG 32 2.610 -3.196 -18.274 284 HH11 ARG 32 HH11 ARG 32 3.354 -3.701 -20.152 285 HH12 ARG 32 HH12 ARG 32 2.318 -4.342 -21.424 286 HH21 ARG 32 HH21 ARG 32 -0.567 -3.973 -19.560 287 HH22 ARG 32 HH22 ARG 32 0.119 -4.468 -21.084 288 H ALA 33 H ALA 33 1.551 -5.648 -12.013 289 HA ALA 33 HA ALA 33 4.060 -4.601 -11.338 290 HB1 ALA 33 HB1 ALA 33 4.345 -6.549 -9.974 291 HB2 ALA 33 HB2 ALA 33 2.619 -6.183 -9.972 292 HB3 ALA 33 HB3 ALA 33 3.235 -7.511 -10.968 293 H SER 34 H SER 34 3.275 -7.087 -13.660 294 HA SER 34 HA SER 34 5.768 -8.194 -14.372 295 HB2 SER 34 HB2 SER 34 4.510 -8.770 -16.439 296 HB3 SER 34 HB3 SER 34 3.568 -9.080 -14.938 297 HG SER 34 HG SER 34 2.374 -8.008 -16.630 298 H ASP 35 H ASP 35 4.464 -5.011 -15.139 299 HA ASP 35 HA ASP 35 6.195 -4.577 -17.437 300 HB2 ASP 35 HB2 ASP 35 3.802 -3.632 -16.849 301 HB3 ASP 35 HB3 ASP 35 4.686 -2.424 -15.929 302 H TRP 36 H TRP 36 6.515 -4.237 -13.990 303 HA TRP 36 HA TRP 36 8.982 -2.614 -14.269 304 HB2 TRP 36 HB2 TRP 36 8.254 -1.466 -12.063 305 HB3 TRP 36 HB3 TRP 36 7.716 -0.952 -13.625 306 HD1 TRP 36 HD1 TRP 36 5.345 -0.816 -14.163 307 HE1 TRP 36 HE1 TRP 36 3.129 -1.206 -12.964 308 HE3 TRP 36 HE3 TRP 36 7.106 -3.221 -9.993 309 HZ2 TRP 36 HZ2 TRP 36 2.293 -1.989 -10.305 310 HZ3 TRP 36 HZ3 TRP 36 5.562 -3.763 -8.128 311 HH2 TRP 36 HH2 TRP 36 3.158 -3.148 -8.261 312 H LYS 37 H LYS 37 9.289 -2.637 -11.334 313 HA LYS 37 HA LYS 37 11.151 -4.831 -11.509 314 HB2 LYS 37 HB2 LYS 37 10.751 -2.773 -9.288 315 HB3 LYS 37 HB3 LYS 37 12.154 -3.801 -9.560 316 HG2 LYS 37 HG2 LYS 37 12.148 -2.565 -11.949 317 HG3 LYS 37 HG3 LYS 37 11.331 -1.308 -11.000 318 HD2 LYS 37 HD2 LYS 37 13.993 -2.655 -10.475 319 HD3 LYS 37 HD3 LYS 37 13.772 -0.966 -10.961 320 HE2 LYS 37 HE2 LYS 37 12.943 -2.241 -8.310 321 HE3 LYS 37 HE3 LYS 37 14.389 -1.282 -8.554 322 HZ1 LYS 37 HZ1 LYS 37 13.031 0.653 -8.981 323 HZ2 LYS 37 HZ2 LYS 37 11.630 -0.199 -8.922 324 HZ3 LYS 37 HZ3 LYS 37 12.528 -0.018 -7.573 325 H LEU 38 H LEU 38 8.758 -6.081 -11.203 326 HA LEU 38 HA LEU 38 7.951 -6.546 -8.569 327 HB2 LEU 38 HB2 LEU 38 6.508 -8.185 -9.330 328 HB3 LEU 38 HB3 LEU 38 6.619 -6.984 -10.592 329 HG LEU 38 HG LEU 38 8.075 -9.665 -10.615 330 HD11 LEU 38 HD11 LEU 38 5.511 -8.793 -12.032 331 HD12 LEU 38 HD12 LEU 38 6.356 -10.333 -12.278 332 HD13 LEU 38 HD13 LEU 38 5.609 -9.957 -10.715 333 HD21 LEU 38 HD21 LEU 38 8.309 -9.268 -13.051 334 HD22 LEU 38 HD22 LEU 38 7.693 -7.624 -12.826 335 HD23 LEU 38 HD23 LEU 38 9.228 -8.125 -12.080 336 H ASP 39 H ASP 39 10.916 -7.590 -9.552 337 HA ASP 39 HA ASP 39 11.085 -9.547 -7.320 338 HB2 ASP 39 HB2 ASP 39 11.045 -10.667 -9.581 339 HB3 ASP 39 HB3 ASP 39 12.538 -9.818 -9.974 340 H GLN 40 H GLN 40 11.972 -6.506 -8.038 341 HA GLN 40 HA GLN 40 14.661 -6.717 -6.718 342 HB2 GLN 40 HB2 GLN 40 13.963 -4.829 -8.982 343 HB3 GLN 40 HB3 GLN 40 15.472 -4.884 -8.072 344 HG2 GLN 40 HG2 GLN 40 15.901 -7.161 -8.981 345 HG3 GLN 40 HG3 GLN 40 14.385 -7.061 -9.895 346 HE21 GLN 40 HE21 GLN 40 16.700 -6.022 -12.460 347 HE22 GLN 40 HE22 GLN 40 15.989 -7.469 -11.751 348 HA PRO 41 HA PRO 41 11.904 -3.864 -4.375 349 HB2 PRO 41 HB2 PRO 41 12.702 -4.425 -1.829 350 HB3 PRO 41 HB3 PRO 41 11.576 -5.456 -2.763 351 HG2 PRO 41 HG2 PRO 41 14.568 -5.818 -2.414 352 HG3 PRO 41 HG3 PRO 41 13.275 -7.044 -2.210 353 HD2 PRO 41 HD2 PRO 41 14.714 -6.817 -4.517 354 HD3 PRO 41 HD3 PRO 41 12.979 -7.254 -4.542 355 H ASP 42 H ASP 42 12.210 -1.880 -3.501 356 HA ASP 42 HA ASP 42 14.951 -0.705 -3.565 357 HB2 ASP 42 HB2 ASP 42 12.181 0.568 -3.362 358 HB3 ASP 42 HB3 ASP 42 13.701 1.452 -3.435 359 H TRP 43 H TRP 43 12.292 -1.453 -1.423 360 HA TRP 43 HA TRP 43 13.949 -0.987 0.949 361 HB2 TRP 43 HB2 TRP 43 12.854 1.186 0.652 362 HB3 TRP 43 HB3 TRP 43 11.297 0.414 0.407 363 HD1 TRP 43 HD1 TRP 43 13.639 1.597 3.102 364 HE1 TRP 43 HE1 TRP 43 12.493 1.463 5.396 365 HE3 TRP 43 HE3 TRP 43 9.466 -1.075 1.788 366 HZ2 TRP 43 HZ2 TRP 43 9.998 0.498 6.471 367 HZ3 TRP 43 HZ3 TRP 43 7.731 -1.612 3.476 368 HH2 TRP 43 HH2 TRP 43 7.964 -0.794 5.811 369 H THR 44 H THR 44 13.299 -2.342 2.700 370 HA THR 44 HA THR 44 10.637 -3.536 2.584 371 HB THR 44 HB THR 44 11.185 -5.702 2.928 372 HG1 THR 44 HG1 THR 44 13.921 -5.117 3.281 373 HG21 THR 44 HG21 THR 44 13.422 -4.969 1.013 374 HG22 THR 44 HG22 THR 44 12.625 -6.554 1.218 375 HG23 THR 44 HG23 THR 44 11.712 -5.177 0.593 376 H GLY 45 H GLY 45 9.806 -4.176 4.513 377 HA2 GLY 45 HA2 GLY 45 11.041 -3.641 7.086 378 HA3 GLY 45 HA3 GLY 45 10.058 -2.295 6.533 379 H ARG 46 H ARG 46 8.280 -2.416 7.662 380 HA ARG 46 HA ARG 46 6.643 -4.917 7.878 381 HB2 ARG 46 HB2 ARG 46 7.880 -4.460 9.955 382 HB3 ARG 46 HB3 ARG 46 7.251 -2.812 10.002 383 HG2 ARG 46 HG2 ARG 46 4.945 -3.692 10.328 384 HG3 ARG 46 HG3 ARG 46 5.573 -5.345 10.190 385 HD2 ARG 46 HD2 ARG 46 5.250 -4.863 12.510 386 HD3 ARG 46 HD3 ARG 46 6.982 -4.974 12.182 387 HE ARG 46 HE ARG 46 5.676 -2.268 12.228 388 HH11 ARG 46 HH11 ARG 46 6.309 -0.831 13.597 389 HH12 ARG 46 HH12 ARG 46 7.490 -1.177 14.866 390 HH21 ARG 46 HH21 ARG 46 7.838 -4.474 13.919 391 HH22 ARG 46 HH22 ARG 46 8.365 -3.221 15.007 392 H LEU 47 H LEU 47 4.386 -4.604 7.741 393 HA LEU 47 HA LEU 47 3.457 -2.012 6.610 394 HB2 LEU 47 HB2 LEU 47 2.827 -4.228 5.559 395 HB3 LEU 47 HB3 LEU 47 2.019 -4.629 7.073 396 HG LEU 47 HG LEU 47 0.589 -2.479 6.681 397 HD11 LEU 47 HD11 LEU 47 1.940 -1.509 4.865 398 HD12 LEU 47 HD12 LEU 47 1.615 -2.938 3.855 399 HD13 LEU 47 HD13 LEU 47 0.290 -1.855 4.339 400 HD21 LEU 47 HD21 LEU 47 -0.271 -4.742 6.569 401 HD22 LEU 47 HD22 LEU 47 -0.987 -3.741 5.321 402 HD23 LEU 47 HD23 LEU 47 0.290 -4.900 4.886 403 H ARG 48 H ARG 48 2.159 -0.579 7.721 404 HA ARG 48 HA ARG 48 0.611 -1.543 10.066 405 HB2 ARG 48 HB2 ARG 48 2.982 -0.317 10.553 406 HB3 ARG 48 HB3 ARG 48 2.043 1.132 10.294 407 HG2 ARG 48 HG2 ARG 48 1.986 0.742 12.618 408 HG3 ARG 48 HG3 ARG 48 0.395 0.192 12.068 409 HD2 ARG 48 HD2 ARG 48 1.149 -2.136 12.096 410 HD3 ARG 48 HD3 ARG 48 2.811 -1.659 12.420 411 HE ARG 48 HE ARG 48 0.609 -1.849 14.337 412 HH11 ARG 48 HH11 ARG 48 1.038 -1.613 16.500 413 HH12 ARG 48 HH12 ARG 48 2.554 -0.943 17.018 414 HH21 ARG 48 HH21 ARG 48 3.820 -0.432 13.864 415 HH22 ARG 48 HH22 ARG 48 4.052 -0.268 15.585 416 H ILE 49 H ILE 49 -1.263 -1.433 8.933 417 HA ILE 49 HA ILE 49 -2.096 1.073 7.569 418 HB ILE 49 HB ILE 49 -3.556 -1.546 7.987 419 HG12 ILE 49 HG12 ILE 49 -2.225 -0.309 5.529 420 HG13 ILE 49 HG13 ILE 49 -1.648 -1.712 6.423 421 HG21 ILE 49 HG21 ILE 49 -4.387 0.798 6.232 422 HG22 ILE 49 HG22 ILE 49 -5.279 -0.717 6.515 423 HG23 ILE 49 HG23 ILE 49 -5.110 0.434 7.819 424 HD11 ILE 49 HD11 ILE 49 -2.720 -2.452 4.405 425 HD12 ILE 49 HD12 ILE 49 -3.701 -2.961 5.786 426 HD13 ILE 49 HD13 ILE 49 -4.199 -1.576 4.768 427 H THR 50 H THR 50 -3.218 2.607 8.526 428 HA THR 50 HA THR 50 -4.537 2.138 11.164 429 HB THR 50 HB THR 50 -3.693 4.270 11.983 430 HG1 THR 50 HG1 THR 50 -2.191 4.299 9.579 431 HG21 THR 50 HG21 THR 50 -1.317 2.656 10.962 432 HG22 THR 50 HG22 THR 50 -1.333 3.825 12.296 433 HG23 THR 50 HG23 THR 50 -2.225 2.307 12.445 434 H SER 51 H SER 51 -6.060 4.070 11.701 435 HA SER 51 HA SER 51 -6.980 5.672 9.434 436 HB2 SER 51 HB2 SER 51 -8.252 3.672 8.997 437 HB3 SER 51 HB3 SER 51 -8.821 3.610 10.684 438 HG SER 51 HG SER 51 -9.268 5.744 8.831 439 H LYS 52 H LYS 52 -7.740 7.509 10.032 440 HA LYS 52 HA LYS 52 -8.460 8.184 12.833 441 HB2 LYS 52 HB2 LYS 52 -6.754 9.390 11.489 442 HB3 LYS 52 HB3 LYS 52 -8.044 9.906 10.377 443 HG2 LYS 52 HG2 LYS 52 -9.083 10.975 12.546 444 HG3 LYS 52 HG3 LYS 52 -7.496 10.704 13.238 445 HD2 LYS 52 HD2 LYS 52 -8.239 12.306 10.775 446 HD3 LYS 52 HD3 LYS 52 -7.688 12.954 12.336 447 HE2 LYS 52 HE2 LYS 52 -5.442 12.097 11.938 448 HE3 LYS 52 HE3 LYS 52 -5.976 11.239 10.489 449 HZ1 LYS 52 HZ1 LYS 52 -6.486 13.437 9.508 450 HZ2 LYS 52 HZ2 LYS 52 -5.864 14.189 10.839 451 HZ3 LYS 52 HZ3 LYS 52 -4.904 13.287 9.881 452 H GLY 53 H GLY 53 -10.173 6.561 10.911 453 HA2 GLY 53 HA2 GLY 53 -12.464 6.213 10.725 454 HA3 GLY 53 HA3 GLY 53 -12.797 7.803 11.408 455 H LYS 54 H LYS 54 -13.376 6.125 8.768 456 HA LYS 54 HA LYS 54 -13.668 6.335 6.543 457 HB2 LYS 54 HB2 LYS 54 -15.145 8.198 7.699 458 HB3 LYS 54 HB3 LYS 54 -14.047 9.302 6.853 459 HG2 LYS 54 HG2 LYS 54 -14.691 7.899 4.719 460 HG3 LYS 54 HG3 LYS 54 -15.954 7.222 5.755 461 HD2 LYS 54 HD2 LYS 54 -16.789 9.548 6.183 462 HD3 LYS 54 HD3 LYS 54 -15.505 10.168 5.123 463 HE2 LYS 54 HE2 LYS 54 -16.479 8.686 3.271 464 HE3 LYS 54 HE3 LYS 54 -17.861 8.391 4.337 465 HZ1 LYS 54 HZ1 LYS 54 -16.993 11.062 3.352 466 HZ2 LYS 54 HZ2 LYS 54 -18.316 10.256 2.847 467 HZ3 LYS 54 HZ3 LYS 54 -18.238 10.824 4.377 468 H THR 55 H THR 55 -10.953 7.853 7.684 469 HA THR 55 HA THR 55 -9.725 7.605 4.959 470 HB THR 55 HB THR 55 -8.603 9.487 7.060 471 HG1 THR 55 HG1 THR 55 -10.670 10.276 6.714 472 HG21 THR 55 HG21 THR 55 -7.284 8.818 5.049 473 HG22 THR 55 HG22 THR 55 -8.621 9.375 4.017 474 HG23 THR 55 HG23 THR 55 -7.706 10.546 5.002 475 H ALA 56 H ALA 56 -8.621 5.834 4.952 476 HA ALA 56 HA ALA 56 -7.166 4.980 7.395 477 HB1 ALA 56 HB1 ALA 56 -7.761 3.464 4.839 478 HB2 ALA 56 HB2 ALA 56 -6.608 2.922 6.070 479 HB3 ALA 56 HB3 ALA 56 -8.313 3.125 6.475 480 H TYR 57 H TYR 57 -4.938 4.551 7.240 481 HA TYR 57 HA TYR 57 -3.415 6.098 5.191 482 HB2 TYR 57 HB2 TYR 57 -2.941 6.096 8.190 483 HB3 TYR 57 HB3 TYR 57 -1.902 6.830 6.985 484 HD1 TYR 57 HD1 TYR 57 -2.288 9.068 6.264 485 HD2 TYR 57 HD2 TYR 57 -5.318 7.007 8.539 486 HE1 TYR 57 HE1 TYR 57 -3.609 11.175 6.438 487 HE2 TYR 57 HE2 TYR 57 -6.661 9.078 8.646 488 HH TYR 57 HH TYR 57 -5.552 12.146 7.149 489 H ILE 58 H ILE 58 -2.350 4.578 4.089 490 HA ILE 58 HA ILE 58 -1.447 2.047 5.307 491 HB ILE 58 HB ILE 58 -0.529 3.201 2.652 492 HG12 ILE 58 HG12 ILE 58 -2.929 3.231 2.453 493 HG13 ILE 58 HG13 ILE 58 -2.200 2.007 1.435 494 HG21 ILE 58 HG21 ILE 58 -0.649 0.389 3.775 495 HG22 ILE 58 HG22 ILE 58 -0.162 0.820 2.119 496 HG23 ILE 58 HG23 ILE 58 0.801 1.369 3.489 497 HD11 ILE 58 HD11 ILE 58 -4.276 1.258 2.493 498 HD12 ILE 58 HD12 ILE 58 -2.906 0.230 2.960 499 HD13 ILE 58 HD13 ILE 58 -3.552 1.436 4.102 500 H LYS 59 H LYS 59 0.119 2.408 6.909 501 HA LYS 59 HA LYS 59 2.393 4.203 6.168 502 HB2 LYS 59 HB2 LYS 59 1.725 3.331 8.980 503 HB3 LYS 59 HB3 LYS 59 2.894 4.528 8.426 504 HG2 LYS 59 HG2 LYS 59 0.765 5.665 7.300 505 HG3 LYS 59 HG3 LYS 59 -0.127 4.692 8.482 506 HD2 LYS 59 HD2 LYS 59 1.298 5.754 10.295 507 HD3 LYS 59 HD3 LYS 59 2.026 6.775 9.024 508 HE2 LYS 59 HE2 LYS 59 -0.388 7.427 8.410 509 HE3 LYS 59 HE3 LYS 59 -0.871 6.685 9.946 510 HZ1 LYS 59 HZ1 LYS 59 0.862 9.037 9.490 511 HZ2 LYS 59 HZ2 LYS 59 -0.490 8.949 10.445 512 HZ3 LYS 59 HZ3 LYS 59 0.894 8.250 10.936 513 H LEU 60 H LEU 60 4.456 3.549 6.356 514 HA LEU 60 HA LEU 60 4.933 0.589 6.482 515 HB2 LEU 60 HB2 LEU 60 5.983 2.710 4.575 516 HB3 LEU 60 HB3 LEU 60 6.643 1.081 4.684 517 HG LEU 60 HG LEU 60 3.703 1.587 4.044 518 HD11 LEU 60 HD11 LEU 60 6.062 1.289 2.167 519 HD12 LEU 60 HD12 LEU 60 4.357 1.168 1.673 520 HD13 LEU 60 HD13 LEU 60 4.984 2.690 2.324 521 HD21 LEU 60 HD21 LEU 60 5.527 -0.806 3.536 522 HD22 LEU 60 HD22 LEU 60 4.299 -0.712 4.813 523 HD23 LEU 60 HD23 LEU 60 3.807 -0.684 3.115 524 H GLU 61 H GLU 61 6.397 -0.048 7.874 525 HA GLU 61 HA GLU 61 7.981 2.020 9.347 526 HB2 GLU 61 HB2 GLU 61 6.671 -0.526 10.365 527 HB3 GLU 61 HB3 GLU 61 7.632 0.605 11.320 528 HG2 GLU 61 HG2 GLU 61 5.956 2.399 10.810 529 HG3 GLU 61 HG3 GLU 61 4.945 1.186 10.012 530 H ASP 62 H ASP 62 10.113 1.450 10.112 531 HA ASP 62 HA ASP 62 11.534 -0.603 8.674 532 HB2 ASP 62 HB2 ASP 62 12.524 1.525 9.412 533 HB3 ASP 62 HB3 ASP 62 12.201 1.103 11.094 534 H LYS 63 H LYS 63 11.858 -2.690 9.256 535 HA LYS 63 HA LYS 63 10.141 -3.859 11.251 536 HB2 LYS 63 HB2 LYS 63 10.919 -5.991 10.455 537 HB3 LYS 63 HB3 LYS 63 10.630 -4.923 9.090 538 HG2 LYS 63 HG2 LYS 63 13.134 -4.458 9.012 539 HG3 LYS 63 HG3 LYS 63 13.335 -5.630 10.314 540 HD2 LYS 63 HD2 LYS 63 13.876 -6.748 8.313 541 HD3 LYS 63 HD3 LYS 63 12.304 -7.390 8.808 542 HE2 LYS 63 HE2 LYS 63 11.151 -6.049 7.120 543 HE3 LYS 63 HE3 LYS 63 12.628 -5.119 6.802 544 HZ1 LYS 63 HZ1 LYS 63 12.479 -6.689 5.072 545 HZ2 LYS 63 HZ2 LYS 63 13.654 -7.243 6.032 546 HZ3 LYS 63 HZ3 LYS 63 12.184 -7.959 6.085 547 H VAL 64 H VAL 64 13.022 -2.366 11.801 548 HA VAL 64 HA VAL 64 13.793 -4.053 14.142 549 HB VAL 64 HB VAL 64 15.530 -1.922 12.866 550 HG11 VAL 64 HG11 VAL 64 16.167 -4.438 14.441 551 HG12 VAL 64 HG12 VAL 64 17.342 -3.252 13.820 552 HG13 VAL 64 HG13 VAL 64 16.183 -2.769 15.063 553 HG21 VAL 64 HG21 VAL 64 15.045 -3.365 10.985 554 HG22 VAL 64 HG22 VAL 64 16.679 -3.693 11.560 555 HG23 VAL 64 HG23 VAL 64 15.361 -4.823 11.965 556 H SER 65 H SER 65 13.267 -0.668 13.045 557 HA SER 65 HA SER 65 13.312 0.158 15.908 558 HB2 SER 65 HB2 SER 65 13.887 2.396 15.019 559 HB3 SER 65 HB3 SER 65 15.046 1.140 14.527 560 HG SER 65 HG SER 65 14.506 2.379 12.740 561 H GLY 66 H GLY 66 11.056 -0.212 13.357 562 HA2 GLY 66 HA2 GLY 66 8.857 0.397 13.158 563 HA3 GLY 66 HA3 GLY 66 8.912 1.196 14.733 564 H GLU 67 H GLU 67 11.407 2.311 12.612 565 HA GLU 67 HA GLU 67 10.325 4.971 12.637 566 HB2 GLU 67 HB2 GLU 67 12.703 3.713 11.248 567 HB3 GLU 67 HB3 GLU 67 12.289 5.409 11.007 568 HG2 GLU 67 HG2 GLU 67 12.619 4.283 13.800 569 HG3 GLU 67 HG3 GLU 67 14.008 4.797 12.845 570 H LEU 68 H LEU 68 9.482 6.270 11.057 571 HA LEU 68 HA LEU 68 7.813 4.874 9.153 572 HB2 LEU 68 HB2 LEU 68 7.082 6.873 10.464 573 HB3 LEU 68 HB3 LEU 68 8.208 7.864 9.535 574 HG LEU 68 HG LEU 68 6.937 7.232 7.433 575 HD11 LEU 68 HD11 LEU 68 5.817 5.169 8.193 576 HD12 LEU 68 HD12 LEU 68 4.946 6.080 9.443 577 HD13 LEU 68 HD13 LEU 68 4.623 6.375 7.721 578 HD21 LEU 68 HD21 LEU 68 6.538 9.359 8.614 579 HD22 LEU 68 HD22 LEU 68 5.051 8.733 7.885 580 HD23 LEU 68 HD23 LEU 68 5.316 8.571 9.637 581 H PHE 69 H PHE 69 8.301 4.260 7.188 582 HA PHE 69 HA PHE 69 10.465 5.488 5.560 583 HB2 PHE 69 HB2 PHE 69 10.441 3.139 5.560 584 HB3 PHE 69 HB3 PHE 69 8.699 3.053 5.346 585 HD1 PHE 69 HD1 PHE 69 11.518 4.759 3.463 586 HD2 PHE 69 HD2 PHE 69 8.096 2.149 3.314 587 HE1 PHE 69 HE1 PHE 69 11.760 4.575 1.015 588 HE2 PHE 69 HE2 PHE 69 8.352 1.936 0.880 589 HZ PHE 69 HZ PHE 69 10.150 3.173 -0.315 590 H ALA 70 H ALA 70 6.935 4.864 5.232 591 HA ALA 70 HA ALA 70 6.521 7.417 3.869 592 HB1 ALA 70 HB1 ALA 70 7.323 5.981 2.001 593 HB2 ALA 70 HB2 ALA 70 6.066 4.784 2.383 594 HB3 ALA 70 HB3 ALA 70 5.613 6.403 1.813 595 H GLN 71 H GLN 71 4.245 7.813 3.381 596 HA GLN 71 HA GLN 71 2.293 5.963 4.511 597 HB2 GLN 71 HB2 GLN 71 1.111 7.705 5.796 598 HB3 GLN 71 HB3 GLN 71 2.696 7.270 6.433 599 HG2 GLN 71 HG2 GLN 71 3.653 9.336 5.337 600 HG3 GLN 71 HG3 GLN 71 2.013 9.808 4.886 601 HE21 GLN 71 HE21 GLN 71 3.025 11.438 8.148 602 HE22 GLN 71 HE22 GLN 71 3.745 11.399 6.547 603 H ALA 72 H ALA 72 0.425 5.844 3.422 604 HA ALA 72 HA ALA 72 -0.151 7.845 1.271 605 HB1 ALA 72 HB1 ALA 72 -0.602 4.846 1.265 606 HB2 ALA 72 HB2 ALA 72 -1.191 5.955 0.034 607 HB3 ALA 72 HB3 ALA 72 0.548 5.756 0.268 608 HA PRO 73 HA PRO 73 -4.041 7.917 3.764 609 HB2 PRO 73 HB2 PRO 73 -5.009 10.327 2.994 610 HB3 PRO 73 HB3 PRO 73 -3.616 10.174 4.106 611 HG2 PRO 73 HG2 PRO 73 -3.551 10.691 1.123 612 HG3 PRO 73 HG3 PRO 73 -2.653 11.542 2.416 613 HD2 PRO 73 HD2 PRO 73 -1.579 9.496 0.912 614 HD3 PRO 73 HD3 PRO 73 -1.096 9.803 2.608 615 H VAL 74 H VAL 74 -6.054 7.130 3.213 616 HA VAL 74 HA VAL 74 -6.956 7.247 0.364 617 HB VAL 74 HB VAL 74 -5.989 5.112 0.782 618 HG11 VAL 74 HG11 VAL 74 -7.988 4.569 2.945 619 HG12 VAL 74 HG12 VAL 74 -6.932 3.372 2.178 620 HG13 VAL 74 HG13 VAL 74 -6.215 4.683 3.105 621 HG21 VAL 74 HG21 VAL 74 -7.998 5.320 -0.727 622 HG22 VAL 74 HG22 VAL 74 -7.806 3.703 -0.035 623 HG23 VAL 74 HG23 VAL 74 -9.009 4.795 0.639 624 H GLU 75 H GLU 75 -8.980 7.866 0.014 625 HA GLU 75 HA GLU 75 -10.851 8.005 2.329 626 HB2 GLU 75 HB2 GLU 75 -10.620 9.746 -0.151 627 HB3 GLU 75 HB3 GLU 75 -11.956 9.839 0.999 628 HG2 GLU 75 HG2 GLU 75 -10.407 10.408 2.818 629 HG3 GLU 75 HG3 GLU 75 -9.035 10.317 1.707 630 H GLN 76 H GLN 76 -10.306 6.195 -0.415 631 HA GLN 76 HA GLN 76 -12.929 5.025 -0.407 632 HB2 GLN 76 HB2 GLN 76 -12.452 5.416 -3.219 633 HB3 GLN 76 HB3 GLN 76 -13.835 5.846 -2.264 634 HG2 GLN 76 HG2 GLN 76 -13.084 7.712 -3.569 635 HG3 GLN 76 HG3 GLN 76 -12.928 8.090 -1.862 636 HE21 GLN 76 HE21 GLN 76 -9.179 7.397 -3.256 637 HE22 GLN 76 HE22 GLN 76 -10.279 6.043 -2.997 638 H TYR 77 H TYR 77 -12.754 2.868 -0.907 639 HA TYR 77 HA TYR 77 -10.384 1.956 -2.430 640 HB2 TYR 77 HB2 TYR 77 -10.187 1.449 0.001 641 HB3 TYR 77 HB3 TYR 77 -11.634 0.444 -0.122 642 HD1 TYR 77 HD1 TYR 77 -8.620 0.858 -2.312 643 HD2 TYR 77 HD2 TYR 77 -10.872 -1.835 0.175 644 HE1 TYR 77 HE1 TYR 77 -7.043 -0.925 -2.863 645 HE2 TYR 77 HE2 TYR 77 -9.298 -3.659 -0.408 646 HH TYR 77 HH TYR 77 -6.491 -3.153 -2.576 647 HA PRO 78 HA PRO 78 -9.787 0.616 -4.219 648 HB2 PRO 78 HB2 PRO 78 -11.205 0.875 -6.849 649 HB3 PRO 78 HB3 PRO 78 -9.733 -0.059 -6.437 650 HG2 PRO 78 HG2 PRO 78 -12.100 -1.334 -6.714 651 HG3 PRO 78 HG3 PRO 78 -11.035 -1.746 -5.326 652 HD2 PRO 78 HD2 PRO 78 -13.411 0.151 -5.365 653 HD3 PRO 78 HD3 PRO 78 -13.056 -1.176 -4.217 654 H GLY 79 H GLY 79 -8.531 2.322 -5.210 655 HA2 GLY 79 HA2 GLY 79 -9.712 4.755 -6.256 656 HA3 GLY 79 HA3 GLY 79 -9.098 4.957 -4.613 657 H ILE 80 H ILE 80 -7.670 6.552 -5.699 658 HA ILE 80 HA ILE 80 -5.459 5.501 -7.322 659 HB ILE 80 HB ILE 80 -6.408 7.712 -7.797 660 HG12 ILE 80 HG12 ILE 80 -4.392 9.009 -8.055 661 HG13 ILE 80 HG13 ILE 80 -3.540 8.064 -6.839 662 HG21 ILE 80 HG21 ILE 80 -5.255 8.614 -5.115 663 HG22 ILE 80 HG22 ILE 80 -5.984 9.651 -6.350 664 HG23 ILE 80 HG23 ILE 80 -6.987 8.471 -5.506 665 HD11 ILE 80 HD11 ILE 80 -3.506 6.110 -8.304 666 HD12 ILE 80 HD12 ILE 80 -4.584 6.920 -9.466 667 HD13 ILE 80 HD13 ILE 80 -2.927 7.514 -9.206 668 H ALA 81 H ALA 81 -6.122 6.057 -3.934 669 HA ALA 81 HA ALA 81 -3.374 6.238 -3.132 670 HB1 ALA 81 HB1 ALA 81 -4.246 5.985 -0.867 671 HB2 ALA 81 HB2 ALA 81 -5.170 7.213 -1.780 672 HB3 ALA 81 HB3 ALA 81 -5.857 5.595 -1.518 673 H VAL 82 H VAL 82 -5.370 3.551 -3.961 674 HA VAL 82 HA VAL 82 -3.266 1.612 -3.413 675 HB VAL 82 HB VAL 82 -4.065 1.667 -1.238 676 HG11 VAL 82 HG11 VAL 82 -5.998 2.696 -1.001 677 HG12 VAL 82 HG12 VAL 82 -6.791 1.854 -2.321 678 HG13 VAL 82 HG13 VAL 82 -6.533 1.029 -0.765 679 HG21 VAL 82 HG21 VAL 82 -3.429 -0.432 -1.992 680 HG22 VAL 82 HG22 VAL 82 -4.822 -0.633 -0.913 681 HG23 VAL 82 HG23 VAL 82 -4.997 -0.797 -2.676 682 H GLU 83 H GLU 83 -3.307 0.372 -5.161 683 HA GLU 83 HA GLU 83 -5.852 -0.432 -6.496 684 HB2 GLU 83 HB2 GLU 83 -4.036 1.552 -7.434 685 HB3 GLU 83 HB3 GLU 83 -3.661 0.118 -8.377 686 HG2 GLU 83 HG2 GLU 83 -6.464 1.282 -8.058 687 HG3 GLU 83 HG3 GLU 83 -5.361 1.694 -9.366 688 H THR 84 H THR 84 -5.666 -2.314 -7.913 689 HA THR 84 HA THR 84 -3.438 -4.165 -7.097 690 HB THR 84 HB THR 84 -5.990 -5.131 -8.253 691 HG1 THR 84 HG1 THR 84 -6.653 -3.970 -6.413 692 HG21 THR 84 HG21 THR 84 -5.409 -7.131 -6.952 693 HG22 THR 84 HG22 THR 84 -4.127 -6.646 -8.076 694 HG23 THR 84 HG23 THR 84 -3.963 -6.292 -6.335 695 H VAL 85 H VAL 85 -2.229 -3.233 -8.544 696 HA VAL 85 HA VAL 85 -1.175 -3.025 -10.681 697 HB VAL 85 HB VAL 85 -0.286 -5.429 -10.992 698 HG11 VAL 85 HG11 VAL 85 1.124 -5.051 -8.955 699 HG12 VAL 85 HG12 VAL 85 0.856 -3.566 -9.855 700 HG13 VAL 85 HG13 VAL 85 -0.048 -3.879 -8.359 701 HG21 VAL 85 HG21 VAL 85 -2.152 -6.615 -9.750 702 HG22 VAL 85 HG22 VAL 85 -0.526 -6.950 -9.161 703 HG23 VAL 85 HG23 VAL 85 -1.576 -5.840 -8.272 704 H THR 86 H THR 86 -2.924 -6.049 -11.216 705 HA THR 86 HA THR 86 -4.429 -4.778 -13.341 706 HB THR 86 HB THR 86 -4.266 -6.889 -14.803 707 HG1 THR 86 HG1 THR 86 -2.380 -8.042 -14.646 708 HG21 THR 86 HG21 THR 86 -3.106 -4.618 -15.256 709 HG22 THR 86 HG22 THR 86 -1.674 -5.347 -14.514 710 HG23 THR 86 HG23 THR 86 -2.334 -6.041 -16.016 711 H ASP 87 H ASP 87 -3.790 -7.858 -11.753 712 HA ASP 87 HA ASP 87 -6.711 -8.181 -11.180 713 HB2 ASP 87 HB2 ASP 87 -6.402 -9.053 -13.435 714 HB3 ASP 87 HB3 ASP 87 -5.101 -10.086 -12.879 715 H SER 88 H SER 88 -4.093 -10.656 -11.111 716 HA SER 88 HA SER 88 -4.462 -11.581 -8.566 717 HB2 SER 88 HB2 SER 88 -2.606 -12.153 -10.210 718 HB3 SER 88 HB3 SER 88 -1.629 -10.953 -9.383 719 HG SER 88 HG SER 88 -1.621 -13.222 -8.623 720 H SER 89 H SER 89 -4.089 -11.085 -6.512 721 HA SER 89 HA SER 89 -3.217 -8.339 -5.860 722 HB2 SER 89 HB2 SER 89 -4.637 -8.565 -3.930 723 HB3 SER 89 HB3 SER 89 -5.479 -8.954 -5.449 724 HG SER 89 HG SER 89 -6.011 -10.718 -4.451 725 H ARG 90 H ARG 90 -1.432 -10.858 -6.142 726 HA ARG 90 HA ARG 90 0.047 -11.074 -3.660 727 HB2 ARG 90 HB2 ARG 90 0.269 -12.500 -5.767 728 HB3 ARG 90 HB3 ARG 90 1.112 -11.144 -6.521 729 HG2 ARG 90 HG2 ARG 90 2.832 -11.241 -4.682 730 HG3 ARG 90 HG3 ARG 90 2.007 -12.655 -4.017 731 HD2 ARG 90 HD2 ARG 90 3.275 -12.458 -6.790 732 HD3 ARG 90 HD3 ARG 90 4.025 -13.181 -5.377 733 HE ARG 90 HE ARG 90 2.563 -15.029 -5.456 734 HH11 ARG 90 HH11 ARG 90 1.311 -16.510 -6.611 735 HH12 ARG 90 HH12 ARG 90 0.634 -16.034 -8.161 736 HH21 ARG 90 HH21 ARG 90 1.888 -12.886 -8.157 737 HH22 ARG 90 HH22 ARG 90 0.716 -14.021 -8.817 738 H TYR 91 H TYR 91 -0.075 -8.653 -6.162 739 HA TYR 91 HA TYR 91 1.747 -6.858 -4.625 740 HB2 TYR 91 HB2 TYR 91 1.161 -6.794 -7.597 741 HB3 TYR 91 HB3 TYR 91 2.363 -5.834 -6.755 742 HD1 TYR 91 HD1 TYR 91 4.404 -7.028 -5.777 743 HD2 TYR 91 HD2 TYR 91 1.654 -8.885 -8.529 744 HE1 TYR 91 HE1 TYR 91 6.111 -8.767 -6.310 745 HE2 TYR 91 HE2 TYR 91 3.353 -10.581 -9.104 746 HH TYR 91 HH TYR 91 6.614 -10.596 -7.536 747 H PHE 92 H PHE 92 1.343 -4.615 -4.870 748 HA PHE 92 HA PHE 92 -1.295 -3.689 -5.837 749 HB2 PHE 92 HB2 PHE 92 -0.263 -3.068 -3.041 750 HB3 PHE 92 HB3 PHE 92 -1.668 -2.335 -3.801 751 HD1 PHE 92 HD1 PHE 92 -0.444 -5.158 -1.924 752 HD2 PHE 92 HD2 PHE 92 -3.664 -3.797 -4.449 753 HE1 PHE 92 HE1 PHE 92 -1.910 -6.958 -1.053 754 HE2 PHE 92 HE2 PHE 92 -5.099 -5.649 -3.630 755 HZ PHE 92 HZ PHE 92 -4.211 -7.249 -1.935 756 H VAL 93 H VAL 93 -1.313 -1.239 -5.761 757 HA VAL 93 HA VAL 93 1.365 0.056 -5.709 758 HB VAL 93 HB VAL 93 -0.799 0.536 -7.798 759 HG11 VAL 93 HG11 VAL 93 1.732 2.137 -7.233 760 HG12 VAL 93 HG12 VAL 93 0.733 2.286 -8.692 761 HG13 VAL 93 HG13 VAL 93 0.055 2.721 -7.129 762 HG21 VAL 93 HG21 VAL 93 0.704 -1.339 -8.329 763 HG22 VAL 93 HG22 VAL 93 1.047 0.039 -9.386 764 HG23 VAL 93 HG23 VAL 93 2.121 -0.318 -8.021 765 H ILE 94 H ILE 94 1.382 1.890 -4.431 766 HA ILE 94 HA ILE 94 -1.237 3.065 -3.691 767 HB ILE 94 HB ILE 94 -0.608 3.393 -1.389 768 HG12 ILE 94 HG12 ILE 94 1.931 1.769 -1.906 769 HG13 ILE 94 HG13 ILE 94 1.915 3.527 -1.815 770 HG21 ILE 94 HG21 ILE 94 -0.817 1.149 -0.574 771 HG22 ILE 94 HG22 ILE 94 -1.705 1.242 -2.081 772 HG23 ILE 94 HG23 ILE 94 -0.120 0.454 -2.053 773 HD11 ILE 94 HD11 ILE 94 2.564 2.607 0.343 774 HD12 ILE 94 HD12 ILE 94 0.996 3.430 0.474 775 HD13 ILE 94 HD13 ILE 94 1.063 1.669 0.425 776 H ARG 95 H ARG 95 -1.278 5.231 -3.209 777 HA ARG 95 HA ARG 95 0.955 6.883 -4.340 778 HB2 ARG 95 HB2 ARG 95 -1.260 7.154 -5.345 779 HB3 ARG 95 HB3 ARG 95 -1.953 7.590 -3.797 780 HG2 ARG 95 HG2 ARG 95 0.273 9.225 -5.078 781 HG3 ARG 95 HG3 ARG 95 -1.442 9.465 -5.432 782 HD2 ARG 95 HD2 ARG 95 -1.801 9.700 -2.892 783 HD3 ARG 95 HD3 ARG 95 -0.046 9.835 -2.777 784 HE ARG 95 HE ARG 95 -0.101 11.968 -3.606 785 HH11 ARG 95 HH11 ARG 95 -0.893 13.819 -4.217 786 HH12 ARG 95 HH12 ARG 95 -2.577 14.008 -4.663 787 HH21 ARG 95 HH21 ARG 95 -3.324 10.676 -4.151 788 HH22 ARG 95 HH22 ARG 95 -3.933 12.237 -4.628 789 H ILE 96 H ILE 96 2.407 7.113 -2.775 790 HA ILE 96 HA ILE 96 1.614 7.831 -0.003 791 HB ILE 96 HB ILE 96 4.023 7.768 0.491 792 HG12 ILE 96 HG12 ILE 96 4.466 6.539 -2.254 793 HG13 ILE 96 HG13 ILE 96 4.736 8.260 -1.930 794 HG21 ILE 96 HG21 ILE 96 2.863 5.246 -0.750 795 HG22 ILE 96 HG22 ILE 96 4.252 5.272 0.331 796 HG23 ILE 96 HG23 ILE 96 2.687 5.794 0.933 797 HD11 ILE 96 HD11 ILE 96 6.345 7.678 -0.154 798 HD12 ILE 96 HD12 ILE 96 6.169 5.957 -0.584 799 HD13 ILE 96 HD13 ILE 96 6.830 7.103 -1.766 800 H GLN 97 H GLN 97 2.601 9.703 1.028 801 HA GLN 97 HA GLN 97 3.373 11.877 -0.878 802 HB2 GLN 97 HB2 GLN 97 2.006 12.105 1.813 803 HB3 GLN 97 HB3 GLN 97 2.937 13.418 1.088 804 HG2 GLN 97 HG2 GLN 97 1.467 12.910 -1.062 805 HG3 GLN 97 HG3 GLN 97 0.357 12.189 0.110 806 HE21 GLN 97 HE21 GLN 97 1.085 16.267 0.098 807 HE22 GLN 97 HE22 GLN 97 2.278 15.146 -0.579 808 H ASP 98 H ASP 98 5.189 13.086 -0.553 809 HA ASP 98 HA ASP 98 7.278 11.725 1.023 810 HB2 ASP 98 HB2 ASP 98 7.585 12.599 -1.329 811 HB3 ASP 98 HB3 ASP 98 7.486 14.226 -0.649 812 H GLY 99 H GLY 99 4.947 13.990 1.721 813 HA2 GLY 99 HA2 GLY 99 4.504 14.997 3.771 814 HA3 GLY 99 HA3 GLY 99 6.141 14.633 4.313 815 H THR 100 H THR 100 6.369 16.248 1.374 816 HA THR 100 HA THR 100 6.813 18.900 2.689 817 HB THR 100 HB THR 100 8.454 19.334 0.930 818 HG1 THR 100 HG1 THR 100 9.009 17.681 -0.465 819 HG21 THR 100 HG21 THR 100 9.192 18.171 3.026 820 HG22 THR 100 HG22 THR 100 8.992 16.612 2.188 821 HG23 THR 100 HG23 THR 100 10.185 17.790 1.605 822 H GLY 101 H GLY 101 4.329 17.697 1.231 823 HA2 GLY 101 HA2 GLY 101 2.523 18.891 0.250 824 HA3 GLY 101 HA3 GLY 101 3.636 20.094 -0.398 825 H ARG 102 H ARG 102 4.683 16.852 -0.845 826 HA ARG 102 HA ARG 102 3.622 16.698 -3.630 827 HB2 ARG 102 HB2 ARG 102 5.751 16.257 -4.515 828 HB3 ARG 102 HB3 ARG 102 5.914 17.678 -3.465 829 HG2 ARG 102 HG2 ARG 102 6.842 16.153 -1.693 830 HG3 ARG 102 HG3 ARG 102 6.850 14.843 -2.893 831 HD2 ARG 102 HD2 ARG 102 8.300 16.166 -4.371 832 HD3 ARG 102 HD3 ARG 102 8.266 17.523 -3.227 833 HE ARG 102 HE ARG 102 9.230 15.340 -1.749 834 HH11 ARG 102 HH11 ARG 102 11.225 14.930 -1.344 835 HH12 ARG 102 HH12 ARG 102 12.551 15.558 -2.328 836 HH21 ARG 102 HH21 ARG 102 10.399 17.152 -4.527 837 HH22 ARG 102 HH22 ARG 102 12.061 16.806 -4.130 838 H SER 103 H SER 103 4.107 14.581 -4.671 839 HA SER 103 HA SER 103 3.416 12.332 -2.830 840 HB2 SER 103 HB2 SER 103 2.089 13.024 -5.480 841 HB3 SER 103 HB3 SER 103 1.722 11.625 -4.460 842 HG SER 103 HG SER 103 1.432 14.374 -3.731 843 H ALA 104 H ALA 104 3.749 10.199 -3.632 844 HA ALA 104 HA ALA 104 5.067 9.822 -6.247 845 HB1 ALA 104 HB1 ALA 104 6.850 8.413 -5.283 846 HB2 ALA 104 HB2 ALA 104 6.968 10.085 -4.702 847 HB3 ALA 104 HB3 ALA 104 6.300 8.823 -3.645 848 H PHE 105 H PHE 105 4.721 7.823 -7.183 849 HA PHE 105 HA PHE 105 2.833 5.991 -5.785 850 HB2 PHE 105 HB2 PHE 105 3.640 5.955 -8.697 851 HB3 PHE 105 HB3 PHE 105 2.353 5.040 -7.925 852 HD1 PHE 105 HD1 PHE 105 3.310 8.213 -9.432 853 HD2 PHE 105 HD2 PHE 105 0.305 6.290 -7.002 854 HE1 PHE 105 HE1 PHE 105 1.769 10.099 -9.848 855 HE2 PHE 105 HE2 PHE 105 -1.259 8.151 -7.487 856 HZ PHE 105 HZ PHE 105 -0.543 10.063 -8.892 857 H ILE 106 H ILE 106 3.459 4.098 -5.040 858 HA ILE 106 HA ILE 106 5.900 2.783 -6.145 859 HB ILE 106 HB ILE 106 6.487 1.809 -4.002 860 HG12 ILE 106 HG12 ILE 106 4.348 3.735 -2.869 861 HG13 ILE 106 HG13 ILE 106 4.234 1.980 -2.867 862 HG21 ILE 106 HG21 ILE 106 6.410 4.857 -3.750 863 HG22 ILE 106 HG22 ILE 106 7.639 3.737 -3.124 864 HG23 ILE 106 HG23 ILE 106 7.476 3.993 -4.864 865 HD11 ILE 106 HD11 ILE 106 4.747 2.957 -0.666 866 HD12 ILE 106 HD12 ILE 106 5.921 1.765 -1.205 867 HD13 ILE 106 HD13 ILE 106 6.314 3.506 -1.271 868 H GLY 107 H GLY 107 5.820 0.649 -6.442 869 HA2 GLY 107 HA2 GLY 107 3.296 -0.827 -6.178 870 HA3 GLY 107 HA3 GLY 107 4.819 -1.412 -6.852 871 H ILE 108 H ILE 108 3.180 -2.704 -4.882 872 HA ILE 108 HA ILE 108 5.225 -3.013 -2.747 873 HB ILE 108 HB ILE 108 2.232 -3.371 -2.292 874 HG12 ILE 108 HG12 ILE 108 4.096 -1.033 -1.668 875 HG13 ILE 108 HG13 ILE 108 2.578 -1.005 -2.571 876 HG21 ILE 108 HG21 ILE 108 4.599 -3.362 -0.366 877 HG22 ILE 108 HG22 ILE 108 2.894 -3.597 0.086 878 HG23 ILE 108 HG23 ILE 108 3.691 -4.808 -0.868 879 HD11 ILE 108 HD11 ILE 108 1.387 -1.627 -0.431 880 HD12 ILE 108 HD12 ILE 108 2.945 -1.358 0.418 881 HD13 ILE 108 HD13 ILE 108 2.180 -0.033 -0.446 882 H GLY 109 H GLY 109 5.654 -5.212 -2.240 883 HA2 GLY 109 HA2 GLY 109 3.897 -7.344 -3.311 884 HA3 GLY 109 HA3 GLY 109 5.614 -7.443 -3.706 885 H PHE 110 H PHE 110 3.552 -8.863 -1.844 886 HA PHE 110 HA PHE 110 4.900 -8.673 0.786 887 HB2 PHE 110 HB2 PHE 110 2.388 -10.000 -0.218 888 HB3 PHE 110 HB3 PHE 110 3.002 -10.287 1.390 889 HD1 PHE 110 HD1 PHE 110 1.849 -7.444 -0.832 890 HD2 PHE 110 HD2 PHE 110 2.594 -8.867 3.178 891 HE1 PHE 110 HE1 PHE 110 0.789 -5.406 0.102 892 HE2 PHE 110 HE2 PHE 110 1.469 -6.874 4.093 893 HZ PHE 110 HZ PHE 110 0.616 -5.103 2.552 894 H THR 111 H THR 111 5.412 -10.503 2.045 895 HA THR 111 HA THR 111 7.073 -12.447 0.707 896 HB THR 111 HB THR 111 7.481 -11.402 2.918 897 HG1 THR 111 HG1 THR 111 8.438 -13.234 3.721 898 HG21 THR 111 HG21 THR 111 5.508 -13.457 3.990 899 HG22 THR 111 HG22 THR 111 6.531 -12.362 4.936 900 HG23 THR 111 HG23 THR 111 5.231 -11.701 3.937 901 H ASP 112 H ASP 112 3.792 -12.423 1.852 902 HA ASP 112 HA ASP 112 3.321 -15.105 0.668 903 HB2 ASP 112 HB2 ASP 112 3.384 -15.041 3.285 904 HB3 ASP 112 HB3 ASP 112 1.838 -14.186 3.152 905 H ARG 113 H ARG 113 1.460 -15.222 -0.614 906 HA ARG 113 HA ARG 113 0.180 -12.715 -1.328 907 HB2 ARG 113 HB2 ARG 113 0.644 -14.679 -2.866 908 HB3 ARG 113 HB3 ARG 113 -0.721 -15.514 -2.123 909 HG2 ARG 113 HG2 ARG 113 -1.360 -12.733 -2.983 910 HG3 ARG 113 HG3 ARG 113 -0.758 -13.732 -4.297 911 HD2 ARG 113 HD2 ARG 113 -3.061 -14.575 -2.515 912 HD3 ARG 113 HD3 ARG 113 -3.247 -13.651 -4.011 913 HE ARG 113 HE ARG 113 -2.426 -16.492 -3.775 914 HH11 ARG 113 HH11 ARG 113 -2.213 -17.694 -5.737 915 HH12 ARG 113 HH12 ARG 113 -2.398 -16.776 -7.248 916 HH21 ARG 113 HH21 ARG 113 -2.819 -13.765 -6.031 917 HH22 ARG 113 HH22 ARG 113 -2.702 -14.875 -7.389 918 H GLY 114 H GLY 114 -0.566 -15.134 1.072 919 HA2 GLY 114 HA2 GLY 114 -3.305 -14.288 1.608 920 HA3 GLY 114 HA3 GLY 114 -2.223 -15.194 2.674 921 H ASP 115 H ASP 115 -0.055 -13.180 2.668 922 HA ASP 115 HA ASP 115 -1.089 -11.283 4.631 923 HB2 ASP 115 HB2 ASP 115 1.623 -11.623 3.339 924 HB3 ASP 115 HB3 ASP 115 1.234 -10.291 4.411 925 H ALA 116 H ALA 116 -0.288 -11.129 1.160 926 HA ALA 116 HA ALA 116 -0.985 -8.345 0.870 927 HB1 ALA 116 HB1 ALA 116 -1.200 -10.487 -1.269 928 HB2 ALA 116 HB2 ALA 116 -0.822 -8.756 -1.440 929 HB3 ALA 116 HB3 ALA 116 0.355 -9.840 -0.728 930 H PHE 117 H PHE 117 -2.949 -11.369 0.591 931 HA PHE 117 HA PHE 117 -5.360 -10.081 -0.185 932 HB2 PHE 117 HB2 PHE 117 -4.734 -12.569 -0.198 933 HB3 PHE 117 HB3 PHE 117 -5.179 -12.594 1.502 934 HD1 PHE 117 HD1 PHE 117 -7.535 -12.651 2.134 935 HD2 PHE 117 HD2 PHE 117 -6.388 -11.969 -1.970 936 HE1 PHE 117 HE1 PHE 117 -9.875 -13.064 1.406 937 HE2 PHE 117 HE2 PHE 117 -8.724 -12.372 -2.690 938 HZ PHE 117 HZ PHE 117 -10.471 -12.946 -1.005 939 H ASP 118 H ASP 118 -3.909 -10.450 3.031 940 HA ASP 118 HA ASP 118 -6.182 -9.411 4.526 941 HB2 ASP 118 HB2 ASP 118 -3.255 -9.874 5.081 942 HB3 ASP 118 HB3 ASP 118 -4.265 -8.996 6.228 943 H PHE 119 H PHE 119 -3.323 -7.933 2.914 944 HA PHE 119 HA PHE 119 -3.751 -5.301 3.900 945 HB2 PHE 119 HB2 PHE 119 -1.676 -5.832 2.905 946 HB3 PHE 119 HB3 PHE 119 -2.405 -6.387 1.419 947 HD1 PHE 119 HD1 PHE 119 -1.065 -3.515 3.132 948 HD2 PHE 119 HD2 PHE 119 -3.517 -4.760 -0.155 949 HE1 PHE 119 HE1 PHE 119 -0.891 -1.255 2.161 950 HE2 PHE 119 HE2 PHE 119 -3.232 -2.521 -1.217 951 HZ PHE 119 HZ PHE 119 -1.957 -0.751 -0.030 952 H ASN 120 H ASN 120 -5.210 -7.046 1.161 953 HA ASN 120 HA ASN 120 -6.900 -4.821 0.326 954 HB2 ASN 120 HB2 ASN 120 -6.562 -6.343 -1.361 955 HB3 ASN 120 HB3 ASN 120 -6.695 -7.751 -0.303 956 HD21 ASN 120 HD21 ASN 120 -10.051 -8.255 -1.089 957 HD22 ASN 120 HD22 ASN 120 -8.567 -8.884 -0.384 958 H VAL 121 H VAL 121 -7.673 -7.803 2.269 959 HA VAL 121 HA VAL 121 -10.371 -6.984 2.657 960 HB VAL 121 HB VAL 121 -8.660 -8.991 4.164 961 HG11 VAL 121 HG11 VAL 121 -11.675 -8.558 4.367 962 HG12 VAL 121 HG12 VAL 121 -10.803 -9.986 4.972 963 HG13 VAL 121 HG13 VAL 121 -10.488 -8.406 5.685 964 HG21 VAL 121 HG21 VAL 121 -9.145 -9.513 1.768 965 HG22 VAL 121 HG22 VAL 121 -9.967 -10.633 2.851 966 HG23 VAL 121 HG23 VAL 121 -10.878 -9.314 2.080 967 H SER 122 H SER 122 -7.546 -6.232 4.693 968 HA SER 122 HA SER 122 -9.067 -5.055 6.832 969 HB2 SER 122 HB2 SER 122 -6.978 -3.835 7.375 970 HB3 SER 122 HB3 SER 122 -6.767 -5.589 7.210 971 HG SER 122 HG SER 122 -5.802 -5.313 5.274 972 H LEU 123 H LEU 123 -8.424 -3.848 3.603 973 HA LEU 123 HA LEU 123 -9.452 -1.147 4.339 974 HB2 LEU 123 HB2 LEU 123 -8.403 -2.256 1.729 975 HB3 LEU 123 HB3 LEU 123 -8.942 -0.593 1.982 976 HG LEU 123 HG LEU 123 -6.628 -1.913 3.440 977 HD11 LEU 123 HD11 LEU 123 -6.309 -1.597 0.961 978 HD12 LEU 123 HD12 LEU 123 -6.493 0.151 1.239 979 HD13 LEU 123 HD13 LEU 123 -5.152 -0.756 1.984 980 HD21 LEU 123 HD21 LEU 123 -7.559 -0.072 4.762 981 HD22 LEU 123 HD22 LEU 123 -6.007 0.402 4.075 982 HD23 LEU 123 HD23 LEU 123 -7.514 0.999 3.344 983 H GLN 124 H GLN 124 -10.431 -4.069 2.491 984 HA GLN 124 HA GLN 124 -12.903 -3.048 1.489 985 HB2 GLN 124 HB2 GLN 124 -12.267 -5.852 2.491 986 HB3 GLN 124 HB3 GLN 124 -13.699 -5.422 1.579 987 HG2 GLN 124 HG2 GLN 124 -10.859 -5.117 0.532 988 HG3 GLN 124 HG3 GLN 124 -11.878 -6.505 0.232 989 HE21 GLN 124 HE21 GLN 124 -12.095 -4.285 -2.733 990 HE22 GLN 124 HE22 GLN 124 -10.810 -5.162 -1.893 991 H ASP 125 H ASP 125 -12.221 -4.680 4.634 992 HA ASP 125 HA ASP 125 -14.870 -4.202 5.694 993 HB2 ASP 125 HB2 ASP 125 -13.274 -6.071 6.308 994 HB3 ASP 125 HB3 ASP 125 -12.336 -4.868 7.206 995 H HIS 126 H HIS 126 -12.333 -2.030 5.200 996 HA HIS 126 HA HIS 126 -12.956 -0.321 7.547 997 HB2 HIS 126 HB2 HIS 126 -10.632 -0.424 6.812 998 HB3 HIS 126 HB3 HIS 126 -11.091 0.189 5.214 999 HD2 HIS 126 HD2 HIS 126 -11.450 1.333 8.933 1000 HE1 HIS 126 HE1 HIS 126 -10.801 4.805 6.557 1001 HE2 HIS 126 HE2 HIS 126 -11.058 3.943 8.918 1002 H PHE 127 H PHE 127 -13.599 -0.370 4.028 1003 HA PHE 127 HA PHE 127 -15.121 2.155 4.336 1004 HB2 PHE 127 HB2 PHE 127 -14.295 0.647 1.857 1005 HB3 PHE 127 HB3 PHE 127 -15.359 2.056 1.846 1006 HD1 PHE 127 HD1 PHE 127 -14.562 4.290 2.727 1007 HD2 PHE 127 HD2 PHE 127 -11.892 0.943 2.194 1008 HE1 PHE 127 HE1 PHE 127 -12.611 5.797 2.943 1009 HE2 PHE 127 HE2 PHE 127 -9.939 2.450 2.411 1010 HZ PHE 127 HZ PHE 127 -10.306 4.896 2.789 1011 H LYS 128 H LYS 128 -15.717 -1.187 4.132 1012 HA LYS 128 HA LYS 128 -18.290 -1.747 3.503 1013 HB2 LYS 128 HB2 LYS 128 -16.717 -3.278 4.342 1014 HB3 LYS 128 HB3 LYS 128 -16.522 -2.432 5.870 1015 HG2 LYS 128 HG2 LYS 128 -19.041 -3.893 5.051 1016 HG3 LYS 128 HG3 LYS 128 -17.641 -4.626 5.860 1017 HD2 LYS 128 HD2 LYS 128 -18.044 -2.608 7.581 1018 HD3 LYS 128 HD3 LYS 128 -19.708 -2.768 7.011 1019 HE2 LYS 128 HE2 LYS 128 -17.950 -4.981 8.150 1020 HE3 LYS 128 HE3 LYS 128 -19.143 -4.069 9.074 1021 HZ1 LYS 128 HZ1 LYS 128 -20.880 -4.957 7.597 1022 HZ2 LYS 128 HZ2 LYS 128 -19.775 -5.820 6.751 1023 HZ3 LYS 128 HZ3 LYS 128 -20.069 -6.178 8.314 1024 H TRP 129 H TRP 129 -17.455 -0.010 6.528 1025 HA TRP 129 HA TRP 129 -20.348 0.223 7.198 1026 HB2 TRP 129 HB2 TRP 129 -19.524 0.709 9.471 1027 HB3 TRP 129 HB3 TRP 129 -19.069 -0.862 8.855 1028 HD1 TRP 129 HD1 TRP 129 -16.484 -1.381 8.522 1029 HE1 TRP 129 HE1 TRP 129 -14.352 -0.183 9.088 1030 HE3 TRP 129 HE3 TRP 129 -18.459 3.142 9.818 1031 HZ2 TRP 129 HZ2 TRP 129 -13.521 2.503 9.887 1032 HZ3 TRP 129 HZ3 TRP 129 -16.955 5.064 10.367 1033 HH2 TRP 129 HH2 TRP 129 -14.498 4.762 10.359 1034 H VAL 130 H VAL 130 -18.499 2.135 5.397 1035 HA VAL 130 HA VAL 130 -19.678 4.677 6.419 1036 HB VAL 130 HB VAL 130 -17.204 5.445 5.353 1037 HG11 VAL 130 HG11 VAL 130 -18.198 5.201 8.211 1038 HG12 VAL 130 HG12 VAL 130 -16.777 6.147 7.723 1039 HG13 VAL 130 HG13 VAL 130 -18.387 6.593 7.131 1040 HG21 VAL 130 HG21 VAL 130 -16.622 3.259 7.332 1041 HG22 VAL 130 HG22 VAL 130 -16.291 3.221 5.601 1042 HG23 VAL 130 HG23 VAL 130 -15.484 4.416 6.623 1043 H LYS 131 H LYS 131 -19.005 6.467 4.704 1044 HA LYS 131 HA LYS 131 -19.325 7.410 2.713 1045 HB2 LYS 131 HB2 LYS 131 -17.227 6.061 2.513 1046 HB3 LYS 131 HB3 LYS 131 -18.134 4.823 1.640 1047 HG2 LYS 131 HG2 LYS 131 -18.501 6.241 -0.214 1048 HG3 LYS 131 HG3 LYS 131 -18.089 7.709 0.704 1049 HD2 LYS 131 HD2 LYS 131 -15.760 6.973 0.863 1050 HD3 LYS 131 HD3 LYS 131 -16.125 5.486 -0.035 1051 HE2 LYS 131 HE2 LYS 131 -16.706 8.285 -1.087 1052 HE3 LYS 131 HE3 LYS 131 -15.153 7.489 -1.360 1053 HZ1 LYS 131 HZ1 LYS 131 -16.723 7.150 -3.226 1054 HZ2 LYS 131 HZ2 LYS 131 -16.317 5.718 -2.554 1055 HZ3 LYS 131 HZ3 LYS 131 -17.780 6.362 -2.265 1056 H GLN 132 H GLN 132 -21.485 5.501 3.600 1057 HA GLN 132 HA GLN 132 -23.645 5.063 2.996 1058 HB2 GLN 132 HB2 GLN 132 -23.318 7.632 1.399 1059 HB3 GLN 132 HB3 GLN 132 -24.805 6.951 2.045 1060 HG2 GLN 132 HG2 GLN 132 -24.280 8.649 3.564 1061 HG3 GLN 132 HG3 GLN 132 -23.792 7.170 4.380 1062 HE21 GLN 132 HE21 GLN 132 -20.733 8.801 5.106 1063 HE22 GLN 132 HE22 GLN 132 -22.109 7.891 5.709 1064 H GLU 133 H GLU 133 -21.841 3.592 1.374 1065 HA GLU 133 HA GLU 133 -23.472 3.128 -1.093 1066 HB2 GLU 133 HB2 GLU 133 -20.450 3.262 -0.825 1067 HB3 GLU 133 HB3 GLU 133 -21.254 2.405 -2.142 1068 HG2 GLU 133 HG2 GLU 133 -22.400 4.464 -2.847 1069 HG3 GLU 133 HG3 GLU 133 -21.640 5.368 -1.547 1070 H1 SER 149 H1 SER 149 20.236 -14.950 -16.388 1071 H2 SER 149 H2 SER 149 20.459 -14.255 -17.859 1072 H3 SER 149 H3 SER 149 19.785 -15.745 -17.749 1073 HA SER 149 HA SER 149 18.577 -13.250 -16.783 1074 HB2 SER 149 HB2 SER 149 16.864 -13.702 -18.554 1075 HB3 SER 149 HB3 SER 149 18.472 -13.344 -19.195 1076 HG SER 149 HG SER 149 17.502 -15.167 -20.213 1077 H GLN 150 H GLN 150 16.274 -13.521 -16.170 1078 HA GLN 150 HA GLN 150 15.561 -16.167 -15.010 1079 HB2 GLN 150 HB2 GLN 150 15.676 -13.515 -13.490 1080 HB3 GLN 150 HB3 GLN 150 14.821 -14.947 -12.946 1081 HG2 GLN 150 HG2 GLN 150 16.773 -15.102 -11.756 1082 HG3 GLN 150 HG3 GLN 150 17.048 -16.217 -13.083 1083 HE21 GLN 150 HE21 GLN 150 20.228 -14.439 -12.782 1084 HE22 GLN 150 HE22 GLN 150 19.332 -15.768 -12.055 1085 H ILE 151 H ILE 151 13.326 -16.437 -14.587 1086 HA ILE 151 HA ILE 151 11.569 -14.965 -16.396 1087 HB ILE 151 HB ILE 151 11.559 -17.459 -16.048 1088 HG12 ILE 151 HG12 ILE 151 8.851 -16.119 -15.677 1089 HG13 ILE 151 HG13 ILE 151 9.760 -16.140 -17.193 1090 HG21 ILE 151 HG21 ILE 151 10.363 -18.429 -14.176 1091 HG22 ILE 151 HG22 ILE 151 11.629 -17.388 -13.522 1092 HG23 ILE 151 HG23 ILE 151 9.944 -16.825 -13.542 1093 HD11 ILE 151 HD11 ILE 151 9.689 -18.640 -17.175 1094 HD12 ILE 151 HD12 ILE 151 8.660 -18.569 -15.722 1095 HD13 ILE 151 HD13 ILE 151 8.087 -17.880 -17.247 1096 H THR 152 H THR 152 9.567 -13.966 -15.780 1097 HA THR 152 HA THR 152 9.769 -12.372 -13.290 1098 HB THR 152 HB THR 152 7.861 -11.081 -14.390 1099 HG1 THR 152 HG1 THR 152 7.307 -12.694 -15.929 1100 HG21 THR 152 HG21 THR 152 9.365 -9.866 -15.888 1101 HG22 THR 152 HG22 THR 152 10.211 -10.299 -14.391 1102 HG23 THR 152 HG23 THR 152 10.516 -11.220 -15.882 1103 H SER 153 H SER 153 8.408 -12.504 -11.620 1104 HA SER 153 HA SER 153 6.436 -14.644 -11.479 1105 HB2 SER 153 HB2 SER 153 7.224 -12.539 -9.458 1106 HB3 SER 153 HB3 SER 153 6.245 -13.990 -9.136 1107 HG SER 153 HG SER 153 8.473 -14.302 -8.594 1108 H GLN 154 H GLN 154 5.582 -13.112 -13.339 1109 HA GLN 154 HA GLN 154 4.243 -10.743 -12.997 1110 HB2 GLN 154 HB2 GLN 154 3.045 -11.267 -15.112 1111 HB3 GLN 154 HB3 GLN 154 4.795 -11.514 -15.165 1112 HG2 GLN 154 HG2 GLN 154 4.492 -13.940 -14.936 1113 HG3 GLN 154 HG3 GLN 154 2.746 -13.736 -14.769 1114 HE21 GLN 154 HE21 GLN 154 3.202 -14.721 -18.274 1115 HE22 GLN 154 HE22 GLN 154 3.266 -15.456 -16.678 1116 H VAL 155 H VAL 155 2.109 -9.996 -12.975 1117 HA VAL 155 HA VAL 155 0.430 -11.012 -10.998 1118 HB VAL 155 HB VAL 155 -0.707 -9.390 -13.301 1119 HG11 VAL 155 HG11 VAL 155 -1.189 -9.141 -10.280 1120 HG12 VAL 155 HG12 VAL 155 -2.018 -8.229 -11.512 1121 HG13 VAL 155 HG13 VAL 155 -2.250 -9.967 -11.451 1122 HG21 VAL 155 HG21 VAL 155 1.411 -8.257 -12.864 1123 HG22 VAL 155 HG22 VAL 155 0.014 -7.307 -12.330 1124 HG23 VAL 155 HG23 VAL 155 0.998 -8.183 -11.114 1125 H TPO 156 H T2P 156 -0.879 -12.805 -11.071 1126 HA TPO 156 HA T2P 156 -1.612 -14.446 -13.262 1127 HB TPO 156 HB T2P 156 -2.981 -13.948 -10.656 1128 HG21 TPO 156 HG21 T2P 156 -4.826 -14.372 -11.896 1129 HG22 TPO 156 HG22 T2P 156 -4.428 -15.814 -10.957 1130 HG23 TPO 156 HG23 T2P 156 -4.063 -15.817 -12.693 1131 H GLY 157 H GLY 157 -3.477 -14.743 -14.266 1132 HA2 GLY 157 HA2 GLY 157 -5.617 -12.890 -14.638 1133 HA3 GLY 157 HA3 GLY 157 -4.478 -12.718 -15.983 1134 H GLN 158 H GLN 158 -3.823 -15.706 -15.738 1135 HA GLN 158 HA GLN 158 -5.578 -16.785 -17.631 1136 HB2 GLN 158 HB2 GLN 158 -4.438 -18.903 -17.185 1137 HB3 GLN 158 HB3 GLN 158 -3.305 -17.560 -17.294 1138 HG2 GLN 158 HG2 GLN 158 -3.116 -17.504 -14.805 1139 HG3 GLN 158 HG3 GLN 158 -4.273 -18.832 -14.687 1140 HE21 GLN 158 HE21 GLN 158 -1.862 -21.333 -15.476 1141 HE22 GLN 158 HE22 GLN 158 -3.567 -20.990 -15.210 1142 H ILE 159 H ILE 159 -5.985 -16.805 -14.147 1143 HA ILE 159 HA ILE 159 -8.417 -18.529 -14.433 1144 HB ILE 159 HB ILE 159 -6.751 -19.506 -13.016 1145 HG12 ILE 159 HG12 ILE 159 -9.130 -18.557 -11.364 1146 HG13 ILE 159 HG13 ILE 159 -9.193 -19.823 -12.594 1147 HG21 ILE 159 HG21 ILE 159 -6.076 -18.558 -10.852 1148 HG22 ILE 159 HG22 ILE 159 -5.576 -17.538 -12.180 1149 HG23 ILE 159 HG23 ILE 159 -6.990 -17.082 -11.193 1150 HD11 ILE 159 HD11 ILE 159 -9.057 -20.868 -10.435 1151 HD12 ILE 159 HD12 ILE 159 -7.513 -21.140 -11.265 1152 HD13 ILE 159 HD13 ILE 159 -7.640 -19.917 -9.976 1153 H GLY 160 H GLY 160 -7.287 -15.475 -13.035 1154 HA2 GLY 160 HA2 GLY 160 -8.437 -13.477 -12.746 1155 HA3 GLY 160 HA3 GLY 160 -9.845 -14.193 -13.531 1156 H TRP 161 H TRP 161 -8.001 -14.303 -10.422 1157 HA TRP 161 HA TRP 161 -10.496 -14.713 -8.885 1158 HB2 TRP 161 HB2 TRP 161 -9.559 -16.530 -7.716 1159 HB3 TRP 161 HB3 TRP 161 -9.352 -16.891 -9.405 1160 HD1 TRP 161 HD1 TRP 161 -6.472 -14.874 -9.212 1161 HE1 TRP 161 HE1 TRP 161 -4.353 -16.230 -8.642 1162 HE3 TRP 161 HE3 TRP 161 -8.678 -18.740 -6.776 1163 HZ2 TRP 161 HZ2 TRP 161 -3.750 -18.794 -7.449 1164 HZ3 TRP 161 HZ3 TRP 161 -7.316 -20.634 -5.872 1165 HH2 TRP 161 HH2 TRP 161 -4.855 -20.676 -6.229 1166 H ARG 162 H ARG 162 -9.421 -14.933 -6.462 1167 HA ARG 162 HA ARG 162 -8.656 -13.823 -4.726 1168 HB2 ARG 162 HB2 ARG 162 -6.360 -13.914 -6.620 1169 HB3 ARG 162 HB3 ARG 162 -6.110 -13.106 -5.069 1170 HG2 ARG 162 HG2 ARG 162 -7.211 -15.926 -5.312 1171 HG3 ARG 162 HG3 ARG 162 -5.491 -15.549 -5.174 1172 HD2 ARG 162 HD2 ARG 162 -5.901 -14.363 -3.031 1173 HD3 ARG 162 HD3 ARG 162 -7.624 -14.770 -3.138 1174 HE ARG 162 HE ARG 162 -6.045 -17.156 -3.310 1175 HH11 ARG 162 HH11 ARG 162 -5.932 -18.566 -1.591 1176 HH12 ARG 162 HH12 ARG 162 -6.377 -18.035 0.003 1177 HH21 ARG 162 HH21 ARG 162 -7.174 -14.831 -0.927 1178 HH22 ARG 162 HH22 ARG 162 -7.064 -15.983 0.372 1179 H ARG 163 H ARG 163 -10.372 -12.275 -6.024 1180 HA ARG 163 HA ARG 163 -11.356 -10.231 -6.057 1181 HB2 ARG 163 HB2 ARG 163 -9.710 -9.869 -3.533 1182 HB3 ARG 163 HB3 ARG 163 -11.068 -8.854 -4.034 1183 HG2 ARG 163 HG2 ARG 163 -12.550 -10.896 -4.025 1184 HG3 ARG 163 HG3 ARG 163 -11.188 -11.834 -3.401 1185 HD2 ARG 163 HD2 ARG 163 -12.567 -11.271 -1.554 1186 HD3 ARG 163 HD3 ARG 163 -11.093 -10.301 -1.413 1187 HE ARG 163 HE ARG 163 -12.925 -8.697 -2.800 1188 HH11 ARG 163 HH11 ARG 163 -14.355 -7.254 -1.925 1189 HH12 ARG 163 HH12 ARG 163 -14.861 -7.421 -0.273 1190 HH21 ARG 163 HH21 ARG 163 -12.965 -10.204 0.362 1191 HH22 ARG 163 HH22 ARG 163 -14.093 -9.041 0.997 Start of MODEL 24 1 H1 GLY -4 H1 GLY -4 -15.219 14.750 34.273 2 H2 GLY -4 H2 GLY -4 -16.109 14.611 32.904 3 H3 GLY -4 H3 GLY -4 -15.120 15.901 33.115 4 HA2 GLY -4 HA2 GLY -4 -14.244 13.101 32.813 5 HA3 GLY -4 HA3 GLY -4 -14.133 14.352 31.561 6 H SER -3 H SER -3 -11.836 13.409 31.815 7 HA SER -3 HA SER -3 -10.236 15.175 33.616 8 HB2 SER -3 HB2 SER -3 -9.719 12.228 33.050 9 HB3 SER -3 HB3 SER -3 -8.611 13.318 33.895 10 HG SER -3 HG SER -3 -11.227 12.531 34.714 11 HA PRO -2 HA PRO -2 -8.062 16.114 29.848 12 HB2 PRO -2 HB2 PRO -2 -5.635 17.000 30.740 13 HB3 PRO -2 HB3 PRO -2 -7.159 17.906 30.995 14 HG2 PRO -2 HG2 PRO -2 -5.776 16.013 32.930 15 HG3 PRO -2 HG3 PRO -2 -6.374 17.675 33.248 16 HD2 PRO -2 HD2 PRO -2 -7.849 15.484 33.881 17 HD3 PRO -2 HD3 PRO -2 -8.627 16.964 33.247 18 H ASN -1 H ASN -1 -6.507 15.341 28.394 19 HA ASN -1 HA ASN -1 -4.618 13.219 29.140 20 HB2 ASN -1 HB2 ASN -1 -6.685 11.939 28.778 21 HB3 ASN -1 HB3 ASN -1 -6.968 12.758 27.244 22 HD21 ASN -1 HD21 ASN -1 -4.263 9.702 27.401 23 HD22 ASN -1 HD22 ASN -1 -4.942 10.341 28.892 24 H SER 0 H SER 0 -2.876 13.102 27.751 25 HA SER 0 HA SER 0 -2.222 15.396 26.280 26 HB2 SER 0 HB2 SER 0 -0.902 12.662 26.139 27 HB3 SER 0 HB3 SER 0 -0.164 14.219 25.718 28 HG SER 0 HG SER 0 0.391 13.551 27.846 29 H MET 1 H MET 1 -3.893 12.583 25.062 30 HA MET 1 HA MET 1 -3.361 13.355 22.233 31 HB2 MET 1 HB2 MET 1 -4.617 10.825 23.370 32 HB3 MET 1 HB3 MET 1 -4.320 11.179 21.671 33 HG2 MET 1 HG2 MET 1 -2.551 9.813 22.227 34 HG3 MET 1 HG3 MET 1 -1.848 11.426 22.261 35 HE1 MET 1 HE1 MET 1 0.261 9.514 24.938 36 HE2 MET 1 HE2 MET 1 -0.371 8.890 23.399 37 HE3 MET 1 HE3 MET 1 0.292 10.538 23.487 38 H ALA 2 H ALA 2 -5.654 14.047 24.595 39 HA ALA 2 HA ALA 2 -8.021 13.953 22.845 40 HB1 ALA 2 HB1 ALA 2 -7.657 14.899 25.713 41 HB2 ALA 2 HB2 ALA 2 -9.202 14.635 24.882 42 HB3 ALA 2 HB3 ALA 2 -8.136 13.256 25.207 43 H THR 3 H THR 3 -5.531 16.184 23.177 44 HA THR 3 HA THR 3 -7.033 18.642 23.373 45 HB THR 3 HB THR 3 -4.844 19.715 22.977 46 HG1 THR 3 HG1 THR 3 -3.041 18.378 22.697 47 HG21 THR 3 HG21 THR 3 -4.599 17.360 24.898 48 HG22 THR 3 HG22 THR 3 -3.697 18.890 24.954 49 HG23 THR 3 HG23 THR 3 -5.444 18.883 25.257 50 H GLU 4 H GLU 4 -6.400 16.651 20.739 51 HA GLU 4 HA GLU 4 -7.617 18.564 18.862 52 HB2 GLU 4 HB2 GLU 4 -5.156 18.926 18.635 53 HB3 GLU 4 HB3 GLU 4 -4.937 17.213 18.297 54 HG2 GLU 4 HG2 GLU 4 -4.817 18.548 16.261 55 HG3 GLU 4 HG3 GLU 4 -6.154 17.432 16.172 56 H LEU 5 H LEU 5 -8.488 17.532 16.969 57 HA LEU 5 HA LEU 5 -9.272 14.704 17.326 58 HB2 LEU 5 HB2 LEU 5 -10.028 16.732 15.192 59 HB3 LEU 5 HB3 LEU 5 -10.746 15.136 15.400 60 HG LEU 5 HG LEU 5 -10.956 17.445 17.382 61 HD11 LEU 5 HD11 LEU 5 -13.027 16.149 15.561 62 HD12 LEU 5 HD12 LEU 5 -13.317 17.464 16.724 63 HD13 LEU 5 HD13 LEU 5 -12.276 17.742 15.319 64 HD21 LEU 5 HD21 LEU 5 -12.636 16.007 18.527 65 HD22 LEU 5 HD22 LEU 5 -12.198 14.657 17.456 66 HD23 LEU 5 HD23 LEU 5 -11.013 15.320 18.608 67 H GLU 6 H GLU 6 -6.432 15.554 16.606 68 HA GLU 6 HA GLU 6 -6.071 14.310 13.969 69 HB2 GLU 6 HB2 GLU 6 -4.282 15.990 15.699 70 HB3 GLU 6 HB3 GLU 6 -3.625 15.024 14.384 71 HG2 GLU 6 HG2 GLU 6 -5.899 16.988 13.908 72 HG3 GLU 6 HG3 GLU 6 -4.205 17.466 13.869 73 H TYR 7 H TYR 7 -6.146 12.093 14.153 74 HA TYR 7 HA TYR 7 -4.099 10.707 15.704 75 HB2 TYR 7 HB2 TYR 7 -5.562 9.383 17.022 76 HB3 TYR 7 HB3 TYR 7 -6.083 11.032 17.279 77 HD1 TYR 7 HD1 TYR 7 -7.100 7.711 16.310 78 HD2 TYR 7 HD2 TYR 7 -8.133 11.880 15.932 79 HE1 TYR 7 HE1 TYR 7 -9.397 7.076 15.606 80 HE2 TYR 7 HE2 TYR 7 -10.415 11.248 15.177 81 HH TYR 7 HH TYR 7 -11.468 7.817 14.976 82 H GLU 8 H GLU 8 -4.623 8.214 15.485 83 HA GLU 8 HA GLU 8 -6.250 7.361 13.319 84 HB2 GLU 8 HB2 GLU 8 -4.542 6.213 11.974 85 HB3 GLU 8 HB3 GLU 8 -4.535 7.943 11.772 86 HG2 GLU 8 HG2 GLU 8 -2.589 6.604 13.671 87 HG3 GLU 8 HG3 GLU 8 -2.286 6.664 11.950 88 H SER 9 H SER 9 -6.950 5.401 13.814 89 HA SER 9 HA SER 9 -5.738 3.936 16.086 90 HB2 SER 9 HB2 SER 9 -8.275 4.473 15.861 91 HB3 SER 9 HB3 SER 9 -8.285 3.100 14.715 92 HG SER 9 HG SER 9 -8.708 2.476 16.913 93 H VAL 10 H VAL 10 -5.153 1.660 15.949 94 HA VAL 10 HA VAL 10 -4.173 0.959 13.278 95 HB VAL 10 HB VAL 10 -2.735 0.590 15.174 96 HG11 VAL 10 HG11 VAL 10 -4.382 -0.154 16.880 97 HG12 VAL 10 HG12 VAL 10 -4.581 -1.687 16.002 98 HG13 VAL 10 HG13 VAL 10 -3.014 -1.264 16.716 99 HG21 VAL 10 HG21 VAL 10 -2.455 -0.708 13.077 100 HG22 VAL 10 HG22 VAL 10 -1.881 -1.574 14.512 101 HG23 VAL 10 HG23 VAL 10 -3.429 -2.022 13.776 102 H LEU 11 H LEU 11 -4.940 -0.353 11.818 103 HA LEU 11 HA LEU 11 -7.400 -1.949 12.403 104 HB2 LEU 11 HB2 LEU 11 -6.295 -1.008 9.727 105 HB3 LEU 11 HB3 LEU 11 -7.757 -1.943 9.992 106 HG LEU 11 HG LEU 11 -7.275 0.964 10.750 107 HD11 LEU 11 HD11 LEU 11 -9.125 -0.486 8.804 108 HD12 LEU 11 HD12 LEU 11 -9.176 1.245 9.132 109 HD13 LEU 11 HD13 LEU 11 -7.736 0.539 8.388 110 HD21 LEU 11 HD21 LEU 11 -9.687 -0.805 11.350 111 HD22 LEU 11 HD22 LEU 11 -8.643 0.025 12.534 112 HD23 LEU 11 HD23 LEU 11 -9.678 0.968 11.463 113 H CYS 12 H CYS 12 -4.266 -2.032 10.643 114 HA CYS 12 HA CYS 12 -4.056 -4.932 11.116 115 HB2 CYS 12 HB2 CYS 12 -5.233 -4.618 8.945 116 HB3 CYS 12 HB3 CYS 12 -3.801 -3.788 8.321 117 HG CYS 12 HG CYS 12 -4.166 -6.894 9.438 118 H VAL 13 H VAL 13 -2.046 -5.813 10.940 119 HA VAL 13 HA VAL 13 0.288 -4.107 10.470 120 HB VAL 13 HB VAL 13 -0.000 -3.959 12.871 121 HG11 VAL 13 HG11 VAL 13 -1.241 -6.046 13.343 122 HG12 VAL 13 HG12 VAL 13 0.243 -6.984 13.057 123 HG13 VAL 13 HG13 VAL 13 0.160 -5.828 14.397 124 HG21 VAL 13 HG21 VAL 13 2.305 -4.048 11.978 125 HG22 VAL 13 HG22 VAL 13 2.200 -4.742 13.605 126 HG23 VAL 13 HG23 VAL 13 2.327 -5.811 12.199 127 H LYS 14 H LYS 14 1.735 -5.153 9.256 128 HA LYS 14 HA LYS 14 1.754 -8.115 9.350 129 HB2 LYS 14 HB2 LYS 14 1.790 -6.530 6.771 130 HB3 LYS 14 HB3 LYS 14 2.462 -8.138 6.860 131 HG2 LYS 14 HG2 LYS 14 -0.408 -7.457 7.616 132 HG3 LYS 14 HG3 LYS 14 0.122 -8.049 6.040 133 HD2 LYS 14 HD2 LYS 14 1.017 -10.121 7.113 134 HD3 LYS 14 HD3 LYS 14 0.371 -9.581 8.682 135 HE2 LYS 14 HE2 LYS 14 -1.878 -9.510 7.809 136 HE3 LYS 14 HE3 LYS 14 -1.289 -9.876 6.176 137 HZ1 LYS 14 HZ1 LYS 14 -2.193 -11.838 7.197 138 HZ2 LYS 14 HZ2 LYS 14 -0.569 -12.048 6.979 139 HZ3 LYS 14 HZ3 LYS 14 -1.169 -11.737 8.482 140 HA PRO 15 HA PRO 15 5.771 -7.740 10.646 141 HB2 PRO 15 HB2 PRO 15 6.750 -10.280 10.285 142 HB3 PRO 15 HB3 PRO 15 5.429 -9.891 11.425 143 HG2 PRO 15 HG2 PRO 15 5.151 -10.924 8.565 144 HG3 PRO 15 HG3 PRO 15 4.376 -11.569 10.051 145 HD2 PRO 15 HD2 PRO 15 3.080 -9.881 8.435 146 HD3 PRO 15 HD3 PRO 15 2.936 -9.738 10.214 147 H ASP 16 H ASP 16 5.459 -8.777 7.283 148 HA ASP 16 HA ASP 16 8.061 -7.534 6.611 149 HB2 ASP 16 HB2 ASP 16 8.502 -9.941 6.969 150 HB3 ASP 16 HB3 ASP 16 7.258 -10.348 5.785 151 H VAL 17 H VAL 17 7.952 -6.345 4.791 152 HA VAL 17 HA VAL 17 6.051 -6.921 2.639 153 HB VAL 17 HB VAL 17 4.645 -5.600 4.121 154 HG11 VAL 17 HG11 VAL 17 6.284 -4.330 5.401 155 HG12 VAL 17 HG12 VAL 17 6.714 -3.382 3.964 156 HG13 VAL 17 HG13 VAL 17 5.093 -3.254 4.662 157 HG21 VAL 17 HG21 VAL 17 4.434 -5.309 1.670 158 HG22 VAL 17 HG22 VAL 17 3.934 -3.886 2.593 159 HG23 VAL 17 HG23 VAL 17 5.502 -3.886 1.767 160 H SER 18 H SER 18 6.845 -6.282 0.688 161 HA SER 18 HA SER 18 9.400 -4.734 0.672 162 HB2 SER 18 HB2 SER 18 8.505 -6.875 -1.276 163 HB3 SER 18 HB3 SER 18 10.058 -6.021 -1.242 164 HG SER 18 HG SER 18 10.084 -8.131 -0.241 165 H VAL 19 H VAL 19 9.720 -3.123 -0.760 166 HA VAL 19 HA VAL 19 7.338 -2.149 -2.283 167 HB VAL 19 HB VAL 19 9.328 -0.608 -0.634 168 HG11 VAL 19 HG11 VAL 19 7.237 0.428 -2.579 169 HG12 VAL 19 HG12 VAL 19 8.067 1.423 -1.374 170 HG13 VAL 19 HG13 VAL 19 8.996 0.697 -2.669 171 HG21 VAL 19 HG21 VAL 19 7.378 -1.662 0.544 172 HG22 VAL 19 HG22 VAL 19 7.280 0.095 0.539 173 HG23 VAL 19 HG23 VAL 19 6.281 -0.843 -0.582 174 H TYR 20 H TYR 20 7.511 -1.415 -4.187 175 HA TYR 20 HA TYR 20 10.072 -1.547 -5.718 176 HB2 TYR 20 HB2 TYR 20 7.376 -2.713 -6.541 177 HB3 TYR 20 HB3 TYR 20 8.894 -2.812 -7.411 178 HD1 TYR 20 HD1 TYR 20 10.425 -4.637 -6.953 179 HD2 TYR 20 HD2 TYR 20 7.041 -3.950 -4.376 180 HE1 TYR 20 HE1 TYR 20 10.776 -6.861 -5.872 181 HE2 TYR 20 HE2 TYR 20 7.461 -6.138 -3.253 182 HH TYR 20 HH TYR 20 10.081 -8.338 -4.262 183 H ARG 21 H ARG 21 9.906 0.858 -5.446 184 HA ARG 21 HA ARG 21 7.775 2.431 -6.403 185 HB2 ARG 21 HB2 ARG 21 9.364 4.278 -6.621 186 HB3 ARG 21 HB3 ARG 21 9.516 3.415 -5.091 187 HG2 ARG 21 HG2 ARG 21 11.522 2.244 -5.903 188 HG3 ARG 21 HG3 ARG 21 11.395 3.064 -7.472 189 HD2 ARG 21 HD2 ARG 21 11.793 5.232 -6.455 190 HD3 ARG 21 HD3 ARG 21 11.618 4.559 -4.833 191 HE ARG 21 HE ARG 21 13.715 3.575 -4.908 192 HH11 ARG 21 HH11 ARG 21 15.667 3.066 -5.708 193 HH12 ARG 21 HH12 ARG 21 16.267 3.859 -7.151 194 HH21 ARG 21 HH21 ARG 21 13.244 5.321 -7.922 195 HH22 ARG 21 HH22 ARG 21 14.889 5.047 -8.426 196 H ILE 22 H ILE 22 7.151 3.349 -8.284 197 HA ILE 22 HA ILE 22 8.041 1.812 -10.675 198 HB ILE 22 HB ILE 22 5.749 1.730 -11.405 199 HG12 ILE 22 HG12 ILE 22 5.171 3.437 -8.964 200 HG13 ILE 22 HG13 ILE 22 4.725 3.711 -10.650 201 HG21 ILE 22 HG21 ILE 22 5.889 0.837 -8.538 202 HG22 ILE 22 HG22 ILE 22 4.979 0.107 -9.852 203 HG23 ILE 22 HG23 ILE 22 6.746 0.013 -9.860 204 HD11 ILE 22 HD11 ILE 22 3.527 1.699 -8.720 205 HD12 ILE 22 HD12 ILE 22 2.758 3.119 -9.453 206 HD13 ILE 22 HD13 ILE 22 3.174 1.718 -10.468 207 HA PRO 23 HA PRO 23 8.340 5.666 -12.892 208 HB2 PRO 23 HB2 PRO 23 8.476 4.665 -15.500 209 HB3 PRO 23 HB3 PRO 23 9.823 4.926 -14.360 210 HG2 PRO 23 HG2 PRO 23 8.471 2.368 -15.097 211 HG3 PRO 23 HG3 PRO 23 10.140 2.648 -14.550 212 HD2 PRO 23 HD2 PRO 23 8.059 1.653 -12.960 213 HD3 PRO 23 HD3 PRO 23 9.559 2.398 -12.345 214 HA PRO 24 HA PRO 24 4.428 5.604 -15.558 215 HB2 PRO 24 HB2 PRO 24 2.618 3.571 -15.603 216 HB3 PRO 24 HB3 PRO 24 4.124 3.544 -16.574 217 HG2 PRO 24 HG2 PRO 24 3.656 2.282 -13.843 218 HG3 PRO 24 HG3 PRO 24 4.313 1.502 -15.320 219 HD2 PRO 24 HD2 PRO 24 5.948 2.493 -13.415 220 HD3 PRO 24 HD3 PRO 24 6.351 2.679 -15.146 221 H ARG 25 H ARG 25 2.403 6.454 -15.188 222 HA ARG 25 HA ARG 25 1.237 6.331 -12.425 223 HB2 ARG 25 HB2 ARG 25 0.152 8.424 -12.888 224 HB3 ARG 25 HB3 ARG 25 1.889 8.588 -13.138 225 HG2 ARG 25 HG2 ARG 25 1.615 8.538 -15.563 226 HG3 ARG 25 HG3 ARG 25 -0.109 8.140 -15.414 227 HD2 ARG 25 HD2 ARG 25 -0.572 10.270 -14.349 228 HD3 ARG 25 HD3 ARG 25 1.155 10.702 -14.382 229 HE ARG 25 HE ARG 25 0.327 10.095 -17.039 230 HH11 ARG 25 HH11 ARG 25 -0.092 11.669 -18.551 231 HH12 ARG 25 HH12 ARG 25 -0.474 13.286 -18.039 232 HH21 ARG 25 HH21 ARG 25 -0.234 12.625 -14.682 233 HH22 ARG 25 HH22 ARG 25 -0.555 13.822 -15.909 234 H ALA 26 H ALA 26 0.540 5.518 -15.700 235 HA ALA 26 HA ALA 26 -1.865 4.053 -14.969 236 HB1 ALA 26 HB1 ALA 26 -3.388 5.448 -16.341 237 HB2 ALA 26 HB2 ALA 26 -2.717 6.387 -14.986 238 HB3 ALA 26 HB3 ALA 26 -2.070 6.626 -16.614 239 H SER 27 H SER 27 -1.200 2.303 -15.882 240 HA SER 27 HA SER 27 -0.387 2.263 -18.740 241 HB2 SER 27 HB2 SER 27 0.918 0.930 -17.025 242 HB3 SER 27 HB3 SER 27 -0.518 -0.099 -16.845 243 HG SER 27 HG SER 27 1.013 0.420 -19.201 244 H ASN 28 H ASN 28 -1.389 0.736 -20.093 245 HA ASN 28 HA ASN 28 -4.072 1.139 -20.554 246 HB2 ASN 28 HB2 ASN 28 -3.796 -0.329 -22.392 247 HB3 ASN 28 HB3 ASN 28 -2.228 0.420 -22.149 248 HD21 ASN 28 HD21 ASN 28 -0.840 -2.789 -20.922 249 HD22 ASN 28 HD22 ASN 28 -0.828 -1.134 -20.354 250 H ARG 29 H ARG 29 -2.846 -1.367 -18.443 251 HA ARG 29 HA ARG 29 -5.626 -2.470 -18.091 252 HB2 ARG 29 HB2 ARG 29 -3.086 -3.885 -17.274 253 HB3 ARG 29 HB3 ARG 29 -4.702 -4.558 -17.428 254 HG2 ARG 29 HG2 ARG 29 -2.776 -3.756 -19.609 255 HG3 ARG 29 HG3 ARG 29 -3.310 -5.380 -19.200 256 HD2 ARG 29 HD2 ARG 29 -4.901 -3.195 -20.579 257 HD3 ARG 29 HD3 ARG 29 -4.370 -4.715 -21.251 258 HE ARG 29 HE ARG 29 -5.936 -5.895 -19.754 259 HH11 ARG 29 HH11 ARG 29 -8.097 -6.100 -19.375 260 HH12 ARG 29 HH12 ARG 29 -9.137 -4.710 -19.452 261 HH21 ARG 29 HH21 ARG 29 -6.660 -2.458 -20.200 262 HH22 ARG 29 HH22 ARG 29 -8.360 -2.731 -19.941 263 H GLY 30 H GLY 30 -3.671 -0.337 -16.695 264 HA2 GLY 30 HA2 GLY 30 -4.498 0.490 -14.423 265 HA3 GLY 30 HA3 GLY 30 -4.174 -1.161 -13.854 266 H TYR 31 H TYR 31 -2.074 -1.779 -13.430 267 HA TYR 31 HA TYR 31 0.171 0.076 -14.188 268 HB2 TYR 31 HB2 TYR 31 -0.351 -1.182 -11.480 269 HB3 TYR 31 HB3 TYR 31 1.206 -0.537 -11.971 270 HD1 TYR 31 HD1 TYR 31 1.602 1.830 -12.364 271 HD2 TYR 31 HD2 TYR 31 -2.198 0.316 -10.961 272 HE1 TYR 31 HE1 TYR 31 1.013 4.091 -11.486 273 HE2 TYR 31 HE2 TYR 31 -2.795 2.590 -10.108 274 HH TYR 31 HH TYR 31 -0.574 5.374 -10.394 275 H ARG 32 H ARG 32 -0.846 -3.228 -13.506 276 HA ARG 32 HA ARG 32 0.114 -5.191 -13.338 277 HB2 ARG 32 HB2 ARG 32 1.668 -5.178 -15.773 278 HB3 ARG 32 HB3 ARG 32 0.246 -6.065 -15.272 279 HG2 ARG 32 HG2 ARG 32 -0.672 -5.083 -17.069 280 HG3 ARG 32 HG3 ARG 32 -1.024 -3.794 -15.943 281 HD2 ARG 32 HD2 ARG 32 -0.135 -2.717 -17.826 282 HD3 ARG 32 HD3 ARG 32 1.229 -2.749 -16.690 283 HE ARG 32 HE ARG 32 1.356 -5.103 -18.281 284 HH11 ARG 32 HH11 ARG 32 2.925 -5.315 -19.857 285 HH12 ARG 32 HH12 ARG 32 3.598 -3.888 -20.588 286 HH21 ARG 32 HH21 ARG 32 1.646 -1.665 -18.870 287 HH22 ARG 32 HH22 ARG 32 2.962 -1.892 -19.999 288 H ALA 33 H ALA 33 1.457 -5.828 -11.810 289 HA ALA 33 HA ALA 33 3.942 -4.797 -11.111 290 HB1 ALA 33 HB1 ALA 33 2.553 -6.496 -9.830 291 HB2 ALA 33 HB2 ALA 33 3.158 -7.747 -10.929 292 HB3 ALA 33 HB3 ALA 33 4.278 -6.857 -9.884 293 H SER 34 H SER 34 3.227 -7.128 -13.633 294 HA SER 34 HA SER 34 5.841 -8.029 -14.298 295 HB2 SER 34 HB2 SER 34 3.504 -8.954 -14.876 296 HB3 SER 34 HB3 SER 34 3.460 -7.754 -16.172 297 HG SER 34 HG SER 34 5.491 -8.696 -16.914 298 H ASP 35 H ASP 35 4.436 -4.894 -14.942 299 HA ASP 35 HA ASP 35 6.120 -4.343 -17.299 300 HB2 ASP 35 HB2 ASP 35 3.775 -3.474 -16.979 301 HB3 ASP 35 HB3 ASP 35 4.375 -2.474 -15.662 302 H TRP 36 H TRP 36 6.503 -4.199 -13.868 303 HA TRP 36 HA TRP 36 8.951 -2.537 -14.125 304 HB2 TRP 36 HB2 TRP 36 8.183 -1.837 -11.638 305 HB3 TRP 36 HB3 TRP 36 7.884 -0.920 -13.087 306 HD1 TRP 36 HD1 TRP 36 5.412 -0.727 -13.995 307 HE1 TRP 36 HE1 TRP 36 3.132 -1.189 -12.991 308 HE3 TRP 36 HE3 TRP 36 6.888 -3.218 -9.758 309 HZ2 TRP 36 HZ2 TRP 36 2.111 -1.984 -10.389 310 HZ3 TRP 36 HZ3 TRP 36 5.230 -3.726 -7.984 311 HH2 TRP 36 HH2 TRP 36 2.845 -3.104 -8.274 312 H LYS 37 H LYS 37 9.993 -2.847 -11.622 313 HA LYS 37 HA LYS 37 10.879 -5.627 -11.518 314 HB2 LYS 37 HB2 LYS 37 11.264 -3.171 -9.751 315 HB3 LYS 37 HB3 LYS 37 11.837 -4.768 -9.265 316 HG2 LYS 37 HG2 LYS 37 13.237 -4.981 -11.221 317 HG3 LYS 37 HG3 LYS 37 12.616 -3.476 -11.916 318 HD2 LYS 37 HD2 LYS 37 13.683 -2.127 -10.273 319 HD3 LYS 37 HD3 LYS 37 14.006 -3.507 -9.210 320 HE2 LYS 37 HE2 LYS 37 15.562 -4.473 -10.819 321 HE3 LYS 37 HE3 LYS 37 15.217 -3.184 -11.984 322 HZ1 LYS 37 HZ1 LYS 37 16.471 -2.774 -9.316 323 HZ2 LYS 37 HZ2 LYS 37 17.263 -2.749 -10.742 324 HZ3 LYS 37 HZ3 LYS 37 16.165 -1.591 -10.405 325 H LEU 38 H LEU 38 9.488 -7.197 -10.923 326 HA LEU 38 HA LEU 38 7.837 -6.751 -8.485 327 HB2 LEU 38 HB2 LEU 38 6.424 -8.540 -9.108 328 HB3 LEU 38 HB3 LEU 38 6.571 -7.350 -10.376 329 HG LEU 38 HG LEU 38 8.157 -8.940 -11.581 330 HD11 LEU 38 HD11 LEU 38 7.925 -11.362 -11.065 331 HD12 LEU 38 HD12 LEU 38 8.726 -10.529 -9.740 332 HD13 LEU 38 HD13 LEU 38 7.026 -10.968 -9.586 333 HD21 LEU 38 HD21 LEU 38 5.718 -8.610 -12.084 334 HD22 LEU 38 HD22 LEU 38 6.322 -10.200 -12.512 335 HD23 LEU 38 HD23 LEU 38 5.329 -9.966 -11.028 336 H ASP 39 H ASP 39 10.782 -8.115 -9.300 337 HA ASP 39 HA ASP 39 10.798 -9.987 -6.981 338 HB2 ASP 39 HB2 ASP 39 12.266 -11.377 -8.238 339 HB3 ASP 39 HB3 ASP 39 10.885 -11.028 -9.263 340 H GLN 40 H GLN 40 12.062 -7.070 -8.044 341 HA GLN 40 HA GLN 40 14.586 -7.270 -6.440 342 HB2 GLN 40 HB2 GLN 40 13.996 -5.971 -9.099 343 HB3 GLN 40 HB3 GLN 40 15.423 -5.566 -8.138 344 HG2 GLN 40 HG2 GLN 40 16.376 -7.711 -8.390 345 HG3 GLN 40 HG3 GLN 40 14.854 -8.453 -8.875 346 HE21 GLN 40 HE21 GLN 40 15.119 -7.537 -12.303 347 HE22 GLN 40 HE22 GLN 40 14.047 -8.151 -11.034 348 HA PRO 41 HA PRO 41 11.861 -3.960 -4.694 349 HB2 PRO 41 HB2 PRO 41 12.333 -4.321 -2.034 350 HB3 PRO 41 HB3 PRO 41 11.208 -5.336 -2.984 351 HG2 PRO 41 HG2 PRO 41 14.095 -5.930 -2.263 352 HG3 PRO 41 HG3 PRO 41 12.671 -7.006 -2.092 353 HD2 PRO 41 HD2 PRO 41 14.366 -7.148 -4.231 354 HD3 PRO 41 HD3 PRO 41 12.612 -7.446 -4.405 355 H ASP 42 H ASP 42 12.286 -1.974 -3.736 356 HA ASP 42 HA ASP 42 15.142 -1.078 -3.764 357 HB2 ASP 42 HB2 ASP 42 13.495 0.032 -5.266 358 HB3 ASP 42 HB3 ASP 42 12.543 0.497 -3.855 359 H TRP 43 H TRP 43 12.382 -1.563 -1.691 360 HA TRP 43 HA TRP 43 14.000 -1.082 0.708 361 HB2 TRP 43 HB2 TRP 43 12.975 1.110 0.324 362 HB3 TRP 43 HB3 TRP 43 11.398 0.378 0.091 363 HD1 TRP 43 HD1 TRP 43 13.719 1.639 2.753 364 HE1 TRP 43 HE1 TRP 43 12.555 1.604 5.042 365 HE3 TRP 43 HE3 TRP 43 9.552 -1.063 1.513 366 HZ2 TRP 43 HZ2 TRP 43 10.069 0.653 6.144 367 HZ3 TRP 43 HZ3 TRP 43 7.794 -1.521 3.201 368 HH2 TRP 43 HH2 TRP 43 8.033 -0.653 5.520 369 H THR 44 H THR 44 13.280 -2.392 2.478 370 HA THR 44 HA THR 44 10.588 -3.519 2.367 371 HB THR 44 HB THR 44 11.090 -5.702 2.759 372 HG1 THR 44 HG1 THR 44 13.839 -5.147 3.098 373 HG21 THR 44 HG21 THR 44 13.354 -5.090 0.839 374 HG22 THR 44 HG22 THR 44 12.503 -6.638 1.073 375 HG23 THR 44 HG23 THR 44 11.641 -5.251 0.402 376 H GLY 45 H GLY 45 9.739 -4.154 4.312 377 HA2 GLY 45 HA2 GLY 45 11.032 -3.600 6.849 378 HA3 GLY 45 HA3 GLY 45 10.085 -2.239 6.287 379 H ARG 46 H ARG 46 8.482 -2.248 7.582 380 HA ARG 46 HA ARG 46 6.758 -4.653 8.066 381 HB2 ARG 46 HB2 ARG 46 8.184 -4.021 10.006 382 HB3 ARG 46 HB3 ARG 46 7.479 -2.405 10.005 383 HG2 ARG 46 HG2 ARG 46 5.239 -3.391 10.530 384 HG3 ARG 46 HG3 ARG 46 5.961 -5.006 10.441 385 HD2 ARG 46 HD2 ARG 46 5.811 -4.513 12.731 386 HD3 ARG 46 HD3 ARG 46 7.520 -4.347 12.304 387 HE ARG 46 HE ARG 46 6.016 -1.807 12.213 388 HH11 ARG 46 HH11 ARG 46 6.214 -0.340 13.679 389 HH12 ARG 46 HH12 ARG 46 7.050 -0.624 15.210 390 HH21 ARG 46 HH21 ARG 46 7.775 -3.909 14.422 391 HH22 ARG 46 HH22 ARG 46 7.948 -2.633 15.595 392 H LEU 47 H LEU 47 4.533 -4.314 8.135 393 HA LEU 47 HA LEU 47 3.550 -1.777 6.877 394 HB2 LEU 47 HB2 LEU 47 3.065 -3.955 5.726 395 HB3 LEU 47 HB3 LEU 47 2.311 -4.509 7.212 396 HG LEU 47 HG LEU 47 0.691 -2.453 6.922 397 HD11 LEU 47 HD11 LEU 47 1.691 -2.764 4.073 398 HD12 LEU 47 HD12 LEU 47 0.309 -1.789 4.629 399 HD13 LEU 47 HD13 LEU 47 1.945 -1.348 5.122 400 HD21 LEU 47 HD21 LEU 47 -0.002 -4.781 6.775 401 HD22 LEU 47 HD22 LEU 47 -0.794 -3.817 5.536 402 HD23 LEU 47 HD23 LEU 47 0.571 -4.871 5.098 403 H ARG 48 H ARG 48 2.375 -0.381 8.062 404 HA ARG 48 HA ARG 48 0.440 -1.550 10.004 405 HB2 ARG 48 HB2 ARG 48 1.803 1.172 10.109 406 HB3 ARG 48 HB3 ARG 48 0.286 0.849 10.940 407 HG2 ARG 48 HG2 ARG 48 2.853 -0.717 11.435 408 HG3 ARG 48 HG3 ARG 48 2.311 0.676 12.383 409 HD2 ARG 48 HD2 ARG 48 0.181 -0.572 12.913 410 HD3 ARG 48 HD3 ARG 48 0.850 -1.973 12.082 411 HE ARG 48 HE ARG 48 2.325 -2.366 13.838 412 HH11 ARG 48 HH11 ARG 48 3.012 -2.235 15.944 413 HH12 ARG 48 HH12 ARG 48 2.599 -0.849 16.905 414 HH21 ARG 48 HH21 ARG 48 0.819 0.741 14.452 415 HH22 ARG 48 HH22 ARG 48 1.387 0.785 16.097 416 H ILE 49 H ILE 49 -1.612 -1.151 9.615 417 HA ILE 49 HA ILE 49 -2.367 0.984 7.656 418 HB ILE 49 HB ILE 49 -3.726 -1.701 8.021 419 HG12 ILE 49 HG12 ILE 49 -2.194 -0.441 5.700 420 HG13 ILE 49 HG13 ILE 49 -1.763 -1.893 6.607 421 HG21 ILE 49 HG21 ILE 49 -4.546 0.618 6.236 422 HG22 ILE 49 HG22 ILE 49 -5.363 -0.954 6.398 423 HG23 ILE 49 HG23 ILE 49 -5.366 0.142 7.758 424 HD11 ILE 49 HD11 ILE 49 -4.061 -1.568 4.649 425 HD12 ILE 49 HD12 ILE 49 -2.633 -2.593 4.512 426 HD13 ILE 49 HD13 ILE 49 -3.862 -2.988 5.723 427 H THR 50 H THR 50 -3.409 2.540 8.639 428 HA THR 50 HA THR 50 -4.860 1.984 11.182 429 HB THR 50 HB THR 50 -3.983 4.055 12.106 430 HG1 THR 50 HG1 THR 50 -2.257 5.057 10.900 431 HG21 THR 50 HG21 THR 50 -2.539 1.972 12.349 432 HG22 THR 50 HG22 THR 50 -1.587 2.556 10.973 433 HG23 THR 50 HG23 THR 50 -1.678 3.511 12.468 434 H SER 51 H SER 51 -6.354 3.879 11.774 435 HA SER 51 HA SER 51 -7.553 5.305 9.468 436 HB2 SER 51 HB2 SER 51 -8.747 3.322 9.266 437 HB3 SER 51 HB3 SER 51 -8.885 3.107 11.031 438 HG SER 51 HG SER 51 -10.794 3.932 10.630 439 H LYS 52 H LYS 52 -8.049 7.223 10.036 440 HA LYS 52 HA LYS 52 -8.796 8.009 12.815 441 HB2 LYS 52 HB2 LYS 52 -7.025 9.163 11.516 442 HB3 LYS 52 HB3 LYS 52 -8.271 9.705 10.367 443 HG2 LYS 52 HG2 LYS 52 -9.352 10.786 12.531 444 HG3 LYS 52 HG3 LYS 52 -7.777 10.511 13.238 445 HD2 LYS 52 HD2 LYS 52 -8.486 12.133 10.779 446 HD3 LYS 52 HD3 LYS 52 -7.939 12.759 12.349 447 HE2 LYS 52 HE2 LYS 52 -5.699 11.886 11.965 448 HE3 LYS 52 HE3 LYS 52 -6.225 11.033 10.512 449 HZ1 LYS 52 HZ1 LYS 52 -5.125 13.072 9.910 450 HZ2 LYS 52 HZ2 LYS 52 -6.699 13.250 9.526 451 HZ3 LYS 52 HZ3 LYS 52 -6.080 13.987 10.861 452 H GLY 53 H GLY 53 -10.492 6.356 11.003 453 HA2 GLY 53 HA2 GLY 53 -12.790 6.022 10.867 454 HA3 GLY 53 HA3 GLY 53 -13.092 7.661 11.438 455 H LYS 54 H LYS 54 -13.571 5.731 8.878 456 HA LYS 54 HA LYS 54 -13.924 5.843 6.645 457 HB2 LYS 54 HB2 LYS 54 -15.540 7.553 7.624 458 HB3 LYS 54 HB3 LYS 54 -14.442 8.806 7.021 459 HG2 LYS 54 HG2 LYS 54 -14.798 7.888 4.691 460 HG3 LYS 54 HG3 LYS 54 -15.898 6.685 5.396 461 HD2 LYS 54 HD2 LYS 54 -17.246 8.643 6.320 462 HD3 LYS 54 HD3 LYS 54 -16.191 9.721 5.377 463 HE2 LYS 54 HE2 LYS 54 -16.879 8.565 3.287 464 HE3 LYS 54 HE3 LYS 54 -17.861 7.440 4.233 465 HZ1 LYS 54 HZ1 LYS 54 -19.325 9.092 3.428 466 HZ2 LYS 54 HZ2 LYS 54 -19.145 9.436 5.005 467 HZ3 LYS 54 HZ3 LYS 54 -18.359 10.341 3.892 468 H THR 55 H THR 55 -11.253 7.462 7.752 469 HA THR 55 HA THR 55 -10.031 7.317 5.025 470 HB THR 55 HB THR 55 -8.918 9.218 7.091 471 HG1 THR 55 HG1 THR 55 -11.084 9.839 7.030 472 HG21 THR 55 HG21 THR 55 -8.333 10.463 5.049 473 HG22 THR 55 HG22 THR 55 -7.803 8.771 4.915 474 HG23 THR 55 HG23 THR 55 -9.282 9.308 4.073 475 H ALA 56 H ALA 56 -8.643 5.757 4.948 476 HA ALA 56 HA ALA 56 -7.268 4.890 7.428 477 HB1 ALA 56 HB1 ALA 56 -6.644 2.832 6.146 478 HB2 ALA 56 HB2 ALA 56 -8.371 3.020 6.458 479 HB3 ALA 56 HB3 ALA 56 -7.720 3.368 4.849 480 H TYR 57 H TYR 57 -4.994 4.412 7.287 481 HA TYR 57 HA TYR 57 -3.484 6.036 5.298 482 HB2 TYR 57 HB2 TYR 57 -3.090 5.995 8.311 483 HB3 TYR 57 HB3 TYR 57 -2.047 6.787 7.144 484 HD1 TYR 57 HD1 TYR 57 -5.541 6.820 8.569 485 HD2 TYR 57 HD2 TYR 57 -2.492 9.025 6.447 486 HE1 TYR 57 HE1 TYR 57 -6.961 8.826 8.633 487 HE2 TYR 57 HE2 TYR 57 -3.911 11.075 6.584 488 HH TYR 57 HH TYR 57 -7.189 11.034 8.024 489 H ILE 58 H ILE 58 -2.344 4.582 4.196 490 HA ILE 58 HA ILE 58 -1.369 2.067 5.417 491 HB ILE 58 HB ILE 58 -0.448 3.248 2.781 492 HG12 ILE 58 HG12 ILE 58 -2.848 3.190 2.524 493 HG13 ILE 58 HG13 ILE 58 -2.049 1.987 1.532 494 HG21 ILE 58 HG21 ILE 58 -0.513 0.446 3.930 495 HG22 ILE 58 HG22 ILE 58 0.003 0.867 2.278 496 HG23 ILE 58 HG23 ILE 58 0.917 1.461 3.665 497 HD11 ILE 58 HD11 ILE 58 -2.712 0.197 3.078 498 HD12 ILE 58 HD12 ILE 58 -3.463 1.396 4.164 499 HD13 ILE 58 HD13 ILE 58 -4.106 1.144 2.527 500 H LYS 59 H LYS 59 0.232 2.332 6.894 501 HA LYS 59 HA LYS 59 2.396 4.347 6.327 502 HB2 LYS 59 HB2 LYS 59 1.500 3.367 9.053 503 HB3 LYS 59 HB3 LYS 59 2.759 4.553 8.689 504 HG2 LYS 59 HG2 LYS 59 0.759 5.761 7.362 505 HG3 LYS 59 HG3 LYS 59 -0.243 4.804 8.464 506 HD2 LYS 59 HD2 LYS 59 1.076 5.820 10.387 507 HD3 LYS 59 HD3 LYS 59 1.908 6.836 9.182 508 HE2 LYS 59 HE2 LYS 59 -0.452 7.558 8.418 509 HE3 LYS 59 HE3 LYS 59 -1.046 6.807 9.907 510 HZ1 LYS 59 HZ1 LYS 59 0.706 9.150 9.581 511 HZ2 LYS 59 HZ2 LYS 59 -0.665 9.009 10.514 512 HZ3 LYS 59 HZ3 LYS 59 0.722 8.322 11.005 513 H LEU 60 H LEU 60 4.292 3.617 5.837 514 HA LEU 60 HA LEU 60 4.942 0.735 6.310 515 HB2 LEU 60 HB2 LEU 60 5.933 2.789 4.301 516 HB3 LEU 60 HB3 LEU 60 6.614 1.172 4.469 517 HG LEU 60 HG LEU 60 3.662 1.626 3.847 518 HD11 LEU 60 HD11 LEU 60 5.999 1.225 1.953 519 HD12 LEU 60 HD12 LEU 60 4.284 1.123 1.492 520 HD13 LEU 60 HD13 LEU 60 4.956 2.656 2.068 521 HD21 LEU 60 HD21 LEU 60 5.500 -0.777 3.445 522 HD22 LEU 60 HD22 LEU 60 4.272 -0.632 4.716 523 HD23 LEU 60 HD23 LEU 60 3.779 -0.689 3.020 524 H GLU 61 H GLU 61 6.630 0.141 7.534 525 HA GLU 61 HA GLU 61 8.151 2.298 8.948 526 HB2 GLU 61 HB2 GLU 61 6.877 -0.202 10.096 527 HB3 GLU 61 HB3 GLU 61 7.782 1.025 10.984 528 HG2 GLU 61 HG2 GLU 61 6.025 2.709 10.320 529 HG3 GLU 61 HG3 GLU 61 5.072 1.376 9.646 530 H ASP 62 H ASP 62 10.220 1.718 9.914 531 HA ASP 62 HA ASP 62 11.780 -0.137 8.406 532 HB2 ASP 62 HB2 ASP 62 12.676 1.937 9.317 533 HB3 ASP 62 HB3 ASP 62 12.258 1.442 10.961 534 H LYS 63 H LYS 63 12.433 -2.168 8.856 535 HA LYS 63 HA LYS 63 10.761 -3.812 10.473 536 HB2 LYS 63 HB2 LYS 63 12.488 -4.172 8.318 537 HB3 LYS 63 HB3 LYS 63 13.353 -4.997 9.600 538 HG2 LYS 63 HG2 LYS 63 11.348 -6.366 10.101 539 HG3 LYS 63 HG3 LYS 63 10.428 -5.506 8.863 540 HD2 LYS 63 HD2 LYS 63 12.884 -7.245 8.360 541 HD3 LYS 63 HD3 LYS 63 11.198 -7.720 8.089 542 HE2 LYS 63 HE2 LYS 63 10.946 -5.883 6.433 543 HE3 LYS 63 HE3 LYS 63 12.650 -5.446 6.662 544 HZ1 LYS 63 HZ1 LYS 63 11.578 -7.949 5.502 545 HZ2 LYS 63 HZ2 LYS 63 12.508 -6.815 4.757 546 HZ3 LYS 63 HZ3 LYS 63 13.167 -7.772 5.909 547 H VAL 64 H VAL 64 13.350 -1.975 11.541 548 HA VAL 64 HA VAL 64 14.072 -3.822 13.776 549 HB VAL 64 HB VAL 64 15.783 -1.497 12.873 550 HG11 VAL 64 HG11 VAL 64 17.586 -2.900 13.753 551 HG12 VAL 64 HG12 VAL 64 16.330 -2.657 14.972 552 HG13 VAL 64 HG13 VAL 64 16.429 -4.205 14.099 553 HG21 VAL 64 HG21 VAL 64 15.480 -2.671 10.778 554 HG22 VAL 64 HG22 VAL 64 17.085 -3.030 11.412 555 HG23 VAL 64 HG23 VAL 64 15.790 -4.243 11.563 556 H SER 65 H SER 65 13.325 -0.437 12.927 557 HA SER 65 HA SER 65 13.041 0.135 15.854 558 HB2 SER 65 HB2 SER 65 14.126 1.908 13.640 559 HB3 SER 65 HB3 SER 65 13.897 2.403 15.329 560 HG SER 65 HG SER 65 16.050 1.712 14.896 561 H GLY 66 H GLY 66 11.113 -0.104 13.135 562 HA2 GLY 66 HA2 GLY 66 8.945 0.503 12.781 563 HA3 GLY 66 HA3 GLY 66 8.898 1.211 14.395 564 H GLU 67 H GLU 67 11.360 2.572 12.392 565 HA GLU 67 HA GLU 67 10.127 5.188 12.505 566 HB2 GLU 67 HB2 GLU 67 12.621 4.243 11.033 567 HB3 GLU 67 HB3 GLU 67 12.122 5.927 11.247 568 HG2 GLU 67 HG2 GLU 67 12.222 5.593 13.741 569 HG3 GLU 67 HG3 GLU 67 12.870 3.975 13.465 570 H LEU 68 H LEU 68 9.215 6.470 10.872 571 HA LEU 68 HA LEU 68 7.763 4.968 8.928 572 HB2 LEU 68 HB2 LEU 68 6.958 7.018 10.186 573 HB3 LEU 68 HB3 LEU 68 8.004 7.988 9.153 574 HG LEU 68 HG LEU 68 6.707 6.985 7.149 575 HD11 LEU 68 HD11 LEU 68 5.609 5.104 8.371 576 HD12 LEU 68 HD12 LEU 68 4.745 6.278 9.380 577 HD13 LEU 68 HD13 LEU 68 4.429 6.188 7.635 578 HD21 LEU 68 HD21 LEU 68 6.379 9.290 7.946 579 HD22 LEU 68 HD22 LEU 68 4.857 8.569 7.404 580 HD23 LEU 68 HD23 LEU 68 5.196 8.717 9.144 581 H PHE 69 H PHE 69 8.288 4.364 6.980 582 HA PHE 69 HA PHE 69 10.454 5.594 5.360 583 HB2 PHE 69 HB2 PHE 69 10.419 3.236 5.364 584 HB3 PHE 69 HB3 PHE 69 8.678 3.162 5.141 585 HD1 PHE 69 HD1 PHE 69 11.481 4.892 3.264 586 HD2 PHE 69 HD2 PHE 69 8.115 2.210 3.113 587 HE1 PHE 69 HE1 PHE 69 11.759 4.676 0.822 588 HE2 PHE 69 HE2 PHE 69 8.412 1.963 0.682 589 HZ PHE 69 HZ PHE 69 10.195 3.221 -0.505 590 H ALA 70 H ALA 70 6.918 4.983 5.078 591 HA ALA 70 HA ALA 70 6.493 7.522 3.698 592 HB1 ALA 70 HB1 ALA 70 5.535 6.488 1.679 593 HB2 ALA 70 HB2 ALA 70 7.245 6.059 1.832 594 HB3 ALA 70 HB3 ALA 70 5.991 4.872 2.256 595 H GLN 71 H GLN 71 4.197 7.970 3.338 596 HA GLN 71 HA GLN 71 2.299 6.050 4.441 597 HB2 GLN 71 HB2 GLN 71 1.085 7.697 5.792 598 HB3 GLN 71 HB3 GLN 71 2.703 7.344 6.391 599 HG2 GLN 71 HG2 GLN 71 3.523 9.475 5.326 600 HG3 GLN 71 HG3 GLN 71 1.860 9.853 4.874 601 HE21 GLN 71 HE21 GLN 71 2.718 11.559 8.121 602 HE22 GLN 71 HE22 GLN 71 3.426 11.576 6.514 603 H ALA 72 H ALA 72 0.356 5.963 3.484 604 HA ALA 72 HA ALA 72 -0.286 7.924 1.317 605 HB1 ALA 72 HB1 ALA 72 -0.684 4.917 1.330 606 HB2 ALA 72 HB2 ALA 72 -1.311 6.013 0.103 607 HB3 ALA 72 HB3 ALA 72 0.433 5.841 0.302 608 HA PRO 73 HA PRO 73 -4.175 7.827 3.826 609 HB2 PRO 73 HB2 PRO 73 -5.219 10.223 3.140 610 HB3 PRO 73 HB3 PRO 73 -3.786 10.088 4.205 611 HG2 PRO 73 HG2 PRO 73 -3.836 10.661 1.228 612 HG3 PRO 73 HG3 PRO 73 -2.920 11.514 2.507 613 HD2 PRO 73 HD2 PRO 73 -1.851 9.511 0.926 614 HD3 PRO 73 HD3 PRO 73 -1.300 9.831 2.598 615 H VAL 74 H VAL 74 -6.234 7.085 3.299 616 HA VAL 74 HA VAL 74 -7.211 7.282 0.482 617 HB VAL 74 HB VAL 74 -6.146 5.147 0.781 618 HG11 VAL 74 HG11 VAL 74 -6.974 3.311 2.079 619 HG12 VAL 74 HG12 VAL 74 -6.420 4.622 3.118 620 HG13 VAL 74 HG13 VAL 74 -8.166 4.362 2.859 621 HG21 VAL 74 HG21 VAL 74 -9.153 4.738 0.622 622 HG22 VAL 74 HG22 VAL 74 -8.180 5.412 -0.702 623 HG23 VAL 74 HG23 VAL 74 -7.915 3.753 -0.141 624 H GLU 75 H GLU 75 -9.309 7.779 0.234 625 HA GLU 75 HA GLU 75 -11.127 7.406 2.555 626 HB2 GLU 75 HB2 GLU 75 -10.333 9.827 1.804 627 HB3 GLU 75 HB3 GLU 75 -11.546 9.612 0.543 628 HG2 GLU 75 HG2 GLU 75 -13.224 9.121 2.427 629 HG3 GLU 75 HG3 GLU 75 -11.954 9.552 3.567 630 H GLN 76 H GLN 76 -10.462 6.053 -0.272 631 HA GLN 76 HA GLN 76 -13.123 5.016 -0.801 632 HB2 GLN 76 HB2 GLN 76 -12.440 5.736 -3.390 633 HB3 GLN 76 HB3 GLN 76 -13.675 6.469 -2.399 634 HG2 GLN 76 HG2 GLN 76 -12.263 8.124 -3.550 635 HG3 GLN 76 HG3 GLN 76 -12.279 8.335 -1.810 636 HE21 GLN 76 HE21 GLN 76 -8.773 7.056 -3.526 637 HE22 GLN 76 HE22 GLN 76 -10.291 6.719 -4.371 638 H TYR 77 H TYR 77 -12.929 2.924 -1.423 639 HA TYR 77 HA TYR 77 -10.400 1.986 -2.654 640 HB2 TYR 77 HB2 TYR 77 -10.376 1.559 -0.228 641 HB3 TYR 77 HB3 TYR 77 -11.862 0.609 -0.383 642 HD1 TYR 77 HD1 TYR 77 -11.305 -1.736 -0.052 643 HD2 TYR 77 HD2 TYR 77 -8.626 0.824 -2.234 644 HE1 TYR 77 HE1 TYR 77 -9.839 -3.659 -0.539 645 HE2 TYR 77 HE2 TYR 77 -7.135 -1.067 -2.674 646 HH TYR 77 HH TYR 77 -8.062 -4.418 -1.721 647 HA PRO 78 HA PRO 78 -9.594 0.612 -4.232 648 HB2 PRO 78 HB2 PRO 78 -9.704 0.383 -6.928 649 HB3 PRO 78 HB3 PRO 78 -9.825 -1.024 -5.827 650 HG2 PRO 78 HG2 PRO 78 -12.103 0.527 -7.112 651 HG3 PRO 78 HG3 PRO 78 -11.842 -1.248 -7.108 652 HD2 PRO 78 HD2 PRO 78 -13.484 -0.060 -5.305 653 HD3 PRO 78 HD3 PRO 78 -12.433 -1.423 -4.822 654 H GLY 79 H GLY 79 -8.328 2.269 -5.307 655 HA2 GLY 79 HA2 GLY 79 -9.558 4.517 -6.675 656 HA3 GLY 79 HA3 GLY 79 -9.176 4.875 -4.989 657 H ILE 80 H ILE 80 -7.761 6.532 -5.932 658 HA ILE 80 HA ILE 80 -5.385 5.701 -7.405 659 HB ILE 80 HB ILE 80 -6.516 7.866 -7.801 660 HG12 ILE 80 HG12 ILE 80 -4.579 9.321 -7.934 661 HG13 ILE 80 HG13 ILE 80 -3.675 8.313 -6.809 662 HG21 ILE 80 HG21 ILE 80 -5.434 8.732 -5.080 663 HG22 ILE 80 HG22 ILE 80 -6.258 9.752 -6.266 664 HG23 ILE 80 HG23 ILE 80 -7.151 8.457 -5.462 665 HD11 ILE 80 HD11 ILE 80 -3.061 8.006 -9.226 666 HD12 ILE 80 HD12 ILE 80 -3.564 6.501 -8.444 667 HD13 ILE 80 HD13 ILE 80 -4.686 7.365 -9.529 668 H ALA 81 H ALA 81 -6.274 6.102 -4.039 669 HA ALA 81 HA ALA 81 -3.574 6.349 -3.093 670 HB1 ALA 81 HB1 ALA 81 -6.116 5.634 -1.603 671 HB2 ALA 81 HB2 ALA 81 -4.538 6.021 -0.880 672 HB3 ALA 81 HB3 ALA 81 -5.438 7.268 -1.792 673 H VAL 82 H VAL 82 -5.565 3.646 -3.982 674 HA VAL 82 HA VAL 82 -3.450 1.715 -3.475 675 HB VAL 82 HB VAL 82 -4.203 1.723 -1.292 676 HG11 VAL 82 HG11 VAL 82 -6.698 1.002 -0.889 677 HG12 VAL 82 HG12 VAL 82 -6.104 2.665 -0.883 678 HG13 VAL 82 HG13 VAL 82 -6.915 2.044 -2.315 679 HG21 VAL 82 HG21 VAL 82 -5.117 -0.713 -2.784 680 HG22 VAL 82 HG22 VAL 82 -3.554 -0.350 -2.088 681 HG23 VAL 82 HG23 VAL 82 -4.946 -0.597 -1.017 682 H GLU 83 H GLU 83 -3.496 0.581 -5.265 683 HA GLU 83 HA GLU 83 -6.059 -0.313 -6.511 684 HB2 GLU 83 HB2 GLU 83 -4.174 1.574 -7.573 685 HB3 GLU 83 HB3 GLU 83 -3.919 0.082 -8.464 686 HG2 GLU 83 HG2 GLU 83 -6.639 1.412 -8.086 687 HG3 GLU 83 HG3 GLU 83 -5.569 1.701 -9.456 688 H THR 84 H THR 84 -5.958 -2.280 -7.689 689 HA THR 84 HA THR 84 -3.719 -4.123 -6.912 690 HB THR 84 HB THR 84 -6.175 -5.065 -8.275 691 HG1 THR 84 HG1 THR 84 -7.216 -5.329 -6.298 692 HG21 THR 84 HG21 THR 84 -4.291 -6.559 -7.857 693 HG22 THR 84 HG22 THR 84 -4.408 -6.246 -6.109 694 HG23 THR 84 HG23 THR 84 -5.730 -7.078 -6.969 695 H VAL 85 H VAL 85 -2.311 -3.464 -8.238 696 HA VAL 85 HA VAL 85 -1.306 -3.017 -10.442 697 HB VAL 85 HB VAL 85 -0.437 -5.454 -10.842 698 HG11 VAL 85 HG11 VAL 85 1.099 -5.127 -8.935 699 HG12 VAL 85 HG12 VAL 85 0.763 -3.599 -9.743 700 HG13 VAL 85 HG13 VAL 85 -0.026 -3.973 -8.198 701 HG21 VAL 85 HG21 VAL 85 -2.286 -6.598 -9.491 702 HG22 VAL 85 HG22 VAL 85 -0.631 -6.991 -9.044 703 HG23 VAL 85 HG23 VAL 85 -1.574 -5.869 -8.052 704 H THR 86 H THR 86 -3.078 -6.033 -10.915 705 HA THR 86 HA THR 86 -4.655 -4.817 -13.017 706 HB THR 86 HB THR 86 -4.524 -6.957 -14.434 707 HG1 THR 86 HG1 THR 86 -2.601 -8.058 -14.345 708 HG21 THR 86 HG21 THR 86 -1.964 -5.328 -14.335 709 HG22 THR 86 HG22 THR 86 -2.683 -6.103 -15.768 710 HG23 THR 86 HG23 THR 86 -3.466 -4.685 -15.021 711 H ASP 87 H ASP 87 -3.919 -7.903 -11.453 712 HA ASP 87 HA ASP 87 -6.820 -8.301 -10.815 713 HB2 ASP 87 HB2 ASP 87 -5.143 -9.716 -12.831 714 HB3 ASP 87 HB3 ASP 87 -6.272 -10.704 -11.898 715 H SER 88 H SER 88 -4.044 -10.617 -10.702 716 HA SER 88 HA SER 88 -4.408 -11.633 -8.173 717 HB2 SER 88 HB2 SER 88 -2.351 -12.008 -9.673 718 HB3 SER 88 HB3 SER 88 -1.626 -10.659 -8.832 719 HG SER 88 HG SER 88 -2.506 -13.130 -7.793 720 H SER 89 H SER 89 -4.195 -11.084 -6.114 721 HA SER 89 HA SER 89 -3.243 -8.358 -5.401 722 HB2 SER 89 HB2 SER 89 -4.857 -8.408 -3.600 723 HB3 SER 89 HB3 SER 89 -5.558 -8.581 -5.225 724 HG SER 89 HG SER 89 -6.533 -10.050 -3.792 725 H ARG 90 H ARG 90 -1.441 -10.542 -5.720 726 HA ARG 90 HA ARG 90 -0.184 -10.734 -3.041 727 HB2 ARG 90 HB2 ARG 90 0.276 -12.322 -5.018 728 HB3 ARG 90 HB3 ARG 90 1.177 -11.001 -5.749 729 HG2 ARG 90 HG2 ARG 90 2.702 -10.937 -3.776 730 HG3 ARG 90 HG3 ARG 90 1.737 -12.202 -2.992 731 HD2 ARG 90 HD2 ARG 90 2.268 -13.700 -4.942 732 HD3 ARG 90 HD3 ARG 90 3.364 -12.442 -5.552 733 HE ARG 90 HE ARG 90 4.208 -12.845 -2.937 734 HH11 ARG 90 HH11 ARG 90 5.545 -14.550 -2.138 735 HH12 ARG 90 HH12 ARG 90 5.969 -15.832 -3.246 736 HH21 ARG 90 HH21 ARG 90 3.964 -14.905 -5.783 737 HH22 ARG 90 HH22 ARG 90 5.133 -16.042 -5.148 738 H TYR 91 H TYR 91 -0.478 -8.459 -5.617 739 HA TYR 91 HA TYR 91 1.517 -6.617 -4.394 740 HB2 TYR 91 HB2 TYR 91 0.702 -6.731 -7.302 741 HB3 TYR 91 HB3 TYR 91 2.004 -5.786 -6.625 742 HD1 TYR 91 HD1 TYR 91 4.128 -6.906 -5.932 743 HD2 TYR 91 HD2 TYR 91 0.961 -8.992 -7.988 744 HE1 TYR 91 HE1 TYR 91 5.722 -8.729 -6.547 745 HE2 TYR 91 HE2 TYR 91 2.556 -10.794 -8.619 746 HH TYR 91 HH TYR 91 5.981 -10.707 -7.609 747 H PHE 92 H PHE 92 1.146 -4.394 -4.710 748 HA PHE 92 HA PHE 92 -1.511 -3.460 -5.592 749 HB2 PHE 92 HB2 PHE 92 -0.373 -2.746 -2.867 750 HB3 PHE 92 HB3 PHE 92 -1.788 -2.010 -3.613 751 HD1 PHE 92 HD1 PHE 92 -3.832 -3.429 -4.136 752 HD2 PHE 92 HD2 PHE 92 -0.538 -4.847 -1.738 753 HE1 PHE 92 HE1 PHE 92 -5.245 -5.297 -3.315 754 HE2 PHE 92 HE2 PHE 92 -1.970 -6.670 -0.877 755 HZ PHE 92 HZ PHE 92 -4.299 -6.947 -1.697 756 H VAL 93 H VAL 93 -1.519 -1.057 -5.737 757 HA VAL 93 HA VAL 93 1.162 0.239 -5.755 758 HB VAL 93 HB VAL 93 -1.022 0.677 -7.831 759 HG11 VAL 93 HG11 VAL 93 0.611 2.310 -8.799 760 HG12 VAL 93 HG12 VAL 93 -0.079 2.840 -7.271 761 HG13 VAL 93 HG13 VAL 93 1.575 2.184 -7.316 762 HG21 VAL 93 HG21 VAL 93 0.331 -1.276 -8.355 763 HG22 VAL 93 HG22 VAL 93 0.825 0.053 -9.410 764 HG23 VAL 93 HG23 VAL 93 1.832 -0.380 -8.022 765 H ILE 94 H ILE 94 1.195 2.022 -4.441 766 HA ILE 94 HA ILE 94 -1.415 3.244 -3.724 767 HB ILE 94 HB ILE 94 -0.811 3.518 -1.421 768 HG12 ILE 94 HG12 ILE 94 1.751 1.937 -1.971 769 HG13 ILE 94 HG13 ILE 94 1.696 3.685 -1.766 770 HG21 ILE 94 HG21 ILE 94 -1.866 1.344 -2.211 771 HG22 ILE 94 HG22 ILE 94 -0.275 0.585 -2.074 772 HG23 ILE 94 HG23 ILE 94 -1.077 1.293 -0.653 773 HD11 ILE 94 HD11 ILE 94 0.892 1.640 0.324 774 HD12 ILE 94 HD12 ILE 94 2.330 2.679 0.343 775 HD13 ILE 94 HD13 ILE 94 0.712 3.387 0.499 776 H ARG 95 H ARG 95 -1.462 5.392 -3.234 777 HA ARG 95 HA ARG 95 0.778 7.055 -4.318 778 HB2 ARG 95 HB2 ARG 95 -1.435 7.361 -5.299 779 HB3 ARG 95 HB3 ARG 95 -2.129 7.748 -3.739 780 HG2 ARG 95 HG2 ARG 95 0.103 9.419 -4.967 781 HG3 ARG 95 HG3 ARG 95 -1.609 9.671 -5.331 782 HD2 ARG 95 HD2 ARG 95 -2.002 9.848 -2.801 783 HD3 ARG 95 HD3 ARG 95 -0.250 9.943 -2.641 784 HE ARG 95 HE ARG 95 -0.242 12.105 -3.385 785 HH11 ARG 95 HH11 ARG 95 -0.973 13.987 -3.978 786 HH12 ARG 95 HH12 ARG 95 -2.635 14.224 -4.483 787 HH21 ARG 95 HH21 ARG 95 -3.466 10.895 -4.096 788 HH22 ARG 95 HH22 ARG 95 -4.025 12.481 -4.554 789 H ILE 96 H ILE 96 2.233 7.320 -2.796 790 HA ILE 96 HA ILE 96 1.486 7.980 0.007 791 HB ILE 96 HB ILE 96 3.913 7.877 0.446 792 HG12 ILE 96 HG12 ILE 96 4.275 6.682 -2.327 793 HG13 ILE 96 HG13 ILE 96 4.560 8.398 -1.996 794 HG21 ILE 96 HG21 ILE 96 2.691 5.389 -0.798 795 HG22 ILE 96 HG22 ILE 96 4.119 5.380 0.233 796 HG23 ILE 96 HG23 ILE 96 2.583 5.910 0.900 797 HD11 ILE 96 HD11 ILE 96 6.017 6.081 -0.709 798 HD12 ILE 96 HD12 ILE 96 6.651 7.242 -1.893 799 HD13 ILE 96 HD13 ILE 96 6.204 7.798 -0.262 800 H GLN 97 H GLN 97 2.585 9.828 1.032 801 HA GLN 97 HA GLN 97 3.373 11.996 -0.868 802 HB2 GLN 97 HB2 GLN 97 2.758 12.095 2.089 803 HB3 GLN 97 HB3 GLN 97 3.749 13.310 1.279 804 HG2 GLN 97 HG2 GLN 97 1.736 13.344 -0.480 805 HG3 GLN 97 HG3 GLN 97 0.817 12.723 0.896 806 HE21 GLN 97 HE21 GLN 97 2.374 16.560 0.934 807 HE22 GLN 97 HE22 GLN 97 3.088 15.321 -0.111 808 H ASP 98 H ASP 98 5.435 12.806 -0.963 809 HA ASP 98 HA ASP 98 7.538 10.918 -0.085 810 HB2 ASP 98 HB2 ASP 98 7.380 11.924 -2.398 811 HB3 ASP 98 HB3 ASP 98 7.793 13.476 -1.665 812 H GLY 99 H GLY 99 5.976 13.414 1.393 813 HA2 GLY 99 HA2 GLY 99 6.330 14.260 3.526 814 HA3 GLY 99 HA3 GLY 99 7.954 13.573 3.533 815 H THR 100 H THR 100 7.660 15.443 0.764 816 HA THR 100 HA THR 100 8.922 17.836 2.044 817 HB THR 100 HB THR 100 10.133 18.151 -0.057 818 HG1 THR 100 HG1 THR 100 10.009 16.552 -1.621 819 HG21 THR 100 HG21 THR 100 10.439 15.266 0.877 820 HG22 THR 100 HG22 THR 100 11.653 16.278 0.071 821 HG23 THR 100 HG23 THR 100 11.127 16.677 1.717 822 H GLY 101 H GLY 101 5.977 17.237 1.282 823 HA2 GLY 101 HA2 GLY 101 4.236 18.789 0.865 824 HA3 GLY 101 HA3 GLY 101 5.354 19.858 0.019 825 H ARG 102 H ARG 102 5.600 16.541 -0.875 826 HA ARG 102 HA ARG 102 3.879 16.862 -3.293 827 HB2 ARG 102 HB2 ARG 102 5.621 16.268 -4.744 828 HB3 ARG 102 HB3 ARG 102 6.296 17.489 -3.649 829 HG2 ARG 102 HG2 ARG 102 7.337 15.609 -2.339 830 HG3 ARG 102 HG3 ARG 102 6.809 14.492 -3.615 831 HD2 ARG 102 HD2 ARG 102 8.067 15.779 -5.295 832 HD3 ARG 102 HD3 ARG 102 8.588 16.929 -4.047 833 HE ARG 102 HE ARG 102 9.416 14.404 -3.129 834 HH11 ARG 102 HH11 ARG 102 11.315 13.601 -3.315 835 HH12 ARG 102 HH12 ARG 102 12.469 14.137 -4.542 836 HH21 ARG 102 HH21 ARG 102 10.234 16.416 -5.895 837 HH22 ARG 102 HH22 ARG 102 11.833 15.728 -5.999 838 H SER 103 H SER 103 3.869 14.790 -4.598 839 HA SER 103 HA SER 103 3.299 12.462 -2.811 840 HB2 SER 103 HB2 SER 103 1.849 13.352 -5.328 841 HB3 SER 103 HB3 SER 103 1.523 11.862 -4.427 842 HG SER 103 HG SER 103 1.363 14.504 -3.350 843 H ALA 104 H ALA 104 3.485 10.348 -3.716 844 HA ALA 104 HA ALA 104 4.792 9.982 -6.326 845 HB1 ALA 104 HB1 ALA 104 6.084 9.016 -3.738 846 HB2 ALA 104 HB2 ALA 104 6.612 8.602 -5.382 847 HB3 ALA 104 HB3 ALA 104 6.720 10.278 -4.814 848 H PHE 105 H PHE 105 4.479 7.953 -7.230 849 HA PHE 105 HA PHE 105 2.618 6.129 -5.792 850 HB2 PHE 105 HB2 PHE 105 3.436 6.050 -8.701 851 HB3 PHE 105 HB3 PHE 105 2.153 5.136 -7.919 852 HD1 PHE 105 HD1 PHE 105 0.158 6.451 -6.890 853 HD2 PHE 105 HD2 PHE 105 3.037 8.235 -9.566 854 HE1 PHE 105 HE1 PHE 105 -1.417 8.304 -7.373 855 HE2 PHE 105 HE2 PHE 105 1.485 10.112 -9.986 856 HZ PHE 105 HZ PHE 105 -0.776 10.138 -8.899 857 H ILE 106 H ILE 106 3.255 4.252 -5.004 858 HA ILE 106 HA ILE 106 5.727 2.972 -6.077 859 HB ILE 106 HB ILE 106 6.247 1.969 -3.925 860 HG12 ILE 106 HG12 ILE 106 4.137 3.890 -2.775 861 HG13 ILE 106 HG13 ILE 106 3.984 2.136 -2.849 862 HG21 ILE 106 HG21 ILE 106 6.175 5.017 -3.673 863 HG22 ILE 106 HG22 ILE 106 7.393 3.897 -3.025 864 HG23 ILE 106 HG23 ILE 106 7.267 4.158 -4.767 865 HD11 ILE 106 HD11 ILE 106 4.541 2.909 -0.605 866 HD12 ILE 106 HD12 ILE 106 5.777 1.832 -1.256 867 HD13 ILE 106 HD13 ILE 106 6.066 3.591 -1.183 868 H GLY 107 H GLY 107 5.709 0.851 -6.480 869 HA2 GLY 107 HA2 GLY 107 3.211 -0.687 -6.251 870 HA3 GLY 107 HA3 GLY 107 4.742 -1.218 -6.956 871 H ILE 108 H ILE 108 3.010 -2.432 -4.868 872 HA ILE 108 HA ILE 108 5.148 -2.889 -2.844 873 HB ILE 108 HB ILE 108 2.161 -3.099 -2.270 874 HG12 ILE 108 HG12 ILE 108 4.224 -0.925 -1.657 875 HG13 ILE 108 HG13 ILE 108 2.691 -0.744 -2.509 876 HG21 ILE 108 HG21 ILE 108 4.601 -3.324 -0.462 877 HG22 ILE 108 HG22 ILE 108 2.903 -3.445 0.057 878 HG23 ILE 108 HG23 ILE 108 3.565 -4.677 -0.978 879 HD11 ILE 108 HD11 ILE 108 2.529 0.222 -0.325 880 HD12 ILE 108 HD12 ILE 108 1.479 -1.220 -0.380 881 HD13 ILE 108 HD13 ILE 108 3.056 -1.253 0.466 882 H GLY 109 H GLY 109 5.539 -5.098 -2.424 883 HA2 GLY 109 HA2 GLY 109 3.699 -7.152 -3.530 884 HA3 GLY 109 HA3 GLY 109 5.410 -7.259 -3.961 885 H PHE 110 H PHE 110 3.282 -8.645 -2.036 886 HA PHE 110 HA PHE 110 4.944 -8.734 0.430 887 HB2 PHE 110 HB2 PHE 110 2.230 -9.861 -0.228 888 HB3 PHE 110 HB3 PHE 110 3.074 -10.191 1.257 889 HD1 PHE 110 HD1 PHE 110 1.911 -7.155 -0.737 890 HD2 PHE 110 HD2 PHE 110 2.789 -8.876 3.127 891 HE1 PHE 110 HE1 PHE 110 0.989 -5.149 0.377 892 HE2 PHE 110 HE2 PHE 110 1.806 -6.899 4.229 893 HZ PHE 110 HZ PHE 110 0.947 -5.003 2.847 894 H THR 111 H THR 111 5.694 -10.588 1.378 895 HA THR 111 HA THR 111 6.918 -12.494 -0.381 896 HB THR 111 HB THR 111 7.859 -11.636 1.734 897 HG1 THR 111 HG1 THR 111 8.815 -13.606 2.223 898 HG21 THR 111 HG21 THR 111 6.057 -13.667 3.114 899 HG22 THR 111 HG22 THR 111 7.322 -12.668 3.858 900 HG23 THR 111 HG23 THR 111 5.865 -11.900 3.214 901 H ASP 112 H ASP 112 4.012 -12.546 1.611 902 HA ASP 112 HA ASP 112 3.299 -15.209 0.490 903 HB2 ASP 112 HB2 ASP 112 3.571 -14.879 3.053 904 HB3 ASP 112 HB3 ASP 112 2.029 -14.016 2.958 905 H ARG 113 H ARG 113 1.452 -15.455 -0.649 906 HA ARG 113 HA ARG 113 -0.019 -13.287 -1.787 907 HB2 ARG 113 HB2 ARG 113 0.242 -15.627 -2.704 908 HB3 ARG 113 HB3 ARG 113 -0.788 -16.226 -1.410 909 HG2 ARG 113 HG2 ARG 113 -2.047 -16.082 -3.462 910 HG3 ARG 113 HG3 ARG 113 -2.699 -14.900 -2.324 911 HD2 ARG 113 HD2 ARG 113 -1.482 -13.087 -3.478 912 HD3 ARG 113 HD3 ARG 113 -0.677 -14.275 -4.515 913 HE ARG 113 HE ARG 113 -2.523 -14.365 -5.889 914 HH11 ARG 113 HH11 ARG 113 -4.334 -13.764 -6.714 915 HH12 ARG 113 HH12 ARG 113 -5.610 -13.003 -5.733 916 HH21 ARG 113 HH21 ARG 113 -3.566 -12.712 -2.966 917 HH22 ARG 113 HH22 ARG 113 -4.952 -12.050 -3.787 918 H GLY 114 H GLY 114 -0.570 -15.177 1.144 919 HA2 GLY 114 HA2 GLY 114 -3.241 -14.199 1.705 920 HA3 GLY 114 HA3 GLY 114 -2.160 -15.082 2.786 921 H ASP 115 H ASP 115 0.035 -12.981 2.453 922 HA ASP 115 HA ASP 115 -0.887 -11.231 4.607 923 HB2 ASP 115 HB2 ASP 115 1.726 -11.353 3.088 924 HB3 ASP 115 HB3 ASP 115 1.367 -10.188 4.367 925 H ALA 116 H ALA 116 -0.199 -10.811 1.137 926 HA ALA 116 HA ALA 116 -1.006 -8.035 1.049 927 HB1 ALA 116 HB1 ALA 116 -1.130 -8.532 -1.413 928 HB2 ALA 116 HB2 ALA 116 0.379 -9.020 -0.694 929 HB3 ALA 116 HB3 ALA 116 -0.852 -10.249 -1.034 930 H PHE 117 H PHE 117 -2.807 -11.144 0.627 931 HA PHE 117 HA PHE 117 -5.310 -9.988 -0.045 932 HB2 PHE 117 HB2 PHE 117 -4.751 -12.366 -0.198 933 HB3 PHE 117 HB3 PHE 117 -4.681 -12.475 1.558 934 HD1 PHE 117 HD1 PHE 117 -6.912 -12.173 -1.373 935 HD2 PHE 117 HD2 PHE 117 -6.694 -12.372 2.922 936 HE1 PHE 117 HE1 PHE 117 -9.328 -12.731 -1.264 937 HE2 PHE 117 HE2 PHE 117 -9.051 -13.080 3.022 938 HZ PHE 117 HZ PHE 117 -10.408 -13.223 0.924 939 H ASP 118 H ASP 118 -3.782 -10.304 3.206 940 HA ASP 118 HA ASP 118 -6.115 -9.289 4.637 941 HB2 ASP 118 HB2 ASP 118 -3.198 -9.665 5.352 942 HB3 ASP 118 HB3 ASP 118 -4.318 -8.851 6.438 943 H PHE 119 H PHE 119 -3.249 -7.772 3.091 944 HA PHE 119 HA PHE 119 -3.647 -5.161 4.097 945 HB2 PHE 119 HB2 PHE 119 -1.618 -5.793 2.962 946 HB3 PHE 119 HB3 PHE 119 -2.468 -6.188 1.494 947 HD1 PHE 119 HD1 PHE 119 -3.553 -4.381 0.090 948 HD2 PHE 119 HD2 PHE 119 -0.813 -3.585 3.290 949 HE1 PHE 119 HE1 PHE 119 -3.112 -2.118 -0.856 950 HE2 PHE 119 HE2 PHE 119 -0.487 -1.292 2.452 951 HZ PHE 119 HZ PHE 119 -1.620 -0.551 0.363 952 H ASN 120 H ASN 120 -5.099 -6.805 1.268 953 HA ASN 120 HA ASN 120 -6.867 -4.631 0.542 954 HB2 ASN 120 HB2 ASN 120 -6.561 -6.116 -1.169 955 HB3 ASN 120 HB3 ASN 120 -6.589 -7.544 -0.122 956 HD21 ASN 120 HD21 ASN 120 -9.965 -8.196 -0.721 957 HD22 ASN 120 HD22 ASN 120 -8.470 -8.711 0.041 958 H VAL 121 H VAL 121 -7.500 -7.596 2.555 959 HA VAL 121 HA VAL 121 -10.222 -6.915 2.981 960 HB VAL 121 HB VAL 121 -8.350 -8.720 4.541 961 HG11 VAL 121 HG11 VAL 121 -10.104 -8.114 6.134 962 HG12 VAL 121 HG12 VAL 121 -11.361 -8.409 4.909 963 HG13 VAL 121 HG13 VAL 121 -10.385 -9.750 5.548 964 HG21 VAL 121 HG21 VAL 121 -8.965 -9.418 2.212 965 HG22 VAL 121 HG22 VAL 121 -9.640 -10.503 3.426 966 HG23 VAL 121 HG23 VAL 121 -10.679 -9.295 2.642 967 H SER 122 H SER 122 -7.366 -5.914 4.843 968 HA SER 122 HA SER 122 -8.674 -4.643 7.015 969 HB2 SER 122 HB2 SER 122 -6.196 -4.991 6.731 970 HB3 SER 122 HB3 SER 122 -6.191 -3.666 5.551 971 HG SER 122 HG SER 122 -7.215 -2.398 7.324 972 H LEU 123 H LEU 123 -8.497 -3.635 3.629 973 HA LEU 123 HA LEU 123 -9.652 -0.973 4.277 974 HB2 LEU 123 HB2 LEU 123 -8.706 -2.094 1.637 975 HB3 LEU 123 HB3 LEU 123 -9.273 -0.450 1.939 976 HG LEU 123 HG LEU 123 -6.749 -1.747 3.044 977 HD11 LEU 123 HD11 LEU 123 -7.105 0.634 1.219 978 HD12 LEU 123 HD12 LEU 123 -5.590 -0.211 1.628 979 HD13 LEU 123 HD13 LEU 123 -6.804 -1.025 0.641 980 HD21 LEU 123 HD21 LEU 123 -7.842 1.057 3.542 981 HD22 LEU 123 HD22 LEU 123 -7.576 -0.205 4.765 982 HD23 LEU 123 HD23 LEU 123 -6.195 0.516 3.937 983 H GLN 124 H GLN 124 -10.514 -4.034 2.603 984 HA GLN 124 HA GLN 124 -13.085 -3.253 1.663 985 HB2 GLN 124 HB2 GLN 124 -12.221 -5.937 2.818 986 HB3 GLN 124 HB3 GLN 124 -13.711 -5.665 1.934 987 HG2 GLN 124 HG2 GLN 124 -10.926 -5.285 0.766 988 HG3 GLN 124 HG3 GLN 124 -11.898 -6.728 0.589 989 HE21 GLN 124 HE21 GLN 124 -12.330 -4.733 -2.505 990 HE22 GLN 124 HE22 GLN 124 -10.965 -5.479 -1.668 991 H ASP 125 H ASP 125 -12.230 -4.676 4.871 992 HA ASP 125 HA ASP 125 -14.911 -4.252 5.937 993 HB2 ASP 125 HB2 ASP 125 -13.237 -6.083 6.550 994 HB3 ASP 125 HB3 ASP 125 -12.313 -4.841 7.409 995 H HIS 126 H HIS 126 -12.411 -2.058 5.423 996 HA HIS 126 HA HIS 126 -13.106 -0.263 7.692 997 HB2 HIS 126 HB2 HIS 126 -10.780 -0.322 7.064 998 HB3 HIS 126 HB3 HIS 126 -11.181 0.032 5.379 999 HD2 HIS 126 HD2 HIS 126 -11.529 1.766 8.857 1000 HE1 HIS 126 HE1 HIS 126 -10.837 4.769 5.920 1001 HE2 HIS 126 HE2 HIS 126 -11.046 4.311 8.419 1002 H PHE 127 H PHE 127 -13.535 -0.499 4.136 1003 HA PHE 127 HA PHE 127 -15.289 1.849 4.203 1004 HB2 PHE 127 HB2 PHE 127 -14.227 0.164 1.949 1005 HB3 PHE 127 HB3 PHE 127 -15.417 1.445 1.723 1006 HD1 PHE 127 HD1 PHE 127 -14.874 3.801 2.733 1007 HD2 PHE 127 HD2 PHE 127 -11.892 0.779 1.994 1008 HE1 PHE 127 HE1 PHE 127 -13.096 5.526 2.806 1009 HE2 PHE 127 HE2 PHE 127 -10.120 2.513 2.035 1010 HZ PHE 127 HZ PHE 127 -10.723 4.896 2.410 1011 H LYS 128 H LYS 128 -15.839 -1.573 4.470 1012 HA LYS 128 HA LYS 128 -18.354 -1.780 3.308 1013 HB2 LYS 128 HB2 LYS 128 -18.660 -3.818 4.370 1014 HB3 LYS 128 HB3 LYS 128 -16.950 -3.650 4.099 1015 HG2 LYS 128 HG2 LYS 128 -16.921 -4.505 6.205 1016 HG3 LYS 128 HG3 LYS 128 -16.937 -2.782 6.627 1017 HD2 LYS 128 HD2 LYS 128 -19.492 -3.066 6.799 1018 HD3 LYS 128 HD3 LYS 128 -19.216 -4.794 6.566 1019 HE2 LYS 128 HE2 LYS 128 -17.942 -3.182 8.808 1020 HE3 LYS 128 HE3 LYS 128 -19.553 -3.891 8.952 1021 HZ1 LYS 128 HZ1 LYS 128 -17.047 -5.423 8.476 1022 HZ2 LYS 128 HZ2 LYS 128 -17.905 -5.391 9.859 1023 HZ3 LYS 128 HZ3 LYS 128 -18.549 -6.085 8.530 1024 H TRP 129 H TRP 129 -17.712 -0.236 6.362 1025 HA TRP 129 HA TRP 129 -20.621 -0.087 7.014 1026 HB2 TRP 129 HB2 TRP 129 -19.837 0.537 9.261 1027 HB3 TRP 129 HB3 TRP 129 -19.321 -1.047 8.729 1028 HD1 TRP 129 HD1 TRP 129 -16.721 -1.508 8.482 1029 HE1 TRP 129 HE1 TRP 129 -14.638 -0.229 9.076 1030 HE3 TRP 129 HE3 TRP 129 -18.843 3.037 9.461 1031 HZ2 TRP 129 HZ2 TRP 129 -13.910 2.475 9.896 1032 HZ3 TRP 129 HZ3 TRP 129 -17.408 4.991 10.068 1033 HH2 TRP 129 HH2 TRP 129 -14.957 4.714 10.297 1034 H VAL 130 H VAL 130 -18.728 1.698 5.173 1035 HA VAL 130 HA VAL 130 -20.072 4.296 5.751 1036 HB VAL 130 HB VAL 130 -17.598 5.133 4.856 1037 HG11 VAL 130 HG11 VAL 130 -18.681 4.895 7.681 1038 HG12 VAL 130 HG12 VAL 130 -17.345 5.951 7.194 1039 HG13 VAL 130 HG13 VAL 130 -18.971 6.225 6.542 1040 HG21 VAL 130 HG21 VAL 130 -15.872 4.260 6.203 1041 HG22 VAL 130 HG22 VAL 130 -16.961 3.104 6.985 1042 HG23 VAL 130 HG23 VAL 130 -16.589 2.941 5.267 1043 H LYS 131 H LYS 131 -18.622 5.490 3.525 1044 HA LYS 131 HA LYS 131 -18.837 5.940 1.394 1045 HB2 LYS 131 HB2 LYS 131 -17.285 3.964 1.715 1046 HB3 LYS 131 HB3 LYS 131 -18.582 2.924 1.136 1047 HG2 LYS 131 HG2 LYS 131 -16.887 3.412 -0.533 1048 HG3 LYS 131 HG3 LYS 131 -18.499 3.936 -1.027 1049 HD2 LYS 131 HD2 LYS 131 -17.876 6.303 -0.477 1050 HD3 LYS 131 HD3 LYS 131 -16.285 5.732 0.051 1051 HE2 LYS 131 HE2 LYS 131 -16.099 6.614 -2.205 1052 HE3 LYS 131 HE3 LYS 131 -15.868 4.860 -2.260 1053 HZ1 LYS 131 HZ1 LYS 131 -18.399 6.270 -2.944 1054 HZ2 LYS 131 HZ2 LYS 131 -17.362 5.624 -4.025 1055 HZ3 LYS 131 HZ3 LYS 131 -18.186 4.650 -3.006 1056 H GLN 132 H GLN 132 -21.401 5.237 2.692 1057 HA GLN 132 HA GLN 132 -23.591 5.382 2.246 1058 HB2 GLN 132 HB2 GLN 132 -23.141 6.582 -0.451 1059 HB3 GLN 132 HB3 GLN 132 -24.251 7.041 0.826 1060 HG2 GLN 132 HG2 GLN 132 -21.340 7.748 0.450 1061 HG3 GLN 132 HG3 GLN 132 -22.722 8.815 0.654 1062 HE21 GLN 132 HE21 GLN 132 -22.664 8.219 4.327 1063 HE22 GLN 132 HE22 GLN 132 -23.871 8.199 3.045 1064 H GLU 133 H GLU 133 -22.358 2.855 1.338 1065 HA GLU 133 HA GLU 133 -24.506 1.898 -0.482 1066 HB2 GLU 133 HB2 GLU 133 -22.944 0.675 -1.850 1067 HB3 GLU 133 HB3 GLU 133 -22.603 2.398 -1.903 1068 HG2 GLU 133 HG2 GLU 133 -20.683 2.071 -0.343 1069 HG3 GLU 133 HG3 GLU 133 -21.046 0.349 -0.261 1070 H1 SER 149 H1 SER 149 5.071 -23.032 -9.094 1071 H2 SER 149 H2 SER 149 6.339 -23.237 -8.076 1072 H3 SER 149 H3 SER 149 6.140 -21.808 -8.857 1073 HA SER 149 HA SER 149 4.090 -21.394 -7.654 1074 HB2 SER 149 HB2 SER 149 3.560 -22.896 -5.723 1075 HB3 SER 149 HB3 SER 149 3.402 -23.692 -7.294 1076 HG SER 149 HG SER 149 4.549 -24.985 -5.783 1077 H GLN 150 H GLN 150 4.051 -20.642 -5.340 1078 HA GLN 150 HA GLN 150 4.780 -19.375 -3.687 1079 HB2 GLN 150 HB2 GLN 150 7.297 -21.057 -3.638 1080 HB3 GLN 150 HB3 GLN 150 6.645 -20.073 -2.335 1081 HG2 GLN 150 HG2 GLN 150 5.401 -22.604 -3.498 1082 HG3 GLN 150 HG3 GLN 150 6.167 -22.421 -1.929 1083 HE21 GLN 150 HE21 GLN 150 3.302 -20.820 -0.430 1084 HE22 GLN 150 HE22 GLN 150 5.045 -21.003 -0.288 1085 H ILE 151 H ILE 151 7.567 -19.644 -5.936 1086 HA ILE 151 HA ILE 151 8.767 -17.172 -5.179 1087 HB ILE 151 HB ILE 151 9.808 -19.106 -6.394 1088 HG12 ILE 151 HG12 ILE 151 10.319 -16.426 -7.740 1089 HG13 ILE 151 HG13 ILE 151 10.866 -16.845 -6.112 1090 HG21 ILE 151 HG21 ILE 151 8.621 -17.855 -8.910 1091 HG22 ILE 151 HG22 ILE 151 9.655 -19.294 -8.805 1092 HG23 ILE 151 HG23 ILE 151 8.017 -19.344 -8.155 1093 HD11 ILE 151 HD11 ILE 151 12.682 -17.175 -7.671 1094 HD12 ILE 151 HD12 ILE 151 12.162 -18.760 -7.062 1095 HD13 ILE 151 HD13 ILE 151 11.694 -18.226 -8.697 1096 H THR 152 H THR 152 8.981 -15.184 -6.482 1097 HA THR 152 HA THR 152 6.420 -14.109 -7.352 1098 HB THR 152 HB THR 152 8.035 -12.170 -8.048 1099 HG1 THR 152 HG1 THR 152 9.902 -12.178 -6.706 1100 HG21 THR 152 HG21 THR 152 7.934 -11.235 -5.858 1101 HG22 THR 152 HG22 THR 152 6.455 -12.160 -6.123 1102 HG23 THR 152 HG23 THR 152 7.740 -12.845 -5.102 1103 H SER 153 H SER 153 5.626 -13.968 -9.309 1104 HA SER 153 HA SER 153 7.121 -13.447 -11.652 1105 HB2 SER 153 HB2 SER 153 6.549 -15.462 -12.994 1106 HB3 SER 153 HB3 SER 153 7.817 -15.679 -11.794 1107 HG SER 153 HG SER 153 5.085 -16.436 -11.459 1108 H GLN 154 H GLN 154 5.794 -11.933 -12.192 1109 HA GLN 154 HA GLN 154 4.114 -10.739 -13.036 1110 HB2 GLN 154 HB2 GLN 154 3.017 -13.330 -14.098 1111 HB3 GLN 154 HB3 GLN 154 2.780 -11.691 -14.727 1112 HG2 GLN 154 HG2 GLN 154 5.297 -11.594 -15.131 1113 HG3 GLN 154 HG3 GLN 154 5.352 -13.320 -14.764 1114 HE21 GLN 154 HE21 GLN 154 3.892 -12.064 -18.375 1115 HE22 GLN 154 HE22 GLN 154 4.335 -10.901 -17.119 1116 H VAL 155 H VAL 155 1.663 -10.440 -13.319 1117 HA VAL 155 HA VAL 155 0.315 -10.933 -10.732 1118 HB VAL 155 HB VAL 155 -0.981 -9.481 -13.044 1119 HG11 VAL 155 HG11 VAL 155 -2.136 -8.200 -11.231 1120 HG12 VAL 155 HG12 VAL 155 -2.334 -9.921 -11.019 1121 HG13 VAL 155 HG13 VAL 155 -1.188 -9.021 -10.013 1122 HG21 VAL 155 HG21 VAL 155 1.187 -8.307 -12.824 1123 HG22 VAL 155 HG22 VAL 155 -0.202 -7.330 -12.309 1124 HG23 VAL 155 HG23 VAL 155 0.848 -8.085 -11.077 1125 H TPO 156 H T2P 156 -1.009 -12.737 -10.603 1126 HA TPO 156 HA T2P 156 -2.156 -14.420 -12.648 1127 HB TPO 156 HB T2P 156 -3.549 -13.439 -10.191 1128 HG21 TPO 156 HG21 T2P 156 -4.904 -15.489 -10.358 1129 HG22 TPO 156 HG22 T2P 156 -4.244 -15.708 -12.004 1130 HG23 TPO 156 HG23 T2P 156 -5.173 -14.230 -11.547 1131 H GLY 157 H GLY 157 -3.808 -14.191 -13.909 1132 HA2 GLY 157 HA2 GLY 157 -5.279 -11.602 -14.209 1133 HA3 GLY 157 HA3 GLY 157 -4.174 -12.079 -15.496 1134 H GLN 158 H GLN 158 -5.053 -15.023 -15.040 1135 HA GLN 158 HA GLN 158 -7.305 -15.037 -16.839 1136 HB2 GLN 158 HB2 GLN 158 -7.198 -17.432 -16.680 1137 HB3 GLN 158 HB3 GLN 158 -5.576 -16.771 -16.855 1138 HG2 GLN 158 HG2 GLN 158 -5.167 -17.117 -14.420 1139 HG3 GLN 158 HG3 GLN 158 -6.813 -17.728 -14.225 1140 HE21 GLN 158 HE21 GLN 158 -3.998 -20.152 -16.003 1141 HE22 GLN 158 HE22 GLN 158 -3.680 -18.427 -15.894 1142 H ILE 159 H ILE 159 -7.169 -14.750 -13.408 1143 HA ILE 159 HA ILE 159 -10.111 -15.012 -13.262 1144 HB ILE 159 HB ILE 159 -9.182 -17.258 -12.852 1145 HG12 ILE 159 HG12 ILE 159 -10.341 -17.763 -10.708 1146 HG13 ILE 159 HG13 ILE 159 -10.557 -16.034 -10.438 1147 HG21 ILE 159 HG21 ILE 159 -7.952 -17.823 -10.836 1148 HG22 ILE 159 HG22 ILE 159 -7.031 -16.676 -11.805 1149 HG23 ILE 159 HG23 ILE 159 -7.892 -16.126 -10.350 1150 HD11 ILE 159 HD11 ILE 159 -12.573 -17.144 -11.378 1151 HD12 ILE 159 HD12 ILE 159 -11.974 -15.861 -12.440 1152 HD13 ILE 159 HD13 ILE 159 -11.652 -17.568 -12.834 1153 H GLY 160 H GLY 160 -7.193 -13.988 -11.529 1154 HA2 GLY 160 HA2 GLY 160 -6.837 -12.157 -10.142 1155 HA3 GLY 160 HA3 GLY 160 -8.401 -11.515 -10.661 1156 H TRP 161 H TRP 161 -7.522 -14.475 -8.855 1157 HA TRP 161 HA TRP 161 -9.788 -14.042 -7.044 1158 HB2 TRP 161 HB2 TRP 161 -9.742 -16.399 -6.713 1159 HB3 TRP 161 HB3 TRP 161 -9.698 -16.026 -8.408 1160 HD1 TRP 161 HD1 TRP 161 -6.249 -15.523 -7.665 1161 HE1 TRP 161 HE1 TRP 161 -4.847 -17.543 -8.259 1162 HE3 TRP 161 HE3 TRP 161 -9.956 -19.023 -7.525 1163 HZ2 TRP 161 HZ2 TRP 161 -5.285 -20.421 -8.590 1164 HZ3 TRP 161 HZ3 TRP 161 -9.436 -21.428 -7.969 1165 HH2 TRP 161 HH2 TRP 161 -7.113 -22.129 -8.511 1166 H ARG 162 H ARG 162 -8.459 -16.157 -5.317 1167 HA ARG 162 HA ARG 162 -7.723 -14.144 -3.251 1168 HB2 ARG 162 HB2 ARG 162 -10.064 -16.110 -3.245 1169 HB3 ARG 162 HB3 ARG 162 -9.778 -14.849 -2.048 1170 HG2 ARG 162 HG2 ARG 162 -10.616 -14.519 -4.955 1171 HG3 ARG 162 HG3 ARG 162 -11.629 -14.267 -3.553 1172 HD2 ARG 162 HD2 ARG 162 -10.799 -12.158 -3.121 1173 HD3 ARG 162 HD3 ARG 162 -9.173 -12.564 -3.643 1174 HE ARG 162 HE ARG 162 -9.612 -11.906 -5.789 1175 HH11 ARG 162 HH11 ARG 162 -10.723 -11.171 -7.501 1176 HH12 ARG 162 HH12 ARG 162 -12.414 -10.746 -7.350 1177 HH21 ARG 162 HH21 ARG 162 -12.706 -11.921 -4.127 1178 HH22 ARG 162 HH22 ARG 162 -13.526 -11.212 -5.490 1179 H ARG 163 H ARG 163 -7.592 -15.243 -1.015 1180 HA ARG 163 HA ARG 163 -5.837 -17.593 -1.184 1181 HB2 ARG 163 HB2 ARG 163 -5.241 -17.247 1.017 1182 HB3 ARG 163 HB3 ARG 163 -5.389 -15.638 0.321 1183 HG2 ARG 163 HG2 ARG 163 -7.668 -15.447 1.434 1184 HG3 ARG 163 HG3 ARG 163 -7.364 -17.022 2.210 1185 HD2 ARG 163 HD2 ARG 163 -5.252 -16.110 3.181 1186 HD3 ARG 163 HD3 ARG 163 -5.632 -14.545 2.425 1187 HE ARG 163 HE ARG 163 -7.784 -15.304 4.133 1188 HH11 ARG 163 HH11 ARG 163 -8.116 -13.847 5.883 1189 HH12 ARG 163 HH12 ARG 163 -6.779 -12.794 6.322 1190 HH21 ARG 163 HH21 ARG 163 -4.468 -14.150 4.314 1191 HH22 ARG 163 HH22 ARG 163 -4.798 -13.115 5.673 Start of MODEL 25 1 H1 GLY -4 H1 GLY -4 10.424 20.537 2.144 2 H2 GLY -4 H2 GLY -4 11.605 20.715 3.269 3 H3 GLY -4 H3 GLY -4 10.654 21.991 2.866 4 HA2 GLY -4 HA2 GLY -4 9.718 19.531 4.192 5 HA3 GLY -4 HA3 GLY -4 10.003 21.078 5.012 6 H SER -3 H SER -3 7.508 19.622 4.925 7 HA SER -3 HA SER -3 5.644 20.681 3.062 8 HB2 SER -3 HB2 SER -3 5.270 19.602 5.880 9 HB3 SER -3 HB3 SER -3 3.941 19.942 4.757 10 HG SER -3 HG SER -3 4.667 17.739 4.710 11 HA PRO -2 HA PRO -2 4.992 24.795 4.414 12 HB2 PRO -2 HB2 PRO -2 2.422 25.359 3.650 13 HB3 PRO -2 HB3 PRO -2 3.745 25.037 2.489 14 HG2 PRO -2 HG2 PRO -2 1.684 23.068 3.544 15 HG3 PRO -2 HG3 PRO -2 2.123 23.397 1.834 16 HD2 PRO -2 HD2 PRO -2 3.220 21.324 3.177 17 HD3 PRO -2 HD3 PRO -2 4.215 22.310 2.065 18 H ASN -1 H ASN -1 3.126 22.354 5.993 19 HA ASN -1 HA ASN -1 2.799 24.072 8.365 20 HB2 ASN -1 HB2 ASN -1 0.648 24.115 6.960 21 HB3 ASN -1 HB3 ASN -1 0.495 22.388 7.282 22 HD21 ASN -1 HD21 ASN -1 -1.601 23.710 9.884 23 HD22 ASN -1 HD22 ASN -1 -1.623 23.139 8.222 24 H SER 0 H SER 0 2.235 22.739 10.307 25 HA SER 0 HA SER 0 3.140 19.899 10.189 26 HB2 SER 0 HB2 SER 0 5.050 21.237 10.956 27 HB3 SER 0 HB3 SER 0 4.051 21.945 12.242 28 HG SER 0 HG SER 0 5.345 20.108 12.905 29 H MET 1 H MET 1 2.201 18.534 11.659 30 HA MET 1 HA MET 1 -0.369 19.488 12.829 31 HB2 MET 1 HB2 MET 1 0.522 16.682 12.075 32 HB3 MET 1 HB3 MET 1 -1.070 17.144 12.680 33 HG2 MET 1 HG2 MET 1 0.182 18.008 10.050 34 HG3 MET 1 HG3 MET 1 -1.131 16.859 10.271 35 HE1 MET 1 HE1 MET 1 -2.497 18.104 8.391 36 HE2 MET 1 HE2 MET 1 -2.843 19.847 8.404 37 HE3 MET 1 HE3 MET 1 -1.171 19.276 8.200 38 H ALA 2 H ALA 2 2.651 19.048 14.049 39 HA ALA 2 HA ALA 2 2.320 17.272 16.216 40 HB1 ALA 2 HB1 ALA 2 4.377 18.335 17.064 41 HB2 ALA 2 HB2 ALA 2 4.478 18.056 15.316 42 HB3 ALA 2 HB3 ALA 2 4.155 19.693 15.940 43 H THR 3 H THR 3 1.103 20.528 15.955 44 HA THR 3 HA THR 3 0.580 20.798 18.866 45 HB THR 3 HB THR 3 -0.142 23.085 18.259 46 HG1 THR 3 HG1 THR 3 0.185 23.768 16.131 47 HG21 THR 3 HG21 THR 3 2.550 22.372 17.017 48 HG22 THR 3 HG22 THR 3 2.048 23.959 17.649 49 HG23 THR 3 HG23 THR 3 2.261 22.588 18.757 50 H GLU 4 H GLU 4 -0.980 19.458 16.264 51 HA GLU 4 HA GLU 4 -3.728 20.278 17.033 52 HB2 GLU 4 HB2 GLU 4 -2.946 20.479 14.669 53 HB3 GLU 4 HB3 GLU 4 -2.712 18.735 14.612 54 HG2 GLU 4 HG2 GLU 4 -4.760 19.398 13.484 55 HG3 GLU 4 HG3 GLU 4 -5.124 18.356 14.846 56 H LEU 5 H LEU 5 -5.434 18.664 17.166 57 HA LEU 5 HA LEU 5 -4.677 16.217 18.561 58 HB2 LEU 5 HB2 LEU 5 -7.012 15.805 18.922 59 HB3 LEU 5 HB3 LEU 5 -6.373 17.296 19.587 60 HG LEU 5 HG LEU 5 -7.421 18.629 17.921 61 HD11 LEU 5 HD11 LEU 5 -8.318 16.017 16.652 62 HD12 LEU 5 HD12 LEU 5 -8.934 17.629 16.187 63 HD13 LEU 5 HD13 LEU 5 -7.222 17.229 15.958 64 HD21 LEU 5 HD21 LEU 5 -8.754 17.906 19.863 65 HD22 LEU 5 HD22 LEU 5 -9.785 18.153 18.438 66 HD23 LEU 5 HD23 LEU 5 -9.341 16.503 18.944 67 H GLU 6 H GLU 6 -4.027 16.535 15.630 68 HA GLU 6 HA GLU 6 -5.512 14.743 14.039 69 HB2 GLU 6 HB2 GLU 6 -2.684 15.794 14.004 70 HB3 GLU 6 HB3 GLU 6 -3.120 14.506 12.885 71 HG2 GLU 6 HG2 GLU 6 -4.761 17.050 13.057 72 HG3 GLU 6 HG3 GLU 6 -3.320 16.934 12.054 73 H TYR 7 H TYR 7 -5.495 12.500 13.760 74 HA TYR 7 HA TYR 7 -3.462 10.820 15.006 75 HB2 TYR 7 HB2 TYR 7 -4.850 9.691 16.529 76 HB3 TYR 7 HB3 TYR 7 -5.168 11.385 16.833 77 HD1 TYR 7 HD1 TYR 7 -6.571 8.166 15.939 78 HD2 TYR 7 HD2 TYR 7 -7.335 12.416 15.895 79 HE1 TYR 7 HE1 TYR 7 -8.975 7.715 15.614 80 HE2 TYR 7 HE2 TYR 7 -9.765 11.968 15.589 81 HH TYR 7 HH TYR 7 -11.079 8.631 15.389 82 H GLU 8 H GLU 8 -4.139 8.487 14.893 83 HA GLU 8 HA GLU 8 -6.052 7.573 12.992 84 HB2 GLU 8 HB2 GLU 8 -4.524 6.432 11.450 85 HB3 GLU 8 HB3 GLU 8 -4.496 8.162 11.245 86 HG2 GLU 8 HG2 GLU 8 -2.388 6.757 12.923 87 HG3 GLU 8 HG3 GLU 8 -2.276 6.846 11.185 88 H SER 9 H SER 9 -6.668 5.631 13.608 89 HA SER 9 HA SER 9 -5.274 4.272 15.813 90 HB2 SER 9 HB2 SER 9 -8.054 4.049 14.650 91 HB3 SER 9 HB3 SER 9 -7.454 3.038 15.982 92 HG SER 9 HG SER 9 -8.569 4.888 16.762 93 H VAL 10 H VAL 10 -4.342 2.216 15.625 94 HA VAL 10 HA VAL 10 -3.735 1.202 13.034 95 HB VAL 10 HB VAL 10 -3.558 -0.228 15.676 96 HG11 VAL 10 HG11 VAL 10 -2.119 -0.773 13.034 97 HG12 VAL 10 HG12 VAL 10 -1.751 -1.561 14.586 98 HG13 VAL 10 HG13 VAL 10 -3.310 -1.836 13.823 99 HG21 VAL 10 HG21 VAL 10 -2.252 1.904 15.662 100 HG22 VAL 10 HG22 VAL 10 -1.217 0.483 15.735 101 HG23 VAL 10 HG23 VAL 10 -1.405 1.352 14.200 102 H LEU 11 H LEU 11 -4.592 -0.204 11.709 103 HA LEU 11 HA LEU 11 -7.056 -1.733 12.459 104 HB2 LEU 11 HB2 LEU 11 -6.073 -0.841 9.720 105 HB3 LEU 11 HB3 LEU 11 -7.525 -1.772 10.050 106 HG LEU 11 HG LEU 11 -7.023 1.139 10.791 107 HD11 LEU 11 HD11 LEU 11 -7.512 0.808 8.446 108 HD12 LEU 11 HD12 LEU 11 -8.841 -0.308 8.820 109 HD13 LEU 11 HD13 LEU 11 -8.996 1.406 9.208 110 HD21 LEU 11 HD21 LEU 11 -9.397 1.153 11.546 111 HD22 LEU 11 HD22 LEU 11 -9.442 -0.618 11.390 112 HD23 LEU 11 HD23 LEU 11 -8.369 0.165 12.580 113 H CYS 12 H CYS 12 -3.915 -1.936 10.716 114 HA CYS 12 HA CYS 12 -3.840 -4.849 11.122 115 HB2 CYS 12 HB2 CYS 12 -5.123 -4.484 9.016 116 HB3 CYS 12 HB3 CYS 12 -3.703 -3.700 8.311 117 HG CYS 12 HG CYS 12 -3.964 -6.133 7.370 118 H VAL 13 H VAL 13 -1.850 -5.761 10.998 119 HA VAL 13 HA VAL 13 0.503 -4.119 10.369 120 HB VAL 13 HB VAL 13 0.220 -3.779 12.743 121 HG11 VAL 13 HG11 VAL 13 0.415 -6.783 13.169 122 HG12 VAL 13 HG12 VAL 13 0.348 -5.527 14.415 123 HG13 VAL 13 HG13 VAL 13 -1.054 -5.803 13.378 124 HG21 VAL 13 HG21 VAL 13 2.524 -3.954 11.895 125 HG22 VAL 13 HG22 VAL 13 2.383 -4.518 13.562 126 HG23 VAL 13 HG23 VAL 13 2.530 -5.698 12.245 127 H LYS 14 H LYS 14 1.940 -5.244 9.224 128 HA LYS 14 HA LYS 14 1.863 -8.201 9.364 129 HB2 LYS 14 HB2 LYS 14 1.798 -6.637 6.763 130 HB3 LYS 14 HB3 LYS 14 2.385 -8.276 6.826 131 HG2 LYS 14 HG2 LYS 14 -0.389 -7.425 7.750 132 HG3 LYS 14 HG3 LYS 14 0.015 -8.096 6.167 133 HD2 LYS 14 HD2 LYS 14 0.890 -10.164 7.281 134 HD3 LYS 14 HD3 LYS 14 0.324 -9.542 8.850 135 HE2 LYS 14 HE2 LYS 14 -1.956 -9.426 8.056 136 HE3 LYS 14 HE3 LYS 14 -1.438 -9.884 6.423 137 HZ1 LYS 14 HZ1 LYS 14 -2.349 -11.768 7.563 138 HZ2 LYS 14 HZ2 LYS 14 -0.738 -12.034 7.303 139 HZ3 LYS 14 HZ3 LYS 14 -1.281 -11.638 8.808 140 HA PRO 15 HA PRO 15 5.943 -8.045 10.392 141 HB2 PRO 15 HB2 PRO 15 6.774 -10.624 9.993 142 HB3 PRO 15 HB3 PRO 15 5.510 -10.180 11.177 143 HG2 PRO 15 HG2 PRO 15 5.092 -11.174 8.323 144 HG3 PRO 15 HG3 PRO 15 4.338 -11.798 9.829 145 HD2 PRO 15 HD2 PRO 15 3.067 -10.031 8.271 146 HD3 PRO 15 HD3 PRO 15 2.986 -9.909 10.056 147 H ASP 16 H ASP 16 5.414 -8.966 7.021 148 HA ASP 16 HA ASP 16 7.976 -7.690 6.329 149 HB2 ASP 16 HB2 ASP 16 8.479 -10.116 6.448 150 HB3 ASP 16 HB3 ASP 16 7.222 -10.419 5.244 151 H VAL 17 H VAL 17 7.818 -6.390 4.655 152 HA VAL 17 HA VAL 17 5.973 -6.900 2.433 153 HB VAL 17 HB VAL 17 4.575 -5.585 3.927 154 HG11 VAL 17 HG11 VAL 17 5.058 -3.271 4.528 155 HG12 VAL 17 HG12 VAL 17 6.262 -4.366 5.220 156 HG13 VAL 17 HG13 VAL 17 6.670 -3.390 3.797 157 HG21 VAL 17 HG21 VAL 17 4.381 -5.262 1.485 158 HG22 VAL 17 HG22 VAL 17 3.910 -3.834 2.417 159 HG23 VAL 17 HG23 VAL 17 5.482 -3.864 1.598 160 H SER 18 H SER 18 6.798 -6.191 0.508 161 HA SER 18 HA SER 18 9.396 -4.707 0.570 162 HB2 SER 18 HB2 SER 18 10.238 -6.089 -1.106 163 HB3 SER 18 HB3 SER 18 9.499 -7.175 0.061 164 HG SER 18 HG SER 18 7.604 -7.118 -1.384 165 H VAL 19 H VAL 19 9.847 -3.162 -0.990 166 HA VAL 19 HA VAL 19 7.488 -2.179 -2.560 167 HB VAL 19 HB VAL 19 9.330 -0.597 -0.774 168 HG11 VAL 19 HG11 VAL 19 7.243 0.332 -2.773 169 HG12 VAL 19 HG12 VAL 19 7.925 1.363 -1.507 170 HG13 VAL 19 HG13 VAL 19 8.980 0.737 -2.764 171 HG21 VAL 19 HG21 VAL 19 7.459 -1.736 0.381 172 HG22 VAL 19 HG22 VAL 19 7.175 0.001 0.307 173 HG23 VAL 19 HG23 VAL 19 6.316 -1.078 -0.803 174 H TYR 20 H TYR 20 7.743 -1.595 -4.508 175 HA TYR 20 HA TYR 20 10.364 -2.068 -5.790 176 HB2 TYR 20 HB2 TYR 20 7.543 -1.984 -6.904 177 HB3 TYR 20 HB3 TYR 20 8.961 -2.481 -7.801 178 HD1 TYR 20 HD1 TYR 20 10.457 -4.342 -6.374 179 HD2 TYR 20 HD2 TYR 20 6.195 -3.754 -6.213 180 HE1 TYR 20 HE1 TYR 20 10.161 -6.663 -5.495 181 HE2 TYR 20 HE2 TYR 20 5.900 -6.128 -5.585 182 HH TYR 20 HH TYR 20 8.663 -8.265 -4.812 183 H ARG 21 H ARG 21 8.641 0.673 -5.151 184 HA ARG 21 HA ARG 21 8.522 2.867 -5.996 185 HB2 ARG 21 HB2 ARG 21 11.499 2.292 -6.211 186 HB3 ARG 21 HB3 ARG 21 10.753 3.890 -6.097 187 HG2 ARG 21 HG2 ARG 21 9.865 3.300 -3.826 188 HG3 ARG 21 HG3 ARG 21 10.637 1.709 -3.973 189 HD2 ARG 21 HD2 ARG 21 12.135 2.973 -2.683 190 HD3 ARG 21 HD3 ARG 21 12.827 2.858 -4.311 191 HE ARG 21 HE ARG 21 11.278 5.284 -3.958 192 HH11 ARG 21 HH11 ARG 21 12.323 7.249 -3.828 193 HH12 ARG 21 HH12 ARG 21 14.027 7.308 -3.487 194 HH21 ARG 21 HH21 ARG 21 14.454 3.896 -3.300 195 HH22 ARG 21 HH22 ARG 21 15.198 5.475 -3.188 196 H ILE 22 H ILE 22 7.283 2.630 -7.798 197 HA ILE 22 HA ILE 22 8.426 1.614 -10.236 198 HB ILE 22 HB ILE 22 6.131 1.422 -10.998 199 HG12 ILE 22 HG12 ILE 22 5.444 3.101 -8.549 200 HG13 ILE 22 HG13 ILE 22 5.113 3.450 -10.247 201 HG21 ILE 22 HG21 ILE 22 6.467 0.537 -8.107 202 HG22 ILE 22 HG22 ILE 22 5.370 -0.149 -9.311 203 HG23 ILE 22 HG23 ILE 22 7.118 -0.279 -9.535 204 HD11 ILE 22 HD11 ILE 22 3.791 1.361 -8.507 205 HD12 ILE 22 HD12 ILE 22 3.078 2.808 -9.234 206 HD13 ILE 22 HD13 ILE 22 3.573 1.450 -10.275 207 HA PRO 23 HA PRO 23 8.584 5.448 -12.491 208 HB2 PRO 23 HB2 PRO 23 8.683 4.471 -15.109 209 HB3 PRO 23 HB3 PRO 23 10.043 4.714 -13.983 210 HG2 PRO 23 HG2 PRO 23 8.692 2.171 -14.748 211 HG3 PRO 23 HG3 PRO 23 10.351 2.441 -14.172 212 HD2 PRO 23 HD2 PRO 23 8.212 1.451 -12.626 213 HD3 PRO 23 HD3 PRO 23 9.742 2.117 -11.995 214 HA PRO 24 HA PRO 24 4.698 5.487 -15.173 215 HB2 PRO 24 HB2 PRO 24 2.904 3.464 -15.377 216 HB3 PRO 24 HB3 PRO 24 4.476 3.431 -16.234 217 HG2 PRO 24 HG2 PRO 24 3.801 2.156 -13.554 218 HG3 PRO 24 HG3 PRO 24 4.542 1.376 -14.992 219 HD2 PRO 24 HD2 PRO 24 6.048 2.348 -12.952 220 HD3 PRO 24 HD3 PRO 24 6.585 2.486 -14.653 221 H ARG 25 H ARG 25 2.462 6.055 -14.951 222 HA ARG 25 HA ARG 25 1.225 5.825 -12.222 223 HB2 ARG 25 HB2 ARG 25 0.311 8.016 -12.412 224 HB3 ARG 25 HB3 ARG 25 2.059 8.107 -12.637 225 HG2 ARG 25 HG2 ARG 25 1.699 8.252 -15.124 226 HG3 ARG 25 HG3 ARG 25 -0.045 8.167 -14.858 227 HD2 ARG 25 HD2 ARG 25 0.518 10.477 -15.182 228 HD3 ARG 25 HD3 ARG 25 0.064 10.248 -13.500 229 HE ARG 25 HE ARG 25 2.222 10.775 -12.817 230 HH11 ARG 25 HH11 ARG 25 4.279 11.572 -13.029 231 HH12 ARG 25 HH12 ARG 25 5.012 11.683 -14.601 232 HH21 ARG 25 HH21 ARG 25 2.329 10.403 -16.304 233 HH22 ARG 25 HH22 ARG 25 3.948 11.039 -16.407 234 H ALA 26 H ALA 26 0.627 5.524 -15.644 235 HA ALA 26 HA ALA 26 -1.848 4.085 -15.089 236 HB1 ALA 26 HB1 ALA 26 -1.946 6.799 -16.481 237 HB2 ALA 26 HB2 ALA 26 -3.306 5.653 -16.297 238 HB3 ALA 26 HB3 ALA 26 -2.587 6.431 -14.870 239 H SER 27 H SER 27 -1.373 2.418 -16.205 240 HA SER 27 HA SER 27 -0.997 2.618 -19.165 241 HB2 SER 27 HB2 SER 27 0.591 1.109 -18.090 242 HB3 SER 27 HB3 SER 27 -0.737 0.205 -17.336 243 HG SER 27 HG SER 27 0.229 -0.541 -19.466 244 H ASN 28 H ASN 28 -2.380 1.256 -20.422 245 HA ASN 28 HA ASN 28 -5.135 1.667 -20.087 246 HB2 ASN 28 HB2 ASN 28 -5.351 0.476 -22.121 247 HB3 ASN 28 HB3 ASN 28 -3.810 1.310 -22.217 248 HD21 ASN 28 HD21 ASN 28 -2.031 -1.946 -21.891 249 HD22 ASN 28 HD22 ASN 28 -1.959 -0.457 -20.981 250 H ARG 29 H ARG 29 -3.237 -0.985 -18.811 251 HA ARG 29 HA ARG 29 -5.717 -2.454 -17.962 252 HB2 ARG 29 HB2 ARG 29 -2.866 -3.457 -17.705 253 HB3 ARG 29 HB3 ARG 29 -4.363 -4.380 -17.600 254 HG2 ARG 29 HG2 ARG 29 -3.088 -3.175 -20.063 255 HG3 ARG 29 HG3 ARG 29 -3.283 -4.886 -19.683 256 HD2 ARG 29 HD2 ARG 29 -5.778 -4.611 -19.865 257 HD3 ARG 29 HD3 ARG 29 -5.524 -2.915 -20.289 258 HE ARG 29 HE ARG 29 -4.722 -3.449 -22.378 259 HH11 ARG 29 HH11 ARG 29 -4.636 -4.690 -24.191 260 HH12 ARG 29 HH12 ARG 29 -4.869 -6.412 -24.101 261 HH21 ARG 29 HH21 ARG 29 -5.354 -6.472 -20.701 262 HH22 ARG 29 HH22 ARG 29 -5.271 -7.403 -22.171 263 H GLY 30 H GLY 30 -3.778 -0.123 -16.756 264 HA2 GLY 30 HA2 GLY 30 -4.296 0.597 -14.418 265 HA3 GLY 30 HA3 GLY 30 -3.943 -1.073 -13.915 266 H TYR 31 H TYR 31 -1.882 -1.623 -13.485 267 HA TYR 31 HA TYR 31 0.363 0.281 -14.151 268 HB2 TYR 31 HB2 TYR 31 -0.328 -1.117 -11.557 269 HB3 TYR 31 HB3 TYR 31 1.295 -0.567 -11.919 270 HD1 TYR 31 HD1 TYR 31 -2.138 0.538 -11.209 271 HD2 TYR 31 HD2 TYR 31 1.937 1.704 -11.999 272 HE1 TYR 31 HE1 TYR 31 -2.598 2.805 -10.239 273 HE2 TYR 31 HE2 TYR 31 1.511 3.928 -10.973 274 HH TYR 31 HH TYR 31 -1.706 4.834 -9.656 275 H ARG 32 H ARG 32 -0.614 -3.066 -13.722 276 HA ARG 32 HA ARG 32 0.367 -5.028 -13.578 277 HB2 ARG 32 HB2 ARG 32 2.109 -4.722 -15.920 278 HB3 ARG 32 HB3 ARG 32 0.818 -5.835 -15.524 279 HG2 ARG 32 HG2 ARG 32 -0.108 -4.901 -17.341 280 HG3 ARG 32 HG3 ARG 32 -0.753 -3.799 -16.144 281 HD2 ARG 32 HD2 ARG 32 -0.031 -2.391 -17.861 282 HD3 ARG 32 HD3 ARG 32 1.244 -2.271 -16.654 283 HE ARG 32 HE ARG 32 2.746 -3.051 -18.189 284 HH11 ARG 32 HH11 ARG 32 3.534 -3.574 -20.019 285 HH12 ARG 32 HH12 ARG 32 2.570 -4.344 -21.277 286 HH21 ARG 32 HH21 ARG 32 -0.352 -4.147 -19.440 287 HH22 ARG 32 HH22 ARG 32 0.380 -4.640 -20.943 288 H ALA 33 H ALA 33 1.631 -5.601 -11.896 289 HA ALA 33 HA ALA 33 4.159 -4.553 -11.221 290 HB1 ALA 33 HB1 ALA 33 2.680 -5.993 -9.763 291 HB2 ALA 33 HB2 ALA 33 3.208 -7.404 -10.701 292 HB3 ALA 33 HB3 ALA 33 4.384 -6.464 -9.770 293 H SER 34 H SER 34 3.355 -6.856 -13.670 294 HA SER 34 HA SER 34 5.930 -8.025 -14.179 295 HB2 SER 34 HB2 SER 34 4.739 -8.709 -16.278 296 HB3 SER 34 HB3 SER 34 3.831 -9.085 -14.773 297 HG SER 34 HG SER 34 2.554 -8.102 -16.472 298 H ASP 35 H ASP 35 4.593 -4.877 -14.975 299 HA ASP 35 HA ASP 35 6.240 -4.471 -17.338 300 HB2 ASP 35 HB2 ASP 35 3.915 -3.467 -16.679 301 HB3 ASP 35 HB3 ASP 35 4.840 -2.310 -15.735 302 H TRP 36 H TRP 36 6.446 -3.748 -13.923 303 HA TRP 36 HA TRP 36 9.115 -2.443 -14.191 304 HB2 TRP 36 HB2 TRP 36 8.389 -1.548 -11.793 305 HB3 TRP 36 HB3 TRP 36 8.012 -0.764 -13.297 306 HD1 TRP 36 HD1 TRP 36 5.592 -0.576 -14.074 307 HE1 TRP 36 HE1 TRP 36 3.311 -0.972 -13.000 308 HE3 TRP 36 HE3 TRP 36 7.083 -3.184 -9.942 309 HZ2 TRP 36 HZ2 TRP 36 2.316 -1.853 -10.406 310 HZ3 TRP 36 HZ3 TRP 36 5.429 -3.867 -8.230 311 HH2 TRP 36 HH2 TRP 36 3.058 -3.167 -8.408 312 H LYS 37 H LYS 37 9.679 -2.768 -11.311 313 HA LYS 37 HA LYS 37 10.782 -5.489 -11.316 314 HB2 LYS 37 HB2 LYS 37 10.511 -3.486 -9.011 315 HB3 LYS 37 HB3 LYS 37 11.481 -4.950 -9.022 316 HG2 LYS 37 HG2 LYS 37 11.970 -2.416 -10.633 317 HG3 LYS 37 HG3 LYS 37 12.879 -3.023 -9.255 318 HD2 LYS 37 HD2 LYS 37 13.189 -5.162 -10.887 319 HD3 LYS 37 HD3 LYS 37 12.910 -3.928 -12.123 320 HE2 LYS 37 HE2 LYS 37 14.726 -2.538 -11.093 321 HE3 LYS 37 HE3 LYS 37 14.972 -3.800 -9.870 322 HZ1 LYS 37 HZ1 LYS 37 15.640 -5.320 -11.598 323 HZ2 LYS 37 HZ2 LYS 37 15.357 -4.220 -12.787 324 HZ3 LYS 37 HZ3 LYS 37 16.564 -3.979 -11.712 325 H LEU 38 H LEU 38 9.661 -7.045 -11.349 326 HA LEU 38 HA LEU 38 7.127 -7.374 -10.006 327 HB2 LEU 38 HB2 LEU 38 7.655 -8.163 -12.282 328 HB3 LEU 38 HB3 LEU 38 9.008 -9.116 -11.666 329 HG LEU 38 HG LEU 38 7.474 -10.460 -10.369 330 HD11 LEU 38 HD11 LEU 38 5.278 -9.030 -11.960 331 HD12 LEU 38 HD12 LEU 38 5.026 -10.452 -10.932 332 HD13 LEU 38 HD13 LEU 38 5.510 -8.928 -10.202 333 HD21 LEU 38 HD21 LEU 38 6.587 -11.756 -12.312 334 HD22 LEU 38 HD22 LEU 38 6.932 -10.359 -13.359 335 HD23 LEU 38 HD23 LEU 38 8.258 -11.219 -12.551 336 H ASP 39 H ASP 39 10.453 -8.445 -9.334 337 HA ASP 39 HA ASP 39 9.590 -9.382 -6.657 338 HB2 ASP 39 HB2 ASP 39 9.557 -11.262 -8.434 339 HB3 ASP 39 HB3 ASP 39 11.315 -11.147 -8.424 340 H GLN 40 H GLN 40 11.269 -7.123 -7.756 341 HA GLN 40 HA GLN 40 13.896 -7.631 -6.379 342 HB2 GLN 40 HB2 GLN 40 13.381 -6.232 -8.997 343 HB3 GLN 40 HB3 GLN 40 14.936 -6.289 -8.160 344 HG2 GLN 40 HG2 GLN 40 15.057 -8.715 -8.458 345 HG3 GLN 40 HG3 GLN 40 13.425 -8.758 -9.125 346 HE21 GLN 40 HE21 GLN 40 14.996 -8.731 -12.293 347 HE22 GLN 40 HE22 GLN 40 14.118 -9.701 -11.118 348 HA PRO 41 HA PRO 41 11.742 -3.918 -4.631 349 HB2 PRO 41 HB2 PRO 41 12.245 -4.298 -1.973 350 HB3 PRO 41 HB3 PRO 41 10.967 -5.162 -2.884 351 HG2 PRO 41 HG2 PRO 41 13.780 -6.119 -2.243 352 HG3 PRO 41 HG3 PRO 41 12.239 -6.993 -1.975 353 HD2 PRO 41 HD2 PRO 41 13.776 -7.427 -4.176 354 HD3 PRO 41 HD3 PRO 41 11.991 -7.452 -4.273 355 H ASP 42 H ASP 42 12.439 -1.966 -3.819 356 HA ASP 42 HA ASP 42 15.387 -1.490 -3.691 357 HB2 ASP 42 HB2 ASP 42 14.011 -0.127 -5.275 358 HB3 ASP 42 HB3 ASP 42 13.117 0.510 -3.894 359 H TRP 43 H TRP 43 12.449 -1.541 -1.789 360 HA TRP 43 HA TRP 43 14.039 -1.164 0.680 361 HB2 TRP 43 HB2 TRP 43 13.014 1.013 0.264 362 HB3 TRP 43 HB3 TRP 43 11.440 0.268 0.033 363 HD1 TRP 43 HD1 TRP 43 13.842 1.391 2.734 364 HE1 TRP 43 HE1 TRP 43 12.692 1.317 5.027 365 HE3 TRP 43 HE3 TRP 43 9.565 -1.100 1.424 366 HZ2 TRP 43 HZ2 TRP 43 10.195 0.382 6.126 367 HZ3 TRP 43 HZ3 TRP 43 7.812 -1.569 3.113 368 HH2 TRP 43 HH2 TRP 43 8.110 -0.829 5.470 369 H THR 44 H THR 44 13.350 -2.376 2.424 370 HA THR 44 HA THR 44 10.822 -3.893 2.292 371 HB THR 44 HB THR 44 11.939 -5.914 3.135 372 HG1 THR 44 HG1 THR 44 14.193 -6.095 2.954 373 HG21 THR 44 HG21 THR 44 11.539 -5.701 0.693 374 HG22 THR 44 HG22 THR 44 13.200 -5.114 0.485 375 HG23 THR 44 HG23 THR 44 12.898 -6.761 1.087 376 H GLY 45 H GLY 45 9.926 -4.435 4.208 377 HA2 GLY 45 HA2 GLY 45 11.085 -3.972 6.781 378 HA3 GLY 45 HA3 GLY 45 10.245 -2.519 6.253 379 H ARG 46 H ARG 46 8.477 -2.428 7.324 380 HA ARG 46 HA ARG 46 6.714 -4.807 7.851 381 HB2 ARG 46 HB2 ARG 46 8.229 -4.215 9.723 382 HB3 ARG 46 HB3 ARG 46 7.607 -2.574 9.721 383 HG2 ARG 46 HG2 ARG 46 5.332 -3.494 10.363 384 HG3 ARG 46 HG3 ARG 46 6.081 -5.107 10.439 385 HD2 ARG 46 HD2 ARG 46 7.771 -4.121 12.069 386 HD3 ARG 46 HD3 ARG 46 6.806 -2.651 12.095 387 HE ARG 46 HE ARG 46 5.901 -5.369 13.003 388 HH11 ARG 46 HH11 ARG 46 4.889 -5.504 14.946 389 HH12 ARG 46 HH12 ARG 46 4.348 -4.066 15.754 390 HH21 ARG 46 HH21 ARG 46 5.465 -1.865 13.366 391 HH22 ARG 46 HH22 ARG 46 4.738 -2.085 14.935 392 H LEU 47 H LEU 47 4.516 -4.445 7.910 393 HA LEU 47 HA LEU 47 3.533 -1.904 6.673 394 HB2 LEU 47 HB2 LEU 47 2.965 -4.121 5.620 395 HB3 LEU 47 HB3 LEU 47 2.231 -4.587 7.151 396 HG LEU 47 HG LEU 47 0.652 -2.541 6.833 397 HD11 LEU 47 HD11 LEU 47 1.643 -2.863 3.978 398 HD12 LEU 47 HD12 LEU 47 0.251 -1.894 4.512 399 HD13 LEU 47 HD13 LEU 47 1.878 -1.440 5.020 400 HD21 LEU 47 HD21 LEU 47 0.488 -4.963 5.010 401 HD22 LEU 47 HD22 LEU 47 -0.079 -4.860 6.688 402 HD23 LEU 47 HD23 LEU 47 -0.865 -3.893 5.445 403 H ARG 48 H ARG 48 2.202 -0.503 7.789 404 HA ARG 48 HA ARG 48 0.715 -1.488 10.175 405 HB2 ARG 48 HB2 ARG 48 2.995 -0.343 10.747 406 HB3 ARG 48 HB3 ARG 48 2.249 1.142 10.234 407 HG2 ARG 48 HG2 ARG 48 1.804 1.249 12.478 408 HG3 ARG 48 HG3 ARG 48 0.329 0.417 11.972 409 HD2 ARG 48 HD2 ARG 48 1.311 -1.751 12.556 410 HD3 ARG 48 HD3 ARG 48 2.881 -1.018 12.871 411 HE ARG 48 HE ARG 48 0.605 -1.116 14.668 412 HH11 ARG 48 HH11 ARG 48 0.891 -0.454 16.769 413 HH12 ARG 48 HH12 ARG 48 2.212 0.595 17.174 414 HH21 ARG 48 HH21 ARG 48 3.527 0.807 14.010 415 HH22 ARG 48 HH22 ARG 48 3.653 1.250 15.687 416 H ILE 49 H ILE 49 -1.189 -1.422 9.050 417 HA ILE 49 HA ILE 49 -2.076 1.054 7.664 418 HB ILE 49 HB ILE 49 -3.445 -1.617 8.070 419 HG12 ILE 49 HG12 ILE 49 -2.147 -0.307 5.634 420 HG13 ILE 49 HG13 ILE 49 -1.526 -1.698 6.519 421 HG21 ILE 49 HG21 ILE 49 -5.190 -0.862 6.577 422 HG22 ILE 49 HG22 ILE 49 -5.098 0.275 7.897 423 HG23 ILE 49 HG23 ILE 49 -4.373 0.697 6.322 424 HD11 ILE 49 HD11 ILE 49 -3.517 -3.017 5.848 425 HD12 ILE 49 HD12 ILE 49 -4.060 -1.641 4.838 426 HD13 ILE 49 HD13 ILE 49 -2.541 -2.454 4.485 427 H THR 50 H THR 50 -3.443 2.477 8.499 428 HA THR 50 HA THR 50 -4.567 2.122 11.249 429 HB THR 50 HB THR 50 -3.781 4.373 11.813 430 HG1 THR 50 HG1 THR 50 -2.521 4.198 9.271 431 HG21 THR 50 HG21 THR 50 -2.197 2.539 12.370 432 HG22 THR 50 HG22 THR 50 -1.396 2.768 10.804 433 HG23 THR 50 HG23 THR 50 -1.390 4.068 12.008 434 H SER 51 H SER 51 -6.215 4.006 11.698 435 HA SER 51 HA SER 51 -7.199 5.508 9.397 436 HB2 SER 51 HB2 SER 51 -8.496 3.604 8.916 437 HB3 SER 51 HB3 SER 51 -8.803 3.271 10.639 438 HG SER 51 HG SER 51 -10.605 4.123 9.601 439 H LYS 52 H LYS 52 -8.106 7.319 9.894 440 HA LYS 52 HA LYS 52 -8.734 8.086 12.710 441 HB2 LYS 52 HB2 LYS 52 -7.039 9.300 11.311 442 HB3 LYS 52 HB3 LYS 52 -8.369 9.791 10.238 443 HG2 LYS 52 HG2 LYS 52 -9.346 10.834 12.480 444 HG3 LYS 52 HG3 LYS 52 -7.699 10.657 13.052 445 HD2 LYS 52 HD2 LYS 52 -8.716 12.189 10.644 446 HD3 LYS 52 HD3 LYS 52 -8.020 12.872 12.130 447 HE2 LYS 52 HE2 LYS 52 -5.815 12.112 11.523 448 HE3 LYS 52 HE3 LYS 52 -6.433 11.171 10.165 449 HZ1 LYS 52 HZ1 LYS 52 -7.136 13.306 9.143 450 HZ2 LYS 52 HZ2 LYS 52 -6.485 14.127 10.419 451 HZ3 LYS 52 HZ3 LYS 52 -5.523 13.286 9.424 452 H GLY 53 H GLY 53 -10.436 6.491 10.673 453 HA2 GLY 53 HA2 GLY 53 -12.765 6.131 10.649 454 HA3 GLY 53 HA3 GLY 53 -13.065 7.771 11.219 455 H LYS 54 H LYS 54 -13.610 5.886 8.692 456 HA LYS 54 HA LYS 54 -13.679 5.797 6.461 457 HB2 LYS 54 HB2 LYS 54 -15.401 7.583 7.002 458 HB3 LYS 54 HB3 LYS 54 -14.206 8.778 6.463 459 HG2 LYS 54 HG2 LYS 54 -14.121 7.595 4.238 460 HG3 LYS 54 HG3 LYS 54 -15.352 6.465 4.837 461 HD2 LYS 54 HD2 LYS 54 -16.924 8.350 5.098 462 HD3 LYS 54 HD3 LYS 54 -15.692 9.484 4.538 463 HE2 LYS 54 HE2 LYS 54 -16.800 7.156 2.886 464 HE3 LYS 54 HE3 LYS 54 -17.386 8.816 2.791 465 HZ1 LYS 54 HZ1 LYS 54 -14.642 7.907 2.041 466 HZ2 LYS 54 HZ2 LYS 54 -15.797 8.461 1.045 467 HZ3 LYS 54 HZ3 LYS 54 -15.107 9.480 2.110 468 H THR 55 H THR 55 -11.165 7.835 7.570 469 HA THR 55 HA THR 55 -9.789 7.359 4.951 470 HB THR 55 HB THR 55 -8.760 9.342 6.982 471 HG1 THR 55 HG1 THR 55 -10.857 10.049 6.560 472 HG21 THR 55 HG21 THR 55 -7.858 10.308 4.871 473 HG22 THR 55 HG22 THR 55 -7.408 8.591 5.021 474 HG23 THR 55 HG23 THR 55 -8.743 9.061 3.950 475 H ALA 56 H ALA 56 -8.797 5.557 5.041 476 HA ALA 56 HA ALA 56 -7.285 4.784 7.452 477 HB1 ALA 56 HB1 ALA 56 -6.687 2.738 6.165 478 HB2 ALA 56 HB2 ALA 56 -8.423 2.931 6.447 479 HB3 ALA 56 HB3 ALA 56 -7.746 3.289 4.857 480 H TYR 57 H TYR 57 -5.007 4.488 7.330 481 HA TYR 57 HA TYR 57 -3.609 5.971 5.167 482 HB2 TYR 57 HB2 TYR 57 -2.990 6.289 8.116 483 HB3 TYR 57 HB3 TYR 57 -2.106 6.987 6.774 484 HD1 TYR 57 HD1 TYR 57 -5.384 7.036 8.599 485 HD2 TYR 57 HD2 TYR 57 -2.762 9.117 5.872 486 HE1 TYR 57 HE1 TYR 57 -6.864 9.002 8.684 487 HE2 TYR 57 HE2 TYR 57 -4.225 11.134 6.037 488 HH TYR 57 HH TYR 57 -7.295 11.110 7.867 489 H ILE 58 H ILE 58 -2.349 4.548 4.209 490 HA ILE 58 HA ILE 58 -1.377 2.094 5.541 491 HB ILE 58 HB ILE 58 -0.375 3.232 2.904 492 HG12 ILE 58 HG12 ILE 58 -2.734 3.201 2.537 493 HG13 ILE 58 HG13 ILE 58 -1.935 1.936 1.629 494 HG21 ILE 58 HG21 ILE 58 0.937 1.430 3.899 495 HG22 ILE 58 HG22 ILE 58 -0.511 0.418 4.051 496 HG23 ILE 58 HG23 ILE 58 0.116 0.855 2.450 497 HD11 ILE 58 HD11 ILE 58 -2.748 0.228 3.195 498 HD12 ILE 58 HD12 ILE 58 -3.494 1.495 4.207 499 HD13 ILE 58 HD13 ILE 58 -4.073 1.215 2.554 500 H LYS 59 H LYS 59 0.168 2.510 7.154 501 HA LYS 59 HA LYS 59 2.416 4.366 6.459 502 HB2 LYS 59 HB2 LYS 59 2.180 2.936 9.082 503 HB3 LYS 59 HB3 LYS 59 3.074 4.378 8.696 504 HG2 LYS 59 HG2 LYS 59 0.047 4.153 9.001 505 HG3 LYS 59 HG3 LYS 59 1.187 4.798 10.173 506 HD2 LYS 59 HD2 LYS 59 1.793 6.608 8.511 507 HD3 LYS 59 HD3 LYS 59 0.460 6.017 7.477 508 HE2 LYS 59 HE2 LYS 59 -1.119 6.311 9.388 509 HE3 LYS 59 HE3 LYS 59 0.216 6.867 10.398 510 HZ1 LYS 59 HZ1 LYS 59 -0.926 8.770 9.629 511 HZ2 LYS 59 HZ2 LYS 59 0.490 8.744 8.785 512 HZ3 LYS 59 HZ3 LYS 59 -0.903 8.298 8.060 513 H LEU 60 H LEU 60 4.472 3.595 6.165 514 HA LEU 60 HA LEU 60 4.932 0.636 6.372 515 HB2 LEU 60 HB2 LEU 60 6.018 2.674 4.393 516 HB3 LEU 60 HB3 LEU 60 6.659 1.043 4.571 517 HG LEU 60 HG LEU 60 3.760 1.634 3.810 518 HD11 LEU 60 HD11 LEU 60 4.454 0.997 1.527 519 HD12 LEU 60 HD12 LEU 60 5.293 2.455 2.080 520 HD13 LEU 60 HD13 LEU 60 6.142 0.895 2.077 521 HD21 LEU 60 HD21 LEU 60 5.433 -0.916 3.662 522 HD22 LEU 60 HD22 LEU 60 4.103 -0.616 4.797 523 HD23 LEU 60 HD23 LEU 60 3.769 -0.728 3.066 524 H GLU 61 H GLU 61 6.560 -0.010 7.618 525 HA GLU 61 HA GLU 61 8.098 2.078 9.116 526 HB2 GLU 61 HB2 GLU 61 6.854 -0.519 10.065 527 HB3 GLU 61 HB3 GLU 61 7.871 0.540 11.046 528 HG2 GLU 61 HG2 GLU 61 6.188 2.347 10.825 529 HG3 GLU 61 HG3 GLU 61 5.150 1.264 9.884 530 H ASP 62 H ASP 62 10.226 1.582 9.827 531 HA ASP 62 HA ASP 62 11.724 -0.450 8.409 532 HB2 ASP 62 HB2 ASP 62 12.719 1.690 8.965 533 HB3 ASP 62 HB3 ASP 62 12.326 1.490 10.675 534 H LYS 63 H LYS 63 12.174 -2.474 9.088 535 HA LYS 63 HA LYS 63 10.517 -3.667 11.095 536 HB2 LYS 63 HB2 LYS 63 11.444 -4.598 8.869 537 HB3 LYS 63 HB3 LYS 63 12.917 -4.976 9.767 538 HG2 LYS 63 HG2 LYS 63 11.505 -6.383 11.327 539 HG3 LYS 63 HG3 LYS 63 10.093 -6.018 10.330 540 HD2 LYS 63 HD2 LYS 63 12.627 -7.425 9.370 541 HD3 LYS 63 HD3 LYS 63 11.144 -8.239 9.888 542 HE2 LYS 63 HE2 LYS 63 9.887 -7.118 8.060 543 HE3 LYS 63 HE3 LYS 63 11.379 -6.339 7.513 544 HZ1 LYS 63 HZ1 LYS 63 10.896 -8.406 6.283 545 HZ2 LYS 63 HZ2 LYS 63 12.315 -8.533 7.091 546 HZ3 LYS 63 HZ3 LYS 63 10.972 -9.274 7.661 547 H VAL 64 H VAL 64 13.420 -2.021 11.586 548 HA VAL 64 HA VAL 64 14.299 -3.686 13.900 549 HB VAL 64 HB VAL 64 15.895 -1.422 12.681 550 HG11 VAL 64 HG11 VAL 64 16.683 -3.994 14.101 551 HG12 VAL 64 HG12 VAL 64 17.789 -2.725 13.529 552 HG13 VAL 64 HG13 VAL 64 16.641 -2.369 14.822 553 HG21 VAL 64 HG21 VAL 64 15.442 -2.802 10.738 554 HG22 VAL 64 HG22 VAL 64 17.098 -3.083 11.269 555 HG23 VAL 64 HG23 VAL 64 15.839 -4.285 11.646 556 H SER 65 H SER 65 13.398 -0.380 12.915 557 HA SER 65 HA SER 65 13.358 0.366 15.813 558 HB2 SER 65 HB2 SER 65 14.250 2.007 13.419 559 HB3 SER 65 HB3 SER 65 14.141 2.609 15.087 560 HG SER 65 HG SER 65 16.264 1.905 14.528 561 H GLY 66 H GLY 66 11.232 -0.018 13.255 562 HA2 GLY 66 HA2 GLY 66 9.036 0.562 13.022 563 HA3 GLY 66 HA3 GLY 66 9.093 1.372 14.588 564 H GLU 67 H GLU 67 11.433 2.543 12.328 565 HA GLU 67 HA GLU 67 10.240 5.188 12.389 566 HB2 GLU 67 HB2 GLU 67 12.680 4.141 10.900 567 HB3 GLU 67 HB3 GLU 67 12.194 5.839 11.009 568 HG2 GLU 67 HG2 GLU 67 12.357 5.687 13.512 569 HG3 GLU 67 HG3 GLU 67 12.982 4.046 13.343 570 H LEU 68 H LEU 68 9.341 6.428 10.733 571 HA LEU 68 HA LEU 68 7.796 4.911 8.863 572 HB2 LEU 68 HB2 LEU 68 7.074 7.011 10.080 573 HB3 LEU 68 HB3 LEU 68 8.149 7.926 9.025 574 HG LEU 68 HG LEU 68 6.806 6.967 7.042 575 HD11 LEU 68 HD11 LEU 68 5.672 5.110 8.249 576 HD12 LEU 68 HD12 LEU 68 4.857 6.289 9.295 577 HD13 LEU 68 HD13 LEU 68 4.504 6.233 7.556 578 HD21 LEU 68 HD21 LEU 68 5.344 8.729 9.049 579 HD22 LEU 68 HD22 LEU 68 6.539 9.279 7.852 580 HD23 LEU 68 HD23 LEU 68 5.000 8.597 7.309 581 H PHE 69 H PHE 69 8.295 4.232 6.919 582 HA PHE 69 HA PHE 69 10.474 5.384 5.263 583 HB2 PHE 69 HB2 PHE 69 10.368 3.019 5.320 584 HB3 PHE 69 HB3 PHE 69 8.632 2.996 5.056 585 HD1 PHE 69 HD1 PHE 69 8.018 2.163 2.984 586 HD2 PHE 69 HD2 PHE 69 11.600 4.539 3.276 587 HE1 PHE 69 HE1 PHE 69 8.395 1.887 0.554 588 HE2 PHE 69 HE2 PHE 69 11.944 4.319 0.836 589 HZ PHE 69 HZ PHE 69 10.341 2.988 -0.543 590 H ALA 70 H ALA 70 6.934 4.841 4.982 591 HA ALA 70 HA ALA 70 6.545 7.379 3.596 592 HB1 ALA 70 HB1 ALA 70 5.543 6.377 1.587 593 HB2 ALA 70 HB2 ALA 70 7.240 5.888 1.720 594 HB3 ALA 70 HB3 ALA 70 5.948 4.747 2.158 595 H GLN 71 H GLN 71 4.225 7.803 3.189 596 HA GLN 71 HA GLN 71 2.338 5.964 4.424 597 HB2 GLN 71 HB2 GLN 71 1.203 7.703 5.755 598 HB3 GLN 71 HB3 GLN 71 2.825 7.307 6.319 599 HG2 GLN 71 HG2 GLN 71 3.700 9.372 5.186 600 HG3 GLN 71 HG3 GLN 71 2.047 9.798 4.735 601 HE21 GLN 71 HE21 GLN 71 2.953 11.585 7.911 602 HE22 GLN 71 HE22 GLN 71 3.636 11.547 6.291 603 H ALA 72 H ALA 72 0.363 5.868 3.438 604 HA ALA 72 HA ALA 72 -0.266 7.923 1.352 605 HB1 ALA 72 HB1 ALA 72 -1.311 6.154 0.021 606 HB2 ALA 72 HB2 ALA 72 0.408 5.847 0.258 607 HB3 ALA 72 HB3 ALA 72 -0.794 4.940 1.203 608 HA PRO 73 HA PRO 73 -4.212 7.890 3.746 609 HB2 PRO 73 HB2 PRO 73 -5.312 10.167 2.782 610 HB3 PRO 73 HB3 PRO 73 -3.906 10.207 3.887 611 HG2 PRO 73 HG2 PRO 73 -3.883 10.455 0.872 612 HG3 PRO 73 HG3 PRO 73 -3.044 11.477 2.079 613 HD2 PRO 73 HD2 PRO 73 -1.841 9.371 0.762 614 HD3 PRO 73 HD3 PRO 73 -1.372 9.877 2.414 615 H VAL 74 H VAL 74 -6.219 6.995 3.212 616 HA VAL 74 HA VAL 74 -7.112 7.047 0.364 617 HB VAL 74 HB VAL 74 -6.108 4.924 0.736 618 HG11 VAL 74 HG11 VAL 74 -8.096 4.290 2.898 619 HG12 VAL 74 HG12 VAL 74 -6.968 3.158 2.132 620 HG13 VAL 74 HG13 VAL 74 -6.333 4.492 3.089 621 HG21 VAL 74 HG21 VAL 74 -7.945 3.492 -0.042 622 HG22 VAL 74 HG22 VAL 74 -9.131 4.610 0.609 623 HG23 VAL 74 HG23 VAL 74 -8.117 5.106 -0.750 624 H GLU 75 H GLU 75 -9.074 7.771 0.076 625 HA GLU 75 HA GLU 75 -11.006 7.803 2.357 626 HB2 GLU 75 HB2 GLU 75 -10.763 9.586 -0.101 627 HB3 GLU 75 HB3 GLU 75 -12.095 9.660 1.055 628 HG2 GLU 75 HG2 GLU 75 -10.538 10.219 2.872 629 HG3 GLU 75 HG3 GLU 75 -9.174 10.156 1.748 630 H GLN 76 H GLN 76 -10.435 6.134 -0.513 631 HA GLN 76 HA GLN 76 -12.918 4.798 -0.352 632 HB2 GLN 76 HB2 GLN 76 -13.318 5.139 -2.953 633 HB3 GLN 76 HB3 GLN 76 -14.061 6.156 -1.733 634 HG2 GLN 76 HG2 GLN 76 -13.339 7.471 -3.626 635 HG3 GLN 76 HG3 GLN 76 -12.503 7.965 -2.169 636 HE21 GLN 76 HE21 GLN 76 -9.301 7.323 -3.549 637 HE22 GLN 76 HE22 GLN 76 -10.240 7.973 -2.213 638 H TYR 77 H TYR 77 -12.885 2.832 -1.233 639 HA TYR 77 HA TYR 77 -10.480 1.859 -2.670 640 HB2 TYR 77 HB2 TYR 77 -10.382 1.424 -0.220 641 HB3 TYR 77 HB3 TYR 77 -11.855 0.460 -0.358 642 HD1 TYR 77 HD1 TYR 77 -8.789 0.592 -2.511 643 HD2 TYR 77 HD2 TYR 77 -11.067 -1.742 0.298 644 HE1 TYR 77 HE1 TYR 77 -7.224 -1.257 -2.811 645 HE2 TYR 77 HE2 TYR 77 -9.543 -3.642 -0.067 646 HH TYR 77 HH TYR 77 -6.752 -3.467 -2.310 647 HA PRO 78 HA PRO 78 -9.874 0.395 -4.346 648 HB2 PRO 78 HB2 PRO 78 -10.255 0.240 -7.028 649 HB3 PRO 78 HB3 PRO 78 -10.333 -1.184 -5.947 650 HG2 PRO 78 HG2 PRO 78 -12.651 0.493 -6.973 651 HG3 PRO 78 HG3 PRO 78 -12.473 -1.292 -7.021 652 HD2 PRO 78 HD2 PRO 78 -13.876 -0.072 -5.049 653 HD3 PRO 78 HD3 PRO 78 -12.839 -1.483 -4.689 654 H GLY 79 H GLY 79 -8.620 2.034 -5.429 655 HA2 GLY 79 HA2 GLY 79 -9.824 4.413 -6.592 656 HA3 GLY 79 HA3 GLY 79 -9.296 4.650 -4.925 657 H ILE 80 H ILE 80 -7.910 6.284 -5.972 658 HA ILE 80 HA ILE 80 -5.604 5.369 -7.530 659 HB ILE 80 HB ILE 80 -6.674 7.544 -7.959 660 HG12 ILE 80 HG12 ILE 80 -4.721 8.971 -8.126 661 HG13 ILE 80 HG13 ILE 80 -3.827 7.986 -6.975 662 HG21 ILE 80 HG21 ILE 80 -7.296 8.195 -5.634 663 HG22 ILE 80 HG22 ILE 80 -5.573 8.442 -5.252 664 HG23 ILE 80 HG23 ILE 80 -6.379 9.459 -6.455 665 HD11 ILE 80 HD11 ILE 80 -3.200 7.609 -9.369 666 HD12 ILE 80 HD12 ILE 80 -3.740 6.129 -8.564 667 HD13 ILE 80 HD13 ILE 80 -4.834 6.990 -9.679 668 H ALA 81 H ALA 81 -6.388 5.841 -4.154 669 HA ALA 81 HA ALA 81 -3.664 6.128 -3.276 670 HB1 ALA 81 HB1 ALA 81 -6.209 5.498 -1.754 671 HB2 ALA 81 HB2 ALA 81 -4.620 5.873 -1.035 672 HB3 ALA 81 HB3 ALA 81 -5.494 7.108 -1.989 673 H VAL 82 H VAL 82 -5.608 3.396 -4.078 674 HA VAL 82 HA VAL 82 -3.478 1.508 -3.466 675 HB VAL 82 HB VAL 82 -4.304 1.523 -1.316 676 HG11 VAL 82 HG11 VAL 82 -7.015 1.684 -2.440 677 HG12 VAL 82 HG12 VAL 82 -6.769 0.838 -0.891 678 HG13 VAL 82 HG13 VAL 82 -6.250 2.516 -1.098 679 HG21 VAL 82 HG21 VAL 82 -3.621 -0.556 -2.090 680 HG22 VAL 82 HG22 VAL 82 -5.020 -0.795 -1.028 681 HG23 VAL 82 HG23 VAL 82 -5.180 -0.938 -2.795 682 H GLU 83 H GLU 83 -3.417 0.419 -5.270 683 HA GLU 83 HA GLU 83 -5.901 -0.541 -6.644 684 HB2 GLU 83 HB2 GLU 83 -4.114 1.449 -7.573 685 HB3 GLU 83 HB3 GLU 83 -3.595 -0.009 -8.406 686 HG2 GLU 83 HG2 GLU 83 -6.454 1.057 -8.370 687 HG3 GLU 83 HG3 GLU 83 -5.271 1.404 -9.626 688 H THR 84 H THR 84 -5.682 -2.493 -7.864 689 HA THR 84 HA THR 84 -3.384 -4.231 -7.006 690 HB THR 84 HB THR 84 -5.945 -5.296 -8.063 691 HG1 THR 84 HG1 THR 84 -6.555 -5.628 -5.849 692 HG21 THR 84 HG21 THR 84 -3.798 -6.393 -6.225 693 HG22 THR 84 HG22 THR 84 -5.222 -7.292 -6.807 694 HG23 THR 84 HG23 THR 84 -3.982 -6.760 -7.955 695 H VAL 85 H VAL 85 -2.434 -2.985 -8.635 696 HA VAL 85 HA VAL 85 -1.312 -2.848 -10.654 697 HB VAL 85 HB VAL 85 -0.276 -5.163 -11.013 698 HG11 VAL 85 HG11 VAL 85 -0.168 -3.732 -8.313 699 HG12 VAL 85 HG12 VAL 85 1.082 -4.802 -8.949 700 HG13 VAL 85 HG13 VAL 85 0.733 -3.286 -9.777 701 HG21 VAL 85 HG21 VAL 85 -2.138 -6.468 -9.811 702 HG22 VAL 85 HG22 VAL 85 -0.479 -6.818 -9.344 703 HG23 VAL 85 HG23 VAL 85 -1.495 -5.797 -8.313 704 H THR 86 H THR 86 -3.035 -5.860 -11.220 705 HA THR 86 HA THR 86 -4.472 -4.658 -13.376 706 HB THR 86 HB THR 86 -4.338 -6.602 -14.920 707 HG1 THR 86 HG1 THR 86 -3.181 -8.240 -14.485 708 HG21 THR 86 HG21 THR 86 -1.608 -5.392 -14.419 709 HG22 THR 86 HG22 THR 86 -2.266 -5.922 -15.988 710 HG23 THR 86 HG23 THR 86 -2.922 -4.468 -15.175 711 H ASP 87 H ASP 87 -3.743 -7.671 -11.673 712 HA ASP 87 HA ASP 87 -6.532 -7.919 -10.727 713 HB2 ASP 87 HB2 ASP 87 -6.596 -8.811 -13.075 714 HB3 ASP 87 HB3 ASP 87 -5.415 -10.014 -12.606 715 H SER 88 H SER 88 -3.789 -10.274 -11.230 716 HA SER 88 HA SER 88 -4.128 -11.545 -8.799 717 HB2 SER 88 HB2 SER 88 -2.322 -11.890 -10.786 718 HB3 SER 88 HB3 SER 88 -1.267 -11.311 -9.467 719 HG SER 88 HG SER 88 -1.798 -13.670 -9.671 720 H SER 89 H SER 89 -3.529 -11.380 -6.746 721 HA SER 89 HA SER 89 -3.022 -8.619 -5.923 722 HB2 SER 89 HB2 SER 89 -4.542 -9.166 -4.127 723 HB3 SER 89 HB3 SER 89 -5.214 -9.589 -5.719 724 HG SER 89 HG SER 89 -5.245 -11.181 -3.815 725 H ARG 90 H ARG 90 -0.894 -11.017 -5.938 726 HA ARG 90 HA ARG 90 0.281 -10.804 -3.271 727 HB2 ARG 90 HB2 ARG 90 1.099 -12.458 -4.928 728 HB3 ARG 90 HB3 ARG 90 1.604 -11.148 -6.011 729 HG2 ARG 90 HG2 ARG 90 3.231 -10.359 -4.323 730 HG3 ARG 90 HG3 ARG 90 2.685 -11.610 -3.193 731 HD2 ARG 90 HD2 ARG 90 3.547 -13.344 -4.712 732 HD3 ARG 90 HD3 ARG 90 3.982 -12.108 -5.901 733 HE ARG 90 HE ARG 90 5.110 -12.010 -3.130 734 HH11 ARG 90 HH11 ARG 90 7.311 -11.853 -2.881 735 HH12 ARG 90 HH12 ARG 90 8.323 -11.837 -4.334 736 HH21 ARG 90 HH21 ARG 90 5.906 -11.979 -6.610 737 HH22 ARG 90 HH22 ARG 90 7.617 -11.920 -6.183 738 H TYR 91 H TYR 91 0.086 -8.712 -6.066 739 HA TYR 91 HA TYR 91 1.823 -6.691 -4.746 740 HB2 TYR 91 HB2 TYR 91 1.005 -6.683 -7.642 741 HB3 TYR 91 HB3 TYR 91 2.386 -5.886 -6.911 742 HD1 TYR 91 HD1 TYR 91 1.249 -8.691 -8.761 743 HD2 TYR 91 HD2 TYR 91 4.199 -7.489 -5.866 744 HE1 TYR 91 HE1 TYR 91 2.620 -10.658 -9.386 745 HE2 TYR 91 HE2 TYR 91 5.574 -9.500 -6.444 746 HH TYR 91 HH TYR 91 4.513 -11.848 -8.946 747 H PHE 92 H PHE 92 1.366 -4.520 -4.915 748 HA PHE 92 HA PHE 92 -1.318 -3.629 -5.749 749 HB2 PHE 92 HB2 PHE 92 -0.191 -3.013 -2.993 750 HB3 PHE 92 HB3 PHE 92 -1.651 -2.323 -3.684 751 HD1 PHE 92 HD1 PHE 92 -3.581 -3.927 -4.347 752 HD2 PHE 92 HD2 PHE 92 -0.309 -5.041 -1.768 753 HE1 PHE 92 HE1 PHE 92 -4.922 -5.823 -3.462 754 HE2 PHE 92 HE2 PHE 92 -1.691 -6.877 -0.823 755 HZ PHE 92 HZ PHE 92 -3.972 -7.313 -1.718 756 H VAL 93 H VAL 93 -1.383 -1.186 -5.733 757 HA VAL 93 HA VAL 93 1.271 0.151 -5.631 758 HB VAL 93 HB VAL 93 -0.845 0.732 -7.745 759 HG11 VAL 93 HG11 VAL 93 1.799 2.111 -7.103 760 HG12 VAL 93 HG12 VAL 93 0.850 2.376 -8.567 761 HG13 VAL 93 HG13 VAL 93 0.171 2.825 -7.013 762 HG21 VAL 93 HG21 VAL 93 0.990 0.161 -9.338 763 HG22 VAL 93 HG22 VAL 93 1.988 -0.375 -7.982 764 HG23 VAL 93 HG23 VAL 93 0.475 -1.221 -8.372 765 H ILE 94 H ILE 94 1.236 1.959 -4.353 766 HA ILE 94 HA ILE 94 -1.411 3.126 -3.696 767 HB ILE 94 HB ILE 94 -0.865 3.458 -1.385 768 HG12 ILE 94 HG12 ILE 94 1.693 1.862 -1.860 769 HG13 ILE 94 HG13 ILE 94 1.624 3.606 -1.623 770 HG21 ILE 94 HG21 ILE 94 -0.363 0.506 -1.991 771 HG22 ILE 94 HG22 ILE 94 -1.157 1.233 -0.573 772 HG23 ILE 94 HG23 ILE 94 -1.942 1.292 -2.133 773 HD11 ILE 94 HD11 ILE 94 2.204 2.608 0.493 774 HD12 ILE 94 HD12 ILE 94 0.540 3.218 0.611 775 HD13 ILE 94 HD13 ILE 94 0.834 1.486 0.394 776 H ARG 95 H ARG 95 -1.479 5.254 -3.100 777 HA ARG 95 HA ARG 95 0.674 6.952 -4.297 778 HB2 ARG 95 HB2 ARG 95 -1.594 7.005 -5.248 779 HB3 ARG 95 HB3 ARG 95 -2.236 7.603 -3.724 780 HG2 ARG 95 HG2 ARG 95 -0.096 9.080 -5.313 781 HG3 ARG 95 HG3 ARG 95 -1.835 9.284 -5.575 782 HD2 ARG 95 HD2 ARG 95 -2.037 9.832 -3.088 783 HD3 ARG 95 HD3 ARG 95 -0.283 9.924 -3.056 784 HE ARG 95 HE ARG 95 -0.290 11.856 -4.425 785 HH11 ARG 95 HH11 ARG 95 -1.075 13.708 -5.059 786 HH12 ARG 95 HH12 ARG 95 -2.798 13.996 -5.145 787 HH21 ARG 95 HH21 ARG 95 -3.627 10.867 -3.949 788 HH22 ARG 95 HH22 ARG 95 -4.223 12.404 -4.514 789 H ILE 96 H ILE 96 2.135 7.206 -2.742 790 HA ILE 96 HA ILE 96 1.423 7.881 0.044 791 HB ILE 96 HB ILE 96 3.871 7.820 0.435 792 HG12 ILE 96 HG12 ILE 96 4.167 6.672 -2.367 793 HG13 ILE 96 HG13 ILE 96 4.452 8.383 -2.016 794 HG21 ILE 96 HG21 ILE 96 2.553 5.840 0.888 795 HG22 ILE 96 HG22 ILE 96 2.613 5.356 -0.819 796 HG23 ILE 96 HG23 ILE 96 4.073 5.326 0.170 797 HD11 ILE 96 HD11 ILE 96 5.970 6.059 -0.827 798 HD12 ILE 96 HD12 ILE 96 6.545 7.255 -2.009 799 HD13 ILE 96 HD13 ILE 96 6.156 7.768 -0.350 800 H GLN 97 H GLN 97 2.302 9.717 1.158 801 HA GLN 97 HA GLN 97 2.920 12.080 -0.543 802 HB2 GLN 97 HB2 GLN 97 2.373 11.811 2.423 803 HB3 GLN 97 HB3 GLN 97 3.133 13.233 1.706 804 HG2 GLN 97 HG2 GLN 97 1.017 12.998 0.006 805 HG3 GLN 97 HG3 GLN 97 0.304 12.280 1.452 806 HE21 GLN 97 HE21 GLN 97 1.368 16.281 1.396 807 HE22 GLN 97 HE22 GLN 97 2.156 15.152 0.287 808 H ASP 98 H ASP 98 4.860 13.182 -0.459 809 HA ASP 98 HA ASP 98 7.202 11.462 0.116 810 HB2 ASP 98 HB2 ASP 98 6.710 12.658 -2.072 811 HB3 ASP 98 HB3 ASP 98 6.991 14.161 -1.184 812 H GLY 99 H GLY 99 5.503 13.586 1.983 813 HA2 GLY 99 HA2 GLY 99 5.964 14.538 4.035 814 HA3 GLY 99 HA3 GLY 99 7.621 13.947 3.919 815 H THR 100 H THR 100 6.552 15.978 1.311 816 HA THR 100 HA THR 100 7.512 18.453 2.579 817 HB THR 100 HB THR 100 9.523 17.392 1.781 818 HG1 THR 100 HG1 THR 100 8.842 19.728 0.356 819 HG21 THR 100 HG21 THR 100 8.674 16.273 -0.229 820 HG22 THR 100 HG22 THR 100 8.440 17.856 -1.010 821 HG23 THR 100 HG23 THR 100 10.073 17.308 -0.573 822 H GLY 101 H GLY 101 4.923 17.740 1.827 823 HA2 GLY 101 HA2 GLY 101 3.097 18.976 1.122 824 HA3 GLY 101 HA3 GLY 101 4.169 20.115 0.301 825 H ARG 102 H ARG 102 4.498 16.728 -0.404 826 HA ARG 102 HA ARG 102 3.062 16.894 -2.994 827 HB2 ARG 102 HB2 ARG 102 4.946 16.599 -4.309 828 HB3 ARG 102 HB3 ARG 102 5.300 17.917 -3.168 829 HG2 ARG 102 HG2 ARG 102 6.594 16.293 -1.785 830 HG3 ARG 102 HG3 ARG 102 6.371 15.082 -3.080 831 HD2 ARG 102 HD2 ARG 102 7.570 17.822 -3.525 832 HD3 ARG 102 HD3 ARG 102 8.559 16.422 -3.102 833 HE ARG 102 HE ARG 102 7.211 16.960 -5.670 834 HH11 ARG 102 HH11 ARG 102 7.738 15.748 -7.432 835 HH12 ARG 102 HH12 ARG 102 8.683 14.301 -7.250 836 HH21 ARG 102 HH21 ARG 102 9.001 14.501 -3.833 837 HH22 ARG 102 HH22 ARG 102 9.380 13.635 -5.295 838 H SER 103 H SER 103 3.653 14.729 -4.287 839 HA SER 103 HA SER 103 3.568 12.384 -2.498 840 HB2 SER 103 HB2 SER 103 1.440 11.592 -3.518 841 HB3 SER 103 HB3 SER 103 1.257 13.033 -2.513 842 HG SER 103 HG SER 103 1.313 14.260 -4.511 843 H ALA 104 H ALA 104 3.415 10.320 -3.572 844 HA ALA 104 HA ALA 104 4.472 10.084 -6.317 845 HB1 ALA 104 HB1 ALA 104 6.485 10.445 -4.923 846 HB2 ALA 104 HB2 ALA 104 5.985 9.114 -3.855 847 HB3 ALA 104 HB3 ALA 104 6.423 8.785 -5.544 848 H PHE 105 H PHE 105 4.351 7.977 -7.181 849 HA PHE 105 HA PHE 105 2.528 6.112 -5.755 850 HB2 PHE 105 HB2 PHE 105 3.529 5.976 -8.609 851 HB3 PHE 105 HB3 PHE 105 2.273 4.988 -7.870 852 HD1 PHE 105 HD1 PHE 105 3.006 8.097 -9.574 853 HD2 PHE 105 HD2 PHE 105 0.141 6.161 -6.994 854 HE1 PHE 105 HE1 PHE 105 1.343 9.851 -10.105 855 HE2 PHE 105 HE2 PHE 105 -1.536 7.890 -7.570 856 HZ PHE 105 HZ PHE 105 -0.950 9.743 -9.118 857 H ILE 106 H ILE 106 3.198 4.310 -4.833 858 HA ILE 106 HA ILE 106 5.760 3.067 -5.740 859 HB ILE 106 HB ILE 106 6.046 2.039 -3.520 860 HG12 ILE 106 HG12 ILE 106 4.179 4.198 -2.452 861 HG13 ILE 106 HG13 ILE 106 3.739 2.500 -2.630 862 HG21 ILE 106 HG21 ILE 106 6.230 5.098 -3.551 863 HG22 ILE 106 HG22 ILE 106 7.259 3.985 -2.621 864 HG23 ILE 106 HG23 ILE 106 7.360 4.019 -4.381 865 HD11 ILE 106 HD11 ILE 106 5.957 3.531 -0.828 866 HD12 ILE 106 HD12 ILE 106 4.373 2.921 -0.339 867 HD13 ILE 106 HD13 ILE 106 5.535 1.820 -1.091 868 H GLY 107 H GLY 107 5.753 1.054 -6.314 869 HA2 GLY 107 HA2 GLY 107 3.293 -0.584 -6.188 870 HA3 GLY 107 HA3 GLY 107 4.777 -0.987 -7.052 871 H ILE 108 H ILE 108 3.151 -2.430 -4.970 872 HA ILE 108 HA ILE 108 5.290 -2.929 -2.957 873 HB ILE 108 HB ILE 108 2.287 -3.201 -2.430 874 HG12 ILE 108 HG12 ILE 108 4.265 -0.950 -1.820 875 HG13 ILE 108 HG13 ILE 108 2.746 -0.837 -2.708 876 HG21 ILE 108 HG21 ILE 108 4.737 -3.345 -0.653 877 HG22 ILE 108 HG22 ILE 108 3.043 -3.492 -0.105 878 HG23 ILE 108 HG23 ILE 108 3.712 -4.723 -1.135 879 HD11 ILE 108 HD11 ILE 108 1.513 -1.390 -0.602 880 HD12 ILE 108 HD12 ILE 108 3.073 -1.301 0.276 881 HD13 ILE 108 HD13 ILE 108 2.456 0.125 -0.540 882 H GLY 109 H GLY 109 5.684 -5.125 -2.454 883 HA2 GLY 109 HA2 GLY 109 3.875 -7.207 -3.561 884 HA3 GLY 109 HA3 GLY 109 5.611 -7.396 -3.791 885 H PHE 110 H PHE 110 3.370 -8.727 -2.160 886 HA PHE 110 HA PHE 110 4.610 -8.737 0.537 887 HB2 PHE 110 HB2 PHE 110 2.036 -9.713 -0.653 888 HB3 PHE 110 HB3 PHE 110 2.567 -10.320 0.907 889 HD1 PHE 110 HD1 PHE 110 2.481 -9.026 2.900 890 HD2 PHE 110 HD2 PHE 110 1.598 -7.184 -0.902 891 HE1 PHE 110 HE1 PHE 110 1.615 -7.030 4.074 892 HE2 PHE 110 HE2 PHE 110 0.799 -5.147 0.286 893 HZ PHE 110 HZ PHE 110 0.829 -5.059 2.756 894 H THR 111 H THR 111 5.072 -10.633 1.663 895 HA THR 111 HA THR 111 6.583 -12.575 0.109 896 HB THR 111 HB THR 111 7.239 -11.474 2.253 897 HG1 THR 111 HG1 THR 111 8.398 -13.287 2.870 898 HG21 THR 111 HG21 THR 111 5.540 -13.653 3.536 899 HG22 THR 111 HG22 THR 111 6.662 -12.563 4.365 900 HG23 THR 111 HG23 THR 111 5.206 -11.907 3.599 901 H ASP 112 H ASP 112 3.445 -12.483 1.551 902 HA ASP 112 HA ASP 112 2.877 -15.249 0.610 903 HB2 ASP 112 HB2 ASP 112 3.239 -15.032 3.176 904 HB3 ASP 112 HB3 ASP 112 1.701 -14.158 3.187 905 H ARG 113 H ARG 113 0.875 -15.542 -0.350 906 HA ARG 113 HA ARG 113 -0.583 -13.269 -1.332 907 HB2 ARG 113 HB2 ARG 113 -0.469 -15.499 -2.462 908 HB3 ARG 113 HB3 ARG 113 -1.393 -16.209 -1.144 909 HG2 ARG 113 HG2 ARG 113 -2.831 -15.820 -3.071 910 HG3 ARG 113 HG3 ARG 113 -3.356 -14.838 -1.715 911 HD2 ARG 113 HD2 ARG 113 -3.516 -13.530 -3.712 912 HD3 ARG 113 HD3 ARG 113 -2.222 -12.847 -2.744 913 HE ARG 113 HE ARG 113 -0.608 -14.111 -4.211 914 HH11 ARG 113 HH11 ARG 113 0.045 -14.296 -6.348 915 HH12 ARG 113 HH12 ARG 113 -1.084 -13.866 -7.605 916 HH21 ARG 113 HH21 ARG 113 -3.729 -13.291 -5.579 917 HH22 ARG 113 HH22 ARG 113 -3.133 -13.556 -7.223 918 H GLY 114 H GLY 114 -1.077 -15.319 1.533 919 HA2 GLY 114 HA2 GLY 114 -3.694 -14.281 2.244 920 HA3 GLY 114 HA3 GLY 114 -2.560 -15.154 3.286 921 H ASP 115 H ASP 115 -0.324 -13.297 3.005 922 HA ASP 115 HA ASP 115 -1.076 -11.267 4.925 923 HB2 ASP 115 HB2 ASP 115 1.455 -11.630 3.304 924 HB3 ASP 115 HB3 ASP 115 1.209 -10.359 4.499 925 H ALA 116 H ALA 116 -0.603 -11.241 1.396 926 HA ALA 116 HA ALA 116 -1.146 -8.437 1.095 927 HB1 ALA 116 HB1 ALA 116 -1.081 -8.915 -1.218 928 HB2 ALA 116 HB2 ALA 116 -0.023 -10.152 -0.529 929 HB3 ALA 116 HB3 ALA 116 -1.666 -10.578 -1.004 930 H PHE 117 H PHE 117 -3.262 -11.352 0.976 931 HA PHE 117 HA PHE 117 -5.671 -10.022 0.266 932 HB2 PHE 117 HB2 PHE 117 -5.092 -12.530 0.346 933 HB3 PHE 117 HB3 PHE 117 -5.470 -12.462 2.058 934 HD1 PHE 117 HD1 PHE 117 -6.768 -12.472 -1.373 935 HD2 PHE 117 HD2 PHE 117 -7.851 -12.053 2.780 936 HE1 PHE 117 HE1 PHE 117 -9.143 -12.944 -1.945 937 HE2 PHE 117 HE2 PHE 117 -10.224 -12.513 2.201 938 HZ PHE 117 HZ PHE 117 -10.872 -12.956 -0.157 939 H ASP 118 H ASP 118 -4.014 -10.252 3.404 940 HA ASP 118 HA ASP 118 -6.222 -9.061 4.922 941 HB2 ASP 118 HB2 ASP 118 -3.312 -9.639 5.532 942 HB3 ASP 118 HB3 ASP 118 -4.378 -8.810 6.663 943 H PHE 119 H PHE 119 -3.306 -7.817 3.215 944 HA PHE 119 HA PHE 119 -3.557 -5.118 4.098 945 HB2 PHE 119 HB2 PHE 119 -1.565 -5.808 2.995 946 HB3 PHE 119 HB3 PHE 119 -2.423 -6.356 1.576 947 HD1 PHE 119 HD1 PHE 119 -3.474 -4.737 -0.008 948 HD2 PHE 119 HD2 PHE 119 -0.894 -3.489 3.175 949 HE1 PHE 119 HE1 PHE 119 -3.228 -2.503 -1.090 950 HE2 PHE 119 HE2 PHE 119 -0.794 -1.211 2.218 951 HZ PHE 119 HZ PHE 119 -1.941 -0.722 0.061 952 H ASN 120 H ASN 120 -5.209 -6.942 1.532 953 HA ASN 120 HA ASN 120 -6.861 -4.720 0.643 954 HB2 ASN 120 HB2 ASN 120 -6.620 -6.330 -0.972 955 HB3 ASN 120 HB3 ASN 120 -6.711 -7.688 0.161 956 HD21 ASN 120 HD21 ASN 120 -10.153 -6.161 -1.373 957 HD22 ASN 120 HD22 ASN 120 -8.639 -5.253 -1.520 958 H VAL 121 H VAL 121 -7.689 -7.598 2.684 959 HA VAL 121 HA VAL 121 -10.356 -6.741 3.092 960 HB VAL 121 HB VAL 121 -8.564 -8.762 4.373 961 HG11 VAL 121 HG11 VAL 121 -11.450 -8.273 5.232 962 HG12 VAL 121 HG12 VAL 121 -10.498 -9.721 5.625 963 HG13 VAL 121 HG13 VAL 121 -10.006 -8.158 6.268 964 HG21 VAL 121 HG21 VAL 121 -9.505 -9.264 2.166 965 HG22 VAL 121 HG22 VAL 121 -10.163 -10.351 3.386 966 HG23 VAL 121 HG23 VAL 121 -11.153 -9.003 2.792 967 H SER 122 H SER 122 -7.492 -5.934 5.047 968 HA SER 122 HA SER 122 -9.007 -4.740 7.194 969 HB2 SER 122 HB2 SER 122 -6.928 -3.553 7.745 970 HB3 SER 122 HB3 SER 122 -6.695 -5.298 7.525 971 HG SER 122 HG SER 122 -5.716 -4.967 5.623 972 H LEU 123 H LEU 123 -8.209 -3.537 3.954 973 HA LEU 123 HA LEU 123 -9.365 -0.883 4.569 974 HB2 LEU 123 HB2 LEU 123 -8.587 -2.096 1.907 975 HB3 LEU 123 HB3 LEU 123 -9.073 -0.426 2.189 976 HG LEU 123 HG LEU 123 -6.580 -1.802 3.254 977 HD11 LEU 123 HD11 LEU 123 -6.844 0.499 1.304 978 HD12 LEU 123 HD12 LEU 123 -5.373 -0.415 1.726 979 HD13 LEU 123 HD13 LEU 123 -6.659 -1.204 0.813 980 HD21 LEU 123 HD21 LEU 123 -7.511 1.077 3.631 981 HD22 LEU 123 HD22 LEU 123 -7.281 -0.138 4.910 982 HD23 LEU 123 HD23 LEU 123 -5.887 0.468 4.023 983 H GLN 124 H GLN 124 -10.425 -3.927 2.946 984 HA GLN 124 HA GLN 124 -12.947 -2.924 2.085 985 HB2 GLN 124 HB2 GLN 124 -12.291 -5.762 2.972 986 HB3 GLN 124 HB3 GLN 124 -13.777 -5.242 2.192 987 HG2 GLN 124 HG2 GLN 124 -12.318 -4.377 0.252 988 HG3 GLN 124 HG3 GLN 124 -11.008 -5.325 0.972 989 HE21 GLN 124 HE21 GLN 124 -12.566 -8.492 0.148 990 HE22 GLN 124 HE22 GLN 124 -11.144 -7.709 0.811 991 H ASP 125 H ASP 125 -12.214 -4.570 5.231 992 HA ASP 125 HA ASP 125 -14.843 -4.208 6.383 993 HB2 ASP 125 HB2 ASP 125 -12.992 -5.812 7.063 994 HB3 ASP 125 HB3 ASP 125 -12.119 -4.419 7.723 995 H HIS 126 H HIS 126 -12.316 -1.936 5.826 996 HA HIS 126 HA HIS 126 -13.233 -0.030 7.897 997 HB2 HIS 126 HB2 HIS 126 -10.923 -0.025 7.755 998 HB3 HIS 126 HB3 HIS 126 -10.913 -0.138 6.000 999 HD2 HIS 126 HD2 HIS 126 -11.253 1.997 4.561 1000 HE1 HIS 126 HE1 HIS 126 -11.265 4.891 7.667 1001 HE2 HIS 126 HE2 HIS 126 -11.289 4.562 5.138 1002 H PHE 127 H PHE 127 -13.670 -0.652 4.446 1003 HA PHE 127 HA PHE 127 -15.122 1.926 4.167 1004 HB2 PHE 127 HB2 PHE 127 -13.955 0.050 2.125 1005 HB3 PHE 127 HB3 PHE 127 -15.129 1.293 1.706 1006 HD1 PHE 127 HD1 PHE 127 -14.631 3.728 2.744 1007 HD2 PHE 127 HD2 PHE 127 -11.663 0.696 1.971 1008 HE1 PHE 127 HE1 PHE 127 -12.848 5.453 2.774 1009 HE2 PHE 127 HE2 PHE 127 -9.891 2.439 1.971 1010 HZ PHE 127 HZ PHE 127 -10.496 4.811 2.405 1011 H LYS 128 H LYS 128 -15.681 -1.404 4.451 1012 HA LYS 128 HA LYS 128 -18.125 -2.045 3.419 1013 HB2 LYS 128 HB2 LYS 128 -16.704 -3.591 4.436 1014 HB3 LYS 128 HB3 LYS 128 -16.599 -2.707 5.952 1015 HG2 LYS 128 HG2 LYS 128 -19.246 -3.826 5.147 1016 HG3 LYS 128 HG3 LYS 128 -17.963 -4.949 5.607 1017 HD2 LYS 128 HD2 LYS 128 -18.724 -2.622 7.378 1018 HD3 LYS 128 HD3 LYS 128 -19.578 -4.165 7.476 1019 HE2 LYS 128 HE2 LYS 128 -16.572 -3.821 7.826 1020 HE3 LYS 128 HE3 LYS 128 -17.720 -3.807 9.162 1021 HZ1 LYS 128 HZ1 LYS 128 -16.625 -5.972 8.679 1022 HZ2 LYS 128 HZ2 LYS 128 -18.272 -6.067 8.750 1023 HZ3 LYS 128 HZ3 LYS 128 -17.492 -6.109 7.307 1024 H TRP 129 H TRP 129 -17.660 -0.048 6.284 1025 HA TRP 129 HA TRP 129 -20.610 0.168 6.724 1026 HB2 TRP 129 HB2 TRP 129 -19.945 0.960 8.982 1027 HB3 TRP 129 HB3 TRP 129 -19.511 -0.692 8.598 1028 HD1 TRP 129 HD1 TRP 129 -16.915 -1.324 8.425 1029 HE1 TRP 129 HE1 TRP 129 -14.807 -0.158 9.041 1030 HE3 TRP 129 HE3 TRP 129 -18.803 3.391 9.088 1031 HZ2 TRP 129 HZ2 TRP 129 -13.928 2.555 9.734 1032 HZ3 TRP 129 HZ3 TRP 129 -17.255 5.295 9.577 1033 HH2 TRP 129 HH2 TRP 129 -14.843 4.875 9.952 1034 H VAL 130 H VAL 130 -18.664 1.805 4.846 1035 HA VAL 130 HA VAL 130 -20.017 4.423 5.266 1036 HB VAL 130 HB VAL 130 -17.448 5.103 4.284 1037 HG11 VAL 130 HG11 VAL 130 -18.660 5.339 7.071 1038 HG12 VAL 130 HG12 VAL 130 -17.301 6.292 6.459 1039 HG13 VAL 130 HG13 VAL 130 -18.903 6.473 5.724 1040 HG21 VAL 130 HG21 VAL 130 -15.851 4.404 5.901 1041 HG22 VAL 130 HG22 VAL 130 -17.045 3.416 6.752 1042 HG23 VAL 130 HG23 VAL 130 -16.546 2.978 5.123 1043 H LYS 131 H LYS 131 -18.925 5.758 3.092 1044 HA LYS 131 HA LYS 131 -18.798 5.999 0.860 1045 HB2 LYS 131 HB2 LYS 131 -17.130 4.162 1.480 1046 HB3 LYS 131 HB3 LYS 131 -18.245 3.017 0.741 1047 HG2 LYS 131 HG2 LYS 131 -17.908 4.018 -1.459 1048 HG3 LYS 131 HG3 LYS 131 -17.066 5.403 -0.737 1049 HD2 LYS 131 HD2 LYS 131 -15.381 3.958 -1.622 1050 HD3 LYS 131 HD3 LYS 131 -15.339 3.853 0.144 1051 HE2 LYS 131 HE2 LYS 131 -15.071 1.628 -0.531 1052 HE3 LYS 131 HE3 LYS 131 -16.779 1.718 -0.098 1053 HZ1 LYS 131 HZ1 LYS 131 -17.282 1.909 -2.512 1054 HZ2 LYS 131 HZ2 LYS 131 -15.673 1.839 -2.858 1055 HZ3 LYS 131 HZ3 LYS 131 -16.420 0.563 -2.201 1056 H GLN 132 H GLN 132 -21.394 4.952 1.976 1057 HA GLN 132 HA GLN 132 -23.525 4.591 1.298 1058 HB2 GLN 132 HB2 GLN 132 -22.748 6.178 -1.169 1059 HB3 GLN 132 HB3 GLN 132 -24.336 6.025 -0.430 1060 HG2 GLN 132 HG2 GLN 132 -23.661 8.123 0.299 1061 HG3 GLN 132 HG3 GLN 132 -23.321 7.097 1.686 1062 HE21 GLN 132 HE21 GLN 132 -20.100 8.593 1.747 1063 HE22 GLN 132 HE22 GLN 132 -21.557 8.178 2.639 1064 H GLU 133 H GLU 133 -21.621 2.466 0.374 1065 HA GLU 133 HA GLU 133 -23.370 1.201 -1.710 1066 HB2 GLU 133 HB2 GLU 133 -20.375 0.957 -1.277 1067 HB3 GLU 133 HB3 GLU 133 -21.320 -0.144 -2.287 1068 HG2 GLU 133 HG2 GLU 133 -22.049 1.731 -3.714 1069 HG3 GLU 133 HG3 GLU 133 -21.116 2.864 -2.740 1070 H1 SER 149 H1 SER 149 17.018 -23.105 -10.782 1071 H2 SER 149 H2 SER 149 18.011 -23.026 -12.088 1072 H3 SER 149 H3 SER 149 16.405 -23.284 -12.292 1073 HA SER 149 HA SER 149 17.606 -20.840 -11.181 1074 HB2 SER 149 HB2 SER 149 16.376 -21.255 -13.935 1075 HB3 SER 149 HB3 SER 149 17.036 -19.740 -13.283 1076 HG SER 149 HG SER 149 18.566 -20.854 -14.580 1077 H GLN 150 H GLN 150 16.119 -19.081 -10.839 1078 HA GLN 150 HA GLN 150 13.495 -19.906 -9.873 1079 HB2 GLN 150 HB2 GLN 150 14.866 -17.199 -10.095 1080 HB3 GLN 150 HB3 GLN 150 13.271 -17.420 -9.391 1081 HG2 GLN 150 HG2 GLN 150 15.807 -18.759 -8.346 1082 HG3 GLN 150 HG3 GLN 150 15.115 -17.274 -7.713 1083 HE21 GLN 150 HE21 GLN 150 13.912 -19.930 -5.456 1084 HE22 GLN 150 HE22 GLN 150 15.452 -19.180 -5.856 1085 H ILE 151 H ILE 151 11.492 -18.996 -10.482 1086 HA ILE 151 HA ILE 151 11.211 -18.176 -13.346 1087 HB ILE 151 HB ILE 151 9.464 -20.067 -11.739 1088 HG12 ILE 151 HG12 ILE 151 11.487 -21.159 -12.575 1089 HG13 ILE 151 HG13 ILE 151 10.037 -21.770 -13.346 1090 HG21 ILE 151 HG21 ILE 151 7.954 -18.802 -13.108 1091 HG22 ILE 151 HG22 ILE 151 9.006 -18.948 -14.534 1092 HG23 ILE 151 HG23 ILE 151 8.171 -20.370 -13.875 1093 HD11 ILE 151 HD11 ILE 151 10.553 -20.501 -15.406 1094 HD12 ILE 151 HD12 ILE 151 12.007 -19.828 -14.634 1095 HD13 ILE 151 HD13 ILE 151 11.888 -21.566 -14.942 1096 H THR 152 H THR 152 9.570 -16.744 -13.829 1097 HA THR 152 HA THR 152 9.098 -14.737 -11.752 1098 HB THR 152 HB THR 152 8.021 -13.470 -13.669 1099 HG1 THR 152 HG1 THR 152 8.536 -14.294 -15.742 1100 HG21 THR 152 HG21 THR 152 10.384 -13.125 -13.001 1101 HG22 THR 152 HG22 THR 152 10.885 -14.426 -14.104 1102 HG23 THR 152 HG23 THR 152 10.154 -12.938 -14.746 1103 H SER 153 H SER 153 7.175 -13.910 -11.046 1104 HA SER 153 HA SER 153 4.723 -15.602 -11.389 1105 HB2 SER 153 HB2 SER 153 5.698 -14.159 -8.923 1106 HB3 SER 153 HB3 SER 153 4.174 -15.059 -9.096 1107 HG SER 153 HG SER 153 5.848 -16.332 -8.122 1108 H GLN 154 H GLN 154 4.642 -13.986 -13.186 1109 HA GLN 154 HA GLN 154 4.099 -11.253 -12.908 1110 HB2 GLN 154 HB2 GLN 154 3.196 -13.234 -15.030 1111 HB3 GLN 154 HB3 GLN 154 3.005 -11.482 -15.171 1112 HG2 GLN 154 HG2 GLN 154 5.451 -11.173 -14.990 1113 HG3 GLN 154 HG3 GLN 154 5.680 -12.920 -14.880 1114 HE21 GLN 154 HE21 GLN 154 6.323 -12.051 -18.410 1115 HE22 GLN 154 HE22 GLN 154 7.088 -11.758 -16.855 1116 H VAL 155 H VAL 155 2.080 -10.026 -13.231 1117 HA VAL 155 HA VAL 155 -0.113 -10.978 -11.637 1118 HB VAL 155 HB VAL 155 -0.518 -8.693 -13.541 1119 HG11 VAL 155 HG11 VAL 155 -1.327 -9.176 -10.605 1120 HG12 VAL 155 HG12 VAL 155 -1.760 -7.763 -11.568 1121 HG13 VAL 155 HG13 VAL 155 -2.377 -9.329 -12.033 1122 HG21 VAL 155 HG21 VAL 155 1.692 -8.153 -12.727 1123 HG22 VAL 155 HG22 VAL 155 0.460 -7.103 -11.996 1124 HG23 VAL 155 HG23 VAL 155 1.151 -8.437 -11.040 1125 H TPO 156 H T2P 156 -2.142 -11.483 -12.377 1126 HA TPO 156 HA T2P 156 -2.302 -12.888 -14.952 1127 HB TPO 156 HB T2P 156 -3.026 -13.675 -12.555 1128 HG21 TPO 156 HG21 T2P 156 -5.288 -13.700 -12.110 1129 HG22 TPO 156 HG22 T2P 156 -5.708 -12.952 -13.666 1130 HG23 TPO 156 HG23 T2P 156 -4.835 -12.039 -12.395 1131 H GLY 157 H GLY 157 -4.348 -13.076 -15.960 1132 HA2 GLY 157 HA2 GLY 157 -5.969 -10.631 -16.301 1133 HA3 GLY 157 HA3 GLY 157 -4.913 -11.001 -17.672 1134 H GLN 158 H GLN 158 -6.261 -13.642 -15.834 1135 HA GLN 158 HA GLN 158 -8.321 -14.228 -17.883 1136 HB2 GLN 158 HB2 GLN 158 -7.289 -16.393 -18.425 1137 HB3 GLN 158 HB3 GLN 158 -6.272 -15.026 -18.883 1138 HG2 GLN 158 HG2 GLN 158 -4.901 -15.373 -16.806 1139 HG3 GLN 158 HG3 GLN 158 -5.890 -16.773 -16.410 1140 HE21 GLN 158 HE21 GLN 158 -2.940 -18.240 -17.947 1141 HE22 GLN 158 HE22 GLN 158 -3.438 -17.417 -16.445 1142 H ILE 159 H ILE 159 -6.811 -15.312 -14.819 1143 HA ILE 159 HA ILE 159 -9.002 -17.208 -14.403 1144 HB ILE 159 HB ILE 159 -6.728 -17.751 -13.786 1145 HG12 ILE 159 HG12 ILE 159 -8.642 -17.780 -11.421 1146 HG13 ILE 159 HG13 ILE 159 -8.709 -18.875 -12.802 1147 HG21 ILE 159 HG21 ILE 159 -5.663 -16.867 -11.743 1148 HG22 ILE 159 HG22 ILE 159 -5.925 -15.626 -12.946 1149 HG23 ILE 159 HG23 ILE 159 -7.004 -15.727 -11.535 1150 HD11 ILE 159 HD11 ILE 159 -6.482 -18.714 -10.732 1151 HD12 ILE 159 HD12 ILE 159 -7.648 -20.021 -10.973 1152 HD13 ILE 159 HD13 ILE 159 -6.414 -19.707 -12.210 1153 H GLY 160 H GLY 160 -8.238 -14.032 -13.112 1154 HA2 GLY 160 HA2 GLY 160 -9.607 -12.432 -12.141 1155 HA3 GLY 160 HA3 GLY 160 -10.991 -13.388 -12.680 1156 H TRP 161 H TRP 161 -8.388 -14.047 -10.311 1157 HA TRP 161 HA TRP 161 -10.323 -15.335 -8.525 1158 HB2 TRP 161 HB2 TRP 161 -8.468 -16.545 -7.691 1159 HB3 TRP 161 HB3 TRP 161 -8.574 -16.651 -9.427 1160 HD1 TRP 161 HD1 TRP 161 -6.790 -13.589 -9.439 1161 HE1 TRP 161 HE1 TRP 161 -4.261 -13.930 -9.504 1162 HE3 TRP 161 HE3 TRP 161 -6.555 -18.367 -7.602 1163 HZ2 TRP 161 HZ2 TRP 161 -2.378 -16.030 -8.971 1164 HZ3 TRP 161 HZ3 TRP 161 -4.353 -19.503 -7.350 1165 HH2 TRP 161 HH2 TRP 161 -2.262 -18.350 -8.042 1166 H ARG 162 H ARG 162 -7.518 -14.542 -7.124 1167 HA ARG 162 HA ARG 162 -8.671 -13.425 -4.776 1168 HB2 ARG 162 HB2 ARG 162 -5.757 -13.491 -5.648 1169 HB3 ARG 162 HB3 ARG 162 -6.326 -13.297 -3.985 1170 HG2 ARG 162 HG2 ARG 162 -6.635 -15.780 -5.729 1171 HG3 ARG 162 HG3 ARG 162 -5.482 -15.554 -4.414 1172 HD2 ARG 162 HD2 ARG 162 -7.364 -15.323 -2.802 1173 HD3 ARG 162 HD3 ARG 162 -8.515 -15.606 -4.126 1174 HE ARG 162 HE ARG 162 -6.649 -17.746 -4.115 1175 HH11 ARG 162 HH11 ARG 162 -7.139 -19.751 -3.297 1176 HH12 ARG 162 HH12 ARG 162 -8.423 -19.929 -2.138 1177 HH21 ARG 162 HH21 ARG 162 -9.248 -16.601 -2.060 1178 HH22 ARG 162 HH22 ARG 162 -9.592 -18.199 -1.455 1179 H ARG 163 H ARG 163 -8.004 -11.470 -3.678 1180 HA ARG 163 HA ARG 163 -7.974 -9.052 -5.414 1181 HB2 ARG 163 HB2 ARG 163 -9.939 -8.185 -4.268 1182 HB3 ARG 163 HB3 ARG 163 -10.302 -9.723 -5.054 1183 HG2 ARG 163 HG2 ARG 163 -9.919 -10.836 -2.771 1184 HG3 ARG 163 HG3 ARG 163 -9.881 -9.219 -2.075 1185 HD2 ARG 163 HD2 ARG 163 -12.193 -10.429 -3.656 1186 HD3 ARG 163 HD3 ARG 163 -12.063 -10.418 -1.907 1187 HE ARG 163 HE ARG 163 -12.372 -8.056 -1.842 1188 HH11 ARG 163 HH11 ARG 163 -13.780 -6.505 -2.378 1189 HH12 ARG 163 HH12 ARG 163 -14.302 -6.320 -4.037 1190 HH21 ARG 163 HH21 ARG 163 -12.775 -9.192 -5.137 1191 HH22 ARG 163 HH22 ARG 163 -13.789 -7.838 -5.551 Start of MODEL 26 1 H1 GLY -4 H1 GLY -4 1.170 33.828 25.685 2 H2 GLY -4 H2 GLY -4 2.240 33.979 24.452 3 H3 GLY -4 H3 GLY -4 2.779 33.730 25.978 4 HA2 GLY -4 HA2 GLY -4 1.805 31.534 26.041 5 HA3 GLY -4 HA3 GLY -4 1.196 31.806 24.397 6 H SER -3 H SER -3 3.007 29.695 25.363 7 HA SER -3 HA SER -3 5.681 30.270 24.384 8 HB2 SER -3 HB2 SER -3 6.135 27.951 24.929 9 HB3 SER -3 HB3 SER -3 5.202 28.690 26.237 10 HG SER -3 HG SER -3 4.322 26.674 25.722 11 HA PRO -2 HA PRO -2 5.352 28.968 20.114 12 HB2 PRO -2 HB2 PRO -2 7.617 27.046 20.662 13 HB3 PRO -2 HB3 PRO -2 7.431 28.215 19.318 14 HG2 PRO -2 HG2 PRO -2 9.055 28.810 21.389 15 HG3 PRO -2 HG3 PRO -2 7.928 30.063 20.769 16 HD2 PRO -2 HD2 PRO -2 7.575 28.239 23.167 17 HD3 PRO -2 HD3 PRO -2 7.324 30.007 23.046 18 H ASN -1 H ASN -1 5.241 26.525 22.618 19 HA ASN -1 HA ASN -1 4.116 24.434 20.845 20 HB2 ASN -1 HB2 ASN -1 4.862 24.481 23.798 21 HB3 ASN -1 HB3 ASN -1 4.179 23.087 22.969 22 HD21 ASN -1 HD21 ASN -1 7.826 22.569 23.042 23 HD22 ASN -1 HD22 ASN -1 6.549 22.738 24.239 24 H SER 0 H SER 0 2.822 27.108 22.448 25 HA SER 0 HA SER 0 0.466 25.987 23.622 26 HB2 SER 0 HB2 SER 0 1.415 28.242 24.110 27 HB3 SER 0 HB3 SER 0 0.834 28.792 22.522 28 HG SER 0 HG SER 0 -0.661 29.212 24.259 29 H MET 1 H MET 1 -1.635 25.893 22.916 30 HA MET 1 HA MET 1 -3.314 25.244 21.583 31 HB2 MET 1 HB2 MET 1 -2.313 27.392 19.695 32 HB3 MET 1 HB3 MET 1 -3.925 26.675 19.707 33 HG2 MET 1 HG2 MET 1 -4.276 27.489 22.020 34 HG3 MET 1 HG3 MET 1 -2.708 28.295 21.974 35 HE1 MET 1 HE1 MET 1 -2.514 29.627 19.085 36 HE2 MET 1 HE2 MET 1 -3.209 31.214 19.466 37 HE3 MET 1 HE3 MET 1 -2.127 30.421 20.631 38 H ALA 2 H ALA 2 -0.396 24.142 20.780 39 HA ALA 2 HA ALA 2 -1.011 22.981 18.162 40 HB1 ALA 2 HB1 ALA 2 1.302 22.477 20.075 41 HB2 ALA 2 HB2 ALA 2 1.218 22.017 18.364 42 HB3 ALA 2 HB3 ALA 2 1.267 23.733 18.812 43 H THR 3 H THR 3 -2.092 22.189 21.212 44 HA THR 3 HA THR 3 -1.657 19.319 21.187 45 HB THR 3 HB THR 3 -2.910 19.421 23.365 46 HG1 THR 3 HG1 THR 3 -4.096 21.295 23.109 47 HG21 THR 3 HG21 THR 3 -1.044 20.499 24.520 48 HG22 THR 3 HG22 THR 3 -0.452 19.540 23.145 49 HG23 THR 3 HG23 THR 3 -0.543 21.306 23.013 50 H GLU 4 H GLU 4 -2.829 19.540 19.031 51 HA GLU 4 HA GLU 4 -5.685 18.719 19.224 52 HB2 GLU 4 HB2 GLU 4 -4.966 20.130 17.317 53 HB3 GLU 4 HB3 GLU 4 -3.814 18.890 16.827 54 HG2 GLU 4 HG2 GLU 4 -5.818 18.836 15.432 55 HG3 GLU 4 HG3 GLU 4 -5.644 17.333 16.319 56 H LEU 5 H LEU 5 -6.356 16.583 18.597 57 HA LEU 5 HA LEU 5 -4.733 14.517 19.764 58 HB2 LEU 5 HB2 LEU 5 -7.230 14.314 18.039 59 HB3 LEU 5 HB3 LEU 5 -6.534 12.989 18.967 60 HG LEU 5 HG LEU 5 -7.715 15.541 20.150 61 HD11 LEU 5 HD11 LEU 5 -9.387 14.022 19.149 62 HD12 LEU 5 HD12 LEU 5 -8.742 12.670 20.105 63 HD13 LEU 5 HD13 LEU 5 -9.516 14.053 20.915 64 HD21 LEU 5 HD21 LEU 5 -6.647 13.027 21.510 65 HD22 LEU 5 HD22 LEU 5 -5.965 14.667 21.634 66 HD23 LEU 5 HD23 LEU 5 -7.556 14.325 22.315 67 H GLU 6 H GLU 6 -5.477 15.286 16.506 68 HA GLU 6 HA GLU 6 -4.985 14.278 14.470 69 HB2 GLU 6 HB2 GLU 6 -2.435 15.237 15.730 70 HB3 GLU 6 HB3 GLU 6 -2.328 14.455 14.155 71 HG2 GLU 6 HG2 GLU 6 -4.256 16.739 14.631 72 HG3 GLU 6 HG3 GLU 6 -2.572 16.994 14.194 73 H TYR 7 H TYR 7 -5.794 12.255 15.892 74 HA TYR 7 HA TYR 7 -3.800 10.227 16.298 75 HB2 TYR 7 HB2 TYR 7 -5.421 9.074 17.492 76 HB3 TYR 7 HB3 TYR 7 -5.820 10.754 17.775 77 HD1 TYR 7 HD1 TYR 7 -6.975 7.551 16.530 78 HD2 TYR 7 HD2 TYR 7 -7.779 11.796 16.436 79 HE1 TYR 7 HE1 TYR 7 -9.260 7.093 15.707 80 HE2 TYR 7 HE2 TYR 7 -10.058 11.337 15.562 81 HH TYR 7 HH TYR 7 -11.282 7.991 15.090 82 H GLU 8 H GLU 8 -4.423 7.893 15.842 83 HA GLU 8 HA GLU 8 -5.842 7.238 13.462 84 HB2 GLU 8 HB2 GLU 8 -4.011 6.394 12.074 85 HB3 GLU 8 HB3 GLU 8 -3.924 8.122 12.266 86 HG2 GLU 8 HG2 GLU 8 -2.297 7.305 14.346 87 HG3 GLU 8 HG3 GLU 8 -2.049 6.002 13.197 88 H SER 9 H SER 9 -6.672 5.369 13.930 89 HA SER 9 HA SER 9 -5.559 3.692 16.070 90 HB2 SER 9 HB2 SER 9 -8.234 3.783 14.656 91 HB3 SER 9 HB3 SER 9 -7.814 2.567 15.887 92 HG SER 9 HG SER 9 -8.873 4.366 16.823 93 H VAL 10 H VAL 10 -4.599 1.685 15.713 94 HA VAL 10 HA VAL 10 -3.904 0.948 13.037 95 HB VAL 10 HB VAL 10 -3.620 -0.648 15.571 96 HG11 VAL 10 HG11 VAL 10 -1.813 -1.858 14.345 97 HG12 VAL 10 HG12 VAL 10 -3.415 -2.173 13.691 98 HG13 VAL 10 HG13 VAL 10 -2.333 -1.044 12.847 99 HG21 VAL 10 HG21 VAL 10 -2.417 1.542 15.616 100 HG22 VAL 10 HG22 VAL 10 -1.366 0.134 15.697 101 HG23 VAL 10 HG23 VAL 10 -1.520 1.029 14.174 102 H LEU 11 H LEU 11 -4.690 -0.398 11.586 103 HA LEU 11 HA LEU 11 -7.200 -1.930 12.164 104 HB2 LEU 11 HB2 LEU 11 -6.097 -0.916 9.517 105 HB3 LEU 11 HB3 LEU 11 -7.586 -1.820 9.748 106 HG LEU 11 HG LEU 11 -7.031 1.020 10.696 107 HD11 LEU 11 HD11 LEU 11 -8.860 1.507 9.052 108 HD12 LEU 11 HD12 LEU 11 -7.417 0.823 8.295 109 HD13 LEU 11 HD13 LEU 11 -8.852 -0.191 8.568 110 HD21 LEU 11 HD21 LEU 11 -8.510 -0.052 12.333 111 HD22 LEU 11 HD22 LEU 11 -9.436 1.066 11.332 112 HD23 LEU 11 HD23 LEU 11 -9.542 -0.683 11.024 113 H CYS 12 H CYS 12 -4.084 -2.120 10.354 114 HA CYS 12 HA CYS 12 -4.003 -5.038 10.770 115 HB2 CYS 12 HB2 CYS 12 -5.224 -4.877 8.700 116 HB3 CYS 12 HB3 CYS 12 -4.071 -3.713 8.036 117 HG CYS 12 HG CYS 12 -3.859 -6.081 6.873 118 H VAL 13 H VAL 13 -2.022 -5.798 11.083 119 HA VAL 13 HA VAL 13 0.313 -4.117 10.317 120 HB VAL 13 HB VAL 13 -0.048 -4.059 12.746 121 HG11 VAL 13 HG11 VAL 13 0.622 -7.029 12.756 122 HG12 VAL 13 HG12 VAL 13 0.410 -5.973 14.166 123 HG13 VAL 13 HG13 VAL 13 -0.971 -6.329 13.120 124 HG21 VAL 13 HG21 VAL 13 2.204 -3.767 11.795 125 HG22 VAL 13 HG22 VAL 13 2.252 -4.532 13.388 126 HG23 VAL 13 HG23 VAL 13 2.498 -5.517 11.928 127 H LYS 14 H LYS 14 1.851 -5.085 9.166 128 HA LYS 14 HA LYS 14 1.845 -8.033 8.999 129 HB2 LYS 14 HB2 LYS 14 1.869 -6.163 6.609 130 HB3 LYS 14 HB3 LYS 14 2.425 -7.832 6.491 131 HG2 LYS 14 HG2 LYS 14 -0.352 -7.015 7.431 132 HG3 LYS 14 HG3 LYS 14 0.048 -7.507 5.791 133 HD2 LYS 14 HD2 LYS 14 0.701 -9.718 6.489 134 HD3 LYS 14 HD3 LYS 14 0.526 -9.349 8.196 135 HE2 LYS 14 HE2 LYS 14 -1.766 -9.208 6.228 136 HE3 LYS 14 HE3 LYS 14 -1.354 -10.643 7.195 137 HZ1 LYS 14 HZ1 LYS 14 -1.979 -7.999 8.389 138 HZ2 LYS 14 HZ2 LYS 14 -3.082 -9.184 8.206 139 HZ3 LYS 14 HZ3 LYS 14 -1.776 -9.405 9.198 140 HA PRO 15 HA PRO 15 5.803 -7.554 10.381 141 HB2 PRO 15 HB2 PRO 15 6.795 -10.097 10.231 142 HB3 PRO 15 HB3 PRO 15 5.402 -9.658 11.263 143 HG2 PRO 15 HG2 PRO 15 5.318 -10.846 8.457 144 HG3 PRO 15 HG3 PRO 15 4.452 -11.417 9.922 145 HD2 PRO 15 HD2 PRO 15 3.247 -9.809 8.128 146 HD3 PRO 15 HD3 PRO 15 2.981 -9.607 9.888 147 H ASP 16 H ASP 16 5.624 -8.773 7.077 148 HA ASP 16 HA ASP 16 8.231 -7.524 6.448 149 HB2 ASP 16 HB2 ASP 16 8.714 -9.906 6.858 150 HB3 ASP 16 HB3 ASP 16 7.471 -10.370 5.689 151 H VAL 17 H VAL 17 8.155 -6.357 4.641 152 HA VAL 17 HA VAL 17 6.279 -6.933 2.457 153 HB VAL 17 HB VAL 17 4.890 -5.639 4.003 154 HG11 VAL 17 HG11 VAL 17 5.357 -3.266 4.492 155 HG12 VAL 17 HG12 VAL 17 6.563 -4.340 5.205 156 HG13 VAL 17 HG13 VAL 17 6.949 -3.416 3.741 157 HG21 VAL 17 HG21 VAL 17 4.582 -5.372 1.559 158 HG22 VAL 17 HG22 VAL 17 4.100 -3.948 2.493 159 HG23 VAL 17 HG23 VAL 17 5.635 -3.934 1.605 160 H SER 18 H SER 18 6.950 -6.100 0.517 161 HA SER 18 HA SER 18 9.489 -4.523 0.495 162 HB2 SER 18 HB2 SER 18 10.194 -5.712 -1.458 163 HB3 SER 18 HB3 SER 18 9.854 -6.850 -0.158 164 HG SER 18 HG SER 18 7.670 -7.002 -1.246 165 H VAL 19 H VAL 19 9.737 -2.854 -0.902 166 HA VAL 19 HA VAL 19 7.262 -1.878 -2.275 167 HB VAL 19 HB VAL 19 9.183 -0.366 -0.510 168 HG11 VAL 19 HG11 VAL 19 8.790 1.098 -2.389 169 HG12 VAL 19 HG12 VAL 19 7.060 0.672 -2.410 170 HG13 VAL 19 HG13 VAL 19 7.740 1.635 -1.097 171 HG21 VAL 19 HG21 VAL 19 7.128 0.147 0.742 172 HG22 VAL 19 HG22 VAL 19 6.158 -0.770 -0.426 173 HG23 VAL 19 HG23 VAL 19 7.327 -1.598 0.621 174 H TYR 20 H TYR 20 7.395 -0.905 -4.099 175 HA TYR 20 HA TYR 20 9.997 -0.734 -5.581 176 HB2 TYR 20 HB2 TYR 20 7.320 -1.783 -6.605 177 HB3 TYR 20 HB3 TYR 20 8.850 -1.769 -7.464 178 HD1 TYR 20 HD1 TYR 20 6.913 -3.342 -4.693 179 HD2 TYR 20 HD2 TYR 20 10.502 -3.519 -7.069 180 HE1 TYR 20 HE1 TYR 20 7.451 -5.574 -3.732 181 HE2 TYR 20 HE2 TYR 20 10.948 -5.807 -6.187 182 HH TYR 20 HH TYR 20 9.021 -7.236 -3.585 183 H ARG 21 H ARG 21 10.039 1.634 -5.415 184 HA ARG 21 HA ARG 21 7.995 3.397 -6.356 185 HB2 ARG 21 HB2 ARG 21 11.034 3.553 -6.508 186 HB3 ARG 21 HB3 ARG 21 9.989 4.816 -7.168 187 HG2 ARG 21 HG2 ARG 21 8.947 5.164 -4.970 188 HG3 ARG 21 HG3 ARG 21 10.001 3.930 -4.249 189 HD2 ARG 21 HD2 ARG 21 11.975 5.309 -4.780 190 HD3 ARG 21 HD3 ARG 21 10.969 6.447 -5.671 191 HE ARG 21 HE ARG 21 10.089 7.334 -3.678 192 HH11 ARG 21 HH11 ARG 21 10.297 7.987 -1.648 193 HH12 ARG 21 HH12 ARG 21 11.357 7.145 -0.537 194 HH21 ARG 21 HH21 ARG 21 12.309 4.712 -2.810 195 HH22 ARG 21 HH22 ARG 21 12.507 5.362 -1.206 196 H ILE 22 H ILE 22 7.020 3.691 -8.236 197 HA ILE 22 HA ILE 22 8.003 2.116 -10.559 198 HB ILE 22 HB ILE 22 5.735 1.895 -11.307 199 HG12 ILE 22 HG12 ILE 22 5.022 3.665 -8.947 200 HG13 ILE 22 HG13 ILE 22 4.624 3.888 -10.650 201 HG21 ILE 22 HG21 ILE 22 5.866 1.184 -8.400 202 HG22 ILE 22 HG22 ILE 22 5.034 0.320 -9.677 203 HG23 ILE 22 HG23 ILE 22 6.806 0.326 -9.641 204 HD11 ILE 22 HD11 ILE 22 3.443 1.871 -8.715 205 HD12 ILE 22 HD12 ILE 22 2.633 3.212 -9.542 206 HD13 ILE 22 HD13 ILE 22 3.179 1.801 -10.476 207 HA PRO 23 HA PRO 23 8.092 5.834 -13.027 208 HB2 PRO 23 HB2 PRO 23 8.444 4.661 -15.540 209 HB3 PRO 23 HB3 PRO 23 9.705 5.136 -14.372 210 HG2 PRO 23 HG2 PRO 23 8.657 2.412 -14.975 211 HG3 PRO 23 HG3 PRO 23 10.248 2.898 -14.349 212 HD2 PRO 23 HD2 PRO 23 8.139 1.820 -12.826 213 HD3 PRO 23 HD3 PRO 23 9.550 2.700 -12.179 214 HA PRO 24 HA PRO 24 4.368 5.220 -15.869 215 HB2 PRO 24 HB2 PRO 24 2.771 3.019 -15.905 216 HB3 PRO 24 HB3 PRO 24 4.349 3.078 -16.749 217 HG2 PRO 24 HG2 PRO 24 3.770 1.960 -13.979 218 HG3 PRO 24 HG3 PRO 24 4.615 1.155 -15.345 219 HD2 PRO 24 HD2 PRO 24 5.986 2.427 -13.385 220 HD3 PRO 24 HD3 PRO 24 6.520 2.517 -15.088 221 H ARG 25 H ARG 25 2.130 5.638 -15.765 222 HA ARG 25 HA ARG 25 0.843 5.774 -13.053 223 HB2 ARG 25 HB2 ARG 25 1.385 7.996 -13.772 224 HB3 ARG 25 HB3 ARG 25 0.794 7.686 -15.404 225 HG2 ARG 25 HG2 ARG 25 -0.800 9.069 -14.243 226 HG3 ARG 25 HG3 ARG 25 -1.515 7.499 -14.583 227 HD2 ARG 25 HD2 ARG 25 -0.950 6.841 -12.159 228 HD3 ARG 25 HD3 ARG 25 -0.449 8.508 -11.909 229 HE ARG 25 HE ARG 25 -2.677 9.217 -11.987 230 HH11 ARG 25 HH11 ARG 25 -4.877 8.975 -11.961 231 HH12 ARG 25 HH12 ARG 25 -5.590 7.423 -12.282 232 HH21 ARG 25 HH21 ARG 25 -2.619 5.789 -12.825 233 HH22 ARG 25 HH22 ARG 25 -4.356 5.671 -12.735 234 H ALA 26 H ALA 26 0.150 5.265 -16.523 235 HA ALA 26 HA ALA 26 -2.240 3.672 -15.809 236 HB1 ALA 26 HB1 ALA 26 -2.365 6.346 -17.266 237 HB2 ALA 26 HB2 ALA 26 -3.718 5.198 -17.076 238 HB3 ALA 26 HB3 ALA 26 -3.007 5.984 -15.649 239 H SER 27 H SER 27 -1.386 1.999 -16.743 240 HA SER 27 HA SER 27 -1.126 1.915 -19.715 241 HB2 SER 27 HB2 SER 27 0.542 0.648 -18.471 242 HB3 SER 27 HB3 SER 27 -0.731 -0.269 -17.643 243 HG SER 27 HG SER 27 0.321 -1.164 -19.670 244 H ASN 28 H ASN 28 -2.394 0.324 -20.833 245 HA ASN 28 HA ASN 28 -5.175 0.576 -20.562 246 HB2 ASN 28 HB2 ASN 28 -5.279 -0.846 -22.452 247 HB3 ASN 28 HB3 ASN 28 -3.800 0.082 -22.631 248 HD21 ASN 28 HD21 ASN 28 -1.800 -2.982 -21.938 249 HD22 ASN 28 HD22 ASN 28 -1.845 -1.402 -21.196 250 H ARG 29 H ARG 29 -3.114 -1.765 -18.976 251 HA ARG 29 HA ARG 29 -5.497 -3.299 -17.979 252 HB2 ARG 29 HB2 ARG 29 -2.591 -4.071 -17.601 253 HB3 ARG 29 HB3 ARG 29 -4.025 -5.077 -17.406 254 HG2 ARG 29 HG2 ARG 29 -2.789 -4.075 -19.978 255 HG3 ARG 29 HG3 ARG 29 -2.872 -5.739 -19.402 256 HD2 ARG 29 HD2 ARG 29 -5.371 -5.675 -19.648 257 HD3 ARG 29 HD3 ARG 29 -5.237 -4.019 -20.252 258 HE ARG 29 HE ARG 29 -4.374 -4.715 -22.265 259 HH11 ARG 29 HH11 ARG 29 -4.120 -6.135 -23.922 260 HH12 ARG 29 HH12 ARG 29 -4.175 -7.852 -23.637 261 HH21 ARG 29 HH21 ARG 29 -4.730 -7.578 -20.258 262 HH22 ARG 29 HH22 ARG 29 -4.513 -8.656 -21.611 263 H GLY 30 H GLY 30 -3.646 -0.747 -17.013 264 HA2 GLY 30 HA2 GLY 30 -4.221 0.206 -14.779 265 HA3 GLY 30 HA3 GLY 30 -3.859 -1.388 -14.093 266 H TYR 31 H TYR 31 -1.835 -1.777 -13.449 267 HA TYR 31 HA TYR 31 0.388 0.103 -14.235 268 HB2 TYR 31 HB2 TYR 31 -0.314 -1.171 -11.572 269 HB3 TYR 31 HB3 TYR 31 1.271 -0.506 -11.920 270 HD1 TYR 31 HD1 TYR 31 -2.224 0.316 -11.222 271 HD2 TYR 31 HD2 TYR 31 1.664 1.848 -12.299 272 HE1 TYR 31 HE1 TYR 31 -2.923 2.598 -10.475 273 HE2 TYR 31 HE2 TYR 31 0.980 4.125 -11.522 274 HH TYR 31 HH TYR 31 -2.271 4.765 -10.140 275 H ARG 32 H ARG 32 -0.462 -3.248 -13.595 276 HA ARG 32 HA ARG 32 0.600 -5.169 -13.352 277 HB2 ARG 32 HB2 ARG 32 2.386 -4.812 -15.664 278 HB3 ARG 32 HB3 ARG 32 1.198 -6.026 -15.255 279 HG2 ARG 32 HG2 ARG 32 0.182 -5.248 -17.093 280 HG3 ARG 32 HG3 ARG 32 -0.520 -4.107 -15.969 281 HD2 ARG 32 HD2 ARG 32 0.096 -2.782 -17.771 282 HD3 ARG 32 HD3 ARG 32 1.361 -2.496 -16.583 283 HE ARG 32 HE ARG 32 2.901 -3.239 -18.094 284 HH11 ARG 32 HH11 ARG 32 3.734 -3.844 -19.860 285 HH12 ARG 32 HH12 ARG 32 2.844 -4.784 -21.058 286 HH21 ARG 32 HH21 ARG 32 -0.089 -4.699 -19.225 287 HH22 ARG 32 HH22 ARG 32 0.686 -5.248 -20.688 288 H ALA 33 H ALA 33 1.844 -5.648 -11.617 289 HA ALA 33 HA ALA 33 4.309 -4.511 -10.865 290 HB1 ALA 33 HB1 ALA 33 3.481 -7.431 -10.519 291 HB2 ALA 33 HB2 ALA 33 4.643 -6.518 -9.538 292 HB3 ALA 33 HB3 ALA 33 2.925 -6.106 -9.489 293 H SER 34 H SER 34 3.645 -7.087 -13.114 294 HA SER 34 HA SER 34 6.172 -7.968 -13.899 295 HB2 SER 34 HB2 SER 34 3.489 -7.686 -15.324 296 HB3 SER 34 HB3 SER 34 4.829 -8.725 -15.903 297 HG SER 34 HG SER 34 3.301 -9.870 -14.712 298 H ASP 35 H ASP 35 4.774 -4.831 -14.665 299 HA ASP 35 HA ASP 35 6.324 -4.467 -17.141 300 HB2 ASP 35 HB2 ASP 35 3.978 -3.526 -16.512 301 HB3 ASP 35 HB3 ASP 35 4.856 -2.319 -15.587 302 H TRP 36 H TRP 36 6.548 -3.640 -13.749 303 HA TRP 36 HA TRP 36 9.098 -2.131 -14.129 304 HB2 TRP 36 HB2 TRP 36 8.354 -1.393 -11.636 305 HB3 TRP 36 HB3 TRP 36 7.980 -0.538 -13.103 306 HD1 TRP 36 HD1 TRP 36 5.506 -0.526 -13.972 307 HE1 TRP 36 HE1 TRP 36 3.270 -1.035 -12.899 308 HE3 TRP 36 HE3 TRP 36 7.159 -2.802 -9.683 309 HZ2 TRP 36 HZ2 TRP 36 2.310 -1.872 -10.296 310 HZ3 TRP 36 HZ3 TRP 36 5.544 -3.417 -7.903 311 HH2 TRP 36 HH2 TRP 36 3.118 -2.951 -8.187 312 H LYS 37 H LYS 37 9.957 -2.368 -11.412 313 HA LYS 37 HA LYS 37 11.164 -5.037 -11.377 314 HB2 LYS 37 HB2 LYS 37 10.910 -2.944 -9.156 315 HB3 LYS 37 HB3 LYS 37 11.958 -4.367 -9.143 316 HG2 LYS 37 HG2 LYS 37 12.232 -1.883 -10.877 317 HG3 LYS 37 HG3 LYS 37 13.230 -2.380 -9.517 318 HD2 LYS 37 HD2 LYS 37 13.631 -4.553 -11.078 319 HD3 LYS 37 HD3 LYS 37 13.203 -3.397 -12.348 320 HE2 LYS 37 HE2 LYS 37 14.924 -1.812 -11.420 321 HE3 LYS 37 HE3 LYS 37 15.343 -3.028 -10.195 322 HZ1 LYS 37 HZ1 LYS 37 16.842 -3.053 -12.142 323 HZ2 LYS 37 HZ2 LYS 37 16.110 -4.488 -11.907 324 HZ3 LYS 37 HZ3 LYS 37 15.608 -3.491 -13.120 325 H LEU 38 H LEU 38 10.186 -6.670 -11.182 326 HA LEU 38 HA LEU 38 7.733 -7.061 -9.641 327 HB2 LEU 38 HB2 LEU 38 7.975 -7.734 -11.981 328 HB3 LEU 38 HB3 LEU 38 9.457 -8.618 -11.618 329 HG LEU 38 HG LEU 38 8.217 -10.156 -10.236 330 HD11 LEU 38 HD11 LEU 38 5.710 -8.869 -11.449 331 HD12 LEU 38 HD12 LEU 38 5.741 -10.319 -10.426 332 HD13 LEU 38 HD13 LEU 38 6.181 -8.753 -9.743 333 HD21 LEU 38 HD21 LEU 38 8.736 -10.638 -12.611 334 HD22 LEU 38 HD22 LEU 38 7.239 -11.434 -12.094 335 HD23 LEU 38 HD23 LEU 38 7.164 -9.965 -13.091 336 H ASP 39 H ASP 39 11.149 -7.883 -9.340 337 HA ASP 39 HA ASP 39 10.669 -9.162 -6.691 338 HB2 ASP 39 HB2 ASP 39 10.772 -10.850 -8.574 339 HB3 ASP 39 HB3 ASP 39 12.420 -10.319 -8.895 340 H GLN 40 H GLN 40 12.081 -6.607 -7.971 341 HA GLN 40 HA GLN 40 14.683 -6.756 -6.472 342 HB2 GLN 40 HB2 GLN 40 14.066 -5.467 -9.122 343 HB3 GLN 40 HB3 GLN 40 15.585 -5.286 -8.238 344 HG2 GLN 40 HG2 GLN 40 16.095 -7.649 -8.486 345 HG3 GLN 40 HG3 GLN 40 14.490 -7.992 -9.125 346 HE21 GLN 40 HE21 GLN 40 15.897 -7.801 -12.349 347 HE22 GLN 40 HE22 GLN 40 15.106 -8.812 -11.148 348 HA PRO 41 HA PRO 41 11.886 -3.468 -4.825 349 HB2 PRO 41 HB2 PRO 41 12.402 -3.697 -2.136 350 HB3 PRO 41 HB3 PRO 41 11.293 -4.756 -3.056 351 HG2 PRO 41 HG2 PRO 41 14.201 -5.264 -2.348 352 HG3 PRO 41 HG3 PRO 41 12.802 -6.365 -2.123 353 HD2 PRO 41 HD2 PRO 41 14.440 -6.587 -4.270 354 HD3 PRO 41 HD3 PRO 41 12.674 -6.823 -4.439 355 H ASP 42 H ASP 42 12.068 -1.472 -3.896 356 HA ASP 42 HA ASP 42 14.751 -0.186 -3.998 357 HB2 ASP 42 HB2 ASP 42 12.923 0.709 -5.420 358 HB3 ASP 42 HB3 ASP 42 11.919 0.942 -3.990 359 H TRP 43 H TRP 43 12.116 -0.996 -1.818 360 HA TRP 43 HA TRP 43 13.846 -0.474 0.492 361 HB2 TRP 43 HB2 TRP 43 12.652 1.647 0.303 362 HB3 TRP 43 HB3 TRP 43 11.116 0.817 0.152 363 HD1 TRP 43 HD1 TRP 43 13.575 2.074 2.713 364 HE1 TRP 43 HE1 TRP 43 12.562 1.888 5.065 365 HE3 TRP 43 HE3 TRP 43 9.515 -0.842 1.623 366 HZ2 TRP 43 HZ2 TRP 43 10.157 0.796 6.271 367 HZ3 TRP 43 HZ3 TRP 43 7.874 -1.422 3.379 368 HH2 TRP 43 HH2 TRP 43 8.162 -0.576 5.697 369 H THR 44 H THR 44 13.299 -1.765 2.306 370 HA THR 44 HA THR 44 10.894 -3.472 2.201 371 HB THR 44 HB THR 44 12.197 -5.434 2.926 372 HG1 THR 44 HG1 THR 44 14.442 -5.440 2.608 373 HG21 THR 44 HG21 THR 44 13.202 -4.434 0.230 374 HG22 THR 44 HG22 THR 44 13.109 -6.122 0.786 375 HG23 THR 44 HG23 THR 44 11.625 -5.197 0.529 376 H GLY 45 H GLY 45 10.125 -4.162 4.149 377 HA2 GLY 45 HA2 GLY 45 11.309 -3.722 6.698 378 HA3 GLY 45 HA3 GLY 45 10.444 -2.259 6.240 379 H ARG 46 H ARG 46 8.634 -2.198 7.285 380 HA ARG 46 HA ARG 46 6.866 -4.594 7.656 381 HB2 ARG 46 HB2 ARG 46 8.372 -3.930 9.625 382 HB3 ARG 46 HB3 ARG 46 7.455 -2.424 9.718 383 HG2 ARG 46 HG2 ARG 46 5.373 -3.777 10.135 384 HG3 ARG 46 HG3 ARG 46 6.364 -5.251 10.046 385 HD2 ARG 46 HD2 ARG 46 7.757 -4.350 11.949 386 HD3 ARG 46 HD3 ARG 46 6.656 -2.979 12.052 387 HE ARG 46 HE ARG 46 4.989 -4.327 12.978 388 HH11 ARG 46 HH11 ARG 46 4.297 -6.061 14.189 389 HH12 ARG 46 HH12 ARG 46 5.215 -7.534 14.198 390 HH21 ARG 46 HH21 ARG 46 7.689 -6.399 12.120 391 HH22 ARG 46 HH22 ARG 46 7.101 -7.713 13.097 392 H LEU 47 H LEU 47 4.588 -4.088 7.895 393 HA LEU 47 HA LEU 47 3.820 -1.298 7.100 394 HB2 LEU 47 HB2 LEU 47 3.331 -2.792 5.229 395 HB3 LEU 47 HB3 LEU 47 2.501 -3.912 6.307 396 HG LEU 47 HG LEU 47 0.761 -2.153 6.754 397 HD11 LEU 47 HD11 LEU 47 1.987 -0.608 4.446 398 HD12 LEU 47 HD12 LEU 47 0.601 -0.167 5.474 399 HD13 LEU 47 HD13 LEU 47 2.229 -0.148 6.135 400 HD21 LEU 47 HD21 LEU 47 0.365 -3.829 5.060 401 HD22 LEU 47 HD22 LEU 47 -0.291 -2.256 4.567 402 HD23 LEU 47 HD23 LEU 47 1.223 -2.844 3.844 403 H ARG 48 H ARG 48 2.419 -0.262 8.369 404 HA ARG 48 HA ARG 48 0.513 -1.882 9.949 405 HB2 ARG 48 HB2 ARG 48 2.388 -1.198 11.455 406 HB3 ARG 48 HB3 ARG 48 1.930 0.492 11.194 407 HG2 ARG 48 HG2 ARG 48 -0.263 0.099 12.195 408 HG3 ARG 48 HG3 ARG 48 -0.009 -1.653 12.188 409 HD2 ARG 48 HD2 ARG 48 0.292 -0.793 14.447 410 HD3 ARG 48 HD3 ARG 48 1.813 -1.440 13.820 411 HE ARG 48 HE ARG 48 1.691 1.339 13.228 412 HH11 ARG 48 HH11 ARG 48 3.456 2.392 13.996 413 HH12 ARG 48 HH12 ARG 48 3.825 2.306 15.702 414 HH21 ARG 48 HH21 ARG 48 1.905 -0.513 16.184 415 HH22 ARG 48 HH22 ARG 48 3.061 0.587 16.888 416 H ILE 49 H ILE 49 -1.178 -1.524 8.774 417 HA ILE 49 HA ILE 49 -2.030 1.041 7.655 418 HB ILE 49 HB ILE 49 -3.544 -1.564 8.088 419 HG12 ILE 49 HG12 ILE 49 -2.008 -0.500 5.683 420 HG13 ILE 49 HG13 ILE 49 -1.691 -1.972 6.608 421 HG21 ILE 49 HG21 ILE 49 -5.199 -0.727 6.536 422 HG22 ILE 49 HG22 ILE 49 -5.043 0.420 7.845 423 HG23 ILE 49 HG23 ILE 49 -4.271 0.772 6.280 424 HD11 ILE 49 HD11 ILE 49 -3.943 -2.850 5.816 425 HD12 ILE 49 HD12 ILE 49 -3.973 -1.467 4.681 426 HD13 ILE 49 HD13 ILE 49 -2.682 -2.671 4.591 427 H THR 50 H THR 50 -3.245 2.532 8.652 428 HA THR 50 HA THR 50 -4.569 1.943 11.273 429 HB THR 50 HB THR 50 -3.794 4.025 12.202 430 HG1 THR 50 HG1 THR 50 -2.323 4.300 9.794 431 HG21 THR 50 HG21 THR 50 -2.195 2.007 12.306 432 HG22 THR 50 HG22 THR 50 -1.269 2.804 11.032 433 HG23 THR 50 HG23 THR 50 -1.495 3.611 12.596 434 H SER 51 H SER 51 -6.147 3.844 11.829 435 HA SER 51 HA SER 51 -6.979 5.529 9.591 436 HB2 SER 51 HB2 SER 51 -8.319 3.603 9.082 437 HB3 SER 51 HB3 SER 51 -8.876 3.475 10.769 438 HG SER 51 HG SER 51 -9.288 5.716 9.044 439 H LYS 52 H LYS 52 -7.642 7.390 10.233 440 HA LYS 52 HA LYS 52 -8.375 7.998 13.049 441 HB2 LYS 52 HB2 LYS 52 -6.618 9.213 11.838 442 HB3 LYS 52 HB3 LYS 52 -7.836 9.795 10.673 443 HG2 LYS 52 HG2 LYS 52 -8.974 10.854 12.759 444 HG3 LYS 52 HG3 LYS 52 -7.484 10.470 13.603 445 HD2 LYS 52 HD2 LYS 52 -7.919 12.209 11.171 446 HD3 LYS 52 HD3 LYS 52 -7.454 12.744 12.810 447 HE2 LYS 52 HE2 LYS 52 -5.236 11.810 12.530 448 HE3 LYS 52 HE3 LYS 52 -5.703 11.025 11.015 449 HZ1 LYS 52 HZ1 LYS 52 -5.413 13.954 11.472 450 HZ2 LYS 52 HZ2 LYS 52 -4.496 13.013 10.518 451 HZ3 LYS 52 HZ3 LYS 52 -6.045 13.302 10.096 452 H GLY 53 H GLY 53 -10.091 6.406 11.285 453 HA2 GLY 53 HA2 GLY 53 -12.380 6.040 11.162 454 HA3 GLY 53 HA3 GLY 53 -12.703 7.664 11.763 455 H LYS 54 H LYS 54 -13.206 5.784 9.186 456 HA LYS 54 HA LYS 54 -13.615 5.923 6.961 457 HB2 LYS 54 HB2 LYS 54 -15.236 7.581 7.915 458 HB3 LYS 54 HB3 LYS 54 -14.097 8.867 7.483 459 HG2 LYS 54 HG2 LYS 54 -14.308 8.145 5.071 460 HG3 LYS 54 HG3 LYS 54 -15.517 6.947 5.594 461 HD2 LYS 54 HD2 LYS 54 -16.909 8.798 6.494 462 HD3 LYS 54 HD3 LYS 54 -15.656 9.967 6.009 463 HE2 LYS 54 HE2 LYS 54 -15.934 9.272 3.637 464 HE3 LYS 54 HE3 LYS 54 -17.210 8.147 4.112 465 HZ1 LYS 54 HZ1 LYS 54 -18.143 10.274 3.349 466 HZ2 LYS 54 HZ2 LYS 54 -18.491 10.082 4.934 467 HZ3 LYS 54 HZ3 LYS 54 -17.306 11.104 4.472 468 H THR 55 H THR 55 -11.006 7.910 7.947 469 HA THR 55 HA THR 55 -9.798 7.466 5.236 470 HB THR 55 HB THR 55 -8.624 9.372 7.271 471 HG1 THR 55 HG1 THR 55 -9.837 11.032 6.360 472 HG21 THR 55 HG21 THR 55 -8.864 9.269 4.237 473 HG22 THR 55 HG22 THR 55 -7.876 10.444 5.151 474 HG23 THR 55 HG23 THR 55 -7.448 8.715 5.155 475 H ALA 56 H ALA 56 -8.576 5.794 5.146 476 HA ALA 56 HA ALA 56 -7.083 4.931 7.562 477 HB1 ALA 56 HB1 ALA 56 -7.760 3.406 5.040 478 HB2 ALA 56 HB2 ALA 56 -6.596 2.849 6.254 479 HB3 ALA 56 HB3 ALA 56 -8.290 3.096 6.688 480 H TYR 57 H TYR 57 -4.872 4.451 7.373 481 HA TYR 57 HA TYR 57 -3.354 6.040 5.345 482 HB2 TYR 57 HB2 TYR 57 -2.904 5.967 8.346 483 HB3 TYR 57 HB3 TYR 57 -1.861 6.750 7.178 484 HD1 TYR 57 HD1 TYR 57 -2.261 8.993 6.509 485 HD2 TYR 57 HD2 TYR 57 -5.305 6.855 8.692 486 HE1 TYR 57 HE1 TYR 57 -3.603 11.084 6.715 487 HE2 TYR 57 HE2 TYR 57 -6.653 8.917 8.861 488 HH TYR 57 HH TYR 57 -5.544 12.036 7.474 489 H ILE 58 H ILE 58 -2.128 4.667 4.239 490 HA ILE 58 HA ILE 58 -1.371 2.028 5.294 491 HB ILE 58 HB ILE 58 -0.503 3.283 2.681 492 HG12 ILE 58 HG12 ILE 58 -2.937 3.381 2.638 493 HG13 ILE 58 HG13 ILE 58 -2.301 2.211 1.501 494 HG21 ILE 58 HG21 ILE 58 -0.705 0.407 3.649 495 HG22 ILE 58 HG22 ILE 58 -0.362 0.883 1.979 496 HG23 ILE 58 HG23 ILE 58 0.774 1.311 3.254 497 HD11 ILE 58 HD11 ILE 58 -4.325 1.426 2.629 498 HD12 ILE 58 HD12 ILE 58 -2.952 0.352 2.946 499 HD13 ILE 58 HD13 ILE 58 -3.499 1.492 4.202 500 H LYS 59 H LYS 59 -0.099 2.869 7.137 501 HA LYS 59 HA LYS 59 2.261 4.493 6.501 502 HB2 LYS 59 HB2 LYS 59 1.360 3.419 9.196 503 HB3 LYS 59 HB3 LYS 59 2.584 4.647 8.908 504 HG2 LYS 59 HG2 LYS 59 0.841 6.160 7.940 505 HG3 LYS 59 HG3 LYS 59 -0.371 4.902 8.194 506 HD2 LYS 59 HD2 LYS 59 -0.700 6.272 10.030 507 HD3 LYS 59 HD3 LYS 59 0.259 4.946 10.670 508 HE2 LYS 59 HE2 LYS 59 1.411 6.680 11.590 509 HE3 LYS 59 HE3 LYS 59 2.305 6.567 10.063 510 HZ1 LYS 59 HZ1 LYS 59 0.022 8.387 10.602 511 HZ2 LYS 59 HZ2 LYS 59 1.586 8.854 10.649 512 HZ3 LYS 59 HZ3 LYS 59 0.920 8.399 9.220 513 H LEU 60 H LEU 60 3.986 3.607 5.723 514 HA LEU 60 HA LEU 60 4.754 0.809 6.328 515 HB2 LEU 60 HB2 LEU 60 5.724 2.903 4.354 516 HB3 LEU 60 HB3 LEU 60 6.531 1.351 4.580 517 HG LEU 60 HG LEU 60 3.564 1.421 3.926 518 HD11 LEU 60 HD11 LEU 60 5.886 1.600 1.975 519 HD12 LEU 60 HD12 LEU 60 4.222 1.152 1.528 520 HD13 LEU 60 HD13 LEU 60 4.558 2.760 2.185 521 HD21 LEU 60 HD21 LEU 60 4.051 -0.790 2.991 522 HD22 LEU 60 HD22 LEU 60 5.784 -0.572 3.301 523 HD23 LEU 60 HD23 LEU 60 4.655 -0.722 4.657 524 H GLU 61 H GLU 61 6.446 0.245 7.589 525 HA GLU 61 HA GLU 61 7.842 2.431 9.075 526 HB2 GLU 61 HB2 GLU 61 6.520 -0.037 10.246 527 HB3 GLU 61 HB3 GLU 61 7.429 1.196 11.129 528 HG2 GLU 61 HG2 GLU 61 5.729 2.905 10.370 529 HG3 GLU 61 HG3 GLU 61 4.769 1.577 9.704 530 H ASP 62 H ASP 62 9.872 1.911 10.074 531 HA ASP 62 HA ASP 62 11.479 -0.039 8.698 532 HB2 ASP 62 HB2 ASP 62 12.368 2.101 9.423 533 HB3 ASP 62 HB3 ASP 62 11.917 1.774 11.099 534 H LYS 63 H LYS 63 11.969 -2.068 9.284 535 HA LYS 63 HA LYS 63 10.283 -3.499 11.078 536 HB2 LYS 63 HB2 LYS 63 11.363 -4.268 8.937 537 HB3 LYS 63 HB3 LYS 63 12.902 -4.384 9.794 538 HG2 LYS 63 HG2 LYS 63 11.917 -6.115 11.287 539 HG3 LYS 63 HG3 LYS 63 10.369 -5.977 10.438 540 HD2 LYS 63 HD2 LYS 63 13.011 -6.768 9.125 541 HD3 LYS 63 HD3 LYS 63 11.850 -7.926 9.783 542 HE2 LYS 63 HE2 LYS 63 10.123 -7.160 8.213 543 HE3 LYS 63 HE3 LYS 63 11.219 -5.940 7.556 544 HZ1 LYS 63 HZ1 LYS 63 12.671 -7.705 6.780 545 HZ2 LYS 63 HZ2 LYS 63 11.742 -8.860 7.470 546 HZ3 LYS 63 HZ3 LYS 63 11.160 -8.000 6.212 547 H VAL 64 H VAL 64 13.046 -1.692 11.895 548 HA VAL 64 HA VAL 64 13.775 -3.401 14.231 549 HB VAL 64 HB VAL 64 15.435 -1.093 13.197 550 HG11 VAL 64 HG11 VAL 64 16.139 -3.719 14.567 551 HG12 VAL 64 HG12 VAL 64 17.272 -2.418 14.133 552 HG13 VAL 64 HG13 VAL 64 16.026 -2.124 15.351 553 HG21 VAL 64 HG21 VAL 64 16.751 -2.691 11.814 554 HG22 VAL 64 HG22 VAL 64 15.476 -3.913 12.046 555 HG23 VAL 64 HG23 VAL 64 15.136 -2.394 11.174 556 H SER 65 H SER 65 12.928 -0.084 13.242 557 HA SER 65 HA SER 65 12.681 0.619 16.139 558 HB2 SER 65 HB2 SER 65 13.716 2.299 13.832 559 HB3 SER 65 HB3 SER 65 13.496 2.875 15.496 560 HG SER 65 HG SER 65 15.655 2.190 15.067 561 H GLY 66 H GLY 66 10.726 0.249 13.449 562 HA2 GLY 66 HA2 GLY 66 8.546 0.818 13.084 563 HA3 GLY 66 HA3 GLY 66 8.497 1.594 14.667 564 H GLU 67 H GLU 67 10.948 2.851 12.578 565 HA GLU 67 HA GLU 67 9.718 5.478 12.610 566 HB2 GLU 67 HB2 GLU 67 12.229 4.479 11.205 567 HB3 GLU 67 HB3 GLU 67 11.724 6.171 11.328 568 HG2 GLU 67 HG2 GLU 67 11.794 5.975 13.831 569 HG3 GLU 67 HG3 GLU 67 12.433 4.340 13.657 570 H LEU 68 H LEU 68 8.807 6.699 10.951 571 HA LEU 68 HA LEU 68 7.411 5.162 8.987 572 HB2 LEU 68 HB2 LEU 68 6.565 7.225 10.201 573 HB3 LEU 68 HB3 LEU 68 7.635 8.188 9.186 574 HG LEU 68 HG LEU 68 6.397 7.186 7.155 575 HD11 LEU 68 HD11 LEU 68 4.425 6.403 9.352 576 HD12 LEU 68 HD12 LEU 68 4.108 6.358 7.602 577 HD13 LEU 68 HD13 LEU 68 5.303 5.275 8.307 578 HD21 LEU 68 HD21 LEU 68 4.510 8.733 7.380 579 HD22 LEU 68 HD22 LEU 68 4.803 8.870 9.130 580 HD23 LEU 68 HD23 LEU 68 6.003 9.478 7.968 581 H PHE 69 H PHE 69 7.963 4.573 7.033 582 HA PHE 69 HA PHE 69 10.159 5.863 5.475 583 HB2 PHE 69 HB2 PHE 69 10.322 3.530 5.494 584 HB3 PHE 69 HB3 PHE 69 8.591 3.298 5.301 585 HD1 PHE 69 HD1 PHE 69 8.041 2.313 3.287 586 HD2 PHE 69 HD2 PHE 69 11.239 5.197 3.358 587 HE1 PHE 69 HE1 PHE 69 8.248 2.128 0.854 588 HE2 PHE 69 HE2 PHE 69 11.426 5.042 0.908 589 HZ PHE 69 HZ PHE 69 9.902 3.516 -0.390 590 H ALA 70 H ALA 70 6.692 5.012 5.052 591 HA ALA 70 HA ALA 70 6.176 7.501 3.594 592 HB1 ALA 70 HB1 ALA 70 6.973 6.025 1.770 593 HB2 ALA 70 HB2 ALA 70 5.806 4.776 2.257 594 HB3 ALA 70 HB3 ALA 70 5.230 6.325 1.624 595 H GLN 71 H GLN 71 3.881 7.820 3.194 596 HA GLN 71 HA GLN 71 2.015 5.861 4.304 597 HB2 GLN 71 HB2 GLN 71 0.759 7.488 5.632 598 HB3 GLN 71 HB3 GLN 71 2.379 7.193 6.259 599 HG2 GLN 71 HG2 GLN 71 3.155 9.336 5.193 600 HG3 GLN 71 HG3 GLN 71 1.493 9.659 4.690 601 HE21 GLN 71 HE21 GLN 71 2.153 11.431 7.930 602 HE22 GLN 71 HE22 GLN 71 2.897 11.475 6.340 603 H ALA 72 H ALA 72 0.191 5.694 3.142 604 HA ALA 72 HA ALA 72 -0.461 7.865 1.194 605 HB1 ALA 72 HB1 ALA 72 -1.064 4.903 0.962 606 HB2 ALA 72 HB2 ALA 72 -1.549 6.173 -0.179 607 HB3 ALA 72 HB3 ALA 72 0.167 5.811 0.051 608 HA PRO 73 HA PRO 73 -4.224 7.833 3.840 609 HB2 PRO 73 HB2 PRO 73 -5.279 10.226 3.137 610 HB3 PRO 73 HB3 PRO 73 -3.842 10.093 4.198 611 HG2 PRO 73 HG2 PRO 73 -3.909 10.655 1.219 612 HG3 PRO 73 HG3 PRO 73 -2.966 11.498 2.487 613 HD2 PRO 73 HD2 PRO 73 -1.941 9.487 0.893 614 HD3 PRO 73 HD3 PRO 73 -1.367 9.792 2.562 615 H VAL 74 H VAL 74 -6.232 7.009 3.344 616 HA VAL 74 HA VAL 74 -7.192 7.101 0.509 617 HB VAL 74 HB VAL 74 -6.207 4.974 0.962 618 HG11 VAL 74 HG11 VAL 74 -7.161 3.266 2.394 619 HG12 VAL 74 HG12 VAL 74 -6.465 4.601 3.303 620 HG13 VAL 74 HG13 VAL 74 -8.237 4.473 3.121 621 HG21 VAL 74 HG21 VAL 74 -8.230 5.164 -0.542 622 HG22 VAL 74 HG22 VAL 74 -8.001 3.554 0.156 623 HG23 VAL 74 HG23 VAL 74 -9.225 4.632 0.830 624 H GLU 75 H GLU 75 -9.203 7.718 0.176 625 HA GLU 75 HA GLU 75 -11.059 7.931 2.504 626 HB2 GLU 75 HB2 GLU 75 -10.759 9.680 0.027 627 HB3 GLU 75 HB3 GLU 75 -12.081 9.828 1.187 628 HG2 GLU 75 HG2 GLU 75 -10.509 10.339 2.992 629 HG3 GLU 75 HG3 GLU 75 -9.140 10.185 1.880 630 H GLN 76 H GLN 76 -10.576 6.029 -0.153 631 HA GLN 76 HA GLN 76 -13.223 4.998 -0.166 632 HB2 GLN 76 HB2 GLN 76 -13.861 5.351 -2.426 633 HB3 GLN 76 HB3 GLN 76 -13.514 6.929 -1.748 634 HG2 GLN 76 HG2 GLN 76 -11.755 5.368 -3.679 635 HG3 GLN 76 HG3 GLN 76 -12.765 6.743 -4.059 636 HE21 GLN 76 HE21 GLN 76 -9.056 7.387 -2.504 637 HE22 GLN 76 HE22 GLN 76 -9.748 5.750 -2.478 638 H TYR 77 H TYR 77 -13.230 2.867 -0.861 639 HA TYR 77 HA TYR 77 -10.807 1.819 -2.204 640 HB2 TYR 77 HB2 TYR 77 -10.658 1.329 0.189 641 HB3 TYR 77 HB3 TYR 77 -12.193 0.435 0.109 642 HD1 TYR 77 HD1 TYR 77 -11.937 -1.988 -0.181 643 HD2 TYR 77 HD2 TYR 77 -8.935 0.725 -1.584 644 HE1 TYR 77 HE1 TYR 77 -10.563 -3.908 -0.969 645 HE2 TYR 77 HE2 TYR 77 -7.529 -1.181 -2.350 646 HH TYR 77 HH TYR 77 -8.681 -4.571 -2.017 647 HA PRO 78 HA PRO 78 -10.135 0.573 -3.844 648 HB2 PRO 78 HB2 PRO 78 -10.361 0.357 -6.537 649 HB3 PRO 78 HB3 PRO 78 -10.455 -1.057 -5.443 650 HG2 PRO 78 HG2 PRO 78 -12.764 0.533 -6.623 651 HG3 PRO 78 HG3 PRO 78 -12.522 -1.246 -6.646 652 HD2 PRO 78 HD2 PRO 78 -14.075 -0.044 -4.765 653 HD3 PRO 78 HD3 PRO 78 -13.038 -1.439 -4.346 654 H GLY 79 H GLY 79 -8.948 2.203 -5.103 655 HA2 GLY 79 HA2 GLY 79 -10.286 4.505 -6.288 656 HA3 GLY 79 HA3 GLY 79 -9.642 4.844 -4.682 657 H ILE 80 H ILE 80 -8.210 6.408 -5.624 658 HA ILE 80 HA ILE 80 -6.031 5.445 -7.366 659 HB ILE 80 HB ILE 80 -7.064 7.645 -7.757 660 HG12 ILE 80 HG12 ILE 80 -5.095 9.014 -8.040 661 HG13 ILE 80 HG13 ILE 80 -4.171 8.049 -6.894 662 HG21 ILE 80 HG21 ILE 80 -6.658 9.554 -6.269 663 HG22 ILE 80 HG22 ILE 80 -7.555 8.313 -5.397 664 HG23 ILE 80 HG23 ILE 80 -5.809 8.523 -5.108 665 HD11 ILE 80 HD11 ILE 80 -4.143 6.154 -8.427 666 HD12 ILE 80 HD12 ILE 80 -5.285 6.975 -9.521 667 HD13 ILE 80 HD13 ILE 80 -3.637 7.605 -9.298 668 H ALA 81 H ALA 81 -6.608 5.990 -3.949 669 HA ALA 81 HA ALA 81 -3.835 6.220 -3.242 670 HB1 ALA 81 HB1 ALA 81 -6.248 5.499 -1.540 671 HB2 ALA 81 HB2 ALA 81 -4.629 5.924 -0.941 672 HB3 ALA 81 HB3 ALA 81 -5.612 7.139 -1.805 673 H VAL 82 H VAL 82 -5.892 3.452 -3.885 674 HA VAL 82 HA VAL 82 -3.615 1.617 -3.503 675 HB VAL 82 HB VAL 82 -4.540 1.569 -1.341 676 HG11 VAL 82 HG11 VAL 82 -7.232 1.315 -2.602 677 HG12 VAL 82 HG12 VAL 82 -6.863 0.990 -0.891 678 HG13 VAL 82 HG13 VAL 82 -6.628 2.603 -1.547 679 HG21 VAL 82 HG21 VAL 82 -3.845 -0.540 -2.304 680 HG22 VAL 82 HG22 VAL 82 -5.186 -0.757 -1.157 681 HG23 VAL 82 HG23 VAL 82 -5.476 -0.851 -2.908 682 H GLU 83 H GLU 83 -3.559 0.364 -5.256 683 HA GLU 83 HA GLU 83 -6.036 -0.598 -6.615 684 HB2 GLU 83 HB2 GLU 83 -4.205 1.387 -7.628 685 HB3 GLU 83 HB3 GLU 83 -3.918 -0.080 -8.547 686 HG2 GLU 83 HG2 GLU 83 -6.678 1.153 -8.138 687 HG3 GLU 83 HG3 GLU 83 -5.616 1.531 -9.491 688 H THR 84 H THR 84 -5.767 -2.547 -7.893 689 HA THR 84 HA THR 84 -3.443 -4.258 -7.022 690 HB THR 84 HB THR 84 -5.856 -5.368 -8.324 691 HG1 THR 84 HG1 THR 84 -6.844 -5.637 -6.325 692 HG21 THR 84 HG21 THR 84 -3.939 -6.397 -6.206 693 HG22 THR 84 HG22 THR 84 -5.278 -7.319 -6.921 694 HG23 THR 84 HG23 THR 84 -3.926 -6.797 -7.943 695 H VAL 85 H VAL 85 -2.149 -3.364 -8.369 696 HA VAL 85 HA VAL 85 -1.021 -3.042 -10.475 697 HB VAL 85 HB VAL 85 -0.040 -5.422 -10.786 698 HG11 VAL 85 HG11 VAL 85 0.999 -3.539 -9.588 699 HG12 VAL 85 HG12 VAL 85 0.054 -3.904 -8.130 700 HG13 VAL 85 HG13 VAL 85 1.278 -5.033 -8.705 701 HG21 VAL 85 HG21 VAL 85 -1.970 -6.640 -9.589 702 HG22 VAL 85 HG22 VAL 85 -0.337 -7.008 -9.052 703 HG23 VAL 85 HG23 VAL 85 -1.363 -5.923 -8.098 704 H THR 86 H THR 86 -2.576 -6.143 -11.116 705 HA THR 86 HA THR 86 -4.117 -4.889 -13.238 706 HB THR 86 HB THR 86 -4.006 -6.970 -14.673 707 HG1 THR 86 HG1 THR 86 -2.209 -8.258 -14.462 708 HG21 THR 86 HG21 THR 86 -2.697 -4.801 -15.111 709 HG22 THR 86 HG22 THR 86 -1.319 -5.605 -14.342 710 HG23 THR 86 HG23 THR 86 -2.004 -6.273 -15.846 711 H ASP 87 H ASP 87 -3.481 -7.905 -11.525 712 HA ASP 87 HA ASP 87 -6.384 -8.226 -10.915 713 HB2 ASP 87 HB2 ASP 87 -4.816 -9.672 -12.993 714 HB3 ASP 87 HB3 ASP 87 -5.891 -10.664 -12.007 715 H SER 88 H SER 88 -3.728 -10.642 -10.969 716 HA SER 88 HA SER 88 -4.156 -11.757 -8.522 717 HB2 SER 88 HB2 SER 88 -2.294 -12.188 -10.240 718 HB3 SER 88 HB3 SER 88 -1.289 -11.166 -9.195 719 HG SER 88 HG SER 88 -1.491 -13.593 -8.777 720 H SER 89 H SER 89 -3.648 -11.538 -6.434 721 HA SER 89 HA SER 89 -2.779 -8.846 -5.510 722 HB2 SER 89 HB2 SER 89 -4.401 -9.039 -3.770 723 HB3 SER 89 HB3 SER 89 -5.130 -9.295 -5.369 724 HG SER 89 HG SER 89 -4.413 -11.296 -3.462 725 H ARG 90 H ARG 90 -0.783 -10.671 -5.937 726 HA ARG 90 HA ARG 90 0.362 -10.946 -3.182 727 HB2 ARG 90 HB2 ARG 90 1.193 -12.524 -4.849 728 HB3 ARG 90 HB3 ARG 90 1.586 -11.217 -5.967 729 HG2 ARG 90 HG2 ARG 90 3.329 -10.385 -4.468 730 HG3 ARG 90 HG3 ARG 90 2.876 -11.558 -3.223 731 HD2 ARG 90 HD2 ARG 90 3.896 -12.279 -6.004 732 HD3 ARG 90 HD3 ARG 90 4.947 -12.082 -4.607 733 HE ARG 90 HE ARG 90 3.243 -14.360 -5.215 734 HH11 ARG 90 HH11 ARG 90 3.476 -16.199 -3.975 735 HH12 ARG 90 HH12 ARG 90 4.226 -16.097 -2.412 736 HH21 ARG 90 HH21 ARG 90 4.757 -12.720 -2.476 737 HH22 ARG 90 HH22 ARG 90 4.956 -14.221 -1.609 738 H TYR 91 H TYR 91 -0.049 -8.646 -5.761 739 HA TYR 91 HA TYR 91 1.704 -6.666 -4.381 740 HB2 TYR 91 HB2 TYR 91 1.064 -6.804 -7.334 741 HB3 TYR 91 HB3 TYR 91 2.244 -5.757 -6.578 742 HD1 TYR 91 HD1 TYR 91 4.472 -6.649 -5.922 743 HD2 TYR 91 HD2 TYR 91 1.505 -9.061 -7.922 744 HE1 TYR 91 HE1 TYR 91 6.196 -8.368 -6.413 745 HE2 TYR 91 HE2 TYR 91 3.215 -10.743 -8.460 746 HH TYR 91 HH TYR 91 6.648 -10.370 -7.353 747 H PHE 92 H PHE 92 1.240 -4.470 -4.766 748 HA PHE 92 HA PHE 92 -1.417 -3.669 -5.764 749 HB2 PHE 92 HB2 PHE 92 -0.416 -2.877 -3.001 750 HB3 PHE 92 HB3 PHE 92 -1.839 -2.219 -3.800 751 HD1 PHE 92 HD1 PHE 92 -3.775 -3.775 -4.412 752 HD2 PHE 92 HD2 PHE 92 -0.538 -4.927 -1.804 753 HE1 PHE 92 HE1 PHE 92 -5.125 -5.690 -3.597 754 HE2 PHE 92 HE2 PHE 92 -1.923 -6.786 -0.928 755 HZ PHE 92 HZ PHE 92 -4.191 -7.222 -1.876 756 H VAL 93 H VAL 93 -1.506 -1.219 -5.814 757 HA VAL 93 HA VAL 93 1.124 0.152 -5.782 758 HB VAL 93 HB VAL 93 -1.030 0.533 -7.897 759 HG11 VAL 93 HG11 VAL 93 1.444 2.218 -7.321 760 HG12 VAL 93 HG12 VAL 93 0.465 2.315 -8.798 761 HG13 VAL 93 HG13 VAL 93 -0.251 2.755 -7.252 762 HG21 VAL 93 HG21 VAL 93 0.538 -1.301 -8.379 763 HG22 VAL 93 HG22 VAL 93 0.861 0.072 -9.447 764 HG23 VAL 93 HG23 VAL 93 1.919 -0.232 -8.062 765 H ILE 94 H ILE 94 1.077 2.010 -4.571 766 HA ILE 94 HA ILE 94 -1.571 3.108 -3.821 767 HB ILE 94 HB ILE 94 -0.949 3.435 -1.509 768 HG12 ILE 94 HG12 ILE 94 1.577 1.791 -2.008 769 HG13 ILE 94 HG13 ILE 94 1.572 3.547 -1.948 770 HG21 ILE 94 HG21 ILE 94 -0.480 0.497 -2.200 771 HG22 ILE 94 HG22 ILE 94 -1.143 1.178 -0.699 772 HG23 ILE 94 HG23 ILE 94 -2.063 1.291 -2.181 773 HD11 ILE 94 HD11 ILE 94 0.581 3.459 0.346 774 HD12 ILE 94 HD12 ILE 94 0.744 1.701 0.301 775 HD13 ILE 94 HD13 ILE 94 2.189 2.719 0.243 776 H ARG 95 H ARG 95 -1.639 5.252 -3.180 777 HA ARG 95 HA ARG 95 0.483 6.970 -4.413 778 HB2 ARG 95 HB2 ARG 95 -1.853 7.032 -5.268 779 HB3 ARG 95 HB3 ARG 95 -2.381 7.710 -3.733 780 HG2 ARG 95 HG2 ARG 95 -0.259 9.002 -5.507 781 HG3 ARG 95 HG3 ARG 95 -1.993 9.330 -5.639 782 HD2 ARG 95 HD2 ARG 95 -1.978 10.014 -3.206 783 HD3 ARG 95 HD3 ARG 95 -0.227 9.876 -3.238 784 HE ARG 95 HE ARG 95 -0.020 11.778 -4.587 785 HH11 ARG 95 HH11 ARG 95 -0.576 13.713 -5.225 786 HH12 ARG 95 HH12 ARG 95 -2.256 14.169 -5.415 787 HH21 ARG 95 HH21 ARG 95 -3.459 11.147 -4.257 788 HH22 ARG 95 HH22 ARG 95 -3.868 12.735 -4.848 789 H ILE 96 H ILE 96 1.992 7.094 -2.826 790 HA ILE 96 HA ILE 96 1.286 7.807 -0.045 791 HB ILE 96 HB ILE 96 3.707 7.650 0.376 792 HG12 ILE 96 HG12 ILE 96 4.048 6.541 -2.432 793 HG13 ILE 96 HG13 ILE 96 4.353 8.243 -2.062 794 HG21 ILE 96 HG21 ILE 96 3.883 5.189 0.123 795 HG22 ILE 96 HG22 ILE 96 2.320 5.695 0.746 796 HG23 ILE 96 HG23 ILE 96 2.490 5.224 -0.961 797 HD11 ILE 96 HD11 ILE 96 6.427 7.078 -2.012 798 HD12 ILE 96 HD12 ILE 96 6.008 7.597 -0.364 799 HD13 ILE 96 HD13 ILE 96 5.803 5.894 -0.840 800 H GLN 97 H GLN 97 2.282 9.582 1.084 801 HA GLN 97 HA GLN 97 3.379 11.787 -0.583 802 HB2 GLN 97 HB2 GLN 97 2.852 11.562 2.385 803 HB3 GLN 97 HB3 GLN 97 4.014 12.709 1.721 804 HG2 GLN 97 HG2 GLN 97 1.935 13.245 0.054 805 HG3 GLN 97 HG3 GLN 97 1.028 12.704 1.470 806 HE21 GLN 97 HE21 GLN 97 3.296 16.168 1.597 807 HE22 GLN 97 HE22 GLN 97 3.685 14.897 0.426 808 H ASP 98 H ASP 98 5.541 12.150 -0.825 809 HA ASP 98 HA ASP 98 7.226 9.785 -0.295 810 HB2 ASP 98 HB2 ASP 98 6.994 10.944 -2.524 811 HB3 ASP 98 HB3 ASP 98 7.894 12.293 -1.832 812 H GLY 99 H GLY 99 6.487 12.209 1.660 813 HA2 GLY 99 HA2 GLY 99 7.377 12.757 3.722 814 HA3 GLY 99 HA3 GLY 99 8.842 11.857 3.329 815 H THR 100 H THR 100 8.228 14.135 0.901 816 HA THR 100 HA THR 100 10.124 16.127 2.094 817 HB THR 100 HB THR 100 11.143 16.341 -0.121 818 HG1 THR 100 HG1 THR 100 10.569 14.866 -1.712 819 HG21 THR 100 HG21 THR 100 12.315 14.237 -0.231 820 HG22 THR 100 HG22 THR 100 12.033 14.615 1.479 821 HG23 THR 100 HG23 THR 100 11.027 13.397 0.657 822 H GLY 101 H GLY 101 7.059 16.133 1.676 823 HA2 GLY 101 HA2 GLY 101 5.605 17.983 1.537 824 HA3 GLY 101 HA3 GLY 101 6.832 18.920 0.685 825 H ARG 102 H ARG 102 6.334 15.731 -0.505 826 HA ARG 102 HA ARG 102 4.523 16.598 -2.717 827 HB2 ARG 102 HB2 ARG 102 6.008 15.845 -4.366 828 HB3 ARG 102 HB3 ARG 102 7.005 16.770 -3.231 829 HG2 ARG 102 HG2 ARG 102 7.707 14.571 -2.204 830 HG3 ARG 102 HG3 ARG 102 6.870 13.744 -3.532 831 HD2 ARG 102 HD2 ARG 102 8.252 14.956 -5.180 832 HD3 ARG 102 HD3 ARG 102 9.100 15.792 -3.864 833 HE ARG 102 HE ARG 102 9.395 13.021 -3.370 834 HH11 ARG 102 HH11 ARG 102 11.091 11.896 -3.831 835 HH12 ARG 102 HH12 ARG 102 12.272 12.409 -5.041 836 HH21 ARG 102 HH21 ARG 102 10.498 15.274 -5.832 837 HH22 ARG 102 HH22 ARG 102 11.915 14.315 -6.165 838 H SER 103 H SER 103 4.066 14.590 -4.172 839 HA SER 103 HA SER 103 3.698 12.149 -2.532 840 HB2 SER 103 HB2 SER 103 1.541 11.691 -3.563 841 HB3 SER 103 HB3 SER 103 1.509 13.161 -2.579 842 HG SER 103 HG SER 103 1.715 14.351 -4.562 843 H ALA 104 H ALA 104 3.457 10.181 -3.630 844 HA ALA 104 HA ALA 104 4.526 9.964 -6.369 845 HB1 ALA 104 HB1 ALA 104 6.364 8.484 -5.620 846 HB2 ALA 104 HB2 ALA 104 6.550 10.122 -4.965 847 HB3 ALA 104 HB3 ALA 104 5.944 8.812 -3.926 848 H PHE 105 H PHE 105 4.160 7.952 -7.329 849 HA PHE 105 HA PHE 105 2.354 6.090 -5.878 850 HB2 PHE 105 HB2 PHE 105 3.203 6.016 -8.779 851 HB3 PHE 105 HB3 PHE 105 1.994 5.005 -7.995 852 HD1 PHE 105 HD1 PHE 105 2.695 8.277 -9.471 853 HD2 PHE 105 HD2 PHE 105 -0.175 6.035 -7.151 854 HE1 PHE 105 HE1 PHE 105 1.001 10.036 -9.867 855 HE2 PHE 105 HE2 PHE 105 -1.883 7.763 -7.617 856 HZ PHE 105 HZ PHE 105 -1.311 9.769 -8.969 857 H ILE 106 H ILE 106 3.037 4.243 -5.052 858 HA ILE 106 HA ILE 106 5.563 3.020 -6.067 859 HB ILE 106 HB ILE 106 6.144 2.087 -3.940 860 HG12 ILE 106 HG12 ILE 106 3.878 3.819 -2.769 861 HG13 ILE 106 HG13 ILE 106 3.827 2.064 -2.885 862 HG21 ILE 106 HG21 ILE 106 5.798 5.099 -3.571 863 HG22 ILE 106 HG22 ILE 106 7.125 4.064 -2.992 864 HG23 ILE 106 HG23 ILE 106 6.928 4.389 -4.720 865 HD11 ILE 106 HD11 ILE 106 5.878 3.493 -1.173 866 HD12 ILE 106 HD12 ILE 106 4.296 2.941 -0.614 867 HD13 ILE 106 HD13 ILE 106 5.447 1.760 -1.208 868 H GLY 107 H GLY 107 5.527 0.945 -6.490 869 HA2 GLY 107 HA2 GLY 107 3.101 -0.688 -6.243 870 HA3 GLY 107 HA3 GLY 107 4.670 -1.171 -6.894 871 H ILE 108 H ILE 108 2.996 -2.452 -4.860 872 HA ILE 108 HA ILE 108 5.107 -2.755 -2.791 873 HB ILE 108 HB ILE 108 2.117 -3.036 -2.225 874 HG12 ILE 108 HG12 ILE 108 4.136 -0.827 -1.582 875 HG13 ILE 108 HG13 ILE 108 2.624 -0.672 -2.479 876 HG21 ILE 108 HG21 ILE 108 3.594 -4.578 -0.929 877 HG22 ILE 108 HG22 ILE 108 4.590 -3.183 -0.445 878 HG23 ILE 108 HG23 ILE 108 2.903 -3.366 0.108 879 HD11 ILE 108 HD11 ILE 108 2.911 -1.200 0.501 880 HD12 ILE 108 HD12 ILE 108 2.362 0.262 -0.290 881 HD13 ILE 108 HD13 ILE 108 1.361 -1.214 -0.397 882 H GLY 109 H GLY 109 5.619 -4.916 -2.373 883 HA2 GLY 109 HA2 GLY 109 3.903 -7.082 -3.507 884 HA3 GLY 109 HA3 GLY 109 5.654 -7.147 -3.709 885 H PHE 110 H PHE 110 3.358 -8.543 -2.023 886 HA PHE 110 HA PHE 110 4.754 -8.569 0.610 887 HB2 PHE 110 HB2 PHE 110 2.122 -9.681 -0.339 888 HB3 PHE 110 HB3 PHE 110 2.800 -10.069 1.219 889 HD1 PHE 110 HD1 PHE 110 2.624 -8.672 3.089 890 HD2 PHE 110 HD2 PHE 110 1.657 -7.096 -0.810 891 HE1 PHE 110 HE1 PHE 110 1.565 -6.705 4.146 892 HE2 PHE 110 HE2 PHE 110 0.661 -5.087 0.261 893 HZ PHE 110 HZ PHE 110 0.605 -4.895 2.731 894 H THR 111 H THR 111 5.294 -10.473 1.660 895 HA THR 111 HA THR 111 6.714 -12.381 0.010 896 HB THR 111 HB THR 111 7.468 -11.401 2.152 897 HG1 THR 111 HG1 THR 111 8.543 -13.265 2.706 898 HG21 THR 111 HG21 THR 111 6.866 -12.447 4.264 899 HG22 THR 111 HG22 THR 111 5.425 -11.736 3.525 900 HG23 THR 111 HG23 THR 111 5.684 -13.495 3.457 901 H ASP 112 H ASP 112 3.639 -12.370 1.675 902 HA ASP 112 HA ASP 112 3.045 -15.088 0.598 903 HB2 ASP 112 HB2 ASP 112 3.318 -14.822 3.168 904 HB3 ASP 112 HB3 ASP 112 1.761 -13.985 3.102 905 H ARG 113 H ARG 113 1.085 -15.432 -0.385 906 HA ARG 113 HA ARG 113 -0.430 -13.229 -1.492 907 HB2 ARG 113 HB2 ARG 113 -0.608 -16.243 -1.434 908 HB3 ARG 113 HB3 ARG 113 -2.085 -15.374 -1.818 909 HG2 ARG 113 HG2 ARG 113 0.502 -14.706 -3.247 910 HG3 ARG 113 HG3 ARG 113 -0.501 -16.058 -3.770 911 HD2 ARG 113 HD2 ARG 113 -1.971 -13.482 -3.318 912 HD3 ARG 113 HD3 ARG 113 -0.815 -13.460 -4.634 913 HE ARG 113 HE ARG 113 -3.339 -14.949 -4.560 914 HH11 ARG 113 HH11 ARG 113 -4.047 -15.838 -6.418 915 HH12 ARG 113 HH12 ARG 113 -2.927 -16.056 -7.786 916 HH21 ARG 113 HH21 ARG 113 -0.242 -14.731 -6.195 917 HH22 ARG 113 HH22 ARG 113 -0.943 -15.245 -7.706 918 H GLY 114 H GLY 114 -0.923 -15.204 1.426 919 HA2 GLY 114 HA2 GLY 114 -3.580 -14.182 2.012 920 HA3 GLY 114 HA3 GLY 114 -2.470 -14.997 3.126 921 H ASP 115 H ASP 115 -0.259 -13.084 2.796 922 HA ASP 115 HA ASP 115 -1.041 -11.074 4.719 923 HB2 ASP 115 HB2 ASP 115 1.454 -11.366 3.024 924 HB3 ASP 115 HB3 ASP 115 1.203 -10.093 4.209 925 H ALA 116 H ALA 116 -0.481 -10.939 1.184 926 HA ALA 116 HA ALA 116 -1.223 -8.151 0.988 927 HB1 ALA 116 HB1 ALA 116 0.173 -9.006 -0.737 928 HB2 ALA 116 HB2 ALA 116 -0.842 -10.439 -0.982 929 HB3 ALA 116 HB3 ALA 116 -1.384 -8.831 -1.512 930 H PHE 117 H PHE 117 -3.101 -11.218 0.461 931 HA PHE 117 HA PHE 117 -5.467 -9.919 -0.419 932 HB2 PHE 117 HB2 PHE 117 -4.931 -12.341 -0.528 933 HB3 PHE 117 HB3 PHE 117 -5.231 -12.472 1.205 934 HD1 PHE 117 HD1 PHE 117 -6.736 -11.944 -2.154 935 HD2 PHE 117 HD2 PHE 117 -7.542 -12.386 2.070 936 HE1 PHE 117 HE1 PHE 117 -9.097 -12.368 -2.649 937 HE2 PHE 117 HE2 PHE 117 -9.915 -12.870 1.558 938 HZ PHE 117 HZ PHE 117 -10.716 -12.847 -0.804 939 H ASP 118 H ASP 118 -4.185 -10.339 2.866 940 HA ASP 118 HA ASP 118 -6.564 -9.328 4.191 941 HB2 ASP 118 HB2 ASP 118 -4.901 -10.990 5.123 942 HB3 ASP 118 HB3 ASP 118 -3.750 -9.656 5.264 943 H PHE 119 H PHE 119 -3.586 -7.865 2.879 944 HA PHE 119 HA PHE 119 -3.905 -5.262 4.013 945 HB2 PHE 119 HB2 PHE 119 -1.878 -5.704 2.904 946 HB3 PHE 119 HB3 PHE 119 -2.649 -6.297 1.466 947 HD1 PHE 119 HD1 PHE 119 -1.227 -3.431 3.005 948 HD2 PHE 119 HD2 PHE 119 -3.864 -4.696 -0.120 949 HE1 PHE 119 HE1 PHE 119 -1.059 -1.195 1.978 950 HE2 PHE 119 HE2 PHE 119 -3.602 -2.494 -1.237 951 HZ PHE 119 HZ PHE 119 -2.251 -0.716 -0.160 952 H ASN 120 H ASN 120 -5.313 -6.789 1.117 953 HA ASN 120 HA ASN 120 -7.033 -4.594 0.387 954 HB2 ASN 120 HB2 ASN 120 -6.772 -5.977 -1.371 955 HB3 ASN 120 HB3 ASN 120 -6.591 -7.425 -0.376 956 HD21 ASN 120 HD21 ASN 120 -9.835 -8.528 -0.853 957 HD22 ASN 120 HD22 ASN 120 -8.250 -8.813 -0.144 958 H VAL 121 H VAL 121 -7.779 -7.599 2.301 959 HA VAL 121 HA VAL 121 -10.473 -6.822 2.665 960 HB VAL 121 HB VAL 121 -8.756 -8.788 4.210 961 HG11 VAL 121 HG11 VAL 121 -11.762 -8.340 4.482 962 HG12 VAL 121 HG12 VAL 121 -10.878 -9.754 5.099 963 HG13 VAL 121 HG13 VAL 121 -10.539 -8.160 5.763 964 HG21 VAL 121 HG21 VAL 121 -10.099 -10.461 2.983 965 HG22 VAL 121 HG22 VAL 121 -11.029 -9.164 2.198 966 HG23 VAL 121 HG23 VAL 121 -9.305 -9.376 1.849 967 H SER 122 H SER 122 -7.626 -6.015 4.625 968 HA SER 122 HA SER 122 -8.900 -4.767 6.824 969 HB2 SER 122 HB2 SER 122 -6.445 -5.180 6.575 970 HB3 SER 122 HB3 SER 122 -6.369 -3.858 5.396 971 HG SER 122 HG SER 122 -7.331 -2.536 7.153 972 H LEU 123 H LEU 123 -8.682 -3.659 3.469 973 HA LEU 123 HA LEU 123 -9.808 -1.009 4.215 974 HB2 LEU 123 HB2 LEU 123 -8.845 -2.007 1.529 975 HB3 LEU 123 HB3 LEU 123 -9.401 -0.377 1.913 976 HG LEU 123 HG LEU 123 -6.918 -1.744 3.021 977 HD11 LEU 123 HD11 LEU 123 -5.686 -0.162 1.717 978 HD12 LEU 123 HD12 LEU 123 -6.857 -0.947 0.652 979 HD13 LEU 123 HD13 LEU 123 -7.178 0.699 1.262 980 HD21 LEU 123 HD21 LEU 123 -7.992 1.052 3.586 981 HD22 LEU 123 HD22 LEU 123 -7.768 -0.255 4.769 982 HD23 LEU 123 HD23 LEU 123 -6.360 0.481 4.004 983 H GLN 124 H GLN 124 -10.738 -4.005 2.457 984 HA GLN 124 HA GLN 124 -13.301 -3.133 1.579 985 HB2 GLN 124 HB2 GLN 124 -12.552 -5.886 2.670 986 HB3 GLN 124 HB3 GLN 124 -14.048 -5.469 1.834 987 HG2 GLN 124 HG2 GLN 124 -12.653 -4.773 -0.166 988 HG3 GLN 124 HG3 GLN 124 -11.250 -5.458 0.660 989 HE21 GLN 124 HE21 GLN 124 -12.303 -8.188 -1.501 990 HE22 GLN 124 HE22 GLN 124 -11.258 -6.760 -1.449 991 H ASP 125 H ASP 125 -12.476 -4.672 4.743 992 HA ASP 125 HA ASP 125 -15.143 -4.176 5.812 993 HB2 ASP 125 HB2 ASP 125 -13.543 -6.084 6.389 994 HB3 ASP 125 HB3 ASP 125 -12.588 -4.899 7.296 995 H HIS 126 H HIS 126 -12.557 -2.063 5.383 996 HA HIS 126 HA HIS 126 -13.222 -0.330 7.705 997 HB2 HIS 126 HB2 HIS 126 -10.884 -0.498 7.082 998 HB3 HIS 126 HB3 HIS 126 -11.255 0.058 5.438 999 HD2 HIS 126 HD2 HIS 126 -11.640 1.361 9.102 1000 HE1 HIS 126 HE1 HIS 126 -10.719 4.688 6.612 1001 HE2 HIS 126 HE2 HIS 126 -11.070 3.933 9.001 1002 H PHE 127 H PHE 127 -13.546 -0.338 4.123 1003 HA PHE 127 HA PHE 127 -15.264 2.027 4.306 1004 HB2 PHE 127 HB2 PHE 127 -14.195 0.471 1.970 1005 HB3 PHE 127 HB3 PHE 127 -15.391 1.755 1.797 1006 HD1 PHE 127 HD1 PHE 127 -14.899 4.100 2.669 1007 HD2 PHE 127 HD2 PHE 127 -11.860 1.049 2.408 1008 HE1 PHE 127 HE1 PHE 127 -13.128 5.814 2.976 1009 HE2 PHE 127 HE2 PHE 127 -10.101 2.770 2.664 1010 HZ PHE 127 HZ PHE 127 -10.742 5.154 2.974 1011 H LYS 128 H LYS 128 -15.925 -1.375 4.424 1012 HA LYS 128 HA LYS 128 -18.437 -1.453 3.234 1013 HB2 LYS 128 HB2 LYS 128 -18.844 -3.496 4.244 1014 HB3 LYS 128 HB3 LYS 128 -17.126 -3.401 3.997 1015 HG2 LYS 128 HG2 LYS 128 -17.157 -4.298 6.085 1016 HG3 LYS 128 HG3 LYS 128 -17.114 -2.585 6.546 1017 HD2 LYS 128 HD2 LYS 128 -19.675 -2.771 6.681 1018 HD3 LYS 128 HD3 LYS 128 -19.468 -4.503 6.401 1019 HE2 LYS 128 HE2 LYS 128 -18.158 -3.010 8.702 1020 HE3 LYS 128 HE3 LYS 128 -19.796 -3.661 8.809 1021 HZ1 LYS 128 HZ1 LYS 128 -18.211 -5.247 9.688 1022 HZ2 LYS 128 HZ2 LYS 128 -18.873 -5.876 8.335 1023 HZ3 LYS 128 HZ3 LYS 128 -17.347 -5.276 8.308 1024 H TRP 129 H TRP 129 -17.756 0.000 6.320 1025 HA TRP 129 HA TRP 129 -20.660 0.251 6.955 1026 HB2 TRP 129 HB2 TRP 129 -19.880 0.761 9.229 1027 HB3 TRP 129 HB3 TRP 129 -19.427 -0.825 8.648 1028 HD1 TRP 129 HD1 TRP 129 -16.854 -1.407 8.458 1029 HE1 TRP 129 HE1 TRP 129 -14.724 -0.243 9.109 1030 HE3 TRP 129 HE3 TRP 129 -18.762 3.228 9.495 1031 HZ2 TRP 129 HZ2 TRP 129 -13.876 2.397 10.003 1032 HZ3 TRP 129 HZ3 TRP 129 -17.235 5.093 10.150 1033 HH2 TRP 129 HH2 TRP 129 -14.807 4.683 10.418 1034 H VAL 130 H VAL 130 -18.664 2.053 5.196 1035 HA VAL 130 HA VAL 130 -19.929 4.635 5.977 1036 HB VAL 130 HB VAL 130 -17.436 5.410 4.977 1037 HG11 VAL 130 HG11 VAL 130 -18.478 5.221 7.824 1038 HG12 VAL 130 HG12 VAL 130 -17.110 6.221 7.308 1039 HG13 VAL 130 HG13 VAL 130 -18.736 6.562 6.690 1040 HG21 VAL 130 HG21 VAL 130 -16.872 3.334 7.084 1041 HG22 VAL 130 HG22 VAL 130 -16.505 3.193 5.363 1042 HG23 VAL 130 HG23 VAL 130 -15.737 4.462 6.325 1043 H LYS 131 H LYS 131 -18.903 6.212 3.934 1044 HA LYS 131 HA LYS 131 -19.390 6.926 1.894 1045 HB2 LYS 131 HB2 LYS 131 -17.758 4.733 1.647 1046 HB3 LYS 131 HB3 LYS 131 -19.102 4.226 0.639 1047 HG2 LYS 131 HG2 LYS 131 -17.592 5.292 -0.815 1048 HG3 LYS 131 HG3 LYS 131 -18.869 6.498 -0.551 1049 HD2 LYS 131 HD2 LYS 131 -17.443 7.653 1.110 1050 HD3 LYS 131 HD3 LYS 131 -16.187 6.411 0.905 1051 HE2 LYS 131 HE2 LYS 131 -15.978 7.008 -1.487 1052 HE3 LYS 131 HE3 LYS 131 -17.246 8.226 -1.311 1053 HZ1 LYS 131 HZ1 LYS 131 -14.634 8.272 0.124 1054 HZ2 LYS 131 HZ2 LYS 131 -15.016 9.208 -1.167 1055 HZ3 LYS 131 HZ3 LYS 131 -15.802 9.420 0.244 1056 H GLN 132 H GLN 132 -21.634 5.661 3.394 1057 HA GLN 132 HA GLN 132 -23.847 5.234 3.224 1058 HB2 GLN 132 HB2 GLN 132 -23.784 7.163 0.884 1059 HB3 GLN 132 HB3 GLN 132 -25.165 6.790 1.912 1060 HG2 GLN 132 HG2 GLN 132 -22.624 8.248 2.745 1061 HG3 GLN 132 HG3 GLN 132 -24.212 8.954 2.511 1062 HE21 GLN 132 HE21 GLN 132 -23.496 8.188 6.201 1063 HE22 GLN 132 HE22 GLN 132 -22.467 8.906 4.969 1064 H GLU 133 H GLU 133 -22.161 3.371 1.701 1065 HA GLU 133 HA GLU 133 -24.066 2.370 -0.334 1066 HB2 GLU 133 HB2 GLU 133 -21.341 1.309 0.493 1067 HB3 GLU 133 HB3 GLU 133 -22.387 0.619 -0.752 1068 HG2 GLU 133 HG2 GLU 133 -22.337 2.928 -1.891 1069 HG3 GLU 133 HG3 GLU 133 -21.014 3.331 -0.794 1070 H1 SER 149 H1 SER 149 13.720 -24.171 -10.989 1071 H2 SER 149 H2 SER 149 14.772 -23.979 -12.235 1072 H3 SER 149 H3 SER 149 13.618 -25.140 -12.301 1073 HA SER 149 HA SER 149 13.050 -23.335 -13.727 1074 HB2 SER 149 HB2 SER 149 11.154 -23.559 -11.366 1075 HB3 SER 149 HB3 SER 149 10.764 -23.004 -13.008 1076 HG SER 149 HG SER 149 10.284 -25.230 -12.706 1077 H GLN 150 H GLN 150 12.504 -22.059 -10.360 1078 HA GLN 150 HA GLN 150 12.629 -19.996 -9.525 1079 HB2 GLN 150 HB2 GLN 150 15.042 -20.809 -9.828 1080 HB3 GLN 150 HB3 GLN 150 15.170 -19.615 -11.121 1081 HG2 GLN 150 HG2 GLN 150 14.542 -17.829 -9.442 1082 HG3 GLN 150 HG3 GLN 150 14.443 -19.075 -8.196 1083 HE21 GLN 150 HE21 GLN 150 18.145 -17.830 -9.523 1084 HE22 GLN 150 HE22 GLN 150 16.716 -17.460 -10.481 1085 H ILE 151 H ILE 151 10.808 -19.981 -11.532 1086 HA ILE 151 HA ILE 151 11.153 -17.645 -13.279 1087 HB ILE 151 HB ILE 151 8.746 -19.426 -12.755 1088 HG12 ILE 151 HG12 ILE 151 10.695 -19.345 -15.112 1089 HG13 ILE 151 HG13 ILE 151 10.707 -20.562 -13.839 1090 HG21 ILE 151 HG21 ILE 151 8.016 -17.197 -13.543 1091 HG22 ILE 151 HG22 ILE 151 9.161 -17.290 -14.903 1092 HG23 ILE 151 HG23 ILE 151 7.772 -18.392 -14.793 1093 HD11 ILE 151 HD11 ILE 151 8.530 -20.175 -15.914 1094 HD12 ILE 151 HD12 ILE 151 9.638 -21.536 -15.721 1095 HD13 ILE 151 HD13 ILE 151 8.385 -21.249 -14.498 1096 H THR 152 H THR 152 10.311 -15.605 -12.982 1097 HA THR 152 HA THR 152 9.752 -14.729 -10.289 1098 HB THR 152 HB THR 152 9.269 -12.521 -11.454 1099 HG1 THR 152 HG1 THR 152 8.791 -13.399 -13.527 1100 HG21 THR 152 HG21 THR 152 11.471 -13.025 -10.496 1101 HG22 THR 152 HG22 THR 152 11.965 -13.800 -12.022 1102 HG23 THR 152 HG23 THR 152 11.589 -12.059 -11.978 1103 H SER 153 H SER 153 7.922 -13.878 -9.380 1104 HA SER 153 HA SER 153 5.515 -15.247 -10.135 1105 HB2 SER 153 HB2 SER 153 6.031 -13.359 -7.838 1106 HB3 SER 153 HB3 SER 153 4.678 -14.502 -7.994 1107 HG SER 153 HG SER 153 6.413 -15.336 -6.690 1108 H GLN 154 H GLN 154 5.728 -13.685 -12.119 1109 HA GLN 154 HA GLN 154 4.634 -11.164 -12.374 1110 HB2 GLN 154 HB2 GLN 154 3.932 -11.865 -14.644 1111 HB3 GLN 154 HB3 GLN 154 5.574 -12.356 -14.229 1112 HG2 GLN 154 HG2 GLN 154 4.740 -14.677 -13.785 1113 HG3 GLN 154 HG3 GLN 154 3.110 -14.161 -14.219 1114 HE21 GLN 154 HE21 GLN 154 4.400 -15.762 -17.253 1115 HE22 GLN 154 HE22 GLN 154 3.849 -16.232 -15.651 1116 H VAL 155 H VAL 155 2.545 -10.195 -12.618 1117 HA VAL 155 HA VAL 155 0.579 -11.157 -10.870 1118 HB VAL 155 HB VAL 155 -0.333 -9.388 -13.136 1119 HG11 VAL 155 HG11 VAL 155 -0.874 -9.251 -10.108 1120 HG12 VAL 155 HG12 VAL 155 -1.631 -8.238 -11.325 1121 HG13 VAL 155 HG13 VAL 155 -1.940 -9.956 -11.331 1122 HG21 VAL 155 HG21 VAL 155 1.782 -8.331 -12.711 1123 HG22 VAL 155 HG22 VAL 155 0.446 -7.370 -12.064 1124 HG23 VAL 155 HG23 VAL 155 1.437 -8.337 -10.939 1125 H TPO 156 H T2P 156 -0.696 -12.893 -11.116 1126 HA TPO 156 HA T2P 156 -1.707 -14.186 -13.510 1127 HB TPO 156 HB T2P 156 -2.795 -14.022 -10.728 1128 HG21 TPO 156 HG21 T2P 156 -4.071 -15.489 -12.998 1129 HG22 TPO 156 HG22 T2P 156 -4.746 -14.208 -11.914 1130 HG23 TPO 156 HG23 T2P 156 -4.366 -15.812 -11.279 1131 H GLY 157 H GLY 157 -3.623 -14.023 -14.435 1132 HA2 GLY 157 HA2 GLY 157 -5.468 -11.795 -14.192 1133 HA3 GLY 157 HA3 GLY 157 -4.350 -11.538 -15.534 1134 H GLN 158 H GLN 158 -4.365 -14.601 -16.036 1135 HA GLN 158 HA GLN 158 -6.518 -14.769 -17.872 1136 HB2 GLN 158 HB2 GLN 158 -5.858 -17.058 -18.188 1137 HB3 GLN 158 HB3 GLN 158 -4.428 -16.035 -18.059 1138 HG2 GLN 158 HG2 GLN 158 -4.121 -16.792 -15.687 1139 HG3 GLN 158 HG3 GLN 158 -5.547 -17.819 -15.839 1140 HE21 GLN 158 HE21 GLN 158 -2.760 -20.122 -16.387 1141 HE22 GLN 158 HE22 GLN 158 -3.522 -19.261 -15.057 1142 H ILE 159 H ILE 159 -6.538 -15.380 -14.469 1143 HA ILE 159 HA ILE 159 -9.366 -16.333 -14.648 1144 HB ILE 159 HB ILE 159 -7.883 -18.141 -13.995 1145 HG12 ILE 159 HG12 ILE 159 -8.964 -18.873 -11.898 1146 HG13 ILE 159 HG13 ILE 159 -9.626 -17.258 -11.663 1147 HG21 ILE 159 HG21 ILE 159 -6.705 -18.187 -11.841 1148 HG22 ILE 159 HG22 ILE 159 -6.051 -16.959 -12.915 1149 HG23 ILE 159 HG23 ILE 159 -7.114 -16.491 -11.563 1150 HD11 ILE 159 HD11 ILE 159 -11.009 -17.503 -13.692 1151 HD12 ILE 159 HD12 ILE 159 -10.239 -19.071 -14.042 1152 HD13 ILE 159 HD13 ILE 159 -11.267 -18.878 -12.608 1153 H GLY 160 H GLY 160 -7.104 -14.299 -12.879 1154 HA2 GLY 160 HA2 GLY 160 -7.483 -12.228 -11.895 1155 HA3 GLY 160 HA3 GLY 160 -9.168 -12.312 -12.414 1156 H TRP 161 H TRP 161 -7.504 -14.641 -10.311 1157 HA TRP 161 HA TRP 161 -9.694 -14.415 -8.373 1158 HB2 TRP 161 HB2 TRP 161 -9.198 -16.618 -7.767 1159 HB3 TRP 161 HB3 TRP 161 -9.231 -16.504 -9.509 1160 HD1 TRP 161 HD1 TRP 161 -5.914 -15.317 -8.927 1161 HE1 TRP 161 HE1 TRP 161 -4.168 -17.173 -9.147 1162 HE3 TRP 161 HE3 TRP 161 -8.986 -19.334 -8.230 1163 HZ2 TRP 161 HZ2 TRP 161 -4.112 -20.066 -8.984 1164 HZ3 TRP 161 HZ3 TRP 161 -8.057 -21.651 -8.246 1165 HH2 TRP 161 HH2 TRP 161 -5.630 -22.024 -8.629 1166 H ARG 162 H ARG 162 -7.736 -15.897 -6.540 1167 HA ARG 162 HA ARG 162 -7.386 -13.449 -4.840 1168 HB2 ARG 162 HB2 ARG 162 -8.893 -16.043 -4.259 1169 HB3 ARG 162 HB3 ARG 162 -8.844 -14.628 -3.214 1170 HG2 ARG 162 HG2 ARG 162 -10.172 -14.862 -5.939 1171 HG3 ARG 162 HG3 ARG 162 -10.976 -14.757 -4.387 1172 HD2 ARG 162 HD2 ARG 162 -10.891 -12.487 -4.337 1173 HD3 ARG 162 HD3 ARG 162 -9.209 -12.436 -4.826 1174 HE ARG 162 HE ARG 162 -9.774 -12.209 -7.046 1175 HH11 ARG 162 HH11 ARG 162 -11.078 -11.956 -8.808 1176 HH12 ARG 162 HH12 ARG 162 -12.812 -11.927 -8.610 1177 HH21 ARG 162 HH21 ARG 162 -12.758 -12.763 -5.281 1178 HH22 ARG 162 HH22 ARG 162 -13.743 -12.426 -6.678 1179 H ARG 163 H ARG 163 -7.037 -14.811 -2.441 1180 HA ARG 163 HA ARG 163 -4.271 -15.644 -2.380 1181 HB2 ARG 163 HB2 ARG 163 -4.730 -16.262 -0.047 1182 HB3 ARG 163 HB3 ARG 163 -5.260 -14.632 -0.432 1183 HG2 ARG 163 HG2 ARG 163 -7.616 -15.415 -0.593 1184 HG3 ARG 163 HG3 ARG 163 -7.088 -17.070 -0.226 1185 HD2 ARG 163 HD2 ARG 163 -6.262 -16.342 1.971 1186 HD3 ARG 163 HD3 ARG 163 -6.719 -14.667 1.599 1187 HE ARG 163 HE ARG 163 -8.997 -16.366 1.297 1188 HH11 ARG 163 HH11 ARG 163 -10.647 -16.336 2.775 1189 HH12 ARG 163 HH12 ARG 163 -10.368 -15.732 4.381 1190 HH21 ARG 163 HH21 ARG 163 -7.059 -15.006 3.879 1191 HH22 ARG 163 HH22 ARG 163 -8.397 -14.992 4.994 Start of MODEL 27 1 H1 GLY -4 H1 GLY -4 5.132 28.734 25.489 2 H2 GLY -4 H2 GLY -4 4.288 28.425 26.857 3 H3 GLY -4 H3 GLY -4 5.470 29.560 26.864 4 HA2 GLY -4 HA2 GLY -4 3.312 30.623 26.835 5 HA3 GLY -4 HA3 GLY -4 4.237 30.967 25.363 6 H SER -3 H SER -3 1.463 31.232 25.454 7 HA SER -3 HA SER -3 0.003 28.969 24.542 8 HB2 SER -3 HB2 SER -3 -0.548 31.926 24.090 9 HB3 SER -3 HB3 SER -3 -1.720 30.609 23.904 10 HG SER -3 HG SER -3 -1.866 31.631 25.966 11 HA PRO -2 HA PRO -2 1.125 28.770 20.229 12 HB2 PRO -2 HB2 PRO -2 -1.043 27.562 19.087 13 HB3 PRO -2 HB3 PRO -2 0.062 26.716 20.212 14 HG2 PRO -2 HG2 PRO -2 -2.588 28.050 20.867 15 HG3 PRO -2 HG3 PRO -2 -2.049 26.395 21.301 16 HD2 PRO -2 HD2 PRO -2 -1.825 28.469 23.043 17 HD3 PRO -2 HD3 PRO -2 -0.555 27.213 22.942 18 H ASN -1 H ASN -1 0.779 29.731 18.193 19 HA ASN -1 HA ASN -1 -0.562 32.296 18.152 20 HB2 ASN -1 HB2 ASN -1 1.560 31.788 16.977 21 HB3 ASN -1 HB3 ASN -1 0.734 30.612 15.953 22 HD21 ASN -1 HD21 ASN -1 -0.652 33.093 13.797 23 HD22 ASN -1 HD22 ASN -1 -0.795 31.416 14.312 24 H SER 0 H SER 0 -1.446 29.079 17.052 25 HA SER 0 HA SER 0 -3.893 30.079 15.640 26 HB2 SER 0 HB2 SER 0 -2.006 27.868 14.749 27 HB3 SER 0 HB3 SER 0 -3.419 28.480 13.874 28 HG SER 0 HG SER 0 -1.497 29.388 13.071 29 H MET 1 H MET 1 -5.417 28.266 15.093 30 HA MET 1 HA MET 1 -6.214 26.869 17.494 31 HB2 MET 1 HB2 MET 1 -7.389 26.855 14.682 32 HB3 MET 1 HB3 MET 1 -8.115 26.114 16.112 33 HG2 MET 1 HG2 MET 1 -9.225 28.141 15.896 34 HG3 MET 1 HG3 MET 1 -8.085 28.399 17.212 35 HE1 MET 1 HE1 MET 1 -9.690 30.732 15.816 36 HE2 MET 1 HE2 MET 1 -8.498 30.993 17.111 37 HE3 MET 1 HE3 MET 1 -8.419 31.959 15.622 38 H ALA 2 H ALA 2 -4.216 25.635 17.693 39 HA ALA 2 HA ALA 2 -3.449 23.576 15.892 40 HB1 ALA 2 HB1 ALA 2 -1.880 22.996 17.697 41 HB2 ALA 2 HB2 ALA 2 -1.971 24.756 17.490 42 HB3 ALA 2 HB3 ALA 2 -2.817 23.973 18.847 43 H THR 3 H THR 3 -6.124 23.496 17.979 44 HA THR 3 HA THR 3 -6.000 20.685 18.747 45 HB THR 3 HB THR 3 -8.276 21.166 19.704 46 HG1 THR 3 HG1 THR 3 -8.904 22.921 18.472 47 HG21 THR 3 HG21 THR 3 -7.358 22.497 21.536 48 HG22 THR 3 HG22 THR 3 -6.164 21.307 20.973 49 HG23 THR 3 HG23 THR 3 -5.994 23.013 20.512 50 H GLU 4 H GLU 4 -5.645 20.348 16.378 51 HA GLU 4 HA GLU 4 -8.078 19.956 14.744 52 HB2 GLU 4 HB2 GLU 4 -6.624 19.411 12.956 53 HB3 GLU 4 HB3 GLU 4 -5.943 20.807 13.780 54 HG2 GLU 4 HG2 GLU 4 -4.344 19.250 14.976 55 HG3 GLU 4 HG3 GLU 4 -5.001 17.910 14.032 56 H LEU 5 H LEU 5 -8.097 17.780 13.457 57 HA LEU 5 HA LEU 5 -8.202 15.508 15.357 58 HB2 LEU 5 HB2 LEU 5 -8.975 15.694 12.423 59 HB3 LEU 5 HB3 LEU 5 -9.203 14.293 13.471 60 HG LEU 5 HG LEU 5 -10.556 17.003 13.807 61 HD11 LEU 5 HD11 LEU 5 -11.656 14.294 12.947 62 HD12 LEU 5 HD12 LEU 5 -12.592 15.792 13.159 63 HD13 LEU 5 HD13 LEU 5 -11.372 15.689 11.881 64 HD21 LEU 5 HD21 LEU 5 -10.289 15.962 16.010 65 HD22 LEU 5 HD22 LEU 5 -11.971 15.848 15.493 66 HD23 LEU 5 HD23 LEU 5 -10.921 14.419 15.386 67 H GLU 6 H GLU 6 -6.026 15.384 15.828 68 HA GLU 6 HA GLU 6 -4.217 14.394 13.669 69 HB2 GLU 6 HB2 GLU 6 -2.369 15.079 15.155 70 HB3 GLU 6 HB3 GLU 6 -3.324 16.361 14.427 71 HG2 GLU 6 HG2 GLU 6 -4.360 16.954 16.476 72 HG3 GLU 6 HG3 GLU 6 -3.909 15.440 17.258 73 H TYR 7 H TYR 7 -5.480 12.330 14.013 74 HA TYR 7 HA TYR 7 -3.868 10.565 15.677 75 HB2 TYR 7 HB2 TYR 7 -5.622 9.518 16.835 76 HB3 TYR 7 HB3 TYR 7 -5.862 11.233 17.112 77 HD1 TYR 7 HD1 TYR 7 -7.316 8.146 15.910 78 HD2 TYR 7 HD2 TYR 7 -7.703 12.444 15.748 79 HE1 TYR 7 HE1 TYR 7 -9.629 7.893 15.073 80 HE2 TYR 7 HE2 TYR 7 -10.045 12.185 14.913 81 HH TYR 7 HH TYR 7 -11.547 8.974 14.403 82 H GLU 8 H GLU 8 -4.758 8.274 15.378 83 HA GLU 8 HA GLU 8 -6.254 7.529 13.088 84 HB2 GLU 8 HB2 GLU 8 -4.559 6.286 11.870 85 HB3 GLU 8 HB3 GLU 8 -4.260 7.995 11.758 86 HG2 GLU 8 HG2 GLU 8 -2.779 6.241 13.750 87 HG3 GLU 8 HG3 GLU 8 -2.258 6.432 12.091 88 H SER 9 H SER 9 -7.183 5.659 13.534 89 HA SER 9 HA SER 9 -6.372 4.150 15.924 90 HB2 SER 9 HB2 SER 9 -8.781 4.052 14.098 91 HB3 SER 9 HB3 SER 9 -8.538 2.933 15.460 92 HG SER 9 HG SER 9 -9.797 4.759 16.065 93 H VAL 10 H VAL 10 -5.469 2.036 15.872 94 HA VAL 10 HA VAL 10 -4.408 1.212 13.309 95 HB VAL 10 HB VAL 10 -3.131 0.954 15.354 96 HG11 VAL 10 HG11 VAL 10 -3.479 -0.890 16.895 97 HG12 VAL 10 HG12 VAL 10 -4.903 0.161 16.907 98 HG13 VAL 10 HG13 VAL 10 -4.949 -1.390 16.041 99 HG21 VAL 10 HG21 VAL 10 -3.581 -1.705 13.942 100 HG22 VAL 10 HG22 VAL 10 -2.597 -0.360 13.317 101 HG23 VAL 10 HG23 VAL 10 -2.131 -1.182 14.814 102 H LEU 11 H LEU 11 -4.966 -0.280 11.885 103 HA LEU 11 HA LEU 11 -7.447 -1.902 12.360 104 HB2 LEU 11 HB2 LEU 11 -6.286 -0.838 9.756 105 HB3 LEU 11 HB3 LEU 11 -7.693 -1.878 9.907 106 HG LEU 11 HG LEU 11 -7.471 1.006 10.862 107 HD11 LEU 11 HD11 LEU 11 -9.046 -0.380 8.644 108 HD12 LEU 11 HD12 LEU 11 -9.227 1.316 9.112 109 HD13 LEU 11 HD13 LEU 11 -7.692 0.755 8.442 110 HD21 LEU 11 HD21 LEU 11 -9.800 -0.958 11.077 111 HD22 LEU 11 HD22 LEU 11 -8.929 -0.180 12.425 112 HD23 LEU 11 HD23 LEU 11 -9.915 0.797 11.341 113 H CYS 12 H CYS 12 -4.197 -1.932 10.809 114 HA CYS 12 HA CYS 12 -4.043 -4.831 11.268 115 HB2 CYS 12 HB2 CYS 12 -5.186 -4.416 9.031 116 HB3 CYS 12 HB3 CYS 12 -3.632 -3.792 8.451 117 HG CYS 12 HG CYS 12 -4.259 -6.311 7.726 118 H VAL 13 H VAL 13 -2.050 -5.756 11.062 119 HA VAL 13 HA VAL 13 0.308 -4.128 10.484 120 HB VAL 13 HB VAL 13 0.115 -3.902 12.878 121 HG11 VAL 13 HG11 VAL 13 0.287 -6.924 13.159 122 HG12 VAL 13 HG12 VAL 13 0.287 -5.724 14.462 123 HG13 VAL 13 HG13 VAL 13 -1.159 -5.937 13.469 124 HG21 VAL 13 HG21 VAL 13 2.391 -4.099 11.895 125 HG22 VAL 13 HG22 VAL 13 2.324 -4.698 13.556 126 HG23 VAL 13 HG23 VAL 13 2.367 -5.846 12.206 127 H LYS 14 H LYS 14 1.647 -5.234 9.199 128 HA LYS 14 HA LYS 14 1.591 -8.203 9.329 129 HB2 LYS 14 HB2 LYS 14 1.537 -6.606 6.759 130 HB3 LYS 14 HB3 LYS 14 2.150 -8.239 6.804 131 HG2 LYS 14 HG2 LYS 14 -0.655 -7.442 7.690 132 HG3 LYS 14 HG3 LYS 14 -0.212 -8.084 6.104 133 HD2 LYS 14 HD2 LYS 14 0.703 -10.146 7.243 134 HD3 LYS 14 HD3 LYS 14 0.022 -9.553 8.777 135 HE2 LYS 14 HE2 LYS 14 -2.211 -9.509 7.823 136 HE3 LYS 14 HE3 LYS 14 -1.560 -9.945 6.231 137 HZ1 LYS 14 HZ1 LYS 14 -1.523 -11.699 8.622 138 HZ2 LYS 14 HZ2 LYS 14 -2.478 -11.874 7.291 139 HZ3 LYS 14 HZ3 LYS 14 -0.846 -12.068 7.166 140 HA PRO 15 HA PRO 15 5.530 -8.010 10.555 141 HB2 PRO 15 HB2 PRO 15 6.523 -10.530 10.053 142 HB3 PRO 15 HB3 PRO 15 5.189 -10.191 11.194 143 HG2 PRO 15 HG2 PRO 15 4.948 -11.072 8.284 144 HG3 PRO 15 HG3 PRO 15 4.132 -11.775 9.721 145 HD2 PRO 15 HD2 PRO 15 2.884 -9.997 8.172 146 HD3 PRO 15 HD3 PRO 15 2.725 -9.923 9.954 147 H ASP 16 H ASP 16 5.474 -8.968 7.119 148 HA ASP 16 HA ASP 16 8.007 -7.519 6.680 149 HB2 ASP 16 HB2 ASP 16 8.687 -9.844 7.104 150 HB3 ASP 16 HB3 ASP 16 7.583 -10.405 5.848 151 H VAL 17 H VAL 17 8.057 -6.433 4.795 152 HA VAL 17 HA VAL 17 6.243 -7.013 2.575 153 HB VAL 17 HB VAL 17 4.789 -5.763 4.144 154 HG11 VAL 17 HG11 VAL 17 6.664 -3.409 3.769 155 HG12 VAL 17 HG12 VAL 17 5.106 -3.401 4.604 156 HG13 VAL 17 HG13 VAL 17 6.456 -4.340 5.264 157 HG21 VAL 17 HG21 VAL 17 4.458 -5.608 1.695 158 HG22 VAL 17 HG22 VAL 17 3.920 -4.168 2.569 159 HG23 VAL 17 HG23 VAL 17 5.451 -4.129 1.678 160 H SER 18 H SER 18 6.986 -6.137 0.659 161 HA SER 18 HA SER 18 9.504 -4.529 0.775 162 HB2 SER 18 HB2 SER 18 8.776 -6.611 -1.297 163 HB3 SER 18 HB3 SER 18 10.303 -5.723 -1.119 164 HG SER 18 HG SER 18 10.340 -7.887 -0.247 165 H VAL 19 H VAL 19 9.822 -2.946 -0.748 166 HA VAL 19 HA VAL 19 7.395 -2.020 -2.234 167 HB VAL 19 HB VAL 19 9.298 -0.467 -0.500 168 HG11 VAL 19 HG11 VAL 19 7.320 0.628 -2.512 169 HG12 VAL 19 HG12 VAL 19 8.093 1.583 -1.238 170 HG13 VAL 19 HG13 VAL 19 9.083 0.890 -2.506 171 HG21 VAL 19 HG21 VAL 19 7.310 -1.547 0.561 172 HG22 VAL 19 HG22 VAL 19 7.175 0.207 0.572 173 HG23 VAL 19 HG23 VAL 19 6.259 -0.734 -0.612 174 H TYR 20 H TYR 20 7.560 -1.143 -4.089 175 HA TYR 20 HA TYR 20 10.118 -1.278 -5.643 176 HB2 TYR 20 HB2 TYR 20 7.366 -2.347 -6.422 177 HB3 TYR 20 HB3 TYR 20 8.826 -2.430 -7.387 178 HD1 TYR 20 HD1 TYR 20 7.203 -3.668 -4.236 179 HD2 TYR 20 HD2 TYR 20 10.283 -4.314 -7.180 180 HE1 TYR 20 HE1 TYR 20 7.668 -5.908 -3.261 181 HE2 TYR 20 HE2 TYR 20 10.647 -6.608 -6.259 182 HH TYR 20 HH TYR 20 8.856 -7.873 -3.456 183 H ARG 21 H ARG 21 10.089 1.144 -5.429 184 HA ARG 21 HA ARG 21 8.161 2.943 -6.343 185 HB2 ARG 21 HB2 ARG 21 11.165 3.021 -6.867 186 HB3 ARG 21 HB3 ARG 21 10.063 4.383 -7.087 187 HG2 ARG 21 HG2 ARG 21 9.481 4.291 -4.662 188 HG3 ARG 21 HG3 ARG 21 10.668 3.004 -4.429 189 HD2 ARG 21 HD2 ARG 21 11.281 5.803 -5.484 190 HD3 ARG 21 HD3 ARG 21 11.463 5.297 -3.807 191 HE ARG 21 HE ARG 21 13.173 3.694 -4.451 192 HH11 ARG 21 HH11 ARG 21 15.022 3.314 -5.539 193 HH12 ARG 21 HH12 ARG 21 15.520 4.379 -6.836 194 HH21 ARG 21 HH21 ARG 21 12.639 6.253 -6.807 195 HH22 ARG 21 HH22 ARG 21 14.180 5.973 -7.569 196 H ILE 22 H ILE 22 7.255 3.569 -8.236 197 HA ILE 22 HA ILE 22 8.004 1.995 -10.657 198 HB ILE 22 HB ILE 22 5.717 1.861 -11.293 199 HG12 ILE 22 HG12 ILE 22 5.155 3.634 -8.897 200 HG13 ILE 22 HG13 ILE 22 4.686 3.864 -10.585 201 HG21 ILE 22 HG21 ILE 22 5.953 1.090 -8.407 202 HG22 ILE 22 HG22 ILE 22 5.011 0.290 -9.651 203 HG23 ILE 22 HG23 ILE 22 6.780 0.221 -9.722 204 HD11 ILE 22 HD11 ILE 22 3.533 1.889 -8.590 205 HD12 ILE 22 HD12 ILE 22 2.725 3.248 -9.391 206 HD13 ILE 22 HD13 ILE 22 3.194 1.818 -10.338 207 HA PRO 23 HA PRO 23 8.028 5.796 -13.032 208 HB2 PRO 23 HB2 PRO 23 7.930 4.393 -15.560 209 HB3 PRO 23 HB3 PRO 23 9.281 5.260 -14.798 210 HG2 PRO 23 HG2 PRO 23 8.981 2.432 -15.078 211 HG3 PRO 23 HG3 PRO 23 10.231 3.302 -14.138 212 HD2 PRO 23 HD2 PRO 23 7.855 1.853 -13.170 213 HD3 PRO 23 HD3 PRO 23 9.300 2.406 -12.287 214 HA PRO 24 HA PRO 24 4.234 5.360 -15.761 215 HB2 PRO 24 HB2 PRO 24 2.685 3.146 -16.031 216 HB3 PRO 24 HB3 PRO 24 4.312 3.278 -16.770 217 HG2 PRO 24 HG2 PRO 24 3.588 1.984 -14.115 218 HG3 PRO 24 HG3 PRO 24 4.516 1.271 -15.479 219 HD2 PRO 24 HD2 PRO 24 5.735 2.446 -13.359 220 HD3 PRO 24 HD3 PRO 24 6.400 2.604 -15.012 221 H ARG 25 H ARG 25 1.814 5.444 -15.735 222 HA ARG 25 HA ARG 25 0.639 5.619 -12.985 223 HB2 ARG 25 HB2 ARG 25 -0.413 7.705 -13.510 224 HB3 ARG 25 HB3 ARG 25 1.337 7.840 -13.660 225 HG2 ARG 25 HG2 ARG 25 1.180 7.766 -16.115 226 HG3 ARG 25 HG3 ARG 25 -0.575 7.501 -16.022 227 HD2 ARG 25 HD2 ARG 25 -0.884 9.663 -14.927 228 HD3 ARG 25 HD3 ARG 25 0.871 9.954 -14.961 229 HE ARG 25 HE ARG 25 0.031 9.422 -17.619 230 HH11 ARG 25 HH11 ARG 25 -0.298 11.019 -19.129 231 HH12 ARG 25 HH12 ARG 25 -0.609 12.651 -18.615 232 HH21 ARG 25 HH21 ARG 25 -0.437 11.968 -15.259 233 HH22 ARG 25 HH22 ARG 25 -0.689 13.182 -16.483 234 H ALA 26 H ALA 26 -0.119 4.949 -16.379 235 HA ALA 26 HA ALA 26 -2.568 3.576 -15.516 236 HB1 ALA 26 HB1 ALA 26 -2.694 6.124 -17.186 237 HB2 ALA 26 HB2 ALA 26 -4.062 5.044 -16.794 238 HB3 ALA 26 HB3 ALA 26 -3.234 5.945 -15.507 239 H SER 27 H SER 27 -2.056 1.776 -16.433 240 HA SER 27 HA SER 27 -2.179 1.516 -19.408 241 HB2 SER 27 HB2 SER 27 -0.595 0.007 -18.324 242 HB3 SER 27 HB3 SER 27 -1.819 -0.492 -17.152 243 HG SER 27 HG SER 27 -1.730 -1.044 -19.935 244 H ASN 28 H ASN 28 -3.989 -0.046 -20.119 245 HA ASN 28 HA ASN 28 -6.551 0.732 -18.927 246 HB2 ASN 28 HB2 ASN 28 -7.533 -0.589 -20.716 247 HB3 ASN 28 HB3 ASN 28 -6.301 0.489 -21.363 248 HD21 ASN 28 HD21 ASN 28 -5.585 -3.564 -21.352 249 HD22 ASN 28 HD22 ASN 28 -6.726 -2.888 -20.190 250 H ARG 29 H ARG 29 -4.254 -1.818 -18.441 251 HA ARG 29 HA ARG 29 -6.152 -3.509 -16.883 252 HB2 ARG 29 HB2 ARG 29 -3.131 -3.750 -17.270 253 HB3 ARG 29 HB3 ARG 29 -4.199 -4.944 -16.530 254 HG2 ARG 29 HG2 ARG 29 -4.211 -4.105 -19.436 255 HG3 ARG 29 HG3 ARG 29 -3.593 -5.623 -18.782 256 HD2 ARG 29 HD2 ARG 29 -6.487 -4.688 -18.697 257 HD3 ARG 29 HD3 ARG 29 -5.830 -5.873 -19.807 258 HE ARG 29 HE ARG 29 -6.101 -6.241 -16.825 259 HH11 ARG 29 HH11 ARG 29 -6.263 -8.394 -16.016 260 HH12 ARG 29 HH12 ARG 29 -6.394 -9.651 -17.217 261 HH21 ARG 29 HH21 ARG 29 -5.899 -7.803 -19.973 262 HH22 ARG 29 HH22 ARG 29 -6.096 -9.389 -19.249 263 H GLY 30 H GLY 30 -4.186 -0.812 -16.326 264 HA2 GLY 30 HA2 GLY 30 -4.616 0.234 -14.124 265 HA3 GLY 30 HA3 GLY 30 -4.127 -1.307 -13.382 266 H TYR 31 H TYR 31 -1.992 -1.692 -13.040 267 HA TYR 31 HA TYR 31 0.068 0.273 -14.044 268 HB2 TYR 31 HB2 TYR 31 -0.327 -0.996 -11.318 269 HB3 TYR 31 HB3 TYR 31 1.217 -0.344 -11.828 270 HD1 TYR 31 HD1 TYR 31 1.631 1.988 -12.136 271 HD2 TYR 31 HD2 TYR 31 -2.234 0.509 -10.930 272 HE1 TYR 31 HE1 TYR 31 1.033 4.260 -11.297 273 HE2 TYR 31 HE2 TYR 31 -2.857 2.807 -10.111 274 HH TYR 31 HH TYR 31 -0.573 5.562 -10.280 275 H ARG 32 H ARG 32 -0.668 -3.096 -13.441 276 HA ARG 32 HA ARG 32 0.448 -4.994 -13.331 277 HB2 ARG 32 HB2 ARG 32 2.016 -4.655 -15.776 278 HB3 ARG 32 HB3 ARG 32 0.790 -5.801 -15.292 279 HG2 ARG 32 HG2 ARG 32 -0.243 -4.904 -17.096 280 HG3 ARG 32 HG3 ARG 32 -0.896 -3.860 -15.852 281 HD2 ARG 32 HD2 ARG 32 -0.362 -2.362 -17.485 282 HD3 ARG 32 HD3 ARG 32 1.058 -2.247 -16.449 283 HE ARG 32 HE ARG 32 2.387 -3.171 -18.126 284 HH11 ARG 32 HH11 ARG 32 2.937 -3.452 -20.106 285 HH12 ARG 32 HH12 ARG 32 1.762 -3.803 -21.369 286 HH21 ARG 32 HH21 ARG 32 -0.934 -3.263 -19.275 287 HH22 ARG 32 HH22 ARG 32 -0.419 -3.700 -20.882 288 H ALA 33 H ALA 33 1.772 -5.401 -11.675 289 HA ALA 33 HA ALA 33 4.317 -4.370 -11.122 290 HB1 ALA 33 HB1 ALA 33 3.081 -5.805 -9.570 291 HB2 ALA 33 HB2 ALA 33 3.259 -7.197 -10.665 292 HB3 ALA 33 HB3 ALA 33 4.678 -6.477 -9.877 293 H SER 34 H SER 34 3.453 -6.924 -13.380 294 HA SER 34 HA SER 34 5.999 -7.826 -14.182 295 HB2 SER 34 HB2 SER 34 3.343 -7.668 -15.654 296 HB3 SER 34 HB3 SER 34 4.709 -8.724 -16.103 297 HG SER 34 HG SER 34 3.036 -9.725 -14.840 298 H ASP 35 H ASP 35 4.546 -4.734 -14.917 299 HA ASP 35 HA ASP 35 6.041 -4.321 -17.419 300 HB2 ASP 35 HB2 ASP 35 3.666 -3.440 -16.698 301 HB3 ASP 35 HB3 ASP 35 4.573 -2.176 -15.883 302 H TRP 36 H TRP 36 6.297 -3.521 -14.024 303 HA TRP 36 HA TRP 36 8.904 -2.110 -14.407 304 HB2 TRP 36 HB2 TRP 36 8.300 -1.246 -11.993 305 HB3 TRP 36 HB3 TRP 36 7.768 -0.489 -13.458 306 HD1 TRP 36 HD1 TRP 36 5.294 -0.461 -14.089 307 HE1 TRP 36 HE1 TRP 36 3.125 -0.926 -12.858 308 HE3 TRP 36 HE3 TRP 36 7.202 -2.810 -9.944 309 HZ2 TRP 36 HZ2 TRP 36 2.335 -1.791 -10.211 310 HZ3 TRP 36 HZ3 TRP 36 5.698 -3.431 -8.072 311 HH2 TRP 36 HH2 TRP 36 3.268 -2.921 -8.181 312 H LYS 37 H LYS 37 9.540 -2.479 -11.550 313 HA LYS 37 HA LYS 37 10.778 -5.159 -11.716 314 HB2 LYS 37 HB2 LYS 37 10.912 -2.851 -9.729 315 HB3 LYS 37 HB3 LYS 37 11.643 -4.436 -9.417 316 HG2 LYS 37 HG2 LYS 37 12.954 -4.314 -11.472 317 HG3 LYS 37 HG3 LYS 37 12.221 -2.762 -11.906 318 HD2 LYS 37 HD2 LYS 37 13.325 -1.613 -10.123 319 HD3 LYS 37 HD3 LYS 37 13.747 -3.124 -9.311 320 HE2 LYS 37 HE2 LYS 37 15.756 -2.411 -10.319 321 HE3 LYS 37 HE3 LYS 37 15.152 -3.772 -11.277 322 HZ1 LYS 37 HZ1 LYS 37 15.911 -1.930 -12.686 323 HZ2 LYS 37 HZ2 LYS 37 14.312 -2.157 -12.908 324 HZ3 LYS 37 HZ3 LYS 37 14.846 -0.899 -12.006 325 H LEU 38 H LEU 38 9.542 -6.618 -11.722 326 HA LEU 38 HA LEU 38 7.313 -7.169 -9.993 327 HB2 LEU 38 HB2 LEU 38 7.576 -7.808 -12.391 328 HB3 LEU 38 HB3 LEU 38 9.044 -8.701 -12.003 329 HG LEU 38 HG LEU 38 7.733 -10.216 -10.614 330 HD11 LEU 38 HD11 LEU 38 5.307 -8.937 -11.985 331 HD12 LEU 38 HD12 LEU 38 5.275 -10.344 -10.902 332 HD13 LEU 38 HD13 LEU 38 5.703 -8.758 -10.263 333 HD21 LEU 38 HD21 LEU 38 6.750 -11.473 -12.547 334 HD22 LEU 38 HD22 LEU 38 6.908 -10.020 -13.543 335 HD23 LEU 38 HD23 LEU 38 8.360 -10.822 -12.907 336 H ASP 39 H ASP 39 10.735 -8.015 -9.970 337 HA ASP 39 HA ASP 39 10.453 -9.689 -7.516 338 HB2 ASP 39 HB2 ASP 39 11.942 -11.245 -8.557 339 HB3 ASP 39 HB3 ASP 39 10.658 -10.892 -9.706 340 H GLN 40 H GLN 40 11.802 -6.844 -8.477 341 HA GLN 40 HA GLN 40 14.383 -7.169 -6.964 342 HB2 GLN 40 HB2 GLN 40 13.693 -5.619 -9.457 343 HB3 GLN 40 HB3 GLN 40 15.170 -5.335 -8.534 344 HG2 GLN 40 HG2 GLN 40 16.102 -7.407 -9.092 345 HG3 GLN 40 HG3 GLN 40 14.547 -8.150 -9.447 346 HE21 GLN 40 HE21 GLN 40 14.368 -6.929 -12.805 347 HE22 GLN 40 HE22 GLN 40 13.495 -7.726 -11.490 348 HA PRO 41 HA PRO 41 11.817 -4.045 -4.733 349 HB2 PRO 41 HB2 PRO 41 12.545 -4.603 -2.163 350 HB3 PRO 41 HB3 PRO 41 11.357 -5.570 -3.088 351 HG2 PRO 41 HG2 PRO 41 14.313 -6.137 -2.709 352 HG3 PRO 41 HG3 PRO 41 12.935 -7.259 -2.469 353 HD2 PRO 41 HD2 PRO 41 14.368 -7.229 -4.778 354 HD3 PRO 41 HD3 PRO 41 12.597 -7.490 -4.796 355 H ASP 42 H ASP 42 12.247 -2.141 -3.659 356 HA ASP 42 HA ASP 42 15.050 -1.109 -3.825 357 HB2 ASP 42 HB2 ASP 42 13.352 -0.098 -5.307 358 HB3 ASP 42 HB3 ASP 42 12.340 0.273 -3.912 359 H TRP 43 H TRP 43 12.329 -1.571 -1.658 360 HA TRP 43 HA TRP 43 14.035 -1.038 0.684 361 HB2 TRP 43 HB2 TRP 43 12.953 1.118 0.345 362 HB3 TRP 43 HB3 TRP 43 11.391 0.359 0.116 363 HD1 TRP 43 HD1 TRP 43 13.720 1.611 2.786 364 HE1 TRP 43 HE1 TRP 43 12.557 1.568 5.074 365 HE3 TRP 43 HE3 TRP 43 9.550 -1.095 1.547 366 HZ2 TRP 43 HZ2 TRP 43 10.069 0.617 6.179 367 HZ3 TRP 43 HZ3 TRP 43 7.787 -1.544 3.232 368 HH2 TRP 43 HH2 TRP 43 8.024 -0.668 5.547 369 H THR 44 H THR 44 13.343 -2.282 2.545 370 HA THR 44 HA THR 44 10.710 -3.544 2.429 371 HB THR 44 HB THR 44 11.293 -5.674 2.898 372 HG1 THR 44 HG1 THR 44 14.010 -5.024 3.316 373 HG21 THR 44 HG21 THR 44 11.910 -5.270 0.556 374 HG22 THR 44 HG22 THR 44 13.601 -5.032 1.043 375 HG23 THR 44 HG23 THR 44 12.798 -6.605 1.297 376 H GLY 45 H GLY 45 9.858 -4.170 4.377 377 HA2 GLY 45 HA2 GLY 45 11.081 -3.534 6.938 378 HA3 GLY 45 HA3 GLY 45 10.054 -2.241 6.351 379 H ARG 46 H ARG 46 8.335 -2.341 7.501 380 HA ARG 46 HA ARG 46 6.715 -4.833 7.862 381 HB2 ARG 46 HB2 ARG 46 8.118 -4.312 9.864 382 HB3 ARG 46 HB3 ARG 46 7.360 -2.724 9.976 383 HG2 ARG 46 HG2 ARG 46 5.150 -3.819 10.390 384 HG3 ARG 46 HG3 ARG 46 5.929 -5.400 10.184 385 HD2 ARG 46 HD2 ARG 46 5.677 -5.027 12.520 386 HD3 ARG 46 HD3 ARG 46 7.398 -4.935 12.113 387 HE ARG 46 HE ARG 46 5.952 -2.338 12.210 388 HH11 ARG 46 HH11 ARG 46 6.382 -0.932 13.646 389 HH12 ARG 46 HH12 ARG 46 7.403 -1.263 15.058 390 HH21 ARG 46 HH21 ARG 46 7.894 -4.558 14.134 391 HH22 ARG 46 HH22 ARG 46 8.250 -3.322 15.307 392 H LEU 47 H LEU 47 4.476 -4.507 7.878 393 HA LEU 47 HA LEU 47 3.518 -1.903 6.750 394 HB2 LEU 47 HB2 LEU 47 2.963 -4.027 5.538 395 HB3 LEU 47 HB3 LEU 47 2.253 -4.632 7.023 396 HG LEU 47 HG LEU 47 0.621 -2.564 6.850 397 HD11 LEU 47 HD11 LEU 47 1.555 -2.798 3.967 398 HD12 LEU 47 HD12 LEU 47 0.178 -1.847 4.570 399 HD13 LEU 47 HD13 LEU 47 1.822 -1.404 5.042 400 HD21 LEU 47 HD21 LEU 47 0.443 -4.928 4.972 401 HD22 LEU 47 HD22 LEU 47 -0.098 -4.863 6.662 402 HD23 LEU 47 HD23 LEU 47 -0.902 -3.867 5.456 403 H ARG 48 H ARG 48 2.346 -0.512 8.038 404 HA ARG 48 HA ARG 48 0.345 -1.914 9.694 405 HB2 ARG 48 HB2 ARG 48 1.684 0.682 10.524 406 HB3 ARG 48 HB3 ARG 48 0.078 0.191 11.079 407 HG2 ARG 48 HG2 ARG 48 1.173 -2.051 11.769 408 HG3 ARG 48 HG3 ARG 48 2.722 -1.204 11.609 409 HD2 ARG 48 HD2 ARG 48 1.860 0.520 13.230 410 HD3 ARG 48 HD3 ARG 48 0.348 -0.387 13.335 411 HE ARG 48 HE ARG 48 1.439 -2.176 14.465 412 HH11 ARG 48 HH11 ARG 48 2.602 -2.637 16.284 413 HH12 ARG 48 HH12 ARG 48 3.951 -1.639 16.731 414 HH21 ARG 48 HH21 ARG 48 3.747 0.450 14.023 415 HH22 ARG 48 HH22 ARG 48 4.490 0.137 15.574 416 H ILE 49 H ILE 49 -1.664 -1.207 9.613 417 HA ILE 49 HA ILE 49 -2.383 0.936 7.657 418 HB ILE 49 HB ILE 49 -3.776 -1.731 8.035 419 HG12 ILE 49 HG12 ILE 49 -2.297 -0.441 5.696 420 HG13 ILE 49 HG13 ILE 49 -1.843 -1.905 6.572 421 HG21 ILE 49 HG21 ILE 49 -5.468 -0.994 6.492 422 HG22 ILE 49 HG22 ILE 49 -5.416 0.138 7.818 423 HG23 ILE 49 HG23 ILE 49 -4.651 0.575 6.263 424 HD11 ILE 49 HD11 ILE 49 -2.750 -2.555 4.475 425 HD12 ILE 49 HD12 ILE 49 -3.935 -3.007 5.712 426 HD13 ILE 49 HD13 ILE 49 -4.194 -1.562 4.680 427 H THR 50 H THR 50 -3.615 2.435 8.481 428 HA THR 50 HA THR 50 -4.980 2.037 11.104 429 HB THR 50 HB THR 50 -4.139 4.166 11.903 430 HG1 THR 50 HG1 THR 50 -2.567 4.169 9.539 431 HG21 THR 50 HG21 THR 50 -1.729 2.558 10.964 432 HG22 THR 50 HG22 THR 50 -1.808 3.713 12.309 433 HG23 THR 50 HG23 THR 50 -2.698 2.188 12.403 434 H SER 51 H SER 51 -6.497 3.980 11.547 435 HA SER 51 HA SER 51 -7.319 5.464 9.166 436 HB2 SER 51 HB2 SER 51 -9.678 4.832 9.342 437 HB3 SER 51 HB3 SER 51 -8.650 3.473 8.881 438 HG SER 51 HG SER 51 -9.487 3.998 11.561 439 H LYS 52 H LYS 52 -7.713 7.463 9.693 440 HA LYS 52 HA LYS 52 -8.596 8.261 12.432 441 HB2 LYS 52 HB2 LYS 52 -6.668 9.379 11.316 442 HB3 LYS 52 HB3 LYS 52 -7.791 9.964 10.069 443 HG2 LYS 52 HG2 LYS 52 -9.117 10.926 12.170 444 HG3 LYS 52 HG3 LYS 52 -7.549 10.763 12.964 445 HD2 LYS 52 HD2 LYS 52 -8.214 12.324 10.455 446 HD3 LYS 52 HD3 LYS 52 -7.796 12.965 12.061 447 HE2 LYS 52 HE2 LYS 52 -5.520 11.992 11.815 448 HE3 LYS 52 HE3 LYS 52 -5.951 11.414 10.199 449 HZ1 LYS 52 HZ1 LYS 52 -4.779 13.560 10.123 450 HZ2 LYS 52 HZ2 LYS 52 -6.300 13.746 9.553 451 HZ3 LYS 52 HZ3 LYS 52 -5.926 14.258 11.068 452 H GLY 53 H GLY 53 -10.462 6.938 11.858 453 HA2 GLY 53 HA2 GLY 53 -12.824 6.957 11.757 454 HA3 GLY 53 HA3 GLY 53 -12.782 8.591 11.099 455 H LYS 54 H LYS 54 -13.671 8.618 9.132 456 HA LYS 54 HA LYS 54 -13.841 6.319 7.346 457 HB2 LYS 54 HB2 LYS 54 -15.685 7.877 7.755 458 HB3 LYS 54 HB3 LYS 54 -14.754 9.218 7.117 459 HG2 LYS 54 HG2 LYS 54 -15.169 6.932 5.220 460 HG3 LYS 54 HG3 LYS 54 -16.632 7.743 5.767 461 HD2 LYS 54 HD2 LYS 54 -15.838 9.917 5.058 462 HD3 LYS 54 HD3 LYS 54 -14.282 9.243 4.547 463 HE2 LYS 54 HE2 LYS 54 -15.354 7.894 2.832 464 HE3 LYS 54 HE3 LYS 54 -16.966 8.343 3.417 465 HZ1 LYS 54 HZ1 LYS 54 -16.511 10.637 2.770 466 HZ2 LYS 54 HZ2 LYS 54 -14.986 10.292 2.310 467 HZ3 LYS 54 HZ3 LYS 54 -16.254 9.688 1.468 468 H THR 55 H THR 55 -11.186 7.763 7.905 469 HA THR 55 HA THR 55 -10.229 7.546 5.080 470 HB THR 55 HB THR 55 -8.980 9.302 7.221 471 HG1 THR 55 HG1 THR 55 -10.032 11.030 6.232 472 HG21 THR 55 HG21 THR 55 -8.918 9.196 4.165 473 HG22 THR 55 HG22 THR 55 -8.034 10.393 5.155 474 HG23 THR 55 HG23 THR 55 -7.607 8.672 5.242 475 H ALA 56 H ALA 56 -8.881 5.866 4.830 476 HA ALA 56 HA ALA 56 -7.475 4.672 7.146 477 HB1 ALA 56 HB1 ALA 56 -8.590 3.042 5.775 478 HB2 ALA 56 HB2 ALA 56 -7.860 3.694 4.296 479 HB3 ALA 56 HB3 ALA 56 -6.854 2.877 5.512 480 H TYR 57 H TYR 57 -5.152 4.262 6.985 481 HA TYR 57 HA TYR 57 -3.651 5.878 5.013 482 HB2 TYR 57 HB2 TYR 57 -3.156 5.950 8.006 483 HB3 TYR 57 HB3 TYR 57 -2.132 6.657 6.765 484 HD1 TYR 57 HD1 TYR 57 -2.512 8.894 6.013 485 HD2 TYR 57 HD2 TYR 57 -5.537 6.868 8.334 486 HE1 TYR 57 HE1 TYR 57 -3.782 11.022 6.235 487 HE2 TYR 57 HE2 TYR 57 -6.849 8.956 8.438 488 HH TYR 57 HH TYR 57 -5.692 12.030 7.012 489 H ILE 58 H ILE 58 -2.265 4.552 4.064 490 HA ILE 58 HA ILE 58 -1.393 2.018 5.365 491 HB ILE 58 HB ILE 58 -0.371 3.134 2.735 492 HG12 ILE 58 HG12 ILE 58 -2.722 3.098 2.352 493 HG13 ILE 58 HG13 ILE 58 -1.956 1.776 1.500 494 HG21 ILE 58 HG21 ILE 58 -0.507 0.355 3.954 495 HG22 ILE 58 HG22 ILE 58 0.104 0.734 2.327 496 HG23 ILE 58 HG23 ILE 58 0.943 1.356 3.747 497 HD11 ILE 58 HD11 ILE 58 -2.774 0.166 3.169 498 HD12 ILE 58 HD12 ILE 58 -3.497 1.491 4.115 499 HD13 ILE 58 HD13 ILE 58 -4.096 1.136 2.486 500 H LYS 59 H LYS 59 0.128 2.309 6.908 501 HA LYS 59 HA LYS 59 2.277 4.371 6.466 502 HB2 LYS 59 HB2 LYS 59 1.169 3.427 9.136 503 HB3 LYS 59 HB3 LYS 59 2.440 4.630 8.860 504 HG2 LYS 59 HG2 LYS 59 0.637 5.818 7.353 505 HG3 LYS 59 HG3 LYS 59 -0.522 4.817 8.228 506 HD2 LYS 59 HD2 LYS 59 0.250 5.850 10.377 507 HD3 LYS 59 HD3 LYS 59 1.423 6.823 9.449 508 HE2 LYS 59 HE2 LYS 59 -0.629 7.543 8.024 509 HE3 LYS 59 HE3 LYS 59 -1.622 6.925 9.359 510 HZ1 LYS 59 HZ1 LYS 59 0.454 9.040 9.564 511 HZ2 LYS 59 HZ2 LYS 59 -1.149 9.317 9.507 512 HZ3 LYS 59 HZ3 LYS 59 -0.557 8.562 10.809 513 H LEU 60 H LEU 60 4.084 3.564 5.855 514 HA LEU 60 HA LEU 60 4.756 0.723 6.404 515 HB2 LEU 60 HB2 LEU 60 5.828 2.799 4.465 516 HB3 LEU 60 HB3 LEU 60 6.506 1.182 4.638 517 HG LEU 60 HG LEU 60 3.577 1.633 3.916 518 HD11 LEU 60 HD11 LEU 60 4.295 1.160 1.574 519 HD12 LEU 60 HD12 LEU 60 4.921 2.696 2.197 520 HD13 LEU 60 HD13 LEU 60 5.989 1.281 2.106 521 HD21 LEU 60 HD21 LEU 60 5.448 -0.753 3.543 522 HD22 LEU 60 HD22 LEU 60 4.170 -0.636 4.769 523 HD23 LEU 60 HD23 LEU 60 3.742 -0.669 3.054 524 H GLU 61 H GLU 61 6.394 0.057 7.627 525 HA GLU 61 HA GLU 61 7.905 2.123 9.172 526 HB2 GLU 61 HB2 GLU 61 6.749 -0.520 10.094 527 HB3 GLU 61 HB3 GLU 61 7.641 0.634 11.089 528 HG2 GLU 61 HG2 GLU 61 5.834 2.315 10.722 529 HG3 GLU 61 HG3 GLU 61 4.917 1.110 9.802 530 H ASP 62 H ASP 62 10.059 1.622 9.861 531 HA ASP 62 HA ASP 62 11.538 -0.331 8.314 532 HB2 ASP 62 HB2 ASP 62 12.518 1.797 8.894 533 HB3 ASP 62 HB3 ASP 62 12.174 1.557 10.609 534 H LYS 63 H LYS 63 12.060 -2.395 8.897 535 HA LYS 63 HA LYS 63 10.580 -3.582 11.089 536 HB2 LYS 63 HB2 LYS 63 11.395 -5.724 10.303 537 HB3 LYS 63 HB3 LYS 63 10.713 -4.767 9.003 538 HG2 LYS 63 HG2 LYS 63 12.863 -4.350 8.023 539 HG3 LYS 63 HG3 LYS 63 13.713 -4.804 9.498 540 HD2 LYS 63 HD2 LYS 63 13.945 -6.554 7.790 541 HD3 LYS 63 HD3 LYS 63 13.142 -7.121 9.243 542 HE2 LYS 63 HE2 LYS 63 11.943 -8.136 7.536 543 HE3 LYS 63 HE3 LYS 63 10.902 -6.803 8.022 544 HZ1 LYS 63 HZ1 LYS 63 12.720 -6.764 5.655 545 HZ2 LYS 63 HZ2 LYS 63 11.115 -7.070 5.617 546 HZ3 LYS 63 HZ3 LYS 63 11.661 -5.587 6.060 547 H VAL 64 H VAL 64 13.368 -1.939 11.400 548 HA VAL 64 HA VAL 64 14.472 -3.664 13.573 549 HB VAL 64 HB VAL 64 15.880 -1.253 12.405 550 HG11 VAL 64 HG11 VAL 64 17.879 -2.456 13.152 551 HG12 VAL 64 HG12 VAL 64 16.749 -2.215 14.488 552 HG13 VAL 64 HG13 VAL 64 16.874 -3.813 13.712 553 HG21 VAL 64 HG21 VAL 64 15.459 -2.596 10.426 554 HG22 VAL 64 HG22 VAL 64 17.146 -2.781 10.901 555 HG23 VAL 64 HG23 VAL 64 15.982 -4.078 11.270 556 H SER 65 H SER 65 13.348 -0.366 12.786 557 HA SER 65 HA SER 65 13.358 0.226 15.722 558 HB2 SER 65 HB2 SER 65 13.903 2.084 13.382 559 HB3 SER 65 HB3 SER 65 13.864 2.561 15.090 560 HG SER 65 HG SER 65 16.000 2.131 14.351 561 H GLY 66 H GLY 66 11.156 -0.166 13.181 562 HA2 GLY 66 HA2 GLY 66 8.919 0.276 13.022 563 HA3 GLY 66 HA3 GLY 66 8.939 0.976 14.645 564 H GLU 67 H GLU 67 11.193 2.413 12.451 565 HA GLU 67 HA GLU 67 9.844 4.984 12.693 566 HB2 GLU 67 HB2 GLU 67 12.416 4.084 11.353 567 HB3 GLU 67 HB3 GLU 67 11.841 5.749 11.262 568 HG2 GLU 67 HG2 GLU 67 12.263 4.318 13.904 569 HG3 GLU 67 HG3 GLU 67 13.541 5.206 13.079 570 H LEU 68 H LEU 68 9.082 6.331 11.092 571 HA LEU 68 HA LEU 68 7.557 4.899 9.106 572 HB2 LEU 68 HB2 LEU 68 6.753 6.915 10.411 573 HB3 LEU 68 HB3 LEU 68 7.824 7.907 9.422 574 HG LEU 68 HG LEU 68 6.554 6.984 7.368 575 HD11 LEU 68 HD11 LEU 68 4.540 6.204 9.530 576 HD12 LEU 68 HD12 LEU 68 4.265 6.178 7.775 577 HD13 LEU 68 HD13 LEU 68 5.423 5.064 8.499 578 HD21 LEU 68 HD21 LEU 68 6.215 9.260 8.247 579 HD22 LEU 68 HD22 LEU 68 4.702 8.561 7.650 580 HD23 LEU 68 HD23 LEU 68 5.008 8.644 9.400 581 H PHE 69 H PHE 69 8.164 4.288 7.183 582 HA PHE 69 HA PHE 69 10.366 5.542 5.632 583 HB2 PHE 69 HB2 PHE 69 10.343 3.190 5.594 584 HB3 PHE 69 HB3 PHE 69 8.605 3.109 5.349 585 HD1 PHE 69 HD1 PHE 69 11.414 4.892 3.525 586 HD2 PHE 69 HD2 PHE 69 8.083 2.168 3.305 587 HE1 PHE 69 HE1 PHE 69 11.700 4.737 1.080 588 HE2 PHE 69 HE2 PHE 69 8.400 1.974 0.873 589 HZ PHE 69 HZ PHE 69 10.164 3.285 -0.284 590 H ALA 70 H ALA 70 6.847 4.934 5.217 591 HA ALA 70 HA ALA 70 6.464 7.499 3.871 592 HB1 ALA 70 HB1 ALA 70 5.576 6.506 1.801 593 HB2 ALA 70 HB2 ALA 70 7.276 6.061 2.003 594 HB3 ALA 70 HB3 ALA 70 5.999 4.878 2.364 595 H GLN 71 H GLN 71 4.192 7.956 3.466 596 HA GLN 71 HA GLN 71 2.256 6.035 4.516 597 HB2 GLN 71 HB2 GLN 71 1.027 7.714 5.827 598 HB3 GLN 71 HB3 GLN 71 2.618 7.316 6.473 599 HG2 GLN 71 HG2 GLN 71 3.521 9.432 5.436 600 HG3 GLN 71 HG3 GLN 71 1.877 9.855 4.953 601 HE21 GLN 71 HE21 GLN 71 2.674 11.531 8.217 602 HE22 GLN 71 HE22 GLN 71 3.379 11.570 6.608 603 H ALA 72 H ALA 72 0.392 5.907 3.393 604 HA ALA 72 HA ALA 72 -0.148 7.980 1.303 605 HB1 ALA 72 HB1 ALA 72 -0.726 5.008 1.161 606 HB2 ALA 72 HB2 ALA 72 -1.187 6.225 -0.045 607 HB3 ALA 72 HB3 ALA 72 0.520 5.898 0.249 608 HA PRO 73 HA PRO 73 -4.069 8.074 3.700 609 HB2 PRO 73 HB2 PRO 73 -5.080 10.422 2.801 610 HB3 PRO 73 HB3 PRO 73 -3.676 10.353 3.908 611 HG2 PRO 73 HG2 PRO 73 -3.645 10.726 0.904 612 HG3 PRO 73 HG3 PRO 73 -2.737 11.634 2.149 613 HD2 PRO 73 HD2 PRO 73 -1.686 9.514 0.716 614 HD3 PRO 73 HD3 PRO 73 -1.158 9.931 2.374 615 H VAL 74 H VAL 74 -5.807 6.897 3.169 616 HA VAL 74 HA VAL 74 -6.814 6.778 0.348 617 HB VAL 74 HB VAL 74 -6.829 4.577 2.442 618 HG11 VAL 74 HG11 VAL 74 -7.681 3.130 0.700 619 HG12 VAL 74 HG12 VAL 74 -8.783 4.468 0.943 620 HG13 VAL 74 HG13 VAL 74 -7.693 4.486 -0.459 621 HG21 VAL 74 HG21 VAL 74 -5.198 4.541 -0.085 622 HG22 VAL 74 HG22 VAL 74 -4.542 4.911 1.526 623 HG23 VAL 74 HG23 VAL 74 -5.266 3.334 1.197 624 H GLU 75 H GLU 75 -8.873 7.529 0.103 625 HA GLU 75 HA GLU 75 -10.721 7.334 2.437 626 HB2 GLU 75 HB2 GLU 75 -9.813 9.698 1.607 627 HB3 GLU 75 HB3 GLU 75 -11.109 9.508 0.419 628 HG2 GLU 75 HG2 GLU 75 -12.617 8.952 2.493 629 HG3 GLU 75 HG3 GLU 75 -11.289 9.567 3.460 630 H GLN 76 H GLN 76 -10.174 5.775 -0.278 631 HA GLN 76 HA GLN 76 -12.854 4.850 -0.580 632 HB2 GLN 76 HB2 GLN 76 -13.255 5.377 -2.862 633 HB3 GLN 76 HB3 GLN 76 -12.909 6.893 -2.045 634 HG2 GLN 76 HG2 GLN 76 -11.049 5.371 -3.904 635 HG3 GLN 76 HG3 GLN 76 -11.951 6.818 -4.284 636 HE21 GLN 76 HE21 GLN 76 -8.374 7.173 -2.372 637 HE22 GLN 76 HE22 GLN 76 -9.144 5.574 -2.489 638 H TYR 77 H TYR 77 -12.868 2.761 -1.385 639 HA TYR 77 HA TYR 77 -10.423 1.746 -2.689 640 HB2 TYR 77 HB2 TYR 77 -10.415 1.231 -0.228 641 HB3 TYR 77 HB3 TYR 77 -11.837 0.222 -0.481 642 HD1 TYR 77 HD1 TYR 77 -8.744 0.613 -2.554 643 HD2 TYR 77 HD2 TYR 77 -10.964 -1.982 0.051 644 HE1 TYR 77 HE1 TYR 77 -7.044 -1.108 -2.878 645 HE2 TYR 77 HE2 TYR 77 -9.314 -3.788 -0.382 646 HH TYR 77 HH TYR 77 -6.439 -3.293 -2.464 647 HA PRO 78 HA PRO 78 -9.743 0.445 -4.481 648 HB2 PRO 78 HB2 PRO 78 -11.061 0.741 -7.159 649 HB3 PRO 78 HB3 PRO 78 -9.606 -0.200 -6.703 650 HG2 PRO 78 HG2 PRO 78 -11.961 -1.467 -7.091 651 HG3 PRO 78 HG3 PRO 78 -10.951 -1.902 -5.671 652 HD2 PRO 78 HD2 PRO 78 -13.325 -0.005 -5.771 653 HD3 PRO 78 HD3 PRO 78 -13.012 -1.348 -4.631 654 H GLY 79 H GLY 79 -8.457 2.202 -5.451 655 HA2 GLY 79 HA2 GLY 79 -9.737 4.676 -6.345 656 HA3 GLY 79 HA3 GLY 79 -9.030 4.776 -4.730 657 H ILE 80 H ILE 80 -7.680 6.447 -5.654 658 HA ILE 80 HA ILE 80 -5.468 5.560 -7.403 659 HB ILE 80 HB ILE 80 -6.530 7.754 -7.776 660 HG12 ILE 80 HG12 ILE 80 -4.564 9.147 -7.997 661 HG13 ILE 80 HG13 ILE 80 -3.651 8.150 -6.868 662 HG21 ILE 80 HG21 ILE 80 -5.334 8.613 -5.098 663 HG22 ILE 80 HG22 ILE 80 -6.175 9.643 -6.264 664 HG23 ILE 80 HG23 ILE 80 -7.070 8.380 -5.422 665 HD11 ILE 80 HD11 ILE 80 -3.602 6.301 -8.454 666 HD12 ILE 80 HD12 ILE 80 -4.741 7.146 -9.537 667 HD13 ILE 80 HD13 ILE 80 -3.100 7.775 -9.291 668 H ALA 81 H ALA 81 -6.110 6.129 -3.986 669 HA ALA 81 HA ALA 81 -3.293 6.233 -3.317 670 HB1 ALA 81 HB1 ALA 81 -5.760 6.166 -1.566 671 HB2 ALA 81 HB2 ALA 81 -4.071 6.390 -1.015 672 HB3 ALA 81 HB3 ALA 81 -4.840 7.601 -2.072 673 H VAL 82 H VAL 82 -5.648 3.686 -3.523 674 HA VAL 82 HA VAL 82 -3.413 1.766 -3.230 675 HB VAL 82 HB VAL 82 -4.361 1.724 -1.068 676 HG11 VAL 82 HG11 VAL 82 -6.769 0.904 -0.786 677 HG12 VAL 82 HG12 VAL 82 -6.404 2.609 -1.084 678 HG13 VAL 82 HG13 VAL 82 -6.995 1.627 -2.392 679 HG21 VAL 82 HG21 VAL 82 -3.501 -0.305 -1.898 680 HG22 VAL 82 HG22 VAL 82 -4.941 -0.653 -0.928 681 HG23 VAL 82 HG23 VAL 82 -5.004 -0.728 -2.702 682 H GLU 83 H GLU 83 -3.396 0.465 -4.941 683 HA GLU 83 HA GLU 83 -5.909 -0.450 -6.249 684 HB2 GLU 83 HB2 GLU 83 -4.156 1.539 -7.346 685 HB3 GLU 83 HB3 GLU 83 -3.824 0.063 -8.239 686 HG2 GLU 83 HG2 GLU 83 -6.621 1.191 -7.803 687 HG3 GLU 83 HG3 GLU 83 -5.601 1.596 -9.184 688 H THR 84 H THR 84 -5.705 -2.392 -7.522 689 HA THR 84 HA THR 84 -3.354 -4.111 -6.752 690 HB THR 84 HB THR 84 -5.788 -5.230 -8.000 691 HG1 THR 84 HG1 THR 84 -6.651 -4.114 -6.232 692 HG21 THR 84 HG21 THR 84 -3.834 -6.655 -7.650 693 HG22 THR 84 HG22 THR 84 -3.851 -6.262 -5.912 694 HG23 THR 84 HG23 THR 84 -5.191 -7.178 -6.641 695 H VAL 85 H VAL 85 -2.104 -3.204 -8.146 696 HA VAL 85 HA VAL 85 -1.061 -2.930 -10.324 697 HB VAL 85 HB VAL 85 -0.154 -5.362 -10.594 698 HG11 VAL 85 HG11 VAL 85 1.002 -3.453 -9.559 699 HG12 VAL 85 HG12 VAL 85 0.172 -3.754 -8.020 700 HG13 VAL 85 HG13 VAL 85 1.318 -4.933 -8.667 701 HG21 VAL 85 HG21 VAL 85 -2.090 -6.405 -9.210 702 HG22 VAL 85 HG22 VAL 85 -0.454 -6.863 -8.776 703 HG23 VAL 85 HG23 VAL 85 -1.328 -5.666 -7.805 704 H THR 86 H THR 86 -2.679 -6.034 -10.786 705 HA THR 86 HA THR 86 -4.352 -4.891 -12.855 706 HB THR 86 HB THR 86 -4.121 -6.878 -14.373 707 HG1 THR 86 HG1 THR 86 -2.536 -8.279 -14.106 708 HG21 THR 86 HG21 THR 86 -2.899 -4.620 -14.706 709 HG22 THR 86 HG22 THR 86 -1.473 -5.453 -14.097 710 HG23 THR 86 HG23 THR 86 -2.244 -6.038 -15.584 711 H ASP 87 H ASP 87 -3.404 -7.977 -11.456 712 HA ASP 87 HA ASP 87 -6.208 -8.557 -10.577 713 HB2 ASP 87 HB2 ASP 87 -4.512 -10.051 -12.589 714 HB3 ASP 87 HB3 ASP 87 -5.841 -10.829 -11.734 715 H SER 88 H SER 88 -3.090 -10.399 -10.758 716 HA SER 88 HA SER 88 -3.600 -11.852 -8.419 717 HB2 SER 88 HB2 SER 88 -0.790 -11.296 -9.340 718 HB3 SER 88 HB3 SER 88 -1.414 -12.691 -8.462 719 HG SER 88 HG SER 88 -1.239 -13.253 -10.609 720 H SER 89 H SER 89 -3.974 -11.059 -6.449 721 HA SER 89 HA SER 89 -2.960 -8.493 -5.748 722 HB2 SER 89 HB2 SER 89 -4.525 -8.592 -3.928 723 HB3 SER 89 HB3 SER 89 -5.242 -9.173 -5.442 724 HG SER 89 HG SER 89 -5.756 -10.550 -3.710 725 H ARG 90 H ARG 90 -0.957 -10.867 -5.556 726 HA ARG 90 HA ARG 90 0.144 -10.579 -2.858 727 HB2 ARG 90 HB2 ARG 90 0.781 -12.453 -4.326 728 HB3 ARG 90 HB3 ARG 90 1.556 -11.324 -5.453 729 HG2 ARG 90 HG2 ARG 90 3.187 -10.688 -3.755 730 HG3 ARG 90 HG3 ARG 90 2.314 -11.596 -2.505 731 HD2 ARG 90 HD2 ARG 90 2.867 -13.706 -3.636 732 HD3 ARG 90 HD3 ARG 90 3.681 -12.804 -4.942 733 HE ARG 90 HE ARG 90 4.799 -11.964 -2.468 734 HH11 ARG 90 HH11 ARG 90 6.696 -12.520 -1.777 735 HH12 ARG 90 HH12 ARG 90 7.476 -14.008 -2.282 736 HH21 ARG 90 HH21 ARG 90 4.877 -14.910 -4.377 737 HH22 ARG 90 HH22 ARG 90 6.450 -15.340 -3.763 738 H TYR 91 H TYR 91 0.077 -8.605 -5.697 739 HA TYR 91 HA TYR 91 1.896 -6.630 -4.408 740 HB2 TYR 91 HB2 TYR 91 1.077 -6.670 -7.301 741 HB3 TYR 91 HB3 TYR 91 2.364 -5.728 -6.592 742 HD1 TYR 91 HD1 TYR 91 4.489 -6.934 -5.848 743 HD2 TYR 91 HD2 TYR 91 1.406 -8.763 -8.247 744 HE1 TYR 91 HE1 TYR 91 6.087 -8.712 -6.555 745 HE2 TYR 91 HE2 TYR 91 3.002 -10.458 -9.055 746 HH TYR 91 HH TYR 91 6.425 -10.524 -7.818 747 H PHE 92 H PHE 92 1.408 -4.425 -4.726 748 HA PHE 92 HA PHE 92 -1.280 -3.594 -5.600 749 HB2 PHE 92 HB2 PHE 92 -0.202 -2.913 -2.836 750 HB3 PHE 92 HB3 PHE 92 -1.604 -2.162 -3.587 751 HD1 PHE 92 HD1 PHE 92 -0.390 -5.049 -1.767 752 HD2 PHE 92 HD2 PHE 92 -3.644 -3.554 -4.168 753 HE1 PHE 92 HE1 PHE 92 -1.861 -6.877 -0.947 754 HE2 PHE 92 HE2 PHE 92 -5.081 -5.427 -3.403 755 HZ PHE 92 HZ PHE 92 -4.174 -7.112 -1.806 756 H VAL 93 H VAL 93 -1.347 -1.137 -5.583 757 HA VAL 93 HA VAL 93 1.301 0.204 -5.647 758 HB VAL 93 HB VAL 93 -0.942 0.608 -7.665 759 HG11 VAL 93 HG11 VAL 93 0.503 2.412 -8.607 760 HG12 VAL 93 HG12 VAL 93 -0.174 2.830 -7.038 761 HG13 VAL 93 HG13 VAL 93 1.529 2.322 -7.163 762 HG21 VAL 93 HG21 VAL 93 0.903 0.193 -9.291 763 HG22 VAL 93 HG22 VAL 93 2.003 -0.139 -7.947 764 HG23 VAL 93 HG23 VAL 93 0.609 -1.201 -8.243 765 H ILE 94 H ILE 94 1.328 2.052 -4.416 766 HA ILE 94 HA ILE 94 -1.270 3.203 -3.604 767 HB ILE 94 HB ILE 94 -0.657 3.493 -1.301 768 HG12 ILE 94 HG12 ILE 94 1.856 1.826 -1.781 769 HG13 ILE 94 HG13 ILE 94 1.872 3.584 -1.714 770 HG21 ILE 94 HG21 ILE 94 -0.221 0.550 -2.020 771 HG22 ILE 94 HG22 ILE 94 -0.864 1.207 -0.508 772 HG23 ILE 94 HG23 ILE 94 -1.791 1.367 -1.982 773 HD11 ILE 94 HD11 ILE 94 0.902 3.529 0.564 774 HD12 ILE 94 HD12 ILE 94 0.967 1.766 0.535 775 HD13 ILE 94 HD13 ILE 94 2.468 2.703 0.471 776 H ARG 95 H ARG 95 -1.286 5.346 -3.028 777 HA ARG 95 HA ARG 95 0.901 6.989 -4.254 778 HB2 ARG 95 HB2 ARG 95 -1.378 7.101 -5.204 779 HB3 ARG 95 HB3 ARG 95 -1.974 7.772 -3.687 780 HG2 ARG 95 HG2 ARG 95 0.220 9.095 -5.331 781 HG3 ARG 95 HG3 ARG 95 -1.510 9.390 -5.568 782 HD2 ARG 95 HD2 ARG 95 -1.636 9.992 -3.087 783 HD3 ARG 95 HD3 ARG 95 0.120 9.984 -3.089 784 HE ARG 95 HE ARG 95 0.197 11.914 -4.436 785 HH11 ARG 95 HH11 ARG 95 -0.499 13.790 -5.096 786 HH12 ARG 95 HH12 ARG 95 -2.207 14.136 -5.254 787 HH21 ARG 95 HH21 ARG 95 -3.187 11.043 -4.076 788 HH22 ARG 95 HH22 ARG 95 -3.710 12.594 -4.670 789 H ILE 96 H ILE 96 2.369 7.188 -2.663 790 HA ILE 96 HA ILE 96 1.624 7.909 0.106 791 HB ILE 96 HB ILE 96 4.060 7.795 0.526 792 HG12 ILE 96 HG12 ILE 96 4.384 6.578 -2.241 793 HG13 ILE 96 HG13 ILE 96 4.662 8.301 -1.951 794 HG21 ILE 96 HG21 ILE 96 2.802 5.328 -0.724 795 HG22 ILE 96 HG22 ILE 96 4.226 5.305 0.317 796 HG23 ILE 96 HG23 ILE 96 2.684 5.844 0.974 797 HD11 ILE 96 HD11 ILE 96 6.157 6.039 -0.622 798 HD12 ILE 96 HD12 ILE 96 6.754 7.166 -1.864 799 HD13 ILE 96 HD13 ILE 96 6.337 7.772 -0.243 800 H GLN 97 H GLN 97 2.534 9.735 1.222 801 HA GLN 97 HA GLN 97 3.402 12.016 -0.488 802 HB2 GLN 97 HB2 GLN 97 2.773 11.838 2.468 803 HB3 GLN 97 HB3 GLN 97 3.701 13.160 1.756 804 HG2 GLN 97 HG2 GLN 97 1.614 13.148 0.012 805 HG3 GLN 97 HG3 GLN 97 0.790 12.523 1.442 806 HE21 GLN 97 HE21 GLN 97 2.294 16.383 1.396 807 HE22 GLN 97 HE22 GLN 97 2.988 15.158 0.326 808 H ASP 98 H ASP 98 5.485 12.869 -0.433 809 HA ASP 98 HA ASP 98 7.549 10.876 0.297 810 HB2 ASP 98 HB2 ASP 98 7.365 12.029 -1.960 811 HB3 ASP 98 HB3 ASP 98 7.894 13.503 -1.145 812 H GLY 99 H GLY 99 6.091 13.223 2.045 813 HA2 GLY 99 HA2 GLY 99 6.596 14.078 4.134 814 HA3 GLY 99 HA3 GLY 99 8.210 13.377 4.031 815 H THR 100 H THR 100 7.483 15.383 1.362 816 HA THR 100 HA THR 100 8.549 17.868 2.557 817 HB THR 100 HB THR 100 10.563 16.853 2.113 818 HG1 THR 100 HG1 THR 100 11.481 18.278 0.810 819 HG21 THR 100 HG21 THR 100 9.439 16.060 -0.561 820 HG22 THR 100 HG22 THR 100 11.194 16.120 -0.252 821 HG23 THR 100 HG23 THR 100 10.151 15.054 0.703 822 H GLY 101 H GLY 101 6.063 17.717 2.010 823 HA2 GLY 101 HA2 GLY 101 4.444 19.101 1.170 824 HA3 GLY 101 HA3 GLY 101 5.682 19.928 0.221 825 H ARG 102 H ARG 102 5.354 16.513 -0.271 826 HA ARG 102 HA ARG 102 3.937 16.827 -2.867 827 HB2 ARG 102 HB2 ARG 102 5.792 16.396 -4.175 828 HB3 ARG 102 HB3 ARG 102 6.321 17.594 -2.979 829 HG2 ARG 102 HG2 ARG 102 7.367 15.672 -1.678 830 HG3 ARG 102 HG3 ARG 102 6.998 14.638 -3.079 831 HD2 ARG 102 HD2 ARG 102 9.205 15.351 -3.470 832 HD3 ARG 102 HD3 ARG 102 8.201 16.390 -4.509 833 HE ARG 102 HE ARG 102 8.547 17.678 -1.982 834 HH11 ARG 102 HH11 ARG 102 10.143 18.975 -1.356 835 HH12 ARG 102 HH12 ARG 102 11.446 19.371 -2.450 836 HH21 ARG 102 HH21 ARG 102 10.509 17.037 -4.811 837 HH22 ARG 102 HH22 ARG 102 11.694 18.233 -4.353 838 H SER 103 H SER 103 4.220 14.674 -4.169 839 HA SER 103 HA SER 103 3.982 12.309 -2.421 840 HB2 SER 103 HB2 SER 103 1.816 11.681 -3.410 841 HB3 SER 103 HB3 SER 103 1.722 13.161 -2.451 842 HG SER 103 HG SER 103 1.865 14.324 -4.475 843 H ALA 104 H ALA 104 3.756 10.277 -3.497 844 HA ALA 104 HA ALA 104 4.843 10.048 -6.235 845 HB1 ALA 104 HB1 ALA 104 6.252 8.951 -3.764 846 HB2 ALA 104 HB2 ALA 104 6.708 8.635 -5.451 847 HB3 ALA 104 HB3 ALA 104 6.836 10.277 -4.794 848 H PHE 105 H PHE 105 4.540 8.043 -7.196 849 HA PHE 105 HA PHE 105 2.696 6.159 -5.824 850 HB2 PHE 105 HB2 PHE 105 3.646 6.137 -8.700 851 HB3 PHE 105 HB3 PHE 105 2.384 5.141 -7.982 852 HD1 PHE 105 HD1 PHE 105 0.255 6.245 -7.111 853 HD2 PHE 105 HD2 PHE 105 3.179 8.365 -9.473 854 HE1 PHE 105 HE1 PHE 105 -1.405 8.019 -7.590 855 HE2 PHE 105 HE2 PHE 105 1.526 10.154 -9.916 856 HZ PHE 105 HZ PHE 105 -0.784 9.980 -8.989 857 H ILE 106 H ILE 106 3.335 4.296 -5.013 858 HA ILE 106 HA ILE 106 5.835 3.022 -6.031 859 HB ILE 106 HB ILE 106 6.364 2.066 -3.889 860 HG12 ILE 106 HG12 ILE 106 4.155 3.885 -2.751 861 HG13 ILE 106 HG13 ILE 106 4.075 2.128 -2.831 862 HG21 ILE 106 HG21 ILE 106 7.262 4.329 -4.699 863 HG22 ILE 106 HG22 ILE 106 6.154 5.098 -3.559 864 HG23 ILE 106 HG23 ILE 106 7.431 4.012 -2.965 865 HD11 ILE 106 HD11 ILE 106 6.095 3.631 -1.135 866 HD12 ILE 106 HD12 ILE 106 4.558 2.963 -0.576 867 HD13 ILE 106 HD13 ILE 106 5.798 1.873 -1.185 868 H GLY 107 H GLY 107 5.797 0.900 -6.411 869 HA2 GLY 107 HA2 GLY 107 3.305 -0.641 -6.176 870 HA3 GLY 107 HA3 GLY 107 4.855 -1.183 -6.831 871 H ILE 108 H ILE 108 3.145 -2.423 -4.810 872 HA ILE 108 HA ILE 108 5.226 -2.769 -2.715 873 HB ILE 108 HB ILE 108 2.227 -3.108 -2.220 874 HG12 ILE 108 HG12 ILE 108 4.184 -0.860 -1.559 875 HG13 ILE 108 HG13 ILE 108 2.644 -0.745 -2.408 876 HG21 ILE 108 HG21 ILE 108 4.667 -3.277 -0.407 877 HG22 ILE 108 HG22 ILE 108 2.972 -3.459 0.122 878 HG23 ILE 108 HG23 ILE 108 3.666 -4.657 -0.930 879 HD11 ILE 108 HD11 ILE 108 3.057 -1.270 0.559 880 HD12 ILE 108 HD12 ILE 108 2.413 0.170 -0.203 881 HD13 ILE 108 HD13 ILE 108 1.471 -1.341 -0.271 882 H GLY 109 H GLY 109 5.694 -4.968 -2.261 883 HA2 GLY 109 HA2 GLY 109 3.998 -7.105 -3.422 884 HA3 GLY 109 HA3 GLY 109 5.722 -7.149 -3.794 885 H PHE 110 H PHE 110 3.581 -8.578 -1.930 886 HA PHE 110 HA PHE 110 4.895 -8.417 0.697 887 HB2 PHE 110 HB2 PHE 110 2.449 -9.733 -0.441 888 HB3 PHE 110 HB3 PHE 110 3.010 -10.181 1.152 889 HD1 PHE 110 HD1 PHE 110 1.885 -7.180 -0.825 890 HD2 PHE 110 HD2 PHE 110 2.611 -8.899 3.068 891 HE1 PHE 110 HE1 PHE 110 0.814 -5.215 0.254 892 HE2 PHE 110 HE2 PHE 110 1.461 -6.986 4.130 893 HZ PHE 110 HZ PHE 110 0.620 -5.105 2.717 894 H THR 111 H THR 111 5.334 -10.263 1.995 895 HA THR 111 HA THR 111 7.109 -12.174 0.753 896 HB THR 111 HB THR 111 7.337 -11.124 3.002 897 HG1 THR 111 HG1 THR 111 8.428 -12.845 3.728 898 HG21 THR 111 HG21 THR 111 5.066 -11.519 3.897 899 HG22 THR 111 HG22 THR 111 5.381 -13.270 3.904 900 HG23 THR 111 HG23 THR 111 6.326 -12.191 4.943 901 H ASP 112 H ASP 112 3.740 -12.184 1.642 902 HA ASP 112 HA ASP 112 3.406 -14.896 0.484 903 HB2 ASP 112 HB2 ASP 112 3.472 -14.840 3.088 904 HB3 ASP 112 HB3 ASP 112 1.894 -14.049 2.975 905 H ARG 113 H ARG 113 1.495 -15.261 -0.626 906 HA ARG 113 HA ARG 113 -0.040 -13.099 -1.719 907 HB2 ARG 113 HB2 ARG 113 0.245 -15.342 -2.780 908 HB3 ARG 113 HB3 ARG 113 -0.639 -16.084 -1.455 909 HG2 ARG 113 HG2 ARG 113 -2.132 -15.959 -3.299 910 HG3 ARG 113 HG3 ARG 113 -2.688 -14.789 -2.118 911 HD2 ARG 113 HD2 ARG 113 -2.880 -13.725 -4.241 912 HD3 ARG 113 HD3 ARG 113 -1.498 -12.984 -3.460 913 HE ARG 113 HE ARG 113 -0.042 -14.011 -5.010 914 HH11 ARG 113 HH11 ARG 113 0.467 -14.917 -6.971 915 HH12 ARG 113 HH12 ARG 113 -0.735 -15.821 -7.835 916 HH21 ARG 113 HH21 ARG 113 -3.222 -15.340 -5.537 917 HH22 ARG 113 HH22 ARG 113 -2.796 -15.990 -7.101 918 H GLY 114 H GLY 114 -0.632 -15.198 1.109 919 HA2 GLY 114 HA2 GLY 114 -3.331 -14.276 1.631 920 HA3 GLY 114 HA3 GLY 114 -2.265 -15.163 2.729 921 H ASP 115 H ASP 115 -0.088 -13.244 2.794 922 HA ASP 115 HA ASP 115 -1.077 -11.363 4.742 923 HB2 ASP 115 HB2 ASP 115 1.582 -11.544 3.304 924 HB3 ASP 115 HB3 ASP 115 1.209 -10.344 4.540 925 H ALA 116 H ALA 116 -0.439 -11.109 1.278 926 HA ALA 116 HA ALA 116 -1.056 -8.281 1.107 927 HB1 ALA 116 HB1 ALA 116 -0.676 -8.609 -1.184 928 HB2 ALA 116 HB2 ALA 116 0.368 -9.802 -0.424 929 HB3 ALA 116 HB3 ALA 116 -1.168 -10.326 -1.111 930 H PHE 117 H PHE 117 -2.975 -11.310 0.533 931 HA PHE 117 HA PHE 117 -5.349 -9.956 -0.288 932 HB2 PHE 117 HB2 PHE 117 -4.713 -12.459 -0.414 933 HB3 PHE 117 HB3 PHE 117 -5.334 -12.574 1.226 934 HD1 PHE 117 HD1 PHE 117 -7.797 -12.116 1.642 935 HD2 PHE 117 HD2 PHE 117 -6.145 -12.219 -2.347 936 HE1 PHE 117 HE1 PHE 117 -10.076 -12.370 0.692 937 HE2 PHE 117 HE2 PHE 117 -8.415 -12.449 -3.287 938 HZ PHE 117 HZ PHE 117 -10.385 -12.560 -1.772 939 H ASP 118 H ASP 118 -3.977 -10.463 2.935 940 HA ASP 118 HA ASP 118 -6.301 -9.461 4.392 941 HB2 ASP 118 HB2 ASP 118 -3.394 -9.914 5.131 942 HB3 ASP 118 HB3 ASP 118 -4.568 -9.219 6.240 943 H PHE 119 H PHE 119 -3.363 -7.952 2.926 944 HA PHE 119 HA PHE 119 -3.790 -5.359 4.018 945 HB2 PHE 119 HB2 PHE 119 -1.709 -5.831 2.987 946 HB3 PHE 119 HB3 PHE 119 -2.439 -6.339 1.488 947 HD1 PHE 119 HD1 PHE 119 -3.570 -4.653 -0.030 948 HD2 PHE 119 HD2 PHE 119 -1.009 -3.548 3.221 949 HE1 PHE 119 HE1 PHE 119 -3.298 -2.378 -1.020 950 HE2 PHE 119 HE2 PHE 119 -0.842 -1.260 2.323 951 HZ PHE 119 HZ PHE 119 -1.975 -0.665 0.190 952 H ASN 120 H ASN 120 -5.129 -6.966 1.128 953 HA ASN 120 HA ASN 120 -6.898 -4.842 0.336 954 HB2 ASN 120 HB2 ASN 120 -6.571 -6.423 -1.310 955 HB3 ASN 120 HB3 ASN 120 -6.633 -7.782 -0.195 956 HD21 ASN 120 HD21 ASN 120 -9.975 -8.476 -0.853 957 HD22 ASN 120 HD22 ASN 120 -8.449 -8.989 -0.148 958 H VAL 121 H VAL 121 -7.685 -7.784 2.337 959 HA VAL 121 HA VAL 121 -10.355 -6.946 2.764 960 HB VAL 121 HB VAL 121 -8.598 -8.871 4.323 961 HG11 VAL 121 HG11 VAL 121 -11.595 -8.411 4.653 962 HG12 VAL 121 HG12 VAL 121 -10.700 -9.810 5.287 963 HG13 VAL 121 HG13 VAL 121 -10.343 -8.197 5.899 964 HG21 VAL 121 HG21 VAL 121 -9.217 -9.503 1.976 965 HG22 VAL 121 HG22 VAL 121 -9.950 -10.576 3.164 966 HG23 VAL 121 HG23 VAL 121 -10.928 -9.311 2.388 967 H SER 122 H SER 122 -7.482 -6.107 4.652 968 HA SER 122 HA SER 122 -8.733 -4.858 6.879 969 HB2 SER 122 HB2 SER 122 -6.172 -4.060 5.434 970 HB3 SER 122 HB3 SER 122 -6.655 -3.547 7.061 971 HG SER 122 HG SER 122 -6.027 -6.160 6.142 972 H LEU 123 H LEU 123 -8.512 -3.759 3.550 973 HA LEU 123 HA LEU 123 -9.529 -1.049 4.268 974 HB2 LEU 123 HB2 LEU 123 -8.501 -2.149 1.646 975 HB3 LEU 123 HB3 LEU 123 -8.984 -0.476 1.945 976 HG LEU 123 HG LEU 123 -6.672 -1.938 3.280 977 HD11 LEU 123 HD11 LEU 123 -6.436 -1.392 0.820 978 HD12 LEU 123 HD12 LEU 123 -6.501 0.325 1.297 979 HD13 LEU 123 HD13 LEU 123 -5.203 -0.737 1.895 980 HD21 LEU 123 HD21 LEU 123 -7.510 -0.193 4.782 981 HD22 LEU 123 HD22 LEU 123 -5.980 0.323 4.067 982 HD23 LEU 123 HD23 LEU 123 -7.510 0.987 3.451 983 H GLN 124 H GLN 124 -10.461 -4.022 2.475 984 HA GLN 124 HA GLN 124 -12.942 -3.068 1.446 985 HB2 GLN 124 HB2 GLN 124 -12.290 -5.836 2.539 986 HB3 GLN 124 HB3 GLN 124 -13.722 -5.440 1.606 987 HG2 GLN 124 HG2 GLN 124 -10.871 -5.214 0.577 988 HG3 GLN 124 HG3 GLN 124 -11.941 -6.568 0.288 989 HE21 GLN 124 HE21 GLN 124 -12.054 -4.424 -2.728 990 HE22 GLN 124 HE22 GLN 124 -10.816 -5.337 -1.857 991 H ASP 125 H ASP 125 -12.313 -4.679 4.603 992 HA ASP 125 HA ASP 125 -14.946 -4.279 5.731 993 HB2 ASP 125 HB2 ASP 125 -13.159 -5.975 6.355 994 HB3 ASP 125 HB3 ASP 125 -12.225 -4.650 7.061 995 H HIS 126 H HIS 126 -12.426 -1.999 5.181 996 HA HIS 126 HA HIS 126 -13.249 -0.236 7.416 997 HB2 HIS 126 HB2 HIS 126 -10.871 -0.355 6.925 998 HB3 HIS 126 HB3 HIS 126 -11.165 0.177 5.263 999 HD2 HIS 126 HD2 HIS 126 -11.845 1.552 8.871 1000 HE1 HIS 126 HE1 HIS 126 -11.194 4.883 6.300 1001 HE2 HIS 126 HE2 HIS 126 -11.709 4.186 8.681 1002 H PHE 127 H PHE 127 -13.772 -0.542 3.918 1003 HA PHE 127 HA PHE 127 -15.277 2.042 3.930 1004 HB2 PHE 127 HB2 PHE 127 -14.155 0.403 1.658 1005 HB3 PHE 127 HB3 PHE 127 -15.240 1.776 1.441 1006 HD1 PHE 127 HD1 PHE 127 -14.592 4.023 2.631 1007 HD2 PHE 127 HD2 PHE 127 -11.803 0.837 1.842 1008 HE1 PHE 127 HE1 PHE 127 -12.702 5.590 2.970 1009 HE2 PHE 127 HE2 PHE 127 -9.912 2.405 2.158 1010 HZ PHE 127 HZ PHE 127 -10.362 4.783 2.734 1011 H LYS 128 H LYS 128 -15.753 -1.337 3.856 1012 HA LYS 128 HA LYS 128 -18.228 -1.919 2.894 1013 HB2 LYS 128 HB2 LYS 128 -16.766 -3.495 3.822 1014 HB3 LYS 128 HB3 LYS 128 -16.700 -2.704 5.395 1015 HG2 LYS 128 HG2 LYS 128 -19.328 -3.763 4.456 1016 HG3 LYS 128 HG3 LYS 128 -18.060 -4.933 4.835 1017 HD2 LYS 128 HD2 LYS 128 -18.847 -2.756 6.778 1018 HD3 LYS 128 HD3 LYS 128 -19.691 -4.306 6.744 1019 HE2 LYS 128 HE2 LYS 128 -16.694 -3.973 7.168 1020 HE3 LYS 128 HE3 LYS 128 -17.863 -4.070 8.481 1021 HZ1 LYS 128 HZ1 LYS 128 -17.573 -6.221 6.459 1022 HZ2 LYS 128 HZ2 LYS 128 -16.753 -6.182 7.868 1023 HZ3 LYS 128 HZ3 LYS 128 -18.401 -6.295 7.875 1024 H TRP 129 H TRP 129 -17.719 -0.083 5.889 1025 HA TRP 129 HA TRP 129 -20.673 0.142 6.322 1026 HB2 TRP 129 HB2 TRP 129 -20.039 0.601 8.671 1027 HB3 TRP 129 HB3 TRP 129 -19.596 -0.990 8.092 1028 HD1 TRP 129 HD1 TRP 129 -16.987 -1.579 7.883 1029 HE1 TRP 129 HE1 TRP 129 -14.880 -0.466 8.629 1030 HE3 TRP 129 HE3 TRP 129 -18.940 2.956 9.177 1031 HZ2 TRP 129 HZ2 TRP 129 -14.053 2.143 9.705 1032 HZ3 TRP 129 HZ3 TRP 129 -17.451 4.784 10.003 1033 HH2 TRP 129 HH2 TRP 129 -15.007 4.388 10.252 1034 H VAL 130 H VAL 130 -18.638 1.958 4.695 1035 HA VAL 130 HA VAL 130 -19.901 4.543 5.398 1036 HB VAL 130 HB VAL 130 -17.383 5.451 4.882 1037 HG11 VAL 130 HG11 VAL 130 -18.680 4.860 7.563 1038 HG12 VAL 130 HG12 VAL 130 -17.324 5.974 7.315 1039 HG13 VAL 130 HG13 VAL 130 -18.896 6.316 6.574 1040 HG21 VAL 130 HG21 VAL 130 -16.315 3.298 5.078 1041 HG22 VAL 130 HG22 VAL 130 -15.773 4.438 6.308 1042 HG23 VAL 130 HG23 VAL 130 -16.889 3.134 6.745 1043 H LYS 131 H LYS 131 -18.355 5.991 3.493 1044 HA LYS 131 HA LYS 131 -18.454 6.687 1.447 1045 HB2 LYS 131 HB2 LYS 131 -16.767 4.751 1.563 1046 HB3 LYS 131 HB3 LYS 131 -17.971 3.767 0.737 1047 HG2 LYS 131 HG2 LYS 131 -16.344 4.525 -0.815 1048 HG3 LYS 131 HG3 LYS 131 -17.889 5.304 -1.173 1049 HD2 LYS 131 HD2 LYS 131 -17.045 7.393 -0.035 1050 HD3 LYS 131 HD3 LYS 131 -15.520 6.552 0.278 1051 HE2 LYS 131 HE2 LYS 131 -15.220 7.954 -1.659 1052 HE3 LYS 131 HE3 LYS 131 -15.214 6.270 -2.195 1053 HZ1 LYS 131 HZ1 LYS 131 -16.584 7.725 -3.619 1054 HZ2 LYS 131 HZ2 LYS 131 -17.490 6.534 -2.982 1055 HZ3 LYS 131 HZ3 LYS 131 -17.587 8.054 -2.374 1056 H GLN 132 H GLN 132 -20.931 4.913 2.252 1057 HA GLN 132 HA GLN 132 -23.086 4.588 1.531 1058 HB2 GLN 132 HB2 GLN 132 -22.510 7.298 0.295 1059 HB3 GLN 132 HB3 GLN 132 -24.128 6.602 0.437 1060 HG2 GLN 132 HG2 GLN 132 -24.085 6.631 2.819 1061 HG3 GLN 132 HG3 GLN 132 -22.351 6.931 2.885 1062 HE21 GLN 132 HE21 GLN 132 -22.641 10.442 2.601 1063 HE22 GLN 132 HE22 GLN 132 -21.558 9.062 2.729 1064 H GLU 133 H GLU 133 -21.242 3.152 0.040 1065 HA GLU 133 HA GLU 133 -22.647 2.774 -2.572 1066 HB2 GLU 133 HB2 GLU 133 -19.648 3.030 -2.136 1067 HB3 GLU 133 HB3 GLU 133 -20.356 2.220 -3.538 1068 HG2 GLU 133 HG2 GLU 133 -21.563 4.280 -4.166 1069 HG3 GLU 133 HG3 GLU 133 -20.864 5.130 -2.791 1070 H1 SER 149 H1 SER 149 21.418 -12.050 -13.889 1071 H2 SER 149 H2 SER 149 20.875 -11.395 -12.484 1072 H3 SER 149 H3 SER 149 20.182 -10.976 -13.907 1073 HA SER 149 HA SER 149 19.330 -13.167 -14.249 1074 HB2 SER 149 HB2 SER 149 21.162 -14.336 -13.009 1075 HB3 SER 149 HB3 SER 149 20.420 -13.810 -11.484 1076 HG SER 149 HG SER 149 19.749 -15.920 -12.167 1077 H GLN 150 H GLN 150 17.194 -13.404 -13.795 1078 HA GLN 150 HA GLN 150 15.946 -11.865 -11.572 1079 HB2 GLN 150 HB2 GLN 150 15.540 -11.444 -14.563 1080 HB3 GLN 150 HB3 GLN 150 14.249 -11.148 -13.413 1081 HG2 GLN 150 HG2 GLN 150 15.159 -9.061 -13.689 1082 HG3 GLN 150 HG3 GLN 150 15.789 -9.598 -12.139 1083 HE21 GLN 150 HE21 GLN 150 18.672 -7.988 -13.653 1084 HE22 GLN 150 HE22 GLN 150 17.234 -7.628 -12.702 1085 H ILE 151 H ILE 151 13.753 -12.399 -11.182 1086 HA ILE 151 HA ILE 151 13.022 -15.222 -11.902 1087 HB ILE 151 HB ILE 151 12.589 -13.713 -9.296 1088 HG12 ILE 151 HG12 ILE 151 14.392 -16.102 -9.926 1089 HG13 ILE 151 HG13 ILE 151 14.947 -14.451 -9.654 1090 HG21 ILE 151 HG21 ILE 151 11.847 -16.585 -10.038 1091 HG22 ILE 151 HG22 ILE 151 11.664 -15.848 -8.433 1092 HG23 ILE 151 HG23 ILE 151 10.702 -15.252 -9.761 1093 HD11 ILE 151 HD11 ILE 151 13.692 -16.275 -7.583 1094 HD12 ILE 151 HD12 ILE 151 15.344 -15.651 -7.647 1095 HD13 ILE 151 HD13 ILE 151 13.999 -14.536 -7.333 1096 H THR 152 H THR 152 10.961 -15.613 -12.618 1097 HA THR 152 HA THR 152 9.124 -13.277 -12.891 1098 HB THR 152 HB THR 152 7.908 -14.712 -14.530 1099 HG1 THR 152 HG1 THR 152 8.864 -16.715 -14.004 1100 HG21 THR 152 HG21 THR 152 10.792 -13.972 -15.188 1101 HG22 THR 152 HG22 THR 152 9.474 -14.215 -16.357 1102 HG23 THR 152 HG23 THR 152 9.396 -12.871 -15.204 1103 H SER 153 H SER 153 7.460 -13.091 -11.743 1104 HA SER 153 HA SER 153 5.911 -15.372 -10.643 1105 HB2 SER 153 HB2 SER 153 6.941 -13.033 -8.997 1106 HB3 SER 153 HB3 SER 153 5.836 -14.300 -8.421 1107 HG SER 153 HG SER 153 8.013 -14.708 -7.802 1108 H GLN 154 H GLN 154 5.253 -13.986 -12.733 1109 HA GLN 154 HA GLN 154 4.423 -11.420 -12.742 1110 HB2 GLN 154 HB2 GLN 154 3.249 -11.820 -14.786 1111 HB3 GLN 154 HB3 GLN 154 4.686 -12.835 -14.719 1112 HG2 GLN 154 HG2 GLN 154 3.209 -14.775 -14.057 1113 HG3 GLN 154 HG3 GLN 154 1.805 -13.712 -14.209 1114 HE21 GLN 154 HE21 GLN 154 1.534 -14.867 -17.551 1115 HE22 GLN 154 HE22 GLN 154 0.739 -14.727 -15.978 1116 H VAL 155 H VAL 155 2.653 -10.127 -12.576 1117 HA VAL 155 HA VAL 155 0.271 -11.128 -11.165 1118 HB VAL 155 HB VAL 155 1.139 -8.874 -10.625 1119 HG11 VAL 155 HG11 VAL 155 1.840 -8.101 -12.827 1120 HG12 VAL 155 HG12 VAL 155 0.149 -8.074 -13.376 1121 HG13 VAL 155 HG13 VAL 155 0.669 -6.997 -12.073 1122 HG21 VAL 155 HG21 VAL 155 -1.041 -9.228 -9.911 1123 HG22 VAL 155 HG22 VAL 155 -1.187 -7.739 -10.820 1124 HG23 VAL 155 HG23 VAL 155 -1.720 -9.246 -11.544 1125 H TPO 156 H T2P 156 -1.571 -11.595 -12.150 1126 HA TPO 156 HA T2P 156 -1.327 -12.648 -14.771 1127 HB TPO 156 HB T2P 156 -3.060 -12.907 -12.604 1128 HG21 TPO 156 HG21 T2P 156 -4.860 -13.288 -14.904 1129 HG22 TPO 156 HG22 T2P 156 -4.778 -11.765 -13.993 1130 HG23 TPO 156 HG23 T2P 156 -5.159 -13.247 -13.146 1131 H GLY 157 H GLY 157 -2.968 -12.745 -16.284 1132 HA2 GLY 157 HA2 GLY 157 -3.940 -10.077 -17.245 1133 HA3 GLY 157 HA3 GLY 157 -3.009 -11.122 -18.319 1134 H GLN 158 H GLN 158 -4.374 -13.622 -17.145 1135 HA GLN 158 HA GLN 158 -6.828 -13.322 -18.838 1136 HB2 GLN 158 HB2 GLN 158 -6.300 -15.362 -19.905 1137 HB3 GLN 158 HB3 GLN 158 -4.876 -14.337 -19.937 1138 HG2 GLN 158 HG2 GLN 158 -4.614 -15.918 -17.571 1139 HG3 GLN 158 HG3 GLN 158 -5.241 -17.013 -18.793 1140 HE21 GLN 158 HE21 GLN 158 -1.392 -15.643 -19.013 1141 HE22 GLN 158 HE22 GLN 158 -2.515 -15.120 -17.738 1142 H ILE 159 H ILE 159 -5.753 -14.874 -15.821 1143 HA ILE 159 HA ILE 159 -8.148 -16.569 -15.802 1144 HB ILE 159 HB ILE 159 -6.093 -17.366 -14.836 1145 HG12 ILE 159 HG12 ILE 159 -8.311 -17.189 -12.757 1146 HG13 ILE 159 HG13 ILE 159 -8.365 -18.220 -14.190 1147 HG21 ILE 159 HG21 ILE 159 -5.171 -15.407 -13.802 1148 HG22 ILE 159 HG22 ILE 159 -6.500 -15.327 -12.613 1149 HG23 ILE 159 HG23 ILE 159 -5.323 -16.652 -12.593 1150 HD11 ILE 159 HD11 ILE 159 -7.715 -19.572 -12.317 1151 HD12 ILE 159 HD12 ILE 159 -6.298 -19.396 -13.371 1152 HD13 ILE 159 HD13 ILE 159 -6.420 -18.460 -11.859 1153 H GLY 160 H GLY 160 -7.319 -13.496 -14.360 1154 HA2 GLY 160 HA2 GLY 160 -8.685 -11.784 -13.584 1155 HA3 GLY 160 HA3 GLY 160 -10.058 -12.647 -14.282 1156 H TRP 161 H TRP 161 -7.792 -13.265 -11.525 1157 HA TRP 161 HA TRP 161 -10.011 -14.253 -9.849 1158 HB2 TRP 161 HB2 TRP 161 -8.309 -15.638 -8.863 1159 HB3 TRP 161 HB3 TRP 161 -8.252 -15.830 -10.592 1160 HD1 TRP 161 HD1 TRP 161 -6.308 -12.819 -10.389 1161 HE1 TRP 161 HE1 TRP 161 -3.789 -13.341 -10.331 1162 HE3 TRP 161 HE3 TRP 161 -6.532 -17.522 -8.508 1163 HZ2 TRP 161 HZ2 TRP 161 -2.110 -15.601 -9.763 1164 HZ3 TRP 161 HZ3 TRP 161 -4.441 -18.865 -8.160 1165 HH2 TRP 161 HH2 TRP 161 -2.237 -17.933 -8.828 1166 H ARG 162 H ARG 162 -8.762 -14.261 -7.520 1167 HA ARG 162 HA ARG 162 -8.278 -13.093 -5.698 1168 HB2 ARG 162 HB2 ARG 162 -6.164 -12.256 -7.648 1169 HB3 ARG 162 HB3 ARG 162 -6.036 -11.887 -5.929 1170 HG2 ARG 162 HG2 ARG 162 -6.437 -14.708 -6.971 1171 HG3 ARG 162 HG3 ARG 162 -4.853 -13.977 -6.709 1172 HD2 ARG 162 HD2 ARG 162 -5.296 -13.706 -4.333 1173 HD3 ARG 162 HD3 ARG 162 -6.966 -14.261 -4.529 1174 HE ARG 162 HE ARG 162 -5.498 -16.365 -5.530 1175 HH11 ARG 162 HH11 ARG 162 -4.926 -18.179 -4.372 1176 HH12 ARG 162 HH12 ARG 162 -4.945 -18.134 -2.638 1177 HH21 ARG 162 HH21 ARG 162 -5.862 -14.843 -2.396 1178 HH22 ARG 162 HH22 ARG 162 -5.454 -16.304 -1.545 1179 H ARG 163 H ARG 163 -10.405 -11.874 -6.783 1180 HA ARG 163 HA ARG 163 -11.793 -10.080 -6.701 1181 HB2 ARG 163 HB2 ARG 163 -10.162 -9.433 -4.221 1182 HB3 ARG 163 HB3 ARG 163 -11.712 -8.701 -4.660 1183 HG2 ARG 163 HG2 ARG 163 -12.745 -11.000 -4.663 1184 HG3 ARG 163 HG3 ARG 163 -11.219 -11.638 -4.018 1185 HD2 ARG 163 HD2 ARG 163 -11.407 -10.191 -2.048 1186 HD3 ARG 163 HD3 ARG 163 -12.862 -9.432 -2.689 1187 HE ARG 163 HE ARG 163 -12.638 -12.041 -1.383 1188 HH11 ARG 163 HH11 ARG 163 -14.460 -13.197 -0.913 1189 HH12 ARG 163 HH12 ARG 163 -15.985 -12.742 -1.614 1190 HH21 ARG 163 HH21 ARG 163 -14.747 -10.104 -3.409 1191 HH22 ARG 163 HH22 ARG 163 -16.149 -11.048 -2.989 Start of MODEL 28 1 H1 GLY -4 H1 GLY -4 -29.168 28.154 16.155 2 H2 GLY -4 H2 GLY -4 -28.820 27.267 17.488 3 H3 GLY -4 H3 GLY -4 -29.547 26.560 16.204 4 HA2 GLY -4 HA2 GLY -4 -27.605 26.896 14.828 5 HA3 GLY -4 HA3 GLY -4 -26.818 27.677 16.210 6 H SER -3 H SER -3 -25.653 25.519 14.925 7 HA SER -3 HA SER -3 -25.532 23.495 17.075 8 HB2 SER -3 HB2 SER -3 -25.639 21.642 15.408 9 HB3 SER -3 HB3 SER -3 -27.157 22.534 15.574 10 HG SER -3 HG SER -3 -26.611 22.146 13.377 11 HA PRO -2 HA PRO -2 -21.200 23.729 16.157 12 HB2 PRO -2 HB2 PRO -2 -20.214 21.349 17.062 13 HB3 PRO -2 HB3 PRO -2 -20.878 22.606 18.152 14 HG2 PRO -2 HG2 PRO -2 -22.308 20.166 17.042 15 HG3 PRO -2 HG3 PRO -2 -22.224 20.715 18.748 16 HD2 PRO -2 HD2 PRO -2 -24.343 21.316 17.164 17 HD3 PRO -2 HD3 PRO -2 -23.715 22.503 18.343 18 H ASN -1 H ASN -1 -19.541 23.042 14.737 19 HA ASN -1 HA ASN -1 -20.478 21.652 12.315 20 HB2 ASN -1 HB2 ASN -1 -19.303 23.794 12.147 21 HB3 ASN -1 HB3 ASN -1 -17.898 23.124 12.977 22 HD21 ASN -1 HD21 ASN -1 -16.978 23.005 9.457 23 HD22 ASN -1 HD22 ASN -1 -17.159 24.187 10.745 24 H SER 0 H SER 0 -20.390 19.491 12.246 25 HA SER 0 HA SER 0 -18.809 17.798 13.862 26 HB2 SER 0 HB2 SER 0 -20.045 17.178 11.153 27 HB3 SER 0 HB3 SER 0 -19.586 16.005 12.402 28 HG SER 0 HG SER 0 -21.832 16.503 12.459 29 H MET 1 H MET 1 -17.801 19.496 11.002 30 HA MET 1 HA MET 1 -15.531 17.667 10.459 31 HB2 MET 1 HB2 MET 1 -16.317 20.302 9.166 32 HB3 MET 1 HB3 MET 1 -15.034 19.219 8.624 33 HG2 MET 1 HG2 MET 1 -16.679 17.421 8.244 34 HG3 MET 1 HG3 MET 1 -17.989 18.494 8.736 35 HE1 MET 1 HE1 MET 1 -18.943 20.455 7.387 36 HE2 MET 1 HE2 MET 1 -17.379 21.301 7.357 37 HE3 MET 1 HE3 MET 1 -18.283 21.057 5.850 38 H ALA 2 H ALA 2 -16.124 20.334 12.553 39 HA ALA 2 HA ALA 2 -13.372 21.379 12.473 40 HB1 ALA 2 HB1 ALA 2 -14.235 23.023 14.060 41 HB2 ALA 2 HB2 ALA 2 -15.315 22.886 12.661 42 HB3 ALA 2 HB3 ALA 2 -15.757 22.125 14.211 43 H THR 3 H THR 3 -15.053 18.934 14.273 44 HA THR 3 HA THR 3 -13.393 19.121 16.670 45 HB THR 3 HB THR 3 -14.706 17.110 17.393 46 HG1 THR 3 HG1 THR 3 -15.365 16.304 15.405 47 HG21 THR 3 HG21 THR 3 -16.275 19.557 16.481 48 HG22 THR 3 HG22 THR 3 -16.729 18.428 17.782 49 HG23 THR 3 HG23 THR 3 -15.284 19.450 17.949 50 H GLU 4 H GLU 4 -11.601 18.971 15.016 51 HA GLU 4 HA GLU 4 -10.616 16.245 14.466 52 HB2 GLU 4 HB2 GLU 4 -10.320 17.967 12.764 53 HB3 GLU 4 HB3 GLU 4 -9.491 19.014 13.913 54 HG2 GLU 4 HG2 GLU 4 -7.887 18.023 12.409 55 HG3 GLU 4 HG3 GLU 4 -7.601 17.429 14.037 56 H LEU 5 H LEU 5 -8.983 15.266 15.485 57 HA LEU 5 HA LEU 5 -7.555 16.585 17.750 58 HB2 LEU 5 HB2 LEU 5 -8.738 13.782 17.743 59 HB3 LEU 5 HB3 LEU 5 -7.645 14.393 18.977 60 HG LEU 5 HG LEU 5 -10.410 15.549 18.399 61 HD11 LEU 5 HD11 LEU 5 -11.061 14.456 20.499 62 HD12 LEU 5 HD12 LEU 5 -10.508 13.263 19.314 63 HD13 LEU 5 HD13 LEU 5 -9.439 13.742 20.651 64 HD21 LEU 5 HD21 LEU 5 -8.910 17.228 19.413 65 HD22 LEU 5 HD22 LEU 5 -10.107 16.680 20.588 66 HD23 LEU 5 HD23 LEU 5 -8.439 16.068 20.676 67 H GLU 6 H GLU 6 -7.253 15.306 14.790 68 HA GLU 6 HA GLU 6 -5.641 14.379 13.522 69 HB2 GLU 6 HB2 GLU 6 -4.164 16.204 15.359 70 HB3 GLU 6 HB3 GLU 6 -3.194 15.185 14.299 71 HG2 GLU 6 HG2 GLU 6 -5.457 16.849 13.180 72 HG3 GLU 6 HG3 GLU 6 -3.872 17.538 13.501 73 H TYR 7 H TYR 7 -6.692 12.566 15.209 74 HA TYR 7 HA TYR 7 -4.485 10.778 16.043 75 HB2 TYR 7 HB2 TYR 7 -6.017 9.602 17.335 76 HB3 TYR 7 HB3 TYR 7 -6.427 11.286 17.589 77 HD1 TYR 7 HD1 TYR 7 -7.657 8.035 16.768 78 HD2 TYR 7 HD2 TYR 7 -8.427 12.234 16.102 79 HE1 TYR 7 HE1 TYR 7 -10.016 7.515 16.252 80 HE2 TYR 7 HE2 TYR 7 -10.794 11.710 15.567 81 HH TYR 7 HH TYR 7 -12.094 8.374 15.737 82 H GLU 8 H GLU 8 -5.264 8.377 15.798 83 HA GLU 8 HA GLU 8 -6.641 7.490 13.529 84 HB2 GLU 8 HB2 GLU 8 -4.833 6.501 12.206 85 HB3 GLU 8 HB3 GLU 8 -4.742 8.243 12.185 86 HG2 GLU 8 HG2 GLU 8 -2.982 7.986 14.125 87 HG3 GLU 8 HG3 GLU 8 -2.915 6.297 13.617 88 H SER 9 H SER 9 -7.394 5.613 14.074 89 HA SER 9 HA SER 9 -6.277 4.112 16.341 90 HB2 SER 9 HB2 SER 9 -8.845 3.898 14.755 91 HB3 SER 9 HB3 SER 9 -8.403 2.784 16.069 92 HG SER 9 HG SER 9 -9.698 4.519 16.829 93 H VAL 10 H VAL 10 -5.159 2.157 16.137 94 HA VAL 10 HA VAL 10 -4.263 1.383 13.511 95 HB VAL 10 HB VAL 10 -3.997 -0.138 16.093 96 HG11 VAL 10 HG11 VAL 10 -2.413 -0.327 13.486 97 HG12 VAL 10 HG12 VAL 10 -1.971 -1.134 15.007 98 HG13 VAL 10 HG13 VAL 10 -3.456 -1.590 14.183 99 HG21 VAL 10 HG21 VAL 10 -2.992 2.113 16.306 100 HG22 VAL 10 HG22 VAL 10 -1.740 0.875 16.242 101 HG23 VAL 10 HG23 VAL 10 -2.081 1.856 14.804 102 H LEU 11 H LEU 11 -4.814 -0.217 12.160 103 HA LEU 11 HA LEU 11 -7.242 -1.885 12.748 104 HB2 LEU 11 HB2 LEU 11 -6.206 -0.802 10.096 105 HB3 LEU 11 HB3 LEU 11 -7.551 -1.913 10.290 106 HG LEU 11 HG LEU 11 -7.458 0.996 11.170 107 HD11 LEU 11 HD11 LEU 11 -9.305 1.136 9.483 108 HD12 LEU 11 HD12 LEU 11 -7.770 0.621 8.769 109 HD13 LEU 11 HD13 LEU 11 -9.053 -0.567 9.085 110 HD21 LEU 11 HD21 LEU 11 -8.758 -0.186 12.850 111 HD22 LEU 11 HD22 LEU 11 -9.870 0.650 11.772 112 HD23 LEU 11 HD23 LEU 11 -9.635 -1.102 11.594 113 H CYS 12 H CYS 12 -4.056 -1.847 11.073 114 HA CYS 12 HA CYS 12 -3.893 -4.769 11.419 115 HB2 CYS 12 HB2 CYS 12 -5.006 -4.161 9.156 116 HB3 CYS 12 HB3 CYS 12 -3.391 -3.618 8.665 117 HG CYS 12 HG CYS 12 -4.381 -6.589 9.772 118 H VAL 13 H VAL 13 -1.897 -5.676 11.207 119 HA VAL 13 HA VAL 13 0.469 -4.042 10.711 120 HB VAL 13 HB VAL 13 0.211 -3.801 13.106 121 HG11 VAL 13 HG11 VAL 13 0.402 -6.819 13.414 122 HG12 VAL 13 HG12 VAL 13 0.349 -5.608 14.705 123 HG13 VAL 13 HG13 VAL 13 -1.063 -5.846 13.671 124 HG21 VAL 13 HG21 VAL 13 2.495 -5.724 12.486 125 HG22 VAL 13 HG22 VAL 13 2.505 -3.972 12.192 126 HG23 VAL 13 HG23 VAL 13 2.404 -4.584 13.844 127 H LYS 14 H LYS 14 1.801 -5.165 9.438 128 HA LYS 14 HA LYS 14 1.608 -8.141 9.476 129 HB2 LYS 14 HB2 LYS 14 1.731 -6.442 6.972 130 HB3 LYS 14 HB3 LYS 14 2.207 -8.114 6.973 131 HG2 LYS 14 HG2 LYS 14 -0.553 -7.141 7.828 132 HG3 LYS 14 HG3 LYS 14 -0.117 -7.745 6.224 133 HD2 LYS 14 HD2 LYS 14 0.649 -9.899 7.317 134 HD3 LYS 14 HD3 LYS 14 -0.078 -9.325 8.837 135 HE2 LYS 14 HE2 LYS 14 -2.265 -9.135 7.731 136 HE3 LYS 14 HE3 LYS 14 -1.523 -9.631 6.194 137 HZ1 LYS 14 HZ1 LYS 14 -0.946 -11.753 7.231 138 HZ2 LYS 14 HZ2 LYS 14 -1.720 -11.332 8.618 139 HZ3 LYS 14 HZ3 LYS 14 -2.578 -11.530 7.229 140 HA PRO 15 HA PRO 15 5.772 -8.236 10.478 141 HB2 PRO 15 HB2 PRO 15 6.424 -10.841 9.983 142 HB3 PRO 15 HB3 PRO 15 5.209 -10.373 11.210 143 HG2 PRO 15 HG2 PRO 15 4.684 -11.211 8.323 144 HG3 PRO 15 HG3 PRO 15 3.939 -11.880 9.815 145 HD2 PRO 15 HD2 PRO 15 2.717 -9.969 8.381 146 HD3 PRO 15 HD3 PRO 15 2.678 -9.937 10.171 147 H ASP 16 H ASP 16 4.967 -8.637 7.143 148 HA ASP 16 HA ASP 16 7.679 -7.786 6.369 149 HB2 ASP 16 HB2 ASP 16 7.916 -9.331 4.619 150 HB3 ASP 16 HB3 ASP 16 7.473 -10.307 6.013 151 H VAL 17 H VAL 17 7.732 -6.473 4.558 152 HA VAL 17 HA VAL 17 5.669 -6.471 2.594 153 HB VAL 17 HB VAL 17 4.435 -5.012 4.049 154 HG11 VAL 17 HG11 VAL 17 6.802 -3.114 4.163 155 HG12 VAL 17 HG12 VAL 17 5.191 -2.873 4.872 156 HG13 VAL 17 HG13 VAL 17 6.241 -4.155 5.482 157 HG21 VAL 17 HG21 VAL 17 4.407 -4.540 1.655 158 HG22 VAL 17 HG22 VAL 17 4.090 -3.108 2.646 159 HG23 VAL 17 HG23 VAL 17 5.678 -3.308 1.877 160 H SER 18 H SER 18 6.708 -6.167 0.699 161 HA SER 18 HA SER 18 9.315 -4.701 0.700 162 HB2 SER 18 HB2 SER 18 8.395 -6.894 -1.179 163 HB3 SER 18 HB3 SER 18 9.987 -6.116 -1.116 164 HG SER 18 HG SER 18 9.864 -8.172 -0.012 165 H VAL 19 H VAL 19 9.738 -3.136 -0.789 166 HA VAL 19 HA VAL 19 7.445 -2.179 -2.462 167 HB VAL 19 HB VAL 19 9.341 -0.554 -0.768 168 HG11 VAL 19 HG11 VAL 19 7.229 0.294 -2.779 169 HG12 VAL 19 HG12 VAL 19 7.968 1.385 -1.593 170 HG13 VAL 19 HG13 VAL 19 8.973 0.663 -2.840 171 HG21 VAL 19 HG21 VAL 19 7.452 -1.599 0.469 172 HG22 VAL 19 HG22 VAL 19 7.195 0.137 0.299 173 HG23 VAL 19 HG23 VAL 19 6.311 -0.987 -0.743 174 H TYR 20 H TYR 20 7.769 -1.678 -4.437 175 HA TYR 20 HA TYR 20 10.429 -2.333 -5.602 176 HB2 TYR 20 HB2 TYR 20 7.595 -2.777 -6.590 177 HB3 TYR 20 HB3 TYR 20 9.047 -3.180 -7.487 178 HD1 TYR 20 HD1 TYR 20 10.175 -5.234 -7.153 179 HD2 TYR 20 HD2 TYR 20 7.212 -3.965 -4.297 180 HE1 TYR 20 HE1 TYR 20 10.270 -7.470 -6.048 181 HE2 TYR 20 HE2 TYR 20 7.402 -6.170 -3.145 182 HH TYR 20 HH TYR 20 9.523 -8.780 -4.317 183 H ARG 21 H ARG 21 8.703 0.392 -5.263 184 HA ARG 21 HA ARG 21 8.585 2.487 -6.311 185 HB2 ARG 21 HB2 ARG 21 11.441 1.593 -6.070 186 HB3 ARG 21 HB3 ARG 21 11.103 3.154 -6.825 187 HG2 ARG 21 HG2 ARG 21 9.939 3.984 -4.920 188 HG3 ARG 21 HG3 ARG 21 9.950 2.406 -4.111 189 HD2 ARG 21 HD2 ARG 21 12.272 2.479 -3.718 190 HD3 ARG 21 HD3 ARG 21 12.531 3.804 -4.872 191 HE ARG 21 HE ARG 21 10.810 4.845 -2.941 192 HH11 ARG 21 HH11 ARG 21 11.536 6.234 -1.368 193 HH12 ARG 21 HH12 ARG 21 13.181 6.144 -0.820 194 HH21 ARG 21 HH21 ARG 21 14.074 3.510 -2.846 195 HH22 ARG 21 HH22 ARG 21 14.577 4.654 -1.627 196 H ILE 22 H ILE 22 7.337 2.495 -8.023 197 HA ILE 22 HA ILE 22 8.238 1.285 -10.512 198 HB ILE 22 HB ILE 22 5.911 1.256 -11.144 199 HG12 ILE 22 HG12 ILE 22 5.450 2.976 -8.675 200 HG13 ILE 22 HG13 ILE 22 5.061 3.342 -10.358 201 HG21 ILE 22 HG21 ILE 22 6.301 0.372 -8.262 202 HG22 ILE 22 HG22 ILE 22 5.131 -0.260 -9.428 203 HG23 ILE 22 HG23 ILE 22 6.864 -0.491 -9.700 204 HD11 ILE 22 HD11 ILE 22 3.677 1.348 -8.546 205 HD12 ILE 22 HD12 ILE 22 3.032 2.837 -9.250 206 HD13 ILE 22 HD13 ILE 22 3.390 1.450 -10.303 207 HA PRO 23 HA PRO 23 8.567 5.127 -12.742 208 HB2 PRO 23 HB2 PRO 23 8.473 4.137 -15.367 209 HB3 PRO 23 HB3 PRO 23 9.902 4.344 -14.323 210 HG2 PRO 23 HG2 PRO 23 8.448 1.844 -15.007 211 HG3 PRO 23 HG3 PRO 23 10.128 2.064 -14.471 212 HD2 PRO 23 HD2 PRO 23 7.975 1.162 -12.876 213 HD3 PRO 23 HD3 PRO 23 9.559 1.736 -12.288 214 HA PRO 24 HA PRO 24 4.583 5.404 -15.244 215 HB2 PRO 24 HB2 PRO 24 2.702 3.463 -15.450 216 HB3 PRO 24 HB3 PRO 24 4.245 3.390 -16.357 217 HG2 PRO 24 HG2 PRO 24 3.596 2.062 -13.696 218 HG3 PRO 24 HG3 PRO 24 4.266 1.299 -15.176 219 HD2 PRO 24 HD2 PRO 24 5.860 2.150 -13.147 220 HD3 PRO 24 HD3 PRO 24 6.361 2.311 -14.857 221 H ARG 25 H ARG 25 2.460 6.177 -14.901 222 HA ARG 25 HA ARG 25 1.280 5.893 -12.155 223 HB2 ARG 25 HB2 ARG 25 0.308 8.029 -12.344 224 HB3 ARG 25 HB3 ARG 25 2.032 8.188 -12.678 225 HG2 ARG 25 HG2 ARG 25 1.595 8.337 -15.094 226 HG3 ARG 25 HG3 ARG 25 -0.131 8.052 -14.843 227 HD2 ARG 25 HD2 ARG 25 1.413 10.423 -13.764 228 HD3 ARG 25 HD3 ARG 25 0.425 10.428 -15.231 229 HE ARG 25 HE ARG 25 -0.506 10.515 -12.455 230 HH11 ARG 25 HH11 ARG 25 -2.660 10.806 -12.021 231 HH12 ARG 25 HH12 ARG 25 -3.835 10.638 -13.292 232 HH21 ARG 25 HH21 ARG 25 -1.560 9.903 -15.745 233 HH22 ARG 25 HH22 ARG 25 -3.237 10.138 -15.340 234 H ALA 26 H ALA 26 0.576 5.490 -15.538 235 HA ALA 26 HA ALA 26 -1.961 4.158 -14.948 236 HB1 ALA 26 HB1 ALA 26 -3.325 5.833 -16.158 237 HB2 ALA 26 HB2 ALA 26 -2.584 6.532 -14.703 238 HB3 ALA 26 HB3 ALA 26 -1.898 6.906 -16.291 239 H SER 27 H SER 27 -1.436 2.453 -16.059 240 HA SER 27 HA SER 27 -1.098 2.660 -19.020 241 HB2 SER 27 HB2 SER 27 0.414 1.080 -17.934 242 HB3 SER 27 HB3 SER 27 -0.963 0.223 -17.213 243 HG SER 27 HG SER 27 0.030 -0.483 -19.377 244 H ASN 28 H ASN 28 -2.530 1.348 -20.282 245 HA ASN 28 HA ASN 28 -5.255 1.921 -19.994 246 HB2 ASN 28 HB2 ASN 28 -5.510 0.714 -22.018 247 HB3 ASN 28 HB3 ASN 28 -3.924 1.463 -22.096 248 HD21 ASN 28 HD21 ASN 28 -2.331 -1.881 -21.706 249 HD22 ASN 28 HD22 ASN 28 -2.197 -0.394 -20.800 250 H ARG 29 H ARG 29 -3.553 -0.817 -18.636 251 HA ARG 29 HA ARG 29 -6.137 -2.119 -17.824 252 HB2 ARG 29 HB2 ARG 29 -3.369 -3.310 -17.502 253 HB3 ARG 29 HB3 ARG 29 -4.926 -4.129 -17.435 254 HG2 ARG 29 HG2 ARG 29 -3.509 -3.029 -19.870 255 HG3 ARG 29 HG3 ARG 29 -3.815 -4.720 -19.479 256 HD2 ARG 29 HD2 ARG 29 -6.282 -4.303 -19.738 257 HD3 ARG 29 HD3 ARG 29 -5.918 -2.627 -20.165 258 HE ARG 29 HE ARG 29 -5.103 -3.224 -22.230 259 HH11 ARG 29 HH11 ARG 29 -5.005 -4.489 -24.024 260 HH12 ARG 29 HH12 ARG 29 -5.300 -6.202 -23.921 261 HH21 ARG 29 HH21 ARG 29 -5.893 -6.201 -20.537 262 HH22 ARG 29 HH22 ARG 29 -5.793 -7.154 -21.993 263 H GLY 30 H GLY 30 -4.037 0.075 -16.591 264 HA2 GLY 30 HA2 GLY 30 -4.507 0.799 -14.231 265 HA3 GLY 30 HA3 GLY 30 -4.252 -0.900 -13.762 266 H TYR 31 H TYR 31 -2.192 -1.546 -13.306 267 HA TYR 31 HA TYR 31 0.097 0.277 -14.060 268 HB2 TYR 31 HB2 TYR 31 -0.515 -1.153 -11.464 269 HB3 TYR 31 HB3 TYR 31 1.097 -0.607 -11.884 270 HD1 TYR 31 HD1 TYR 31 1.713 1.697 -12.045 271 HD2 TYR 31 HD2 TYR 31 -2.267 0.471 -10.903 272 HE1 TYR 31 HE1 TYR 31 1.334 3.923 -11.005 273 HE2 TYR 31 HE2 TYR 31 -2.683 2.738 -9.926 274 HH TYR 31 HH TYR 31 -0.176 5.289 -9.885 275 H ARG 32 H ARG 32 -0.958 -3.040 -13.683 276 HA ARG 32 HA ARG 32 -0.016 -5.030 -13.640 277 HB2 ARG 32 HB2 ARG 32 1.577 -4.780 -16.073 278 HB3 ARG 32 HB3 ARG 32 0.238 -5.810 -15.615 279 HG2 ARG 32 HG2 ARG 32 -0.680 -4.782 -17.399 280 HG3 ARG 32 HG3 ARG 32 -1.253 -3.715 -16.137 281 HD2 ARG 32 HD2 ARG 32 -0.527 -2.253 -17.808 282 HD3 ARG 32 HD3 ARG 32 0.794 -2.237 -16.642 283 HE ARG 32 HE ARG 32 2.207 -2.984 -18.268 284 HH11 ARG 32 HH11 ARG 32 2.916 -3.464 -20.145 285 HH12 ARG 32 HH12 ARG 32 1.887 -4.165 -21.391 286 HH21 ARG 32 HH21 ARG 32 -0.957 -3.971 -19.436 287 HH22 ARG 32 HH22 ARG 32 -0.292 -4.435 -20.979 288 H ALA 33 H ALA 33 1.323 -5.671 -12.055 289 HA ALA 33 HA ALA 33 3.853 -4.665 -11.421 290 HB1 ALA 33 HB1 ALA 33 2.509 -6.228 -10.014 291 HB2 ALA 33 HB2 ALA 33 2.925 -7.554 -11.124 292 HB3 ALA 33 HB3 ALA 33 4.192 -6.728 -10.190 293 H SER 34 H SER 34 3.064 -7.221 -13.750 294 HA SER 34 HA SER 34 5.578 -8.097 -14.590 295 HB2 SER 34 HB2 SER 34 3.013 -7.679 -16.172 296 HB3 SER 34 HB3 SER 34 4.352 -8.763 -16.629 297 HG SER 34 HG SER 34 2.644 -9.850 -15.590 298 H ASP 35 H ASP 35 4.193 -4.920 -15.207 299 HA ASP 35 HA ASP 35 5.782 -4.367 -17.600 300 HB2 ASP 35 HB2 ASP 35 3.435 -3.447 -16.808 301 HB3 ASP 35 HB3 ASP 35 4.393 -2.302 -15.881 302 H TRP 36 H TRP 36 6.266 -4.195 -14.168 303 HA TRP 36 HA TRP 36 8.807 -2.682 -14.466 304 HB2 TRP 36 HB2 TRP 36 8.166 -1.704 -12.117 305 HB3 TRP 36 HB3 TRP 36 7.700 -0.990 -13.628 306 HD1 TRP 36 HD1 TRP 36 5.285 -0.704 -14.208 307 HE1 TRP 36 HE1 TRP 36 3.050 -1.086 -13.032 308 HE3 TRP 36 HE3 TRP 36 6.950 -3.363 -10.174 309 HZ2 TRP 36 HZ2 TRP 36 2.217 -1.855 -10.344 310 HZ3 TRP 36 HZ3 TRP 36 5.418 -3.886 -8.293 311 HH2 TRP 36 HH2 TRP 36 3.057 -3.112 -8.348 312 H LYS 37 H LYS 37 9.481 -2.904 -11.688 313 HA LYS 37 HA LYS 37 10.576 -5.613 -11.603 314 HB2 LYS 37 HB2 LYS 37 10.695 -3.181 -9.768 315 HB3 LYS 37 HB3 LYS 37 11.379 -4.749 -9.320 316 HG2 LYS 37 HG2 LYS 37 12.770 -4.811 -11.318 317 HG3 LYS 37 HG3 LYS 37 12.104 -3.271 -11.889 318 HD2 LYS 37 HD2 LYS 37 13.171 -2.031 -10.150 319 HD3 LYS 37 HD3 LYS 37 13.465 -3.483 -9.189 320 HE2 LYS 37 HE2 LYS 37 15.566 -2.945 -10.100 321 HE3 LYS 37 HE3 LYS 37 14.968 -4.360 -10.974 322 HZ1 LYS 37 HZ1 LYS 37 14.850 -1.555 -11.976 323 HZ2 LYS 37 HZ2 LYS 37 15.910 -2.685 -12.483 324 HZ3 LYS 37 HZ3 LYS 37 14.322 -2.865 -12.802 325 H LEU 38 H LEU 38 9.017 -7.164 -11.372 326 HA LEU 38 HA LEU 38 7.305 -7.060 -8.953 327 HB2 LEU 38 HB2 LEU 38 5.941 -8.640 -9.846 328 HB3 LEU 38 HB3 LEU 38 6.339 -7.602 -11.192 329 HG LEU 38 HG LEU 38 7.525 -10.367 -10.676 330 HD11 LEU 38 HD11 LEU 38 5.444 -9.421 -12.698 331 HD12 LEU 38 HD12 LEU 38 6.118 -11.065 -12.559 332 HD13 LEU 38 HD13 LEU 38 5.129 -10.393 -11.254 333 HD21 LEU 38 HD21 LEU 38 8.301 -10.212 -13.048 334 HD22 LEU 38 HD22 LEU 38 7.834 -8.496 -13.061 335 HD23 LEU 38 HD23 LEU 38 9.127 -9.082 -11.978 336 H ASP 39 H ASP 39 10.361 -8.100 -9.589 337 HA ASP 39 HA ASP 39 10.322 -10.216 -7.468 338 HB2 ASP 39 HB2 ASP 39 10.410 -11.084 -9.808 339 HB3 ASP 39 HB3 ASP 39 11.894 -10.174 -10.069 340 H GLN 40 H GLN 40 11.671 -7.214 -8.328 341 HA GLN 40 HA GLN 40 14.066 -7.594 -6.565 342 HB2 GLN 40 HB2 GLN 40 13.843 -6.070 -9.173 343 HB3 GLN 40 HB3 GLN 40 15.194 -5.937 -8.039 344 HG2 GLN 40 HG2 GLN 40 15.642 -8.372 -8.282 345 HG3 GLN 40 HG3 GLN 40 14.328 -8.496 -9.457 346 HE21 GLN 40 HE21 GLN 40 16.215 -6.998 -12.113 347 HE22 GLN 40 HE22 GLN 40 14.593 -7.409 -11.575 348 HA PRO 41 HA PRO 41 11.672 -4.081 -4.794 349 HB2 PRO 41 HB2 PRO 41 12.102 -4.525 -2.151 350 HB3 PRO 41 HB3 PRO 41 10.894 -5.436 -3.107 351 HG2 PRO 41 HG2 PRO 41 13.721 -6.273 -2.388 352 HG3 PRO 41 HG3 PRO 41 12.214 -7.231 -2.237 353 HD2 PRO 41 HD2 PRO 41 13.924 -7.456 -4.375 354 HD3 PRO 41 HD3 PRO 41 12.158 -7.675 -4.544 355 H ASP 42 H ASP 42 12.354 -2.165 -3.753 356 HA ASP 42 HA ASP 42 15.306 -1.653 -3.753 357 HB2 ASP 42 HB2 ASP 42 13.886 -0.392 -5.375 358 HB3 ASP 42 HB3 ASP 42 12.998 0.297 -4.016 359 H TRP 43 H TRP 43 12.444 -1.698 -1.752 360 HA TRP 43 HA TRP 43 14.097 -1.318 0.661 361 HB2 TRP 43 HB2 TRP 43 13.202 0.924 0.293 362 HB3 TRP 43 HB3 TRP 43 11.586 0.281 0.037 363 HD1 TRP 43 HD1 TRP 43 14.002 1.252 2.780 364 HE1 TRP 43 HE1 TRP 43 12.814 1.213 5.058 365 HE3 TRP 43 HE3 TRP 43 9.614 -0.986 1.387 366 HZ2 TRP 43 HZ2 TRP 43 10.285 0.334 6.128 367 HZ3 TRP 43 HZ3 TRP 43 7.836 -1.422 3.053 368 HH2 TRP 43 HH2 TRP 43 8.165 -0.781 5.440 369 H THR 44 H THR 44 13.324 -2.556 2.438 370 HA THR 44 HA THR 44 10.624 -3.703 2.308 371 HB THR 44 HB THR 44 11.263 -5.896 2.817 372 HG1 THR 44 HG1 THR 44 13.441 -6.529 3.054 373 HG21 THR 44 HG21 THR 44 11.514 -5.352 0.386 374 HG22 THR 44 HG22 THR 44 13.263 -5.210 0.641 375 HG23 THR 44 HG23 THR 44 12.430 -6.758 0.933 376 H GLY 45 H GLY 45 9.760 -4.344 4.271 377 HA2 GLY 45 HA2 GLY 45 11.100 -4.008 6.797 378 HA3 GLY 45 HA3 GLY 45 10.228 -2.544 6.365 379 H ARG 46 H ARG 46 8.498 -2.466 7.484 380 HA ARG 46 HA ARG 46 6.729 -4.831 8.010 381 HB2 ARG 46 HB2 ARG 46 8.321 -4.316 9.888 382 HB3 ARG 46 HB3 ARG 46 7.609 -2.709 10.022 383 HG2 ARG 46 HG2 ARG 46 5.402 -3.767 10.598 384 HG3 ARG 46 HG3 ARG 46 6.156 -5.361 10.399 385 HD2 ARG 46 HD2 ARG 46 6.096 -4.929 12.728 386 HD3 ARG 46 HD3 ARG 46 7.781 -4.776 12.209 387 HE ARG 46 HE ARG 46 6.236 -2.242 12.297 388 HH11 ARG 46 HH11 ARG 46 6.601 -0.788 13.692 389 HH12 ARG 46 HH12 ARG 46 7.647 -1.027 15.101 390 HH21 ARG 46 HH21 ARG 46 8.350 -4.302 14.220 391 HH22 ARG 46 HH22 ARG 46 8.654 -3.019 15.358 392 H LEU 47 H LEU 47 4.526 -4.388 8.248 393 HA LEU 47 HA LEU 47 3.625 -1.813 7.017 394 HB2 LEU 47 HB2 LEU 47 2.994 -3.991 5.942 395 HB3 LEU 47 HB3 LEU 47 2.255 -4.458 7.468 396 HG LEU 47 HG LEU 47 0.718 -2.359 7.163 397 HD11 LEU 47 HD11 LEU 47 1.655 -2.724 4.302 398 HD12 LEU 47 HD12 LEU 47 0.317 -1.697 4.876 399 HD13 LEU 47 HD13 LEU 47 1.974 -1.314 5.340 400 HD21 LEU 47 HD21 LEU 47 -0.047 -4.676 7.046 401 HD22 LEU 47 HD22 LEU 47 -0.859 -3.664 5.862 402 HD23 LEU 47 HD23 LEU 47 0.443 -4.763 5.340 403 H ARG 48 H ARG 48 2.375 -0.379 8.109 404 HA ARG 48 HA ARG 48 0.621 -1.421 10.273 405 HB2 ARG 48 HB2 ARG 48 2.613 0.534 10.705 406 HB3 ARG 48 HB3 ARG 48 1.168 1.481 10.428 407 HG2 ARG 48 HG2 ARG 48 1.382 1.137 12.767 408 HG3 ARG 48 HG3 ARG 48 -0.007 0.182 12.227 409 HD2 ARG 48 HD2 ARG 48 1.269 -1.861 12.310 410 HD3 ARG 48 HD3 ARG 48 2.793 -0.998 12.528 411 HE ARG 48 HE ARG 48 0.786 -1.624 14.567 412 HH11 ARG 48 HH11 ARG 48 1.271 -1.260 16.694 413 HH12 ARG 48 HH12 ARG 48 2.606 -0.235 17.123 414 HH21 ARG 48 HH21 ARG 48 3.560 0.500 13.903 415 HH22 ARG 48 HH22 ARG 48 3.849 0.715 15.606 416 H ILE 49 H ILE 49 -1.461 -1.034 9.971 417 HA ILE 49 HA ILE 49 -2.288 1.171 8.112 418 HB ILE 49 HB ILE 49 -3.605 -1.543 8.353 419 HG12 ILE 49 HG12 ILE 49 -2.194 -0.102 6.055 420 HG13 ILE 49 HG13 ILE 49 -1.635 -1.552 6.888 421 HG21 ILE 49 HG21 ILE 49 -4.519 0.822 6.677 422 HG22 ILE 49 HG22 ILE 49 -5.300 -0.772 6.822 423 HG23 ILE 49 HG23 ILE 49 -5.296 0.300 8.199 424 HD11 ILE 49 HD11 ILE 49 -2.531 -2.182 4.767 425 HD12 ILE 49 HD12 ILE 49 -3.623 -2.790 6.024 426 HD13 ILE 49 HD13 ILE 49 -4.053 -1.349 5.055 427 H THR 50 H THR 50 -3.594 2.595 8.963 428 HA THR 50 HA THR 50 -4.959 2.090 11.585 429 HB THR 50 HB THR 50 -4.327 4.310 12.291 430 HG1 THR 50 HG1 THR 50 -2.932 5.547 10.852 431 HG21 THR 50 HG21 THR 50 -2.547 2.510 12.596 432 HG22 THR 50 HG22 THR 50 -1.755 3.147 11.142 433 HG23 THR 50 HG23 THR 50 -1.952 4.179 12.571 434 H SER 51 H SER 51 -6.675 3.887 11.950 435 HA SER 51 HA SER 51 -7.549 5.393 9.621 436 HB2 SER 51 HB2 SER 51 -9.865 4.673 9.662 437 HB3 SER 51 HB3 SER 51 -8.797 3.338 9.211 438 HG SER 51 HG SER 51 -9.719 3.774 11.880 439 H LYS 52 H LYS 52 -8.124 7.298 10.198 440 HA LYS 52 HA LYS 52 -8.808 7.980 13.019 441 HB2 LYS 52 HB2 LYS 52 -7.215 9.309 11.723 442 HB3 LYS 52 HB3 LYS 52 -8.473 9.652 10.514 443 HG2 LYS 52 HG2 LYS 52 -9.810 10.689 12.461 444 HG3 LYS 52 HG3 LYS 52 -8.313 10.610 13.394 445 HD2 LYS 52 HD2 LYS 52 -8.775 11.999 10.736 446 HD3 LYS 52 HD3 LYS 52 -8.755 12.776 12.340 447 HE2 LYS 52 HE2 LYS 52 -6.403 12.387 12.575 448 HE3 LYS 52 HE3 LYS 52 -6.334 11.432 11.092 449 HZ1 LYS 52 HZ1 LYS 52 -6.768 13.372 9.807 450 HZ2 LYS 52 HZ2 LYS 52 -7.259 14.257 11.098 451 HZ3 LYS 52 HZ3 LYS 52 -5.679 13.893 10.924 452 H GLY 53 H GLY 53 -10.442 7.468 9.957 453 HA2 GLY 53 HA2 GLY 53 -13.050 7.236 11.119 454 HA3 GLY 53 HA3 GLY 53 -12.882 8.836 10.382 455 H LYS 54 H LYS 54 -13.767 8.831 8.382 456 HA LYS 54 HA LYS 54 -13.881 6.590 6.535 457 HB2 LYS 54 HB2 LYS 54 -15.396 8.587 6.531 458 HB3 LYS 54 HB3 LYS 54 -14.027 9.591 5.997 459 HG2 LYS 54 HG2 LYS 54 -13.896 8.175 3.923 460 HG3 LYS 54 HG3 LYS 54 -15.249 7.232 4.553 461 HD2 LYS 54 HD2 LYS 54 -16.690 9.221 4.501 462 HD3 LYS 54 HD3 LYS 54 -15.350 10.214 3.922 463 HE2 LYS 54 HE2 LYS 54 -16.521 7.827 2.402 464 HE3 LYS 54 HE3 LYS 54 -17.019 9.501 2.169 465 HZ1 LYS 54 HZ1 LYS 54 -15.393 9.006 0.529 466 HZ2 LYS 54 HZ2 LYS 54 -14.647 10.004 1.589 467 HZ3 LYS 54 HZ3 LYS 54 -14.319 8.395 1.587 468 H THR 55 H THR 55 -11.278 8.668 7.356 469 HA THR 55 HA THR 55 -9.715 7.626 5.074 470 HB THR 55 HB THR 55 -8.367 9.327 7.101 471 HG1 THR 55 HG1 THR 55 -9.298 11.211 6.272 472 HG21 THR 55 HG21 THR 55 -8.713 9.394 4.069 473 HG22 THR 55 HG22 THR 55 -7.527 10.367 4.992 474 HG23 THR 55 HG23 THR 55 -7.379 8.597 4.926 475 H ALA 56 H ALA 56 -8.473 6.008 5.144 476 HA ALA 56 HA ALA 56 -7.277 5.088 7.703 477 HB1 ALA 56 HB1 ALA 56 -8.330 3.191 6.840 478 HB2 ALA 56 HB2 ALA 56 -7.871 3.549 5.172 479 HB3 ALA 56 HB3 ALA 56 -6.650 3.012 6.339 480 H TYR 57 H TYR 57 -4.943 4.517 7.590 481 HA TYR 57 HA TYR 57 -3.477 6.097 5.529 482 HB2 TYR 57 HB2 TYR 57 -2.846 6.153 8.494 483 HB3 TYR 57 HB3 TYR 57 -1.971 6.955 7.215 484 HD1 TYR 57 HD1 TYR 57 -5.280 6.891 9.002 485 HD2 TYR 57 HD2 TYR 57 -2.572 9.152 6.526 486 HE1 TYR 57 HE1 TYR 57 -6.835 8.826 9.071 487 HE2 TYR 57 HE2 TYR 57 -4.073 11.142 6.723 488 HH TYR 57 HH TYR 57 -7.195 11.006 8.471 489 H ILE 58 H ILE 58 -2.268 4.738 4.449 490 HA ILE 58 HA ILE 58 -1.263 2.219 5.637 491 HB ILE 58 HB ILE 58 -0.337 3.466 3.031 492 HG12 ILE 58 HG12 ILE 58 -2.723 3.360 2.737 493 HG13 ILE 58 HG13 ILE 58 -1.911 2.152 1.763 494 HG21 ILE 58 HG21 ILE 58 -0.333 0.657 4.187 495 HG22 ILE 58 HG22 ILE 58 0.127 1.048 2.516 496 HG23 ILE 58 HG23 ILE 58 1.066 1.697 3.863 497 HD11 ILE 58 HD11 ILE 58 -3.975 1.313 2.744 498 HD12 ILE 58 HD12 ILE 58 -2.586 0.376 3.328 499 HD13 ILE 58 HD13 ILE 58 -3.358 1.583 4.386 500 H LYS 59 H LYS 59 0.319 2.433 7.073 501 HA LYS 59 HA LYS 59 2.542 4.438 6.659 502 HB2 LYS 59 HB2 LYS 59 1.273 3.227 9.105 503 HB3 LYS 59 HB3 LYS 59 2.931 3.853 9.155 504 HG2 LYS 59 HG2 LYS 59 2.223 6.050 8.495 505 HG3 LYS 59 HG3 LYS 59 0.569 5.512 8.154 506 HD2 LYS 59 HD2 LYS 59 0.008 5.293 10.410 507 HD3 LYS 59 HD3 LYS 59 1.690 5.054 10.917 508 HE2 LYS 59 HE2 LYS 59 1.064 7.184 11.706 509 HE3 LYS 59 HE3 LYS 59 2.187 7.429 10.342 510 HZ1 LYS 59 HZ1 LYS 59 0.146 8.864 10.384 511 HZ2 LYS 59 HZ2 LYS 59 0.337 8.059 8.974 512 HZ3 LYS 59 HZ3 LYS 59 -0.764 7.552 10.143 513 H LEU 60 H LEU 60 4.444 3.648 6.010 514 HA LEU 60 HA LEU 60 5.011 0.721 6.336 515 HB2 LEU 60 HB2 LEU 60 6.109 2.809 4.422 516 HB3 LEU 60 HB3 LEU 60 6.732 1.166 4.562 517 HG LEU 60 HG LEU 60 3.859 1.842 3.769 518 HD11 LEU 60 HD11 LEU 60 6.252 0.978 2.109 519 HD12 LEU 60 HD12 LEU 60 4.587 1.153 1.505 520 HD13 LEU 60 HD13 LEU 60 5.480 2.576 2.069 521 HD21 LEU 60 HD21 LEU 60 3.800 -0.528 3.028 522 HD22 LEU 60 HD22 LEU 60 5.435 -0.771 3.684 523 HD23 LEU 60 HD23 LEU 60 4.073 -0.419 4.768 524 H GLU 61 H GLU 61 6.554 0.045 7.641 525 HA GLU 61 HA GLU 61 8.113 2.089 9.164 526 HB2 GLU 61 HB2 GLU 61 6.879 -0.530 10.072 527 HB3 GLU 61 HB3 GLU 61 7.829 0.565 11.077 528 HG2 GLU 61 HG2 GLU 61 6.105 2.327 10.780 529 HG3 GLU 61 HG3 GLU 61 5.130 1.207 9.817 530 H ASP 62 H ASP 62 10.241 1.583 9.866 531 HA ASP 62 HA ASP 62 11.772 -0.324 8.359 532 HB2 ASP 62 HB2 ASP 62 12.698 1.779 9.189 533 HB3 ASP 62 HB3 ASP 62 12.348 1.312 10.858 534 H LYS 63 H LYS 63 12.712 -2.290 9.075 535 HA LYS 63 HA LYS 63 10.750 -3.868 10.471 536 HB2 LYS 63 HB2 LYS 63 12.546 -4.323 8.422 537 HB3 LYS 63 HB3 LYS 63 13.363 -5.136 9.753 538 HG2 LYS 63 HG2 LYS 63 11.331 -6.465 10.207 539 HG3 LYS 63 HG3 LYS 63 10.443 -5.557 8.971 540 HD2 LYS 63 HD2 LYS 63 12.133 -6.381 7.262 541 HD3 LYS 63 HD3 LYS 63 12.774 -7.473 8.501 542 HE2 LYS 63 HE2 LYS 63 9.867 -7.341 7.574 543 HE3 LYS 63 HE3 LYS 63 11.047 -8.485 6.928 544 HZ1 LYS 63 HZ1 LYS 63 10.360 -8.366 9.812 545 HZ2 LYS 63 HZ2 LYS 63 9.570 -9.316 8.769 546 HZ3 LYS 63 HZ3 LYS 63 11.180 -9.561 9.043 547 H VAL 64 H VAL 64 13.379 -2.160 11.662 548 HA VAL 64 HA VAL 64 13.419 -3.753 14.194 549 HB VAL 64 HB VAL 64 15.858 -2.971 14.292 550 HG11 VAL 64 HG11 VAL 64 16.626 -5.095 13.297 551 HG12 VAL 64 HG12 VAL 64 15.122 -5.337 14.196 552 HG13 VAL 64 HG13 VAL 64 15.088 -5.250 12.420 553 HG21 VAL 64 HG21 VAL 64 16.040 -1.610 12.304 554 HG22 VAL 64 HG22 VAL 64 17.147 -2.981 12.234 555 HG23 VAL 64 HG23 VAL 64 15.659 -3.012 11.272 556 H SER 65 H SER 65 13.615 -0.545 12.710 557 HA SER 65 HA SER 65 13.787 0.629 15.453 558 HB2 SER 65 HB2 SER 65 14.105 1.916 12.720 559 HB3 SER 65 HB3 SER 65 14.274 2.738 14.282 560 HG SER 65 HG SER 65 15.874 0.632 13.236 561 H GLY 66 H GLY 66 11.426 -0.144 13.134 562 HA2 GLY 66 HA2 GLY 66 9.205 0.379 12.895 563 HA3 GLY 66 HA3 GLY 66 9.256 1.167 14.475 564 H GLU 67 H GLU 67 11.520 2.513 12.286 565 HA GLU 67 HA GLU 67 10.183 5.088 12.372 566 HB2 GLU 67 HB2 GLU 67 12.770 4.068 11.164 567 HB3 GLU 67 HB3 GLU 67 12.221 5.716 10.872 568 HG2 GLU 67 HG2 GLU 67 12.511 4.596 13.679 569 HG3 GLU 67 HG3 GLU 67 13.851 5.341 12.811 570 H LEU 68 H LEU 68 9.449 6.389 10.696 571 HA LEU 68 HA LEU 68 7.915 4.869 8.801 572 HB2 LEU 68 HB2 LEU 68 7.173 6.965 10.056 573 HB3 LEU 68 HB3 LEU 68 8.159 7.888 8.923 574 HG LEU 68 HG LEU 68 6.770 6.745 7.046 575 HD11 LEU 68 HD11 LEU 68 5.735 4.963 8.480 576 HD12 LEU 68 HD12 LEU 68 4.899 6.222 9.405 577 HD13 LEU 68 HD13 LEU 68 4.533 5.976 7.683 578 HD21 LEU 68 HD21 LEU 68 6.484 9.101 7.685 579 HD22 LEU 68 HD22 LEU 68 4.930 8.352 7.290 580 HD23 LEU 68 HD23 LEU 68 5.373 8.626 8.990 581 H PHE 69 H PHE 69 8.484 4.174 6.894 582 HA PHE 69 HA PHE 69 10.645 5.329 5.228 583 HB2 PHE 69 HB2 PHE 69 10.488 2.967 5.275 584 HB3 PHE 69 HB3 PHE 69 8.750 2.980 5.019 585 HD1 PHE 69 HD1 PHE 69 8.054 2.264 2.928 586 HD2 PHE 69 HD2 PHE 69 11.799 4.362 3.248 587 HE1 PHE 69 HE1 PHE 69 8.407 1.991 0.494 588 HE2 PHE 69 HE2 PHE 69 12.136 4.128 0.816 589 HZ PHE 69 HZ PHE 69 10.426 2.945 -0.590 590 H ALA 70 H ALA 70 7.097 4.874 4.990 591 HA ALA 70 HA ALA 70 6.724 7.432 3.662 592 HB1 ALA 70 HB1 ALA 70 6.080 4.851 2.151 593 HB2 ALA 70 HB2 ALA 70 5.660 6.493 1.642 594 HB3 ALA 70 HB3 ALA 70 7.361 6.005 1.716 595 H GLN 71 H GLN 71 4.375 7.865 3.285 596 HA GLN 71 HA GLN 71 2.548 5.860 4.298 597 HB2 GLN 71 HB2 GLN 71 1.266 7.336 5.759 598 HB3 GLN 71 HB3 GLN 71 2.910 7.099 6.343 599 HG2 GLN 71 HG2 GLN 71 3.562 9.324 5.446 600 HG3 GLN 71 HG3 GLN 71 1.917 9.579 4.858 601 HE21 GLN 71 HE21 GLN 71 2.376 11.175 8.268 602 HE22 GLN 71 HE22 GLN 71 3.327 11.271 6.795 603 H ALA 72 H ALA 72 0.460 5.958 3.554 604 HA ALA 72 HA ALA 72 -0.150 7.985 1.447 605 HB1 ALA 72 HB1 ALA 72 -1.256 6.184 0.165 606 HB2 ALA 72 HB2 ALA 72 0.485 5.928 0.332 607 HB3 ALA 72 HB3 ALA 72 -0.658 4.995 1.327 608 HA PRO 73 HA PRO 73 -3.967 7.922 4.088 609 HB2 PRO 73 HB2 PRO 73 -5.005 10.336 3.376 610 HB3 PRO 73 HB3 PRO 73 -3.620 10.174 4.494 611 HG2 PRO 73 HG2 PRO 73 -3.535 10.798 1.537 612 HG3 PRO 73 HG3 PRO 73 -2.671 11.619 2.871 613 HD2 PRO 73 HD2 PRO 73 -1.505 9.682 1.323 614 HD3 PRO 73 HD3 PRO 73 -1.098 9.887 3.051 615 H VAL 74 H VAL 74 -5.915 6.990 3.517 616 HA VAL 74 HA VAL 74 -6.841 7.182 0.674 617 HB VAL 74 HB VAL 74 -5.827 5.070 1.034 618 HG11 VAL 74 HG11 VAL 74 -7.839 4.372 3.149 619 HG12 VAL 74 HG12 VAL 74 -6.653 3.282 2.415 620 HG13 VAL 74 HG13 VAL 74 -6.091 4.631 3.404 621 HG21 VAL 74 HG21 VAL 74 -7.830 5.243 -0.466 622 HG22 VAL 74 HG22 VAL 74 -7.646 3.626 0.221 623 HG23 VAL 74 HG23 VAL 74 -8.847 4.715 0.890 624 H GLU 75 H GLU 75 -8.849 7.843 0.371 625 HA GLU 75 HA GLU 75 -10.747 7.721 2.662 626 HB2 GLU 75 HB2 GLU 75 -9.767 10.012 1.615 627 HB3 GLU 75 HB3 GLU 75 -11.097 9.744 0.484 628 HG2 GLU 75 HG2 GLU 75 -12.487 9.360 2.722 629 HG3 GLU 75 HG3 GLU 75 -11.158 10.218 3.481 630 H GLN 76 H GLN 76 -10.172 6.180 -0.176 631 HA GLN 76 HA GLN 76 -12.804 5.077 -0.255 632 HB2 GLN 76 HB2 GLN 76 -13.423 5.549 -2.491 633 HB3 GLN 76 HB3 GLN 76 -13.090 7.089 -1.728 634 HG2 GLN 76 HG2 GLN 76 -11.311 5.630 -3.730 635 HG3 GLN 76 HG3 GLN 76 -12.321 7.022 -4.044 636 HE21 GLN 76 HE21 GLN 76 -8.623 7.591 -2.429 637 HE22 GLN 76 HE22 GLN 76 -9.318 5.956 -2.479 638 H TYR 77 H TYR 77 -12.742 2.962 -0.944 639 HA TYR 77 HA TYR 77 -10.371 2.011 -2.444 640 HB2 TYR 77 HB2 TYR 77 -10.228 1.489 -0.003 641 HB3 TYR 77 HB3 TYR 77 -11.669 0.485 -0.174 642 HD1 TYR 77 HD1 TYR 77 -8.627 0.853 -2.357 643 HD2 TYR 77 HD2 TYR 77 -10.787 -1.719 0.338 644 HE1 TYR 77 HE1 TYR 77 -7.044 -0.935 -2.830 645 HE2 TYR 77 HE2 TYR 77 -9.210 -3.562 -0.193 646 HH TYR 77 HH TYR 77 -6.471 -3.145 -2.454 647 HA PRO 78 HA PRO 78 -9.754 0.590 -4.170 648 HB2 PRO 78 HB2 PRO 78 -10.151 0.617 -6.857 649 HB3 PRO 78 HB3 PRO 78 -10.221 -0.870 -5.863 650 HG2 PRO 78 HG2 PRO 78 -12.546 0.869 -6.761 651 HG3 PRO 78 HG3 PRO 78 -12.369 -0.910 -6.925 652 HD2 PRO 78 HD2 PRO 78 -13.756 0.154 -4.869 653 HD3 PRO 78 HD3 PRO 78 -12.684 -1.246 -4.596 654 H GLY 79 H GLY 79 -8.461 2.255 -5.132 655 HA2 GLY 79 HA2 GLY 79 -9.588 4.658 -6.298 656 HA3 GLY 79 HA3 GLY 79 -9.084 4.900 -4.623 657 H ILE 80 H ILE 80 -7.584 6.474 -5.617 658 HA ILE 80 HA ILE 80 -5.332 5.399 -7.171 659 HB ILE 80 HB ILE 80 -6.389 7.580 -7.706 660 HG12 ILE 80 HG12 ILE 80 -4.392 8.878 -8.116 661 HG13 ILE 80 HG13 ILE 80 -3.472 7.943 -6.941 662 HG21 ILE 80 HG21 ILE 80 -5.088 8.605 -5.138 663 HG22 ILE 80 HG22 ILE 80 -5.923 9.573 -6.361 664 HG23 ILE 80 HG23 ILE 80 -6.836 8.405 -5.397 665 HD11 ILE 80 HD11 ILE 80 -3.030 7.349 -9.348 666 HD12 ILE 80 HD12 ILE 80 -3.535 5.971 -8.364 667 HD13 ILE 80 HD13 ILE 80 -4.697 6.753 -9.469 668 H ALA 81 H ALA 81 -6.092 5.991 -3.845 669 HA ALA 81 HA ALA 81 -3.310 6.117 -3.005 670 HB1 ALA 81 HB1 ALA 81 -5.887 5.899 -1.392 671 HB2 ALA 81 HB2 ALA 81 -4.264 6.227 -0.740 672 HB3 ALA 81 HB3 ALA 81 -5.061 7.410 -1.814 673 H VAL 82 H VAL 82 -5.498 3.571 -3.738 674 HA VAL 82 HA VAL 82 -3.425 1.656 -3.267 675 HB VAL 82 HB VAL 82 -4.080 1.605 -1.059 676 HG11 VAL 82 HG11 VAL 82 -6.811 1.926 -1.914 677 HG12 VAL 82 HG12 VAL 82 -6.584 0.676 -0.664 678 HG13 VAL 82 HG13 VAL 82 -5.987 2.315 -0.406 679 HG21 VAL 82 HG21 VAL 82 -5.011 -0.879 -2.461 680 HG22 VAL 82 HG22 VAL 82 -3.387 -0.436 -1.975 681 HG23 VAL 82 HG23 VAL 82 -4.623 -0.726 -0.737 682 H GLU 83 H GLU 83 -3.478 0.429 -4.951 683 HA GLU 83 HA GLU 83 -6.015 -0.465 -6.251 684 HB2 GLU 83 HB2 GLU 83 -4.198 1.524 -7.213 685 HB3 GLU 83 HB3 GLU 83 -3.825 0.081 -8.136 686 HG2 GLU 83 HG2 GLU 83 -6.608 1.289 -7.844 687 HG3 GLU 83 HG3 GLU 83 -5.490 1.622 -9.166 688 H THR 84 H THR 84 -5.866 -2.417 -7.468 689 HA THR 84 HA THR 84 -3.501 -4.176 -6.866 690 HB THR 84 HB THR 84 -5.929 -5.219 -8.181 691 HG1 THR 84 HG1 THR 84 -6.900 -5.623 -6.181 692 HG21 THR 84 HG21 THR 84 -5.336 -7.233 -6.904 693 HG22 THR 84 HG22 THR 84 -3.946 -6.630 -7.821 694 HG23 THR 84 HG23 THR 84 -4.051 -6.327 -6.070 695 H VAL 85 H VAL 85 -2.189 -3.392 -8.193 696 HA VAL 85 HA VAL 85 -1.265 -2.877 -10.422 697 HB VAL 85 HB VAL 85 -0.276 -5.254 -10.805 698 HG11 VAL 85 HG11 VAL 85 0.818 -3.370 -9.653 699 HG12 VAL 85 HG12 VAL 85 0.016 -3.793 -8.133 700 HG13 VAL 85 HG13 VAL 85 1.198 -4.894 -8.851 701 HG21 VAL 85 HG21 VAL 85 -2.147 -6.448 -9.430 702 HG22 VAL 85 HG22 VAL 85 -0.475 -6.838 -9.051 703 HG23 VAL 85 HG23 VAL 85 -1.391 -5.740 -8.008 704 H THR 86 H THR 86 -2.908 -5.957 -10.865 705 HA THR 86 HA THR 86 -4.745 -4.864 -12.795 706 HB THR 86 HB THR 86 -4.482 -6.891 -14.341 707 HG1 THR 86 HG1 THR 86 -2.420 -7.727 -14.483 708 HG21 THR 86 HG21 THR 86 -2.912 -5.798 -15.806 709 HG22 THR 86 HG22 THR 86 -3.818 -4.518 -14.960 710 HG23 THR 86 HG23 THR 86 -2.175 -4.936 -14.437 711 H ASP 87 H ASP 87 -3.475 -7.939 -11.555 712 HA ASP 87 HA ASP 87 -6.226 -8.847 -10.783 713 HB2 ASP 87 HB2 ASP 87 -4.335 -9.879 -12.891 714 HB3 ASP 87 HB3 ASP 87 -5.443 -10.983 -12.103 715 H SER 88 H SER 88 -2.867 -10.353 -10.807 716 HA SER 88 HA SER 88 -3.280 -11.808 -8.428 717 HB2 SER 88 HB2 SER 88 -1.193 -12.189 -9.644 718 HB3 SER 88 HB3 SER 88 -0.602 -10.591 -9.167 719 HG SER 88 HG SER 88 0.197 -12.002 -7.709 720 H SER 89 H SER 89 -3.785 -11.252 -6.514 721 HA SER 89 HA SER 89 -3.199 -8.552 -5.446 722 HB2 SER 89 HB2 SER 89 -5.456 -9.415 -5.704 723 HB3 SER 89 HB3 SER 89 -5.120 -10.680 -4.501 724 HG SER 89 HG SER 89 -6.166 -8.768 -3.640 725 H ARG 90 H ARG 90 -1.135 -10.545 -5.752 726 HA ARG 90 HA ARG 90 -0.062 -10.733 -2.983 727 HB2 ARG 90 HB2 ARG 90 0.457 -12.455 -4.788 728 HB3 ARG 90 HB3 ARG 90 1.399 -11.200 -5.605 729 HG2 ARG 90 HG2 ARG 90 2.858 -11.010 -3.578 730 HG3 ARG 90 HG3 ARG 90 1.871 -12.244 -2.767 731 HD2 ARG 90 HD2 ARG 90 2.448 -13.831 -4.627 732 HD3 ARG 90 HD3 ARG 90 3.516 -12.585 -5.307 733 HE ARG 90 HE ARG 90 4.295 -12.950 -2.615 734 HH11 ARG 90 HH11 ARG 90 5.795 -14.537 -1.905 735 HH12 ARG 90 HH12 ARG 90 6.532 -15.560 -3.097 736 HH21 ARG 90 HH21 ARG 90 4.444 -14.687 -5.652 737 HH22 ARG 90 HH22 ARG 90 5.737 -15.722 -5.117 738 H TYR 91 H TYR 91 -0.262 -8.561 -5.663 739 HA TYR 91 HA TYR 91 1.676 -6.676 -4.417 740 HB2 TYR 91 HB2 TYR 91 0.793 -6.655 -7.296 741 HB3 TYR 91 HB3 TYR 91 2.148 -5.808 -6.611 742 HD1 TYR 91 HD1 TYR 91 4.130 -7.248 -5.745 743 HD2 TYR 91 HD2 TYR 91 1.051 -8.666 -8.408 744 HE1 TYR 91 HE1 TYR 91 5.651 -9.065 -6.546 745 HE2 TYR 91 HE2 TYR 91 2.554 -10.424 -9.263 746 HH TYR 91 HH TYR 91 5.930 -10.779 -7.964 747 H PHE 92 H PHE 92 1.271 -4.449 -4.716 748 HA PHE 92 HA PHE 92 -1.396 -3.549 -5.572 749 HB2 PHE 92 HB2 PHE 92 -0.281 -2.819 -2.833 750 HB3 PHE 92 HB3 PHE 92 -1.733 -2.146 -3.566 751 HD1 PHE 92 HD1 PHE 92 -0.354 -4.903 -1.675 752 HD2 PHE 92 HD2 PHE 92 -3.704 -3.681 -4.103 753 HE1 PHE 92 HE1 PHE 92 -1.677 -6.799 -0.817 754 HE2 PHE 92 HE2 PHE 92 -5.007 -5.633 -3.289 755 HZ PHE 92 HZ PHE 92 -3.985 -7.216 -1.666 756 H VAL 93 H VAL 93 -1.451 -1.114 -5.614 757 HA VAL 93 HA VAL 93 1.212 0.207 -5.576 758 HB VAL 93 HB VAL 93 -0.952 0.801 -7.636 759 HG11 VAL 93 HG11 VAL 93 0.134 2.866 -6.977 760 HG12 VAL 93 HG12 VAL 93 1.744 2.106 -7.060 761 HG13 VAL 93 HG13 VAL 93 0.796 2.369 -8.525 762 HG21 VAL 93 HG21 VAL 93 0.248 -1.192 -8.301 763 HG22 VAL 93 HG22 VAL 93 0.848 0.156 -9.266 764 HG23 VAL 93 HG23 VAL 93 1.817 -0.445 -7.916 765 H ILE 94 H ILE 94 1.223 1.991 -4.288 766 HA ILE 94 HA ILE 94 -1.382 3.250 -3.586 767 HB ILE 94 HB ILE 94 -0.738 3.581 -1.294 768 HG12 ILE 94 HG12 ILE 94 1.788 1.972 -1.827 769 HG13 ILE 94 HG13 ILE 94 1.733 3.719 -1.598 770 HG21 ILE 94 HG21 ILE 94 -1.822 1.383 -2.036 771 HG22 ILE 94 HG22 ILE 94 -0.241 0.622 -1.838 772 HG23 ILE 94 HG23 ILE 94 -1.066 1.392 -0.461 773 HD11 ILE 94 HD11 ILE 94 0.738 3.379 0.667 774 HD12 ILE 94 HD12 ILE 94 0.962 1.637 0.466 775 HD13 ILE 94 HD13 ILE 94 2.372 2.708 0.501 776 H ARG 95 H ARG 95 -1.405 5.471 -3.538 777 HA ARG 95 HA ARG 95 1.101 6.849 -4.339 778 HB2 ARG 95 HB2 ARG 95 -0.026 8.631 -5.131 779 HB3 ARG 95 HB3 ARG 95 -1.060 7.274 -5.534 780 HG2 ARG 95 HG2 ARG 95 -2.579 8.857 -4.923 781 HG3 ARG 95 HG3 ARG 95 -2.433 7.905 -3.456 782 HD2 ARG 95 HD2 ARG 95 -0.811 9.688 -2.591 783 HD3 ARG 95 HD3 ARG 95 -1.175 10.610 -4.049 784 HE ARG 95 HE ARG 95 -3.235 11.204 -3.126 785 HH11 ARG 95 HH11 ARG 95 -4.938 11.154 -1.621 786 HH12 ARG 95 HH12 ARG 95 -4.894 9.946 -0.352 787 HH21 ARG 95 HH21 ARG 95 -1.951 8.524 -1.222 788 HH22 ARG 95 HH22 ARG 95 -3.356 8.562 -0.154 789 H ILE 96 H ILE 96 2.426 7.502 -2.871 790 HA ILE 96 HA ILE 96 1.557 7.970 -0.060 791 HB ILE 96 HB ILE 96 4.003 7.925 0.424 792 HG12 ILE 96 HG12 ILE 96 4.417 6.758 -2.352 793 HG13 ILE 96 HG13 ILE 96 4.637 8.484 -2.039 794 HG21 ILE 96 HG21 ILE 96 2.831 5.455 -0.901 795 HG22 ILE 96 HG22 ILE 96 4.241 5.441 0.160 796 HG23 ILE 96 HG23 ILE 96 2.678 5.924 0.807 797 HD11 ILE 96 HD11 ILE 96 6.173 6.232 -0.751 798 HD12 ILE 96 HD12 ILE 96 6.754 7.439 -1.925 799 HD13 ILE 96 HD13 ILE 96 6.282 7.952 -0.283 800 H GLN 97 H GLN 97 2.395 9.798 1.095 801 HA GLN 97 HA GLN 97 2.988 12.257 -0.484 802 HB2 GLN 97 HB2 GLN 97 2.557 11.595 2.440 803 HB3 GLN 97 HB3 GLN 97 3.403 13.071 2.000 804 HG2 GLN 97 HG2 GLN 97 0.735 12.497 0.699 805 HG3 GLN 97 HG3 GLN 97 0.796 13.075 2.368 806 HE21 GLN 97 HE21 GLN 97 1.708 15.709 -0.613 807 HE22 GLN 97 HE22 GLN 97 1.463 14.021 -1.025 808 H ASP 98 H ASP 98 5.069 13.090 -0.737 809 HA ASP 98 HA ASP 98 7.333 11.457 0.240 810 HB2 ASP 98 HB2 ASP 98 7.153 12.388 -2.104 811 HB3 ASP 98 HB3 ASP 98 7.350 13.993 -1.392 812 H GLY 99 H GLY 99 5.437 13.752 1.643 813 HA2 GLY 99 HA2 GLY 99 5.617 14.766 3.699 814 HA3 GLY 99 HA3 GLY 99 7.291 14.219 3.820 815 H THR 100 H THR 100 6.598 16.071 0.993 816 HA THR 100 HA THR 100 7.444 18.633 2.237 817 HB THR 100 HB THR 100 9.463 17.472 1.579 818 HG1 THR 100 HG1 THR 100 8.854 19.792 0.089 819 HG21 THR 100 HG21 THR 100 8.672 16.263 -0.389 820 HG22 THR 100 HG22 THR 100 8.473 17.800 -1.267 821 HG23 THR 100 HG23 THR 100 10.090 17.260 -0.761 822 H GLY 101 H GLY 101 4.884 17.740 1.222 823 HA2 GLY 101 HA2 GLY 101 3.107 19.010 0.406 824 HA3 GLY 101 HA3 GLY 101 4.227 20.122 -0.383 825 H ARG 102 H ARG 102 4.676 16.723 -0.929 826 HA ARG 102 HA ARG 102 3.331 16.730 -3.573 827 HB2 ARG 102 HB2 ARG 102 5.314 16.335 -4.775 828 HB3 ARG 102 HB3 ARG 102 5.629 17.736 -3.718 829 HG2 ARG 102 HG2 ARG 102 6.848 16.192 -2.164 830 HG3 ARG 102 HG3 ARG 102 6.637 14.896 -3.368 831 HD2 ARG 102 HD2 ARG 102 7.838 16.248 -5.050 832 HD3 ARG 102 HD3 ARG 102 8.055 17.546 -3.856 833 HE ARG 102 HE ARG 102 9.098 15.078 -2.798 834 HH11 ARG 102 HH11 ARG 102 11.092 14.676 -2.590 835 HH12 ARG 102 HH12 ARG 102 12.350 15.528 -3.496 836 HH21 ARG 102 HH21 ARG 102 10.032 17.493 -5.176 837 HH22 ARG 102 HH22 ARG 102 11.724 17.128 -4.960 838 H SER 103 H SER 103 3.354 14.656 -4.652 839 HA SER 103 HA SER 103 3.501 12.350 -2.761 840 HB2 SER 103 HB2 SER 103 1.286 13.031 -4.722 841 HB3 SER 103 HB3 SER 103 1.418 11.491 -3.855 842 HG SER 103 HG SER 103 0.056 13.084 -2.820 843 H ALA 104 H ALA 104 3.640 10.259 -3.671 844 HA ALA 104 HA ALA 104 4.685 9.981 -6.440 845 HB1 ALA 104 HB1 ALA 104 6.172 9.083 -3.940 846 HB2 ALA 104 HB2 ALA 104 6.645 8.739 -5.617 847 HB3 ALA 104 HB3 ALA 104 6.657 10.409 -5.020 848 H PHE 105 H PHE 105 4.471 7.892 -7.336 849 HA PHE 105 HA PHE 105 2.630 6.074 -5.871 850 HB2 PHE 105 HB2 PHE 105 3.596 5.863 -8.730 851 HB3 PHE 105 HB3 PHE 105 2.297 4.957 -7.965 852 HD1 PHE 105 HD1 PHE 105 0.218 6.279 -7.097 853 HD2 PHE 105 HD2 PHE 105 3.175 7.962 -9.763 854 HE1 PHE 105 HE1 PHE 105 -1.353 8.086 -7.731 855 HE2 PHE 105 HE2 PHE 105 1.603 9.781 -10.358 856 HZ PHE 105 HZ PHE 105 -0.682 9.839 -9.341 857 H ILE 106 H ILE 106 3.288 4.281 -4.900 858 HA ILE 106 HA ILE 106 5.803 2.974 -5.844 859 HB ILE 106 HB ILE 106 6.109 1.995 -3.604 860 HG12 ILE 106 HG12 ILE 106 4.332 4.251 -2.570 861 HG13 ILE 106 HG13 ILE 106 3.827 2.567 -2.684 862 HG21 ILE 106 HG21 ILE 106 7.411 3.903 -2.797 863 HG22 ILE 106 HG22 ILE 106 7.459 3.892 -4.561 864 HG23 ILE 106 HG23 ILE 106 6.400 5.036 -3.718 865 HD11 ILE 106 HD11 ILE 106 6.116 3.577 -0.960 866 HD12 ILE 106 HD12 ILE 106 4.519 3.045 -0.418 867 HD13 ILE 106 HD13 ILE 106 5.624 1.874 -1.153 868 H GLY 107 H GLY 107 5.756 0.966 -6.369 869 HA2 GLY 107 HA2 GLY 107 3.278 -0.637 -6.187 870 HA3 GLY 107 HA3 GLY 107 4.748 -1.073 -7.060 871 H ILE 108 H ILE 108 3.081 -2.356 -4.853 872 HA ILE 108 HA ILE 108 5.269 -2.927 -2.909 873 HB ILE 108 HB ILE 108 2.292 -3.141 -2.305 874 HG12 ILE 108 HG12 ILE 108 4.260 -0.854 -1.806 875 HG13 ILE 108 HG13 ILE 108 2.720 -0.776 -2.658 876 HG21 ILE 108 HG21 ILE 108 3.065 -3.353 0.007 877 HG22 ILE 108 HG22 ILE 108 3.778 -4.596 -0.974 878 HG23 ILE 108 HG23 ILE 108 4.756 -3.175 -0.535 879 HD11 ILE 108 HD11 ILE 108 1.530 -1.229 -0.513 880 HD12 ILE 108 HD12 ILE 108 3.104 -1.155 0.335 881 HD13 ILE 108 HD13 ILE 108 2.508 0.259 -0.508 882 H GLY 109 H GLY 109 5.569 -5.125 -2.400 883 HA2 GLY 109 HA2 GLY 109 3.630 -7.145 -3.349 884 HA3 GLY 109 HA3 GLY 109 5.328 -7.396 -3.770 885 H PHE 110 H PHE 110 3.272 -8.688 -1.841 886 HA PHE 110 HA PHE 110 4.950 -8.683 0.641 887 HB2 PHE 110 HB2 PHE 110 2.226 -9.858 0.106 888 HB3 PHE 110 HB3 PHE 110 3.131 -10.096 1.566 889 HD1 PHE 110 HD1 PHE 110 1.965 -7.085 -0.501 890 HD2 PHE 110 HD2 PHE 110 2.666 -8.821 3.398 891 HE1 PHE 110 HE1 PHE 110 1.056 -5.058 0.578 892 HE2 PHE 110 HE2 PHE 110 1.688 -6.825 4.457 893 HZ PHE 110 HZ PHE 110 0.932 -4.904 3.047 894 H THR 111 H THR 111 5.657 -10.631 1.587 895 HA THR 111 HA THR 111 6.822 -12.432 -0.354 896 HB THR 111 HB THR 111 7.690 -11.547 1.936 897 HG1 THR 111 HG1 THR 111 9.103 -13.301 1.930 898 HG21 THR 111 HG21 THR 111 7.547 -13.078 3.788 899 HG22 THR 111 HG22 THR 111 5.881 -12.718 3.306 900 HG23 THR 111 HG23 THR 111 6.618 -14.261 2.841 901 H ASP 112 H ASP 112 3.896 -12.477 1.516 902 HA ASP 112 HA ASP 112 3.249 -15.182 0.453 903 HB2 ASP 112 HB2 ASP 112 3.497 -14.851 3.034 904 HB3 ASP 112 HB3 ASP 112 1.937 -14.016 2.910 905 H ARG 113 H ARG 113 1.309 -15.488 -0.562 906 HA ARG 113 HA ARG 113 -0.197 -13.333 -1.710 907 HB2 ARG 113 HB2 ARG 113 -0.170 -16.258 -1.751 908 HB3 ARG 113 HB3 ARG 113 -1.822 -15.720 -1.536 909 HG2 ARG 113 HG2 ARG 113 0.015 -14.691 -3.730 910 HG3 ARG 113 HG3 ARG 113 -1.067 -16.073 -3.909 911 HD2 ARG 113 HD2 ARG 113 -3.039 -14.650 -3.498 912 HD3 ARG 113 HD3 ARG 113 -1.996 -13.249 -3.228 913 HE ARG 113 HE ARG 113 -1.565 -13.078 -5.515 914 HH11 ARG 113 HH11 ARG 113 -1.381 -13.682 -7.566 915 HH12 ARG 113 HH12 ARG 113 -2.059 -15.205 -8.129 916 HH21 ARG 113 HH21 ARG 113 -3.580 -15.978 -5.174 917 HH22 ARG 113 HH22 ARG 113 -3.260 -16.406 -6.837 918 H GLY 114 H GLY 114 -0.712 -15.222 1.259 919 HA2 GLY 114 HA2 GLY 114 -3.341 -14.169 1.864 920 HA3 GLY 114 HA3 GLY 114 -2.237 -15.009 2.963 921 H ASP 115 H ASP 115 -0.008 -13.195 2.820 922 HA ASP 115 HA ASP 115 -0.933 -11.215 4.700 923 HB2 ASP 115 HB2 ASP 115 1.773 -11.646 3.442 924 HB3 ASP 115 HB3 ASP 115 1.419 -10.409 4.654 925 H ALA 116 H ALA 116 -0.169 -11.008 1.235 926 HA ALA 116 HA ALA 116 -0.787 -8.165 1.066 927 HB1 ALA 116 HB1 ALA 116 0.505 -9.055 -0.720 928 HB2 ALA 116 HB2 ALA 116 -0.602 -10.438 -0.933 929 HB3 ALA 116 HB3 ALA 116 -1.075 -8.792 -1.404 930 H PHE 117 H PHE 117 -2.768 -11.169 0.425 931 HA PHE 117 HA PHE 117 -5.081 -9.739 -0.352 932 HB2 PHE 117 HB2 PHE 117 -4.639 -12.168 -0.651 933 HB3 PHE 117 HB3 PHE 117 -4.947 -12.408 1.067 934 HD1 PHE 117 HD1 PHE 117 -6.435 -11.625 -2.247 935 HD2 PHE 117 HD2 PHE 117 -7.267 -12.245 1.950 936 HE1 PHE 117 HE1 PHE 117 -8.825 -11.741 -2.738 937 HE2 PHE 117 HE2 PHE 117 -9.678 -12.482 1.424 938 HZ PHE 117 HZ PHE 117 -10.477 -12.203 -0.917 939 H ASP 118 H ASP 118 -3.816 -10.308 2.892 940 HA ASP 118 HA ASP 118 -6.181 -9.339 4.301 941 HB2 ASP 118 HB2 ASP 118 -3.311 -9.842 5.125 942 HB3 ASP 118 HB3 ASP 118 -4.573 -9.308 6.234 943 H PHE 119 H PHE 119 -3.224 -7.837 2.946 944 HA PHE 119 HA PHE 119 -3.629 -5.247 4.130 945 HB2 PHE 119 HB2 PHE 119 -1.499 -5.758 3.204 946 HB3 PHE 119 HB3 PHE 119 -2.163 -6.202 1.654 947 HD1 PHE 119 HD1 PHE 119 -0.934 -3.462 3.649 948 HD2 PHE 119 HD2 PHE 119 -3.113 -4.469 0.100 949 HE1 PHE 119 HE1 PHE 119 -0.655 -1.145 2.831 950 HE2 PHE 119 HE2 PHE 119 -2.711 -2.186 -0.801 951 HZ PHE 119 HZ PHE 119 -1.516 -0.506 0.589 952 H ASN 120 H ASN 120 -4.985 -6.921 1.322 953 HA ASN 120 HA ASN 120 -6.709 -4.714 0.507 954 HB2 ASN 120 HB2 ASN 120 -6.435 -6.134 -1.230 955 HB3 ASN 120 HB3 ASN 120 -6.329 -7.574 -0.226 956 HD21 ASN 120 HD21 ASN 120 -9.649 -8.485 -0.700 957 HD22 ASN 120 HD22 ASN 120 -8.096 -8.859 0.035 958 H VAL 121 H VAL 121 -7.450 -7.736 2.420 959 HA VAL 121 HA VAL 121 -10.123 -6.960 2.805 960 HB VAL 121 HB VAL 121 -8.398 -8.917 4.350 961 HG11 VAL 121 HG11 VAL 121 -11.403 -8.495 4.642 962 HG12 VAL 121 HG12 VAL 121 -10.507 -9.908 5.241 963 HG13 VAL 121 HG13 VAL 121 -10.175 -8.319 5.919 964 HG21 VAL 121 HG21 VAL 121 -9.733 -10.593 3.127 965 HG22 VAL 121 HG22 VAL 121 -10.681 -9.303 2.353 966 HG23 VAL 121 HG23 VAL 121 -8.959 -9.496 1.988 967 H SER 122 H SER 122 -7.347 -6.171 4.886 968 HA SER 122 HA SER 122 -8.869 -5.007 7.023 969 HB2 SER 122 HB2 SER 122 -6.774 -3.755 7.536 970 HB3 SER 122 HB3 SER 122 -6.560 -5.509 7.390 971 HG SER 122 HG SER 122 -5.601 -5.268 5.464 972 H LEU 123 H LEU 123 -8.154 -3.770 3.806 973 HA LEU 123 HA LEU 123 -9.323 -1.127 4.491 974 HB2 LEU 123 HB2 LEU 123 -8.253 -2.182 1.869 975 HB3 LEU 123 HB3 LEU 123 -8.818 -0.536 2.170 976 HG LEU 123 HG LEU 123 -6.441 -1.883 3.491 977 HD11 LEU 123 HD11 LEU 123 -6.419 0.419 1.541 978 HD12 LEU 123 HD12 LEU 123 -5.048 -0.557 2.124 979 HD13 LEU 123 HD13 LEU 123 -6.235 -1.284 1.045 980 HD21 LEU 123 HD21 LEU 123 -5.867 0.403 4.314 981 HD22 LEU 123 HD22 LEU 123 -7.442 0.985 3.731 982 HD23 LEU 123 HD23 LEU 123 -7.351 -0.220 5.035 983 H GLN 124 H GLN 124 -10.211 -4.120 2.693 984 HA GLN 124 HA GLN 124 -12.679 -3.147 1.643 985 HB2 GLN 124 HB2 GLN 124 -12.038 -5.944 2.658 986 HB3 GLN 124 HB3 GLN 124 -13.472 -5.520 1.747 987 HG2 GLN 124 HG2 GLN 124 -10.634 -5.242 0.697 988 HG3 GLN 124 HG3 GLN 124 -11.698 -6.594 0.373 989 HE21 GLN 124 HE21 GLN 124 -11.864 -4.336 -2.558 990 HE22 GLN 124 HE22 GLN 124 -10.612 -5.277 -1.738 991 H ASP 125 H ASP 125 -12.082 -4.717 4.858 992 HA ASP 125 HA ASP 125 -14.807 -4.211 5.754 993 HB2 ASP 125 HB2 ASP 125 -13.212 -6.023 6.567 994 HB3 ASP 125 HB3 ASP 125 -12.334 -4.745 7.430 995 H HIS 126 H HIS 126 -12.180 -2.092 5.394 996 HA HIS 126 HA HIS 126 -13.079 -0.206 7.506 997 HB2 HIS 126 HB2 HIS 126 -10.680 -0.355 7.142 998 HB3 HIS 126 HB3 HIS 126 -10.891 0.046 5.432 999 HD2 HIS 126 HD2 HIS 126 -11.901 1.739 8.822 1000 HE1 HIS 126 HE1 HIS 126 -10.818 4.811 6.076 1001 HE2 HIS 126 HE2 HIS 126 -11.709 4.342 8.396 1002 H PHE 127 H PHE 127 -13.230 -0.608 3.962 1003 HA PHE 127 HA PHE 127 -15.004 1.747 3.805 1004 HB2 PHE 127 HB2 PHE 127 -13.578 0.142 1.689 1005 HB3 PHE 127 HB3 PHE 127 -14.766 1.390 1.320 1006 HD1 PHE 127 HD1 PHE 127 -11.302 0.802 2.277 1007 HD2 PHE 127 HD2 PHE 127 -14.429 3.759 2.180 1008 HE1 PHE 127 HE1 PHE 127 -9.624 2.578 2.693 1009 HE2 PHE 127 HE2 PHE 127 -12.748 5.529 2.705 1010 HZ PHE 127 HZ PHE 127 -10.362 4.938 2.936 1011 H LYS 128 H LYS 128 -15.552 -1.624 4.146 1012 HA LYS 128 HA LYS 128 -17.913 -1.906 2.652 1013 HB2 LYS 128 HB2 LYS 128 -18.361 -3.879 3.800 1014 HB3 LYS 128 HB3 LYS 128 -16.630 -3.741 3.705 1015 HG2 LYS 128 HG2 LYS 128 -16.832 -4.462 5.847 1016 HG3 LYS 128 HG3 LYS 128 -16.874 -2.716 6.162 1017 HD2 LYS 128 HD2 LYS 128 -19.435 -2.975 6.077 1018 HD3 LYS 128 HD3 LYS 128 -19.157 -4.716 5.977 1019 HE2 LYS 128 HE2 LYS 128 -18.128 -2.963 8.238 1020 HE3 LYS 128 HE3 LYS 128 -19.732 -3.703 8.257 1021 HZ1 LYS 128 HZ1 LYS 128 -18.158 -5.109 9.416 1022 HZ2 LYS 128 HZ2 LYS 128 -18.646 -5.891 8.070 1023 HZ3 LYS 128 HZ3 LYS 128 -17.161 -5.199 8.133 1024 H TRP 129 H TRP 129 -17.551 -0.258 5.681 1025 HA TRP 129 HA TRP 129 -20.493 0.155 5.950 1026 HB2 TRP 129 HB2 TRP 129 -19.911 0.962 8.202 1027 HB3 TRP 129 HB3 TRP 129 -19.455 -0.701 7.898 1028 HD1 TRP 129 HD1 TRP 129 -16.859 -1.342 8.021 1029 HE1 TRP 129 HE1 TRP 129 -14.800 -0.122 8.768 1030 HE3 TRP 129 HE3 TRP 129 -18.784 3.403 8.257 1031 HZ2 TRP 129 HZ2 TRP 129 -14.002 2.621 9.399 1032 HZ3 TRP 129 HZ3 TRP 129 -17.317 5.323 8.873 1033 HH2 TRP 129 HH2 TRP 129 -14.921 4.945 9.406 1034 H VAL 130 H VAL 130 -18.266 1.529 4.168 1035 HA VAL 130 HA VAL 130 -19.036 4.406 4.539 1036 HB VAL 130 HB VAL 130 -16.564 3.177 3.261 1037 HG11 VAL 130 HG11 VAL 130 -15.577 5.432 3.461 1038 HG12 VAL 130 HG12 VAL 130 -16.838 5.391 2.286 1039 HG13 VAL 130 HG13 VAL 130 -17.183 6.084 3.897 1040 HG21 VAL 130 HG21 VAL 130 -16.860 4.604 5.942 1041 HG22 VAL 130 HG22 VAL 130 -16.525 2.876 5.734 1042 HG23 VAL 130 HG23 VAL 130 -15.331 4.054 5.226 1043 H LYS 131 H LYS 131 -18.704 5.442 2.160 1044 HA LYS 131 HA LYS 131 -18.992 5.597 -0.052 1045 HB2 LYS 131 HB2 LYS 131 -17.079 4.043 0.494 1046 HB3 LYS 131 HB3 LYS 131 -18.097 2.689 0.030 1047 HG2 LYS 131 HG2 LYS 131 -18.038 3.265 -2.240 1048 HG3 LYS 131 HG3 LYS 131 -17.605 4.961 -1.916 1049 HD2 LYS 131 HD2 LYS 131 -15.414 4.421 -1.236 1050 HD3 LYS 131 HD3 LYS 131 -15.747 2.686 -1.100 1051 HE2 LYS 131 HE2 LYS 131 -16.079 4.116 -3.742 1052 HE3 LYS 131 HE3 LYS 131 -14.463 3.626 -3.198 1053 HZ1 LYS 131 HZ1 LYS 131 -16.728 1.695 -3.402 1054 HZ2 LYS 131 HZ2 LYS 131 -15.613 1.915 -4.583 1055 HZ3 LYS 131 HZ3 LYS 131 -15.150 1.361 -3.110 1056 H GLN 132 H GLN 132 -21.348 4.320 1.351 1057 HA GLN 132 HA GLN 132 -23.501 3.811 0.874 1058 HB2 GLN 132 HB2 GLN 132 -23.206 5.229 -1.767 1059 HB3 GLN 132 HB3 GLN 132 -24.573 5.208 -0.658 1060 HG2 GLN 132 HG2 GLN 132 -21.965 6.747 -0.426 1061 HG3 GLN 132 HG3 GLN 132 -23.592 7.388 -0.541 1062 HE21 GLN 132 HE21 GLN 132 -22.043 6.936 3.093 1063 HE22 GLN 132 HE22 GLN 132 -21.107 7.037 1.608 1064 H GLU 133 H GLU 133 -21.704 1.722 0.121 1065 HA GLU 133 HA GLU 133 -23.129 0.382 -2.127 1066 HB2 GLU 133 HB2 GLU 133 -20.432 -0.161 -0.841 1067 HB3 GLU 133 HB3 GLU 133 -21.228 -1.280 -1.954 1068 HG2 GLU 133 HG2 GLU 133 -21.291 0.477 -3.706 1069 HG3 GLU 133 HG3 GLU 133 -20.469 1.593 -2.621 1070 H1 SER 149 H1 SER 149 8.134 -20.730 -12.558 1071 H2 SER 149 H2 SER 149 8.633 -19.199 -12.230 1072 H3 SER 149 H3 SER 149 8.362 -20.266 -11.007 1073 HA SER 149 HA SER 149 10.685 -20.115 -11.250 1074 HB2 SER 149 HB2 SER 149 11.255 -22.466 -11.938 1075 HB3 SER 149 HB3 SER 149 9.979 -22.332 -10.716 1076 HG SER 149 HG SER 149 9.388 -23.793 -12.369 1077 H GLN 150 H GLN 150 9.956 -21.794 -14.347 1078 HA GLN 150 HA GLN 150 11.980 -20.282 -15.779 1079 HB2 GLN 150 HB2 GLN 150 11.300 -22.629 -16.272 1080 HB3 GLN 150 HB3 GLN 150 9.730 -22.044 -16.842 1081 HG2 GLN 150 HG2 GLN 150 10.857 -20.761 -18.642 1082 HG3 GLN 150 HG3 GLN 150 12.438 -21.250 -18.019 1083 HE21 GLN 150 HE21 GLN 150 10.198 -23.957 -20.176 1084 HE22 GLN 150 HE22 GLN 150 9.421 -22.513 -19.542 1085 H ILE 151 H ILE 151 8.451 -20.072 -15.532 1086 HA ILE 151 HA ILE 151 8.387 -17.442 -16.925 1087 HB ILE 151 HB ILE 151 6.144 -19.147 -15.781 1088 HG12 ILE 151 HG12 ILE 151 6.944 -18.571 -18.676 1089 HG13 ILE 151 HG13 ILE 151 7.220 -20.092 -17.830 1090 HG21 ILE 151 HG21 ILE 151 6.000 -16.539 -17.373 1091 HG22 ILE 151 HG22 ILE 151 4.610 -17.538 -16.889 1092 HG23 ILE 151 HG23 ILE 151 5.563 -16.748 -15.661 1093 HD11 ILE 151 HD11 ILE 151 4.737 -20.356 -17.548 1094 HD12 ILE 151 HD12 ILE 151 4.524 -18.950 -18.625 1095 HD13 ILE 151 HD13 ILE 151 5.324 -20.408 -19.221 1096 H THR 152 H THR 152 7.856 -15.548 -15.810 1097 HA THR 152 HA THR 152 8.803 -15.297 -13.081 1098 HB THR 152 HB THR 152 8.133 -12.910 -13.378 1099 HG1 THR 152 HG1 THR 152 7.378 -12.329 -15.463 1100 HG21 THR 152 HG21 THR 152 10.351 -13.694 -14.199 1101 HG22 THR 152 HG22 THR 152 9.640 -13.965 -15.807 1102 HG23 THR 152 HG23 THR 152 9.702 -12.326 -15.118 1103 H SER 153 H SER 153 7.487 -13.956 -11.490 1104 HA SER 153 HA SER 153 4.943 -15.224 -10.937 1105 HB2 SER 153 HB2 SER 153 6.359 -12.961 -9.510 1106 HB3 SER 153 HB3 SER 153 5.001 -13.910 -8.861 1107 HG SER 153 HG SER 153 7.085 -14.646 -8.118 1108 H GLN 154 H GLN 154 4.809 -13.918 -13.251 1109 HA GLN 154 HA GLN 154 3.850 -11.336 -13.408 1110 HB2 GLN 154 HB2 GLN 154 2.520 -12.206 -15.487 1111 HB3 GLN 154 HB3 GLN 154 4.267 -12.083 -15.465 1112 HG2 GLN 154 HG2 GLN 154 3.496 -14.114 -16.585 1113 HG3 GLN 154 HG3 GLN 154 4.554 -14.447 -15.238 1114 HE21 GLN 154 HE21 GLN 154 2.160 -16.538 -13.661 1115 HE22 GLN 154 HE22 GLN 154 3.845 -16.021 -13.784 1116 H VAL 155 H VAL 155 2.005 -10.216 -13.258 1117 HA VAL 155 HA VAL 155 0.228 -11.134 -11.251 1118 HB VAL 155 HB VAL 155 0.909 -8.898 -11.235 1119 HG11 VAL 155 HG11 VAL 155 1.417 -8.347 -13.454 1120 HG12 VAL 155 HG12 VAL 155 -0.259 -8.611 -14.001 1121 HG13 VAL 155 HG13 VAL 155 0.133 -7.234 -12.961 1122 HG21 VAL 155 HG21 VAL 155 -1.199 -8.956 -10.168 1123 HG22 VAL 155 HG22 VAL 155 -1.270 -7.590 -11.231 1124 HG23 VAL 155 HG23 VAL 155 -2.058 -9.077 -11.733 1125 H TPO 156 H T2P 156 -1.657 -11.890 -11.255 1126 HA TPO 156 HA T2P 156 -1.713 -13.853 -13.245 1127 HB TPO 156 HB T2P 156 -1.632 -13.824 -10.791 1128 HG21 TPO 156 HG21 T2P 156 -3.549 -13.993 -9.466 1129 HG22 TPO 156 HG22 T2P 156 -4.501 -14.674 -10.800 1130 HG23 TPO 156 HG23 T2P 156 -4.118 -12.931 -10.785 1131 H GLY 157 H GLY 157 -3.123 -11.778 -13.854 1132 HA2 GLY 157 HA2 GLY 157 -5.865 -11.790 -14.470 1133 HA3 GLY 157 HA3 GLY 157 -4.652 -11.048 -15.525 1134 H GLN 158 H GLN 158 -3.757 -14.144 -15.506 1135 HA GLN 158 HA GLN 158 -5.354 -15.322 -17.629 1136 HB2 GLN 158 HB2 GLN 158 -4.345 -17.403 -16.905 1137 HB3 GLN 158 HB3 GLN 158 -3.135 -16.147 -17.125 1138 HG2 GLN 158 HG2 GLN 158 -2.936 -15.880 -14.649 1139 HG3 GLN 158 HG3 GLN 158 -4.189 -17.083 -14.405 1140 HE21 GLN 158 HE21 GLN 158 -1.084 -19.046 -14.076 1141 HE22 GLN 158 HE22 GLN 158 -2.011 -17.945 -13.077 1142 H ILE 159 H ILE 159 -5.901 -14.646 -14.267 1143 HA ILE 159 HA ILE 159 -8.600 -15.820 -14.431 1144 HB ILE 159 HB ILE 159 -7.234 -17.761 -13.796 1145 HG12 ILE 159 HG12 ILE 159 -9.101 -16.886 -11.558 1146 HG13 ILE 159 HG13 ILE 159 -9.624 -17.480 -13.136 1147 HG21 ILE 159 HG21 ILE 159 -6.651 -16.389 -11.144 1148 HG22 ILE 159 HG22 ILE 159 -6.132 -17.995 -11.666 1149 HG23 ILE 159 HG23 ILE 159 -5.467 -16.576 -12.455 1150 HD11 ILE 159 HD11 ILE 159 -8.456 -19.644 -12.693 1151 HD12 ILE 159 HD12 ILE 159 -8.060 -19.061 -11.058 1152 HD13 ILE 159 HD13 ILE 159 -9.749 -19.280 -11.532 1153 H GLY 160 H GLY 160 -6.278 -14.182 -12.279 1154 HA2 GLY 160 HA2 GLY 160 -6.559 -12.309 -10.940 1155 HA3 GLY 160 HA3 GLY 160 -8.125 -12.028 -11.716 1156 H TRP 161 H TRP 161 -6.760 -14.535 -9.585 1157 HA TRP 161 HA TRP 161 -9.200 -14.565 -7.914 1158 HB2 TRP 161 HB2 TRP 161 -8.663 -16.808 -7.409 1159 HB3 TRP 161 HB3 TRP 161 -8.631 -16.536 -9.139 1160 HD1 TRP 161 HD1 TRP 161 -5.400 -15.307 -8.347 1161 HE1 TRP 161 HE1 TRP 161 -3.629 -17.058 -8.960 1162 HE3 TRP 161 HE3 TRP 161 -8.320 -19.485 -8.086 1163 HZ2 TRP 161 HZ2 TRP 161 -3.461 -19.923 -9.117 1164 HZ3 TRP 161 HZ3 TRP 161 -7.318 -21.746 -8.436 1165 HH2 TRP 161 HH2 TRP 161 -4.899 -21.976 -8.963 1166 H ARG 162 H ARG 162 -7.318 -16.155 -6.034 1167 HA ARG 162 HA ARG 162 -7.263 -13.858 -4.090 1168 HB2 ARG 162 HB2 ARG 162 -8.596 -16.595 -3.833 1169 HB3 ARG 162 HB3 ARG 162 -8.727 -15.269 -2.677 1170 HG2 ARG 162 HG2 ARG 162 -9.817 -15.240 -5.529 1171 HG3 ARG 162 HG3 ARG 162 -10.752 -15.553 -4.072 1172 HD2 ARG 162 HD2 ARG 162 -10.362 -13.329 -3.223 1173 HD3 ARG 162 HD3 ARG 162 -9.228 -12.948 -4.515 1174 HE ARG 162 HE ARG 162 -12.193 -13.214 -4.731 1175 HH11 ARG 162 HH11 ARG 162 -13.209 -12.445 -6.551 1176 HH12 ARG 162 HH12 ARG 162 -12.264 -11.772 -7.849 1177 HH21 ARG 162 HH21 ARG 162 -9.216 -12.322 -6.401 1178 HH22 ARG 162 HH22 ARG 162 -10.075 -11.902 -7.847 1179 H ARG 163 H ARG 163 -6.829 -14.944 -1.770 1180 HA ARG 163 HA ARG 163 -4.149 -16.140 -1.754 1181 HB2 ARG 163 HB2 ARG 163 -4.313 -16.123 0.648 1182 HB3 ARG 163 HB3 ARG 163 -4.712 -14.548 -0.020 1183 HG2 ARG 163 HG2 ARG 163 -7.112 -14.935 0.372 1184 HG3 ARG 163 HG3 ARG 163 -6.792 -16.577 0.935 1185 HD2 ARG 163 HD2 ARG 163 -5.723 -14.066 2.288 1186 HD3 ARG 163 HD3 ARG 163 -7.195 -14.916 2.767 1187 HE ARG 163 HE ARG 163 -5.342 -16.915 2.834 1188 HH11 ARG 163 HH11 ARG 163 -4.096 -17.548 4.538 1189 HH12 ARG 163 HH12 ARG 163 -3.714 -16.420 5.804 1190 HH21 ARG 163 HH21 ARG 163 -5.376 -13.745 4.473 1191 HH22 ARG 163 HH22 ARG 163 -4.376 -14.340 5.731 Start of MODEL 29 1 H1 GLY -4 H1 GLY -4 4.250 13.951 28.537 2 H2 GLY -4 H2 GLY -4 3.096 13.402 27.513 3 H3 GLY -4 H3 GLY -4 2.847 14.779 28.369 4 HA2 GLY -4 HA2 GLY -4 4.886 14.426 26.266 5 HA3 GLY -4 HA3 GLY -4 3.357 15.301 26.068 6 H SER -3 H SER -3 6.279 16.165 25.938 7 HA SER -3 HA SER -3 6.641 17.988 28.189 8 HB2 SER -3 HB2 SER -3 8.726 18.588 27.055 9 HB3 SER -3 HB3 SER -3 8.541 16.833 27.172 10 HG SER -3 HG SER -3 9.207 17.399 25.088 11 HA PRO -2 HA PRO -2 4.804 21.612 26.311 12 HB2 PRO -2 HB2 PRO -2 6.239 23.674 27.388 13 HB3 PRO -2 HB3 PRO -2 5.136 22.649 28.355 14 HG2 PRO -2 HG2 PRO -2 8.144 22.350 28.037 15 HG3 PRO -2 HG3 PRO -2 7.197 22.409 29.561 16 HD2 PRO -2 HD2 PRO -2 7.927 20.051 28.454 17 HD3 PRO -2 HD3 PRO -2 6.318 20.240 29.205 18 H ASN -1 H ASN -1 8.028 20.675 25.599 19 HA ASN -1 HA ASN -1 8.616 22.781 23.648 20 HB2 ASN -1 HB2 ASN -1 10.022 20.185 24.411 21 HB3 ASN -1 HB3 ASN -1 10.648 21.348 23.249 22 HD21 ASN -1 HD21 ASN -1 12.331 22.072 26.443 23 HD22 ASN -1 HD22 ASN -1 12.248 20.707 25.337 24 H SER 0 H SER 0 6.483 20.247 23.471 25 HA SER 0 HA SER 0 6.694 20.058 20.505 26 HB2 SER 0 HB2 SER 0 7.751 18.060 21.598 27 HB3 SER 0 HB3 SER 0 6.182 17.688 22.339 28 HG SER 0 HG SER 0 6.569 16.582 20.322 29 H MET 1 H MET 1 4.702 19.268 19.504 30 HA MET 1 HA MET 1 2.368 20.647 20.635 31 HB2 MET 1 HB2 MET 1 2.763 19.311 17.934 32 HB3 MET 1 HB3 MET 1 1.361 20.268 18.410 33 HG2 MET 1 HG2 MET 1 4.217 21.250 18.118 34 HG3 MET 1 HG3 MET 1 2.862 21.605 17.059 35 HE1 MET 1 HE1 MET 1 0.474 22.286 19.220 36 HE2 MET 1 HE2 MET 1 0.669 24.050 19.232 37 HE3 MET 1 HE3 MET 1 0.808 23.157 17.702 38 H ALA 2 H ALA 2 2.987 18.457 22.197 39 HA ALA 2 HA ALA 2 1.598 16.048 21.568 40 HB1 ALA 2 HB1 ALA 2 2.031 15.522 23.937 41 HB2 ALA 2 HB2 ALA 2 3.461 16.254 23.182 42 HB3 ALA 2 HB3 ALA 2 2.424 17.226 24.258 43 H THR 3 H THR 3 0.270 19.061 22.491 44 HA THR 3 HA THR 3 -2.151 18.071 23.798 45 HB THR 3 HB THR 3 -2.814 20.474 23.710 46 HG1 THR 3 HG1 THR 3 -1.296 21.941 22.913 47 HG21 THR 3 HG21 THR 3 -1.109 21.309 25.233 48 HG22 THR 3 HG22 THR 3 -1.399 19.592 25.575 49 HG23 THR 3 HG23 THR 3 0.052 20.084 24.673 50 H GLU 4 H GLU 4 -1.177 18.309 20.584 51 HA GLU 4 HA GLU 4 -3.688 18.988 19.323 52 HB2 GLU 4 HB2 GLU 4 -1.546 19.242 18.191 53 HB3 GLU 4 HB3 GLU 4 -1.276 17.494 18.228 54 HG2 GLU 4 HG2 GLU 4 -3.096 17.093 16.671 55 HG3 GLU 4 HG3 GLU 4 -3.693 18.737 16.866 56 H LEU 5 H LEU 5 -5.383 17.796 18.727 57 HA LEU 5 HA LEU 5 -5.655 15.084 19.732 58 HB2 LEU 5 HB2 LEU 5 -7.335 17.300 19.488 59 HB3 LEU 5 HB3 LEU 5 -7.959 16.217 18.258 60 HG LEU 5 HG LEU 5 -7.469 15.525 21.186 61 HD11 LEU 5 HD11 LEU 5 -10.080 16.081 19.711 62 HD12 LEU 5 HD12 LEU 5 -9.925 15.590 21.414 63 HD13 LEU 5 HD13 LEU 5 -9.294 17.157 20.889 64 HD21 LEU 5 HD21 LEU 5 -8.919 13.925 19.030 65 HD22 LEU 5 HD22 LEU 5 -7.384 13.485 19.807 66 HD23 LEU 5 HD23 LEU 5 -8.870 13.516 20.760 67 H GLU 6 H GLU 6 -3.856 15.477 17.417 68 HA GLU 6 HA GLU 6 -5.116 14.289 15.110 69 HB2 GLU 6 HB2 GLU 6 -2.299 14.979 15.846 70 HB3 GLU 6 HB3 GLU 6 -2.550 13.794 14.569 71 HG2 GLU 6 HG2 GLU 6 -3.900 16.520 14.526 72 HG3 GLU 6 HG3 GLU 6 -2.321 16.201 13.807 73 H TYR 7 H TYR 7 -5.330 12.093 14.572 74 HA TYR 7 HA TYR 7 -3.856 10.044 16.034 75 HB2 TYR 7 HB2 TYR 7 -5.631 8.994 17.104 76 HB3 TYR 7 HB3 TYR 7 -5.884 10.684 17.477 77 HD1 TYR 7 HD1 TYR 7 -7.287 7.678 16.018 78 HD2 TYR 7 HD2 TYR 7 -7.710 11.970 16.208 79 HE1 TYR 7 HE1 TYR 7 -9.596 7.477 15.150 80 HE2 TYR 7 HE2 TYR 7 -10.045 11.767 15.349 81 HH TYR 7 HH TYR 7 -11.520 8.593 14.567 82 H GLU 8 H GLU 8 -4.644 7.850 15.497 83 HA GLU 8 HA GLU 8 -6.280 7.311 13.246 84 HB2 GLU 8 HB2 GLU 8 -4.656 6.112 11.857 85 HB3 GLU 8 HB3 GLU 8 -4.427 7.838 11.794 86 HG2 GLU 8 HG2 GLU 8 -2.737 6.191 13.698 87 HG3 GLU 8 HG3 GLU 8 -2.371 6.199 11.992 88 H SER 9 H SER 9 -7.171 5.387 13.545 89 HA SER 9 HA SER 9 -6.295 3.742 15.825 90 HB2 SER 9 HB2 SER 9 -8.787 3.807 14.110 91 HB3 SER 9 HB3 SER 9 -8.512 2.606 15.392 92 HG SER 9 HG SER 9 -9.690 4.427 16.163 93 H VAL 10 H VAL 10 -5.252 1.764 15.590 94 HA VAL 10 HA VAL 10 -4.352 0.992 12.977 95 HB VAL 10 HB VAL 10 -4.242 -0.607 15.518 96 HG11 VAL 10 HG11 VAL 10 -2.565 -0.810 12.971 97 HG12 VAL 10 HG12 VAL 10 -2.256 -1.701 14.482 98 HG13 VAL 10 HG13 VAL 10 -3.721 -2.024 13.570 99 HG21 VAL 10 HG21 VAL 10 -3.126 1.593 15.814 100 HG22 VAL 10 HG22 VAL 10 -1.956 0.281 15.791 101 HG23 VAL 10 HG23 VAL 10 -2.162 1.299 14.352 102 H LEU 11 H LEU 11 -4.969 -0.478 11.550 103 HA LEU 11 HA LEU 11 -7.452 -2.083 12.038 104 HB2 LEU 11 HB2 LEU 11 -6.330 -0.941 9.455 105 HB3 LEU 11 HB3 LEU 11 -7.767 -1.942 9.598 106 HG LEU 11 HG LEU 11 -7.456 0.869 10.732 107 HD11 LEU 11 HD11 LEU 11 -7.608 0.888 8.324 108 HD12 LEU 11 HD12 LEU 11 -8.922 -0.305 8.339 109 HD13 LEU 11 HD13 LEU 11 -9.195 1.329 8.963 110 HD21 LEU 11 HD21 LEU 11 -9.908 0.692 11.143 111 HD22 LEU 11 HD22 LEU 11 -9.850 -1.030 10.708 112 HD23 LEU 11 HD23 LEU 11 -8.986 -0.423 12.146 113 H CYS 12 H CYS 12 -4.227 -2.111 10.427 114 HA CYS 12 HA CYS 12 -4.065 -5.000 10.858 115 HB2 CYS 12 HB2 CYS 12 -5.215 -4.788 8.677 116 HB3 CYS 12 HB3 CYS 12 -3.835 -3.883 8.038 117 HG CYS 12 HG CYS 12 -4.023 -6.996 9.178 118 H VAL 13 H VAL 13 -2.004 -5.839 10.816 119 HA VAL 13 HA VAL 13 0.291 -4.100 10.251 120 HB VAL 13 HB VAL 13 -0.085 -3.754 12.600 121 HG11 VAL 13 HG11 VAL 13 -1.284 -5.827 13.227 122 HG12 VAL 13 HG12 VAL 13 0.241 -6.732 13.106 123 HG13 VAL 13 HG13 VAL 13 0.057 -5.448 14.311 124 HG21 VAL 13 HG21 VAL 13 2.084 -4.371 13.492 125 HG22 VAL 13 HG22 VAL 13 2.321 -5.579 12.213 126 HG23 VAL 13 HG23 VAL 13 2.253 -3.847 11.816 127 H LYS 14 H LYS 14 1.651 -5.162 8.966 128 HA LYS 14 HA LYS 14 1.608 -8.144 9.002 129 HB2 LYS 14 HB2 LYS 14 1.065 -6.448 6.759 130 HB3 LYS 14 HB3 LYS 14 2.583 -7.273 6.449 131 HG2 LYS 14 HG2 LYS 14 0.787 -8.574 5.532 132 HG3 LYS 14 HG3 LYS 14 1.430 -9.453 6.914 133 HD2 LYS 14 HD2 LYS 14 -0.489 -8.356 8.278 134 HD3 LYS 14 HD3 LYS 14 -1.114 -7.826 6.705 135 HE2 LYS 14 HE2 LYS 14 -2.305 -9.761 7.461 136 HE3 LYS 14 HE3 LYS 14 -1.378 -10.147 6.012 137 HZ1 LYS 14 HZ1 LYS 14 0.179 -11.353 7.307 138 HZ2 LYS 14 HZ2 LYS 14 -0.457 -10.829 8.749 139 HZ3 LYS 14 HZ3 LYS 14 -1.292 -11.853 7.782 140 HA PRO 15 HA PRO 15 5.627 -7.902 10.496 141 HB2 PRO 15 HB2 PRO 15 6.574 -10.458 10.004 142 HB3 PRO 15 HB3 PRO 15 5.331 -10.054 11.223 143 HG2 PRO 15 HG2 PRO 15 4.866 -11.024 8.367 144 HG3 PRO 15 HG3 PRO 15 4.135 -11.657 9.883 145 HD2 PRO 15 HD2 PRO 15 2.832 -9.939 8.367 146 HD3 PRO 15 HD3 PRO 15 2.804 -9.740 10.144 147 H ASP 16 H ASP 16 5.408 -8.801 7.069 148 HA ASP 16 HA ASP 16 7.928 -7.349 6.577 149 HB2 ASP 16 HB2 ASP 16 8.628 -9.704 6.741 150 HB3 ASP 16 HB3 ASP 16 7.429 -10.155 5.523 151 H VAL 17 H VAL 17 7.935 -6.194 4.728 152 HA VAL 17 HA VAL 17 6.090 -6.724 2.528 153 HB VAL 17 HB VAL 17 4.654 -5.417 4.024 154 HG11 VAL 17 HG11 VAL 17 6.678 -3.165 3.815 155 HG12 VAL 17 HG12 VAL 17 5.067 -3.078 4.552 156 HG13 VAL 17 HG13 VAL 17 6.308 -4.115 5.268 157 HG21 VAL 17 HG21 VAL 17 4.441 -5.170 1.570 158 HG22 VAL 17 HG22 VAL 17 3.928 -3.736 2.470 159 HG23 VAL 17 HG23 VAL 17 5.497 -3.737 1.645 160 H SER 18 H SER 18 6.870 -5.945 0.601 161 HA SER 18 HA SER 18 9.382 -4.329 0.685 162 HB2 SER 18 HB2 SER 18 10.240 -5.548 -1.173 163 HB3 SER 18 HB3 SER 18 9.839 -6.658 0.135 164 HG SER 18 HG SER 18 7.726 -6.850 -1.139 165 H VAL 19 H VAL 19 9.723 -2.750 -0.821 166 HA VAL 19 HA VAL 19 7.277 -1.758 -2.238 167 HB VAL 19 HB VAL 19 9.246 -0.285 -0.511 168 HG11 VAL 19 HG11 VAL 19 7.235 0.857 -2.475 169 HG12 VAL 19 HG12 VAL 19 7.975 1.789 -1.169 170 HG13 VAL 19 HG13 VAL 19 8.992 1.149 -2.443 171 HG21 VAL 19 HG21 VAL 19 7.167 0.364 0.654 172 HG22 VAL 19 HG22 VAL 19 6.198 -0.519 -0.534 173 HG23 VAL 19 HG23 VAL 19 7.273 -1.391 0.571 174 H TYR 20 H TYR 20 7.424 -0.833 -4.100 175 HA TYR 20 HA TYR 20 9.995 -0.832 -5.634 176 HB2 TYR 20 HB2 TYR 20 7.285 -1.904 -6.547 177 HB3 TYR 20 HB3 TYR 20 8.792 -1.946 -7.442 178 HD1 TYR 20 HD1 TYR 20 6.993 -3.304 -4.452 179 HD2 TYR 20 HD2 TYR 20 10.306 -3.806 -7.158 180 HE1 TYR 20 HE1 TYR 20 7.486 -5.525 -3.454 181 HE2 TYR 20 HE2 TYR 20 10.682 -6.092 -6.241 182 HH TYR 20 HH TYR 20 8.957 -7.258 -3.375 183 H ARG 21 H ARG 21 9.973 1.560 -5.389 184 HA ARG 21 HA ARG 21 7.961 3.342 -6.247 185 HB2 ARG 21 HB2 ARG 21 10.993 3.478 -6.562 186 HB3 ARG 21 HB3 ARG 21 9.916 4.796 -7.032 187 HG2 ARG 21 HG2 ARG 21 9.040 4.940 -4.738 188 HG3 ARG 21 HG3 ARG 21 10.146 3.662 -4.206 189 HD2 ARG 21 HD2 ARG 21 12.065 5.086 -4.656 190 HD3 ARG 21 HD3 ARG 21 11.064 6.251 -5.519 191 HE ARG 21 HE ARG 21 10.147 7.067 -3.503 192 HH11 ARG 21 HH11 ARG 21 10.319 7.682 -1.495 193 HH12 ARG 21 HH12 ARG 21 11.421 6.892 -0.383 194 HH21 ARG 21 HH21 ARG 21 12.511 4.545 -2.692 195 HH22 ARG 21 HH22 ARG 21 12.666 5.177 -1.078 196 H ILE 22 H ILE 22 7.033 3.941 -8.134 197 HA ILE 22 HA ILE 22 7.933 2.525 -10.605 198 HB ILE 22 HB ILE 22 5.649 2.265 -11.295 199 HG12 ILE 22 HG12 ILE 22 4.918 3.669 -8.712 200 HG13 ILE 22 HG13 ILE 22 4.447 4.072 -10.369 201 HG21 ILE 22 HG21 ILE 22 5.888 1.174 -8.519 202 HG22 ILE 22 HG22 ILE 22 5.092 0.464 -9.908 203 HG23 ILE 22 HG23 ILE 22 6.861 0.559 -9.877 204 HD11 ILE 22 HD11 ILE 22 3.135 1.906 -10.423 205 HD12 ILE 22 HD12 ILE 22 3.449 1.765 -8.675 206 HD13 ILE 22 HD13 ILE 22 2.545 3.154 -9.305 207 HA PRO 23 HA PRO 23 7.542 6.504 -12.643 208 HB2 PRO 23 HB2 PRO 23 8.163 5.708 -15.228 209 HB3 PRO 23 HB3 PRO 23 9.310 6.178 -13.946 210 HG2 PRO 23 HG2 PRO 23 8.605 3.434 -14.904 211 HG3 PRO 23 HG3 PRO 23 10.140 4.038 -14.241 212 HD2 PRO 23 HD2 PRO 23 8.246 2.538 -12.822 213 HD3 PRO 23 HD3 PRO 23 9.502 3.565 -12.084 214 HA PRO 24 HA PRO 24 4.025 5.472 -15.661 215 HB2 PRO 24 HB2 PRO 24 2.711 3.082 -15.714 216 HB3 PRO 24 HB3 PRO 24 4.253 3.365 -16.579 217 HG2 PRO 24 HG2 PRO 24 3.875 2.137 -13.820 218 HG3 PRO 24 HG3 PRO 24 4.793 1.467 -15.211 219 HD2 PRO 24 HD2 PRO 24 6.044 2.860 -13.282 220 HD3 PRO 24 HD3 PRO 24 6.492 3.095 -14.993 221 H ARG 25 H ARG 25 1.747 5.584 -15.579 222 HA ARG 25 HA ARG 25 0.384 5.404 -12.922 223 HB2 ARG 25 HB2 ARG 25 -0.707 7.515 -13.284 224 HB3 ARG 25 HB3 ARG 25 1.041 7.744 -13.331 225 HG2 ARG 25 HG2 ARG 25 0.994 7.854 -15.799 226 HG3 ARG 25 HG3 ARG 25 -0.746 7.518 -15.807 227 HD2 ARG 25 HD2 ARG 25 -1.197 9.580 -14.578 228 HD3 ARG 25 HD3 ARG 25 0.526 9.950 -14.480 229 HE ARG 25 HE ARG 25 -1.260 10.224 -16.808 230 HH11 ARG 25 HH11 ARG 25 -0.539 11.270 -18.622 231 HH12 ARG 25 HH12 ARG 25 1.154 11.616 -18.816 232 HH21 ARG 25 HH21 ARG 25 2.115 10.207 -15.842 233 HH22 ARG 25 HH22 ARG 25 2.621 11.032 -17.290 234 H ALA 26 H ALA 26 0.072 4.924 -16.351 235 HA ALA 26 HA ALA 26 -2.466 3.510 -15.942 236 HB1 ALA 26 HB1 ALA 26 -3.154 5.882 -15.941 237 HB2 ALA 26 HB2 ALA 26 -2.336 6.133 -17.495 238 HB3 ALA 26 HB3 ALA 26 -3.740 5.034 -17.394 239 H SER 27 H SER 27 -1.912 1.762 -16.916 240 HA SER 27 HA SER 27 -1.631 1.922 -19.898 241 HB2 SER 27 HB2 SER 27 -0.898 -0.297 -19.988 242 HB3 SER 27 HB3 SER 27 0.080 0.481 -18.735 243 HG SER 27 HG SER 27 -1.140 -0.506 -17.174 244 H ASN 28 H ASN 28 -2.999 0.200 -21.000 245 HA ASN 28 HA ASN 28 -5.772 0.497 -20.263 246 HB2 ASN 28 HB2 ASN 28 -6.207 -0.907 -22.202 247 HB3 ASN 28 HB3 ASN 28 -4.980 0.293 -22.593 248 HD21 ASN 28 HD21 ASN 28 -3.928 -3.682 -22.427 249 HD22 ASN 28 HD22 ASN 28 -5.369 -3.136 -21.575 250 H ARG 29 H ARG 29 -3.397 -1.801 -19.250 251 HA ARG 29 HA ARG 29 -5.370 -3.782 -18.229 252 HB2 ARG 29 HB2 ARG 29 -2.397 -3.694 -18.497 253 HB3 ARG 29 HB3 ARG 29 -3.135 -4.784 -17.319 254 HG2 ARG 29 HG2 ARG 29 -4.295 -6.036 -18.903 255 HG3 ARG 29 HG3 ARG 29 -4.347 -4.710 -20.068 256 HD2 ARG 29 HD2 ARG 29 -2.866 -6.321 -20.919 257 HD3 ARG 29 HD3 ARG 29 -1.964 -4.871 -20.425 258 HE ARG 29 HE ARG 29 -2.067 -6.956 -18.366 259 HH11 ARG 29 HH11 ARG 29 -0.249 -8.098 -17.796 260 HH12 ARG 29 HH12 ARG 29 1.146 -8.082 -18.832 261 HH21 ARG 29 HH21 ARG 29 -0.249 -6.071 -21.225 262 HH22 ARG 29 HH22 ARG 29 1.159 -6.957 -20.715 263 H GLY 30 H GLY 30 -3.131 -1.355 -17.102 264 HA2 GLY 30 HA2 GLY 30 -4.379 0.002 -15.270 265 HA3 GLY 30 HA3 GLY 30 -4.155 -1.476 -14.312 266 H TYR 31 H TYR 31 -2.228 -1.827 -13.352 267 HA TYR 31 HA TYR 31 0.078 0.023 -13.962 268 HB2 TYR 31 HB2 TYR 31 -0.894 -1.188 -11.370 269 HB3 TYR 31 HB3 TYR 31 0.768 -0.651 -11.570 270 HD1 TYR 31 HD1 TYR 31 -2.737 0.373 -11.366 271 HD2 TYR 31 HD2 TYR 31 1.343 1.664 -11.896 272 HE1 TYR 31 HE1 TYR 31 -3.433 2.724 -10.908 273 HE2 TYR 31 HE2 TYR 31 0.693 4.002 -11.299 274 HH TYR 31 HH TYR 31 -2.710 4.890 -10.542 275 H ARG 32 H ARG 32 -0.877 -3.284 -13.452 276 HA ARG 32 HA ARG 32 0.208 -5.223 -13.203 277 HB2 ARG 32 HB2 ARG 32 0.630 -6.147 -15.231 278 HB3 ARG 32 HB3 ARG 32 -0.518 -4.854 -15.530 279 HG2 ARG 32 HG2 ARG 32 2.352 -4.704 -16.248 280 HG3 ARG 32 HG3 ARG 32 1.004 -5.222 -17.273 281 HD2 ARG 32 HD2 ARG 32 -0.040 -3.018 -17.149 282 HD3 ARG 32 HD3 ARG 32 1.292 -2.431 -16.154 283 HE ARG 32 HE ARG 32 2.830 -2.650 -17.976 284 HH11 ARG 32 HH11 ARG 32 3.366 -2.362 -19.918 285 HH12 ARG 32 HH12 ARG 32 2.213 -2.429 -21.250 286 HH21 ARG 32 HH21 ARG 32 -0.467 -2.716 -19.095 287 HH22 ARG 32 HH22 ARG 32 0.035 -2.709 -20.771 288 H ALA 33 H ALA 33 1.588 -5.739 -11.723 289 HA ALA 33 HA ALA 33 3.985 -4.556 -11.052 290 HB1 ALA 33 HB1 ALA 33 3.258 -7.511 -10.767 291 HB2 ALA 33 HB2 ALA 33 4.428 -6.602 -9.782 292 HB3 ALA 33 HB3 ALA 33 2.713 -6.217 -9.689 293 H SER 34 H SER 34 3.507 -6.918 -13.573 294 HA SER 34 HA SER 34 6.250 -7.677 -13.999 295 HB2 SER 34 HB2 SER 34 3.951 -8.821 -14.585 296 HB3 SER 34 HB3 SER 34 4.048 -7.858 -16.066 297 HG SER 34 HG SER 34 6.094 -8.836 -16.478 298 H ASP 35 H ASP 35 4.603 -4.734 -14.821 299 HA ASP 35 HA ASP 35 6.220 -4.072 -17.167 300 HB2 ASP 35 HB2 ASP 35 3.887 -3.212 -16.472 301 HB3 ASP 35 HB3 ASP 35 4.717 -2.149 -15.360 302 H TRP 36 H TRP 36 6.337 -3.382 -13.699 303 HA TRP 36 HA TRP 36 8.936 -1.947 -13.925 304 HB2 TRP 36 HB2 TRP 36 8.179 -1.410 -11.401 305 HB3 TRP 36 HB3 TRP 36 7.782 -0.447 -12.793 306 HD1 TRP 36 HD1 TRP 36 5.295 -0.439 -13.676 307 HE1 TRP 36 HE1 TRP 36 3.066 -0.991 -12.589 308 HE3 TRP 36 HE3 TRP 36 7.002 -2.857 -9.483 309 HZ2 TRP 36 HZ2 TRP 36 2.156 -1.873 -10.000 310 HZ3 TRP 36 HZ3 TRP 36 5.407 -3.498 -7.694 311 HH2 TRP 36 HH2 TRP 36 2.982 -3.019 -7.933 312 H LYS 37 H LYS 37 9.882 -2.354 -11.333 313 HA LYS 37 HA LYS 37 11.010 -5.048 -11.405 314 HB2 LYS 37 HB2 LYS 37 10.872 -2.961 -9.164 315 HB3 LYS 37 HB3 LYS 37 11.815 -4.448 -9.110 316 HG2 LYS 37 HG2 LYS 37 12.283 -2.037 -10.901 317 HG3 LYS 37 HG3 LYS 37 13.244 -2.587 -9.534 318 HD2 LYS 37 HD2 LYS 37 13.489 -4.809 -11.031 319 HD3 LYS 37 HD3 LYS 37 13.100 -3.682 -12.339 320 HE2 LYS 37 HE2 LYS 37 14.936 -2.173 -11.528 321 HE3 LYS 37 HE3 LYS 37 15.315 -3.351 -10.257 322 HZ1 LYS 37 HZ1 LYS 37 16.757 -3.554 -12.237 323 HZ2 LYS 37 HZ2 LYS 37 15.955 -4.937 -11.926 324 HZ3 LYS 37 HZ3 LYS 37 15.475 -3.960 -13.163 325 H LEU 38 H LEU 38 10.199 -6.695 -11.087 326 HA LEU 38 HA LEU 38 7.661 -7.137 -9.700 327 HB2 LEU 38 HB2 LEU 38 8.190 -7.746 -12.082 328 HB3 LEU 38 HB3 LEU 38 9.529 -8.752 -11.517 329 HG LEU 38 HG LEU 38 7.880 -10.079 -10.251 330 HD11 LEU 38 HD11 LEU 38 5.973 -8.368 -10.424 331 HD12 LEU 38 HD12 LEU 38 5.812 -8.835 -12.126 332 HD13 LEU 38 HD13 LEU 38 5.523 -10.016 -10.836 333 HD21 LEU 38 HD21 LEU 38 7.145 -11.399 -12.241 334 HD22 LEU 38 HD22 LEU 38 7.594 -10.039 -13.286 335 HD23 LEU 38 HD23 LEU 38 8.839 -10.899 -12.357 336 H ASP 39 H ASP 39 11.058 -8.035 -9.322 337 HA ASP 39 HA ASP 39 10.524 -9.257 -6.665 338 HB2 ASP 39 HB2 ASP 39 11.811 -11.167 -7.189 339 HB3 ASP 39 HB3 ASP 39 10.679 -10.972 -8.519 340 H GLN 40 H GLN 40 12.009 -6.744 -7.978 341 HA GLN 40 HA GLN 40 14.544 -6.867 -6.368 342 HB2 GLN 40 HB2 GLN 40 13.937 -5.678 -9.065 343 HB3 GLN 40 HB3 GLN 40 15.406 -5.306 -8.160 344 HG2 GLN 40 HG2 GLN 40 16.307 -7.438 -8.443 345 HG3 GLN 40 HG3 GLN 40 14.744 -8.209 -8.657 346 HE21 GLN 40 HE21 GLN 40 14.812 -7.965 -12.169 347 HE22 GLN 40 HE22 GLN 40 14.031 -8.633 -10.729 348 HA PRO 41 HA PRO 41 11.786 -3.483 -4.794 349 HB2 PRO 41 HB2 PRO 41 12.158 -3.791 -2.097 350 HB3 PRO 41 HB3 PRO 41 11.046 -4.792 -3.076 351 HG2 PRO 41 HG2 PRO 41 13.900 -5.434 -2.256 352 HG3 PRO 41 HG3 PRO 41 12.446 -6.472 -2.093 353 HD2 PRO 41 HD2 PRO 41 14.157 -6.743 -4.183 354 HD3 PRO 41 HD3 PRO 41 12.391 -6.919 -4.409 355 H ASP 42 H ASP 42 12.107 -1.546 -3.680 356 HA ASP 42 HA ASP 42 14.886 -0.472 -3.732 357 HB2 ASP 42 HB2 ASP 42 13.179 0.553 -5.214 358 HB3 ASP 42 HB3 ASP 42 12.146 0.862 -3.820 359 H TRP 43 H TRP 43 12.188 -1.135 -1.608 360 HA TRP 43 HA TRP 43 13.859 -0.635 0.749 361 HB2 TRP 43 HB2 TRP 43 12.762 1.530 0.495 362 HB3 TRP 43 HB3 TRP 43 11.202 0.767 0.260 363 HD1 TRP 43 HD1 TRP 43 13.612 1.852 2.962 364 HE1 TRP 43 HE1 TRP 43 12.452 1.759 5.252 365 HE3 TRP 43 HE3 TRP 43 9.360 -0.668 1.636 366 HZ2 TRP 43 HZ2 TRP 43 9.936 0.853 6.328 367 HZ3 TRP 43 HZ3 TRP 43 7.586 -1.129 3.309 368 HH2 TRP 43 HH2 TRP 43 7.854 -0.350 5.656 369 H THR 44 H THR 44 13.179 -1.916 2.574 370 HA THR 44 HA THR 44 10.583 -3.254 2.415 371 HB THR 44 HB THR 44 11.273 -5.376 2.936 372 HG1 THR 44 HG1 THR 44 13.965 -4.566 3.156 373 HG21 THR 44 HG21 THR 44 13.387 -4.614 0.893 374 HG22 THR 44 HG22 THR 44 12.681 -6.224 1.185 375 HG23 THR 44 HG23 THR 44 11.680 -4.918 0.537 376 H GLY 45 H GLY 45 9.703 -3.890 4.329 377 HA2 GLY 45 HA2 GLY 45 10.872 -3.246 6.912 378 HA3 GLY 45 HA3 GLY 45 9.843 -1.967 6.318 379 H ARG 46 H ARG 46 8.139 -2.082 7.468 380 HA ARG 46 HA ARG 46 6.564 -4.603 7.871 381 HB2 ARG 46 HB2 ARG 46 7.979 -4.052 9.815 382 HB3 ARG 46 HB3 ARG 46 7.310 -2.430 9.873 383 HG2 ARG 46 HG2 ARG 46 5.048 -3.432 10.421 384 HG3 ARG 46 HG3 ARG 46 5.835 -5.031 10.444 385 HD2 ARG 46 HD2 ARG 46 7.467 -4.088 12.147 386 HD3 ARG 46 HD3 ARG 46 6.490 -2.628 12.208 387 HE ARG 46 HE ARG 46 5.617 -5.382 13.028 388 HH11 ARG 46 HH11 ARG 46 4.555 -5.573 14.940 389 HH12 ARG 46 HH12 ARG 46 3.952 -4.162 15.752 390 HH21 ARG 46 HH21 ARG 46 5.071 -1.895 13.424 391 HH22 ARG 46 HH22 ARG 46 4.296 -2.158 14.963 392 H LEU 47 H LEU 47 4.328 -4.345 7.764 393 HA LEU 47 HA LEU 47 3.332 -1.781 6.619 394 HB2 LEU 47 HB2 LEU 47 2.782 -3.949 5.504 395 HB3 LEU 47 HB3 LEU 47 2.042 -4.487 7.005 396 HG LEU 47 HG LEU 47 0.453 -2.413 6.743 397 HD11 LEU 47 HD11 LEU 47 0.059 -1.718 4.444 398 HD12 LEU 47 HD12 LEU 47 1.680 -1.273 4.973 399 HD13 LEU 47 HD13 LEU 47 1.462 -2.667 3.894 400 HD21 LEU 47 HD21 LEU 47 0.283 -4.845 4.950 401 HD22 LEU 47 HD22 LEU 47 -0.352 -4.660 6.599 402 HD23 LEU 47 HD23 LEU 47 -1.054 -3.729 5.288 403 H ARG 48 H ARG 48 1.972 -0.389 7.705 404 HA ARG 48 HA ARG 48 0.378 -1.433 9.988 405 HB2 ARG 48 HB2 ARG 48 2.592 -0.064 10.606 406 HB3 ARG 48 HB3 ARG 48 1.672 1.332 10.107 407 HG2 ARG 48 HG2 ARG 48 1.287 1.268 12.399 408 HG3 ARG 48 HG3 ARG 48 -0.156 0.436 11.801 409 HD2 ARG 48 HD2 ARG 48 0.902 -1.744 12.225 410 HD3 ARG 48 HD3 ARG 48 2.418 -0.975 12.682 411 HE ARG 48 HE ARG 48 0.034 -1.296 14.327 412 HH11 ARG 48 HH11 ARG 48 0.183 -0.829 16.495 413 HH12 ARG 48 HH12 ARG 48 1.458 0.196 17.074 414 HH21 ARG 48 HH21 ARG 48 2.968 0.689 14.029 415 HH22 ARG 48 HH22 ARG 48 2.977 1.000 15.741 416 H ILE 49 H ILE 49 -1.500 -1.470 8.916 417 HA ILE 49 HA ILE 49 -2.481 0.961 7.499 418 HB ILE 49 HB ILE 49 -3.801 -1.737 7.866 419 HG12 ILE 49 HG12 ILE 49 -2.364 -0.408 5.517 420 HG13 ILE 49 HG13 ILE 49 -1.883 -1.873 6.377 421 HG21 ILE 49 HG21 ILE 49 -5.426 0.187 7.665 422 HG22 ILE 49 HG22 ILE 49 -4.678 0.579 6.094 423 HG23 ILE 49 HG23 ILE 49 -5.517 -0.969 6.362 424 HD11 ILE 49 HD11 ILE 49 -2.838 -2.529 4.308 425 HD12 ILE 49 HD12 ILE 49 -3.994 -2.973 5.574 426 HD13 ILE 49 HD13 ILE 49 -4.275 -1.529 4.541 427 H THR 50 H THR 50 -3.760 2.361 8.418 428 HA THR 50 HA THR 50 -5.038 1.837 11.068 429 HB THR 50 HB THR 50 -4.183 3.917 11.946 430 HG1 THR 50 HG1 THR 50 -2.768 4.096 9.492 431 HG21 THR 50 HG21 THR 50 -2.615 1.905 12.133 432 HG22 THR 50 HG22 THR 50 -1.729 2.563 10.753 433 HG23 THR 50 HG23 THR 50 -1.856 3.500 12.255 434 H SER 51 H SER 51 -6.552 3.859 11.562 435 HA SER 51 HA SER 51 -7.356 5.427 9.231 436 HB2 SER 51 HB2 SER 51 -9.732 4.830 9.403 437 HB3 SER 51 HB3 SER 51 -8.730 3.483 8.870 438 HG SER 51 HG SER 51 -9.526 3.888 11.581 439 H LYS 52 H LYS 52 -7.742 7.424 9.843 440 HA LYS 52 HA LYS 52 -8.637 8.106 12.605 441 HB2 LYS 52 HB2 LYS 52 -6.687 9.249 11.579 442 HB3 LYS 52 HB3 LYS 52 -7.775 9.911 10.336 443 HG2 LYS 52 HG2 LYS 52 -9.121 10.838 12.413 444 HG3 LYS 52 HG3 LYS 52 -7.620 10.530 13.283 445 HD2 LYS 52 HD2 LYS 52 -8.092 12.334 10.897 446 HD3 LYS 52 HD3 LYS 52 -7.604 12.808 12.545 447 HE2 LYS 52 HE2 LYS 52 -5.410 11.811 12.212 448 HE3 LYS 52 HE3 LYS 52 -5.887 11.182 10.628 449 HZ1 LYS 52 HZ1 LYS 52 -4.626 13.237 10.413 450 HZ2 LYS 52 HZ2 LYS 52 -6.162 13.523 9.908 451 HZ3 LYS 52 HZ3 LYS 52 -5.633 14.044 11.386 452 H GLY 53 H GLY 53 -10.512 6.810 11.927 453 HA2 GLY 53 HA2 GLY 53 -12.882 6.931 11.899 454 HA3 GLY 53 HA3 GLY 53 -12.795 8.556 11.226 455 H LYS 54 H LYS 54 -13.769 8.561 9.292 456 HA LYS 54 HA LYS 54 -13.950 6.259 7.508 457 HB2 LYS 54 HB2 LYS 54 -15.782 7.867 7.936 458 HB3 LYS 54 HB3 LYS 54 -14.850 9.160 7.202 459 HG2 LYS 54 HG2 LYS 54 -15.292 6.775 5.450 460 HG3 LYS 54 HG3 LYS 54 -16.762 7.584 5.979 461 HD2 LYS 54 HD2 LYS 54 -16.079 9.710 5.090 462 HD3 LYS 54 HD3 LYS 54 -14.468 9.103 4.675 463 HE2 LYS 54 HE2 LYS 54 -15.386 7.571 3.031 464 HE3 LYS 54 HE3 LYS 54 -17.046 7.962 3.515 465 HZ1 LYS 54 HZ1 LYS 54 -16.292 9.177 1.493 466 HZ2 LYS 54 HZ2 LYS 54 -16.731 10.199 2.689 467 HZ3 LYS 54 HZ3 LYS 54 -15.153 9.965 2.365 468 H THR 55 H THR 55 -11.308 7.786 8.041 469 HA THR 55 HA THR 55 -10.368 7.545 5.215 470 HB THR 55 HB THR 55 -9.089 9.299 7.335 471 HG1 THR 55 HG1 THR 55 -10.174 11.027 6.382 472 HG21 THR 55 HG21 THR 55 -9.110 9.195 4.277 473 HG22 THR 55 HG22 THR 55 -8.205 10.399 5.242 474 HG23 THR 55 HG23 THR 55 -7.767 8.681 5.319 475 H ALA 56 H ALA 56 -9.048 5.858 4.946 476 HA ALA 56 HA ALA 56 -7.595 4.666 7.227 477 HB1 ALA 56 HB1 ALA 56 -6.913 2.929 5.552 478 HB2 ALA 56 HB2 ALA 56 -8.651 3.033 5.827 479 HB3 ALA 56 HB3 ALA 56 -7.952 3.739 4.360 480 H TYR 57 H TYR 57 -5.320 4.350 7.110 481 HA TYR 57 HA TYR 57 -3.787 6.024 5.182 482 HB2 TYR 57 HB2 TYR 57 -3.278 5.922 8.175 483 HB3 TYR 57 HB3 TYR 57 -2.222 6.652 6.983 484 HD1 TYR 57 HD1 TYR 57 -2.487 8.940 6.418 485 HD2 TYR 57 HD2 TYR 57 -5.660 6.862 8.466 486 HE1 TYR 57 HE1 TYR 57 -3.774 11.070 6.606 487 HE2 TYR 57 HE2 TYR 57 -6.975 8.947 8.570 488 HH TYR 57 HH TYR 57 -5.728 12.062 7.289 489 H ILE 58 H ILE 58 -2.565 4.668 4.077 490 HA ILE 58 HA ILE 58 -1.623 2.100 5.233 491 HB ILE 58 HB ILE 58 -0.752 3.342 2.602 492 HG12 ILE 58 HG12 ILE 58 -3.131 3.229 2.371 493 HG13 ILE 58 HG13 ILE 58 -2.335 2.031 1.373 494 HG21 ILE 58 HG21 ILE 58 -0.700 0.530 3.744 495 HG22 ILE 58 HG22 ILE 58 -0.252 0.964 2.081 496 HG23 ILE 58 HG23 ILE 58 0.688 1.591 3.432 497 HD11 ILE 58 HD11 ILE 58 -4.358 1.152 2.380 498 HD12 ILE 58 HD12 ILE 58 -2.949 0.248 2.965 499 HD13 ILE 58 HD13 ILE 58 -3.734 1.457 4.015 500 H LYS 59 H LYS 59 -0.137 2.522 6.861 501 HA LYS 59 HA LYS 59 2.041 4.505 6.306 502 HB2 LYS 59 HB2 LYS 59 1.157 3.400 8.991 503 HB3 LYS 59 HB3 LYS 59 2.339 4.667 8.699 504 HG2 LYS 59 HG2 LYS 59 0.567 6.164 7.821 505 HG3 LYS 59 HG3 LYS 59 -0.621 4.868 7.959 506 HD2 LYS 59 HD2 LYS 59 -1.055 6.188 9.825 507 HD3 LYS 59 HD3 LYS 59 -0.176 4.796 10.440 508 HE2 LYS 59 HE2 LYS 59 0.990 6.391 11.550 509 HE3 LYS 59 HE3 LYS 59 1.935 6.427 10.053 510 HZ1 LYS 59 HZ1 LYS 59 -0.298 8.268 10.765 511 HZ2 LYS 59 HZ2 LYS 59 1.284 8.654 10.771 512 HZ3 LYS 59 HZ3 LYS 59 0.554 8.337 9.347 513 H LEU 60 H LEU 60 4.131 3.867 6.325 514 HA LEU 60 HA LEU 60 4.654 0.914 6.524 515 HB2 LEU 60 HB2 LEU 60 5.714 3.018 4.602 516 HB3 LEU 60 HB3 LEU 60 6.394 1.400 4.755 517 HG LEU 60 HG LEU 60 3.491 1.929 3.971 518 HD11 LEU 60 HD11 LEU 60 5.924 1.297 2.262 519 HD12 LEU 60 HD12 LEU 60 4.241 1.323 1.684 520 HD13 LEU 60 HD13 LEU 60 5.001 2.813 2.261 521 HD21 LEU 60 HD21 LEU 60 5.232 -0.577 3.814 522 HD22 LEU 60 HD22 LEU 60 3.872 -0.324 4.925 523 HD23 LEU 60 HD23 LEU 60 3.577 -0.423 3.188 524 H GLU 61 H GLU 61 6.178 0.258 7.841 525 HA GLU 61 HA GLU 61 7.718 2.310 9.376 526 HB2 GLU 61 HB2 GLU 61 6.569 -0.366 10.220 527 HB3 GLU 61 HB3 GLU 61 7.517 0.710 11.251 528 HG2 GLU 61 HG2 GLU 61 5.757 2.434 11.082 529 HG3 GLU 61 HG3 GLU 61 4.796 1.368 10.048 530 H ASP 62 H ASP 62 9.893 1.856 9.998 531 HA ASP 62 HA ASP 62 11.387 -0.000 8.377 532 HB2 ASP 62 HB2 ASP 62 12.300 2.140 9.030 533 HB3 ASP 62 HB3 ASP 62 12.030 1.797 10.743 534 H LYS 63 H LYS 63 12.003 -2.033 8.839 535 HA LYS 63 HA LYS 63 10.653 -3.474 10.945 536 HB2 LYS 63 HB2 LYS 63 11.733 -5.476 9.981 537 HB3 LYS 63 HB3 LYS 63 10.867 -4.495 8.812 538 HG2 LYS 63 HG2 LYS 63 12.989 -3.550 7.969 539 HG3 LYS 63 HG3 LYS 63 13.892 -4.386 9.233 540 HD2 LYS 63 HD2 LYS 63 14.091 -5.488 7.048 541 HD3 LYS 63 HD3 LYS 63 13.370 -6.553 8.265 542 HE2 LYS 63 HE2 LYS 63 11.152 -6.271 7.328 543 HE3 LYS 63 HE3 LYS 63 11.696 -4.960 6.282 544 HZ1 LYS 63 HZ1 LYS 63 12.850 -6.423 4.912 545 HZ2 LYS 63 HZ2 LYS 63 12.832 -7.664 6.002 546 HZ3 LYS 63 HZ3 LYS 63 11.454 -7.237 5.247 547 H VAL 64 H VAL 64 13.329 -1.647 11.359 548 HA VAL 64 HA VAL 64 14.511 -3.408 13.468 549 HB VAL 64 HB VAL 64 15.870 -0.948 12.355 550 HG11 VAL 64 HG11 VAL 64 16.911 -3.550 13.537 551 HG12 VAL 64 HG12 VAL 64 17.892 -2.156 13.028 552 HG13 VAL 64 HG13 VAL 64 16.775 -1.992 14.386 553 HG21 VAL 64 HG21 VAL 64 15.437 -2.208 10.328 554 HG22 VAL 64 HG22 VAL 64 17.132 -2.396 10.772 555 HG23 VAL 64 HG23 VAL 64 15.986 -3.720 11.101 556 H SER 65 H SER 65 13.330 -0.114 12.760 557 HA SER 65 HA SER 65 13.330 0.414 15.709 558 HB2 SER 65 HB2 SER 65 14.064 2.280 13.428 559 HB3 SER 65 HB3 SER 65 13.974 2.742 15.140 560 HG SER 65 HG SER 65 16.114 2.208 14.477 561 H GLY 66 H GLY 66 11.158 0.105 13.177 562 HA2 GLY 66 HA2 GLY 66 8.928 0.569 13.050 563 HA3 GLY 66 HA3 GLY 66 8.992 1.271 14.666 564 H GLU 67 H GLU 67 11.168 2.748 12.425 565 HA GLU 67 HA GLU 67 9.785 5.296 12.692 566 HB2 GLU 67 HB2 GLU 67 12.284 4.548 11.122 567 HB3 GLU 67 HB3 GLU 67 11.685 6.191 11.391 568 HG2 GLU 67 HG2 GLU 67 11.885 5.809 13.872 569 HG3 GLU 67 HG3 GLU 67 12.635 4.246 13.535 570 H LEU 68 H LEU 68 8.860 6.616 11.068 571 HA LEU 68 HA LEU 68 7.411 5.125 9.097 572 HB2 LEU 68 HB2 LEU 68 6.575 7.146 10.385 573 HB3 LEU 68 HB3 LEU 68 7.614 8.142 9.368 574 HG LEU 68 HG LEU 68 6.341 7.159 7.345 575 HD11 LEU 68 HD11 LEU 68 4.402 6.347 9.563 576 HD12 LEU 68 HD12 LEU 68 4.065 6.320 7.817 577 HD13 LEU 68 HD13 LEU 68 5.273 5.230 8.498 578 HD21 LEU 68 HD21 LEU 68 5.958 9.439 8.191 579 HD22 LEU 68 HD22 LEU 68 4.452 8.699 7.631 580 HD23 LEU 68 HD23 LEU 68 4.787 8.815 9.375 581 H PHE 69 H PHE 69 8.039 4.509 7.181 582 HA PHE 69 HA PHE 69 10.207 5.787 5.606 583 HB2 PHE 69 HB2 PHE 69 10.218 3.440 5.593 584 HB3 PHE 69 HB3 PHE 69 8.478 3.326 5.376 585 HD1 PHE 69 HD1 PHE 69 7.816 2.517 3.316 586 HD2 PHE 69 HD2 PHE 69 11.340 4.983 3.530 587 HE1 PHE 69 HE1 PHE 69 8.084 2.329 0.878 588 HE2 PHE 69 HE2 PHE 69 11.592 4.831 1.086 589 HZ PHE 69 HZ PHE 69 9.943 3.511 -0.283 590 H ALA 70 H ALA 70 6.699 5.142 5.235 591 HA ALA 70 HA ALA 70 6.265 7.657 3.802 592 HB1 ALA 70 HB1 ALA 70 5.288 6.525 1.806 593 HB2 ALA 70 HB2 ALA 70 7.027 6.202 1.949 594 HB3 ALA 70 HB3 ALA 70 5.843 4.960 2.419 595 H GLN 71 H GLN 71 3.959 8.016 3.363 596 HA GLN 71 HA GLN 71 2.112 6.026 4.363 597 HB2 GLN 71 HB2 GLN 71 0.772 7.551 5.739 598 HB3 GLN 71 HB3 GLN 71 2.380 7.254 6.394 599 HG2 GLN 71 HG2 GLN 71 3.142 9.461 5.474 600 HG3 GLN 71 HG3 GLN 71 1.496 9.777 4.919 601 HE21 GLN 71 HE21 GLN 71 2.029 11.374 8.291 602 HE22 GLN 71 HE22 GLN 71 2.866 11.494 6.754 603 H ALA 72 H ALA 72 0.177 5.954 3.332 604 HA ALA 72 HA ALA 72 -0.426 8.074 1.307 605 HB1 ALA 72 HB1 ALA 72 -0.954 5.100 1.105 606 HB2 ALA 72 HB2 ALA 72 -1.474 6.334 -0.055 607 HB3 ALA 72 HB3 ALA 72 0.249 6.039 0.188 608 HA PRO 73 HA PRO 73 -4.279 8.056 3.853 609 HB2 PRO 73 HB2 PRO 73 -4.905 10.503 2.260 610 HB3 PRO 73 HB3 PRO 73 -4.916 10.269 4.032 611 HG2 PRO 73 HG2 PRO 73 -2.938 11.692 2.785 612 HG3 PRO 73 HG3 PRO 73 -2.572 10.615 4.175 613 HD2 PRO 73 HD2 PRO 73 -2.275 10.023 1.213 614 HD3 PRO 73 HD3 PRO 73 -1.106 9.757 2.546 615 H VAL 74 H VAL 74 -6.103 6.978 3.295 616 HA VAL 74 HA VAL 74 -7.035 6.830 0.449 617 HB VAL 74 HB VAL 74 -7.005 4.612 2.528 618 HG11 VAL 74 HG11 VAL 74 -7.945 4.547 -0.353 619 HG12 VAL 74 HG12 VAL 74 -7.827 3.152 0.746 620 HG13 VAL 74 HG13 VAL 74 -8.978 4.429 1.091 621 HG21 VAL 74 HG21 VAL 74 -5.445 4.573 -0.046 622 HG22 VAL 74 HG22 VAL 74 -4.742 4.996 1.531 623 HG23 VAL 74 HG23 VAL 74 -5.444 3.398 1.263 624 H GLU 75 H GLU 75 -9.126 7.525 0.211 625 HA GLU 75 HA GLU 75 -10.946 7.347 2.574 626 HB2 GLU 75 HB2 GLU 75 -10.054 9.706 1.693 627 HB3 GLU 75 HB3 GLU 75 -11.381 9.495 0.543 628 HG2 GLU 75 HG2 GLU 75 -12.797 8.915 2.704 629 HG3 GLU 75 HG3 GLU 75 -11.461 9.639 3.581 630 H GLN 76 H GLN 76 -10.433 5.775 -0.140 631 HA GLN 76 HA GLN 76 -13.081 4.760 -0.299 632 HB2 GLN 76 HB2 GLN 76 -13.610 5.163 -2.576 633 HB3 GLN 76 HB3 GLN 76 -13.290 6.727 -1.854 634 HG2 GLN 76 HG2 GLN 76 -11.441 5.179 -3.715 635 HG3 GLN 76 HG3 GLN 76 -12.423 6.563 -4.133 636 HE21 GLN 76 HE21 GLN 76 -8.798 7.181 -2.379 637 HE22 GLN 76 HE22 GLN 76 -9.494 5.545 -2.393 638 H TYR 77 H TYR 77 -13.053 2.645 -1.087 639 HA TYR 77 HA TYR 77 -10.466 1.610 -2.107 640 HB2 TYR 77 HB2 TYR 77 -10.628 1.158 0.271 641 HB3 TYR 77 HB3 TYR 77 -12.132 0.235 0.018 642 HD1 TYR 77 HD1 TYR 77 -11.871 -2.186 -0.598 643 HD2 TYR 77 HD2 TYR 77 -8.648 0.600 -0.949 644 HE1 TYR 77 HE1 TYR 77 -10.369 -4.021 -1.340 645 HE2 TYR 77 HE2 TYR 77 -7.126 -1.193 -1.749 646 HH TYR 77 HH TYR 77 -8.310 -4.593 -2.055 647 HA PRO 78 HA PRO 78 -9.535 0.493 -3.666 648 HB2 PRO 78 HB2 PRO 78 -10.375 0.232 -6.531 649 HB3 PRO 78 HB3 PRO 78 -8.951 -0.460 -5.694 650 HG2 PRO 78 HG2 PRO 78 -11.071 -2.035 -6.288 651 HG3 PRO 78 HG3 PRO 78 -10.295 -2.166 -4.672 652 HD2 PRO 78 HD2 PRO 78 -12.776 -0.574 -5.430 653 HD3 PRO 78 HD3 PRO 78 -12.557 -1.735 -4.083 654 H GLY 79 H GLY 79 -8.378 2.224 -4.946 655 HA2 GLY 79 HA2 GLY 79 -9.907 4.324 -6.286 656 HA3 GLY 79 HA3 GLY 79 -9.332 4.803 -4.689 657 H ILE 80 H ILE 80 -8.071 6.459 -5.732 658 HA ILE 80 HA ILE 80 -5.802 5.697 -7.427 659 HB ILE 80 HB ILE 80 -6.948 7.860 -7.680 660 HG12 ILE 80 HG12 ILE 80 -5.041 9.350 -7.855 661 HG13 ILE 80 HG13 ILE 80 -4.082 8.355 -6.765 662 HG21 ILE 80 HG21 ILE 80 -6.663 9.699 -6.097 663 HG22 ILE 80 HG22 ILE 80 -7.470 8.358 -5.281 664 HG23 ILE 80 HG23 ILE 80 -5.738 8.673 -4.994 665 HD11 ILE 80 HD11 ILE 80 -5.103 7.422 -9.482 666 HD12 ILE 80 HD12 ILE 80 -3.491 8.104 -9.176 667 HD13 ILE 80 HD13 ILE 80 -3.947 6.572 -8.419 668 H ALA 81 H ALA 81 -6.457 6.204 -4.005 669 HA ALA 81 HA ALA 81 -3.664 6.367 -3.337 670 HB1 ALA 81 HB1 ALA 81 -6.106 6.128 -1.568 671 HB2 ALA 81 HB2 ALA 81 -4.420 6.409 -1.030 672 HB3 ALA 81 HB3 ALA 81 -5.255 7.621 -2.034 673 H VAL 82 H VAL 82 -5.991 3.639 -3.433 674 HA VAL 82 HA VAL 82 -3.616 1.868 -3.279 675 HB VAL 82 HB VAL 82 -4.484 1.948 -1.053 676 HG11 VAL 82 HG11 VAL 82 -7.150 1.240 -2.181 677 HG12 VAL 82 HG12 VAL 82 -6.685 1.327 -0.449 678 HG13 VAL 82 HG13 VAL 82 -6.706 2.775 -1.430 679 HG21 VAL 82 HG21 VAL 82 -4.928 -0.431 -0.763 680 HG22 VAL 82 HG22 VAL 82 -5.207 -0.617 -2.511 681 HG23 VAL 82 HG23 VAL 82 -3.613 -0.150 -1.917 682 H GLU 83 H GLU 83 -3.593 0.642 -5.009 683 HA GLU 83 HA GLU 83 -6.078 -0.356 -6.335 684 HB2 GLU 83 HB2 GLU 83 -4.346 1.697 -7.325 685 HB3 GLU 83 HB3 GLU 83 -3.963 0.257 -8.256 686 HG2 GLU 83 HG2 GLU 83 -6.802 1.291 -7.845 687 HG3 GLU 83 HG3 GLU 83 -5.766 1.794 -9.178 688 H THR 84 H THR 84 -5.714 -2.243 -7.775 689 HA THR 84 HA THR 84 -3.354 -3.932 -6.951 690 HB THR 84 HB THR 84 -5.847 -5.094 -8.030 691 HG1 THR 84 HG1 THR 84 -6.721 -5.272 -5.969 692 HG21 THR 84 HG21 THR 84 -3.894 -6.521 -7.653 693 HG22 THR 84 HG22 THR 84 -3.859 -6.041 -5.942 694 HG23 THR 84 HG23 THR 84 -5.222 -6.983 -6.583 695 H VAL 85 H VAL 85 -2.128 -3.158 -8.456 696 HA VAL 85 HA VAL 85 -1.148 -3.127 -10.744 697 HB VAL 85 HB VAL 85 -0.355 -5.536 -10.827 698 HG11 VAL 85 HG11 VAL 85 1.165 -5.009 -8.903 699 HG12 VAL 85 HG12 VAL 85 0.933 -3.674 -10.023 700 HG13 VAL 85 HG13 VAL 85 0.099 -3.680 -8.449 701 HG21 VAL 85 HG21 VAL 85 -2.225 -6.471 -9.292 702 HG22 VAL 85 HG22 VAL 85 -0.566 -6.895 -8.880 703 HG23 VAL 85 HG23 VAL 85 -1.410 -5.629 -7.971 704 H THR 86 H THR 86 -2.856 -6.191 -10.895 705 HA THR 86 HA THR 86 -4.566 -5.141 -12.996 706 HB THR 86 HB THR 86 -4.334 -7.305 -14.334 707 HG1 THR 86 HG1 THR 86 -2.392 -8.387 -14.112 708 HG21 THR 86 HG21 THR 86 -2.340 -6.474 -15.587 709 HG22 THR 86 HG22 THR 86 -3.404 -5.122 -15.092 710 HG23 THR 86 HG23 THR 86 -1.940 -5.470 -14.177 711 H ASP 87 H ASP 87 -3.687 -8.129 -11.343 712 HA ASP 87 HA ASP 87 -6.543 -8.574 -10.573 713 HB2 ASP 87 HB2 ASP 87 -4.918 -9.965 -12.637 714 HB3 ASP 87 HB3 ASP 87 -5.910 -11.003 -11.609 715 H SER 88 H SER 88 -3.652 -10.745 -10.526 716 HA SER 88 HA SER 88 -4.219 -11.866 -8.085 717 HB2 SER 88 HB2 SER 88 -2.314 -12.283 -9.770 718 HB3 SER 88 HB3 SER 88 -1.320 -11.353 -8.646 719 HG SER 88 HG SER 88 -1.514 -13.742 -8.365 720 H SER 89 H SER 89 -3.210 -11.866 -6.086 721 HA SER 89 HA SER 89 -2.799 -9.137 -4.933 722 HB2 SER 89 HB2 SER 89 -5.018 -10.006 -4.637 723 HB3 SER 89 HB3 SER 89 -4.389 -11.483 -3.881 724 HG SER 89 HG SER 89 -3.531 -10.201 -2.222 725 H ARG 90 H ARG 90 -0.571 -10.329 -5.727 726 HA ARG 90 HA ARG 90 0.793 -10.677 -3.068 727 HB2 ARG 90 HB2 ARG 90 1.771 -12.070 -4.831 728 HB3 ARG 90 HB3 ARG 90 1.968 -10.673 -5.893 729 HG2 ARG 90 HG2 ARG 90 3.562 -9.662 -4.321 730 HG3 ARG 90 HG3 ARG 90 3.263 -10.956 -3.149 731 HD2 ARG 90 HD2 ARG 90 4.321 -12.567 -4.709 732 HD3 ARG 90 HD3 ARG 90 4.585 -11.253 -5.872 733 HE ARG 90 HE ARG 90 5.647 -11.139 -3.064 734 HH11 ARG 90 HH11 ARG 90 7.517 -10.116 -2.713 735 HH12 ARG 90 HH12 ARG 90 8.550 -9.660 -4.041 736 HH21 ARG 90 HH21 ARG 90 6.455 -10.910 -6.459 737 HH22 ARG 90 HH22 ARG 90 7.934 -10.046 -6.142 738 H TYR 91 H TYR 91 0.044 -8.417 -5.650 739 HA TYR 91 HA TYR 91 1.774 -6.362 -4.383 740 HB2 TYR 91 HB2 TYR 91 0.881 -6.499 -7.256 741 HB3 TYR 91 HB3 TYR 91 2.097 -5.431 -6.602 742 HD1 TYR 91 HD1 TYR 91 4.378 -6.326 -6.024 743 HD2 TYR 91 HD2 TYR 91 1.347 -8.670 -8.013 744 HE1 TYR 91 HE1 TYR 91 6.110 -7.922 -6.788 745 HE2 TYR 91 HE2 TYR 91 3.078 -10.207 -8.876 746 HH TYR 91 HH TYR 91 6.566 -9.691 -8.120 747 H PHE 92 H PHE 92 1.250 -4.193 -4.657 748 HA PHE 92 HA PHE 92 -1.432 -3.405 -5.568 749 HB2 PHE 92 HB2 PHE 92 -0.382 -2.634 -2.813 750 HB3 PHE 92 HB3 PHE 92 -1.824 -1.974 -3.576 751 HD1 PHE 92 HD1 PHE 92 -0.439 -4.768 -1.713 752 HD2 PHE 92 HD2 PHE 92 -3.794 -3.490 -4.104 753 HE1 PHE 92 HE1 PHE 92 -1.767 -6.690 -0.896 754 HE2 PHE 92 HE2 PHE 92 -5.101 -5.447 -3.326 755 HZ PHE 92 HZ PHE 92 -4.077 -7.078 -1.748 756 H VAL 93 H VAL 93 -1.538 -0.965 -5.631 757 HA VAL 93 HA VAL 93 1.095 0.407 -5.699 758 HB VAL 93 HB VAL 93 -1.136 0.767 -7.737 759 HG11 VAL 93 HG11 VAL 93 -0.350 3.000 -7.113 760 HG12 VAL 93 HG12 VAL 93 1.345 2.477 -7.256 761 HG13 VAL 93 HG13 VAL 93 0.297 2.568 -8.688 762 HG21 VAL 93 HG21 VAL 93 0.735 0.332 -9.339 763 HG22 VAL 93 HG22 VAL 93 1.811 0.005 -7.976 764 HG23 VAL 93 HG23 VAL 93 0.416 -1.051 -8.285 765 H ILE 94 H ILE 94 1.105 2.248 -4.480 766 HA ILE 94 HA ILE 94 -1.503 3.383 -3.676 767 HB ILE 94 HB ILE 94 -0.890 3.656 -1.364 768 HG12 ILE 94 HG12 ILE 94 1.640 2.019 -1.891 769 HG13 ILE 94 HG13 ILE 94 1.638 3.772 -1.809 770 HG21 ILE 94 HG21 ILE 94 -0.411 0.725 -2.100 771 HG22 ILE 94 HG22 ILE 94 -1.059 1.373 -0.582 772 HG23 ILE 94 HG23 ILE 94 -1.992 1.520 -2.055 773 HD11 ILE 94 HD11 ILE 94 0.663 3.656 0.491 774 HD12 ILE 94 HD12 ILE 94 0.823 1.899 0.424 775 HD13 ILE 94 HD13 ILE 94 2.268 2.917 0.367 776 H ARG 95 H ARG 95 -1.545 5.519 -3.041 777 HA ARG 95 HA ARG 95 0.576 7.232 -4.285 778 HB2 ARG 95 HB2 ARG 95 -1.755 7.311 -5.124 779 HB3 ARG 95 HB3 ARG 95 -2.287 7.931 -3.566 780 HG2 ARG 95 HG2 ARG 95 -0.231 9.344 -5.320 781 HG3 ARG 95 HG3 ARG 95 -1.980 9.617 -5.402 782 HD2 ARG 95 HD2 ARG 95 -1.884 10.104 -2.895 783 HD3 ARG 95 HD3 ARG 95 -0.122 10.197 -3.090 784 HE ARG 95 HE ARG 95 -1.278 11.860 -5.069 785 HH11 ARG 95 HH11 ARG 95 -1.545 14.060 -4.860 786 HH12 ARG 95 HH12 ARG 95 -1.463 14.799 -3.289 787 HH21 ARG 95 HH21 ARG 95 -1.031 11.855 -1.579 788 HH22 ARG 95 HH22 ARG 95 -1.200 13.587 -1.469 789 H ILE 96 H ILE 96 2.113 7.424 -2.736 790 HA ILE 96 HA ILE 96 1.396 8.092 0.059 791 HB ILE 96 HB ILE 96 3.806 7.829 0.515 792 HG12 ILE 96 HG12 ILE 96 4.126 6.716 -2.293 793 HG13 ILE 96 HG13 ILE 96 4.514 8.398 -1.902 794 HG21 ILE 96 HG21 ILE 96 2.474 5.469 -0.819 795 HG22 ILE 96 HG22 ILE 96 3.880 5.355 0.245 796 HG23 ILE 96 HG23 ILE 96 2.358 5.942 0.892 797 HD11 ILE 96 HD11 ILE 96 6.525 7.124 -1.821 798 HD12 ILE 96 HD12 ILE 96 6.091 7.636 -0.173 799 HD13 ILE 96 HD13 ILE 96 5.811 5.958 -0.684 800 H GLN 97 H GLN 97 2.475 9.751 1.222 801 HA GLN 97 HA GLN 97 3.609 12.072 -0.244 802 HB2 GLN 97 HB2 GLN 97 2.340 12.281 1.970 803 HB3 GLN 97 HB3 GLN 97 3.661 11.394 2.721 804 HG2 GLN 97 HG2 GLN 97 4.515 13.459 3.111 805 HG3 GLN 97 HG3 GLN 97 5.091 13.349 1.447 806 HE21 GLN 97 HE21 GLN 97 2.948 15.947 0.297 807 HE22 GLN 97 HE22 GLN 97 4.159 14.728 -0.121 808 H ASP 98 H ASP 98 5.850 12.078 -0.801 809 HA ASP 98 HA ASP 98 7.317 9.573 -0.275 810 HB2 ASP 98 HB2 ASP 98 7.108 10.753 -2.509 811 HB3 ASP 98 HB3 ASP 98 8.199 11.974 -1.862 812 H GLY 99 H GLY 99 6.985 12.231 1.577 813 HA2 GLY 99 HA2 GLY 99 8.028 12.763 3.569 814 HA3 GLY 99 HA3 GLY 99 9.294 11.588 3.214 815 H THR 100 H THR 100 9.264 13.580 0.554 816 HA THR 100 HA THR 100 11.391 15.365 1.639 817 HB THR 100 HB THR 100 12.278 15.419 -0.636 818 HG1 THR 100 HG1 THR 100 11.365 14.075 -2.181 819 HG21 THR 100 HG21 THR 100 12.979 13.559 0.910 820 HG22 THR 100 HG22 THR 100 11.730 12.529 0.168 821 HG23 THR 100 HG23 THR 100 13.075 13.143 -0.812 822 H GLY 101 H GLY 101 8.325 15.795 1.409 823 HA2 GLY 101 HA2 GLY 101 7.141 17.833 1.372 824 HA3 GLY 101 HA3 GLY 101 8.411 18.590 0.407 825 H ARG 102 H ARG 102 7.385 15.480 -0.671 826 HA ARG 102 HA ARG 102 5.546 16.580 -2.754 827 HB2 ARG 102 HB2 ARG 102 6.750 15.571 -4.494 828 HB3 ARG 102 HB3 ARG 102 7.966 16.386 -3.483 829 HG2 ARG 102 HG2 ARG 102 8.463 14.155 -2.442 830 HG3 ARG 102 HG3 ARG 102 7.387 13.403 -3.637 831 HD2 ARG 102 HD2 ARG 102 8.750 14.326 -5.473 832 HD3 ARG 102 HD3 ARG 102 9.838 15.088 -4.294 833 HE ARG 102 HE ARG 102 9.787 12.347 -3.634 834 HH11 ARG 102 HH11 ARG 102 11.197 10.942 -4.166 835 HH12 ARG 102 HH12 ARG 102 12.293 11.147 -5.539 836 HH21 ARG 102 HH21 ARG 102 10.909 14.208 -6.399 837 HH22 ARG 102 HH22 ARG 102 12.105 13.003 -6.798 838 H SER 103 H SER 103 4.468 14.821 -4.031 839 HA SER 103 HA SER 103 3.885 12.408 -2.378 840 HB2 SER 103 HB2 SER 103 1.805 12.199 -3.701 841 HB3 SER 103 HB3 SER 103 1.876 13.669 -2.713 842 HG SER 103 HG SER 103 1.156 14.181 -4.802 843 H ALA 104 H ALA 104 3.779 10.399 -3.383 844 HA ALA 104 HA ALA 104 4.784 10.121 -6.161 845 HB1 ALA 104 HB1 ALA 104 6.509 8.490 -5.480 846 HB2 ALA 104 HB2 ALA 104 6.829 10.097 -4.807 847 HB3 ALA 104 HB3 ALA 104 6.150 8.817 -3.772 848 H PHE 105 H PHE 105 4.253 8.194 -7.200 849 HA PHE 105 HA PHE 105 2.425 6.334 -5.778 850 HB2 PHE 105 HB2 PHE 105 3.317 6.311 -8.673 851 HB3 PHE 105 HB3 PHE 105 2.096 5.280 -7.930 852 HD1 PHE 105 HD1 PHE 105 2.787 8.542 -9.396 853 HD2 PHE 105 HD2 PHE 105 -0.041 6.334 -7.001 854 HE1 PHE 105 HE1 PHE 105 1.095 10.302 -9.776 855 HE2 PHE 105 HE2 PHE 105 -1.754 8.070 -7.434 856 HZ PHE 105 HZ PHE 105 -1.202 10.063 -8.817 857 H ILE 106 H ILE 106 3.081 4.451 -4.979 858 HA ILE 106 HA ILE 106 5.606 3.236 -6.005 859 HB ILE 106 HB ILE 106 6.174 2.270 -3.891 860 HG12 ILE 106 HG12 ILE 106 3.917 3.967 -2.672 861 HG13 ILE 106 HG13 ILE 106 3.869 2.213 -2.840 862 HG21 ILE 106 HG21 ILE 106 5.817 5.269 -3.451 863 HG22 ILE 106 HG22 ILE 106 7.167 4.230 -2.938 864 HG23 ILE 106 HG23 ILE 106 6.922 4.615 -4.652 865 HD11 ILE 106 HD11 ILE 106 5.917 3.635 -1.109 866 HD12 ILE 106 HD12 ILE 106 4.380 2.970 -0.546 867 HD13 ILE 106 HD13 ILE 106 5.587 1.887 -1.226 868 H GLY 107 H GLY 107 5.580 1.161 -6.476 869 HA2 GLY 107 HA2 GLY 107 3.148 -0.470 -6.236 870 HA3 GLY 107 HA3 GLY 107 4.717 -0.952 -6.892 871 H ILE 108 H ILE 108 3.034 -2.216 -4.843 872 HA ILE 108 HA ILE 108 5.150 -2.551 -2.778 873 HB ILE 108 HB ILE 108 2.155 -2.830 -2.238 874 HG12 ILE 108 HG12 ILE 108 4.169 -0.626 -1.587 875 HG13 ILE 108 HG13 ILE 108 2.644 -0.467 -2.454 876 HG21 ILE 108 HG21 ILE 108 4.592 -3.020 -0.430 877 HG22 ILE 108 HG22 ILE 108 2.895 -3.177 0.096 878 HG23 ILE 108 HG23 ILE 108 3.578 -4.392 -0.944 879 HD11 ILE 108 HD11 ILE 108 2.977 -1.007 0.523 880 HD12 ILE 108 HD12 ILE 108 2.451 0.471 -0.252 881 HD13 ILE 108 HD13 ILE 108 1.413 -0.975 -0.348 882 H GLY 109 H GLY 109 5.587 -4.741 -2.306 883 HA2 GLY 109 HA2 GLY 109 3.875 -6.867 -3.477 884 HA3 GLY 109 HA3 GLY 109 5.612 -6.936 -3.772 885 H PHE 110 H PHE 110 3.396 -8.338 -1.979 886 HA PHE 110 HA PHE 110 4.803 -8.313 0.629 887 HB2 PHE 110 HB2 PHE 110 2.204 -9.464 -0.377 888 HB3 PHE 110 HB3 PHE 110 2.856 -9.908 1.182 889 HD1 PHE 110 HD1 PHE 110 1.762 -6.883 -0.791 890 HD2 PHE 110 HD2 PHE 110 2.744 -8.522 3.077 891 HE1 PHE 110 HE1 PHE 110 0.859 -4.851 0.311 892 HE2 PHE 110 HE2 PHE 110 1.760 -6.548 4.170 893 HZ PHE 110 HZ PHE 110 0.874 -4.669 2.776 894 H THR 111 H THR 111 5.121 -10.362 1.784 895 HA THR 111 HA THR 111 6.862 -12.101 0.222 896 HB THR 111 HB THR 111 7.291 -11.162 2.489 897 HG1 THR 111 HG1 THR 111 8.625 -12.752 1.797 898 HG21 THR 111 HG21 THR 111 6.559 -12.375 4.460 899 HG22 THR 111 HG22 THR 111 5.165 -11.703 3.601 900 HG23 THR 111 HG23 THR 111 5.539 -13.437 3.472 901 H ASP 112 H ASP 112 3.606 -12.245 1.315 902 HA ASP 112 HA ASP 112 3.244 -14.935 0.103 903 HB2 ASP 112 HB2 ASP 112 3.438 -14.953 2.702 904 HB3 ASP 112 HB3 ASP 112 1.855 -14.159 2.687 905 H ARG 113 H ARG 113 1.127 -15.354 -0.738 906 HA ARG 113 HA ARG 113 -0.437 -13.093 -1.685 907 HB2 ARG 113 HB2 ARG 113 -1.065 -16.080 -1.477 908 HB3 ARG 113 HB3 ARG 113 -2.164 -14.905 -2.189 909 HG2 ARG 113 HG2 ARG 113 0.597 -15.605 -3.231 910 HG3 ARG 113 HG3 ARG 113 -0.956 -16.093 -3.919 911 HD2 ARG 113 HD2 ARG 113 -1.532 -13.650 -4.213 912 HD3 ARG 113 HD3 ARG 113 0.097 -13.235 -3.731 913 HE ARG 113 HE ARG 113 -0.738 -14.111 -6.340 914 HH11 ARG 113 HH11 ARG 113 0.654 -14.623 -7.979 915 HH12 ARG 113 HH12 ARG 113 2.340 -14.886 -7.626 916 HH21 ARG 113 HH21 ARG 113 2.037 -14.596 -4.232 917 HH22 ARG 113 HH22 ARG 113 3.083 -14.953 -5.579 918 H GLY 114 H GLY 114 -0.742 -15.158 1.203 919 HA2 GLY 114 HA2 GLY 114 -3.318 -14.126 2.009 920 HA3 GLY 114 HA3 GLY 114 -2.109 -14.915 3.042 921 H ASP 115 H ASP 115 0.055 -13.054 2.640 922 HA ASP 115 HA ASP 115 -0.616 -11.081 4.598 923 HB2 ASP 115 HB2 ASP 115 1.813 -11.443 2.846 924 HB3 ASP 115 HB3 ASP 115 1.644 -10.136 4.015 925 H ALA 116 H ALA 116 -0.265 -10.834 1.091 926 HA ALA 116 HA ALA 116 -1.050 -8.034 0.943 927 HB1 ALA 116 HB1 ALA 116 -1.387 -8.818 -1.558 928 HB2 ALA 116 HB2 ALA 116 0.219 -8.644 -0.871 929 HB3 ALA 116 HB3 ALA 116 -0.498 -10.260 -0.993 930 H PHE 117 H PHE 117 -2.893 -11.130 0.237 931 HA PHE 117 HA PHE 117 -5.330 -9.847 -0.293 932 HB2 PHE 117 HB2 PHE 117 -4.758 -12.287 -0.515 933 HB3 PHE 117 HB3 PHE 117 -5.042 -12.452 1.218 934 HD1 PHE 117 HD1 PHE 117 -6.557 -12.016 -2.136 935 HD2 PHE 117 HD2 PHE 117 -7.376 -12.188 2.101 936 HE1 PHE 117 HE1 PHE 117 -8.936 -12.285 -2.608 937 HE2 PHE 117 HE2 PHE 117 -9.778 -12.590 1.606 938 HZ PHE 117 HZ PHE 117 -10.575 -12.610 -0.749 939 H ASP 118 H ASP 118 -3.848 -10.305 2.921 940 HA ASP 118 HA ASP 118 -6.179 -9.368 4.410 941 HB2 ASP 118 HB2 ASP 118 -3.257 -9.810 5.086 942 HB3 ASP 118 HB3 ASP 118 -4.380 -9.082 6.232 943 H PHE 119 H PHE 119 -3.306 -7.787 2.949 944 HA PHE 119 HA PHE 119 -3.725 -5.206 4.070 945 HB2 PHE 119 HB2 PHE 119 -1.675 -5.640 2.959 946 HB3 PHE 119 HB3 PHE 119 -2.449 -6.180 1.499 947 HD1 PHE 119 HD1 PHE 119 -0.936 -3.391 3.078 948 HD2 PHE 119 HD2 PHE 119 -3.727 -4.509 0.023 949 HE1 PHE 119 HE1 PHE 119 -0.793 -1.130 2.139 950 HE2 PHE 119 HE2 PHE 119 -3.508 -2.250 -0.999 951 HZ PHE 119 HZ PHE 119 -2.076 -0.540 0.084 952 H ASN 120 H ASN 120 -5.083 -6.794 1.183 953 HA ASN 120 HA ASN 120 -6.895 -4.684 0.446 954 HB2 ASN 120 HB2 ASN 120 -6.537 -6.117 -1.273 955 HB3 ASN 120 HB3 ASN 120 -6.431 -7.550 -0.242 956 HD21 ASN 120 HD21 ASN 120 -9.740 -8.510 -0.723 957 HD22 ASN 120 HD22 ASN 120 -8.193 -8.847 0.041 958 H VAL 121 H VAL 121 -7.564 -7.692 2.400 959 HA VAL 121 HA VAL 121 -10.299 -6.978 2.723 960 HB VAL 121 HB VAL 121 -8.528 -8.911 4.242 961 HG11 VAL 121 HG11 VAL 121 -10.288 -8.340 5.845 962 HG12 VAL 121 HG12 VAL 121 -11.535 -8.540 4.589 963 HG13 VAL 121 HG13 VAL 121 -10.603 -9.937 5.175 964 HG21 VAL 121 HG21 VAL 121 -10.827 -9.312 2.267 965 HG22 VAL 121 HG22 VAL 121 -9.103 -9.511 1.904 966 HG23 VAL 121 HG23 VAL 121 -9.884 -10.602 3.045 967 H SER 122 H SER 122 -7.509 -6.120 4.739 968 HA SER 122 HA SER 122 -8.844 -4.950 6.943 969 HB2 SER 122 HB2 SER 122 -6.388 -5.224 6.718 970 HB3 SER 122 HB3 SER 122 -6.363 -3.974 5.461 971 HG SER 122 HG SER 122 -7.270 -3.618 8.145 972 H LEU 123 H LEU 123 -8.404 -3.720 3.639 973 HA LEU 123 HA LEU 123 -9.604 -1.105 4.257 974 HB2 LEU 123 HB2 LEU 123 -8.616 -2.331 1.663 975 HB3 LEU 123 HB3 LEU 123 -9.152 -0.668 1.863 976 HG LEU 123 HG LEU 123 -6.844 -1.801 3.504 977 HD11 LEU 123 HD11 LEU 123 -6.682 -0.369 0.854 978 HD12 LEU 123 HD12 LEU 123 -5.313 -0.864 1.882 979 HD13 LEU 123 HD13 LEU 123 -6.333 -2.083 1.120 980 HD21 LEU 123 HD21 LEU 123 -6.220 0.544 3.746 981 HD22 LEU 123 HD22 LEU 123 -7.587 1.050 2.727 982 HD23 LEU 123 HD23 LEU 123 -7.869 0.310 4.320 983 H GLN 124 H GLN 124 -10.547 -4.103 2.475 984 HA GLN 124 HA GLN 124 -13.100 -3.220 1.597 985 HB2 GLN 124 HB2 GLN 124 -12.369 -5.997 2.638 986 HB3 GLN 124 HB3 GLN 124 -13.842 -5.557 1.773 987 HG2 GLN 124 HG2 GLN 124 -12.368 -4.809 -0.168 988 HG3 GLN 124 HG3 GLN 124 -11.011 -5.560 0.677 989 HE21 GLN 124 HE21 GLN 124 -12.097 -8.173 -1.624 990 HE22 GLN 124 HE22 GLN 124 -11.024 -6.769 -1.510 991 H ASP 125 H ASP 125 -12.282 -4.775 4.753 992 HA ASP 125 HA ASP 125 -14.957 -4.352 5.819 993 HB2 ASP 125 HB2 ASP 125 -13.316 -6.219 6.393 994 HB3 ASP 125 HB3 ASP 125 -12.373 -5.013 7.284 995 H HIS 126 H HIS 126 -12.398 -2.173 5.417 996 HA HIS 126 HA HIS 126 -13.183 -0.449 7.709 997 HB2 HIS 126 HB2 HIS 126 -10.835 -0.434 7.124 998 HB3 HIS 126 HB3 HIS 126 -11.211 0.045 5.464 999 HD2 HIS 126 HD2 HIS 126 -11.949 1.461 9.054 1000 HE1 HIS 126 HE1 HIS 126 -11.283 4.766 6.453 1001 HE2 HIS 126 HE2 HIS 126 -11.836 4.094 8.833 1002 H PHE 127 H PHE 127 -13.503 -0.539 4.131 1003 HA PHE 127 HA PHE 127 -15.297 1.778 4.266 1004 HB2 PHE 127 HB2 PHE 127 -14.135 0.236 1.957 1005 HB3 PHE 127 HB3 PHE 127 -15.342 1.504 1.758 1006 HD1 PHE 127 HD1 PHE 127 -11.812 0.850 2.394 1007 HD2 PHE 127 HD2 PHE 127 -14.894 3.847 2.646 1008 HE1 PHE 127 HE1 PHE 127 -10.080 2.596 2.671 1009 HE2 PHE 127 HE2 PHE 127 -13.161 5.590 2.987 1010 HZ PHE 127 HZ PHE 127 -10.753 4.966 2.983 1011 H LYS 128 H LYS 128 -15.839 -1.630 4.425 1012 HA LYS 128 HA LYS 128 -18.338 -1.796 3.193 1013 HB2 LYS 128 HB2 LYS 128 -18.677 -3.854 4.198 1014 HB3 LYS 128 HB3 LYS 128 -16.961 -3.697 3.961 1015 HG2 LYS 128 HG2 LYS 128 -16.974 -4.604 6.044 1016 HG3 LYS 128 HG3 LYS 128 -16.985 -2.891 6.508 1017 HD2 LYS 128 HD2 LYS 128 -19.545 -3.158 6.625 1018 HD3 LYS 128 HD3 LYS 128 -19.277 -4.882 6.360 1019 HE2 LYS 128 HE2 LYS 128 -18.042 -3.326 8.662 1020 HE3 LYS 128 HE3 LYS 128 -19.652 -4.042 8.759 1021 HZ1 LYS 128 HZ1 LYS 128 -18.632 -6.222 8.301 1022 HZ2 LYS 128 HZ2 LYS 128 -17.132 -5.556 8.296 1023 HZ3 LYS 128 HZ3 LYS 128 -18.019 -5.560 9.660 1024 H TRP 129 H TRP 129 -17.712 -0.305 6.284 1025 HA TRP 129 HA TRP 129 -20.634 -0.098 6.859 1026 HB2 TRP 129 HB2 TRP 129 -19.914 0.393 9.151 1027 HB3 TRP 129 HB3 TRP 129 -19.414 -1.180 8.569 1028 HD1 TRP 129 HD1 TRP 129 -16.795 -1.670 8.367 1029 HE1 TRP 129 HE1 TRP 129 -14.718 -0.449 9.091 1030 HE3 TRP 129 HE3 TRP 129 -18.913 2.803 9.579 1031 HZ2 TRP 129 HZ2 TRP 129 -13.997 2.203 10.096 1032 HZ3 TRP 129 HZ3 TRP 129 -17.500 4.701 10.382 1033 HH2 TRP 129 HH2 TRP 129 -15.040 4.421 10.594 1034 H VAL 130 H VAL 130 -18.572 1.681 5.175 1035 HA VAL 130 HA VAL 130 -19.895 4.301 5.763 1036 HB VAL 130 HB VAL 130 -17.678 5.288 4.837 1037 HG11 VAL 130 HG11 VAL 130 -17.932 4.147 7.615 1038 HG12 VAL 130 HG12 VAL 130 -16.763 5.392 7.153 1039 HG13 VAL 130 HG13 VAL 130 -18.505 5.734 7.075 1040 HG21 VAL 130 HG21 VAL 130 -15.665 4.198 5.350 1041 HG22 VAL 130 HG22 VAL 130 -16.537 2.747 5.881 1042 HG23 VAL 130 HG23 VAL 130 -16.638 3.296 4.172 1043 H LYS 131 H LYS 131 -18.684 5.471 3.401 1044 HA LYS 131 HA LYS 131 -19.256 5.921 1.291 1045 HB2 LYS 131 HB2 LYS 131 -17.732 3.758 1.345 1046 HB3 LYS 131 HB3 LYS 131 -19.176 2.943 0.767 1047 HG2 LYS 131 HG2 LYS 131 -17.921 3.459 -1.136 1048 HG3 LYS 131 HG3 LYS 131 -19.223 4.661 -1.120 1049 HD2 LYS 131 HD2 LYS 131 -17.666 6.364 -0.232 1050 HD3 LYS 131 HD3 LYS 131 -16.393 5.142 -0.112 1051 HE2 LYS 131 HE2 LYS 131 -15.955 6.384 -2.104 1052 HE3 LYS 131 HE3 LYS 131 -16.532 4.782 -2.585 1053 HZ1 LYS 131 HZ1 LYS 131 -18.722 5.776 -3.011 1054 HZ2 LYS 131 HZ2 LYS 131 -18.196 7.252 -2.540 1055 HZ3 LYS 131 HZ3 LYS 131 -17.586 6.556 -3.881 1056 H GLN 132 H GLN 132 -21.500 5.294 3.093 1057 HA GLN 132 HA GLN 132 -23.720 4.943 3.177 1058 HB2 GLN 132 HB2 GLN 132 -23.796 6.125 0.385 1059 HB3 GLN 132 HB3 GLN 132 -25.102 6.118 1.568 1060 HG2 GLN 132 HG2 GLN 132 -22.457 7.625 1.800 1061 HG3 GLN 132 HG3 GLN 132 -24.028 8.325 1.451 1062 HE21 GLN 132 HE21 GLN 132 -23.084 8.575 5.168 1063 HE22 GLN 132 HE22 GLN 132 -22.103 8.834 3.732 1064 H GLU 133 H GLU 133 -22.194 2.695 2.338 1065 HA GLU 133 HA GLU 133 -23.950 1.147 0.583 1066 HB2 GLU 133 HB2 GLU 133 -21.472 0.437 2.191 1067 HB3 GLU 133 HB3 GLU 133 -22.349 -0.729 1.208 1068 HG2 GLU 133 HG2 GLU 133 -21.154 1.842 0.074 1069 HG3 GLU 133 HG3 GLU 133 -20.301 0.314 0.134 1070 H1 SER 149 H1 SER 149 9.130 -25.770 -19.952 1071 H2 SER 149 H2 SER 149 8.116 -25.025 -18.901 1072 H3 SER 149 H3 SER 149 9.543 -25.633 -18.369 1073 HA SER 149 HA SER 149 10.797 -24.069 -19.641 1074 HB2 SER 149 HB2 SER 149 8.096 -22.971 -20.513 1075 HB3 SER 149 HB3 SER 149 9.694 -22.322 -20.936 1076 HG SER 149 HG SER 149 8.861 -23.701 -22.573 1077 H GLN 150 H GLN 150 11.382 -21.997 -18.785 1078 HA GLN 150 HA GLN 150 10.320 -21.455 -16.115 1079 HB2 GLN 150 HB2 GLN 150 12.465 -20.079 -17.774 1080 HB3 GLN 150 HB3 GLN 150 12.038 -19.648 -16.111 1081 HG2 GLN 150 HG2 GLN 150 12.624 -21.943 -15.356 1082 HG3 GLN 150 HG3 GLN 150 13.095 -22.370 -17.001 1083 HE21 GLN 150 HE21 GLN 150 16.267 -21.556 -15.345 1084 HE22 GLN 150 HE22 GLN 150 15.066 -22.842 -15.332 1085 H ILE 151 H ILE 151 9.259 -19.653 -15.391 1086 HA ILE 151 HA ILE 151 8.213 -17.629 -17.299 1087 HB ILE 151 HB ILE 151 6.443 -19.143 -15.335 1088 HG12 ILE 151 HG12 ILE 151 6.550 -19.389 -18.377 1089 HG13 ILE 151 HG13 ILE 151 7.027 -20.628 -17.214 1090 HG21 ILE 151 HG21 ILE 151 5.747 -17.074 -17.476 1091 HG22 ILE 151 HG22 ILE 151 4.589 -17.897 -16.408 1092 HG23 ILE 151 HG23 ILE 151 5.745 -16.789 -15.722 1093 HD11 ILE 151 HD11 ILE 151 4.668 -20.707 -16.366 1094 HD12 ILE 151 HD12 ILE 151 4.207 -19.661 -17.736 1095 HD13 ILE 151 HD13 ILE 151 4.904 -21.255 -18.037 1096 H THR 152 H THR 152 7.860 -15.593 -16.326 1097 HA THR 152 HA THR 152 9.269 -14.970 -13.882 1098 HB THR 152 HB THR 152 8.027 -12.727 -14.177 1099 HG1 THR 152 HG1 THR 152 7.162 -12.418 -16.231 1100 HG21 THR 152 HG21 THR 152 9.797 -13.720 -16.447 1101 HG22 THR 152 HG22 THR 152 9.476 -12.021 -16.014 1102 HG23 THR 152 HG23 THR 152 10.353 -13.064 -14.888 1103 H SER 153 H SER 153 8.484 -14.262 -11.913 1104 HA SER 153 HA SER 153 6.035 -15.481 -10.952 1105 HB2 SER 153 HB2 SER 153 7.980 -13.649 -9.538 1106 HB3 SER 153 HB3 SER 153 6.739 -14.675 -8.781 1107 HG SER 153 HG SER 153 8.826 -15.666 -8.742 1108 H GLN 154 H GLN 154 5.172 -13.908 -12.762 1109 HA GLN 154 HA GLN 154 4.638 -11.206 -12.319 1110 HB2 GLN 154 HB2 GLN 154 3.019 -11.364 -14.110 1111 HB3 GLN 154 HB3 GLN 154 4.496 -12.239 -14.501 1112 HG2 GLN 154 HG2 GLN 154 3.439 -14.381 -14.093 1113 HG3 GLN 154 HG3 GLN 154 2.002 -13.618 -13.404 1114 HE21 GLN 154 HE21 GLN 154 0.587 -12.726 -16.575 1115 HE22 GLN 154 HE22 GLN 154 0.611 -12.286 -14.865 1116 H VAL 155 H VAL 155 2.495 -10.122 -12.111 1117 HA VAL 155 HA VAL 155 0.638 -11.224 -10.129 1118 HB VAL 155 HB VAL 155 0.780 -8.859 -10.239 1119 HG11 VAL 155 HG11 VAL 155 0.101 -7.489 -12.129 1120 HG12 VAL 155 HG12 VAL 155 1.533 -8.480 -12.519 1121 HG13 VAL 155 HG13 VAL 155 -0.083 -8.926 -13.132 1122 HG21 VAL 155 HG21 VAL 155 -1.397 -9.467 -9.553 1123 HG22 VAL 155 HG22 VAL 155 -1.647 -8.181 -10.710 1124 HG23 VAL 155 HG23 VAL 155 -1.928 -9.841 -11.208 1125 H TPO 156 H T2P 156 -0.610 -12.844 -10.558 1126 HA TPO 156 HA T2P 156 -1.303 -14.080 -13.057 1127 HB TPO 156 HB T2P 156 -2.517 -14.104 -10.348 1128 HG21 TPO 156 HG21 T2P 156 -3.851 -15.514 -12.586 1129 HG22 TPO 156 HG22 T2P 156 -4.480 -14.283 -11.446 1130 HG23 TPO 156 HG23 T2P 156 -4.033 -15.887 -10.857 1131 H GLY 157 H GLY 157 -3.051 -14.090 -14.124 1132 HA2 GLY 157 HA2 GLY 157 -5.269 -12.174 -13.930 1133 HA3 GLY 157 HA3 GLY 157 -4.209 -11.866 -15.313 1134 H GLN 158 H GLN 158 -3.771 -14.943 -15.382 1135 HA GLN 158 HA GLN 158 -5.749 -15.714 -17.256 1136 HB2 GLN 158 HB2 GLN 158 -4.603 -17.784 -17.320 1137 HB3 GLN 158 HB3 GLN 158 -3.401 -16.520 -17.187 1138 HG2 GLN 158 HG2 GLN 158 -4.331 -18.295 -14.874 1139 HG3 GLN 158 HG3 GLN 158 -2.939 -18.617 -15.884 1140 HE21 GLN 158 HE21 GLN 158 -1.698 -17.047 -12.746 1141 HE22 GLN 158 HE22 GLN 158 -2.447 -18.565 -13.224 1142 H ILE 159 H ILE 159 -5.984 -15.684 -13.864 1143 HA ILE 159 HA ILE 159 -8.586 -17.046 -14.012 1144 HB ILE 159 HB ILE 159 -7.026 -18.815 -13.388 1145 HG12 ILE 159 HG12 ILE 159 -8.092 -19.657 -11.334 1146 HG13 ILE 159 HG13 ILE 159 -8.824 -18.082 -11.044 1147 HG21 ILE 159 HG21 ILE 159 -5.264 -17.556 -12.260 1148 HG22 ILE 159 HG22 ILE 159 -6.357 -17.215 -10.895 1149 HG23 ILE 159 HG23 ILE 159 -5.850 -18.870 -11.249 1150 HD11 ILE 159 HD11 ILE 159 -10.386 -19.734 -12.063 1151 HD12 ILE 159 HD12 ILE 159 -10.183 -18.309 -13.091 1152 HD13 ILE 159 HD13 ILE 159 -9.343 -19.827 -13.496 1153 H GLY 160 H GLY 160 -6.399 -15.010 -12.123 1154 HA2 GLY 160 HA2 GLY 160 -6.832 -13.019 -11.020 1155 HA3 GLY 160 HA3 GLY 160 -8.461 -13.044 -11.701 1156 H TRP 161 H TRP 161 -6.798 -15.234 -9.426 1157 HA TRP 161 HA TRP 161 -9.200 -15.333 -7.724 1158 HB2 TRP 161 HB2 TRP 161 -8.478 -17.508 -7.115 1159 HB3 TRP 161 HB3 TRP 161 -8.507 -17.323 -8.846 1160 HD1 TRP 161 HD1 TRP 161 -5.332 -15.811 -8.082 1161 HE1 TRP 161 HE1 TRP 161 -3.408 -17.445 -8.511 1162 HE3 TRP 161 HE3 TRP 161 -7.977 -20.157 -7.814 1163 HZ2 TRP 161 HZ2 TRP 161 -3.057 -20.326 -8.609 1164 HZ3 TRP 161 HZ3 TRP 161 -6.823 -22.362 -8.062 1165 HH2 TRP 161 HH2 TRP 161 -4.372 -22.451 -8.468 1166 H ARG 162 H ARG 162 -7.215 -16.726 -5.804 1167 HA ARG 162 HA ARG 162 -7.335 -14.376 -3.936 1168 HB2 ARG 162 HB2 ARG 162 -8.511 -17.185 -3.641 1169 HB3 ARG 162 HB3 ARG 162 -8.713 -15.864 -2.485 1170 HG2 ARG 162 HG2 ARG 162 -9.796 -15.882 -5.333 1171 HG3 ARG 162 HG3 ARG 162 -10.715 -16.234 -3.875 1172 HD2 ARG 162 HD2 ARG 162 -10.387 -13.992 -3.015 1173 HD3 ARG 162 HD3 ARG 162 -9.303 -13.566 -4.334 1174 HE ARG 162 HE ARG 162 -12.258 -13.918 -4.464 1175 HH11 ARG 162 HH11 ARG 162 -13.349 -13.226 -6.275 1176 HH12 ARG 162 HH12 ARG 162 -12.459 -12.589 -7.627 1177 HH21 ARG 162 HH21 ARG 162 -9.355 -13.041 -6.264 1178 HH22 ARG 162 HH22 ARG 162 -10.263 -12.682 -7.695 1179 H ARG 163 H ARG 163 -7.044 -15.880 -1.605 1180 HA ARG 163 HA ARG 163 -4.289 -15.851 -1.027 1181 HB2 ARG 163 HB2 ARG 163 -6.404 -17.576 0.328 1182 HB3 ARG 163 HB3 ARG 163 -4.859 -17.061 1.008 1183 HG2 ARG 163 HG2 ARG 163 -5.662 -14.677 0.915 1184 HG3 ARG 163 HG3 ARG 163 -7.228 -15.261 0.334 1185 HD2 ARG 163 HD2 ARG 163 -7.651 -15.064 2.584 1186 HD3 ARG 163 HD3 ARG 163 -7.232 -16.763 2.468 1187 HE ARG 163 HE ARG 163 -5.040 -16.286 3.407 1188 HH11 ARG 163 HH11 ARG 163 -3.852 -15.174 4.975 1189 HH12 ARG 163 HH12 ARG 163 -4.387 -13.582 5.479 1190 HH21 ARG 163 HH21 ARG 163 -7.333 -13.673 3.788 1191 HH22 ARG 163 HH22 ARG 163 -6.308 -12.820 4.929 Start of MODEL 30 1 H1 GLY -4 H1 GLY -4 2.585 16.717 16.139 2 H2 GLY -4 H2 GLY -4 2.376 15.943 17.566 3 H3 GLY -4 H3 GLY -4 3.822 16.629 17.212 4 HA2 GLY -4 HA2 GLY -4 2.633 17.992 18.796 5 HA3 GLY -4 HA3 GLY -4 2.874 18.833 17.254 6 H SER -3 H SER -3 0.917 19.683 18.974 7 HA SER -3 HA SER -3 -1.681 18.590 18.556 8 HB2 SER -3 HB2 SER -3 -0.887 21.443 19.263 9 HB3 SER -3 HB3 SER -3 -2.474 20.710 19.533 10 HG SER -3 HG SER -3 -1.507 19.252 20.993 11 HA PRO -2 HA PRO -2 -2.882 20.367 14.585 12 HB2 PRO -2 HB2 PRO -2 -5.582 20.692 14.884 13 HB3 PRO -2 HB3 PRO -2 -4.807 19.083 14.736 14 HG2 PRO -2 HG2 PRO -2 -5.607 20.533 17.281 15 HG3 PRO -2 HG3 PRO -2 -5.998 18.848 16.802 16 HD2 PRO -2 HD2 PRO -2 -3.905 19.394 18.428 17 HD3 PRO -2 HD3 PRO -2 -3.772 18.127 17.174 18 H ASN -1 H ASN -1 -3.651 22.383 13.629 19 HA ASN -1 HA ASN -1 -2.937 24.757 15.078 20 HB2 ASN -1 HB2 ASN -1 -4.446 24.322 12.458 21 HB3 ASN -1 HB3 ASN -1 -3.998 25.910 13.071 22 HD21 ASN -1 HD21 ASN -1 -1.355 25.027 10.697 23 HD22 ASN -1 HD22 ASN -1 -3.078 25.376 10.635 24 H SER 0 H SER 0 -6.097 23.255 14.452 25 HA SER 0 HA SER 0 -7.072 24.371 16.949 26 HB2 SER 0 HB2 SER 0 -7.798 26.156 15.421 27 HB3 SER 0 HB3 SER 0 -8.580 24.962 14.366 28 HG SER 0 HG SER 0 -9.940 26.083 15.998 29 H MET 1 H MET 1 -8.592 23.017 17.887 30 HA MET 1 HA MET 1 -9.034 20.368 16.819 31 HB2 MET 1 HB2 MET 1 -10.242 21.878 19.167 32 HB3 MET 1 HB3 MET 1 -10.691 20.227 18.733 33 HG2 MET 1 HG2 MET 1 -9.069 20.024 20.422 34 HG3 MET 1 HG3 MET 1 -8.306 19.533 18.916 35 HE1 MET 1 HE1 MET 1 -6.634 19.982 21.527 36 HE2 MET 1 HE2 MET 1 -5.933 19.566 19.947 37 HE3 MET 1 HE3 MET 1 -5.260 20.912 20.891 38 H ALA 2 H ALA 2 -10.576 23.371 16.140 39 HA ALA 2 HA ALA 2 -13.066 22.178 15.133 40 HB1 ALA 2 HB1 ALA 2 -11.916 24.980 14.823 41 HB2 ALA 2 HB2 ALA 2 -13.573 24.466 14.456 42 HB3 ALA 2 HB3 ALA 2 -12.998 24.445 16.132 43 H THR 3 H THR 3 -9.836 22.475 13.876 44 HA THR 3 HA THR 3 -10.841 22.195 11.076 45 HB THR 3 HB THR 3 -8.775 23.218 10.299 46 HG1 THR 3 HG1 THR 3 -7.394 24.189 11.758 47 HG21 THR 3 HG21 THR 3 -10.123 24.982 12.388 48 HG22 THR 3 HG22 THR 3 -9.214 25.518 10.957 49 HG23 THR 3 HG23 THR 3 -10.755 24.664 10.756 50 H GLU 4 H GLU 4 -8.775 20.752 13.444 51 HA GLU 4 HA GLU 4 -8.665 18.320 11.805 52 HB2 GLU 4 HB2 GLU 4 -6.630 19.498 11.098 53 HB3 GLU 4 HB3 GLU 4 -6.156 19.750 12.770 54 HG2 GLU 4 HG2 GLU 4 -4.848 17.960 11.799 55 HG3 GLU 4 HG3 GLU 4 -5.868 17.326 13.082 56 H LEU 5 H LEU 5 -8.238 16.445 13.043 57 HA LEU 5 HA LEU 5 -8.224 16.632 15.993 58 HB2 LEU 5 HB2 LEU 5 -10.401 15.282 14.342 59 HB3 LEU 5 HB3 LEU 5 -10.075 14.870 16.023 60 HG LEU 5 HG LEU 5 -10.911 17.646 15.075 61 HD11 LEU 5 HD11 LEU 5 -12.512 15.458 16.464 62 HD12 LEU 5 HD12 LEU 5 -13.083 17.097 16.077 63 HD13 LEU 5 HD13 LEU 5 -12.691 15.969 14.771 64 HD21 LEU 5 HD21 LEU 5 -10.619 16.437 17.871 65 HD22 LEU 5 HD22 LEU 5 -9.664 17.776 17.189 66 HD23 LEU 5 HD23 LEU 5 -11.382 18.001 17.512 67 H GLU 6 H GLU 6 -6.077 16.105 15.389 68 HA GLU 6 HA GLU 6 -5.286 13.828 13.936 69 HB2 GLU 6 HB2 GLU 6 -3.984 15.574 15.998 70 HB3 GLU 6 HB3 GLU 6 -3.148 14.102 15.488 71 HG2 GLU 6 HG2 GLU 6 -4.050 16.262 13.570 72 HG3 GLU 6 HG3 GLU 6 -2.453 16.172 14.285 73 H TYR 7 H TYR 7 -6.540 12.048 14.464 74 HA TYR 7 HA TYR 7 -5.044 10.358 16.338 75 HB2 TYR 7 HB2 TYR 7 -6.881 9.194 17.207 76 HB3 TYR 7 HB3 TYR 7 -7.295 10.882 17.411 77 HD1 TYR 7 HD1 TYR 7 -9.058 11.917 15.909 78 HD2 TYR 7 HD2 TYR 7 -8.209 7.686 15.900 79 HE1 TYR 7 HE1 TYR 7 -11.202 11.486 14.722 80 HE2 TYR 7 HE2 TYR 7 -10.341 7.255 14.709 81 HH TYR 7 HH TYR 7 -12.594 9.905 13.813 82 H GLU 8 H GLU 8 -5.686 7.987 15.808 83 HA GLU 8 HA GLU 8 -6.769 7.292 13.294 84 HB2 GLU 8 HB2 GLU 8 -4.889 6.306 12.144 85 HB3 GLU 8 HB3 GLU 8 -4.569 8.009 12.370 86 HG2 GLU 8 HG2 GLU 8 -3.217 7.282 14.492 87 HG3 GLU 8 HG3 GLU 8 -3.296 5.658 13.781 88 H SER 9 H SER 9 -7.660 5.372 13.578 89 HA SER 9 HA SER 9 -6.965 3.710 15.893 90 HB2 SER 9 HB2 SER 9 -9.241 3.726 13.901 91 HB3 SER 9 HB3 SER 9 -9.050 2.453 15.130 92 HG SER 9 HG SER 9 -10.403 4.169 15.862 93 H VAL 10 H VAL 10 -5.856 1.731 15.759 94 HA VAL 10 HA VAL 10 -4.671 1.036 13.233 95 HB VAL 10 HB VAL 10 -3.534 0.743 15.378 96 HG11 VAL 10 HG11 VAL 10 -5.259 -1.738 15.766 97 HG12 VAL 10 HG12 VAL 10 -3.897 -1.214 16.772 98 HG13 VAL 10 HG13 VAL 10 -5.377 -0.246 16.723 99 HG21 VAL 10 HG21 VAL 10 -2.755 -0.407 13.321 100 HG22 VAL 10 HG22 VAL 10 -2.361 -1.291 14.804 101 HG23 VAL 10 HG23 VAL 10 -3.697 -1.844 13.784 102 H LEU 11 H LEU 11 -4.946 -0.597 11.811 103 HA LEU 11 HA LEU 11 -7.469 -2.211 12.004 104 HB2 LEU 11 HB2 LEU 11 -6.249 -0.891 9.549 105 HB3 LEU 11 HB3 LEU 11 -7.612 -1.998 9.546 106 HG LEU 11 HG LEU 11 -7.597 0.780 10.781 107 HD11 LEU 11 HD11 LEU 11 -8.855 -0.433 8.282 108 HD12 LEU 11 HD12 LEU 11 -9.263 1.164 8.919 109 HD13 LEU 11 HD13 LEU 11 -7.618 0.840 8.357 110 HD21 LEU 11 HD21 LEU 11 -9.118 -0.662 12.062 111 HD22 LEU 11 HD22 LEU 11 -10.051 0.419 11.030 112 HD23 LEU 11 HD23 LEU 11 -9.840 -1.281 10.555 113 H CYS 12 H CYS 12 -4.192 -2.054 10.502 114 HA CYS 12 HA CYS 12 -3.934 -4.968 10.803 115 HB2 CYS 12 HB2 CYS 12 -4.988 -4.655 8.584 116 HB3 CYS 12 HB3 CYS 12 -3.601 -3.683 8.070 117 HG CYS 12 HG CYS 12 -3.564 -6.092 7.008 118 H VAL 13 H VAL 13 -1.909 -5.787 10.713 119 HA VAL 13 HA VAL 13 0.403 -4.042 10.319 120 HB VAL 13 HB VAL 13 0.063 -3.897 12.706 121 HG11 VAL 13 HG11 VAL 13 0.223 -5.789 14.233 122 HG12 VAL 13 HG12 VAL 13 -1.172 -5.982 13.167 123 HG13 VAL 13 HG13 VAL 13 0.304 -6.927 12.876 124 HG21 VAL 13 HG21 VAL 13 2.249 -4.603 13.489 125 HG22 VAL 13 HG22 VAL 13 2.416 -5.758 12.154 126 HG23 VAL 13 HG23 VAL 13 2.401 -4.013 11.831 127 H LYS 14 H LYS 14 1.925 -5.079 9.168 128 HA LYS 14 HA LYS 14 1.948 -8.044 9.249 129 HB2 LYS 14 HB2 LYS 14 2.136 -6.430 6.687 130 HB3 LYS 14 HB3 LYS 14 2.628 -8.107 6.785 131 HG2 LYS 14 HG2 LYS 14 -0.164 -7.134 7.508 132 HG3 LYS 14 HG3 LYS 14 0.293 -7.744 5.926 133 HD2 LYS 14 HD2 LYS 14 0.842 -9.921 6.788 134 HD3 LYS 14 HD3 LYS 14 0.614 -9.430 8.462 135 HE2 LYS 14 HE2 LYS 14 -1.607 -9.268 6.406 136 HE3 LYS 14 HE3 LYS 14 -1.285 -10.725 7.369 137 HZ1 LYS 14 HZ1 LYS 14 -2.979 -9.216 8.346 138 HZ2 LYS 14 HZ2 LYS 14 -1.715 -9.490 9.371 139 HZ3 LYS 14 HZ3 LYS 14 -1.839 -8.070 8.571 140 HA PRO 15 HA PRO 15 5.958 -7.698 10.569 141 HB2 PRO 15 HB2 PRO 15 6.809 -10.276 10.543 142 HB3 PRO 15 HB3 PRO 15 5.384 -9.758 11.493 143 HG2 PRO 15 HG2 PRO 15 5.393 -10.986 8.703 144 HG3 PRO 15 HG3 PRO 15 4.455 -11.521 10.137 145 HD2 PRO 15 HD2 PRO 15 3.372 -9.884 8.276 146 HD3 PRO 15 HD3 PRO 15 3.024 -9.687 10.020 147 H ASP 16 H ASP 16 5.667 -8.662 7.238 148 HA ASP 16 HA ASP 16 8.271 -7.461 6.679 149 HB2 ASP 16 HB2 ASP 16 8.852 -9.855 6.959 150 HB3 ASP 16 HB3 ASP 16 7.643 -10.291 5.748 151 H VAL 17 H VAL 17 8.176 -6.265 4.852 152 HA VAL 17 HA VAL 17 6.409 -6.967 2.627 153 HB VAL 17 HB VAL 17 4.942 -5.654 4.160 154 HG11 VAL 17 HG11 VAL 17 5.209 -3.268 4.440 155 HG12 VAL 17 HG12 VAL 17 6.626 -4.100 5.100 156 HG13 VAL 17 HG13 VAL 17 6.729 -3.287 3.528 157 HG21 VAL 17 HG21 VAL 17 4.566 -5.712 1.713 158 HG22 VAL 17 HG22 VAL 17 4.004 -4.220 2.476 159 HG23 VAL 17 HG23 VAL 17 5.518 -4.216 1.555 160 H SER 18 H SER 18 7.083 -6.057 0.674 161 HA SER 18 HA SER 18 9.544 -4.362 0.735 162 HB2 SER 18 HB2 SER 18 10.456 -5.531 -1.068 163 HB3 SER 18 HB3 SER 18 9.921 -6.760 0.075 164 HG SER 18 HG SER 18 7.941 -6.841 -1.271 165 H VAL 19 H VAL 19 9.846 -2.840 -0.905 166 HA VAL 19 HA VAL 19 7.334 -1.878 -2.243 167 HB VAL 19 HB VAL 19 9.314 -0.435 -0.516 168 HG11 VAL 19 HG11 VAL 19 7.462 0.802 -2.572 169 HG12 VAL 19 HG12 VAL 19 8.197 1.701 -1.237 170 HG13 VAL 19 HG13 VAL 19 9.230 0.998 -2.465 171 HG21 VAL 19 HG21 VAL 19 7.282 -1.417 0.509 172 HG22 VAL 19 HG22 VAL 19 7.229 0.344 0.530 173 HG23 VAL 19 HG23 VAL 19 6.271 -0.546 -0.661 174 H TYR 20 H TYR 20 7.439 -1.053 -4.186 175 HA TYR 20 HA TYR 20 10.097 -0.641 -5.515 176 HB2 TYR 20 HB2 TYR 20 7.700 -1.470 -7.134 177 HB3 TYR 20 HB3 TYR 20 9.402 -1.669 -7.468 178 HD1 TYR 20 HD1 TYR 20 10.661 -3.538 -6.298 179 HD2 TYR 20 HD2 TYR 20 6.388 -3.126 -6.078 180 HE1 TYR 20 HE1 TYR 20 10.480 -5.906 -5.508 181 HE2 TYR 20 HE2 TYR 20 6.192 -5.510 -5.388 182 HH TYR 20 HH TYR 20 9.050 -7.593 -4.875 183 H ARG 21 H ARG 21 10.200 1.657 -5.552 184 HA ARG 21 HA ARG 21 8.016 3.405 -6.295 185 HB2 ARG 21 HB2 ARG 21 11.037 3.670 -6.589 186 HB3 ARG 21 HB3 ARG 21 9.906 4.915 -7.132 187 HG2 ARG 21 HG2 ARG 21 8.997 5.146 -4.863 188 HG3 ARG 21 HG3 ARG 21 10.115 3.909 -4.257 189 HD2 ARG 21 HD2 ARG 21 12.026 5.354 -4.801 190 HD3 ARG 21 HD3 ARG 21 10.963 6.504 -5.609 191 HE ARG 21 HE ARG 21 10.145 7.299 -3.546 192 HH11 ARG 21 HH11 ARG 21 10.401 7.880 -1.562 193 HH12 ARG 21 HH12 ARG 21 11.516 7.062 -0.477 194 HH21 ARG 21 HH21 ARG 21 12.472 4.710 -2.847 195 HH22 ARG 21 HH22 ARG 21 12.696 5.318 -1.230 196 H ILE 22 H ILE 22 7.042 3.844 -8.189 197 HA ILE 22 HA ILE 22 8.042 2.418 -10.617 198 HB ILE 22 HB ILE 22 5.781 1.931 -11.281 199 HG12 ILE 22 HG12 ILE 22 4.943 3.267 -8.688 200 HG13 ILE 22 HG13 ILE 22 4.489 3.705 -10.341 201 HG21 ILE 22 HG21 ILE 22 6.258 0.908 -8.493 202 HG22 ILE 22 HG22 ILE 22 5.343 0.140 -9.784 203 HG23 ILE 22 HG23 ILE 22 7.093 0.316 -9.949 204 HD11 ILE 22 HD11 ILE 22 3.571 1.292 -8.757 205 HD12 ILE 22 HD12 ILE 22 2.617 2.659 -9.347 206 HD13 ILE 22 HD13 ILE 22 3.287 1.489 -10.506 207 HA PRO 23 HA PRO 23 7.554 6.332 -12.636 208 HB2 PRO 23 HB2 PRO 23 7.937 5.616 -15.278 209 HB3 PRO 23 HB3 PRO 23 9.208 5.849 -14.048 210 HG2 PRO 23 HG2 PRO 23 8.048 3.278 -15.073 211 HG3 PRO 23 HG3 PRO 23 9.717 3.639 -14.569 212 HD2 PRO 23 HD2 PRO 23 7.841 2.321 -12.981 213 HD3 PRO 23 HD3 PRO 23 9.256 3.211 -12.355 214 HA PRO 24 HA PRO 24 3.717 5.790 -15.385 215 HB2 PRO 24 HB2 PRO 24 2.156 3.570 -15.398 216 HB3 PRO 24 HB3 PRO 24 3.679 3.667 -16.335 217 HG2 PRO 24 HG2 PRO 24 3.280 2.467 -13.566 218 HG3 PRO 24 HG3 PRO 24 4.038 1.699 -15.000 219 HD2 PRO 24 HD2 PRO 24 5.516 2.940 -13.101 220 HD3 PRO 24 HD3 PRO 24 5.953 3.054 -14.830 221 H ARG 25 H ARG 25 1.438 6.112 -15.063 222 HA ARG 25 HA ARG 25 0.354 5.828 -12.275 223 HB2 ARG 25 HB2 ARG 25 -0.776 7.937 -12.453 224 HB3 ARG 25 HB3 ARG 25 0.959 8.171 -12.659 225 HG2 ARG 25 HG2 ARG 25 0.687 8.405 -15.093 226 HG3 ARG 25 HG3 ARG 25 -1.045 8.034 -14.969 227 HD2 ARG 25 HD2 ARG 25 -1.419 10.029 -13.615 228 HD3 ARG 25 HD3 ARG 25 0.318 10.415 -13.657 229 HE ARG 25 HE ARG 25 -0.589 10.163 -16.336 230 HH11 ARG 25 HH11 ARG 25 -1.028 11.915 -17.633 231 HH12 ARG 25 HH12 ARG 25 -1.381 13.459 -16.916 232 HH21 ARG 25 HH21 ARG 25 -1.072 12.387 -13.673 233 HH22 ARG 25 HH22 ARG 25 -1.408 13.728 -14.735 234 H ALA 26 H ALA 26 -0.335 5.469 -15.674 235 HA ALA 26 HA ALA 26 -2.788 3.987 -15.070 236 HB1 ALA 26 HB1 ALA 26 -2.890 6.704 -16.463 237 HB2 ALA 26 HB2 ALA 26 -4.255 5.568 -16.268 238 HB3 ALA 26 HB3 ALA 26 -3.517 6.339 -14.847 239 H SER 27 H SER 27 -2.177 2.298 -16.159 240 HA SER 27 HA SER 27 -1.962 2.482 -19.133 241 HB2 SER 27 HB2 SER 27 -0.267 1.057 -17.913 242 HB3 SER 27 HB3 SER 27 -1.607 0.022 -17.393 243 HG SER 27 HG SER 27 -0.704 0.587 -20.039 244 H ASN 28 H ASN 28 -3.264 0.797 -20.216 245 HA ASN 28 HA ASN 28 -5.997 1.319 -19.990 246 HB2 ASN 28 HB2 ASN 28 -6.230 -0.178 -21.818 247 HB3 ASN 28 HB3 ASN 28 -4.641 0.550 -22.007 248 HD21 ASN 28 HD21 ASN 28 -2.995 -2.640 -21.188 249 HD22 ASN 28 HD22 ASN 28 -2.791 -0.954 -20.768 250 H ARG 29 H ARG 29 -4.230 -1.288 -18.453 251 HA ARG 29 HA ARG 29 -6.725 -2.547 -17.370 252 HB2 ARG 29 HB2 ARG 29 -3.960 -3.549 -17.926 253 HB3 ARG 29 HB3 ARG 29 -5.043 -4.419 -16.824 254 HG2 ARG 29 HG2 ARG 29 -6.564 -4.990 -18.412 255 HG3 ARG 29 HG3 ARG 29 -6.275 -3.549 -19.410 256 HD2 ARG 29 HD2 ARG 29 -4.360 -4.367 -20.364 257 HD3 ARG 29 HD3 ARG 29 -4.071 -5.529 -19.071 258 HE ARG 29 HE ARG 29 -5.409 -7.111 -20.068 259 HH11 ARG 29 HH11 ARG 29 -6.647 -8.077 -21.600 260 HH12 ARG 29 HH12 ARG 29 -7.322 -7.139 -22.898 261 HH21 ARG 29 HH21 ARG 29 -5.989 -4.144 -21.891 262 HH22 ARG 29 HH22 ARG 29 -6.982 -4.989 -23.049 263 H GLY 30 H GLY 30 -4.460 -0.398 -16.448 264 HA2 GLY 30 HA2 GLY 30 -4.831 0.527 -14.105 265 HA3 GLY 30 HA3 GLY 30 -4.498 -1.114 -13.529 266 H TYR 31 H TYR 31 -2.445 -1.599 -13.049 267 HA TYR 31 HA TYR 31 -0.216 0.237 -13.936 268 HB2 TYR 31 HB2 TYR 31 -0.850 -1.080 -11.280 269 HB3 TYR 31 HB3 TYR 31 0.778 -0.574 -11.688 270 HD1 TYR 31 HD1 TYR 31 1.431 1.704 -11.935 271 HD2 TYR 31 HD2 TYR 31 -2.601 0.590 -10.886 272 HE1 TYR 31 HE1 TYR 31 1.053 3.985 -11.001 273 HE2 TYR 31 HE2 TYR 31 -3.025 2.915 -10.043 274 HH TYR 31 HH TYR 31 -2.108 4.975 -9.625 275 H ARG 32 H ARG 32 -1.147 -3.077 -13.437 276 HA ARG 32 HA ARG 32 -0.103 -5.040 -13.358 277 HB2 ARG 32 HB2 ARG 32 1.374 -5.027 -15.781 278 HB3 ARG 32 HB3 ARG 32 -0.150 -5.756 -15.347 279 HG2 ARG 32 HG2 ARG 32 -0.519 -4.631 -17.331 280 HG3 ARG 32 HG3 ARG 32 -1.349 -3.676 -16.117 281 HD2 ARG 32 HD2 ARG 32 0.083 -1.873 -16.355 282 HD3 ARG 32 HD3 ARG 32 1.465 -2.861 -16.790 283 HE ARG 32 HE ARG 32 -0.472 -1.621 -18.561 284 HH11 ARG 32 HH11 ARG 32 -0.146 -1.640 -20.688 285 HH12 ARG 32 HH12 ARG 32 0.871 -2.844 -21.435 286 HH21 ARG 32 HH21 ARG 32 1.740 -4.351 -18.471 287 HH22 ARG 32 HH22 ARG 32 1.946 -4.326 -20.200 288 H ALA 33 H ALA 33 1.264 -5.518 -11.778 289 HA ALA 33 HA ALA 33 3.780 -4.471 -11.216 290 HB1 ALA 33 HB1 ALA 33 2.446 -6.085 -9.806 291 HB2 ALA 33 HB2 ALA 33 2.970 -7.392 -10.888 292 HB3 ALA 33 HB3 ALA 33 4.156 -6.480 -9.930 293 H SER 34 H SER 34 2.983 -7.018 -13.504 294 HA SER 34 HA SER 34 5.447 -7.956 -14.376 295 HB2 SER 34 HB2 SER 34 2.829 -7.431 -15.851 296 HB3 SER 34 HB3 SER 34 4.112 -8.540 -16.415 297 HG SER 34 HG SER 34 2.441 -9.613 -15.318 298 H ASP 35 H ASP 35 4.156 -4.731 -14.983 299 HA ASP 35 HA ASP 35 5.826 -4.269 -17.371 300 HB2 ASP 35 HB2 ASP 35 3.502 -3.402 -17.095 301 HB3 ASP 35 HB3 ASP 35 4.069 -2.361 -15.781 302 H TRP 36 H TRP 36 6.263 -3.999 -13.945 303 HA TRP 36 HA TRP 36 8.692 -2.324 -14.321 304 HB2 TRP 36 HB2 TRP 36 8.021 -1.436 -11.904 305 HB3 TRP 36 HB3 TRP 36 7.572 -0.675 -13.401 306 HD1 TRP 36 HD1 TRP 36 5.123 -0.497 -14.048 307 HE1 TRP 36 HE1 TRP 36 2.896 -0.965 -12.880 308 HE3 TRP 36 HE3 TRP 36 6.863 -3.086 -9.987 309 HZ2 TRP 36 HZ2 TRP 36 2.060 -1.819 -10.235 310 HZ3 TRP 36 HZ3 TRP 36 5.322 -3.707 -8.146 311 HH2 TRP 36 HH2 TRP 36 2.929 -3.046 -8.232 312 H LYS 37 H LYS 37 9.724 -2.430 -11.798 313 HA LYS 37 HA LYS 37 10.768 -5.126 -11.508 314 HB2 LYS 37 HB2 LYS 37 10.932 -2.558 -9.870 315 HB3 LYS 37 HB3 LYS 37 11.616 -4.076 -9.286 316 HG2 LYS 37 HG2 LYS 37 13.067 -4.284 -11.206 317 HG3 LYS 37 HG3 LYS 37 12.358 -2.856 -11.978 318 HD2 LYS 37 HD2 LYS 37 13.266 -1.371 -10.354 319 HD3 LYS 37 HD3 LYS 37 13.660 -2.687 -9.233 320 HE2 LYS 37 HE2 LYS 37 15.337 -3.579 -10.761 321 HE3 LYS 37 HE3 LYS 37 14.927 -2.363 -11.982 322 HZ1 LYS 37 HZ1 LYS 37 15.696 -0.644 -10.435 323 HZ2 LYS 37 HZ2 LYS 37 16.064 -1.759 -9.298 324 HZ3 LYS 37 HZ3 LYS 37 16.894 -1.716 -10.703 325 H LEU 38 H LEU 38 9.088 -6.605 -11.152 326 HA LEU 38 HA LEU 38 7.687 -6.384 -8.547 327 HB2 LEU 38 HB2 LEU 38 6.386 -8.288 -9.167 328 HB3 LEU 38 HB3 LEU 38 6.328 -7.010 -10.363 329 HG LEU 38 HG LEU 38 7.886 -8.314 -11.814 330 HD11 LEU 38 HD11 LEU 38 8.087 -10.746 -11.458 331 HD12 LEU 38 HD12 LEU 38 8.979 -9.844 -10.251 332 HD13 LEU 38 HD13 LEU 38 7.412 -10.573 -9.823 333 HD21 LEU 38 HD21 LEU 38 5.344 -8.411 -11.973 334 HD22 LEU 38 HD22 LEU 38 6.178 -9.827 -12.607 335 HD23 LEU 38 HD23 LEU 38 5.396 -9.888 -11.007 336 H ASP 39 H ASP 39 10.696 -7.264 -9.395 337 HA ASP 39 HA ASP 39 10.925 -9.497 -7.422 338 HB2 ASP 39 HB2 ASP 39 11.206 -10.155 -9.774 339 HB3 ASP 39 HB3 ASP 39 12.458 -8.935 -9.984 340 H GLN 40 H GLN 40 12.070 -6.305 -8.199 341 HA GLN 40 HA GLN 40 14.516 -6.591 -6.499 342 HB2 GLN 40 HB2 GLN 40 14.089 -5.078 -9.076 343 HB3 GLN 40 HB3 GLN 40 15.487 -4.861 -8.012 344 HG2 GLN 40 HG2 GLN 40 16.063 -7.263 -8.268 345 HG3 GLN 40 HG3 GLN 40 14.685 -7.481 -9.353 346 HE21 GLN 40 HE21 GLN 40 16.326 -5.991 -12.157 347 HE22 GLN 40 HE22 GLN 40 14.787 -6.552 -11.523 348 HA PRO 41 HA PRO 41 11.857 -3.410 -4.527 349 HB2 PRO 41 HB2 PRO 41 12.531 -3.796 -1.915 350 HB3 PRO 41 HB3 PRO 41 11.413 -4.851 -2.835 351 HG2 PRO 41 HG2 PRO 41 14.375 -5.282 -2.326 352 HG3 PRO 41 HG3 PRO 41 13.032 -6.443 -2.067 353 HD2 PRO 41 HD2 PRO 41 14.541 -6.469 -4.331 354 HD3 PRO 41 HD3 PRO 41 12.786 -6.816 -4.386 355 H ASP 42 H ASP 42 12.136 -1.433 -3.740 356 HA ASP 42 HA ASP 42 14.853 -0.214 -3.780 357 HB2 ASP 42 HB2 ASP 42 13.083 0.655 -5.304 358 HB3 ASP 42 HB3 ASP 42 12.061 0.998 -3.909 359 H TRP 43 H TRP 43 12.189 -1.017 -1.667 360 HA TRP 43 HA TRP 43 13.835 -0.401 0.670 361 HB2 TRP 43 HB2 TRP 43 12.603 1.691 0.433 362 HB3 TRP 43 HB3 TRP 43 11.085 0.829 0.268 363 HD1 TRP 43 HD1 TRP 43 13.584 2.007 2.864 364 HE1 TRP 43 HE1 TRP 43 12.574 1.787 5.215 365 HE3 TRP 43 HE3 TRP 43 9.381 -0.680 1.705 366 HZ2 TRP 43 HZ2 TRP 43 10.166 0.725 6.406 367 HZ3 TRP 43 HZ3 TRP 43 7.744 -1.285 3.469 368 HH2 TRP 43 HH2 TRP 43 8.113 -0.564 5.816 369 H THR 44 H THR 44 13.239 -1.620 2.524 370 HA THR 44 HA THR 44 10.909 -3.420 2.410 371 HB THR 44 HB THR 44 12.268 -5.314 3.213 372 HG1 THR 44 HG1 THR 44 14.519 -5.250 2.935 373 HG21 THR 44 HG21 THR 44 13.240 -6.039 1.121 374 HG22 THR 44 HG22 THR 44 11.731 -5.171 0.815 375 HG23 THR 44 HG23 THR 44 13.288 -4.368 0.509 376 H GLY 45 H GLY 45 10.140 -4.118 4.360 377 HA2 GLY 45 HA2 GLY 45 11.203 -3.629 6.929 378 HA3 GLY 45 HA3 GLY 45 10.355 -2.165 6.439 379 H ARG 46 H ARG 46 8.494 -2.120 7.424 380 HA ARG 46 HA ARG 46 6.663 -4.489 7.543 381 HB2 ARG 46 HB2 ARG 46 7.669 -2.760 9.849 382 HB3 ARG 46 HB3 ARG 46 6.131 -3.644 9.936 383 HG2 ARG 46 HG2 ARG 46 7.315 -5.730 9.321 384 HG3 ARG 46 HG3 ARG 46 8.866 -4.881 9.414 385 HD2 ARG 46 HD2 ARG 46 8.533 -4.446 11.786 386 HD3 ARG 46 HD3 ARG 46 6.893 -5.132 11.719 387 HE ARG 46 HE ARG 46 8.496 -7.160 10.735 388 HH11 ARG 46 HH11 ARG 46 9.324 -8.840 11.881 389 HH12 ARG 46 HH12 ARG 46 9.582 -8.699 13.596 390 HH21 ARG 46 HH21 ARG 46 8.444 -5.464 13.807 391 HH22 ARG 46 HH22 ARG 46 9.104 -6.827 14.668 392 H LEU 47 H LEU 47 4.497 -4.046 8.059 393 HA LEU 47 HA LEU 47 3.493 -1.533 6.768 394 HB2 LEU 47 HB2 LEU 47 3.029 -3.711 5.627 395 HB3 LEU 47 HB3 LEU 47 2.325 -4.299 7.123 396 HG LEU 47 HG LEU 47 0.611 -2.307 6.852 397 HD11 LEU 47 HD11 LEU 47 1.760 -1.179 5.000 398 HD12 LEU 47 HD12 LEU 47 1.568 -2.631 3.989 399 HD13 LEU 47 HD13 LEU 47 0.142 -1.723 4.547 400 HD21 LEU 47 HD21 LEU 47 0.022 -4.660 6.775 401 HD22 LEU 47 HD22 LEU 47 -0.821 -3.786 5.500 402 HD23 LEU 47 HD23 LEU 47 0.596 -4.782 5.101 403 H ARG 48 H ARG 48 2.121 -0.207 7.857 404 HA ARG 48 HA ARG 48 0.410 -1.379 9.996 405 HB2 ARG 48 HB2 ARG 48 1.603 1.424 10.096 406 HB3 ARG 48 HB3 ARG 48 0.385 0.794 11.203 407 HG2 ARG 48 HG2 ARG 48 3.203 -0.315 10.897 408 HG3 ARG 48 HG3 ARG 48 2.702 0.870 12.097 409 HD2 ARG 48 HD2 ARG 48 1.224 -1.758 11.963 410 HD3 ARG 48 HD3 ARG 48 2.836 -1.715 12.678 411 HE ARG 48 HE ARG 48 0.390 -0.719 13.841 412 HH11 ARG 48 HH11 ARG 48 0.433 0.001 15.936 413 HH12 ARG 48 HH12 ARG 48 1.929 0.527 16.646 414 HH21 ARG 48 HH21 ARG 48 3.870 0.026 13.863 415 HH22 ARG 48 HH22 ARG 48 3.795 0.496 15.532 416 H ILE 49 H ILE 49 -1.616 -1.239 9.421 417 HA ILE 49 HA ILE 49 -2.517 1.015 7.657 418 HB ILE 49 HB ILE 49 -3.887 -1.643 8.053 419 HG12 ILE 49 HG12 ILE 49 -2.175 -0.536 5.778 420 HG13 ILE 49 HG13 ILE 49 -1.886 -1.993 6.734 421 HG21 ILE 49 HG21 ILE 49 -5.412 0.296 7.628 422 HG22 ILE 49 HG22 ILE 49 -4.546 0.577 6.092 423 HG23 ILE 49 HG23 ILE 49 -5.448 -0.934 6.382 424 HD11 ILE 49 HD11 ILE 49 -2.650 -2.674 4.601 425 HD12 ILE 49 HD12 ILE 49 -3.972 -2.991 5.733 426 HD13 ILE 49 HD13 ILE 49 -4.035 -1.575 4.634 427 H THR 50 H THR 50 -3.656 2.494 8.610 428 HA THR 50 HA THR 50 -5.126 1.957 11.153 429 HB THR 50 HB THR 50 -4.392 4.169 11.955 430 HG1 THR 50 HG1 THR 50 -2.808 5.282 10.794 431 HG21 THR 50 HG21 THR 50 -1.943 2.521 11.188 432 HG22 THR 50 HG22 THR 50 -2.064 3.729 12.484 433 HG23 THR 50 HG23 THR 50 -2.971 2.218 12.605 434 H SER 51 H SER 51 -6.719 3.849 11.583 435 HA SER 51 HA SER 51 -7.500 5.374 9.221 436 HB2 SER 51 HB2 SER 51 -9.840 4.643 9.241 437 HB3 SER 51 HB3 SER 51 -8.733 3.338 8.810 438 HG SER 51 HG SER 51 -8.860 2.752 11.129 439 H LYS 52 H LYS 52 -7.918 7.326 9.757 440 HA LYS 52 HA LYS 52 -9.067 8.052 12.409 441 HB2 LYS 52 HB2 LYS 52 -7.063 9.222 11.565 442 HB3 LYS 52 HB3 LYS 52 -8.018 9.811 10.186 443 HG2 LYS 52 HG2 LYS 52 -9.643 10.713 12.079 444 HG3 LYS 52 HG3 LYS 52 -8.237 10.509 13.120 445 HD2 LYS 52 HD2 LYS 52 -8.421 12.136 10.563 446 HD3 LYS 52 HD3 LYS 52 -8.382 12.775 12.228 447 HE2 LYS 52 HE2 LYS 52 -6.106 12.011 12.508 448 HE3 LYS 52 HE3 LYS 52 -6.112 11.235 10.924 449 HZ1 LYS 52 HZ1 LYS 52 -6.161 13.356 9.877 450 HZ2 LYS 52 HZ2 LYS 52 -6.603 14.157 11.234 451 HZ3 LYS 52 HZ3 LYS 52 -5.089 13.568 11.112 452 H GLY 53 H GLY 53 -10.865 6.772 11.732 453 HA2 GLY 53 HA2 GLY 53 -13.193 6.755 11.427 454 HA3 GLY 53 HA3 GLY 53 -13.114 8.413 10.834 455 H LYS 54 H LYS 54 -13.918 8.506 8.843 456 HA LYS 54 HA LYS 54 -14.066 6.278 6.974 457 HB2 LYS 54 HB2 LYS 54 -15.870 7.929 7.461 458 HB3 LYS 54 HB3 LYS 54 -14.890 9.203 6.759 459 HG2 LYS 54 HG2 LYS 54 -15.327 6.976 4.860 460 HG3 LYS 54 HG3 LYS 54 -16.836 7.575 5.543 461 HD2 LYS 54 HD2 LYS 54 -16.152 9.927 4.956 462 HD3 LYS 54 HD3 LYS 54 -14.766 9.254 4.075 463 HE2 LYS 54 HE2 LYS 54 -16.335 7.950 2.650 464 HE3 LYS 54 HE3 LYS 54 -17.706 8.628 3.549 465 HZ1 LYS 54 HZ1 LYS 54 -17.370 9.927 1.561 466 HZ2 LYS 54 HZ2 LYS 54 -16.904 10.864 2.813 467 HZ3 LYS 54 HZ3 LYS 54 -15.773 10.136 1.871 468 H THR 55 H THR 55 -11.418 7.171 7.612 469 HA THR 55 HA THR 55 -10.287 7.316 4.869 470 HB THR 55 HB THR 55 -9.261 9.085 7.135 471 HG1 THR 55 HG1 THR 55 -10.281 10.815 6.122 472 HG21 THR 55 HG21 THR 55 -8.986 9.187 4.098 473 HG22 THR 55 HG22 THR 55 -8.155 10.259 5.256 474 HG23 THR 55 HG23 THR 55 -7.756 8.529 5.201 475 H ALA 56 H ALA 56 -8.862 5.682 4.760 476 HA ALA 56 HA ALA 56 -7.515 4.754 7.245 477 HB1 ALA 56 HB1 ALA 56 -6.855 2.737 5.839 478 HB2 ALA 56 HB2 ALA 56 -8.537 2.870 6.355 479 HB3 ALA 56 HB3 ALA 56 -8.104 3.264 4.692 480 H TYR 57 H TYR 57 -5.223 4.230 7.058 481 HA TYR 57 HA TYR 57 -3.722 5.939 5.122 482 HB2 TYR 57 HB2 TYR 57 -3.337 5.830 8.132 483 HB3 TYR 57 HB3 TYR 57 -2.247 6.604 7.005 484 HD1 TYR 57 HD1 TYR 57 -5.776 6.731 8.328 485 HD2 TYR 57 HD2 TYR 57 -2.565 8.878 6.410 486 HE1 TYR 57 HE1 TYR 57 -7.121 8.795 8.413 487 HE2 TYR 57 HE2 TYR 57 -3.882 10.989 6.604 488 HH TYR 57 HH TYR 57 -7.189 11.059 7.984 489 H ILE 58 H ILE 58 -2.418 4.650 4.027 490 HA ILE 58 HA ILE 58 -1.496 2.057 5.151 491 HB ILE 58 HB ILE 58 -0.735 3.247 2.466 492 HG12 ILE 58 HG12 ILE 58 -3.151 3.155 2.406 493 HG13 ILE 58 HG13 ILE 58 -2.412 1.983 1.333 494 HG21 ILE 58 HG21 ILE 58 -0.663 0.464 3.675 495 HG22 ILE 58 HG22 ILE 58 -0.355 0.817 1.961 496 HG23 ILE 58 HG23 ILE 58 0.715 1.477 3.202 497 HD11 ILE 58 HD11 ILE 58 -2.907 0.160 2.891 498 HD12 ILE 58 HD12 ILE 58 -3.575 1.325 4.063 499 HD13 ILE 58 HD13 ILE 58 -4.364 1.094 2.487 500 H LYS 59 H LYS 59 0.017 2.476 6.708 501 HA LYS 59 HA LYS 59 2.242 4.374 6.074 502 HB2 LYS 59 HB2 LYS 59 1.475 3.295 8.798 503 HB3 LYS 59 HB3 LYS 59 2.621 4.585 8.417 504 HG2 LYS 59 HG2 LYS 59 0.568 5.815 7.370 505 HG3 LYS 59 HG3 LYS 59 -0.418 4.631 8.228 506 HD2 LYS 59 HD2 LYS 59 1.550 6.603 9.460 507 HD3 LYS 59 HD3 LYS 59 -0.218 6.701 9.520 508 HE2 LYS 59 HE2 LYS 59 -0.359 4.672 10.832 509 HE3 LYS 59 HE3 LYS 59 1.401 4.422 10.725 510 HZ1 LYS 59 HZ1 LYS 59 0.849 5.476 12.819 511 HZ2 LYS 59 HZ2 LYS 59 1.644 6.584 11.913 512 HZ3 LYS 59 HZ3 LYS 59 0.010 6.667 12.080 513 H LEU 60 H LEU 60 4.352 3.780 6.298 514 HA LEU 60 HA LEU 60 4.918 0.839 6.514 515 HB2 LEU 60 HB2 LEU 60 5.989 2.905 4.559 516 HB3 LEU 60 HB3 LEU 60 6.647 1.281 4.748 517 HG LEU 60 HG LEU 60 3.769 1.858 3.896 518 HD11 LEU 60 HD11 LEU 60 6.221 1.097 2.289 519 HD12 LEU 60 HD12 LEU 60 4.561 1.162 1.649 520 HD13 LEU 60 HD13 LEU 60 5.353 2.645 2.207 521 HD21 LEU 60 HD21 LEU 60 4.032 -0.372 4.918 522 HD22 LEU 60 HD22 LEU 60 3.811 -0.523 3.175 523 HD23 LEU 60 HD23 LEU 60 5.433 -0.704 3.883 524 H GLU 61 H GLU 61 6.516 0.245 7.800 525 HA GLU 61 HA GLU 61 8.051 2.373 9.239 526 HB2 GLU 61 HB2 GLU 61 6.763 -0.124 10.392 527 HB3 GLU 61 HB3 GLU 61 7.782 1.026 11.264 528 HG2 GLU 61 HG2 GLU 61 6.102 2.834 10.668 529 HG3 GLU 61 HG3 GLU 61 5.029 1.552 10.091 530 H ASP 62 H ASP 62 10.156 1.910 9.949 531 HA ASP 62 HA ASP 62 11.642 -0.127 8.551 532 HB2 ASP 62 HB2 ASP 62 12.671 1.981 9.025 533 HB3 ASP 62 HB3 ASP 62 12.242 1.886 10.734 534 H LYS 63 H LYS 63 12.282 -2.067 9.230 535 HA LYS 63 HA LYS 63 10.718 -3.473 11.147 536 HB2 LYS 63 HB2 LYS 63 11.708 -4.330 9.025 537 HB3 LYS 63 HB3 LYS 63 13.314 -4.284 9.761 538 HG2 LYS 63 HG2 LYS 63 12.614 -5.984 11.411 539 HG3 LYS 63 HG3 LYS 63 10.977 -5.989 10.741 540 HD2 LYS 63 HD2 LYS 63 13.499 -6.722 9.192 541 HD3 LYS 63 HD3 LYS 63 12.464 -7.892 10.022 542 HE2 LYS 63 HE2 LYS 63 10.553 -7.277 8.590 543 HE3 LYS 63 HE3 LYS 63 11.533 -6.054 7.770 544 HZ1 LYS 63 HZ1 LYS 63 12.117 -8.965 7.761 545 HZ2 LYS 63 HZ2 LYS 63 11.460 -8.135 6.516 546 HZ3 LYS 63 HZ3 LYS 63 12.997 -7.825 6.983 547 H VAL 64 H VAL 64 13.540 -1.604 11.723 548 HA VAL 64 HA VAL 64 14.438 -3.214 14.064 549 HB VAL 64 HB VAL 64 15.935 -0.864 12.884 550 HG11 VAL 64 HG11 VAL 64 17.891 -2.104 13.695 551 HG12 VAL 64 HG12 VAL 64 16.734 -1.831 15.000 552 HG13 VAL 64 HG13 VAL 64 16.843 -3.435 14.238 553 HG21 VAL 64 HG21 VAL 64 15.557 -2.203 10.904 554 HG22 VAL 64 HG22 VAL 64 17.220 -2.431 11.437 555 HG23 VAL 64 HG23 VAL 64 16.011 -3.696 11.771 556 H SER 65 H SER 65 13.224 -0.058 13.089 557 HA SER 65 HA SER 65 13.386 0.859 15.921 558 HB2 SER 65 HB2 SER 65 13.802 3.107 14.959 559 HB3 SER 65 HB3 SER 65 15.028 1.925 14.466 560 HG SER 65 HG SER 65 13.993 1.710 12.474 561 H GLY 66 H GLY 66 11.138 0.314 13.374 562 HA2 GLY 66 HA2 GLY 66 8.904 0.794 13.172 563 HA3 GLY 66 HA3 GLY 66 8.915 1.610 14.736 564 H GLU 67 H GLU 67 11.367 2.849 12.614 565 HA GLU 67 HA GLU 67 10.085 5.436 12.603 566 HB2 GLU 67 HB2 GLU 67 12.615 4.371 11.321 567 HB3 GLU 67 HB3 GLU 67 12.069 6.023 11.052 568 HG2 GLU 67 HG2 GLU 67 12.408 4.936 13.861 569 HG3 GLU 67 HG3 GLU 67 13.762 5.601 12.948 570 H LEU 68 H LEU 68 9.226 6.658 10.987 571 HA LEU 68 HA LEU 68 7.691 5.140 9.081 572 HB2 LEU 68 HB2 LEU 68 6.883 7.166 10.351 573 HB3 LEU 68 HB3 LEU 68 7.930 8.157 9.339 574 HG LEU 68 HG LEU 68 6.636 7.220 7.311 575 HD11 LEU 68 HD11 LEU 68 4.684 6.402 9.514 576 HD12 LEU 68 HD12 LEU 68 4.356 6.396 7.769 577 HD13 LEU 68 HD13 LEU 68 5.550 5.286 8.443 578 HD21 LEU 68 HD21 LEU 68 6.282 9.492 8.193 579 HD22 LEU 68 HD22 LEU 68 4.765 8.777 7.626 580 HD23 LEU 68 HD23 LEU 68 5.107 8.863 9.370 581 H PHE 69 H PHE 69 8.235 4.512 7.132 582 HA PHE 69 HA PHE 69 10.380 5.772 5.505 583 HB2 PHE 69 HB2 PHE 69 10.383 3.424 5.470 584 HB3 PHE 69 HB3 PHE 69 8.638 3.317 5.295 585 HD1 PHE 69 HD1 PHE 69 7.996 2.433 3.255 586 HD2 PHE 69 HD2 PHE 69 11.391 5.080 3.376 587 HE1 PHE 69 HE1 PHE 69 8.181 2.289 0.802 588 HE2 PHE 69 HE2 PHE 69 11.567 4.959 0.922 589 HZ PHE 69 HZ PHE 69 9.944 3.575 -0.401 590 H ALA 70 H ALA 70 6.870 5.103 5.184 591 HA ALA 70 HA ALA 70 6.393 7.619 3.762 592 HB1 ALA 70 HB1 ALA 70 5.978 4.908 2.403 593 HB2 ALA 70 HB2 ALA 70 5.427 6.469 1.781 594 HB3 ALA 70 HB3 ALA 70 7.166 6.142 1.921 595 H GLN 71 H GLN 71 4.091 7.953 3.344 596 HA GLN 71 HA GLN 71 2.266 5.920 4.276 597 HB2 GLN 71 HB2 GLN 71 0.872 7.406 5.659 598 HB3 GLN 71 HB3 GLN 71 2.458 7.056 6.350 599 HG2 GLN 71 HG2 GLN 71 3.268 9.296 5.576 600 HG3 GLN 71 HG3 GLN 71 1.646 9.658 4.981 601 HE21 GLN 71 HE21 GLN 71 2.053 11.078 8.444 602 HE22 GLN 71 HE22 GLN 71 2.919 11.295 6.928 603 H ALA 72 H ALA 72 0.352 5.849 3.216 604 HA ALA 72 HA ALA 72 -0.250 8.014 1.248 605 HB1 ALA 72 HB1 ALA 72 -1.305 6.323 -0.153 606 HB2 ALA 72 HB2 ALA 72 0.402 5.953 0.118 607 HB3 ALA 72 HB3 ALA 72 -0.858 5.051 1.000 608 HA PRO 73 HA PRO 73 -4.115 7.919 3.802 609 HB2 PRO 73 HB2 PRO 73 -5.190 10.290 3.037 610 HB3 PRO 73 HB3 PRO 73 -3.803 10.191 4.164 611 HG2 PRO 73 HG2 PRO 73 -3.738 10.749 1.188 612 HG3 PRO 73 HG3 PRO 73 -2.878 11.610 2.499 613 HD2 PRO 73 HD2 PRO 73 -1.726 9.631 0.962 614 HD3 PRO 73 HD3 PRO 73 -1.252 9.933 2.662 615 H VAL 74 H VAL 74 -5.990 6.911 3.211 616 HA VAL 74 HA VAL 74 -6.855 6.990 0.356 617 HB VAL 74 HB VAL 74 -7.460 4.771 0.309 618 HG11 VAL 74 HG11 VAL 74 -4.740 4.871 1.718 619 HG12 VAL 74 HG12 VAL 74 -5.345 3.489 0.808 620 HG13 VAL 74 HG13 VAL 74 -5.029 5.001 -0.024 621 HG21 VAL 74 HG21 VAL 74 -7.243 3.099 2.032 622 HG22 VAL 74 HG22 VAL 74 -6.736 4.341 3.196 623 HG23 VAL 74 HG23 VAL 74 -8.384 4.342 2.505 624 H GLU 75 H GLU 75 -8.891 7.503 -0.055 625 HA GLU 75 HA GLU 75 -10.831 7.609 2.202 626 HB2 GLU 75 HB2 GLU 75 -9.852 9.776 1.463 627 HB3 GLU 75 HB3 GLU 75 -10.594 9.570 -0.108 628 HG2 GLU 75 HG2 GLU 75 -12.292 9.485 2.419 629 HG3 GLU 75 HG3 GLU 75 -11.658 11.027 1.873 630 H GLN 76 H GLN 76 -10.194 5.717 -0.265 631 HA GLN 76 HA GLN 76 -12.833 4.711 -0.484 632 HB2 GLN 76 HB2 GLN 76 -13.234 4.910 -2.816 633 HB3 GLN 76 HB3 GLN 76 -12.925 6.533 -2.236 634 HG2 GLN 76 HG2 GLN 76 -10.991 4.787 -3.795 635 HG3 GLN 76 HG3 GLN 76 -11.930 6.116 -4.434 636 HE21 GLN 76 HE21 GLN 76 -8.418 6.919 -2.531 637 HE22 GLN 76 HE22 GLN 76 -9.113 5.289 -2.418 638 H TYR 77 H TYR 77 -12.794 2.559 -1.259 639 HA TYR 77 HA TYR 77 -10.220 1.513 -2.240 640 HB2 TYR 77 HB2 TYR 77 -10.369 1.058 0.186 641 HB3 TYR 77 HB3 TYR 77 -11.823 0.076 -0.094 642 HD1 TYR 77 HD1 TYR 77 -8.442 0.602 -1.414 643 HD2 TYR 77 HD2 TYR 77 -11.330 -2.338 -0.282 644 HE1 TYR 77 HE1 TYR 77 -6.842 -1.139 -2.079 645 HE2 TYR 77 HE2 TYR 77 -9.698 -4.143 -0.894 646 HH TYR 77 HH TYR 77 -6.468 -3.417 -2.245 647 HA PRO 78 HA PRO 78 -9.301 0.338 -3.789 648 HB2 PRO 78 HB2 PRO 78 -10.164 -0.001 -6.634 649 HB3 PRO 78 HB3 PRO 78 -8.751 -0.696 -5.779 650 HG2 PRO 78 HG2 PRO 78 -10.907 -2.244 -6.322 651 HG3 PRO 78 HG3 PRO 78 -10.122 -2.345 -4.708 652 HD2 PRO 78 HD2 PRO 78 -12.573 -0.721 -5.493 653 HD3 PRO 78 HD3 PRO 78 -12.376 -1.854 -4.122 654 H GLY 79 H GLY 79 -8.128 2.026 -5.071 655 HA2 GLY 79 HA2 GLY 79 -9.614 4.131 -6.461 656 HA3 GLY 79 HA3 GLY 79 -9.049 4.608 -4.861 657 H ILE 80 H ILE 80 -7.759 6.246 -5.854 658 HA ILE 80 HA ILE 80 -5.502 5.434 -7.569 659 HB ILE 80 HB ILE 80 -6.651 7.594 -7.942 660 HG12 ILE 80 HG12 ILE 80 -4.745 9.056 -8.191 661 HG13 ILE 80 HG13 ILE 80 -3.793 8.133 -7.031 662 HG21 ILE 80 HG21 ILE 80 -6.370 9.497 -6.439 663 HG22 ILE 80 HG22 ILE 80 -7.173 8.197 -5.557 664 HG23 ILE 80 HG23 ILE 80 -5.439 8.526 -5.292 665 HD11 ILE 80 HD11 ILE 80 -3.623 6.260 -8.561 666 HD12 ILE 80 HD12 ILE 80 -4.788 7.014 -9.687 667 HD13 ILE 80 HD13 ILE 80 -3.187 7.740 -9.426 668 H ALA 81 H ALA 81 -6.153 6.167 -4.183 669 HA ALA 81 HA ALA 81 -3.348 6.259 -3.524 670 HB1 ALA 81 HB1 ALA 81 -4.914 7.698 -2.347 671 HB2 ALA 81 HB2 ALA 81 -5.783 6.281 -1.715 672 HB3 ALA 81 HB3 ALA 81 -4.076 6.579 -1.251 673 H VAL 82 H VAL 82 -5.654 3.621 -3.733 674 HA VAL 82 HA VAL 82 -3.440 1.773 -3.218 675 HB VAL 82 HB VAL 82 -4.269 2.034 -1.014 676 HG11 VAL 82 HG11 VAL 82 -6.988 1.719 -2.156 677 HG12 VAL 82 HG12 VAL 82 -6.613 1.475 -0.416 678 HG13 VAL 82 HG13 VAL 82 -6.344 3.023 -1.208 679 HG21 VAL 82 HG21 VAL 82 -3.472 -0.067 -1.482 680 HG22 VAL 82 HG22 VAL 82 -4.969 -0.322 -0.594 681 HG23 VAL 82 HG23 VAL 82 -4.895 -0.574 -2.358 682 H GLU 83 H GLU 83 -3.487 0.419 -4.881 683 HA GLU 83 HA GLU 83 -6.049 -0.572 -6.064 684 HB2 GLU 83 HB2 GLU 83 -4.369 1.418 -7.213 685 HB3 GLU 83 HB3 GLU 83 -3.950 -0.054 -8.067 686 HG2 GLU 83 HG2 GLU 83 -6.796 0.986 -7.727 687 HG3 GLU 83 HG3 GLU 83 -5.752 1.363 -9.098 688 H THR 84 H THR 84 -5.895 -2.512 -7.313 689 HA THR 84 HA THR 84 -3.543 -4.266 -6.617 690 HB THR 84 HB THR 84 -6.031 -5.325 -7.817 691 HG1 THR 84 HG1 THR 84 -6.448 -4.097 -5.747 692 HG21 THR 84 HG21 THR 84 -4.054 -6.721 -7.646 693 HG22 THR 84 HG22 THR 84 -4.000 -6.457 -5.883 694 HG23 THR 84 HG23 THR 84 -5.354 -7.346 -6.627 695 H VAL 85 H VAL 85 -2.352 -3.285 -8.038 696 HA VAL 85 HA VAL 85 -1.384 -2.945 -10.229 697 HB VAL 85 HB VAL 85 -0.432 -5.347 -10.602 698 HG11 VAL 85 HG11 VAL 85 -0.092 -3.761 -8.006 699 HG12 VAL 85 HG12 VAL 85 1.068 -4.926 -8.644 700 HG13 VAL 85 HG13 VAL 85 0.727 -3.454 -9.551 701 HG21 VAL 85 HG21 VAL 85 -2.235 -6.523 -9.208 702 HG22 VAL 85 HG22 VAL 85 -0.561 -6.858 -8.765 703 HG23 VAL 85 HG23 VAL 85 -1.527 -5.747 -7.787 704 H THR 86 H THR 86 -2.960 -6.056 -10.765 705 HA THR 86 HA THR 86 -4.729 -4.861 -12.737 706 HB THR 86 HB THR 86 -4.506 -6.968 -14.220 707 HG1 THR 86 HG1 THR 86 -2.482 -7.875 -14.259 708 HG21 THR 86 HG21 THR 86 -2.816 -5.897 -15.630 709 HG22 THR 86 HG22 THR 86 -3.809 -4.626 -14.870 710 HG23 THR 86 HG23 THR 86 -2.208 -4.984 -14.226 711 H ASP 87 H ASP 87 -3.712 -7.989 -11.392 712 HA ASP 87 HA ASP 87 -6.522 -8.573 -10.583 713 HB2 ASP 87 HB2 ASP 87 -4.889 -9.822 -12.728 714 HB3 ASP 87 HB3 ASP 87 -5.841 -10.928 -11.723 715 H SER 88 H SER 88 -3.548 -10.663 -10.659 716 HA SER 88 HA SER 88 -3.885 -11.752 -8.168 717 HB2 SER 88 HB2 SER 88 -1.893 -12.143 -9.665 718 HB3 SER 88 HB3 SER 88 -1.093 -10.821 -8.845 719 HG SER 88 HG SER 88 -1.010 -13.159 -8.106 720 H SER 89 H SER 89 -3.664 -11.324 -6.082 721 HA SER 89 HA SER 89 -2.661 -8.648 -5.246 722 HB2 SER 89 HB2 SER 89 -4.101 -8.715 -3.406 723 HB3 SER 89 HB3 SER 89 -5.006 -9.091 -4.889 724 HG SER 89 HG SER 89 -4.091 -10.912 -2.892 725 H ARG 90 H ARG 90 -0.832 -10.699 -5.905 726 HA ARG 90 HA ARG 90 0.665 -11.157 -3.379 727 HB2 ARG 90 HB2 ARG 90 1.550 -10.851 -6.281 728 HB3 ARG 90 HB3 ARG 90 2.627 -11.274 -4.950 729 HG2 ARG 90 HG2 ARG 90 1.449 -13.404 -4.622 730 HG3 ARG 90 HG3 ARG 90 0.269 -12.956 -5.871 731 HD2 ARG 90 HD2 ARG 90 2.224 -12.722 -7.484 732 HD3 ARG 90 HD3 ARG 90 3.234 -13.505 -6.267 733 HE ARG 90 HE ARG 90 0.975 -14.644 -7.853 734 HH11 ARG 90 HH11 ARG 90 0.718 -16.785 -8.019 735 HH12 ARG 90 HH12 ARG 90 1.700 -17.884 -7.065 736 HH21 ARG 90 HH21 ARG 90 3.395 -15.385 -5.407 737 HH22 ARG 90 HH22 ARG 90 3.178 -17.102 -5.603 738 H TYR 91 H TYR 91 -0.126 -8.538 -5.468 739 HA TYR 91 HA TYR 91 1.809 -6.688 -4.189 740 HB2 TYR 91 HB2 TYR 91 0.944 -6.540 -7.077 741 HB3 TYR 91 HB3 TYR 91 2.303 -5.730 -6.348 742 HD1 TYR 91 HD1 TYR 91 1.141 -8.533 -8.214 743 HD2 TYR 91 HD2 TYR 91 4.318 -7.218 -5.613 744 HE1 TYR 91 HE1 TYR 91 2.571 -10.351 -9.071 745 HE2 TYR 91 HE2 TYR 91 5.778 -9.069 -6.479 746 HH TYR 91 HH TYR 91 4.575 -11.385 -8.953 747 H PHE 92 H PHE 92 1.302 -4.450 -4.516 748 HA PHE 92 HA PHE 92 -1.400 -3.673 -5.409 749 HB2 PHE 92 HB2 PHE 92 -0.289 -2.849 -2.697 750 HB3 PHE 92 HB3 PHE 92 -1.711 -2.150 -3.464 751 HD1 PHE 92 HD1 PHE 92 -3.727 -3.595 -3.974 752 HD2 PHE 92 HD2 PHE 92 -0.429 -4.940 -1.546 753 HE1 PHE 92 HE1 PHE 92 -5.117 -5.474 -3.153 754 HE2 PHE 92 HE2 PHE 92 -1.844 -6.776 -0.672 755 HZ PHE 92 HZ PHE 92 -4.164 -7.097 -1.521 756 H VAL 93 H VAL 93 -1.483 -1.222 -5.500 757 HA VAL 93 HA VAL 93 1.161 0.118 -5.614 758 HB VAL 93 HB VAL 93 -1.115 0.548 -7.591 759 HG11 VAL 93 HG11 VAL 93 -0.236 2.741 -6.994 760 HG12 VAL 93 HG12 VAL 93 1.440 2.159 -7.166 761 HG13 VAL 93 HG13 VAL 93 0.378 2.282 -8.572 762 HG21 VAL 93 HG21 VAL 93 0.336 -1.322 -8.202 763 HG22 VAL 93 HG22 VAL 93 0.675 0.053 -9.257 764 HG23 VAL 93 HG23 VAL 93 1.786 -0.330 -7.935 765 H ILE 94 H ILE 94 1.197 1.996 -4.426 766 HA ILE 94 HA ILE 94 -1.393 3.172 -3.619 767 HB ILE 94 HB ILE 94 -0.760 3.527 -1.331 768 HG12 ILE 94 HG12 ILE 94 1.776 1.888 -1.826 769 HG13 ILE 94 HG13 ILE 94 1.755 3.642 -1.788 770 HG21 ILE 94 HG21 ILE 94 -0.944 1.289 -0.460 771 HG22 ILE 94 HG22 ILE 94 -1.843 1.351 -1.962 772 HG23 ILE 94 HG23 ILE 94 -0.258 0.569 -1.928 773 HD11 ILE 94 HD11 ILE 94 0.819 3.580 0.528 774 HD12 ILE 94 HD12 ILE 94 0.984 1.821 0.507 775 HD13 ILE 94 HD13 ILE 94 2.424 2.840 0.401 776 H ARG 95 H ARG 95 -1.387 5.352 -3.095 777 HA ARG 95 HA ARG 95 0.824 6.936 -4.359 778 HB2 ARG 95 HB2 ARG 95 -1.473 7.077 -5.293 779 HB3 ARG 95 HB3 ARG 95 -2.010 7.847 -3.799 780 HG2 ARG 95 HG2 ARG 95 0.227 8.950 -5.552 781 HG3 ARG 95 HG3 ARG 95 -1.482 9.370 -5.738 782 HD2 ARG 95 HD2 ARG 95 -1.483 10.110 -3.318 783 HD3 ARG 95 HD3 ARG 95 0.261 9.896 -3.319 784 HE ARG 95 HE ARG 95 0.569 11.754 -4.713 785 HH11 ARG 95 HH11 ARG 95 0.096 13.690 -5.418 786 HH12 ARG 95 HH12 ARG 95 -1.562 14.200 -5.659 787 HH21 ARG 95 HH21 ARG 95 -2.899 11.265 -4.435 788 HH22 ARG 95 HH22 ARG 95 -3.235 12.846 -5.084 789 H ILE 96 H ILE 96 2.304 7.129 -2.763 790 HA ILE 96 HA ILE 96 1.552 7.906 -0.009 791 HB ILE 96 HB ILE 96 3.966 7.700 0.459 792 HG12 ILE 96 HG12 ILE 96 4.310 6.513 -2.320 793 HG13 ILE 96 HG13 ILE 96 4.665 8.212 -1.983 794 HG21 ILE 96 HG21 ILE 96 4.079 5.224 0.275 795 HG22 ILE 96 HG22 ILE 96 2.523 5.793 0.861 796 HG23 ILE 96 HG23 ILE 96 2.706 5.276 -0.830 797 HD11 ILE 96 HD11 ILE 96 6.007 5.846 -0.666 798 HD12 ILE 96 HD12 ILE 96 6.701 6.967 -1.858 799 HD13 ILE 96 HD13 ILE 96 6.260 7.550 -0.236 800 H GLN 97 H GLN 97 2.572 9.652 1.118 801 HA GLN 97 HA GLN 97 3.679 11.885 -0.496 802 HB2 GLN 97 HB2 GLN 97 2.383 12.297 1.664 803 HB3 GLN 97 HB3 GLN 97 3.762 11.568 2.516 804 HG2 GLN 97 HG2 GLN 97 5.233 13.259 1.246 805 HG3 GLN 97 HG3 GLN 97 3.745 14.054 0.743 806 HE21 GLN 97 HE21 GLN 97 5.278 15.586 3.854 807 HE22 GLN 97 HE22 GLN 97 5.942 15.102 2.292 808 H ASP 98 H ASP 98 5.924 12.057 -0.882 809 HA ASP 98 HA ASP 98 7.411 9.568 -0.435 810 HB2 ASP 98 HB2 ASP 98 7.114 10.869 -2.620 811 HB3 ASP 98 HB3 ASP 98 8.219 12.050 -1.908 812 H GLY 99 H GLY 99 7.088 12.053 1.583 813 HA2 GLY 99 HA2 GLY 99 8.224 12.645 3.492 814 HA3 GLY 99 HA3 GLY 99 9.460 11.458 3.086 815 H THR 100 H THR 100 9.185 13.685 0.532 816 HA THR 100 HA THR 100 11.276 15.496 1.638 817 HB THR 100 HB THR 100 12.328 13.632 0.500 818 HG1 THR 100 HG1 THR 100 12.601 16.153 -0.741 819 HG21 THR 100 HG21 THR 100 10.692 13.167 -1.244 820 HG22 THR 100 HG22 THR 100 11.029 14.736 -2.011 821 HG23 THR 100 HG23 THR 100 12.293 13.483 -1.930 822 H GLY 101 H GLY 101 8.406 15.933 1.140 823 HA2 GLY 101 HA2 GLY 101 7.329 17.987 0.791 824 HA3 GLY 101 HA3 GLY 101 8.677 18.560 -0.191 825 H ARG 102 H ARG 102 7.435 15.427 -0.948 826 HA ARG 102 HA ARG 102 5.701 16.388 -3.166 827 HB2 ARG 102 HB2 ARG 102 6.870 15.319 -4.819 828 HB3 ARG 102 HB3 ARG 102 8.150 16.067 -3.834 829 HG2 ARG 102 HG2 ARG 102 8.761 13.934 -2.898 830 HG3 ARG 102 HG3 ARG 102 7.349 13.152 -3.653 831 HD2 ARG 102 HD2 ARG 102 9.073 12.507 -5.032 832 HD3 ARG 102 HD3 ARG 102 8.271 13.807 -5.896 833 HE ARG 102 HE ARG 102 10.112 15.273 -5.440 834 HH11 ARG 102 HH11 ARG 102 12.300 15.508 -5.565 835 HH12 ARG 102 HH12 ARG 102 13.351 14.202 -5.105 836 HH21 ARG 102 HH21 ARG 102 10.856 12.035 -4.176 837 HH22 ARG 102 HH22 ARG 102 12.560 12.286 -4.434 838 H SER 103 H SER 103 4.603 14.544 -4.282 839 HA SER 103 HA SER 103 4.176 12.195 -2.499 840 HB2 SER 103 HB2 SER 103 2.037 11.784 -3.546 841 HB3 SER 103 HB3 SER 103 2.062 13.345 -2.712 842 HG SER 103 HG SER 103 2.361 14.331 -4.778 843 H ALA 104 H ALA 104 3.858 10.134 -3.573 844 HA ALA 104 HA ALA 104 4.984 9.842 -6.284 845 HB1 ALA 104 HB1 ALA 104 6.714 8.250 -5.500 846 HB2 ALA 104 HB2 ALA 104 6.988 9.883 -4.870 847 HB3 ALA 104 HB3 ALA 104 6.297 8.627 -3.816 848 H PHE 105 H PHE 105 4.525 7.907 -7.280 849 HA PHE 105 HA PHE 105 2.593 6.077 -5.959 850 HB2 PHE 105 HB2 PHE 105 3.596 6.105 -8.821 851 HB3 PHE 105 HB3 PHE 105 2.326 5.081 -8.159 852 HD1 PHE 105 HD1 PHE 105 0.161 6.119 -7.346 853 HD2 PHE 105 HD2 PHE 105 3.159 8.409 -9.437 854 HE1 PHE 105 HE1 PHE 105 -1.489 7.917 -7.757 855 HE2 PHE 105 HE2 PHE 105 1.519 10.228 -9.797 856 HZ PHE 105 HZ PHE 105 -0.828 9.977 -8.982 857 H ILE 106 H ILE 106 3.191 4.203 -5.105 858 HA ILE 106 HA ILE 106 5.672 2.885 -6.098 859 HB ILE 106 HB ILE 106 6.304 2.026 -3.996 860 HG12 ILE 106 HG12 ILE 106 3.920 3.563 -2.810 861 HG13 ILE 106 HG13 ILE 106 4.073 1.807 -2.890 862 HG21 ILE 106 HG21 ILE 106 5.829 4.998 -3.502 863 HG22 ILE 106 HG22 ILE 106 7.221 4.001 -3.018 864 HG23 ILE 106 HG23 ILE 106 6.954 4.408 -4.718 865 HD11 ILE 106 HD11 ILE 106 5.867 3.571 -1.195 866 HD12 ILE 106 HD12 ILE 106 4.455 2.667 -0.638 867 HD13 ILE 106 HD13 ILE 106 5.841 1.792 -1.273 868 H GLY 107 H GLY 107 5.544 0.831 -6.529 869 HA2 GLY 107 HA2 GLY 107 3.098 -0.760 -6.178 870 HA3 GLY 107 HA3 GLY 107 4.631 -1.295 -6.870 871 H ILE 108 H ILE 108 3.059 -2.534 -4.771 872 HA ILE 108 HA ILE 108 5.190 -2.731 -2.701 873 HB ILE 108 HB ILE 108 2.208 -3.103 -2.146 874 HG12 ILE 108 HG12 ILE 108 4.157 -0.813 -1.597 875 HG13 ILE 108 HG13 ILE 108 2.600 -0.735 -2.420 876 HG21 ILE 108 HG21 ILE 108 2.980 -3.379 0.181 877 HG22 ILE 108 HG22 ILE 108 3.723 -4.580 -0.842 878 HG23 ILE 108 HG23 ILE 108 4.662 -3.145 -0.358 879 HD11 ILE 108 HD11 ILE 108 2.424 0.257 -0.241 880 HD12 ILE 108 HD12 ILE 108 1.470 -1.250 -0.244 881 HD13 ILE 108 HD13 ILE 108 3.071 -1.164 0.556 882 H GLY 109 H GLY 109 5.811 -4.862 -2.234 883 HA2 GLY 109 HA2 GLY 109 4.219 -7.113 -3.385 884 HA3 GLY 109 HA3 GLY 109 5.972 -7.080 -3.577 885 H PHE 110 H PHE 110 3.696 -8.560 -1.921 886 HA PHE 110 HA PHE 110 5.018 -8.537 0.746 887 HB2 PHE 110 HB2 PHE 110 2.429 -9.669 -0.302 888 HB3 PHE 110 HB3 PHE 110 3.064 -10.118 1.261 889 HD1 PHE 110 HD1 PHE 110 2.752 -8.821 3.174 890 HD2 PHE 110 HD2 PHE 110 2.054 -7.055 -0.699 891 HE1 PHE 110 HE1 PHE 110 1.650 -6.892 4.253 892 HE2 PHE 110 HE2 PHE 110 1.028 -5.074 0.396 893 HZ PHE 110 HZ PHE 110 0.831 -4.987 2.860 894 H THR 111 H THR 111 5.530 -10.436 1.853 895 HA THR 111 HA THR 111 7.065 -12.332 0.286 896 HB THR 111 HB THR 111 7.658 -11.294 2.470 897 HG1 THR 111 HG1 THR 111 8.811 -13.097 3.076 898 HG21 THR 111 HG21 THR 111 7.013 -12.393 4.546 899 HG22 THR 111 HG22 THR 111 5.576 -11.748 3.735 900 HG23 THR 111 HG23 THR 111 5.927 -13.490 3.670 901 H ASP 112 H ASP 112 3.883 -12.297 1.616 902 HA ASP 112 HA ASP 112 3.385 -15.033 0.562 903 HB2 ASP 112 HB2 ASP 112 3.589 -14.867 3.153 904 HB3 ASP 112 HB3 ASP 112 2.027 -14.040 3.083 905 H ARG 113 H ARG 113 1.522 -15.304 -0.572 906 HA ARG 113 HA ARG 113 0.026 -13.082 -1.606 907 HB2 ARG 113 HB2 ARG 113 0.396 -15.239 -2.767 908 HB3 ARG 113 HB3 ARG 113 -0.544 -16.084 -1.544 909 HG2 ARG 113 HG2 ARG 113 -1.748 -15.794 -3.651 910 HG3 ARG 113 HG3 ARG 113 -2.604 -15.042 -2.307 911 HD2 ARG 113 HD2 ARG 113 -2.317 -12.903 -3.126 912 HD3 ARG 113 HD3 ARG 113 -0.753 -13.268 -3.832 913 HE ARG 113 HE ARG 113 -1.751 -13.725 -5.860 914 HH11 ARG 113 HH11 ARG 113 -3.284 -14.367 -7.309 915 HH12 ARG 113 HH12 ARG 113 -4.951 -14.323 -6.833 916 HH21 ARG 113 HH21 ARG 113 -4.341 -13.729 -3.515 917 HH22 ARG 113 HH22 ARG 113 -5.539 -14.067 -4.733 918 H GLY 114 H GLY 114 -0.530 -15.165 1.204 919 HA2 GLY 114 HA2 GLY 114 -3.240 -14.254 1.752 920 HA3 GLY 114 HA3 GLY 114 -2.159 -15.144 2.828 921 H ASP 115 H ASP 115 0.024 -13.123 2.718 922 HA ASP 115 HA ASP 115 -0.892 -11.305 4.797 923 HB2 ASP 115 HB2 ASP 115 1.671 -11.407 3.183 924 HB3 ASP 115 HB3 ASP 115 1.336 -10.214 4.431 925 H ALA 116 H ALA 116 -0.247 -10.938 1.309 926 HA ALA 116 HA ALA 116 -1.113 -8.174 1.227 927 HB1 ALA 116 HB1 ALA 116 -1.113 -8.683 -1.271 928 HB2 ALA 116 HB2 ALA 116 0.405 -8.919 -0.434 929 HB3 ALA 116 HB3 ALA 116 -0.580 -10.329 -0.838 930 H PHE 117 H PHE 117 -2.840 -11.318 0.565 931 HA PHE 117 HA PHE 117 -5.280 -10.149 -0.262 932 HB2 PHE 117 HB2 PHE 117 -4.644 -12.588 -0.291 933 HB3 PHE 117 HB3 PHE 117 -4.978 -12.649 1.435 934 HD1 PHE 117 HD1 PHE 117 -6.386 -12.621 -1.946 935 HD2 PHE 117 HD2 PHE 117 -7.352 -12.292 2.250 936 HE1 PHE 117 HE1 PHE 117 -8.762 -13.075 -2.458 937 HE2 PHE 117 HE2 PHE 117 -9.743 -12.698 1.723 938 HZ PHE 117 HZ PHE 117 -10.456 -13.051 -0.622 939 H ASP 118 H ASP 118 -3.921 -10.388 3.012 940 HA ASP 118 HA ASP 118 -6.370 -9.463 4.302 941 HB2 ASP 118 HB2 ASP 118 -4.714 -11.098 5.280 942 HB3 ASP 118 HB3 ASP 118 -3.585 -9.753 5.455 943 H PHE 119 H PHE 119 -3.426 -7.916 3.010 944 HA PHE 119 HA PHE 119 -3.881 -5.303 4.108 945 HB2 PHE 119 HB2 PHE 119 -1.787 -5.828 3.047 946 HB3 PHE 119 HB3 PHE 119 -2.563 -6.296 1.560 947 HD1 PHE 119 HD1 PHE 119 -3.764 -4.520 0.136 948 HD2 PHE 119 HD2 PHE 119 -0.924 -3.619 3.218 949 HE1 PHE 119 HE1 PHE 119 -3.399 -2.266 -0.858 950 HE2 PHE 119 HE2 PHE 119 -0.613 -1.373 2.292 951 HZ PHE 119 HZ PHE 119 -1.846 -0.676 0.244 952 H ASN 120 H ASN 120 -5.133 -7.016 1.234 953 HA ASN 120 HA ASN 120 -6.983 -4.978 0.391 954 HB2 ASN 120 HB2 ASN 120 -6.614 -6.507 -1.261 955 HB3 ASN 120 HB3 ASN 120 -6.492 -7.868 -0.161 956 HD21 ASN 120 HD21 ASN 120 -9.759 -8.935 -0.643 957 HD22 ASN 120 HD22 ASN 120 -8.205 -9.198 0.142 958 H VAL 121 H VAL 121 -7.671 -7.934 2.423 959 HA VAL 121 HA VAL 121 -10.373 -7.193 2.760 960 HB VAL 121 HB VAL 121 -8.622 -9.024 4.434 961 HG11 VAL 121 HG11 VAL 121 -11.645 -8.658 4.625 962 HG12 VAL 121 HG12 VAL 121 -10.733 -10.011 5.331 963 HG13 VAL 121 HG13 VAL 121 -10.456 -8.376 5.919 964 HG21 VAL 121 HG21 VAL 121 -9.894 -10.801 3.283 965 HG22 VAL 121 HG22 VAL 121 -10.841 -9.580 2.404 966 HG23 VAL 121 HG23 VAL 121 -9.106 -9.761 2.102 967 H SER 122 H SER 122 -7.595 -6.276 4.778 968 HA SER 122 HA SER 122 -8.935 -5.026 6.922 969 HB2 SER 122 HB2 SER 122 -6.482 -5.360 6.739 970 HB3 SER 122 HB3 SER 122 -6.411 -4.132 5.461 971 HG SER 122 HG SER 122 -7.300 -3.738 8.145 972 H LEU 123 H LEU 123 -8.498 -3.885 3.586 973 HA LEU 123 HA LEU 123 -9.679 -1.241 4.187 974 HB2 LEU 123 HB2 LEU 123 -8.571 -2.446 1.639 975 HB3 LEU 123 HB3 LEU 123 -9.143 -0.785 1.816 976 HG LEU 123 HG LEU 123 -6.854 -1.940 3.458 977 HD11 LEU 123 HD11 LEU 123 -5.347 -0.845 1.926 978 HD12 LEU 123 HD12 LEU 123 -6.350 -1.992 1.046 979 HD13 LEU 123 HD13 LEU 123 -6.725 -0.259 0.955 980 HD21 LEU 123 HD21 LEU 123 -7.747 0.923 2.948 981 HD22 LEU 123 HD22 LEU 123 -7.882 0.042 4.485 982 HD23 LEU 123 HD23 LEU 123 -6.288 0.434 3.839 983 H GLN 124 H GLN 124 -10.541 -4.241 2.399 984 HA GLN 124 HA GLN 124 -13.031 -3.385 1.326 985 HB2 GLN 124 HB2 GLN 124 -12.320 -6.095 2.528 986 HB3 GLN 124 HB3 GLN 124 -13.752 -5.778 1.569 987 HG2 GLN 124 HG2 GLN 124 -10.911 -5.481 0.530 988 HG3 GLN 124 HG3 GLN 124 -11.888 -6.921 0.352 989 HE21 GLN 124 HE21 GLN 124 -12.189 -5.139 -2.838 990 HE22 GLN 124 HE22 GLN 124 -10.922 -5.959 -1.915 991 H ASP 125 H ASP 125 -12.417 -4.888 4.554 992 HA ASP 125 HA ASP 125 -15.147 -4.382 5.449 993 HB2 ASP 125 HB2 ASP 125 -13.603 -6.305 6.114 994 HB3 ASP 125 HB3 ASP 125 -12.685 -5.134 7.074 995 H HIS 126 H HIS 126 -12.526 -2.278 5.184 996 HA HIS 126 HA HIS 126 -13.371 -0.537 7.447 997 HB2 HIS 126 HB2 HIS 126 -10.996 -0.615 7.060 998 HB3 HIS 126 HB3 HIS 126 -11.214 -0.167 5.360 999 HD2 HIS 126 HD2 HIS 126 -12.115 1.381 8.852 1000 HE1 HIS 126 HE1 HIS 126 -11.205 4.579 6.192 1001 HE2 HIS 126 HE2 HIS 126 -11.911 4.001 8.554 1002 H PHE 127 H PHE 127 -13.485 -0.603 3.850 1003 HA PHE 127 HA PHE 127 -15.192 1.786 3.894 1004 HB2 PHE 127 HB2 PHE 127 -13.957 0.198 1.662 1005 HB3 PHE 127 HB3 PHE 127 -15.161 1.453 1.379 1006 HD1 PHE 127 HD1 PHE 127 -14.761 3.829 2.105 1007 HD2 PHE 127 HD2 PHE 127 -11.675 0.827 2.333 1008 HE1 PHE 127 HE1 PHE 127 -13.058 5.595 2.505 1009 HE2 PHE 127 HE2 PHE 127 -9.976 2.582 2.676 1010 HZ PHE 127 HZ PHE 127 -10.668 4.980 2.780 1011 H LYS 128 H LYS 128 -15.850 -1.632 3.967 1012 HA LYS 128 HA LYS 128 -18.266 -1.711 2.607 1013 HB2 LYS 128 HB2 LYS 128 -18.739 -3.763 3.570 1014 HB3 LYS 128 HB3 LYS 128 -17.010 -3.661 3.441 1015 HG2 LYS 128 HG2 LYS 128 -17.180 -4.582 5.513 1016 HG3 LYS 128 HG3 LYS 128 -17.169 -2.874 5.994 1017 HD2 LYS 128 HD2 LYS 128 -19.740 -3.065 5.940 1018 HD3 LYS 128 HD3 LYS 128 -19.507 -4.793 5.673 1019 HE2 LYS 128 HE2 LYS 128 -18.380 -3.297 8.070 1020 HE3 LYS 128 HE3 LYS 128 -20.016 -3.961 8.050 1021 HZ1 LYS 128 HZ1 LYS 128 -18.501 -5.540 9.044 1022 HZ2 LYS 128 HZ2 LYS 128 -19.037 -6.170 7.636 1023 HZ3 LYS 128 HZ3 LYS 128 -17.520 -5.551 7.745 1024 H TRP 129 H TRP 129 -17.830 -0.277 5.755 1025 HA TRP 129 HA TRP 129 -20.779 -0.048 6.152 1026 HB2 TRP 129 HB2 TRP 129 -20.187 0.422 8.491 1027 HB3 TRP 129 HB3 TRP 129 -19.672 -1.151 7.923 1028 HD1 TRP 129 HD1 TRP 129 -17.064 -1.682 7.894 1029 HE1 TRP 129 HE1 TRP 129 -15.008 -0.487 8.714 1030 HE3 TRP 129 HE3 TRP 129 -19.169 2.838 8.971 1031 HZ2 TRP 129 HZ2 TRP 129 -14.282 2.181 9.659 1032 HZ3 TRP 129 HZ3 TRP 129 -17.754 4.732 9.788 1033 HH2 TRP 129 HH2 TRP 129 -15.307 4.426 10.071 1034 H VAL 130 H VAL 130 -18.684 1.761 4.550 1035 HA VAL 130 HA VAL 130 -19.970 4.355 5.236 1036 HB VAL 130 HB VAL 130 -17.384 5.157 4.635 1037 HG11 VAL 130 HG11 VAL 130 -17.318 5.758 7.057 1038 HG12 VAL 130 HG12 VAL 130 -18.857 6.179 6.280 1039 HG13 VAL 130 HG13 VAL 130 -18.750 4.745 7.316 1040 HG21 VAL 130 HG21 VAL 130 -17.030 2.925 6.620 1041 HG22 VAL 130 HG22 VAL 130 -16.490 2.913 4.937 1042 HG23 VAL 130 HG23 VAL 130 -15.832 4.106 6.064 1043 H LYS 131 H LYS 131 -18.528 5.895 3.351 1044 HA LYS 131 HA LYS 131 -18.803 6.689 1.315 1045 HB2 LYS 131 HB2 LYS 131 -17.254 4.506 1.107 1046 HB3 LYS 131 HB3 LYS 131 -18.591 3.933 0.119 1047 HG2 LYS 131 HG2 LYS 131 -17.073 4.900 -1.382 1048 HG3 LYS 131 HG3 LYS 131 -18.347 6.120 -1.206 1049 HD2 LYS 131 HD2 LYS 131 -16.927 7.383 0.376 1050 HD3 LYS 131 HD3 LYS 131 -15.656 6.147 0.216 1051 HE2 LYS 131 HE2 LYS 131 -15.594 6.592 -2.246 1052 HE3 LYS 131 HE3 LYS 131 -16.794 7.877 -2.035 1053 HZ1 LYS 131 HZ1 LYS 131 -14.090 7.843 -0.792 1054 HZ2 LYS 131 HZ2 LYS 131 -14.523 8.778 -2.070 1055 HZ3 LYS 131 HZ3 LYS 131 -15.142 9.033 -0.582 1056 H GLN 132 H GLN 132 -21.244 5.618 2.629 1057 HA GLN 132 HA GLN 132 -23.484 5.453 2.275 1058 HB2 GLN 132 HB2 GLN 132 -22.797 7.580 0.205 1059 HB3 GLN 132 HB3 GLN 132 -24.420 7.209 0.766 1060 HG2 GLN 132 HG2 GLN 132 -23.821 9.065 2.023 1061 HG3 GLN 132 HG3 GLN 132 -23.704 7.704 3.123 1062 HE21 GLN 132 HE21 GLN 132 -20.698 9.417 4.067 1063 HE22 GLN 132 HE22 GLN 132 -22.377 9.127 4.495 1064 H GLU 133 H GLU 133 -21.928 3.470 0.762 1065 HA GLU 133 HA GLU 133 -23.727 2.817 -1.474 1066 HB2 GLU 133 HB2 GLU 133 -21.396 1.256 -0.297 1067 HB3 GLU 133 HB3 GLU 133 -22.348 0.781 -1.708 1068 HG2 GLU 133 HG2 GLU 133 -21.698 2.997 -2.784 1069 HG3 GLU 133 HG3 GLU 133 -20.560 3.228 -1.454 1070 H1 SER 149 H1 SER 149 12.813 -21.653 -10.506 1071 H2 SER 149 H2 SER 149 14.111 -21.841 -9.530 1072 H3 SER 149 H3 SER 149 14.224 -20.888 -10.855 1073 HA SER 149 HA SER 149 14.063 -19.546 -8.875 1074 HB2 SER 149 HB2 SER 149 13.096 -18.702 -11.016 1075 HB3 SER 149 HB3 SER 149 11.519 -19.362 -10.535 1076 HG SER 149 HG SER 149 11.782 -17.146 -9.986 1077 H GLN 150 H GLN 150 12.715 -18.752 -7.145 1078 HA GLN 150 HA GLN 150 10.837 -20.779 -5.982 1079 HB2 GLN 150 HB2 GLN 150 12.672 -18.818 -4.556 1080 HB3 GLN 150 HB3 GLN 150 11.498 -19.886 -3.775 1081 HG2 GLN 150 HG2 GLN 150 12.686 -21.870 -4.742 1082 HG3 GLN 150 HG3 GLN 150 13.929 -20.785 -5.377 1083 HE21 GLN 150 HE21 GLN 150 15.377 -20.150 -2.128 1084 HE22 GLN 150 HE22 GLN 150 15.174 -19.447 -3.726 1085 H ILE 151 H ILE 151 10.620 -18.028 -7.683 1086 HA ILE 151 HA ILE 151 8.138 -17.143 -6.331 1087 HB ILE 151 HB ILE 151 10.094 -15.738 -5.586 1088 HG12 ILE 151 HG12 ILE 151 8.003 -14.125 -7.092 1089 HG13 ILE 151 HG13 ILE 151 7.684 -14.990 -5.583 1090 HG21 ILE 151 HG21 ILE 151 10.073 -14.687 -8.451 1091 HG22 ILE 151 HG22 ILE 151 11.070 -14.093 -7.112 1092 HG23 ILE 151 HG23 ILE 151 11.337 -15.714 -7.748 1093 HD11 ILE 151 HD11 ILE 151 9.662 -12.706 -5.964 1094 HD12 ILE 151 HD12 ILE 151 8.122 -12.666 -5.096 1095 HD13 ILE 151 HD13 ILE 151 9.462 -13.640 -4.461 1096 H THR 152 H THR 152 6.754 -15.806 -7.743 1097 HA THR 152 HA THR 152 6.686 -16.736 -10.512 1098 HB THR 152 HB THR 152 4.652 -16.364 -9.228 1099 HG1 THR 152 HG1 THR 152 3.515 -15.479 -10.859 1100 HG21 THR 152 HG21 THR 152 5.289 -13.389 -9.533 1101 HG22 THR 152 HG22 THR 152 3.732 -14.058 -9.018 1102 HG23 THR 152 HG23 THR 152 5.165 -14.278 -8.000 1103 H SER 153 H SER 153 6.112 -15.075 -12.082 1104 HA SER 153 HA SER 153 7.977 -12.773 -12.190 1105 HB2 SER 153 HB2 SER 153 7.730 -14.778 -14.456 1106 HB3 SER 153 HB3 SER 153 8.725 -13.309 -14.480 1107 HG SER 153 HG SER 153 9.957 -15.190 -13.985 1108 H GLN 154 H GLN 154 5.266 -12.890 -11.775 1109 HA GLN 154 HA GLN 154 4.371 -10.806 -13.506 1110 HB2 GLN 154 HB2 GLN 154 2.403 -11.865 -14.478 1111 HB3 GLN 154 HB3 GLN 154 3.861 -12.713 -14.975 1112 HG2 GLN 154 HG2 GLN 154 3.429 -14.492 -13.319 1113 HG3 GLN 154 HG3 GLN 154 2.018 -13.628 -12.715 1114 HE21 GLN 154 HE21 GLN 154 0.451 -16.071 -14.860 1115 HE22 GLN 154 HE22 GLN 154 1.021 -15.826 -13.215 1116 H VAL 155 H VAL 155 2.291 -9.871 -12.953 1117 HA VAL 155 HA VAL 155 0.890 -10.827 -10.498 1118 HB VAL 155 HB VAL 155 0.853 -8.462 -10.688 1119 HG11 VAL 155 HG11 VAL 155 -0.293 -8.688 -13.475 1120 HG12 VAL 155 HG12 VAL 155 -0.135 -7.202 -12.539 1121 HG13 VAL 155 HG13 VAL 155 1.321 -8.079 -13.044 1122 HG21 VAL 155 HG21 VAL 155 -1.223 -9.044 -9.741 1123 HG22 VAL 155 HG22 VAL 155 -1.665 -7.922 -10.974 1124 HG23 VAL 155 HG23 VAL 155 -1.886 -9.639 -11.274 1125 H TPO 156 H T2P 156 -0.428 -12.503 -10.710 1126 HA TPO 156 HA T2P 156 -1.194 -13.927 -13.079 1127 HB TPO 156 HB T2P 156 -2.716 -13.622 -10.514 1128 HG21 TPO 156 HG21 T2P 156 -3.851 -15.718 -11.096 1129 HG22 TPO 156 HG22 T2P 156 -3.334 -15.449 -12.777 1130 HG23 TPO 156 HG23 T2P 156 -4.358 -14.235 -11.905 1131 H GLY 157 H GLY 157 -2.913 -13.886 -14.269 1132 HA2 GLY 157 HA2 GLY 157 -5.105 -11.967 -14.113 1133 HA3 GLY 157 HA3 GLY 157 -4.010 -11.630 -15.458 1134 H GLN 158 H GLN 158 -3.563 -14.698 -15.732 1135 HA GLN 158 HA GLN 158 -5.515 -15.198 -17.702 1136 HB2 GLN 158 HB2 GLN 158 -4.521 -17.375 -17.917 1137 HB3 GLN 158 HB3 GLN 158 -3.267 -16.155 -17.702 1138 HG2 GLN 158 HG2 GLN 158 -3.050 -16.838 -15.293 1139 HG3 GLN 158 HG3 GLN 158 -4.282 -18.075 -15.549 1140 HE21 GLN 158 HE21 GLN 158 -1.134 -19.914 -15.828 1141 HE22 GLN 158 HE22 GLN 158 -2.131 -19.181 -14.579 1142 H ILE 159 H ILE 159 -5.645 -15.983 -14.281 1143 HA ILE 159 HA ILE 159 -8.260 -17.355 -14.703 1144 HB ILE 159 HB ILE 159 -6.674 -18.627 -13.434 1145 HG12 ILE 159 HG12 ILE 159 -7.996 -19.139 -11.413 1146 HG13 ILE 159 HG13 ILE 159 -8.952 -17.680 -11.652 1147 HG21 ILE 159 HG21 ILE 159 -5.254 -17.043 -12.396 1148 HG22 ILE 159 HG22 ILE 159 -6.599 -16.328 -11.477 1149 HG23 ILE 159 HG23 ILE 159 -6.010 -17.947 -11.091 1150 HD11 ILE 159 HD11 ILE 159 -9.861 -18.594 -13.757 1151 HD12 ILE 159 HD12 ILE 159 -8.787 -20.008 -13.621 1152 HD13 ILE 159 HD13 ILE 159 -10.086 -19.752 -12.439 1153 H GLY 160 H GLY 160 -6.835 -14.545 -13.127 1154 HA2 GLY 160 HA2 GLY 160 -7.733 -12.433 -12.840 1155 HA3 GLY 160 HA3 GLY 160 -9.131 -12.956 -13.782 1156 H TRP 161 H TRP 161 -7.685 -13.343 -10.543 1157 HA TRP 161 HA TRP 161 -10.387 -13.873 -9.371 1158 HB2 TRP 161 HB2 TRP 161 -9.643 -15.946 -8.586 1159 HB3 TRP 161 HB3 TRP 161 -9.056 -15.880 -10.228 1160 HD1 TRP 161 HD1 TRP 161 -6.319 -14.386 -9.879 1161 HE1 TRP 161 HE1 TRP 161 -4.326 -15.682 -8.847 1162 HE3 TRP 161 HE3 TRP 161 -8.862 -17.086 -6.448 1163 HZ2 TRP 161 HZ2 TRP 161 -3.997 -17.916 -7.118 1164 HZ3 TRP 161 HZ3 TRP 161 -7.674 -18.739 -4.994 1165 HH2 TRP 161 HH2 TRP 161 -5.253 -19.199 -5.344 1166 H ARG 162 H ARG 162 -10.360 -14.344 -7.141 1167 HA ARG 162 HA ARG 162 -8.216 -13.914 -5.301 1168 HB2 ARG 162 HB2 ARG 162 -9.754 -11.545 -5.967 1169 HB3 ARG 162 HB3 ARG 162 -10.034 -11.991 -4.267 1170 HG2 ARG 162 HG2 ARG 162 -7.478 -12.202 -4.077 1171 HG3 ARG 162 HG3 ARG 162 -7.368 -11.468 -5.666 1172 HD2 ARG 162 HD2 ARG 162 -8.811 -10.175 -3.296 1173 HD3 ARG 162 HD3 ARG 162 -7.113 -9.904 -3.672 1174 HE ARG 162 HE ARG 162 -9.157 -9.350 -5.774 1175 HH11 ARG 162 HH11 ARG 162 -8.994 -7.375 -6.842 1176 HH12 ARG 162 HH12 ARG 162 -7.876 -6.180 -6.213 1177 HH21 ARG 162 HH21 ARG 162 -6.791 -7.954 -3.578 1178 HH22 ARG 162 HH22 ARG 162 -6.691 -6.486 -4.551 1179 H ARG 163 H ARG 163 -11.746 -13.977 -5.667 1180 HA ARG 163 HA ARG 163 -11.859 -16.416 -3.975 1181 HB2 ARG 163 HB2 ARG 163 -13.753 -14.035 -3.751 1182 HB3 ARG 163 HB3 ARG 163 -14.077 -15.621 -3.073 1183 HG2 ARG 163 HG2 ARG 163 -11.775 -13.789 -2.289 1184 HG3 ARG 163 HG3 ARG 163 -13.256 -14.028 -1.373 1185 HD2 ARG 163 HD2 ARG 163 -11.150 -16.159 -1.921 1186 HD3 ARG 163 HD3 ARG 163 -11.375 -15.283 -0.407 1187 HE ARG 163 HE ARG 163 -13.846 -16.422 -0.848 1188 HH11 ARG 163 HH11 ARG 163 -14.531 -18.389 -0.082 1189 HH12 ARG 163 HH12 ARG 163 -13.370 -19.622 0.314 1190 HH21 ARG 163 HH21 ARG 163 -10.627 -17.763 -0.553 1191 HH22 ARG 163 HH22 ARG 163 -11.218 -19.287 0.055
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