NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
572060 | 2m98 | 19286 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 0.999 18.372 15.968 2 H2 GLY 1 HT2 GLY 1 -0.365 18.639 16.945 3 H3 GLY 1 HT3 GLY 1 1.039 17.950 17.610 4 HA2 GLY 1 HA2 GLY 1 0.375 20.585 17.677 5 HA3 GLY 1 HA1 GLY 1 1.980 19.917 17.979 6 H SER 2 HN SER 2 2.957 21.807 17.045 7 HA SER 2 HA SER 2 2.401 22.556 14.270 8 HB2 SER 2 HB2 SER 2 3.417 23.777 16.499 9 HB3 SER 2 HB1 SER 2 4.896 23.428 15.608 10 HG SER 2 HG SER 2 2.593 24.735 14.573 11 H HIS 3 HN HIS 3 5.439 21.482 15.849 12 HA HIS 3 HA HIS 3 6.862 20.841 13.508 13 HB2 HIS 3 HB2 HIS 3 8.285 19.585 15.023 14 HB3 HIS 3 HB1 HIS 3 7.670 20.988 15.896 15 HD1 HIS 3 HD1 HIS 3 5.491 20.485 17.453 16 HD2 HIS 3 HD2 HIS 3 7.683 17.161 16.216 17 HE1 HIS 3 HE1 HIS 3 4.796 18.567 18.956 18 H MET 4 HN MET 4 5.556 19.731 11.968 19 HA MET 4 HA MET 4 4.796 16.930 12.735 20 HB2 MET 4 HB2 MET 4 2.978 17.227 11.052 21 HB3 MET 4 HB1 MET 4 2.873 18.410 12.356 22 HG2 MET 4 HG2 MET 4 3.400 20.164 10.991 23 HG3 MET 4 HG1 MET 4 4.529 19.210 10.028 24 HE1 MET 4 HE1 MET 4 0.014 19.611 9.694 25 HE2 MET 4 HE2 MET 4 1.082 19.983 11.045 26 HE3 MET 4 HE3 MET 4 0.579 18.319 10.760 27 H THR 5 HN THR 5 4.167 16.277 9.957 28 HA THR 5 HA THR 5 6.904 16.408 8.734 29 HB THR 5 HB THR 5 6.586 14.052 8.118 30 HG1 THR 5 HG1 THR 5 4.078 14.519 9.316 31 HG21 THR 5 HG21 THR 5 7.032 15.049 10.683 32 HG22 THR 5 HG22 THR 5 7.382 13.412 10.128 33 HG23 THR 5 HG23 THR 5 5.847 13.765 10.923 34 H GLU 6 HN GLU 6 6.929 16.341 6.427 35 HA GLU 6 HA GLU 6 4.332 16.440 4.986 36 HB2 GLU 6 HB2 GLU 6 4.805 18.655 4.102 37 HB3 GLU 6 HB1 GLU 6 4.923 18.726 5.861 38 HG2 GLU 6 HG2 GLU 6 7.346 18.203 4.134 39 HG3 GLU 6 HG1 GLU 6 6.818 19.843 4.520 40 H ARG 7 HN ARG 7 7.448 15.309 5.107 41 HA ARG 7 HA ARG 7 7.563 14.964 2.134 42 HB2 ARG 7 HB2 ARG 7 9.206 16.607 2.676 43 HB3 ARG 7 HB1 ARG 7 9.686 15.751 4.142 44 HG2 ARG 7 HG2 ARG 7 9.950 14.297 1.550 45 HG3 ARG 7 HG1 ARG 7 11.118 15.574 1.894 46 HD2 ARG 7 HD2 ARG 7 10.637 13.818 4.202 47 HD3 ARG 7 HD1 ARG 7 11.328 12.970 2.804 48 HE ARG 7 HE ARG 7 12.698 15.446 3.078 49 HH11 ARG 7 HH11 ARG 7 14.017 12.735 2.923 50 HH12 ARG 7 HH12 ARG 7 14.790 12.630 4.469 51 HH21 ARG 7 HH21 ARG 7 12.937 15.206 5.869 52 HH22 ARG 7 HH22 ARG 7 14.182 14.031 6.135 53 H ARG 8 HN ARG 8 7.150 13.463 5.027 54 HA ARG 8 HA ARG 8 8.880 11.113 4.589 55 HB2 ARG 8 HB2 ARG 8 8.551 11.908 6.839 56 HB3 ARG 8 HB1 ARG 8 6.801 11.950 6.628 57 HG2 ARG 8 HG2 ARG 8 7.974 9.315 6.071 58 HG3 ARG 8 HG1 ARG 8 8.213 9.854 7.732 59 HD2 ARG 8 HD2 ARG 8 5.621 10.545 7.457 60 HD3 ARG 8 HD1 ARG 8 5.674 9.192 6.311 61 HE ARG 8 HE ARG 8 5.737 7.824 8.228 62 HH11 ARG 8 HH21 ARG 8 5.709 10.532 9.856 63 HH12 ARG 8 HH22 ARG 8 7.028 10.221 10.934 64 HH21 ARG 8 HH11 ARG 8 8.211 7.510 9.133 65 HH22 ARG 8 HH12 ARG 8 8.436 8.508 10.531 66 H LEU 9 HN LEU 9 6.158 12.135 3.110 67 HA LEU 9 HA LEU 9 4.374 9.898 3.326 68 HB2 LEU 9 HB2 LEU 9 4.336 12.438 2.332 69 HB3 LEU 9 HB1 LEU 9 4.411 11.501 0.846 70 HG LEU 9 HG LEU 9 2.550 10.082 2.258 71 HD11 LEU 9 HD11 LEU 9 1.257 12.578 2.768 72 HD12 LEU 9 HD12 LEU 9 2.823 12.608 3.578 73 HD13 LEU 9 HD13 LEU 9 1.675 11.315 3.926 74 HD21 LEU 9 HD21 LEU 9 1.231 10.666 0.496 75 HD22 LEU 9 HD22 LEU 9 2.659 11.525 -0.082 76 HD23 LEU 9 HD23 LEU 9 1.413 12.391 0.817 77 H ARG 10 HN ARG 10 4.872 7.881 2.659 78 HA ARG 10 HA ARG 10 6.223 7.499 0.020 79 HB2 ARG 10 HB2 ARG 10 6.872 5.957 2.544 80 HB3 ARG 10 HB1 ARG 10 7.769 5.966 1.028 81 HG2 ARG 10 HG2 ARG 10 7.390 8.382 2.804 82 HG3 ARG 10 HG1 ARG 10 8.836 7.377 2.783 83 HD2 ARG 10 HD2 ARG 10 8.156 8.089 0.077 84 HD3 ARG 10 HD1 ARG 10 8.253 9.561 1.068 85 HE ARG 10 HE ARG 10 10.474 7.736 0.506 86 HH11 ARG 10 HH21 ARG 10 9.148 10.225 2.508 87 HH12 ARG 10 HH22 ARG 10 10.651 10.570 3.290 88 HH21 ARG 10 HH11 ARG 10 12.415 8.114 1.603 89 HH22 ARG 10 HH12 ARG 10 12.493 9.382 2.781 90 H VAL 11 HN VAL 11 5.597 5.535 -1.015 91 HA VAL 11 HA VAL 11 3.504 3.930 0.398 92 HB VAL 11 HB VAL 11 2.216 3.973 -1.724 93 HG11 VAL 11 HG11 VAL 11 1.690 5.627 -0.016 94 HG12 VAL 11 HG12 VAL 11 1.581 6.383 -1.604 95 HG13 VAL 11 HG13 VAL 11 2.990 6.675 -0.585 96 HG21 VAL 11 HG21 VAL 11 4.673 5.400 -2.608 97 HG22 VAL 11 HG22 VAL 11 3.143 6.030 -3.214 98 HG23 VAL 11 HG23 VAL 11 3.590 4.353 -3.523 99 H LEU 12 HN LEU 12 4.300 1.890 0.502 100 HA LEU 12 HA LEU 12 6.104 0.918 -1.659 101 HB2 LEU 12 HB2 LEU 12 5.381 -0.509 0.900 102 HB3 LEU 12 HB1 LEU 12 6.869 -0.623 -0.030 103 HG LEU 12 HG LEU 12 7.587 0.700 1.733 104 HD11 LEU 12 HD11 LEU 12 8.145 2.696 0.778 105 HD12 LEU 12 HD12 LEU 12 6.471 3.096 0.396 106 HD13 LEU 12 HD13 LEU 12 7.374 1.996 -0.645 107 HD21 LEU 12 HD21 LEU 12 4.818 1.026 2.156 108 HD22 LEU 12 HD22 LEU 12 5.501 2.651 2.085 109 HD23 LEU 12 HD23 LEU 12 6.130 1.476 3.240 110 H VAL 13 HN VAL 13 4.825 0.090 -3.326 111 HA VAL 13 HA VAL 13 2.553 -1.717 -2.539 112 HB VAL 13 HB VAL 13 2.979 -0.270 -5.169 113 HG11 VAL 13 HG11 VAL 13 1.025 -1.218 -5.761 114 HG12 VAL 13 HG12 VAL 13 0.256 -0.685 -4.266 115 HG13 VAL 13 HG13 VAL 13 1.142 -2.208 -4.306 116 HG21 VAL 13 HG21 VAL 13 1.499 1.488 -4.321 117 HG22 VAL 13 HG22 VAL 13 2.924 1.358 -3.290 118 HG23 VAL 13 HG23 VAL 13 1.389 0.666 -2.764 119 H VAL 14 HN VAL 14 3.047 -3.845 -2.927 120 HA VAL 14 HA VAL 14 4.901 -4.381 -5.208 121 HB VAL 14 HB VAL 14 6.034 -5.962 -3.686 122 HG11 VAL 14 HG11 VAL 14 6.043 -3.414 -2.177 123 HG12 VAL 14 HG12 VAL 14 6.407 -3.316 -3.900 124 HG13 VAL 14 HG13 VAL 14 7.393 -4.329 -2.847 125 HG21 VAL 14 HG21 VAL 14 3.716 -5.419 -2.099 126 HG22 VAL 14 HG22 VAL 14 5.156 -4.970 -1.187 127 HG23 VAL 14 HG23 VAL 14 4.985 -6.611 -1.813 128 H GLU 15 HN GLU 15 4.886 -6.507 -5.987 129 HA GLU 15 HA GLU 15 3.057 -8.569 -5.162 130 HB2 GLU 15 HB2 GLU 15 1.339 -8.322 -6.781 131 HB3 GLU 15 HB1 GLU 15 1.603 -6.676 -6.198 132 HG2 GLU 15 HG2 GLU 15 2.992 -6.173 -8.118 133 HG3 GLU 15 HG1 GLU 15 2.919 -7.840 -8.669 134 H ASP 16 HN ASP 16 3.129 -10.356 -6.810 135 HA ASP 16 HA ASP 16 5.556 -11.278 -7.519 136 HB2 ASP 16 HB2 ASP 16 4.287 -12.198 -9.643 137 HB3 ASP 16 HB1 ASP 16 3.809 -12.698 -8.023 138 H GLU 17 HN GLU 17 4.021 -10.447 -10.532 139 HA GLU 17 HA GLU 17 6.511 -9.547 -11.643 140 HB2 GLU 17 HB2 GLU 17 5.308 -9.487 -13.677 141 HB3 GLU 17 HB1 GLU 17 4.565 -10.770 -12.733 142 HG2 GLU 17 HG2 GLU 17 3.497 -8.013 -13.296 143 HG3 GLU 17 HG1 GLU 17 2.758 -9.560 -13.653 144 H SER 18 HN SER 18 6.300 -7.421 -13.152 145 HA SER 18 HA SER 18 6.363 -5.194 -11.263 146 HB2 SER 18 HB2 SER 18 7.125 -4.011 -13.372 147 HB3 SER 18 HB1 SER 18 8.071 -5.429 -12.925 148 HG SER 18 HG SER 18 7.583 -5.654 -15.063 149 H MET 19 HN MET 19 3.715 -6.448 -12.833 150 HA MET 19 HA MET 19 2.417 -4.365 -14.161 151 HB2 MET 19 HB2 MET 19 1.768 -6.843 -13.156 152 HB3 MET 19 HB1 MET 19 0.777 -5.783 -12.150 153 HG2 MET 19 HG2 MET 19 -0.556 -6.288 -14.073 154 HG3 MET 19 HG1 MET 19 0.037 -4.644 -14.312 155 HE1 MET 19 HE1 MET 19 -0.629 -5.395 -17.232 156 HE2 MET 19 HE2 MET 19 0.946 -4.772 -17.717 157 HE3 MET 19 HE3 MET 19 0.122 -4.075 -16.325 158 H ILE 20 HN ILE 20 3.258 -4.657 -10.808 159 HA ILE 20 HA ILE 20 1.595 -2.380 -9.923 160 HB ILE 20 HB ILE 20 1.981 -4.454 -8.597 161 HG12 ILE 20 HG12 ILE 20 3.476 -2.620 -6.898 162 HG13 ILE 20 HG11 ILE 20 2.122 -1.815 -7.702 163 HG21 ILE 20 HG21 ILE 20 4.344 -4.568 -7.544 164 HG22 ILE 20 HG22 ILE 20 4.836 -3.544 -8.892 165 HG23 ILE 20 HG23 ILE 20 4.153 -5.140 -9.202 166 HD11 ILE 20 HD11 ILE 20 1.956 -3.414 -5.426 167 HD12 ILE 20 HD12 ILE 20 1.396 -4.466 -6.724 168 HD13 ILE 20 HD13 ILE 20 0.604 -2.915 -6.442 169 H ALA 21 HN ALA 21 4.846 -3.110 -10.944 170 HA ALA 21 HA ALA 21 6.422 -1.117 -9.796 171 HB1 ALA 21 HB1 ALA 21 6.369 -2.166 -12.645 172 HB2 ALA 21 HB2 ALA 21 7.173 -2.932 -11.283 173 HB3 ALA 21 HB3 ALA 21 7.749 -1.378 -11.883 174 H MET 22 HN MET 22 5.689 -0.588 -13.207 175 HA MET 22 HA MET 22 5.708 2.227 -13.084 176 HB2 MET 22 HB2 MET 22 5.857 0.876 -15.146 177 HB3 MET 22 HB1 MET 22 4.183 0.360 -14.936 178 HG2 MET 22 HG2 MET 22 3.719 2.962 -14.858 179 HG3 MET 22 HG1 MET 22 5.252 3.046 -15.725 180 HE1 MET 22 HE1 MET 22 1.383 2.939 -16.976 181 HE2 MET 22 HE2 MET 22 1.879 2.390 -15.377 182 HE3 MET 22 HE3 MET 22 1.329 1.218 -16.572 183 H LEU 23 HN LEU 23 3.212 -0.018 -12.187 184 HA LEU 23 HA LEU 23 0.941 1.725 -12.312 185 HB2 LEU 23 HB2 LEU 23 0.676 -0.648 -12.010 186 HB3 LEU 23 HB1 LEU 23 1.756 -0.656 -10.620 187 HG LEU 23 HG LEU 23 -0.761 -0.804 -10.136 188 HD11 LEU 23 HD11 LEU 23 1.366 0.543 -8.801 189 HD12 LEU 23 HD12 LEU 23 -0.061 -0.208 -8.090 190 HD13 LEU 23 HD13 LEU 23 -0.102 1.491 -8.559 191 HD21 LEU 23 HD21 LEU 23 -0.799 1.458 -11.777 192 HD22 LEU 23 HD22 LEU 23 -1.036 2.097 -10.151 193 HD23 LEU 23 HD23 LEU 23 -2.129 0.866 -10.784 194 H ILE 24 HN ILE 24 3.783 1.795 -10.435 195 HA ILE 24 HA ILE 24 2.549 3.381 -8.244 196 HB ILE 24 HB ILE 24 4.283 1.300 -8.248 197 HG12 ILE 24 HG12 ILE 24 4.625 3.531 -6.245 198 HG13 ILE 24 HG11 ILE 24 3.129 2.600 -6.338 199 HG21 ILE 24 HG21 ILE 24 6.000 3.791 -8.315 200 HG22 ILE 24 HG22 ILE 24 6.109 2.382 -9.370 201 HG23 ILE 24 HG23 ILE 24 6.550 2.247 -7.669 202 HD11 ILE 24 HD11 ILE 24 4.644 1.617 -4.673 203 HD12 ILE 24 HD12 ILE 24 5.902 1.460 -5.899 204 HD13 ILE 24 HD13 ILE 24 4.421 0.514 -6.030 205 H GLU 25 HN GLU 25 5.268 3.512 -10.579 206 HA GLU 25 HA GLU 25 6.327 6.024 -10.067 207 HB2 GLU 25 HB2 GLU 25 5.718 4.562 -12.648 208 HB3 GLU 25 HB1 GLU 25 6.650 6.061 -12.622 209 HG2 GLU 25 HG2 GLU 25 7.846 4.586 -10.620 210 HG3 GLU 25 HG1 GLU 25 7.448 3.350 -11.813 211 H ASP 26 HN ASP 26 3.178 5.273 -11.417 212 HA ASP 26 HA ASP 26 2.659 8.001 -12.349 213 HB2 ASP 26 HB2 ASP 26 0.740 7.025 -13.226 214 HB3 ASP 26 HB1 ASP 26 1.734 5.582 -13.033 215 H THR 27 HN THR 27 1.903 6.024 -9.501 216 HA THR 27 HA THR 27 0.086 7.836 -8.232 217 HB THR 27 HB THR 27 0.610 6.462 -6.250 218 HG1 THR 27 HG1 THR 27 2.799 6.283 -6.375 219 HG21 THR 27 HG21 THR 27 0.272 4.198 -7.292 220 HG22 THR 27 HG22 THR 27 0.532 4.944 -8.867 221 HG23 THR 27 HG23 THR 27 -0.846 5.428 -7.879 222 H LEU 28 HN LEU 28 3.594 7.302 -7.729 223 HA LEU 28 HA LEU 28 3.955 9.475 -5.898 224 HB2 LEU 28 HB2 LEU 28 5.885 8.297 -5.805 225 HB3 LEU 28 HB1 LEU 28 5.472 7.452 -7.290 226 HG LEU 28 HG LEU 28 6.621 10.244 -7.338 227 HD11 LEU 28 HD11 LEU 28 8.748 9.492 -7.039 228 HD12 LEU 28 HD12 LEU 28 8.441 7.994 -7.918 229 HD13 LEU 28 HD13 LEU 28 7.974 8.133 -6.223 230 HD21 LEU 28 HD21 LEU 28 6.195 9.929 -9.535 231 HD22 LEU 28 HD22 LEU 28 5.770 8.239 -9.266 232 HD23 LEU 28 HD23 LEU 28 7.454 8.693 -9.525 233 H CYS 29 HN CYS 29 3.674 9.332 -9.383 234 HA CYS 29 HA CYS 29 4.948 11.805 -10.076 235 HB2 CYS 29 HB2 CYS 29 3.324 9.753 -11.256 236 HB3 CYS 29 HB1 CYS 29 2.632 11.316 -11.689 237 HG CYS 29 HG CYS 29 5.170 11.957 -12.477 238 H GLU 30 HN GLU 30 1.675 10.999 -8.987 239 HA GLU 30 HA GLU 30 0.733 13.759 -9.129 240 HB2 GLU 30 HB2 GLU 30 -0.864 12.070 -9.589 241 HB3 GLU 30 HB1 GLU 30 -0.330 11.084 -8.229 242 HG2 GLU 30 HG2 GLU 30 -1.232 12.728 -6.648 243 HG3 GLU 30 HG1 GLU 30 -1.719 13.769 -7.986 244 H LEU 31 HN LEU 31 1.376 11.383 -6.529 245 HA LEU 31 HA LEU 31 0.982 13.243 -4.348 246 HB2 LEU 31 HB2 LEU 31 2.041 10.492 -4.811 247 HB3 LEU 31 HB1 LEU 31 2.513 11.286 -3.306 248 HG LEU 31 HG LEU 31 -0.352 11.509 -4.004 249 HD11 LEU 31 HD11 LEU 31 -0.252 9.041 -2.738 250 HD12 LEU 31 HD12 LEU 31 1.052 8.933 -3.921 251 HD13 LEU 31 HD13 LEU 31 -0.588 9.295 -4.450 252 HD21 LEU 31 HD21 LEU 31 -0.337 12.032 -1.804 253 HD22 LEU 31 HD22 LEU 31 1.397 11.714 -1.752 254 HD23 LEU 31 HD23 LEU 31 0.252 10.415 -1.417 255 H GLY 32 HN GLY 32 3.857 12.073 -6.095 256 HA2 GLY 32 HA2 GLY 32 5.923 13.263 -6.328 257 HA3 GLY 32 HA1 GLY 32 5.380 14.397 -5.082 258 H HIS 33 HN HIS 33 4.752 11.177 -4.245 259 HA HIS 33 HA HIS 33 6.060 10.992 -1.853 260 HB2 HIS 33 HB2 HIS 33 5.534 9.013 -4.065 261 HB3 HIS 33 HB1 HIS 33 6.329 8.484 -2.577 262 HD1 HIS 33 HD1 HIS 33 3.252 7.936 -3.661 263 HD2 HIS 33 HD2 HIS 33 4.486 10.350 -0.505 264 HE1 HIS 33 HE1 HIS 33 1.270 8.138 -2.097 265 H GLU 34 HN GLU 34 8.137 9.891 -1.232 266 HA GLU 34 HA GLU 34 10.362 10.953 -2.832 267 HB2 GLU 34 HB2 GLU 34 9.905 10.267 -0.183 268 HB3 GLU 34 HB1 GLU 34 10.988 8.995 -0.748 269 HG2 GLU 34 HG2 GLU 34 12.744 10.415 -1.009 270 HG3 GLU 34 HG1 GLU 34 11.723 11.718 -1.620 271 H VAL 35 HN VAL 35 9.717 7.614 -1.676 272 HA VAL 35 HA VAL 35 10.405 6.597 -4.385 273 HB VAL 35 HB VAL 35 12.333 6.854 -2.499 274 HG11 VAL 35 HG11 VAL 35 11.235 5.371 -0.884 275 HG12 VAL 35 HG12 VAL 35 12.724 4.629 -1.467 276 HG13 VAL 35 HG13 VAL 35 11.166 4.083 -2.086 277 HG21 VAL 35 HG21 VAL 35 11.872 4.991 -4.766 278 HG22 VAL 35 HG22 VAL 35 13.222 4.602 -3.701 279 HG23 VAL 35 HG23 VAL 35 13.164 6.164 -4.516 280 H ALA 36 HN ALA 36 9.002 4.951 -4.907 281 HA ALA 36 HA ALA 36 7.294 3.841 -2.765 282 HB1 ALA 36 HB1 ALA 36 6.850 4.842 -5.309 283 HB2 ALA 36 HB2 ALA 36 5.699 3.877 -4.384 284 HB3 ALA 36 HB3 ALA 36 6.768 3.097 -5.551 285 H ALA 37 HN ALA 37 6.575 1.421 -3.670 286 HA ALA 37 HA ALA 37 9.150 -0.096 -3.979 287 HB1 ALA 37 HB1 ALA 37 6.609 -0.867 -2.503 288 HB2 ALA 37 HB2 ALA 37 8.052 -0.211 -1.732 289 HB3 ALA 37 HB3 ALA 37 8.116 -1.783 -2.528 290 H THR 38 HN THR 38 9.108 -1.789 -5.483 291 HA THR 38 HA THR 38 6.589 -2.151 -7.050 292 HB THR 38 HB THR 38 9.469 -1.732 -7.841 293 HG1 THR 38 HG1 THR 38 8.658 -0.003 -8.721 294 HG21 THR 38 HG21 THR 38 8.669 -2.328 -10.201 295 HG22 THR 38 HG22 THR 38 7.302 -3.123 -9.422 296 HG23 THR 38 HG23 THR 38 8.945 -3.681 -9.104 297 H ALA 39 HN ALA 39 6.315 -4.213 -8.007 298 HA ALA 39 HA ALA 39 6.212 -6.550 -7.904 299 HB1 ALA 39 HB1 ALA 39 8.407 -5.965 -9.058 300 HB2 ALA 39 HB2 ALA 39 8.301 -7.583 -8.362 301 HB3 ALA 39 HB3 ALA 39 9.191 -6.314 -7.518 302 H SER 40 HN SER 40 6.623 -8.458 -6.451 303 HA SER 40 HA SER 40 6.410 -7.659 -3.646 304 HB2 SER 40 HB2 SER 40 5.904 -9.990 -3.333 305 HB3 SER 40 HB1 SER 40 5.110 -9.466 -4.809 306 HG SER 40 HG SER 40 7.050 -11.329 -4.441 307 H ARG 41 HN ARG 41 8.079 -7.596 -2.194 308 HA ARG 41 HA ARG 41 10.509 -9.195 -2.727 309 HB2 ARG 41 HB2 ARG 41 10.389 -6.681 -3.605 310 HB3 ARG 41 HB1 ARG 41 10.794 -6.333 -1.921 311 HG2 ARG 41 HG2 ARG 41 12.851 -6.538 -3.228 312 HG3 ARG 41 HG1 ARG 41 12.732 -7.881 -2.090 313 HD2 ARG 41 HD2 ARG 41 12.971 -9.285 -3.855 314 HD3 ARG 41 HD1 ARG 41 11.381 -8.739 -4.422 315 HE ARG 41 HE ARG 41 13.536 -6.869 -5.056 316 HH11 ARG 41 HH11 ARG 41 13.904 -9.802 -6.156 317 HH12 ARG 41 HH12 ARG 41 13.323 -9.567 -7.770 318 HH21 ARG 41 HH21 ARG 41 11.859 -6.503 -7.087 319 HH22 ARG 41 HH22 ARG 41 12.162 -7.706 -8.295 320 H MET 42 HN MET 42 10.862 -10.298 -0.839 321 HA MET 42 HA MET 42 9.648 -9.717 1.661 322 HB2 MET 42 HB2 MET 42 12.169 -11.229 0.915 323 HB3 MET 42 HB1 MET 42 11.360 -11.354 2.478 324 HG2 MET 42 HG2 MET 42 9.328 -12.183 1.403 325 HG3 MET 42 HG1 MET 42 10.056 -11.968 -0.190 326 HE1 MET 42 HE1 MET 42 12.219 -14.695 -0.916 327 HE2 MET 42 HE2 MET 42 11.542 -13.103 -1.248 328 HE3 MET 42 HE3 MET 42 10.497 -14.520 -1.282 329 H GLN 43 HN GLN 43 12.729 -8.678 0.264 330 HA GLN 43 HA GLN 43 13.866 -7.575 2.672 331 HB2 GLN 43 HB2 GLN 43 14.973 -8.200 0.458 332 HB3 GLN 43 HB1 GLN 43 14.310 -6.701 -0.196 333 HG2 GLN 43 HG2 GLN 43 16.439 -6.032 0.517 334 HG3 GLN 43 HG1 GLN 43 15.429 -5.594 1.896 335 HE21 GLN 43 HE21 GLN 43 15.585 -6.927 3.842 336 HE22 GLN 43 HE22 GLN 43 16.852 -8.036 4.056 337 H GLU 44 HN GLU 44 12.343 -5.922 -0.131 338 HA GLU 44 HA GLU 44 12.146 -3.388 1.242 339 HB2 GLU 44 HB2 GLU 44 11.204 -4.636 -1.308 340 HB3 GLU 44 HB1 GLU 44 10.464 -3.117 -0.806 341 HG2 GLU 44 HG2 GLU 44 12.328 -1.925 -1.286 342 HG3 GLU 44 HG1 GLU 44 13.389 -3.125 -0.546 343 H ALA 45 HN ALA 45 9.893 -6.082 0.648 344 HA ALA 45 HA ALA 45 7.490 -4.886 1.550 345 HB1 ALA 45 HB1 ALA 45 7.597 -7.072 0.485 346 HB2 ALA 45 HB2 ALA 45 6.900 -7.281 2.091 347 HB3 ALA 45 HB3 ALA 45 8.587 -7.706 1.799 348 H LEU 46 HN LEU 46 10.241 -6.177 3.337 349 HA LEU 46 HA LEU 46 9.020 -6.215 5.940 350 HB2 LEU 46 HB2 LEU 46 11.147 -7.345 5.083 351 HB3 LEU 46 HB1 LEU 46 11.928 -5.770 5.222 352 HG LEU 46 HG LEU 46 11.356 -5.688 7.617 353 HD11 LEU 46 HD11 LEU 46 9.873 -8.174 6.869 354 HD12 LEU 46 HD12 LEU 46 9.410 -6.883 7.978 355 HD13 LEU 46 HD13 LEU 46 10.590 -8.095 8.478 356 HD21 LEU 46 HD21 LEU 46 12.658 -7.908 8.235 357 HD22 LEU 46 HD22 LEU 46 13.483 -6.608 7.376 358 HD23 LEU 46 HD23 LEU 46 12.886 -8.012 6.490 359 H ASP 47 HN ASP 47 10.683 -3.756 4.028 360 HA ASP 47 HA ASP 47 11.024 -1.809 6.108 361 HB2 ASP 47 HB2 ASP 47 11.185 -2.033 3.163 362 HB3 ASP 47 HB1 ASP 47 10.881 -0.404 3.769 363 H ILE 48 HN ILE 48 8.402 -2.474 3.804 364 HA ILE 48 HA ILE 48 6.870 -0.110 4.439 365 HB ILE 48 HB ILE 48 5.340 -0.939 2.923 366 HG12 ILE 48 HG12 ILE 48 5.879 -3.637 4.166 367 HG13 ILE 48 HG11 ILE 48 4.368 -2.729 4.119 368 HG21 ILE 48 HG21 ILE 48 7.711 -1.163 2.011 369 HG22 ILE 48 HG22 ILE 48 6.446 -2.058 1.167 370 HG23 ILE 48 HG23 ILE 48 7.529 -2.897 2.270 371 HD11 ILE 48 HD11 ILE 48 4.996 -3.040 1.431 372 HD12 ILE 48 HD12 ILE 48 3.827 -4.008 2.328 373 HD13 ILE 48 HD13 ILE 48 5.484 -4.580 2.136 374 H ALA 49 HN ALA 49 7.217 -3.272 5.916 375 HA ALA 49 HA ALA 49 4.833 -2.853 7.600 376 HB1 ALA 49 HB1 ALA 49 6.660 -5.049 6.824 377 HB2 ALA 49 HB2 ALA 49 4.914 -5.075 7.071 378 HB3 ALA 49 HB3 ALA 49 6.002 -5.157 8.456 379 H ARG 50 HN ARG 50 8.307 -3.551 8.173 380 HA ARG 50 HA ARG 50 8.286 -3.130 10.973 381 HB2 ARG 50 HB2 ARG 50 10.173 -3.444 8.775 382 HB3 ARG 50 HB1 ARG 50 10.809 -2.393 10.043 383 HG2 ARG 50 HG2 ARG 50 11.422 -4.431 10.930 384 HG3 ARG 50 HG1 ARG 50 9.797 -4.317 11.606 385 HD2 ARG 50 HD2 ARG 50 9.254 -5.423 9.161 386 HD3 ARG 50 HD1 ARG 50 10.833 -6.147 9.529 387 HE ARG 50 HE ARG 50 9.822 -6.762 11.789 388 HH11 ARG 50 HH21 ARG 50 7.224 -5.238 11.110 389 HH12 ARG 50 HH22 ARG 50 6.169 -6.561 10.739 390 HH21 ARG 50 HH11 ARG 50 8.739 -8.865 10.407 391 HH22 ARG 50 HH12 ARG 50 7.027 -8.614 10.345 392 H LYS 51 HN LYS 51 8.556 -0.772 8.335 393 HA LYS 51 HA LYS 51 9.620 1.435 9.732 394 HB2 LYS 51 HB2 LYS 51 9.254 1.443 7.341 395 HB3 LYS 51 HB1 LYS 51 7.518 1.220 7.560 396 HG2 LYS 51 HG2 LYS 51 7.476 3.499 7.326 397 HG3 LYS 51 HG1 LYS 51 7.889 3.468 9.035 398 HD2 LYS 51 HD2 LYS 51 10.315 3.148 7.580 399 HD3 LYS 51 HD1 LYS 51 9.438 4.497 6.854 400 HE2 LYS 51 HE2 LYS 51 9.147 5.488 9.137 401 HE3 LYS 51 HE1 LYS 51 10.161 4.185 9.789 402 HZ1 LYS 51 HZ1 LYS 51 11.677 4.917 7.780 403 HZ2 LYS 51 HZ2 LYS 51 11.779 5.689 9.291 404 HZ3 LYS 51 HZ3 LYS 51 10.897 6.402 8.026 405 H GLY 52 HN GLY 52 6.178 0.475 9.428 406 HA2 GLY 52 HA2 GLY 52 4.483 0.776 11.082 407 HA3 GLY 52 HA1 GLY 52 5.622 1.729 12.036 408 H GLN 53 HN GLN 53 6.412 3.651 10.193 409 HA GLN 53 HA GLN 53 3.832 5.075 9.623 410 HB2 GLN 53 HB2 GLN 53 5.552 7.099 9.919 411 HB3 GLN 53 HB1 GLN 53 4.801 6.333 11.315 412 HG2 GLN 53 HG2 GLN 53 6.774 4.875 11.582 413 HG3 GLN 53 HG1 GLN 53 7.529 5.640 10.183 414 HE21 GLN 53 HE21 GLN 53 5.611 7.680 12.293 415 HE22 GLN 53 HE22 GLN 53 6.917 8.471 13.034 416 H PHE 54 HN PHE 54 4.770 3.442 7.661 417 HA PHE 54 HA PHE 54 6.454 4.971 5.773 418 HB2 PHE 54 HB2 PHE 54 6.158 2.890 4.392 419 HB3 PHE 54 HB1 PHE 54 6.832 2.567 5.981 420 HD1 PHE 54 HD1 PHE 54 5.407 1.607 7.783 421 HD2 PHE 54 HD2 PHE 54 3.969 2.088 3.766 422 HE1 PHE 54 HE1 PHE 54 3.527 0.079 8.277 423 HE2 PHE 54 HE2 PHE 54 2.090 0.561 4.269 424 HZ PHE 54 HZ PHE 54 1.861 -0.448 6.517 425 H ASP 55 HN ASP 55 3.389 5.320 6.656 426 HA ASP 55 HA ASP 55 1.628 6.490 5.602 427 HB2 ASP 55 HB2 ASP 55 3.859 6.825 3.935 428 HB3 ASP 55 HB1 ASP 55 2.557 6.302 2.865 429 H ILE 56 HN ILE 56 2.754 4.095 3.120 430 HA ILE 56 HA ILE 56 0.234 2.560 3.547 431 HB ILE 56 HB ILE 56 1.006 3.938 0.957 432 HG12 ILE 56 HG12 ILE 56 -1.087 4.523 3.066 433 HG13 ILE 56 HG11 ILE 56 0.187 5.594 2.484 434 HG21 ILE 56 HG21 ILE 56 -0.596 2.737 -0.090 435 HG22 ILE 56 HG22 ILE 56 -1.709 2.881 1.268 436 HG23 ILE 56 HG23 ILE 56 -0.468 1.628 1.277 437 HD11 ILE 56 HD11 ILE 56 -1.337 4.751 0.225 438 HD12 ILE 56 HD12 ILE 56 -1.197 6.375 0.896 439 HD13 ILE 56 HD13 ILE 56 -2.468 5.292 1.465 440 H ALA 57 HN ALA 57 0.298 0.397 2.541 441 HA ALA 57 HA ALA 57 2.764 -0.306 1.033 442 HB1 ALA 57 HB1 ALA 57 3.531 -0.561 3.280 443 HB2 ALA 57 HB2 ALA 57 3.146 -2.189 2.724 444 HB3 ALA 57 HB3 ALA 57 2.023 -1.329 3.779 445 H ILE 58 HN ILE 58 2.255 -1.939 -0.488 446 HA ILE 58 HA ILE 58 -0.283 -3.444 0.050 447 HB ILE 58 HB ILE 58 0.693 -2.084 -2.465 448 HG12 ILE 58 HG12 ILE 58 -1.635 -1.008 -2.159 449 HG13 ILE 58 HG11 ILE 58 -1.582 -1.662 -0.521 450 HG21 ILE 58 HG21 ILE 58 -1.597 -2.913 -3.320 451 HG22 ILE 58 HG22 ILE 58 -1.535 -4.067 -1.988 452 HG23 ILE 58 HG23 ILE 58 -0.292 -4.097 -3.239 453 HD11 ILE 58 HD11 ILE 58 -0.403 0.735 -1.440 454 HD12 ILE 58 HD12 ILE 58 0.929 -0.382 -1.145 455 HD13 ILE 58 HD13 ILE 58 -0.210 -0.008 0.148 456 H ILE 59 HN ILE 59 0.763 -5.406 0.584 457 HA ILE 59 HA ILE 59 2.546 -6.672 -1.463 458 HB ILE 59 HB ILE 59 1.733 -7.207 1.411 459 HG12 ILE 59 HG12 ILE 59 4.542 -7.364 0.478 460 HG13 ILE 59 HG11 ILE 59 3.789 -5.771 0.374 461 HG21 ILE 59 HG21 ILE 59 1.692 -9.414 0.714 462 HG22 ILE 59 HG22 ILE 59 3.417 -9.229 1.020 463 HG23 ILE 59 HG23 ILE 59 2.798 -9.122 -0.627 464 HD11 ILE 59 HD11 ILE 59 4.940 -6.285 2.586 465 HD12 ILE 59 HD12 ILE 59 3.672 -7.476 2.869 466 HD13 ILE 59 HD13 ILE 59 3.258 -5.770 2.710 467 H ASP 60 HN ASP 60 0.322 -6.371 -2.683 468 HA ASP 60 HA ASP 60 -1.992 -7.848 -2.094 469 HB2 ASP 60 HB2 ASP 60 -2.544 -7.429 -4.394 470 HB3 ASP 60 HB1 ASP 60 -1.578 -6.065 -3.833 471 H VAL 61 HN VAL 61 -2.551 -9.394 -4.268 472 HA VAL 61 HA VAL 61 -2.601 -11.660 -4.815 473 HB VAL 61 HB VAL 61 -0.525 -10.344 -5.878 474 HG11 VAL 61 HG11 VAL 61 1.082 -11.059 -4.151 475 HG12 VAL 61 HG12 VAL 61 1.502 -11.740 -5.721 476 HG13 VAL 61 HG13 VAL 61 0.707 -12.742 -4.511 477 HG21 VAL 61 HG21 VAL 61 -1.690 -13.037 -6.180 478 HG22 VAL 61 HG22 VAL 61 -0.126 -12.809 -6.961 479 HG23 VAL 61 HG23 VAL 61 -1.480 -11.760 -7.378 480 H ASN 62 HN ASN 62 -3.158 -13.005 -3.256 481 HA ASN 62 HA ASN 62 -1.066 -14.162 -1.475 482 HB2 ASN 62 HB2 ASN 62 -2.637 -14.009 0.396 483 HB3 ASN 62 HB1 ASN 62 -2.490 -12.404 -0.320 484 HD21 ASN 62 HD21 ASN 62 -4.144 -12.033 -2.179 485 HD22 ASN 62 HD22 ASN 62 -5.711 -12.622 -1.943 486 H LEU 63 HN LEU 63 -2.610 -14.811 -4.011 487 HA LEU 63 HA LEU 63 -3.991 -17.319 -3.148 488 HB2 LEU 63 HB2 LEU 63 -4.669 -15.088 -4.847 489 HB3 LEU 63 HB1 LEU 63 -4.613 -16.558 -5.820 490 HG LEU 63 HG LEU 63 -6.138 -17.675 -4.254 491 HD11 LEU 63 HD11 LEU 63 -6.960 -16.646 -2.299 492 HD12 LEU 63 HD12 LEU 63 -6.498 -15.033 -2.844 493 HD13 LEU 63 HD13 LEU 63 -5.261 -16.171 -2.311 494 HD21 LEU 63 HD21 LEU 63 -8.146 -16.182 -4.638 495 HD22 LEU 63 HD22 LEU 63 -7.186 -16.477 -6.087 496 HD23 LEU 63 HD23 LEU 63 -7.040 -14.943 -5.230 497 H ASP 64 HN ASP 64 -3.800 -19.055 -4.899 498 HA ASP 64 HA ASP 64 -2.380 -20.450 -6.173 499 HB2 ASP 64 HB2 ASP 64 -2.224 -17.676 -7.151 500 HB3 ASP 64 HB1 ASP 64 -0.820 -18.654 -7.591 501 H GLY 65 HN GLY 65 -1.401 -19.000 -3.520 502 HA2 GLY 65 HA2 GLY 65 0.996 -20.327 -3.132 503 HA3 GLY 65 HA1 GLY 65 1.468 -18.817 -3.907 504 H GLU 66 HN GLU 66 -0.931 -17.509 -2.511 505 HA GLU 66 HA GLU 66 -1.180 -16.218 -0.558 506 HB2 GLU 66 HB2 GLU 66 -1.769 -18.308 0.423 507 HB3 GLU 66 HB1 GLU 66 -0.109 -18.882 0.371 508 HG2 GLU 66 HG2 GLU 66 -1.123 -18.089 2.656 509 HG3 GLU 66 HG1 GLU 66 0.525 -17.637 2.244 510 HA PRO 67 HA PRO 67 3.538 -15.618 -0.510 511 HB2 PRO 67 HB2 PRO 67 3.843 -13.828 -2.548 512 HB3 PRO 67 HB1 PRO 67 3.937 -15.584 -2.788 513 HG2 PRO 67 HG2 PRO 67 1.708 -13.715 -3.369 514 HG3 PRO 67 HG1 PRO 67 2.252 -15.135 -4.270 515 HD2 PRO 67 HD2 PRO 67 0.069 -15.096 -2.614 516 HD3 PRO 67 HD1 PRO 67 0.995 -16.552 -3.033 517 H SER 68 HN SER 68 2.293 -14.526 1.424 518 HA SER 68 HA SER 68 2.448 -11.544 1.088 519 HB2 SER 68 HB2 SER 68 0.702 -12.296 3.228 520 HB3 SER 68 HB1 SER 68 0.286 -11.475 1.727 521 HG SER 68 HG SER 68 -0.820 -13.469 1.968 522 H TYR 69 HN TYR 69 3.666 -14.268 2.633 523 HA TYR 69 HA TYR 69 4.916 -14.670 4.565 524 HB2 TYR 69 HB2 TYR 69 6.382 -12.350 4.867 525 HB3 TYR 69 HB1 TYR 69 6.779 -13.662 3.765 526 HD1 TYR 69 HD1 TYR 69 6.072 -13.513 1.345 527 HD2 TYR 69 HD2 TYR 69 5.601 -10.258 4.087 528 HE1 TYR 69 HE1 TYR 69 5.762 -11.945 -0.560 529 HE2 TYR 69 HE2 TYR 69 5.298 -8.686 2.197 530 HH TYR 69 HH TYR 69 5.262 -9.869 -1.165 531 HA PRO 70 HA PRO 70 3.228 -12.904 8.141 532 HB2 PRO 70 HB2 PRO 70 5.313 -12.867 9.907 533 HB3 PRO 70 HB1 PRO 70 4.530 -14.364 9.365 534 HG2 PRO 70 HG2 PRO 70 7.120 -13.188 8.550 535 HG3 PRO 70 HG1 PRO 70 6.636 -14.885 8.683 536 HD2 PRO 70 HD2 PRO 70 6.821 -13.448 6.314 537 HD3 PRO 70 HD1 PRO 70 5.916 -14.961 6.534 538 H VAL 71 HN VAL 71 5.315 -11.055 6.310 539 HA VAL 71 HA VAL 71 5.632 -8.895 8.275 540 HB VAL 71 HB VAL 71 7.164 -8.029 6.821 541 HG11 VAL 71 HG11 VAL 71 7.392 -10.646 6.945 542 HG12 VAL 71 HG12 VAL 71 8.416 -9.719 5.850 543 HG13 VAL 71 HG13 VAL 71 6.999 -10.562 5.229 544 HG21 VAL 71 HG21 VAL 71 5.919 -7.124 5.088 545 HG22 VAL 71 HG22 VAL 71 5.117 -8.647 4.720 546 HG23 VAL 71 HG23 VAL 71 6.785 -8.391 4.222 547 H ALA 72 HN ALA 72 3.628 -9.564 5.410 548 HA ALA 72 HA ALA 72 2.232 -6.974 5.631 549 HB1 ALA 72 HB1 ALA 72 1.798 -7.529 3.487 550 HB2 ALA 72 HB2 ALA 72 0.902 -8.949 4.029 551 HB3 ALA 72 HB3 ALA 72 2.637 -9.060 3.734 552 H ASP 73 HN ASP 73 1.425 -10.437 5.991 553 HA ASP 73 HA ASP 73 -1.202 -10.238 6.890 554 HB2 ASP 73 HB2 ASP 73 1.125 -12.020 7.321 555 HB3 ASP 73 HB1 ASP 73 -0.243 -12.252 8.400 556 H ILE 74 HN ILE 74 1.740 -10.240 8.919 557 HA ILE 74 HA ILE 74 0.554 -9.704 11.437 558 HB ILE 74 HB ILE 74 3.173 -8.943 10.121 559 HG12 ILE 74 HG12 ILE 74 2.400 -11.016 12.206 560 HG13 ILE 74 HG11 ILE 74 2.819 -11.336 10.522 561 HG21 ILE 74 HG21 ILE 74 3.494 -8.872 12.916 562 HG22 ILE 74 HG22 ILE 74 2.032 -7.940 12.590 563 HG23 ILE 74 HG23 ILE 74 3.550 -7.501 11.808 564 HD11 ILE 74 HD11 ILE 74 4.977 -11.485 11.139 565 HD12 ILE 74 HD12 ILE 74 4.577 -10.995 12.786 566 HD13 ILE 74 HD13 ILE 74 4.928 -9.773 11.564 567 H LEU 75 HN LEU 75 1.792 -7.490 8.966 568 HA LEU 75 HA LEU 75 1.210 -5.004 10.153 569 HB2 LEU 75 HB2 LEU 75 2.461 -5.675 8.013 570 HB3 LEU 75 HB1 LEU 75 0.882 -5.743 7.232 571 HG LEU 75 HG LEU 75 0.551 -3.349 8.181 572 HD11 LEU 75 HD11 LEU 75 2.357 -3.126 9.689 573 HD12 LEU 75 HD12 LEU 75 2.876 -2.205 8.278 574 HD13 LEU 75 HD13 LEU 75 3.508 -3.829 8.552 575 HD21 LEU 75 HD21 LEU 75 2.196 -4.291 5.882 576 HD22 LEU 75 HD22 LEU 75 2.280 -2.569 6.255 577 HD23 LEU 75 HD23 LEU 75 0.725 -3.317 5.886 578 H ALA 76 HN ALA 76 -0.922 -7.460 8.982 579 HA ALA 76 HA ALA 76 -3.189 -5.630 8.627 580 HB1 ALA 76 HB1 ALA 76 -3.718 -7.240 7.146 581 HB2 ALA 76 HB2 ALA 76 -3.887 -8.392 8.471 582 HB3 ALA 76 HB3 ALA 76 -2.325 -8.181 7.681 583 H GLU 77 HN GLU 77 -2.274 -8.393 10.730 584 HA GLU 77 HA GLU 77 -4.613 -8.594 12.275 585 HB2 GLU 77 HB2 GLU 77 -3.178 -9.667 13.906 586 HB3 GLU 77 HB1 GLU 77 -2.566 -10.064 12.303 587 HG2 GLU 77 HG2 GLU 77 -0.659 -8.819 12.576 588 HG3 GLU 77 HG1 GLU 77 -1.459 -7.613 13.583 589 H ARG 78 HN ARG 78 -2.189 -6.088 12.324 590 HA ARG 78 HA ARG 78 -3.498 -4.888 14.715 591 HB2 ARG 78 HB2 ARG 78 -1.242 -3.511 14.607 592 HB3 ARG 78 HB1 ARG 78 -1.242 -5.143 15.270 593 HG2 ARG 78 HG2 ARG 78 -0.517 -6.047 13.106 594 HG3 ARG 78 HG1 ARG 78 -0.568 -4.433 12.397 595 HD2 ARG 78 HD2 ARG 78 1.729 -4.789 12.972 596 HD3 ARG 78 HD1 ARG 78 1.094 -3.769 14.279 597 HE ARG 78 HE ARG 78 1.773 -6.628 14.501 598 HH11 ARG 78 HH11 ARG 78 1.330 -3.734 16.119 599 HH12 ARG 78 HH12 ARG 78 0.672 -4.431 17.561 600 HH21 ARG 78 HH21 ARG 78 0.398 -7.617 16.218 601 HH22 ARG 78 HH22 ARG 78 0.149 -6.630 17.619 602 H ASN 79 HN ASN 79 -2.256 -4.236 11.476 603 HA ASN 79 HA ASN 79 -2.816 -2.591 9.903 604 HB2 ASN 79 HB2 ASN 79 -5.099 -3.413 11.418 605 HB3 ASN 79 HB1 ASN 79 -5.255 -1.698 11.065 606 HD21 ASN 79 HD21 ASN 79 -4.591 -4.838 9.465 607 HD22 ASN 79 HD22 ASN 79 -5.211 -4.378 7.954 608 H VAL 80 HN VAL 80 -1.519 -0.831 10.039 609 HA VAL 80 HA VAL 80 -1.976 1.212 12.190 610 HB VAL 80 HB VAL 80 0.362 1.762 11.797 611 HG11 VAL 80 HG11 VAL 80 0.152 -0.220 13.124 612 HG12 VAL 80 HG12 VAL 80 1.453 -0.515 11.971 613 HG13 VAL 80 HG13 VAL 80 -0.141 -1.218 11.700 614 HG21 VAL 80 HG21 VAL 80 -0.170 1.100 9.153 615 HG22 VAL 80 HG22 VAL 80 0.870 -0.220 9.680 616 HG23 VAL 80 HG23 VAL 80 1.429 1.447 9.806 617 HA PRO 81 HA PRO 81 -2.960 4.033 8.819 618 HB2 PRO 81 HB2 PRO 81 -0.965 5.809 8.269 619 HB3 PRO 81 HB1 PRO 81 -1.941 5.894 9.748 620 HG2 PRO 81 HG2 PRO 81 0.833 4.949 9.371 621 HG3 PRO 81 HG1 PRO 81 0.077 5.700 10.781 622 HD2 PRO 81 HD2 PRO 81 0.612 2.989 10.457 623 HD3 PRO 81 HD1 PRO 81 -0.466 3.693 11.675 624 H PHE 82 HN PHE 82 -3.178 3.158 6.762 625 HA PHE 82 HA PHE 82 -1.128 3.164 4.754 626 HB2 PHE 82 HB2 PHE 82 -0.302 0.923 4.858 627 HB3 PHE 82 HB1 PHE 82 -0.250 1.492 6.525 628 HD1 PHE 82 HD2 PHE 82 -2.885 1.310 7.544 629 HD2 PHE 82 HD1 PHE 82 -0.966 -1.324 4.762 630 HE1 PHE 82 HE2 PHE 82 -4.407 -0.501 8.248 631 HE2 PHE 82 HE1 PHE 82 -2.500 -3.157 5.459 632 HZ PHE 82 HZ PHE 82 -4.214 -2.744 7.200 633 H ILE 83 HN ILE 83 -1.761 0.584 3.673 634 HA ILE 83 HA ILE 83 -4.578 0.169 3.427 635 HB ILE 83 HB ILE 83 -3.305 2.196 1.828 636 HG12 ILE 83 HG12 ILE 83 -5.376 2.604 2.930 637 HG13 ILE 83 HG11 ILE 83 -5.737 2.595 1.204 638 HG21 ILE 83 HG21 ILE 83 -3.023 0.410 0.150 639 HG22 ILE 83 HG22 ILE 83 -4.251 1.562 -0.373 640 HG23 ILE 83 HG23 ILE 83 -4.733 0.003 0.296 641 HD11 ILE 83 HD11 ILE 83 -6.386 0.538 3.291 642 HD12 ILE 83 HD12 ILE 83 -6.162 0.024 1.620 643 HD13 ILE 83 HD13 ILE 83 -7.413 1.195 2.022 644 H PHE 84 HN PHE 84 -4.990 -1.537 1.813 645 HA PHE 84 HA PHE 84 -2.609 -2.994 0.807 646 HB2 PHE 84 HB2 PHE 84 -3.407 -3.261 3.341 647 HB3 PHE 84 HB1 PHE 84 -4.537 -4.388 2.602 648 HD1 PHE 84 HD2 PHE 84 -0.909 -3.582 2.962 649 HD2 PHE 84 HD1 PHE 84 -3.842 -6.542 1.913 650 HE1 PHE 84 HE2 PHE 84 0.853 -5.332 2.948 651 HE2 PHE 84 HE1 PHE 84 -2.078 -8.289 1.905 652 HZ PHE 84 HZ PHE 84 0.266 -7.677 2.415 653 H ALA 85 HN ALA 85 -3.373 -5.034 -0.365 654 HA ALA 85 HA ALA 85 -6.162 -5.396 -1.007 655 HB1 ALA 85 HB1 ALA 85 -6.400 -4.013 -2.794 656 HB2 ALA 85 HB2 ALA 85 -4.845 -4.501 -3.467 657 HB3 ALA 85 HB3 ALA 85 -4.917 -3.232 -2.245 658 H THR 86 HN THR 86 -6.241 -7.560 -1.512 659 HA THR 86 HA THR 86 -4.078 -8.720 -3.213 660 HB THR 86 HB THR 86 -3.377 -10.202 -1.577 661 HG1 THR 86 HG1 THR 86 -4.898 -10.728 0.194 662 HG21 THR 86 HG21 THR 86 -4.634 -8.114 0.224 663 HG22 THR 86 HG22 THR 86 -3.109 -7.891 -0.631 664 HG23 THR 86 HG23 THR 86 -3.253 -9.143 0.601 665 H GLY 87 HN GLY 87 -4.734 -11.204 -3.558 666 HA2 GLY 87 HA2 GLY 87 -7.098 -11.376 -5.044 667 HA3 GLY 87 HA1 GLY 87 -6.337 -12.772 -4.277 668 H TYR 88 HN TYR 88 -6.765 -11.257 -1.604 669 HA TYR 88 HA TYR 88 -9.334 -12.502 -0.987 670 HB2 TYR 88 HB2 TYR 88 -7.405 -12.615 0.513 671 HB3 TYR 88 HB1 TYR 88 -7.320 -10.855 0.580 672 HD1 TYR 88 HD1 TYR 88 -9.559 -9.658 1.316 673 HD2 TYR 88 HD2 TYR 88 -8.580 -13.740 2.174 674 HE1 TYR 88 HE1 TYR 88 -11.186 -9.640 3.176 675 HE2 TYR 88 HE2 TYR 88 -10.207 -13.732 4.040 676 HH TYR 88 HH TYR 88 -12.603 -11.713 4.375 677 H GLY 89 HN GLY 89 -8.068 -9.163 -0.513 678 HA2 GLY 89 HA2 GLY 89 -9.375 -7.247 -1.408 679 HA3 GLY 89 HA1 GLY 89 -10.835 -8.180 -1.083 680 H SER 90 HN SER 90 -8.197 -8.170 1.206 681 HA SER 90 HA SER 90 -7.985 -7.191 3.344 682 HB2 SER 90 HB2 SER 90 -9.380 -5.326 1.677 683 HB3 SER 90 HB1 SER 90 -10.087 -5.276 3.289 684 HG SER 90 HG SER 90 -7.530 -4.627 2.408 685 H LYS 91 HN LYS 91 -8.658 -8.619 4.844 686 HA LYS 91 HA LYS 91 -11.276 -9.752 5.050 687 HB2 LYS 91 HB2 LYS 91 -10.369 -10.555 7.216 688 HB3 LYS 91 HB1 LYS 91 -9.156 -10.707 5.942 689 HG2 LYS 91 HG2 LYS 91 -8.383 -8.347 6.668 690 HG3 LYS 91 HG1 LYS 91 -9.323 -8.636 8.131 691 HD2 LYS 91 HD2 LYS 91 -8.018 -10.654 8.599 692 HD3 LYS 91 HD1 LYS 91 -7.119 -10.443 7.095 693 HE2 LYS 91 HE2 LYS 91 -7.062 -8.659 9.550 694 HE3 LYS 91 HE1 LYS 91 -5.701 -9.492 8.772 695 HZ1 LYS 91 HZ1 LYS 91 -7.302 -7.231 7.719 696 HZ2 LYS 91 HZ2 LYS 91 -6.350 -8.209 6.706 697 HZ3 LYS 91 HZ3 LYS 91 -5.623 -7.307 7.948 698 H GLY 92 HN GLY 92 -9.675 -7.055 6.623 699 HA2 GLY 92 HA2 GLY 92 -11.925 -5.437 7.010 700 HA3 GLY 92 HA1 GLY 92 -11.765 -6.411 8.476 701 H LEU 93 HN LEU 93 -9.071 -5.368 6.459 702 HA LEU 93 HA LEU 93 -7.352 -4.572 8.449 703 HB2 LEU 93 HB2 LEU 93 -6.247 -3.242 6.742 704 HB3 LEU 93 HB1 LEU 93 -6.891 -4.694 5.996 705 HG LEU 93 HG LEU 93 -7.407 -2.942 4.492 706 HD11 LEU 93 HD11 LEU 93 -9.835 -2.783 4.477 707 HD12 LEU 93 HD12 LEU 93 -9.909 -3.257 6.172 708 HD13 LEU 93 HD13 LEU 93 -9.354 -4.409 4.957 709 HD21 LEU 93 HD21 LEU 93 -8.945 -1.083 5.978 710 HD22 LEU 93 HD22 LEU 93 -7.384 -0.828 5.198 711 HD23 LEU 93 HD23 LEU 93 -7.453 -1.362 6.876 712 H ASP 94 HN ASP 94 -7.343 -3.016 9.962 713 HA ASP 94 HA ASP 94 -9.443 -0.899 9.828 714 HB2 ASP 94 HB2 ASP 94 -8.944 -0.835 12.328 715 HB3 ASP 94 HB1 ASP 94 -9.614 -2.357 11.739 716 H THR 95 HN THR 95 -8.242 0.630 8.574 717 HA THR 95 HA THR 95 -5.671 1.601 9.755 718 HB THR 95 HB THR 95 -5.586 0.965 7.419 719 HG1 THR 95 HG1 THR 95 -5.009 2.930 6.519 720 HG21 THR 95 HG21 THR 95 -7.836 0.920 6.732 721 HG22 THR 95 HG22 THR 95 -7.148 2.261 5.816 722 HG23 THR 95 HG23 THR 95 -8.118 2.580 7.254 723 H ARG 96 HN ARG 96 -5.473 4.113 9.375 724 HA ARG 96 HA ARG 96 -7.744 5.380 10.744 725 HB2 ARG 96 HB2 ARG 96 -5.076 6.360 9.669 726 HB3 ARG 96 HB1 ARG 96 -6.183 7.357 10.614 727 HG2 ARG 96 HG2 ARG 96 -5.985 5.890 12.525 728 HG3 ARG 96 HG1 ARG 96 -5.059 4.717 11.588 729 HD2 ARG 96 HD2 ARG 96 -3.615 7.075 11.245 730 HD3 ARG 96 HD1 ARG 96 -4.124 7.138 12.943 731 HE ARG 96 HE ARG 96 -2.339 5.130 11.764 732 HH11 ARG 96 HH11 ARG 96 -2.296 6.476 14.549 733 HH12 ARG 96 HH12 ARG 96 -2.650 5.114 15.558 734 HH21 ARG 96 HH21 ARG 96 -3.756 3.127 12.941 735 HH22 ARG 96 HH22 ARG 96 -3.471 3.214 14.648 736 H TYR 97 HN TYR 97 -7.420 4.426 7.672 737 HA TYR 97 HA TYR 97 -8.048 6.917 6.257 738 HB2 TYR 97 HB2 TYR 97 -7.931 3.970 5.555 739 HB3 TYR 97 HB1 TYR 97 -8.265 5.228 4.368 740 HD1 TYR 97 HD2 TYR 97 -6.089 6.411 6.978 741 HD2 TYR 97 HD1 TYR 97 -6.128 4.181 3.306 742 HE1 TYR 97 HE2 TYR 97 -3.665 6.797 6.725 743 HE2 TYR 97 HE1 TYR 97 -3.692 4.572 3.054 744 HH TYR 97 HH TYR 97 -2.030 6.456 3.945 745 H SER 98 HN SER 98 -9.811 3.809 6.414 746 HA SER 98 HA SER 98 -12.228 4.609 7.541 747 HB2 SER 98 HB2 SER 98 -11.753 5.717 4.841 748 HB3 SER 98 HB1 SER 98 -13.348 4.999 5.079 749 HG SER 98 HG SER 98 -13.532 7.060 5.794 750 H ASN 99 HN ASN 99 -10.452 2.282 6.095 751 HA ASN 99 HA ASN 99 -10.925 0.025 5.580 752 HB2 ASN 99 HB2 ASN 99 -13.747 0.683 6.429 753 HB3 ASN 99 HB1 ASN 99 -12.880 -0.839 6.619 754 HD21 ASN 99 HD21 ASN 99 -10.403 0.838 7.457 755 HD22 ASN 99 HD22 ASN 99 -10.718 1.221 9.079 756 H ILE 100 HN ILE 100 -11.671 2.416 3.723 757 HA ILE 100 HA ILE 100 -13.586 0.911 1.994 758 HB ILE 100 HB ILE 100 -13.558 3.426 0.923 759 HG12 ILE 100 HG12 ILE 100 -14.040 4.742 3.209 760 HG13 ILE 100 HG11 ILE 100 -12.778 3.687 3.809 761 HG21 ILE 100 HG21 ILE 100 -15.669 2.693 1.256 762 HG22 ILE 100 HG22 ILE 100 -15.564 3.581 2.776 763 HG23 ILE 100 HG23 ILE 100 -15.244 1.847 2.744 764 HD11 ILE 100 HD11 ILE 100 -12.615 5.938 1.910 765 HD12 ILE 100 HD12 ILE 100 -11.695 4.514 1.429 766 HD13 ILE 100 HD13 ILE 100 -11.377 5.286 2.983 767 HA PRO 101 HA PRO 101 -10.137 2.096 -1.022 768 HB2 PRO 101 HB2 PRO 101 -7.677 2.741 -0.015 769 HB3 PRO 101 HB1 PRO 101 -8.954 3.924 -0.305 770 HG2 PRO 101 HG2 PRO 101 -7.920 2.906 2.220 771 HG3 PRO 101 HG1 PRO 101 -8.863 4.360 1.891 772 HD2 PRO 101 HD2 PRO 101 -9.781 1.861 2.955 773 HD3 PRO 101 HD1 PRO 101 -10.697 3.345 2.652 774 H LEU 102 HN LEU 102 -10.592 -0.468 -0.457 775 HA LEU 102 HA LEU 102 -7.868 -1.706 -0.391 776 HB2 LEU 102 HB2 LEU 102 -9.010 -3.534 1.002 777 HB3 LEU 102 HB1 LEU 102 -8.759 -1.989 1.815 778 HG LEU 102 HG LEU 102 -11.291 -2.133 0.325 779 HD11 LEU 102 HD11 LEU 102 -12.426 -3.684 1.732 780 HD12 LEU 102 HD12 LEU 102 -11.061 -3.789 2.842 781 HD13 LEU 102 HD13 LEU 102 -10.948 -4.505 1.234 782 HD21 LEU 102 HD21 LEU 102 -12.088 -0.912 2.170 783 HD22 LEU 102 HD22 LEU 102 -10.395 -0.424 2.081 784 HD23 LEU 102 HD23 LEU 102 -10.906 -1.623 3.270 785 H LEU 103 HN LEU 103 -7.756 -3.810 -1.499 786 HA LEU 103 HA LEU 103 -10.065 -4.948 -2.833 787 HB2 LEU 103 HB2 LEU 103 -9.028 -2.545 -3.885 788 HB3 LEU 103 HB1 LEU 103 -8.530 -3.820 -4.997 789 HG LEU 103 HG LEU 103 -11.355 -3.298 -4.031 790 HD11 LEU 103 HD11 LEU 103 -10.302 -1.748 -5.758 791 HD12 LEU 103 HD12 LEU 103 -11.784 -2.564 -6.259 792 HD13 LEU 103 HD13 LEU 103 -10.219 -3.151 -6.824 793 HD21 LEU 103 HD21 LEU 103 -10.464 -5.268 -6.147 794 HD22 LEU 103 HD22 LEU 103 -12.033 -5.162 -5.349 795 HD23 LEU 103 HD23 LEU 103 -10.626 -5.739 -4.455 796 H THR 104 HN THR 104 -8.753 -5.745 -5.263 797 HA THR 104 HA THR 104 -6.546 -7.441 -4.208 798 HB THR 104 HB THR 104 -8.733 -8.587 -4.636 799 HG1 THR 104 HG1 THR 104 -6.698 -9.252 -6.495 800 HG21 THR 104 HG21 THR 104 -9.476 -8.825 -6.971 801 HG22 THR 104 HG22 THR 104 -8.181 -7.750 -7.495 802 HG23 THR 104 HG23 THR 104 -9.484 -7.131 -6.479 803 H LYS 105 HN LYS 105 -6.645 -4.786 -5.843 804 HA LYS 105 HA LYS 105 -5.394 -3.902 -7.645 805 HB2 LYS 105 HB2 LYS 105 -3.471 -4.657 -6.624 806 HB3 LYS 105 HB1 LYS 105 -4.042 -6.315 -6.541 807 HG2 LYS 105 HG2 LYS 105 -3.417 -5.220 -9.244 808 HG3 LYS 105 HG1 LYS 105 -2.067 -5.581 -8.174 809 HD2 LYS 105 HD2 LYS 105 -2.692 -7.858 -7.941 810 HD3 LYS 105 HD1 LYS 105 -4.298 -7.567 -8.606 811 HE2 LYS 105 HE2 LYS 105 -3.502 -7.432 -10.814 812 HE3 LYS 105 HE1 LYS 105 -1.851 -7.039 -10.295 813 HZ1 LYS 105 HZ1 LYS 105 -3.250 -9.633 -10.210 814 HZ2 LYS 105 HZ2 LYS 105 -2.011 -9.307 -9.094 815 HZ3 LYS 105 HZ3 LYS 105 -1.684 -9.283 -10.760 816 HA PRO 106 HA PRO 106 -7.450 -7.186 -10.438 817 HB2 PRO 106 HB2 PRO 106 -9.951 -6.097 -10.696 818 HB3 PRO 106 HB1 PRO 106 -9.552 -7.304 -9.458 819 HG2 PRO 106 HG2 PRO 106 -9.797 -4.346 -9.206 820 HG3 PRO 106 HG1 PRO 106 -10.310 -5.621 -8.088 821 HD2 PRO 106 HD2 PRO 106 -8.043 -4.159 -7.743 822 HD3 PRO 106 HD1 PRO 106 -8.233 -5.816 -7.155 823 H PHE 107 HN PHE 107 -6.872 -3.876 -10.163 824 HA PHE 107 HA PHE 107 -6.401 -2.198 -11.732 825 HB2 PHE 107 HB2 PHE 107 -6.185 -4.774 -13.270 826 HB3 PHE 107 HB1 PHE 107 -5.978 -3.228 -14.102 827 HD1 PHE 107 HD2 PHE 107 -4.512 -1.462 -12.690 828 HD2 PHE 107 HD1 PHE 107 -4.245 -5.736 -12.358 829 HE1 PHE 107 HE2 PHE 107 -2.246 -1.241 -11.718 830 HE2 PHE 107 HE1 PHE 107 -1.977 -5.515 -11.379 831 HZ PHE 107 HZ PHE 107 -0.971 -3.264 -11.067 832 H LEU 108 HN LEU 108 -8.367 -1.187 -11.501 833 HA LEU 108 HA LEU 108 -9.977 -0.656 -13.729 834 HB2 LEU 108 HB2 LEU 108 -10.762 -2.887 -13.790 835 HB3 LEU 108 HB1 LEU 108 -10.786 -3.025 -12.036 836 HG LEU 108 HG LEU 108 -13.050 -2.824 -13.237 837 HD11 LEU 108 HD11 LEU 108 -13.621 -2.436 -11.107 838 HD12 LEU 108 HD12 LEU 108 -13.400 -0.713 -11.408 839 HD13 LEU 108 HD13 LEU 108 -12.064 -1.678 -10.778 840 HD21 LEU 108 HD21 LEU 108 -12.935 -1.104 -14.766 841 HD22 LEU 108 HD22 LEU 108 -11.835 -0.144 -13.783 842 HD23 LEU 108 HD23 LEU 108 -13.549 -0.201 -13.383 843 H ASP 109 HN ASP 109 -9.826 -1.170 -10.266 844 HA ASP 109 HA ASP 109 -10.730 1.579 -9.726 845 HB2 ASP 109 HB2 ASP 109 -12.814 0.286 -9.985 846 HB3 ASP 109 HB1 ASP 109 -12.261 -0.860 -8.767 847 H SER 110 HN SER 110 -8.565 -0.731 -9.137 848 HA SER 110 HA SER 110 -8.494 -1.005 -6.275 849 HB2 SER 110 HB2 SER 110 -7.567 -2.491 -8.059 850 HB3 SER 110 HB1 SER 110 -6.319 -1.294 -8.351 851 HG SER 110 HG SER 110 -5.321 -1.966 -6.626 852 H GLU 111 HN GLU 111 -5.389 -0.153 -7.308 853 HA GLU 111 HA GLU 111 -4.631 1.621 -5.429 854 HB2 GLU 111 HB2 GLU 111 -3.398 0.703 -7.473 855 HB3 GLU 111 HB1 GLU 111 -4.030 2.095 -8.355 856 HG2 GLU 111 HG2 GLU 111 -2.327 3.322 -7.544 857 HG3 GLU 111 HG1 GLU 111 -2.996 3.106 -5.926 858 H LEU 112 HN LEU 112 -6.286 2.685 -8.435 859 HA LEU 112 HA LEU 112 -6.331 5.439 -7.957 860 HB2 LEU 112 HB2 LEU 112 -8.476 5.332 -9.288 861 HB3 LEU 112 HB1 LEU 112 -7.138 4.436 -10.001 862 HG LEU 112 HG LEU 112 -8.202 2.491 -8.464 863 HD11 LEU 112 HD11 LEU 112 -10.728 3.639 -9.505 864 HD12 LEU 112 HD12 LEU 112 -10.058 4.449 -8.089 865 HD13 LEU 112 HD13 LEU 112 -10.431 2.726 -8.025 866 HD21 LEU 112 HD21 LEU 112 -7.775 2.733 -11.036 867 HD22 LEU 112 HD22 LEU 112 -9.499 3.102 -11.110 868 HD23 LEU 112 HD23 LEU 112 -8.954 1.549 -10.474 869 H GLU 113 HN GLU 113 -8.764 3.043 -6.812 870 HA GLU 113 HA GLU 113 -10.465 4.751 -5.372 871 HB2 GLU 113 HB2 GLU 113 -10.751 2.311 -5.733 872 HB3 GLU 113 HB1 GLU 113 -9.417 2.000 -4.616 873 HG2 GLU 113 HG2 GLU 113 -10.649 3.038 -2.793 874 HG3 GLU 113 HG1 GLU 113 -11.949 3.497 -3.891 875 H ALA 114 HN ALA 114 -7.724 2.939 -4.009 876 HA ALA 114 HA ALA 114 -7.525 4.005 -1.486 877 HB1 ALA 114 HB1 ALA 114 -5.920 2.637 -3.398 878 HB2 ALA 114 HB2 ALA 114 -5.668 2.717 -1.655 879 HB3 ALA 114 HB3 ALA 114 -4.915 3.913 -2.710 880 H VAL 115 HN VAL 115 -6.768 5.681 -4.498 881 HA VAL 115 HA VAL 115 -5.769 8.026 -2.927 882 HB VAL 115 HB VAL 115 -5.723 7.664 -5.928 883 HG11 VAL 115 HG11 VAL 115 -3.559 8.922 -4.293 884 HG12 VAL 115 HG12 VAL 115 -5.071 9.809 -4.480 885 HG13 VAL 115 HG13 VAL 115 -4.138 9.347 -5.903 886 HG21 VAL 115 HG21 VAL 115 -4.251 6.165 -3.857 887 HG22 VAL 115 HG22 VAL 115 -3.219 6.910 -5.078 888 HG23 VAL 115 HG23 VAL 115 -4.488 5.786 -5.562 889 H LEU 116 HN LEU 116 -8.482 6.844 -4.682 890 HA LEU 116 HA LEU 116 -9.550 9.535 -5.322 891 HB2 LEU 116 HB2 LEU 116 -9.845 6.798 -6.185 892 HB3 LEU 116 HB1 LEU 116 -11.427 7.444 -5.751 893 HG LEU 116 HG LEU 116 -10.304 9.539 -7.150 894 HD11 LEU 116 HD11 LEU 116 -8.607 8.748 -8.407 895 HD12 LEU 116 HD12 LEU 116 -9.783 7.738 -9.249 896 HD13 LEU 116 HD13 LEU 116 -8.904 7.099 -7.859 897 HD21 LEU 116 HD21 LEU 116 -12.606 8.562 -7.335 898 HD22 LEU 116 HD22 LEU 116 -11.934 7.257 -8.314 899 HD23 LEU 116 HD23 LEU 116 -11.882 8.919 -8.904 900 H VAL 117 HN VAL 117 -10.285 6.753 -3.224 901 HA VAL 117 HA VAL 117 -12.681 7.840 -2.049 902 HB VAL 117 HB VAL 117 -12.162 6.018 -0.356 903 HG11 VAL 117 HG11 VAL 117 -13.472 5.366 -2.228 904 HG12 VAL 117 HG12 VAL 117 -12.163 4.188 -2.158 905 HG13 VAL 117 HG13 VAL 117 -12.101 5.505 -3.330 906 HG21 VAL 117 HG21 VAL 117 -10.022 5.411 -0.139 907 HG22 VAL 117 HG22 VAL 117 -9.564 6.381 -1.538 908 HG23 VAL 117 HG23 VAL 117 -10.098 4.714 -1.757 909 H GLN 118 HN GLN 118 -9.444 8.798 -1.675 910 HA GLN 118 HA GLN 118 -9.838 9.633 1.158 911 HB2 GLN 118 HB2 GLN 118 -7.651 8.836 -0.584 912 HB3 GLN 118 HB1 GLN 118 -7.284 10.348 0.246 913 HG2 GLN 118 HG2 GLN 118 -7.152 9.342 2.279 914 HG3 GLN 118 HG1 GLN 118 -8.547 8.310 1.959 915 HE21 GLN 118 HE21 GLN 118 -5.584 8.521 -0.042 916 HE22 GLN 118 HE22 GLN 118 -5.111 6.911 0.210 917 H ILE 119 HN ILE 119 -8.660 11.073 -1.915 918 HA ILE 119 HA ILE 119 -8.566 13.362 -2.539 919 HB ILE 119 HB ILE 119 -11.201 13.569 -1.148 920 HG12 ILE 119 HG12 ILE 119 -11.777 12.469 -3.631 921 HG13 ILE 119 HG11 ILE 119 -10.413 11.505 -3.060 922 HG21 ILE 119 HG21 ILE 119 -10.237 14.407 -3.891 923 HG22 ILE 119 HG22 ILE 119 -10.338 15.464 -2.482 924 HG23 ILE 119 HG23 ILE 119 -11.808 14.789 -3.187 925 HD11 ILE 119 HD11 ILE 119 -11.557 10.761 -1.167 926 HD12 ILE 119 HD12 ILE 119 -12.847 10.815 -2.369 927 HD13 ILE 119 HD13 ILE 119 -12.683 12.118 -1.191 928 H SER 120 HN SER 120 -7.546 12.654 0.198 929 HA SER 120 HA SER 120 -6.530 13.974 1.907 930 HB2 SER 120 HB2 SER 120 -7.318 15.796 -0.032 931 HB3 SER 120 HB1 SER 120 -8.119 16.379 1.419 932 HG SER 120 HG SER 120 -5.541 16.548 0.737 933 H LYS 121 HN LYS 121 -9.970 14.754 1.345 934 HA LYS 121 HA LYS 121 -11.785 14.176 2.764 935 HB2 LYS 121 HB2 LYS 121 -10.071 12.694 3.997 936 HB3 LYS 121 HB1 LYS 121 -9.857 14.070 5.082 937 HG2 LYS 121 HG2 LYS 121 -11.763 13.578 6.171 938 HG3 LYS 121 HG1 LYS 121 -12.671 13.582 4.660 939 HD2 LYS 121 HD2 LYS 121 -11.972 11.262 4.219 940 HD3 LYS 121 HD1 LYS 121 -11.046 11.253 5.720 941 HE2 LYS 121 HE2 LYS 121 -13.030 11.430 7.056 942 HE3 LYS 121 HE1 LYS 121 -14.027 11.808 5.638 943 HZ1 LYS 121 HZ1 LYS 121 -13.396 9.648 4.698 944 HZ2 LYS 121 HZ2 LYS 121 -14.233 9.477 6.166 945 HZ3 LYS 121 HZ3 LYS 121 -12.547 9.276 6.120 946 H GLU 122 HN GLU 122 -10.338 16.751 2.197 947 HA GLU 122 HA GLU 122 -11.394 18.365 4.486 948 HB2 GLU 122 HB2 GLU 122 -9.913 20.146 3.317 949 HB3 GLU 122 HB1 GLU 122 -9.082 18.832 4.148 950 HG2 GLU 122 HG2 GLU 122 -8.276 17.960 2.217 951 HG3 GLU 122 HG1 GLU 122 -9.781 18.244 1.343 952 H VAL 123 HN VAL 123 -12.494 17.131 1.792 953 HA VAL 123 HA VAL 123 -13.813 17.849 -0.026 954 HB VAL 123 HB VAL 123 -15.923 18.721 0.979 955 HG11 VAL 123 HG11 VAL 123 -14.362 16.479 2.222 956 HG12 VAL 123 HG12 VAL 123 -15.807 16.406 1.213 957 HG13 VAL 123 HG13 VAL 123 -15.933 16.906 2.900 958 HG21 VAL 123 HG21 VAL 123 -16.025 19.525 3.175 959 HG22 VAL 123 HG22 VAL 123 -14.484 20.182 2.623 960 HG23 VAL 123 HG23 VAL 123 -14.515 18.740 3.637 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 10.300 9.973 8.015 2 H2 GLY 1 HT2 GLY 1 9.396 10.518 6.680 3 H3 GLY 1 HT3 GLY 1 9.188 11.237 8.205 4 HA2 GLY 1 HA2 GLY 1 11.727 11.306 6.678 5 HA3 GLY 1 HA1 GLY 1 10.525 12.597 6.646 6 H SER 2 HN SER 2 10.871 14.198 8.097 7 HA SER 2 HA SER 2 12.808 13.786 10.292 8 HB2 SER 2 HB2 SER 2 11.831 15.914 8.620 9 HB3 SER 2 HB1 SER 2 11.614 16.374 10.306 10 HG SER 2 HG SER 2 14.020 15.171 9.523 11 H HIS 3 HN HIS 3 9.364 14.656 9.902 12 HA HIS 3 HA HIS 3 9.009 14.436 12.859 13 HB2 HIS 3 HB2 HIS 3 7.452 15.650 10.569 14 HB3 HIS 3 HB1 HIS 3 6.749 15.473 12.177 15 HD1 HIS 3 HD1 HIS 3 6.832 18.250 11.893 16 HD2 HIS 3 HD2 HIS 3 10.435 16.269 12.575 17 HE1 HIS 3 HE1 HIS 3 8.470 20.003 12.708 18 H MET 4 HN MET 4 6.282 13.787 12.877 19 HA MET 4 HA MET 4 6.394 10.898 12.354 20 HB2 MET 4 HB2 MET 4 5.387 12.284 14.345 21 HB3 MET 4 HB1 MET 4 3.989 12.450 13.283 22 HG2 MET 4 HG2 MET 4 4.965 9.710 13.328 23 HG3 MET 4 HG1 MET 4 4.553 10.274 14.947 24 HE1 MET 4 HE1 MET 4 1.421 9.265 15.326 25 HE2 MET 4 HE2 MET 4 1.466 11.022 15.453 26 HE3 MET 4 HE3 MET 4 2.890 10.079 15.887 27 H THR 5 HN THR 5 5.495 9.903 10.586 28 HA THR 5 HA THR 5 3.610 11.497 8.874 29 HB THR 5 HB THR 5 4.789 10.699 6.960 30 HG1 THR 5 HG1 THR 5 5.899 8.897 6.974 31 HG21 THR 5 HG21 THR 5 6.047 12.456 8.024 32 HG22 THR 5 HG22 THR 5 7.205 11.235 7.499 33 HG23 THR 5 HG23 THR 5 6.734 11.330 9.194 34 H GLU 6 HN GLU 6 2.112 10.075 7.591 35 HA GLU 6 HA GLU 6 1.891 7.284 8.589 36 HB2 GLU 6 HB2 GLU 6 -0.286 7.633 9.508 37 HB3 GLU 6 HB1 GLU 6 0.712 8.956 10.110 38 HG2 GLU 6 HG2 GLU 6 -0.152 10.141 7.887 39 HG3 GLU 6 HG1 GLU 6 -1.487 9.008 8.094 40 H ARG 7 HN ARG 7 1.625 9.421 5.973 41 HA ARG 7 HA ARG 7 0.758 7.403 4.147 42 HB2 ARG 7 HB2 ARG 7 -1.570 8.402 3.754 43 HB3 ARG 7 HB1 ARG 7 -1.367 7.482 5.243 44 HG2 ARG 7 HG2 ARG 7 -2.102 9.297 6.357 45 HG3 ARG 7 HG1 ARG 7 -0.599 10.100 5.902 46 HD2 ARG 7 HD2 ARG 7 -1.597 11.104 3.978 47 HD3 ARG 7 HD1 ARG 7 -3.017 10.043 4.074 48 HE ARG 7 HE ARG 7 -2.712 11.469 6.548 49 HH11 ARG 7 HH11 ARG 7 -3.612 11.859 3.234 50 HH12 ARG 7 HH12 ARG 7 -4.705 13.164 3.552 51 HH21 ARG 7 HH21 ARG 7 -4.130 13.168 6.973 52 HH22 ARG 7 HH22 ARG 7 -4.995 13.908 5.666 53 H ARG 8 HN ARG 8 0.941 10.849 4.892 54 HA ARG 8 HA ARG 8 0.769 11.716 2.113 55 HB2 ARG 8 HB2 ARG 8 0.079 13.330 3.636 56 HB3 ARG 8 HB1 ARG 8 1.305 12.880 4.819 57 HG2 ARG 8 HG2 ARG 8 3.053 13.893 3.381 58 HG3 ARG 8 HG1 ARG 8 1.813 14.370 2.221 59 HD2 ARG 8 HD2 ARG 8 1.253 15.214 4.998 60 HD3 ARG 8 HD1 ARG 8 2.678 15.976 4.264 61 HE ARG 8 HE ARG 8 1.269 16.906 2.556 62 HH11 ARG 8 HH11 ARG 8 -0.454 16.412 5.274 63 HH12 ARG 8 HH12 ARG 8 -1.996 16.164 4.524 64 HH21 ARG 8 HH21 ARG 8 -0.687 15.884 1.325 65 HH22 ARG 8 HH22 ARG 8 -2.127 15.864 2.287 66 H LEU 9 HN LEU 9 3.258 10.155 3.794 67 HA LEU 9 HA LEU 9 5.408 11.708 2.532 68 HB2 LEU 9 HB2 LEU 9 5.086 9.734 4.681 69 HB3 LEU 9 HB1 LEU 9 6.589 9.589 3.767 70 HG LEU 9 HG LEU 9 6.839 11.142 5.689 71 HD11 LEU 9 HD11 LEU 9 7.687 11.495 3.097 72 HD12 LEU 9 HD12 LEU 9 8.235 12.457 4.469 73 HD13 LEU 9 HD13 LEU 9 6.924 13.046 3.445 74 HD21 LEU 9 HD21 LEU 9 5.298 12.732 6.152 75 HD22 LEU 9 HD22 LEU 9 4.273 11.958 4.943 76 HD23 LEU 9 HD23 LEU 9 5.305 13.315 4.487 77 H ARG 10 HN ARG 10 4.517 8.193 2.546 78 HA ARG 10 HA ARG 10 5.329 8.124 -0.297 79 HB2 ARG 10 HB2 ARG 10 7.061 7.597 1.859 80 HB3 ARG 10 HB1 ARG 10 6.706 6.025 1.148 81 HG2 ARG 10 HG2 ARG 10 7.920 8.462 -0.175 82 HG3 ARG 10 HG1 ARG 10 8.591 6.841 -0.052 83 HD2 ARG 10 HD2 ARG 10 7.237 6.007 -1.774 84 HD3 ARG 10 HD1 ARG 10 6.010 7.259 -1.564 85 HE ARG 10 HE ARG 10 8.342 8.623 -2.242 86 HH11 ARG 10 HH11 ARG 10 5.646 7.159 -3.593 87 HH12 ARG 10 HH12 ARG 10 6.228 7.185 -5.224 88 HH21 ARG 10 HH21 ARG 10 9.419 8.237 -4.342 89 HH22 ARG 10 HH22 ARG 10 8.372 7.793 -5.649 90 H VAL 11 HN VAL 11 5.269 5.732 -1.100 91 HA VAL 11 HA VAL 11 3.142 4.159 0.244 92 HB VAL 11 HB VAL 11 1.837 4.103 -1.775 93 HG11 VAL 11 HG11 VAL 11 1.747 6.204 -0.387 94 HG12 VAL 11 HG12 VAL 11 1.303 6.448 -2.075 95 HG13 VAL 11 HG13 VAL 11 2.902 6.929 -1.505 96 HG21 VAL 11 HG21 VAL 11 3.310 3.887 -3.567 97 HG22 VAL 11 HG22 VAL 11 4.365 5.177 -2.988 98 HG23 VAL 11 HG23 VAL 11 2.822 5.573 -3.746 99 H LEU 12 HN LEU 12 4.599 2.477 0.737 100 HA LEU 12 HA LEU 12 6.392 1.423 -1.329 101 HB2 LEU 12 HB2 LEU 12 5.692 0.447 1.457 102 HB3 LEU 12 HB1 LEU 12 7.114 -0.015 0.513 103 HG LEU 12 HG LEU 12 6.442 2.779 1.485 104 HD11 LEU 12 HD11 LEU 12 8.904 1.161 2.118 105 HD12 LEU 12 HD12 LEU 12 7.441 1.005 3.088 106 HD13 LEU 12 HD13 LEU 12 8.259 2.562 2.972 107 HD21 LEU 12 HD21 LEU 12 7.468 2.869 -0.726 108 HD22 LEU 12 HD22 LEU 12 8.724 1.738 -0.222 109 HD23 LEU 12 HD23 LEU 12 8.660 3.354 0.480 110 H VAL 13 HN VAL 13 5.036 0.614 -2.956 111 HA VAL 13 HA VAL 13 3.026 -1.467 -2.235 112 HB VAL 13 HB VAL 13 3.537 -0.366 -4.996 113 HG11 VAL 13 HG11 VAL 13 1.758 -2.175 -4.101 114 HG12 VAL 13 HG12 VAL 13 1.392 -1.072 -5.427 115 HG13 VAL 13 HG13 VAL 13 0.833 -0.705 -3.795 116 HG21 VAL 13 HG21 VAL 13 3.481 1.676 -3.788 117 HG22 VAL 13 HG22 VAL 13 2.260 1.074 -2.665 118 HG23 VAL 13 HG23 VAL 13 1.818 1.445 -4.333 119 H VAL 14 HN VAL 14 3.469 -3.620 -2.737 120 HA VAL 14 HA VAL 14 5.695 -4.152 -4.646 121 HB VAL 14 HB VAL 14 6.612 -5.719 -2.866 122 HG11 VAL 14 HG11 VAL 14 7.739 -3.633 -3.260 123 HG12 VAL 14 HG12 VAL 14 7.590 -3.826 -1.513 124 HG13 VAL 14 HG13 VAL 14 6.503 -2.741 -2.375 125 HG21 VAL 14 HG21 VAL 14 5.539 -4.317 -0.626 126 HG22 VAL 14 HG22 VAL 14 5.406 -6.035 -0.998 127 HG23 VAL 14 HG23 VAL 14 4.191 -4.907 -1.597 128 H GLU 15 HN GLU 15 5.246 -5.840 -5.933 129 HA GLU 15 HA GLU 15 3.720 -8.166 -5.053 130 HB2 GLU 15 HB2 GLU 15 1.709 -7.279 -5.617 131 HB3 GLU 15 HB1 GLU 15 2.471 -5.872 -6.355 132 HG2 GLU 15 HG2 GLU 15 1.126 -7.173 -7.988 133 HG3 GLU 15 HG1 GLU 15 2.832 -7.127 -8.419 134 H ASP 16 HN ASP 16 4.271 -9.905 -6.311 135 HA ASP 16 HA ASP 16 6.590 -10.113 -7.775 136 HB2 ASP 16 HB2 ASP 16 5.658 -12.263 -8.512 137 HB3 ASP 16 HB1 ASP 16 5.248 -11.935 -6.828 138 H GLU 17 HN GLU 17 6.203 -7.992 -9.191 139 HA GLU 17 HA GLU 17 6.262 -8.752 -11.902 140 HB2 GLU 17 HB2 GLU 17 3.953 -7.830 -12.590 141 HB3 GLU 17 HB1 GLU 17 3.984 -9.415 -11.821 142 HG2 GLU 17 HG2 GLU 17 3.590 -8.223 -9.618 143 HG3 GLU 17 HG1 GLU 17 3.271 -6.764 -10.556 144 H SER 18 HN SER 18 6.342 -6.924 -13.386 145 HA SER 18 HA SER 18 7.352 -4.488 -12.100 146 HB2 SER 18 HB2 SER 18 6.878 -5.106 -15.029 147 HB3 SER 18 HB1 SER 18 8.024 -3.950 -14.355 148 HG SER 18 HG SER 18 8.174 -6.697 -14.600 149 H MET 19 HN MET 19 4.307 -5.589 -13.212 150 HA MET 19 HA MET 19 3.111 -3.274 -14.320 151 HB2 MET 19 HB2 MET 19 2.379 -5.829 -13.624 152 HB3 MET 19 HB1 MET 19 1.482 -4.875 -12.441 153 HG2 MET 19 HG2 MET 19 -0.016 -4.311 -14.021 154 HG3 MET 19 HG1 MET 19 1.269 -3.574 -14.979 155 HE1 MET 19 HE1 MET 19 0.309 -4.018 -17.176 156 HE2 MET 19 HE2 MET 19 -1.150 -4.726 -16.487 157 HE3 MET 19 HE3 MET 19 -0.300 -5.562 -17.783 158 H ILE 20 HN ILE 20 4.218 -3.911 -11.119 159 HA ILE 20 HA ILE 20 2.629 -1.650 -9.988 160 HB ILE 20 HB ILE 20 2.575 -3.788 -8.823 161 HG12 ILE 20 HG12 ILE 20 4.466 -1.934 -7.344 162 HG13 ILE 20 HG11 ILE 20 2.730 -1.643 -7.493 163 HG21 ILE 20 HG21 ILE 20 4.481 -4.941 -9.515 164 HG22 ILE 20 HG22 ILE 20 4.859 -4.557 -7.838 165 HG23 ILE 20 HG23 ILE 20 5.554 -3.592 -9.142 166 HD11 ILE 20 HD11 ILE 20 4.036 -4.056 -6.201 167 HD12 ILE 20 HD12 ILE 20 2.299 -3.854 -6.428 168 HD13 ILE 20 HD13 ILE 20 3.184 -2.757 -5.368 169 H ALA 21 HN ALA 21 5.696 -2.402 -11.263 170 HA ALA 21 HA ALA 21 7.271 -0.566 -9.611 171 HB1 ALA 21 HB1 ALA 21 7.589 -2.536 -11.756 172 HB2 ALA 21 HB2 ALA 21 8.686 -2.134 -10.434 173 HB3 ALA 21 HB3 ALA 21 8.681 -1.159 -11.905 174 H MET 22 HN MET 22 7.189 -0.523 -13.158 175 HA MET 22 HA MET 22 7.591 2.258 -13.391 176 HB2 MET 22 HB2 MET 22 7.875 0.805 -15.285 177 HB3 MET 22 HB1 MET 22 6.226 0.195 -15.147 178 HG2 MET 22 HG2 MET 22 5.463 2.608 -15.568 179 HG3 MET 22 HG1 MET 22 7.126 2.935 -16.056 180 HE1 MET 22 HE1 MET 22 3.788 0.847 -18.202 181 HE2 MET 22 HE2 MET 22 3.826 1.697 -16.658 182 HE3 MET 22 HE3 MET 22 4.332 0.012 -16.741 183 H LEU 23 HN LEU 23 4.757 0.468 -12.566 184 HA LEU 23 HA LEU 23 2.779 2.495 -13.186 185 HB2 LEU 23 HB2 LEU 23 2.232 0.134 -12.971 186 HB3 LEU 23 HB1 LEU 23 2.927 0.073 -11.355 187 HG LEU 23 HG LEU 23 0.356 0.209 -11.561 188 HD11 LEU 23 HD11 LEU 23 0.828 2.386 -9.786 189 HD12 LEU 23 HD12 LEU 23 2.231 1.316 -9.703 190 HD13 LEU 23 HD13 LEU 23 0.616 0.681 -9.386 191 HD21 LEU 23 HD21 LEU 23 0.536 3.144 -11.585 192 HD22 LEU 23 HD22 LEU 23 -0.620 2.082 -12.388 193 HD23 LEU 23 HD23 LEU 23 0.945 2.402 -13.131 194 H ILE 24 HN ILE 24 5.299 2.384 -10.966 195 HA ILE 24 HA ILE 24 3.873 3.993 -8.901 196 HB ILE 24 HB ILE 24 5.427 1.784 -8.725 197 HG12 ILE 24 HG12 ILE 24 6.039 3.307 -6.397 198 HG13 ILE 24 HG11 ILE 24 4.447 3.822 -6.954 199 HG21 ILE 24 HG21 ILE 24 7.643 2.533 -7.782 200 HG22 ILE 24 HG22 ILE 24 7.316 4.131 -8.448 201 HG23 ILE 24 HG23 ILE 24 7.474 2.742 -9.522 202 HD11 ILE 24 HD11 ILE 24 3.702 1.982 -5.838 203 HD12 ILE 24 HD12 ILE 24 5.297 1.229 -5.831 204 HD13 ILE 24 HD13 ILE 24 4.270 1.103 -7.258 205 H GLU 25 HN GLU 25 6.951 3.996 -10.764 206 HA GLU 25 HA GLU 25 7.945 6.493 -9.936 207 HB2 GLU 25 HB2 GLU 25 8.133 4.750 -12.351 208 HB3 GLU 25 HB1 GLU 25 8.759 6.393 -12.499 209 HG2 GLU 25 HG2 GLU 25 9.559 5.133 -9.988 210 HG3 GLU 25 HG1 GLU 25 10.119 4.230 -11.398 211 H ASP 26 HN ASP 26 5.281 5.763 -12.089 212 HA ASP 26 HA ASP 26 5.113 8.442 -13.243 213 HB2 ASP 26 HB2 ASP 26 3.223 7.513 -14.367 214 HB3 ASP 26 HB1 ASP 26 4.326 6.152 -14.160 215 H THR 27 HN THR 27 3.451 6.664 -10.627 216 HA THR 27 HA THR 27 1.540 8.682 -9.971 217 HB THR 27 HB THR 27 2.030 7.410 -7.612 218 HG1 THR 27 HG1 THR 27 3.353 5.834 -7.907 219 HG21 THR 27 HG21 THR 27 0.632 5.480 -8.929 220 HG22 THR 27 HG22 THR 27 0.424 6.845 -10.026 221 HG23 THR 27 HG23 THR 27 -0.081 6.982 -8.342 222 H LEU 28 HN LEU 28 4.751 7.976 -8.530 223 HA LEU 28 HA LEU 28 4.897 10.121 -6.703 224 HB2 LEU 28 HB2 LEU 28 6.924 9.135 -6.430 225 HB3 LEU 28 HB1 LEU 28 6.543 8.096 -7.799 226 HG LEU 28 HG LEU 28 7.439 9.951 -9.301 227 HD11 LEU 28 HD11 LEU 28 9.227 11.185 -7.544 228 HD12 LEU 28 HD12 LEU 28 7.689 11.203 -6.682 229 HD13 LEU 28 HD13 LEU 28 7.810 11.931 -8.284 230 HD21 LEU 28 HD21 LEU 28 9.295 8.642 -7.292 231 HD22 LEU 28 HD22 LEU 28 9.817 9.368 -8.812 232 HD23 LEU 28 HD23 LEU 28 8.761 7.956 -8.825 233 H CYS 29 HN CYS 29 5.438 10.048 -10.211 234 HA CYS 29 HA CYS 29 6.636 12.533 -10.679 235 HB2 CYS 29 HB2 CYS 29 5.930 10.651 -12.274 236 HB3 CYS 29 HB1 CYS 29 4.333 11.398 -12.280 237 HG CYS 29 HG CYS 29 6.410 12.301 -14.074 238 H GLU 30 HN GLU 30 3.286 11.812 -9.822 239 HA GLU 30 HA GLU 30 2.460 14.614 -10.175 240 HB2 GLU 30 HB2 GLU 30 0.937 12.932 -10.932 241 HB3 GLU 30 HB1 GLU 30 1.114 12.014 -9.436 242 HG2 GLU 30 HG2 GLU 30 -0.035 13.716 -8.170 243 HG3 GLU 30 HG1 GLU 30 -0.052 14.808 -9.557 244 H LEU 31 HN LEU 31 2.889 12.243 -7.550 245 HA LEU 31 HA LEU 31 2.040 14.177 -5.498 246 HB2 LEU 31 HB2 LEU 31 3.099 11.342 -5.541 247 HB3 LEU 31 HB1 LEU 31 2.781 12.198 -4.030 248 HG LEU 31 HG LEU 31 0.438 12.659 -4.955 249 HD11 LEU 31 HD11 LEU 31 0.305 12.159 -7.175 250 HD12 LEU 31 HD12 LEU 31 -0.007 10.525 -6.588 251 HD13 LEU 31 HD13 LEU 31 1.617 10.986 -7.089 252 HD21 LEU 31 HD21 LEU 31 -0.131 10.075 -4.606 253 HD22 LEU 31 HD22 LEU 31 0.399 11.086 -3.262 254 HD23 LEU 31 HD23 LEU 31 1.550 10.028 -4.077 255 H GLY 32 HN GLY 32 5.071 12.734 -6.665 256 HA2 GLY 32 HA2 GLY 32 7.285 13.489 -6.377 257 HA3 GLY 32 HA1 GLY 32 6.627 14.957 -5.639 258 H HIS 33 HN HIS 33 5.774 11.757 -4.500 259 HA HIS 33 HA HIS 33 6.296 12.290 -1.777 260 HB2 HIS 33 HB2 HIS 33 5.900 9.901 -3.528 261 HB3 HIS 33 HB1 HIS 33 6.472 9.614 -1.879 262 HD1 HIS 33 HD1 HIS 33 3.495 9.127 -3.198 263 HD2 HIS 33 HD2 HIS 33 4.642 12.032 -0.439 264 HE1 HIS 33 HE1 HIS 33 1.386 9.844 -1.998 265 H GLU 34 HN GLU 34 7.941 10.119 -0.927 266 HA GLU 34 HA GLU 34 10.612 11.292 -1.462 267 HB2 GLU 34 HB2 GLU 34 9.204 9.791 0.616 268 HB3 GLU 34 HB1 GLU 34 10.840 9.187 0.340 269 HG2 GLU 34 HG2 GLU 34 11.797 11.351 0.733 270 HG3 GLU 34 HG1 GLU 34 10.211 12.123 0.708 271 H VAL 35 HN VAL 35 9.862 7.877 -0.873 272 HA VAL 35 HA VAL 35 10.827 7.099 -3.565 273 HB VAL 35 HB VAL 35 12.507 5.561 -2.349 274 HG11 VAL 35 HG11 VAL 35 12.955 8.554 -2.130 275 HG12 VAL 35 HG12 VAL 35 13.085 7.640 -3.634 276 HG13 VAL 35 HG13 VAL 35 14.194 7.309 -2.302 277 HG21 VAL 35 HG21 VAL 35 11.526 5.859 -0.091 278 HG22 VAL 35 HG22 VAL 35 11.944 7.572 -0.143 279 HG23 VAL 35 HG23 VAL 35 13.219 6.354 -0.124 280 H ALA 36 HN ALA 36 9.010 5.878 -4.041 281 HA ALA 36 HA ALA 36 7.668 4.251 -2.040 282 HB1 ALA 36 HB1 ALA 36 6.137 4.968 -3.567 283 HB2 ALA 36 HB2 ALA 36 6.646 3.545 -4.474 284 HB3 ALA 36 HB3 ALA 36 7.345 5.120 -4.841 285 H ALA 37 HN ALA 37 7.076 1.913 -2.922 286 HA ALA 37 HA ALA 37 9.631 0.561 -3.738 287 HB1 ALA 37 HB1 ALA 37 7.772 0.205 -1.463 288 HB2 ALA 37 HB2 ALA 37 9.480 -0.210 -1.590 289 HB3 ALA 37 HB3 ALA 37 8.257 -1.291 -2.258 290 H THR 38 HN THR 38 9.277 -1.420 -4.984 291 HA THR 38 HA THR 38 6.530 -1.795 -6.061 292 HB THR 38 HB THR 38 7.505 -1.750 -8.331 293 HG1 THR 38 HG1 THR 38 9.734 -2.073 -7.094 294 HG21 THR 38 HG21 THR 38 8.005 0.710 -8.373 295 HG22 THR 38 HG22 THR 38 8.048 0.686 -6.610 296 HG23 THR 38 HG23 THR 38 6.549 0.313 -7.460 297 H ALA 39 HN ALA 39 6.515 -3.783 -7.511 298 HA ALA 39 HA ALA 39 6.791 -6.116 -7.689 299 HB1 ALA 39 HB1 ALA 39 9.044 -5.108 -8.429 300 HB2 ALA 39 HB2 ALA 39 9.049 -6.801 -7.937 301 HB3 ALA 39 HB3 ALA 39 9.626 -5.559 -6.826 302 H SER 40 HN SER 40 7.244 -8.061 -6.290 303 HA SER 40 HA SER 40 6.703 -7.387 -3.479 304 HB2 SER 40 HB2 SER 40 6.253 -9.762 -3.320 305 HB3 SER 40 HB1 SER 40 5.502 -9.138 -4.780 306 HG SER 40 HG SER 40 6.736 -10.423 -5.884 307 H ARG 41 HN ARG 41 8.505 -6.808 -2.332 308 HA ARG 41 HA ARG 41 10.905 -8.554 -2.554 309 HB2 ARG 41 HB2 ARG 41 10.746 -6.035 -3.445 310 HB3 ARG 41 HB1 ARG 41 11.096 -5.685 -1.750 311 HG2 ARG 41 HG2 ARG 41 13.267 -6.042 -2.229 312 HG3 ARG 41 HG1 ARG 41 12.860 -7.748 -2.431 313 HD2 ARG 41 HD2 ARG 41 12.340 -7.355 -4.815 314 HD3 ARG 41 HD1 ARG 41 12.757 -5.640 -4.620 315 HE ARG 41 HE ARG 41 14.942 -7.080 -3.597 316 HH11 ARG 41 HH11 ARG 41 14.592 -5.217 -6.131 317 HH12 ARG 41 HH12 ARG 41 15.370 -6.215 -7.313 318 HH21 ARG 41 HH21 ARG 41 15.377 -9.044 -5.308 319 HH22 ARG 41 HH22 ARG 41 15.812 -8.381 -6.848 320 H MET 42 HN MET 42 11.153 -9.642 -0.627 321 HA MET 42 HA MET 42 9.767 -9.092 1.777 322 HB2 MET 42 HB2 MET 42 12.370 -10.504 1.149 323 HB3 MET 42 HB1 MET 42 11.597 -10.576 2.734 324 HG2 MET 42 HG2 MET 42 9.809 -11.826 1.960 325 HG3 MET 42 HG1 MET 42 9.944 -11.196 0.318 326 HE1 MET 42 HE1 MET 42 10.123 -14.922 0.236 327 HE2 MET 42 HE2 MET 42 10.343 -13.923 -1.200 328 HE3 MET 42 HE3 MET 42 9.209 -13.417 0.052 329 H GLN 43 HN GLN 43 12.677 -7.670 0.469 330 HA GLN 43 HA GLN 43 13.604 -6.534 3.005 331 HB2 GLN 43 HB2 GLN 43 14.726 -7.168 0.605 332 HB3 GLN 43 HB1 GLN 43 14.487 -5.434 0.392 333 HG2 GLN 43 HG2 GLN 43 16.568 -5.444 1.414 334 HG3 GLN 43 HG1 GLN 43 15.522 -5.325 2.830 335 HE21 GLN 43 HE21 GLN 43 17.680 -7.475 1.046 336 HE22 GLN 43 HE22 GLN 43 17.697 -8.716 2.206 337 H GLU 44 HN GLU 44 12.789 -4.813 -0.037 338 HA GLU 44 HA GLU 44 12.233 -2.308 1.097 339 HB2 GLU 44 HB2 GLU 44 11.116 -3.803 -1.288 340 HB3 GLU 44 HB1 GLU 44 10.702 -2.118 -0.968 341 HG2 GLU 44 HG2 GLU 44 13.259 -1.725 -0.826 342 HG3 GLU 44 HG1 GLU 44 13.400 -3.297 -1.616 343 H ALA 45 HN ALA 45 10.103 -5.123 0.725 344 HA ALA 45 HA ALA 45 7.660 -3.928 1.580 345 HB1 ALA 45 HB1 ALA 45 8.825 -6.717 1.852 346 HB2 ALA 45 HB2 ALA 45 7.753 -6.138 0.576 347 HB3 ALA 45 HB3 ALA 45 7.145 -6.332 2.221 348 H LEU 46 HN LEU 46 10.347 -5.404 3.335 349 HA LEU 46 HA LEU 46 9.311 -5.347 5.969 350 HB2 LEU 46 HB2 LEU 46 11.515 -6.225 4.754 351 HB3 LEU 46 HB1 LEU 46 12.167 -4.703 5.357 352 HG LEU 46 HG LEU 46 12.547 -6.440 7.017 353 HD11 LEU 46 HD11 LEU 46 11.840 -4.112 7.714 354 HD12 LEU 46 HD12 LEU 46 11.548 -5.371 8.915 355 HD13 LEU 46 HD13 LEU 46 10.216 -4.760 7.935 356 HD21 LEU 46 HD21 LEU 46 10.440 -7.720 6.082 357 HD22 LEU 46 HD22 LEU 46 9.591 -6.829 7.345 358 HD23 LEU 46 HD23 LEU 46 10.911 -7.921 7.769 359 H ASP 47 HN ASP 47 10.920 -2.834 4.039 360 HA ASP 47 HA ASP 47 11.225 -0.890 6.116 361 HB2 ASP 47 HB2 ASP 47 11.723 -1.212 3.355 362 HB3 ASP 47 HB1 ASP 47 10.725 0.235 3.497 363 H ILE 48 HN ILE 48 8.496 -1.904 4.199 364 HA ILE 48 HA ILE 48 6.903 0.483 4.772 365 HB ILE 48 HB ILE 48 5.458 -0.387 3.207 366 HG12 ILE 48 HG12 ILE 48 5.970 -3.037 4.555 367 HG13 ILE 48 HG11 ILE 48 4.452 -2.160 4.391 368 HG21 ILE 48 HG21 ILE 48 7.873 -0.646 2.366 369 HG22 ILE 48 HG22 ILE 48 6.605 -1.494 1.483 370 HG23 ILE 48 HG23 ILE 48 7.635 -2.373 2.612 371 HD11 ILE 48 HD11 ILE 48 5.956 -3.652 2.218 372 HD12 ILE 48 HD12 ILE 48 4.618 -2.555 1.879 373 HD13 ILE 48 HD13 ILE 48 4.347 -4.004 2.846 374 H ALA 49 HN ALA 49 7.359 -2.718 6.112 375 HA ALA 49 HA ALA 49 5.014 -2.481 7.864 376 HB1 ALA 49 HB1 ALA 49 5.863 -4.792 8.535 377 HB2 ALA 49 HB2 ALA 49 7.168 -4.558 7.369 378 HB3 ALA 49 HB3 ALA 49 5.492 -4.605 6.819 379 H ARG 50 HN ARG 50 8.380 -3.473 8.579 380 HA ARG 50 HA ARG 50 8.325 -2.928 11.333 381 HB2 ARG 50 HB2 ARG 50 10.328 -3.300 9.195 382 HB3 ARG 50 HB1 ARG 50 10.931 -2.499 10.649 383 HG2 ARG 50 HG2 ARG 50 11.210 -4.895 10.936 384 HG3 ARG 50 HG1 ARG 50 9.925 -4.352 12.015 385 HD2 ARG 50 HD2 ARG 50 8.267 -5.014 10.189 386 HD3 ARG 50 HD1 ARG 50 9.625 -5.810 9.373 387 HE ARG 50 HE ARG 50 9.662 -7.438 11.100 388 HH11 ARG 50 HH11 ARG 50 6.723 -6.130 11.253 389 HH12 ARG 50 HH12 ARG 50 6.506 -6.216 12.970 390 HH21 ARG 50 HH21 ARG 50 9.834 -6.935 13.622 391 HH22 ARG 50 HH22 ARG 50 8.266 -6.673 14.310 392 H LYS 51 HN LYS 51 8.838 -0.660 8.662 393 HA LYS 51 HA LYS 51 10.047 1.479 10.046 394 HB2 LYS 51 HB2 LYS 51 9.734 1.535 7.665 395 HB3 LYS 51 HB1 LYS 51 7.985 1.369 7.830 396 HG2 LYS 51 HG2 LYS 51 8.317 3.683 7.426 397 HG3 LYS 51 HG1 LYS 51 8.091 3.574 9.169 398 HD2 LYS 51 HD2 LYS 51 10.021 4.797 9.218 399 HD3 LYS 51 HD1 LYS 51 10.776 3.215 9.016 400 HE2 LYS 51 HE2 LYS 51 10.928 3.521 6.612 401 HE3 LYS 51 HE1 LYS 51 9.996 5.028 6.706 402 HZ1 LYS 51 HZ1 LYS 51 12.417 4.669 8.351 403 HZ2 LYS 51 HZ2 LYS 51 11.678 6.109 7.836 404 HZ3 LYS 51 HZ3 LYS 51 12.559 5.164 6.734 405 H GLY 52 HN GLY 52 6.570 0.715 9.719 406 HA2 GLY 52 HA2 GLY 52 4.845 1.147 11.282 407 HA3 GLY 52 HA1 GLY 52 6.038 1.894 12.343 408 H GLN 53 HN GLN 53 7.078 3.895 10.729 409 HA GLN 53 HA GLN 53 4.722 5.698 10.531 410 HB2 GLN 53 HB2 GLN 53 7.625 6.484 10.318 411 HB3 GLN 53 HB1 GLN 53 6.270 7.427 10.937 412 HG2 GLN 53 HG2 GLN 53 7.337 4.923 12.268 413 HG3 GLN 53 HG1 GLN 53 7.792 6.560 12.736 414 HE21 GLN 53 HE21 GLN 53 6.061 4.333 14.094 415 HE22 GLN 53 HE22 GLN 53 4.663 5.171 14.567 416 H PHE 54 HN PHE 54 6.425 3.769 8.396 417 HA PHE 54 HA PHE 54 7.251 5.255 6.245 418 HB2 PHE 54 HB2 PHE 54 6.534 3.405 4.805 419 HB3 PHE 54 HB1 PHE 54 7.253 2.810 6.284 420 HD1 PHE 54 HD1 PHE 54 5.380 2.395 8.268 421 HD2 PHE 54 HD2 PHE 54 4.654 2.345 4.029 422 HE1 PHE 54 HE1 PHE 54 3.382 0.997 8.616 423 HE2 PHE 54 HE2 PHE 54 2.655 0.954 4.400 424 HZ PHE 54 HZ PHE 54 2.014 0.268 6.684 425 H ASP 55 HN ASP 55 3.902 4.145 5.782 426 HA ASP 55 HA ASP 55 2.472 6.502 5.819 427 HB2 ASP 55 HB2 ASP 55 2.801 6.926 3.190 428 HB3 ASP 55 HB1 ASP 55 3.862 7.684 4.375 429 H ILE 56 HN ILE 56 3.226 4.251 3.147 430 HA ILE 56 HA ILE 56 0.600 2.903 3.587 431 HB ILE 56 HB ILE 56 1.497 4.222 1.005 432 HG12 ILE 56 HG12 ILE 56 -0.644 4.885 3.041 433 HG13 ILE 56 HG11 ILE 56 0.720 5.892 2.552 434 HG21 ILE 56 HG21 ILE 56 0.132 2.738 0.007 435 HG22 ILE 56 HG22 ILE 56 -1.205 3.516 0.851 436 HG23 ILE 56 HG23 ILE 56 -0.416 2.109 1.560 437 HD11 ILE 56 HD11 ILE 56 -0.598 5.289 0.161 438 HD12 ILE 56 HD12 ILE 56 -0.646 6.827 1.021 439 HD13 ILE 56 HD13 ILE 56 -1.894 5.613 1.310 440 H ALA 57 HN ALA 57 0.516 0.723 2.558 441 HA ALA 57 HA ALA 57 3.022 -0.175 1.223 442 HB1 ALA 57 HB1 ALA 57 3.124 -2.017 3.037 443 HB2 ALA 57 HB2 ALA 57 2.074 -0.957 3.972 444 HB3 ALA 57 HB3 ALA 57 3.671 -0.404 3.482 445 H ILE 58 HN ILE 58 2.493 -1.746 -0.308 446 HA ILE 58 HA ILE 58 -0.012 -3.310 0.193 447 HB ILE 58 HB ILE 58 0.869 -1.846 -2.302 448 HG12 ILE 58 HG12 ILE 58 -1.512 -0.862 -1.889 449 HG13 ILE 58 HG11 ILE 58 -1.313 -1.490 -0.253 450 HG21 ILE 58 HG21 ILE 58 -1.274 -3.911 -1.819 451 HG22 ILE 58 HG22 ILE 58 -0.108 -3.821 -3.139 452 HG23 ILE 58 HG23 ILE 58 -1.464 -2.694 -3.081 453 HD11 ILE 58 HD11 ILE 58 -0.208 0.905 -1.399 454 HD12 ILE 58 HD12 ILE 58 1.107 -0.164 -0.916 455 HD13 ILE 58 HD13 ILE 58 -0.104 0.332 0.265 456 H ILE 59 HN ILE 59 1.140 -5.243 0.643 457 HA ILE 59 HA ILE 59 3.025 -6.347 -1.377 458 HB ILE 59 HB ILE 59 2.001 -7.088 1.375 459 HG12 ILE 59 HG12 ILE 59 4.861 -7.227 0.587 460 HG13 ILE 59 HG11 ILE 59 4.129 -5.624 0.553 461 HG21 ILE 59 HG21 ILE 59 3.911 -9.012 0.582 462 HG22 ILE 59 HG22 ILE 59 2.738 -8.932 -0.731 463 HG23 ILE 59 HG23 ILE 59 2.201 -9.289 0.911 464 HD11 ILE 59 HD11 ILE 59 3.224 -6.192 2.902 465 HD12 ILE 59 HD12 ILE 59 4.940 -5.822 2.757 466 HD13 ILE 59 HD13 ILE 59 4.410 -7.498 2.896 467 H ASP 60 HN ASP 60 0.951 -5.965 -2.777 468 HA ASP 60 HA ASP 60 -1.319 -7.670 -2.492 469 HB2 ASP 60 HB2 ASP 60 -1.904 -6.035 -3.949 470 HB3 ASP 60 HB1 ASP 60 -0.216 -5.653 -4.266 471 H VAL 61 HN VAL 61 -1.615 -9.691 -2.937 472 HA VAL 61 HA VAL 61 -1.432 -11.478 -4.752 473 HB VAL 61 HB VAL 61 0.699 -10.530 -5.567 474 HG11 VAL 61 HG11 VAL 61 2.639 -10.519 -4.297 475 HG12 VAL 61 HG12 VAL 61 2.206 -12.005 -3.451 476 HG13 VAL 61 HG13 VAL 61 1.475 -10.474 -2.972 477 HG21 VAL 61 HG21 VAL 61 1.709 -13.172 -4.997 478 HG22 VAL 61 HG22 VAL 61 1.034 -12.550 -6.503 479 HG23 VAL 61 HG23 VAL 61 -0.030 -13.251 -5.284 480 H ASN 62 HN ASN 62 -2.608 -12.162 -2.729 481 HA ASN 62 HA ASN 62 -0.852 -13.821 -0.945 482 HB2 ASN 62 HB2 ASN 62 -3.219 -12.035 -0.515 483 HB3 ASN 62 HB1 ASN 62 -3.008 -13.413 0.566 484 HD21 ASN 62 HD21 ASN 62 -0.746 -11.006 -0.924 485 HD22 ASN 62 HD22 ASN 62 0.039 -10.635 0.535 486 H LEU 63 HN LEU 63 -1.257 -15.481 -2.759 487 HA LEU 63 HA LEU 63 -3.700 -17.040 -2.074 488 HB2 LEU 63 HB2 LEU 63 -3.449 -15.391 -4.331 489 HB3 LEU 63 HB1 LEU 63 -3.176 -17.027 -4.933 490 HG LEU 63 HG LEU 63 -5.282 -17.542 -3.365 491 HD11 LEU 63 HD11 LEU 63 -5.572 -15.287 -2.531 492 HD12 LEU 63 HD12 LEU 63 -6.909 -15.640 -3.626 493 HD13 LEU 63 HD13 LEU 63 -5.566 -14.633 -4.169 494 HD21 LEU 63 HD21 LEU 63 -6.427 -16.430 -5.720 495 HD22 LEU 63 HD22 LEU 63 -6.013 -18.117 -5.415 496 HD23 LEU 63 HD23 LEU 63 -4.831 -17.039 -6.159 497 H ASP 64 HN ASP 64 -3.506 -19.305 -2.735 498 HA ASP 64 HA ASP 64 -2.302 -21.311 -3.066 499 HB2 ASP 64 HB2 ASP 64 -1.162 -19.226 -4.807 500 HB3 ASP 64 HB1 ASP 64 -0.047 -20.555 -4.468 501 H GLY 65 HN GLY 65 -1.522 -19.106 -0.914 502 HA2 GLY 65 HA2 GLY 65 0.067 -20.482 0.793 503 HA3 GLY 65 HA1 GLY 65 1.264 -19.888 -0.358 504 H GLU 66 HN GLU 66 -0.561 -17.448 -0.731 505 HA GLU 66 HA GLU 66 -0.744 -15.294 0.217 506 HB2 GLU 66 HB2 GLU 66 -1.162 -17.253 2.261 507 HB3 GLU 66 HB1 GLU 66 -0.232 -15.926 2.958 508 HG2 GLU 66 HG2 GLU 66 -1.900 -14.316 2.070 509 HG3 GLU 66 HG1 GLU 66 -2.850 -15.665 1.444 510 HA PRO 67 HA PRO 67 3.921 -15.446 0.660 511 HB2 PRO 67 HB2 PRO 67 4.488 -14.045 -1.622 512 HB3 PRO 67 HB1 PRO 67 4.314 -15.812 -1.589 513 HG2 PRO 67 HG2 PRO 67 2.351 -13.735 -2.435 514 HG3 PRO 67 HG1 PRO 67 2.710 -15.310 -3.162 515 HD2 PRO 67 HD2 PRO 67 0.544 -14.878 -1.587 516 HD3 PRO 67 HD1 PRO 67 1.368 -16.449 -1.685 517 H SER 68 HN SER 68 2.504 -13.859 2.258 518 HA SER 68 HA SER 68 3.186 -11.024 1.549 519 HB2 SER 68 HB2 SER 68 0.956 -12.421 2.843 520 HB3 SER 68 HB1 SER 68 1.529 -11.049 3.786 521 HG SER 68 HG SER 68 0.354 -9.962 2.416 522 H TYR 69 HN TYR 69 4.555 -13.516 3.109 523 HA TYR 69 HA TYR 69 5.960 -13.800 4.964 524 HB2 TYR 69 HB2 TYR 69 6.995 -11.187 5.248 525 HB3 TYR 69 HB1 TYR 69 7.696 -12.508 4.329 526 HD1 TYR 69 HD2 TYR 69 6.513 -12.875 1.923 527 HD2 TYR 69 HD1 TYR 69 6.597 -9.205 4.133 528 HE1 TYR 69 HE2 TYR 69 6.124 -11.602 -0.169 529 HE2 TYR 69 HE1 TYR 69 6.202 -7.925 2.047 530 HH TYR 69 HH TYR 69 5.497 -9.565 -0.991 531 HA PRO 70 HA PRO 70 4.160 -12.266 8.627 532 HB2 PRO 70 HB2 PRO 70 6.251 -11.735 10.297 533 HB3 PRO 70 HB1 PRO 70 5.768 -13.379 9.841 534 HG2 PRO 70 HG2 PRO 70 8.044 -11.745 8.888 535 HG3 PRO 70 HG1 PRO 70 7.912 -13.498 9.083 536 HD2 PRO 70 HD2 PRO 70 7.728 -12.127 6.674 537 HD3 PRO 70 HD1 PRO 70 7.161 -13.785 6.964 538 H VAL 71 HN VAL 71 5.902 -10.119 6.725 539 HA VAL 71 HA VAL 71 5.659 -7.855 8.596 540 HB VAL 71 HB VAL 71 7.232 -6.857 7.297 541 HG11 VAL 71 HG11 VAL 71 7.972 -9.269 7.436 542 HG12 VAL 71 HG12 VAL 71 8.681 -8.341 6.115 543 HG13 VAL 71 HG13 VAL 71 7.369 -9.470 5.792 544 HG21 VAL 71 HG21 VAL 71 5.702 -6.194 5.550 545 HG22 VAL 71 HG22 VAL 71 5.680 -7.822 4.881 546 HG23 VAL 71 HG23 VAL 71 7.148 -6.851 4.786 547 H ALA 72 HN ALA 72 4.279 -8.850 5.457 548 HA ALA 72 HA ALA 72 2.408 -6.645 5.307 549 HB1 ALA 72 HB1 ALA 72 2.096 -7.585 3.267 550 HB2 ALA 72 HB2 ALA 72 1.625 -9.122 3.988 551 HB3 ALA 72 HB3 ALA 72 3.330 -8.761 3.720 552 H ASP 73 HN ASP 73 2.079 -10.106 6.149 553 HA ASP 73 HA ASP 73 -0.634 -10.122 6.858 554 HB2 ASP 73 HB2 ASP 73 1.838 -11.592 7.571 555 HB3 ASP 73 HB1 ASP 73 0.449 -11.862 8.613 556 H ILE 74 HN ILE 74 2.191 -9.597 8.975 557 HA ILE 74 HA ILE 74 0.827 -8.938 11.370 558 HB ILE 74 HB ILE 74 3.453 -8.174 10.091 559 HG12 ILE 74 HG12 ILE 74 2.646 -9.770 12.547 560 HG13 ILE 74 HG11 ILE 74 3.221 -10.430 11.016 561 HG21 ILE 74 HG21 ILE 74 3.901 -7.309 12.571 562 HG22 ILE 74 HG22 ILE 74 2.173 -6.967 12.510 563 HG23 ILE 74 HG23 ILE 74 3.259 -6.232 11.332 564 HD11 ILE 74 HD11 ILE 74 5.015 -8.411 12.185 565 HD12 ILE 74 HD12 ILE 74 5.392 -9.996 11.507 566 HD13 ILE 74 HD13 ILE 74 4.830 -9.861 13.174 567 H LEU 75 HN LEU 75 1.916 -6.839 8.715 568 HA LEU 75 HA LEU 75 0.819 -4.388 9.712 569 HB2 LEU 75 HB2 LEU 75 2.551 -5.051 7.836 570 HB3 LEU 75 HB1 LEU 75 1.129 -5.101 6.799 571 HG LEU 75 HG LEU 75 0.647 -2.736 7.857 572 HD11 LEU 75 HD11 LEU 75 2.243 -2.257 9.418 573 HD12 LEU 75 HD12 LEU 75 3.198 -1.787 8.011 574 HD13 LEU 75 HD13 LEU 75 3.402 -3.388 8.720 575 HD21 LEU 75 HD21 LEU 75 2.900 -3.153 5.869 576 HD22 LEU 75 HD22 LEU 75 1.898 -1.708 6.019 577 HD23 LEU 75 HD23 LEU 75 1.183 -3.225 5.472 578 H ALA 76 HN ALA 76 -0.566 -7.187 8.228 579 HA ALA 76 HA ALA 76 -3.017 -5.797 7.368 580 HB1 ALA 76 HB1 ALA 76 -2.553 -8.752 7.253 581 HB2 ALA 76 HB2 ALA 76 -1.607 -7.695 6.205 582 HB3 ALA 76 HB3 ALA 76 -3.366 -7.710 6.085 583 H GLU 77 HN GLU 77 -1.911 -7.997 9.909 584 HA GLU 77 HA GLU 77 -4.536 -8.816 10.773 585 HB2 GLU 77 HB2 GLU 77 -3.309 -10.147 12.164 586 HB3 GLU 77 HB1 GLU 77 -1.959 -9.606 11.174 587 HG2 GLU 77 HG2 GLU 77 -1.200 -9.192 13.355 588 HG3 GLU 77 HG1 GLU 77 -1.829 -7.619 12.865 589 H ARG 78 HN ARG 78 -2.396 -6.149 11.717 590 HA ARG 78 HA ARG 78 -4.537 -5.175 13.539 591 HB2 ARG 78 HB2 ARG 78 -2.678 -3.986 14.691 592 HB3 ARG 78 HB1 ARG 78 -2.417 -5.728 14.645 593 HG2 ARG 78 HG2 ARG 78 -0.776 -5.561 12.959 594 HG3 ARG 78 HG1 ARG 78 -1.287 -3.937 12.498 595 HD2 ARG 78 HD2 ARG 78 0.849 -3.961 13.841 596 HD3 ARG 78 HD1 ARG 78 -0.446 -3.034 14.625 597 HE ARG 78 HE ARG 78 0.565 -5.664 15.498 598 HH11 ARG 78 HH11 ARG 78 -0.913 -2.815 16.417 599 HH12 ARG 78 HH12 ARG 78 -1.979 -3.525 17.583 600 HH21 ARG 78 HH21 ARG 78 -1.226 -6.788 16.675 601 HH22 ARG 78 HH22 ARG 78 -2.150 -5.776 17.736 602 H ASN 79 HN ASN 79 -2.340 -4.371 10.939 603 HA ASN 79 HA ASN 79 -2.202 -2.541 9.480 604 HB2 ASN 79 HB2 ASN 79 -5.143 -2.181 9.933 605 HB3 ASN 79 HB1 ASN 79 -4.235 -2.182 8.426 606 HD21 ASN 79 HD21 ASN 79 -4.604 -4.025 7.207 607 HD22 ASN 79 HD22 ASN 79 -4.954 -5.562 7.835 608 H VAL 80 HN VAL 80 -1.721 -0.437 9.556 609 HA VAL 80 HA VAL 80 -2.853 1.276 11.745 610 HB VAL 80 HB VAL 80 -0.632 2.214 11.944 611 HG11 VAL 80 HG11 VAL 80 -0.196 -0.732 11.427 612 HG12 VAL 80 HG12 VAL 80 -1.000 -0.110 12.868 613 HG13 VAL 80 HG13 VAL 80 0.685 0.304 12.550 614 HG21 VAL 80 HG21 VAL 80 0.839 0.663 10.011 615 HG22 VAL 80 HG22 VAL 80 0.720 2.416 10.134 616 HG23 VAL 80 HG23 VAL 80 -0.461 1.516 9.183 617 HA PRO 81 HA PRO 81 -3.679 4.185 8.454 618 HB2 PRO 81 HB2 PRO 81 -1.794 6.160 8.160 619 HB3 PRO 81 HB1 PRO 81 -2.997 6.153 9.467 620 HG2 PRO 81 HG2 PRO 81 -0.133 5.349 9.525 621 HG3 PRO 81 HG1 PRO 81 -1.089 6.203 10.745 622 HD2 PRO 81 HD2 PRO 81 -0.466 3.579 10.915 623 HD3 PRO 81 HD1 PRO 81 -1.939 4.263 11.631 624 H PHE 82 HN PHE 82 -3.563 3.419 6.358 625 HA PHE 82 HA PHE 82 -1.143 3.419 4.759 626 HB2 PHE 82 HB2 PHE 82 -0.461 1.156 5.025 627 HB3 PHE 82 HB1 PHE 82 -0.799 1.685 6.673 628 HD1 PHE 82 HD1 PHE 82 -3.779 1.635 6.738 629 HD2 PHE 82 HD2 PHE 82 -1.001 -1.149 4.992 630 HE1 PHE 82 HE1 PHE 82 -5.446 -0.182 6.989 631 HE2 PHE 82 HE2 PHE 82 -2.687 -2.964 5.259 632 HZ PHE 82 HZ PHE 82 -4.898 -2.472 6.244 633 H ILE 83 HN ILE 83 -1.724 0.882 3.544 634 HA ILE 83 HA ILE 83 -4.478 0.701 2.655 635 HB ILE 83 HB ILE 83 -2.379 2.140 1.145 636 HG12 ILE 83 HG12 ILE 83 -5.167 2.572 0.406 637 HG13 ILE 83 HG11 ILE 83 -4.890 2.783 2.132 638 HG21 ILE 83 HG21 ILE 83 -4.135 0.033 -0.018 639 HG22 ILE 83 HG22 ILE 83 -2.533 0.558 -0.533 640 HG23 ILE 83 HG23 ILE 83 -3.952 1.520 -0.948 641 HD11 ILE 83 HD11 ILE 83 -3.465 4.578 1.825 642 HD12 ILE 83 HD12 ILE 83 -4.500 4.783 0.411 643 HD13 ILE 83 HD13 ILE 83 -2.924 4.009 0.245 644 H PHE 84 HN PHE 84 -4.685 -1.315 1.502 645 HA PHE 84 HA PHE 84 -2.259 -2.834 0.799 646 HB2 PHE 84 HB2 PHE 84 -2.910 -2.955 3.353 647 HB3 PHE 84 HB1 PHE 84 -4.160 -4.058 2.777 648 HD1 PHE 84 HD2 PHE 84 -0.507 -3.497 3.033 649 HD2 PHE 84 HD1 PHE 84 -3.609 -6.253 1.912 650 HE1 PHE 84 HE2 PHE 84 1.163 -5.333 2.903 651 HE2 PHE 84 HE1 PHE 84 -1.937 -8.083 1.787 652 HZ PHE 84 HZ PHE 84 0.444 -7.619 2.267 653 H ALA 85 HN ALA 85 -2.866 -4.922 -0.219 654 HA ALA 85 HA ALA 85 -5.591 -5.606 -0.771 655 HB1 ALA 85 HB1 ALA 85 -6.059 -4.361 -2.614 656 HB2 ALA 85 HB2 ALA 85 -4.451 -4.623 -3.288 657 HB3 ALA 85 HB3 ALA 85 -4.710 -3.347 -2.099 658 H THR 86 HN THR 86 -5.582 -7.712 -1.718 659 HA THR 86 HA THR 86 -3.050 -8.559 -3.049 660 HB THR 86 HB THR 86 -2.875 -10.471 -1.577 661 HG1 THR 86 HG1 THR 86 -5.417 -9.591 -0.806 662 HG21 THR 86 HG21 THR 86 -1.978 -8.293 -0.760 663 HG22 THR 86 HG22 THR 86 -2.470 -9.366 0.551 664 HG23 THR 86 HG23 THR 86 -3.506 -8.018 0.081 665 H GLY 87 HN GLY 87 -4.939 -11.214 -2.173 666 HA2 GLY 87 HA2 GLY 87 -6.179 -11.243 -4.887 667 HA3 GLY 87 HA1 GLY 87 -5.707 -12.689 -3.985 668 H TYR 88 HN TYR 88 -6.798 -12.175 -1.484 669 HA TYR 88 HA TYR 88 -9.570 -12.836 -1.901 670 HB2 TYR 88 HB2 TYR 88 -9.600 -12.541 0.628 671 HB3 TYR 88 HB1 TYR 88 -8.378 -13.656 0.019 672 HD1 TYR 88 HD2 TYR 88 -8.916 -10.131 1.127 673 HD2 TYR 88 HD1 TYR 88 -6.077 -13.275 0.415 674 HE1 TYR 88 HE2 TYR 88 -7.138 -8.779 2.205 675 HE2 TYR 88 HE1 TYR 88 -4.304 -11.920 1.496 676 HH TYR 88 HH TYR 88 -3.786 -9.958 2.407 677 H GLY 89 HN GLY 89 -7.875 -9.819 -1.091 678 HA2 GLY 89 HA2 GLY 89 -8.773 -7.658 -1.671 679 HA3 GLY 89 HA1 GLY 89 -10.386 -8.362 -1.720 680 H SER 90 HN SER 90 -7.753 -7.852 0.654 681 HA SER 90 HA SER 90 -7.879 -7.190 2.921 682 HB2 SER 90 HB2 SER 90 -10.387 -5.776 2.709 683 HB3 SER 90 HB1 SER 90 -8.759 -5.121 2.831 684 HG SER 90 HG SER 90 -10.375 -5.254 0.700 685 H LYS 91 HN LYS 91 -9.601 -7.047 4.819 686 HA LYS 91 HA LYS 91 -11.736 -9.066 4.617 687 HB2 LYS 91 HB2 LYS 91 -10.736 -10.529 6.235 688 HB3 LYS 91 HB1 LYS 91 -9.449 -10.152 5.091 689 HG2 LYS 91 HG2 LYS 91 -9.450 -8.113 7.095 690 HG3 LYS 91 HG1 LYS 91 -9.503 -9.672 7.915 691 HD2 LYS 91 HD2 LYS 91 -7.561 -10.430 6.586 692 HD3 LYS 91 HD1 LYS 91 -7.508 -8.861 5.779 693 HE2 LYS 91 HE2 LYS 91 -5.883 -9.029 7.702 694 HE3 LYS 91 HE1 LYS 91 -7.080 -7.739 7.934 695 HZ1 LYS 91 HZ1 LYS 91 -8.176 -8.900 9.513 696 HZ2 LYS 91 HZ2 LYS 91 -6.663 -9.639 9.736 697 HZ3 LYS 91 HZ3 LYS 91 -7.857 -10.407 8.803 698 H GLY 92 HN GLY 92 -11.081 -6.106 5.390 699 HA2 GLY 92 HA2 GLY 92 -12.557 -4.731 6.757 700 HA3 GLY 92 HA1 GLY 92 -12.762 -6.103 7.854 701 H LEU 93 HN LEU 93 -9.966 -4.335 6.497 702 HA LEU 93 HA LEU 93 -8.495 -4.665 9.006 703 HB2 LEU 93 HB2 LEU 93 -6.746 -3.337 7.725 704 HB3 LEU 93 HB1 LEU 93 -7.235 -4.854 6.992 705 HG LEU 93 HG LEU 93 -7.021 -2.624 5.570 706 HD11 LEU 93 HD11 LEU 93 -7.585 -4.337 4.212 707 HD12 LEU 93 HD12 LEU 93 -9.216 -3.679 4.327 708 HD13 LEU 93 HD13 LEU 93 -8.725 -5.014 5.370 709 HD21 LEU 93 HD21 LEU 93 -9.906 -2.501 6.515 710 HD22 LEU 93 HD22 LEU 93 -9.176 -1.497 5.266 711 HD23 LEU 93 HD23 LEU 93 -8.646 -1.344 6.940 712 H ASP 94 HN ASP 94 -7.399 -2.692 9.979 713 HA ASP 94 HA ASP 94 -9.421 -0.496 10.213 714 HB2 ASP 94 HB2 ASP 94 -8.289 -0.194 12.482 715 HB3 ASP 94 HB1 ASP 94 -9.177 -1.699 12.270 716 H THR 95 HN THR 95 -8.617 1.697 10.309 717 HA THR 95 HA THR 95 -5.840 2.402 10.142 718 HB THR 95 HB THR 95 -5.959 1.175 8.049 719 HG1 THR 95 HG1 THR 95 -5.454 2.908 6.626 720 HG21 THR 95 HG21 THR 95 -7.538 2.051 6.250 721 HG22 THR 95 HG22 THR 95 -8.369 2.917 7.542 722 HG23 THR 95 HG23 THR 95 -8.293 1.156 7.568 723 H ARG 96 HN ARG 96 -5.642 4.695 9.072 724 HA ARG 96 HA ARG 96 -7.707 6.408 10.247 725 HB2 ARG 96 HB2 ARG 96 -5.060 6.690 8.851 726 HB3 ARG 96 HB1 ARG 96 -6.098 8.111 8.978 727 HG2 ARG 96 HG2 ARG 96 -6.017 6.749 11.520 728 HG3 ARG 96 HG1 ARG 96 -4.374 7.075 10.966 729 HD2 ARG 96 HD2 ARG 96 -6.621 9.099 11.291 730 HD3 ARG 96 HD1 ARG 96 -5.093 9.034 12.193 731 HE ARG 96 HE ARG 96 -4.035 9.272 9.801 732 HH11 ARG 96 HH11 ARG 96 -5.134 11.749 11.350 733 HH12 ARG 96 HH12 ARG 96 -5.915 12.592 10.052 734 HH21 ARG 96 HH21 ARG 96 -5.871 9.861 7.906 735 HH22 ARG 96 HH22 ARG 96 -6.331 11.520 8.098 736 H TYR 97 HN TYR 97 -7.717 4.644 7.516 737 HA TYR 97 HA TYR 97 -8.601 6.687 5.612 738 HB2 TYR 97 HB2 TYR 97 -8.300 3.680 5.690 739 HB3 TYR 97 HB1 TYR 97 -8.969 4.506 4.281 740 HD1 TYR 97 HD1 TYR 97 -6.086 4.922 6.673 741 HD2 TYR 97 HD2 TYR 97 -7.458 5.095 2.611 742 HE1 TYR 97 HE1 TYR 97 -3.808 5.547 5.936 743 HE2 TYR 97 HE2 TYR 97 -5.179 5.724 1.873 744 HH TYR 97 HH TYR 97 -2.541 5.228 3.433 745 H SER 98 HN SER 98 -10.178 3.671 6.663 746 HA SER 98 HA SER 98 -12.468 4.345 7.951 747 HB2 SER 98 HB2 SER 98 -12.473 5.482 5.197 748 HB3 SER 98 HB1 SER 98 -13.985 4.750 5.738 749 HG SER 98 HG SER 98 -12.520 6.892 6.851 750 H ASN 99 HN ASN 99 -10.859 2.029 6.856 751 HA ASN 99 HA ASN 99 -11.239 -0.169 6.047 752 HB2 ASN 99 HB2 ASN 99 -13.979 0.406 7.200 753 HB3 ASN 99 HB1 ASN 99 -13.146 -1.151 7.141 754 HD21 ASN 99 HD21 ASN 99 -10.550 0.460 7.822 755 HD22 ASN 99 HD22 ASN 99 -10.658 0.675 9.501 756 H ILE 100 HN ILE 100 -11.214 0.800 3.816 757 HA ILE 100 HA ILE 100 -13.449 -0.112 2.281 758 HB ILE 100 HB ILE 100 -13.826 2.423 1.463 759 HG12 ILE 100 HG12 ILE 100 -14.088 3.269 4.160 760 HG13 ILE 100 HG11 ILE 100 -12.422 2.749 3.960 761 HG21 ILE 100 HG21 ILE 100 -15.913 2.012 2.204 762 HG22 ILE 100 HG22 ILE 100 -15.376 1.845 3.877 763 HG23 ILE 100 HG23 ILE 100 -15.257 0.477 2.771 764 HD11 ILE 100 HD11 ILE 100 -12.640 5.119 3.375 765 HD12 ILE 100 HD12 ILE 100 -13.896 4.726 2.201 766 HD13 ILE 100 HD13 ILE 100 -12.242 4.180 1.938 767 HA PRO 101 HA PRO 101 -10.387 1.913 -0.711 768 HB2 PRO 101 HB2 PRO 101 -8.039 2.945 0.226 769 HB3 PRO 101 HB1 PRO 101 -9.516 3.905 0.054 770 HG2 PRO 101 HG2 PRO 101 -8.223 2.825 2.463 771 HG3 PRO 101 HG1 PRO 101 -9.257 4.245 2.272 772 HD2 PRO 101 HD2 PRO 101 -9.998 1.765 3.314 773 HD3 PRO 101 HD1 PRO 101 -11.083 3.081 2.855 774 H LEU 102 HN LEU 102 -10.378 -0.722 -0.098 775 HA LEU 102 HA LEU 102 -7.558 -1.475 -0.596 776 HB2 LEU 102 HB2 LEU 102 -9.156 -2.022 1.867 777 HB3 LEU 102 HB1 LEU 102 -8.102 -3.312 1.290 778 HG LEU 102 HG LEU 102 -6.456 -1.133 1.083 779 HD11 LEU 102 HD11 LEU 102 -8.420 0.074 2.342 780 HD12 LEU 102 HD12 LEU 102 -6.759 0.351 2.869 781 HD13 LEU 102 HD13 LEU 102 -7.790 -0.773 3.755 782 HD21 LEU 102 HD21 LEU 102 -5.331 -2.068 3.027 783 HD22 LEU 102 HD22 LEU 102 -6.043 -3.401 2.116 784 HD23 LEU 102 HD23 LEU 102 -6.828 -2.811 3.579 785 H LEU 103 HN LEU 103 -7.361 -3.740 -1.378 786 HA LEU 103 HA LEU 103 -9.632 -5.448 -1.735 787 HB2 LEU 103 HB2 LEU 103 -10.127 -4.999 -4.097 788 HB3 LEU 103 HB1 LEU 103 -10.374 -3.553 -3.124 789 HG LEU 103 HG LEU 103 -7.812 -4.125 -4.632 790 HD11 LEU 103 HD11 LEU 103 -10.126 -2.331 -5.416 791 HD12 LEU 103 HD12 LEU 103 -9.804 -3.909 -6.129 792 HD13 LEU 103 HD13 LEU 103 -8.644 -2.597 -6.332 793 HD21 LEU 103 HD21 LEU 103 -8.946 -1.806 -3.073 794 HD22 LEU 103 HD22 LEU 103 -7.763 -1.526 -4.354 795 HD23 LEU 103 HD23 LEU 103 -7.339 -2.529 -2.969 796 H THR 104 HN THR 104 -8.502 -5.871 -4.699 797 HA THR 104 HA THR 104 -6.214 -7.558 -3.803 798 HB THR 104 HB THR 104 -7.940 -9.043 -4.289 799 HG1 THR 104 HG1 THR 104 -7.370 -9.996 -6.195 800 HG21 THR 104 HG21 THR 104 -8.721 -7.284 -6.630 801 HG22 THR 104 HG22 THR 104 -9.542 -7.330 -5.071 802 HG23 THR 104 HG23 THR 104 -9.553 -8.745 -6.118 803 H LYS 105 HN LYS 105 -6.020 -4.815 -4.980 804 HA LYS 105 HA LYS 105 -4.628 -3.746 -6.576 805 HB2 LYS 105 HB2 LYS 105 -2.859 -4.992 -5.737 806 HB3 LYS 105 HB1 LYS 105 -3.635 -6.531 -6.091 807 HG2 LYS 105 HG2 LYS 105 -2.813 -4.830 -8.399 808 HG3 LYS 105 HG1 LYS 105 -1.559 -5.665 -7.492 809 HD2 LYS 105 HD2 LYS 105 -2.591 -7.806 -7.816 810 HD3 LYS 105 HD1 LYS 105 -4.055 -7.070 -8.462 811 HE2 LYS 105 HE2 LYS 105 -2.909 -6.368 -10.477 812 HE3 LYS 105 HE1 LYS 105 -1.335 -6.837 -9.803 813 HZ1 LYS 105 HZ1 LYS 105 -1.708 -8.980 -10.252 814 HZ2 LYS 105 HZ2 LYS 105 -3.006 -8.471 -11.222 815 HZ3 LYS 105 HZ3 LYS 105 -3.278 -8.936 -9.611 816 HA PRO 106 HA PRO 106 -6.804 -6.120 -10.148 817 HB2 PRO 106 HB2 PRO 106 -9.257 -4.893 -10.219 818 HB3 PRO 106 HB1 PRO 106 -8.961 -6.426 -9.375 819 HG2 PRO 106 HG2 PRO 106 -9.145 -3.666 -8.274 820 HG3 PRO 106 HG1 PRO 106 -9.766 -5.185 -7.617 821 HD2 PRO 106 HD2 PRO 106 -7.496 -4.028 -6.688 822 HD3 PRO 106 HD1 PRO 106 -7.750 -5.779 -6.709 823 H PHE 107 HN PHE 107 -6.018 -3.063 -9.029 824 HA PHE 107 HA PHE 107 -5.408 -1.072 -10.090 825 HB2 PHE 107 HB2 PHE 107 -5.293 -3.216 -12.182 826 HB3 PHE 107 HB1 PHE 107 -5.021 -1.537 -12.665 827 HD1 PHE 107 HD1 PHE 107 -3.559 -0.184 -10.818 828 HD2 PHE 107 HD2 PHE 107 -3.354 -4.404 -11.586 829 HE1 PHE 107 HE1 PHE 107 -1.300 -0.253 -9.811 830 HE2 PHE 107 HE2 PHE 107 -1.086 -4.475 -10.583 831 HZ PHE 107 HZ PHE 107 -0.050 -2.390 -9.704 832 H LEU 108 HN LEU 108 -6.187 -0.102 -12.651 833 HA LEU 108 HA LEU 108 -7.942 1.437 -13.163 834 HB2 LEU 108 HB2 LEU 108 -8.951 0.375 -14.921 835 HB3 LEU 108 HB1 LEU 108 -7.706 -0.798 -14.555 836 HG LEU 108 HG LEU 108 -9.565 -2.143 -14.840 837 HD11 LEU 108 HD11 LEU 108 -10.184 -3.093 -12.782 838 HD12 LEU 108 HD12 LEU 108 -9.987 -1.580 -11.910 839 HD13 LEU 108 HD13 LEU 108 -8.574 -2.439 -12.521 840 HD21 LEU 108 HD21 LEU 108 -11.588 -1.228 -15.048 841 HD22 LEU 108 HD22 LEU 108 -10.994 0.263 -14.318 842 HD23 LEU 108 HD23 LEU 108 -11.675 -1.007 -13.299 843 H ASP 109 HN ASP 109 -8.110 0.959 -10.430 844 HA ASP 109 HA ASP 109 -10.447 2.048 -9.544 845 HB2 ASP 109 HB2 ASP 109 -11.871 0.460 -10.572 846 HB3 ASP 109 HB1 ASP 109 -10.798 -0.884 -10.190 847 H SER 110 HN SER 110 -7.929 -0.250 -9.104 848 HA SER 110 HA SER 110 -8.280 -0.727 -6.251 849 HB2 SER 110 HB2 SER 110 -5.976 -1.140 -8.170 850 HB3 SER 110 HB1 SER 110 -6.154 -1.913 -6.595 851 HG SER 110 HG SER 110 -7.991 -2.081 -8.748 852 H GLU 111 HN GLU 111 -5.068 0.144 -7.265 853 HA GLU 111 HA GLU 111 -4.290 1.727 -5.184 854 HB2 GLU 111 HB2 GLU 111 -2.509 1.817 -6.572 855 HB3 GLU 111 HB1 GLU 111 -3.520 1.207 -7.876 856 HG2 GLU 111 HG2 GLU 111 -2.630 3.244 -8.704 857 HG3 GLU 111 HG1 GLU 111 -4.272 3.652 -8.203 858 H LEU 112 HN LEU 112 -6.510 2.686 -7.713 859 HA LEU 112 HA LEU 112 -6.524 5.527 -7.210 860 HB2 LEU 112 HB2 LEU 112 -8.943 3.992 -8.133 861 HB3 LEU 112 HB1 LEU 112 -8.327 5.535 -8.716 862 HG LEU 112 HG LEU 112 -7.197 2.780 -9.255 863 HD11 LEU 112 HD11 LEU 112 -9.177 3.808 -10.580 864 HD12 LEU 112 HD12 LEU 112 -7.817 3.160 -11.494 865 HD13 LEU 112 HD13 LEU 112 -7.969 4.900 -11.254 866 HD21 LEU 112 HD21 LEU 112 -5.650 5.007 -8.843 867 HD22 LEU 112 HD22 LEU 112 -5.979 5.131 -10.570 868 HD23 LEU 112 HD23 LEU 112 -5.210 3.682 -9.921 869 H GLU 113 HN GLU 113 -9.056 3.119 -6.410 870 HA GLU 113 HA GLU 113 -10.514 4.630 -4.569 871 HB2 GLU 113 HB2 GLU 113 -11.493 2.569 -4.065 872 HB3 GLU 113 HB1 GLU 113 -10.632 2.119 -5.533 873 HG2 GLU 113 HG2 GLU 113 -8.794 1.203 -4.243 874 HG3 GLU 113 HG1 GLU 113 -9.501 1.795 -2.739 875 H ALA 114 HN ALA 114 -7.504 2.826 -4.111 876 HA ALA 114 HA ALA 114 -7.259 2.869 -1.335 877 HB1 ALA 114 HB1 ALA 114 -5.449 2.942 -3.689 878 HB2 ALA 114 HB2 ALA 114 -5.496 1.799 -2.351 879 HB3 ALA 114 HB3 ALA 114 -4.709 3.364 -2.145 880 H VAL 115 HN VAL 115 -6.400 5.487 -3.603 881 HA VAL 115 HA VAL 115 -5.977 7.333 -1.300 882 HB VAL 115 HB VAL 115 -5.535 7.706 -4.278 883 HG11 VAL 115 HG11 VAL 115 -3.755 9.188 -2.602 884 HG12 VAL 115 HG12 VAL 115 -5.400 9.465 -2.028 885 HG13 VAL 115 HG13 VAL 115 -4.982 9.811 -3.706 886 HG21 VAL 115 HG21 VAL 115 -3.063 7.377 -3.366 887 HG22 VAL 115 HG22 VAL 115 -4.048 5.981 -3.805 888 HG23 VAL 115 HG23 VAL 115 -3.885 6.449 -2.112 889 H LEU 116 HN LEU 116 -8.337 6.466 -3.623 890 HA LEU 116 HA LEU 116 -9.634 9.121 -3.688 891 HB2 LEU 116 HB2 LEU 116 -9.357 7.000 -5.412 892 HB3 LEU 116 HB1 LEU 116 -10.996 6.761 -4.807 893 HG LEU 116 HG LEU 116 -10.067 9.471 -5.742 894 HD11 LEU 116 HD11 LEU 116 -11.172 7.186 -7.396 895 HD12 LEU 116 HD12 LEU 116 -9.641 8.029 -7.633 896 HD13 LEU 116 HD13 LEU 116 -11.166 8.864 -7.938 897 HD21 LEU 116 HD21 LEU 116 -12.584 8.144 -4.939 898 HD22 LEU 116 HD22 LEU 116 -12.710 9.167 -6.370 899 HD23 LEU 116 HD23 LEU 116 -12.132 9.846 -4.848 900 H VAL 117 HN VAL 117 -10.258 5.873 -2.342 901 HA VAL 117 HA VAL 117 -12.880 6.617 -1.290 902 HB VAL 117 HB VAL 117 -11.302 4.313 -0.250 903 HG11 VAL 117 HG11 VAL 117 -13.360 3.839 0.455 904 HG12 VAL 117 HG12 VAL 117 -13.801 3.545 -1.224 905 HG13 VAL 117 HG13 VAL 117 -14.049 5.139 -0.510 906 HG21 VAL 117 HG21 VAL 117 -11.562 4.826 -3.068 907 HG22 VAL 117 HG22 VAL 117 -12.614 3.484 -2.640 908 HG23 VAL 117 HG23 VAL 117 -10.897 3.400 -2.273 909 H GLN 118 HN GLN 118 -9.748 7.357 -0.353 910 HA GLN 118 HA GLN 118 -10.017 7.129 2.532 911 HB2 GLN 118 HB2 GLN 118 -7.859 7.031 1.512 912 HB3 GLN 118 HB1 GLN 118 -8.143 8.516 0.606 913 HG2 GLN 118 HG2 GLN 118 -8.430 9.560 3.027 914 HG3 GLN 118 HG1 GLN 118 -7.462 8.164 3.502 915 HE21 GLN 118 HE21 GLN 118 -7.390 10.455 0.702 916 HE22 GLN 118 HE22 GLN 118 -5.726 10.773 0.824 917 H ILE 119 HN ILE 119 -10.166 9.906 0.253 918 HA ILE 119 HA ILE 119 -10.830 11.781 2.396 919 HB ILE 119 HB ILE 119 -9.531 12.312 0.337 920 HG12 ILE 119 HG12 ILE 119 -12.110 13.773 0.935 921 HG13 ILE 119 HG11 ILE 119 -10.469 14.211 1.412 922 HG21 ILE 119 HG21 ILE 119 -11.028 10.823 -1.112 923 HG22 ILE 119 HG22 ILE 119 -10.586 12.381 -1.808 924 HG23 ILE 119 HG23 ILE 119 -12.187 12.151 -1.107 925 HD11 ILE 119 HD11 ILE 119 -10.661 15.645 -0.363 926 HD12 ILE 119 HD12 ILE 119 -11.876 14.651 -1.167 927 HD13 ILE 119 HD13 ILE 119 -10.170 14.215 -1.272 928 H SER 120 HN SER 120 -12.666 10.062 -0.130 929 HA SER 120 HA SER 120 -15.099 11.313 -0.237 930 HB2 SER 120 HB2 SER 120 -15.663 8.578 0.290 931 HB3 SER 120 HB1 SER 120 -15.465 9.348 -1.280 932 HG SER 120 HG SER 120 -13.831 7.646 0.009 933 H LYS 121 HN LYS 121 -16.142 12.330 1.444 934 HA LYS 121 HA LYS 121 -17.100 10.737 3.711 935 HB2 LYS 121 HB2 LYS 121 -14.616 12.190 3.800 936 HB3 LYS 121 HB1 LYS 121 -15.767 12.952 4.907 937 HG2 LYS 121 HG2 LYS 121 -16.194 10.832 6.011 938 HG3 LYS 121 HG1 LYS 121 -15.183 9.978 4.845 939 HD2 LYS 121 HD2 LYS 121 -13.683 10.262 6.604 940 HD3 LYS 121 HD1 LYS 121 -13.344 11.698 5.638 941 HE2 LYS 121 HE2 LYS 121 -14.210 13.113 7.221 942 HE3 LYS 121 HE1 LYS 121 -15.538 12.004 7.617 943 HZ1 LYS 121 HZ1 LYS 121 -14.305 10.927 9.143 944 HZ2 LYS 121 HZ2 LYS 121 -13.380 12.352 9.167 945 HZ3 LYS 121 HZ3 LYS 121 -12.879 11.027 8.229 946 H GLU 122 HN GLU 122 -18.885 11.785 2.177 947 HA GLU 122 HA GLU 122 -20.546 13.421 1.821 948 HB2 GLU 122 HB2 GLU 122 -21.624 13.991 3.877 949 HB3 GLU 122 HB1 GLU 122 -20.862 12.432 4.169 950 HG2 GLU 122 HG2 GLU 122 -19.302 13.309 5.614 951 HG3 GLU 122 HG1 GLU 122 -19.243 14.863 4.789 952 H VAL 123 HN VAL 123 -17.851 14.281 1.348 953 HA VAL 123 HA VAL 123 -16.785 16.530 2.355 954 HB VAL 123 HB VAL 123 -16.344 17.207 -0.022 955 HG11 VAL 123 HG11 VAL 123 -15.987 14.419 -0.471 956 HG12 VAL 123 HG12 VAL 123 -15.795 14.697 1.260 957 HG13 VAL 123 HG13 VAL 123 -14.792 15.579 0.109 958 HG21 VAL 123 HG21 VAL 123 -18.703 15.433 -0.389 959 HG22 VAL 123 HG22 VAL 123 -17.412 15.264 -1.580 960 HG23 VAL 123 HG23 VAL 123 -18.189 16.829 -1.337 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 0.321 19.106 9.057 2 H2 GLY 1 HT2 GLY 1 -0.334 20.670 8.961 3 H3 GLY 1 HT3 GLY 1 0.312 20.106 10.427 4 HA2 GLY 1 HA2 GLY 1 2.069 20.158 8.086 5 HA3 GLY 1 HA1 GLY 1 1.680 21.691 8.870 6 H SER 2 HN SER 2 1.996 21.716 11.301 7 HA SER 2 HA SER 2 3.464 21.462 13.136 8 HB2 SER 2 HB2 SER 2 3.182 18.717 11.924 9 HB3 SER 2 HB1 SER 2 4.195 18.969 13.343 10 HG SER 2 HG SER 2 1.420 19.398 13.022 11 H HIS 3 HN HIS 3 5.806 20.850 13.672 12 HA HIS 3 HA HIS 3 7.514 21.321 11.257 13 HB2 HIS 3 HB2 HIS 3 8.497 21.652 14.067 14 HB3 HIS 3 HB1 HIS 3 8.865 22.612 12.638 15 HD1 HIS 3 HD1 HIS 3 6.873 22.661 15.659 16 HD2 HIS 3 HD2 HIS 3 6.476 24.287 11.840 17 HE1 HIS 3 HE1 HIS 3 5.137 24.495 15.839 18 H MET 4 HN MET 4 6.607 18.903 13.433 19 HA MET 4 HA MET 4 9.154 17.568 13.809 20 HB2 MET 4 HB2 MET 4 6.326 16.469 13.882 21 HB3 MET 4 HB1 MET 4 7.740 15.797 14.697 22 HG2 MET 4 HG2 MET 4 7.596 17.276 16.408 23 HG3 MET 4 HG1 MET 4 7.282 18.629 15.323 24 HE1 MET 4 HE1 MET 4 4.716 15.436 15.033 25 HE2 MET 4 HE2 MET 4 4.361 15.463 16.759 26 HE3 MET 4 HE3 MET 4 6.028 15.301 16.213 27 H THR 5 HN THR 5 6.393 16.983 11.585 28 HA THR 5 HA THR 5 8.286 15.453 9.830 29 HB THR 5 HB THR 5 6.442 13.903 9.410 30 HG1 THR 5 HG1 THR 5 4.626 15.026 9.528 31 HG21 THR 5 HG21 THR 5 6.108 13.029 11.727 32 HG22 THR 5 HG22 THR 5 6.821 14.515 12.353 33 HG23 THR 5 HG23 THR 5 7.792 13.416 11.374 34 H GLU 6 HN GLU 6 7.563 15.470 7.510 35 HA GLU 6 HA GLU 6 5.478 17.256 6.616 36 HB2 GLU 6 HB2 GLU 6 7.184 18.976 5.722 37 HB3 GLU 6 HB1 GLU 6 6.858 19.004 7.456 38 HG2 GLU 6 HG2 GLU 6 8.852 17.514 7.792 39 HG3 GLU 6 HG1 GLU 6 9.215 17.689 6.075 40 H ARG 7 HN ARG 7 6.804 14.598 6.004 41 HA ARG 7 HA ARG 7 6.543 14.622 3.161 42 HB2 ARG 7 HB2 ARG 7 9.096 14.285 2.761 43 HB3 ARG 7 HB1 ARG 7 8.500 15.925 3.005 44 HG2 ARG 7 HG2 ARG 7 10.425 15.724 4.402 45 HG3 ARG 7 HG1 ARG 7 9.044 15.602 5.489 46 HD2 ARG 7 HD2 ARG 7 9.599 13.482 6.087 47 HD3 ARG 7 HD1 ARG 7 9.841 12.999 4.397 48 HE ARG 7 HE ARG 7 11.920 13.986 6.197 49 HH11 ARG 7 HH11 ARG 7 11.240 12.522 3.262 50 HH12 ARG 7 HH12 ARG 7 12.630 13.133 2.429 51 HH21 ARG 7 HH21 ARG 7 13.552 15.280 4.991 52 HH22 ARG 7 HH22 ARG 7 13.941 14.689 3.410 53 H ARG 8 HN ARG 8 5.961 12.937 5.531 54 HA ARG 8 HA ARG 8 7.603 10.503 5.126 55 HB2 ARG 8 HB2 ARG 8 6.636 11.585 7.324 56 HB3 ARG 8 HB1 ARG 8 5.156 10.745 6.860 57 HG2 ARG 8 HG2 ARG 8 6.440 8.619 6.720 58 HG3 ARG 8 HG1 ARG 8 7.877 9.475 7.277 59 HD2 ARG 8 HD2 ARG 8 5.835 10.150 9.113 60 HD3 ARG 8 HD1 ARG 8 5.713 8.397 8.860 61 HE ARG 8 HE ARG 8 7.751 8.229 10.030 62 HH11 ARG 8 HH11 ARG 8 7.322 11.381 10.319 63 HH12 ARG 8 HH12 ARG 8 8.941 11.892 9.976 64 HH21 ARG 8 HH21 ARG 8 9.932 8.811 8.732 65 HH22 ARG 8 HH22 ARG 8 10.418 10.439 9.069 66 H LEU 9 HN LEU 9 4.896 11.896 3.694 67 HA LEU 9 HA LEU 9 3.056 9.765 3.377 68 HB2 LEU 9 HB2 LEU 9 3.772 12.324 2.088 69 HB3 LEU 9 HB1 LEU 9 2.892 11.199 1.053 70 HG LEU 9 HG LEU 9 1.343 12.672 2.296 71 HD11 LEU 9 HD11 LEU 9 1.209 9.910 2.037 72 HD12 LEU 9 HD12 LEU 9 -0.135 10.968 2.467 73 HD13 LEU 9 HD13 LEU 9 0.806 10.179 3.733 74 HD21 LEU 9 HD21 LEU 9 3.120 12.554 4.326 75 HD22 LEU 9 HD22 LEU 9 1.985 11.320 4.871 76 HD23 LEU 9 HD23 LEU 9 1.423 12.965 4.575 77 H ARG 10 HN ARG 10 3.653 7.742 2.625 78 HA ARG 10 HA ARG 10 4.774 7.563 -0.073 79 HB2 ARG 10 HB2 ARG 10 6.617 7.762 1.811 80 HB3 ARG 10 HB1 ARG 10 6.239 6.059 2.068 81 HG2 ARG 10 HG2 ARG 10 8.115 6.472 0.429 82 HG3 ARG 10 HG1 ARG 10 6.783 5.513 -0.214 83 HD2 ARG 10 HD2 ARG 10 6.160 8.269 -0.657 84 HD3 ARG 10 HD1 ARG 10 7.787 7.980 -1.243 85 HE ARG 10 HE ARG 10 6.159 5.784 -2.036 86 HH11 ARG 10 HH21 ARG 10 7.898 8.162 -3.411 87 HH12 ARG 10 HH22 ARG 10 6.800 8.532 -4.699 88 HH21 ARG 10 HH11 ARG 10 4.194 6.673 -3.370 89 HH22 ARG 10 HH12 ARG 10 4.708 7.686 -4.678 90 H VAL 11 HN VAL 11 4.853 5.276 -0.837 91 HA VAL 11 HA VAL 11 3.027 3.463 0.687 92 HB VAL 11 HB VAL 11 1.669 3.237 -1.362 93 HG11 VAL 11 HG11 VAL 11 0.475 5.152 -0.960 94 HG12 VAL 11 HG12 VAL 11 1.886 6.191 -1.153 95 HG13 VAL 11 HG13 VAL 11 1.623 5.336 0.365 96 HG21 VAL 11 HG21 VAL 11 3.997 4.609 -2.477 97 HG22 VAL 11 HG22 VAL 11 2.486 5.385 -2.945 98 HG23 VAL 11 HG23 VAL 11 2.748 3.679 -3.305 99 H LEU 12 HN LEU 12 4.233 1.569 0.849 100 HA LEU 12 HA LEU 12 6.068 0.804 -1.361 101 HB2 LEU 12 HB2 LEU 12 5.467 -0.720 1.178 102 HB3 LEU 12 HB1 LEU 12 6.952 -0.728 0.229 103 HG LEU 12 HG LEU 12 6.545 1.958 0.954 104 HD11 LEU 12 HD11 LEU 12 6.618 0.709 3.556 105 HD12 LEU 12 HD12 LEU 12 5.101 0.381 2.716 106 HD13 LEU 12 HD13 LEU 12 5.628 2.042 2.968 107 HD21 LEU 12 HD21 LEU 12 8.613 0.255 0.848 108 HD22 LEU 12 HD22 LEU 12 8.321 0.197 2.586 109 HD23 LEU 12 HD23 LEU 12 8.686 1.735 1.804 110 H VAL 13 HN VAL 13 4.571 0.169 -3.005 111 HA VAL 13 HA VAL 13 2.548 -1.896 -2.308 112 HB VAL 13 HB VAL 13 2.941 -0.891 -5.095 113 HG11 VAL 13 HG11 VAL 13 1.048 -2.376 -3.950 114 HG12 VAL 13 HG12 VAL 13 0.658 -1.230 -5.233 115 HG13 VAL 13 HG13 VAL 13 0.385 -0.792 -3.547 116 HG21 VAL 13 HG21 VAL 13 2.091 0.858 -2.771 117 HG22 VAL 13 HG22 VAL 13 1.602 1.198 -4.430 118 HG23 VAL 13 HG23 VAL 13 3.312 1.204 -3.996 119 H VAL 14 HN VAL 14 2.756 -4.031 -3.076 120 HA VAL 14 HA VAL 14 4.966 -4.610 -4.955 121 HB VAL 14 HB VAL 14 5.797 -6.287 -3.144 122 HG11 VAL 14 HG11 VAL 14 6.380 -3.556 -2.200 123 HG12 VAL 14 HG12 VAL 14 6.622 -3.816 -3.928 124 HG13 VAL 14 HG13 VAL 14 7.481 -4.816 -2.757 125 HG21 VAL 14 HG21 VAL 14 5.154 -5.982 -0.953 126 HG22 VAL 14 HG22 VAL 14 3.653 -5.512 -1.750 127 HG23 VAL 14 HG23 VAL 14 4.780 -4.276 -1.195 128 H GLU 15 HN GLU 15 4.680 -6.444 -6.078 129 HA GLU 15 HA GLU 15 3.073 -8.710 -5.249 130 HB2 GLU 15 HB2 GLU 15 1.161 -7.449 -5.741 131 HB3 GLU 15 HB1 GLU 15 1.961 -6.557 -7.037 132 HG2 GLU 15 HG2 GLU 15 1.961 -9.338 -7.738 133 HG3 GLU 15 HG1 GLU 15 0.331 -8.889 -7.247 134 H ASP 16 HN ASP 16 4.024 -10.383 -6.244 135 HA ASP 16 HA ASP 16 6.129 -10.938 -7.561 136 HB2 ASP 16 HB2 ASP 16 4.741 -12.345 -9.277 137 HB3 ASP 16 HB1 ASP 16 4.581 -12.661 -7.550 138 H GLU 17 HN GLU 17 3.633 -10.101 -9.997 139 HA GLU 17 HA GLU 17 5.572 -9.587 -12.021 140 HB2 GLU 17 HB2 GLU 17 3.603 -8.799 -13.286 141 HB3 GLU 17 HB1 GLU 17 3.258 -10.293 -12.414 142 HG2 GLU 17 HG2 GLU 17 2.617 -8.378 -10.547 143 HG3 GLU 17 HG1 GLU 17 2.113 -7.608 -12.051 144 H SER 18 HN SER 18 5.605 -7.529 -13.311 145 HA SER 18 HA SER 18 6.371 -5.275 -11.559 146 HB2 SER 18 HB2 SER 18 6.573 -5.885 -14.521 147 HB3 SER 18 HB1 SER 18 7.190 -4.406 -13.792 148 HG SER 18 HG SER 18 8.790 -5.499 -12.938 149 H MET 19 HN MET 19 3.492 -6.254 -12.940 150 HA MET 19 HA MET 19 2.434 -4.011 -14.280 151 HB2 MET 19 HB2 MET 19 1.520 -6.420 -13.423 152 HB3 MET 19 HB1 MET 19 0.734 -5.368 -12.244 153 HG2 MET 19 HG2 MET 19 -0.801 -5.501 -14.057 154 HG3 MET 19 HG1 MET 19 -0.001 -3.942 -14.253 155 HE1 MET 19 HE1 MET 19 1.964 -3.674 -16.811 156 HE2 MET 19 HE2 MET 19 0.565 -3.120 -15.894 157 HE3 MET 19 HE3 MET 19 0.345 -3.767 -17.518 158 H ILE 20 HN ILE 20 3.363 -4.427 -10.985 159 HA ILE 20 HA ILE 20 1.980 -1.945 -10.089 160 HB ILE 20 HB ILE 20 1.765 -3.983 -8.793 161 HG12 ILE 20 HG12 ILE 20 3.737 -2.151 -7.406 162 HG13 ILE 20 HG11 ILE 20 2.013 -1.799 -7.581 163 HG21 ILE 20 HG21 ILE 20 4.712 -4.086 -9.181 164 HG22 ILE 20 HG22 ILE 20 3.526 -5.391 -9.222 165 HG23 ILE 20 HG23 ILE 20 4.060 -4.735 -7.675 166 HD11 ILE 20 HD11 ILE 20 3.174 -4.238 -6.197 167 HD12 ILE 20 HD12 ILE 20 1.458 -3.870 -6.363 168 HD13 ILE 20 HD13 ILE 20 2.491 -2.831 -5.384 169 H ALA 21 HN ALA 21 4.728 -2.671 -11.646 170 HA ALA 21 HA ALA 21 6.728 -1.268 -10.051 171 HB1 ALA 21 HB1 ALA 21 8.059 -1.785 -12.089 172 HB2 ALA 21 HB2 ALA 21 6.578 -2.334 -12.876 173 HB3 ALA 21 HB3 ALA 21 7.199 -3.193 -11.467 174 H MET 22 HN MET 22 6.318 -0.590 -13.482 175 HA MET 22 HA MET 22 6.804 2.189 -13.237 176 HB2 MET 22 HB2 MET 22 6.536 0.441 -15.273 177 HB3 MET 22 HB1 MET 22 4.948 1.204 -15.363 178 HG2 MET 22 HG2 MET 22 6.175 3.444 -15.302 179 HG3 MET 22 HG1 MET 22 7.655 2.528 -15.584 180 HE1 MET 22 HE1 MET 22 7.941 4.111 -17.745 181 HE2 MET 22 HE2 MET 22 6.405 4.859 -17.316 182 HE3 MET 22 HE3 MET 22 6.677 4.307 -18.966 183 H LEU 23 HN LEU 23 3.977 0.320 -12.616 184 HA LEU 23 HA LEU 23 1.895 2.245 -12.845 185 HB2 LEU 23 HB2 LEU 23 1.528 -0.132 -12.468 186 HB3 LEU 23 HB1 LEU 23 2.432 -0.075 -10.957 187 HG LEU 23 HG LEU 23 -0.128 -0.079 -10.781 188 HD11 LEU 23 HD11 LEU 23 0.490 2.321 -9.326 189 HD12 LEU 23 HD12 LEU 23 1.884 1.242 -9.283 190 HD13 LEU 23 HD13 LEU 23 0.314 0.676 -8.716 191 HD21 LEU 23 HD21 LEU 23 0.112 2.864 -11.365 192 HD22 LEU 23 HD22 LEU 23 -1.333 1.860 -11.316 193 HD23 LEU 23 HD23 LEU 23 -0.209 1.722 -12.668 194 H ILE 24 HN ILE 24 4.614 2.074 -10.751 195 HA ILE 24 HA ILE 24 3.373 3.906 -8.761 196 HB ILE 24 HB ILE 24 4.820 1.592 -8.547 197 HG12 ILE 24 HG12 ILE 24 4.885 3.833 -6.512 198 HG13 ILE 24 HG11 ILE 24 3.451 2.858 -6.838 199 HG21 ILE 24 HG21 ILE 24 7.019 2.311 -7.519 200 HG22 ILE 24 HG22 ILE 24 6.755 3.900 -8.233 201 HG23 ILE 24 HG23 ILE 24 6.928 2.484 -9.270 202 HD11 ILE 24 HD11 ILE 24 6.126 1.676 -6.047 203 HD12 ILE 24 HD12 ILE 24 4.579 0.837 -6.151 204 HD13 ILE 24 HD13 ILE 24 4.846 2.043 -4.892 205 H GLU 25 HN GLU 25 6.369 3.526 -10.683 206 HA GLU 25 HA GLU 25 7.627 5.961 -10.083 207 HB2 GLU 25 HB2 GLU 25 7.556 3.989 -12.294 208 HB3 GLU 25 HB1 GLU 25 8.218 5.570 -12.717 209 HG2 GLU 25 HG2 GLU 25 9.253 4.793 -10.154 210 HG3 GLU 25 HG1 GLU 25 9.507 3.471 -11.295 211 H ASP 26 HN ASP 26 4.778 5.385 -12.034 212 HA ASP 26 HA ASP 26 4.865 8.012 -13.341 213 HB2 ASP 26 HB2 ASP 26 2.964 7.204 -14.490 214 HB3 ASP 26 HB1 ASP 26 3.876 5.732 -14.148 215 H THR 27 HN THR 27 2.880 6.467 -10.776 216 HA THR 27 HA THR 27 1.277 8.758 -10.198 217 HB THR 27 HB THR 27 1.898 7.099 -7.904 218 HG1 THR 27 HG1 THR 27 1.916 5.192 -8.783 219 HG21 THR 27 HG21 THR 27 -0.364 7.103 -7.707 220 HG22 THR 27 HG22 THR 27 -0.609 6.703 -9.408 221 HG23 THR 27 HG23 THR 27 -0.276 8.369 -8.930 222 H LEU 28 HN LEU 28 4.181 7.492 -8.528 223 HA LEU 28 HA LEU 28 4.561 9.655 -6.736 224 HB2 LEU 28 HB2 LEU 28 5.863 7.763 -6.331 225 HB3 LEU 28 HB1 LEU 28 6.221 7.522 -8.037 226 HG LEU 28 HG LEU 28 8.144 8.336 -6.512 227 HD11 LEU 28 HD11 LEU 28 8.201 10.337 -8.562 228 HD12 LEU 28 HD12 LEU 28 7.449 8.881 -9.214 229 HD13 LEU 28 HD13 LEU 28 9.062 8.799 -8.504 230 HD21 LEU 28 HD21 LEU 28 6.238 10.391 -6.026 231 HD22 LEU 28 HD22 LEU 28 7.560 11.118 -6.938 232 HD23 LEU 28 HD23 LEU 28 7.889 10.286 -5.419 233 H CYS 29 HN CYS 29 5.437 9.245 -10.142 234 HA CYS 29 HA CYS 29 7.186 11.445 -10.483 235 HB2 CYS 29 HB2 CYS 29 5.602 9.609 -12.056 236 HB3 CYS 29 HB1 CYS 29 5.507 11.224 -12.758 237 HG CYS 29 HG CYS 29 7.938 11.140 -13.342 238 H GLU 30 HN GLU 30 3.685 11.301 -10.161 239 HA GLU 30 HA GLU 30 3.353 14.142 -10.845 240 HB2 GLU 30 HB2 GLU 30 1.661 12.696 -11.668 241 HB3 GLU 30 HB1 GLU 30 1.554 11.824 -10.138 242 HG2 GLU 30 HG2 GLU 30 0.318 13.501 -9.109 243 HG3 GLU 30 HG1 GLU 30 0.955 14.762 -10.167 244 H LEU 31 HN LEU 31 2.988 11.993 -8.017 245 HA LEU 31 HA LEU 31 2.246 14.183 -6.228 246 HB2 LEU 31 HB2 LEU 31 3.106 11.303 -5.795 247 HB3 LEU 31 HB1 LEU 31 2.473 12.353 -4.524 248 HG LEU 31 HG LEU 31 0.762 12.349 -6.890 249 HD11 LEU 31 HD11 LEU 31 1.176 9.739 -5.398 250 HD12 LEU 31 HD12 LEU 31 1.625 10.033 -7.078 251 HD13 LEU 31 HD13 LEU 31 -0.073 10.048 -6.603 252 HD21 LEU 31 HD21 LEU 31 0.535 12.858 -4.206 253 HD22 LEU 31 HD22 LEU 31 -0.184 11.252 -4.313 254 HD23 LEU 31 HD23 LEU 31 -0.837 12.577 -5.278 255 H GLY 32 HN GLY 32 5.208 12.312 -6.898 256 HA2 GLY 32 HA2 GLY 32 7.451 12.936 -6.473 257 HA3 GLY 32 HA1 GLY 32 6.857 14.486 -5.857 258 H HIS 33 HN HIS 33 5.545 11.489 -4.688 259 HA HIS 33 HA HIS 33 5.852 12.043 -1.945 260 HB2 HIS 33 HB2 HIS 33 5.388 9.669 -3.695 261 HB3 HIS 33 HB1 HIS 33 5.758 9.364 -1.994 262 HD1 HIS 33 HD1 HIS 33 2.889 9.107 -3.561 263 HD2 HIS 33 HD2 HIS 33 4.045 12.036 -0.829 264 HE1 HIS 33 HE1 HIS 33 0.754 10.085 -2.613 265 H GLU 34 HN GLU 34 7.141 9.818 -0.794 266 HA GLU 34 HA GLU 34 9.940 10.679 -0.950 267 HB2 GLU 34 HB2 GLU 34 8.823 10.092 1.150 268 HB3 GLU 34 HB1 GLU 34 8.509 8.464 0.550 269 HG2 GLU 34 HG2 GLU 34 11.085 8.328 0.218 270 HG3 GLU 34 HG1 GLU 34 11.143 9.713 1.309 271 H VAL 35 HN VAL 35 9.381 7.267 -0.575 272 HA VAL 35 HA VAL 35 10.555 6.714 -3.274 273 HB VAL 35 HB VAL 35 11.990 5.044 -2.140 274 HG11 VAL 35 HG11 VAL 35 13.339 6.870 -2.145 275 HG12 VAL 35 HG12 VAL 35 12.973 6.965 -0.423 276 HG13 VAL 35 HG13 VAL 35 12.051 7.931 -1.574 277 HG21 VAL 35 HG21 VAL 35 10.157 5.672 0.064 278 HG22 VAL 35 HG22 VAL 35 11.851 5.693 0.554 279 HG23 VAL 35 HG23 VAL 35 11.164 4.245 -0.183 280 H ALA 36 HN ALA 36 9.004 5.509 -4.330 281 HA ALA 36 HA ALA 36 7.052 3.924 -2.823 282 HB1 ALA 36 HB1 ALA 36 6.994 5.448 -5.077 283 HB2 ALA 36 HB2 ALA 36 5.800 4.202 -4.716 284 HB3 ALA 36 HB3 ALA 36 7.159 3.839 -5.780 285 H ALA 37 HN ALA 37 6.688 1.631 -3.260 286 HA ALA 37 HA ALA 37 9.135 0.204 -4.276 287 HB1 ALA 37 HB1 ALA 37 8.694 0.118 -1.795 288 HB2 ALA 37 HB2 ALA 37 8.678 -1.469 -2.564 289 HB3 ALA 37 HB3 ALA 37 7.159 -0.677 -2.145 290 H THR 38 HN THR 38 8.698 -1.784 -5.430 291 HA THR 38 HA THR 38 5.864 -2.286 -6.190 292 HB THR 38 HB THR 38 6.335 -2.051 -8.485 293 HG1 THR 38 HG1 THR 38 8.242 -2.432 -9.304 294 HG21 THR 38 HG21 THR 38 6.570 0.086 -6.942 295 HG22 THR 38 HG22 THR 38 6.925 0.187 -8.666 296 HG23 THR 38 HG23 THR 38 8.241 0.040 -7.502 297 H ALA 39 HN ALA 39 5.887 -4.307 -7.745 298 HA ALA 39 HA ALA 39 6.169 -6.648 -7.869 299 HB1 ALA 39 HB1 ALA 39 8.213 -6.849 -8.781 300 HB2 ALA 39 HB2 ALA 39 8.923 -6.821 -7.167 301 HB3 ALA 39 HB3 ALA 39 8.702 -5.316 -8.059 302 H SER 40 HN SER 40 6.697 -8.556 -6.487 303 HA SER 40 HA SER 40 6.329 -7.866 -3.636 304 HB2 SER 40 HB2 SER 40 5.679 -10.169 -3.441 305 HB3 SER 40 HB1 SER 40 4.934 -9.524 -4.891 306 HG SER 40 HG SER 40 6.025 -11.611 -5.120 307 H ARG 41 HN ARG 41 8.151 -7.557 -2.456 308 HA ARG 41 HA ARG 41 10.491 -9.328 -2.962 309 HB2 ARG 41 HB2 ARG 41 10.385 -6.710 -3.529 310 HB3 ARG 41 HB1 ARG 41 10.775 -6.589 -1.810 311 HG2 ARG 41 HG2 ARG 41 12.904 -6.689 -2.766 312 HG3 ARG 41 HG1 ARG 41 12.606 -8.382 -2.368 313 HD2 ARG 41 HD2 ARG 41 12.948 -8.878 -4.553 314 HD3 ARG 41 HD1 ARG 41 11.472 -7.970 -4.935 315 HE ARG 41 HE ARG 41 14.130 -6.614 -4.671 316 HH11 ARG 41 HH21 ARG 41 12.672 -7.791 -7.255 317 HH12 ARG 41 HH22 ARG 41 12.193 -6.294 -7.985 318 HH21 ARG 41 HH11 ARG 41 12.822 -4.404 -5.147 319 HH22 ARG 41 HH12 ARG 41 12.279 -4.375 -6.792 320 H MET 42 HN MET 42 10.693 -10.679 -1.198 321 HA MET 42 HA MET 42 9.416 -10.395 1.302 322 HB2 MET 42 HB2 MET 42 12.082 -11.716 0.708 323 HB3 MET 42 HB1 MET 42 10.945 -12.160 1.982 324 HG2 MET 42 HG2 MET 42 9.827 -13.491 0.558 325 HG3 MET 42 HG1 MET 42 9.553 -12.129 -0.529 326 HE1 MET 42 HE1 MET 42 11.321 -15.707 -1.764 327 HE2 MET 42 HE2 MET 42 9.893 -14.806 -2.267 328 HE3 MET 42 HE3 MET 42 10.093 -15.248 -0.575 329 H GLN 43 HN GLN 43 12.500 -9.098 0.168 330 HA GLN 43 HA GLN 43 13.466 -8.252 2.768 331 HB2 GLN 43 HB2 GLN 43 14.845 -8.691 0.734 332 HB3 GLN 43 HB1 GLN 43 14.114 -7.283 -0.035 333 HG2 GLN 43 HG2 GLN 43 14.942 -5.898 1.906 334 HG3 GLN 43 HG1 GLN 43 15.838 -7.315 2.454 335 HE21 GLN 43 HE21 GLN 43 16.162 -4.531 0.602 336 HE22 GLN 43 HE22 GLN 43 17.463 -5.012 -0.377 337 H GLU 44 HN GLU 44 12.442 -6.219 -0.006 338 HA GLU 44 HA GLU 44 12.085 -3.842 1.514 339 HB2 GLU 44 HB2 GLU 44 11.272 -4.924 -1.150 340 HB3 GLU 44 HB1 GLU 44 10.486 -3.447 -0.596 341 HG2 GLU 44 HG2 GLU 44 12.448 -2.221 -0.629 342 HG3 GLU 44 HG1 GLU 44 13.461 -3.638 -0.355 343 H ALA 45 HN ALA 45 9.648 -6.196 0.350 344 HA ALA 45 HA ALA 45 7.285 -5.124 1.298 345 HB1 ALA 45 HB1 ALA 45 8.205 -7.993 1.682 346 HB2 ALA 45 HB2 ALA 45 7.675 -7.325 0.139 347 HB3 ALA 45 HB3 ALA 45 6.542 -7.439 1.485 348 H LEU 46 HN LEU 46 9.549 -7.087 3.247 349 HA LEU 46 HA LEU 46 8.271 -7.020 5.737 350 HB2 LEU 46 HB2 LEU 46 10.266 -8.311 5.250 351 HB3 LEU 46 HB1 LEU 46 11.191 -6.848 4.931 352 HG LEU 46 HG LEU 46 9.869 -7.192 7.602 353 HD11 LEU 46 HD11 LEU 46 12.685 -8.079 7.369 354 HD12 LEU 46 HD12 LEU 46 11.491 -9.179 6.678 355 HD13 LEU 46 HD13 LEU 46 11.384 -8.715 8.376 356 HD21 LEU 46 HD21 LEU 46 11.879 -5.483 6.307 357 HD22 LEU 46 HD22 LEU 46 12.390 -6.085 7.884 358 HD23 LEU 46 HD23 LEU 46 10.891 -5.168 7.734 359 H ASP 47 HN ASP 47 10.369 -4.584 4.232 360 HA ASP 47 HA ASP 47 10.528 -2.798 6.459 361 HB2 ASP 47 HB2 ASP 47 11.461 -3.032 3.812 362 HB3 ASP 47 HB1 ASP 47 10.600 -1.492 3.873 363 H ILE 48 HN ILE 48 7.972 -3.365 4.125 364 HA ILE 48 HA ILE 48 6.686 -0.788 4.593 365 HB ILE 48 HB ILE 48 5.264 -1.423 2.888 366 HG12 ILE 48 HG12 ILE 48 5.462 -4.183 4.077 367 HG13 ILE 48 HG11 ILE 48 4.040 -3.166 3.900 368 HG21 ILE 48 HG21 ILE 48 7.316 -3.542 2.352 369 HG22 ILE 48 HG22 ILE 48 7.744 -1.831 2.305 370 HG23 ILE 48 HG23 ILE 48 6.512 -2.462 1.212 371 HD11 ILE 48 HD11 ILE 48 5.025 -3.510 1.286 372 HD12 ILE 48 HD12 ILE 48 3.590 -4.258 1.983 373 HD13 ILE 48 HD13 ILE 48 5.138 -5.101 2.038 374 H ALA 49 HN ALA 49 6.515 -4.021 5.952 375 HA ALA 49 HA ALA 49 3.958 -3.384 7.260 376 HB1 ALA 49 HB1 ALA 49 5.531 -5.720 6.531 377 HB2 ALA 49 HB2 ALA 49 3.800 -5.600 6.845 378 HB3 ALA 49 HB3 ALA 49 4.924 -5.841 8.182 379 H ARG 50 HN ARG 50 6.997 -4.775 8.523 380 HA ARG 50 HA ARG 50 6.484 -4.108 11.235 381 HB2 ARG 50 HB2 ARG 50 9.043 -4.645 9.703 382 HB3 ARG 50 HB1 ARG 50 8.908 -4.671 11.466 383 HG2 ARG 50 HG2 ARG 50 7.653 -6.612 11.483 384 HG3 ARG 50 HG1 ARG 50 6.953 -6.298 9.895 385 HD2 ARG 50 HD2 ARG 50 8.488 -7.705 9.001 386 HD3 ARG 50 HD1 ARG 50 9.763 -6.581 9.515 387 HE ARG 50 HE ARG 50 8.673 -8.369 11.603 388 HH11 ARG 50 HH11 ARG 50 11.401 -6.775 11.048 389 HH12 ARG 50 HH12 ARG 50 12.484 -8.126 11.040 390 HH21 ARG 50 HH21 ARG 50 9.953 -10.491 10.853 391 HH22 ARG 50 HH22 ARG 50 11.664 -10.232 10.930 392 H LYS 51 HN LYS 51 7.223 -1.936 8.738 393 HA LYS 51 HA LYS 51 8.942 -0.152 10.272 394 HB2 LYS 51 HB2 LYS 51 9.114 -0.221 7.878 395 HB3 LYS 51 HB1 LYS 51 7.383 0.058 7.688 396 HG2 LYS 51 HG2 LYS 51 8.722 2.117 7.280 397 HG3 LYS 51 HG1 LYS 51 7.611 2.301 8.638 398 HD2 LYS 51 HD2 LYS 51 9.773 3.197 9.291 399 HD3 LYS 51 HD1 LYS 51 9.496 1.704 10.186 400 HE2 LYS 51 HE2 LYS 51 10.752 0.636 8.075 401 HE3 LYS 51 HE1 LYS 51 11.459 2.262 7.999 402 HZ1 LYS 51 HZ1 LYS 51 11.557 0.300 10.197 403 HZ2 LYS 51 HZ2 LYS 51 11.664 1.959 10.548 404 HZ3 LYS 51 HZ3 LYS 51 12.815 1.226 9.536 405 H GLY 52 HN GLY 52 5.512 -0.088 9.237 406 HA2 GLY 52 HA2 GLY 52 3.670 0.849 10.392 407 HA3 GLY 52 HA1 GLY 52 4.769 1.318 11.686 408 H GLN 53 HN GLN 53 6.571 2.975 10.420 409 HA GLN 53 HA GLN 53 4.869 5.325 9.860 410 HB2 GLN 53 HB2 GLN 53 6.949 6.537 10.195 411 HB3 GLN 53 HB1 GLN 53 6.823 5.296 11.442 412 HG2 GLN 53 HG2 GLN 53 8.592 4.111 10.622 413 HG3 GLN 53 HG1 GLN 53 8.165 4.440 8.943 414 HE21 GLN 53 HE21 GLN 53 10.814 4.741 9.393 415 HE22 GLN 53 HE22 GLN 53 11.253 6.373 9.536 416 H PHE 54 HN PHE 54 5.090 3.175 7.812 417 HA PHE 54 HA PHE 54 6.626 4.535 5.649 418 HB2 PHE 54 HB2 PHE 54 6.392 2.387 4.536 419 HB3 PHE 54 HB1 PHE 54 6.925 2.111 6.183 420 HD1 PHE 54 HD2 PHE 54 5.453 1.178 7.858 421 HD2 PHE 54 HD1 PHE 54 4.067 1.790 3.838 422 HE1 PHE 54 HE2 PHE 54 3.482 -0.245 8.316 423 HE2 PHE 54 HE1 PHE 54 2.109 0.355 4.313 424 HZ PHE 54 HZ PHE 54 1.817 -0.668 6.536 425 H ASP 55 HN ASP 55 3.778 5.039 6.904 426 HA ASP 55 HA ASP 55 1.803 6.013 6.145 427 HB2 ASP 55 HB2 ASP 55 3.819 6.337 4.092 428 HB3 ASP 55 HB1 ASP 55 2.202 6.234 3.394 429 H ILE 56 HN ILE 56 2.645 4.095 3.232 430 HA ILE 56 HA ILE 56 0.263 2.356 3.802 431 HB ILE 56 HB ILE 56 0.887 3.897 1.270 432 HG12 ILE 56 HG12 ILE 56 -1.402 4.193 3.242 433 HG13 ILE 56 HG11 ILE 56 0.013 5.245 3.193 434 HG21 ILE 56 HG21 ILE 56 -1.116 1.780 1.961 435 HG22 ILE 56 HG22 ILE 56 -0.195 2.003 0.474 436 HG23 ILE 56 HG23 ILE 56 -1.570 3.052 0.826 437 HD11 ILE 56 HD11 ILE 56 -2.324 5.625 1.748 438 HD12 ILE 56 HD12 ILE 56 -1.231 4.908 0.564 439 HD13 ILE 56 HD13 ILE 56 -0.772 6.389 1.405 440 H ALA 57 HN ALA 57 0.282 0.273 2.713 441 HA ALA 57 HA ALA 57 2.608 -0.414 0.984 442 HB1 ALA 57 HB1 ALA 57 2.154 -1.495 3.769 443 HB2 ALA 57 HB2 ALA 57 3.581 -0.651 3.165 444 HB3 ALA 57 HB3 ALA 57 3.202 -2.272 2.587 445 H ILE 58 HN ILE 58 2.058 -2.217 -0.372 446 HA ILE 58 HA ILE 58 -0.384 -3.727 0.454 447 HB ILE 58 HB ILE 58 0.109 -2.317 -2.176 448 HG12 ILE 58 HG12 ILE 58 -2.210 -1.355 -1.380 449 HG13 ILE 58 HG11 ILE 58 -1.666 -1.885 0.213 450 HG21 ILE 58 HG21 ILE 58 -2.466 -3.220 -2.253 451 HG22 ILE 58 HG22 ILE 58 -1.676 -4.548 -1.402 452 HG23 ILE 58 HG23 ILE 58 -1.108 -4.063 -3.000 453 HD11 ILE 58 HD11 ILE 58 0.532 -0.579 -1.032 454 HD12 ILE 58 HD12 ILE 58 -0.389 -0.045 0.375 455 HD13 ILE 58 HD13 ILE 58 -0.881 0.455 -1.243 456 H ILE 59 HN ILE 59 0.774 -5.638 0.770 457 HA ILE 59 HA ILE 59 2.416 -6.835 -1.372 458 HB ILE 59 HB ILE 59 1.440 -7.811 1.354 459 HG12 ILE 59 HG12 ILE 59 4.262 -7.064 0.617 460 HG13 ILE 59 HG11 ILE 59 3.112 -5.815 1.095 461 HG21 ILE 59 HG21 ILE 59 2.486 -9.280 -0.820 462 HG22 ILE 59 HG22 ILE 59 2.300 -9.828 0.847 463 HG23 ILE 59 HG23 ILE 59 3.813 -9.092 0.324 464 HD11 ILE 59 HD11 ILE 59 4.573 -6.940 2.941 465 HD12 ILE 59 HD12 ILE 59 3.449 -8.287 2.775 466 HD13 ILE 59 HD13 ILE 59 2.855 -6.698 3.255 467 H ASP 60 HN ASP 60 0.307 -6.437 -2.684 468 HA ASP 60 HA ASP 60 -1.995 -8.060 -2.148 469 HB2 ASP 60 HB2 ASP 60 -2.817 -6.636 -3.714 470 HB3 ASP 60 HB1 ASP 60 -1.209 -5.932 -3.803 471 H VAL 61 HN VAL 61 -2.852 -9.546 -3.888 472 HA VAL 61 HA VAL 61 -2.668 -11.343 -5.374 473 HB VAL 61 HB VAL 61 -0.419 -9.973 -5.818 474 HG11 VAL 61 HG11 VAL 61 0.721 -12.710 -5.312 475 HG12 VAL 61 HG12 VAL 61 0.698 -11.529 -4.004 476 HG13 VAL 61 HG13 VAL 61 1.562 -11.172 -5.493 477 HG21 VAL 61 HG21 VAL 61 -1.325 -10.961 -7.681 478 HG22 VAL 61 HG22 VAL 61 -1.543 -12.517 -6.881 479 HG23 VAL 61 HG23 VAL 61 0.054 -12.038 -7.458 480 H ASN 62 HN ASN 62 -3.653 -12.360 -3.432 481 HA ASN 62 HA ASN 62 -1.760 -14.188 -2.012 482 HB2 ASN 62 HB2 ASN 62 -4.160 -12.669 -1.299 483 HB3 ASN 62 HB1 ASN 62 -4.224 -14.345 -0.758 484 HD21 ASN 62 HD21 ASN 62 -1.477 -12.015 -1.036 485 HD22 ASN 62 HD22 ASN 62 -0.972 -12.194 0.574 486 H LEU 63 HN LEU 63 -2.129 -15.103 -4.466 487 HA LEU 63 HA LEU 63 -4.092 -17.331 -4.139 488 HB2 LEU 63 HB2 LEU 63 -4.223 -15.101 -5.928 489 HB3 LEU 63 HB1 LEU 63 -3.899 -16.544 -6.890 490 HG LEU 63 HG LEU 63 -5.784 -17.679 -5.625 491 HD11 LEU 63 HD11 LEU 63 -5.601 -15.354 -4.068 492 HD12 LEU 63 HD12 LEU 63 -6.843 -16.600 -3.953 493 HD13 LEU 63 HD13 LEU 63 -7.107 -15.180 -4.965 494 HD21 LEU 63 HD21 LEU 63 -6.270 -16.980 -7.846 495 HD22 LEU 63 HD22 LEU 63 -6.250 -15.274 -7.398 496 HD23 LEU 63 HD23 LEU 63 -7.577 -16.309 -6.871 497 H ASP 64 HN ASP 64 -3.458 -19.252 -5.326 498 HA ASP 64 HA ASP 64 -1.905 -20.758 -6.286 499 HB2 ASP 64 HB2 ASP 64 -1.611 -18.234 -7.526 500 HB3 ASP 64 HB1 ASP 64 0.028 -18.801 -7.190 501 H GLY 65 HN GLY 65 -1.453 -19.140 -3.561 502 HA2 GLY 65 HA2 GLY 65 0.551 -20.646 -2.441 503 HA3 GLY 65 HA1 GLY 65 1.445 -19.361 -3.247 504 H GLU 66 HN GLU 66 -0.947 -17.521 -2.680 505 HA GLU 66 HA GLU 66 -1.476 -15.952 -0.997 506 HB2 GLU 66 HB2 GLU 66 -2.309 -18.131 -0.029 507 HB3 GLU 66 HB1 GLU 66 -0.764 -18.281 0.810 508 HG2 GLU 66 HG2 GLU 66 -1.163 -16.294 2.090 509 HG3 GLU 66 HG1 GLU 66 -2.551 -15.854 1.095 510 HA PRO 67 HA PRO 67 3.145 -15.647 -0.184 511 HB2 PRO 67 HB2 PRO 67 3.747 -13.801 -2.111 512 HB3 PRO 67 HB1 PRO 67 3.790 -15.551 -2.400 513 HG2 PRO 67 HG2 PRO 67 1.732 -13.558 -3.171 514 HG3 PRO 67 HG1 PRO 67 2.286 -15.003 -4.029 515 HD2 PRO 67 HD2 PRO 67 -0.053 -14.836 -2.581 516 HD3 PRO 67 HD1 PRO 67 0.794 -16.349 -2.965 517 H SER 68 HN SER 68 1.939 -14.580 1.704 518 HA SER 68 HA SER 68 2.138 -11.590 1.487 519 HB2 SER 68 HB2 SER 68 -0.119 -13.195 1.908 520 HB3 SER 68 HB1 SER 68 0.294 -12.591 3.510 521 HG SER 68 HG SER 68 -0.885 -10.984 2.669 522 H TYR 69 HN TYR 69 3.466 -14.288 2.860 523 HA TYR 69 HA TYR 69 4.766 -14.722 4.763 524 HB2 TYR 69 HB2 TYR 69 5.435 -11.984 5.387 525 HB3 TYR 69 HB1 TYR 69 6.457 -13.235 4.703 526 HD1 TYR 69 HD1 TYR 69 5.942 -13.769 2.133 527 HD2 TYR 69 HD2 TYR 69 5.047 -10.071 4.118 528 HE1 TYR 69 HE1 TYR 69 5.927 -12.594 -0.044 529 HE2 TYR 69 HE2 TYR 69 5.034 -8.894 1.943 530 HH TYR 69 HH TYR 69 5.594 -10.686 -1.104 531 HA PRO 70 HA PRO 70 2.557 -13.924 8.419 532 HB2 PRO 70 HB2 PRO 70 4.517 -13.730 10.316 533 HB3 PRO 70 HB1 PRO 70 4.067 -15.265 9.545 534 HG2 PRO 70 HG2 PRO 70 6.379 -13.476 8.994 535 HG3 PRO 70 HG1 PRO 70 6.294 -15.244 8.992 536 HD2 PRO 70 HD2 PRO 70 6.271 -13.714 6.724 537 HD3 PRO 70 HD1 PRO 70 5.543 -15.332 6.836 538 H VAL 71 HN VAL 71 4.556 -11.549 7.071 539 HA VAL 71 HA VAL 71 3.991 -9.613 9.227 540 HB VAL 71 HB VAL 71 5.552 -8.175 8.081 541 HG11 VAL 71 HG11 VAL 71 7.347 -10.247 7.684 542 HG12 VAL 71 HG12 VAL 71 6.158 -10.951 8.781 543 HG13 VAL 71 HG13 VAL 71 7.002 -9.470 9.229 544 HG21 VAL 71 HG21 VAL 71 4.967 -8.554 5.767 545 HG22 VAL 71 HG22 VAL 71 5.408 -10.254 5.892 546 HG23 VAL 71 HG23 VAL 71 6.657 -9.016 5.971 547 H ALA 72 HN ALA 72 3.481 -9.666 5.602 548 HA ALA 72 HA ALA 72 1.781 -7.446 5.451 549 HB1 ALA 72 HB1 ALA 72 0.877 -9.814 3.966 550 HB2 ALA 72 HB2 ALA 72 2.619 -9.558 3.860 551 HB3 ALA 72 HB3 ALA 72 1.512 -8.287 3.354 552 H ASP 73 HN ASP 73 1.084 -10.808 6.388 553 HA ASP 73 HA ASP 73 -1.725 -10.548 6.829 554 HB2 ASP 73 HB2 ASP 73 0.530 -12.271 7.680 555 HB3 ASP 73 HB1 ASP 73 -0.947 -12.389 8.626 556 H ILE 74 HN ILE 74 1.032 -10.288 9.052 557 HA ILE 74 HA ILE 74 -0.304 -9.508 11.423 558 HB ILE 74 HB ILE 74 2.387 -9.165 10.166 559 HG12 ILE 74 HG12 ILE 74 3.135 -10.322 12.097 560 HG13 ILE 74 HG11 ILE 74 1.728 -9.837 13.039 561 HG21 ILE 74 HG21 ILE 74 3.097 -7.777 12.215 562 HG22 ILE 74 HG22 ILE 74 1.386 -7.388 12.396 563 HG23 ILE 74 HG23 ILE 74 2.245 -6.925 10.927 564 HD11 ILE 74 HD11 ILE 74 1.994 -12.271 11.839 565 HD12 ILE 74 HD12 ILE 74 1.112 -11.384 10.598 566 HD13 ILE 74 HD13 ILE 74 0.442 -11.527 12.222 567 H LEU 75 HN LEU 75 0.914 -7.599 8.725 568 HA LEU 75 HA LEU 75 0.187 -5.009 9.578 569 HB2 LEU 75 HB2 LEU 75 1.586 -6.012 7.607 570 HB3 LEU 75 HB1 LEU 75 0.061 -5.981 6.726 571 HG LEU 75 HG LEU 75 -0.149 -3.542 7.388 572 HD11 LEU 75 HD11 LEU 75 2.533 -4.246 8.541 573 HD12 LEU 75 HD12 LEU 75 1.260 -3.231 9.218 574 HD13 LEU 75 HD13 LEU 75 2.275 -2.618 7.912 575 HD21 LEU 75 HD21 LEU 75 2.275 -3.284 5.931 576 HD22 LEU 75 HD22 LEU 75 0.634 -3.310 5.284 577 HD23 LEU 75 HD23 LEU 75 1.549 -4.811 5.430 578 H ALA 76 HN ALA 76 -1.724 -7.597 8.142 579 HA ALA 76 HA ALA 76 -4.062 -5.843 7.771 580 HB1 ALA 76 HB1 ALA 76 -3.098 -8.506 6.927 581 HB2 ALA 76 HB2 ALA 76 -4.047 -7.323 6.028 582 HB3 ALA 76 HB3 ALA 76 -4.839 -8.398 7.180 583 H GLU 77 HN GLU 77 -2.742 -8.036 10.097 584 HA GLU 77 HA GLU 77 -5.194 -8.881 11.357 585 HB2 GLU 77 HB2 GLU 77 -2.261 -8.808 11.975 586 HB3 GLU 77 HB1 GLU 77 -3.390 -9.206 13.271 587 HG2 GLU 77 HG2 GLU 77 -3.669 -10.592 10.625 588 HG3 GLU 77 HG1 GLU 77 -2.406 -11.120 11.739 589 H ARG 78 HN ARG 78 -2.729 -6.483 12.369 590 HA ARG 78 HA ARG 78 -4.669 -5.268 14.229 591 HB2 ARG 78 HB2 ARG 78 -2.657 -4.048 15.008 592 HB3 ARG 78 HB1 ARG 78 -2.373 -5.787 14.962 593 HG2 ARG 78 HG2 ARG 78 -1.653 -5.005 12.413 594 HG3 ARG 78 HG1 ARG 78 -1.113 -3.644 13.394 595 HD2 ARG 78 HD2 ARG 78 0.655 -5.396 13.202 596 HD3 ARG 78 HD1 ARG 78 0.116 -5.205 14.882 597 HE ARG 78 HE ARG 78 -1.284 -7.236 13.233 598 HH11 ARG 78 HH11 ARG 78 1.410 -6.649 15.258 599 HH12 ARG 78 HH12 ARG 78 1.229 -8.113 16.167 600 HH21 ARG 78 HH21 ARG 78 -1.712 -9.049 14.593 601 HH22 ARG 78 HH22 ARG 78 -0.533 -9.469 15.790 602 H ASN 79 HN ASN 79 -3.028 -4.641 11.207 603 HA ASN 79 HA ASN 79 -3.213 -2.906 9.643 604 HB2 ASN 79 HB2 ASN 79 -5.863 -2.466 11.025 605 HB3 ASN 79 HB1 ASN 79 -5.475 -2.231 9.326 606 HD21 ASN 79 HD21 ASN 79 -6.174 -4.678 11.783 607 HD22 ASN 79 HD22 ASN 79 -6.346 -5.973 10.698 608 H VAL 80 HN VAL 80 -2.108 -1.062 9.764 609 HA VAL 80 HA VAL 80 -2.642 0.897 11.978 610 HB VAL 80 HB VAL 80 -0.410 -0.608 11.384 611 HG11 VAL 80 HG11 VAL 80 -0.127 2.021 9.936 612 HG12 VAL 80 HG12 VAL 80 0.194 0.400 9.338 613 HG13 VAL 80 HG13 VAL 80 1.266 1.128 10.531 614 HG21 VAL 80 HG21 VAL 80 0.070 0.316 13.363 615 HG22 VAL 80 HG22 VAL 80 -1.078 1.622 13.071 616 HG23 VAL 80 HG23 VAL 80 0.591 1.776 12.521 617 HA PRO 81 HA PRO 81 -3.422 3.930 8.811 618 HB2 PRO 81 HB2 PRO 81 -1.346 5.732 8.656 619 HB3 PRO 81 HB1 PRO 81 -2.584 5.772 9.930 620 HG2 PRO 81 HG2 PRO 81 0.158 4.579 10.001 621 HG3 PRO 81 HG1 PRO 81 -0.657 5.586 11.212 622 HD2 PRO 81 HD2 PRO 81 -0.519 2.949 11.511 623 HD3 PRO 81 HD1 PRO 81 -2.000 3.823 11.963 624 H PHE 82 HN PHE 82 -3.395 3.110 6.806 625 HA PHE 82 HA PHE 82 -1.185 3.110 4.986 626 HB2 PHE 82 HB2 PHE 82 -0.445 0.847 5.125 627 HB3 PHE 82 HB1 PHE 82 -0.474 1.422 6.787 628 HD1 PHE 82 HD1 PHE 82 -3.757 1.332 6.612 629 HD2 PHE 82 HD2 PHE 82 -0.548 -1.473 6.061 630 HE1 PHE 82 HE1 PHE 82 -5.271 -0.513 7.249 631 HE2 PHE 82 HE2 PHE 82 -2.074 -3.325 6.702 632 HZ PHE 82 HZ PHE 82 -4.430 -2.845 7.291 633 H ILE 83 HN ILE 83 -1.866 0.529 3.874 634 HA ILE 83 HA ILE 83 -4.703 0.348 3.355 635 HB ILE 83 HB ILE 83 -2.942 2.031 1.768 636 HG12 ILE 83 HG12 ILE 83 -5.910 1.683 1.441 637 HG13 ILE 83 HG11 ILE 83 -5.241 2.531 2.832 638 HG21 ILE 83 HG21 ILE 83 -2.844 0.209 0.191 639 HG22 ILE 83 HG22 ILE 83 -4.052 1.334 -0.431 640 HG23 ILE 83 HG23 ILE 83 -4.561 -0.135 0.403 641 HD11 ILE 83 HD11 ILE 83 -3.885 3.883 1.069 642 HD12 ILE 83 HD12 ILE 83 -5.594 4.267 1.284 643 HD13 ILE 83 HD13 ILE 83 -5.077 3.274 -0.080 644 H PHE 84 HN PHE 84 -5.060 -1.602 2.078 645 HA PHE 84 HA PHE 84 -2.666 -3.110 1.227 646 HB2 PHE 84 HB2 PHE 84 -3.250 -3.251 3.772 647 HB3 PHE 84 HB1 PHE 84 -4.551 -4.310 3.232 648 HD1 PHE 84 HD1 PHE 84 -0.860 -3.788 2.800 649 HD2 PHE 84 HD2 PHE 84 -4.125 -6.574 2.916 650 HE1 PHE 84 HE1 PHE 84 0.741 -5.676 2.602 651 HE2 PHE 84 HE2 PHE 84 -2.522 -8.456 2.723 652 HZ PHE 84 HZ PHE 84 -0.102 -8.009 2.557 653 H ALA 85 HN ALA 85 -3.379 -5.288 0.321 654 HA ALA 85 HA ALA 85 -6.132 -5.752 -0.308 655 HB1 ALA 85 HB1 ALA 85 -4.407 -4.115 -2.146 656 HB2 ALA 85 HB2 ALA 85 -6.071 -3.820 -1.647 657 HB3 ALA 85 HB3 ALA 85 -5.710 -5.091 -2.816 658 H THR 86 HN THR 86 -6.170 -7.952 -0.757 659 HA THR 86 HA THR 86 -4.426 -9.209 -2.693 660 HB THR 86 HB THR 86 -2.639 -9.565 -1.403 661 HG1 THR 86 HG1 THR 86 -4.202 -10.922 0.478 662 HG21 THR 86 HG21 THR 86 -2.903 -7.755 0.067 663 HG22 THR 86 HG22 THR 86 -2.743 -9.141 1.142 664 HG23 THR 86 HG23 THR 86 -4.337 -8.464 0.813 665 H GLY 87 HN GLY 87 -5.482 -10.993 -3.380 666 HA2 GLY 87 HA2 GLY 87 -7.252 -12.545 -3.528 667 HA3 GLY 87 HA1 GLY 87 -6.452 -13.171 -2.090 668 H TYR 88 HN TYR 88 -7.959 -10.024 -1.770 669 HA TYR 88 HA TYR 88 -10.622 -10.664 -1.227 670 HB2 TYR 88 HB2 TYR 88 -10.509 -10.984 1.280 671 HB3 TYR 88 HB1 TYR 88 -9.861 -12.330 0.360 672 HD1 TYR 88 HD2 TYR 88 -8.907 -9.231 2.176 673 HD2 TYR 88 HD1 TYR 88 -7.601 -13.029 0.666 674 HE1 TYR 88 HE2 TYR 88 -6.761 -8.965 3.385 675 HE2 TYR 88 HE1 TYR 88 -5.450 -12.769 1.883 676 HH TYR 88 HH TYR 88 -4.751 -11.351 4.097 677 H GLY 89 HN GLY 89 -7.759 -8.773 -0.416 678 HA2 GLY 89 HA2 GLY 89 -7.866 -6.338 -0.441 679 HA3 GLY 89 HA1 GLY 89 -9.579 -6.435 -0.071 680 H SER 90 HN SER 90 -10.005 -7.548 2.125 681 HA SER 90 HA SER 90 -7.974 -7.357 4.178 682 HB2 SER 90 HB2 SER 90 -9.779 -5.040 3.558 683 HB3 SER 90 HB1 SER 90 -9.271 -5.314 5.222 684 HG SER 90 HG SER 90 -7.759 -4.659 2.951 685 H LYS 91 HN LYS 91 -8.806 -8.197 6.161 686 HA LYS 91 HA LYS 91 -11.595 -9.196 6.036 687 HB2 LYS 91 HB2 LYS 91 -10.699 -10.671 7.958 688 HB3 LYS 91 HB1 LYS 91 -10.043 -10.971 6.353 689 HG2 LYS 91 HG2 LYS 91 -8.262 -10.923 8.064 690 HG3 LYS 91 HG1 LYS 91 -8.054 -9.621 6.899 691 HD2 LYS 91 HD2 LYS 91 -8.901 -7.989 8.428 692 HD3 LYS 91 HD1 LYS 91 -9.522 -9.235 9.513 693 HE2 LYS 91 HE2 LYS 91 -6.573 -9.112 8.901 694 HE3 LYS 91 HE1 LYS 91 -7.281 -8.086 10.166 695 HZ1 LYS 91 HZ1 LYS 91 -8.459 -10.240 10.873 696 HZ2 LYS 91 HZ2 LYS 91 -6.824 -10.043 11.293 697 HZ3 LYS 91 HZ3 LYS 91 -7.254 -11.031 9.979 698 H GLY 92 HN GLY 92 -11.154 -6.469 6.624 699 HA2 GLY 92 HA2 GLY 92 -12.605 -5.306 8.308 700 HA3 GLY 92 HA1 GLY 92 -11.870 -6.352 9.527 701 H LEU 93 HN LEU 93 -9.764 -5.327 7.041 702 HA LEU 93 HA LEU 93 -7.740 -4.229 8.517 703 HB2 LEU 93 HB2 LEU 93 -7.473 -4.491 6.184 704 HB3 LEU 93 HB1 LEU 93 -8.919 -3.551 5.825 705 HG LEU 93 HG LEU 93 -6.827 -2.087 7.316 706 HD11 LEU 93 HD11 LEU 93 -6.424 -2.954 4.434 707 HD12 LEU 93 HD12 LEU 93 -5.406 -3.401 5.802 708 HD13 LEU 93 HD13 LEU 93 -5.470 -1.724 5.261 709 HD21 LEU 93 HD21 LEU 93 -7.441 -0.535 5.248 710 HD22 LEU 93 HD22 LEU 93 -8.566 -0.720 6.593 711 HD23 LEU 93 HD23 LEU 93 -8.808 -1.639 5.108 712 H ASP 94 HN ASP 94 -7.683 -2.606 10.002 713 HA ASP 94 HA ASP 94 -9.699 -0.398 9.799 714 HB2 ASP 94 HB2 ASP 94 -9.079 -0.112 12.245 715 HB3 ASP 94 HB1 ASP 94 -9.820 -1.666 11.861 716 H THR 95 HN THR 95 -8.890 1.800 10.077 717 HA THR 95 HA THR 95 -6.101 2.415 10.425 718 HB THR 95 HB THR 95 -7.160 1.629 7.757 719 HG1 THR 95 HG1 THR 95 -4.474 1.774 8.518 720 HG21 THR 95 HG21 THR 95 -5.105 3.098 6.880 721 HG22 THR 95 HG22 THR 95 -5.633 4.140 8.195 722 HG23 THR 95 HG23 THR 95 -6.749 3.703 6.905 723 H ARG 96 HN ARG 96 -5.699 4.752 10.070 724 HA ARG 96 HA ARG 96 -7.849 6.448 10.858 725 HB2 ARG 96 HB2 ARG 96 -5.130 6.906 9.611 726 HB3 ARG 96 HB1 ARG 96 -6.148 8.235 10.168 727 HG2 ARG 96 HG2 ARG 96 -6.269 6.935 12.408 728 HG3 ARG 96 HG1 ARG 96 -4.877 6.040 11.798 729 HD2 ARG 96 HD2 ARG 96 -3.631 8.150 11.496 730 HD3 ARG 96 HD1 ARG 96 -5.031 9.061 12.098 731 HE ARG 96 HE ARG 96 -4.127 6.909 13.879 732 HH11 ARG 96 HH21 ARG 96 -1.889 8.945 13.502 733 HH12 ARG 96 HH22 ARG 96 -2.212 10.042 14.803 734 HH21 ARG 96 HH11 ARG 96 -5.434 8.888 15.335 735 HH22 ARG 96 HH12 ARG 96 -4.212 10.005 15.844 736 H TYR 97 HN TYR 97 -7.304 5.138 7.803 737 HA TYR 97 HA TYR 97 -8.055 7.378 6.143 738 HB2 TYR 97 HB2 TYR 97 -7.982 4.367 5.774 739 HB3 TYR 97 HB1 TYR 97 -8.310 5.489 4.463 740 HD1 TYR 97 HD2 TYR 97 -6.112 7.030 6.799 741 HD2 TYR 97 HD1 TYR 97 -6.161 4.172 3.584 742 HE1 TYR 97 HE2 TYR 97 -3.688 7.372 6.456 743 HE2 TYR 97 HE1 TYR 97 -3.736 4.526 3.245 744 HH TYR 97 HH TYR 97 -2.091 6.927 4.061 745 H SER 98 HN SER 98 -9.782 4.318 6.708 746 HA SER 98 HA SER 98 -12.165 4.838 7.837 747 HB2 SER 98 HB2 SER 98 -11.978 6.349 5.263 748 HB3 SER 98 HB1 SER 98 -13.539 5.640 5.682 749 HG SER 98 HG SER 98 -12.910 6.677 7.871 750 H ASN 99 HN ASN 99 -10.432 2.829 6.038 751 HA ASN 99 HA ASN 99 -10.877 0.751 5.006 752 HB2 ASN 99 HB2 ASN 99 -13.603 1.216 6.261 753 HB3 ASN 99 HB1 ASN 99 -12.880 -0.342 5.855 754 HD21 ASN 99 HD21 ASN 99 -10.181 0.977 6.820 755 HD22 ASN 99 HD22 ASN 99 -10.263 0.798 8.503 756 H ILE 100 HN ILE 100 -10.774 1.914 2.909 757 HA ILE 100 HA ILE 100 -13.435 1.892 1.547 758 HB ILE 100 HB ILE 100 -11.450 4.006 0.806 759 HG12 ILE 100 HG12 ILE 100 -12.799 5.432 2.579 760 HG13 ILE 100 HG11 ILE 100 -12.994 3.874 3.383 761 HG21 ILE 100 HG21 ILE 100 -13.926 5.131 0.909 762 HG22 ILE 100 HG22 ILE 100 -14.335 3.450 0.571 763 HG23 ILE 100 HG23 ILE 100 -13.262 4.331 -0.516 764 HD11 ILE 100 HD11 ILE 100 -10.947 5.293 4.049 765 HD12 ILE 100 HD12 ILE 100 -10.283 4.852 2.478 766 HD13 ILE 100 HD13 ILE 100 -10.655 3.600 3.660 767 HA PRO 101 HA PRO 101 -10.234 1.013 -1.761 768 HB2 PRO 101 HB2 PRO 101 -7.595 1.578 -1.373 769 HB3 PRO 101 HB1 PRO 101 -8.784 2.797 -1.857 770 HG2 PRO 101 HG2 PRO 101 -7.414 2.467 0.690 771 HG3 PRO 101 HG1 PRO 101 -8.283 3.868 0.057 772 HD2 PRO 101 HD2 PRO 101 -9.185 1.882 1.951 773 HD3 PRO 101 HD1 PRO 101 -9.993 3.368 1.432 774 H LEU 102 HN LEU 102 -10.795 -1.059 0.003 775 HA LEU 102 HA LEU 102 -8.181 -2.489 0.330 776 HB2 LEU 102 HB2 LEU 102 -10.825 -3.401 1.461 777 HB3 LEU 102 HB1 LEU 102 -9.206 -3.718 2.071 778 HG LEU 102 HG LEU 102 -9.968 -2.129 3.582 779 HD11 LEU 102 HD11 LEU 102 -8.003 -1.335 1.810 780 HD12 LEU 102 HD12 LEU 102 -8.396 -0.527 3.327 781 HD13 LEU 102 HD13 LEU 102 -9.103 0.042 1.815 782 HD21 LEU 102 HD21 LEU 102 -11.057 -0.017 1.989 783 HD22 LEU 102 HD22 LEU 102 -11.881 -1.026 3.177 784 HD23 LEU 102 HD23 LEU 102 -11.811 -1.530 1.489 785 H LEU 103 HN LEU 103 -7.777 -4.278 -0.974 786 HA LEU 103 HA LEU 103 -9.700 -6.140 -1.891 787 HB2 LEU 103 HB2 LEU 103 -10.011 -5.354 -4.266 788 HB3 LEU 103 HB1 LEU 103 -10.820 -4.389 -3.058 789 HG LEU 103 HG LEU 103 -9.849 -2.573 -3.946 790 HD11 LEU 103 HD11 LEU 103 -7.290 -2.365 -3.831 791 HD12 LEU 103 HD12 LEU 103 -7.316 -3.914 -3.021 792 HD13 LEU 103 HD13 LEU 103 -8.152 -2.538 -2.314 793 HD21 LEU 103 HD21 LEU 103 -9.424 -4.438 -5.866 794 HD22 LEU 103 HD22 LEU 103 -7.770 -3.911 -5.562 795 HD23 LEU 103 HD23 LEU 103 -8.995 -2.736 -6.040 796 H THR 104 HN THR 104 -8.337 -5.836 -4.797 797 HA THR 104 HA THR 104 -5.849 -7.239 -3.956 798 HB THR 104 HB THR 104 -7.671 -8.675 -4.864 799 HG1 THR 104 HG1 THR 104 -6.354 -9.652 -6.460 800 HG21 THR 104 HG21 THR 104 -7.314 -6.844 -7.242 801 HG22 THR 104 HG22 THR 104 -8.796 -7.180 -6.346 802 HG23 THR 104 HG23 THR 104 -8.080 -8.428 -7.367 803 H LYS 105 HN LYS 105 -3.984 -6.912 -5.255 804 HA LYS 105 HA LYS 105 -2.472 -5.374 -6.288 805 HB2 LYS 105 HB2 LYS 105 -2.721 -5.718 -8.682 806 HB3 LYS 105 HB1 LYS 105 -3.109 -7.187 -7.797 807 HG2 LYS 105 HG2 LYS 105 -5.499 -5.634 -8.075 808 HG3 LYS 105 HG1 LYS 105 -4.742 -5.797 -9.654 809 HD2 LYS 105 HD2 LYS 105 -4.848 -8.228 -7.925 810 HD3 LYS 105 HD1 LYS 105 -6.351 -7.703 -8.680 811 HE2 LYS 105 HE2 LYS 105 -5.684 -8.553 -10.671 812 HE3 LYS 105 HE1 LYS 105 -4.207 -7.572 -10.620 813 HZ1 LYS 105 HZ1 LYS 105 -4.586 -10.336 -9.911 814 HZ2 LYS 105 HZ2 LYS 105 -3.770 -9.451 -8.713 815 HZ3 LYS 105 HZ3 LYS 105 -3.159 -9.508 -10.296 816 HA PRO 106 HA PRO 106 -3.781 -1.209 -6.315 817 HB2 PRO 106 HB2 PRO 106 -1.645 -0.183 -7.712 818 HB3 PRO 106 HB1 PRO 106 -1.583 -0.627 -5.993 819 HG2 PRO 106 HG2 PRO 106 -0.739 -2.220 -8.380 820 HG3 PRO 106 HG1 PRO 106 0.121 -1.950 -6.855 821 HD2 PRO 106 HD2 PRO 106 -1.192 -4.222 -7.238 822 HD3 PRO 106 HD1 PRO 106 -1.265 -3.405 -5.662 823 H PHE 107 HN PHE 107 -5.316 -2.520 -8.074 824 HA PHE 107 HA PHE 107 -5.463 -0.689 -10.384 825 HB2 PHE 107 HB2 PHE 107 -5.538 -3.681 -10.803 826 HB3 PHE 107 HB1 PHE 107 -5.299 -2.416 -12.006 827 HD1 PHE 107 HD2 PHE 107 -3.721 -4.287 -9.242 828 HD2 PHE 107 HD1 PHE 107 -3.123 -1.424 -12.361 829 HE1 PHE 107 HE2 PHE 107 -1.270 -4.540 -8.996 830 HE2 PHE 107 HE1 PHE 107 -0.670 -1.653 -12.112 831 HZ PHE 107 HZ PHE 107 0.260 -3.214 -10.426 832 H LEU 108 HN LEU 108 -7.617 -1.403 -11.643 833 HA LEU 108 HA LEU 108 -9.952 -1.779 -11.507 834 HB2 LEU 108 HB2 LEU 108 -8.583 -3.762 -9.813 835 HB3 LEU 108 HB1 LEU 108 -10.261 -3.483 -9.350 836 HG LEU 108 HG LEU 108 -10.968 -3.890 -11.685 837 HD11 LEU 108 HD11 LEU 108 -9.286 -4.791 -13.282 838 HD12 LEU 108 HD12 LEU 108 -8.017 -4.469 -12.100 839 HD13 LEU 108 HD13 LEU 108 -8.924 -3.131 -12.807 840 HD21 LEU 108 HD21 LEU 108 -9.160 -6.121 -10.704 841 HD22 LEU 108 HD22 LEU 108 -10.623 -6.283 -11.675 842 HD23 LEU 108 HD23 LEU 108 -10.735 -5.765 -9.993 843 H ASP 109 HN ASP 109 -9.260 -2.190 -8.044 844 HA ASP 109 HA ASP 109 -10.599 0.439 -7.510 845 HB2 ASP 109 HB2 ASP 109 -11.532 -2.244 -7.048 846 HB3 ASP 109 HB1 ASP 109 -11.294 -1.443 -5.495 847 H SER 110 HN SER 110 -7.775 -1.148 -7.183 848 HA SER 110 HA SER 110 -7.323 -0.633 -4.308 849 HB2 SER 110 HB2 SER 110 -6.445 -2.645 -5.445 850 HB3 SER 110 HB1 SER 110 -5.535 -1.627 -6.543 851 HG SER 110 HG SER 110 -4.395 -2.470 -4.627 852 H GLU 111 HN GLU 111 -4.986 0.080 -6.874 853 HA GLU 111 HA GLU 111 -3.923 2.392 -5.671 854 HB2 GLU 111 HB2 GLU 111 -3.276 0.923 -7.757 855 HB3 GLU 111 HB1 GLU 111 -4.198 2.129 -8.654 856 HG2 GLU 111 HG2 GLU 111 -1.978 2.957 -8.673 857 HG3 GLU 111 HG1 GLU 111 -2.779 3.882 -7.401 858 H LEU 112 HN LEU 112 -6.771 2.045 -7.733 859 HA LEU 112 HA LEU 112 -7.209 4.868 -8.189 860 HB2 LEU 112 HB2 LEU 112 -9.171 2.551 -8.140 861 HB3 LEU 112 HB1 LEU 112 -9.370 4.078 -9.002 862 HG LEU 112 HG LEU 112 -6.948 2.387 -9.520 863 HD11 LEU 112 HD11 LEU 112 -8.474 0.713 -10.006 864 HD12 LEU 112 HD12 LEU 112 -8.482 1.582 -11.541 865 HD13 LEU 112 HD13 LEU 112 -9.770 1.855 -10.366 866 HD21 LEU 112 HD21 LEU 112 -8.569 4.037 -11.458 867 HD22 LEU 112 HD22 LEU 112 -6.863 3.598 -11.546 868 HD23 LEU 112 HD23 LEU 112 -7.404 4.800 -10.375 869 H GLU 113 HN GLU 113 -9.222 2.646 -6.223 870 HA GLU 113 HA GLU 113 -10.525 4.629 -4.701 871 HB2 GLU 113 HB2 GLU 113 -10.607 1.926 -4.881 872 HB3 GLU 113 HB1 GLU 113 -9.746 2.092 -3.343 873 HG2 GLU 113 HG2 GLU 113 -11.495 3.363 -2.380 874 HG3 GLU 113 HG1 GLU 113 -12.257 3.649 -3.946 875 H ALA 114 HN ALA 114 -7.266 3.432 -4.514 876 HA ALA 114 HA ALA 114 -6.642 4.089 -1.798 877 HB1 ALA 114 HB1 ALA 114 -5.144 3.815 -4.396 878 HB2 ALA 114 HB2 ALA 114 -5.091 2.771 -2.976 879 HB3 ALA 114 HB3 ALA 114 -4.292 4.342 -2.946 880 H VAL 115 HN VAL 115 -6.548 5.994 -4.790 881 HA VAL 115 HA VAL 115 -5.869 8.434 -3.192 882 HB VAL 115 HB VAL 115 -5.834 8.011 -6.191 883 HG11 VAL 115 HG11 VAL 115 -5.220 10.204 -4.374 884 HG12 VAL 115 HG12 VAL 115 -5.364 10.217 -6.132 885 HG13 VAL 115 HG13 VAL 115 -3.832 9.782 -5.376 886 HG21 VAL 115 HG21 VAL 115 -3.970 6.761 -5.985 887 HG22 VAL 115 HG22 VAL 115 -4.226 6.726 -4.240 888 HG23 VAL 115 HG23 VAL 115 -3.225 7.987 -4.959 889 H LEU 116 HN LEU 116 -8.441 6.895 -4.868 890 HA LEU 116 HA LEU 116 -9.880 9.373 -5.555 891 HB2 LEU 116 HB2 LEU 116 -10.109 6.436 -5.915 892 HB3 LEU 116 HB1 LEU 116 -11.626 7.341 -5.917 893 HG LEU 116 HG LEU 116 -10.672 8.878 -7.604 894 HD11 LEU 116 HD11 LEU 116 -8.412 8.926 -7.702 895 HD12 LEU 116 HD12 LEU 116 -8.543 7.463 -8.678 896 HD13 LEU 116 HD13 LEU 116 -8.272 7.342 -6.940 897 HD21 LEU 116 HD21 LEU 116 -11.604 6.264 -7.953 898 HD22 LEU 116 HD22 LEU 116 -10.184 6.361 -8.993 899 HD23 LEU 116 HD23 LEU 116 -11.508 7.507 -9.201 900 H VAL 117 HN VAL 117 -9.520 7.434 -2.805 901 HA VAL 117 HA VAL 117 -12.217 7.816 -1.711 902 HB VAL 117 HB VAL 117 -10.877 5.828 -1.227 903 HG11 VAL 117 HG11 VAL 117 -8.937 7.147 0.520 904 HG12 VAL 117 HG12 VAL 117 -8.755 7.636 -1.163 905 HG13 VAL 117 HG13 VAL 117 -8.668 5.930 -0.727 906 HG21 VAL 117 HG21 VAL 117 -12.407 6.844 0.530 907 HG22 VAL 117 HG22 VAL 117 -10.965 7.551 1.260 908 HG23 VAL 117 HG23 VAL 117 -11.135 5.800 1.159 909 H GLN 118 HN GLN 118 -9.271 9.623 -1.791 910 HA GLN 118 HA GLN 118 -10.088 11.240 0.582 911 HB2 GLN 118 HB2 GLN 118 -7.536 10.767 -0.957 912 HB3 GLN 118 HB1 GLN 118 -7.683 12.133 0.148 913 HG2 GLN 118 HG2 GLN 118 -8.255 10.606 1.989 914 HG3 GLN 118 HG1 GLN 118 -8.157 9.229 0.892 915 HE21 GLN 118 HE21 GLN 118 -5.899 9.169 -0.355 916 HE22 GLN 118 HE22 GLN 118 -4.534 9.492 0.600 917 H ILE 119 HN ILE 119 -11.733 11.751 -1.566 918 HA ILE 119 HA ILE 119 -10.675 14.364 -2.590 919 HB ILE 119 HB ILE 119 -12.276 13.776 -4.570 920 HG12 ILE 119 HG12 ILE 119 -12.410 11.287 -4.919 921 HG13 ILE 119 HG11 ILE 119 -11.858 11.073 -3.260 922 HG21 ILE 119 HG21 ILE 119 -9.587 12.599 -3.946 923 HG22 ILE 119 HG22 ILE 119 -10.014 13.840 -5.124 924 HG23 ILE 119 HG23 ILE 119 -10.397 12.148 -5.445 925 HD11 ILE 119 HD11 ILE 119 -13.838 11.815 -2.356 926 HD12 ILE 119 HD12 ILE 119 -14.462 11.181 -3.879 927 HD13 ILE 119 HD13 ILE 119 -14.161 12.910 -3.701 928 H SER 120 HN SER 120 -13.064 12.783 -0.774 929 HA SER 120 HA SER 120 -14.461 15.169 -0.072 930 HB2 SER 120 HB2 SER 120 -16.570 14.757 -1.363 931 HB3 SER 120 HB1 SER 120 -15.205 15.155 -2.397 932 HG SER 120 HG SER 120 -16.128 13.370 -3.283 933 H LYS 121 HN LYS 121 -16.984 14.300 0.511 934 HA LYS 121 HA LYS 121 -17.198 11.593 1.423 935 HB2 LYS 121 HB2 LYS 121 -15.386 13.128 2.858 936 HB3 LYS 121 HB1 LYS 121 -16.848 13.186 3.850 937 HG2 LYS 121 HG2 LYS 121 -17.026 10.703 3.613 938 HG3 LYS 121 HG1 LYS 121 -15.454 10.717 2.814 939 HD2 LYS 121 HD2 LYS 121 -14.420 10.743 4.815 940 HD3 LYS 121 HD1 LYS 121 -15.250 12.244 5.228 941 HE2 LYS 121 HE2 LYS 121 -16.033 10.818 6.917 942 HE3 LYS 121 HE1 LYS 121 -17.294 10.600 5.687 943 HZ1 LYS 121 HZ1 LYS 121 -15.456 8.888 4.819 944 HZ2 LYS 121 HZ2 LYS 121 -16.705 8.441 5.880 945 HZ3 LYS 121 HZ3 LYS 121 -15.157 8.793 6.486 946 H GLU 122 HN GLU 122 -18.741 13.765 0.279 947 HA GLU 122 HA GLU 122 -21.329 13.454 1.015 948 HB2 GLU 122 HB2 GLU 122 -21.679 15.329 2.736 949 HB3 GLU 122 HB1 GLU 122 -20.897 13.880 3.357 950 HG2 GLU 122 HG2 GLU 122 -18.845 14.925 3.585 951 HG3 GLU 122 HG1 GLU 122 -19.146 16.035 2.248 952 H VAL 123 HN VAL 123 -18.728 15.569 0.226 953 HA VAL 123 HA VAL 123 -20.579 17.495 -1.123 954 HB VAL 123 HB VAL 123 -18.431 18.864 -1.204 955 HG11 VAL 123 HG11 VAL 123 -18.563 18.512 1.623 956 HG12 VAL 123 HG12 VAL 123 -20.184 18.260 0.977 957 HG13 VAL 123 HG13 VAL 123 -19.328 19.766 0.649 958 HG21 VAL 123 HG21 VAL 123 -17.363 16.980 0.869 959 HG22 VAL 123 HG22 VAL 123 -16.491 18.100 -0.177 960 HG23 VAL 123 HG23 VAL 123 -17.118 16.588 -0.833 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 7.594 14.682 20.682 2 H2 GLY 1 HT2 GLY 1 8.766 15.573 21.529 3 H3 GLY 1 HT3 GLY 1 8.750 15.584 19.830 4 HA2 GLY 1 HA2 GLY 1 6.223 16.402 20.663 5 HA3 GLY 1 HA1 GLY 1 7.413 17.304 21.604 6 H SER 2 HN SER 2 8.205 19.106 20.630 7 HA SER 2 HA SER 2 7.441 20.012 18.064 8 HB2 SER 2 HB2 SER 2 8.911 20.895 20.267 9 HB3 SER 2 HB1 SER 2 10.077 20.925 18.947 10 HG SER 2 HG SER 2 8.326 22.029 17.750 11 H HIS 3 HN HIS 3 8.322 19.716 16.003 12 HA HIS 3 HA HIS 3 9.668 18.757 14.309 13 HB2 HIS 3 HB2 HIS 3 11.521 19.964 14.957 14 HB3 HIS 3 HB1 HIS 3 11.406 19.431 16.631 15 HD1 HIS 3 HD1 HIS 3 11.834 17.340 13.465 16 HD2 HIS 3 HD2 HIS 3 13.817 18.132 17.046 17 HE1 HIS 3 HE1 HIS 3 13.842 15.799 13.528 18 H MET 4 HN MET 4 9.073 16.675 13.769 19 HA MET 4 HA MET 4 10.389 14.392 14.904 20 HB2 MET 4 HB2 MET 4 8.629 15.406 16.650 21 HB3 MET 4 HB1 MET 4 7.514 14.414 15.710 22 HG2 MET 4 HG2 MET 4 9.041 12.463 16.041 23 HG3 MET 4 HG1 MET 4 10.038 13.466 17.094 24 HE1 MET 4 HE1 MET 4 8.963 11.102 19.252 25 HE2 MET 4 HE2 MET 4 9.017 10.892 17.505 26 HE3 MET 4 HE3 MET 4 7.514 10.594 18.374 27 H THR 5 HN THR 5 9.689 15.287 12.236 28 HA THR 5 HA THR 5 7.946 12.997 11.413 29 HB THR 5 HB THR 5 6.950 14.446 9.737 30 HG1 THR 5 HG1 THR 5 8.698 16.423 10.775 31 HG21 THR 5 HG21 THR 5 6.689 14.831 12.530 32 HG22 THR 5 HG22 THR 5 5.502 15.203 11.280 33 HG23 THR 5 HG23 THR 5 6.652 16.435 11.798 34 H GLU 6 HN GLU 6 8.555 12.077 9.364 35 HA GLU 6 HA GLU 6 10.623 13.104 7.684 36 HB2 GLU 6 HB2 GLU 6 12.530 11.816 8.456 37 HB3 GLU 6 HB1 GLU 6 11.884 12.698 9.838 38 HG2 GLU 6 HG2 GLU 6 10.606 10.680 10.511 39 HG3 GLU 6 HG1 GLU 6 11.316 9.800 9.156 40 H ARG 7 HN ARG 7 8.076 11.538 7.545 41 HA ARG 7 HA ARG 7 8.692 9.763 5.408 42 HB2 ARG 7 HB2 ARG 7 9.503 8.816 7.929 43 HB3 ARG 7 HB1 ARG 7 8.030 7.920 7.558 44 HG2 ARG 7 HG2 ARG 7 9.357 6.579 6.312 45 HG3 ARG 7 HG1 ARG 7 9.370 7.901 5.145 46 HD2 ARG 7 HD2 ARG 7 11.494 8.611 5.763 47 HD3 ARG 7 HD1 ARG 7 11.333 7.985 7.417 48 HE ARG 7 HE ARG 7 11.373 6.024 5.180 49 HH11 ARG 7 HH11 ARG 7 12.033 6.537 8.407 50 HH12 ARG 7 HH12 ARG 7 13.567 5.733 8.414 51 HH21 ARG 7 HH21 ARG 7 13.711 5.396 4.969 52 HH22 ARG 7 HH22 ARG 7 14.517 5.088 6.470 53 H ARG 8 HN ARG 8 6.531 11.598 6.167 54 HA ARG 8 HA ARG 8 4.226 9.769 6.643 55 HB2 ARG 8 HB2 ARG 8 4.278 12.790 6.416 56 HB3 ARG 8 HB1 ARG 8 3.044 11.793 7.186 57 HG2 ARG 8 HG2 ARG 8 5.270 10.985 8.540 58 HG3 ARG 8 HG1 ARG 8 5.670 12.672 8.221 59 HD2 ARG 8 HD2 ARG 8 3.564 13.405 9.244 60 HD3 ARG 8 HD1 ARG 8 3.083 11.716 9.505 61 HE ARG 8 HE ARG 8 5.197 13.156 10.981 62 HH11 ARG 8 HH11 ARG 8 2.909 10.755 11.150 63 HH12 ARG 8 HH12 ARG 8 3.879 9.626 12.036 64 HH21 ARG 8 HH21 ARG 8 6.805 11.454 11.679 65 HH22 ARG 8 HH22 ARG 8 6.087 10.019 12.332 66 H LEU 9 HN LEU 9 5.898 10.931 3.985 67 HA LEU 9 HA LEU 9 3.436 10.854 2.309 68 HB2 LEU 9 HB2 LEU 9 5.221 12.967 2.797 69 HB3 LEU 9 HB1 LEU 9 5.620 12.386 1.179 70 HG LEU 9 HG LEU 9 2.942 12.379 0.966 71 HD11 LEU 9 HD11 LEU 9 2.025 14.366 2.103 72 HD12 LEU 9 HD12 LEU 9 3.571 14.623 2.910 73 HD13 LEU 9 HD13 LEU 9 2.613 13.190 3.277 74 HD21 LEU 9 HD21 LEU 9 5.103 14.012 0.119 75 HD22 LEU 9 HD22 LEU 9 3.799 15.104 0.587 76 HD23 LEU 9 HD23 LEU 9 3.514 13.861 -0.631 77 H ARG 10 HN ARG 10 4.141 8.468 2.198 78 HA ARG 10 HA ARG 10 6.047 8.142 -0.081 79 HB2 ARG 10 HB2 ARG 10 6.437 7.417 2.649 80 HB3 ARG 10 HB1 ARG 10 6.237 5.924 1.730 81 HG2 ARG 10 HG2 ARG 10 8.618 6.752 1.841 82 HG3 ARG 10 HG1 ARG 10 8.000 6.552 0.200 83 HD2 ARG 10 HD2 ARG 10 7.905 8.837 -0.191 84 HD3 ARG 10 HD1 ARG 10 7.643 9.216 1.523 85 HE ARG 10 HE ARG 10 10.277 8.392 0.369 86 HH11 ARG 10 HH21 ARG 10 9.033 8.270 3.363 87 HH12 ARG 10 HH22 ARG 10 10.027 9.496 4.077 88 HH21 ARG 10 HH11 ARG 10 11.249 10.640 1.038 89 HH22 ARG 10 HH12 ARG 10 11.284 10.843 2.757 90 H VAL 11 HN VAL 11 5.814 5.870 -1.035 91 HA VAL 11 HA VAL 11 3.151 4.625 -0.586 92 HB VAL 11 HB VAL 11 2.637 6.286 -2.222 93 HG11 VAL 11 HG11 VAL 11 4.931 6.957 -2.747 94 HG12 VAL 11 HG12 VAL 11 4.062 6.607 -4.243 95 HG13 VAL 11 HG13 VAL 11 5.205 5.432 -3.589 96 HG21 VAL 11 HG21 VAL 11 2.352 3.643 -2.788 97 HG22 VAL 11 HG22 VAL 11 3.300 4.158 -4.182 98 HG23 VAL 11 HG23 VAL 11 1.750 4.925 -3.838 99 H LEU 12 HN LEU 12 4.418 2.777 0.118 100 HA LEU 12 HA LEU 12 6.256 1.557 -1.876 101 HB2 LEU 12 HB2 LEU 12 5.570 0.660 0.935 102 HB3 LEU 12 HB1 LEU 12 7.021 0.278 0.007 103 HG LEU 12 HG LEU 12 6.288 3.123 0.725 104 HD11 LEU 12 HD11 LEU 12 8.036 2.852 2.539 105 HD12 LEU 12 HD12 LEU 12 7.904 1.111 2.302 106 HD13 LEU 12 HD13 LEU 12 6.504 2.035 2.846 107 HD21 LEU 12 HD21 LEU 12 8.611 3.546 0.205 108 HD22 LEU 12 HD22 LEU 12 7.934 2.603 -1.122 109 HD23 LEU 12 HD23 LEU 12 8.950 1.820 0.088 110 H VAL 13 HN VAL 13 4.747 0.669 -3.407 111 HA VAL 13 HA VAL 13 2.802 -1.356 -2.362 112 HB VAL 13 HB VAL 13 3.060 -0.148 -5.131 113 HG11 VAL 13 HG11 VAL 13 1.561 -2.279 -4.197 114 HG12 VAL 13 HG12 VAL 13 1.199 -1.330 -5.639 115 HG13 VAL 13 HG13 VAL 13 0.428 -0.932 -4.104 116 HG21 VAL 13 HG21 VAL 13 0.846 0.959 -3.762 117 HG22 VAL 13 HG22 VAL 13 2.311 1.797 -4.272 118 HG23 VAL 13 HG23 VAL 13 2.216 1.089 -2.659 119 H VAL 14 HN VAL 14 3.087 -3.543 -2.994 120 HA VAL 14 HA VAL 14 5.183 -4.074 -5.029 121 HB VAL 14 HB VAL 14 6.490 -5.325 -3.489 122 HG11 VAL 14 HG11 VAL 14 7.111 -3.707 -1.848 123 HG12 VAL 14 HG12 VAL 14 5.500 -2.988 -1.863 124 HG13 VAL 14 HG13 VAL 14 6.561 -2.808 -3.261 125 HG21 VAL 14 HG21 VAL 14 4.661 -6.513 -2.382 126 HG22 VAL 14 HG22 VAL 14 4.181 -5.024 -1.568 127 HG23 VAL 14 HG23 VAL 14 5.724 -5.782 -1.180 128 H GLU 15 HN GLU 15 4.637 -5.729 -6.314 129 HA GLU 15 HA GLU 15 3.082 -8.022 -5.300 130 HB2 GLU 15 HB2 GLU 15 1.339 -7.799 -6.920 131 HB3 GLU 15 HB1 GLU 15 1.482 -6.233 -6.122 132 HG2 GLU 15 HG2 GLU 15 2.296 -5.210 -8.006 133 HG3 GLU 15 HG1 GLU 15 3.106 -6.667 -8.587 134 H ASP 16 HN ASP 16 3.253 -9.859 -6.790 135 HA ASP 16 HA ASP 16 5.838 -10.234 -7.866 136 HB2 ASP 16 HB2 ASP 16 4.849 -12.320 -8.694 137 HB3 ASP 16 HB1 ASP 16 4.310 -11.946 -7.054 138 H GLU 17 HN GLU 17 4.532 -7.880 -9.385 139 HA GLU 17 HA GLU 17 5.367 -8.858 -12.027 140 HB2 GLU 17 HB2 GLU 17 3.256 -8.590 -13.113 141 HB3 GLU 17 HB1 GLU 17 2.937 -9.529 -11.657 142 HG2 GLU 17 HG2 GLU 17 2.609 -7.066 -10.644 143 HG3 GLU 17 HG1 GLU 17 2.159 -6.739 -12.319 144 H SER 18 HN SER 18 5.134 -6.996 -13.700 145 HA SER 18 HA SER 18 6.166 -4.538 -12.429 146 HB2 SER 18 HB2 SER 18 7.134 -4.197 -14.500 147 HB3 SER 18 HB1 SER 18 6.888 -5.938 -14.595 148 HG SER 18 HG SER 18 5.222 -3.876 -15.615 149 H MET 19 HN MET 19 3.107 -5.644 -13.500 150 HA MET 19 HA MET 19 1.986 -3.309 -14.688 151 HB2 MET 19 HB2 MET 19 0.511 -5.078 -12.729 152 HB3 MET 19 HB1 MET 19 -0.106 -4.321 -14.197 153 HG2 MET 19 HG2 MET 19 2.077 -5.938 -14.973 154 HG3 MET 19 HG1 MET 19 1.089 -6.906 -13.879 155 HE1 MET 19 HE1 MET 19 -2.299 -5.724 -15.054 156 HE2 MET 19 HE2 MET 19 -1.289 -6.391 -13.773 157 HE3 MET 19 HE3 MET 19 -2.009 -7.467 -14.968 158 H ILE 20 HN ILE 20 3.044 -3.957 -11.481 159 HA ILE 20 HA ILE 20 1.463 -1.750 -10.322 160 HB ILE 20 HB ILE 20 1.695 -3.844 -9.127 161 HG12 ILE 20 HG12 ILE 20 3.468 -1.733 -7.865 162 HG13 ILE 20 HG11 ILE 20 1.704 -1.776 -7.759 163 HG21 ILE 20 HG21 ILE 20 3.622 -4.853 -9.935 164 HG22 ILE 20 HG22 ILE 20 4.116 -4.375 -8.313 165 HG23 ILE 20 HG23 ILE 20 4.601 -3.406 -9.705 166 HD11 ILE 20 HD11 ILE 20 1.795 -3.938 -6.614 167 HD12 ILE 20 HD12 ILE 20 2.792 -2.770 -5.746 168 HD13 ILE 20 HD13 ILE 20 3.550 -3.977 -6.784 169 H ALA 21 HN ALA 21 4.401 -2.205 -11.890 170 HA ALA 21 HA ALA 21 6.118 -0.405 -10.421 171 HB1 ALA 21 HB1 ALA 21 7.416 -0.638 -12.583 172 HB2 ALA 21 HB2 ALA 21 6.053 -1.560 -13.216 173 HB3 ALA 21 HB3 ALA 21 6.960 -2.165 -11.830 174 H MET 22 HN MET 22 5.566 0.240 -13.843 175 HA MET 22 HA MET 22 5.611 3.028 -13.591 176 HB2 MET 22 HB2 MET 22 5.297 2.909 -15.853 177 HB3 MET 22 HB1 MET 22 5.347 1.167 -15.618 178 HG2 MET 22 HG2 MET 22 2.830 1.261 -15.249 179 HG3 MET 22 HG1 MET 22 2.896 2.935 -15.798 180 HE1 MET 22 HE1 MET 22 2.356 3.073 -18.981 181 HE2 MET 22 HE2 MET 22 4.114 3.205 -18.976 182 HE3 MET 22 HE3 MET 22 3.189 3.794 -17.598 183 H LEU 23 HN LEU 23 3.020 0.807 -12.901 184 HA LEU 23 HA LEU 23 0.793 2.597 -12.919 185 HB2 LEU 23 HB2 LEU 23 0.560 0.186 -12.762 186 HB3 LEU 23 HB1 LEU 23 1.533 0.140 -11.296 187 HG LEU 23 HG LEU 23 -1.018 -0.032 -11.021 188 HD11 LEU 23 HD11 LEU 23 1.006 1.159 -9.455 189 HD12 LEU 23 HD12 LEU 23 -0.533 0.508 -8.893 190 HD13 LEU 23 HD13 LEU 23 -0.400 2.214 -9.314 191 HD21 LEU 23 HD21 LEU 23 -1.244 2.888 -10.945 192 HD22 LEU 23 HD22 LEU 23 -2.348 1.694 -11.625 193 HD23 LEU 23 HD23 LEU 23 -0.977 2.264 -12.572 194 H ILE 24 HN ILE 24 3.592 2.471 -10.960 195 HA ILE 24 HA ILE 24 2.325 3.909 -8.694 196 HB ILE 24 HB ILE 24 4.092 1.892 -8.780 197 HG12 ILE 24 HG12 ILE 24 4.392 4.145 -6.775 198 HG13 ILE 24 HG11 ILE 24 3.009 3.051 -6.790 199 HG21 ILE 24 HG21 ILE 24 5.842 3.069 -9.973 200 HG22 ILE 24 HG22 ILE 24 6.376 2.801 -8.315 201 HG23 ILE 24 HG23 ILE 24 5.798 4.392 -8.807 202 HD11 ILE 24 HD11 ILE 24 5.909 2.380 -6.284 203 HD12 ILE 24 HD12 ILE 24 4.725 1.142 -6.703 204 HD13 ILE 24 HD13 ILE 24 4.523 2.095 -5.232 205 H GLU 25 HN GLU 25 4.949 4.268 -11.084 206 HA GLU 25 HA GLU 25 5.874 6.836 -10.389 207 HB2 GLU 25 HB2 GLU 25 5.565 5.275 -12.948 208 HB3 GLU 25 HB1 GLU 25 6.226 6.911 -12.991 209 HG2 GLU 25 HG2 GLU 25 7.374 5.185 -10.889 210 HG3 GLU 25 HG1 GLU 25 7.717 4.659 -12.540 211 H ASP 26 HN ASP 26 2.881 5.834 -11.885 212 HA ASP 26 HA ASP 26 2.163 8.567 -12.727 213 HB2 ASP 26 HB2 ASP 26 0.393 7.478 -13.815 214 HB3 ASP 26 HB1 ASP 26 1.596 6.189 -13.754 215 H THR 27 HN THR 27 1.130 6.189 -10.259 216 HA THR 27 HA THR 27 -0.828 7.860 -9.016 217 HB THR 27 HB THR 27 0.202 5.269 -8.783 218 HG1 THR 27 HG1 THR 27 -1.692 6.757 -7.321 219 HG21 THR 27 HG21 THR 27 0.579 6.742 -6.159 220 HG22 THR 27 HG22 THR 27 1.874 6.057 -7.141 221 HG23 THR 27 HG23 THR 27 0.685 4.996 -6.384 222 H LEU 28 HN LEU 28 2.652 7.357 -8.401 223 HA LEU 28 HA LEU 28 2.910 9.135 -6.174 224 HB2 LEU 28 HB2 LEU 28 4.728 7.703 -6.625 225 HB3 LEU 28 HB1 LEU 28 4.681 8.043 -8.350 226 HG LEU 28 HG LEU 28 5.217 10.531 -7.187 227 HD11 LEU 28 HD11 LEU 28 6.038 10.055 -5.136 228 HD12 LEU 28 HD12 LEU 28 7.456 9.470 -6.006 229 HD13 LEU 28 HD13 LEU 28 6.199 8.339 -5.501 230 HD21 LEU 28 HD21 LEU 28 6.850 10.435 -8.747 231 HD22 LEU 28 HD22 LEU 28 6.282 8.803 -9.101 232 HD23 LEU 28 HD23 LEU 28 7.606 9.048 -7.960 233 H CYS 29 HN CYS 29 3.088 9.636 -9.702 234 HA CYS 29 HA CYS 29 3.851 12.340 -9.805 235 HB2 CYS 29 HB2 CYS 29 2.953 10.399 -11.539 236 HB3 CYS 29 HB1 CYS 29 1.621 11.554 -11.574 237 HG CYS 29 HG CYS 29 4.505 12.110 -12.559 238 H GLU 30 HN GLU 30 0.861 10.880 -8.755 239 HA GLU 30 HA GLU 30 -0.599 13.431 -8.681 240 HB2 GLU 30 HB2 GLU 30 -1.868 11.538 -9.352 241 HB3 GLU 30 HB1 GLU 30 -1.173 10.528 -8.083 242 HG2 GLU 30 HG2 GLU 30 -2.459 11.538 -6.396 243 HG3 GLU 30 HG1 GLU 30 -2.785 12.970 -7.373 244 H LEU 31 HN LEU 31 0.983 11.144 -6.495 245 HA LEU 31 HA LEU 31 0.065 12.543 -4.070 246 HB2 LEU 31 HB2 LEU 31 1.751 10.164 -4.793 247 HB3 LEU 31 HB1 LEU 31 1.920 10.858 -3.181 248 HG LEU 31 HG LEU 31 -0.838 10.319 -4.222 249 HD11 LEU 31 HD11 LEU 31 1.185 8.314 -4.010 250 HD12 LEU 31 HD12 LEU 31 -0.538 8.087 -4.307 251 HD13 LEU 31 HD13 LEU 31 0.077 8.101 -2.655 252 HD21 LEU 31 HD21 LEU 31 0.589 10.639 -1.608 253 HD22 LEU 31 HD22 LEU 31 -0.864 9.638 -1.644 254 HD23 LEU 31 HD23 LEU 31 -0.946 11.330 -2.136 255 H GLY 32 HN GLY 32 3.031 12.218 -5.996 256 HA2 GLY 32 HA2 GLY 32 4.851 13.738 -6.114 257 HA3 GLY 32 HA1 GLY 32 4.072 14.723 -4.865 258 H HIS 33 HN HIS 33 4.083 11.454 -4.038 259 HA HIS 33 HA HIS 33 5.495 11.629 -1.668 260 HB2 HIS 33 HB2 HIS 33 4.967 9.475 -3.693 261 HB3 HIS 33 HB1 HIS 33 5.964 9.104 -2.274 262 HD1 HIS 33 HD1 HIS 33 2.991 8.019 -2.814 263 HD2 HIS 33 HD2 HIS 33 4.037 11.144 -0.262 264 HE1 HIS 33 HE1 HIS 33 1.124 8.210 -1.110 265 H GLU 34 HN GLU 34 7.705 10.491 -1.235 266 HA GLU 34 HA GLU 34 9.729 11.788 -2.933 267 HB2 GLU 34 HB2 GLU 34 9.499 11.345 -0.289 268 HB3 GLU 34 HB1 GLU 34 10.423 9.907 -0.725 269 HG2 GLU 34 HG2 GLU 34 12.178 11.366 -0.411 270 HG3 GLU 34 HG1 GLU 34 11.839 11.713 -2.106 271 H VAL 35 HN VAL 35 9.599 8.448 -1.627 272 HA VAL 35 HA VAL 35 10.522 7.480 -4.317 273 HB VAL 35 HB VAL 35 12.067 6.050 -3.176 274 HG11 VAL 35 HG11 VAL 35 12.238 8.767 -3.007 275 HG12 VAL 35 HG12 VAL 35 13.508 7.669 -2.465 276 HG13 VAL 35 HG13 VAL 35 12.353 8.323 -1.303 277 HG21 VAL 35 HG21 VAL 35 12.065 6.006 -0.628 278 HG22 VAL 35 HG22 VAL 35 10.697 5.197 -1.395 279 HG23 VAL 35 HG23 VAL 35 10.494 6.805 -0.698 280 H ALA 36 HN ALA 36 9.306 5.793 -5.147 281 HA ALA 36 HA ALA 36 7.277 4.561 -3.352 282 HB1 ALA 36 HB1 ALA 36 6.827 5.975 -5.539 283 HB2 ALA 36 HB2 ALA 36 5.869 4.531 -5.215 284 HB3 ALA 36 HB3 ALA 36 7.219 4.457 -6.348 285 H ALA 37 HN ALA 37 6.796 2.222 -3.825 286 HA ALA 37 HA ALA 37 9.220 0.781 -4.862 287 HB1 ALA 37 HB1 ALA 37 8.290 0.840 -2.285 288 HB2 ALA 37 HB2 ALA 37 9.212 -0.500 -2.967 289 HB3 ALA 37 HB3 ALA 37 7.452 -0.577 -2.915 290 H THR 38 HN THR 38 8.800 -1.006 -6.190 291 HA THR 38 HA THR 38 5.939 -1.564 -6.836 292 HB THR 38 HB THR 38 6.677 -0.225 -8.628 293 HG1 THR 38 HG1 THR 38 5.874 -2.037 -9.549 294 HG21 THR 38 HG21 THR 38 8.948 -0.722 -9.722 295 HG22 THR 38 HG22 THR 38 9.309 -1.664 -8.275 296 HG23 THR 38 HG23 THR 38 8.982 0.065 -8.144 297 H ALA 39 HN ALA 39 5.810 -3.626 -8.206 298 HA ALA 39 HA ALA 39 6.007 -5.956 -8.249 299 HB1 ALA 39 HB1 ALA 39 8.925 -5.653 -7.691 300 HB2 ALA 39 HB2 ALA 39 8.266 -4.965 -9.176 301 HB3 ALA 39 HB3 ALA 39 8.112 -6.694 -8.859 302 H SER 40 HN SER 40 6.523 -7.848 -6.796 303 HA SER 40 HA SER 40 6.225 -7.032 -3.994 304 HB2 SER 40 HB2 SER 40 5.861 -9.455 -3.697 305 HB3 SER 40 HB1 SER 40 4.866 -8.799 -4.989 306 HG SER 40 HG SER 40 7.116 -10.468 -5.103 307 H ARG 41 HN ARG 41 7.763 -7.272 -2.397 308 HA ARG 41 HA ARG 41 10.236 -8.776 -2.896 309 HB2 ARG 41 HB2 ARG 41 10.198 -6.268 -3.803 310 HB3 ARG 41 HB1 ARG 41 10.505 -5.903 -2.105 311 HG2 ARG 41 HG2 ARG 41 12.648 -6.105 -3.169 312 HG3 ARG 41 HG1 ARG 41 12.420 -7.556 -2.191 313 HD2 ARG 41 HD2 ARG 41 11.765 -8.840 -4.159 314 HD3 ARG 41 HD1 ARG 41 11.836 -7.380 -5.168 315 HE ARG 41 HE ARG 41 14.217 -7.437 -5.034 316 HH11 ARG 41 HH11 ARG 41 13.860 -10.414 -5.128 317 HH12 ARG 41 HH12 ARG 41 14.814 -10.934 -3.779 318 HH21 ARG 41 HH21 ARG 41 14.962 -7.782 -2.334 319 HH22 ARG 41 HH22 ARG 41 15.436 -9.442 -2.193 320 H MET 42 HN MET 42 10.699 -9.772 -0.954 321 HA MET 42 HA MET 42 9.273 -9.259 1.455 322 HB2 MET 42 HB2 MET 42 11.965 -10.568 0.947 323 HB3 MET 42 HB1 MET 42 11.012 -10.756 2.421 324 HG2 MET 42 HG2 MET 42 9.118 -11.607 0.969 325 HG3 MET 42 HG1 MET 42 10.257 -11.635 -0.377 326 HE1 MET 42 HE1 MET 42 11.399 -13.945 -0.970 327 HE2 MET 42 HE2 MET 42 9.649 -13.893 -0.773 328 HE3 MET 42 HE3 MET 42 10.561 -15.255 -0.125 329 H GLN 43 HN GLN 43 12.231 -7.889 0.154 330 HA GLN 43 HA GLN 43 13.171 -6.692 2.625 331 HB2 GLN 43 HB2 GLN 43 13.911 -6.961 -0.163 332 HB3 GLN 43 HB1 GLN 43 14.152 -5.298 0.371 333 HG2 GLN 43 HG2 GLN 43 15.072 -7.448 2.217 334 HG3 GLN 43 HG1 GLN 43 16.012 -7.201 0.743 335 HE21 GLN 43 HE21 GLN 43 15.888 -6.219 3.913 336 HE22 GLN 43 HE22 GLN 43 16.592 -4.682 3.760 337 H GLU 44 HN GLU 44 11.837 -5.154 -0.351 338 HA GLU 44 HA GLU 44 11.442 -2.582 0.756 339 HB2 GLU 44 HB2 GLU 44 10.298 -4.194 -1.493 340 HB3 GLU 44 HB1 GLU 44 9.515 -2.669 -1.086 341 HG2 GLU 44 HG2 GLU 44 11.187 -2.171 -2.743 342 HG3 GLU 44 HG1 GLU 44 11.799 -1.580 -1.198 343 H ALA 45 HN ALA 45 9.190 -5.360 0.616 344 HA ALA 45 HA ALA 45 6.939 -4.134 1.811 345 HB1 ALA 45 HB1 ALA 45 6.199 -6.336 2.037 346 HB2 ALA 45 HB2 ALA 45 7.778 -6.910 2.576 347 HB3 ALA 45 HB3 ALA 45 7.499 -6.567 0.868 348 H LEU 46 HN LEU 46 9.839 -5.555 3.183 349 HA LEU 46 HA LEU 46 9.264 -5.331 5.967 350 HB2 LEU 46 HB2 LEU 46 11.194 -6.380 4.436 351 HB3 LEU 46 HB1 LEU 46 11.983 -4.850 4.812 352 HG LEU 46 HG LEU 46 12.620 -6.453 6.504 353 HD11 LEU 46 HD11 LEU 46 11.990 -4.084 7.148 354 HD12 LEU 46 HD12 LEU 46 11.938 -5.261 8.460 355 HD13 LEU 46 HD13 LEU 46 10.443 -4.733 7.688 356 HD21 LEU 46 HD21 LEU 46 9.712 -7.088 6.387 357 HD22 LEU 46 HD22 LEU 46 10.497 -7.225 7.960 358 HD23 LEU 46 HD23 LEU 46 11.088 -8.171 6.594 359 H ASP 47 HN ASP 47 10.292 -3.031 3.520 360 HA ASP 47 HA ASP 47 10.995 -0.944 5.421 361 HB2 ASP 47 HB2 ASP 47 10.590 -1.079 2.423 362 HB3 ASP 47 HB1 ASP 47 11.103 0.389 3.256 363 H ILE 48 HN ILE 48 8.149 -1.786 3.461 364 HA ILE 48 HA ILE 48 6.733 0.664 4.062 365 HB ILE 48 HB ILE 48 5.097 -0.201 2.665 366 HG12 ILE 48 HG12 ILE 48 5.675 -2.841 4.010 367 HG13 ILE 48 HG11 ILE 48 4.165 -1.939 3.952 368 HG21 ILE 48 HG21 ILE 48 7.063 -2.289 1.850 369 HG22 ILE 48 HG22 ILE 48 7.534 -0.597 1.745 370 HG23 ILE 48 HG23 ILE 48 6.128 -1.178 0.855 371 HD11 ILE 48 HD11 ILE 48 3.539 -3.256 2.227 372 HD12 ILE 48 HD12 ILE 48 5.142 -3.976 2.120 373 HD13 ILE 48 HD13 ILE 48 4.787 -2.481 1.255 374 H ALA 49 HN ALA 49 7.554 -2.015 5.912 375 HA ALA 49 HA ALA 49 5.066 -1.985 7.491 376 HB1 ALA 49 HB1 ALA 49 7.575 -3.646 7.866 377 HB2 ALA 49 HB2 ALA 49 6.325 -4.063 6.695 378 HB3 ALA 49 HB3 ALA 49 5.945 -4.032 8.416 379 H ARG 50 HN ARG 50 8.484 -2.137 8.481 380 HA ARG 50 HA ARG 50 8.215 -1.257 11.108 381 HB2 ARG 50 HB2 ARG 50 10.354 -1.202 9.028 382 HB3 ARG 50 HB1 ARG 50 10.655 -0.368 10.559 383 HG2 ARG 50 HG2 ARG 50 11.024 -2.328 11.592 384 HG3 ARG 50 HG1 ARG 50 9.437 -2.917 11.092 385 HD2 ARG 50 HD2 ARG 50 10.582 -4.409 9.804 386 HD3 ARG 50 HD1 ARG 50 10.931 -3.030 8.741 387 HE ARG 50 HE ARG 50 12.707 -3.764 11.046 388 HH11 ARG 50 HH21 ARG 50 13.157 -1.138 9.675 389 HH12 ARG 50 HH22 ARG 50 14.371 -1.542 8.508 390 HH21 ARG 50 HH11 ARG 50 13.830 -4.959 8.732 391 HH22 ARG 50 HH12 ARG 50 14.747 -3.702 7.969 392 H LYS 51 HN LYS 51 8.005 0.784 8.264 393 HA LYS 51 HA LYS 51 8.837 3.262 9.350 394 HB2 LYS 51 HB2 LYS 51 6.443 2.827 7.552 395 HB3 LYS 51 HB1 LYS 51 7.457 4.258 7.632 396 HG2 LYS 51 HG2 LYS 51 8.865 1.728 7.046 397 HG3 LYS 51 HG1 LYS 51 7.774 2.302 5.788 398 HD2 LYS 51 HD2 LYS 51 8.930 4.371 5.585 399 HD3 LYS 51 HD1 LYS 51 9.797 4.129 7.102 400 HE2 LYS 51 HE2 LYS 51 10.201 2.021 5.042 401 HE3 LYS 51 HE1 LYS 51 10.919 3.606 4.694 402 HZ1 LYS 51 HZ1 LYS 51 11.788 3.597 7.003 403 HZ2 LYS 51 HZ2 LYS 51 12.464 2.388 6.020 404 HZ3 LYS 51 HZ3 LYS 51 11.269 1.989 7.160 405 H GLY 52 HN GLY 52 5.645 1.673 9.519 406 HA2 GLY 52 HA2 GLY 52 3.943 1.928 11.129 407 HA3 GLY 52 HA1 GLY 52 5.068 2.896 12.089 408 H GLN 53 HN GLN 53 5.102 4.122 9.020 409 HA GLN 53 HA GLN 53 2.692 5.702 8.972 410 HB2 GLN 53 HB2 GLN 53 3.743 7.836 9.627 411 HB3 GLN 53 HB1 GLN 53 3.876 6.667 10.940 412 HG2 GLN 53 HG2 GLN 53 6.161 6.153 9.505 413 HG3 GLN 53 HG1 GLN 53 5.997 7.897 9.307 414 HE21 GLN 53 HE21 GLN 53 6.219 5.327 11.781 415 HE22 GLN 53 HE22 GLN 53 6.741 6.351 13.030 416 H PHE 54 HN PHE 54 4.309 4.080 7.211 417 HA PHE 54 HA PHE 54 5.882 5.734 5.422 418 HB2 PHE 54 HB2 PHE 54 5.718 3.649 4.003 419 HB3 PHE 54 HB1 PHE 54 6.266 3.345 5.650 420 HD1 PHE 54 HD2 PHE 54 3.328 3.206 3.390 421 HD2 PHE 54 HD1 PHE 54 4.971 1.990 7.162 422 HE1 PHE 54 HE2 PHE 54 1.420 1.681 3.749 423 HE2 PHE 54 HE1 PHE 54 3.068 0.470 7.502 424 HZ PHE 54 HZ PHE 54 1.287 0.304 5.795 425 H ASP 55 HN ASP 55 2.692 5.953 6.037 426 HA ASP 55 HA ASP 55 1.009 7.130 4.890 427 HB2 ASP 55 HB2 ASP 55 3.134 8.018 3.684 428 HB3 ASP 55 HB1 ASP 55 2.664 6.910 2.403 429 H ILE 56 HN ILE 56 2.394 4.945 2.349 430 HA ILE 56 HA ILE 56 -0.109 3.323 2.601 431 HB ILE 56 HB ILE 56 0.921 4.749 0.138 432 HG12 ILE 56 HG12 ILE 56 -1.487 4.989 1.946 433 HG13 ILE 56 HG11 ILE 56 -0.371 6.254 1.432 434 HG21 ILE 56 HG21 ILE 56 -1.081 3.689 -0.970 435 HG22 ILE 56 HG22 ILE 56 -1.258 2.671 0.459 436 HG23 ILE 56 HG23 ILE 56 0.187 2.542 -0.538 437 HD11 ILE 56 HD11 ILE 56 -2.781 5.235 0.104 438 HD12 ILE 56 HD12 ILE 56 -1.384 5.331 -0.967 439 HD13 ILE 56 HD13 ILE 56 -1.941 6.770 -0.114 440 H ALA 57 HN ALA 57 0.117 1.111 1.973 441 HA ALA 57 HA ALA 57 2.615 0.253 0.613 442 HB1 ALA 57 HB1 ALA 57 1.906 -0.349 3.489 443 HB2 ALA 57 HB2 ALA 57 3.363 0.443 2.883 444 HB3 ALA 57 HB3 ALA 57 3.099 -1.274 2.581 445 H ILE 58 HN ILE 58 2.072 -1.507 -0.696 446 HA ILE 58 HA ILE 58 -0.260 -3.162 0.195 447 HB ILE 58 HB ILE 58 0.337 -2.020 -2.546 448 HG12 ILE 58 HG12 ILE 58 -1.980 -0.971 -2.051 449 HG13 ILE 58 HG11 ILE 58 -1.656 -1.393 -0.371 450 HG21 ILE 58 HG21 ILE 58 -0.993 -4.389 -1.938 451 HG22 ILE 58 HG22 ILE 58 -1.171 -3.458 -3.426 452 HG23 ILE 58 HG23 ILE 58 -2.294 -3.207 -2.090 453 HD11 ILE 58 HD11 ILE 58 -0.716 0.870 -1.800 454 HD12 ILE 58 HD12 ILE 58 0.682 -0.155 -1.482 455 HD13 ILE 58 HD13 ILE 58 -0.327 0.402 -0.146 456 H ILE 59 HN ILE 59 0.948 -4.992 0.757 457 HA ILE 59 HA ILE 59 2.883 -6.213 -1.105 458 HB ILE 59 HB ILE 59 1.674 -6.843 1.594 459 HG12 ILE 59 HG12 ILE 59 4.585 -6.881 1.223 460 HG13 ILE 59 HG11 ILE 59 3.856 -5.331 0.806 461 HG21 ILE 59 HG21 ILE 59 3.605 -8.721 1.363 462 HG22 ILE 59 HG22 ILE 59 3.039 -8.670 -0.306 463 HG23 ILE 59 HG23 ILE 59 1.909 -9.037 0.999 464 HD11 ILE 59 HD11 ILE 59 3.448 -6.830 3.410 465 HD12 ILE 59 HD12 ILE 59 2.705 -5.287 2.992 466 HD13 ILE 59 HD13 ILE 59 4.453 -5.398 3.197 467 H ASP 60 HN ASP 60 0.733 -5.901 -2.557 468 HA ASP 60 HA ASP 60 -1.523 -7.495 -2.511 469 HB2 ASP 60 HB2 ASP 60 -1.272 -5.922 -4.229 470 HB3 ASP 60 HB1 ASP 60 0.347 -6.483 -4.641 471 H VAL 61 HN VAL 61 -1.893 -9.448 -4.044 472 HA VAL 61 HA VAL 61 -1.586 -11.740 -4.373 473 HB VAL 61 HB VAL 61 0.415 -10.300 -5.575 474 HG11 VAL 61 HG11 VAL 61 1.821 -12.613 -4.224 475 HG12 VAL 61 HG12 VAL 61 1.979 -10.947 -3.677 476 HG13 VAL 61 HG13 VAL 61 2.523 -11.398 -5.289 477 HG21 VAL 61 HG21 VAL 61 0.894 -12.557 -6.730 478 HG22 VAL 61 HG22 VAL 61 -0.765 -11.964 -6.761 479 HG23 VAL 61 HG23 VAL 61 -0.302 -13.229 -5.623 480 H ASN 62 HN ASN 62 -2.194 -11.959 -2.115 481 HA ASN 62 HA ASN 62 -0.067 -13.294 -0.463 482 HB2 ASN 62 HB2 ASN 62 -2.141 -11.214 0.346 483 HB3 ASN 62 HB1 ASN 62 -1.244 -12.184 1.509 484 HD21 ASN 62 HD21 ASN 62 1.060 -11.892 -0.743 485 HD22 ASN 62 HD22 ASN 62 1.757 -10.411 -0.306 486 H LEU 63 HN LEU 63 -0.797 -15.345 0.019 487 HA LEU 63 HA LEU 63 -3.541 -15.833 0.831 488 HB2 LEU 63 HB2 LEU 63 -3.012 -15.668 -1.944 489 HB3 LEU 63 HB1 LEU 63 -3.177 -17.388 -1.591 490 HG LEU 63 HG LEU 63 -5.260 -16.468 -0.155 491 HD11 LEU 63 HD11 LEU 63 -5.277 -14.185 -0.601 492 HD12 LEU 63 HD12 LEU 63 -6.334 -14.771 -1.883 493 HD13 LEU 63 HD13 LEU 63 -4.647 -14.393 -2.235 494 HD21 LEU 63 HD21 LEU 63 -6.135 -16.599 -2.898 495 HD22 LEU 63 HD22 LEU 63 -6.307 -17.811 -1.628 496 HD23 LEU 63 HD23 LEU 63 -4.859 -17.787 -2.634 497 H ASP 64 HN ASP 64 -3.825 -18.233 1.260 498 HA ASP 64 HA ASP 64 -2.892 -20.233 2.160 499 HB2 ASP 64 HB2 ASP 64 -1.670 -19.524 -0.400 500 HB3 ASP 64 HB1 ASP 64 -0.542 -20.434 0.611 501 H GLY 65 HN GLY 65 -1.952 -17.375 2.961 502 HA2 GLY 65 HA2 GLY 65 -0.282 -16.404 4.306 503 HA3 GLY 65 HA1 GLY 65 -0.125 -18.023 5.006 504 H GLU 66 HN GLU 66 0.661 -16.471 1.864 505 HA GLU 66 HA GLU 66 3.299 -17.775 2.089 506 HB2 GLU 66 HB2 GLU 66 1.236 -17.798 -0.044 507 HB3 GLU 66 HB1 GLU 66 2.935 -17.962 -0.503 508 HG2 GLU 66 HG2 GLU 66 3.180 -19.865 1.046 509 HG3 GLU 66 HG1 GLU 66 1.491 -19.692 1.527 510 HA PRO 67 HA PRO 67 4.599 -14.204 -0.557 511 HB2 PRO 67 HB2 PRO 67 2.830 -12.890 -2.168 512 HB3 PRO 67 HB1 PRO 67 3.698 -14.360 -2.649 513 HG2 PRO 67 HG2 PRO 67 0.892 -14.050 -1.730 514 HG3 PRO 67 HG1 PRO 67 1.564 -15.117 -2.962 515 HD2 PRO 67 HD2 PRO 67 0.895 -15.920 -0.451 516 HD3 PRO 67 HD1 PRO 67 2.122 -16.696 -1.470 517 H SER 68 HN SER 68 2.606 -13.942 1.900 518 HA SER 68 HA SER 68 2.454 -10.946 1.830 519 HB2 SER 68 HB2 SER 68 0.391 -11.139 2.831 520 HB3 SER 68 HB1 SER 68 0.431 -12.722 2.063 521 HG SER 68 HG SER 68 0.928 -12.007 4.741 522 H TYR 69 HN TYR 69 3.783 -13.705 3.378 523 HA TYR 69 HA TYR 69 5.014 -14.045 5.332 524 HB2 TYR 69 HB2 TYR 69 6.393 -11.662 5.648 525 HB3 TYR 69 HB1 TYR 69 6.880 -12.989 4.604 526 HD1 TYR 69 HD1 TYR 69 5.595 -12.950 2.196 527 HD2 TYR 69 HD2 TYR 69 6.317 -9.566 4.734 528 HE1 TYR 69 HE1 TYR 69 5.392 -11.431 0.238 529 HE2 TYR 69 HE2 TYR 69 6.102 -8.050 2.784 530 HH TYR 69 HH TYR 69 6.383 -8.953 -0.272 531 HA PRO 70 HA PRO 70 3.194 -12.390 8.911 532 HB2 PRO 70 HB2 PRO 70 5.273 -11.764 10.584 533 HB3 PRO 70 HB1 PRO 70 4.779 -13.432 10.228 534 HG2 PRO 70 HG2 PRO 70 7.005 -11.826 9.058 535 HG3 PRO 70 HG1 PRO 70 6.990 -13.524 9.566 536 HD2 PRO 70 HD2 PRO 70 6.783 -12.804 6.979 537 HD3 PRO 70 HD1 PRO 70 5.957 -14.235 7.631 538 H VAL 71 HN VAL 71 5.239 -10.357 7.058 539 HA VAL 71 HA VAL 71 5.014 -7.964 8.693 540 HB VAL 71 HB VAL 71 5.510 -8.332 5.742 541 HG11 VAL 71 HG11 VAL 71 5.029 -5.990 6.974 542 HG12 VAL 71 HG12 VAL 71 6.170 -6.142 5.638 543 HG13 VAL 71 HG13 VAL 71 6.757 -6.135 7.302 544 HG21 VAL 71 HG21 VAL 71 7.614 -9.027 6.210 545 HG22 VAL 71 HG22 VAL 71 7.004 -9.355 7.832 546 HG23 VAL 71 HG23 VAL 71 7.808 -7.825 7.486 547 H ALA 72 HN ALA 72 3.648 -8.586 5.458 548 HA ALA 72 HA ALA 72 1.686 -6.570 5.446 549 HB1 ALA 72 HB1 ALA 72 0.972 -9.151 4.218 550 HB2 ALA 72 HB2 ALA 72 2.588 -8.567 3.813 551 HB3 ALA 72 HB3 ALA 72 1.175 -7.567 3.470 552 H ASP 73 HN ASP 73 1.294 -10.017 6.368 553 HA ASP 73 HA ASP 73 -1.416 -9.936 7.078 554 HB2 ASP 73 HB2 ASP 73 1.004 -11.467 7.838 555 HB3 ASP 73 HB1 ASP 73 -0.408 -11.674 8.864 556 H ILE 74 HN ILE 74 1.402 -9.432 9.201 557 HA ILE 74 HA ILE 74 -0.041 -8.642 11.540 558 HB ILE 74 HB ILE 74 2.726 -8.129 10.435 559 HG12 ILE 74 HG12 ILE 74 1.925 -9.570 12.968 560 HG13 ILE 74 HG11 ILE 74 1.907 -10.390 11.405 561 HG21 ILE 74 HG21 ILE 74 3.286 -7.215 12.713 562 HG22 ILE 74 HG22 ILE 74 1.558 -7.157 13.060 563 HG23 ILE 74 HG23 ILE 74 2.231 -6.164 11.767 564 HD11 ILE 74 HD11 ILE 74 4.121 -10.746 11.627 565 HD12 ILE 74 HD12 ILE 74 4.173 -9.771 13.095 566 HD13 ILE 74 HD13 ILE 74 4.364 -9.004 11.518 567 H LEU 75 HN LEU 75 1.427 -6.754 8.909 568 HA LEU 75 HA LEU 75 0.792 -4.137 9.733 569 HB2 LEU 75 HB2 LEU 75 1.998 -5.287 7.629 570 HB3 LEU 75 HB1 LEU 75 0.438 -4.963 6.873 571 HG LEU 75 HG LEU 75 0.801 -2.582 8.034 572 HD11 LEU 75 HD11 LEU 75 3.637 -3.260 7.312 573 HD12 LEU 75 HD12 LEU 75 3.040 -3.590 8.938 574 HD13 LEU 75 HD13 LEU 75 3.029 -1.941 8.313 575 HD21 LEU 75 HD21 LEU 75 0.737 -2.068 5.845 576 HD22 LEU 75 HD22 LEU 75 1.222 -3.711 5.429 577 HD23 LEU 75 HD23 LEU 75 2.448 -2.476 5.715 578 H ALA 76 HN ALA 76 -1.250 -6.560 8.092 579 HA ALA 76 HA ALA 76 -3.509 -4.868 7.629 580 HB1 ALA 76 HB1 ALA 76 -4.598 -7.289 7.744 581 HB2 ALA 76 HB2 ALA 76 -2.908 -7.790 7.791 582 HB3 ALA 76 HB3 ALA 76 -3.510 -6.846 6.429 583 H GLU 77 HN GLU 77 -3.178 -7.411 10.133 584 HA GLU 77 HA GLU 77 -5.484 -6.771 11.609 585 HB2 GLU 77 HB2 GLU 77 -4.479 -8.150 13.296 586 HB3 GLU 77 HB1 GLU 77 -3.926 -8.767 11.742 587 HG2 GLU 77 HG2 GLU 77 -1.778 -8.363 12.279 588 HG3 GLU 77 HG1 GLU 77 -2.142 -6.686 12.680 589 H ARG 78 HN ARG 78 -2.475 -5.016 11.483 590 HA ARG 78 HA ARG 78 -3.512 -3.172 13.566 591 HB2 ARG 78 HB2 ARG 78 -1.384 -3.202 14.685 592 HB3 ARG 78 HB1 ARG 78 -1.822 -4.886 14.414 593 HG2 ARG 78 HG2 ARG 78 -0.006 -5.220 13.118 594 HG3 ARG 78 HG1 ARG 78 -0.386 -3.820 12.121 595 HD2 ARG 78 HD2 ARG 78 0.496 -2.610 14.427 596 HD3 ARG 78 HD1 ARG 78 1.528 -4.053 14.349 597 HE ARG 78 HE ARG 78 1.169 -2.303 11.949 598 HH11 ARG 78 HH21 ARG 78 3.285 -1.993 14.314 599 HH12 ARG 78 HH22 ARG 78 4.691 -2.570 13.483 600 HH21 ARG 78 HH11 ARG 78 2.906 -3.889 10.823 601 HH22 ARG 78 HH12 ARG 78 4.477 -3.644 11.509 602 H ASN 79 HN ASN 79 -3.405 -2.996 10.613 603 HA ASN 79 HA ASN 79 -1.161 -1.412 9.804 604 HB2 ASN 79 HB2 ASN 79 -3.405 -2.634 8.668 605 HB3 ASN 79 HB1 ASN 79 -3.530 -0.918 8.270 606 HD21 ASN 79 HD21 ASN 79 -2.197 -3.732 7.094 607 HD22 ASN 79 HD22 ASN 79 -0.868 -3.089 6.258 608 H VAL 80 HN VAL 80 -0.910 0.695 9.567 609 HA VAL 80 HA VAL 80 -2.614 2.509 11.202 610 HB VAL 80 HB VAL 80 -0.635 3.886 11.156 611 HG11 VAL 80 HG11 VAL 80 1.165 2.292 11.765 612 HG12 VAL 80 HG12 VAL 80 0.200 0.974 11.101 613 HG13 VAL 80 HG13 VAL 80 -0.374 1.861 12.512 614 HG21 VAL 80 HG21 VAL 80 1.122 3.667 9.542 615 HG22 VAL 80 HG22 VAL 80 -0.372 3.565 8.611 616 HG23 VAL 80 HG23 VAL 80 0.525 2.097 9.002 617 HA PRO 81 HA PRO 81 -4.094 4.722 7.625 618 HB2 PRO 81 HB2 PRO 81 -2.613 6.926 6.921 619 HB3 PRO 81 HB1 PRO 81 -3.725 6.904 8.305 620 HG2 PRO 81 HG2 PRO 81 -0.765 6.603 8.250 621 HG3 PRO 81 HG1 PRO 81 -1.790 7.475 9.402 622 HD2 PRO 81 HD2 PRO 81 -0.723 5.062 9.919 623 HD3 PRO 81 HD1 PRO 81 -2.271 5.577 10.612 624 H PHE 82 HN PHE 82 -3.986 3.778 5.614 625 HA PHE 82 HA PHE 82 -1.708 3.946 3.845 626 HB2 PHE 82 HB2 PHE 82 -0.692 1.841 4.217 627 HB3 PHE 82 HB1 PHE 82 -0.975 2.459 5.846 628 HD1 PHE 82 HD2 PHE 82 -3.771 2.019 6.367 629 HD2 PHE 82 HD1 PHE 82 -1.033 -0.473 4.193 630 HE1 PHE 82 HE2 PHE 82 -5.175 0.053 6.868 631 HE2 PHE 82 HE1 PHE 82 -2.443 -2.446 4.699 632 HZ PHE 82 HZ PHE 82 -4.521 -2.186 6.022 633 H ILE 83 HN ILE 83 -2.008 1.304 2.829 634 HA ILE 83 HA ILE 83 -4.800 0.794 2.222 635 HB ILE 83 HB ILE 83 -3.064 2.432 0.530 636 HG12 ILE 83 HG12 ILE 83 -5.166 3.285 1.355 637 HG13 ILE 83 HG11 ILE 83 -5.320 3.080 -0.391 638 HG21 ILE 83 HG21 ILE 83 -4.035 1.504 -1.608 639 HG22 ILE 83 HG22 ILE 83 -4.654 0.143 -0.674 640 HG23 ILE 83 HG23 ILE 83 -2.914 0.394 -0.815 641 HD11 ILE 83 HD11 ILE 83 -7.086 1.729 -0.033 642 HD12 ILE 83 HD12 ILE 83 -6.839 1.818 1.710 643 HD13 ILE 83 HD13 ILE 83 -6.003 0.590 0.760 644 H PHE 84 HN PHE 84 -4.997 -1.272 1.281 645 HA PHE 84 HA PHE 84 -2.563 -2.742 0.503 646 HB2 PHE 84 HB2 PHE 84 -2.892 -2.644 3.026 647 HB3 PHE 84 HB1 PHE 84 -4.322 -3.633 2.782 648 HD1 PHE 84 HD1 PHE 84 -1.719 -4.314 0.382 649 HD2 PHE 84 HD2 PHE 84 -3.041 -5.202 4.371 650 HE1 PHE 84 HE1 PHE 84 -0.344 -6.368 0.392 651 HE2 PHE 84 HE2 PHE 84 -1.639 -7.257 4.373 652 HZ PHE 84 HZ PHE 84 -0.299 -7.834 2.377 653 H ALA 85 HN ALA 85 -3.099 -4.640 -0.652 654 HA ALA 85 HA ALA 85 -5.803 -5.640 -0.752 655 HB1 ALA 85 HB1 ALA 85 -4.776 -4.382 -3.282 656 HB2 ALA 85 HB2 ALA 85 -5.651 -3.417 -2.094 657 HB3 ALA 85 HB3 ALA 85 -6.436 -4.799 -2.859 658 H THR 86 HN THR 86 -5.414 -7.812 -1.040 659 HA THR 86 HA THR 86 -3.083 -8.583 -2.764 660 HB THR 86 HB THR 86 -2.913 -10.530 -1.218 661 HG1 THR 86 HG1 THR 86 -4.993 -9.165 0.136 662 HG21 THR 86 HG21 THR 86 -1.546 -8.619 -0.707 663 HG22 THR 86 HG22 THR 86 -2.236 -9.194 0.811 664 HG23 THR 86 HG23 THR 86 -2.914 -7.773 0.018 665 H GLY 87 HN GLY 87 -4.469 -11.399 -1.938 666 HA2 GLY 87 HA2 GLY 87 -6.277 -11.355 -4.319 667 HA3 GLY 87 HA1 GLY 87 -5.357 -12.774 -3.806 668 H TYR 88 HN TYR 88 -6.088 -11.859 -0.916 669 HA TYR 88 HA TYR 88 -8.520 -13.508 -0.804 670 HB2 TYR 88 HB2 TYR 88 -8.011 -13.700 1.485 671 HB3 TYR 88 HB1 TYR 88 -6.438 -13.594 0.709 672 HD1 TYR 88 HD1 TYR 88 -6.723 -10.507 0.125 673 HD2 TYR 88 HD2 TYR 88 -7.219 -12.937 3.625 674 HE1 TYR 88 HE1 TYR 88 -6.171 -8.557 1.548 675 HE2 TYR 88 HE2 TYR 88 -6.662 -10.996 5.048 676 HH TYR 88 HH TYR 88 -6.297 -8.792 5.098 677 H GLY 89 HN GLY 89 -7.927 -10.164 -1.123 678 HA2 GLY 89 HA2 GLY 89 -9.467 -8.402 -1.126 679 HA3 GLY 89 HA1 GLY 89 -10.735 -9.586 -0.817 680 H SER 90 HN SER 90 -8.108 -7.835 0.809 681 HA SER 90 HA SER 90 -7.948 -7.087 3.033 682 HB2 SER 90 HB2 SER 90 -10.766 -6.839 3.540 683 HB3 SER 90 HB1 SER 90 -9.617 -5.567 3.150 684 HG SER 90 HG SER 90 -11.526 -6.152 1.672 685 H LYS 91 HN LYS 91 -9.946 -7.412 5.089 686 HA LYS 91 HA LYS 91 -10.864 -10.035 5.589 687 HB2 LYS 91 HB2 LYS 91 -8.952 -11.211 5.995 688 HB3 LYS 91 HB1 LYS 91 -8.032 -9.804 5.482 689 HG2 LYS 91 HG2 LYS 91 -8.416 -8.974 7.942 690 HG3 LYS 91 HG1 LYS 91 -8.744 -10.676 8.270 691 HD2 LYS 91 HD2 LYS 91 -6.556 -11.245 8.051 692 HD3 LYS 91 HD1 LYS 91 -6.342 -10.218 6.637 693 HE2 LYS 91 HE2 LYS 91 -4.996 -9.142 8.242 694 HE3 LYS 91 HE1 LYS 91 -6.523 -8.247 8.374 695 HZ1 LYS 91 HZ1 LYS 91 -5.355 -10.190 10.199 696 HZ2 LYS 91 HZ2 LYS 91 -7.029 -10.328 9.951 697 HZ3 LYS 91 HZ3 LYS 91 -6.370 -8.872 10.527 698 H GLY 92 HN GLY 92 -9.242 -7.204 6.816 699 HA2 GLY 92 HA2 GLY 92 -11.309 -6.319 8.532 700 HA3 GLY 92 HA1 GLY 92 -10.145 -7.214 9.519 701 H LEU 93 HN LEU 93 -9.378 -5.405 6.617 702 HA LEU 93 HA LEU 93 -7.102 -4.094 7.652 703 HB2 LEU 93 HB2 LEU 93 -7.571 -4.431 5.290 704 HB3 LEU 93 HB1 LEU 93 -9.029 -3.446 5.399 705 HG LEU 93 HG LEU 93 -6.580 -2.093 6.332 706 HD11 LEU 93 HD11 LEU 93 -5.376 -2.985 4.565 707 HD12 LEU 93 HD12 LEU 93 -6.168 -1.652 3.725 708 HD13 LEU 93 HD13 LEU 93 -6.821 -3.285 3.600 709 HD21 LEU 93 HD21 LEU 93 -8.863 -1.072 6.003 710 HD22 LEU 93 HD22 LEU 93 -8.671 -1.337 4.270 711 HD23 LEU 93 HD23 LEU 93 -7.579 -0.244 5.122 712 H ASP 94 HN ASP 94 -7.031 -2.518 9.207 713 HA ASP 94 HA ASP 94 -9.401 -0.715 9.539 714 HB2 ASP 94 HB2 ASP 94 -8.379 -0.385 11.817 715 HB3 ASP 94 HB1 ASP 94 -8.806 -2.065 11.484 716 H THR 95 HN THR 95 -9.028 1.577 9.563 717 HA THR 95 HA THR 95 -6.452 2.815 9.647 718 HB THR 95 HB THR 95 -5.960 1.664 7.620 719 HG1 THR 95 HG1 THR 95 -5.862 3.369 6.135 720 HG21 THR 95 HG21 THR 95 -7.602 1.947 5.645 721 HG22 THR 95 HG22 THR 95 -8.779 2.407 6.875 722 HG23 THR 95 HG23 THR 95 -8.039 0.806 6.916 723 H ARG 96 HN ARG 96 -6.587 5.058 8.390 724 HA ARG 96 HA ARG 96 -9.040 6.393 9.305 725 HB2 ARG 96 HB2 ARG 96 -6.410 7.185 8.032 726 HB3 ARG 96 HB1 ARG 96 -7.701 8.366 8.256 727 HG2 ARG 96 HG2 ARG 96 -6.787 6.649 10.558 728 HG3 ARG 96 HG1 ARG 96 -5.917 8.125 10.136 729 HD2 ARG 96 HD2 ARG 96 -8.885 7.960 10.781 730 HD3 ARG 96 HD1 ARG 96 -7.627 8.623 11.842 731 HE ARG 96 HE ARG 96 -8.753 9.967 9.530 732 HH11 ARG 96 HH21 ARG 96 -7.164 10.820 12.155 733 HH12 ARG 96 HH22 ARG 96 -5.898 11.734 11.406 734 HH21 ARG 96 HH11 ARG 96 -6.581 10.559 8.218 735 HH22 ARG 96 HH12 ARG 96 -5.562 11.578 9.178 736 H TYR 97 HN TYR 97 -8.470 4.519 6.701 737 HA TYR 97 HA TYR 97 -9.556 6.303 4.601 738 HB2 TYR 97 HB2 TYR 97 -8.551 3.452 4.764 739 HB3 TYR 97 HB1 TYR 97 -9.244 4.117 3.286 740 HD1 TYR 97 HD1 TYR 97 -6.830 5.320 5.929 741 HD2 TYR 97 HD2 TYR 97 -7.674 4.831 1.744 742 HE1 TYR 97 HE1 TYR 97 -4.651 6.364 5.367 743 HE2 TYR 97 HE2 TYR 97 -5.495 5.872 1.186 744 HH TYR 97 HH TYR 97 -3.564 7.486 3.534 745 H SER 98 HN SER 98 -10.597 3.654 6.680 746 HA SER 98 HA SER 98 -12.876 3.215 7.317 747 HB2 SER 98 HB2 SER 98 -13.689 4.256 4.593 748 HB3 SER 98 HB1 SER 98 -14.692 4.074 6.034 749 HG SER 98 HG SER 98 -13.813 6.258 5.476 750 H ASN 99 HN ASN 99 -10.765 1.883 5.478 751 HA ASN 99 HA ASN 99 -10.553 -0.248 4.477 752 HB2 ASN 99 HB2 ASN 99 -13.361 -0.571 5.549 753 HB3 ASN 99 HB1 ASN 99 -12.171 -1.849 5.292 754 HD21 ASN 99 HD21 ASN 99 -10.120 0.331 6.382 755 HD22 ASN 99 HD22 ASN 99 -10.292 0.176 8.062 756 H ILE 100 HN ILE 100 -12.241 2.118 3.266 757 HA ILE 100 HA ILE 100 -14.038 0.782 1.383 758 HB ILE 100 HB ILE 100 -14.379 3.098 0.617 759 HG12 ILE 100 HG12 ILE 100 -12.223 3.860 2.601 760 HG13 ILE 100 HG11 ILE 100 -11.907 3.663 0.879 761 HG21 ILE 100 HG21 ILE 100 -15.718 2.728 2.472 762 HG22 ILE 100 HG22 ILE 100 -14.737 4.075 3.051 763 HG23 ILE 100 HG23 ILE 100 -14.343 2.424 3.534 764 HD11 ILE 100 HD11 ILE 100 -14.008 5.279 0.702 765 HD12 ILE 100 HD12 ILE 100 -12.365 5.891 0.896 766 HD13 ILE 100 HD13 ILE 100 -13.432 5.771 2.295 767 HA PRO 101 HA PRO 101 -10.716 1.856 -1.737 768 HB2 PRO 101 HB2 PRO 101 -8.277 2.761 -0.906 769 HB3 PRO 101 HB1 PRO 101 -9.694 3.811 -1.026 770 HG2 PRO 101 HG2 PRO 101 -8.302 2.898 1.342 771 HG3 PRO 101 HG1 PRO 101 -9.559 4.131 1.193 772 HD2 PRO 101 HD2 PRO 101 -9.799 1.318 1.992 773 HD3 PRO 101 HD1 PRO 101 -10.925 2.659 2.226 774 H LEU 102 HN LEU 102 -10.379 -0.439 0.561 775 HA LEU 102 HA LEU 102 -7.917 -1.566 -0.733 776 HB2 LEU 102 HB2 LEU 102 -7.199 -2.096 1.343 777 HB3 LEU 102 HB1 LEU 102 -8.473 -1.028 1.911 778 HG LEU 102 HG LEU 102 -8.663 -3.095 3.119 779 HD11 LEU 102 HD11 LEU 102 -10.832 -3.832 1.367 780 HD12 LEU 102 HD12 LEU 102 -10.714 -2.076 1.483 781 HD13 LEU 102 HD13 LEU 102 -10.897 -3.046 2.945 782 HD21 LEU 102 HD21 LEU 102 -7.654 -4.235 0.762 783 HD22 LEU 102 HD22 LEU 102 -9.274 -4.909 0.938 784 HD23 LEU 102 HD23 LEU 102 -8.096 -5.088 2.240 785 H LEU 103 HN LEU 103 -7.805 -3.848 -1.150 786 HA LEU 103 HA LEU 103 -9.939 -5.701 -0.903 787 HB2 LEU 103 HB2 LEU 103 -10.436 -5.492 -3.564 788 HB3 LEU 103 HB1 LEU 103 -11.390 -4.681 -2.343 789 HG LEU 103 HG LEU 103 -10.357 -2.595 -2.735 790 HD11 LEU 103 HD11 LEU 103 -8.070 -2.779 -2.823 791 HD12 LEU 103 HD12 LEU 103 -8.375 -2.687 -4.554 792 HD13 LEU 103 HD13 LEU 103 -8.120 -4.250 -3.788 793 HD21 LEU 103 HD21 LEU 103 -11.588 -3.956 -4.787 794 HD22 LEU 103 HD22 LEU 103 -10.104 -3.392 -5.551 795 HD23 LEU 103 HD23 LEU 103 -11.205 -2.235 -4.804 796 H THR 104 HN THR 104 -8.898 -5.941 -4.138 797 HA THR 104 HA THR 104 -6.562 -7.591 -3.318 798 HB THR 104 HB THR 104 -8.239 -9.111 -4.027 799 HG1 THR 104 HG1 THR 104 -7.296 -9.966 -5.740 800 HG21 THR 104 HG21 THR 104 -9.407 -8.568 -6.320 801 HG22 THR 104 HG22 THR 104 -8.930 -6.912 -5.950 802 HG23 THR 104 HG23 THR 104 -9.982 -7.793 -4.843 803 H LYS 105 HN LYS 105 -6.795 -7.637 -6.654 804 HA LYS 105 HA LYS 105 -5.680 -4.995 -7.208 805 HB2 LYS 105 HB2 LYS 105 -3.431 -5.477 -7.164 806 HB3 LYS 105 HB1 LYS 105 -3.996 -6.537 -5.880 807 HG2 LYS 105 HG2 LYS 105 -3.518 -7.369 -8.752 808 HG3 LYS 105 HG1 LYS 105 -2.453 -7.689 -7.409 809 HD2 LYS 105 HD2 LYS 105 -3.614 -9.535 -6.883 810 HD3 LYS 105 HD1 LYS 105 -5.077 -8.575 -6.686 811 HE2 LYS 105 HE2 LYS 105 -5.782 -9.908 -8.444 812 HE3 LYS 105 HE1 LYS 105 -4.962 -8.651 -9.393 813 HZ1 LYS 105 HZ1 LYS 105 -3.407 -10.880 -8.259 814 HZ2 LYS 105 HZ2 LYS 105 -3.067 -9.915 -9.615 815 HZ3 LYS 105 HZ3 LYS 105 -4.266 -11.115 -9.704 816 HA PRO 106 HA PRO 106 -6.913 -7.914 -10.838 817 HB2 PRO 106 HB2 PRO 106 -9.380 -6.767 -11.327 818 HB3 PRO 106 HB1 PRO 106 -9.155 -8.240 -10.358 819 HG2 PRO 106 HG2 PRO 106 -9.432 -5.401 -9.435 820 HG3 PRO 106 HG1 PRO 106 -10.235 -6.863 -8.825 821 HD2 PRO 106 HD2 PRO 106 -8.143 -5.880 -7.521 822 HD3 PRO 106 HD1 PRO 106 -8.298 -7.634 -7.753 823 H PHE 107 HN PHE 107 -6.773 -4.639 -9.857 824 HA PHE 107 HA PHE 107 -5.999 -2.719 -10.924 825 HB2 PHE 107 HB2 PHE 107 -5.073 -5.010 -12.574 826 HB3 PHE 107 HB1 PHE 107 -4.938 -3.401 -13.291 827 HD1 PHE 107 HD1 PHE 107 -4.156 -1.531 -11.509 828 HD2 PHE 107 HD2 PHE 107 -3.257 -5.724 -11.282 829 HE1 PHE 107 HE1 PHE 107 -2.226 -1.036 -10.040 830 HE2 PHE 107 HE2 PHE 107 -1.317 -5.229 -9.817 831 HZ PHE 107 HZ PHE 107 -0.793 -2.874 -9.204 832 H LEU 108 HN LEU 108 -8.650 -4.362 -11.885 833 HA LEU 108 HA LEU 108 -9.282 -2.673 -14.233 834 HB2 LEU 108 HB2 LEU 108 -10.340 -4.658 -14.647 835 HB3 LEU 108 HB1 LEU 108 -10.155 -5.178 -12.977 836 HG LEU 108 HG LEU 108 -12.205 -3.083 -13.603 837 HD11 LEU 108 HD11 LEU 108 -13.341 -5.739 -13.654 838 HD12 LEU 108 HD12 LEU 108 -12.140 -5.572 -14.935 839 HD13 LEU 108 HD13 LEU 108 -13.497 -4.448 -14.845 840 HD21 LEU 108 HD21 LEU 108 -13.273 -3.996 -11.669 841 HD22 LEU 108 HD22 LEU 108 -11.555 -3.948 -11.275 842 HD23 LEU 108 HD23 LEU 108 -12.308 -5.471 -11.746 843 H ASP 109 HN ASP 109 -9.365 -2.639 -10.867 844 HA ASP 109 HA ASP 109 -10.583 -0.061 -10.624 845 HB2 ASP 109 HB2 ASP 109 -12.319 -2.288 -10.939 846 HB3 ASP 109 HB1 ASP 109 -12.479 -1.738 -9.272 847 H SER 110 HN SER 110 -8.585 -2.347 -9.366 848 HA SER 110 HA SER 110 -9.278 -2.052 -6.526 849 HB2 SER 110 HB2 SER 110 -8.532 -4.169 -7.459 850 HB3 SER 110 HB1 SER 110 -7.042 -3.432 -8.031 851 HG SER 110 HG SER 110 -6.432 -3.098 -5.909 852 H GLU 111 HN GLU 111 -5.900 -2.095 -7.437 853 HA GLU 111 HA GLU 111 -4.846 -0.281 -5.722 854 HB2 GLU 111 HB2 GLU 111 -4.347 -0.924 -8.596 855 HB3 GLU 111 HB1 GLU 111 -3.446 0.427 -7.904 856 HG2 GLU 111 HG2 GLU 111 -3.578 -2.074 -6.287 857 HG3 GLU 111 HG1 GLU 111 -2.571 -2.108 -7.734 858 H LEU 112 HN LEU 112 -6.613 0.613 -8.660 859 HA LEU 112 HA LEU 112 -6.269 3.468 -8.473 860 HB2 LEU 112 HB2 LEU 112 -8.713 2.025 -9.523 861 HB3 LEU 112 HB1 LEU 112 -7.966 3.496 -10.147 862 HG LEU 112 HG LEU 112 -5.984 1.461 -10.189 863 HD11 LEU 112 HD11 LEU 112 -8.671 0.450 -10.607 864 HD12 LEU 112 HD12 LEU 112 -7.146 -0.433 -10.545 865 HD13 LEU 112 HD13 LEU 112 -7.695 0.271 -12.065 866 HD21 LEU 112 HD21 LEU 112 -5.677 2.880 -11.938 867 HD22 LEU 112 HD22 LEU 112 -7.385 3.317 -11.983 868 HD23 LEU 112 HD23 LEU 112 -6.827 1.855 -12.795 869 H GLU 113 HN GLU 113 -9.034 1.397 -7.649 870 HA GLU 113 HA GLU 113 -10.648 3.216 -6.267 871 HB2 GLU 113 HB2 GLU 113 -11.349 0.974 -6.790 872 HB3 GLU 113 HB1 GLU 113 -9.996 0.277 -5.892 873 HG2 GLU 113 HG2 GLU 113 -11.704 0.025 -4.362 874 HG3 GLU 113 HG1 GLU 113 -11.074 1.597 -3.882 875 H ALA 114 HN ALA 114 -7.606 1.755 -5.334 876 HA ALA 114 HA ALA 114 -7.793 2.072 -2.501 877 HB1 ALA 114 HB1 ALA 114 -5.160 2.502 -3.742 878 HB2 ALA 114 HB2 ALA 114 -6.011 1.080 -4.347 879 HB3 ALA 114 HB3 ALA 114 -5.675 1.240 -2.622 880 H VAL 115 HN VAL 115 -6.484 4.250 -5.001 881 HA VAL 115 HA VAL 115 -6.351 6.407 -2.924 882 HB VAL 115 HB VAL 115 -5.209 6.367 -5.730 883 HG11 VAL 115 HG11 VAL 115 -4.140 7.821 -3.320 884 HG12 VAL 115 HG12 VAL 115 -5.467 8.509 -4.256 885 HG13 VAL 115 HG13 VAL 115 -3.913 8.195 -5.029 886 HG21 VAL 115 HG21 VAL 115 -4.406 4.916 -3.304 887 HG22 VAL 115 HG22 VAL 115 -3.119 5.923 -3.968 888 HG23 VAL 115 HG23 VAL 115 -3.880 4.688 -4.972 889 H LEU 116 HN LEU 116 -8.204 5.348 -5.616 890 HA LEU 116 HA LEU 116 -9.129 7.997 -6.452 891 HB2 LEU 116 HB2 LEU 116 -8.969 6.119 -8.009 892 HB3 LEU 116 HB1 LEU 116 -10.076 5.170 -7.016 893 HG LEU 116 HG LEU 116 -11.203 7.774 -7.656 894 HD11 LEU 116 HD11 LEU 116 -10.865 7.940 -9.875 895 HD12 LEU 116 HD12 LEU 116 -11.326 6.256 -10.119 896 HD13 LEU 116 HD13 LEU 116 -9.656 6.665 -9.727 897 HD21 LEU 116 HD21 LEU 116 -13.033 6.482 -7.418 898 HD22 LEU 116 HD22 LEU 116 -11.997 5.063 -7.262 899 HD23 LEU 116 HD23 LEU 116 -12.581 5.557 -8.850 900 H VAL 117 HN VAL 117 -9.994 5.803 -3.923 901 HA VAL 117 HA VAL 117 -12.787 6.750 -3.766 902 HB VAL 117 HB VAL 117 -11.151 4.919 -2.031 903 HG11 VAL 117 HG11 VAL 117 -13.299 4.152 -1.166 904 HG12 VAL 117 HG12 VAL 117 -14.147 5.275 -2.229 905 HG13 VAL 117 HG13 VAL 117 -13.146 5.891 -0.914 906 HG21 VAL 117 HG21 VAL 117 -11.630 4.386 -4.561 907 HG22 VAL 117 HG22 VAL 117 -13.264 4.060 -3.981 908 HG23 VAL 117 HG23 VAL 117 -11.903 3.138 -3.345 909 H GLN 118 HN GLN 118 -9.797 7.886 -2.682 910 HA GLN 118 HA GLN 118 -10.772 8.911 -0.096 911 HB2 GLN 118 HB2 GLN 118 -8.466 8.121 -0.397 912 HB3 GLN 118 HB1 GLN 118 -8.208 9.318 -1.668 913 HG2 GLN 118 HG2 GLN 118 -9.252 10.664 0.633 914 HG3 GLN 118 HG1 GLN 118 -7.895 9.660 1.148 915 HE21 GLN 118 HE21 GLN 118 -8.666 11.783 -1.683 916 HE22 GLN 118 HE22 GLN 118 -7.145 12.535 -1.711 917 H ILE 119 HN ILE 119 -10.910 9.941 -3.349 918 HA ILE 119 HA ILE 119 -10.721 12.808 -2.791 919 HB ILE 119 HB ILE 119 -11.656 12.873 -5.212 920 HG12 ILE 119 HG12 ILE 119 -11.601 10.848 -6.461 921 HG13 ILE 119 HG11 ILE 119 -10.841 9.963 -5.142 922 HG21 ILE 119 HG21 ILE 119 -9.224 11.389 -5.551 923 HG22 ILE 119 HG22 ILE 119 -9.093 12.378 -4.097 924 HG23 ILE 119 HG23 ILE 119 -9.472 13.132 -5.645 925 HD11 ILE 119 HD11 ILE 119 -12.834 10.001 -3.839 926 HD12 ILE 119 HD12 ILE 119 -13.349 9.575 -5.470 927 HD13 ILE 119 HD13 ILE 119 -13.568 11.221 -4.877 928 H SER 120 HN SER 120 -13.058 10.563 -2.071 929 HA SER 120 HA SER 120 -15.220 12.643 -2.190 930 HB2 SER 120 HB2 SER 120 -15.441 9.628 -2.484 931 HB3 SER 120 HB1 SER 120 -16.781 10.767 -2.565 932 HG SER 120 HG SER 120 -16.097 11.459 -4.480 933 H LYS 121 HN LYS 121 -16.848 10.452 -0.731 934 HA LYS 121 HA LYS 121 -17.278 9.794 1.509 935 HB2 LYS 121 HB2 LYS 121 -14.777 9.165 1.184 936 HB3 LYS 121 HB1 LYS 121 -14.444 10.625 2.113 937 HG2 LYS 121 HG2 LYS 121 -15.752 9.802 3.985 938 HG3 LYS 121 HG1 LYS 121 -16.270 8.396 3.051 939 HD2 LYS 121 HD2 LYS 121 -14.508 7.448 4.206 940 HD3 LYS 121 HD1 LYS 121 -13.637 8.051 2.795 941 HE2 LYS 121 HE2 LYS 121 -13.518 10.270 4.326 942 HE3 LYS 121 HE1 LYS 121 -13.594 9.045 5.606 943 HZ1 LYS 121 HZ1 LYS 121 -11.672 9.197 3.355 944 HZ2 LYS 121 HZ2 LYS 121 -11.875 7.797 4.295 945 HZ3 LYS 121 HZ3 LYS 121 -11.328 9.236 5.015 946 H GLU 122 HN GLU 122 -14.941 12.460 1.701 947 HA GLU 122 HA GLU 122 -16.976 14.056 3.213 948 HB2 GLU 122 HB2 GLU 122 -14.634 15.010 4.140 949 HB3 GLU 122 HB1 GLU 122 -15.405 13.596 4.856 950 HG2 GLU 122 HG2 GLU 122 -14.002 12.091 3.646 951 HG3 GLU 122 HG1 GLU 122 -13.421 13.370 2.582 952 H VAL 123 HN VAL 123 -16.194 13.893 0.310 953 HA VAL 123 HA VAL 123 -15.725 15.352 -1.469 954 HB VAL 123 HB VAL 123 -16.622 17.392 0.544 955 HG11 VAL 123 HG11 VAL 123 -16.049 18.475 -1.478 956 HG12 VAL 123 HG12 VAL 123 -17.792 18.238 -1.599 957 HG13 VAL 123 HG13 VAL 123 -16.695 17.158 -2.458 958 HG21 VAL 123 HG21 VAL 123 -18.036 15.290 0.523 959 HG22 VAL 123 HG22 VAL 123 -18.376 15.627 -1.175 960 HG23 VAL 123 HG23 VAL 123 -18.900 16.759 0.072 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 11.539 18.879 8.040 2 H2 GLY 1 HT2 GLY 1 12.485 20.017 7.205 3 H3 GLY 1 HT3 GLY 1 10.806 20.240 7.341 4 HA2 GLY 1 HA2 GLY 1 12.440 20.051 9.777 5 HA3 GLY 1 HA1 GLY 1 12.391 21.566 8.875 6 H SER 2 HN SER 2 10.850 22.933 9.601 7 HA SER 2 HA SER 2 8.768 23.699 10.420 8 HB2 SER 2 HB2 SER 2 8.327 21.529 8.721 9 HB3 SER 2 HB1 SER 2 7.403 21.126 10.166 10 HG SER 2 HG SER 2 6.347 22.481 8.504 11 H HIS 3 HN HIS 3 6.868 22.509 11.996 12 HA HIS 3 HA HIS 3 8.227 22.178 14.536 13 HB2 HIS 3 HB2 HIS 3 5.344 21.569 13.816 14 HB3 HIS 3 HB1 HIS 3 5.973 22.099 15.378 15 HD1 HIS 3 HD1 HIS 3 7.825 24.383 14.355 16 HD2 HIS 3 HD2 HIS 3 3.870 23.860 13.143 17 HE1 HIS 3 HE1 HIS 3 7.028 26.637 13.518 18 H MET 4 HN MET 4 5.868 19.977 14.918 19 HA MET 4 HA MET 4 7.584 17.722 15.193 20 HB2 MET 4 HB2 MET 4 5.460 16.507 15.435 21 HB3 MET 4 HB1 MET 4 5.345 18.069 16.246 22 HG2 MET 4 HG2 MET 4 4.429 18.889 13.922 23 HG3 MET 4 HG1 MET 4 4.086 17.178 13.670 24 HE1 MET 4 HE1 MET 4 1.807 16.136 14.439 25 HE2 MET 4 HE2 MET 4 1.566 16.147 16.184 26 HE3 MET 4 HE3 MET 4 3.143 15.725 15.523 27 H THR 5 HN THR 5 5.910 15.764 13.709 28 HA THR 5 HA THR 5 6.874 16.370 10.936 29 HB THR 5 HB THR 5 7.065 13.809 10.851 30 HG1 THR 5 HG1 THR 5 7.227 14.033 13.649 31 HG21 THR 5 HG21 THR 5 9.259 14.205 11.154 32 HG22 THR 5 HG22 THR 5 9.023 14.500 12.875 33 HG23 THR 5 HG23 THR 5 8.823 15.817 11.720 34 H GLU 6 HN GLU 6 5.521 15.664 9.247 35 HA GLU 6 HA GLU 6 2.975 14.322 9.842 36 HB2 GLU 6 HB2 GLU 6 1.579 16.196 9.366 37 HB3 GLU 6 HB1 GLU 6 2.827 16.818 10.446 38 HG2 GLU 6 HG2 GLU 6 4.099 17.658 8.516 39 HG3 GLU 6 HG1 GLU 6 2.872 17.019 7.420 40 H ARG 7 HN ARG 7 5.516 14.597 7.863 41 HA ARG 7 HA ARG 7 3.915 14.243 5.359 42 HB2 ARG 7 HB2 ARG 7 5.694 16.127 5.733 43 HB3 ARG 7 HB1 ARG 7 6.866 14.829 5.498 44 HG2 ARG 7 HG2 ARG 7 6.397 15.938 3.358 45 HG3 ARG 7 HG1 ARG 7 5.799 14.280 3.325 46 HD2 ARG 7 HD2 ARG 7 3.800 15.167 2.681 47 HD3 ARG 7 HD1 ARG 7 3.648 15.769 4.343 48 HE ARG 7 HE ARG 7 5.035 17.778 3.478 49 HH11 ARG 7 HH11 ARG 7 2.020 17.166 2.544 50 HH12 ARG 7 HH12 ARG 7 2.115 17.834 0.949 51 HH21 ARG 7 HH21 ARG 7 5.571 18.091 0.970 52 HH22 ARG 7 HH22 ARG 7 4.121 18.362 0.062 53 H ARG 8 HN ARG 8 4.309 12.172 7.317 54 HA ARG 8 HA ARG 8 6.455 10.377 6.660 55 HB2 ARG 8 HB2 ARG 8 4.895 8.757 7.862 56 HB3 ARG 8 HB1 ARG 8 5.297 10.225 8.755 57 HG2 ARG 8 HG2 ARG 8 3.178 11.097 8.548 58 HG3 ARG 8 HG1 ARG 8 2.901 10.329 6.986 59 HD2 ARG 8 HD2 ARG 8 2.021 8.444 7.935 60 HD3 ARG 8 HD1 ARG 8 3.210 8.445 9.253 61 HE ARG 8 HE ARG 8 0.595 9.630 9.398 62 HH11 ARG 8 HH11 ARG 8 3.882 9.875 10.394 63 HH12 ARG 8 HH12 ARG 8 3.553 11.007 11.662 64 HH21 ARG 8 HH21 ARG 8 0.163 11.212 10.966 65 HH22 ARG 8 HH22 ARG 8 1.449 11.766 11.985 66 H LEU 9 HN LEU 9 4.188 11.354 4.516 67 HA LEU 9 HA LEU 9 2.899 9.068 3.534 68 HB2 LEU 9 HB2 LEU 9 3.930 11.598 2.257 69 HB3 LEU 9 HB1 LEU 9 2.928 10.438 1.384 70 HG LEU 9 HG LEU 9 1.800 11.009 3.993 71 HD11 LEU 9 HD11 LEU 9 1.114 13.365 3.399 72 HD12 LEU 9 HD12 LEU 9 2.326 13.333 2.119 73 HD13 LEU 9 HD13 LEU 9 2.821 13.193 3.805 74 HD21 LEU 9 HD21 LEU 9 -0.198 11.361 2.656 75 HD22 LEU 9 HD22 LEU 9 0.683 9.991 1.979 76 HD23 LEU 9 HD23 LEU 9 0.768 11.569 1.195 77 H ARG 10 HN ARG 10 4.168 7.239 3.429 78 HA ARG 10 HA ARG 10 6.241 7.116 1.272 79 HB2 ARG 10 HB2 ARG 10 6.154 5.458 3.819 80 HB3 ARG 10 HB1 ARG 10 7.473 5.555 2.658 81 HG2 ARG 10 HG2 ARG 10 6.596 7.609 4.673 82 HG3 ARG 10 HG1 ARG 10 8.193 6.923 4.428 83 HD2 ARG 10 HD2 ARG 10 7.656 8.081 1.967 84 HD3 ARG 10 HD1 ARG 10 6.972 9.243 3.124 85 HE ARG 10 HE ARG 10 9.803 8.491 2.922 86 HH11 ARG 10 HH21 ARG 10 7.247 9.723 4.891 87 HH12 ARG 10 HH22 ARG 10 8.313 10.576 5.956 88 HH21 ARG 10 HH11 ARG 10 11.192 9.608 4.290 89 HH22 ARG 10 HH12 ARG 10 10.543 10.509 5.620 90 H VAL 11 HN VAL 11 5.977 5.204 -0.065 91 HA VAL 11 HA VAL 11 3.611 3.515 0.665 92 HB VAL 11 HB VAL 11 2.966 5.163 -0.986 93 HG11 VAL 11 HG11 VAL 11 5.331 5.589 -1.766 94 HG12 VAL 11 HG12 VAL 11 4.143 5.475 -3.065 95 HG13 VAL 11 HG13 VAL 11 5.208 4.114 -2.723 96 HG21 VAL 11 HG21 VAL 11 2.919 2.346 -1.435 97 HG22 VAL 11 HG22 VAL 11 3.170 3.129 -2.995 98 HG23 VAL 11 HG23 VAL 11 1.771 3.554 -2.009 99 H LEU 12 HN LEU 12 5.221 1.909 1.422 100 HA LEU 12 HA LEU 12 7.070 0.732 -0.530 101 HB2 LEU 12 HB2 LEU 12 6.117 -0.248 2.185 102 HB3 LEU 12 HB1 LEU 12 7.609 -0.709 1.361 103 HG LEU 12 HG LEU 12 6.988 2.163 2.069 104 HD11 LEU 12 HD11 LEU 12 8.387 1.880 4.060 105 HD12 LEU 12 HD12 LEU 12 8.598 0.170 3.694 106 HD13 LEU 12 HD13 LEU 12 7.007 0.787 4.140 107 HD21 LEU 12 HD21 LEU 12 9.682 1.879 2.083 108 HD22 LEU 12 HD22 LEU 12 8.767 2.292 0.634 109 HD23 LEU 12 HD23 LEU 12 9.253 0.622 0.923 110 H VAL 13 HN VAL 13 5.797 -0.116 -2.245 111 HA VAL 13 HA VAL 13 3.697 -2.131 -1.512 112 HB VAL 13 HB VAL 13 4.203 -0.511 -4.036 113 HG11 VAL 13 HG11 VAL 13 1.566 -1.663 -3.795 114 HG12 VAL 13 HG12 VAL 13 2.785 -2.932 -3.689 115 HG13 VAL 13 HG13 VAL 13 2.743 -1.862 -5.091 116 HG21 VAL 13 HG21 VAL 13 3.017 0.233 -1.602 117 HG22 VAL 13 HG22 VAL 13 1.663 -0.116 -2.677 118 HG23 VAL 13 HG23 VAL 13 2.873 1.080 -3.143 119 H VAL 14 HN VAL 14 3.941 -4.256 -2.387 120 HA VAL 14 HA VAL 14 6.181 -4.689 -4.277 121 HB VAL 14 HB VAL 14 7.245 -6.218 -2.681 122 HG11 VAL 14 HG11 VAL 14 7.772 -3.750 -2.732 123 HG12 VAL 14 HG12 VAL 14 8.162 -4.568 -1.220 124 HG13 VAL 14 HG13 VAL 14 6.708 -3.578 -1.336 125 HG21 VAL 14 HG21 VAL 14 6.332 -5.920 -0.242 126 HG22 VAL 14 HG22 VAL 14 5.546 -7.074 -1.322 127 HG23 VAL 14 HG23 VAL 14 4.837 -5.478 -1.066 128 H GLU 15 HN GLU 15 5.901 -6.451 -5.544 129 HA GLU 15 HA GLU 15 4.160 -8.701 -4.806 130 HB2 GLU 15 HB2 GLU 15 2.567 -8.323 -6.583 131 HB3 GLU 15 HB1 GLU 15 2.679 -6.827 -5.649 132 HG2 GLU 15 HG2 GLU 15 3.099 -5.797 -7.603 133 HG3 GLU 15 HG1 GLU 15 4.685 -6.566 -7.562 134 H ASP 16 HN ASP 16 4.937 -10.513 -5.798 135 HA ASP 16 HA ASP 16 7.324 -10.983 -6.896 136 HB2 ASP 16 HB2 ASP 16 6.309 -12.887 -8.047 137 HB3 ASP 16 HB1 ASP 16 5.539 -12.617 -6.484 138 H GLU 17 HN GLU 17 4.787 -9.357 -8.832 139 HA GLU 17 HA GLU 17 6.539 -9.598 -11.227 140 HB2 GLU 17 HB2 GLU 17 3.689 -8.815 -10.686 141 HB3 GLU 17 HB1 GLU 17 4.439 -8.401 -12.224 142 HG2 GLU 17 HG2 GLU 17 4.617 -10.596 -12.891 143 HG3 GLU 17 HG1 GLU 17 4.786 -11.193 -11.239 144 H SER 18 HN SER 18 6.768 -7.603 -12.607 145 HA SER 18 HA SER 18 7.688 -5.319 -10.947 146 HB2 SER 18 HB2 SER 18 8.989 -4.794 -12.865 147 HB3 SER 18 HB1 SER 18 8.982 -6.554 -12.806 148 HG SER 18 HG SER 18 6.909 -6.099 -14.167 149 H MET 19 HN MET 19 4.906 -6.192 -12.681 150 HA MET 19 HA MET 19 4.101 -3.837 -14.014 151 HB2 MET 19 HB2 MET 19 3.006 -6.296 -13.104 152 HB3 MET 19 HB1 MET 19 1.934 -5.027 -12.513 153 HG2 MET 19 HG2 MET 19 1.087 -5.488 -14.662 154 HG3 MET 19 HG1 MET 19 2.100 -4.068 -14.922 155 HE1 MET 19 HE1 MET 19 1.445 -7.720 -15.399 156 HE2 MET 19 HE2 MET 19 2.283 -8.019 -16.918 157 HE3 MET 19 HE3 MET 19 1.047 -6.766 -16.833 158 H ILE 20 HN ILE 20 4.576 -4.469 -10.650 159 HA ILE 20 HA ILE 20 2.967 -2.171 -9.722 160 HB ILE 20 HB ILE 20 3.052 -4.226 -8.447 161 HG12 ILE 20 HG12 ILE 20 4.699 -2.032 -7.161 162 HG13 ILE 20 HG11 ILE 20 2.940 -2.190 -7.108 163 HG21 ILE 20 HG21 ILE 20 6.014 -3.873 -8.764 164 HG22 ILE 20 HG22 ILE 20 5.033 -5.311 -9.045 165 HG23 ILE 20 HG23 ILE 20 5.378 -4.789 -7.398 166 HD11 ILE 20 HD11 ILE 20 4.614 -3.144 -5.173 167 HD12 ILE 20 HD12 ILE 20 4.426 -4.574 -6.189 168 HD13 ILE 20 HD13 ILE 20 3.006 -3.794 -5.492 169 H ALA 21 HN ALA 21 6.179 -2.888 -10.723 170 HA ALA 21 HA ALA 21 7.681 -0.988 -9.219 171 HB1 ALA 21 HB1 ALA 21 8.675 -2.789 -10.493 172 HB2 ALA 21 HB2 ALA 21 9.237 -1.272 -11.195 173 HB3 ALA 21 HB3 ALA 21 7.955 -2.190 -11.985 174 H MET 22 HN MET 22 7.024 -0.591 -12.712 175 HA MET 22 HA MET 22 7.319 2.231 -12.711 176 HB2 MET 22 HB2 MET 22 7.195 0.589 -14.672 177 HB3 MET 22 HB1 MET 22 5.441 0.640 -14.484 178 HG2 MET 22 HG2 MET 22 7.070 3.166 -14.767 179 HG3 MET 22 HG1 MET 22 6.477 2.287 -16.176 180 HE1 MET 22 HE1 MET 22 5.524 5.291 -13.945 181 HE2 MET 22 HE2 MET 22 4.477 5.626 -15.322 182 HE3 MET 22 HE3 MET 22 6.125 5.068 -15.594 183 H LEU 23 HN LEU 23 4.503 0.200 -12.075 184 HA LEU 23 HA LEU 23 2.466 2.171 -12.045 185 HB2 LEU 23 HB2 LEU 23 1.889 -0.129 -11.926 186 HB3 LEU 23 HB1 LEU 23 3.018 -0.431 -10.610 187 HG LEU 23 HG LEU 23 0.510 -0.346 -10.022 188 HD11 LEU 23 HD11 LEU 23 1.345 -0.133 -7.951 189 HD12 LEU 23 HD12 LEU 23 1.549 1.602 -8.190 190 HD13 LEU 23 HD13 LEU 23 2.844 0.492 -8.637 191 HD21 LEU 23 HD21 LEU 23 -0.639 1.530 -10.483 192 HD22 LEU 23 HD22 LEU 23 0.795 2.205 -11.250 193 HD23 LEU 23 HD23 LEU 23 0.498 2.484 -9.535 194 H ILE 24 HN ILE 24 5.196 1.726 -9.994 195 HA ILE 24 HA ILE 24 4.017 3.172 -7.708 196 HB ILE 24 HB ILE 24 5.830 1.163 -7.961 197 HG12 ILE 24 HG12 ILE 24 6.635 2.221 -5.595 198 HG13 ILE 24 HG11 ILE 24 5.171 3.164 -5.872 199 HG21 ILE 24 HG21 ILE 24 7.521 3.626 -7.461 200 HG22 ILE 24 HG22 ILE 24 7.489 2.754 -8.994 201 HG23 ILE 24 HG23 ILE 24 8.068 1.951 -7.535 202 HD11 ILE 24 HD11 ILE 24 4.037 0.902 -6.388 203 HD12 ILE 24 HD12 ILE 24 4.415 1.254 -4.701 204 HD13 ILE 24 HD13 ILE 24 5.452 0.171 -5.629 205 H GLU 25 HN GLU 25 6.473 3.689 -10.247 206 HA GLU 25 HA GLU 25 7.349 6.268 -9.319 207 HB2 GLU 25 HB2 GLU 25 7.505 4.576 -11.760 208 HB3 GLU 25 HB1 GLU 25 7.772 6.303 -12.008 209 HG2 GLU 25 HG2 GLU 25 9.167 5.299 -9.645 210 HG3 GLU 25 HG1 GLU 25 9.670 4.471 -11.119 211 H ASP 26 HN ASP 26 4.640 5.184 -11.291 212 HA ASP 26 HA ASP 26 3.923 7.820 -12.272 213 HB2 ASP 26 HB2 ASP 26 2.266 6.629 -13.392 214 HB3 ASP 26 HB1 ASP 26 3.402 5.319 -13.050 215 H THR 27 HN THR 27 2.843 5.778 -9.545 216 HA THR 27 HA THR 27 0.756 7.533 -8.642 217 HB THR 27 HB THR 27 1.945 6.116 -6.478 218 HG1 THR 27 HG1 THR 27 2.479 4.231 -7.331 219 HG21 THR 27 HG21 THR 27 -0.205 5.502 -6.263 220 HG22 THR 27 HG22 THR 27 -0.195 4.705 -7.836 221 HG23 THR 27 HG23 THR 27 -0.537 6.431 -7.725 222 H LEU 28 HN LEU 28 4.139 7.096 -7.529 223 HA LEU 28 HA LEU 28 4.147 9.170 -5.588 224 HB2 LEU 28 HB2 LEU 28 6.292 8.433 -5.387 225 HB3 LEU 28 HB1 LEU 28 5.898 7.279 -6.655 226 HG LEU 28 HG LEU 28 6.522 9.249 -8.276 227 HD11 LEU 28 HD11 LEU 28 7.653 11.038 -7.422 228 HD12 LEU 28 HD12 LEU 28 8.479 10.061 -6.209 229 HD13 LEU 28 HD13 LEU 28 6.826 10.607 -5.925 230 HD21 LEU 28 HD21 LEU 28 7.991 7.119 -7.030 231 HD22 LEU 28 HD22 LEU 28 9.079 8.487 -7.265 232 HD23 LEU 28 HD23 LEU 28 8.213 7.804 -8.640 233 H CYS 29 HN CYS 29 4.163 9.270 -9.057 234 HA CYS 29 HA CYS 29 5.329 11.823 -9.539 235 HB2 CYS 29 HB2 CYS 29 4.582 9.963 -11.143 236 HB3 CYS 29 HB1 CYS 29 2.951 10.614 -10.971 237 HG CYS 29 HG CYS 29 3.557 12.436 -12.521 238 H GLU 30 HN GLU 30 2.158 10.856 -8.363 239 HA GLU 30 HA GLU 30 1.106 13.605 -8.484 240 HB2 GLU 30 HB2 GLU 30 -0.406 11.882 -9.139 241 HB3 GLU 30 HB1 GLU 30 0.032 10.874 -7.760 242 HG2 GLU 30 HG2 GLU 30 -1.300 12.052 -6.302 243 HG3 GLU 30 HG1 GLU 30 -1.065 13.577 -7.157 244 H LEU 31 HN LEU 31 1.726 11.081 -6.031 245 HA LEU 31 HA LEU 31 1.188 12.814 -3.758 246 HB2 LEU 31 HB2 LEU 31 2.205 10.071 -4.334 247 HB3 LEU 31 HB1 LEU 31 2.609 10.754 -2.756 248 HG LEU 31 HG LEU 31 -0.213 11.075 -3.608 249 HD11 LEU 31 HD11 LEU 31 -0.340 8.879 -4.251 250 HD12 LEU 31 HD12 LEU 31 -0.348 8.586 -2.511 251 HD13 LEU 31 HD13 LEU 31 1.156 8.449 -3.423 252 HD21 LEU 31 HD21 LEU 31 1.365 11.209 -1.259 253 HD22 LEU 31 HD22 LEU 31 0.288 9.830 -1.044 254 HD23 LEU 31 HD23 LEU 31 -0.380 11.428 -1.380 255 H GLY 32 HN GLY 32 4.112 11.766 -5.485 256 HA2 GLY 32 HA2 GLY 32 6.271 12.730 -5.444 257 HA3 GLY 32 HA1 GLY 32 5.644 13.990 -4.367 258 H HIS 33 HN HIS 33 4.922 10.745 -3.539 259 HA HIS 33 HA HIS 33 5.708 10.628 -0.943 260 HB2 HIS 33 HB2 HIS 33 5.706 8.688 -3.218 261 HB3 HIS 33 HB1 HIS 33 6.387 8.149 -1.675 262 HD1 HIS 33 HD1 HIS 33 3.558 7.247 -2.982 263 HD2 HIS 33 HD2 HIS 33 4.133 9.931 0.147 264 HE1 HIS 33 HE1 HIS 33 1.384 7.302 -1.680 265 H GLU 34 HN GLU 34 7.625 9.917 0.204 266 HA GLU 34 HA GLU 34 10.075 11.117 -0.705 267 HB2 GLU 34 HB2 GLU 34 9.013 10.064 1.625 268 HB3 GLU 34 HB1 GLU 34 10.295 8.917 1.228 269 HG2 GLU 34 HG2 GLU 34 11.457 10.519 2.472 270 HG3 GLU 34 HG1 GLU 34 11.730 11.076 0.822 271 H VAL 35 HN VAL 35 9.018 7.705 -0.564 272 HA VAL 35 HA VAL 35 10.441 6.984 -2.972 273 HB VAL 35 HB VAL 35 12.227 7.397 -1.142 274 HG11 VAL 35 HG11 VAL 35 12.605 5.454 0.352 275 HG12 VAL 35 HG12 VAL 35 11.101 4.733 -0.223 276 HG13 VAL 35 HG13 VAL 35 11.064 6.243 0.689 277 HG21 VAL 35 HG21 VAL 35 12.072 5.640 -3.299 278 HG22 VAL 35 HG22 VAL 35 12.688 4.638 -1.983 279 HG23 VAL 35 HG23 VAL 35 13.545 6.108 -2.448 280 H ALA 36 HN ALA 36 9.372 5.205 -3.741 281 HA ALA 36 HA ALA 36 7.691 3.660 -1.853 282 HB1 ALA 36 HB1 ALA 36 6.676 4.843 -3.793 283 HB2 ALA 36 HB2 ALA 36 6.434 3.099 -3.886 284 HB3 ALA 36 HB3 ALA 36 7.671 3.871 -4.876 285 H ALA 37 HN ALA 37 7.379 1.287 -2.666 286 HA ALA 37 HA ALA 37 10.049 0.131 -3.410 287 HB1 ALA 37 HB1 ALA 37 9.363 -0.168 -1.022 288 HB2 ALA 37 HB2 ALA 37 9.480 -1.704 -1.880 289 HB3 ALA 37 HB3 ALA 37 7.900 -0.983 -1.573 290 H THR 38 HN THR 38 9.918 -1.764 -4.774 291 HA THR 38 HA THR 38 7.233 -2.263 -5.989 292 HB THR 38 HB THR 38 8.341 -0.838 -7.513 293 HG1 THR 38 HG1 THR 38 9.230 -3.377 -8.368 294 HG21 THR 38 HG21 THR 38 10.521 -0.586 -6.734 295 HG22 THR 38 HG22 THR 38 10.788 -1.535 -8.197 296 HG23 THR 38 HG23 THR 38 10.788 -2.327 -6.621 297 H ALA 39 HN ALA 39 7.170 -4.284 -7.262 298 HA ALA 39 HA ALA 39 7.340 -6.617 -7.342 299 HB1 ALA 39 HB1 ALA 39 9.789 -5.463 -7.853 300 HB2 ALA 39 HB2 ALA 39 9.381 -7.159 -8.116 301 HB3 ALA 39 HB3 ALA 39 10.164 -6.662 -6.615 302 H SER 40 HN SER 40 7.658 -8.531 -5.959 303 HA SER 40 HA SER 40 7.280 -7.859 -3.139 304 HB2 SER 40 HB2 SER 40 6.738 -10.191 -2.949 305 HB3 SER 40 HB1 SER 40 6.009 -9.577 -4.425 306 HG SER 40 HG SER 40 7.638 -11.609 -4.195 307 H ARG 41 HN ARG 41 8.890 -7.758 -1.653 308 HA ARG 41 HA ARG 41 11.304 -9.437 -2.012 309 HB2 ARG 41 HB2 ARG 41 11.278 -6.884 -2.859 310 HB3 ARG 41 HB1 ARG 41 11.632 -6.599 -1.152 311 HG2 ARG 41 HG2 ARG 41 13.791 -6.959 -1.769 312 HG3 ARG 41 HG1 ARG 41 13.339 -8.665 -1.714 313 HD2 ARG 41 HD2 ARG 41 12.447 -7.835 -4.225 314 HD3 ARG 41 HD1 ARG 41 14.014 -7.024 -4.036 315 HE ARG 41 HE ARG 41 15.051 -9.202 -3.686 316 HH11 ARG 41 HH11 ARG 41 13.269 -9.540 -6.166 317 HH12 ARG 41 HH12 ARG 41 12.539 -11.075 -5.833 318 HH21 ARG 41 HH21 ARG 41 13.426 -11.066 -2.480 319 HH22 ARG 41 HH22 ARG 41 12.631 -11.940 -3.747 320 H MET 42 HN MET 42 11.436 -10.565 -0.084 321 HA MET 42 HA MET 42 10.026 -9.960 2.293 322 HB2 MET 42 HB2 MET 42 12.405 -11.616 1.517 323 HB3 MET 42 HB1 MET 42 11.976 -11.483 3.223 324 HG2 MET 42 HG2 MET 42 9.546 -11.922 1.866 325 HG3 MET 42 HG1 MET 42 10.700 -13.045 1.146 326 HE1 MET 42 HE1 MET 42 10.543 -15.500 2.173 327 HE2 MET 42 HE2 MET 42 11.581 -15.560 3.593 328 HE3 MET 42 HE3 MET 42 12.066 -14.600 2.197 329 H GLN 43 HN GLN 43 13.233 -8.924 1.209 330 HA GLN 43 HA GLN 43 14.110 -7.835 3.736 331 HB2 GLN 43 HB2 GLN 43 14.854 -7.174 0.867 332 HB3 GLN 43 HB1 GLN 43 15.815 -6.774 2.291 333 HG2 GLN 43 HG2 GLN 43 15.166 -9.524 1.210 334 HG3 GLN 43 HG1 GLN 43 16.757 -8.787 1.401 335 HE21 GLN 43 HE21 GLN 43 16.488 -7.733 4.041 336 HE22 GLN 43 HE22 GLN 43 16.322 -9.025 5.128 337 H GLU 44 HN GLU 44 12.442 -6.442 0.908 338 HA GLU 44 HA GLU 44 12.415 -3.752 2.011 339 HB2 GLU 44 HB2 GLU 44 10.935 -5.091 -0.272 340 HB3 GLU 44 HB1 GLU 44 10.979 -3.350 0.012 341 HG2 GLU 44 HG2 GLU 44 13.634 -4.620 -0.010 342 HG3 GLU 44 HG1 GLU 44 12.778 -4.722 -1.549 343 H ALA 45 HN ALA 45 9.822 -6.126 1.305 344 HA ALA 45 HA ALA 45 7.613 -4.875 2.408 345 HB1 ALA 45 HB1 ALA 45 7.154 -6.958 1.518 346 HB2 ALA 45 HB2 ALA 45 7.193 -7.403 3.225 347 HB3 ALA 45 HB3 ALA 45 8.606 -7.682 2.208 348 H LEU 46 HN LEU 46 9.847 -6.981 4.240 349 HA LEU 46 HA LEU 46 8.879 -6.732 6.818 350 HB2 LEU 46 HB2 LEU 46 10.890 -7.994 6.010 351 HB3 LEU 46 HB1 LEU 46 11.771 -6.468 5.925 352 HG LEU 46 HG LEU 46 10.457 -7.486 8.459 353 HD11 LEU 46 HD11 LEU 46 12.565 -8.721 7.241 354 HD12 LEU 46 HD12 LEU 46 12.324 -8.681 8.989 355 HD13 LEU 46 HD13 LEU 46 13.403 -7.516 8.219 356 HD21 LEU 46 HD21 LEU 46 10.837 -5.258 8.888 357 HD22 LEU 46 HD22 LEU 46 12.096 -5.131 7.659 358 HD23 LEU 46 HD23 LEU 46 12.462 -5.850 9.228 359 H ASP 47 HN ASP 47 10.835 -4.373 5.021 360 HA ASP 47 HA ASP 47 11.218 -2.483 7.114 361 HB2 ASP 47 HB2 ASP 47 12.040 -2.769 4.564 362 HB3 ASP 47 HB1 ASP 47 10.786 -1.553 4.317 363 H ILE 48 HN ILE 48 8.532 -2.895 4.813 364 HA ILE 48 HA ILE 48 7.179 -0.475 5.500 365 HB ILE 48 HB ILE 48 5.554 -1.221 4.006 366 HG12 ILE 48 HG12 ILE 48 6.063 -3.970 5.132 367 HG13 ILE 48 HG11 ILE 48 4.571 -3.048 5.132 368 HG21 ILE 48 HG21 ILE 48 7.974 -1.471 3.125 369 HG22 ILE 48 HG22 ILE 48 6.653 -2.164 2.185 370 HG23 ILE 48 HG23 ILE 48 7.654 -3.202 3.199 371 HD11 ILE 48 HD11 ILE 48 5.228 -3.262 2.426 372 HD12 ILE 48 HD12 ILE 48 3.988 -4.186 3.273 373 HD13 ILE 48 HD13 ILE 48 5.613 -4.849 3.092 374 H ALA 49 HN ALA 49 6.904 -3.812 6.776 375 HA ALA 49 HA ALA 49 4.685 -3.088 8.504 376 HB1 ALA 49 HB1 ALA 49 5.244 -5.363 7.521 377 HB2 ALA 49 HB2 ALA 49 4.901 -5.372 9.251 378 HB3 ALA 49 HB3 ALA 49 6.568 -5.455 8.683 379 H ARG 50 HN ARG 50 8.101 -3.976 9.205 380 HA ARG 50 HA ARG 50 8.022 -3.360 11.978 381 HB2 ARG 50 HB2 ARG 50 9.972 -3.918 9.860 382 HB3 ARG 50 HB1 ARG 50 10.618 -2.886 11.141 383 HG2 ARG 50 HG2 ARG 50 11.040 -4.992 12.029 384 HG3 ARG 50 HG1 ARG 50 9.456 -4.653 12.726 385 HD2 ARG 50 HD2 ARG 50 8.371 -5.921 10.897 386 HD3 ARG 50 HD1 ARG 50 9.967 -6.273 10.203 387 HE ARG 50 HE ARG 50 10.032 -7.002 12.951 388 HH11 ARG 50 HH11 ARG 50 7.336 -8.088 12.425 389 HH12 ARG 50 HH12 ARG 50 7.668 -9.663 11.785 390 HH21 ARG 50 HH21 ARG 50 10.990 -8.959 11.074 391 HH22 ARG 50 HH22 ARG 50 9.740 -10.157 11.022 392 H LYS 51 HN LYS 51 8.117 -1.238 9.229 393 HA LYS 51 HA LYS 51 9.467 1.011 10.331 394 HB2 LYS 51 HB2 LYS 51 8.999 0.878 7.997 395 HB3 LYS 51 HB1 LYS 51 7.277 0.632 8.281 396 HG2 LYS 51 HG2 LYS 51 7.006 2.852 8.071 397 HG3 LYS 51 HG1 LYS 51 7.911 3.052 9.567 398 HD2 LYS 51 HD2 LYS 51 9.690 2.533 7.326 399 HD3 LYS 51 HD1 LYS 51 8.686 3.952 7.029 400 HE2 LYS 51 HE2 LYS 51 9.371 4.897 9.217 401 HE3 LYS 51 HE1 LYS 51 10.402 3.478 9.493 402 HZ1 LYS 51 HZ1 LYS 51 10.650 5.562 7.414 403 HZ2 LYS 51 HZ2 LYS 51 11.320 4.019 7.174 404 HZ3 LYS 51 HZ3 LYS 51 11.837 4.978 8.477 405 H GLY 52 HN GLY 52 5.965 0.211 10.338 406 HA2 GLY 52 HA2 GLY 52 4.416 0.715 12.071 407 HA3 GLY 52 HA1 GLY 52 5.673 1.636 12.891 408 H GLN 53 HN GLN 53 6.255 3.245 10.420 409 HA GLN 53 HA GLN 53 3.718 4.843 10.315 410 HB2 GLN 53 HB2 GLN 53 5.446 6.827 10.377 411 HB3 GLN 53 HB1 GLN 53 4.990 6.025 11.878 412 HG2 GLN 53 HG2 GLN 53 7.003 4.532 11.608 413 HG3 GLN 53 HG1 GLN 53 7.487 5.525 10.232 414 HE21 GLN 53 HE21 GLN 53 7.151 5.481 13.754 415 HE22 GLN 53 HE22 GLN 53 7.978 6.937 14.030 416 H PHE 54 HN PHE 54 5.010 3.014 8.297 417 HA PHE 54 HA PHE 54 6.241 4.641 6.240 418 HB2 PHE 54 HB2 PHE 54 5.879 2.615 4.867 419 HB3 PHE 54 HB1 PHE 54 6.581 2.230 6.430 420 HD1 PHE 54 HD2 PHE 54 3.342 3.028 7.317 421 HD2 PHE 54 HD1 PHE 54 5.482 0.029 5.169 422 HE1 PHE 54 HE2 PHE 54 1.518 1.446 7.750 423 HE2 PHE 54 HE1 PHE 54 3.670 -1.577 5.622 424 HZ PHE 54 HZ PHE 54 1.679 -0.881 6.904 425 H ASP 55 HN ASP 55 3.130 4.849 7.321 426 HA ASP 55 HA ASP 55 1.252 5.910 6.372 427 HB2 ASP 55 HB2 ASP 55 3.372 6.950 5.114 428 HB3 ASP 55 HB1 ASP 55 2.617 6.136 3.742 429 H ILE 56 HN ILE 56 2.846 3.619 4.028 430 HA ILE 56 HA ILE 56 0.265 2.170 3.825 431 HB ILE 56 HB ILE 56 1.503 3.872 1.669 432 HG12 ILE 56 HG12 ILE 56 -1.245 3.523 2.886 433 HG13 ILE 56 HG11 ILE 56 -0.227 4.964 2.897 434 HG21 ILE 56 HG21 ILE 56 1.231 1.660 0.661 435 HG22 ILE 56 HG22 ILE 56 -0.020 2.743 0.049 436 HG23 ILE 56 HG23 ILE 56 -0.413 1.551 1.288 437 HD11 ILE 56 HD11 ILE 56 -1.659 3.734 0.531 438 HD12 ILE 56 HD12 ILE 56 -0.409 4.967 0.357 439 HD13 ILE 56 HD13 ILE 56 -1.901 5.339 1.223 440 H ALA 57 HN ALA 57 0.467 0.088 2.693 441 HA ALA 57 HA ALA 57 3.160 -0.768 1.746 442 HB1 ALA 57 HB1 ALA 57 3.690 -1.601 3.781 443 HB2 ALA 57 HB2 ALA 57 2.404 -2.782 3.537 444 HB3 ALA 57 HB3 ALA 57 2.069 -1.282 4.402 445 H ILE 58 HN ILE 58 2.888 -2.559 0.230 446 HA ILE 58 HA ILE 58 0.181 -3.813 0.225 447 HB ILE 58 HB ILE 58 1.485 -2.261 -2.008 448 HG12 ILE 58 HG12 ILE 58 -0.982 -1.298 -1.865 449 HG13 ILE 58 HG11 ILE 58 -0.894 -1.932 -0.221 450 HG21 ILE 58 HG21 ILE 58 0.507 -4.408 -2.830 451 HG22 ILE 58 HG22 ILE 58 -0.346 -2.990 -3.438 452 HG23 ILE 58 HG23 ILE 58 -1.038 -3.937 -2.121 453 HD11 ILE 58 HD11 ILE 58 1.568 -0.641 -0.676 454 HD12 ILE 58 HD12 ILE 58 0.257 -0.097 0.370 455 HD13 ILE 58 HD13 ILE 58 0.331 0.446 -1.307 456 H ILE 59 HN ILE 59 0.959 -5.911 0.611 457 HA ILE 59 HA ILE 59 3.067 -7.090 -1.148 458 HB ILE 59 HB ILE 59 1.259 -8.507 0.820 459 HG12 ILE 59 HG12 ILE 59 1.957 -6.778 2.236 460 HG13 ILE 59 HG11 ILE 59 3.185 -8.005 2.501 461 HG21 ILE 59 HG21 ILE 59 4.028 -8.912 -0.270 462 HG22 ILE 59 HG22 ILE 59 2.638 -9.990 -0.362 463 HG23 ILE 59 HG23 ILE 59 3.470 -9.755 1.175 464 HD11 ILE 59 HD11 ILE 59 3.669 -5.372 1.844 465 HD12 ILE 59 HD12 ILE 59 3.832 -6.183 0.292 466 HD13 ILE 59 HD13 ILE 59 4.817 -6.693 1.656 467 H ASP 60 HN ASP 60 1.358 -6.330 -2.887 468 HA ASP 60 HA ASP 60 -1.150 -7.448 -3.249 469 HB2 ASP 60 HB2 ASP 60 -0.671 -5.868 -4.827 470 HB3 ASP 60 HB1 ASP 60 1.028 -6.318 -4.895 471 H VAL 61 HN VAL 61 -1.787 -8.993 -4.953 472 HA VAL 61 HA VAL 61 -2.110 -11.209 -5.518 473 HB VAL 61 HB VAL 61 -0.311 -10.444 -7.029 474 HG11 VAL 61 HG11 VAL 61 1.411 -11.581 -4.828 475 HG12 VAL 61 HG12 VAL 61 1.586 -10.044 -5.674 476 HG13 VAL 61 HG13 VAL 61 1.987 -11.554 -6.493 477 HG21 VAL 61 HG21 VAL 61 -1.349 -12.680 -7.237 478 HG22 VAL 61 HG22 VAL 61 -0.104 -13.342 -6.179 479 HG23 VAL 61 HG23 VAL 61 0.337 -12.693 -7.758 480 H ASN 62 HN ASN 62 -2.489 -12.941 -4.453 481 HA ASN 62 HA ASN 62 -0.649 -13.897 -2.318 482 HB2 ASN 62 HB2 ASN 62 -2.430 -13.859 -0.756 483 HB3 ASN 62 HB1 ASN 62 -2.646 -12.361 -1.657 484 HD21 ASN 62 HD21 ASN 62 -4.025 -12.879 -3.860 485 HD22 ASN 62 HD22 ASN 62 -5.440 -13.763 -3.584 486 H LEU 63 HN LEU 63 -1.399 -14.704 -5.128 487 HA LEU 63 HA LEU 63 -2.297 -17.491 -4.527 488 HB2 LEU 63 HB2 LEU 63 -3.569 -17.284 -6.708 489 HB3 LEU 63 HB1 LEU 63 -4.166 -16.220 -5.434 490 HG LEU 63 HG LEU 63 -2.014 -15.081 -7.116 491 HD11 LEU 63 HD11 LEU 63 -3.387 -16.356 -8.774 492 HD12 LEU 63 HD12 LEU 63 -3.486 -14.611 -9.002 493 HD13 LEU 63 HD13 LEU 63 -4.811 -15.474 -8.222 494 HD21 LEU 63 HD21 LEU 63 -4.652 -13.772 -6.743 495 HD22 LEU 63 HD22 LEU 63 -3.030 -13.119 -6.509 496 HD23 LEU 63 HD23 LEU 63 -3.764 -14.128 -5.262 497 H ASP 64 HN ASP 64 -1.910 -18.667 -6.942 498 HA ASP 64 HA ASP 64 -0.114 -19.569 -8.225 499 HB2 ASP 64 HB2 ASP 64 -0.559 -16.748 -8.685 500 HB3 ASP 64 HB1 ASP 64 1.149 -17.127 -8.931 501 H GLY 65 HN GLY 65 0.352 -18.878 -5.289 502 HA2 GLY 65 HA2 GLY 65 2.805 -19.759 -4.699 503 HA3 GLY 65 HA1 GLY 65 3.206 -18.141 -5.273 504 H GLU 66 HN GLU 66 0.530 -17.188 -4.194 505 HA GLU 66 HA GLU 66 -0.129 -16.067 -2.224 506 HB2 GLU 66 HB2 GLU 66 0.978 -18.617 -1.015 507 HB3 GLU 66 HB1 GLU 66 -0.261 -17.576 -0.311 508 HG2 GLU 66 HG2 GLU 66 -1.161 -18.173 -2.914 509 HG3 GLU 66 HG1 GLU 66 -0.564 -19.696 -2.255 510 HA PRO 67 HA PRO 67 4.326 -15.164 -1.134 511 HB2 PRO 67 HB2 PRO 67 4.786 -13.037 -2.786 512 HB3 PRO 67 HB1 PRO 67 5.090 -14.716 -3.269 513 HG2 PRO 67 HG2 PRO 67 2.913 -12.896 -4.058 514 HG3 PRO 67 HG1 PRO 67 3.618 -14.264 -4.927 515 HD2 PRO 67 HD2 PRO 67 1.186 -14.242 -3.516 516 HD3 PRO 67 HD1 PRO 67 2.031 -15.658 -4.170 517 H SER 68 HN SER 68 2.646 -14.494 0.691 518 HA SER 68 HA SER 68 2.671 -11.495 0.876 519 HB2 SER 68 HB2 SER 68 0.493 -12.981 2.222 520 HB3 SER 68 HB1 SER 68 0.425 -11.488 1.290 521 HG SER 68 HG SER 68 -0.443 -13.692 0.453 522 H TYR 69 HN TYR 69 3.596 -14.432 2.257 523 HA TYR 69 HA TYR 69 4.347 -15.108 4.362 524 HB2 TYR 69 HB2 TYR 69 5.497 -12.777 5.365 525 HB3 TYR 69 HB1 TYR 69 6.279 -13.957 4.326 526 HD1 TYR 69 HD2 TYR 69 6.382 -13.593 1.866 527 HD2 TYR 69 HD1 TYR 69 4.815 -10.629 4.537 528 HE1 TYR 69 HE2 TYR 69 6.613 -11.872 0.096 529 HE2 TYR 69 HE1 TYR 69 5.051 -8.902 2.777 530 HH TYR 69 HH TYR 69 6.822 -9.461 -0.102 531 HA PRO 70 HA PRO 70 1.745 -14.059 7.685 532 HB2 PRO 70 HB2 PRO 70 3.409 -14.058 9.860 533 HB3 PRO 70 HB1 PRO 70 2.934 -15.545 9.014 534 HG2 PRO 70 HG2 PRO 70 5.456 -13.981 8.813 535 HG3 PRO 70 HG1 PRO 70 5.212 -15.735 8.811 536 HD2 PRO 70 HD2 PRO 70 5.670 -14.284 6.549 537 HD3 PRO 70 HD1 PRO 70 4.740 -15.798 6.568 538 H VAL 71 HN VAL 71 4.211 -11.957 6.716 539 HA VAL 71 HA VAL 71 3.799 -9.911 8.757 540 HB VAL 71 HB VAL 71 5.017 -9.648 5.997 541 HG11 VAL 71 HG11 VAL 71 6.483 -8.022 7.359 542 HG12 VAL 71 HG12 VAL 71 5.227 -8.135 8.592 543 HG13 VAL 71 HG13 VAL 71 4.835 -7.515 6.988 544 HG21 VAL 71 HG21 VAL 71 5.842 -11.579 7.648 545 HG22 VAL 71 HG22 VAL 71 6.669 -10.229 8.421 546 HG23 VAL 71 HG23 VAL 71 6.996 -10.611 6.732 547 H ALA 72 HN ALA 72 3.186 -9.908 5.224 548 HA ALA 72 HA ALA 72 1.458 -7.734 5.025 549 HB1 ALA 72 HB1 ALA 72 1.038 -8.640 2.955 550 HB2 ALA 72 HB2 ALA 72 0.691 -10.237 3.618 551 HB3 ALA 72 HB3 ALA 72 2.362 -9.712 3.412 552 H ASP 73 HN ASP 73 0.488 -11.136 5.617 553 HA ASP 73 HA ASP 73 -2.256 -10.711 6.067 554 HB2 ASP 73 HB2 ASP 73 -0.166 -12.651 6.875 555 HB3 ASP 73 HB1 ASP 73 -1.695 -12.741 7.738 556 H ILE 74 HN ILE 74 0.351 -10.852 8.490 557 HA ILE 74 HA ILE 74 -1.194 -10.091 10.760 558 HB ILE 74 HB ILE 74 1.707 -9.869 9.941 559 HG12 ILE 74 HG12 ILE 74 0.375 -11.483 12.138 560 HG13 ILE 74 HG11 ILE 74 0.600 -12.090 10.498 561 HG21 ILE 74 HG21 ILE 74 1.331 -8.003 11.460 562 HG22 ILE 74 HG22 ILE 74 2.193 -9.275 12.325 563 HG23 ILE 74 HG23 ILE 74 0.464 -9.048 12.586 564 HD11 ILE 74 HD11 ILE 74 2.487 -12.077 12.633 565 HD12 ILE 74 HD12 ILE 74 3.080 -10.975 11.390 566 HD13 ILE 74 HD13 ILE 74 2.720 -12.653 10.982 567 H LEU 75 HN LEU 75 0.516 -8.213 8.312 568 HA LEU 75 HA LEU 75 0.314 -5.625 9.436 569 HB2 LEU 75 HB2 LEU 75 1.473 -6.708 7.313 570 HB3 LEU 75 HB1 LEU 75 0.012 -6.167 6.493 571 HG LEU 75 HG LEU 75 0.502 -3.881 7.668 572 HD11 LEU 75 HD11 LEU 75 2.304 -4.807 9.122 573 HD12 LEU 75 HD12 LEU 75 2.875 -3.483 8.107 574 HD13 LEU 75 HD13 LEU 75 3.258 -5.150 7.678 575 HD21 LEU 75 HD21 LEU 75 2.058 -5.065 5.361 576 HD22 LEU 75 HD22 LEU 75 2.170 -3.358 5.787 577 HD23 LEU 75 HD23 LEU 75 0.624 -4.043 5.290 578 H ALA 76 HN ALA 76 -2.114 -7.726 8.204 579 HA ALA 76 HA ALA 76 -4.047 -5.559 7.707 580 HB1 ALA 76 HB1 ALA 76 -4.921 -8.362 7.569 581 HB2 ALA 76 HB2 ALA 76 -3.518 -8.012 6.561 582 HB3 ALA 76 HB3 ALA 76 -5.012 -7.101 6.339 583 H GLU 77 HN GLU 77 -3.324 -8.104 10.050 584 HA GLU 77 HA GLU 77 -5.841 -8.083 11.421 585 HB2 GLU 77 HB2 GLU 77 -4.798 -9.765 12.527 586 HB3 GLU 77 HB1 GLU 77 -3.427 -9.476 11.465 587 HG2 GLU 77 HG2 GLU 77 -2.437 -9.341 13.575 588 HG3 GLU 77 HG1 GLU 77 -2.783 -7.646 13.238 589 H ARG 78 HN ARG 78 -2.920 -6.118 11.747 590 HA ARG 78 HA ARG 78 -4.226 -4.566 13.917 591 HB2 ARG 78 HB2 ARG 78 -2.005 -3.896 14.521 592 HB3 ARG 78 HB1 ARG 78 -1.900 -5.617 14.154 593 HG2 ARG 78 HG2 ARG 78 -1.340 -4.830 11.736 594 HG3 ARG 78 HG1 ARG 78 -0.985 -3.278 12.495 595 HD2 ARG 78 HD2 ARG 78 0.345 -5.948 13.040 596 HD3 ARG 78 HD1 ARG 78 1.105 -4.437 12.503 597 HE ARG 78 HE ARG 78 -0.154 -4.773 15.201 598 HH11 ARG 78 HH11 ARG 78 0.804 -2.190 13.517 599 HH12 ARG 78 HH12 ARG 78 2.168 -1.761 14.495 600 HH21 ARG 78 HH21 ARG 78 2.187 -4.752 16.251 601 HH22 ARG 78 HH22 ARG 78 2.951 -3.212 16.042 602 H ASN 79 HN ASN 79 -3.020 -4.478 10.671 603 HA ASN 79 HA ASN 79 -2.757 -2.667 9.136 604 HB2 ASN 79 HB2 ASN 79 -5.161 -1.859 8.777 605 HB3 ASN 79 HB1 ASN 79 -4.902 -3.601 8.734 606 HD21 ASN 79 HD21 ASN 79 -6.114 -4.841 10.180 607 HD22 ASN 79 HD22 ASN 79 -7.001 -4.209 11.482 608 H VAL 80 HN VAL 80 -1.487 -0.984 9.847 609 HA VAL 80 HA VAL 80 -2.550 1.039 11.752 610 HB VAL 80 HB VAL 80 -0.014 1.617 10.374 611 HG11 VAL 80 HG11 VAL 80 -0.326 0.888 13.273 612 HG12 VAL 80 HG12 VAL 80 -1.025 2.389 12.664 613 HG13 VAL 80 HG13 VAL 80 0.712 2.110 12.539 614 HG21 VAL 80 HG21 VAL 80 1.198 -0.285 11.624 615 HG22 VAL 80 HG22 VAL 80 0.377 -0.707 10.121 616 HG23 VAL 80 HG23 VAL 80 -0.372 -1.088 11.671 617 HA PRO 81 HA PRO 81 -3.517 3.902 8.492 618 HB2 PRO 81 HB2 PRO 81 -1.578 5.796 8.061 619 HB3 PRO 81 HB1 PRO 81 -2.717 5.863 9.423 620 HG2 PRO 81 HG2 PRO 81 0.105 4.900 9.366 621 HG3 PRO 81 HG1 PRO 81 -0.724 5.881 10.586 622 HD2 PRO 81 HD2 PRO 81 -0.286 3.261 10.922 623 HD3 PRO 81 HD1 PRO 81 -1.742 4.044 11.565 624 H PHE 82 HN PHE 82 -3.526 2.957 6.479 625 HA PHE 82 HA PHE 82 -1.153 2.843 4.819 626 HB2 PHE 82 HB2 PHE 82 -0.524 0.605 5.116 627 HB3 PHE 82 HB1 PHE 82 -0.843 1.181 6.753 628 HD1 PHE 82 HD2 PHE 82 -3.936 1.233 6.441 629 HD2 PHE 82 HD1 PHE 82 -0.962 -1.729 5.537 630 HE1 PHE 82 HE2 PHE 82 -5.620 -0.545 6.772 631 HE2 PHE 82 HE1 PHE 82 -2.656 -3.515 5.870 632 HZ PHE 82 HZ PHE 82 -4.979 -2.923 6.483 633 H ILE 83 HN ILE 83 -1.804 0.365 3.600 634 HA ILE 83 HA ILE 83 -4.535 0.261 2.675 635 HB ILE 83 HB ILE 83 -2.631 2.127 1.551 636 HG12 ILE 83 HG12 ILE 83 -5.457 1.694 0.627 637 HG13 ILE 83 HG11 ILE 83 -5.125 2.370 2.221 638 HG21 ILE 83 HG21 ILE 83 -3.121 1.669 -0.849 639 HG22 ILE 83 HG22 ILE 83 -3.892 0.156 -0.372 640 HG23 ILE 83 HG23 ILE 83 -2.165 0.390 -0.101 641 HD11 ILE 83 HD11 ILE 83 -4.137 3.481 -0.421 642 HD12 ILE 83 HD12 ILE 83 -3.756 4.144 1.167 643 HD13 ILE 83 HD13 ILE 83 -5.417 4.172 0.575 644 H PHE 84 HN PHE 84 -4.696 -1.559 1.113 645 HA PHE 84 HA PHE 84 -2.198 -3.035 0.508 646 HB2 PHE 84 HB2 PHE 84 -3.077 -3.420 2.899 647 HB3 PHE 84 HB1 PHE 84 -4.403 -4.286 2.131 648 HD1 PHE 84 HD2 PHE 84 -3.825 -6.233 0.561 649 HD2 PHE 84 HD1 PHE 84 -0.973 -4.466 3.246 650 HE1 PHE 84 HE2 PHE 84 -2.431 -8.277 0.421 651 HE2 PHE 84 HE1 PHE 84 0.409 -6.515 3.113 652 HZ PHE 84 HZ PHE 84 -0.318 -8.415 1.694 653 H ALA 85 HN ALA 85 -2.699 -5.006 -0.802 654 HA ALA 85 HA ALA 85 -5.409 -5.189 -1.910 655 HB1 ALA 85 HB1 ALA 85 -3.395 -3.542 -3.058 656 HB2 ALA 85 HB2 ALA 85 -4.982 -3.920 -3.729 657 HB3 ALA 85 HB3 ALA 85 -3.593 -4.931 -4.126 658 H THR 86 HN THR 86 -5.659 -7.116 -3.222 659 HA THR 86 HA THR 86 -3.634 -8.926 -3.998 660 HB THR 86 HB THR 86 -2.939 -9.186 -1.745 661 HG1 THR 86 HG1 THR 86 -4.287 -11.231 -1.156 662 HG21 THR 86 HG21 THR 86 -4.658 -7.951 -0.602 663 HG22 THR 86 HG22 THR 86 -4.658 -9.572 0.091 664 HG23 THR 86 HG23 THR 86 -5.896 -9.114 -1.080 665 H GLY 87 HN GLY 87 -4.935 -11.379 -3.363 666 HA2 GLY 87 HA2 GLY 87 -6.795 -11.791 -5.309 667 HA3 GLY 87 HA1 GLY 87 -6.924 -12.621 -3.754 668 H TYR 88 HN TYR 88 -8.466 -11.872 -2.229 669 HA TYR 88 HA TYR 88 -10.837 -10.680 -3.267 670 HB2 TYR 88 HB2 TYR 88 -11.378 -10.538 -0.770 671 HB3 TYR 88 HB1 TYR 88 -10.917 -12.131 -1.369 672 HD1 TYR 88 HD1 TYR 88 -9.263 -9.024 -0.042 673 HD2 TYR 88 HD2 TYR 88 -9.343 -13.319 -0.132 674 HE1 TYR 88 HE1 TYR 88 -7.400 -9.102 1.595 675 HE2 TYR 88 HE2 TYR 88 -7.480 -13.388 1.504 676 HH TYR 88 HH TYR 88 -5.479 -11.043 2.117 677 H GLY 89 HN GLY 89 -7.919 -9.168 -2.191 678 HA2 GLY 89 HA2 GLY 89 -7.427 -6.849 -2.316 679 HA3 GLY 89 HA1 GLY 89 -9.135 -6.531 -2.619 680 H SER 90 HN SER 90 -7.050 -7.765 -0.001 681 HA SER 90 HA SER 90 -7.087 -7.336 2.308 682 HB2 SER 90 HB2 SER 90 -8.327 -4.865 1.096 683 HB3 SER 90 HB1 SER 90 -8.029 -4.998 2.827 684 HG SER 90 HG SER 90 -5.964 -5.694 1.088 685 H LYS 91 HN LYS 91 -8.538 -7.206 4.181 686 HA LYS 91 HA LYS 91 -11.259 -8.228 3.573 687 HB2 LYS 91 HB2 LYS 91 -11.017 -9.075 5.967 688 HB3 LYS 91 HB1 LYS 91 -9.865 -9.754 4.818 689 HG2 LYS 91 HG2 LYS 91 -8.097 -8.791 5.855 690 HG3 LYS 91 HG1 LYS 91 -8.931 -7.246 6.011 691 HD2 LYS 91 HD2 LYS 91 -10.141 -8.054 7.974 692 HD3 LYS 91 HD1 LYS 91 -9.416 -9.652 7.793 693 HE2 LYS 91 HE2 LYS 91 -7.321 -8.934 8.534 694 HE3 LYS 91 HE1 LYS 91 -7.604 -7.257 8.026 695 HZ1 LYS 91 HZ1 LYS 91 -9.047 -6.878 9.792 696 HZ2 LYS 91 HZ2 LYS 91 -7.814 -7.802 10.508 697 HZ3 LYS 91 HZ3 LYS 91 -9.292 -8.528 10.091 698 H GLY 92 HN GLY 92 -11.772 -5.763 3.276 699 HA2 GLY 92 HA2 GLY 92 -12.626 -3.745 4.154 700 HA3 GLY 92 HA1 GLY 92 -13.305 -4.786 5.410 701 H LEU 93 HN LEU 93 -9.878 -4.315 4.726 702 HA LEU 93 HA LEU 93 -8.856 -4.183 7.253 703 HB2 LEU 93 HB2 LEU 93 -6.991 -3.211 6.244 704 HB3 LEU 93 HB1 LEU 93 -7.847 -3.850 4.842 705 HG LEU 93 HG LEU 93 -8.007 -0.996 5.860 706 HD11 LEU 93 HD11 LEU 93 -5.859 -1.655 4.741 707 HD12 LEU 93 HD12 LEU 93 -6.755 -0.420 3.863 708 HD13 LEU 93 HD13 LEU 93 -6.788 -2.095 3.312 709 HD21 LEU 93 HD21 LEU 93 -9.391 -0.556 3.934 710 HD22 LEU 93 HD22 LEU 93 -10.095 -1.938 4.768 711 HD23 LEU 93 HD23 LEU 93 -9.136 -2.186 3.313 712 H ASP 94 HN ASP 94 -8.493 -2.584 8.840 713 HA ASP 94 HA ASP 94 -10.381 -0.262 8.724 714 HB2 ASP 94 HB2 ASP 94 -10.539 -0.513 11.087 715 HB3 ASP 94 HB1 ASP 94 -10.513 -2.163 10.464 716 H THR 95 HN THR 95 -9.483 1.804 8.840 717 HA THR 95 HA THR 95 -6.857 2.293 10.015 718 HB THR 95 HB THR 95 -6.196 1.185 7.951 719 HG1 THR 95 HG1 THR 95 -4.738 2.657 7.971 720 HG21 THR 95 HG21 THR 95 -7.980 1.309 6.472 721 HG22 THR 95 HG22 THR 95 -6.876 2.497 5.778 722 HG23 THR 95 HG23 THR 95 -8.234 3.029 6.770 723 H ARG 96 HN ARG 96 -6.102 4.596 9.028 724 HA ARG 96 HA ARG 96 -8.243 6.465 9.679 725 HB2 ARG 96 HB2 ARG 96 -5.470 6.932 8.535 726 HB3 ARG 96 HB1 ARG 96 -6.440 8.084 9.458 727 HG2 ARG 96 HG2 ARG 96 -6.217 5.662 10.975 728 HG3 ARG 96 HG1 ARG 96 -4.603 6.153 10.462 729 HD2 ARG 96 HD2 ARG 96 -6.525 8.165 11.645 730 HD3 ARG 96 HD1 ARG 96 -5.483 7.166 12.679 731 HE ARG 96 HE ARG 96 -3.719 8.576 12.009 732 HH11 ARG 96 HH11 ARG 96 -5.992 10.163 10.488 733 HH12 ARG 96 HH12 ARG 96 -5.210 10.361 8.955 734 HH21 ARG 96 HH21 ARG 96 -2.744 8.016 9.609 735 HH22 ARG 96 HH22 ARG 96 -3.372 9.150 8.460 736 H TYR 97 HN TYR 97 -7.542 4.754 6.921 737 HA TYR 97 HA TYR 97 -7.889 6.877 4.937 738 HB2 TYR 97 HB2 TYR 97 -7.841 3.855 4.953 739 HB3 TYR 97 HB1 TYR 97 -8.128 4.775 3.479 740 HD1 TYR 97 HD2 TYR 97 -5.770 4.647 6.384 741 HD2 TYR 97 HD1 TYR 97 -6.298 5.455 2.202 742 HE1 TYR 97 HE2 TYR 97 -3.336 5.050 6.161 743 HE2 TYR 97 HE1 TYR 97 -3.862 5.861 1.975 744 HH TYR 97 HH TYR 97 -1.960 6.591 3.584 745 H SER 98 HN SER 98 -9.840 3.966 5.527 746 HA SER 98 HA SER 98 -12.352 4.967 6.129 747 HB2 SER 98 HB2 SER 98 -11.453 5.631 3.386 748 HB3 SER 98 HB1 SER 98 -13.096 4.997 3.497 749 HG SER 98 HG SER 98 -13.691 6.713 4.620 750 H ASN 99 HN ASN 99 -10.491 2.422 5.418 751 HA ASN 99 HA ASN 99 -10.940 0.124 5.086 752 HB2 ASN 99 HB2 ASN 99 -13.847 0.926 5.320 753 HB3 ASN 99 HB1 ASN 99 -13.081 -0.565 5.868 754 HD21 ASN 99 HD21 ASN 99 -10.749 1.178 6.938 755 HD22 ASN 99 HD22 ASN 99 -11.346 1.792 8.402 756 H ILE 100 HN ILE 100 -11.459 2.421 2.932 757 HA ILE 100 HA ILE 100 -12.924 0.705 0.980 758 HB ILE 100 HB ILE 100 -13.419 2.901 -0.143 759 HG12 ILE 100 HG12 ILE 100 -13.117 4.920 1.401 760 HG13 ILE 100 HG11 ILE 100 -11.971 3.948 2.308 761 HG21 ILE 100 HG21 ILE 100 -15.290 3.041 1.125 762 HG22 ILE 100 HG22 ILE 100 -14.376 3.340 2.602 763 HG23 ILE 100 HG23 ILE 100 -14.600 1.689 2.023 764 HD11 ILE 100 HD11 ILE 100 -11.354 3.755 -0.496 765 HD12 ILE 100 HD12 ILE 100 -10.357 4.395 0.806 766 HD13 ILE 100 HD13 ILE 100 -11.485 5.449 -0.039 767 HA PRO 101 HA PRO 101 -9.162 2.250 -1.470 768 HB2 PRO 101 HB2 PRO 101 -6.840 2.710 -0.140 769 HB3 PRO 101 HB1 PRO 101 -8.077 3.955 -0.388 770 HG2 PRO 101 HG2 PRO 101 -7.372 2.470 2.050 771 HG3 PRO 101 HG1 PRO 101 -8.112 4.061 1.860 772 HD2 PRO 101 HD2 PRO 101 -9.420 1.634 2.505 773 HD3 PRO 101 HD1 PRO 101 -10.166 3.204 2.143 774 H LEU 102 HN LEU 102 -9.558 -0.315 -1.542 775 HA LEU 102 HA LEU 102 -6.864 -1.484 -1.475 776 HB2 LEU 102 HB2 LEU 102 -7.873 -3.552 -0.220 777 HB3 LEU 102 HB1 LEU 102 -7.340 -2.154 0.700 778 HG LEU 102 HG LEU 102 -9.598 -3.141 1.344 779 HD11 LEU 102 HD11 LEU 102 -9.976 -0.307 0.526 780 HD12 LEU 102 HD12 LEU 102 -8.659 -0.685 1.625 781 HD13 LEU 102 HD13 LEU 102 -10.321 -1.077 2.066 782 HD21 LEU 102 HD21 LEU 102 -11.506 -2.275 -0.077 783 HD22 LEU 102 HD22 LEU 102 -10.570 -3.579 -0.807 784 HD23 LEU 102 HD23 LEU 102 -10.321 -1.916 -1.323 785 H LEU 103 HN LEU 103 -6.930 -3.814 -2.410 786 HA LEU 103 HA LEU 103 -9.135 -4.830 -3.873 787 HB2 LEU 103 HB2 LEU 103 -8.124 -2.335 -4.836 788 HB3 LEU 103 HB1 LEU 103 -7.758 -3.574 -6.035 789 HG LEU 103 HG LEU 103 -10.471 -2.912 -4.869 790 HD11 LEU 103 HD11 LEU 103 -10.805 -2.794 -7.493 791 HD12 LEU 103 HD12 LEU 103 -9.061 -2.528 -7.481 792 HD13 LEU 103 HD13 LEU 103 -10.128 -1.424 -6.613 793 HD21 LEU 103 HD21 LEU 103 -9.599 -5.450 -5.558 794 HD22 LEU 103 HD22 LEU 103 -10.314 -4.868 -7.059 795 HD23 LEU 103 HD23 LEU 103 -11.276 -4.913 -5.584 796 H THR 104 HN THR 104 -7.934 -5.476 -6.338 797 HA THR 104 HA THR 104 -5.558 -7.057 -5.501 798 HB THR 104 HB THR 104 -7.731 -8.279 -5.882 799 HG1 THR 104 HG1 THR 104 -5.639 -8.799 -7.723 800 HG21 THR 104 HG21 THR 104 -7.444 -6.899 -8.508 801 HG22 THR 104 HG22 THR 104 -8.898 -7.293 -7.595 802 HG23 THR 104 HG23 THR 104 -8.069 -8.546 -8.517 803 H LYS 105 HN LYS 105 -5.731 -4.350 -6.771 804 HA LYS 105 HA LYS 105 -4.532 -3.166 -8.414 805 HB2 LYS 105 HB2 LYS 105 -3.317 -5.842 -8.174 806 HB3 LYS 105 HB1 LYS 105 -2.990 -5.042 -9.710 807 HG2 LYS 105 HG2 LYS 105 -1.830 -3.305 -8.712 808 HG3 LYS 105 HG1 LYS 105 -2.725 -3.442 -7.197 809 HD2 LYS 105 HD2 LYS 105 -0.947 -4.576 -6.389 810 HD3 LYS 105 HD1 LYS 105 -1.445 -5.901 -7.442 811 HE2 LYS 105 HE2 LYS 105 0.078 -3.792 -8.833 812 HE3 LYS 105 HE1 LYS 105 1.003 -4.675 -7.600 813 HZ1 LYS 105 HZ1 LYS 105 0.684 -5.670 -9.993 814 HZ2 LYS 105 HZ2 LYS 105 -0.797 -6.192 -9.341 815 HZ3 LYS 105 HZ3 LYS 105 0.665 -6.665 -8.620 816 HA PRO 106 HA PRO 106 -7.059 -5.234 -11.857 817 HB2 PRO 106 HB2 PRO 106 -9.623 -4.442 -11.376 818 HB3 PRO 106 HB1 PRO 106 -8.974 -5.973 -10.757 819 HG2 PRO 106 HG2 PRO 106 -9.468 -3.421 -9.341 820 HG3 PRO 106 HG1 PRO 106 -9.567 -5.084 -8.748 821 HD2 PRO 106 HD2 PRO 106 -7.467 -3.325 -8.276 822 HD3 PRO 106 HD1 PRO 106 -7.412 -5.088 -8.093 823 H PHE 107 HN PHE 107 -6.495 -2.273 -10.412 824 HA PHE 107 HA PHE 107 -6.463 -0.065 -11.210 825 HB2 PHE 107 HB2 PHE 107 -6.509 -1.804 -13.673 826 HB3 PHE 107 HB1 PHE 107 -6.486 -0.042 -13.821 827 HD1 PHE 107 HD1 PHE 107 -4.738 1.193 -12.279 828 HD2 PHE 107 HD2 PHE 107 -4.464 -2.934 -13.437 829 HE1 PHE 107 HE1 PHE 107 -2.320 1.206 -11.744 830 HE2 PHE 107 HE2 PHE 107 -2.042 -2.921 -12.906 831 HZ PHE 107 HZ PHE 107 -0.962 -0.845 -12.062 832 H LEU 108 HN LEU 108 -7.920 1.521 -12.581 833 HA LEU 108 HA LEU 108 -10.109 2.360 -12.986 834 HB2 LEU 108 HB2 LEU 108 -10.035 0.035 -14.243 835 HB3 LEU 108 HB1 LEU 108 -11.066 -0.502 -12.921 836 HG LEU 108 HG LEU 108 -11.651 1.441 -15.120 837 HD11 LEU 108 HD11 LEU 108 -12.484 -1.043 -14.667 838 HD12 LEU 108 HD12 LEU 108 -13.565 0.164 -15.364 839 HD13 LEU 108 HD13 LEU 108 -13.657 -0.216 -13.644 840 HD21 LEU 108 HD21 LEU 108 -13.544 2.368 -13.724 841 HD22 LEU 108 HD22 LEU 108 -11.945 2.890 -13.196 842 HD23 LEU 108 HD23 LEU 108 -12.794 1.623 -12.313 843 H ASP 109 HN ASP 109 -10.519 3.302 -10.943 844 HA ASP 109 HA ASP 109 -11.666 3.508 -8.870 845 HB2 ASP 109 HB2 ASP 109 -13.201 1.848 -10.201 846 HB3 ASP 109 HB1 ASP 109 -12.481 0.619 -9.160 847 H SER 110 HN SER 110 -9.031 1.740 -9.549 848 HA SER 110 HA SER 110 -8.751 0.408 -6.906 849 HB2 SER 110 HB2 SER 110 -8.185 -0.785 -8.992 850 HB3 SER 110 HB1 SER 110 -7.025 0.474 -9.401 851 HG SER 110 HG SER 110 -6.248 -0.132 -7.101 852 H GLU 111 HN GLU 111 -5.815 1.461 -8.336 853 HA GLU 111 HA GLU 111 -4.750 2.775 -6.155 854 HB2 GLU 111 HB2 GLU 111 -3.341 3.954 -7.849 855 HB3 GLU 111 HB1 GLU 111 -3.529 2.236 -8.201 856 HG2 GLU 111 HG2 GLU 111 -4.759 2.621 -10.083 857 HG3 GLU 111 HG1 GLU 111 -5.586 4.010 -9.380 858 H LEU 112 HN LEU 112 -7.153 4.007 -8.397 859 HA LEU 112 HA LEU 112 -6.953 6.800 -7.785 860 HB2 LEU 112 HB2 LEU 112 -9.371 5.108 -8.522 861 HB3 LEU 112 HB1 LEU 112 -9.207 6.849 -8.762 862 HG LEU 112 HG LEU 112 -7.163 4.980 -9.926 863 HD11 LEU 112 HD11 LEU 112 -8.729 4.033 -11.251 864 HD12 LEU 112 HD12 LEU 112 -8.935 5.620 -11.994 865 HD13 LEU 112 HD13 LEU 112 -9.979 5.129 -10.661 866 HD21 LEU 112 HD21 LEU 112 -7.000 7.555 -9.814 867 HD22 LEU 112 HD22 LEU 112 -8.267 7.561 -11.041 868 HD23 LEU 112 HD23 LEU 112 -6.713 6.796 -11.380 869 H GLU 113 HN GLU 113 -9.301 4.379 -6.557 870 HA GLU 113 HA GLU 113 -10.337 5.969 -4.433 871 HB2 GLU 113 HB2 GLU 113 -10.111 3.068 -5.152 872 HB3 GLU 113 HB1 GLU 113 -10.577 3.455 -3.490 873 HG2 GLU 113 HG2 GLU 113 -12.273 5.084 -4.571 874 HG3 GLU 113 HG1 GLU 113 -11.990 4.168 -6.051 875 H ALA 114 HN ALA 114 -7.322 4.337 -4.879 876 HA ALA 114 HA ALA 114 -6.515 3.924 -2.162 877 HB1 ALA 114 HB1 ALA 114 -4.582 4.809 -4.270 878 HB2 ALA 114 HB2 ALA 114 -5.526 3.355 -4.590 879 HB3 ALA 114 HB3 ALA 114 -4.481 3.432 -3.172 880 H VAL 115 HN VAL 115 -6.537 6.742 -4.276 881 HA VAL 115 HA VAL 115 -5.288 8.385 -2.106 882 HB VAL 115 HB VAL 115 -5.827 9.341 -4.906 883 HG11 VAL 115 HG11 VAL 115 -4.074 10.812 -4.474 884 HG12 VAL 115 HG12 VAL 115 -3.308 9.722 -3.318 885 HG13 VAL 115 HG13 VAL 115 -4.754 10.621 -2.857 886 HG21 VAL 115 HG21 VAL 115 -4.793 7.367 -5.570 887 HG22 VAL 115 HG22 VAL 115 -3.901 7.204 -4.057 888 HG23 VAL 115 HG23 VAL 115 -3.375 8.372 -5.269 889 H LEU 116 HN LEU 116 -7.964 8.508 -4.485 890 HA LEU 116 HA LEU 116 -9.256 10.833 -3.509 891 HB2 LEU 116 HB2 LEU 116 -9.977 8.379 -5.053 892 HB3 LEU 116 HB1 LEU 116 -11.291 9.424 -4.510 893 HG LEU 116 HG LEU 116 -8.910 10.681 -5.815 894 HD11 LEU 116 HD11 LEU 116 -9.959 8.603 -7.117 895 HD12 LEU 116 HD12 LEU 116 -9.498 10.080 -7.963 896 HD13 LEU 116 HD13 LEU 116 -11.186 9.798 -7.535 897 HD21 LEU 116 HD21 LEU 116 -11.547 11.416 -4.946 898 HD22 LEU 116 HD22 LEU 116 -11.430 11.670 -6.687 899 HD23 LEU 116 HD23 LEU 116 -10.282 12.454 -5.602 900 H VAL 117 HN VAL 117 -9.074 7.660 -2.170 901 HA VAL 117 HA VAL 117 -11.339 7.147 -0.752 902 HB VAL 117 HB VAL 117 -9.535 5.706 -0.419 903 HG11 VAL 117 HG11 VAL 117 -7.968 8.239 -0.078 904 HG12 VAL 117 HG12 VAL 117 -7.651 6.865 -1.134 905 HG13 VAL 117 HG13 VAL 117 -7.329 6.741 0.595 906 HG21 VAL 117 HG21 VAL 117 -9.070 5.655 1.945 907 HG22 VAL 117 HG22 VAL 117 -10.702 6.296 1.756 908 HG23 VAL 117 HG23 VAL 117 -9.360 7.387 2.094 909 H GLN 118 HN GLN 118 -9.025 9.746 0.138 910 HA GLN 118 HA GLN 118 -10.492 10.383 2.569 911 HB2 GLN 118 HB2 GLN 118 -8.063 11.209 1.145 912 HB3 GLN 118 HB1 GLN 118 -8.858 12.526 2.010 913 HG2 GLN 118 HG2 GLN 118 -8.008 9.860 3.174 914 HG3 GLN 118 HG1 GLN 118 -7.290 11.434 3.520 915 HE21 GLN 118 HE21 GLN 118 -10.052 9.347 4.182 916 HE22 GLN 118 HE22 GLN 118 -10.747 10.334 5.375 917 H ILE 119 HN ILE 119 -11.649 10.730 -0.393 918 HA ILE 119 HA ILE 119 -12.483 13.575 -0.121 919 HB ILE 119 HB ILE 119 -13.252 13.293 -2.411 920 HG12 ILE 119 HG12 ILE 119 -12.529 10.753 -3.214 921 HG13 ILE 119 HG11 ILE 119 -13.225 10.464 -1.618 922 HG21 ILE 119 HG21 ILE 119 -10.895 13.698 -2.249 923 HG22 ILE 119 HG22 ILE 119 -11.104 12.432 -3.457 924 HG23 ILE 119 HG23 ILE 119 -10.569 12.019 -1.829 925 HD11 ILE 119 HD11 ILE 119 -14.952 12.319 -2.784 926 HD12 ILE 119 HD12 ILE 119 -15.254 10.590 -2.605 927 HD13 ILE 119 HD13 ILE 119 -14.558 11.215 -4.102 928 H SER 120 HN SER 120 -13.439 11.521 1.754 929 HA SER 120 HA SER 120 -15.510 11.049 2.814 930 HB2 SER 120 HB2 SER 120 -16.852 12.580 0.597 931 HB3 SER 120 HB1 SER 120 -17.277 12.511 2.304 932 HG SER 120 HG SER 120 -15.503 13.769 2.772 933 H LYS 121 HN LYS 121 -16.264 11.189 -0.692 934 HA LYS 121 HA LYS 121 -17.051 9.495 -2.144 935 HB2 LYS 121 HB2 LYS 121 -15.340 8.255 -0.132 936 HB3 LYS 121 HB1 LYS 121 -16.585 7.139 -0.695 937 HG2 LYS 121 HG2 LYS 121 -15.922 7.425 -2.985 938 HG3 LYS 121 HG1 LYS 121 -14.850 8.763 -2.569 939 HD2 LYS 121 HD2 LYS 121 -13.320 7.019 -2.699 940 HD3 LYS 121 HD1 LYS 121 -13.737 6.954 -0.986 941 HE2 LYS 121 HE2 LYS 121 -15.573 5.411 -2.707 942 HE3 LYS 121 HE1 LYS 121 -13.909 4.796 -2.683 943 HZ1 LYS 121 HZ1 LYS 121 -13.952 4.991 -0.248 944 HZ2 LYS 121 HZ2 LYS 121 -15.113 3.890 -0.819 945 HZ3 LYS 121 HZ3 LYS 121 -15.585 5.442 -0.315 946 H GLU 122 HN GLU 122 -19.264 10.175 -1.770 947 HA GLU 122 HA GLU 122 -21.472 9.990 -0.920 948 HB2 GLU 122 HB2 GLU 122 -22.282 7.754 -1.293 949 HB3 GLU 122 HB1 GLU 122 -20.968 8.002 -2.440 950 HG2 GLU 122 HG2 GLU 122 -19.449 6.712 -1.143 951 HG3 GLU 122 HG1 GLU 122 -20.510 6.738 0.267 952 H VAL 123 HN VAL 123 -19.306 10.250 1.043 953 HA VAL 123 HA VAL 123 -19.043 10.165 3.361 954 HB VAL 123 HB VAL 123 -21.925 9.335 3.168 955 HG11 VAL 123 HG11 VAL 123 -20.614 9.044 5.388 956 HG12 VAL 123 HG12 VAL 123 -22.151 9.908 5.442 957 HG13 VAL 123 HG13 VAL 123 -20.634 10.807 5.451 958 HG21 VAL 123 HG21 VAL 123 -21.530 11.449 2.008 959 HG22 VAL 123 HG22 VAL 123 -20.628 12.063 3.394 960 HG23 VAL 123 HG23 VAL 123 -22.361 11.767 3.531 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 12.813 18.374 12.385 2 H2 GLY 1 HT2 GLY 1 13.559 17.260 13.428 3 H3 GLY 1 HT3 GLY 1 14.460 18.535 12.757 4 HA2 GLY 1 HA2 GLY 1 13.529 18.642 15.205 5 HA3 GLY 1 HA1 GLY 1 13.652 20.078 14.188 6 H SER 2 HN SER 2 11.811 21.265 14.154 7 HA SER 2 HA SER 2 9.248 20.001 14.936 8 HB2 SER 2 HB2 SER 2 10.118 22.858 14.393 9 HB3 SER 2 HB1 SER 2 8.529 22.398 14.995 10 HG SER 2 HG SER 2 9.656 22.766 16.805 11 H HIS 3 HN HIS 3 8.937 22.717 12.865 12 HA HIS 3 HA HIS 3 7.641 22.849 10.873 13 HB2 HIS 3 HB2 HIS 3 9.081 22.127 9.025 14 HB3 HIS 3 HB1 HIS 3 10.060 22.830 10.310 15 HD1 HIS 3 HD1 HIS 3 9.541 19.734 8.386 16 HD2 HIS 3 HD2 HIS 3 11.468 20.816 11.920 17 HE1 HIS 3 HE1 HIS 3 11.096 17.822 8.968 18 H MET 4 HN MET 4 7.630 20.884 8.739 19 HA MET 4 HA MET 4 5.594 19.033 9.862 20 HB2 MET 4 HB2 MET 4 5.285 20.561 7.839 21 HB3 MET 4 HB1 MET 4 6.414 19.511 6.983 22 HG2 MET 4 HG2 MET 4 4.810 17.972 6.626 23 HG3 MET 4 HG1 MET 4 4.393 17.938 8.339 24 HE1 MET 4 HE1 MET 4 1.888 19.265 5.038 25 HE2 MET 4 HE2 MET 4 3.067 17.977 5.279 26 HE3 MET 4 HE3 MET 4 3.613 19.583 4.807 27 H THR 5 HN THR 5 5.645 16.734 9.033 28 HA THR 5 HA THR 5 8.469 15.757 8.836 29 HB THR 5 HB THR 5 7.605 13.735 9.890 30 HG1 THR 5 HG1 THR 5 5.496 13.371 10.101 31 HG21 THR 5 HG21 THR 5 6.161 15.699 11.553 32 HG22 THR 5 HG22 THR 5 7.809 16.162 11.128 33 HG23 THR 5 HG23 THR 5 7.509 14.642 11.971 34 H GLU 6 HN GLU 6 8.805 13.965 7.315 35 HA GLU 6 HA GLU 6 6.651 13.153 5.533 36 HB2 GLU 6 HB2 GLU 6 7.619 14.321 3.538 37 HB3 GLU 6 HB1 GLU 6 7.018 15.441 4.761 38 HG2 GLU 6 HG2 GLU 6 9.105 16.365 4.343 39 HG3 GLU 6 HG1 GLU 6 9.503 15.267 5.666 40 H ARG 7 HN ARG 7 9.136 12.149 7.109 41 HA ARG 7 HA ARG 7 10.567 10.815 4.850 42 HB2 ARG 7 HB2 ARG 7 12.387 10.619 6.348 43 HB3 ARG 7 HB1 ARG 7 11.692 12.187 6.747 44 HG2 ARG 7 HG2 ARG 7 11.630 11.430 8.877 45 HG3 ARG 7 HG1 ARG 7 10.254 10.459 8.356 46 HD2 ARG 7 HD2 ARG 7 11.799 8.921 9.375 47 HD3 ARG 7 HD1 ARG 7 11.986 8.693 7.624 48 HE ARG 7 HE ARG 7 13.765 10.746 8.282 49 HH11 ARG 7 HH21 ARG 7 13.598 7.402 8.088 50 HH12 ARG 7 HH22 ARG 7 15.065 7.100 8.958 51 HH21 ARG 7 HH11 ARG 7 15.500 10.406 9.904 52 HH22 ARG 7 HH12 ARG 7 16.141 8.799 9.982 53 H ARG 8 HN ARG 8 8.476 10.232 7.590 54 HA ARG 8 HA ARG 8 8.784 7.279 7.318 55 HB2 ARG 8 HB2 ARG 8 7.255 9.022 9.282 56 HB3 ARG 8 HB1 ARG 8 7.496 7.281 9.425 57 HG2 ARG 8 HG2 ARG 8 9.424 7.687 10.511 58 HG3 ARG 8 HG1 ARG 8 10.060 8.392 9.024 59 HD2 ARG 8 HD2 ARG 8 10.243 10.049 10.817 60 HD3 ARG 8 HD1 ARG 8 8.979 10.582 9.691 61 HE ARG 8 HE ARG 8 7.445 10.299 11.453 62 HH11 ARG 8 HH11 ARG 8 10.434 8.926 12.317 63 HH12 ARG 8 HH12 ARG 8 9.795 7.964 13.606 64 HH21 ARG 8 HH21 ARG 8 6.491 8.780 12.934 65 HH22 ARG 8 HH22 ARG 8 7.563 7.890 13.963 66 H LEU 9 HN LEU 9 7.002 9.682 5.895 67 HA LEU 9 HA LEU 9 4.431 8.249 5.902 68 HB2 LEU 9 HB2 LEU 9 5.485 10.941 5.173 69 HB3 LEU 9 HB1 LEU 9 4.004 10.402 4.380 70 HG LEU 9 HG LEU 9 3.429 11.616 6.418 71 HD11 LEU 9 HD11 LEU 9 3.051 8.739 7.184 72 HD12 LEU 9 HD12 LEU 9 2.312 9.340 5.701 73 HD13 LEU 9 HD13 LEU 9 1.898 10.071 7.250 74 HD21 LEU 9 HD21 LEU 9 5.717 10.960 7.482 75 HD22 LEU 9 HD22 LEU 9 4.869 9.515 8.032 76 HD23 LEU 9 HD23 LEU 9 4.315 11.110 8.541 77 H ARG 10 HN ARG 10 4.728 6.427 4.531 78 HA ARG 10 HA ARG 10 4.793 7.088 1.704 79 HB2 ARG 10 HB2 ARG 10 7.202 6.840 2.674 80 HB3 ARG 10 HB1 ARG 10 6.847 5.113 2.568 81 HG2 ARG 10 HG2 ARG 10 7.908 6.021 0.482 82 HG3 ARG 10 HG1 ARG 10 6.328 5.298 0.204 83 HD2 ARG 10 HD2 ARG 10 5.979 8.086 0.863 84 HD3 ARG 10 HD1 ARG 10 7.134 7.935 -0.464 85 HE ARG 10 HE ARG 10 5.466 6.577 -1.686 86 HH11 ARG 10 HH11 ARG 10 4.276 8.534 0.970 87 HH12 ARG 10 HH12 ARG 10 2.629 8.330 0.500 88 HH21 ARG 10 HH21 ARG 10 3.311 6.330 -2.213 89 HH22 ARG 10 HH22 ARG 10 2.086 7.111 -1.271 90 H VAL 11 HN VAL 11 4.347 5.284 0.309 91 HA VAL 11 HA VAL 11 2.732 3.198 1.707 92 HB VAL 11 HB VAL 11 1.450 3.153 -0.333 93 HG11 VAL 11 HG11 VAL 11 0.825 5.023 0.997 94 HG12 VAL 11 HG12 VAL 11 0.982 5.657 -0.642 95 HG13 VAL 11 HG13 VAL 11 2.264 5.931 0.536 96 HG21 VAL 11 HG21 VAL 11 3.857 4.580 -1.441 97 HG22 VAL 11 HG22 VAL 11 2.282 4.803 -2.204 98 HG23 VAL 11 HG23 VAL 11 2.990 3.192 -2.097 99 H LEU 12 HN LEU 12 3.765 1.235 1.813 100 HA LEU 12 HA LEU 12 5.890 0.615 -0.162 101 HB2 LEU 12 HB2 LEU 12 4.869 -0.912 2.257 102 HB3 LEU 12 HB1 LEU 12 6.362 -1.239 1.381 103 HG LEU 12 HG LEU 12 7.101 0.032 3.228 104 HD11 LEU 12 HD11 LEU 12 7.673 0.985 0.887 105 HD12 LEU 12 HD12 LEU 12 7.972 2.007 2.293 106 HD13 LEU 12 HD13 LEU 12 6.541 2.274 1.297 107 HD21 LEU 12 HD21 LEU 12 5.811 1.474 4.408 108 HD22 LEU 12 HD22 LEU 12 4.492 0.762 3.479 109 HD23 LEU 12 HD23 LEU 12 5.215 2.285 2.960 110 H VAL 13 HN VAL 13 4.983 -0.102 -2.051 111 HA VAL 13 HA VAL 13 2.715 -2.055 -1.877 112 HB VAL 13 HB VAL 13 3.511 -0.495 -4.322 113 HG11 VAL 13 HG11 VAL 13 0.716 -1.021 -3.393 114 HG12 VAL 13 HG12 VAL 13 1.655 -2.358 -4.060 115 HG13 VAL 13 HG13 VAL 13 1.346 -0.922 -5.037 116 HG21 VAL 13 HG21 VAL 13 1.924 0.541 -1.957 117 HG22 VAL 13 HG22 VAL 13 1.899 1.293 -3.552 118 HG23 VAL 13 HG23 VAL 13 3.401 1.231 -2.632 119 H VAL 14 HN VAL 14 3.504 -4.081 -2.150 120 HA VAL 14 HA VAL 14 5.712 -4.436 -4.131 121 HB VAL 14 HB VAL 14 6.754 -5.884 -2.587 122 HG11 VAL 14 HG11 VAL 14 5.672 -4.208 -0.442 123 HG12 VAL 14 HG12 VAL 14 6.188 -3.303 -1.864 124 HG13 VAL 14 HG13 VAL 14 7.329 -4.357 -1.028 125 HG21 VAL 14 HG21 VAL 14 5.662 -6.852 -0.651 126 HG22 VAL 14 HG22 VAL 14 4.637 -7.148 -2.055 127 HG23 VAL 14 HG23 VAL 14 4.229 -5.861 -0.920 128 H GLU 15 HN GLU 15 5.480 -6.039 -5.569 129 HA GLU 15 HA GLU 15 3.513 -8.209 -5.228 130 HB2 GLU 15 HB2 GLU 15 2.030 -6.623 -6.098 131 HB3 GLU 15 HB1 GLU 15 3.267 -5.871 -7.108 132 HG2 GLU 15 HG2 GLU 15 2.832 -8.679 -7.781 133 HG3 GLU 15 HG1 GLU 15 1.374 -7.708 -7.952 134 H ASP 16 HN ASP 16 3.926 -9.915 -6.820 135 HA ASP 16 HA ASP 16 6.666 -10.330 -7.400 136 HB2 ASP 16 HB2 ASP 16 5.749 -12.276 -8.645 137 HB3 ASP 16 HB1 ASP 16 5.034 -12.065 -7.045 138 H GLU 17 HN GLU 17 5.372 -7.864 -8.998 139 HA GLU 17 HA GLU 17 6.748 -8.649 -11.525 140 HB2 GLU 17 HB2 GLU 17 3.960 -7.492 -11.259 141 HB3 GLU 17 HB1 GLU 17 4.826 -7.616 -12.783 142 HG2 GLU 17 HG2 GLU 17 4.656 -9.921 -12.856 143 HG3 GLU 17 HG1 GLU 17 4.571 -10.079 -11.107 144 H SER 18 HN SER 18 7.248 -6.711 -12.888 145 HA SER 18 HA SER 18 8.138 -4.456 -11.218 146 HB2 SER 18 HB2 SER 18 9.721 -4.979 -12.818 147 HB3 SER 18 HB1 SER 18 8.514 -5.538 -13.972 148 HG SER 18 HG SER 18 9.705 -3.163 -13.824 149 H MET 19 HN MET 19 5.389 -5.247 -13.119 150 HA MET 19 HA MET 19 4.588 -2.807 -14.263 151 HB2 MET 19 HB2 MET 19 3.571 -5.302 -13.986 152 HB3 MET 19 HB1 MET 19 2.548 -4.441 -12.834 153 HG2 MET 19 HG2 MET 19 1.933 -2.812 -14.570 154 HG3 MET 19 HG1 MET 19 2.989 -3.626 -15.725 155 HE1 MET 19 HE1 MET 19 1.827 -6.459 -16.919 156 HE2 MET 19 HE2 MET 19 2.539 -4.860 -17.126 157 HE3 MET 19 HE3 MET 19 0.887 -5.155 -17.659 158 H ILE 20 HN ILE 20 4.902 -3.652 -10.911 159 HA ILE 20 HA ILE 20 3.168 -1.424 -9.990 160 HB ILE 20 HB ILE 20 3.227 -3.700 -8.939 161 HG12 ILE 20 HG12 ILE 20 4.376 -1.822 -6.907 162 HG13 ILE 20 HG11 ILE 20 2.850 -1.395 -7.691 163 HG21 ILE 20 HG21 ILE 20 6.072 -2.858 -8.387 164 HG22 ILE 20 HG22 ILE 20 5.508 -4.311 -9.205 165 HG23 ILE 20 HG23 ILE 20 5.263 -4.131 -7.471 166 HD11 ILE 20 HD11 ILE 20 2.349 -3.987 -7.100 167 HD12 ILE 20 HD12 ILE 20 1.963 -2.664 -5.998 168 HD13 ILE 20 HD13 ILE 20 3.449 -3.591 -5.779 169 H ALA 21 HN ALA 21 6.471 -2.123 -10.696 170 HA ALA 21 HA ALA 21 7.865 -0.381 -8.929 171 HB1 ALA 21 HB1 ALA 21 8.372 -1.219 -11.804 172 HB2 ALA 21 HB2 ALA 21 8.890 -2.085 -10.361 173 HB3 ALA 21 HB3 ALA 21 9.587 -0.510 -10.741 174 H MET 22 HN MET 22 7.815 0.451 -12.368 175 HA MET 22 HA MET 22 7.907 3.251 -11.891 176 HB2 MET 22 HB2 MET 22 8.516 1.953 -13.986 177 HB3 MET 22 HB1 MET 22 6.790 1.816 -14.323 178 HG2 MET 22 HG2 MET 22 6.600 4.011 -14.929 179 HG3 MET 22 HG1 MET 22 7.763 4.551 -13.718 180 HE1 MET 22 HE1 MET 22 8.811 5.811 -17.174 181 HE2 MET 22 HE2 MET 22 7.336 5.683 -16.219 182 HE3 MET 22 HE3 MET 22 7.561 4.641 -17.621 183 H LEU 23 HN LEU 23 5.260 1.037 -11.828 184 HA LEU 23 HA LEU 23 3.120 2.917 -12.347 185 HB2 LEU 23 HB2 LEU 23 2.726 0.566 -12.577 186 HB3 LEU 23 HB1 LEU 23 3.404 0.223 -10.990 187 HG LEU 23 HG LEU 23 0.838 0.167 -11.226 188 HD11 LEU 23 HD11 LEU 23 2.563 1.123 -9.128 189 HD12 LEU 23 HD12 LEU 23 1.071 0.197 -8.996 190 HD13 LEU 23 HD13 LEU 23 1.012 1.958 -9.045 191 HD21 LEU 23 HD21 LEU 23 1.292 2.742 -12.245 192 HD22 LEU 23 HD22 LEU 23 0.606 3.005 -10.643 193 HD23 LEU 23 HD23 LEU 23 -0.267 2.036 -11.825 194 H ILE 24 HN ILE 24 5.369 2.669 -9.850 195 HA ILE 24 HA ILE 24 3.532 3.812 -7.798 196 HB ILE 24 HB ILE 24 5.311 1.771 -7.690 197 HG12 ILE 24 HG12 ILE 24 5.251 3.451 -5.236 198 HG13 ILE 24 HG11 ILE 24 3.684 3.043 -5.936 199 HG21 ILE 24 HG21 ILE 24 7.295 3.077 -8.113 200 HG22 ILE 24 HG22 ILE 24 7.310 2.607 -6.415 201 HG23 ILE 24 HG23 ILE 24 6.851 4.247 -6.870 202 HD11 ILE 24 HD11 ILE 24 4.025 0.731 -5.669 203 HD12 ILE 24 HD12 ILE 24 4.735 1.403 -4.201 204 HD13 ILE 24 HD13 ILE 24 5.774 0.911 -5.538 205 H GLU 25 HN GLU 25 6.709 4.352 -9.339 206 HA GLU 25 HA GLU 25 7.427 6.795 -8.147 207 HB2 GLU 25 HB2 GLU 25 7.723 5.728 -10.968 208 HB3 GLU 25 HB1 GLU 25 8.581 7.153 -10.381 209 HG2 GLU 25 HG2 GLU 25 9.049 5.283 -8.391 210 HG3 GLU 25 HG1 GLU 25 9.111 4.317 -9.866 211 H ASP 26 HN ASP 26 5.093 6.122 -10.706 212 HA ASP 26 HA ASP 26 4.616 8.877 -11.444 213 HB2 ASP 26 HB2 ASP 26 2.922 7.908 -12.800 214 HB3 ASP 26 HB1 ASP 26 4.136 6.637 -12.670 215 H THR 27 HN THR 27 3.200 6.651 -9.070 216 HA THR 27 HA THR 27 0.962 8.254 -8.311 217 HB THR 27 HB THR 27 2.639 6.242 -6.839 218 HG1 THR 27 HG1 THR 27 1.384 5.755 -8.854 219 HG21 THR 27 HG21 THR 27 1.362 6.562 -5.020 220 HG22 THR 27 HG22 THR 27 -0.104 6.371 -5.983 221 HG23 THR 27 HG23 THR 27 0.646 7.960 -5.822 222 H LEU 28 HN LEU 28 4.120 7.820 -6.687 223 HA LEU 28 HA LEU 28 3.805 9.866 -4.753 224 HB2 LEU 28 HB2 LEU 28 5.961 9.259 -4.247 225 HB3 LEU 28 HB1 LEU 28 5.646 7.965 -5.398 226 HG LEU 28 HG LEU 28 6.507 9.623 -7.192 227 HD11 LEU 28 HD11 LEU 28 6.861 11.132 -4.714 228 HD12 LEU 28 HD12 LEU 28 6.927 11.692 -6.385 229 HD13 LEU 28 HD13 LEU 28 8.361 10.993 -5.632 230 HD21 LEU 28 HD21 LEU 28 8.820 9.030 -5.475 231 HD22 LEU 28 HD22 LEU 28 8.442 8.433 -7.091 232 HD23 LEU 28 HD23 LEU 28 7.730 7.658 -5.676 233 H CYS 29 HN CYS 29 4.431 10.021 -8.169 234 HA CYS 29 HA CYS 29 5.552 12.691 -8.274 235 HB2 CYS 29 HB2 CYS 29 5.324 10.625 -9.984 236 HB3 CYS 29 HB1 CYS 29 3.913 11.552 -10.497 237 HG CYS 29 HG CYS 29 5.921 13.594 -10.489 238 H GLU 30 HN GLU 30 2.372 11.374 -7.887 239 HA GLU 30 HA GLU 30 0.981 13.833 -8.676 240 HB2 GLU 30 HB2 GLU 30 -0.093 11.799 -9.255 241 HB3 GLU 30 HB1 GLU 30 0.240 11.082 -7.680 242 HG2 GLU 30 HG2 GLU 30 -1.335 12.619 -6.611 243 HG3 GLU 30 HG1 GLU 30 -1.624 13.428 -8.152 244 H LEU 31 HN LEU 31 2.171 12.267 -5.780 245 HA LEU 31 HA LEU 31 0.756 14.304 -4.094 246 HB2 LEU 31 HB2 LEU 31 1.957 11.600 -3.423 247 HB3 LEU 31 HB1 LEU 31 1.090 12.642 -2.290 248 HG LEU 31 HG LEU 31 -0.553 12.372 -4.592 249 HD11 LEU 31 HD11 LEU 31 1.138 10.120 -4.319 250 HD12 LEU 31 HD12 LEU 31 -0.299 10.261 -5.331 251 HD13 LEU 31 HD13 LEU 31 -0.436 9.631 -3.690 252 HD21 LEU 31 HD21 LEU 31 -1.851 12.517 -2.735 253 HD22 LEU 31 HD22 LEU 31 -0.595 11.837 -1.701 254 HD23 LEU 31 HD23 LEU 31 -1.652 10.768 -2.625 255 H GLY 32 HN GLY 32 3.906 12.696 -4.634 256 HA2 GLY 32 HA2 GLY 32 6.045 13.772 -4.386 257 HA3 GLY 32 HA1 GLY 32 5.253 15.092 -3.511 258 H HIS 33 HN HIS 33 4.971 11.616 -2.995 259 HA HIS 33 HA HIS 33 5.243 11.851 -0.113 260 HB2 HIS 33 HB2 HIS 33 5.029 9.648 -2.156 261 HB3 HIS 33 HB1 HIS 33 5.162 9.330 -0.425 262 HD1 HIS 33 HD1 HIS 33 2.597 9.280 -2.665 263 HD2 HIS 33 HD2 HIS 33 3.143 11.542 0.794 264 HE1 HIS 33 HE1 HIS 33 0.291 10.015 -1.922 265 H GLU 34 HN GLU 34 6.737 9.753 0.714 266 HA GLU 34 HA GLU 34 9.465 10.720 0.315 267 HB2 GLU 34 HB2 GLU 34 8.107 9.655 2.357 268 HB3 GLU 34 HB1 GLU 34 8.815 8.168 1.745 269 HG2 GLU 34 HG2 GLU 34 10.508 10.625 2.169 270 HG3 GLU 34 HG1 GLU 34 10.160 9.526 3.504 271 H VAL 35 HN VAL 35 9.246 7.238 0.452 272 HA VAL 35 HA VAL 35 9.671 6.988 -2.480 273 HB VAL 35 HB VAL 35 11.895 7.320 -1.693 274 HG11 VAL 35 HG11 VAL 35 10.804 6.238 0.738 275 HG12 VAL 35 HG12 VAL 35 12.327 7.097 0.503 276 HG13 VAL 35 HG13 VAL 35 12.264 5.345 0.314 277 HG21 VAL 35 HG21 VAL 35 11.858 4.343 -1.437 278 HG22 VAL 35 HG22 VAL 35 12.899 5.370 -2.421 279 HG23 VAL 35 HG23 VAL 35 11.247 5.037 -2.939 280 H ALA 36 HN ALA 36 7.743 5.748 -2.585 281 HA ALA 36 HA ALA 36 6.870 3.718 -0.843 282 HB1 ALA 36 HB1 ALA 36 5.684 4.833 -2.771 283 HB2 ALA 36 HB2 ALA 36 5.470 3.082 -2.713 284 HB3 ALA 36 HB3 ALA 36 6.605 3.796 -3.859 285 H ALA 37 HN ALA 37 6.600 1.338 -2.000 286 HA ALA 37 HA ALA 37 9.392 0.372 -2.557 287 HB1 ALA 37 HB1 ALA 37 8.896 -0.464 -0.436 288 HB2 ALA 37 HB2 ALA 37 8.281 -1.770 -1.449 289 HB3 ALA 37 HB3 ALA 37 7.170 -0.579 -0.777 290 H THR 38 HN THR 38 9.543 -1.340 -4.111 291 HA THR 38 HA THR 38 7.104 -1.753 -5.777 292 HB THR 38 HB THR 38 10.004 -1.204 -6.387 293 HG1 THR 38 HG1 THR 38 8.049 0.326 -6.214 294 HG21 THR 38 HG21 THR 38 7.959 -2.165 -8.406 295 HG22 THR 38 HG22 THR 38 9.232 -3.184 -7.734 296 HG23 THR 38 HG23 THR 38 9.652 -1.776 -8.708 297 H ALA 39 HN ALA 39 7.094 -3.680 -7.053 298 HA ALA 39 HA ALA 39 7.066 -6.008 -7.243 299 HB1 ALA 39 HB1 ALA 39 9.895 -5.213 -6.712 300 HB2 ALA 39 HB2 ALA 39 9.171 -5.869 -8.182 301 HB3 ALA 39 HB3 ALA 39 9.487 -6.927 -6.807 302 H SER 40 HN SER 40 7.157 -8.024 -5.987 303 HA SER 40 HA SER 40 6.524 -7.579 -3.175 304 HB2 SER 40 HB2 SER 40 6.024 -9.952 -3.238 305 HB3 SER 40 HB1 SER 40 5.416 -9.210 -4.711 306 HG SER 40 HG SER 40 7.314 -11.124 -4.376 307 H ARG 41 HN ARG 41 8.028 -7.550 -1.556 308 HA ARG 41 HA ARG 41 10.466 -9.214 -1.823 309 HB2 ARG 41 HB2 ARG 41 10.606 -6.699 -2.540 310 HB3 ARG 41 HB1 ARG 41 10.566 -6.389 -0.804 311 HG2 ARG 41 HG2 ARG 41 12.887 -6.527 -1.466 312 HG3 ARG 41 HG1 ARG 41 12.503 -7.978 -0.541 313 HD2 ARG 41 HD2 ARG 41 11.932 -8.976 -2.929 314 HD3 ARG 41 HD1 ARG 41 13.025 -7.692 -3.481 315 HE ARG 41 HE ARG 41 14.718 -8.620 -1.860 316 HH11 ARG 41 HH21 ARG 41 12.776 -10.546 -3.806 317 HH12 ARG 41 HH22 ARG 41 13.204 -12.046 -3.052 318 HH21 ARG 41 HH11 ARG 41 14.951 -10.548 -0.457 319 HH22 ARG 41 HH12 ARG 41 14.439 -12.047 -1.158 320 H MET 42 HN MET 42 10.784 -10.346 0.053 321 HA MET 42 HA MET 42 9.091 -10.076 2.336 322 HB2 MET 42 HB2 MET 42 11.791 -11.384 1.890 323 HB3 MET 42 HB1 MET 42 10.783 -11.662 3.313 324 HG2 MET 42 HG2 MET 42 8.931 -12.393 1.801 325 HG3 MET 42 HG1 MET 42 10.036 -12.238 0.433 326 HE1 MET 42 HE1 MET 42 9.488 -15.922 0.762 327 HE2 MET 42 HE2 MET 42 8.582 -14.418 0.607 328 HE3 MET 42 HE3 MET 42 8.563 -15.294 2.135 329 H GLN 43 HN GLN 43 12.314 -8.791 1.579 330 HA GLN 43 HA GLN 43 12.922 -7.776 4.200 331 HB2 GLN 43 HB2 GLN 43 14.337 -8.151 2.017 332 HB3 GLN 43 HB1 GLN 43 13.821 -6.510 1.620 333 HG2 GLN 43 HG2 GLN 43 14.806 -5.634 3.639 334 HG3 GLN 43 HG1 GLN 43 15.132 -7.257 4.247 335 HE21 GLN 43 HE21 GLN 43 17.155 -5.156 3.736 336 HE22 GLN 43 HE22 GLN 43 18.208 -5.783 2.561 337 H GLU 44 HN GLU 44 11.928 -5.939 1.277 338 HA GLU 44 HA GLU 44 11.323 -3.520 2.645 339 HB2 GLU 44 HB2 GLU 44 10.339 -4.765 0.063 340 HB3 GLU 44 HB1 GLU 44 9.968 -3.106 0.531 341 HG2 GLU 44 HG2 GLU 44 12.459 -2.713 0.763 342 HG3 GLU 44 HG1 GLU 44 12.705 -4.298 0.026 343 H ALA 45 HN ALA 45 9.131 -6.137 1.542 344 HA ALA 45 HA ALA 45 6.662 -5.221 2.402 345 HB1 ALA 45 HB1 ALA 45 7.087 -7.398 1.335 346 HB2 ALA 45 HB2 ALA 45 6.178 -7.637 2.827 347 HB3 ALA 45 HB3 ALA 45 7.911 -7.964 2.788 348 H LEU 46 HN LEU 46 9.141 -6.791 4.429 349 HA LEU 46 HA LEU 46 7.784 -6.640 6.923 350 HB2 LEU 46 HB2 LEU 46 9.786 -7.972 6.554 351 HB3 LEU 46 HB1 LEU 46 10.714 -6.532 6.143 352 HG LEU 46 HG LEU 46 9.367 -6.385 8.757 353 HD11 LEU 46 HD11 LEU 46 11.740 -8.239 8.472 354 HD12 LEU 46 HD12 LEU 46 10.079 -8.828 8.543 355 HD13 LEU 46 HD13 LEU 46 10.761 -7.947 9.910 356 HD21 LEU 46 HD21 LEU 46 11.311 -5.212 9.343 357 HD22 LEU 46 HD22 LEU 46 11.188 -4.879 7.616 358 HD23 LEU 46 HD23 LEU 46 12.312 -6.106 8.199 359 H ASP 47 HN ASP 47 9.891 -4.346 5.222 360 HA ASP 47 HA ASP 47 10.082 -2.386 7.288 361 HB2 ASP 47 HB2 ASP 47 10.473 -2.552 4.332 362 HB3 ASP 47 HB1 ASP 47 10.395 -0.943 5.050 363 H ILE 48 HN ILE 48 7.367 -3.348 5.485 364 HA ILE 48 HA ILE 48 6.088 -0.705 5.641 365 HB ILE 48 HB ILE 48 4.678 -1.464 3.983 366 HG12 ILE 48 HG12 ILE 48 4.898 -4.140 5.340 367 HG13 ILE 48 HG11 ILE 48 3.458 -3.209 4.956 368 HG21 ILE 48 HG21 ILE 48 7.064 -1.747 3.277 369 HG22 ILE 48 HG22 ILE 48 5.930 -2.764 2.394 370 HG23 ILE 48 HG23 ILE 48 6.925 -3.456 3.674 371 HD11 ILE 48 HD11 ILE 48 4.984 -5.098 3.248 372 HD12 ILE 48 HD12 ILE 48 4.473 -3.615 2.445 373 HD13 ILE 48 HD13 ILE 48 3.274 -4.669 3.192 374 H ALA 49 HN ALA 49 5.881 -3.950 7.044 375 HA ALA 49 HA ALA 49 3.528 -3.151 8.632 376 HB1 ALA 49 HB1 ALA 49 4.026 -5.433 7.454 377 HB2 ALA 49 HB2 ALA 49 3.318 -5.456 9.070 378 HB3 ALA 49 HB3 ALA 49 5.045 -5.743 8.860 379 H ARG 50 HN ARG 50 6.610 -4.782 9.501 380 HA ARG 50 HA ARG 50 6.625 -4.209 12.248 381 HB2 ARG 50 HB2 ARG 50 8.497 -4.960 10.130 382 HB3 ARG 50 HB1 ARG 50 9.282 -4.020 11.403 383 HG2 ARG 50 HG2 ARG 50 9.432 -6.033 12.458 384 HG3 ARG 50 HG1 ARG 50 7.754 -5.713 12.897 385 HD2 ARG 50 HD2 ARG 50 7.167 -6.852 10.629 386 HD3 ARG 50 HD1 ARG 50 8.817 -7.502 10.713 387 HE ARG 50 HE ARG 50 6.824 -7.865 12.922 388 HH11 ARG 50 HH21 ARG 50 10.002 -8.485 12.241 389 HH12 ARG 50 HH22 ARG 50 9.914 -10.205 12.428 390 HH21 ARG 50 HH11 ARG 50 6.452 -10.277 12.605 391 HH22 ARG 50 HH12 ARG 50 7.906 -11.220 12.633 392 H LYS 51 HN LYS 51 7.043 -2.045 9.595 393 HA LYS 51 HA LYS 51 8.655 0.016 10.588 394 HB2 LYS 51 HB2 LYS 51 7.260 -0.487 8.380 395 HB3 LYS 51 HB1 LYS 51 6.070 0.546 9.151 396 HG2 LYS 51 HG2 LYS 51 7.819 1.616 7.537 397 HG3 LYS 51 HG1 LYS 51 7.444 2.432 9.049 398 HD2 LYS 51 HD2 LYS 51 9.452 1.643 10.085 399 HD3 LYS 51 HD1 LYS 51 9.749 0.489 8.785 400 HE2 LYS 51 HE2 LYS 51 10.515 2.131 7.320 401 HE3 LYS 51 HE1 LYS 51 9.573 3.413 8.108 402 HZ1 LYS 51 HZ1 LYS 51 12.165 3.036 8.576 403 HZ2 LYS 51 HZ2 LYS 51 11.511 2.028 9.777 404 HZ3 LYS 51 HZ3 LYS 51 11.102 3.677 9.731 405 H GLY 52 HN GLY 52 5.128 -0.416 11.024 406 HA2 GLY 52 HA2 GLY 52 3.672 0.444 12.649 407 HA3 GLY 52 HA1 GLY 52 5.088 0.626 13.685 408 H GLN 53 HN GLN 53 5.564 2.253 10.763 409 HA GLN 53 HA GLN 53 4.338 4.777 11.740 410 HB2 GLN 53 HB2 GLN 53 6.728 5.774 11.164 411 HB3 GLN 53 HB1 GLN 53 6.409 5.064 12.743 412 HG2 GLN 53 HG2 GLN 53 7.834 3.339 12.379 413 HG3 GLN 53 HG1 GLN 53 7.258 3.101 10.730 414 HE21 GLN 53 HE21 GLN 53 7.895 5.315 9.343 415 HE22 GLN 53 HE22 GLN 53 9.544 5.700 9.459 416 H PHE 54 HN PHE 54 5.419 2.806 9.091 417 HA PHE 54 HA PHE 54 5.727 4.699 7.016 418 HB2 PHE 54 HB2 PHE 54 5.364 2.832 5.570 419 HB3 PHE 54 HB1 PHE 54 6.090 2.167 7.027 420 HD1 PHE 54 HD1 PHE 54 4.261 1.472 8.910 421 HD2 PHE 54 HD2 PHE 54 3.516 1.725 4.688 422 HE1 PHE 54 HE1 PHE 54 2.335 -0.043 9.153 423 HE2 PHE 54 HE2 PHE 54 1.596 0.193 4.950 424 HZ PHE 54 HZ PHE 54 0.997 -0.687 7.177 425 H ASP 55 HN ASP 55 3.620 4.077 5.152 426 HA ASP 55 HA ASP 55 1.299 5.392 6.521 427 HB2 ASP 55 HB2 ASP 55 2.526 7.013 5.218 428 HB3 ASP 55 HB1 ASP 55 2.566 5.931 3.825 429 H ILE 56 HN ILE 56 2.285 3.347 3.748 430 HA ILE 56 HA ILE 56 -0.341 1.968 3.960 431 HB ILE 56 HB ILE 56 0.757 3.203 1.417 432 HG12 ILE 56 HG12 ILE 56 -1.451 4.023 3.312 433 HG13 ILE 56 HG11 ILE 56 -0.089 4.988 2.746 434 HG21 ILE 56 HG21 ILE 56 -2.024 2.416 1.374 435 HG22 ILE 56 HG22 ILE 56 -1.003 1.040 1.790 436 HG23 ILE 56 HG23 ILE 56 -0.719 1.930 0.294 437 HD11 ILE 56 HD11 ILE 56 -1.973 5.745 1.490 438 HD12 ILE 56 HD12 ILE 56 -2.509 4.096 1.168 439 HD13 ILE 56 HD13 ILE 56 -1.052 4.717 0.393 440 H ALA 57 HN ALA 57 -0.297 -0.194 3.021 441 HA ALA 57 HA ALA 57 2.343 -1.083 1.944 442 HB1 ALA 57 HB1 ALA 57 1.177 -1.602 4.611 443 HB2 ALA 57 HB2 ALA 57 2.859 -1.667 4.091 444 HB3 ALA 57 HB3 ALA 57 1.790 -3.033 3.783 445 H ILE 58 HN ILE 58 1.850 -2.336 0.154 446 HA ILE 58 HA ILE 58 -0.616 -4.017 0.381 447 HB ILE 58 HB ILE 58 0.307 -2.374 -1.988 448 HG12 ILE 58 HG12 ILE 58 -2.022 -1.280 -1.356 449 HG13 ILE 58 HG11 ILE 58 -1.639 -1.912 0.245 450 HG21 ILE 58 HG21 ILE 58 -1.510 -4.596 -1.723 451 HG22 ILE 58 HG22 ILE 58 -1.081 -3.691 -3.175 452 HG23 ILE 58 HG23 ILE 58 -2.414 -3.145 -2.157 453 HD11 ILE 58 HD11 ILE 58 -0.175 -0.244 0.596 454 HD12 ILE 58 HD12 ILE 58 -0.644 0.454 -0.953 455 HD13 ILE 58 HD13 ILE 58 0.706 -0.677 -0.868 456 H ILE 59 HN ILE 59 0.420 -6.012 0.562 457 HA ILE 59 HA ILE 59 2.553 -6.782 -1.352 458 HB ILE 59 HB ILE 59 1.113 -7.928 1.042 459 HG12 ILE 59 HG12 ILE 59 3.445 -8.488 1.675 460 HG13 ILE 59 HG11 ILE 59 4.004 -7.792 0.154 461 HG21 ILE 59 HG21 ILE 59 0.929 -9.939 -0.021 462 HG22 ILE 59 HG22 ILE 59 2.660 -10.042 0.294 463 HG23 ILE 59 HG23 ILE 59 2.082 -9.492 -1.277 464 HD11 ILE 59 HD11 ILE 59 3.927 -6.356 2.378 465 HD12 ILE 59 HD12 ILE 59 2.241 -6.139 1.916 466 HD13 ILE 59 HD13 ILE 59 3.529 -5.626 0.823 467 H ASP 60 HN ASP 60 0.756 -5.902 -2.867 468 HA ASP 60 HA ASP 60 -1.679 -7.145 -3.371 469 HB2 ASP 60 HB2 ASP 60 -1.506 -5.257 -4.600 470 HB3 ASP 60 HB1 ASP 60 0.246 -5.373 -4.679 471 H VAL 61 HN VAL 61 -2.092 -8.237 -5.599 472 HA VAL 61 HA VAL 61 -2.057 -10.204 -6.788 473 HB VAL 61 HB VAL 61 0.355 -8.860 -7.042 474 HG11 VAL 61 HG11 VAL 61 0.916 -11.821 -6.751 475 HG12 VAL 61 HG12 VAL 61 1.513 -10.553 -5.678 476 HG13 VAL 61 HG13 VAL 61 2.047 -10.611 -7.355 477 HG21 VAL 61 HG21 VAL 61 -1.155 -9.567 -8.849 478 HG22 VAL 61 HG22 VAL 61 -0.687 -11.246 -8.588 479 HG23 VAL 61 HG23 VAL 61 0.496 -10.085 -9.186 480 H ASN 62 HN ASN 62 -3.043 -11.380 -5.121 481 HA ASN 62 HA ASN 62 -1.240 -13.306 -3.748 482 HB2 ASN 62 HB2 ASN 62 -3.608 -11.823 -2.561 483 HB3 ASN 62 HB1 ASN 62 -2.634 -13.020 -1.724 484 HD21 ASN 62 HD21 ASN 62 -0.105 -11.918 -3.061 485 HD22 ASN 62 HD22 ASN 62 0.231 -10.488 -2.213 486 H LEU 63 HN LEU 63 -2.087 -15.355 -3.534 487 HA LEU 63 HA LEU 63 -4.781 -16.179 -3.731 488 HB2 LEU 63 HB2 LEU 63 -3.627 -15.256 -6.172 489 HB3 LEU 63 HB1 LEU 63 -3.763 -17.006 -6.305 490 HG LEU 63 HG LEU 63 -6.110 -16.969 -6.059 491 HD11 LEU 63 HD11 LEU 63 -6.629 -14.146 -5.545 492 HD12 LEU 63 HD12 LEU 63 -5.714 -14.869 -4.232 493 HD13 LEU 63 HD13 LEU 63 -7.255 -15.560 -4.707 494 HD21 LEU 63 HD21 LEU 63 -6.838 -15.609 -7.838 495 HD22 LEU 63 HD22 LEU 63 -5.113 -15.795 -8.157 496 HD23 LEU 63 HD23 LEU 63 -5.720 -14.310 -7.423 497 H ASP 64 HN ASP 64 -4.508 -18.739 -4.768 498 HA ASP 64 HA ASP 64 -3.490 -20.817 -4.162 499 HB2 ASP 64 HB2 ASP 64 -1.323 -18.823 -4.759 500 HB3 ASP 64 HB1 ASP 64 -0.838 -20.360 -4.036 501 H GLY 65 HN GLY 65 -4.542 -19.327 -1.947 502 HA2 GLY 65 HA2 GLY 65 -4.274 -19.077 0.387 503 HA3 GLY 65 HA1 GLY 65 -3.129 -20.424 0.271 504 H GLU 66 HN GLU 66 -2.890 -17.431 -1.475 505 HA GLU 66 HA GLU 66 -0.475 -16.613 -1.663 506 HB2 GLU 66 HB2 GLU 66 -2.334 -15.052 -1.808 507 HB3 GLU 66 HB1 GLU 66 -2.461 -15.007 -0.052 508 HG2 GLU 66 HG2 GLU 66 -1.175 -13.067 -0.685 509 HG3 GLU 66 HG1 GLU 66 -0.050 -14.230 0.001 510 HA PRO 67 HA PRO 67 1.873 -17.244 2.054 511 HB2 PRO 67 HB2 PRO 67 4.078 -15.850 1.136 512 HB3 PRO 67 HB1 PRO 67 3.727 -17.535 0.697 513 HG2 PRO 67 HG2 PRO 67 3.151 -15.030 -0.830 514 HG3 PRO 67 HG1 PRO 67 3.808 -16.572 -1.405 515 HD2 PRO 67 HD2 PRO 67 1.253 -15.961 -1.778 516 HD3 PRO 67 HD1 PRO 67 1.748 -17.617 -1.375 517 H SER 68 HN SER 68 2.478 -14.049 0.540 518 HA SER 68 HA SER 68 2.176 -11.860 1.372 519 HB2 SER 68 HB2 SER 68 0.520 -12.943 3.613 520 HB3 SER 68 HB1 SER 68 0.242 -11.531 2.602 521 HG SER 68 HG SER 68 -0.922 -12.754 1.378 522 H TYR 69 HN TYR 69 3.731 -14.288 3.055 523 HA TYR 69 HA TYR 69 5.162 -14.338 4.898 524 HB2 TYR 69 HB2 TYR 69 5.745 -11.529 5.107 525 HB3 TYR 69 HB1 TYR 69 6.760 -12.801 4.443 526 HD1 TYR 69 HD2 TYR 69 5.555 -13.650 1.994 527 HD2 TYR 69 HD1 TYR 69 5.611 -9.719 3.699 528 HE1 TYR 69 HE2 TYR 69 5.215 -12.659 -0.247 529 HE2 TYR 69 HE1 TYR 69 5.279 -8.725 1.474 530 HH TYR 69 HH TYR 69 4.284 -9.500 -0.758 531 HA PRO 70 HA PRO 70 2.916 -13.257 8.431 532 HB2 PRO 70 HB2 PRO 70 4.841 -12.661 10.270 533 HB3 PRO 70 HB1 PRO 70 4.489 -14.312 9.722 534 HG2 PRO 70 HG2 PRO 70 6.682 -12.472 8.898 535 HG3 PRO 70 HG1 PRO 70 6.720 -14.223 9.167 536 HD2 PRO 70 HD2 PRO 70 6.605 -13.096 6.689 537 HD3 PRO 70 HD1 PRO 70 5.927 -14.695 7.067 538 H VAL 71 HN VAL 71 4.687 -10.869 6.806 539 HA VAL 71 HA VAL 71 3.947 -8.793 8.777 540 HB VAL 71 HB VAL 71 5.300 -7.317 7.384 541 HG11 VAL 71 HG11 VAL 71 6.382 -8.998 8.955 542 HG12 VAL 71 HG12 VAL 71 7.421 -8.405 7.659 543 HG13 VAL 71 HG13 VAL 71 6.686 -10.003 7.537 544 HG21 VAL 71 HG21 VAL 71 6.437 -8.376 5.359 545 HG22 VAL 71 HG22 VAL 71 4.724 -7.999 5.172 546 HG23 VAL 71 HG23 VAL 71 5.233 -9.659 5.482 547 H ALA 72 HN ALA 72 3.360 -9.449 5.274 548 HA ALA 72 HA ALA 72 1.439 -7.480 4.747 549 HB1 ALA 72 HB1 ALA 72 1.088 -10.320 3.875 550 HB2 ALA 72 HB2 ALA 72 2.548 -9.451 3.402 551 HB3 ALA 72 HB3 ALA 72 0.963 -8.841 2.923 552 H ASP 73 HN ASP 73 0.839 -10.826 5.929 553 HA ASP 73 HA ASP 73 -1.974 -10.434 6.306 554 HB2 ASP 73 HB2 ASP 73 0.138 -12.344 7.074 555 HB3 ASP 73 HB1 ASP 73 -1.342 -12.421 8.016 556 H ILE 74 HN ILE 74 0.681 -10.538 8.708 557 HA ILE 74 HA ILE 74 -0.842 -9.840 10.987 558 HB ILE 74 HB ILE 74 1.996 -9.252 10.139 559 HG12 ILE 74 HG12 ILE 74 0.712 -11.299 11.996 560 HG13 ILE 74 HG11 ILE 74 1.449 -11.633 10.429 561 HG21 ILE 74 HG21 ILE 74 0.698 -8.906 12.862 562 HG22 ILE 74 HG22 ILE 74 1.300 -7.608 11.830 563 HG23 ILE 74 HG23 ILE 74 2.426 -8.767 12.537 564 HD11 ILE 74 HD11 ILE 74 2.728 -11.630 12.940 565 HD12 ILE 74 HD12 ILE 74 3.300 -10.184 12.108 566 HD13 ILE 74 HD13 ILE 74 3.492 -11.768 11.357 567 H LEU 75 HN LEU 75 0.687 -7.824 8.502 568 HA LEU 75 HA LEU 75 0.353 -5.269 9.600 569 HB2 LEU 75 HB2 LEU 75 1.390 -6.007 7.408 570 HB3 LEU 75 HB1 LEU 75 -0.236 -6.106 6.740 571 HG LEU 75 HG LEU 75 -0.591 -3.729 7.256 572 HD11 LEU 75 HD11 LEU 75 0.611 -3.001 9.038 573 HD12 LEU 75 HD12 LEU 75 1.889 -2.707 7.859 574 HD13 LEU 75 HD13 LEU 75 1.875 -4.205 8.789 575 HD21 LEU 75 HD21 LEU 75 1.887 -3.220 5.958 576 HD22 LEU 75 HD22 LEU 75 0.303 -3.406 5.206 577 HD23 LEU 75 HD23 LEU 75 1.349 -4.811 5.421 578 H ALA 76 HN ALA 76 -2.012 -7.420 8.126 579 HA ALA 76 HA ALA 76 -4.197 -5.491 8.341 580 HB1 ALA 76 HB1 ALA 76 -4.690 -8.365 7.861 581 HB2 ALA 76 HB2 ALA 76 -3.595 -7.590 6.716 582 HB3 ALA 76 HB3 ALA 76 -5.231 -6.968 6.932 583 H GLU 77 HN GLU 77 -3.127 -8.518 9.919 584 HA GLU 77 HA GLU 77 -5.257 -8.954 11.703 585 HB2 GLU 77 HB2 GLU 77 -2.247 -9.195 11.974 586 HB3 GLU 77 HB1 GLU 77 -3.350 -9.799 13.207 587 HG2 GLU 77 HG2 GLU 77 -4.479 -10.906 11.009 588 HG3 GLU 77 HG1 GLU 77 -2.793 -10.857 10.489 589 H ARG 78 HN ARG 78 -2.895 -6.434 11.568 590 HA ARG 78 HA ARG 78 -3.913 -5.280 14.125 591 HB2 ARG 78 HB2 ARG 78 -1.724 -4.344 14.432 592 HB3 ARG 78 HB1 ARG 78 -1.474 -6.016 13.935 593 HG2 ARG 78 HG2 ARG 78 -0.298 -5.328 12.150 594 HG3 ARG 78 HG1 ARG 78 -1.676 -4.389 11.581 595 HD2 ARG 78 HD2 ARG 78 0.188 -2.852 11.908 596 HD3 ARG 78 HD1 ARG 78 -0.977 -2.563 13.215 597 HE ARG 78 HE ARG 78 0.851 -4.621 14.022 598 HH11 ARG 78 HH21 ARG 78 1.276 -1.438 12.895 599 HH12 ARG 78 HH22 ARG 78 2.248 -0.928 14.235 600 HH21 ARG 78 HH11 ARG 78 1.831 -3.886 16.006 601 HH22 ARG 78 HH12 ARG 78 2.559 -2.314 16.003 602 H ASN 79 HN ASN 79 -3.565 -4.920 10.750 603 HA ASN 79 HA ASN 79 -3.822 -3.070 9.286 604 HB2 ASN 79 HB2 ASN 79 -6.239 -2.254 9.784 605 HB3 ASN 79 HB1 ASN 79 -5.986 -3.953 9.418 606 HD21 ASN 79 HD21 ASN 79 -5.748 -5.422 11.377 607 HD22 ASN 79 HD22 ASN 79 -6.615 -5.030 12.783 608 H VAL 80 HN VAL 80 -2.356 -1.439 9.697 609 HA VAL 80 HA VAL 80 -3.002 0.654 11.731 610 HB VAL 80 HB VAL 80 -0.684 -0.667 10.888 611 HG11 VAL 80 HG11 VAL 80 -0.337 2.157 9.905 612 HG12 VAL 80 HG12 VAL 80 -0.914 0.901 8.812 613 HG13 VAL 80 HG13 VAL 80 0.660 0.740 9.587 614 HG21 VAL 80 HG21 VAL 80 -1.377 1.593 12.616 615 HG22 VAL 80 HG22 VAL 80 0.278 1.673 12.010 616 HG23 VAL 80 HG23 VAL 80 -0.266 0.254 12.906 617 HA PRO 81 HA PRO 81 -4.361 3.388 8.509 618 HB2 PRO 81 HB2 PRO 81 -2.574 5.480 8.313 619 HB3 PRO 81 HB1 PRO 81 -3.810 5.359 9.585 620 HG2 PRO 81 HG2 PRO 81 -0.915 4.606 9.692 621 HG3 PRO 81 HG1 PRO 81 -1.892 5.487 10.883 622 HD2 PRO 81 HD2 PRO 81 -1.348 2.900 11.224 623 HD3 PRO 81 HD1 PRO 81 -2.944 3.550 11.652 624 H PHE 82 HN PHE 82 -4.219 2.555 6.501 625 HA PHE 82 HA PHE 82 -1.877 2.796 4.816 626 HB2 PHE 82 HB2 PHE 82 -1.154 0.479 4.901 627 HB3 PHE 82 HB1 PHE 82 -1.137 1.155 6.529 628 HD1 PHE 82 HD1 PHE 82 -4.532 0.894 6.012 629 HD2 PHE 82 HD2 PHE 82 -1.099 -1.656 6.432 630 HE1 PHE 82 HE1 PHE 82 -5.991 -0.929 6.815 631 HE2 PHE 82 HE2 PHE 82 -2.573 -3.483 7.240 632 HZ PHE 82 HZ PHE 82 -5.012 -3.120 7.425 633 H ILE 83 HN ILE 83 -2.521 0.015 3.731 634 HA ILE 83 HA ILE 83 -5.224 -0.139 2.906 635 HB ILE 83 HB ILE 83 -3.734 1.982 1.831 636 HG12 ILE 83 HG12 ILE 83 -6.332 0.862 0.773 637 HG13 ILE 83 HG11 ILE 83 -6.209 1.798 2.265 638 HG21 ILE 83 HG21 ILE 83 -3.646 1.594 -0.536 639 HG22 ILE 83 HG22 ILE 83 -4.462 0.040 -0.362 640 HG23 ILE 83 HG23 ILE 83 -2.816 0.242 0.236 641 HD11 ILE 83 HD11 ILE 83 -5.591 2.705 -0.552 642 HD12 ILE 83 HD12 ILE 83 -5.045 3.597 0.868 643 HD13 ILE 83 HD13 ILE 83 -6.770 3.381 0.572 644 H PHE 84 HN PHE 84 -5.414 -1.664 1.031 645 HA PHE 84 HA PHE 84 -2.982 -3.193 0.344 646 HB2 PHE 84 HB2 PHE 84 -4.169 -3.703 2.661 647 HB3 PHE 84 HB1 PHE 84 -5.246 -4.632 1.630 648 HD1 PHE 84 HD2 PHE 84 -4.069 -6.253 -0.106 649 HD2 PHE 84 HD1 PHE 84 -2.194 -4.683 3.429 650 HE1 PHE 84 HE2 PHE 84 -2.402 -8.092 -0.166 651 HE2 PHE 84 HE1 PHE 84 -0.532 -6.526 3.366 652 HZ PHE 84 HZ PHE 84 -0.634 -8.219 1.555 653 H ALA 85 HN ALA 85 -3.408 -4.715 -1.391 654 HA ALA 85 HA ALA 85 -6.124 -4.929 -2.440 655 HB1 ALA 85 HB1 ALA 85 -5.440 -3.749 -4.592 656 HB2 ALA 85 HB2 ALA 85 -3.978 -3.230 -3.756 657 HB3 ALA 85 HB3 ALA 85 -5.559 -2.697 -3.183 658 H THR 86 HN THR 86 -6.175 -7.001 -3.106 659 HA THR 86 HA THR 86 -4.201 -8.002 -5.015 660 HB THR 86 HB THR 86 -3.029 -8.197 -2.890 661 HG1 THR 86 HG1 THR 86 -2.385 -9.884 -3.842 662 HG21 THR 86 HG21 THR 86 -5.495 -8.570 -1.770 663 HG22 THR 86 HG22 THR 86 -3.972 -8.920 -0.953 664 HG23 THR 86 HG23 THR 86 -4.856 -10.214 -1.762 665 H GLY 87 HN GLY 87 -4.656 -10.544 -5.165 666 HA2 GLY 87 HA2 GLY 87 -6.884 -11.188 -6.448 667 HA3 GLY 87 HA1 GLY 87 -6.232 -12.336 -5.280 668 H TYR 88 HN TYR 88 -6.922 -11.197 -2.847 669 HA TYR 88 HA TYR 88 -9.897 -11.411 -2.978 670 HB2 TYR 88 HB2 TYR 88 -9.525 -11.780 -0.457 671 HB3 TYR 88 HB1 TYR 88 -8.883 -13.014 -1.541 672 HD1 TYR 88 HD2 TYR 88 -7.869 -9.793 0.100 673 HD2 TYR 88 HD1 TYR 88 -6.649 -13.655 -1.331 674 HE1 TYR 88 HE2 TYR 88 -5.590 -9.408 1.001 675 HE2 TYR 88 HE1 TYR 88 -4.372 -13.269 -0.431 676 HH TYR 88 HH TYR 88 -3.045 -10.682 0.158 677 H GLY 89 HN GLY 89 -7.625 -8.990 -2.857 678 HA2 GLY 89 HA2 GLY 89 -8.286 -6.660 -2.683 679 HA3 GLY 89 HA1 GLY 89 -9.588 -7.147 -1.595 680 H SER 90 HN SER 90 -8.872 -8.050 0.535 681 HA SER 90 HA SER 90 -6.209 -7.698 1.545 682 HB2 SER 90 HB2 SER 90 -6.506 -5.562 2.689 683 HB3 SER 90 HB1 SER 90 -6.836 -5.342 0.975 684 HG SER 90 HG SER 90 -9.112 -5.836 1.667 685 H LYS 91 HN LYS 91 -7.952 -9.754 1.997 686 HA LYS 91 HA LYS 91 -9.195 -10.918 3.650 687 HB2 LYS 91 HB2 LYS 91 -7.326 -9.282 5.391 688 HB3 LYS 91 HB1 LYS 91 -8.017 -10.851 5.782 689 HG2 LYS 91 HG2 LYS 91 -6.746 -11.922 4.036 690 HG3 LYS 91 HG1 LYS 91 -6.209 -10.366 3.400 691 HD2 LYS 91 HD2 LYS 91 -5.440 -11.665 6.022 692 HD3 LYS 91 HD1 LYS 91 -4.380 -11.193 4.695 693 HE2 LYS 91 HE2 LYS 91 -5.893 -9.327 6.573 694 HE3 LYS 91 HE1 LYS 91 -4.133 -9.495 6.408 695 HZ1 LYS 91 HZ1 LYS 91 -4.538 -8.985 3.954 696 HZ2 LYS 91 HZ2 LYS 91 -4.660 -7.690 5.046 697 HZ3 LYS 91 HZ3 LYS 91 -6.062 -8.420 4.433 698 H GLY 92 HN GLY 92 -8.620 -8.311 5.897 699 HA2 GLY 92 HA2 GLY 92 -11.216 -7.039 5.468 700 HA3 GLY 92 HA1 GLY 92 -11.086 -7.964 6.968 701 H LEU 93 HN LEU 93 -8.239 -6.511 5.639 702 HA LEU 93 HA LEU 93 -7.296 -5.242 7.873 703 HB2 LEU 93 HB2 LEU 93 -5.755 -4.452 6.378 704 HB3 LEU 93 HB1 LEU 93 -6.646 -5.430 5.223 705 HG LEU 93 HG LEU 93 -7.333 -2.534 5.766 706 HD11 LEU 93 HD11 LEU 93 -5.906 -3.267 3.277 707 HD12 LEU 93 HD12 LEU 93 -4.933 -3.289 4.748 708 HD13 LEU 93 HD13 LEU 93 -5.773 -1.815 4.269 709 HD21 LEU 93 HD21 LEU 93 -8.564 -4.635 4.309 710 HD22 LEU 93 HD22 LEU 93 -7.858 -3.547 3.113 711 HD23 LEU 93 HD23 LEU 93 -9.006 -2.927 4.300 712 H ASP 94 HN ASP 94 -8.493 -3.936 9.247 713 HA ASP 94 HA ASP 94 -10.310 -1.893 8.023 714 HB2 ASP 94 HB2 ASP 94 -11.597 -2.098 10.055 715 HB3 ASP 94 HB1 ASP 94 -11.224 -3.730 9.499 716 H THR 95 HN THR 95 -9.395 0.141 8.030 717 HA THR 95 HA THR 95 -8.138 1.077 10.558 718 HB THR 95 HB THR 95 -6.296 2.073 8.997 719 HG1 THR 95 HG1 THR 95 -6.048 1.072 7.082 720 HG21 THR 95 HG21 THR 95 -5.644 -0.682 8.892 721 HG22 THR 95 HG22 THR 95 -6.607 -0.422 10.342 722 HG23 THR 95 HG23 THR 95 -5.140 0.508 10.087 723 H ARG 96 HN ARG 96 -7.242 3.570 9.149 724 HA ARG 96 HA ARG 96 -9.742 5.035 9.358 725 HB2 ARG 96 HB2 ARG 96 -6.948 5.803 8.457 726 HB3 ARG 96 HB1 ARG 96 -8.229 6.944 8.871 727 HG2 ARG 96 HG2 ARG 96 -8.185 6.378 11.138 728 HG3 ARG 96 HG1 ARG 96 -7.451 4.804 10.831 729 HD2 ARG 96 HD2 ARG 96 -5.538 6.541 9.839 730 HD3 ARG 96 HD1 ARG 96 -6.150 7.402 11.267 731 HE ARG 96 HE ARG 96 -4.988 4.654 11.296 732 HH11 ARG 96 HH21 ARG 96 -3.692 6.904 12.777 733 HH12 ARG 96 HH22 ARG 96 -4.278 6.665 14.390 734 HH21 ARG 96 HH11 ARG 96 -6.872 4.582 13.430 735 HH22 ARG 96 HH12 ARG 96 -6.075 5.357 14.758 736 H TYR 97 HN TYR 97 -8.897 3.077 6.916 737 HA TYR 97 HA TYR 97 -9.433 4.960 4.688 738 HB2 TYR 97 HB2 TYR 97 -8.539 2.097 4.997 739 HB3 TYR 97 HB1 TYR 97 -9.019 2.731 3.421 740 HD1 TYR 97 HD1 TYR 97 -6.759 3.414 6.326 741 HD2 TYR 97 HD2 TYR 97 -7.527 4.022 2.144 742 HE1 TYR 97 HE1 TYR 97 -4.551 4.519 6.079 743 HE2 TYR 97 HE2 TYR 97 -5.321 5.124 1.895 744 HH TYR 97 HH TYR 97 -3.696 6.453 3.883 745 H SER 98 HN SER 98 -11.286 3.116 6.806 746 HA SER 98 HA SER 98 -13.586 2.611 6.758 747 HB2 SER 98 HB2 SER 98 -13.112 4.575 4.708 748 HB3 SER 98 HB1 SER 98 -14.298 3.404 4.124 749 HG SER 98 HG SER 98 -14.370 5.075 6.395 750 H ASN 99 HN ASN 99 -11.255 1.045 5.279 751 HA ASN 99 HA ASN 99 -11.109 -1.037 4.156 752 HB2 ASN 99 HB2 ASN 99 -13.920 -1.007 5.280 753 HB3 ASN 99 HB1 ASN 99 -13.114 -2.465 4.688 754 HD21 ASN 99 HD21 ASN 99 -12.530 0.265 6.965 755 HD22 ASN 99 HD22 ASN 99 -11.700 -0.667 8.109 756 H ILE 100 HN ILE 100 -12.441 1.438 2.824 757 HA ILE 100 HA ILE 100 -14.021 0.012 0.740 758 HB ILE 100 HB ILE 100 -14.462 2.480 -0.004 759 HG12 ILE 100 HG12 ILE 100 -14.510 3.834 2.278 760 HG13 ILE 100 HG11 ILE 100 -13.122 2.835 2.652 761 HG21 ILE 100 HG21 ILE 100 -15.614 0.709 1.957 762 HG22 ILE 100 HG22 ILE 100 -16.420 1.796 0.826 763 HG23 ILE 100 HG23 ILE 100 -15.911 2.389 2.406 764 HD11 ILE 100 HD11 ILE 100 -12.312 3.536 0.254 765 HD12 ILE 100 HD12 ILE 100 -12.115 4.657 1.601 766 HD13 ILE 100 HD13 ILE 100 -13.454 4.863 0.472 767 HA PRO 101 HA PRO 101 -10.565 1.924 -1.875 768 HB2 PRO 101 HB2 PRO 101 -8.226 2.596 -0.659 769 HB3 PRO 101 HB1 PRO 101 -9.597 3.712 -0.783 770 HG2 PRO 101 HG2 PRO 101 -8.567 2.260 1.549 771 HG3 PRO 101 HG1 PRO 101 -9.522 3.745 1.472 772 HD2 PRO 101 HD2 PRO 101 -10.440 1.115 2.059 773 HD3 PRO 101 HD1 PRO 101 -11.408 2.591 1.891 774 H LEU 102 HN LEU 102 -10.784 -0.693 -1.833 775 HA LEU 102 HA LEU 102 -7.985 -1.742 -1.643 776 HB2 LEU 102 HB2 LEU 102 -10.430 -3.253 -0.689 777 HB3 LEU 102 HB1 LEU 102 -8.739 -3.651 -0.399 778 HG LEU 102 HG LEU 102 -9.969 -1.077 0.598 779 HD11 LEU 102 HD11 LEU 102 -11.149 -3.187 1.439 780 HD12 LEU 102 HD12 LEU 102 -10.484 -2.116 2.673 781 HD13 LEU 102 HD13 LEU 102 -9.627 -3.593 2.232 782 HD21 LEU 102 HD21 LEU 102 -7.558 -2.703 1.470 783 HD22 LEU 102 HD22 LEU 102 -8.058 -1.151 2.145 784 HD23 LEU 102 HD23 LEU 102 -7.492 -1.248 0.477 785 H LEU 103 HN LEU 103 -7.716 -3.811 -2.935 786 HA LEU 103 HA LEU 103 -9.761 -4.894 -4.637 787 HB2 LEU 103 HB2 LEU 103 -8.806 -2.262 -5.326 788 HB3 LEU 103 HB1 LEU 103 -8.392 -3.391 -6.614 789 HG LEU 103 HG LEU 103 -11.160 -3.051 -5.417 790 HD11 LEU 103 HD11 LEU 103 -10.772 -1.125 -6.732 791 HD12 LEU 103 HD12 LEU 103 -11.589 -2.232 -7.835 792 HD13 LEU 103 HD13 LEU 103 -9.840 -2.024 -7.930 793 HD21 LEU 103 HD21 LEU 103 -11.885 -4.732 -6.848 794 HD22 LEU 103 HD22 LEU 103 -10.280 -5.330 -6.436 795 HD23 LEU 103 HD23 LEU 103 -10.543 -4.500 -7.969 796 H THR 104 HN THR 104 -8.554 -5.766 -6.886 797 HA THR 104 HA THR 104 -6.072 -7.074 -5.923 798 HB THR 104 HB THR 104 -8.320 -7.748 -7.748 799 HG1 THR 104 HG1 THR 104 -8.137 -9.621 -6.758 800 HG21 THR 104 HG21 THR 104 -6.969 -9.356 -9.069 801 HG22 THR 104 HG22 THR 104 -5.504 -8.658 -8.376 802 HG23 THR 104 HG23 THR 104 -6.541 -7.681 -9.417 803 H LYS 105 HN LYS 105 -6.606 -4.267 -7.270 804 HA LYS 105 HA LYS 105 -5.272 -2.826 -8.551 805 HB2 LYS 105 HB2 LYS 105 -3.244 -3.432 -7.756 806 HB3 LYS 105 HB1 LYS 105 -3.619 -5.140 -7.815 807 HG2 LYS 105 HG2 LYS 105 -2.923 -3.589 -10.313 808 HG3 LYS 105 HG1 LYS 105 -1.688 -4.293 -9.282 809 HD2 LYS 105 HD2 LYS 105 -2.550 -6.511 -9.589 810 HD3 LYS 105 HD1 LYS 105 -3.988 -5.910 -10.409 811 HE2 LYS 105 HE2 LYS 105 -2.908 -5.897 -12.402 812 HE3 LYS 105 HE1 LYS 105 -1.579 -4.938 -11.723 813 HZ1 LYS 105 HZ1 LYS 105 -1.719 -7.674 -10.784 814 HZ2 LYS 105 HZ2 LYS 105 -0.371 -6.762 -11.270 815 HZ3 LYS 105 HZ3 LYS 105 -1.354 -7.521 -12.430 816 HA PRO 106 HA PRO 106 -6.395 -5.299 -12.437 817 HB2 PRO 106 HB2 PRO 106 -9.111 -5.087 -12.616 818 HB3 PRO 106 HB1 PRO 106 -8.313 -6.471 -11.842 819 HG2 PRO 106 HG2 PRO 106 -9.661 -4.135 -10.616 820 HG3 PRO 106 HG1 PRO 106 -9.566 -5.811 -10.056 821 HD2 PRO 106 HD2 PRO 106 -8.055 -3.716 -9.060 822 HD3 PRO 106 HD1 PRO 106 -7.656 -5.438 -8.907 823 H PHE 107 HN PHE 107 -6.772 -2.358 -10.960 824 HA PHE 107 HA PHE 107 -6.924 -0.159 -11.739 825 HB2 PHE 107 HB2 PHE 107 -6.315 -1.727 -14.250 826 HB3 PHE 107 HB1 PHE 107 -6.434 0.034 -14.252 827 HD1 PHE 107 HD2 PHE 107 -5.327 0.780 -11.652 828 HD2 PHE 107 HD1 PHE 107 -4.009 -2.229 -14.418 829 HE1 PHE 107 HE2 PHE 107 -3.037 0.930 -10.717 830 HE2 PHE 107 HE1 PHE 107 -1.718 -2.083 -13.482 831 HZ PHE 107 HZ PHE 107 -1.225 -0.497 -11.636 832 H LEU 108 HN LEU 108 -8.143 0.902 -14.027 833 HA LEU 108 HA LEU 108 -10.282 1.465 -14.856 834 HB2 LEU 108 HB2 LEU 108 -10.672 -1.474 -14.189 835 HB3 LEU 108 HB1 LEU 108 -11.862 -0.508 -15.050 836 HG LEU 108 HG LEU 108 -10.651 -1.541 -16.779 837 HD11 LEU 108 HD11 LEU 108 -10.696 1.083 -16.759 838 HD12 LEU 108 HD12 LEU 108 -9.710 0.242 -17.955 839 HD13 LEU 108 HD13 LEU 108 -8.957 0.924 -16.514 840 HD21 LEU 108 HD21 LEU 108 -8.847 -2.283 -15.100 841 HD22 LEU 108 HD22 LEU 108 -8.024 -0.780 -15.509 842 HD23 LEU 108 HD23 LEU 108 -8.328 -1.988 -16.757 843 H ASP 109 HN ASP 109 -9.529 1.081 -11.766 844 HA ASP 109 HA ASP 109 -11.486 2.569 -10.523 845 HB2 ASP 109 HB2 ASP 109 -13.255 1.152 -11.162 846 HB3 ASP 109 HB1 ASP 109 -12.300 -0.309 -10.908 847 H SER 110 HN SER 110 -9.032 0.156 -10.330 848 HA SER 110 HA SER 110 -9.107 -0.292 -7.467 849 HB2 SER 110 HB2 SER 110 -8.144 -1.858 -9.081 850 HB3 SER 110 HB1 SER 110 -6.957 -0.655 -9.571 851 HG SER 110 HG SER 110 -7.259 -1.695 -6.941 852 H GLU 111 HN GLU 111 -6.005 0.654 -8.666 853 HA GLU 111 HA GLU 111 -5.113 2.198 -6.621 854 HB2 GLU 111 HB2 GLU 111 -4.700 2.136 -9.552 855 HB3 GLU 111 HB1 GLU 111 -4.087 3.573 -8.733 856 HG2 GLU 111 HG2 GLU 111 -2.429 1.676 -8.869 857 HG3 GLU 111 HG1 GLU 111 -2.757 2.239 -7.230 858 H LEU 112 HN LEU 112 -6.949 3.582 -9.374 859 HA LEU 112 HA LEU 112 -6.983 6.264 -8.543 860 HB2 LEU 112 HB2 LEU 112 -9.132 6.344 -9.837 861 HB3 LEU 112 HB1 LEU 112 -7.847 5.478 -10.681 862 HG LEU 112 HG LEU 112 -9.024 3.471 -9.210 863 HD11 LEU 112 HD11 LEU 112 -11.465 4.490 -10.399 864 HD12 LEU 112 HD12 LEU 112 -10.859 5.609 -9.178 865 HD13 LEU 112 HD13 LEU 112 -11.185 3.930 -8.749 866 HD21 LEU 112 HD21 LEU 112 -8.850 4.365 -11.971 867 HD22 LEU 112 HD22 LEU 112 -10.365 3.510 -11.680 868 HD23 LEU 112 HD23 LEU 112 -8.826 2.723 -11.331 869 H GLU 113 HN GLU 113 -8.952 3.565 -7.352 870 HA GLU 113 HA GLU 113 -10.765 5.174 -5.769 871 HB2 GLU 113 HB2 GLU 113 -11.041 2.784 -6.574 872 HB3 GLU 113 HB1 GLU 113 -9.871 2.309 -5.339 873 HG2 GLU 113 HG2 GLU 113 -11.300 3.012 -3.573 874 HG3 GLU 113 HG1 GLU 113 -12.347 3.909 -4.673 875 H ALA 114 HN ALA 114 -7.997 3.126 -4.827 876 HA ALA 114 HA ALA 114 -7.791 3.619 -2.133 877 HB1 ALA 114 HB1 ALA 114 -6.310 2.268 -3.713 878 HB2 ALA 114 HB2 ALA 114 -5.464 3.105 -2.412 879 HB3 ALA 114 HB3 ALA 114 -5.449 3.772 -4.044 880 H VAL 115 HN VAL 115 -7.119 5.941 -4.713 881 HA VAL 115 HA VAL 115 -6.094 7.887 -2.694 882 HB VAL 115 HB VAL 115 -6.244 8.155 -5.706 883 HG11 VAL 115 HG11 VAL 115 -3.924 9.252 -4.364 884 HG12 VAL 115 HG12 VAL 115 -5.405 9.862 -3.625 885 HG13 VAL 115 HG13 VAL 115 -5.127 10.080 -5.353 886 HG21 VAL 115 HG21 VAL 115 -4.561 6.416 -4.014 887 HG22 VAL 115 HG22 VAL 115 -3.655 7.429 -5.140 888 HG23 VAL 115 HG23 VAL 115 -4.889 6.323 -5.745 889 H LEU 116 HN LEU 116 -8.782 7.332 -4.916 890 HA LEU 116 HA LEU 116 -9.914 9.995 -4.750 891 HB2 LEU 116 HB2 LEU 116 -10.485 7.360 -5.875 892 HB3 LEU 116 HB1 LEU 116 -11.946 8.154 -5.294 893 HG LEU 116 HG LEU 116 -11.628 8.814 -7.582 894 HD11 LEU 116 HD11 LEU 116 -11.940 10.581 -5.545 895 HD12 LEU 116 HD12 LEU 116 -11.979 11.048 -7.245 896 HD13 LEU 116 HD13 LEU 116 -10.496 11.239 -6.311 897 HD21 LEU 116 HD21 LEU 116 -9.262 8.280 -7.828 898 HD22 LEU 116 HD22 LEU 116 -8.824 9.566 -6.705 899 HD23 LEU 116 HD23 LEU 116 -9.512 9.966 -8.278 900 H VAL 117 HN VAL 117 -10.468 6.954 -3.027 901 HA VAL 117 HA VAL 117 -12.723 7.554 -1.478 902 HB VAL 117 HB VAL 117 -11.647 5.929 0.116 903 HG11 VAL 117 HG11 VAL 117 -12.167 5.574 -2.730 904 HG12 VAL 117 HG12 VAL 117 -12.589 4.521 -1.379 905 HG13 VAL 117 HG13 VAL 117 -10.997 4.398 -2.129 906 HG21 VAL 117 HG21 VAL 117 -9.410 5.660 0.142 907 HG22 VAL 117 HG22 VAL 117 -9.298 7.007 -0.990 908 HG23 VAL 117 HG23 VAL 117 -9.377 5.355 -1.594 909 H GLN 118 HN GLN 118 -9.471 8.834 -1.150 910 HA GLN 118 HA GLN 118 -9.950 9.824 1.587 911 HB2 GLN 118 HB2 GLN 118 -7.669 10.198 -0.376 912 HB3 GLN 118 HB1 GLN 118 -7.618 10.580 1.347 913 HG2 GLN 118 HG2 GLN 118 -8.438 7.822 0.518 914 HG3 GLN 118 HG1 GLN 118 -6.727 8.245 0.459 915 HE21 GLN 118 HE21 GLN 118 -9.518 7.938 2.658 916 HE22 GLN 118 HE22 GLN 118 -8.602 7.910 4.086 917 H ILE 119 HN ILE 119 -10.032 11.078 -1.709 918 HA ILE 119 HA ILE 119 -10.014 13.875 -0.818 919 HB ILE 119 HB ILE 119 -9.269 12.598 -3.071 920 HG12 ILE 119 HG12 ILE 119 -8.624 14.854 -2.634 921 HG13 ILE 119 HG11 ILE 119 -9.458 14.887 -4.188 922 HG21 ILE 119 HG21 ILE 119 -11.554 11.968 -3.713 923 HG22 ILE 119 HG22 ILE 119 -10.893 13.121 -4.872 924 HG23 ILE 119 HG23 ILE 119 -12.050 13.659 -3.654 925 HD11 ILE 119 HD11 ILE 119 -10.202 16.722 -2.678 926 HD12 ILE 119 HD12 ILE 119 -10.753 15.513 -1.519 927 HD13 ILE 119 HD13 ILE 119 -11.519 15.630 -3.103 928 H SER 120 HN SER 120 -12.354 11.454 -0.824 929 HA SER 120 HA SER 120 -14.616 13.297 -1.414 930 HB2 SER 120 HB2 SER 120 -14.070 10.405 -1.363 931 HB3 SER 120 HB1 SER 120 -15.636 10.837 -0.683 932 HG SER 120 HG SER 120 -14.799 10.842 -3.261 933 H LYS 121 HN LYS 121 -14.438 10.735 1.042 934 HA LYS 121 HA LYS 121 -14.986 10.775 3.338 935 HB2 LYS 121 HB2 LYS 121 -13.459 13.227 2.677 936 HB3 LYS 121 HB1 LYS 121 -14.330 13.273 4.211 937 HG2 LYS 121 HG2 LYS 121 -12.435 11.065 3.357 938 HG3 LYS 121 HG1 LYS 121 -12.033 12.367 4.478 939 HD2 LYS 121 HD2 LYS 121 -14.494 11.180 5.330 940 HD3 LYS 121 HD1 LYS 121 -13.319 9.891 5.062 941 HE2 LYS 121 HE2 LYS 121 -12.297 12.301 6.484 942 HE3 LYS 121 HE1 LYS 121 -13.431 11.274 7.384 943 HZ1 LYS 121 HZ1 LYS 121 -10.774 10.748 6.960 944 HZ2 LYS 121 HZ2 LYS 121 -11.571 9.734 5.855 945 HZ3 LYS 121 HZ3 LYS 121 -11.938 9.644 7.511 946 H GLU 122 HN GLU 122 -16.362 12.083 4.979 947 HA GLU 122 HA GLU 122 -18.600 12.707 5.431 948 HB2 GLU 122 HB2 GLU 122 -18.961 15.082 4.445 949 HB3 GLU 122 HB1 GLU 122 -17.591 14.844 5.523 950 HG2 GLU 122 HG2 GLU 122 -16.086 14.615 3.598 951 HG3 GLU 122 HG1 GLU 122 -17.452 14.794 2.495 952 H VAL 123 HN VAL 123 -18.171 10.975 3.108 953 HA VAL 123 HA VAL 123 -19.210 10.326 1.079 954 HB VAL 123 HB VAL 123 -20.522 9.498 3.013 955 HG11 VAL 123 HG11 VAL 123 -22.735 10.869 3.354 956 HG12 VAL 123 HG12 VAL 123 -21.790 12.205 2.699 957 HG13 VAL 123 HG13 VAL 123 -21.262 11.390 4.171 958 HG21 VAL 123 HG21 VAL 123 -21.653 8.571 1.281 959 HG22 VAL 123 HG22 VAL 123 -21.598 10.064 0.345 960 HG23 VAL 123 HG23 VAL 123 -22.859 9.828 1.554 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 10.080 14.129 17.192 2 H2 GLY 1 HT2 GLY 1 11.724 13.698 17.191 3 H3 GLY 1 HT3 GLY 1 10.838 13.689 15.741 4 HA2 GLY 1 HA2 GLY 1 10.451 16.166 16.196 5 HA3 GLY 1 HA1 GLY 1 11.815 15.993 17.300 6 H SER 2 HN SER 2 13.156 13.948 15.717 7 HA SER 2 HA SER 2 13.614 14.865 13.019 8 HB2 SER 2 HB2 SER 2 14.471 16.816 14.232 9 HB3 SER 2 HB1 SER 2 15.507 15.781 15.209 10 HG SER 2 HG SER 2 16.901 16.047 13.665 11 H HIS 3 HN HIS 3 15.864 13.935 12.252 12 HA HIS 3 HA HIS 3 17.348 12.092 12.105 13 HB2 HIS 3 HB2 HIS 3 17.284 12.838 14.709 14 HB3 HIS 3 HB1 HIS 3 16.652 11.200 14.857 15 HD1 HIS 3 HD1 HIS 3 19.684 13.096 13.645 16 HD2 HIS 3 HD2 HIS 3 18.553 9.163 14.437 17 HE1 HIS 3 HE1 HIS 3 21.796 11.707 13.523 18 H MET 4 HN MET 4 14.873 10.866 14.384 19 HA MET 4 HA MET 4 14.568 8.308 13.297 20 HB2 MET 4 HB2 MET 4 12.780 10.245 14.747 21 HB3 MET 4 HB1 MET 4 12.132 8.691 14.225 22 HG2 MET 4 HG2 MET 4 14.502 7.915 15.348 23 HG3 MET 4 HG1 MET 4 14.082 9.296 16.361 24 HE1 MET 4 HE1 MET 4 13.520 6.911 18.623 25 HE2 MET 4 HE2 MET 4 14.638 6.796 17.266 26 HE3 MET 4 HE3 MET 4 13.420 5.545 17.504 27 H THR 5 HN THR 5 11.722 10.324 12.869 28 HA THR 5 HA THR 5 11.834 9.747 9.925 29 HB THR 5 HB THR 5 9.268 9.760 10.226 30 HG1 THR 5 HG1 THR 5 8.731 9.152 12.431 31 HG21 THR 5 HG21 THR 5 9.971 7.434 11.753 32 HG22 THR 5 HG22 THR 5 11.253 7.747 10.583 33 HG23 THR 5 HG23 THR 5 9.590 7.542 10.034 34 H GLU 6 HN GLU 6 10.910 11.369 8.563 35 HA GLU 6 HA GLU 6 10.158 13.962 9.806 36 HB2 GLU 6 HB2 GLU 6 11.886 15.090 8.380 37 HB3 GLU 6 HB1 GLU 6 12.581 14.020 9.600 38 HG2 GLU 6 HG2 GLU 6 11.950 12.723 7.019 39 HG3 GLU 6 HG1 GLU 6 13.238 13.926 6.953 40 H ARG 7 HN ARG 7 9.711 11.663 7.351 41 HA ARG 7 HA ARG 7 7.987 13.570 5.841 42 HB2 ARG 7 HB2 ARG 7 10.046 11.651 4.698 43 HB3 ARG 7 HB1 ARG 7 8.931 12.624 3.740 44 HG2 ARG 7 HG2 ARG 7 10.908 13.803 5.711 45 HG3 ARG 7 HG1 ARG 7 11.234 13.630 3.986 46 HD2 ARG 7 HD2 ARG 7 9.258 15.032 3.468 47 HD3 ARG 7 HD1 ARG 7 8.950 15.226 5.205 48 HE ARG 7 HE ARG 7 11.691 15.890 4.547 49 HH11 ARG 7 HH11 ARG 7 9.707 17.399 2.674 50 HH12 ARG 7 HH12 ARG 7 9.569 18.898 3.531 51 HH21 ARG 7 HH21 ARG 7 10.980 17.663 6.449 52 HH22 ARG 7 HH22 ARG 7 10.292 19.048 5.669 53 H ARG 8 HN ARG 8 6.299 12.347 7.064 54 HA ARG 8 HA ARG 8 5.954 9.495 6.765 55 HB2 ARG 8 HB2 ARG 8 3.843 9.944 7.855 56 HB3 ARG 8 HB1 ARG 8 5.042 11.035 8.551 57 HG2 ARG 8 HG2 ARG 8 4.002 12.371 6.291 58 HG3 ARG 8 HG1 ARG 8 2.611 11.690 7.136 59 HD2 ARG 8 HD2 ARG 8 4.789 13.288 8.526 60 HD3 ARG 8 HD1 ARG 8 3.252 13.983 7.972 61 HE ARG 8 HE ARG 8 2.766 11.592 9.503 62 HH11 ARG 8 HH21 ARG 8 1.176 14.096 9.795 63 HH12 ARG 8 HH22 ARG 8 1.645 14.656 11.366 64 HH21 ARG 8 HH11 ARG 8 4.472 12.649 11.523 65 HH22 ARG 8 HH12 ARG 8 3.513 13.833 12.346 66 H LEU 9 HN LEU 9 5.745 11.836 4.413 67 HA LEU 9 HA LEU 9 3.316 10.916 3.072 68 HB2 LEU 9 HB2 LEU 9 5.409 12.457 1.610 69 HB3 LEU 9 HB1 LEU 9 3.672 12.727 1.686 70 HG LEU 9 HG LEU 9 4.380 13.267 4.267 71 HD11 LEU 9 HD11 LEU 9 6.456 14.387 4.381 72 HD12 LEU 9 HD12 LEU 9 6.577 14.529 2.626 73 HD13 LEU 9 HD13 LEU 9 6.820 12.965 3.403 74 HD21 LEU 9 HD21 LEU 9 4.189 15.009 1.808 75 HD22 LEU 9 HD22 LEU 9 4.435 15.712 3.406 76 HD23 LEU 9 HD23 LEU 9 2.985 14.764 3.073 77 H ARG 10 HN ARG 10 3.842 8.589 2.806 78 HA ARG 10 HA ARG 10 5.580 8.141 0.433 79 HB2 ARG 10 HB2 ARG 10 6.346 7.706 3.149 80 HB3 ARG 10 HB1 ARG 10 6.186 6.130 2.372 81 HG2 ARG 10 HG2 ARG 10 7.843 8.466 1.384 82 HG3 ARG 10 HG1 ARG 10 8.454 6.944 2.035 83 HD2 ARG 10 HD2 ARG 10 6.709 6.146 -0.003 84 HD3 ARG 10 HD1 ARG 10 7.567 7.544 -0.680 85 HE ARG 10 HE ARG 10 8.777 5.029 -0.325 86 HH11 ARG 10 HH11 ARG 10 9.344 8.381 0.006 87 HH12 ARG 10 HH12 ARG 10 11.013 8.208 0.435 88 HH21 ARG 10 HH21 ARG 10 10.900 4.743 0.541 89 HH22 ARG 10 HH22 ARG 10 11.894 6.148 0.741 90 H VAL 11 HN VAL 11 5.023 6.271 -0.738 91 HA VAL 11 HA VAL 11 2.711 4.684 0.334 92 HB VAL 11 HB VAL 11 2.146 4.539 -2.189 93 HG11 VAL 11 HG11 VAL 11 1.282 7.016 -2.080 94 HG12 VAL 11 HG12 VAL 11 1.919 6.969 -0.436 95 HG13 VAL 11 HG13 VAL 11 0.665 5.831 -0.929 96 HG21 VAL 11 HG21 VAL 11 4.386 5.403 -2.910 97 HG22 VAL 11 HG22 VAL 11 3.965 6.967 -2.213 98 HG23 VAL 11 HG23 VAL 11 3.042 6.331 -3.574 99 H LEU 12 HN LEU 12 3.945 2.852 0.986 100 HA LEU 12 HA LEU 12 5.985 1.721 -0.788 101 HB2 LEU 12 HB2 LEU 12 4.631 0.712 1.737 102 HB3 LEU 12 HB1 LEU 12 6.094 0.037 1.024 103 HG LEU 12 HG LEU 12 7.018 1.457 2.613 104 HD11 LEU 12 HD11 LEU 12 7.862 2.124 0.387 105 HD12 LEU 12 HD12 LEU 12 7.822 3.495 1.494 106 HD13 LEU 12 HD13 LEU 12 6.572 3.320 0.262 107 HD21 LEU 12 HD21 LEU 12 4.532 2.415 2.945 108 HD22 LEU 12 HD22 LEU 12 5.245 3.794 2.105 109 HD23 LEU 12 HD23 LEU 12 5.951 3.221 3.616 110 H VAL 13 HN VAL 13 5.308 0.653 -2.611 111 HA VAL 13 HA VAL 13 2.944 -1.178 -2.358 112 HB VAL 13 HB VAL 13 3.822 0.359 -4.814 113 HG11 VAL 13 HG11 VAL 13 1.959 -0.480 -5.841 114 HG12 VAL 13 HG12 VAL 13 1.008 -0.456 -4.355 115 HG13 VAL 13 HG13 VAL 13 2.152 -1.766 -4.650 116 HG21 VAL 13 HG21 VAL 13 2.096 1.160 -2.503 117 HG22 VAL 13 HG22 VAL 13 1.655 1.714 -4.117 118 HG23 VAL 13 HG23 VAL 13 3.228 2.133 -3.440 119 H VAL 14 HN VAL 14 3.711 -3.271 -2.566 120 HA VAL 14 HA VAL 14 6.008 -3.630 -4.444 121 HB VAL 14 HB VAL 14 7.112 -4.898 -2.768 122 HG11 VAL 14 HG11 VAL 14 6.628 -2.272 -2.447 123 HG12 VAL 14 HG12 VAL 14 7.630 -3.205 -1.336 124 HG13 VAL 14 HG13 VAL 14 5.941 -2.887 -0.943 125 HG21 VAL 14 HG21 VAL 14 5.366 -6.263 -1.889 126 HG22 VAL 14 HG22 VAL 14 4.438 -4.853 -1.379 127 HG23 VAL 14 HG23 VAL 14 5.925 -5.282 -0.534 128 H GLU 15 HN GLU 15 6.245 -5.610 -5.407 129 HA GLU 15 HA GLU 15 4.439 -7.868 -5.028 130 HB2 GLU 15 HB2 GLU 15 3.054 -7.562 -6.860 131 HB3 GLU 15 HB1 GLU 15 3.365 -5.867 -6.479 132 HG2 GLU 15 HG2 GLU 15 5.171 -5.798 -8.133 133 HG3 GLU 15 HG1 GLU 15 4.959 -7.512 -8.472 134 H ASP 16 HN ASP 16 5.227 -9.704 -6.271 135 HA ASP 16 HA ASP 16 7.878 -10.203 -6.516 136 HB2 ASP 16 HB2 ASP 16 7.126 -11.599 -8.610 137 HB3 ASP 16 HB1 ASP 16 6.478 -11.968 -7.013 138 H GLU 17 HN GLU 17 6.238 -9.421 -9.611 139 HA GLU 17 HA GLU 17 8.753 -8.696 -10.851 140 HB2 GLU 17 HB2 GLU 17 5.974 -8.117 -11.871 141 HB3 GLU 17 HB1 GLU 17 7.419 -8.501 -12.804 142 HG2 GLU 17 HG2 GLU 17 6.685 -10.638 -12.798 143 HG3 GLU 17 HG1 GLU 17 7.167 -10.678 -11.102 144 H SER 18 HN SER 18 8.730 -6.598 -12.256 145 HA SER 18 HA SER 18 8.472 -4.298 -10.405 146 HB2 SER 18 HB2 SER 18 9.820 -4.881 -13.041 147 HB3 SER 18 HB1 SER 18 9.707 -3.235 -12.427 148 HG SER 18 HG SER 18 11.020 -3.735 -10.808 149 H MET 19 HN MET 19 6.481 -5.792 -12.636 150 HA MET 19 HA MET 19 5.456 -3.805 -14.323 151 HB2 MET 19 HB2 MET 19 4.743 -6.199 -14.175 152 HB3 MET 19 HB1 MET 19 3.914 -5.834 -12.661 153 HG2 MET 19 HG2 MET 19 3.304 -4.223 -15.126 154 HG3 MET 19 HG1 MET 19 2.550 -5.801 -14.898 155 HE1 MET 19 HE1 MET 19 -0.002 -3.174 -14.426 156 HE2 MET 19 HE2 MET 19 -0.361 -4.858 -14.055 157 HE3 MET 19 HE3 MET 19 0.731 -4.470 -15.381 158 H ILE 20 HN ILE 20 5.292 -4.134 -10.871 159 HA ILE 20 HA ILE 20 3.172 -2.176 -10.425 160 HB ILE 20 HB ILE 20 3.633 -3.985 -8.862 161 HG12 ILE 20 HG12 ILE 20 4.768 -1.759 -7.271 162 HG13 ILE 20 HG11 ILE 20 3.275 -1.381 -8.138 163 HG21 ILE 20 HG21 ILE 20 5.925 -4.489 -9.202 164 HG22 ILE 20 HG22 ILE 20 5.847 -3.852 -7.561 165 HG23 ILE 20 HG23 ILE 20 6.420 -2.828 -8.876 166 HD11 ILE 20 HD11 ILE 20 3.665 -3.046 -5.779 167 HD12 ILE 20 HD12 ILE 20 2.824 -3.920 -7.060 168 HD13 ILE 20 HD13 ILE 20 2.170 -2.398 -6.455 169 H ALA 21 HN ALA 21 6.683 -2.201 -10.627 170 HA ALA 21 HA ALA 21 7.357 0.283 -9.486 171 HB1 ALA 21 HB1 ALA 21 8.521 -1.760 -10.995 172 HB2 ALA 21 HB2 ALA 21 9.363 -0.355 -10.341 173 HB3 ALA 21 HB3 ALA 21 8.739 -0.322 -11.991 174 H MET 22 HN MET 22 6.967 -0.251 -13.015 175 HA MET 22 HA MET 22 6.718 2.461 -13.777 176 HB2 MET 22 HB2 MET 22 6.991 0.489 -15.276 177 HB3 MET 22 HB1 MET 22 5.335 0.003 -14.912 178 HG2 MET 22 HG2 MET 22 4.416 1.675 -16.190 179 HG3 MET 22 HG1 MET 22 5.730 2.801 -15.851 180 HE1 MET 22 HE1 MET 22 8.627 1.737 -17.717 181 HE2 MET 22 HE2 MET 22 7.835 2.673 -16.453 182 HE3 MET 22 HE3 MET 22 7.722 3.199 -18.131 183 H LEU 23 HN LEU 23 4.318 0.215 -12.487 184 HA LEU 23 HA LEU 23 2.011 1.930 -12.893 185 HB2 LEU 23 HB2 LEU 23 1.692 -0.422 -12.683 186 HB3 LEU 23 HB1 LEU 23 2.722 -0.514 -11.258 187 HG LEU 23 HG LEU 23 0.176 -0.688 -10.897 188 HD11 LEU 23 HD11 LEU 23 2.249 0.611 -9.386 189 HD12 LEU 23 HD12 LEU 23 0.871 -0.320 -8.799 190 HD13 LEU 23 HD13 LEU 23 0.710 1.414 -9.076 191 HD21 LEU 23 HD21 LEU 23 -0.209 2.140 -10.606 192 HD22 LEU 23 HD22 LEU 23 -1.127 1.001 -11.587 193 HD23 LEU 23 HD23 LEU 23 0.286 1.804 -12.264 194 H ILE 24 HN ILE 24 4.695 2.200 -10.905 195 HA ILE 24 HA ILE 24 3.252 3.437 -8.627 196 HB ILE 24 HB ILE 24 5.523 1.833 -8.989 197 HG12 ILE 24 HG12 ILE 24 5.001 3.436 -6.496 198 HG13 ILE 24 HG11 ILE 24 3.876 2.183 -7.028 199 HG21 ILE 24 HG21 ILE 24 6.308 4.666 -8.268 200 HG22 ILE 24 HG22 ILE 24 6.992 3.641 -9.530 201 HG23 ILE 24 HG23 ILE 24 7.285 3.263 -7.832 202 HD11 ILE 24 HD11 ILE 24 5.218 0.713 -5.963 203 HD12 ILE 24 HD12 ILE 24 6.501 1.907 -5.785 204 HD13 ILE 24 HD13 ILE 24 6.365 0.974 -7.275 205 H GLU 25 HN GLU 25 5.894 4.254 -10.901 206 HA GLU 25 HA GLU 25 6.272 6.949 -10.192 207 HB2 GLU 25 HB2 GLU 25 6.375 5.600 -12.909 208 HB3 GLU 25 HB1 GLU 25 7.179 7.116 -12.494 209 HG2 GLU 25 HG2 GLU 25 7.942 5.348 -10.463 210 HG3 GLU 25 HG1 GLU 25 8.016 4.384 -11.942 211 H ASP 26 HN ASP 26 3.700 5.469 -12.080 212 HA ASP 26 HA ASP 26 2.671 8.020 -13.087 213 HB2 ASP 26 HB2 ASP 26 1.202 6.638 -14.263 214 HB3 ASP 26 HB1 ASP 26 2.520 5.507 -13.961 215 H THR 27 HN THR 27 1.825 5.703 -10.511 216 HA THR 27 HA THR 27 -0.477 7.115 -9.537 217 HB THR 27 HB THR 27 0.492 5.757 -7.387 218 HG1 THR 27 HG1 THR 27 1.429 3.848 -8.701 219 HG21 THR 27 HG21 THR 27 -0.834 3.885 -8.146 220 HG22 THR 27 HG22 THR 27 -0.675 4.396 -9.826 221 HG23 THR 27 HG23 THR 27 -1.621 5.364 -8.696 222 H LEU 28 HN LEU 28 2.925 7.010 -8.420 223 HA LEU 28 HA LEU 28 2.728 8.994 -6.392 224 HB2 LEU 28 HB2 LEU 28 4.826 8.152 -6.241 225 HB3 LEU 28 HB1 LEU 28 4.707 7.484 -7.858 226 HG LEU 28 HG LEU 28 5.247 9.866 -8.695 227 HD11 LEU 28 HD11 LEU 28 5.774 11.487 -7.198 228 HD12 LEU 28 HD12 LEU 28 6.724 10.379 -6.208 229 HD13 LEU 28 HD13 LEU 28 4.974 10.461 -6.009 230 HD21 LEU 28 HD21 LEU 28 7.021 7.837 -7.462 231 HD22 LEU 28 HD22 LEU 28 7.758 9.416 -7.740 232 HD23 LEU 28 HD23 LEU 28 7.052 8.523 -9.087 233 H CYS 29 HN CYS 29 3.319 9.260 -9.911 234 HA CYS 29 HA CYS 29 3.902 11.972 -10.194 235 HB2 CYS 29 HB2 CYS 29 3.663 10.274 -12.012 236 HB3 CYS 29 HB1 CYS 29 1.913 10.330 -11.802 237 HG CYS 29 HG CYS 29 1.824 12.478 -13.046 238 H GLU 30 HN GLU 30 0.821 10.436 -9.422 239 HA GLU 30 HA GLU 30 -0.650 12.970 -9.426 240 HB2 GLU 30 HB2 GLU 30 -1.757 10.980 -10.221 241 HB3 GLU 30 HB1 GLU 30 -1.292 10.083 -8.776 242 HG2 GLU 30 HG2 GLU 30 -3.302 10.671 -7.929 243 HG3 GLU 30 HG1 GLU 30 -2.638 12.295 -7.762 244 H LEU 31 HN LEU 31 0.467 10.535 -7.068 245 HA LEU 31 HA LEU 31 -0.574 11.876 -4.731 246 HB2 LEU 31 HB2 LEU 31 1.721 9.933 -5.150 247 HB3 LEU 31 HB1 LEU 31 1.022 10.337 -3.583 248 HG LEU 31 HG LEU 31 -0.889 9.457 -5.680 249 HD11 LEU 31 HD11 LEU 31 -0.049 7.379 -5.997 250 HD12 LEU 31 HD12 LEU 31 0.268 7.177 -4.274 251 HD13 LEU 31 HD13 LEU 31 1.457 7.976 -5.301 252 HD21 LEU 31 HD21 LEU 31 -0.807 8.196 -3.016 253 HD22 LEU 31 HD22 LEU 31 -2.151 8.979 -3.845 254 HD23 LEU 31 HD23 LEU 31 -0.968 9.952 -2.970 255 H GLY 32 HN GLY 32 2.570 11.922 -6.406 256 HA2 GLY 32 HA2 GLY 32 4.222 13.617 -6.365 257 HA3 GLY 32 HA1 GLY 32 3.189 14.551 -5.272 258 H HIS 33 HN HIS 33 3.326 11.465 -4.091 259 HA HIS 33 HA HIS 33 4.569 11.970 -1.670 260 HB2 HIS 33 HB2 HIS 33 4.246 9.571 -3.455 261 HB3 HIS 33 HB1 HIS 33 5.145 9.403 -1.946 262 HD1 HIS 33 HD1 HIS 33 2.016 8.535 -2.901 263 HD2 HIS 33 HD2 HIS 33 3.266 11.219 0.033 264 HE1 HIS 33 HE1 HIS 33 0.066 8.810 -1.303 265 H GLU 34 HN GLU 34 6.765 10.993 -0.961 266 HA GLU 34 HA GLU 34 8.905 12.325 -2.316 267 HB2 GLU 34 HB2 GLU 34 8.403 10.821 0.054 268 HB3 GLU 34 HB1 GLU 34 9.814 10.108 -0.727 269 HG2 GLU 34 HG2 GLU 34 10.305 12.805 -0.999 270 HG3 GLU 34 HG1 GLU 34 9.521 12.726 0.580 271 H VAL 35 HN VAL 35 8.953 8.818 -1.761 272 HA VAL 35 HA VAL 35 9.314 8.282 -4.658 273 HB VAL 35 HB VAL 35 11.381 7.330 -2.671 274 HG11 VAL 35 HG11 VAL 35 12.124 8.100 -5.415 275 HG12 VAL 35 HG12 VAL 35 10.933 6.802 -5.335 276 HG13 VAL 35 HG13 VAL 35 12.489 6.623 -4.523 277 HG21 VAL 35 HG21 VAL 35 11.315 9.776 -2.421 278 HG22 VAL 35 HG22 VAL 35 11.392 9.972 -4.172 279 HG23 VAL 35 HG23 VAL 35 12.769 9.300 -3.298 280 H ALA 36 HN ALA 36 7.509 6.859 -4.612 281 HA ALA 36 HA ALA 36 6.793 5.060 -2.561 282 HB1 ALA 36 HB1 ALA 36 6.492 4.402 -5.482 283 HB2 ALA 36 HB2 ALA 36 5.683 5.821 -4.814 284 HB3 ALA 36 HB3 ALA 36 5.318 4.216 -4.178 285 H ALA 37 HN ALA 37 6.804 2.532 -3.076 286 HA ALA 37 HA ALA 37 9.636 1.742 -3.736 287 HB1 ALA 37 HB1 ALA 37 8.248 1.557 -1.327 288 HB2 ALA 37 HB2 ALA 37 9.696 0.643 -1.746 289 HB3 ALA 37 HB3 ALA 37 8.101 -0.061 -2.009 290 H THR 38 HN THR 38 9.825 -0.063 -5.109 291 HA THR 38 HA THR 38 7.250 -1.141 -6.183 292 HB THR 38 HB THR 38 8.296 0.193 -7.834 293 HG1 THR 38 HG1 THR 38 9.430 -2.307 -8.438 294 HG21 THR 38 HG21 THR 38 10.432 0.732 -7.219 295 HG22 THR 38 HG22 THR 38 10.839 -0.575 -8.332 296 HG23 THR 38 HG23 THR 38 10.770 -0.884 -6.597 297 H ALA 39 HN ALA 39 7.578 -3.245 -7.348 298 HA ALA 39 HA ALA 39 7.892 -5.547 -7.184 299 HB1 ALA 39 HB1 ALA 39 9.979 -5.441 -8.079 300 HB2 ALA 39 HB2 ALA 39 10.447 -5.964 -6.460 301 HB3 ALA 39 HB3 ALA 39 10.537 -4.257 -6.896 302 H SER 40 HN SER 40 8.169 -7.322 -5.644 303 HA SER 40 HA SER 40 7.407 -6.557 -2.941 304 HB2 SER 40 HB2 SER 40 7.124 -8.914 -2.651 305 HB3 SER 40 HB1 SER 40 6.568 -8.521 -4.269 306 HG SER 40 HG SER 40 9.061 -9.638 -3.488 307 H ARG 41 HN ARG 41 8.646 -6.778 -1.058 308 HA ARG 41 HA ARG 41 11.351 -7.886 -1.168 309 HB2 ARG 41 HB2 ARG 41 11.110 -5.368 -2.054 310 HB3 ARG 41 HB1 ARG 41 11.165 -5.029 -0.322 311 HG2 ARG 41 HG2 ARG 41 13.421 -5.089 -0.609 312 HG3 ARG 41 HG1 ARG 41 13.197 -6.838 -0.556 313 HD2 ARG 41 HD2 ARG 41 12.635 -6.324 -3.190 314 HD3 ARG 41 HD1 ARG 41 13.887 -5.113 -2.853 315 HE ARG 41 HE ARG 41 14.917 -7.355 -1.658 316 HH11 ARG 41 HH11 ARG 41 14.035 -6.329 -4.805 317 HH12 ARG 41 HH12 ARG 41 14.782 -7.670 -5.607 318 HH21 ARG 41 HH21 ARG 41 15.686 -9.269 -2.668 319 HH22 ARG 41 HH22 ARG 41 15.711 -9.336 -4.398 320 H MET 42 HN MET 42 11.775 -8.734 0.847 321 HA MET 42 HA MET 42 9.886 -8.498 2.997 322 HB2 MET 42 HB2 MET 42 12.726 -9.540 2.818 323 HB3 MET 42 HB1 MET 42 11.653 -9.819 4.191 324 HG2 MET 42 HG2 MET 42 9.980 -10.755 2.464 325 HG3 MET 42 HG1 MET 42 11.350 -10.804 1.352 326 HE1 MET 42 HE1 MET 42 13.196 -12.060 1.375 327 HE2 MET 42 HE2 MET 42 12.084 -13.382 1.028 328 HE3 MET 42 HE3 MET 42 13.405 -13.627 2.169 329 H GLN 43 HN GLN 43 13.003 -6.944 2.323 330 HA GLN 43 HA GLN 43 13.257 -5.682 4.924 331 HB2 GLN 43 HB2 GLN 43 14.854 -6.183 2.754 332 HB3 GLN 43 HB1 GLN 43 14.546 -4.454 2.565 333 HG2 GLN 43 HG2 GLN 43 15.778 -3.914 4.395 334 HG3 GLN 43 HG1 GLN 43 15.148 -5.271 5.331 335 HE21 GLN 43 HE21 GLN 43 16.458 -7.131 5.503 336 HE22 GLN 43 HE22 GLN 43 17.926 -7.335 4.675 337 H GLU 44 HN GLU 44 12.598 -4.240 1.690 338 HA GLU 44 HA GLU 44 11.844 -1.673 2.537 339 HB2 GLU 44 HB2 GLU 44 11.667 -3.336 0.229 340 HB3 GLU 44 HB1 GLU 44 10.086 -2.595 0.461 341 HG2 GLU 44 HG2 GLU 44 11.286 -1.025 -0.853 342 HG3 GLU 44 HG1 GLU 44 11.356 -0.382 0.787 343 H ALA 45 HN ALA 45 9.784 -4.542 2.087 344 HA ALA 45 HA ALA 45 7.292 -3.583 2.909 345 HB1 ALA 45 HB1 ALA 45 7.580 -5.862 2.193 346 HB2 ALA 45 HB2 ALA 45 7.060 -5.955 3.876 347 HB3 ALA 45 HB3 ALA 45 8.761 -6.181 3.465 348 H LEU 46 HN LEU 46 9.894 -4.851 5.010 349 HA LEU 46 HA LEU 46 8.751 -4.341 7.537 350 HB2 LEU 46 HB2 LEU 46 10.896 -5.537 6.973 351 HB3 LEU 46 HB1 LEU 46 11.635 -3.970 6.650 352 HG LEU 46 HG LEU 46 11.378 -3.276 8.924 353 HD11 LEU 46 HD11 LEU 46 9.606 -5.715 9.127 354 HD12 LEU 46 HD12 LEU 46 9.199 -4.038 9.490 355 HD13 LEU 46 HD13 LEU 46 10.276 -4.935 10.559 356 HD21 LEU 46 HD21 LEU 46 12.346 -6.113 8.594 357 HD22 LEU 46 HD22 LEU 46 12.433 -5.297 10.154 358 HD23 LEU 46 HD23 LEU 46 13.302 -4.641 8.767 359 H ASP 47 HN ASP 47 10.419 -2.203 5.278 360 HA ASP 47 HA ASP 47 10.603 0.112 6.959 361 HB2 ASP 47 HB2 ASP 47 11.755 -0.593 4.723 362 HB3 ASP 47 HB1 ASP 47 10.334 0.117 3.956 363 H ILE 48 HN ILE 48 7.932 -1.343 5.327 364 HA ILE 48 HA ILE 48 6.394 1.162 5.240 365 HB ILE 48 HB ILE 48 5.162 0.120 3.605 366 HG12 ILE 48 HG12 ILE 48 5.497 -2.444 5.186 367 HG13 ILE 48 HG11 ILE 48 4.023 -1.506 4.957 368 HG21 ILE 48 HG21 ILE 48 7.633 -0.222 3.094 369 HG22 ILE 48 HG22 ILE 48 6.521 -1.288 2.235 370 HG23 ILE 48 HG23 ILE 48 7.421 -1.887 3.625 371 HD11 ILE 48 HD11 ILE 48 3.641 -3.046 3.297 372 HD12 ILE 48 HD12 ILE 48 5.355 -3.411 3.102 373 HD13 ILE 48 HD13 ILE 48 4.674 -1.961 2.366 374 H ALA 49 HN ALA 49 6.824 -1.644 7.230 375 HA ALA 49 HA ALA 49 4.200 -1.345 8.529 376 HB1 ALA 49 HB1 ALA 49 6.531 -3.229 8.971 377 HB2 ALA 49 HB2 ALA 49 5.100 -3.562 7.996 378 HB3 ALA 49 HB3 ALA 49 4.953 -3.380 9.744 379 H ARG 50 HN ARG 50 7.485 -1.723 9.922 380 HA ARG 50 HA ARG 50 7.015 -0.757 12.473 381 HB2 ARG 50 HB2 ARG 50 9.436 -0.046 12.376 382 HB3 ARG 50 HB1 ARG 50 9.135 -1.677 11.765 383 HG2 ARG 50 HG2 ARG 50 8.792 -0.267 9.485 384 HG3 ARG 50 HG1 ARG 50 9.965 0.767 10.300 385 HD2 ARG 50 HD2 ARG 50 10.357 -2.226 10.055 386 HD3 ARG 50 HD1 ARG 50 10.971 -1.081 8.845 387 HE ARG 50 HE ARG 50 11.665 -0.764 11.739 388 HH11 ARG 50 HH11 ARG 50 12.374 0.718 8.965 389 HH12 ARG 50 HH12 ARG 50 14.067 0.355 8.921 390 HH21 ARG 50 HH21 ARG 50 13.889 -2.009 11.455 391 HH22 ARG 50 HH22 ARG 50 14.926 -1.195 10.331 392 H LYS 51 HN LYS 51 6.984 1.149 9.544 393 HA LYS 51 HA LYS 51 7.626 3.733 10.465 394 HB2 LYS 51 HB2 LYS 51 5.452 2.776 8.586 395 HB3 LYS 51 HB1 LYS 51 6.026 4.439 8.680 396 HG2 LYS 51 HG2 LYS 51 7.864 2.112 8.144 397 HG3 LYS 51 HG1 LYS 51 7.057 3.008 6.855 398 HD2 LYS 51 HD2 LYS 51 8.333 4.889 7.172 399 HD3 LYS 51 HD1 LYS 51 8.456 4.639 8.913 400 HE2 LYS 51 HE2 LYS 51 10.137 2.902 8.603 401 HE3 LYS 51 HE1 LYS 51 9.942 2.985 6.840 402 HZ1 LYS 51 HZ1 LYS 51 10.410 5.505 8.221 403 HZ2 LYS 51 HZ2 LYS 51 10.987 4.970 6.715 404 HZ3 LYS 51 HZ3 LYS 51 11.732 4.446 8.149 405 H GLY 52 HN GLY 52 4.420 2.143 10.487 406 HA2 GLY 52 HA2 GLY 52 2.707 2.416 12.123 407 HA3 GLY 52 HA1 GLY 52 3.670 3.687 12.881 408 H GLN 53 HN GLN 53 4.097 5.062 10.253 409 HA GLN 53 HA GLN 53 1.346 5.940 9.561 410 HB2 GLN 53 HB2 GLN 53 1.956 8.272 10.041 411 HB3 GLN 53 HB1 GLN 53 2.162 7.281 11.486 412 HG2 GLN 53 HG2 GLN 53 4.618 7.078 10.182 413 HG3 GLN 53 HG1 GLN 53 4.160 8.770 9.972 414 HE21 GLN 53 HE21 GLN 53 3.239 9.791 12.139 415 HE22 GLN 53 HE22 GLN 53 4.090 9.394 13.553 416 H PHE 54 HN PHE 54 3.471 4.496 8.100 417 HA PHE 54 HA PHE 54 4.857 6.214 6.252 418 HB2 PHE 54 HB2 PHE 54 5.247 4.145 5.062 419 HB3 PHE 54 HB1 PHE 54 5.342 3.819 6.785 420 HD1 PHE 54 HD1 PHE 54 2.115 4.130 6.983 421 HD2 PHE 54 HD2 PHE 54 4.812 1.728 4.670 422 HE1 PHE 54 HE1 PHE 54 0.379 2.428 6.769 423 HE2 PHE 54 HE2 PHE 54 3.064 0.018 4.460 424 HZ PHE 54 HZ PHE 54 0.836 0.355 5.508 425 H ASP 55 HN ASP 55 1.592 6.099 6.530 426 HA ASP 55 HA ASP 55 -0.026 7.018 5.076 427 HB2 ASP 55 HB2 ASP 55 2.358 7.541 3.779 428 HB3 ASP 55 HB1 ASP 55 1.452 6.607 2.589 429 H ILE 56 HN ILE 56 1.649 4.610 2.947 430 HA ILE 56 HA ILE 56 -0.753 2.847 3.261 431 HB ILE 56 HB ILE 56 0.228 3.750 0.552 432 HG12 ILE 56 HG12 ILE 56 -1.886 4.995 2.339 433 HG13 ILE 56 HG11 ILE 56 -0.438 5.776 1.704 434 HG21 ILE 56 HG21 ILE 56 -1.178 1.709 0.694 435 HG22 ILE 56 HG22 ILE 56 -2.006 3.020 -0.144 436 HG23 ILE 56 HG23 ILE 56 -2.416 2.644 1.527 437 HD11 ILE 56 HD11 ILE 56 -2.501 6.363 0.419 438 HD12 ILE 56 HD12 ILE 56 -2.671 4.662 -0.015 439 HD13 ILE 56 HD13 ILE 56 -1.271 5.579 -0.573 440 H ALA 57 HN ALA 57 -0.498 0.702 2.095 441 HA ALA 57 HA ALA 57 2.322 -0.041 1.415 442 HB1 ALA 57 HB1 ALA 57 1.254 -0.423 3.937 443 HB2 ALA 57 HB2 ALA 57 2.618 -1.310 3.269 444 HB3 ALA 57 HB3 ALA 57 0.990 -1.976 3.158 445 H ILE 58 HN ILE 58 2.259 -1.474 -0.375 446 HA ILE 58 HA ILE 58 -0.260 -3.075 -0.643 447 HB ILE 58 HB ILE 58 1.228 -1.488 -2.737 448 HG12 ILE 58 HG12 ILE 58 -1.145 -0.522 -2.973 449 HG13 ILE 58 HG11 ILE 58 -1.481 -1.303 -1.426 450 HG21 ILE 58 HG21 ILE 58 -1.230 -2.633 -3.669 451 HG22 ILE 58 HG22 ILE 58 -0.203 -3.921 -3.038 452 HG23 ILE 58 HG23 ILE 58 0.397 -2.857 -4.311 453 HD11 ILE 58 HD11 ILE 58 -0.223 1.195 -1.843 454 HD12 ILE 58 HD12 ILE 58 1.032 0.097 -1.272 455 HD13 ILE 58 HD13 ILE 58 -0.427 0.341 -0.315 456 H ILE 59 HN ILE 59 0.762 -4.988 0.051 457 HA ILE 59 HA ILE 59 3.023 -6.050 -1.615 458 HB ILE 59 HB ILE 59 1.816 -6.643 1.097 459 HG12 ILE 59 HG12 ILE 59 4.741 -6.588 0.543 460 HG13 ILE 59 HG11 ILE 59 3.882 -5.055 0.391 461 HG21 ILE 59 HG21 ILE 59 3.705 -8.530 0.959 462 HG22 ILE 59 HG22 ILE 59 3.262 -8.485 -0.748 463 HG23 ILE 59 HG23 ILE 59 2.040 -8.848 0.472 464 HD11 ILE 59 HD11 ILE 59 4.642 -5.230 2.673 465 HD12 ILE 59 HD12 ILE 59 3.986 -6.861 2.820 466 HD13 ILE 59 HD13 ILE 59 2.896 -5.481 2.679 467 H ASP 60 HN ASP 60 1.042 -5.912 -3.184 468 HA ASP 60 HA ASP 60 -1.195 -7.630 -2.951 469 HB2 ASP 60 HB2 ASP 60 -1.670 -6.807 -5.055 470 HB3 ASP 60 HB1 ASP 60 -0.448 -5.644 -4.556 471 H VAL 61 HN VAL 61 -1.147 -8.944 -5.439 472 HA VAL 61 HA VAL 61 -0.878 -11.161 -6.135 473 HB VAL 61 HB VAL 61 0.959 -9.846 -7.063 474 HG11 VAL 61 HG11 VAL 61 2.153 -9.027 -5.193 475 HG12 VAL 61 HG12 VAL 61 3.255 -10.166 -5.965 476 HG13 VAL 61 HG13 VAL 61 2.372 -10.638 -4.519 477 HG21 VAL 61 HG21 VAL 61 2.228 -12.453 -6.306 478 HG22 VAL 61 HG22 VAL 61 2.122 -11.684 -7.890 479 HG23 VAL 61 HG23 VAL 61 0.708 -12.479 -7.199 480 H ASN 62 HN ASN 62 -1.859 -11.905 -4.049 481 HA ASN 62 HA ASN 62 0.120 -13.280 -2.271 482 HB2 ASN 62 HB2 ASN 62 -2.633 -12.106 -1.953 483 HB3 ASN 62 HB1 ASN 62 -2.088 -13.353 -0.833 484 HD21 ASN 62 HD21 ASN 62 0.495 -11.407 -2.069 485 HD22 ASN 62 HD22 ASN 62 0.672 -10.403 -0.715 486 H LEU 63 HN LEU 63 -0.036 -14.753 -4.423 487 HA LEU 63 HA LEU 63 -2.073 -16.866 -3.825 488 HB2 LEU 63 HB2 LEU 63 -1.835 -15.114 -6.098 489 HB3 LEU 63 HB1 LEU 63 -1.545 -16.774 -6.619 490 HG LEU 63 HG LEU 63 -3.649 -17.413 -5.324 491 HD11 LEU 63 HD11 LEU 63 -4.994 -14.937 -5.501 492 HD12 LEU 63 HD12 LEU 63 -3.465 -14.593 -4.692 493 HD13 LEU 63 HD13 LEU 63 -4.560 -15.807 -4.030 494 HD21 LEU 63 HD21 LEU 63 -5.060 -15.984 -7.172 495 HD22 LEU 63 HD22 LEU 63 -4.164 -17.455 -7.551 496 HD23 LEU 63 HD23 LEU 63 -3.436 -15.877 -7.850 497 H ASP 64 HN ASP 64 -1.397 -18.881 -5.310 498 HA ASP 64 HA ASP 64 0.205 -20.626 -5.430 499 HB2 ASP 64 HB2 ASP 64 0.723 -18.462 -7.110 500 HB3 ASP 64 HB1 ASP 64 2.291 -18.792 -6.364 501 H GLY 65 HN GLY 65 0.200 -18.882 -2.904 502 HA2 GLY 65 HA2 GLY 65 1.873 -19.961 -1.183 503 HA3 GLY 65 HA1 GLY 65 3.066 -19.090 -2.145 504 H GLU 66 HN GLU 66 0.751 -17.017 -2.502 505 HA GLU 66 HA GLU 66 0.265 -14.944 -1.492 506 HB2 GLU 66 HB2 GLU 66 0.475 -16.550 1.064 507 HB3 GLU 66 HB1 GLU 66 -0.578 -15.172 0.741 508 HG2 GLU 66 HG2 GLU 66 -1.485 -16.714 -1.202 509 HG3 GLU 66 HG1 GLU 66 -0.831 -18.008 -0.196 510 HA PRO 67 HA PRO 67 4.739 -14.556 -0.244 511 HB2 PRO 67 HB2 PRO 67 5.447 -12.820 -2.239 512 HB3 PRO 67 HB1 PRO 67 5.525 -14.584 -2.413 513 HG2 PRO 67 HG2 PRO 67 3.481 -12.672 -3.412 514 HG3 PRO 67 HG1 PRO 67 4.125 -14.136 -4.167 515 HD2 PRO 67 HD2 PRO 67 1.694 -14.015 -2.919 516 HD3 PRO 67 HD1 PRO 67 2.650 -15.502 -3.089 517 H SER 68 HN SER 68 2.996 -13.343 1.327 518 HA SER 68 HA SER 68 3.441 -10.394 1.011 519 HB2 SER 68 HB2 SER 68 1.360 -11.401 2.857 520 HB3 SER 68 HB1 SER 68 1.270 -10.104 1.670 521 HG SER 68 HG SER 68 0.413 -12.616 1.465 522 H TYR 69 HN TYR 69 4.686 -12.951 2.585 523 HA TYR 69 HA TYR 69 5.791 -13.312 4.616 524 HB2 TYR 69 HB2 TYR 69 6.438 -10.657 5.369 525 HB3 TYR 69 HB1 TYR 69 7.456 -11.798 4.502 526 HD1 TYR 69 HD2 TYR 69 6.969 -11.978 1.896 527 HD2 TYR 69 HD1 TYR 69 5.900 -8.632 4.364 528 HE1 TYR 69 HE2 TYR 69 6.859 -10.527 -0.112 529 HE2 TYR 69 HE1 TYR 69 5.792 -7.181 2.360 530 HH TYR 69 HH TYR 69 7.030 -8.144 -0.668 531 HA PRO 70 HA PRO 70 3.182 -12.599 8.011 532 HB2 PRO 70 HB2 PRO 70 4.924 -12.243 10.096 533 HB3 PRO 70 HB1 PRO 70 4.641 -13.820 9.331 534 HG2 PRO 70 HG2 PRO 70 6.883 -11.899 8.927 535 HG3 PRO 70 HG1 PRO 70 6.913 -13.667 9.020 536 HD2 PRO 70 HD2 PRO 70 7.038 -12.309 6.670 537 HD3 PRO 70 HD1 PRO 70 6.316 -13.928 6.819 538 H VAL 71 HN VAL 71 5.243 -10.166 6.856 539 HA VAL 71 HA VAL 71 4.606 -8.119 8.835 540 HB VAL 71 HB VAL 71 5.610 -7.813 5.996 541 HG11 VAL 71 HG11 VAL 71 6.389 -6.140 8.368 542 HG12 VAL 71 HG12 VAL 71 4.863 -5.824 7.546 543 HG13 VAL 71 HG13 VAL 71 6.382 -5.708 6.659 544 HG21 VAL 71 HG21 VAL 71 7.157 -9.321 6.869 545 HG22 VAL 71 HG22 VAL 71 6.964 -8.720 8.516 546 HG23 VAL 71 HG23 VAL 71 7.871 -7.777 7.332 547 H ALA 72 HN ALA 72 3.853 -8.252 5.339 548 HA ALA 72 HA ALA 72 1.812 -6.368 5.223 549 HB1 ALA 72 HB1 ALA 72 1.616 -7.259 3.139 550 HB2 ALA 72 HB2 ALA 72 1.262 -8.865 3.775 551 HB3 ALA 72 HB3 ALA 72 2.934 -8.326 3.623 552 H ASP 73 HN ASP 73 1.461 -9.866 5.853 553 HA ASP 73 HA ASP 73 -1.310 -9.867 6.396 554 HB2 ASP 73 HB2 ASP 73 1.073 -11.511 7.036 555 HB3 ASP 73 HB1 ASP 73 -0.383 -11.848 7.963 556 H ILE 74 HN ILE 74 1.414 -9.737 8.727 557 HA ILE 74 HA ILE 74 -0.065 -9.278 11.099 558 HB ILE 74 HB ILE 74 2.642 -8.451 10.054 559 HG12 ILE 74 HG12 ILE 74 1.850 -10.040 12.512 560 HG13 ILE 74 HG11 ILE 74 2.097 -10.776 10.929 561 HG21 ILE 74 HG21 ILE 74 2.982 -7.710 12.568 562 HG22 ILE 74 HG22 ILE 74 1.249 -7.394 12.488 563 HG23 ILE 74 HG23 ILE 74 2.347 -6.569 11.381 564 HD11 ILE 74 HD11 ILE 74 4.127 -9.337 12.646 565 HD12 ILE 74 HD12 ILE 74 4.398 -9.648 10.931 566 HD13 ILE 74 HD13 ILE 74 4.188 -10.996 12.048 567 H LEU 75 HN LEU 75 1.127 -7.067 8.640 568 HA LEU 75 HA LEU 75 0.278 -4.591 9.662 569 HB2 LEU 75 HB2 LEU 75 1.545 -5.546 7.474 570 HB3 LEU 75 HB1 LEU 75 -0.026 -5.229 6.752 571 HG LEU 75 HG LEU 75 0.342 -2.929 8.166 572 HD11 LEU 75 HD11 LEU 75 3.013 -4.167 7.660 573 HD12 LEU 75 HD12 LEU 75 2.510 -3.072 8.948 574 HD13 LEU 75 HD13 LEU 75 2.855 -2.440 7.339 575 HD21 LEU 75 HD21 LEU 75 1.105 -3.743 5.364 576 HD22 LEU 75 HD22 LEU 75 1.333 -2.080 5.904 577 HD23 LEU 75 HD23 LEU 75 -0.281 -2.792 5.898 578 H ALA 76 HN ALA 76 -1.505 -7.233 8.178 579 HA ALA 76 HA ALA 76 -3.959 -5.805 7.686 580 HB1 ALA 76 HB1 ALA 76 -2.883 -8.121 6.883 581 HB2 ALA 76 HB2 ALA 76 -4.625 -7.848 6.856 582 HB3 ALA 76 HB3 ALA 76 -3.892 -8.738 8.190 583 H GLU 77 HN GLU 77 -3.423 -8.447 10.072 584 HA GLU 77 HA GLU 77 -5.688 -8.167 11.626 585 HB2 GLU 77 HB2 GLU 77 -4.284 -9.021 13.476 586 HB3 GLU 77 HB1 GLU 77 -3.867 -9.812 11.956 587 HG2 GLU 77 HG2 GLU 77 -1.909 -8.487 11.686 588 HG3 GLU 77 HG1 GLU 77 -2.407 -7.361 12.950 589 H ARG 78 HN ARG 78 -2.992 -5.942 11.453 590 HA ARG 78 HA ARG 78 -4.455 -4.082 13.247 591 HB2 ARG 78 HB2 ARG 78 -2.398 -3.604 14.417 592 HB3 ARG 78 HB1 ARG 78 -2.558 -5.360 14.364 593 HG2 ARG 78 HG2 ARG 78 -0.592 -5.512 13.283 594 HG3 ARG 78 HG1 ARG 78 -1.235 -4.525 11.971 595 HD2 ARG 78 HD2 ARG 78 -0.502 -2.490 13.012 596 HD3 ARG 78 HD1 ARG 78 -0.141 -3.327 14.535 597 HE ARG 78 HE ARG 78 1.298 -4.097 12.030 598 HH11 ARG 78 HH11 ARG 78 2.421 -1.686 13.442 599 HH12 ARG 78 HH12 ARG 78 3.592 -2.405 14.497 600 HH21 ARG 78 HH21 ARG 78 2.306 -5.609 14.177 601 HH22 ARG 78 HH22 ARG 78 3.526 -4.624 14.914 602 H ASN 79 HN ASN 79 -4.678 -3.874 10.520 603 HA ASN 79 HA ASN 79 -2.587 -2.352 9.268 604 HB2 ASN 79 HB2 ASN 79 -5.172 -3.492 8.671 605 HB3 ASN 79 HB1 ASN 79 -5.035 -1.878 7.968 606 HD21 ASN 79 HD21 ASN 79 -4.985 -4.387 6.425 607 HD22 ASN 79 HD22 ASN 79 -3.468 -4.469 5.671 608 H VAL 80 HN VAL 80 -2.206 -0.254 9.254 609 HA VAL 80 HA VAL 80 -3.849 1.596 10.896 610 HB VAL 80 HB VAL 80 -1.216 0.935 10.661 611 HG11 VAL 80 HG11 VAL 80 -0.049 2.060 9.123 612 HG12 VAL 80 HG12 VAL 80 -0.831 3.582 9.518 613 HG13 VAL 80 HG13 VAL 80 -1.576 2.482 8.364 614 HG21 VAL 80 HG21 VAL 80 -2.727 3.190 11.784 615 HG22 VAL 80 HG22 VAL 80 -0.999 3.490 11.594 616 HG23 VAL 80 HG23 VAL 80 -1.556 2.115 12.549 617 HA PRO 81 HA PRO 81 -5.238 3.997 7.388 618 HB2 PRO 81 HB2 PRO 81 -3.748 6.296 7.071 619 HB3 PRO 81 HB1 PRO 81 -5.022 6.114 8.295 620 HG2 PRO 81 HG2 PRO 81 -2.066 5.803 8.587 621 HG3 PRO 81 HG1 PRO 81 -3.222 6.623 9.652 622 HD2 PRO 81 HD2 PRO 81 -2.317 4.197 10.226 623 HD3 PRO 81 HD1 PRO 81 -3.997 4.629 10.569 624 H PHE 82 HN PHE 82 -4.909 3.209 5.379 625 HA PHE 82 HA PHE 82 -2.494 3.543 3.815 626 HB2 PHE 82 HB2 PHE 82 -1.481 1.422 4.186 627 HB3 PHE 82 HB1 PHE 82 -1.933 1.962 5.804 628 HD1 PHE 82 HD2 PHE 82 -4.829 1.481 5.898 629 HD2 PHE 82 HD1 PHE 82 -1.716 -0.910 4.163 630 HE1 PHE 82 HE2 PHE 82 -6.250 -0.514 6.128 631 HE2 PHE 82 HE1 PHE 82 -3.148 -2.916 4.406 632 HZ PHE 82 HZ PHE 82 -5.418 -2.716 5.373 633 H ILE 83 HN ILE 83 -2.777 0.809 2.743 634 HA ILE 83 HA ILE 83 -5.449 0.279 1.860 635 HB ILE 83 HB ILE 83 -3.924 2.319 0.504 636 HG12 ILE 83 HG12 ILE 83 -6.350 1.810 -0.838 637 HG13 ILE 83 HG11 ILE 83 -6.638 1.415 0.857 638 HG21 ILE 83 HG21 ILE 83 -4.397 1.441 -1.842 639 HG22 ILE 83 HG22 ILE 83 -4.669 -0.140 -1.108 640 HG23 ILE 83 HG23 ILE 83 -3.081 0.622 -1.000 641 HD11 ILE 83 HD11 ILE 83 -5.221 3.737 1.099 642 HD12 ILE 83 HD12 ILE 83 -6.982 3.654 1.077 643 HD13 ILE 83 HD13 ILE 83 -6.100 4.033 -0.401 644 H PHE 84 HN PHE 84 -5.396 -1.640 0.495 645 HA PHE 84 HA PHE 84 -2.761 -2.858 -0.071 646 HB2 PHE 84 HB2 PHE 84 -3.649 -3.037 2.396 647 HB3 PHE 84 HB1 PHE 84 -4.703 -4.273 1.721 648 HD1 PHE 84 HD2 PHE 84 -3.796 -6.351 0.816 649 HD2 PHE 84 HD1 PHE 84 -1.219 -3.369 2.532 650 HE1 PHE 84 HE2 PHE 84 -1.970 -8.023 0.975 651 HE2 PHE 84 HE1 PHE 84 0.607 -5.051 2.692 652 HZ PHE 84 HZ PHE 84 0.229 -7.368 1.898 653 H ALA 85 HN ALA 85 -3.061 -4.912 -1.307 654 HA ALA 85 HA ALA 85 -5.731 -5.743 -2.055 655 HB1 ALA 85 HB1 ALA 85 -5.845 -3.782 -3.333 656 HB2 ALA 85 HB2 ALA 85 -5.287 -4.971 -4.511 657 HB3 ALA 85 HB3 ALA 85 -4.138 -3.858 -3.767 658 H THR 86 HN THR 86 -5.520 -7.887 -2.624 659 HA THR 86 HA THR 86 -3.139 -8.779 -4.191 660 HB THR 86 HB THR 86 -2.365 -10.218 -2.555 661 HG1 THR 86 HG1 THR 86 -3.827 -10.932 -0.841 662 HG21 THR 86 HG21 THR 86 -3.786 -8.458 -0.582 663 HG22 THR 86 HG22 THR 86 -2.542 -7.782 -1.634 664 HG23 THR 86 HG23 THR 86 -2.141 -9.088 -0.524 665 H GLY 87 HN GLY 87 -3.808 -11.579 -3.671 666 HA2 GLY 87 HA2 GLY 87 -6.078 -11.817 -5.520 667 HA3 GLY 87 HA1 GLY 87 -5.085 -13.150 -4.918 668 H TYR 88 HN TYR 88 -5.673 -11.614 -2.171 669 HA TYR 88 HA TYR 88 -7.839 -13.432 -1.419 670 HB2 TYR 88 HB2 TYR 88 -7.200 -12.893 0.759 671 HB3 TYR 88 HB1 TYR 88 -5.707 -12.596 -0.119 672 HD1 TYR 88 HD2 TYR 88 -6.009 -10.012 -1.345 673 HD2 TYR 88 HD1 TYR 88 -7.459 -11.340 2.471 674 HE1 TYR 88 HE2 TYR 88 -5.971 -7.682 -0.528 675 HE2 TYR 88 HE1 TYR 88 -7.419 -8.998 3.291 676 HH TYR 88 HH TYR 88 -6.825 -6.310 1.142 677 H GLY 89 HN GLY 89 -7.529 -10.053 -2.305 678 HA2 GLY 89 HA2 GLY 89 -9.211 -8.458 -2.693 679 HA3 GLY 89 HA1 GLY 89 -10.377 -9.782 -2.614 680 H SER 90 HN SER 90 -8.369 -7.721 -0.547 681 HA SER 90 HA SER 90 -8.728 -6.938 1.631 682 HB2 SER 90 HB2 SER 90 -10.694 -5.757 1.653 683 HB3 SER 90 HB1 SER 90 -10.818 -6.331 -0.007 684 HG SER 90 HG SER 90 -12.363 -6.904 2.115 685 H LYS 91 HN LYS 91 -9.916 -7.485 3.756 686 HA LYS 91 HA LYS 91 -11.089 -10.135 4.020 687 HB2 LYS 91 HB2 LYS 91 -9.242 -11.169 5.159 688 HB3 LYS 91 HB1 LYS 91 -8.570 -10.449 3.695 689 HG2 LYS 91 HG2 LYS 91 -7.090 -9.427 5.070 690 HG3 LYS 91 HG1 LYS 91 -8.429 -8.370 5.517 691 HD2 LYS 91 HD2 LYS 91 -8.753 -9.410 7.540 692 HD3 LYS 91 HD1 LYS 91 -8.275 -10.991 6.921 693 HE2 LYS 91 HE2 LYS 91 -6.022 -9.161 6.831 694 HE3 LYS 91 HE1 LYS 91 -6.685 -9.263 8.475 695 HZ1 LYS 91 HZ1 LYS 91 -6.797 -11.734 8.094 696 HZ2 LYS 91 HZ2 LYS 91 -5.232 -11.093 8.253 697 HZ3 LYS 91 HZ3 LYS 91 -5.837 -11.494 6.716 698 H GLY 92 HN GLY 92 -11.452 -7.223 4.789 699 HA2 GLY 92 HA2 GLY 92 -12.702 -6.367 6.650 700 HA3 GLY 92 HA1 GLY 92 -12.135 -7.728 7.624 701 H LEU 93 HN LEU 93 -9.631 -6.340 5.805 702 HA LEU 93 HA LEU 93 -7.906 -5.677 7.836 703 HB2 LEU 93 HB2 LEU 93 -6.802 -4.268 6.217 704 HB3 LEU 93 HB1 LEU 93 -7.534 -5.606 5.346 705 HG LEU 93 HG LEU 93 -7.989 -3.637 4.071 706 HD11 LEU 93 HD11 LEU 93 -9.936 -5.152 4.345 707 HD12 LEU 93 HD12 LEU 93 -10.419 -3.476 4.097 708 HD13 LEU 93 HD13 LEU 93 -10.476 -4.178 5.714 709 HD21 LEU 93 HD21 LEU 93 -9.493 -2.128 6.070 710 HD22 LEU 93 HD22 LEU 93 -8.248 -1.576 4.951 711 HD23 LEU 93 HD23 LEU 93 -7.792 -2.308 6.489 712 H ASP 94 HN ASP 94 -7.425 -3.767 9.053 713 HA ASP 94 HA ASP 94 -9.788 -1.967 9.460 714 HB2 ASP 94 HB2 ASP 94 -8.615 -1.660 11.723 715 HB3 ASP 94 HB1 ASP 94 -9.281 -3.261 11.399 716 H THR 95 HN THR 95 -9.397 0.312 9.775 717 HA THR 95 HA THR 95 -6.804 1.540 9.710 718 HB THR 95 HB THR 95 -6.709 0.558 7.498 719 HG1 THR 95 HG1 THR 95 -6.515 2.475 6.298 720 HG21 THR 95 HG21 THR 95 -8.473 1.312 5.804 721 HG22 THR 95 HG22 THR 95 -9.428 1.824 7.196 722 HG23 THR 95 HG23 THR 95 -8.995 0.127 7.002 723 H ARG 96 HN ARG 96 -7.079 3.933 8.811 724 HA ARG 96 HA ARG 96 -9.385 5.095 10.197 725 HB2 ARG 96 HB2 ARG 96 -7.067 6.199 8.575 726 HB3 ARG 96 HB1 ARG 96 -8.247 7.216 9.403 727 HG2 ARG 96 HG2 ARG 96 -7.398 5.306 11.305 728 HG3 ARG 96 HG1 ARG 96 -5.937 5.878 10.498 729 HD2 ARG 96 HD2 ARG 96 -8.027 7.851 11.422 730 HD3 ARG 96 HD1 ARG 96 -6.792 7.243 12.544 731 HE ARG 96 HE ARG 96 -5.197 8.519 11.361 732 HH11 ARG 96 HH11 ARG 96 -8.033 9.503 10.105 733 HH12 ARG 96 HH12 ARG 96 -7.485 9.763 8.483 734 HH21 ARG 96 HH21 ARG 96 -4.446 8.159 8.967 735 HH22 ARG 96 HH22 ARG 96 -5.454 9.002 7.838 736 H TYR 97 HN TYR 97 -9.033 3.676 7.231 737 HA TYR 97 HA TYR 97 -10.482 5.654 5.613 738 HB2 TYR 97 HB2 TYR 97 -9.535 2.798 5.261 739 HB3 TYR 97 HB1 TYR 97 -10.420 3.658 4.003 740 HD1 TYR 97 HD2 TYR 97 -7.534 4.293 6.339 741 HD2 TYR 97 HD1 TYR 97 -9.152 4.747 2.387 742 HE1 TYR 97 HE2 TYR 97 -5.431 5.380 5.606 743 HE2 TYR 97 HE1 TYR 97 -7.047 5.839 1.655 744 HH TYR 97 HH TYR 97 -5.006 6.469 2.234 745 H SER 98 HN SER 98 -11.184 2.261 6.411 746 HA SER 98 HA SER 98 -13.418 1.974 7.785 747 HB2 SER 98 HB2 SER 98 -14.136 3.562 5.329 748 HB3 SER 98 HB1 SER 98 -15.330 2.478 6.046 749 HG SER 98 HG SER 98 -14.662 3.608 8.095 750 H ASN 99 HN ASN 99 -11.483 0.751 5.570 751 HA ASN 99 HA ASN 99 -11.403 -1.313 4.427 752 HB2 ASN 99 HB2 ASN 99 -14.073 -1.783 5.787 753 HB3 ASN 99 HB1 ASN 99 -12.899 -2.996 5.281 754 HD21 ASN 99 HD21 ASN 99 -10.780 -0.840 6.331 755 HD22 ASN 99 HD22 ASN 99 -10.740 -1.175 7.989 756 H ILE 100 HN ILE 100 -11.703 -0.201 2.400 757 HA ILE 100 HA ILE 100 -14.308 -0.807 1.129 758 HB ILE 100 HB ILE 100 -13.311 1.948 0.625 759 HG12 ILE 100 HG12 ILE 100 -14.693 2.719 2.657 760 HG13 ILE 100 HG11 ILE 100 -14.501 1.088 3.275 761 HG21 ILE 100 HG21 ILE 100 -15.393 0.744 -0.305 762 HG22 ILE 100 HG22 ILE 100 -15.593 2.393 0.291 763 HG23 ILE 100 HG23 ILE 100 -16.096 1.028 1.288 764 HD11 ILE 100 HD11 ILE 100 -12.447 3.234 2.909 765 HD12 ILE 100 HD12 ILE 100 -11.929 1.567 2.769 766 HD13 ILE 100 HD13 ILE 100 -12.669 2.131 4.254 767 HA PRO 101 HA PRO 101 -11.328 0.167 -2.360 768 HB2 PRO 101 HB2 PRO 101 -8.940 1.395 -1.932 769 HB3 PRO 101 HB1 PRO 101 -10.468 2.276 -2.108 770 HG2 PRO 101 HG2 PRO 101 -8.868 1.770 0.301 771 HG3 PRO 101 HG1 PRO 101 -10.011 3.071 -0.047 772 HD2 PRO 101 HD2 PRO 101 -10.461 0.758 1.522 773 HD3 PRO 101 HD1 PRO 101 -11.643 1.990 1.048 774 H LEU 102 HN LEU 102 -11.172 -2.270 -1.181 775 HA LEU 102 HA LEU 102 -8.262 -2.965 -1.147 776 HB2 LEU 102 HB2 LEU 102 -10.712 -4.483 -0.180 777 HB3 LEU 102 HB1 LEU 102 -9.042 -4.990 0.057 778 HG LEU 102 HG LEU 102 -9.559 -3.960 2.099 779 HD11 LEU 102 HD11 LEU 102 -8.288 -1.899 2.170 780 HD12 LEU 102 HD12 LEU 102 -8.525 -1.643 0.442 781 HD13 LEU 102 HD13 LEU 102 -7.519 -2.977 1.006 782 HD21 LEU 102 HD21 LEU 102 -10.784 -1.550 0.779 783 HD22 LEU 102 HD22 LEU 102 -11.058 -2.189 2.400 784 HD23 LEU 102 HD23 LEU 102 -11.743 -3.014 1.000 785 H LEU 103 HN LEU 103 -7.484 -4.485 -2.711 786 HA LEU 103 HA LEU 103 -9.443 -5.993 -4.323 787 HB2 LEU 103 HB2 LEU 103 -8.678 -3.338 -4.986 788 HB3 LEU 103 HB1 LEU 103 -7.973 -4.416 -6.193 789 HG LEU 103 HG LEU 103 -10.883 -4.411 -5.341 790 HD11 LEU 103 HD11 LEU 103 -9.559 -2.643 -7.012 791 HD12 LEU 103 HD12 LEU 103 -11.290 -2.979 -7.038 792 HD13 LEU 103 HD13 LEU 103 -10.206 -3.846 -8.127 793 HD21 LEU 103 HD21 LEU 103 -9.977 -6.632 -6.032 794 HD22 LEU 103 HD22 LEU 103 -9.450 -5.916 -7.555 795 HD23 LEU 103 HD23 LEU 103 -11.169 -6.012 -7.175 796 H THR 104 HN THR 104 -7.912 -6.388 -6.611 797 HA THR 104 HA THR 104 -5.469 -7.726 -5.565 798 HB THR 104 HB THR 104 -7.610 -9.035 -6.256 799 HG1 THR 104 HG1 THR 104 -4.978 -9.510 -7.117 800 HG21 THR 104 HG21 THR 104 -8.286 -8.995 -8.413 801 HG22 THR 104 HG22 THR 104 -6.633 -9.104 -9.020 802 HG23 THR 104 HG23 THR 104 -7.301 -7.539 -8.556 803 H LYS 105 HN LYS 105 -5.914 -5.026 -6.974 804 HA LYS 105 HA LYS 105 -4.701 -3.763 -8.566 805 HB2 LYS 105 HB2 LYS 105 -3.129 -6.135 -7.881 806 HB3 LYS 105 HB1 LYS 105 -2.758 -5.507 -9.486 807 HG2 LYS 105 HG2 LYS 105 -1.975 -3.497 -8.672 808 HG3 LYS 105 HG1 LYS 105 -3.030 -3.542 -7.257 809 HD2 LYS 105 HD2 LYS 105 -1.214 -4.221 -6.097 810 HD3 LYS 105 HD1 LYS 105 -1.413 -5.768 -6.924 811 HE2 LYS 105 HE2 LYS 105 0.172 -3.464 -8.106 812 HE3 LYS 105 HE1 LYS 105 0.910 -4.779 -7.169 813 HZ1 LYS 105 HZ1 LYS 105 0.769 -5.161 -9.643 814 HZ2 LYS 105 HZ2 LYS 105 -0.915 -5.263 -9.455 815 HZ3 LYS 105 HZ3 LYS 105 0.098 -6.382 -8.676 816 HA PRO 106 HA PRO 106 -6.606 -6.314 -11.988 817 HB2 PRO 106 HB2 PRO 106 -9.124 -5.267 -12.053 818 HB3 PRO 106 HB1 PRO 106 -8.702 -6.661 -11.039 819 HG2 PRO 106 HG2 PRO 106 -9.172 -3.854 -10.279 820 HG3 PRO 106 HG1 PRO 106 -9.422 -5.334 -9.345 821 HD2 PRO 106 HD2 PRO 106 -7.264 -3.549 -9.097 822 HD3 PRO 106 HD1 PRO 106 -7.375 -5.180 -8.403 823 H PHE 107 HN PHE 107 -6.187 -3.076 -11.046 824 HA PHE 107 HA PHE 107 -5.807 -1.085 -12.242 825 HB2 PHE 107 HB2 PHE 107 -5.465 -3.246 -14.325 826 HB3 PHE 107 HB1 PHE 107 -5.232 -1.540 -14.717 827 HD1 PHE 107 HD2 PHE 107 -4.243 -4.092 -12.180 828 HD2 PHE 107 HD1 PHE 107 -3.138 -0.547 -14.320 829 HE1 PHE 107 HE2 PHE 107 -1.996 -4.173 -11.132 830 HE2 PHE 107 HE1 PHE 107 -0.889 -0.618 -13.275 831 HZ PHE 107 HZ PHE 107 -0.315 -2.429 -11.683 832 H LEU 108 HN LEU 108 -8.241 -0.971 -11.652 833 HA LEU 108 HA LEU 108 -9.696 0.353 -13.647 834 HB2 LEU 108 HB2 LEU 108 -11.367 -1.555 -14.156 835 HB3 LEU 108 HB1 LEU 108 -9.798 -1.649 -14.948 836 HG LEU 108 HG LEU 108 -9.280 -2.983 -12.613 837 HD11 LEU 108 HD11 LEU 108 -11.536 -4.570 -12.953 838 HD12 LEU 108 HD12 LEU 108 -12.178 -2.928 -12.990 839 HD13 LEU 108 HD13 LEU 108 -11.239 -3.478 -11.601 840 HD21 LEU 108 HD21 LEU 108 -9.279 -4.961 -13.968 841 HD22 LEU 108 HD22 LEU 108 -8.880 -3.625 -15.049 842 HD23 LEU 108 HD23 LEU 108 -10.509 -4.301 -15.046 843 H ASP 109 HN ASP 109 -10.506 1.608 -11.957 844 HA ASP 109 HA ASP 109 -12.053 2.179 -10.256 845 HB2 ASP 109 HB2 ASP 109 -13.369 0.393 -11.598 846 HB3 ASP 109 HB1 ASP 109 -12.909 -0.719 -10.307 847 H SER 110 HN SER 110 -9.410 0.343 -9.971 848 HA SER 110 HA SER 110 -9.828 -0.579 -7.181 849 HB2 SER 110 HB2 SER 110 -7.521 -0.783 -9.138 850 HB3 SER 110 HB1 SER 110 -7.576 -1.571 -7.565 851 HG SER 110 HG SER 110 -9.539 -1.893 -9.586 852 H GLU 111 HN GLU 111 -6.775 0.715 -8.371 853 HA GLU 111 HA GLU 111 -5.880 2.059 -6.159 854 HB2 GLU 111 HB2 GLU 111 -5.654 2.370 -9.093 855 HB3 GLU 111 HB1 GLU 111 -5.164 3.785 -8.161 856 HG2 GLU 111 HG2 GLU 111 -3.302 2.759 -7.380 857 HG3 GLU 111 HG1 GLU 111 -4.172 1.265 -7.033 858 H LEU 112 HN LEU 112 -7.859 3.611 -8.680 859 HA LEU 112 HA LEU 112 -8.294 6.138 -7.657 860 HB2 LEU 112 HB2 LEU 112 -10.845 4.837 -8.371 861 HB3 LEU 112 HB1 LEU 112 -10.056 6.223 -9.111 862 HG LEU 112 HG LEU 112 -9.326 3.323 -9.600 863 HD11 LEU 112 HD11 LEU 112 -10.787 5.354 -11.319 864 HD12 LEU 112 HD12 LEU 112 -11.503 3.928 -10.571 865 HD13 LEU 112 HD13 LEU 112 -10.297 3.745 -11.845 866 HD21 LEU 112 HD21 LEU 112 -7.517 5.166 -9.784 867 HD22 LEU 112 HD22 LEU 112 -8.444 5.763 -11.160 868 HD23 LEU 112 HD23 LEU 112 -7.758 4.140 -11.199 869 H GLU 113 HN GLU 113 -10.071 3.199 -6.683 870 HA GLU 113 HA GLU 113 -11.711 4.325 -4.659 871 HB2 GLU 113 HB2 GLU 113 -11.272 1.866 -5.769 872 HB3 GLU 113 HB1 GLU 113 -10.528 1.646 -4.180 873 HG2 GLU 113 HG2 GLU 113 -12.546 1.496 -3.218 874 HG3 GLU 113 HG1 GLU 113 -13.001 3.070 -3.870 875 H ALA 114 HN ALA 114 -8.346 3.221 -4.575 876 HA ALA 114 HA ALA 114 -7.898 3.204 -1.785 877 HB1 ALA 114 HB1 ALA 114 -6.390 2.537 -3.738 878 HB2 ALA 114 HB2 ALA 114 -5.587 3.377 -2.411 879 HB3 ALA 114 HB3 ALA 114 -5.988 4.247 -3.892 880 H VAL 115 HN VAL 115 -7.942 5.936 -4.049 881 HA VAL 115 HA VAL 115 -7.468 7.810 -1.758 882 HB VAL 115 HB VAL 115 -7.467 8.614 -4.654 883 HG11 VAL 115 HG11 VAL 115 -5.231 9.586 -3.254 884 HG12 VAL 115 HG12 VAL 115 -6.564 9.657 -2.101 885 HG13 VAL 115 HG13 VAL 115 -6.696 10.481 -3.655 886 HG21 VAL 115 HG21 VAL 115 -4.877 7.964 -4.363 887 HG22 VAL 115 HG22 VAL 115 -6.051 6.825 -5.022 888 HG23 VAL 115 HG23 VAL 115 -5.576 6.719 -3.327 889 H LEU 116 HN LEU 116 -9.926 6.678 -3.878 890 HA LEU 116 HA LEU 116 -11.537 9.141 -3.843 891 HB2 LEU 116 HB2 LEU 116 -11.790 6.323 -4.870 892 HB3 LEU 116 HB1 LEU 116 -13.161 7.432 -4.928 893 HG LEU 116 HG LEU 116 -10.433 7.884 -6.160 894 HD11 LEU 116 HD11 LEU 116 -11.335 6.906 -7.968 895 HD12 LEU 116 HD12 LEU 116 -12.625 8.107 -7.971 896 HD13 LEU 116 HD13 LEU 116 -12.821 6.603 -7.071 897 HD21 LEU 116 HD21 LEU 116 -12.232 9.804 -7.087 898 HD22 LEU 116 HD22 LEU 116 -10.946 10.073 -5.909 899 HD23 LEU 116 HD23 LEU 116 -12.580 9.699 -5.362 900 H VAL 117 HN VAL 117 -11.086 6.574 -1.663 901 HA VAL 117 HA VAL 117 -13.865 6.439 -0.728 902 HB VAL 117 HB VAL 117 -12.505 4.468 -0.612 903 HG11 VAL 117 HG11 VAL 117 -10.422 4.651 0.980 904 HG12 VAL 117 HG12 VAL 117 -10.525 6.372 0.614 905 HG13 VAL 117 HG13 VAL 117 -10.281 5.209 -0.682 906 HG21 VAL 117 HG21 VAL 117 -12.156 4.934 2.206 907 HG22 VAL 117 HG22 VAL 117 -13.369 3.947 1.391 908 HG23 VAL 117 HG23 VAL 117 -13.670 5.662 1.669 909 H GLN 118 HN GLN 118 -10.924 8.147 0.215 910 HA GLN 118 HA GLN 118 -11.874 8.930 2.843 911 HB2 GLN 118 HB2 GLN 118 -9.499 8.828 1.538 912 HB3 GLN 118 HB1 GLN 118 -9.855 10.550 1.395 913 HG2 GLN 118 HG2 GLN 118 -8.600 10.162 3.449 914 HG3 GLN 118 HG1 GLN 118 -10.251 10.631 3.859 915 HE21 GLN 118 HE21 GLN 118 -11.687 8.959 4.716 916 HE22 GLN 118 HE22 GLN 118 -11.079 7.478 5.281 917 H ILE 119 HN ILE 119 -11.761 10.573 -0.334 918 HA ILE 119 HA ILE 119 -12.999 13.000 0.757 919 HB ILE 119 HB ILE 119 -12.530 13.903 -1.347 920 HG12 ILE 119 HG12 ILE 119 -13.897 12.431 -2.705 921 HG13 ILE 119 HG11 ILE 119 -12.279 12.488 -3.402 922 HG21 ILE 119 HG21 ILE 119 -10.535 11.808 -1.826 923 HG22 ILE 119 HG22 ILE 119 -10.579 12.357 -0.150 924 HG23 ILE 119 HG23 ILE 119 -10.307 13.517 -1.451 925 HD11 ILE 119 HD11 ILE 119 -11.720 10.365 -2.256 926 HD12 ILE 119 HD12 ILE 119 -13.103 10.171 -3.333 927 HD13 ILE 119 HD13 ILE 119 -13.352 10.303 -1.592 928 H SER 120 HN SER 120 -14.329 10.059 0.193 929 HA SER 120 HA SER 120 -17.032 10.985 0.160 930 HB2 SER 120 HB2 SER 120 -15.612 10.682 -2.432 931 HB3 SER 120 HB1 SER 120 -17.241 10.016 -2.367 932 HG SER 120 HG SER 120 -16.903 12.360 -2.925 933 H LYS 121 HN LYS 121 -18.470 9.028 -0.884 934 HA LYS 121 HA LYS 121 -17.511 6.370 -0.958 935 HB2 LYS 121 HB2 LYS 121 -16.676 6.656 1.264 936 HB3 LYS 121 HB1 LYS 121 -18.149 7.474 1.785 937 HG2 LYS 121 HG2 LYS 121 -19.344 5.505 1.959 938 HG3 LYS 121 HG1 LYS 121 -18.392 4.697 0.712 939 HD2 LYS 121 HD2 LYS 121 -17.135 3.745 2.313 940 HD3 LYS 121 HD1 LYS 121 -16.609 5.347 2.826 941 HE2 LYS 121 HE2 LYS 121 -17.695 4.945 4.781 942 HE3 LYS 121 HE1 LYS 121 -19.211 5.080 3.866 943 HZ1 LYS 121 HZ1 LYS 121 -19.184 2.927 4.836 944 HZ2 LYS 121 HZ2 LYS 121 -17.590 2.635 4.324 945 HZ3 LYS 121 HZ3 LYS 121 -18.848 2.718 3.186 946 H GLU 122 HN GLU 122 -20.056 8.600 -0.046 947 HA GLU 122 HA GLU 122 -22.052 6.795 -1.291 948 HB2 GLU 122 HB2 GLU 122 -23.462 7.400 0.892 949 HB3 GLU 122 HB1 GLU 122 -22.357 6.026 0.886 950 HG2 GLU 122 HG2 GLU 122 -20.674 7.237 2.049 951 HG3 GLU 122 HG1 GLU 122 -21.457 8.784 1.733 952 H VAL 123 HN VAL 123 -21.376 9.927 0.268 953 HA VAL 123 HA VAL 123 -22.696 11.411 -1.854 954 HB VAL 123 HB VAL 123 -24.385 12.335 -0.007 955 HG11 VAL 123 HG11 VAL 123 -24.567 10.642 -2.197 956 HG12 VAL 123 HG12 VAL 123 -25.928 11.351 -1.329 957 HG13 VAL 123 HG13 VAL 123 -25.365 9.733 -0.914 958 HG21 VAL 123 HG21 VAL 123 -23.383 10.831 1.756 959 HG22 VAL 123 HG22 VAL 123 -24.004 9.451 0.852 960 HG23 VAL 123 HG23 VAL 123 -25.122 10.626 1.544 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 12.871 19.138 3.204 2 H2 GLY 1 HT2 GLY 1 11.669 18.453 2.219 3 H3 GLY 1 HT3 GLY 1 13.107 17.601 2.524 4 HA2 GLY 1 HA2 GLY 1 12.173 16.628 4.259 5 HA3 GLY 1 HA1 GLY 1 11.994 18.219 4.999 6 H SER 2 HN SER 2 10.117 19.520 3.697 7 HA SER 2 HA SER 2 7.788 19.656 3.287 8 HB2 SER 2 HB2 SER 2 8.813 17.653 1.758 9 HB3 SER 2 HB1 SER 2 7.638 16.748 2.707 10 HG SER 2 HG SER 2 7.023 17.948 0.623 11 H HIS 3 HN HIS 3 7.381 19.934 5.620 12 HA HIS 3 HA HIS 3 6.898 17.585 7.297 13 HB2 HIS 3 HB2 HIS 3 7.525 20.240 7.687 14 HB3 HIS 3 HB1 HIS 3 5.816 20.200 8.129 15 HD1 HIS 3 HD1 HIS 3 8.208 17.317 8.638 16 HD2 HIS 3 HD2 HIS 3 6.177 20.149 10.926 17 HE1 HIS 3 HE1 HIS 3 8.503 16.631 11.059 18 H MET 4 HN MET 4 4.705 20.271 6.298 19 HA MET 4 HA MET 4 2.262 19.121 7.018 20 HB2 MET 4 HB2 MET 4 1.373 20.505 5.097 21 HB3 MET 4 HB1 MET 4 2.482 21.384 6.151 22 HG2 MET 4 HG2 MET 4 4.332 20.950 4.588 23 HG3 MET 4 HG1 MET 4 3.244 20.046 3.537 24 HE1 MET 4 HE1 MET 4 2.111 21.460 1.353 25 HE2 MET 4 HE2 MET 4 3.805 21.109 1.688 26 HE3 MET 4 HE3 MET 4 3.339 22.714 1.128 27 H THR 5 HN THR 5 0.654 17.931 5.635 28 HA THR 5 HA THR 5 1.987 16.249 3.549 29 HB THR 5 HB THR 5 0.381 14.451 4.521 30 HG1 THR 5 HG1 THR 5 -0.630 16.148 5.871 31 HG21 THR 5 HG21 THR 5 2.697 14.099 4.792 32 HG22 THR 5 HG22 THR 5 2.069 14.047 6.439 33 HG23 THR 5 HG23 THR 5 2.877 15.499 5.849 34 H GLU 6 HN GLU 6 0.626 15.564 1.882 35 HA GLU 6 HA GLU 6 -2.215 16.162 1.781 36 HB2 GLU 6 HB2 GLU 6 -2.043 17.998 0.147 37 HB3 GLU 6 HB1 GLU 6 -1.176 18.413 1.625 38 HG2 GLU 6 HG2 GLU 6 0.856 18.383 0.595 39 HG3 GLU 6 HG1 GLU 6 0.436 16.987 -0.399 40 H ARG 7 HN ARG 7 0.387 14.447 0.771 41 HA ARG 7 HA ARG 7 -0.718 12.651 -0.982 42 HB2 ARG 7 HB2 ARG 7 -0.467 15.300 -2.185 43 HB3 ARG 7 HB1 ARG 7 0.453 14.103 -3.093 44 HG2 ARG 7 HG2 ARG 7 -1.449 12.751 -3.481 45 HG3 ARG 7 HG1 ARG 7 -2.381 13.555 -2.218 46 HD2 ARG 7 HD2 ARG 7 -3.064 14.267 -4.530 47 HD3 ARG 7 HD1 ARG 7 -2.461 15.621 -3.555 48 HE ARG 7 HE ARG 7 -0.266 14.381 -4.922 49 HH11 ARG 7 HH21 ARG 7 -2.433 16.976 -4.896 50 HH12 ARG 7 HH22 ARG 7 -2.071 17.509 -6.504 51 HH21 ARG 7 HH11 ARG 7 -0.058 14.786 -7.243 52 HH22 ARG 7 HH12 ARG 7 -0.729 16.270 -7.831 53 H ARG 8 HN ARG 8 1.954 14.578 0.004 54 HA ARG 8 HA ARG 8 4.085 13.127 -1.335 55 HB2 ARG 8 HB2 ARG 8 3.685 15.330 0.608 56 HB3 ARG 8 HB1 ARG 8 5.221 14.473 0.749 57 HG2 ARG 8 HG2 ARG 8 5.985 15.658 -1.005 58 HG3 ARG 8 HG1 ARG 8 4.786 14.853 -2.018 59 HD2 ARG 8 HD2 ARG 8 3.521 16.946 -0.451 60 HD3 ARG 8 HD1 ARG 8 4.869 17.599 -1.402 61 HE ARG 8 HE ARG 8 2.403 16.600 -2.510 62 HH11 ARG 8 HH11 ARG 8 5.456 17.789 -3.217 63 HH12 ARG 8 HH12 ARG 8 5.553 17.101 -4.803 64 HH21 ARG 8 HH21 ARG 8 2.676 15.202 -4.447 65 HH22 ARG 8 HH22 ARG 8 3.978 15.641 -5.501 66 H LEU 9 HN LEU 9 2.008 11.949 0.857 67 HA LEU 9 HA LEU 9 3.459 10.992 3.070 68 HB2 LEU 9 HB2 LEU 9 1.269 9.621 1.485 69 HB3 LEU 9 HB1 LEU 9 1.670 9.337 3.178 70 HG LEU 9 HG LEU 9 1.174 12.166 2.490 71 HD11 LEU 9 HD11 LEU 9 -0.669 10.140 1.605 72 HD12 LEU 9 HD12 LEU 9 -0.819 11.894 1.482 73 HD13 LEU 9 HD13 LEU 9 -1.402 11.058 2.922 74 HD21 LEU 9 HD21 LEU 9 -0.361 10.776 4.593 75 HD22 LEU 9 HD22 LEU 9 0.606 12.248 4.690 76 HD23 LEU 9 HD23 LEU 9 1.391 10.671 4.770 77 H ARG 10 HN ARG 10 3.060 8.098 2.770 78 HA ARG 10 HA ARG 10 5.275 7.459 0.840 79 HB2 ARG 10 HB2 ARG 10 5.149 5.872 3.328 80 HB3 ARG 10 HB1 ARG 10 6.541 6.615 2.546 81 HG2 ARG 10 HG2 ARG 10 4.486 8.122 4.193 82 HG3 ARG 10 HG1 ARG 10 6.059 7.593 4.793 83 HD2 ARG 10 HD2 ARG 10 6.570 8.947 2.350 84 HD3 ARG 10 HD1 ARG 10 5.437 9.962 3.267 85 HE ARG 10 HE ARG 10 8.094 9.051 4.267 86 HH11 ARG 10 HH11 ARG 10 6.688 11.876 3.796 87 HH12 ARG 10 HH12 ARG 10 6.578 12.393 5.445 88 HH21 ARG 10 HH21 ARG 10 7.286 9.264 6.753 89 HH22 ARG 10 HH22 ARG 10 6.915 10.917 7.116 90 H VAL 11 HN VAL 11 5.182 5.333 -0.075 91 HA VAL 11 HA VAL 11 2.741 3.736 0.587 92 HB VAL 11 HB VAL 11 2.409 3.447 -1.873 93 HG11 VAL 11 HG11 VAL 11 2.129 5.959 -0.370 94 HG12 VAL 11 HG12 VAL 11 0.943 5.087 -1.340 95 HG13 VAL 11 HG13 VAL 11 2.095 6.169 -2.121 96 HG21 VAL 11 HG21 VAL 11 4.890 5.100 -1.884 97 HG22 VAL 11 HG22 VAL 11 3.685 5.465 -3.120 98 HG23 VAL 11 HG23 VAL 11 4.367 3.844 -3.006 99 H LEU 12 HN LEU 12 4.235 2.237 1.666 100 HA LEU 12 HA LEU 12 6.369 0.978 0.089 101 HB2 LEU 12 HB2 LEU 12 5.111 0.097 2.704 102 HB3 LEU 12 HB1 LEU 12 6.750 -0.229 2.141 103 HG LEU 12 HG LEU 12 5.589 2.436 2.990 104 HD11 LEU 12 HD11 LEU 12 8.180 1.531 4.037 105 HD12 LEU 12 HD12 LEU 12 6.841 0.462 4.450 106 HD13 LEU 12 HD13 LEU 12 6.776 2.164 4.896 107 HD21 LEU 12 HD21 LEU 12 7.850 3.349 2.404 108 HD22 LEU 12 HD22 LEU 12 6.931 2.818 0.995 109 HD23 LEU 12 HD23 LEU 12 8.230 1.809 1.632 110 H VAL 13 HN VAL 13 5.475 -0.189 -1.661 111 HA VAL 13 HA VAL 13 3.302 -2.151 -0.988 112 HB VAL 13 HB VAL 13 3.897 -1.200 -3.778 113 HG11 VAL 13 HG11 VAL 13 2.036 -2.892 -2.688 114 HG12 VAL 13 HG12 VAL 13 1.822 -2.039 -4.216 115 HG13 VAL 13 HG13 VAL 13 1.141 -1.374 -2.736 116 HG21 VAL 13 HG21 VAL 13 3.829 0.889 -2.500 117 HG22 VAL 13 HG22 VAL 13 2.352 0.369 -1.688 118 HG23 VAL 13 HG23 VAL 13 2.333 0.716 -3.417 119 H VAL 14 HN VAL 14 3.715 -4.311 -1.553 120 HA VAL 14 HA VAL 14 6.155 -4.834 -3.172 121 HB VAL 14 HB VAL 14 7.034 -6.246 -1.425 122 HG11 VAL 14 HG11 VAL 14 7.673 -4.605 0.097 123 HG12 VAL 14 HG12 VAL 14 6.074 -3.863 0.115 124 HG13 VAL 14 HG13 VAL 14 7.137 -3.636 -1.274 125 HG21 VAL 14 HG21 VAL 14 4.946 -7.203 -0.610 126 HG22 VAL 14 HG22 VAL 14 4.448 -5.631 0.017 127 HG23 VAL 14 HG23 VAL 14 5.816 -6.476 0.740 128 H GLU 15 HN GLU 15 6.019 -6.626 -4.411 129 HA GLU 15 HA GLU 15 4.024 -8.743 -3.916 130 HB2 GLU 15 HB2 GLU 15 2.811 -8.366 -5.911 131 HB3 GLU 15 HB1 GLU 15 3.039 -6.750 -5.245 132 HG2 GLU 15 HG2 GLU 15 4.075 -6.107 -7.099 133 HG3 GLU 15 HG1 GLU 15 5.297 -7.347 -6.891 134 H ASP 16 HN ASP 16 4.674 -10.694 -4.906 135 HA ASP 16 HA ASP 16 7.332 -11.297 -5.264 136 HB2 ASP 16 HB2 ASP 16 6.392 -13.156 -6.761 137 HB3 ASP 16 HB1 ASP 16 5.722 -13.005 -5.137 138 H GLU 17 HN GLU 17 5.175 -10.198 -7.932 139 HA GLU 17 HA GLU 17 7.394 -10.409 -9.848 140 HB2 GLU 17 HB2 GLU 17 4.692 -9.115 -10.246 141 HB3 GLU 17 HB1 GLU 17 5.723 -9.860 -11.464 142 HG2 GLU 17 HG2 GLU 17 4.771 -11.860 -11.098 143 HG3 GLU 17 HG1 GLU 17 5.182 -11.777 -9.385 144 H SER 18 HN SER 18 8.025 -8.573 -11.207 145 HA SER 18 HA SER 18 8.580 -6.152 -9.615 146 HB2 SER 18 HB2 SER 18 10.441 -6.682 -10.858 147 HB3 SER 18 HB1 SER 18 9.495 -7.502 -12.097 148 HG SER 18 HG SER 18 10.169 -5.665 -13.058 149 H MET 19 HN MET 19 5.975 -7.159 -11.385 150 HA MET 19 HA MET 19 5.377 -5.029 -13.162 151 HB2 MET 19 HB2 MET 19 4.202 -7.367 -12.188 152 HB3 MET 19 HB1 MET 19 3.093 -6.096 -11.670 153 HG2 MET 19 HG2 MET 19 2.763 -5.332 -13.901 154 HG3 MET 19 HG1 MET 19 4.152 -6.239 -14.497 155 HE1 MET 19 HE1 MET 19 0.290 -8.072 -12.837 156 HE2 MET 19 HE2 MET 19 0.277 -6.454 -13.536 157 HE3 MET 19 HE3 MET 19 1.289 -6.793 -12.135 158 H ILE 20 HN ILE 20 5.676 -5.038 -9.752 159 HA ILE 20 HA ILE 20 3.936 -2.652 -9.377 160 HB ILE 20 HB ILE 20 3.770 -4.449 -7.769 161 HG12 ILE 20 HG12 ILE 20 5.556 -2.438 -6.408 162 HG13 ILE 20 HG11 ILE 20 3.944 -1.988 -6.980 163 HG21 ILE 20 HG21 ILE 20 5.764 -5.688 -8.003 164 HG22 ILE 20 HG22 ILE 20 5.919 -4.966 -6.402 165 HG23 ILE 20 HG23 ILE 20 6.779 -4.263 -7.771 166 HD11 ILE 20 HD11 ILE 20 4.731 -3.772 -4.740 167 HD12 ILE 20 HD12 ILE 20 3.343 -4.290 -5.697 168 HD13 ILE 20 HD13 ILE 20 3.330 -2.719 -4.902 169 H ALA 21 HN ALA 21 7.279 -3.673 -9.465 170 HA ALA 21 HA ALA 21 8.662 -1.592 -8.223 171 HB1 ALA 21 HB1 ALA 21 9.040 -3.554 -10.388 172 HB2 ALA 21 HB2 ALA 21 10.087 -3.178 -9.020 173 HB3 ALA 21 HB3 ALA 21 10.136 -2.175 -10.470 174 H MET 22 HN MET 22 8.847 -1.549 -11.738 175 HA MET 22 HA MET 22 9.039 1.261 -11.959 176 HB2 MET 22 HB2 MET 22 9.688 0.082 -13.867 177 HB3 MET 22 HB1 MET 22 8.335 -1.042 -13.747 178 HG2 MET 22 HG2 MET 22 6.800 0.817 -14.432 179 HG3 MET 22 HG1 MET 22 8.214 1.841 -14.683 180 HE1 MET 22 HE1 MET 22 5.708 0.276 -15.953 181 HE2 MET 22 HE2 MET 22 6.073 -0.795 -17.304 182 HE3 MET 22 HE3 MET 22 6.163 0.951 -17.523 183 H LEU 23 HN LEU 23 6.296 -0.788 -11.556 184 HA LEU 23 HA LEU 23 4.205 0.968 -12.447 185 HB2 LEU 23 HB2 LEU 23 3.688 -1.297 -12.167 186 HB3 LEU 23 HB1 LEU 23 4.585 -1.419 -10.664 187 HG LEU 23 HG LEU 23 2.008 0.151 -10.920 188 HD11 LEU 23 HD11 LEU 23 0.797 -1.753 -10.504 189 HD12 LEU 23 HD12 LEU 23 2.078 -2.472 -9.528 190 HD13 LEU 23 HD13 LEU 23 2.170 -2.532 -11.287 191 HD21 LEU 23 HD21 LEU 23 2.516 -0.975 -8.334 192 HD22 LEU 23 HD22 LEU 23 2.443 0.730 -8.777 193 HD23 LEU 23 HD23 LEU 23 3.977 -0.138 -8.854 194 H ILE 24 HN ILE 24 6.419 1.205 -9.882 195 HA ILE 24 HA ILE 24 4.573 2.831 -8.206 196 HB ILE 24 HB ILE 24 6.232 0.742 -7.640 197 HG12 ILE 24 HG12 ILE 24 6.012 2.750 -5.469 198 HG13 ILE 24 HG11 ILE 24 4.500 2.342 -6.282 199 HG21 ILE 24 HG21 ILE 24 8.097 1.783 -6.248 200 HG22 ILE 24 HG22 ILE 24 7.809 3.271 -7.146 201 HG23 ILE 24 HG23 ILE 24 8.323 1.813 -7.995 202 HD11 ILE 24 HD11 ILE 24 5.044 0.876 -4.296 203 HD12 ILE 24 HD12 ILE 24 6.426 0.268 -5.208 204 HD13 ILE 24 HD13 ILE 24 4.789 -0.003 -5.803 205 H GLU 25 HN GLU 25 7.957 2.906 -9.417 206 HA GLU 25 HA GLU 25 8.660 5.504 -8.682 207 HB2 GLU 25 HB2 GLU 25 9.324 3.598 -10.871 208 HB3 GLU 25 HB1 GLU 25 9.849 5.268 -11.101 209 HG2 GLU 25 HG2 GLU 25 10.356 4.364 -8.377 210 HG3 GLU 25 HG1 GLU 25 11.150 3.324 -9.565 211 H ASP 26 HN ASP 26 6.452 4.465 -11.215 212 HA ASP 26 HA ASP 26 6.264 7.086 -12.494 213 HB2 ASP 26 HB2 ASP 26 4.632 5.988 -13.842 214 HB3 ASP 26 HB1 ASP 26 5.768 4.707 -13.419 215 H THR 27 HN THR 27 4.308 5.212 -10.153 216 HA THR 27 HA THR 27 2.304 7.245 -9.765 217 HB THR 27 HB THR 27 2.761 5.596 -7.448 218 HG1 THR 27 HG1 THR 27 2.474 3.594 -8.701 219 HG21 THR 27 HG21 THR 27 0.538 5.947 -7.715 220 HG22 THR 27 HG22 THR 27 0.616 4.527 -8.758 221 HG23 THR 27 HG23 THR 27 0.685 6.142 -9.462 222 H LEU 28 HN LEU 28 5.226 6.295 -7.959 223 HA LEU 28 HA LEU 28 5.125 8.301 -5.939 224 HB2 LEU 28 HB2 LEU 28 6.634 6.490 -5.693 225 HB3 LEU 28 HB1 LEU 28 7.264 6.687 -7.323 226 HG LEU 28 HG LEU 28 8.772 7.451 -5.391 227 HD11 LEU 28 HD11 LEU 28 8.640 9.865 -6.957 228 HD12 LEU 28 HD12 LEU 28 8.350 8.469 -7.994 229 HD13 LEU 28 HD13 LEU 28 9.824 8.560 -7.030 230 HD21 LEU 28 HD21 LEU 28 7.542 8.715 -3.910 231 HD22 LEU 28 HD22 LEU 28 6.501 9.383 -5.163 232 HD23 LEU 28 HD23 LEU 28 8.130 10.012 -4.948 233 H CYS 29 HN CYS 29 6.181 8.353 -9.302 234 HA CYS 29 HA CYS 29 7.661 10.777 -9.322 235 HB2 CYS 29 HB2 CYS 29 6.480 8.896 -11.141 236 HB3 CYS 29 HB1 CYS 29 6.112 10.526 -11.706 237 HG CYS 29 HG CYS 29 9.051 9.644 -11.081 238 H GLU 30 HN GLU 30 4.221 10.139 -9.174 239 HA GLU 30 HA GLU 30 3.458 12.913 -9.711 240 HB2 GLU 30 HB2 GLU 30 1.970 11.252 -10.506 241 HB3 GLU 30 HB1 GLU 30 2.077 10.324 -9.011 242 HG2 GLU 30 HG2 GLU 30 0.649 11.754 -7.859 243 HG3 GLU 30 HG1 GLU 30 1.003 13.122 -8.916 244 H LEU 31 HN LEU 31 3.324 10.663 -6.929 245 HA LEU 31 HA LEU 31 2.467 12.727 -5.059 246 HB2 LEU 31 HB2 LEU 31 3.656 9.954 -4.713 247 HB3 LEU 31 HB1 LEU 31 2.937 10.906 -3.415 248 HG LEU 31 HG LEU 31 1.199 10.656 -5.766 249 HD11 LEU 31 HD11 LEU 31 0.837 8.350 -5.734 250 HD12 LEU 31 HD12 LEU 31 1.496 8.170 -4.108 251 HD13 LEU 31 HD13 LEU 31 2.581 8.414 -5.477 252 HD21 LEU 31 HD21 LEU 31 0.540 11.551 -3.532 253 HD22 LEU 31 HD22 LEU 31 0.873 9.972 -2.824 254 HD23 LEU 31 HD23 LEU 31 -0.433 10.154 -3.992 255 H GLY 32 HN GLY 32 5.576 11.274 -5.991 256 HA2 GLY 32 HA2 GLY 32 7.771 11.967 -5.465 257 HA3 GLY 32 HA1 GLY 32 7.075 13.477 -4.842 258 H HIS 33 HN HIS 33 5.818 10.452 -3.754 259 HA HIS 33 HA HIS 33 5.842 10.883 -1.049 260 HB2 HIS 33 HB2 HIS 33 6.000 8.504 -2.831 261 HB3 HIS 33 HB1 HIS 33 6.276 8.227 -1.102 262 HD1 HIS 33 HD1 HIS 33 3.778 6.957 -1.659 263 HD2 HIS 33 HD2 HIS 33 3.912 11.100 -1.306 264 HE1 HIS 33 HE1 HIS 33 1.400 7.716 -1.197 265 H GLU 34 HN GLU 34 7.193 9.849 0.647 266 HA GLU 34 HA GLU 34 9.912 10.771 0.521 267 HB2 GLU 34 HB2 GLU 34 8.122 10.411 2.422 268 HB3 GLU 34 HB1 GLU 34 8.849 8.808 2.526 269 HG2 GLU 34 HG2 GLU 34 10.310 9.838 3.946 270 HG3 GLU 34 HG1 GLU 34 11.087 10.365 2.451 271 H VAL 35 HN VAL 35 8.481 7.478 0.482 272 HA VAL 35 HA VAL 35 10.767 6.430 -1.021 273 HB VAL 35 HB VAL 35 10.478 6.189 1.950 274 HG11 VAL 35 HG11 VAL 35 11.818 4.101 1.954 275 HG12 VAL 35 HG12 VAL 35 11.653 4.006 0.201 276 HG13 VAL 35 HG13 VAL 35 10.228 3.859 1.229 277 HG21 VAL 35 HG21 VAL 35 12.392 7.354 1.675 278 HG22 VAL 35 HG22 VAL 35 12.491 6.939 -0.036 279 HG23 VAL 35 HG23 VAL 35 13.124 5.828 1.179 280 H ALA 36 HN ALA 36 9.716 4.980 -2.378 281 HA ALA 36 HA ALA 36 7.306 3.577 -1.373 282 HB1 ALA 36 HB1 ALA 36 7.631 4.987 -3.589 283 HB2 ALA 36 HB2 ALA 36 6.651 3.522 -3.609 284 HB3 ALA 36 HB3 ALA 36 8.314 3.477 -4.194 285 H ALA 37 HN ALA 37 7.117 1.218 -1.931 286 HA ALA 37 HA ALA 37 9.811 -0.122 -1.995 287 HB1 ALA 37 HB1 ALA 37 8.335 -1.942 -0.746 288 HB2 ALA 37 HB2 ALA 37 7.311 -0.554 -0.386 289 HB3 ALA 37 HB3 ALA 37 8.992 -0.571 0.147 290 H THR 38 HN THR 38 9.926 -2.058 -3.261 291 HA THR 38 HA THR 38 7.573 -2.605 -5.016 292 HB THR 38 HB THR 38 9.134 -2.672 -6.886 293 HG1 THR 38 HG1 THR 38 10.945 -2.729 -4.809 294 HG21 THR 38 HG21 THR 38 9.434 -0.378 -7.071 295 HG22 THR 38 HG22 THR 38 10.022 -0.223 -5.417 296 HG23 THR 38 HG23 THR 38 8.298 -0.431 -5.723 297 H ALA 39 HN ALA 39 7.741 -4.688 -6.143 298 HA ALA 39 HA ALA 39 7.834 -7.028 -6.076 299 HB1 ALA 39 HB1 ALA 39 10.091 -7.913 -5.631 300 HB2 ALA 39 HB2 ALA 39 10.569 -6.342 -4.988 301 HB3 ALA 39 HB3 ALA 39 10.143 -6.506 -6.692 302 H SER 40 HN SER 40 7.779 -8.872 -4.537 303 HA SER 40 HA SER 40 6.925 -8.006 -1.868 304 HB2 SER 40 HB2 SER 40 6.359 -10.353 -1.612 305 HB3 SER 40 HB1 SER 40 5.823 -9.803 -3.188 306 HG SER 40 HG SER 40 8.224 -11.207 -2.594 307 H ARG 41 HN ARG 41 8.472 -7.591 -0.335 308 HA ARG 41 HA ARG 41 10.802 -9.435 -0.190 309 HB2 ARG 41 HB2 ARG 41 10.960 -6.930 -1.119 310 HB3 ARG 41 HB1 ARG 41 11.036 -6.570 0.608 311 HG2 ARG 41 HG2 ARG 41 13.273 -6.949 0.306 312 HG3 ARG 41 HG1 ARG 41 12.784 -8.632 0.502 313 HD2 ARG 41 HD2 ARG 41 12.448 -8.706 -2.030 314 HD3 ARG 41 HD1 ARG 41 13.290 -7.144 -2.089 315 HE ARG 41 HE ARG 41 15.162 -8.328 -0.805 316 HH11 ARG 41 HH21 ARG 41 14.251 -9.246 -3.756 317 HH12 ARG 41 HH22 ARG 41 14.693 -10.916 -3.636 318 HH21 ARG 41 HH11 ARG 41 15.131 -10.824 -0.197 319 HH22 ARG 41 HH12 ARG 41 15.189 -11.812 -1.619 320 H MET 42 HN MET 42 10.902 -10.404 1.794 321 HA MET 42 HA MET 42 9.111 -9.811 3.936 322 HB2 MET 42 HB2 MET 42 11.655 -11.386 3.580 323 HB3 MET 42 HB1 MET 42 10.876 -11.289 5.160 324 HG2 MET 42 HG2 MET 42 8.785 -12.162 4.199 325 HG3 MET 42 HG1 MET 42 9.538 -12.234 2.604 326 HE1 MET 42 HE1 MET 42 10.561 -14.477 6.390 327 HE2 MET 42 HE2 MET 42 10.235 -12.763 6.142 328 HE3 MET 42 HE3 MET 42 11.858 -13.391 5.873 329 H GLN 43 HN GLN 43 12.351 -8.662 3.161 330 HA GLN 43 HA GLN 43 12.952 -7.526 5.749 331 HB2 GLN 43 HB2 GLN 43 14.174 -7.922 3.235 332 HB3 GLN 43 HB1 GLN 43 14.189 -6.178 3.501 333 HG2 GLN 43 HG2 GLN 43 16.142 -6.793 4.604 334 HG3 GLN 43 HG1 GLN 43 14.979 -6.874 5.928 335 HE21 GLN 43 HE21 GLN 43 17.457 -8.624 4.559 336 HE22 GLN 43 HE22 GLN 43 16.971 -10.189 5.003 337 H GLU 44 HN GLU 44 11.801 -6.052 2.683 338 HA GLU 44 HA GLU 44 11.383 -3.452 3.868 339 HB2 GLU 44 HB2 GLU 44 10.822 -4.869 1.302 340 HB3 GLU 44 HB1 GLU 44 9.895 -3.406 1.630 341 HG2 GLU 44 HG2 GLU 44 12.693 -3.014 2.289 342 HG3 GLU 44 HG1 GLU 44 12.511 -3.536 0.613 343 H ALA 45 HN ALA 45 9.199 -6.151 2.989 344 HA ALA 45 HA ALA 45 6.700 -5.112 3.602 345 HB1 ALA 45 HB1 ALA 45 8.059 -7.760 3.984 346 HB2 ALA 45 HB2 ALA 45 6.720 -7.342 2.915 347 HB3 ALA 45 HB3 ALA 45 6.437 -7.553 4.643 348 H LEU 46 HN LEU 46 9.119 -6.350 5.900 349 HA LEU 46 HA LEU 46 7.673 -6.003 8.317 350 HB2 LEU 46 HB2 LEU 46 9.700 -7.210 8.357 351 HB3 LEU 46 HB1 LEU 46 10.565 -5.971 7.461 352 HG LEU 46 HG LEU 46 9.481 -4.947 9.969 353 HD11 LEU 46 HD11 LEU 46 10.257 -6.443 11.477 354 HD12 LEU 46 HD12 LEU 46 11.783 -6.626 10.610 355 HD13 LEU 46 HD13 LEU 46 10.380 -7.581 10.133 356 HD21 LEU 46 HD21 LEU 46 11.487 -4.321 8.221 357 HD22 LEU 46 HD22 LEU 46 12.398 -5.125 9.500 358 HD23 LEU 46 HD23 LEU 46 11.404 -3.718 9.876 359 H ASP 47 HN ASP 47 9.697 -3.775 6.454 360 HA ASP 47 HA ASP 47 9.724 -1.572 8.243 361 HB2 ASP 47 HB2 ASP 47 11.178 -1.806 6.297 362 HB3 ASP 47 HB1 ASP 47 9.787 -1.729 5.216 363 H ILE 48 HN ILE 48 7.396 -2.366 5.628 364 HA ILE 48 HA ILE 48 5.836 0.029 5.946 365 HB ILE 48 HB ILE 48 4.437 -0.920 4.360 366 HG12 ILE 48 HG12 ILE 48 4.887 -3.490 5.858 367 HG13 ILE 48 HG11 ILE 48 3.372 -2.672 5.498 368 HG21 ILE 48 HG21 ILE 48 7.048 -1.278 3.924 369 HG22 ILE 48 HG22 ILE 48 5.817 -1.757 2.758 370 HG23 ILE 48 HG23 ILE 48 6.523 -2.958 3.840 371 HD11 ILE 48 HD11 ILE 48 3.165 -4.160 3.796 372 HD12 ILE 48 HD12 ILE 48 4.865 -4.623 3.881 373 HD13 ILE 48 HD13 ILE 48 4.386 -3.189 2.974 374 H ALA 49 HN ALA 49 6.060 -2.893 7.783 375 HA ALA 49 HA ALA 49 3.453 -2.474 9.089 376 HB1 ALA 49 HB1 ALA 49 3.795 -4.656 9.924 377 HB2 ALA 49 HB2 ALA 49 5.548 -4.521 9.791 378 HB3 ALA 49 HB3 ALA 49 4.565 -4.697 8.338 379 H ARG 50 HN ARG 50 6.793 -3.012 10.284 380 HA ARG 50 HA ARG 50 6.346 -2.101 12.930 381 HB2 ARG 50 HB2 ARG 50 8.591 -2.699 11.111 382 HB3 ARG 50 HB1 ARG 50 8.995 -1.604 12.438 383 HG2 ARG 50 HG2 ARG 50 9.374 -3.847 13.230 384 HG3 ARG 50 HG1 ARG 50 7.903 -3.263 14.008 385 HD2 ARG 50 HD2 ARG 50 7.398 -4.572 11.417 386 HD3 ARG 50 HD1 ARG 50 8.092 -5.654 12.643 387 HE ARG 50 HE ARG 50 5.796 -3.893 13.376 388 HH11 ARG 50 HH11 ARG 50 7.046 -6.026 15.173 389 HH12 ARG 50 HH12 ARG 50 5.888 -7.305 15.021 390 HH21 ARG 50 HH21 ARG 50 4.380 -5.960 12.206 391 HH22 ARG 50 HH22 ARG 50 4.379 -7.267 13.342 392 H LYS 51 HN LYS 51 7.163 -0.285 9.994 393 HA LYS 51 HA LYS 51 8.052 2.145 11.113 394 HB2 LYS 51 HB2 LYS 51 8.132 1.773 8.752 395 HB3 LYS 51 HB1 LYS 51 6.395 1.464 8.675 396 HG2 LYS 51 HG2 LYS 51 7.009 3.749 7.864 397 HG3 LYS 51 HG1 LYS 51 5.907 3.779 9.243 398 HD2 LYS 51 HD2 LYS 51 7.601 5.395 9.734 399 HD3 LYS 51 HD1 LYS 51 7.981 3.986 10.723 400 HE2 LYS 51 HE2 LYS 51 10.074 4.443 9.785 401 HE3 LYS 51 HE1 LYS 51 9.425 3.306 8.587 402 HZ1 LYS 51 HZ1 LYS 51 9.098 4.929 7.088 403 HZ2 LYS 51 HZ2 LYS 51 10.237 5.800 7.999 404 HZ3 LYS 51 HZ3 LYS 51 8.575 6.051 8.246 405 H GLY 52 HN GLY 52 4.696 1.088 10.468 406 HA2 GLY 52 HA2 GLY 52 2.726 1.735 11.611 407 HA3 GLY 52 HA1 GLY 52 3.714 2.757 12.657 408 H GLN 53 HN GLN 53 4.764 4.682 11.331 409 HA GLN 53 HA GLN 53 2.505 6.115 10.091 410 HB2 GLN 53 HB2 GLN 53 3.855 8.037 10.501 411 HB3 GLN 53 HB1 GLN 53 4.161 6.960 11.862 412 HG2 GLN 53 HG2 GLN 53 6.349 6.957 11.366 413 HG3 GLN 53 HG1 GLN 53 5.989 6.270 9.784 414 HE21 GLN 53 HE21 GLN 53 4.480 8.496 8.722 415 HE22 GLN 53 HE22 GLN 53 5.551 9.795 8.507 416 H PHE 54 HN PHE 54 3.467 3.948 8.511 417 HA PHE 54 HA PHE 54 5.141 5.140 6.371 418 HB2 PHE 54 HB2 PHE 54 5.117 2.829 5.515 419 HB3 PHE 54 HB1 PHE 54 5.514 2.827 7.228 420 HD1 PHE 54 HD1 PHE 54 3.885 2.041 8.909 421 HD2 PHE 54 HD2 PHE 54 2.996 2.009 4.717 422 HE1 PHE 54 HE1 PHE 54 1.962 0.542 9.327 423 HE2 PHE 54 HE2 PHE 54 1.070 0.521 5.133 424 HZ PHE 54 HZ PHE 54 0.552 -0.225 7.437 425 H ASP 55 HN ASP 55 2.207 5.754 7.123 426 HA ASP 55 HA ASP 55 0.256 6.392 6.030 427 HB2 ASP 55 HB2 ASP 55 2.271 7.275 4.577 428 HB3 ASP 55 HB1 ASP 55 1.677 6.077 3.427 429 H ILE 56 HN ILE 56 1.649 4.191 3.547 430 HA ILE 56 HA ILE 56 -0.699 2.375 4.018 431 HB ILE 56 HB ILE 56 0.196 3.724 1.463 432 HG12 ILE 56 HG12 ILE 56 -2.332 3.771 3.135 433 HG13 ILE 56 HG11 ILE 56 -1.229 5.111 2.830 434 HG21 ILE 56 HG21 ILE 56 -1.539 1.319 1.933 435 HG22 ILE 56 HG22 ILE 56 -0.355 1.612 0.660 436 HG23 ILE 56 HG23 ILE 56 -1.920 2.414 0.605 437 HD11 ILE 56 HD11 ILE 56 -1.776 4.789 0.343 438 HD12 ILE 56 HD12 ILE 56 -3.056 5.467 1.348 439 HD13 ILE 56 HD13 ILE 56 -3.109 3.768 0.881 440 H ALA 57 HN ALA 57 -0.432 0.176 3.172 441 HA ALA 57 HA ALA 57 2.261 -0.565 2.118 442 HB1 ALA 57 HB1 ALA 57 1.074 -1.375 4.778 443 HB2 ALA 57 HB2 ALA 57 2.651 -0.653 4.471 444 HB3 ALA 57 HB3 ALA 57 2.339 -2.323 3.998 445 H ILE 58 HN ILE 58 2.065 -2.397 0.734 446 HA ILE 58 HA ILE 58 -0.442 -3.981 1.040 447 HB ILE 58 HB ILE 58 0.497 -2.721 -1.543 448 HG12 ILE 58 HG12 ILE 58 -1.725 -1.396 -1.101 449 HG13 ILE 58 HG11 ILE 58 -1.422 -1.812 0.586 450 HG21 ILE 58 HG21 ILE 58 -2.281 -3.648 -1.065 451 HG22 ILE 58 HG22 ILE 58 -1.058 -4.900 -1.269 452 HG23 ILE 58 HG23 ILE 58 -1.320 -3.703 -2.539 453 HD11 ILE 58 HD11 ILE 58 1.047 -0.943 -0.520 454 HD12 ILE 58 HD12 ILE 58 0.072 -0.143 0.710 455 HD13 ILE 58 HD13 ILE 58 -0.180 0.232 -0.994 456 H ILE 59 HN ILE 59 0.613 -5.944 1.486 457 HA ILE 59 HA ILE 59 2.693 -7.030 -0.361 458 HB ILE 59 HB ILE 59 1.198 -7.840 2.145 459 HG12 ILE 59 HG12 ILE 59 3.645 -8.537 2.711 460 HG13 ILE 59 HG11 ILE 59 4.079 -7.607 1.278 461 HG21 ILE 59 HG21 ILE 59 0.982 -9.947 1.331 462 HG22 ILE 59 HG22 ILE 59 2.722 -10.060 1.594 463 HG23 ILE 59 HG23 ILE 59 2.097 -9.643 -0.001 464 HD11 ILE 59 HD11 ILE 59 3.791 -6.553 3.801 465 HD12 ILE 59 HD12 ILE 59 2.217 -6.212 3.083 466 HD13 ILE 59 HD13 ILE 59 3.687 -5.621 2.309 467 H ASP 60 HN ASP 60 1.057 -6.346 -1.989 468 HA ASP 60 HA ASP 60 -1.543 -7.419 -2.215 469 HB2 ASP 60 HB2 ASP 60 -1.422 -6.353 -4.391 470 HB3 ASP 60 HB1 ASP 60 -0.608 -5.356 -3.178 471 H VAL 61 HN VAL 61 -2.053 -8.098 -4.581 472 HA VAL 61 HA VAL 61 -2.607 -10.180 -5.570 473 HB VAL 61 HB VAL 61 -0.146 -8.857 -6.455 474 HG11 VAL 61 HG11 VAL 61 -0.943 -11.617 -7.345 475 HG12 VAL 61 HG12 VAL 61 0.673 -11.015 -6.970 476 HG13 VAL 61 HG13 VAL 61 -0.133 -10.512 -8.454 477 HG21 VAL 61 HG21 VAL 61 -1.681 -7.898 -7.763 478 HG22 VAL 61 HG22 VAL 61 -2.914 -8.974 -7.104 479 HG23 VAL 61 HG23 VAL 61 -1.988 -9.459 -8.525 480 H ASN 62 HN ASN 62 -2.534 -11.422 -3.564 481 HA ASN 62 HA ASN 62 -0.227 -12.915 -2.742 482 HB2 ASN 62 HB2 ASN 62 -1.972 -14.215 -1.538 483 HB3 ASN 62 HB1 ASN 62 -2.235 -12.482 -1.383 484 HD21 ASN 62 HD21 ASN 62 -3.146 -13.013 -4.540 485 HD22 ASN 62 HD22 ASN 62 -4.780 -13.355 -4.294 486 H LEU 63 HN LEU 63 0.522 -13.520 -4.966 487 HA LEU 63 HA LEU 63 -0.792 -16.030 -5.908 488 HB2 LEU 63 HB2 LEU 63 -0.902 -13.452 -7.072 489 HB3 LEU 63 HB1 LEU 63 0.192 -14.395 -8.081 490 HG LEU 63 HG LEU 63 -1.732 -16.229 -7.783 491 HD11 LEU 63 HD11 LEU 63 -3.108 -14.802 -6.315 492 HD12 LEU 63 HD12 LEU 63 -3.947 -15.113 -7.835 493 HD13 LEU 63 HD13 LEU 63 -3.162 -13.558 -7.564 494 HD21 LEU 63 HD21 LEU 63 -1.530 -15.839 -10.005 495 HD22 LEU 63 HD22 LEU 63 -1.098 -14.151 -9.734 496 HD23 LEU 63 HD23 LEU 63 -2.794 -14.626 -9.808 497 H ASP 64 HN ASP 64 0.792 -16.936 -7.768 498 HA ASP 64 HA ASP 64 2.896 -17.978 -8.088 499 HB2 ASP 64 HB2 ASP 64 3.096 -15.502 -8.810 500 HB3 ASP 64 HB1 ASP 64 3.965 -15.263 -7.289 501 H GLY 65 HN GLY 65 1.707 -17.808 -5.285 502 HA2 GLY 65 HA2 GLY 65 3.078 -19.284 -3.650 503 HA3 GLY 65 HA1 GLY 65 4.223 -17.945 -3.700 504 H GLU 66 HN GLU 66 1.481 -16.331 -3.997 505 HA GLU 66 HA GLU 66 0.300 -14.981 -2.459 506 HB2 GLU 66 HB2 GLU 66 0.266 -17.752 -1.226 507 HB3 GLU 66 HB1 GLU 66 -0.748 -16.427 -0.653 508 HG2 GLU 66 HG2 GLU 66 -2.114 -16.498 -2.488 509 HG3 GLU 66 HG1 GLU 66 -0.800 -16.935 -3.578 510 HA PRO 67 HA PRO 67 4.061 -14.815 0.302 511 HB2 PRO 67 HB2 PRO 67 5.092 -12.476 -0.661 512 HB3 PRO 67 HB1 PRO 67 5.488 -14.060 -1.355 513 HG2 PRO 67 HG2 PRO 67 3.622 -11.974 -2.338 514 HG3 PRO 67 HG1 PRO 67 4.660 -13.082 -3.246 515 HD2 PRO 67 HD2 PRO 67 1.945 -13.413 -2.885 516 HD3 PRO 67 HD1 PRO 67 3.082 -14.721 -3.278 517 H SER 68 HN SER 68 2.204 -14.390 1.790 518 HA SER 68 HA SER 68 1.715 -11.472 2.242 519 HB2 SER 68 HB2 SER 68 -0.435 -12.081 2.972 520 HB3 SER 68 HB1 SER 68 -0.137 -13.227 1.667 521 HG SER 68 HG SER 68 -0.403 -14.703 3.125 522 H TYR 69 HN TYR 69 2.802 -14.475 3.632 523 HA TYR 69 HA TYR 69 3.652 -15.053 5.730 524 HB2 TYR 69 HB2 TYR 69 4.950 -12.749 6.571 525 HB3 TYR 69 HB1 TYR 69 5.635 -13.982 5.523 526 HD1 TYR 69 HD2 TYR 69 4.879 -13.682 2.919 527 HD2 TYR 69 HD1 TYR 69 5.065 -10.576 5.865 528 HE1 TYR 69 HE2 TYR 69 5.077 -11.980 1.123 529 HE2 TYR 69 HE1 TYR 69 5.256 -8.872 4.078 530 HH TYR 69 HH TYR 69 5.279 -9.831 0.640 531 HA PRO 70 HA PRO 70 1.171 -13.721 9.031 532 HB2 PRO 70 HB2 PRO 70 2.874 -13.511 11.162 533 HB3 PRO 70 HB1 PRO 70 2.374 -15.065 10.465 534 HG2 PRO 70 HG2 PRO 70 4.898 -13.535 10.057 535 HG3 PRO 70 HG1 PRO 70 4.653 -15.280 10.246 536 HD2 PRO 70 HD2 PRO 70 5.064 -14.102 7.836 537 HD3 PRO 70 HD1 PRO 70 4.091 -15.575 8.041 538 H VAL 71 HN VAL 71 3.520 -11.607 7.820 539 HA VAL 71 HA VAL 71 3.023 -9.448 9.751 540 HB VAL 71 HB VAL 71 4.428 -9.524 7.073 541 HG11 VAL 71 HG11 VAL 71 4.448 -7.434 9.261 542 HG12 VAL 71 HG12 VAL 71 3.716 -7.257 7.666 543 HG13 VAL 71 HG13 VAL 71 5.466 -7.408 7.822 544 HG21 VAL 71 HG21 VAL 71 5.226 -10.865 9.240 545 HG22 VAL 71 HG22 VAL 71 5.840 -9.275 9.692 546 HG23 VAL 71 HG23 VAL 71 6.383 -10.038 8.198 547 H ALA 72 HN ALA 72 2.616 -9.634 6.209 548 HA ALA 72 HA ALA 72 0.863 -7.515 5.808 549 HB1 ALA 72 HB1 ALA 72 1.946 -9.492 4.332 550 HB2 ALA 72 HB2 ALA 72 0.612 -8.499 3.748 551 HB3 ALA 72 HB3 ALA 72 0.291 -10.091 4.433 552 H ASP 73 HN ASP 73 -0.053 -10.921 6.524 553 HA ASP 73 HA ASP 73 -2.846 -10.494 6.676 554 HB2 ASP 73 HB2 ASP 73 -0.844 -12.403 7.750 555 HB3 ASP 73 HB1 ASP 73 -2.445 -12.454 8.473 556 H ILE 74 HN ILE 74 -0.432 -10.530 9.300 557 HA ILE 74 HA ILE 74 -2.082 -9.674 11.440 558 HB ILE 74 HB ILE 74 0.824 -9.367 10.689 559 HG12 ILE 74 HG12 ILE 74 -0.574 -10.756 12.999 560 HG13 ILE 74 HG11 ILE 74 -0.059 -11.550 11.509 561 HG21 ILE 74 HG21 ILE 74 1.269 -8.382 12.907 562 HG22 ILE 74 HG22 ILE 74 -0.464 -8.307 13.224 563 HG23 ILE 74 HG23 ILE 74 0.242 -7.321 11.943 564 HD11 ILE 74 HD11 ILE 74 1.720 -11.949 13.021 565 HD12 ILE 74 HD12 ILE 74 1.659 -10.305 13.656 566 HD13 ILE 74 HD13 ILE 74 2.284 -10.600 12.034 567 H LEU 75 HN LEU 75 -0.117 -7.765 9.163 568 HA LEU 75 HA LEU 75 -0.705 -5.162 9.971 569 HB2 LEU 75 HB2 LEU 75 0.669 -6.282 7.990 570 HB3 LEU 75 HB1 LEU 75 -0.789 -5.936 7.063 571 HG LEU 75 HG LEU 75 -0.611 -3.545 8.044 572 HD11 LEU 75 HD11 LEU 75 2.269 -3.681 8.204 573 HD12 LEU 75 HD12 LEU 75 1.566 -4.811 9.361 574 HD13 LEU 75 HD13 LEU 75 1.127 -3.103 9.417 575 HD21 LEU 75 HD21 LEU 75 1.491 -3.207 6.377 576 HD22 LEU 75 HD22 LEU 75 -0.135 -3.551 5.784 577 HD23 LEU 75 HD23 LEU 75 1.045 -4.854 5.931 578 H ALA 76 HN ALA 76 -2.672 -7.417 8.069 579 HA ALA 76 HA ALA 76 -4.860 -5.534 7.689 580 HB1 ALA 76 HB1 ALA 76 -4.001 -7.707 6.380 581 HB2 ALA 76 HB2 ALA 76 -5.702 -7.241 6.355 582 HB3 ALA 76 HB3 ALA 76 -5.148 -8.502 7.457 583 H GLU 77 HN GLU 77 -4.167 -8.355 9.750 584 HA GLU 77 HA GLU 77 -6.637 -8.518 11.129 585 HB2 GLU 77 HB2 GLU 77 -5.431 -10.289 11.860 586 HB3 GLU 77 HB1 GLU 77 -3.957 -9.574 11.220 587 HG2 GLU 77 HG2 GLU 77 -3.558 -8.376 13.279 588 HG3 GLU 77 HG1 GLU 77 -5.142 -8.830 13.910 589 H ARG 78 HN ARG 78 -3.625 -6.871 12.186 590 HA ARG 78 HA ARG 78 -5.016 -5.441 14.308 591 HB2 ARG 78 HB2 ARG 78 -2.858 -4.713 14.875 592 HB3 ARG 78 HB1 ARG 78 -2.508 -6.223 14.042 593 HG2 ARG 78 HG2 ARG 78 -1.998 -5.031 11.983 594 HG3 ARG 78 HG1 ARG 78 -2.501 -3.502 12.704 595 HD2 ARG 78 HD2 ARG 78 -0.203 -5.204 13.732 596 HD3 ARG 78 HD1 ARG 78 -0.022 -3.752 12.728 597 HE ARG 78 HE ARG 78 -1.713 -3.252 15.030 598 HH11 ARG 78 HH11 ARG 78 0.144 -1.208 14.023 599 HH12 ARG 78 HH12 ARG 78 1.421 -1.220 15.193 600 HH21 ARG 78 HH21 ARG 78 0.530 -4.310 16.509 601 HH22 ARG 78 HH22 ARG 78 1.634 -2.979 16.611 602 H ASN 79 HN ASN 79 -3.607 -4.621 11.156 603 HA ASN 79 HA ASN 79 -4.156 -2.929 9.622 604 HB2 ASN 79 HB2 ASN 79 -6.401 -3.980 10.373 605 HB3 ASN 79 HB1 ASN 79 -6.613 -2.492 11.301 606 HD21 ASN 79 HD21 ASN 79 -6.744 -3.886 8.138 607 HD22 ASN 79 HD22 ASN 79 -7.153 -2.464 7.313 608 H VAL 80 HN VAL 80 -2.795 -1.261 9.861 609 HA VAL 80 HA VAL 80 -3.320 0.785 11.985 610 HB VAL 80 HB VAL 80 -1.034 -0.613 11.204 611 HG11 VAL 80 HG11 VAL 80 0.446 1.272 10.295 612 HG12 VAL 80 HG12 VAL 80 -1.048 2.077 9.835 613 HG13 VAL 80 HG13 VAL 80 -0.655 0.506 9.151 614 HG21 VAL 80 HG21 VAL 80 -0.236 1.907 12.323 615 HG22 VAL 80 HG22 VAL 80 -0.360 0.338 13.117 616 HG23 VAL 80 HG23 VAL 80 -1.760 1.408 13.058 617 HA PRO 81 HA PRO 81 -4.574 3.577 8.795 618 HB2 PRO 81 HB2 PRO 81 -2.722 5.599 8.564 619 HB3 PRO 81 HB1 PRO 81 -3.932 5.518 9.864 620 HG2 PRO 81 HG2 PRO 81 -1.061 4.668 9.897 621 HG3 PRO 81 HG1 PRO 81 -1.977 5.572 11.119 622 HD2 PRO 81 HD2 PRO 81 -1.504 2.962 11.418 623 HD3 PRO 81 HD1 PRO 81 -3.062 3.665 11.912 624 H PHE 82 HN PHE 82 -4.499 2.680 6.790 625 HA PHE 82 HA PHE 82 -2.279 3.031 4.990 626 HB2 PHE 82 HB2 PHE 82 -1.248 0.912 5.087 627 HB3 PHE 82 HB1 PHE 82 -1.493 1.344 6.778 628 HD1 PHE 82 HD1 PHE 82 -4.647 0.880 6.512 629 HD2 PHE 82 HD2 PHE 82 -1.173 -1.483 5.620 630 HE1 PHE 82 HE1 PHE 82 -5.961 -1.189 6.876 631 HE2 PHE 82 HE2 PHE 82 -2.501 -3.553 5.987 632 HZ PHE 82 HZ PHE 82 -4.888 -3.403 6.610 633 H ILE 83 HN ILE 83 -2.568 0.540 3.656 634 HA ILE 83 HA ILE 83 -5.364 0.142 2.933 635 HB ILE 83 HB ILE 83 -3.452 1.876 1.505 636 HG12 ILE 83 HG12 ILE 83 -5.243 3.045 2.507 637 HG13 ILE 83 HG11 ILE 83 -5.672 2.963 0.803 638 HG21 ILE 83 HG21 ILE 83 -5.458 0.113 0.092 639 HG22 ILE 83 HG22 ILE 83 -3.709 0.114 -0.135 640 HG23 ILE 83 HG23 ILE 83 -4.669 1.498 -0.661 641 HD11 ILE 83 HD11 ILE 83 -7.660 2.297 1.826 642 HD12 ILE 83 HD12 ILE 83 -6.829 1.425 3.112 643 HD13 ILE 83 HD13 ILE 83 -6.894 0.746 1.484 644 H PHE 84 HN PHE 84 -5.478 -1.596 1.230 645 HA PHE 84 HA PHE 84 -2.939 -3.070 0.730 646 HB2 PHE 84 HB2 PHE 84 -4.320 -3.540 2.952 647 HB3 PHE 84 HB1 PHE 84 -5.281 -4.533 1.861 648 HD1 PHE 84 HD1 PHE 84 -1.918 -4.034 3.343 649 HD2 PHE 84 HD2 PHE 84 -4.401 -6.584 0.934 650 HE1 PHE 84 HE1 PHE 84 -0.264 -5.866 3.569 651 HE2 PHE 84 HE2 PHE 84 -2.739 -8.413 1.156 652 HZ PHE 84 HZ PHE 84 -0.670 -8.049 2.469 653 H ALA 85 HN ALA 85 -3.440 -5.053 -0.708 654 HA ALA 85 HA ALA 85 -5.945 -5.053 -2.198 655 HB1 ALA 85 HB1 ALA 85 -5.363 -3.450 -3.691 656 HB2 ALA 85 HB2 ALA 85 -3.927 -4.379 -4.125 657 HB3 ALA 85 HB3 ALA 85 -3.853 -3.200 -2.815 658 H THR 86 HN THR 86 -6.105 -7.038 -3.346 659 HA THR 86 HA THR 86 -3.785 -8.439 -4.364 660 HB THR 86 HB THR 86 -3.371 -8.776 -1.992 661 HG1 THR 86 HG1 THR 86 -4.091 -11.179 -1.987 662 HG21 THR 86 HG21 THR 86 -5.952 -10.192 -1.559 663 HG22 THR 86 HG22 THR 86 -6.013 -8.431 -1.635 664 HG23 THR 86 HG23 THR 86 -4.997 -9.227 -0.434 665 H GLY 87 HN GLY 87 -4.656 -11.035 -4.367 666 HA2 GLY 87 HA2 GLY 87 -6.344 -11.400 -6.439 667 HA3 GLY 87 HA1 GLY 87 -6.409 -12.498 -5.061 668 H TYR 88 HN TYR 88 -7.518 -10.616 -3.155 669 HA TYR 88 HA TYR 88 -10.206 -10.110 -4.396 670 HB2 TYR 88 HB2 TYR 88 -11.055 -10.812 -2.078 671 HB3 TYR 88 HB1 TYR 88 -10.384 -12.094 -3.086 672 HD1 TYR 88 HD1 TYR 88 -9.038 -9.479 -0.717 673 HD2 TYR 88 HD2 TYR 88 -9.014 -13.588 -1.978 674 HE1 TYR 88 HE1 TYR 88 -7.373 -10.012 1.036 675 HE2 TYR 88 HE2 TYR 88 -7.351 -14.117 -0.222 676 HH TYR 88 HH TYR 88 -6.250 -13.352 1.549 677 H GLY 89 HN GLY 89 -7.611 -8.568 -3.120 678 HA2 GLY 89 HA2 GLY 89 -7.605 -6.200 -2.638 679 HA3 GLY 89 HA1 GLY 89 -9.304 -6.317 -2.185 680 H SER 90 HN SER 90 -9.740 -7.625 -0.149 681 HA SER 90 HA SER 90 -7.475 -7.810 1.739 682 HB2 SER 90 HB2 SER 90 -8.961 -6.261 3.279 683 HB3 SER 90 HB1 SER 90 -7.884 -5.547 2.082 684 HG SER 90 HG SER 90 -10.502 -6.275 1.366 685 H LYS 91 HN LYS 91 -8.028 -9.040 3.629 686 HA LYS 91 HA LYS 91 -10.467 -10.675 3.350 687 HB2 LYS 91 HB2 LYS 91 -9.320 -12.095 5.055 688 HB3 LYS 91 HB1 LYS 91 -8.322 -11.805 3.634 689 HG2 LYS 91 HG2 LYS 91 -6.743 -11.268 5.193 690 HG3 LYS 91 HG1 LYS 91 -7.549 -9.709 5.184 691 HD2 LYS 91 HD2 LYS 91 -9.030 -10.546 7.051 692 HD3 LYS 91 HD1 LYS 91 -8.024 -11.989 7.119 693 HE2 LYS 91 HE2 LYS 91 -6.894 -9.181 7.405 694 HE3 LYS 91 HE1 LYS 91 -7.349 -10.198 8.786 695 HZ1 LYS 91 HZ1 LYS 91 -5.340 -11.116 8.558 696 HZ2 LYS 91 HZ2 LYS 91 -5.089 -10.426 7.026 697 HZ3 LYS 91 HZ3 LYS 91 -5.949 -11.884 7.174 698 H GLY 92 HN GLY 92 -8.843 -8.656 5.789 699 HA2 GLY 92 HA2 GLY 92 -11.475 -8.050 6.987 700 HA3 GLY 92 HA1 GLY 92 -10.245 -8.745 8.050 701 H LEU 93 HN LEU 93 -9.014 -6.860 5.498 702 HA LEU 93 HA LEU 93 -7.506 -5.056 6.923 703 HB2 LEU 93 HB2 LEU 93 -7.532 -5.428 4.481 704 HB3 LEU 93 HB1 LEU 93 -9.095 -4.620 4.373 705 HG LEU 93 HG LEU 93 -6.893 -3.133 5.706 706 HD11 LEU 93 HD11 LEU 93 -6.134 -4.316 3.465 707 HD12 LEU 93 HD12 LEU 93 -5.702 -2.637 3.791 708 HD13 LEU 93 HD13 LEU 93 -7.059 -3.009 2.730 709 HD21 LEU 93 HD21 LEU 93 -8.091 -1.420 4.044 710 HD22 LEU 93 HD22 LEU 93 -8.805 -1.857 5.597 711 HD23 LEU 93 HD23 LEU 93 -9.367 -2.636 4.120 712 H ASP 94 HN ASP 94 -8.493 -4.155 8.779 713 HA ASP 94 HA ASP 94 -10.949 -2.470 8.368 714 HB2 ASP 94 HB2 ASP 94 -11.115 -2.732 10.865 715 HB3 ASP 94 HB1 ASP 94 -11.145 -4.274 10.008 716 H THR 95 HN THR 95 -9.819 -0.553 7.618 717 HA THR 95 HA THR 95 -7.879 0.636 9.577 718 HB THR 95 HB THR 95 -6.929 0.180 7.415 719 HG1 THR 95 HG1 THR 95 -6.280 2.197 6.890 720 HG21 THR 95 HG21 THR 95 -9.391 1.569 6.352 721 HG22 THR 95 HG22 THR 95 -8.900 -0.100 6.074 722 HG23 THR 95 HG23 THR 95 -7.977 1.219 5.359 723 H ARG 96 HN ARG 96 -7.828 3.111 9.339 724 HA ARG 96 HA ARG 96 -10.410 4.225 10.059 725 HB2 ARG 96 HB2 ARG 96 -7.675 5.384 9.397 726 HB3 ARG 96 HB1 ARG 96 -9.009 6.329 10.068 727 HG2 ARG 96 HG2 ARG 96 -8.153 3.808 11.460 728 HG3 ARG 96 HG1 ARG 96 -7.218 5.287 11.690 729 HD2 ARG 96 HD2 ARG 96 -10.229 5.206 12.055 730 HD3 ARG 96 HD1 ARG 96 -9.090 4.936 13.390 731 HE ARG 96 HE ARG 96 -8.512 7.329 11.800 732 HH11 ARG 96 HH21 ARG 96 -7.858 7.003 14.716 733 HH12 ARG 96 HH22 ARG 96 -9.030 8.037 15.461 734 HH21 ARG 96 HH11 ARG 96 -11.047 8.222 12.653 735 HH22 ARG 96 HH12 ARG 96 -10.828 8.734 14.293 736 H TYR 97 HN TYR 97 -9.043 3.394 7.111 737 HA TYR 97 HA TYR 97 -9.808 5.687 5.503 738 HB2 TYR 97 HB2 TYR 97 -9.024 2.809 4.966 739 HB3 TYR 97 HB1 TYR 97 -9.333 3.962 3.675 740 HD1 TYR 97 HD2 TYR 97 -7.502 4.321 6.983 741 HD2 TYR 97 HD1 TYR 97 -7.307 4.537 2.692 742 HE1 TYR 97 HE2 TYR 97 -5.177 5.119 7.130 743 HE2 TYR 97 HE1 TYR 97 -4.971 5.329 2.849 744 HH TYR 97 HH TYR 97 -3.500 6.416 4.433 745 H SER 98 HN SER 98 -11.445 2.874 6.738 746 HA SER 98 HA SER 98 -13.818 2.509 6.746 747 HB2 SER 98 HB2 SER 98 -13.707 4.965 5.603 748 HB3 SER 98 HB1 SER 98 -14.257 4.000 4.240 749 HG SER 98 HG SER 98 -16.060 4.605 5.359 750 H ASN 99 HN ASN 99 -11.561 1.187 5.147 751 HA ASN 99 HA ASN 99 -11.367 -0.495 3.477 752 HB2 ASN 99 HB2 ASN 99 -14.205 -0.738 4.514 753 HB3 ASN 99 HB1 ASN 99 -13.421 -1.975 3.529 754 HD21 ASN 99 HD21 ASN 99 -10.902 -0.736 5.267 755 HD22 ASN 99 HD22 ASN 99 -10.961 -1.746 6.625 756 H ILE 100 HN ILE 100 -11.163 0.802 1.560 757 HA ILE 100 HA ILE 100 -13.613 0.851 -0.107 758 HB ILE 100 HB ILE 100 -12.040 3.374 -0.139 759 HG12 ILE 100 HG12 ILE 100 -13.500 4.224 1.775 760 HG13 ILE 100 HG11 ILE 100 -13.795 2.538 2.182 761 HG21 ILE 100 HG21 ILE 100 -15.006 2.810 -0.053 762 HG22 ILE 100 HG22 ILE 100 -14.056 2.885 -1.538 763 HG23 ILE 100 HG23 ILE 100 -14.224 4.319 -0.524 764 HD11 ILE 100 HD11 ILE 100 -11.402 4.184 2.600 765 HD12 ILE 100 HD12 ILE 100 -11.059 2.587 1.976 766 HD13 ILE 100 HD13 ILE 100 -11.938 2.773 3.476 767 HA PRO 101 HA PRO 101 -10.031 1.463 -3.074 768 HB2 PRO 101 HB2 PRO 101 -7.505 1.981 -2.212 769 HB3 PRO 101 HB1 PRO 101 -8.718 3.244 -2.469 770 HG2 PRO 101 HG2 PRO 101 -7.720 2.075 0.022 771 HG3 PRO 101 HG1 PRO 101 -8.320 3.703 -0.289 772 HD2 PRO 101 HD2 PRO 101 -9.719 1.637 0.962 773 HD3 PRO 101 HD1 PRO 101 -10.412 3.140 0.328 774 H LEU 102 HN LEU 102 -10.636 -0.960 -1.597 775 HA LEU 102 HA LEU 102 -8.089 -2.417 -1.369 776 HB2 LEU 102 HB2 LEU 102 -10.955 -3.411 -1.220 777 HB3 LEU 102 HB1 LEU 102 -9.526 -4.206 -0.557 778 HG LEU 102 HG LEU 102 -10.331 -1.427 0.304 779 HD11 LEU 102 HD11 LEU 102 -12.244 -2.557 0.996 780 HD12 LEU 102 HD12 LEU 102 -11.184 -2.835 2.378 781 HD13 LEU 102 HD13 LEU 102 -11.399 -4.096 1.163 782 HD21 LEU 102 HD21 LEU 102 -9.101 -3.105 2.289 783 HD22 LEU 102 HD22 LEU 102 -8.488 -1.611 1.581 784 HD23 LEU 102 HD23 LEU 102 -8.139 -3.159 0.811 785 H LEU 103 HN LEU 103 -7.231 -3.678 -3.047 786 HA LEU 103 HA LEU 103 -8.951 -4.896 -5.075 787 HB2 LEU 103 HB2 LEU 103 -8.158 -3.340 -6.929 788 HB3 LEU 103 HB1 LEU 103 -9.279 -2.627 -5.771 789 HG LEU 103 HG LEU 103 -7.032 -1.987 -4.504 790 HD11 LEU 103 HD11 LEU 103 -5.265 -2.740 -5.749 791 HD12 LEU 103 HD12 LEU 103 -5.539 -1.238 -6.631 792 HD13 LEU 103 HD13 LEU 103 -6.195 -2.754 -7.248 793 HD21 LEU 103 HD21 LEU 103 -8.091 -0.564 -6.963 794 HD22 LEU 103 HD22 LEU 103 -7.093 0.180 -5.713 795 HD23 LEU 103 HD23 LEU 103 -8.713 -0.399 -5.321 796 H THR 104 HN THR 104 -7.120 -4.832 -7.271 797 HA THR 104 HA THR 104 -4.729 -6.170 -6.081 798 HB THR 104 HB THR 104 -5.763 -7.975 -7.083 799 HG1 THR 104 HG1 THR 104 -5.129 -7.257 -9.616 800 HG21 THR 104 HG21 THR 104 -7.195 -7.615 -9.228 801 HG22 THR 104 HG22 THR 104 -7.127 -5.906 -8.804 802 HG23 THR 104 HG23 THR 104 -7.852 -7.061 -7.689 803 H LYS 105 HN LYS 105 -5.458 -5.428 -9.464 804 HA LYS 105 HA LYS 105 -3.620 -3.118 -9.554 805 HB2 LYS 105 HB2 LYS 105 -2.849 -5.893 -10.107 806 HB3 LYS 105 HB1 LYS 105 -2.496 -4.802 -11.449 807 HG2 LYS 105 HG2 LYS 105 -0.798 -3.844 -10.320 808 HG3 LYS 105 HG1 LYS 105 -1.818 -3.584 -8.902 809 HD2 LYS 105 HD2 LYS 105 -1.508 -6.247 -8.704 810 HD3 LYS 105 HD1 LYS 105 0.004 -5.857 -9.524 811 HE2 LYS 105 HE2 LYS 105 0.841 -5.222 -7.520 812 HE3 LYS 105 HE1 LYS 105 -0.344 -3.900 -7.496 813 HZ1 LYS 105 HZ1 LYS 105 -0.957 -5.132 -5.668 814 HZ2 LYS 105 HZ2 LYS 105 -0.591 -6.624 -6.397 815 HZ3 LYS 105 HZ3 LYS 105 -1.980 -5.763 -6.860 816 HA PRO 106 HA PRO 106 -6.787 -3.776 -13.011 817 HB2 PRO 106 HB2 PRO 106 -8.816 -2.176 -12.107 818 HB3 PRO 106 HB1 PRO 106 -8.735 -3.912 -11.754 819 HG2 PRO 106 HG2 PRO 106 -8.046 -1.596 -10.028 820 HG3 PRO 106 HG1 PRO 106 -8.785 -3.146 -9.598 821 HD2 PRO 106 HD2 PRO 106 -6.141 -2.519 -9.173 822 HD3 PRO 106 HD1 PRO 106 -6.768 -4.174 -9.340 823 H PHE 107 HN PHE 107 -5.129 -1.389 -11.317 824 HA PHE 107 HA PHE 107 -4.444 0.798 -11.842 825 HB2 PHE 107 HB2 PHE 107 -4.570 -0.848 -14.333 826 HB3 PHE 107 HB1 PHE 107 -4.233 0.877 -14.512 827 HD1 PHE 107 HD2 PHE 107 -3.337 -1.485 -11.754 828 HD2 PHE 107 HD1 PHE 107 -1.908 1.054 -14.910 829 HE1 PHE 107 HE2 PHE 107 -1.014 -1.842 -10.976 830 HE2 PHE 107 HE1 PHE 107 0.418 0.698 -14.131 831 HZ PHE 107 HZ PHE 107 0.873 -0.740 -12.167 832 H LEU 108 HN LEU 108 -5.103 2.667 -13.619 833 HA LEU 108 HA LEU 108 -6.776 4.190 -14.270 834 HB2 LEU 108 HB2 LEU 108 -7.747 2.570 -15.678 835 HB3 LEU 108 HB1 LEU 108 -8.229 1.544 -14.335 836 HG LEU 108 HG LEU 108 -10.066 2.940 -15.520 837 HD11 LEU 108 HD11 LEU 108 -9.855 1.886 -13.017 838 HD12 LEU 108 HD12 LEU 108 -11.313 2.666 -13.632 839 HD13 LEU 108 HD13 LEU 108 -10.178 3.577 -12.637 840 HD21 LEU 108 HD21 LEU 108 -8.345 5.019 -14.969 841 HD22 LEU 108 HD22 LEU 108 -9.501 5.142 -13.644 842 HD23 LEU 108 HD23 LEU 108 -10.064 5.207 -15.314 843 H ASP 109 HN ASP 109 -8.125 1.882 -11.859 844 HA ASP 109 HA ASP 109 -8.928 4.240 -10.186 845 HB2 ASP 109 HB2 ASP 109 -10.941 3.310 -10.986 846 HB3 ASP 109 HB1 ASP 109 -10.299 1.670 -10.959 847 H SER 110 HN SER 110 -6.684 1.911 -10.408 848 HA SER 110 HA SER 110 -6.849 0.572 -7.837 849 HB2 SER 110 HB2 SER 110 -5.767 -0.282 -9.918 850 HB3 SER 110 HB1 SER 110 -4.539 0.971 -9.765 851 HG SER 110 HG SER 110 -4.223 0.041 -7.579 852 H GLU 111 HN GLU 111 -3.683 1.714 -8.271 853 HA GLU 111 HA GLU 111 -3.092 2.748 -5.846 854 HB2 GLU 111 HB2 GLU 111 -2.343 3.462 -8.634 855 HB3 GLU 111 HB1 GLU 111 -1.800 4.560 -7.365 856 HG2 GLU 111 HG2 GLU 111 -1.451 1.660 -6.834 857 HG3 GLU 111 HG1 GLU 111 -0.411 2.362 -8.076 858 H LEU 112 HN LEU 112 -5.030 4.504 -8.244 859 HA LEU 112 HA LEU 112 -5.040 7.075 -7.042 860 HB2 LEU 112 HB2 LEU 112 -7.284 5.602 -8.460 861 HB3 LEU 112 HB1 LEU 112 -7.148 7.355 -8.287 862 HG LEU 112 HG LEU 112 -5.104 5.593 -9.643 863 HD11 LEU 112 HD11 LEU 112 -6.576 7.587 -11.233 864 HD12 LEU 112 HD12 LEU 112 -7.585 6.277 -10.621 865 HD13 LEU 112 HD13 LEU 112 -6.179 5.912 -11.621 866 HD21 LEU 112 HD21 LEU 112 -5.331 8.523 -9.049 867 HD22 LEU 112 HD22 LEU 112 -4.518 8.017 -10.530 868 HD23 LEU 112 HD23 LEU 112 -3.916 7.474 -8.963 869 H GLU 113 HN GLU 113 -7.761 4.759 -6.771 870 HA GLU 113 HA GLU 113 -9.049 5.895 -4.567 871 HB2 GLU 113 HB2 GLU 113 -8.631 3.064 -5.543 872 HB3 GLU 113 HB1 GLU 113 -9.569 3.365 -4.075 873 HG2 GLU 113 HG2 GLU 113 -10.954 5.004 -5.385 874 HG3 GLU 113 HG1 GLU 113 -10.117 4.464 -6.841 875 H ALA 114 HN ALA 114 -6.056 4.081 -4.724 876 HA ALA 114 HA ALA 114 -5.753 3.279 -2.021 877 HB1 ALA 114 HB1 ALA 114 -4.278 3.273 -4.338 878 HB2 ALA 114 HB2 ALA 114 -3.656 2.775 -2.765 879 HB3 ALA 114 HB3 ALA 114 -3.373 4.416 -3.346 880 H VAL 115 HN VAL 115 -5.203 6.426 -3.554 881 HA VAL 115 HA VAL 115 -4.534 7.579 -0.867 882 HB VAL 115 HB VAL 115 -4.257 8.866 -3.593 883 HG11 VAL 115 HG11 VAL 115 -4.061 10.297 -1.566 884 HG12 VAL 115 HG12 VAL 115 -2.538 10.188 -2.448 885 HG13 VAL 115 HG13 VAL 115 -2.773 9.248 -0.974 886 HG21 VAL 115 HG21 VAL 115 -2.834 7.121 -4.026 887 HG22 VAL 115 HG22 VAL 115 -2.675 6.698 -2.322 888 HG23 VAL 115 HG23 VAL 115 -1.739 8.035 -2.989 889 H LEU 116 HN LEU 116 -6.662 7.983 -3.685 890 HA LEU 116 HA LEU 116 -8.007 10.351 -2.968 891 HB2 LEU 116 HB2 LEU 116 -8.548 7.894 -4.555 892 HB3 LEU 116 HB1 LEU 116 -9.945 8.900 -4.167 893 HG LEU 116 HG LEU 116 -8.767 9.488 -6.335 894 HD11 LEU 116 HD11 LEU 116 -9.933 11.087 -4.378 895 HD12 LEU 116 HD12 LEU 116 -9.605 11.568 -6.043 896 HD13 LEU 116 HD13 LEU 116 -8.438 11.937 -4.772 897 HD21 LEU 116 HD21 LEU 116 -6.652 10.695 -6.177 898 HD22 LEU 116 HD22 LEU 116 -6.461 9.112 -5.421 899 HD23 LEU 116 HD23 LEU 116 -6.665 10.549 -4.419 900 H VAL 117 HN VAL 117 -8.729 7.003 -1.966 901 HA VAL 117 HA VAL 117 -11.121 7.073 -0.704 902 HB VAL 117 HB VAL 117 -9.770 5.135 -0.555 903 HG11 VAL 117 HG11 VAL 117 -7.704 5.863 1.284 904 HG12 VAL 117 HG12 VAL 117 -7.708 7.063 -0.008 905 HG13 VAL 117 HG13 VAL 117 -7.520 5.356 -0.393 906 HG21 VAL 117 HG21 VAL 117 -9.761 6.309 2.231 907 HG22 VAL 117 HG22 VAL 117 -9.770 4.597 1.801 908 HG23 VAL 117 HG23 VAL 117 -11.177 5.606 1.453 909 H GLN 118 HN GLN 118 -8.327 8.936 0.401 910 HA GLN 118 HA GLN 118 -8.958 9.465 3.048 911 HB2 GLN 118 HB2 GLN 118 -7.691 10.961 0.799 912 HB3 GLN 118 HB1 GLN 118 -7.985 11.828 2.310 913 HG2 GLN 118 HG2 GLN 118 -6.726 9.098 2.386 914 HG3 GLN 118 HG1 GLN 118 -5.732 10.508 2.015 915 HE21 GLN 118 HE21 GLN 118 -7.726 8.990 4.517 916 HE22 GLN 118 HE22 GLN 118 -7.189 9.974 5.792 917 H ILE 119 HN ILE 119 -10.759 10.611 0.223 918 HA ILE 119 HA ILE 119 -12.108 12.773 1.600 919 HB ILE 119 HB ILE 119 -13.831 12.347 -0.297 920 HG12 ILE 119 HG12 ILE 119 -13.144 10.949 -2.106 921 HG13 ILE 119 HG11 ILE 119 -11.572 10.660 -1.380 922 HG21 ILE 119 HG21 ILE 119 -10.932 12.952 -0.929 923 HG22 ILE 119 HG22 ILE 119 -12.133 14.109 -0.356 924 HG23 ILE 119 HG23 ILE 119 -12.309 13.373 -1.949 925 HD11 ILE 119 HD11 ILE 119 -13.391 8.814 -1.165 926 HD12 ILE 119 HD12 ILE 119 -14.090 9.866 0.064 927 HD13 ILE 119 HD13 ILE 119 -12.459 9.235 0.266 928 H SER 120 HN SER 120 -12.227 9.454 2.038 929 HA SER 120 HA SER 120 -14.891 9.650 3.393 930 HB2 SER 120 HB2 SER 120 -13.700 7.490 1.628 931 HB3 SER 120 HB1 SER 120 -15.104 7.208 2.656 932 HG SER 120 HG SER 120 -16.224 8.094 1.125 933 H LYS 121 HN LYS 121 -14.612 9.212 5.569 934 HA LYS 121 HA LYS 121 -12.773 7.092 6.444 935 HB2 LYS 121 HB2 LYS 121 -11.221 8.892 5.958 936 HB3 LYS 121 HB1 LYS 121 -12.218 10.043 6.849 937 HG2 LYS 121 HG2 LYS 121 -11.331 9.434 8.835 938 HG3 LYS 121 HG1 LYS 121 -11.507 7.719 8.469 939 HD2 LYS 121 HD2 LYS 121 -9.341 7.531 7.860 940 HD3 LYS 121 HD1 LYS 121 -9.432 8.968 6.842 941 HE2 LYS 121 HE2 LYS 121 -8.985 8.906 9.849 942 HE3 LYS 121 HE1 LYS 121 -7.828 9.427 8.609 943 HZ1 LYS 121 HZ1 LYS 121 -10.007 10.863 7.978 944 HZ2 LYS 121 HZ2 LYS 121 -8.734 11.441 8.945 945 HZ3 LYS 121 HZ3 LYS 121 -10.137 10.814 9.669 946 H GLU 122 HN GLU 122 -14.689 9.921 7.341 947 HA GLU 122 HA GLU 122 -15.724 8.401 9.702 948 HB2 GLU 122 HB2 GLU 122 -15.723 10.912 10.652 949 HB3 GLU 122 HB1 GLU 122 -14.305 9.874 10.789 950 HG2 GLU 122 HG2 GLU 122 -13.176 10.957 9.050 951 HG3 GLU 122 HG1 GLU 122 -14.666 11.571 8.334 952 H VAL 123 HN VAL 123 -16.205 10.950 7.292 953 HA VAL 123 HA VAL 123 -19.131 10.483 7.454 954 HB VAL 123 HB VAL 123 -19.292 13.091 7.403 955 HG11 VAL 123 HG11 VAL 123 -20.130 11.954 9.308 956 HG12 VAL 123 HG12 VAL 123 -18.973 13.115 9.959 957 HG13 VAL 123 HG13 VAL 123 -18.523 11.419 9.797 958 HG21 VAL 123 HG21 VAL 123 -16.603 12.804 8.763 959 HG22 VAL 123 HG22 VAL 123 -17.441 14.293 8.325 960 HG23 VAL 123 HG23 VAL 123 -16.758 13.263 7.067 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 6.298 26.452 2.785 2 H2 GLY 1 HT2 GLY 1 4.683 25.961 2.589 3 H3 GLY 1 HT3 GLY 1 5.159 26.780 4.000 4 HA2 GLY 1 HA2 GLY 1 4.056 27.924 1.784 5 HA3 GLY 1 HA1 GLY 1 4.901 28.772 3.080 6 H SER 2 HN SER 2 6.767 29.825 2.554 7 HA SER 2 HA SER 2 7.627 30.035 -0.178 8 HB2 SER 2 HB2 SER 2 9.372 30.718 2.164 9 HB3 SER 2 HB1 SER 2 9.059 31.650 0.702 10 HG SER 2 HG SER 2 7.300 32.448 1.585 11 H HIS 3 HN HIS 3 8.460 27.831 2.386 12 HA HIS 3 HA HIS 3 9.964 26.101 0.670 13 HB2 HIS 3 HB2 HIS 3 12.078 26.929 0.825 14 HB3 HIS 3 HB1 HIS 3 11.316 28.413 1.381 15 HD1 HIS 3 HD1 HIS 3 10.949 28.493 4.117 16 HD2 HIS 3 HD2 HIS 3 13.815 25.836 2.671 17 HE1 HIS 3 HE1 HIS 3 12.432 27.901 6.082 18 H MET 4 HN MET 4 9.731 24.129 1.632 19 HA MET 4 HA MET 4 10.276 23.675 4.454 20 HB2 MET 4 HB2 MET 4 7.742 24.672 3.720 21 HB3 MET 4 HB1 MET 4 7.494 22.955 4.036 22 HG2 MET 4 HG2 MET 4 9.164 23.730 6.104 23 HG3 MET 4 HG1 MET 4 8.102 25.125 5.908 24 HE1 MET 4 HE1 MET 4 6.365 24.398 8.552 25 HE2 MET 4 HE2 MET 4 5.166 24.676 7.291 26 HE3 MET 4 HE3 MET 4 6.734 25.474 7.196 27 H THR 5 HN THR 5 9.159 21.302 4.948 28 HA THR 5 HA THR 5 9.633 19.629 2.500 29 HB THR 5 HB THR 5 10.451 18.064 4.594 30 HG1 THR 5 HG1 THR 5 11.572 20.543 5.214 31 HG21 THR 5 HG21 THR 5 12.370 20.057 3.429 32 HG22 THR 5 HG22 THR 5 11.575 18.894 2.366 33 HG23 THR 5 HG23 THR 5 12.586 18.326 3.697 34 H GLU 6 HN GLU 6 8.595 17.465 2.645 35 HA GLU 6 HA GLU 6 6.496 17.068 4.680 36 HB2 GLU 6 HB2 GLU 6 4.679 17.183 3.049 37 HB3 GLU 6 HB1 GLU 6 5.594 18.691 2.979 38 HG2 GLU 6 HG2 GLU 6 6.991 17.403 1.146 39 HG3 GLU 6 HG1 GLU 6 5.527 16.426 1.014 40 H ARG 7 HN ARG 7 8.908 15.672 3.552 41 HA ARG 7 HA ARG 7 7.933 13.400 1.992 42 HB2 ARG 7 HB2 ARG 7 10.455 14.473 3.125 43 HB3 ARG 7 HB1 ARG 7 10.400 12.721 2.937 44 HG2 ARG 7 HG2 ARG 7 9.803 12.958 0.577 45 HG3 ARG 7 HG1 ARG 7 9.763 14.713 0.743 46 HD2 ARG 7 HD2 ARG 7 12.247 14.286 1.689 47 HD3 ARG 7 HD1 ARG 7 12.118 12.887 0.606 48 HE ARG 7 HE ARG 7 11.103 14.983 -0.895 49 HH11 ARG 7 HH21 ARG 7 13.724 13.541 -1.456 50 HH12 ARG 7 HH22 ARG 7 14.833 14.870 -1.486 51 HH21 ARG 7 HH11 ARG 7 12.657 17.066 0.080 52 HH22 ARG 7 HH12 ARG 7 14.230 16.864 -0.615 53 H ARG 8 HN ARG 8 7.311 14.163 5.101 54 HA ARG 8 HA ARG 8 8.110 11.929 6.663 55 HB2 ARG 8 HB2 ARG 8 6.320 14.200 6.771 56 HB3 ARG 8 HB1 ARG 8 5.566 12.795 7.527 57 HG2 ARG 8 HG2 ARG 8 7.229 12.607 9.151 58 HG3 ARG 8 HG1 ARG 8 8.429 13.438 8.162 59 HD2 ARG 8 HD2 ARG 8 6.174 15.191 8.689 60 HD3 ARG 8 HD1 ARG 8 6.878 14.594 10.204 61 HE ARG 8 HE ARG 8 9.002 15.554 9.560 62 HH11 ARG 8 HH21 ARG 8 6.855 17.637 8.697 63 HH12 ARG 8 HH22 ARG 8 7.503 18.122 7.166 64 HH21 ARG 8 HH11 ARG 8 9.701 15.450 6.955 65 HH22 ARG 8 HH12 ARG 8 9.119 16.887 6.182 66 H LEU 9 HN LEU 9 5.896 12.013 4.033 67 HA LEU 9 HA LEU 9 4.093 9.935 4.925 68 HB2 LEU 9 HB2 LEU 9 4.667 11.556 2.533 69 HB3 LEU 9 HB1 LEU 9 3.982 9.972 2.186 70 HG LEU 9 HG LEU 9 2.210 11.685 2.494 71 HD11 LEU 9 HD11 LEU 9 1.140 9.786 3.127 72 HD12 LEU 9 HD12 LEU 9 1.343 10.382 4.774 73 HD13 LEU 9 HD13 LEU 9 2.505 9.239 4.100 74 HD21 LEU 9 HD21 LEU 9 3.103 13.250 4.009 75 HD22 LEU 9 HD22 LEU 9 3.644 11.999 5.128 76 HD23 LEU 9 HD23 LEU 9 1.928 12.384 4.999 77 H ARG 10 HN ARG 10 3.997 7.736 3.958 78 HA ARG 10 HA ARG 10 6.495 6.663 2.771 79 HB2 ARG 10 HB2 ARG 10 5.640 4.994 4.991 80 HB3 ARG 10 HB1 ARG 10 7.221 5.690 4.680 81 HG2 ARG 10 HG2 ARG 10 6.432 6.506 6.822 82 HG3 ARG 10 HG1 ARG 10 6.408 7.848 5.681 83 HD2 ARG 10 HD2 ARG 10 4.191 8.133 6.085 84 HD3 ARG 10 HD1 ARG 10 3.883 6.483 5.511 85 HE ARG 10 HE ARG 10 4.611 5.769 7.885 86 HH11 ARG 10 HH21 ARG 10 4.504 9.080 7.896 87 HH12 ARG 10 HH22 ARG 10 3.314 9.232 9.147 88 HH21 ARG 10 HH11 ARG 10 2.517 5.860 9.173 89 HH22 ARG 10 HH12 ARG 10 2.195 7.413 9.869 90 H VAL 11 HN VAL 11 6.100 4.743 1.574 91 HA VAL 11 HA VAL 11 3.424 3.441 1.851 92 HB VAL 11 HB VAL 11 3.358 3.585 -0.733 93 HG11 VAL 11 HG11 VAL 11 2.953 5.845 1.198 94 HG12 VAL 11 HG12 VAL 11 1.744 4.836 0.411 95 HG13 VAL 11 HG13 VAL 11 2.598 6.073 -0.512 96 HG21 VAL 11 HG21 VAL 11 5.327 5.812 -0.105 97 HG22 VAL 11 HG22 VAL 11 4.601 5.493 -1.680 98 HG23 VAL 11 HG23 VAL 11 5.720 4.328 -0.973 99 H LEU 12 HN LEU 12 4.297 1.408 2.427 100 HA LEU 12 HA LEU 12 6.532 0.334 0.803 101 HB2 LEU 12 HB2 LEU 12 5.147 -1.032 3.097 102 HB3 LEU 12 HB1 LEU 12 6.825 -1.174 2.579 103 HG LEU 12 HG LEU 12 6.196 1.579 3.264 104 HD11 LEU 12 HD11 LEU 12 6.252 0.442 5.812 105 HD12 LEU 12 HD12 LEU 12 5.016 -0.442 4.921 106 HD13 LEU 12 HD13 LEU 12 4.923 1.309 5.047 107 HD21 LEU 12 HD21 LEU 12 8.163 -0.539 4.100 108 HD22 LEU 12 HD22 LEU 12 8.083 0.995 4.966 109 HD23 LEU 12 HD23 LEU 12 8.468 0.972 3.245 110 H VAL 13 HN VAL 13 5.297 0.012 -1.156 111 HA VAL 13 HA VAL 13 3.104 -1.993 -1.123 112 HB VAL 13 HB VAL 13 4.426 -0.443 -3.388 113 HG11 VAL 13 HG11 VAL 13 2.828 -2.608 -3.622 114 HG12 VAL 13 HG12 VAL 13 2.806 -1.271 -4.770 115 HG13 VAL 13 HG13 VAL 13 1.600 -1.350 -3.488 116 HG21 VAL 13 HG21 VAL 13 2.052 0.769 -3.077 117 HG22 VAL 13 HG22 VAL 13 3.490 1.306 -2.209 118 HG23 VAL 13 HG23 VAL 13 2.311 0.269 -1.407 119 H VAL 14 HN VAL 14 3.336 -3.992 -2.295 120 HA VAL 14 HA VAL 14 6.041 -4.680 -3.263 121 HB VAL 14 HB VAL 14 4.845 -5.254 -0.659 122 HG11 VAL 14 HG11 VAL 14 6.392 -7.462 -0.742 123 HG12 VAL 14 HG12 VAL 14 5.765 -7.475 -2.389 124 HG13 VAL 14 HG13 VAL 14 4.652 -7.500 -1.024 125 HG21 VAL 14 HG21 VAL 14 7.308 -4.408 -1.785 126 HG22 VAL 14 HG22 VAL 14 7.624 -5.867 -0.846 127 HG23 VAL 14 HG23 VAL 14 6.858 -4.475 -0.081 128 H GLU 15 HN GLU 15 6.086 -6.442 -4.562 129 HA GLU 15 HA GLU 15 4.124 -8.500 -4.848 130 HB2 GLU 15 HB2 GLU 15 3.030 -7.705 -6.867 131 HB3 GLU 15 HB1 GLU 15 2.879 -6.443 -5.638 132 HG2 GLU 15 HG2 GLU 15 3.707 -5.094 -7.267 133 HG3 GLU 15 HG1 GLU 15 5.262 -5.775 -6.788 134 H ASP 16 HN ASP 16 4.714 -9.777 -6.957 135 HA ASP 16 HA ASP 16 7.617 -9.795 -7.188 136 HB2 ASP 16 HB2 ASP 16 7.180 -11.792 -8.527 137 HB3 ASP 16 HB1 ASP 16 6.209 -11.809 -7.052 138 H GLU 17 HN GLU 17 7.509 -7.462 -8.248 139 HA GLU 17 HA GLU 17 8.274 -7.693 -10.959 140 HB2 GLU 17 HB2 GLU 17 5.400 -7.604 -10.444 141 HB3 GLU 17 HB1 GLU 17 5.919 -6.342 -11.556 142 HG2 GLU 17 HG2 GLU 17 6.250 -7.836 -13.212 143 HG3 GLU 17 HG1 GLU 17 7.201 -8.884 -12.158 144 H SER 18 HN SER 18 9.560 -5.943 -11.225 145 HA SER 18 HA SER 18 9.733 -3.726 -9.503 146 HB2 SER 18 HB2 SER 18 11.454 -4.421 -11.105 147 HB3 SER 18 HB1 SER 18 10.393 -4.011 -12.451 148 HG SER 18 HG SER 18 11.500 -2.191 -12.237 149 H MET 19 HN MET 19 7.560 -4.252 -12.225 150 HA MET 19 HA MET 19 6.767 -1.703 -12.978 151 HB2 MET 19 HB2 MET 19 5.883 -4.199 -13.405 152 HB3 MET 19 HB1 MET 19 4.640 -3.679 -12.264 153 HG2 MET 19 HG2 MET 19 3.792 -2.085 -13.699 154 HG3 MET 19 HG1 MET 19 5.352 -1.799 -14.468 155 HE1 MET 19 HE1 MET 19 4.452 -2.933 -17.706 156 HE2 MET 19 HE2 MET 19 4.991 -1.705 -16.564 157 HE3 MET 19 HE3 MET 19 3.266 -1.964 -16.818 158 H ILE 20 HN ILE 20 6.300 -3.281 -9.892 159 HA ILE 20 HA ILE 20 4.293 -1.445 -8.870 160 HB ILE 20 HB ILE 20 4.706 -3.792 -8.121 161 HG12 ILE 20 HG12 ILE 20 5.048 -2.943 -5.551 162 HG13 ILE 20 HG11 ILE 20 4.594 -1.427 -6.337 163 HG21 ILE 20 HG21 ILE 20 7.286 -3.376 -8.249 164 HG22 ILE 20 HG22 ILE 20 6.657 -4.438 -6.990 165 HG23 ILE 20 HG23 ILE 20 7.099 -2.774 -6.605 166 HD11 ILE 20 HD11 ILE 20 2.905 -3.628 -5.601 167 HD12 ILE 20 HD12 ILE 20 2.878 -3.463 -7.356 168 HD13 ILE 20 HD13 ILE 20 2.441 -2.096 -6.339 169 H ALA 21 HN ALA 21 7.817 -1.558 -8.940 170 HA ALA 21 HA ALA 21 8.440 0.351 -6.931 171 HB1 ALA 21 HB1 ALA 21 9.995 -1.140 -8.245 172 HB2 ALA 21 HB2 ALA 21 10.538 0.537 -8.151 173 HB3 ALA 21 HB3 ALA 21 9.776 -0.061 -9.625 174 H MET 22 HN MET 22 8.197 0.971 -10.470 175 HA MET 22 HA MET 22 8.168 3.822 -10.180 176 HB2 MET 22 HB2 MET 22 8.738 2.871 -12.295 177 HB3 MET 22 HB1 MET 22 7.290 1.863 -12.313 178 HG2 MET 22 HG2 MET 22 6.033 3.513 -13.212 179 HG3 MET 22 HG1 MET 22 6.664 4.710 -12.081 180 HE1 MET 22 HE1 MET 22 8.311 3.389 -16.119 181 HE2 MET 22 HE2 MET 22 7.095 2.626 -15.099 182 HE3 MET 22 HE3 MET 22 8.802 2.447 -14.704 183 H LEU 23 HN LEU 23 5.683 1.388 -9.981 184 HA LEU 23 HA LEU 23 3.401 3.143 -10.244 185 HB2 LEU 23 HB2 LEU 23 3.106 0.813 -10.600 186 HB3 LEU 23 HB1 LEU 23 4.006 0.393 -9.148 187 HG LEU 23 HG LEU 23 1.456 0.114 -9.059 188 HD11 LEU 23 HD11 LEU 23 1.938 0.039 -6.871 189 HD12 LEU 23 HD12 LEU 23 1.788 1.795 -6.791 190 HD13 LEU 23 HD13 LEU 23 3.354 1.057 -7.130 191 HD21 LEU 23 HD21 LEU 23 0.168 1.897 -9.517 192 HD22 LEU 23 HD22 LEU 23 1.610 2.866 -9.812 193 HD23 LEU 23 HD23 LEU 23 0.918 2.785 -8.192 194 H ILE 24 HN ILE 24 5.835 2.988 -7.931 195 HA ILE 24 HA ILE 24 4.068 3.775 -5.673 196 HB ILE 24 HB ILE 24 6.043 1.974 -5.811 197 HG12 ILE 24 HG12 ILE 24 5.944 3.750 -3.378 198 HG13 ILE 24 HG11 ILE 24 4.529 2.808 -3.850 199 HG21 ILE 24 HG21 ILE 24 8.170 2.737 -5.265 200 HG22 ILE 24 HG22 ILE 24 7.574 4.282 -4.659 201 HG23 ILE 24 HG23 ILE 24 7.631 3.976 -6.391 202 HD11 ILE 24 HD11 ILE 24 6.449 0.895 -4.031 203 HD12 ILE 24 HD12 ILE 24 5.518 1.192 -2.564 204 HD13 ILE 24 HD13 ILE 24 7.127 1.890 -2.742 205 H GLU 25 HN GLU 25 6.753 4.942 -7.677 206 HA GLU 25 HA GLU 25 7.102 7.390 -6.144 207 HB2 GLU 25 HB2 GLU 25 7.965 6.586 -8.938 208 HB3 GLU 25 HB1 GLU 25 8.621 7.938 -8.011 209 HG2 GLU 25 HG2 GLU 25 8.912 5.951 -6.188 210 HG3 GLU 25 HG1 GLU 25 9.081 5.023 -7.682 211 H ASP 26 HN ASP 26 5.129 6.402 -8.886 212 HA ASP 26 HA ASP 26 4.444 9.070 -9.781 213 HB2 ASP 26 HB2 ASP 26 2.860 7.892 -11.124 214 HB3 ASP 26 HB1 ASP 26 4.179 6.739 -10.907 215 H THR 27 HN THR 27 3.143 6.805 -7.395 216 HA THR 27 HA THR 27 0.810 8.327 -6.690 217 HB THR 27 HB THR 27 2.220 6.618 -4.725 218 HG1 THR 27 HG1 THR 27 0.906 5.283 -6.758 219 HG21 THR 27 HG21 THR 27 -0.377 5.706 -5.349 220 HG22 THR 27 HG22 THR 27 -0.450 7.468 -5.354 221 HG23 THR 27 HG23 THR 27 0.128 6.614 -3.923 222 H LEU 28 HN LEU 28 4.054 8.009 -5.241 223 HA LEU 28 HA LEU 28 3.710 9.851 -3.111 224 HB2 LEU 28 HB2 LEU 28 5.942 9.420 -2.800 225 HB3 LEU 28 HB1 LEU 28 5.651 8.167 -4.003 226 HG LEU 28 HG LEU 28 6.261 9.988 -5.746 227 HD11 LEU 28 HD11 LEU 28 8.058 11.365 -3.989 228 HD12 LEU 28 HD12 LEU 28 6.422 11.512 -3.344 229 HD13 LEU 28 HD13 LEU 28 6.773 12.040 -4.991 230 HD21 LEU 28 HD21 LEU 28 8.770 9.633 -4.352 231 HD22 LEU 28 HD22 LEU 28 8.208 8.849 -5.827 232 HD23 LEU 28 HD23 LEU 28 7.814 8.155 -4.253 233 H CYS 29 HN CYS 29 3.908 10.347 -6.511 234 HA CYS 29 HA CYS 29 4.955 13.012 -6.602 235 HB2 CYS 29 HB2 CYS 29 4.203 11.111 -8.386 236 HB3 CYS 29 HB1 CYS 29 2.807 12.183 -8.482 237 HG CYS 29 HG CYS 29 4.491 14.158 -9.058 238 H GLU 30 HN GLU 30 1.892 11.674 -5.638 239 HA GLU 30 HA GLU 30 0.504 14.271 -5.722 240 HB2 GLU 30 HB2 GLU 30 -0.651 12.263 -6.479 241 HB3 GLU 30 HB1 GLU 30 -0.298 11.452 -4.952 242 HG2 GLU 30 HG2 GLU 30 -2.637 12.407 -5.119 243 HG3 GLU 30 HG1 GLU 30 -1.708 12.975 -3.729 244 H LEU 31 HN LEU 31 1.194 11.731 -3.294 245 HA LEU 31 HA LEU 31 0.553 13.538 -1.059 246 HB2 LEU 31 HB2 LEU 31 1.567 10.699 -1.362 247 HB3 LEU 31 HB1 LEU 31 1.332 11.456 0.215 248 HG LEU 31 HG LEU 31 -1.050 11.996 -1.085 249 HD11 LEU 31 HD11 LEU 31 -0.180 10.361 -2.862 250 HD12 LEU 31 HD12 LEU 31 -1.765 9.993 -2.179 251 HD13 LEU 31 HD13 LEU 31 -0.342 9.106 -1.635 252 HD21 LEU 31 HD21 LEU 31 -0.927 11.311 1.219 253 HD22 LEU 31 HD22 LEU 31 -0.188 9.769 0.786 254 HD23 LEU 31 HD23 LEU 31 -1.879 10.079 0.391 255 H GLY 32 HN GLY 32 3.406 12.252 -2.670 256 HA2 GLY 32 HA2 GLY 32 5.590 13.298 -2.541 257 HA3 GLY 32 HA1 GLY 32 5.109 14.027 -0.998 258 H HIS 33 HN HIS 33 4.161 10.780 -1.450 259 HA HIS 33 HA HIS 33 5.216 9.679 0.837 260 HB2 HIS 33 HB2 HIS 33 4.542 8.660 -1.894 261 HB3 HIS 33 HB1 HIS 33 5.288 7.544 -0.747 262 HD1 HIS 33 HD1 HIS 33 2.094 8.282 -1.857 263 HD2 HIS 33 HD2 HIS 33 3.720 8.137 1.977 264 HE1 HIS 33 HE1 HIS 33 0.149 7.965 -0.264 265 H GLU 34 HN GLU 34 7.232 9.269 1.579 266 HA GLU 34 HA GLU 34 9.623 9.891 0.143 267 HB2 GLU 34 HB2 GLU 34 8.781 9.160 2.721 268 HB3 GLU 34 HB1 GLU 34 9.903 7.887 2.245 269 HG2 GLU 34 HG2 GLU 34 11.622 9.539 1.732 270 HG3 GLU 34 HG1 GLU 34 10.497 10.855 2.071 271 H VAL 35 HN VAL 35 11.043 7.374 0.864 272 HA VAL 35 HA VAL 35 10.100 5.665 -1.413 273 HB VAL 35 HB VAL 35 12.835 6.123 -0.172 274 HG11 VAL 35 HG11 VAL 35 13.216 4.818 -2.566 275 HG12 VAL 35 HG12 VAL 35 11.775 4.020 -1.938 276 HG13 VAL 35 HG13 VAL 35 13.257 4.045 -0.983 277 HG21 VAL 35 HG21 VAL 35 11.787 6.785 -2.940 278 HG22 VAL 35 HG22 VAL 35 13.364 7.212 -2.278 279 HG23 VAL 35 HG23 VAL 35 11.904 7.953 -1.624 280 H ALA 36 HN ALA 36 8.870 4.076 -0.389 281 HA ALA 36 HA ALA 36 9.839 2.972 2.173 282 HB1 ALA 36 HB1 ALA 36 7.308 3.347 0.753 283 HB2 ALA 36 HB2 ALA 36 7.623 3.321 2.485 284 HB3 ALA 36 HB3 ALA 36 7.423 1.807 1.603 285 H ALA 37 HN ALA 37 7.903 1.090 -0.049 286 HA ALA 37 HA ALA 37 10.206 -0.657 -0.729 287 HB1 ALA 37 HB1 ALA 37 8.474 -1.079 1.474 288 HB2 ALA 37 HB2 ALA 37 9.685 -2.193 0.836 289 HB3 ALA 37 HB3 ALA 37 8.023 -2.265 0.249 290 H THR 38 HN THR 38 9.876 -1.813 -2.575 291 HA THR 38 HA THR 38 7.177 -2.001 -3.788 292 HB THR 38 HB THR 38 7.678 -0.348 -5.263 293 HG1 THR 38 HG1 THR 38 10.012 -1.764 -5.979 294 HG21 THR 38 HG21 THR 38 10.007 0.710 -5.280 295 HG22 THR 38 HG22 THR 38 10.418 -0.411 -3.980 296 HG23 THR 38 HG23 THR 38 9.137 0.780 -3.747 297 H ALA 39 HN ALA 39 6.995 -3.839 -5.111 298 HA ALA 39 HA ALA 39 7.678 -5.865 -6.188 299 HB1 ALA 39 HB1 ALA 39 9.949 -4.515 -6.384 300 HB2 ALA 39 HB2 ALA 39 9.933 -6.267 -6.585 301 HB3 ALA 39 HB3 ALA 39 10.436 -5.561 -5.050 302 H SER 40 HN SER 40 8.238 -8.061 -5.200 303 HA SER 40 HA SER 40 7.516 -7.926 -2.340 304 HB2 SER 40 HB2 SER 40 6.689 -10.088 -2.638 305 HB3 SER 40 HB1 SER 40 6.369 -9.312 -4.180 306 HG SER 40 HG SER 40 7.685 -10.688 -5.079 307 H ARG 41 HN ARG 41 8.904 -8.149 -0.789 308 HA ARG 41 HA ARG 41 11.270 -9.893 -1.095 309 HB2 ARG 41 HB2 ARG 41 11.509 -7.257 -1.529 310 HB3 ARG 41 HB1 ARG 41 11.562 -7.230 0.237 311 HG2 ARG 41 HG2 ARG 41 13.817 -7.502 -0.281 312 HG3 ARG 41 HG1 ARG 41 13.303 -9.174 -0.064 313 HD2 ARG 41 HD2 ARG 41 12.724 -8.643 -2.749 314 HD3 ARG 41 HD1 ARG 41 14.299 -7.873 -2.474 315 HE ARG 41 HE ARG 41 13.805 -10.679 -1.562 316 HH11 ARG 41 HH21 ARG 41 16.445 -9.270 -1.134 317 HH12 ARG 41 HH22 ARG 41 17.383 -9.882 -2.455 318 HH21 ARG 41 HH11 ARG 41 14.636 -11.071 -4.205 319 HH22 ARG 41 HH12 ARG 41 16.359 -10.893 -4.197 320 H MET 42 HN MET 42 10.910 -11.335 0.571 321 HA MET 42 HA MET 42 9.180 -11.097 2.732 322 HB2 MET 42 HB2 MET 42 11.782 -12.535 2.257 323 HB3 MET 42 HB1 MET 42 10.925 -12.735 3.788 324 HG2 MET 42 HG2 MET 42 8.864 -13.344 2.486 325 HG3 MET 42 HG1 MET 42 9.831 -13.296 1.012 326 HE1 MET 42 HE1 MET 42 11.391 -14.507 0.303 327 HE2 MET 42 HE2 MET 42 10.499 -16.019 0.147 328 HE3 MET 42 HE3 MET 42 12.091 -16.018 0.902 329 H GLN 43 HN GLN 43 12.399 -9.695 2.405 330 HA GLN 43 HA GLN 43 12.618 -8.954 5.232 331 HB2 GLN 43 HB2 GLN 43 14.524 -9.441 3.662 332 HB3 GLN 43 HB1 GLN 43 14.120 -7.963 2.786 333 HG2 GLN 43 HG2 GLN 43 14.220 -7.152 5.449 334 HG3 GLN 43 HG1 GLN 43 15.567 -8.283 5.301 335 HE21 GLN 43 HE21 GLN 43 14.723 -5.050 4.837 336 HE22 GLN 43 HE22 GLN 43 15.961 -4.613 3.760 337 H GLU 44 HN GLU 44 11.978 -7.209 2.169 338 HA GLU 44 HA GLU 44 11.576 -4.638 3.371 339 HB2 GLU 44 HB2 GLU 44 10.501 -5.808 0.787 340 HB3 GLU 44 HB1 GLU 44 10.684 -4.092 1.152 341 HG2 GLU 44 HG2 GLU 44 13.133 -5.677 1.568 342 HG3 GLU 44 HG1 GLU 44 12.589 -5.613 -0.109 343 H ALA 45 HN ALA 45 9.243 -7.152 2.316 344 HA ALA 45 HA ALA 45 6.842 -5.803 2.941 345 HB1 ALA 45 HB1 ALA 45 5.948 -8.112 3.154 346 HB2 ALA 45 HB2 ALA 45 7.596 -8.729 3.251 347 HB3 ALA 45 HB3 ALA 45 7.027 -7.965 1.768 348 H LEU 46 HN LEU 46 8.612 -8.096 5.039 349 HA LEU 46 HA LEU 46 7.196 -7.960 7.402 350 HB2 LEU 46 HB2 LEU 46 9.194 -9.297 7.086 351 HB3 LEU 46 HB1 LEU 46 10.185 -7.855 6.894 352 HG LEU 46 HG LEU 46 8.717 -7.708 9.371 353 HD11 LEU 46 HD11 LEU 46 10.660 -9.992 9.368 354 HD12 LEU 46 HD12 LEU 46 8.987 -10.291 8.899 355 HD13 LEU 46 HD13 LEU 46 9.353 -9.645 10.499 356 HD21 LEU 46 HD21 LEU 46 11.205 -7.732 10.177 357 HD22 LEU 46 HD22 LEU 46 10.656 -6.400 9.158 358 HD23 LEU 46 HD23 LEU 46 11.585 -7.725 8.454 359 H ASP 47 HN ASP 47 9.409 -5.547 6.097 360 HA ASP 47 HA ASP 47 9.533 -3.802 8.344 361 HB2 ASP 47 HB2 ASP 47 10.347 -3.917 5.604 362 HB3 ASP 47 HB1 ASP 47 9.619 -2.337 5.893 363 H ILE 48 HN ILE 48 7.327 -3.733 5.518 364 HA ILE 48 HA ILE 48 5.844 -1.444 6.266 365 HB ILE 48 HB ILE 48 4.405 -2.072 4.536 366 HG12 ILE 48 HG12 ILE 48 4.819 -4.915 5.471 367 HG13 ILE 48 HG11 ILE 48 3.325 -3.979 5.472 368 HG21 ILE 48 HG21 ILE 48 6.505 -4.067 3.792 369 HG22 ILE 48 HG22 ILE 48 6.973 -2.380 3.997 370 HG23 ILE 48 HG23 ILE 48 5.747 -2.817 2.805 371 HD11 ILE 48 HD11 ILE 48 4.008 -3.858 2.826 372 HD12 ILE 48 HD12 ILE 48 2.918 -5.070 3.503 373 HD13 ILE 48 HD13 ILE 48 4.623 -5.454 3.257 374 H ALA 49 HN ALA 49 5.883 -4.665 7.539 375 HA ALA 49 HA ALA 49 3.369 -4.292 9.036 376 HB1 ALA 49 HB1 ALA 49 4.840 -6.437 7.957 377 HB2 ALA 49 HB2 ALA 49 3.395 -6.563 8.958 378 HB3 ALA 49 HB3 ALA 49 4.989 -6.611 9.705 379 H ARG 50 HN ARG 50 6.698 -5.284 9.889 380 HA ARG 50 HA ARG 50 6.551 -4.799 12.669 381 HB2 ARG 50 HB2 ARG 50 8.588 -5.155 10.556 382 HB3 ARG 50 HB1 ARG 50 9.168 -4.333 12.008 383 HG2 ARG 50 HG2 ARG 50 9.494 -6.696 12.350 384 HG3 ARG 50 HG1 ARG 50 8.138 -6.203 13.366 385 HD2 ARG 50 HD2 ARG 50 7.471 -7.102 10.597 386 HD3 ARG 50 HD1 ARG 50 7.968 -8.351 11.757 387 HE ARG 50 HE ARG 50 5.674 -6.478 12.151 388 HH11 ARG 50 HH11 ARG 50 7.763 -8.647 13.709 389 HH12 ARG 50 HH12 ARG 50 6.508 -9.523 14.519 390 HH21 ARG 50 HH21 ARG 50 3.934 -7.866 12.891 391 HH22 ARG 50 HH22 ARG 50 4.341 -9.080 14.058 392 H LYS 51 HN LYS 51 7.060 -2.570 9.997 393 HA LYS 51 HA LYS 51 8.231 -0.365 11.304 394 HB2 LYS 51 HB2 LYS 51 7.842 -0.493 8.903 395 HB3 LYS 51 HB1 LYS 51 6.097 -0.551 9.155 396 HG2 LYS 51 HG2 LYS 51 6.930 1.712 8.505 397 HG3 LYS 51 HG1 LYS 51 6.087 1.687 10.054 398 HD2 LYS 51 HD2 LYS 51 8.245 3.004 10.088 399 HD3 LYS 51 HD1 LYS 51 8.184 1.697 11.271 400 HE2 LYS 51 HE2 LYS 51 9.962 0.656 10.316 401 HE3 LYS 51 HE1 LYS 51 9.229 0.769 8.703 402 HZ1 LYS 51 HZ1 LYS 51 10.114 3.272 9.881 403 HZ2 LYS 51 HZ2 LYS 51 10.228 2.729 8.276 404 HZ3 LYS 51 HZ3 LYS 51 11.353 2.202 9.436 405 H GLY 52 HN GLY 52 4.861 -1.466 11.256 406 HA2 GLY 52 HA2 GLY 52 3.064 -0.907 12.655 407 HA3 GLY 52 HA1 GLY 52 4.248 -0.209 13.758 408 H GLN 53 HN GLN 53 5.236 1.939 12.794 409 HA GLN 53 HA GLN 53 3.008 3.776 12.477 410 HB2 GLN 53 HB2 GLN 53 4.708 5.428 12.738 411 HB3 GLN 53 HB1 GLN 53 5.226 4.060 13.725 412 HG2 GLN 53 HG2 GLN 53 6.602 3.269 11.764 413 HG3 GLN 53 HG1 GLN 53 6.207 4.785 10.951 414 HE21 GLN 53 HE21 GLN 53 7.877 6.272 11.192 415 HE22 GLN 53 HE22 GLN 53 8.836 6.449 12.581 416 H PHE 54 HN PHE 54 4.219 1.774 10.162 417 HA PHE 54 HA PHE 54 4.822 3.622 8.023 418 HB2 PHE 54 HB2 PHE 54 5.031 1.710 6.753 419 HB3 PHE 54 HB1 PHE 54 5.201 1.020 8.341 420 HD1 PHE 54 HD2 PHE 54 3.286 -0.053 9.456 421 HD2 PHE 54 HD1 PHE 54 3.151 1.089 5.323 422 HE1 PHE 54 HE2 PHE 54 1.354 -1.530 9.123 423 HE2 PHE 54 HE1 PHE 54 1.215 -0.397 4.994 424 HZ PHE 54 HZ PHE 54 0.312 -1.724 6.881 425 H ASP 55 HN ASP 55 3.437 4.208 6.237 426 HA ASP 55 HA ASP 55 0.666 4.643 7.107 427 HB2 ASP 55 HB2 ASP 55 2.126 6.381 6.059 428 HB3 ASP 55 HB1 ASP 55 2.082 5.452 4.563 429 H ILE 56 HN ILE 56 1.986 3.465 3.922 430 HA ILE 56 HA ILE 56 -0.442 1.694 3.876 431 HB ILE 56 HB ILE 56 1.027 3.139 1.658 432 HG12 ILE 56 HG12 ILE 56 -0.582 4.297 3.456 433 HG13 ILE 56 HG11 ILE 56 -0.604 4.775 1.763 434 HG21 ILE 56 HG21 ILE 56 0.135 1.540 0.348 435 HG22 ILE 56 HG22 ILE 56 -1.415 2.316 0.655 436 HG23 ILE 56 HG23 ILE 56 -0.908 0.939 1.634 437 HD11 ILE 56 HD11 ILE 56 -2.495 3.212 1.372 438 HD12 ILE 56 HD12 ILE 56 -2.891 4.443 2.572 439 HD13 ILE 56 HD13 ILE 56 -2.482 2.810 3.085 440 H ALA 57 HN ALA 57 -0.286 -0.402 2.897 441 HA ALA 57 HA ALA 57 2.453 -1.361 2.146 442 HB1 ALA 57 HB1 ALA 57 2.519 -2.030 4.368 443 HB2 ALA 57 HB2 ALA 57 1.680 -3.419 3.674 444 HB3 ALA 57 HB3 ALA 57 0.763 -2.150 4.484 445 H ILE 58 HN ILE 58 2.282 -2.767 0.358 446 HA ILE 58 HA ILE 58 -0.386 -4.057 -0.068 447 HB ILE 58 HB ILE 58 1.217 -2.293 -1.918 448 HG12 ILE 58 HG12 ILE 58 -1.292 -1.420 -2.097 449 HG13 ILE 58 HG11 ILE 58 -1.421 -2.189 -0.514 450 HG21 ILE 58 HG21 ILE 58 0.602 -4.011 -3.389 451 HG22 ILE 58 HG22 ILE 58 -0.756 -2.893 -3.518 452 HG23 ILE 58 HG23 ILE 58 -0.899 -4.344 -2.527 453 HD11 ILE 58 HD11 ILE 58 -0.190 0.319 -1.193 454 HD12 ILE 58 HD12 ILE 58 1.032 -0.769 -0.535 455 HD13 ILE 58 HD13 ILE 58 -0.416 -0.400 0.403 456 H ILE 59 HN ILE 59 0.439 -6.160 0.322 457 HA ILE 59 HA ILE 59 2.709 -7.151 -1.355 458 HB ILE 59 HB ILE 59 0.932 -8.793 0.450 459 HG12 ILE 59 HG12 ILE 59 1.327 -6.921 1.889 460 HG13 ILE 59 HG11 ILE 59 2.510 -8.141 2.353 461 HG21 ILE 59 HG21 ILE 59 3.924 -8.827 0.141 462 HG22 ILE 59 HG22 ILE 59 2.852 -9.691 -0.959 463 HG23 ILE 59 HG23 ILE 59 2.879 -10.106 0.755 464 HD11 ILE 59 HD11 ILE 59 4.183 -6.727 1.901 465 HD12 ILE 59 HD12 ILE 59 3.004 -5.482 1.490 466 HD13 ILE 59 HD13 ILE 59 3.619 -6.563 0.238 467 H ASP 60 HN ASP 60 0.764 -6.340 -3.005 468 HA ASP 60 HA ASP 60 -1.536 -7.907 -3.412 469 HB2 ASP 60 HB2 ASP 60 -1.574 -6.790 -5.556 470 HB3 ASP 60 HB1 ASP 60 -0.844 -5.676 -4.402 471 H VAL 61 HN VAL 61 -1.786 -8.935 -5.735 472 HA VAL 61 HA VAL 61 -1.597 -10.965 -6.859 473 HB VAL 61 HB VAL 61 0.443 -9.177 -7.334 474 HG11 VAL 61 HG11 VAL 61 1.617 -11.922 -6.859 475 HG12 VAL 61 HG12 VAL 61 2.141 -10.393 -6.152 476 HG13 VAL 61 HG13 VAL 61 2.399 -10.705 -7.869 477 HG21 VAL 61 HG21 VAL 61 -1.149 -10.870 -8.745 478 HG22 VAL 61 HG22 VAL 61 0.431 -11.603 -9.018 479 HG23 VAL 61 HG23 VAL 61 0.151 -9.920 -9.465 480 H ASN 62 HN ASN 62 -2.011 -12.685 -5.641 481 HA ASN 62 HA ASN 62 0.261 -13.915 -4.179 482 HB2 ASN 62 HB2 ASN 62 -2.049 -14.604 -2.751 483 HB3 ASN 62 HB1 ASN 62 -0.804 -13.472 -2.240 484 HD21 ASN 62 HD21 ASN 62 -3.461 -13.275 -4.677 485 HD22 ASN 62 HD22 ASN 62 -4.088 -11.825 -4.061 486 H LEU 63 HN LEU 63 -0.335 -14.562 -6.711 487 HA LEU 63 HA LEU 63 -1.525 -17.285 -6.469 488 HB2 LEU 63 HB2 LEU 63 -2.707 -16.834 -8.617 489 HB3 LEU 63 HB1 LEU 63 -3.216 -15.709 -7.356 490 HG LEU 63 HG LEU 63 -0.873 -14.765 -8.840 491 HD11 LEU 63 HD11 LEU 63 -2.124 -14.221 -10.898 492 HD12 LEU 63 HD12 LEU 63 -3.510 -15.128 -10.296 493 HD13 LEU 63 HD13 LEU 63 -2.006 -15.965 -10.676 494 HD21 LEU 63 HD21 LEU 63 -2.689 -12.840 -9.112 495 HD22 LEU 63 HD22 LEU 63 -1.901 -13.126 -7.559 496 HD23 LEU 63 HD23 LEU 63 -3.520 -13.761 -7.858 497 H ASP 64 HN ASP 64 -0.899 -18.495 -8.665 498 HA ASP 64 HA ASP 64 0.935 -19.314 -9.933 499 HB2 ASP 64 HB2 ASP 64 0.485 -16.473 -10.377 500 HB3 ASP 64 HB1 ASP 64 2.184 -16.886 -10.637 501 H GLY 65 HN GLY 65 1.300 -18.784 -7.004 502 HA2 GLY 65 HA2 GLY 65 3.682 -19.587 -6.249 503 HA3 GLY 65 HA1 GLY 65 4.177 -18.024 -6.898 504 H GLU 66 HN GLU 66 1.204 -17.394 -5.806 505 HA GLU 66 HA GLU 66 0.584 -15.976 -4.018 506 HB2 GLU 66 HB2 GLU 66 0.423 -17.347 -1.975 507 HB3 GLU 66 HB1 GLU 66 -0.024 -18.273 -3.407 508 HG2 GLU 66 HG2 GLU 66 2.046 -19.434 -3.437 509 HG3 GLU 66 HG1 GLU 66 2.792 -18.294 -2.318 510 HA PRO 67 HA PRO 67 4.920 -14.839 -2.758 511 HB2 PRO 67 HB2 PRO 67 5.146 -12.553 -4.236 512 HB3 PRO 67 HB1 PRO 67 5.615 -14.148 -4.854 513 HG2 PRO 67 HG2 PRO 67 3.181 -12.545 -5.409 514 HG3 PRO 67 HG1 PRO 67 4.089 -13.626 -6.475 515 HD2 PRO 67 HD2 PRO 67 1.717 -14.266 -5.223 516 HD3 PRO 67 HD1 PRO 67 2.891 -15.447 -5.836 517 H SER 68 HN SER 68 2.538 -14.453 -1.290 518 HA SER 68 HA SER 68 2.671 -11.537 -0.578 519 HB2 SER 68 HB2 SER 68 0.532 -11.951 -1.498 520 HB3 SER 68 HB1 SER 68 0.427 -13.544 -0.757 521 HG SER 68 HG SER 68 -0.422 -11.207 0.189 522 H TYR 69 HN TYR 69 3.196 -14.721 0.478 523 HA TYR 69 HA TYR 69 3.616 -15.720 2.531 524 HB2 TYR 69 HB2 TYR 69 4.476 -13.600 4.134 525 HB3 TYR 69 HB1 TYR 69 5.489 -14.605 3.108 526 HD1 TYR 69 HD1 TYR 69 5.765 -13.863 0.625 527 HD2 TYR 69 HD2 TYR 69 4.277 -11.309 3.733 528 HE1 TYR 69 HE1 TYR 69 6.310 -11.873 -0.744 529 HE2 TYR 69 HE2 TYR 69 4.814 -9.322 2.370 530 HH TYR 69 HH TYR 69 6.096 -9.653 -0.928 531 HA PRO 70 HA PRO 70 0.113 -15.349 5.046 532 HB2 PRO 70 HB2 PRO 70 1.109 -16.349 7.411 533 HB3 PRO 70 HB1 PRO 70 0.701 -17.371 6.016 534 HG2 PRO 70 HG2 PRO 70 3.361 -16.314 6.870 535 HG3 PRO 70 HG1 PRO 70 2.925 -17.935 6.293 536 HD2 PRO 70 HD2 PRO 70 4.109 -16.143 4.680 537 HD3 PRO 70 HD1 PRO 70 2.878 -17.277 4.071 538 H VAL 71 HN VAL 71 2.996 -13.581 5.566 539 HA VAL 71 HA VAL 71 2.080 -12.249 7.990 540 HB VAL 71 HB VAL 71 4.125 -11.269 8.036 541 HG11 VAL 71 HG11 VAL 71 5.702 -12.816 7.436 542 HG12 VAL 71 HG12 VAL 71 5.045 -13.020 5.812 543 HG13 VAL 71 HG13 VAL 71 4.252 -13.789 7.187 544 HG21 VAL 71 HG21 VAL 71 5.253 -10.865 5.566 545 HG22 VAL 71 HG22 VAL 71 4.349 -9.649 6.465 546 HG23 VAL 71 HG23 VAL 71 3.551 -10.600 5.227 547 H ALA 72 HN ALA 72 2.073 -11.438 4.486 548 HA ALA 72 HA ALA 72 0.900 -8.862 4.655 549 HB1 ALA 72 HB1 ALA 72 -0.304 -9.868 2.514 550 HB2 ALA 72 HB2 ALA 72 0.771 -11.229 2.805 551 HB3 ALA 72 HB3 ALA 72 1.442 -9.629 2.494 552 H ASP 73 HN ASP 73 -0.457 -12.121 4.580 553 HA ASP 73 HA ASP 73 -3.196 -11.476 4.962 554 HB2 ASP 73 HB2 ASP 73 -1.348 -13.754 5.383 555 HB3 ASP 73 HB1 ASP 73 -2.902 -13.859 6.194 556 H ILE 74 HN ILE 74 -0.723 -12.456 7.357 557 HA ILE 74 HA ILE 74 -2.138 -12.110 9.755 558 HB ILE 74 HB ILE 74 0.694 -11.467 8.896 559 HG12 ILE 74 HG12 ILE 74 0.773 -13.748 9.064 560 HG13 ILE 74 HG11 ILE 74 0.898 -13.428 10.784 561 HG21 ILE 74 HG21 ILE 74 0.629 -11.737 11.711 562 HG22 ILE 74 HG22 ILE 74 -0.645 -10.594 11.288 563 HG23 ILE 74 HG23 ILE 74 1.017 -10.291 10.779 564 HD11 ILE 74 HD11 ILE 74 -0.818 -15.100 10.425 565 HD12 ILE 74 HD12 ILE 74 -1.631 -14.067 9.249 566 HD13 ILE 74 HD13 ILE 74 -1.590 -13.603 10.950 567 H LEU 75 HN LEU 75 -0.347 -9.712 7.862 568 HA LEU 75 HA LEU 75 -0.857 -7.393 9.375 569 HB2 LEU 75 HB2 LEU 75 0.579 -7.942 7.264 570 HB3 LEU 75 HB1 LEU 75 -0.859 -7.509 6.346 571 HG LEU 75 HG LEU 75 -0.714 -5.421 8.115 572 HD11 LEU 75 HD11 LEU 75 2.099 -6.364 7.530 573 HD12 LEU 75 HD12 LEU 75 1.359 -6.131 9.114 574 HD13 LEU 75 HD13 LEU 75 1.711 -4.738 8.091 575 HD21 LEU 75 HD21 LEU 75 0.654 -5.717 5.423 576 HD22 LEU 75 HD22 LEU 75 0.404 -4.170 6.233 577 HD23 LEU 75 HD23 LEU 75 -0.983 -5.130 5.718 578 H ALA 76 HN ALA 76 -2.950 -9.199 7.179 579 HA ALA 76 HA ALA 76 -5.006 -7.198 6.918 580 HB1 ALA 76 HB1 ALA 76 -5.748 -8.739 5.446 581 HB2 ALA 76 HB2 ALA 76 -5.884 -9.959 6.713 582 HB3 ALA 76 HB3 ALA 76 -4.344 -9.710 5.888 583 H GLU 77 HN GLU 77 -4.425 -9.811 9.262 584 HA GLU 77 HA GLU 77 -7.037 -9.534 10.502 585 HB2 GLU 77 HB2 GLU 77 -6.260 -11.257 11.936 586 HB3 GLU 77 HB1 GLU 77 -5.462 -11.571 10.398 587 HG2 GLU 77 HG2 GLU 77 -3.388 -11.059 11.216 588 HG3 GLU 77 HG1 GLU 77 -3.994 -9.792 12.278 589 H ARG 78 HN ARG 78 -4.038 -7.894 10.737 590 HA ARG 78 HA ARG 78 -5.082 -6.225 12.935 591 HB2 ARG 78 HB2 ARG 78 -2.901 -6.467 14.109 592 HB3 ARG 78 HB1 ARG 78 -3.719 -8.021 13.949 593 HG2 ARG 78 HG2 ARG 78 -2.176 -8.829 12.466 594 HG3 ARG 78 HG1 ARG 78 -1.932 -7.254 11.707 595 HD2 ARG 78 HD2 ARG 78 -0.923 -6.804 14.224 596 HD3 ARG 78 HD1 ARG 78 -0.458 -8.495 13.942 597 HE ARG 78 HE ARG 78 0.260 -6.208 12.155 598 HH11 ARG 78 HH21 ARG 78 1.713 -8.534 13.928 599 HH12 ARG 78 HH22 ARG 78 2.578 -9.291 12.632 600 HH21 ARG 78 HH11 ARG 78 0.862 -7.600 10.140 601 HH22 ARG 78 HH12 ARG 78 2.101 -8.758 10.490 602 H ASN 79 HN ASN 79 -4.870 -5.670 10.154 603 HA ASN 79 HA ASN 79 -2.425 -4.361 9.455 604 HB2 ASN 79 HB2 ASN 79 -4.946 -5.000 8.300 605 HB3 ASN 79 HB1 ASN 79 -4.647 -3.278 8.049 606 HD21 ASN 79 HD21 ASN 79 -4.377 -5.711 6.147 607 HD22 ASN 79 HD22 ASN 79 -2.811 -5.561 5.516 608 H VAL 80 HN VAL 80 -1.730 -2.416 9.822 609 HA VAL 80 HA VAL 80 -3.096 -0.622 11.704 610 HB VAL 80 HB VAL 80 -0.567 -1.451 11.114 611 HG11 VAL 80 HG11 VAL 80 -0.316 -0.289 9.058 612 HG12 VAL 80 HG12 VAL 80 0.635 0.600 10.245 613 HG13 VAL 80 HG13 VAL 80 -0.933 1.207 9.733 614 HG21 VAL 80 HG21 VAL 80 -0.176 1.038 12.316 615 HG22 VAL 80 HG22 VAL 80 -0.461 -0.500 13.132 616 HG23 VAL 80 HG23 VAL 80 -1.815 0.570 12.765 617 HA PRO 81 HA PRO 81 -4.619 2.299 8.721 618 HB2 PRO 81 HB2 PRO 81 -3.072 4.584 8.671 619 HB3 PRO 81 HB1 PRO 81 -4.268 4.236 9.937 620 HG2 PRO 81 HG2 PRO 81 -1.312 3.835 9.971 621 HG3 PRO 81 HG1 PRO 81 -2.379 4.469 11.235 622 HD2 PRO 81 HD2 PRO 81 -1.471 1.959 11.296 623 HD3 PRO 81 HD1 PRO 81 -3.100 2.356 11.877 624 H PHE 82 HN PHE 82 -4.450 1.947 6.542 625 HA PHE 82 HA PHE 82 -2.093 2.380 4.937 626 HB2 PHE 82 HB2 PHE 82 -1.209 0.175 4.867 627 HB3 PHE 82 HB1 PHE 82 -1.536 0.444 6.582 628 HD1 PHE 82 HD1 PHE 82 -4.381 0.135 6.867 629 HD2 PHE 82 HD2 PHE 82 -1.699 -2.060 4.347 630 HE1 PHE 82 HE1 PHE 82 -5.960 -1.746 6.873 631 HE2 PHE 82 HE2 PHE 82 -3.290 -3.955 4.352 632 HZ PHE 82 HZ PHE 82 -5.416 -3.797 5.586 633 H ILE 83 HN ILE 83 -2.459 0.033 3.345 634 HA ILE 83 HA ILE 83 -5.240 -0.153 2.452 635 HB ILE 83 HB ILE 83 -3.117 1.467 1.154 636 HG12 ILE 83 HG12 ILE 83 -4.892 2.660 2.263 637 HG13 ILE 83 HG11 ILE 83 -5.121 2.856 0.529 638 HG21 ILE 83 HG21 ILE 83 -5.163 -0.209 -0.289 639 HG22 ILE 83 HG22 ILE 83 -3.441 -0.050 -0.635 640 HG23 ILE 83 HG23 ILE 83 -4.541 1.278 -1.003 641 HD11 ILE 83 HD11 ILE 83 -6.674 1.143 2.451 642 HD12 ILE 83 HD12 ILE 83 -6.617 0.723 0.740 643 HD13 ILE 83 HD13 ILE 83 -7.274 2.280 1.243 644 H PHE 84 HN PHE 84 -5.377 -1.902 0.795 645 HA PHE 84 HA PHE 84 -2.888 -3.374 0.166 646 HB2 PHE 84 HB2 PHE 84 -4.021 -3.875 2.529 647 HB3 PHE 84 HB1 PHE 84 -5.068 -4.887 1.541 648 HD1 PHE 84 HD2 PHE 84 -3.782 -6.451 -0.216 649 HD2 PHE 84 HD1 PHE 84 -2.029 -4.806 3.353 650 HE1 PHE 84 HE2 PHE 84 -2.073 -8.242 -0.210 651 HE2 PHE 84 HE1 PHE 84 -0.338 -6.609 3.348 652 HZ PHE 84 HZ PHE 84 -0.365 -8.313 1.555 653 H ALA 85 HN ALA 85 -3.230 -4.991 -1.460 654 HA ALA 85 HA ALA 85 -5.880 -5.571 -2.474 655 HB1 ALA 85 HB1 ALA 85 -5.878 -3.456 -3.470 656 HB2 ALA 85 HB2 ALA 85 -5.164 -4.432 -4.755 657 HB3 ALA 85 HB3 ALA 85 -4.130 -3.463 -3.705 658 H THR 86 HN THR 86 -5.730 -7.555 -3.474 659 HA THR 86 HA THR 86 -3.194 -8.304 -4.820 660 HB THR 86 HB THR 86 -2.568 -9.812 -3.222 661 HG1 THR 86 HG1 THR 86 -5.273 -10.373 -2.614 662 HG21 THR 86 HG21 THR 86 -3.452 -9.361 -0.938 663 HG22 THR 86 HG22 THR 86 -4.709 -8.347 -1.648 664 HG23 THR 86 HG23 THR 86 -3.013 -7.882 -1.793 665 H GLY 87 HN GLY 87 -3.586 -10.815 -5.525 666 HA2 GLY 87 HA2 GLY 87 -5.356 -10.930 -7.602 667 HA3 GLY 87 HA1 GLY 87 -4.964 -12.368 -6.658 668 H TYR 88 HN TYR 88 -6.263 -11.703 -4.205 669 HA TYR 88 HA TYR 88 -9.048 -12.122 -5.090 670 HB2 TYR 88 HB2 TYR 88 -9.373 -12.661 -2.658 671 HB3 TYR 88 HB1 TYR 88 -8.143 -13.634 -3.454 672 HD1 TYR 88 HD2 TYR 88 -8.736 -10.853 -1.077 673 HD2 TYR 88 HD1 TYR 88 -5.806 -13.428 -2.881 674 HE1 TYR 88 HE2 TYR 88 -7.063 -10.155 0.613 675 HE2 TYR 88 HE1 TYR 88 -4.143 -12.720 -1.189 676 HH TYR 88 HH TYR 88 -4.773 -10.086 1.006 677 H GLY 89 HN GLY 89 -7.374 -9.807 -2.881 678 HA2 GLY 89 HA2 GLY 89 -8.133 -7.422 -3.107 679 HA3 GLY 89 HA1 GLY 89 -9.773 -8.052 -3.249 680 H SER 90 HN SER 90 -7.007 -8.167 -0.989 681 HA SER 90 HA SER 90 -7.017 -8.352 1.372 682 HB2 SER 90 HB2 SER 90 -8.653 -6.125 0.379 683 HB3 SER 90 HB1 SER 90 -9.042 -6.581 2.036 684 HG SER 90 HG SER 90 -7.362 -5.207 2.230 685 H LYS 91 HN LYS 91 -8.995 -8.201 3.257 686 HA LYS 91 HA LYS 91 -11.121 -10.114 2.493 687 HB2 LYS 91 HB2 LYS 91 -10.493 -11.581 4.344 688 HB3 LYS 91 HB1 LYS 91 -9.080 -11.328 3.317 689 HG2 LYS 91 HG2 LYS 91 -7.978 -10.625 5.152 690 HG3 LYS 91 HG1 LYS 91 -9.024 -9.204 5.148 691 HD2 LYS 91 HD2 LYS 91 -10.696 -10.964 6.319 692 HD3 LYS 91 HD1 LYS 91 -9.155 -11.647 6.839 693 HE2 LYS 91 HE2 LYS 91 -8.948 -10.020 8.396 694 HE3 LYS 91 HE1 LYS 91 -9.053 -8.780 7.130 695 HZ1 LYS 91 HZ1 LYS 91 -10.905 -8.746 8.805 696 HZ2 LYS 91 HZ2 LYS 91 -11.419 -10.235 8.168 697 HZ3 LYS 91 HZ3 LYS 91 -11.400 -8.848 7.187 698 H GLY 92 HN GLY 92 -10.740 -7.194 3.445 699 HA2 GLY 92 HA2 GLY 92 -12.591 -5.982 4.517 700 HA3 GLY 92 HA1 GLY 92 -12.774 -7.342 5.627 701 H LEU 93 HN LEU 93 -9.602 -6.202 4.773 702 HA LEU 93 HA LEU 93 -8.449 -5.992 7.241 703 HB2 LEU 93 HB2 LEU 93 -6.858 -4.633 6.186 704 HB3 LEU 93 HB1 LEU 93 -7.625 -5.442 4.823 705 HG LEU 93 HG LEU 93 -8.301 -2.663 5.846 706 HD11 LEU 93 HD11 LEU 93 -6.374 -3.683 3.920 707 HD12 LEU 93 HD12 LEU 93 -6.578 -2.042 4.533 708 HD13 LEU 93 HD13 LEU 93 -7.529 -2.592 3.156 709 HD21 LEU 93 HD21 LEU 93 -9.794 -2.543 3.912 710 HD22 LEU 93 HD22 LEU 93 -10.249 -3.919 4.912 711 HD23 LEU 93 HD23 LEU 93 -9.337 -4.174 3.429 712 H ASP 94 HN ASP 94 -8.288 -4.378 8.898 713 HA ASP 94 HA ASP 94 -10.523 -2.368 8.860 714 HB2 ASP 94 HB2 ASP 94 -10.641 -2.691 11.231 715 HB3 ASP 94 HB1 ASP 94 -10.461 -4.306 10.541 716 H THR 95 HN THR 95 -10.004 -0.197 9.264 717 HA THR 95 HA THR 95 -7.675 0.749 10.570 718 HB THR 95 HB THR 95 -7.102 -0.507 8.152 719 HG1 THR 95 HG1 THR 95 -5.049 0.489 8.512 720 HG21 THR 95 HG21 THR 95 -6.922 2.475 7.738 721 HG22 THR 95 HG22 THR 95 -7.965 1.366 6.851 722 HG23 THR 95 HG23 THR 95 -6.215 1.251 6.690 723 H ARG 96 HN ARG 96 -7.112 3.117 9.539 724 HA ARG 96 HA ARG 96 -9.530 4.677 9.825 725 HB2 ARG 96 HB2 ARG 96 -6.688 5.318 8.980 726 HB3 ARG 96 HB1 ARG 96 -7.904 6.537 9.377 727 HG2 ARG 96 HG2 ARG 96 -7.497 4.349 11.356 728 HG3 ARG 96 HG1 ARG 96 -6.218 5.558 11.225 729 HD2 ARG 96 HD2 ARG 96 -9.108 6.408 11.443 730 HD3 ARG 96 HD1 ARG 96 -8.152 6.048 12.894 731 HE ARG 96 HE ARG 96 -6.765 7.792 11.003 732 HH11 ARG 96 HH21 ARG 96 -6.805 7.654 14.122 733 HH12 ARG 96 HH22 ARG 96 -7.461 9.217 14.479 734 HH21 ARG 96 HH11 ARG 96 -8.573 9.774 11.237 735 HH22 ARG 96 HH12 ARG 96 -8.466 10.421 12.841 736 H TYR 97 HN TYR 97 -8.836 2.884 7.193 737 HA TYR 97 HA TYR 97 -9.330 5.021 5.187 738 HB2 TYR 97 HB2 TYR 97 -8.422 2.151 5.161 739 HB3 TYR 97 HB1 TYR 97 -8.979 2.917 3.671 740 HD1 TYR 97 HD2 TYR 97 -6.897 3.924 6.625 741 HD2 TYR 97 HD1 TYR 97 -7.262 3.804 2.350 742 HE1 TYR 97 HE2 TYR 97 -4.710 5.068 6.411 743 HE2 TYR 97 HE1 TYR 97 -5.075 4.956 2.134 744 HH TYR 97 HH TYR 97 -3.262 6.020 5.011 745 H SER 98 HN SER 98 -11.243 3.376 7.199 746 HA SER 98 HA SER 98 -13.519 2.810 7.176 747 HB2 SER 98 HB2 SER 98 -13.292 4.404 4.601 748 HB3 SER 98 HB1 SER 98 -14.816 3.976 5.387 749 HG SER 98 HG SER 98 -13.405 6.074 5.870 750 H ASN 99 HN ASN 99 -11.329 1.286 5.421 751 HA ASN 99 HA ASN 99 -11.364 -0.596 3.957 752 HB2 ASN 99 HB2 ASN 99 -13.853 -0.736 5.667 753 HB3 ASN 99 HB1 ASN 99 -13.295 -2.095 4.690 754 HD21 ASN 99 HD21 ASN 99 -10.455 -0.630 5.534 755 HD22 ASN 99 HD22 ASN 99 -10.136 -1.434 6.988 756 H ILE 100 HN ILE 100 -11.678 0.272 1.829 757 HA ILE 100 HA ILE 100 -14.341 -0.188 0.711 758 HB ILE 100 HB ILE 100 -13.819 2.441 -0.156 759 HG12 ILE 100 HG12 ILE 100 -14.132 2.929 2.693 760 HG13 ILE 100 HG11 ILE 100 -12.570 2.188 2.366 761 HG21 ILE 100 HG21 ILE 100 -15.890 2.902 1.238 762 HG22 ILE 100 HG22 ILE 100 -15.782 1.232 1.797 763 HG23 ILE 100 HG23 ILE 100 -16.025 1.575 0.084 764 HD11 ILE 100 HD11 ILE 100 -12.770 4.003 0.319 765 HD12 ILE 100 HD12 ILE 100 -11.892 4.268 1.825 766 HD13 ILE 100 HD13 ILE 100 -13.546 4.856 1.653 767 HA PRO 101 HA PRO 101 -11.480 0.744 -2.885 768 HB2 PRO 101 HB2 PRO 101 -9.059 1.928 -2.512 769 HB3 PRO 101 HB1 PRO 101 -10.581 2.833 -2.591 770 HG2 PRO 101 HG2 PRO 101 -8.864 2.300 -0.292 771 HG3 PRO 101 HG1 PRO 101 -10.109 3.536 -0.509 772 HD2 PRO 101 HD2 PRO 101 -10.295 1.030 0.893 773 HD3 PRO 101 HD1 PRO 101 -11.510 2.310 0.748 774 H LEU 102 HN LEU 102 -11.105 -1.588 -1.058 775 HA LEU 102 HA LEU 102 -8.271 -2.323 -1.612 776 HB2 LEU 102 HB2 LEU 102 -10.457 -3.690 -0.006 777 HB3 LEU 102 HB1 LEU 102 -8.773 -4.200 -0.064 778 HG LEU 102 HG LEU 102 -8.820 -2.939 1.890 779 HD11 LEU 102 HD11 LEU 102 -8.308 -0.688 -0.054 780 HD12 LEU 102 HD12 LEU 102 -7.179 -2.034 0.113 781 HD13 LEU 102 HD13 LEU 102 -7.526 -0.995 1.497 782 HD21 LEU 102 HD21 LEU 102 -10.175 -1.011 2.268 783 HD22 LEU 102 HD22 LEU 102 -11.195 -2.172 1.418 784 HD23 LEU 102 HD23 LEU 102 -10.489 -0.811 0.547 785 H LEU 103 HN LEU 103 -7.725 -4.133 -2.914 786 HA LEU 103 HA LEU 103 -9.584 -6.081 -3.922 787 HB2 LEU 103 HB2 LEU 103 -10.002 -5.158 -6.167 788 HB3 LEU 103 HB1 LEU 103 -10.600 -4.049 -4.935 789 HG LEU 103 HG LEU 103 -7.775 -3.675 -5.765 790 HD11 LEU 103 HD11 LEU 103 -8.832 -4.105 -7.934 791 HD12 LEU 103 HD12 LEU 103 -8.471 -2.386 -7.774 792 HD13 LEU 103 HD13 LEU 103 -10.123 -2.965 -7.554 793 HD21 LEU 103 HD21 LEU 103 -9.923 -2.243 -4.488 794 HD22 LEU 103 HD22 LEU 103 -9.341 -1.319 -5.872 795 HD23 LEU 103 HD23 LEU 103 -8.220 -1.804 -4.601 796 H THR 104 HN THR 104 -8.233 -5.552 -6.768 797 HA THR 104 HA THR 104 -5.654 -6.818 -6.003 798 HB THR 104 HB THR 104 -6.960 -8.431 -7.149 799 HG1 THR 104 HG1 THR 104 -5.427 -8.810 -8.498 800 HG21 THR 104 HG21 THR 104 -8.195 -7.934 -9.227 801 HG22 THR 104 HG22 THR 104 -7.676 -6.254 -9.129 802 HG23 THR 104 HG23 THR 104 -8.747 -6.917 -7.898 803 H LYS 105 HN LYS 105 -5.554 -6.296 -9.267 804 HA LYS 105 HA LYS 105 -4.558 -3.483 -9.010 805 HB2 LYS 105 HB2 LYS 105 -3.125 -6.002 -9.727 806 HB3 LYS 105 HB1 LYS 105 -2.661 -4.520 -10.567 807 HG2 LYS 105 HG2 LYS 105 -1.942 -3.475 -8.617 808 HG3 LYS 105 HG1 LYS 105 -2.984 -4.461 -7.588 809 HD2 LYS 105 HD2 LYS 105 -0.766 -5.252 -7.222 810 HD3 LYS 105 HD1 LYS 105 -1.539 -6.454 -8.256 811 HE2 LYS 105 HE2 LYS 105 -0.381 -4.422 -9.932 812 HE3 LYS 105 HE1 LYS 105 0.852 -5.007 -8.796 813 HZ1 LYS 105 HZ1 LYS 105 0.086 -7.295 -9.318 814 HZ2 LYS 105 HZ2 LYS 105 0.798 -6.502 -10.640 815 HZ3 LYS 105 HZ3 LYS 105 -0.893 -6.653 -10.548 816 HA PRO 106 HA PRO 106 -6.767 -4.269 -13.012 817 HB2 PRO 106 HB2 PRO 106 -9.216 -3.197 -12.429 818 HB3 PRO 106 HB1 PRO 106 -8.827 -4.903 -12.143 819 HG2 PRO 106 HG2 PRO 106 -9.167 -2.720 -10.221 820 HG3 PRO 106 HG1 PRO 106 -9.279 -4.467 -9.979 821 HD2 PRO 106 HD2 PRO 106 -7.096 -2.744 -9.325 822 HD3 PRO 106 HD1 PRO 106 -7.192 -4.502 -9.128 823 H PHE 107 HN PHE 107 -6.199 -1.729 -10.798 824 HA PHE 107 HA PHE 107 -5.753 0.550 -11.064 825 HB2 PHE 107 HB2 PHE 107 -5.259 -0.735 -13.718 826 HB3 PHE 107 HB1 PHE 107 -5.186 1.029 -13.613 827 HD1 PHE 107 HD2 PHE 107 -4.115 -1.934 -11.567 828 HD2 PHE 107 HD1 PHE 107 -3.096 1.946 -13.105 829 HE1 PHE 107 HE2 PHE 107 -1.903 -2.081 -10.457 830 HE2 PHE 107 HE1 PHE 107 -0.885 1.803 -11.992 831 HZ PHE 107 HZ PHE 107 -0.279 -0.204 -10.666 832 H LEU 108 HN LEU 108 -8.336 0.060 -10.735 833 HA LEU 108 HA LEU 108 -9.661 2.181 -12.310 834 HB2 LEU 108 HB2 LEU 108 -10.216 0.263 -13.641 835 HB3 LEU 108 HB1 LEU 108 -10.444 -0.748 -12.215 836 HG LEU 108 HG LEU 108 -12.549 0.160 -13.468 837 HD11 LEU 108 HD11 LEU 108 -12.664 0.791 -10.552 838 HD12 LEU 108 HD12 LEU 108 -12.188 -0.841 -11.022 839 HD13 LEU 108 HD13 LEU 108 -13.747 -0.195 -11.535 840 HD21 LEU 108 HD21 LEU 108 -13.137 2.367 -13.205 841 HD22 LEU 108 HD22 LEU 108 -11.386 2.567 -13.139 842 HD23 LEU 108 HD23 LEU 108 -12.324 2.507 -11.647 843 H ASP 109 HN ASP 109 -9.998 -0.385 -9.880 844 HA ASP 109 HA ASP 109 -11.551 1.485 -8.127 845 HB2 ASP 109 HB2 ASP 109 -12.120 -1.064 -9.031 846 HB3 ASP 109 HB1 ASP 109 -11.400 -1.385 -7.453 847 H SER 110 HN SER 110 -8.518 0.111 -8.638 848 HA SER 110 HA SER 110 -7.679 -0.444 -5.923 849 HB2 SER 110 HB2 SER 110 -6.709 -1.415 -7.980 850 HB3 SER 110 HB1 SER 110 -6.162 0.186 -8.474 851 HG SER 110 HG SER 110 -4.937 -1.551 -6.901 852 H GLU 111 HN GLU 111 -5.136 1.277 -6.801 853 HA GLU 111 HA GLU 111 -5.032 3.239 -4.927 854 HB2 GLU 111 HB2 GLU 111 -3.639 2.590 -7.162 855 HB3 GLU 111 HB1 GLU 111 -4.317 4.138 -7.669 856 HG2 GLU 111 HG2 GLU 111 -3.388 4.416 -4.978 857 HG3 GLU 111 HG1 GLU 111 -2.099 3.680 -5.932 858 H LEU 112 HN LEU 112 -6.636 3.690 -8.085 859 HA LEU 112 HA LEU 112 -7.534 6.310 -7.952 860 HB2 LEU 112 HB2 LEU 112 -9.298 3.950 -8.685 861 HB3 LEU 112 HB1 LEU 112 -9.348 5.572 -9.369 862 HG LEU 112 HG LEU 112 -7.163 3.510 -9.701 863 HD11 LEU 112 HD11 LEU 112 -7.942 3.236 -11.835 864 HD12 LEU 112 HD12 LEU 112 -8.421 4.927 -11.986 865 HD13 LEU 112 HD13 LEU 112 -9.454 3.792 -11.117 866 HD21 LEU 112 HD21 LEU 112 -5.737 5.258 -9.885 867 HD22 LEU 112 HD22 LEU 112 -7.057 6.421 -9.768 868 HD23 LEU 112 HD23 LEU 112 -6.628 5.730 -11.333 869 H GLU 113 HN GLU 113 -9.614 3.609 -6.892 870 HA GLU 113 HA GLU 113 -11.337 5.202 -5.260 871 HB2 GLU 113 HB2 GLU 113 -11.072 2.544 -6.137 872 HB3 GLU 113 HB1 GLU 113 -10.971 2.443 -4.373 873 HG2 GLU 113 HG2 GLU 113 -13.155 2.925 -4.136 874 HG3 GLU 113 HG1 GLU 113 -13.031 4.313 -5.217 875 H ALA 114 HN ALA 114 -8.279 3.571 -4.687 876 HA ALA 114 HA ALA 114 -8.242 3.577 -1.846 877 HB1 ALA 114 HB1 ALA 114 -6.049 2.946 -2.184 878 HB2 ALA 114 HB2 ALA 114 -5.761 4.230 -3.359 879 HB3 ALA 114 HB3 ALA 114 -6.614 2.765 -3.846 880 H VAL 115 HN VAL 115 -7.537 6.124 -4.186 881 HA VAL 115 HA VAL 115 -6.974 8.001 -1.924 882 HB VAL 115 HB VAL 115 -6.474 8.490 -4.860 883 HG11 VAL 115 HG11 VAL 115 -5.797 10.435 -3.912 884 HG12 VAL 115 HG12 VAL 115 -4.403 9.516 -3.343 885 HG13 VAL 115 HG13 VAL 115 -5.800 9.742 -2.290 886 HG21 VAL 115 HG21 VAL 115 -5.193 6.528 -3.080 887 HG22 VAL 115 HG22 VAL 115 -4.055 7.660 -3.813 888 HG23 VAL 115 HG23 VAL 115 -5.104 6.677 -4.836 889 H LEU 116 HN LEU 116 -9.246 7.330 -4.499 890 HA LEU 116 HA LEU 116 -10.384 10.053 -4.367 891 HB2 LEU 116 HB2 LEU 116 -11.182 9.535 -6.431 892 HB3 LEU 116 HB1 LEU 116 -10.059 8.184 -6.339 893 HG LEU 116 HG LEU 116 -12.093 6.997 -5.118 894 HD11 LEU 116 HD11 LEU 116 -13.208 9.493 -6.114 895 HD12 LEU 116 HD12 LEU 116 -13.950 8.283 -5.067 896 HD13 LEU 116 HD13 LEU 116 -14.030 8.101 -6.820 897 HD21 LEU 116 HD21 LEU 116 -10.948 6.612 -7.450 898 HD22 LEU 116 HD22 LEU 116 -12.393 7.396 -8.087 899 HD23 LEU 116 HD23 LEU 116 -12.537 5.909 -7.149 900 H VAL 117 HN VAL 117 -10.857 7.122 -2.662 901 HA VAL 117 HA VAL 117 -13.726 7.700 -2.146 902 HB VAL 117 HB VAL 117 -12.007 5.480 -1.082 903 HG11 VAL 117 HG11 VAL 117 -14.101 5.676 0.082 904 HG12 VAL 117 HG12 VAL 117 -14.262 4.329 -1.046 905 HG13 VAL 117 HG13 VAL 117 -14.979 5.893 -1.431 906 HG21 VAL 117 HG21 VAL 117 -12.438 4.207 -2.999 907 HG22 VAL 117 HG22 VAL 117 -12.142 5.804 -3.681 908 HG23 VAL 117 HG23 VAL 117 -13.796 5.223 -3.483 909 H GLN 118 HN GLN 118 -10.695 8.474 -0.807 910 HA GLN 118 HA GLN 118 -12.028 9.160 1.789 911 HB2 GLN 118 HB2 GLN 118 -10.305 7.113 1.518 912 HB3 GLN 118 HB1 GLN 118 -9.139 8.417 1.744 913 HG2 GLN 118 HG2 GLN 118 -9.733 7.444 3.915 914 HG3 GLN 118 HG1 GLN 118 -10.330 9.100 3.814 915 HE21 GLN 118 HE21 GLN 118 -12.136 6.902 1.850 916 HE22 GLN 118 HE22 GLN 118 -13.450 6.702 2.905 917 H ILE 119 HN ILE 119 -12.010 11.145 0.034 918 HA ILE 119 HA ILE 119 -9.511 12.729 0.504 919 HB ILE 119 HB ILE 119 -9.706 13.102 -1.724 920 HG12 ILE 119 HG12 ILE 119 -10.857 15.180 -0.802 921 HG13 ILE 119 HG11 ILE 119 -11.204 14.796 -2.487 922 HG21 ILE 119 HG21 ILE 119 -11.464 12.212 -3.090 923 HG22 ILE 119 HG22 ILE 119 -12.576 12.147 -1.723 924 HG23 ILE 119 HG23 ILE 119 -11.190 11.058 -1.784 925 HD11 ILE 119 HD11 ILE 119 -13.050 15.046 -0.308 926 HD12 ILE 119 HD12 ILE 119 -13.093 13.381 -0.888 927 HD13 ILE 119 HD13 ILE 119 -13.398 14.712 -2.004 928 H SER 120 HN SER 120 -12.903 12.507 1.166 929 HA SER 120 HA SER 120 -12.877 15.202 2.492 930 HB2 SER 120 HB2 SER 120 -14.573 14.971 0.771 931 HB3 SER 120 HB1 SER 120 -15.061 13.402 1.395 932 HG SER 120 HG SER 120 -16.019 15.751 2.042 933 H LYS 121 HN LYS 121 -15.151 12.608 3.074 934 HA LYS 121 HA LYS 121 -15.754 11.507 5.055 935 HB2 LYS 121 HB2 LYS 121 -13.540 10.524 4.201 936 HB3 LYS 121 HB1 LYS 121 -12.765 11.454 5.484 937 HG2 LYS 121 HG2 LYS 121 -13.210 9.222 6.328 938 HG3 LYS 121 HG1 LYS 121 -14.302 10.350 7.132 939 HD2 LYS 121 HD2 LYS 121 -15.536 9.461 4.701 940 HD3 LYS 121 HD1 LYS 121 -14.992 8.049 5.607 941 HE2 LYS 121 HE2 LYS 121 -16.062 9.428 7.650 942 HE3 LYS 121 HE1 LYS 121 -17.059 10.077 6.332 943 HZ1 LYS 121 HZ1 LYS 121 -17.989 8.084 5.930 944 HZ2 LYS 121 HZ2 LYS 121 -17.516 7.718 7.520 945 HZ3 LYS 121 HZ3 LYS 121 -16.552 7.227 6.210 946 H GLU 122 HN GLU 122 -16.716 12.906 6.508 947 HA GLU 122 HA GLU 122 -16.913 14.574 8.183 948 HB2 GLU 122 HB2 GLU 122 -15.704 13.848 10.174 949 HB3 GLU 122 HB1 GLU 122 -16.216 12.418 9.279 950 HG2 GLU 122 HG2 GLU 122 -14.018 12.091 8.375 951 HG3 GLU 122 HG1 GLU 122 -13.479 13.668 8.953 952 H VAL 123 HN VAL 123 -15.404 15.390 5.958 953 HA VAL 123 HA VAL 123 -13.127 16.472 5.616 954 HB VAL 123 HB VAL 123 -15.068 17.497 4.634 955 HG11 VAL 123 HG11 VAL 123 -16.838 18.129 5.875 956 HG12 VAL 123 HG12 VAL 123 -15.849 19.283 6.770 957 HG13 VAL 123 HG13 VAL 123 -15.955 17.608 7.310 958 HG21 VAL 123 HG21 VAL 123 -13.147 18.953 4.571 959 HG22 VAL 123 HG22 VAL 123 -13.405 19.460 6.240 960 HG23 VAL 123 HG23 VAL 123 -14.538 19.954 4.982 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 17.968 14.209 -0.497 2 H2 GLY 1 HT2 GLY 1 18.460 15.731 -1.069 3 H3 GLY 1 HT3 GLY 1 16.944 15.103 -1.510 4 HA2 GLY 1 HA2 GLY 1 15.978 15.978 0.259 5 HA3 GLY 1 HA1 GLY 1 17.148 15.173 1.306 6 H SER 2 HN SER 2 15.975 18.067 1.018 7 HA SER 2 HA SER 2 18.465 19.401 1.834 8 HB2 SER 2 HB2 SER 2 18.191 19.301 -0.777 9 HB3 SER 2 HB1 SER 2 16.988 20.560 -0.520 10 HG SER 2 HG SER 2 18.621 21.743 0.593 11 H HIS 3 HN HIS 3 15.028 19.692 0.958 12 HA HIS 3 HA HIS 3 14.739 22.042 2.765 13 HB2 HIS 3 HB2 HIS 3 13.117 20.694 0.614 14 HB3 HIS 3 HB1 HIS 3 12.351 21.839 1.714 15 HD1 HIS 3 HD1 HIS 3 12.673 22.503 -1.304 16 HD2 HIS 3 HD2 HIS 3 15.379 23.668 1.645 17 HE1 HIS 3 HE1 HIS 3 13.916 24.508 -2.225 18 H MET 4 HN MET 4 15.276 20.126 4.458 19 HA MET 4 HA MET 4 14.483 18.527 6.036 20 HB2 MET 4 HB2 MET 4 13.229 19.747 7.571 21 HB3 MET 4 HB1 MET 4 13.854 21.039 6.551 22 HG2 MET 4 HG2 MET 4 11.519 20.283 5.249 23 HG3 MET 4 HG1 MET 4 11.090 20.156 6.951 24 HE1 MET 4 HE1 MET 4 9.656 21.875 7.568 25 HE2 MET 4 HE2 MET 4 10.235 23.495 7.944 26 HE3 MET 4 HE3 MET 4 11.043 22.096 8.644 27 H THR 5 HN THR 5 11.725 18.203 6.861 28 HA THR 5 HA THR 5 10.545 16.877 4.445 29 HB THR 5 HB THR 5 9.833 15.145 6.288 30 HG1 THR 5 HG1 THR 5 11.444 15.072 7.940 31 HG21 THR 5 HG21 THR 5 12.778 15.120 5.742 32 HG22 THR 5 HG22 THR 5 11.660 15.060 4.379 33 HG23 THR 5 HG23 THR 5 11.605 13.808 5.619 34 H GLU 6 HN GLU 6 8.198 16.622 4.589 35 HA GLU 6 HA GLU 6 6.707 17.883 6.764 36 HB2 GLU 6 HB2 GLU 6 5.773 19.639 5.171 37 HB3 GLU 6 HB1 GLU 6 7.456 19.878 5.639 38 HG2 GLU 6 HG2 GLU 6 7.978 18.460 3.495 39 HG3 GLU 6 HG1 GLU 6 6.343 18.920 3.015 40 H ARG 7 HN ARG 7 6.740 15.313 5.415 41 HA ARG 7 HA ARG 7 3.888 15.117 4.716 42 HB2 ARG 7 HB2 ARG 7 4.628 13.980 2.491 43 HB3 ARG 7 HB1 ARG 7 4.673 15.740 2.569 44 HG2 ARG 7 HG2 ARG 7 7.128 15.483 3.300 45 HG3 ARG 7 HG1 ARG 7 6.988 13.807 2.774 46 HD2 ARG 7 HD2 ARG 7 7.096 14.393 0.576 47 HD3 ARG 7 HD1 ARG 7 5.950 15.730 0.799 48 HE ARG 7 HE ARG 7 7.781 17.164 1.406 49 HH11 ARG 7 HH11 ARG 7 8.867 14.027 1.950 50 HH12 ARG 7 HH12 ARG 7 10.476 14.302 1.372 51 HH21 ARG 7 HH21 ARG 7 9.788 17.475 0.167 52 HH22 ARG 7 HH22 ARG 7 10.995 16.249 0.360 53 H ARG 8 HN ARG 8 4.991 13.972 6.888 54 HA ARG 8 HA ARG 8 6.344 11.532 6.777 55 HB2 ARG 8 HB2 ARG 8 4.718 13.041 8.578 56 HB3 ARG 8 HB1 ARG 8 4.202 11.356 8.667 57 HG2 ARG 8 HG2 ARG 8 6.167 10.667 9.594 58 HG3 ARG 8 HG1 ARG 8 7.132 11.764 8.603 59 HD2 ARG 8 HD2 ARG 8 7.257 12.460 10.963 60 HD3 ARG 8 HD1 ARG 8 6.339 13.671 10.045 61 HE ARG 8 HE ARG 8 4.289 12.201 10.791 62 HH11 ARG 8 HH21 ARG 8 5.137 14.357 12.706 63 HH12 ARG 8 HH22 ARG 8 5.282 13.477 14.191 64 HH21 ARG 8 HH11 ARG 8 5.362 10.371 12.648 65 HH22 ARG 8 HH12 ARG 8 5.420 11.220 14.157 66 H LEU 9 HN LEU 9 3.121 12.219 5.629 67 HA LEU 9 HA LEU 9 1.903 9.663 5.802 68 HB2 LEU 9 HB2 LEU 9 1.750 11.905 3.764 69 HB3 LEU 9 HB1 LEU 9 0.628 10.545 3.787 70 HG LEU 9 HG LEU 9 1.099 12.392 6.143 71 HD11 LEU 9 HD11 LEU 9 -1.529 12.588 4.994 72 HD12 LEU 9 HD12 LEU 9 -0.330 12.878 3.734 73 HD13 LEU 9 HD13 LEU 9 -0.323 13.858 5.200 74 HD21 LEU 9 HD21 LEU 9 0.290 10.129 6.715 75 HD22 LEU 9 HD22 LEU 9 -1.035 10.309 5.565 76 HD23 LEU 9 HD23 LEU 9 -0.965 11.334 6.998 77 H ARG 10 HN ARG 10 2.326 7.743 4.698 78 HA ARG 10 HA ARG 10 3.626 7.838 2.074 79 HB2 ARG 10 HB2 ARG 10 5.373 8.094 3.942 80 HB3 ARG 10 HB1 ARG 10 5.021 6.415 4.346 81 HG2 ARG 10 HG2 ARG 10 6.988 6.745 2.787 82 HG3 ARG 10 HG1 ARG 10 5.741 5.659 2.180 83 HD2 ARG 10 HD2 ARG 10 4.935 8.200 1.300 84 HD3 ARG 10 HD1 ARG 10 6.671 8.170 1.038 85 HE ARG 10 HE ARG 10 5.564 5.659 0.248 86 HH11 ARG 10 HH21 ARG 10 7.516 7.426 -1.286 87 HH12 ARG 10 HH22 ARG 10 6.590 7.798 -2.701 88 HH21 ARG 10 HH11 ARG 10 3.572 6.813 -1.297 89 HH22 ARG 10 HH12 ARG 10 4.350 7.444 -2.709 90 H VAL 11 HN VAL 11 4.115 5.498 1.319 91 HA VAL 11 HA VAL 11 2.261 3.499 2.505 92 HB VAL 11 HB VAL 11 1.162 3.230 0.313 93 HG11 VAL 11 HG11 VAL 11 0.455 5.011 2.058 94 HG12 VAL 11 HG12 VAL 11 -0.187 5.168 0.423 95 HG13 VAL 11 HG13 VAL 11 1.159 6.181 0.942 96 HG21 VAL 11 HG21 VAL 11 1.916 5.554 -1.068 97 HG22 VAL 11 HG22 VAL 11 2.335 3.895 -1.498 98 HG23 VAL 11 HG23 VAL 11 3.434 4.853 -0.505 99 H LEU 12 HN LEU 12 3.540 1.671 2.665 100 HA LEU 12 HA LEU 12 5.715 1.251 0.692 101 HB2 LEU 12 HB2 LEU 12 4.883 -0.421 3.088 102 HB3 LEU 12 HB1 LEU 12 6.431 -0.473 2.251 103 HG LEU 12 HG LEU 12 5.468 1.409 4.317 104 HD11 LEU 12 HD11 LEU 12 8.020 0.186 3.356 105 HD12 LEU 12 HD12 LEU 12 7.337 0.225 4.980 106 HD13 LEU 12 HD13 LEU 12 8.114 1.661 4.316 107 HD21 LEU 12 HD21 LEU 12 7.131 3.172 3.278 108 HD22 LEU 12 HD22 LEU 12 5.456 3.143 2.736 109 HD23 LEU 12 HD23 LEU 12 6.712 2.391 1.754 110 H VAL 13 HN VAL 13 4.883 0.421 -1.215 111 HA VAL 13 HA VAL 13 2.828 -1.750 -1.017 112 HB VAL 13 HB VAL 13 3.530 -0.219 -3.517 113 HG11 VAL 13 HG11 VAL 13 0.749 -0.849 -2.698 114 HG12 VAL 13 HG12 VAL 13 1.784 -2.234 -3.051 115 HG13 VAL 13 HG13 VAL 13 1.516 -0.995 -4.278 116 HG21 VAL 13 HG21 VAL 13 1.666 1.389 -2.820 117 HG22 VAL 13 HG22 VAL 13 3.206 1.592 -1.983 118 HG23 VAL 13 HG23 VAL 13 1.868 0.764 -1.183 119 H VAL 14 HN VAL 14 3.439 -3.775 -1.787 120 HA VAL 14 HA VAL 14 5.880 -3.895 -3.473 121 HB VAL 14 HB VAL 14 7.015 -5.239 -1.919 122 HG11 VAL 14 HG11 VAL 14 6.579 -2.824 -1.179 123 HG12 VAL 14 HG12 VAL 14 7.133 -3.955 0.055 124 HG13 VAL 14 HG13 VAL 14 5.429 -3.517 -0.036 125 HG21 VAL 14 HG21 VAL 14 4.278 -5.811 -0.871 126 HG22 VAL 14 HG22 VAL 14 5.660 -6.010 0.203 127 HG23 VAL 14 HG23 VAL 14 5.563 -6.941 -1.293 128 H GLU 15 HN GLU 15 5.836 -5.469 -4.957 129 HA GLU 15 HA GLU 15 4.093 -7.832 -4.736 130 HB2 GLU 15 HB2 GLU 15 3.001 -7.240 -6.936 131 HB3 GLU 15 HB1 GLU 15 2.555 -6.162 -5.608 132 HG2 GLU 15 HG2 GLU 15 3.442 -4.385 -6.673 133 HG3 GLU 15 HG1 GLU 15 4.966 -5.233 -6.933 134 H ASP 16 HN ASP 16 4.750 -9.448 -6.271 135 HA ASP 16 HA ASP 16 7.453 -9.725 -6.851 136 HB2 ASP 16 HB2 ASP 16 6.613 -11.411 -8.510 137 HB3 ASP 16 HB1 ASP 16 5.834 -11.511 -6.929 138 H GLU 17 HN GLU 17 5.253 -7.644 -8.584 139 HA GLU 17 HA GLU 17 6.971 -7.698 -11.004 140 HB2 GLU 17 HB2 GLU 17 4.223 -6.966 -10.259 141 HB3 GLU 17 HB1 GLU 17 4.964 -5.861 -11.419 142 HG2 GLU 17 HG2 GLU 17 4.199 -7.430 -12.912 143 HG3 GLU 17 HG1 GLU 17 5.738 -8.196 -12.512 144 H SER 18 HN SER 18 7.815 -5.721 -11.919 145 HA SER 18 HA SER 18 8.759 -3.794 -9.864 146 HB2 SER 18 HB2 SER 18 9.876 -5.058 -12.068 147 HB3 SER 18 HB1 SER 18 9.550 -3.435 -12.672 148 HG SER 18 HG SER 18 11.528 -4.221 -11.124 149 H MET 19 HN MET 19 6.251 -4.099 -12.143 150 HA MET 19 HA MET 19 6.000 -1.480 -13.198 151 HB2 MET 19 HB2 MET 19 4.636 -3.825 -13.359 152 HB3 MET 19 HB1 MET 19 3.550 -2.916 -12.307 153 HG2 MET 19 HG2 MET 19 2.921 -1.507 -13.974 154 HG3 MET 19 HG1 MET 19 4.564 -1.369 -14.600 155 HE1 MET 19 HE1 MET 19 5.764 -3.292 -15.223 156 HE2 MET 19 HE2 MET 19 5.365 -3.476 -16.929 157 HE3 MET 19 HE3 MET 19 5.146 -4.836 -15.830 158 H ILE 20 HN ILE 20 5.409 -2.756 -9.987 159 HA ILE 20 HA ILE 20 3.831 -0.484 -9.045 160 HB ILE 20 HB ILE 20 3.651 -2.726 -8.084 161 HG12 ILE 20 HG12 ILE 20 5.000 -0.880 -6.094 162 HG13 ILE 20 HG11 ILE 20 3.320 -0.710 -6.618 163 HG21 ILE 20 HG21 ILE 20 5.799 -3.255 -6.551 164 HG22 ILE 20 HG22 ILE 20 6.594 -2.413 -7.882 165 HG23 ILE 20 HG23 ILE 20 5.630 -3.855 -8.199 166 HD11 ILE 20 HD11 ILE 20 2.718 -2.828 -5.682 167 HD12 ILE 20 HD12 ILE 20 3.670 -2.005 -4.447 168 HD13 ILE 20 HD13 ILE 20 4.406 -3.271 -5.429 169 H ALA 21 HN ALA 21 7.197 -1.296 -9.342 170 HA ALA 21 HA ALA 21 8.399 0.374 -7.401 171 HB1 ALA 21 HB1 ALA 21 9.398 -1.392 -8.917 172 HB2 ALA 21 HB2 ALA 21 10.347 0.092 -8.813 173 HB3 ALA 21 HB3 ALA 21 9.337 -0.213 -10.222 174 H MET 22 HN MET 22 8.325 1.164 -10.891 175 HA MET 22 HA MET 22 8.669 3.996 -10.426 176 HB2 MET 22 HB2 MET 22 9.014 2.286 -12.502 177 HB3 MET 22 HB1 MET 22 7.464 2.996 -12.960 178 HG2 MET 22 HG2 MET 22 8.706 4.681 -13.835 179 HG3 MET 22 HG1 MET 22 8.896 5.208 -12.163 180 HE1 MET 22 HE1 MET 22 12.473 5.860 -12.951 181 HE2 MET 22 HE2 MET 22 11.000 6.320 -12.102 182 HE3 MET 22 HE3 MET 22 11.023 6.302 -13.865 183 H LEU 23 HN LEU 23 5.923 1.884 -10.572 184 HA LEU 23 HA LEU 23 3.880 3.809 -11.220 185 HB2 LEU 23 HB2 LEU 23 3.409 1.497 -11.441 186 HB3 LEU 23 HB1 LEU 23 4.066 1.130 -9.851 187 HG LEU 23 HG LEU 23 1.512 1.075 -10.095 188 HD11 LEU 23 HD11 LEU 23 1.661 1.167 -7.859 189 HD12 LEU 23 HD12 LEU 23 1.712 2.929 -7.939 190 HD13 LEU 23 HD13 LEU 23 3.211 2.000 -7.988 191 HD21 LEU 23 HD21 LEU 23 2.058 3.792 -10.926 192 HD22 LEU 23 HD22 LEU 23 1.010 3.785 -9.510 193 HD23 LEU 23 HD23 LEU 23 0.537 2.905 -10.963 194 H ILE 24 HN ILE 24 5.915 3.528 -8.535 195 HA ILE 24 HA ILE 24 3.934 4.747 -6.673 196 HB ILE 24 HB ILE 24 5.825 2.714 -6.463 197 HG12 ILE 24 HG12 ILE 24 5.214 3.912 -3.885 198 HG13 ILE 24 HG11 ILE 24 3.798 3.898 -4.937 199 HG21 ILE 24 HG21 ILE 24 7.676 4.308 -6.357 200 HG22 ILE 24 HG22 ILE 24 7.454 3.533 -4.789 201 HG23 ILE 24 HG23 ILE 24 6.876 5.178 -5.050 202 HD11 ILE 24 HD11 ILE 24 3.556 1.677 -4.673 203 HD12 ILE 24 HD12 ILE 24 4.850 1.726 -3.477 204 HD13 ILE 24 HD13 ILE 24 5.225 1.396 -5.169 205 H GLU 25 HN GLU 25 7.255 5.212 -7.928 206 HA GLU 25 HA GLU 25 7.844 7.694 -6.715 207 HB2 GLU 25 HB2 GLU 25 8.734 6.046 -8.927 208 HB3 GLU 25 HB1 GLU 25 8.841 7.754 -9.354 209 HG2 GLU 25 HG2 GLU 25 9.753 7.535 -6.684 210 HG3 GLU 25 HG1 GLU 25 10.534 6.237 -7.588 211 H ASP 26 HN ASP 26 5.755 6.941 -9.446 212 HA ASP 26 HA ASP 26 5.412 9.728 -10.269 213 HB2 ASP 26 HB2 ASP 26 4.112 8.761 -11.979 214 HB3 ASP 26 HB1 ASP 26 5.254 7.474 -11.591 215 H THR 27 HN THR 27 3.559 7.343 -8.377 216 HA THR 27 HA THR 27 1.190 8.893 -8.024 217 HB THR 27 HB THR 27 1.000 7.356 -5.976 218 HG1 THR 27 HG1 THR 27 2.611 5.876 -5.712 219 HG21 THR 27 HG21 THR 27 -0.069 6.295 -7.674 220 HG22 THR 27 HG22 THR 27 1.368 5.273 -7.715 221 HG23 THR 27 HG23 THR 27 1.222 6.637 -8.825 222 H LEU 28 HN LEU 28 3.948 8.410 -5.784 223 HA LEU 28 HA LEU 28 3.170 10.332 -3.851 224 HB2 LEU 28 HB2 LEU 28 5.003 9.351 -2.953 225 HB3 LEU 28 HB1 LEU 28 5.377 8.632 -4.511 226 HG LEU 28 HG LEU 28 6.128 11.494 -3.953 227 HD11 LEU 28 HD11 LEU 28 8.179 10.847 -2.950 228 HD12 LEU 28 HD12 LEU 28 7.949 9.153 -3.384 229 HD13 LEU 28 HD13 LEU 28 6.957 9.882 -2.123 230 HD21 LEU 28 HD21 LEU 28 6.815 11.205 -6.093 231 HD22 LEU 28 HD22 LEU 28 6.579 9.460 -6.008 232 HD23 LEU 28 HD23 LEU 28 8.086 10.174 -5.436 233 H CYS 29 HN CYS 29 4.822 10.701 -6.957 234 HA CYS 29 HA CYS 29 5.846 13.305 -6.777 235 HB2 CYS 29 HB2 CYS 29 5.445 11.408 -8.712 236 HB3 CYS 29 HB1 CYS 29 4.300 12.650 -9.217 237 HG CYS 29 HG CYS 29 7.226 13.534 -8.636 238 H GLU 30 HN GLU 30 2.504 12.227 -7.187 239 HA GLU 30 HA GLU 30 1.489 14.968 -7.429 240 HB2 GLU 30 HB2 GLU 30 0.498 13.219 -8.777 241 HB3 GLU 30 HB1 GLU 30 0.244 12.208 -7.353 242 HG2 GLU 30 HG2 GLU 30 -1.507 13.532 -6.557 243 HG3 GLU 30 HG1 GLU 30 -0.977 14.951 -7.464 244 H LEU 31 HN LEU 31 1.604 12.345 -5.041 245 HA LEU 31 HA LEU 31 -0.133 13.734 -3.133 246 HB2 LEU 31 HB2 LEU 31 1.759 11.409 -2.674 247 HB3 LEU 31 HB1 LEU 31 0.294 11.796 -1.768 248 HG LEU 31 HG LEU 31 0.433 10.918 -4.667 249 HD11 LEU 31 HD11 LEU 31 0.785 9.125 -2.982 250 HD12 LEU 31 HD12 LEU 31 -0.743 8.926 -3.841 251 HD13 LEU 31 HD13 LEU 31 -0.731 9.581 -2.204 252 HD21 LEU 31 HD21 LEU 31 -1.568 12.396 -3.188 253 HD22 LEU 31 HD22 LEU 31 -2.204 10.823 -3.669 254 HD23 LEU 31 HD23 LEU 31 -1.571 11.928 -4.888 255 H GLY 32 HN GLY 32 3.370 13.190 -3.520 256 HA2 GLY 32 HA2 GLY 32 5.113 14.593 -2.673 257 HA3 GLY 32 HA1 GLY 32 3.901 15.496 -1.746 258 H HIS 33 HN HIS 33 4.456 12.024 -1.900 259 HA HIS 33 HA HIS 33 4.350 11.791 1.019 260 HB2 HIS 33 HB2 HIS 33 4.180 10.164 -1.432 261 HB3 HIS 33 HB1 HIS 33 4.915 9.327 -0.061 262 HD1 HIS 33 HD1 HIS 33 2.228 8.282 -0.860 263 HD2 HIS 33 HD2 HIS 33 2.613 11.491 1.773 264 HE1 HIS 33 HE1 HIS 33 0.065 8.397 0.453 265 H GLU 34 HN GLU 34 6.092 10.066 1.913 266 HA GLU 34 HA GLU 34 8.721 11.347 1.476 267 HB2 GLU 34 HB2 GLU 34 7.360 10.314 3.635 268 HB3 GLU 34 HB1 GLU 34 8.536 9.045 3.302 269 HG2 GLU 34 HG2 GLU 34 10.271 10.953 3.145 270 HG3 GLU 34 HG1 GLU 34 9.053 11.943 3.950 271 H VAL 35 HN VAL 35 8.247 7.858 2.039 272 HA VAL 35 HA VAL 35 9.441 7.229 -0.606 273 HB VAL 35 HB VAL 35 11.193 5.865 0.632 274 HG11 VAL 35 HG11 VAL 35 11.451 8.275 -0.295 275 HG12 VAL 35 HG12 VAL 35 12.654 7.709 0.864 276 HG13 VAL 35 HG13 VAL 35 11.356 8.781 1.392 277 HG21 VAL 35 HG21 VAL 35 10.998 5.651 2.867 278 HG22 VAL 35 HG22 VAL 35 9.566 6.678 2.839 279 HG23 VAL 35 HG23 VAL 35 11.162 7.397 3.048 280 H ALA 36 HN ALA 36 8.023 5.663 -1.341 281 HA ALA 36 HA ALA 36 6.554 3.968 0.544 282 HB1 ALA 36 HB1 ALA 36 6.505 4.707 -2.342 283 HB2 ALA 36 HB2 ALA 36 5.177 4.639 -1.187 284 HB3 ALA 36 HB3 ALA 36 5.791 3.156 -1.909 285 H ALA 37 HN ALA 37 6.300 1.645 -1.005 286 HA ALA 37 HA ALA 37 9.086 0.510 -0.944 287 HB1 ALA 37 HB1 ALA 37 6.388 -0.624 -0.151 288 HB2 ALA 37 HB2 ALA 37 7.777 -0.340 0.897 289 HB3 ALA 37 HB3 ALA 37 7.832 -1.622 -0.312 290 H THR 38 HN THR 38 9.557 -1.010 -2.628 291 HA THR 38 HA THR 38 7.617 -1.028 -4.903 292 HB THR 38 HB THR 38 10.558 -0.474 -4.643 293 HG1 THR 38 HG1 THR 38 8.942 1.186 -4.739 294 HG21 THR 38 HG21 THR 38 9.137 -1.496 -7.103 295 HG22 THR 38 HG22 THR 38 10.569 -2.172 -6.329 296 HG23 THR 38 HG23 THR 38 10.671 -0.626 -7.166 297 H ALA 39 HN ALA 39 7.588 -2.877 -6.232 298 HA ALA 39 HA ALA 39 7.545 -5.208 -6.612 299 HB1 ALA 39 HB1 ALA 39 9.708 -6.100 -6.870 300 HB2 ALA 39 HB2 ALA 39 10.350 -5.175 -5.512 301 HB3 ALA 39 HB3 ALA 39 9.972 -4.363 -7.033 302 H SER 40 HN SER 40 7.846 -7.388 -5.418 303 HA SER 40 HA SER 40 6.968 -7.024 -2.635 304 HB2 SER 40 HB2 SER 40 6.596 -9.424 -2.750 305 HB3 SER 40 HB1 SER 40 6.028 -8.704 -4.251 306 HG SER 40 HG SER 40 7.544 -10.662 -4.233 307 H ARG 41 HN ARG 41 8.386 -7.021 -0.912 308 HA ARG 41 HA ARG 41 10.929 -8.514 -1.154 309 HB2 ARG 41 HB2 ARG 41 10.854 -5.931 -1.821 310 HB3 ARG 41 HB1 ARG 41 10.988 -5.733 -0.071 311 HG2 ARG 41 HG2 ARG 41 13.232 -5.773 -0.923 312 HG3 ARG 41 HG1 ARG 41 12.960 -7.335 -0.148 313 HD2 ARG 41 HD2 ARG 41 12.095 -7.499 -2.894 314 HD3 ARG 41 HD1 ARG 41 13.759 -6.881 -2.834 315 HE ARG 41 HE ARG 41 13.275 -9.110 -1.002 316 HH11 ARG 41 HH11 ARG 41 13.282 -8.753 -4.353 317 HH12 ARG 41 HH12 ARG 41 14.539 -9.908 -4.644 318 HH21 ARG 41 HH21 ARG 41 15.271 -10.351 -1.283 319 HH22 ARG 41 HH22 ARG 41 15.669 -10.810 -2.905 320 H MET 42 HN MET 42 10.980 -9.784 0.647 321 HA MET 42 HA MET 42 9.369 -9.505 2.951 322 HB2 MET 42 HB2 MET 42 12.062 -10.801 2.450 323 HB3 MET 42 HB1 MET 42 11.128 -11.056 3.925 324 HG2 MET 42 HG2 MET 42 9.301 -11.440 1.824 325 HG3 MET 42 HG1 MET 42 10.774 -12.264 1.312 326 HE1 MET 42 HE1 MET 42 10.870 -14.250 1.382 327 HE2 MET 42 HE2 MET 42 10.217 -15.459 2.484 328 HE3 MET 42 HE3 MET 42 11.741 -14.663 2.865 329 H GLN 43 HN GLN 43 12.495 -8.069 2.152 330 HA GLN 43 HA GLN 43 13.168 -7.146 4.805 331 HB2 GLN 43 HB2 GLN 43 14.506 -7.393 2.535 332 HB3 GLN 43 HB1 GLN 43 13.959 -5.737 2.268 333 HG2 GLN 43 HG2 GLN 43 15.264 -4.890 3.951 334 HG3 GLN 43 HG1 GLN 43 15.088 -6.332 4.952 335 HE21 GLN 43 HE21 GLN 43 17.591 -4.825 4.001 336 HE22 GLN 43 HE22 GLN 43 18.553 -6.028 3.289 337 H GLU 44 HN GLU 44 12.161 -5.168 1.991 338 HA GLU 44 HA GLU 44 11.408 -2.875 3.488 339 HB2 GLU 44 HB2 GLU 44 10.730 -4.024 0.784 340 HB3 GLU 44 HB1 GLU 44 9.978 -2.523 1.326 341 HG2 GLU 44 HG2 GLU 44 11.823 -1.466 0.577 342 HG3 GLU 44 HG1 GLU 44 12.671 -2.181 1.947 343 H ALA 45 HN ALA 45 9.397 -5.554 2.223 344 HA ALA 45 HA ALA 45 6.861 -4.733 3.050 345 HB1 ALA 45 HB1 ALA 45 7.660 -6.838 1.810 346 HB2 ALA 45 HB2 ALA 45 6.314 -7.047 2.927 347 HB3 ALA 45 HB3 ALA 45 7.937 -7.537 3.406 348 H LEU 46 HN LEU 46 9.080 -6.775 4.988 349 HA LEU 46 HA LEU 46 7.709 -6.876 7.408 350 HB2 LEU 46 HB2 LEU 46 9.765 -8.047 7.125 351 HB3 LEU 46 HB1 LEU 46 10.629 -6.578 6.675 352 HG LEU 46 HG LEU 46 9.350 -6.784 9.386 353 HD11 LEU 46 HD11 LEU 46 10.831 -8.304 10.145 354 HD12 LEU 46 HD12 LEU 46 12.176 -7.437 9.402 355 HD13 LEU 46 HD13 LEU 46 11.264 -8.621 8.465 356 HD21 LEU 46 HD21 LEU 46 10.287 -4.730 9.475 357 HD22 LEU 46 HD22 LEU 46 11.116 -4.989 7.939 358 HD23 LEU 46 HD23 LEU 46 11.863 -5.524 9.445 359 H ASP 47 HN ASP 47 9.846 -4.308 6.220 360 HA ASP 47 HA ASP 47 9.803 -2.567 8.443 361 HB2 ASP 47 HB2 ASP 47 11.151 -2.511 6.274 362 HB3 ASP 47 HB1 ASP 47 9.739 -1.761 5.528 363 H ILE 48 HN ILE 48 7.436 -2.910 5.795 364 HA ILE 48 HA ILE 48 5.883 -0.608 6.480 365 HB ILE 48 HB ILE 48 4.461 -1.337 4.784 366 HG12 ILE 48 HG12 ILE 48 4.943 -4.120 5.835 367 HG13 ILE 48 HG11 ILE 48 3.430 -3.232 5.735 368 HG21 ILE 48 HG21 ILE 48 6.676 -3.224 4.101 369 HG22 ILE 48 HG22 ILE 48 6.970 -1.487 4.159 370 HG23 ILE 48 HG23 ILE 48 5.765 -2.141 3.049 371 HD11 ILE 48 HD11 ILE 48 4.015 -3.214 3.133 372 HD12 ILE 48 HD12 ILE 48 3.193 -4.588 3.872 373 HD13 ILE 48 HD13 ILE 48 4.929 -4.659 3.570 374 H ALA 49 HN ALA 49 5.698 -4.020 7.536 375 HA ALA 49 HA ALA 49 3.338 -3.499 9.163 376 HB1 ALA 49 HB1 ALA 49 4.204 -5.692 8.056 377 HB2 ALA 49 HB2 ALA 49 3.503 -5.803 9.671 378 HB3 ALA 49 HB3 ALA 49 5.256 -5.809 9.467 379 H ARG 50 HN ARG 50 6.841 -3.705 9.717 380 HA ARG 50 HA ARG 50 6.623 -3.453 12.608 381 HB2 ARG 50 HB2 ARG 50 8.678 -3.758 10.505 382 HB3 ARG 50 HB1 ARG 50 9.213 -2.890 11.948 383 HG2 ARG 50 HG2 ARG 50 9.650 -5.195 12.383 384 HG3 ARG 50 HG1 ARG 50 8.197 -4.803 13.304 385 HD2 ARG 50 HD2 ARG 50 6.773 -5.861 11.688 386 HD3 ARG 50 HD1 ARG 50 8.099 -5.995 10.515 387 HE ARG 50 HE ARG 50 9.182 -7.363 12.548 388 HH11 ARG 50 HH11 ARG 50 6.861 -8.143 10.354 389 HH12 ARG 50 HH12 ARG 50 6.123 -9.412 11.273 390 HH21 ARG 50 HH21 ARG 50 7.839 -8.661 14.191 391 HH22 ARG 50 HH22 ARG 50 6.677 -9.705 13.443 392 H LYS 51 HN LYS 51 6.915 -1.261 9.891 393 HA LYS 51 HA LYS 51 8.085 1.002 11.094 394 HB2 LYS 51 HB2 LYS 51 7.596 0.834 8.722 395 HB3 LYS 51 HB1 LYS 51 5.865 0.725 9.047 396 HG2 LYS 51 HG2 LYS 51 6.075 2.990 8.544 397 HG3 LYS 51 HG1 LYS 51 6.276 3.016 10.288 398 HD2 LYS 51 HD2 LYS 51 8.767 2.510 8.806 399 HD3 LYS 51 HD1 LYS 51 8.059 4.096 8.504 400 HE2 LYS 51 HE2 LYS 51 7.795 3.933 11.223 401 HE3 LYS 51 HE1 LYS 51 9.313 3.048 10.965 402 HZ1 LYS 51 HZ1 LYS 51 10.001 4.882 9.465 403 HZ2 LYS 51 HZ2 LYS 51 9.831 5.365 11.084 404 HZ3 LYS 51 HZ3 LYS 51 8.628 5.753 9.949 405 H GLY 52 HN GLY 52 4.612 0.113 10.993 406 HA2 GLY 52 HA2 GLY 52 2.981 0.566 12.664 407 HA3 GLY 52 HA1 GLY 52 4.193 1.482 13.558 408 H GLN 53 HN GLN 53 4.995 3.299 11.551 409 HA GLN 53 HA GLN 53 2.492 4.906 11.243 410 HB2 GLN 53 HB2 GLN 53 4.130 6.828 11.262 411 HB3 GLN 53 HB1 GLN 53 4.113 5.882 12.749 412 HG2 GLN 53 HG2 GLN 53 6.106 4.664 12.044 413 HG3 GLN 53 HG1 GLN 53 6.094 5.494 10.487 414 HE21 GLN 53 HE21 GLN 53 5.729 6.646 13.899 415 HE22 GLN 53 HE22 GLN 53 6.925 7.844 13.770 416 H PHE 54 HN PHE 54 3.719 2.865 9.295 417 HA PHE 54 HA PHE 54 4.741 4.420 7.052 418 HB2 PHE 54 HB2 PHE 54 4.651 2.293 5.896 419 HB3 PHE 54 HB1 PHE 54 5.220 1.998 7.527 420 HD1 PHE 54 HD2 PHE 54 2.082 2.586 8.459 421 HD2 PHE 54 HD1 PHE 54 4.154 -0.159 5.928 422 HE1 PHE 54 HE2 PHE 54 0.285 0.950 8.791 423 HE2 PHE 54 HE1 PHE 54 2.372 -1.816 6.272 424 HZ PHE 54 HZ PHE 54 0.425 -1.280 7.699 425 H ASP 55 HN ASP 55 1.726 4.390 8.362 426 HA ASP 55 HA ASP 55 -0.332 5.170 7.537 427 HB2 ASP 55 HB2 ASP 55 1.728 6.099 5.787 428 HB3 ASP 55 HB1 ASP 55 0.339 5.631 4.804 429 H ILE 56 HN ILE 56 1.127 3.530 4.663 430 HA ILE 56 HA ILE 56 -1.167 1.587 4.771 431 HB ILE 56 HB ILE 56 -0.154 3.303 2.492 432 HG12 ILE 56 HG12 ILE 56 -2.795 3.136 3.971 433 HG13 ILE 56 HG11 ILE 56 -1.637 4.465 4.034 434 HG21 ILE 56 HG21 ILE 56 -2.298 2.165 1.412 435 HG22 ILE 56 HG22 ILE 56 -1.871 0.856 2.513 436 HG23 ILE 56 HG23 ILE 56 -0.712 1.412 1.306 437 HD11 ILE 56 HD11 ILE 56 -2.413 3.759 1.299 438 HD12 ILE 56 HD12 ILE 56 -2.374 5.339 2.082 439 HD13 ILE 56 HD13 ILE 56 -3.776 4.287 2.285 440 H ALA 57 HN ALA 57 -0.823 -0.390 3.409 441 HA ALA 57 HA ALA 57 1.940 -0.954 2.468 442 HB1 ALA 57 HB1 ALA 57 0.898 -1.676 5.064 443 HB2 ALA 57 HB2 ALA 57 2.521 -1.928 4.417 444 HB3 ALA 57 HB3 ALA 57 1.259 -3.128 4.130 445 H ILE 58 HN ILE 58 1.732 -2.323 0.632 446 HA ILE 58 HA ILE 58 -0.701 -4.063 0.583 447 HB ILE 58 HB ILE 58 0.288 -2.274 -1.645 448 HG12 ILE 58 HG12 ILE 58 -2.067 -1.271 -1.201 449 HG13 ILE 58 HG11 ILE 58 -1.940 -2.067 0.369 450 HG21 ILE 58 HG21 ILE 58 -1.131 -4.641 -1.836 451 HG22 ILE 58 HG22 ILE 58 -1.138 -3.346 -3.034 452 HG23 ILE 58 HG23 ILE 58 -2.405 -3.419 -1.808 453 HD11 ILE 58 HD11 ILE 58 0.540 -0.757 -0.161 454 HD12 ILE 58 HD12 ILE 58 -0.631 -0.407 1.111 455 HD13 ILE 58 HD13 ILE 58 -0.762 0.396 -0.453 456 H ILE 59 HN ILE 59 0.570 -5.955 0.838 457 HA ILE 59 HA ILE 59 2.675 -6.596 -1.125 458 HB ILE 59 HB ILE 59 1.353 -7.966 1.221 459 HG12 ILE 59 HG12 ILE 59 4.205 -7.921 1.298 460 HG13 ILE 59 HG11 ILE 59 3.666 -6.314 0.812 461 HG21 ILE 59 HG21 ILE 59 2.914 -9.109 -1.026 462 HG22 ILE 59 HG22 ILE 59 1.766 -9.894 0.059 463 HG23 ILE 59 HG23 ILE 59 3.424 -9.602 0.587 464 HD11 ILE 59 HD11 ILE 59 2.262 -7.670 3.083 465 HD12 ILE 59 HD12 ILE 59 2.510 -5.950 2.788 466 HD13 ILE 59 HD13 ILE 59 3.843 -6.945 3.375 467 H ASP 60 HN ASP 60 0.881 -6.067 -2.765 468 HA ASP 60 HA ASP 60 -1.450 -7.574 -3.183 469 HB2 ASP 60 HB2 ASP 60 -1.448 -6.027 -4.821 470 HB3 ASP 60 HB1 ASP 60 0.265 -5.719 -4.558 471 H VAL 61 HN VAL 61 -1.721 -9.104 -5.132 472 HA VAL 61 HA VAL 61 -1.295 -11.180 -6.118 473 HB VAL 61 HB VAL 61 1.096 -9.650 -6.038 474 HG11 VAL 61 HG11 VAL 61 1.509 -12.611 -5.511 475 HG12 VAL 61 HG12 VAL 61 2.198 -11.253 -4.621 476 HG13 VAL 61 HG13 VAL 61 2.740 -11.596 -6.264 477 HG21 VAL 61 HG21 VAL 61 -0.467 -11.013 -7.858 478 HG22 VAL 61 HG22 VAL 61 1.032 -11.943 -7.875 479 HG23 VAL 61 HG23 VAL 61 1.062 -10.215 -8.230 480 H ASN 62 HN ASN 62 -2.285 -12.553 -4.691 481 HA ASN 62 HA ASN 62 -0.608 -13.703 -2.484 482 HB2 ASN 62 HB2 ASN 62 -3.267 -12.458 -2.568 483 HB3 ASN 62 HB1 ASN 62 -3.279 -14.039 -1.789 484 HD21 ASN 62 HD21 ASN 62 -1.338 -10.993 -1.764 485 HD22 ASN 62 HD22 ASN 62 -1.013 -11.045 -0.098 486 H LEU 63 HN LEU 63 -1.162 -14.425 -5.364 487 HA LEU 63 HA LEU 63 -2.001 -17.248 -4.904 488 HB2 LEU 63 HB2 LEU 63 -3.360 -17.072 -6.989 489 HB3 LEU 63 HB1 LEU 63 -3.936 -15.955 -5.752 490 HG LEU 63 HG LEU 63 -1.877 -15.038 -7.741 491 HD11 LEU 63 HD11 LEU 63 -4.116 -16.138 -8.729 492 HD12 LEU 63 HD12 LEU 63 -3.405 -14.686 -9.431 493 HD13 LEU 63 HD13 LEU 63 -4.764 -14.551 -8.317 494 HD21 LEU 63 HD21 LEU 63 -2.285 -13.041 -6.768 495 HD22 LEU 63 HD22 LEU 63 -3.245 -13.903 -5.565 496 HD23 LEU 63 HD23 LEU 63 -4.025 -13.225 -6.994 497 H ASP 64 HN ASP 64 -1.584 -18.203 -7.454 498 HA ASP 64 HA ASP 64 0.254 -18.883 -8.811 499 HB2 ASP 64 HB2 ASP 64 -0.172 -15.975 -8.862 500 HB3 ASP 64 HB1 ASP 64 1.464 -16.435 -9.346 501 H GLY 65 HN GLY 65 0.653 -18.524 -5.816 502 HA2 GLY 65 HA2 GLY 65 3.025 -19.394 -5.135 503 HA3 GLY 65 HA1 GLY 65 3.538 -17.817 -5.741 504 H GLU 66 HN GLU 66 0.878 -16.710 -4.770 505 HA GLU 66 HA GLU 66 0.272 -15.432 -2.883 506 HB2 GLU 66 HB2 GLU 66 -0.263 -17.994 -2.533 507 HB3 GLU 66 HB1 GLU 66 0.992 -17.877 -1.298 508 HG2 GLU 66 HG2 GLU 66 -0.794 -15.618 -1.095 509 HG3 GLU 66 HG1 GLU 66 -1.718 -17.120 -1.050 510 HA PRO 67 HA PRO 67 4.771 -15.097 -1.552 511 HB2 PRO 67 HB2 PRO 67 5.485 -12.936 -3.073 512 HB3 PRO 67 HB1 PRO 67 5.669 -14.610 -3.631 513 HG2 PRO 67 HG2 PRO 67 3.596 -12.603 -4.324 514 HG3 PRO 67 HG1 PRO 67 4.339 -13.857 -5.327 515 HD2 PRO 67 HD2 PRO 67 1.837 -14.044 -4.191 516 HD3 PRO 67 HD1 PRO 67 2.824 -15.433 -4.693 517 H SER 68 HN SER 68 2.851 -14.378 0.095 518 HA SER 68 HA SER 68 3.078 -11.415 0.473 519 HB2 SER 68 HB2 SER 68 0.860 -11.515 1.401 520 HB3 SER 68 HB1 SER 68 0.826 -12.456 -0.084 521 HG SER 68 HG SER 68 0.529 -13.243 2.531 522 H TYR 69 HN TYR 69 4.203 -14.296 1.616 523 HA TYR 69 HA TYR 69 5.062 -15.078 3.642 524 HB2 TYR 69 HB2 TYR 69 5.959 -12.724 4.846 525 HB3 TYR 69 HB1 TYR 69 6.856 -13.703 3.692 526 HD1 TYR 69 HD1 TYR 69 6.340 -13.214 1.138 527 HD2 TYR 69 HD2 TYR 69 5.517 -10.507 4.358 528 HE1 TYR 69 HE1 TYR 69 6.268 -11.320 -0.468 529 HE2 TYR 69 HE2 TYR 69 5.439 -8.619 2.763 530 HH TYR 69 HH TYR 69 4.963 -8.810 -0.296 531 HA PRO 70 HA PRO 70 2.381 -14.673 7.028 532 HB2 PRO 70 HB2 PRO 70 4.023 -14.521 9.217 533 HB3 PRO 70 HB1 PRO 70 3.787 -16.012 8.283 534 HG2 PRO 70 HG2 PRO 70 6.027 -14.053 8.185 535 HG3 PRO 70 HG1 PRO 70 6.068 -15.821 8.089 536 HD2 PRO 70 HD2 PRO 70 6.288 -14.214 5.910 537 HD3 PRO 70 HD1 PRO 70 5.585 -15.845 5.848 538 H VAL 71 HN VAL 71 4.460 -12.074 6.272 539 HA VAL 71 HA VAL 71 3.636 -10.309 8.448 540 HB VAL 71 HB VAL 71 4.799 -9.683 5.728 541 HG11 VAL 71 HG11 VAL 71 5.554 -7.999 7.983 542 HG12 VAL 71 HG12 VAL 71 3.815 -7.981 7.691 543 HG13 VAL 71 HG13 VAL 71 4.930 -7.537 6.399 544 HG21 VAL 71 HG21 VAL 71 6.267 -10.061 8.347 545 HG22 VAL 71 HG22 VAL 71 6.972 -9.853 6.744 546 HG23 VAL 71 HG23 VAL 71 6.108 -11.339 7.141 547 H ALA 72 HN ALA 72 3.060 -10.049 4.926 548 HA ALA 72 HA ALA 72 0.936 -8.253 4.907 549 HB1 ALA 72 HB1 ALA 72 0.797 -8.952 2.738 550 HB2 ALA 72 HB2 ALA 72 0.626 -10.645 3.202 551 HB3 ALA 72 HB3 ALA 72 2.225 -9.902 3.149 552 H ASP 73 HN ASP 73 0.632 -11.825 5.042 553 HA ASP 73 HA ASP 73 -2.139 -11.989 5.455 554 HB2 ASP 73 HB2 ASP 73 0.279 -13.563 6.118 555 HB3 ASP 73 HB1 ASP 73 -1.209 -14.040 6.926 556 H ILE 74 HN ILE 74 0.406 -11.899 7.961 557 HA ILE 74 HA ILE 74 -1.297 -11.696 10.228 558 HB ILE 74 HB ILE 74 1.504 -10.768 9.560 559 HG12 ILE 74 HG12 ILE 74 0.472 -12.871 11.497 560 HG13 ILE 74 HG11 ILE 74 0.962 -13.219 9.839 561 HG21 ILE 74 HG21 ILE 74 -0.124 -10.274 12.033 562 HG22 ILE 74 HG22 ILE 74 1.045 -9.221 11.236 563 HG23 ILE 74 HG23 ILE 74 1.603 -10.593 12.193 564 HD11 ILE 74 HD11 ILE 74 3.207 -12.180 10.388 565 HD12 ILE 74 HD12 ILE 74 2.860 -13.682 11.244 566 HD13 ILE 74 HD13 ILE 74 2.693 -12.135 12.075 567 H LEU 75 HN LEU 75 0.274 -9.132 8.297 568 HA LEU 75 HA LEU 75 -0.790 -6.880 9.639 569 HB2 LEU 75 HB2 LEU 75 0.914 -7.307 7.629 570 HB3 LEU 75 HB1 LEU 75 -0.513 -6.970 6.652 571 HG LEU 75 HG LEU 75 -0.701 -4.918 8.391 572 HD11 LEU 75 HD11 LEU 75 2.227 -4.788 7.981 573 HD12 LEU 75 HD12 LEU 75 1.707 -5.986 9.167 574 HD13 LEU 75 HD13 LEU 75 1.264 -4.291 9.373 575 HD21 LEU 75 HD21 LEU 75 -0.707 -4.547 6.035 576 HD22 LEU 75 HD22 LEU 75 0.929 -5.182 5.857 577 HD23 LEU 75 HD23 LEU 75 0.669 -3.622 6.638 578 H ALA 76 HN ALA 76 -2.256 -9.238 7.571 579 HA ALA 76 HA ALA 76 -4.679 -7.623 7.114 580 HB1 ALA 76 HB1 ALA 76 -3.632 -10.305 6.191 581 HB2 ALA 76 HB2 ALA 76 -3.891 -8.851 5.225 582 HB3 ALA 76 HB3 ALA 76 -5.273 -9.771 5.824 583 H GLU 77 HN GLU 77 -3.500 -10.328 9.033 584 HA GLU 77 HA GLU 77 -6.113 -11.224 9.907 585 HB2 GLU 77 HB2 GLU 77 -4.881 -12.856 10.988 586 HB3 GLU 77 HB1 GLU 77 -3.660 -12.313 9.841 587 HG2 GLU 77 HG2 GLU 77 -2.832 -10.707 11.602 588 HG3 GLU 77 HG1 GLU 77 -3.947 -11.468 12.738 589 H ARG 78 HN ARG 78 -3.883 -8.742 10.882 590 HA ARG 78 HA ARG 78 -5.514 -8.192 13.308 591 HB2 ARG 78 HB2 ARG 78 -3.482 -7.107 14.160 592 HB3 ARG 78 HB1 ARG 78 -3.093 -8.738 13.615 593 HG2 ARG 78 HG2 ARG 78 -2.683 -7.389 11.309 594 HG3 ARG 78 HG1 ARG 78 -2.288 -6.120 12.466 595 HD2 ARG 78 HD2 ARG 78 -1.149 -8.794 13.073 596 HD3 ARG 78 HD1 ARG 78 -0.481 -7.973 11.649 597 HE ARG 78 HE ARG 78 -0.753 -6.447 14.196 598 HH11 ARG 78 HH21 ARG 78 0.660 -5.553 11.604 599 HH12 ARG 78 HH22 ARG 78 2.319 -5.743 12.066 600 HH21 ARG 78 HH11 ARG 78 1.602 -7.687 14.845 601 HH22 ARG 78 HH12 ARG 78 2.852 -6.951 13.897 602 H ASN 79 HN ASN 79 -4.154 -6.906 10.352 603 HA ASN 79 HA ASN 79 -4.518 -4.931 9.162 604 HB2 ASN 79 HB2 ASN 79 -7.129 -5.032 10.683 605 HB3 ASN 79 HB1 ASN 79 -6.852 -4.376 9.076 606 HD21 ASN 79 HD21 ASN 79 -6.070 -6.036 7.395 607 HD22 ASN 79 HD22 ASN 79 -6.662 -7.622 7.528 608 H VAL 80 HN VAL 80 -3.858 -2.905 9.417 609 HA VAL 80 HA VAL 80 -4.384 -1.417 11.967 610 HB VAL 80 HB VAL 80 -2.021 -2.631 11.162 611 HG11 VAL 80 HG11 VAL 80 -0.480 -0.740 10.592 612 HG12 VAL 80 HG12 VAL 80 -1.892 0.281 10.341 613 HG13 VAL 80 HG13 VAL 80 -1.631 -1.126 9.316 614 HG21 VAL 80 HG21 VAL 80 -2.916 -0.898 13.237 615 HG22 VAL 80 HG22 VAL 80 -1.324 -0.341 12.724 616 HG23 VAL 80 HG23 VAL 80 -1.545 -2.006 13.259 617 HA PRO 81 HA PRO 81 -5.402 1.985 9.259 618 HB2 PRO 81 HB2 PRO 81 -3.528 3.982 9.557 619 HB3 PRO 81 HB1 PRO 81 -4.814 3.670 10.738 620 HG2 PRO 81 HG2 PRO 81 -1.973 2.740 10.770 621 HG3 PRO 81 HG1 PRO 81 -2.928 3.459 12.081 622 HD2 PRO 81 HD2 PRO 81 -2.570 0.836 11.978 623 HD3 PRO 81 HD1 PRO 81 -4.157 1.494 12.435 624 H PHE 82 HN PHE 82 -5.162 1.616 7.095 625 HA PHE 82 HA PHE 82 -2.774 2.115 5.576 626 HB2 PHE 82 HB2 PHE 82 -1.853 -0.085 5.383 627 HB3 PHE 82 HB1 PHE 82 -2.078 0.190 7.106 628 HD1 PHE 82 HD1 PHE 82 -5.321 -0.097 6.556 629 HD2 PHE 82 HD2 PHE 82 -1.834 -2.526 5.936 630 HE1 PHE 82 HE1 PHE 82 -6.716 -2.126 6.739 631 HE2 PHE 82 HE2 PHE 82 -3.239 -4.564 6.112 632 HZ PHE 82 HZ PHE 82 -5.674 -4.365 6.512 633 H ILE 83 HN ILE 83 -3.003 -0.231 3.939 634 HA ILE 83 HA ILE 83 -5.728 -0.552 3.000 635 HB ILE 83 HB ILE 83 -3.882 1.457 1.970 636 HG12 ILE 83 HG12 ILE 83 -6.074 2.083 2.735 637 HG13 ILE 83 HG11 ILE 83 -6.041 2.326 0.988 638 HG21 ILE 83 HG21 ILE 83 -5.238 -0.465 0.054 639 HG22 ILE 83 HG22 ILE 83 -3.510 -0.137 0.172 640 HG23 ILE 83 HG23 ILE 83 -4.603 1.106 -0.434 641 HD11 ILE 83 HD11 ILE 83 -8.002 1.127 1.135 642 HD12 ILE 83 HD12 ILE 83 -7.495 0.275 2.591 643 HD13 ILE 83 HD13 ILE 83 -6.873 -0.220 1.017 644 H PHE 84 HN PHE 84 -5.746 -2.344 1.482 645 HA PHE 84 HA PHE 84 -3.152 -3.526 0.688 646 HB2 PHE 84 HB2 PHE 84 -3.815 -4.089 3.108 647 HB3 PHE 84 HB1 PHE 84 -5.126 -5.027 2.410 648 HD1 PHE 84 HD2 PHE 84 -2.246 -5.033 0.267 649 HD2 PHE 84 HD1 PHE 84 -3.890 -6.874 3.781 650 HE1 PHE 84 HE2 PHE 84 -0.751 -6.979 -0.045 651 HE2 PHE 84 HE1 PHE 84 -2.364 -8.810 3.472 652 HZ PHE 84 HZ PHE 84 -0.802 -8.861 1.562 653 H ALA 85 HN ALA 85 -3.467 -5.228 -0.891 654 HA ALA 85 HA ALA 85 -6.147 -6.008 -1.654 655 HB1 ALA 85 HB1 ALA 85 -5.758 -4.994 -3.993 656 HB2 ALA 85 HB2 ALA 85 -4.439 -4.085 -3.256 657 HB3 ALA 85 HB3 ALA 85 -6.095 -3.845 -2.699 658 H THR 86 HN THR 86 -6.023 -8.020 -2.617 659 HA THR 86 HA THR 86 -3.521 -8.844 -4.014 660 HB THR 86 HB THR 86 -3.085 -10.611 -2.453 661 HG1 THR 86 HG1 THR 86 -4.513 -11.222 -0.930 662 HG21 THR 86 HG21 THR 86 -3.895 -8.243 -0.760 663 HG22 THR 86 HG22 THR 86 -2.435 -8.276 -1.749 664 HG23 THR 86 HG23 THR 86 -2.621 -9.414 -0.415 665 H GLY 87 HN GLY 87 -4.854 -11.649 -3.041 666 HA2 GLY 87 HA2 GLY 87 -6.516 -11.856 -5.479 667 HA3 GLY 87 HA1 GLY 87 -5.885 -13.215 -4.540 668 H TYR 88 HN TYR 88 -6.741 -11.985 -1.952 669 HA TYR 88 HA TYR 88 -9.390 -13.127 -1.881 670 HB2 TYR 88 HB2 TYR 88 -9.355 -11.936 0.444 671 HB3 TYR 88 HB1 TYR 88 -8.226 -13.248 0.145 672 HD1 TYR 88 HD2 TYR 88 -8.156 -9.591 -0.794 673 HD2 TYR 88 HD1 TYR 88 -6.250 -12.824 1.278 674 HE1 TYR 88 HE2 TYR 88 -6.297 -8.093 -0.205 675 HE2 TYR 88 HE1 TYR 88 -4.380 -11.314 1.882 676 HH TYR 88 HH TYR 88 -4.468 -7.866 1.066 677 H GLY 89 HN GLY 89 -8.199 -9.988 -2.693 678 HA2 GLY 89 HA2 GLY 89 -9.424 -8.147 -3.532 679 HA3 GLY 89 HA1 GLY 89 -10.904 -9.078 -3.311 680 H SER 90 HN SER 90 -9.812 -9.443 -0.361 681 HA SER 90 HA SER 90 -9.671 -7.067 1.056 682 HB2 SER 90 HB2 SER 90 -11.628 -6.074 0.381 683 HB3 SER 90 HB1 SER 90 -12.305 -7.599 -0.181 684 HG SER 90 HG SER 90 -13.163 -6.443 1.834 685 H LYS 91 HN LYS 91 -12.158 -9.627 1.251 686 HA LYS 91 HA LYS 91 -12.318 -11.469 2.745 687 HB2 LYS 91 HB2 LYS 91 -10.349 -12.187 3.627 688 HB3 LYS 91 HB1 LYS 91 -9.622 -10.809 2.809 689 HG2 LYS 91 HG2 LYS 91 -10.070 -9.437 4.882 690 HG3 LYS 91 HG1 LYS 91 -10.602 -10.913 5.680 691 HD2 LYS 91 HD2 LYS 91 -8.352 -11.922 5.125 692 HD3 LYS 91 HD1 LYS 91 -7.843 -10.324 4.578 693 HE2 LYS 91 HE2 LYS 91 -7.464 -9.664 6.715 694 HE3 LYS 91 HE1 LYS 91 -9.102 -10.149 7.195 695 HZ1 LYS 91 HZ1 LYS 91 -7.075 -11.432 8.147 696 HZ2 LYS 91 HZ2 LYS 91 -7.074 -12.208 6.635 697 HZ3 LYS 91 HZ3 LYS 91 -8.444 -12.294 7.638 698 H GLY 92 HN GLY 92 -11.567 -8.254 4.036 699 HA2 GLY 92 HA2 GLY 92 -13.701 -7.394 5.298 700 HA3 GLY 92 HA1 GLY 92 -13.354 -8.765 6.358 701 H LEU 93 HN LEU 93 -11.047 -6.631 4.743 702 HA LEU 93 HA LEU 93 -9.344 -6.332 7.006 703 HB2 LEU 93 HB2 LEU 93 -8.353 -5.927 4.950 704 HB3 LEU 93 HB1 LEU 93 -9.771 -5.097 4.315 705 HG LEU 93 HG LEU 93 -8.146 -3.866 6.534 706 HD11 LEU 93 HD11 LEU 93 -7.617 -3.795 3.550 707 HD12 LEU 93 HD12 LEU 93 -6.513 -4.321 4.819 708 HD13 LEU 93 HD13 LEU 93 -6.949 -2.618 4.679 709 HD21 LEU 93 HD21 LEU 93 -9.122 -2.012 4.624 710 HD22 LEU 93 HD22 LEU 93 -9.723 -2.276 6.260 711 HD23 LEU 93 HD23 LEU 93 -10.428 -3.162 4.908 712 H ASP 94 HN ASP 94 -9.306 -4.786 8.639 713 HA ASP 94 HA ASP 94 -11.594 -2.855 8.713 714 HB2 ASP 94 HB2 ASP 94 -11.678 -3.255 11.002 715 HB3 ASP 94 HB1 ASP 94 -11.042 -4.802 10.454 716 H THR 95 HN THR 95 -11.101 -0.650 9.410 717 HA THR 95 HA THR 95 -8.462 0.274 10.043 718 HB THR 95 HB THR 95 -7.895 -0.526 7.841 719 HG1 THR 95 HG1 THR 95 -6.974 1.249 7.233 720 HG21 THR 95 HG21 THR 95 -10.239 -0.661 7.032 721 HG22 THR 95 HG22 THR 95 -9.159 0.082 5.854 722 HG23 THR 95 HG23 THR 95 -10.237 1.088 6.821 723 H ARG 96 HN ARG 96 -8.358 2.618 10.112 724 HA ARG 96 HA ARG 96 -10.778 3.972 10.756 725 HB2 ARG 96 HB2 ARG 96 -8.046 4.916 9.819 726 HB3 ARG 96 HB1 ARG 96 -9.276 5.994 10.484 727 HG2 ARG 96 HG2 ARG 96 -8.956 5.259 12.616 728 HG3 ARG 96 HG1 ARG 96 -8.703 3.588 12.108 729 HD2 ARG 96 HD2 ARG 96 -6.601 4.479 12.994 730 HD3 ARG 96 HD1 ARG 96 -6.439 4.267 11.244 731 HE ARG 96 HE ARG 96 -7.200 6.759 11.154 732 HH11 ARG 96 HH11 ARG 96 -7.275 7.310 14.029 733 HH12 ARG 96 HH12 ARG 96 -5.678 7.886 14.370 734 HH21 ARG 96 HH21 ARG 96 -4.318 6.642 11.435 735 HH22 ARG 96 HH22 ARG 96 -4.006 7.517 12.897 736 H TYR 97 HN TYR 97 -9.331 3.137 7.746 737 HA TYR 97 HA TYR 97 -10.315 5.256 6.084 738 HB2 TYR 97 HB2 TYR 97 -9.612 2.342 5.614 739 HB3 TYR 97 HB1 TYR 97 -9.981 3.462 4.306 740 HD1 TYR 97 HD1 TYR 97 -8.438 5.156 7.062 741 HD2 TYR 97 HD2 TYR 97 -7.562 2.721 3.630 742 HE1 TYR 97 HE1 TYR 97 -6.106 5.966 7.085 743 HE2 TYR 97 HE2 TYR 97 -5.225 3.540 3.656 744 HH TYR 97 HH TYR 97 -4.053 5.724 4.561 745 H SER 98 HN SER 98 -11.783 2.317 7.343 746 HA SER 98 HA SER 98 -14.121 1.896 7.623 747 HB2 SER 98 HB2 SER 98 -14.632 3.889 5.407 748 HB3 SER 98 HB1 SER 98 -15.728 3.372 6.682 749 HG SER 98 HG SER 98 -14.234 4.355 8.168 750 H ASN 99 HN ASN 99 -12.047 0.949 5.535 751 HA ASN 99 HA ASN 99 -12.003 -0.672 3.816 752 HB2 ASN 99 HB2 ASN 99 -14.787 -0.972 4.968 753 HB3 ASN 99 HB1 ASN 99 -14.074 -2.124 3.840 754 HD21 ASN 99 HD21 ASN 99 -11.527 -0.912 5.663 755 HD22 ASN 99 HD22 ASN 99 -11.486 -2.094 6.876 756 H ILE 100 HN ILE 100 -11.850 0.590 1.902 757 HA ILE 100 HA ILE 100 -14.329 0.739 0.320 758 HB ILE 100 HB ILE 100 -13.326 3.313 -0.026 759 HG12 ILE 100 HG12 ILE 100 -12.198 2.624 2.354 760 HG13 ILE 100 HG11 ILE 100 -12.709 4.255 1.973 761 HG21 ILE 100 HG21 ILE 100 -15.456 3.837 1.414 762 HG22 ILE 100 HG22 ILE 100 -15.681 2.088 1.364 763 HG23 ILE 100 HG23 ILE 100 -15.623 3.013 -0.136 764 HD11 ILE 100 HD11 ILE 100 -14.725 2.396 3.150 765 HD12 ILE 100 HD12 ILE 100 -14.559 4.141 3.339 766 HD13 ILE 100 HD13 ILE 100 -13.476 3.054 4.197 767 HA PRO 101 HA PRO 101 -10.938 1.919 -2.744 768 HB2 PRO 101 HB2 PRO 101 -8.481 2.728 -1.889 769 HB3 PRO 101 HB1 PRO 101 -9.846 3.843 -2.097 770 HG2 PRO 101 HG2 PRO 101 -8.760 2.622 0.385 771 HG3 PRO 101 HG1 PRO 101 -9.396 4.249 0.115 772 HD2 PRO 101 HD2 PRO 101 -10.804 2.248 1.327 773 HD3 PRO 101 HD1 PRO 101 -11.553 3.602 0.449 774 H LEU 102 HN LEU 102 -10.518 -0.238 -0.236 775 HA LEU 102 HA LEU 102 -8.006 -1.460 -1.070 776 HB2 LEU 102 HB2 LEU 102 -8.332 -2.697 0.835 777 HB3 LEU 102 HB1 LEU 102 -9.485 -1.416 1.178 778 HG LEU 102 HG LEU 102 -10.615 -3.466 1.613 779 HD11 LEU 102 HD11 LEU 102 -11.428 -1.824 -0.623 780 HD12 LEU 102 HD12 LEU 102 -12.422 -2.598 0.607 781 HD13 LEU 102 HD13 LEU 102 -11.975 -3.483 -0.850 782 HD21 LEU 102 HD21 LEU 102 -8.914 -4.439 -0.465 783 HD22 LEU 102 HD22 LEU 102 -10.582 -4.822 -0.894 784 HD23 LEU 102 HD23 LEU 102 -9.922 -5.358 0.649 785 H LEU 103 HN LEU 103 -7.838 -3.601 -2.113 786 HA LEU 103 HA LEU 103 -10.065 -5.026 -3.240 787 HB2 LEU 103 HB2 LEU 103 -9.912 -4.131 -5.568 788 HB3 LEU 103 HB1 LEU 103 -10.398 -2.881 -4.428 789 HG LEU 103 HG LEU 103 -7.497 -3.081 -4.633 790 HD11 LEU 103 HD11 LEU 103 -7.255 -3.265 -6.853 791 HD12 LEU 103 HD12 LEU 103 -8.154 -1.759 -7.039 792 HD13 LEU 103 HD13 LEU 103 -9.003 -3.304 -7.080 793 HD21 LEU 103 HD21 LEU 103 -7.799 -0.934 -4.049 794 HD22 LEU 103 HD22 LEU 103 -9.544 -1.146 -4.203 795 HD23 LEU 103 HD23 LEU 103 -8.594 -0.611 -5.589 796 H THR 104 HN THR 104 -8.280 -4.961 -5.902 797 HA THR 104 HA THR 104 -6.180 -6.790 -4.873 798 HB THR 104 HB THR 104 -7.687 -8.229 -5.937 799 HG1 THR 104 HG1 THR 104 -6.453 -8.959 -7.474 800 HG21 THR 104 HG21 THR 104 -8.328 -7.227 -8.457 801 HG22 THR 104 HG22 THR 104 -8.439 -5.824 -7.402 802 HG23 THR 104 HG23 THR 104 -9.389 -7.262 -7.050 803 H LYS 105 HN LYS 105 -6.229 -6.271 -8.273 804 HA LYS 105 HA LYS 105 -4.535 -3.857 -8.179 805 HB2 LYS 105 HB2 LYS 105 -3.309 -6.153 -7.566 806 HB3 LYS 105 HB1 LYS 105 -3.213 -6.270 -9.326 807 HG2 LYS 105 HG2 LYS 105 -1.368 -4.964 -9.093 808 HG3 LYS 105 HG1 LYS 105 -2.532 -3.650 -8.920 809 HD2 LYS 105 HD2 LYS 105 -2.445 -3.753 -6.539 810 HD3 LYS 105 HD1 LYS 105 -1.577 -5.288 -6.564 811 HE2 LYS 105 HE2 LYS 105 -0.497 -2.633 -7.587 812 HE3 LYS 105 HE1 LYS 105 0.001 -3.454 -6.095 813 HZ1 LYS 105 HZ1 LYS 105 0.392 -5.455 -7.615 814 HZ2 LYS 105 HZ2 LYS 105 1.532 -4.198 -7.665 815 HZ3 LYS 105 HZ3 LYS 105 0.367 -4.340 -8.892 816 HA PRO 106 HA PRO 106 -6.492 -4.975 -12.311 817 HB2 PRO 106 HB2 PRO 106 -8.785 -3.491 -12.183 818 HB3 PRO 106 HB1 PRO 106 -8.711 -5.184 -11.654 819 HG2 PRO 106 HG2 PRO 106 -8.751 -2.701 -10.042 820 HG3 PRO 106 HG1 PRO 106 -9.414 -4.300 -9.677 821 HD2 PRO 106 HD2 PRO 106 -7.051 -3.266 -8.658 822 HD3 PRO 106 HD1 PRO 106 -7.499 -4.982 -8.689 823 H PHE 107 HN PHE 107 -5.850 -2.232 -10.354 824 HA PHE 107 HA PHE 107 -5.047 -0.085 -10.832 825 HB2 PHE 107 HB2 PHE 107 -4.300 -1.843 -13.112 826 HB3 PHE 107 HB1 PHE 107 -4.075 -0.105 -13.331 827 HD1 PHE 107 HD1 PHE 107 -2.908 1.177 -11.377 828 HD2 PHE 107 HD2 PHE 107 -2.686 -3.078 -11.915 829 HE1 PHE 107 HE1 PHE 107 -0.899 1.100 -9.928 830 HE2 PHE 107 HE2 PHE 107 -0.672 -3.157 -10.467 831 HZ PHE 107 HZ PHE 107 0.231 -1.057 -9.476 832 H LEU 108 HN LEU 108 -5.152 1.450 -13.177 833 HA LEU 108 HA LEU 108 -6.668 2.756 -14.461 834 HB2 LEU 108 HB2 LEU 108 -8.751 0.635 -13.943 835 HB3 LEU 108 HB1 LEU 108 -8.514 1.612 -15.388 836 HG LEU 108 HG LEU 108 -6.939 -0.788 -14.468 837 HD11 LEU 108 HD11 LEU 108 -8.958 -0.294 -16.371 838 HD12 LEU 108 HD12 LEU 108 -8.014 -1.770 -16.176 839 HD13 LEU 108 HD13 LEU 108 -7.471 -0.516 -17.292 840 HD21 LEU 108 HD21 LEU 108 -5.562 -0.020 -16.653 841 HD22 LEU 108 HD22 LEU 108 -5.089 0.471 -15.026 842 HD23 LEU 108 HD23 LEU 108 -6.017 1.572 -16.044 843 H ASP 109 HN ASP 109 -6.668 2.219 -11.325 844 HA ASP 109 HA ASP 109 -8.079 4.411 -10.384 845 HB2 ASP 109 HB2 ASP 109 -9.796 2.232 -11.328 846 HB3 ASP 109 HB1 ASP 109 -10.136 2.663 -9.651 847 H SER 110 HN SER 110 -7.100 1.103 -9.968 848 HA SER 110 HA SER 110 -7.465 0.489 -7.301 849 HB2 SER 110 HB2 SER 110 -6.358 -0.914 -8.981 850 HB3 SER 110 HB1 SER 110 -4.988 0.188 -9.023 851 HG SER 110 HG SER 110 -4.672 -0.290 -6.793 852 H GLU 111 HN GLU 111 -4.109 1.267 -7.816 853 HA GLU 111 HA GLU 111 -3.415 2.351 -5.422 854 HB2 GLU 111 HB2 GLU 111 -2.115 2.054 -7.652 855 HB3 GLU 111 HB1 GLU 111 -2.598 3.715 -7.994 856 HG2 GLU 111 HG2 GLU 111 -0.742 4.308 -6.836 857 HG3 GLU 111 HG1 GLU 111 -1.672 3.887 -5.397 858 H LEU 112 HN LEU 112 -4.787 4.289 -8.076 859 HA LEU 112 HA LEU 112 -4.909 6.823 -6.885 860 HB2 LEU 112 HB2 LEU 112 -7.401 5.897 -8.246 861 HB3 LEU 112 HB1 LEU 112 -6.437 7.336 -8.547 862 HG LEU 112 HG LEU 112 -5.847 4.513 -9.448 863 HD11 LEU 112 HD11 LEU 112 -7.496 6.194 -10.643 864 HD12 LEU 112 HD12 LEU 112 -6.347 5.252 -11.594 865 HD13 LEU 112 HD13 LEU 112 -6.000 6.937 -11.207 866 HD21 LEU 112 HD21 LEU 112 -3.719 5.184 -10.144 867 HD22 LEU 112 HD22 LEU 112 -3.875 6.075 -8.631 868 HD23 LEU 112 HD23 LEU 112 -4.157 6.893 -10.168 869 H GLU 113 HN GLU 113 -7.736 4.650 -6.921 870 HA GLU 113 HA GLU 113 -9.332 5.787 -4.989 871 HB2 GLU 113 HB2 GLU 113 -9.200 3.433 -6.396 872 HB3 GLU 113 HB1 GLU 113 -9.009 2.863 -4.735 873 HG2 GLU 113 HG2 GLU 113 -11.212 3.112 -4.420 874 HG3 GLU 113 HG1 GLU 113 -11.028 4.845 -4.691 875 H ALA 114 HN ALA 114 -6.502 3.713 -4.416 876 HA ALA 114 HA ALA 114 -6.730 3.279 -1.649 877 HB1 ALA 114 HB1 ALA 114 -4.835 2.987 -3.687 878 HB2 ALA 114 HB2 ALA 114 -4.658 2.428 -2.024 879 HB3 ALA 114 HB3 ALA 114 -4.027 4.006 -2.495 880 H VAL 115 HN VAL 115 -5.538 6.165 -3.350 881 HA VAL 115 HA VAL 115 -5.340 7.582 -0.714 882 HB VAL 115 HB VAL 115 -4.301 8.529 -3.389 883 HG11 VAL 115 HG11 VAL 115 -4.415 9.833 -1.057 884 HG12 VAL 115 HG12 VAL 115 -3.040 10.010 -2.147 885 HG13 VAL 115 HG13 VAL 115 -2.934 8.922 -0.763 886 HG21 VAL 115 HG21 VAL 115 -3.091 6.580 -3.394 887 HG22 VAL 115 HG22 VAL 115 -3.337 6.303 -1.669 888 HG23 VAL 115 HG23 VAL 115 -2.108 7.446 -2.213 889 H LEU 116 HN LEU 116 -7.173 7.408 -3.631 890 HA LEU 116 HA LEU 116 -8.168 10.158 -3.584 891 HB2 LEU 116 HB2 LEU 116 -7.996 9.053 -5.678 892 HB3 LEU 116 HB1 LEU 116 -8.767 7.594 -5.064 893 HG LEU 116 HG LEU 116 -10.790 9.312 -4.653 894 HD11 LEU 116 HD11 LEU 116 -10.758 11.204 -5.907 895 HD12 LEU 116 HD12 LEU 116 -9.937 10.409 -7.251 896 HD13 LEU 116 HD13 LEU 116 -9.008 10.986 -5.867 897 HD21 LEU 116 HD21 LEU 116 -11.706 8.557 -6.803 898 HD22 LEU 116 HD22 LEU 116 -10.850 7.238 -6.003 899 HD23 LEU 116 HD23 LEU 116 -10.089 8.100 -7.341 900 H VAL 117 HN VAL 117 -9.075 7.176 -2.024 901 HA VAL 117 HA VAL 117 -11.856 8.040 -1.608 902 HB VAL 117 HB VAL 117 -10.247 5.679 -0.705 903 HG11 VAL 117 HG11 VAL 117 -11.947 5.411 0.763 904 HG12 VAL 117 HG12 VAL 117 -12.904 4.977 -0.653 905 HG13 VAL 117 HG13 VAL 117 -12.936 6.629 -0.041 906 HG21 VAL 117 HG21 VAL 117 -12.270 6.079 -2.922 907 HG22 VAL 117 HG22 VAL 117 -11.606 4.514 -2.451 908 HG23 VAL 117 HG23 VAL 117 -10.548 5.755 -3.123 909 H GLN 118 HN GLN 118 -8.855 8.323 0.159 910 HA GLN 118 HA GLN 118 -10.448 8.925 2.626 911 HB2 GLN 118 HB2 GLN 118 -8.597 8.145 3.867 912 HB3 GLN 118 HB1 GLN 118 -8.667 7.050 2.488 913 HG2 GLN 118 HG2 GLN 118 -7.024 8.678 1.348 914 HG3 GLN 118 HG1 GLN 118 -6.765 9.339 2.961 915 HE21 GLN 118 HE21 GLN 118 -6.368 6.428 0.971 916 HE22 GLN 118 HE22 GLN 118 -5.291 5.649 2.027 917 H ILE 119 HN ILE 119 -10.243 10.945 0.615 918 HA ILE 119 HA ILE 119 -8.298 12.861 1.862 919 HB ILE 119 HB ILE 119 -7.930 13.749 -0.247 920 HG12 ILE 119 HG12 ILE 119 -10.321 14.383 -0.592 921 HG13 ILE 119 HG11 ILE 119 -9.557 13.796 -2.068 922 HG21 ILE 119 HG21 ILE 119 -7.854 11.948 -1.927 923 HG22 ILE 119 HG22 ILE 119 -8.923 10.967 -0.924 924 HG23 ILE 119 HG23 ILE 119 -7.305 11.373 -0.352 925 HD11 ILE 119 HD11 ILE 119 -11.344 12.183 -0.224 926 HD12 ILE 119 HD12 ILE 119 -10.532 11.553 -1.653 927 HD13 ILE 119 HD13 ILE 119 -11.775 12.790 -1.821 928 H SER 120 HN SER 120 -11.567 12.076 1.619 929 HA SER 120 HA SER 120 -12.405 14.505 3.001 930 HB2 SER 120 HB2 SER 120 -12.839 14.081 0.061 931 HB3 SER 120 HB1 SER 120 -14.094 14.898 0.988 932 HG SER 120 HG SER 120 -12.827 16.557 0.577 933 H LYS 121 HN LYS 121 -13.685 11.920 0.875 934 HA LYS 121 HA LYS 121 -15.384 10.329 1.242 935 HB2 LYS 121 HB2 LYS 121 -13.925 9.690 3.084 936 HB3 LYS 121 HB1 LYS 121 -14.565 10.992 4.087 937 HG2 LYS 121 HG2 LYS 121 -15.987 9.396 4.856 938 HG3 LYS 121 HG1 LYS 121 -16.865 9.716 3.359 939 HD2 LYS 121 HD2 LYS 121 -14.856 7.942 2.592 940 HD3 LYS 121 HD1 LYS 121 -15.394 7.328 4.158 941 HE2 LYS 121 HE2 LYS 121 -17.535 6.867 3.397 942 HE3 LYS 121 HE1 LYS 121 -17.495 8.167 2.189 943 HZ1 LYS 121 HZ1 LYS 121 -15.845 6.915 0.944 944 HZ2 LYS 121 HZ2 LYS 121 -17.260 5.994 1.140 945 HZ3 LYS 121 HZ3 LYS 121 -15.890 5.666 2.090 946 H GLU 122 HN GLU 122 -16.576 12.397 0.437 947 HA GLU 122 HA GLU 122 -19.162 12.602 1.224 948 HB2 GLU 122 HB2 GLU 122 -19.156 14.608 2.807 949 HB3 GLU 122 HB1 GLU 122 -18.598 13.100 3.517 950 HG2 GLU 122 HG2 GLU 122 -16.343 13.777 3.483 951 HG3 GLU 122 HG1 GLU 122 -16.635 14.995 2.241 952 H VAL 123 HN VAL 123 -16.325 14.142 0.154 953 HA VAL 123 HA VAL 123 -15.957 15.994 -1.213 954 HB VAL 123 HB VAL 123 -17.163 15.696 -3.328 955 HG11 VAL 123 HG11 VAL 123 -16.042 13.776 -3.703 956 HG12 VAL 123 HG12 VAL 123 -17.104 12.873 -2.622 957 HG13 VAL 123 HG13 VAL 123 -15.705 13.728 -1.972 958 HG21 VAL 123 HG21 VAL 123 -19.124 14.314 -3.501 959 HG22 VAL 123 HG22 VAL 123 -19.419 15.448 -2.182 960 HG23 VAL 123 HG23 VAL 123 -18.969 13.779 -1.829 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 10.957 16.097 8.472 2 H2 GLY 1 HT2 GLY 1 10.417 17.226 7.323 3 H3 GLY 1 HT3 GLY 1 9.868 17.312 8.929 4 HA2 GLY 1 HA2 GLY 1 11.836 18.153 9.730 5 HA3 GLY 1 HA1 GLY 1 12.746 17.519 8.358 6 H SER 2 HN SER 2 9.677 19.201 8.011 7 HA SER 2 HA SER 2 9.175 21.316 7.069 8 HB2 SER 2 HB2 SER 2 12.098 21.983 7.361 9 HB3 SER 2 HB1 SER 2 10.705 23.043 7.549 10 HG SER 2 HG SER 2 11.591 22.441 9.565 11 H HIS 3 HN HIS 3 12.529 20.569 6.019 12 HA HIS 3 HA HIS 3 11.836 21.242 3.239 13 HB2 HIS 3 HB2 HIS 3 14.381 20.149 4.478 14 HB3 HIS 3 HB1 HIS 3 14.238 20.939 2.908 15 HD1 HIS 3 HD1 HIS 3 14.732 21.643 6.475 16 HD2 HIS 3 HD2 HIS 3 13.437 23.776 3.136 17 HE1 HIS 3 HE1 HIS 3 14.855 24.095 7.099 18 H MET 4 HN MET 4 12.063 18.376 5.205 19 HA MET 4 HA MET 4 11.342 16.725 2.846 20 HB2 MET 4 HB2 MET 4 13.975 16.932 3.945 21 HB3 MET 4 HB1 MET 4 13.355 15.324 4.320 22 HG2 MET 4 HG2 MET 4 12.862 16.322 1.563 23 HG3 MET 4 HG1 MET 4 14.529 15.908 1.965 24 HE1 MET 4 HE1 MET 4 14.223 13.261 4.031 25 HE2 MET 4 HE2 MET 4 15.337 14.018 2.896 26 HE3 MET 4 HE3 MET 4 14.779 12.373 2.604 27 H THR 5 HN THR 5 10.639 14.521 3.539 28 HA THR 5 HA THR 5 9.817 14.398 6.417 29 HB THR 5 HB THR 5 7.640 13.547 5.604 30 HG1 THR 5 HG1 THR 5 8.259 14.302 3.003 31 HG21 THR 5 HG21 THR 5 8.680 16.198 5.181 32 HG22 THR 5 HG22 THR 5 7.054 15.712 5.660 33 HG23 THR 5 HG23 THR 5 7.471 15.831 3.951 34 H GLU 6 HN GLU 6 9.456 12.133 7.142 35 HA GLU 6 HA GLU 6 10.595 10.051 5.342 36 HB2 GLU 6 HB2 GLU 6 12.028 9.374 7.365 37 HB3 GLU 6 HB1 GLU 6 12.498 10.849 6.517 38 HG2 GLU 6 HG2 GLU 6 10.581 11.034 8.817 39 HG3 GLU 6 HG1 GLU 6 12.305 10.865 9.142 40 H ARG 7 HN ARG 7 7.988 10.881 6.991 41 HA ARG 7 HA ARG 7 7.006 8.194 7.322 42 HB2 ARG 7 HB2 ARG 7 6.937 8.255 9.836 43 HB3 ARG 7 HB1 ARG 7 8.563 8.148 9.159 44 HG2 ARG 7 HG2 ARG 7 8.944 10.501 9.497 45 HG3 ARG 7 HG1 ARG 7 7.258 10.768 9.932 46 HD2 ARG 7 HD2 ARG 7 7.845 10.428 12.093 47 HD3 ARG 7 HD1 ARG 7 8.204 8.741 11.675 48 HE ARG 7 HE ARG 7 10.226 10.923 11.321 49 HH11 ARG 7 HH21 ARG 7 9.718 7.629 11.075 50 HH12 ARG 7 HH22 ARG 7 11.087 7.160 12.025 51 HH21 ARG 7 HH11 ARG 7 11.802 10.385 13.068 52 HH22 ARG 7 HH12 ARG 7 12.267 8.718 13.152 53 H ARG 8 HN ARG 8 6.250 11.141 6.579 54 HA ARG 8 HA ARG 8 3.859 11.456 8.324 55 HB2 ARG 8 HB2 ARG 8 5.731 13.196 7.227 56 HB3 ARG 8 HB1 ARG 8 4.321 13.412 6.190 57 HG2 ARG 8 HG2 ARG 8 3.029 13.477 8.501 58 HG3 ARG 8 HG1 ARG 8 4.612 13.946 9.125 59 HD2 ARG 8 HD2 ARG 8 3.477 15.327 6.692 60 HD3 ARG 8 HD1 ARG 8 3.014 15.846 8.324 61 HE ARG 8 HE ARG 8 5.879 15.497 8.120 62 HH11 ARG 8 HH21 ARG 8 3.443 17.702 8.676 63 HH12 ARG 8 HH22 ARG 8 4.304 19.087 8.093 64 HH21 ARG 8 HH11 ARG 8 6.929 17.237 6.789 65 HH22 ARG 8 HH12 ARG 8 6.278 18.825 7.027 66 H LEU 9 HN LEU 9 4.772 11.037 4.915 67 HA LEU 9 HA LEU 9 2.032 10.047 4.348 68 HB2 LEU 9 HB2 LEU 9 3.419 12.451 3.289 69 HB3 LEU 9 HB1 LEU 9 2.525 11.490 2.111 70 HG LEU 9 HG LEU 9 0.957 11.779 4.513 71 HD11 LEU 9 HD11 LEU 9 1.006 14.449 3.377 72 HD12 LEU 9 HD12 LEU 9 2.584 14.023 4.039 73 HD13 LEU 9 HD13 LEU 9 1.151 13.957 5.064 74 HD21 LEU 9 HD21 LEU 9 -0.209 13.242 2.431 75 HD22 LEU 9 HD22 LEU 9 -0.493 11.540 2.799 76 HD23 LEU 9 HD23 LEU 9 0.734 11.994 1.616 77 H ARG 10 HN ARG 10 2.901 7.895 4.079 78 HA ARG 10 HA ARG 10 4.650 7.596 1.656 79 HB2 ARG 10 HB2 ARG 10 4.821 6.200 4.339 80 HB3 ARG 10 HB1 ARG 10 5.839 5.831 2.946 81 HG2 ARG 10 HG2 ARG 10 5.661 8.502 4.361 82 HG3 ARG 10 HG1 ARG 10 7.006 7.364 4.464 83 HD2 ARG 10 HD2 ARG 10 7.391 7.603 2.024 84 HD3 ARG 10 HD1 ARG 10 6.062 8.768 1.936 85 HE ARG 10 HE ARG 10 8.694 9.308 3.032 86 HH11 ARG 10 HH11 ARG 10 5.827 10.746 2.164 87 HH12 ARG 10 HH12 ARG 10 5.826 11.944 3.415 88 HH21 ARG 10 HH21 ARG 10 8.459 10.524 5.149 89 HH22 ARG 10 HH22 ARG 10 7.305 11.810 5.105 90 H VAL 11 HN VAL 11 4.579 5.407 0.744 91 HA VAL 11 HA VAL 11 2.208 3.750 1.468 92 HB VAL 11 HB VAL 11 1.625 3.761 -1.024 93 HG11 VAL 11 HG11 VAL 11 1.422 6.317 0.593 94 HG12 VAL 11 HG12 VAL 11 0.261 4.990 0.566 95 HG13 VAL 11 HG13 VAL 11 0.490 5.989 -0.867 96 HG21 VAL 11 HG21 VAL 11 2.675 6.355 -1.570 97 HG22 VAL 11 HG22 VAL 11 3.016 4.848 -2.415 98 HG23 VAL 11 HG23 VAL 11 4.013 5.336 -1.044 99 H LEU 12 HN LEU 12 3.704 2.062 2.045 100 HA LEU 12 HA LEU 12 5.808 1.267 0.179 101 HB2 LEU 12 HB2 LEU 12 4.660 -0.147 2.608 102 HB3 LEU 12 HB1 LEU 12 6.257 -0.391 1.895 103 HG LEU 12 HG LEU 12 5.401 2.336 2.848 104 HD11 LEU 12 HD11 LEU 12 5.189 0.542 4.671 105 HD12 LEU 12 HD12 LEU 12 6.237 1.916 5.024 106 HD13 LEU 12 HD13 LEU 12 6.940 0.375 4.547 107 HD21 LEU 12 HD21 LEU 12 8.048 0.924 2.407 108 HD22 LEU 12 HD22 LEU 12 7.899 2.531 3.117 109 HD23 LEU 12 HD23 LEU 12 7.383 2.250 1.455 110 H VAL 13 HN VAL 13 4.531 0.813 -1.744 111 HA VAL 13 HA VAL 13 2.529 -1.349 -1.682 112 HB VAL 13 HB VAL 13 3.800 -0.223 -4.172 113 HG11 VAL 13 HG11 VAL 13 1.758 -1.940 -3.799 114 HG12 VAL 13 HG12 VAL 13 1.807 -0.810 -5.151 115 HG13 VAL 13 HG13 VAL 13 0.863 -0.423 -3.715 116 HG21 VAL 13 HG21 VAL 13 2.080 1.265 -2.185 117 HG22 VAL 13 HG22 VAL 13 2.012 1.656 -3.904 118 HG23 VAL 13 HG23 VAL 13 3.528 1.823 -3.021 119 H VAL 14 HN VAL 14 2.933 -3.434 -2.779 120 HA VAL 14 HA VAL 14 5.695 -3.998 -3.593 121 HB VAL 14 HB VAL 14 4.620 -4.227 -0.906 122 HG11 VAL 14 HG11 VAL 14 5.359 -6.731 -2.201 123 HG12 VAL 14 HG12 VAL 14 4.642 -6.456 -0.620 124 HG13 VAL 14 HG13 VAL 14 6.387 -6.373 -0.819 125 HG21 VAL 14 HG21 VAL 14 6.626 -3.341 -0.483 126 HG22 VAL 14 HG22 VAL 14 6.982 -3.435 -2.207 127 HG23 VAL 14 HG23 VAL 14 7.435 -4.764 -1.141 128 H GLU 15 HN GLU 15 5.544 -5.453 -5.184 129 HA GLU 15 HA GLU 15 3.780 -7.831 -4.953 130 HB2 GLU 15 HB2 GLU 15 2.294 -6.600 -6.209 131 HB3 GLU 15 HB1 GLU 15 3.552 -5.545 -6.848 132 HG2 GLU 15 HG2 GLU 15 4.328 -7.501 -8.269 133 HG3 GLU 15 HG1 GLU 15 2.876 -8.358 -7.754 134 H ASP 16 HN ASP 16 4.478 -9.456 -6.737 135 HA ASP 16 HA ASP 16 7.246 -9.884 -6.647 136 HB2 ASP 16 HB2 ASP 16 6.716 -11.296 -8.763 137 HB3 ASP 16 HB1 ASP 16 5.949 -11.702 -7.229 138 H GLU 17 HN GLU 17 5.597 -8.829 -9.691 139 HA GLU 17 HA GLU 17 8.216 -8.092 -10.768 140 HB2 GLU 17 HB2 GLU 17 7.015 -7.851 -12.825 141 HB3 GLU 17 HB1 GLU 17 6.317 -9.231 -11.980 142 HG2 GLU 17 HG2 GLU 17 5.043 -6.684 -11.270 143 HG3 GLU 17 HG1 GLU 17 4.892 -7.092 -12.979 144 H SER 18 HN SER 18 8.163 -6.000 -12.200 145 HA SER 18 HA SER 18 8.104 -3.731 -10.370 146 HB2 SER 18 HB2 SER 18 9.913 -3.803 -11.855 147 HB3 SER 18 HB1 SER 18 8.910 -4.328 -13.203 148 HG SER 18 HG SER 18 9.029 -2.267 -13.677 149 H MET 19 HN MET 19 5.708 -5.120 -12.356 150 HA MET 19 HA MET 19 4.364 -3.012 -13.608 151 HB2 MET 19 HB2 MET 19 3.828 -5.630 -12.684 152 HB3 MET 19 HB1 MET 19 2.539 -4.625 -12.031 153 HG2 MET 19 HG2 MET 19 2.274 -3.664 -14.377 154 HG3 MET 19 HG1 MET 19 3.336 -4.959 -14.930 155 HE1 MET 19 HE1 MET 19 -0.798 -4.739 -13.458 156 HE2 MET 19 HE2 MET 19 0.630 -3.946 -12.797 157 HE3 MET 19 HE3 MET 19 0.080 -5.471 -12.106 158 H ILE 20 HN ILE 20 4.819 -3.654 -10.224 159 HA ILE 20 HA ILE 20 2.830 -1.753 -9.247 160 HB ILE 20 HB ILE 20 3.530 -3.824 -8.093 161 HG12 ILE 20 HG12 ILE 20 4.513 -2.249 -5.989 162 HG13 ILE 20 HG11 ILE 20 3.496 -1.161 -6.941 163 HG21 ILE 20 HG21 ILE 20 5.700 -4.292 -7.455 164 HG22 ILE 20 HG22 ILE 20 6.135 -2.591 -7.307 165 HG23 ILE 20 HG23 ILE 20 6.035 -3.335 -8.897 166 HD11 ILE 20 HD11 ILE 20 2.584 -3.011 -5.078 167 HD12 ILE 20 HD12 ILE 20 2.302 -3.810 -6.624 168 HD13 ILE 20 HD13 ILE 20 1.602 -2.223 -6.313 169 H ALA 21 HN ALA 21 6.262 -1.715 -10.014 170 HA ALA 21 HA ALA 21 7.157 0.544 -8.581 171 HB1 ALA 21 HB1 ALA 21 8.852 0.631 -10.384 172 HB2 ALA 21 HB2 ALA 21 7.836 -0.409 -11.382 173 HB3 ALA 21 HB3 ALA 21 8.536 -1.032 -9.888 174 H MET 22 HN MET 22 6.492 0.734 -12.086 175 HA MET 22 HA MET 22 6.244 3.521 -12.222 176 HB2 MET 22 HB2 MET 22 6.309 1.689 -14.043 177 HB3 MET 22 HB1 MET 22 4.558 1.605 -13.842 178 HG2 MET 22 HG2 MET 22 4.273 3.879 -14.501 179 HG3 MET 22 HG1 MET 22 5.999 4.210 -14.363 180 HE1 MET 22 HE1 MET 22 3.798 3.700 -17.905 181 HE2 MET 22 HE2 MET 22 3.321 3.997 -16.235 182 HE3 MET 22 HE3 MET 22 3.241 2.363 -16.889 183 H LEU 23 HN LEU 23 3.901 1.171 -11.109 184 HA LEU 23 HA LEU 23 1.594 2.930 -11.167 185 HB2 LEU 23 HB2 LEU 23 1.249 0.581 -11.172 186 HB3 LEU 23 HB1 LEU 23 2.399 0.326 -9.867 187 HG LEU 23 HG LEU 23 -0.096 0.115 -9.298 188 HD11 LEU 23 HD11 LEU 23 0.791 0.248 -7.248 189 HD12 LEU 23 HD12 LEU 23 0.620 2.002 -7.314 190 HD13 LEU 23 HD13 LEU 23 2.117 1.241 -7.854 191 HD21 LEU 23 HD21 LEU 23 -1.417 1.859 -9.801 192 HD22 LEU 23 HD22 LEU 23 -0.030 2.824 -10.298 193 HD23 LEU 23 HD23 LEU 23 -0.542 2.820 -8.611 194 H ILE 24 HN ILE 24 4.421 3.029 -9.382 195 HA ILE 24 HA ILE 24 3.153 4.026 -6.890 196 HB ILE 24 HB ILE 24 5.223 2.354 -7.337 197 HG12 ILE 24 HG12 ILE 24 5.712 4.152 -5.043 198 HG13 ILE 24 HG11 ILE 24 4.060 3.550 -5.172 199 HG21 ILE 24 HG21 ILE 24 7.333 3.632 -6.798 200 HG22 ILE 24 HG22 ILE 24 6.456 5.117 -7.154 201 HG23 ILE 24 HG23 ILE 24 6.708 3.918 -8.420 202 HD11 ILE 24 HD11 ILE 24 5.169 1.903 -3.891 203 HD12 ILE 24 HD12 ILE 24 6.614 1.965 -4.898 204 HD13 ILE 24 HD13 ILE 24 5.138 1.224 -5.518 205 H GLU 25 HN GLU 25 5.567 5.068 -9.319 206 HA GLU 25 HA GLU 25 5.943 7.712 -8.300 207 HB2 GLU 25 HB2 GLU 25 6.348 6.234 -10.867 208 HB3 GLU 25 HB1 GLU 25 6.490 7.992 -10.905 209 HG2 GLU 25 HG2 GLU 25 7.871 6.990 -8.581 210 HG3 GLU 25 HG1 GLU 25 8.431 6.117 -10.012 211 H ASP 26 HN ASP 26 3.379 6.328 -10.260 212 HA ASP 26 HA ASP 26 2.333 8.902 -11.166 213 HB2 ASP 26 HB2 ASP 26 0.717 7.546 -12.250 214 HB3 ASP 26 HB1 ASP 26 2.157 6.529 -12.206 215 H THR 27 HN THR 27 1.396 6.522 -8.642 216 HA THR 27 HA THR 27 -0.895 7.959 -7.708 217 HB THR 27 HB THR 27 0.498 6.540 -5.621 218 HG1 THR 27 HG1 THR 27 0.207 4.539 -7.169 219 HG21 THR 27 HG21 THR 27 -2.075 6.622 -6.946 220 HG22 THR 27 HG22 THR 27 -1.684 6.092 -5.310 221 HG23 THR 27 HG23 THR 27 -1.576 4.955 -6.655 222 H LEU 28 HN LEU 28 2.509 7.947 -6.638 223 HA LEU 28 HA LEU 28 2.267 9.826 -4.520 224 HB2 LEU 28 HB2 LEU 28 4.357 8.913 -4.478 225 HB3 LEU 28 HB1 LEU 28 4.331 8.570 -6.203 226 HG LEU 28 HG LEU 28 4.634 11.428 -5.368 227 HD11 LEU 28 HD11 LEU 28 6.924 9.443 -5.302 228 HD12 LEU 28 HD12 LEU 28 6.167 10.138 -3.868 229 HD13 LEU 28 HD13 LEU 28 7.026 11.178 -5.005 230 HD21 LEU 28 HD21 LEU 28 5.837 9.671 -7.533 231 HD22 LEU 28 HD22 LEU 28 6.172 11.392 -7.342 232 HD23 LEU 28 HD23 LEU 28 4.544 10.851 -7.743 233 H CYS 29 HN CYS 29 2.429 10.241 -8.017 234 HA CYS 29 HA CYS 29 3.108 12.955 -8.276 235 HB2 CYS 29 HB2 CYS 29 2.185 10.906 -9.859 236 HB3 CYS 29 HB1 CYS 29 0.819 12.021 -9.890 237 HG CYS 29 HG CYS 29 3.200 13.688 -10.399 238 H GLU 30 HN GLU 30 0.145 11.482 -7.102 239 HA GLU 30 HA GLU 30 -1.277 14.060 -7.015 240 HB2 GLU 30 HB2 GLU 30 -2.484 12.125 -7.790 241 HB3 GLU 30 HB1 GLU 30 -1.968 11.180 -6.394 242 HG2 GLU 30 HG2 GLU 30 -3.618 12.013 -5.092 243 HG3 GLU 30 HG1 GLU 30 -3.328 13.664 -5.643 244 H LEU 31 HN LEU 31 -0.197 11.503 -4.765 245 HA LEU 31 HA LEU 31 -0.981 12.933 -2.364 246 HB2 LEU 31 HB2 LEU 31 0.525 10.486 -3.147 247 HB3 LEU 31 HB1 LEU 31 0.839 11.131 -1.534 248 HG LEU 31 HG LEU 31 -2.011 11.085 -2.158 249 HD11 LEU 31 HD11 LEU 31 -2.188 9.023 -3.052 250 HD12 LEU 31 HD12 LEU 31 -1.436 8.365 -1.598 251 HD13 LEU 31 HD13 LEU 31 -0.436 8.815 -2.980 252 HD21 LEU 31 HD21 LEU 31 -2.071 10.751 0.090 253 HD22 LEU 31 HD22 LEU 31 -0.330 11.029 0.054 254 HD23 LEU 31 HD23 LEU 31 -0.963 9.383 -0.008 255 H GLY 32 HN GLY 32 2.079 12.541 -4.138 256 HA2 GLY 32 HA2 GLY 32 3.957 14.010 -4.079 257 HA3 GLY 32 HA1 GLY 32 3.151 14.935 -2.800 258 H HIS 33 HN HIS 33 3.307 11.483 -2.600 259 HA HIS 33 HA HIS 33 4.249 11.220 -0.009 260 HB2 HIS 33 HB2 HIS 33 4.576 9.577 -2.521 261 HB3 HIS 33 HB1 HIS 33 5.191 8.994 -0.970 262 HD1 HIS 33 HD1 HIS 33 2.508 8.190 -2.854 263 HD2 HIS 33 HD2 HIS 33 2.682 9.843 0.968 264 HE1 HIS 33 HE1 HIS 33 0.313 7.622 -1.730 265 H GLU 34 HN GLU 34 6.532 10.163 0.538 266 HA GLU 34 HA GLU 34 8.584 11.958 -0.756 267 HB2 GLU 34 HB2 GLU 34 7.842 11.906 1.821 268 HB3 GLU 34 HB1 GLU 34 9.079 10.651 1.869 269 HG2 GLU 34 HG2 GLU 34 9.403 13.522 0.977 270 HG3 GLU 34 HG1 GLU 34 10.202 12.717 2.328 271 H VAL 35 HN VAL 35 7.826 8.628 0.082 272 HA VAL 35 HA VAL 35 9.822 7.616 -1.772 273 HB VAL 35 HB VAL 35 11.315 8.291 0.022 274 HG11 VAL 35 HG11 VAL 35 10.056 6.494 2.024 275 HG12 VAL 35 HG12 VAL 35 9.195 7.992 1.672 276 HG13 VAL 35 HG13 VAL 35 10.859 8.047 2.255 277 HG21 VAL 35 HG21 VAL 35 10.853 5.485 -0.643 278 HG22 VAL 35 HG22 VAL 35 11.612 5.671 0.938 279 HG23 VAL 35 HG23 VAL 35 12.376 6.361 -0.493 280 H ALA 36 HN ALA 36 8.040 6.347 -2.523 281 HA ALA 36 HA ALA 36 6.626 4.594 -0.641 282 HB1 ALA 36 HB1 ALA 36 6.502 5.222 -3.589 283 HB2 ALA 36 HB2 ALA 36 5.312 5.599 -2.345 284 HB3 ALA 36 HB3 ALA 36 5.526 3.934 -2.883 285 H ALA 37 HN ALA 37 6.365 2.219 -1.478 286 HA ALA 37 HA ALA 37 9.046 1.192 -2.363 287 HB1 ALA 37 HB1 ALA 37 7.446 -0.715 -0.873 288 HB2 ALA 37 HB2 ALA 37 7.622 0.777 0.050 289 HB3 ALA 37 HB3 ALA 37 9.054 -0.096 -0.497 290 H THR 38 HN THR 38 8.971 -0.421 -3.953 291 HA THR 38 HA THR 38 6.280 -1.372 -4.791 292 HB THR 38 HB THR 38 7.443 0.711 -6.002 293 HG1 THR 38 HG1 THR 38 5.839 0.332 -7.266 294 HG21 THR 38 HG21 THR 38 9.499 -0.725 -6.479 295 HG22 THR 38 HG22 THR 38 8.808 0.113 -7.867 296 HG23 THR 38 HG23 THR 38 8.497 -1.607 -7.630 297 H ALA 39 HN ALA 39 6.264 -3.397 -5.678 298 HA ALA 39 HA ALA 39 7.121 -5.450 -6.537 299 HB1 ALA 39 HB1 ALA 39 9.853 -4.940 -5.479 300 HB2 ALA 39 HB2 ALA 39 9.328 -3.962 -6.851 301 HB3 ALA 39 HB3 ALA 39 9.354 -5.722 -6.977 302 H SER 40 HN SER 40 7.950 -7.433 -5.296 303 HA SER 40 HA SER 40 7.126 -7.063 -2.482 304 HB2 SER 40 HB2 SER 40 6.407 -9.272 -2.615 305 HB3 SER 40 HB1 SER 40 6.164 -8.692 -4.246 306 HG SER 40 HG SER 40 7.331 -10.445 -4.634 307 H ARG 41 HN ARG 41 8.513 -7.078 -0.862 308 HA ARG 41 HA ARG 41 11.079 -8.545 -1.103 309 HB2 ARG 41 HB2 ARG 41 10.933 -5.889 -1.547 310 HB3 ARG 41 HB1 ARG 41 11.015 -5.876 0.217 311 HG2 ARG 41 HG2 ARG 41 13.243 -6.119 0.044 312 HG3 ARG 41 HG1 ARG 41 12.946 -7.750 -0.559 313 HD2 ARG 41 HD2 ARG 41 13.647 -7.164 -2.630 314 HD3 ARG 41 HD1 ARG 41 12.516 -5.795 -2.664 315 HE ARG 41 HE ARG 41 14.693 -5.211 -0.884 316 HH11 ARG 41 HH21 ARG 41 13.385 -3.618 -3.244 317 HH12 ARG 41 HH22 ARG 41 14.789 -3.337 -4.217 318 HH21 ARG 41 HH11 ARG 41 16.733 -5.682 -2.557 319 HH22 ARG 41 HH12 ARG 41 16.686 -4.507 -3.829 320 H MET 42 HN MET 42 10.995 -9.976 0.631 321 HA MET 42 HA MET 42 9.271 -9.745 2.873 322 HB2 MET 42 HB2 MET 42 11.869 -11.194 2.330 323 HB3 MET 42 HB1 MET 42 10.977 -11.415 3.836 324 HG2 MET 42 HG2 MET 42 8.994 -11.672 1.937 325 HG3 MET 42 HG1 MET 42 10.376 -12.428 1.143 326 HE1 MET 42 HE1 MET 42 11.394 -14.208 1.498 327 HE2 MET 42 HE2 MET 42 10.949 -15.585 2.504 328 HE3 MET 42 HE3 MET 42 12.027 -14.347 3.144 329 H GLN 43 HN GLN 43 12.546 -8.513 2.330 330 HA GLN 43 HA GLN 43 13.055 -7.750 5.079 331 HB2 GLN 43 HB2 GLN 43 14.188 -7.099 2.359 332 HB3 GLN 43 HB1 GLN 43 14.800 -6.295 3.805 333 HG2 GLN 43 HG2 GLN 43 15.748 -8.219 4.645 334 HG3 GLN 43 HG1 GLN 43 14.534 -9.264 3.908 335 HE21 GLN 43 HE21 GLN 43 17.575 -9.391 3.747 336 HE22 GLN 43 HE22 GLN 43 17.917 -9.387 2.084 337 H GLU 44 HN GLU 44 12.403 -5.685 2.206 338 HA GLU 44 HA GLU 44 11.878 -3.317 3.717 339 HB2 GLU 44 HB2 GLU 44 10.949 -4.194 0.964 340 HB3 GLU 44 HB1 GLU 44 10.957 -2.532 1.549 341 HG2 GLU 44 HG2 GLU 44 13.354 -2.516 1.721 342 HG3 GLU 44 HG1 GLU 44 13.445 -4.255 1.444 343 H ALA 45 HN ALA 45 9.676 -5.772 2.323 344 HA ALA 45 HA ALA 45 7.180 -4.671 2.912 345 HB1 ALA 45 HB1 ALA 45 7.560 -6.823 1.784 346 HB2 ALA 45 HB2 ALA 45 6.478 -7.058 3.157 347 HB3 ALA 45 HB3 ALA 45 8.176 -7.518 3.283 348 H LEU 46 HN LEU 46 9.446 -6.310 5.087 349 HA LEU 46 HA LEU 46 7.900 -6.440 7.447 350 HB2 LEU 46 HB2 LEU 46 10.223 -7.347 6.906 351 HB3 LEU 46 HB1 LEU 46 10.834 -5.721 7.215 352 HG LEU 46 HG LEU 46 9.300 -6.107 9.423 353 HD11 LEU 46 HD11 LEU 46 9.071 -8.288 10.019 354 HD12 LEU 46 HD12 LEU 46 10.659 -8.722 9.384 355 HD13 LEU 46 HD13 LEU 46 9.276 -8.602 8.295 356 HD21 LEU 46 HD21 LEU 46 12.170 -6.417 8.740 357 HD22 LEU 46 HD22 LEU 46 11.680 -7.096 10.292 358 HD23 LEU 46 HD23 LEU 46 11.409 -5.387 9.953 359 H ASP 47 HN ASP 47 9.685 -3.778 5.974 360 HA ASP 47 HA ASP 47 9.498 -1.906 8.130 361 HB2 ASP 47 HB2 ASP 47 9.608 -1.452 5.134 362 HB3 ASP 47 HB1 ASP 47 10.159 -0.333 6.382 363 H ILE 48 HN ILE 48 7.275 -2.841 5.555 364 HA ILE 48 HA ILE 48 5.457 -0.600 6.076 365 HB ILE 48 HB ILE 48 4.439 -1.236 4.122 366 HG12 ILE 48 HG12 ILE 48 4.861 -4.076 5.067 367 HG13 ILE 48 HG11 ILE 48 3.340 -3.216 4.846 368 HG21 ILE 48 HG21 ILE 48 6.841 -3.017 3.775 369 HG22 ILE 48 HG22 ILE 48 6.957 -1.259 3.763 370 HG23 ILE 48 HG23 ILE 48 5.984 -2.086 2.550 371 HD11 ILE 48 HD11 ILE 48 3.227 -4.100 2.773 372 HD12 ILE 48 HD12 ILE 48 4.854 -4.764 2.916 373 HD13 ILE 48 HD13 ILE 48 4.623 -3.114 2.339 374 H ALA 49 HN ALA 49 5.914 -3.839 7.268 375 HA ALA 49 HA ALA 49 3.125 -3.990 8.194 376 HB1 ALA 49 HB1 ALA 49 4.064 -5.976 7.240 377 HB2 ALA 49 HB2 ALA 49 3.955 -6.267 8.976 378 HB3 ALA 49 HB3 ALA 49 5.506 -5.850 8.247 379 H ARG 50 HN ARG 50 6.205 -4.700 9.858 380 HA ARG 50 HA ARG 50 5.218 -4.380 12.483 381 HB2 ARG 50 HB2 ARG 50 7.530 -4.468 13.091 382 HB3 ARG 50 HB1 ARG 50 7.374 -5.422 11.612 383 HG2 ARG 50 HG2 ARG 50 7.881 -3.083 10.459 384 HG3 ARG 50 HG1 ARG 50 8.639 -2.740 12.015 385 HD2 ARG 50 HD2 ARG 50 9.358 -5.403 11.114 386 HD3 ARG 50 HD1 ARG 50 9.785 -4.190 9.889 387 HE ARG 50 HE ARG 50 11.178 -4.507 12.330 388 HH11 ARG 50 HH21 ARG 50 10.184 -2.206 10.029 389 HH12 ARG 50 HH22 ARG 50 10.872 -0.852 10.862 390 HH21 ARG 50 HH11 ARG 50 11.798 -2.697 13.649 391 HH22 ARG 50 HH12 ARG 50 11.785 -1.130 12.911 392 H LYS 51 HN LYS 51 6.278 -1.909 10.203 393 HA LYS 51 HA LYS 51 6.930 0.192 11.970 394 HB2 LYS 51 HB2 LYS 51 7.293 0.405 9.619 395 HB3 LYS 51 HB1 LYS 51 5.594 0.088 9.260 396 HG2 LYS 51 HG2 LYS 51 5.033 2.256 9.564 397 HG3 LYS 51 HG1 LYS 51 5.908 2.331 11.090 398 HD2 LYS 51 HD2 LYS 51 7.609 2.203 8.671 399 HD3 LYS 51 HD1 LYS 51 6.676 3.688 8.865 400 HE2 LYS 51 HE2 LYS 51 8.019 4.397 10.550 401 HE3 LYS 51 HE1 LYS 51 7.890 2.836 11.386 402 HZ1 LYS 51 HZ1 LYS 51 9.660 3.501 9.096 403 HZ2 LYS 51 HZ2 LYS 51 9.416 1.921 9.672 404 HZ3 LYS 51 HZ3 LYS 51 10.139 3.091 10.670 405 H GLY 52 HN GLY 52 3.707 -0.661 10.648 406 HA2 GLY 52 HA2 GLY 52 1.600 -0.354 11.690 407 HA3 GLY 52 HA1 GLY 52 2.424 0.371 13.072 408 H GLN 53 HN GLN 53 3.791 2.475 11.946 409 HA GLN 53 HA GLN 53 1.556 4.219 11.004 410 HB2 GLN 53 HB2 GLN 53 2.963 6.017 11.893 411 HB3 GLN 53 HB1 GLN 53 2.802 4.745 13.104 412 HG2 GLN 53 HG2 GLN 53 4.995 4.066 12.885 413 HG3 GLN 53 HG1 GLN 53 5.087 4.552 11.192 414 HE21 GLN 53 HE21 GLN 53 3.754 6.808 13.531 415 HE22 GLN 53 HE22 GLN 53 5.078 7.869 13.545 416 H PHE 54 HN PHE 54 2.801 2.496 9.090 417 HA PHE 54 HA PHE 54 4.705 4.178 7.560 418 HB2 PHE 54 HB2 PHE 54 4.803 2.129 6.139 419 HB3 PHE 54 HB1 PHE 54 5.118 1.767 7.830 420 HD1 PHE 54 HD1 PHE 54 2.684 1.526 5.086 421 HD2 PHE 54 HD2 PHE 54 3.519 0.493 9.170 422 HE1 PHE 54 HE1 PHE 54 0.805 -0.073 5.067 423 HE2 PHE 54 HE2 PHE 54 1.641 -1.112 9.148 424 HZ PHE 54 HZ PHE 54 0.281 -1.404 7.092 425 H ASP 55 HN ASP 55 1.811 4.876 7.971 426 HA ASP 55 HA ASP 55 0.060 5.824 6.737 427 HB2 ASP 55 HB2 ASP 55 2.007 6.948 5.739 428 HB3 ASP 55 HB1 ASP 55 2.185 5.620 4.597 429 H ILE 56 HN ILE 56 1.562 3.832 4.169 430 HA ILE 56 HA ILE 56 -0.826 2.026 4.241 431 HB ILE 56 HB ILE 56 0.126 3.711 1.912 432 HG12 ILE 56 HG12 ILE 56 -2.449 3.596 3.510 433 HG13 ILE 56 HG11 ILE 56 -1.295 4.925 3.458 434 HG21 ILE 56 HG21 ILE 56 -0.471 1.734 0.835 435 HG22 ILE 56 HG22 ILE 56 -2.023 2.567 0.890 436 HG23 ILE 56 HG23 ILE 56 -1.659 1.304 2.065 437 HD11 ILE 56 HD11 ILE 56 -1.742 5.187 1.024 438 HD12 ILE 56 HD12 ILE 56 -3.190 5.437 2.000 439 HD13 ILE 56 HD13 ILE 56 -2.961 3.917 1.135 440 H ALA 57 HN ALA 57 -0.504 0.002 2.997 441 HA ALA 57 HA ALA 57 2.198 -0.478 1.871 442 HB1 ALA 57 HB1 ALA 57 1.114 -1.778 4.381 443 HB2 ALA 57 HB2 ALA 57 2.620 -0.876 4.201 444 HB3 ALA 57 HB3 ALA 57 2.443 -2.459 3.448 445 H ILE 58 HN ILE 58 1.902 -1.834 0.114 446 HA ILE 58 HA ILE 58 -0.525 -3.594 0.188 447 HB ILE 58 HB ILE 58 0.691 -1.899 -2.000 448 HG12 ILE 58 HG12 ILE 58 -1.763 -1.142 -2.072 449 HG13 ILE 58 HG11 ILE 58 -1.956 -2.004 -0.544 450 HG21 ILE 58 HG21 ILE 58 -1.575 -3.037 -3.076 451 HG22 ILE 58 HG22 ILE 58 -0.872 -4.386 -2.183 452 HG23 ILE 58 HG23 ILE 58 0.074 -3.559 -3.420 453 HD11 ILE 58 HD11 ILE 58 0.419 -0.293 -0.589 454 HD12 ILE 58 HD12 ILE 58 -0.860 -0.404 0.619 455 HD13 ILE 58 HD13 ILE 58 -1.080 0.610 -0.808 456 H ILE 59 HN ILE 59 0.661 -5.496 0.787 457 HA ILE 59 HA ILE 59 2.876 -6.368 -1.004 458 HB ILE 59 HB ILE 59 1.568 -7.571 1.480 459 HG12 ILE 59 HG12 ILE 59 4.421 -6.699 1.355 460 HG13 ILE 59 HG11 ILE 59 3.191 -5.436 1.444 461 HG21 ILE 59 HG21 ILE 59 2.876 -9.425 1.271 462 HG22 ILE 59 HG22 ILE 59 4.186 -8.532 0.504 463 HG23 ILE 59 HG23 ILE 59 2.788 -9.021 -0.444 464 HD11 ILE 59 HD11 ILE 59 4.130 -7.217 3.534 465 HD12 ILE 59 HD12 ILE 59 2.387 -7.372 3.315 466 HD13 ILE 59 HD13 ILE 59 3.093 -5.797 3.668 467 H ASP 60 HN ASP 60 0.834 -6.072 -2.554 468 HA ASP 60 HA ASP 60 -1.162 -8.118 -2.567 469 HB2 ASP 60 HB2 ASP 60 -1.963 -6.520 -3.943 470 HB3 ASP 60 HB1 ASP 60 -0.378 -5.762 -4.024 471 H VAL 61 HN VAL 61 -1.439 -9.423 -4.645 472 HA VAL 61 HA VAL 61 -0.684 -11.000 -6.183 473 HB VAL 61 HB VAL 61 1.453 -9.327 -5.911 474 HG11 VAL 61 HG11 VAL 61 2.614 -12.082 -5.466 475 HG12 VAL 61 HG12 VAL 61 2.399 -10.928 -4.150 476 HG13 VAL 61 HG13 VAL 61 3.463 -10.537 -5.498 477 HG21 VAL 61 HG21 VAL 61 1.782 -11.846 -7.499 478 HG22 VAL 61 HG22 VAL 61 2.091 -10.176 -7.973 479 HG23 VAL 61 HG23 VAL 61 0.433 -10.769 -7.861 480 H ASN 62 HN ASN 62 -1.917 -12.281 -4.589 481 HA ASN 62 HA ASN 62 -0.200 -14.008 -2.847 482 HB2 ASN 62 HB2 ASN 62 -3.107 -13.187 -2.890 483 HB3 ASN 62 HB1 ASN 62 -2.580 -14.582 -1.953 484 HD21 ASN 62 HD21 ASN 62 -1.212 -11.278 -2.501 485 HD22 ASN 62 HD22 ASN 62 -0.970 -10.954 -0.852 486 H LEU 63 HN LEU 63 -0.087 -14.504 -5.595 487 HA LEU 63 HA LEU 63 -1.597 -17.079 -5.815 488 HB2 LEU 63 HB2 LEU 63 -2.070 -14.667 -7.194 489 HB3 LEU 63 HB1 LEU 63 -1.219 -15.697 -8.344 490 HG LEU 63 HG LEU 63 -3.018 -17.444 -7.180 491 HD11 LEU 63 HD11 LEU 63 -5.187 -16.321 -7.220 492 HD12 LEU 63 HD12 LEU 63 -4.421 -14.799 -7.675 493 HD13 LEU 63 HD13 LEU 63 -4.127 -15.491 -6.080 494 HD21 LEU 63 HD21 LEU 63 -2.729 -15.962 -9.727 495 HD22 LEU 63 HD22 LEU 63 -4.335 -16.625 -9.425 496 HD23 LEU 63 HD23 LEU 63 -2.930 -17.692 -9.449 497 H ASP 64 HN ASP 64 -0.611 -18.317 -7.815 498 HA ASP 64 HA ASP 64 1.322 -19.459 -8.580 499 HB2 ASP 64 HB2 ASP 64 1.267 -16.703 -9.267 500 HB3 ASP 64 HB1 ASP 64 2.946 -17.089 -8.870 501 H GLY 65 HN GLY 65 1.130 -18.754 -5.604 502 HA2 GLY 65 HA2 GLY 65 3.130 -19.934 -4.368 503 HA3 GLY 65 HA1 GLY 65 4.029 -18.541 -4.962 504 H GLU 66 HN GLU 66 0.996 -17.413 -4.387 505 HA GLU 66 HA GLU 66 0.397 -15.745 -2.805 506 HB2 GLU 66 HB2 GLU 66 -0.602 -16.898 -0.994 507 HB3 GLU 66 HB1 GLU 66 -0.516 -18.097 -2.281 508 HG2 GLU 66 HG2 GLU 66 0.670 -19.439 -0.925 509 HG3 GLU 66 HG1 GLU 66 1.942 -18.225 -0.849 510 HA PRO 67 HA PRO 67 4.684 -15.471 -0.894 511 HB2 PRO 67 HB2 PRO 67 5.655 -13.429 -2.427 512 HB3 PRO 67 HB1 PRO 67 5.834 -15.139 -2.867 513 HG2 PRO 67 HG2 PRO 67 3.928 -13.109 -3.899 514 HG3 PRO 67 HG1 PRO 67 4.747 -14.426 -4.750 515 HD2 PRO 67 HD2 PRO 67 2.127 -14.509 -3.934 516 HD3 PRO 67 HD1 PRO 67 3.138 -15.944 -4.211 517 H SER 68 HN SER 68 2.686 -14.561 0.542 518 HA SER 68 HA SER 68 2.972 -11.576 0.712 519 HB2 SER 68 HB2 SER 68 0.746 -13.465 0.822 520 HB3 SER 68 HB1 SER 68 0.765 -12.394 2.218 521 HG SER 68 HG SER 68 1.201 -10.730 0.441 522 H TYR 69 HN TYR 69 4.231 -14.251 2.033 523 HA TYR 69 HA TYR 69 5.091 -14.905 4.102 524 HB2 TYR 69 HB2 TYR 69 5.580 -12.350 5.235 525 HB3 TYR 69 HB1 TYR 69 6.714 -13.388 4.389 526 HD1 TYR 69 HD1 TYR 69 7.207 -13.052 2.012 527 HD2 TYR 69 HD2 TYR 69 4.475 -10.479 4.097 528 HE1 TYR 69 HE1 TYR 69 7.353 -11.389 0.182 529 HE2 TYR 69 HE2 TYR 69 4.631 -8.820 2.280 530 HH TYR 69 HH TYR 69 6.934 -8.605 0.191 531 HA PRO 70 HA PRO 70 2.240 -14.611 7.370 532 HB2 PRO 70 HB2 PRO 70 3.841 -14.645 9.587 533 HB3 PRO 70 HB1 PRO 70 3.590 -16.068 8.558 534 HG2 PRO 70 HG2 PRO 70 5.898 -14.209 8.687 535 HG3 PRO 70 HG1 PRO 70 5.866 -15.951 8.381 536 HD2 PRO 70 HD2 PRO 70 6.170 -14.027 6.434 537 HD3 PRO 70 HD1 PRO 70 5.572 -15.674 6.143 538 H VAL 71 HN VAL 71 4.379 -12.059 6.738 539 HA VAL 71 HA VAL 71 3.515 -10.414 9.018 540 HB VAL 71 HB VAL 71 5.047 -8.766 8.082 541 HG11 VAL 71 HG11 VAL 71 6.208 -10.416 9.312 542 HG12 VAL 71 HG12 VAL 71 7.089 -10.331 7.786 543 HG13 VAL 71 HG13 VAL 71 5.947 -11.645 8.074 544 HG21 VAL 71 HG21 VAL 71 5.174 -10.641 5.713 545 HG22 VAL 71 HG22 VAL 71 6.204 -9.232 5.937 546 HG23 VAL 71 HG23 VAL 71 4.467 -9.028 5.711 547 H ALA 72 HN ALA 72 3.117 -10.288 5.434 548 HA ALA 72 HA ALA 72 1.301 -8.100 5.374 549 HB1 ALA 72 HB1 ALA 72 2.586 -9.622 3.593 550 HB2 ALA 72 HB2 ALA 72 1.123 -8.742 3.150 551 HB3 ALA 72 HB3 ALA 72 1.034 -10.457 3.555 552 H ASP 73 HN ASP 73 0.709 -11.627 5.431 553 HA ASP 73 HA ASP 73 -2.083 -11.659 5.499 554 HB2 ASP 73 HB2 ASP 73 0.148 -13.308 6.536 555 HB3 ASP 73 HB1 ASP 73 -1.458 -13.695 7.141 556 H ILE 74 HN ILE 74 0.097 -11.607 8.332 557 HA ILE 74 HA ILE 74 -1.931 -11.239 10.307 558 HB ILE 74 HB ILE 74 1.014 -10.834 10.040 559 HG12 ILE 74 HG12 ILE 74 0.064 -11.848 12.570 560 HG13 ILE 74 HG11 ILE 74 -0.821 -12.635 11.265 561 HG21 ILE 74 HG21 ILE 74 0.424 -8.711 11.084 562 HG22 ILE 74 HG22 ILE 74 1.132 -9.768 12.306 563 HG23 ILE 74 HG23 ILE 74 -0.614 -9.534 12.247 564 HD11 ILE 74 HD11 ILE 74 2.170 -12.360 11.109 565 HD12 ILE 74 HD12 ILE 74 1.122 -13.541 10.323 566 HD13 ILE 74 HD13 ILE 74 1.448 -13.664 12.052 567 H LEU 75 HN LEU 75 0.029 -8.936 8.469 568 HA LEU 75 HA LEU 75 -0.806 -6.489 9.475 569 HB2 LEU 75 HB2 LEU 75 0.755 -7.303 7.503 570 HB3 LEU 75 HB1 LEU 75 -0.666 -7.010 6.507 571 HG LEU 75 HG LEU 75 -0.745 -4.692 7.204 572 HD11 LEU 75 HD11 LEU 75 1.202 -5.684 9.254 573 HD12 LEU 75 HD12 LEU 75 -0.157 -4.577 9.446 574 HD13 LEU 75 HD13 LEU 75 1.343 -4.011 8.713 575 HD21 LEU 75 HD21 LEU 75 1.392 -3.912 6.311 576 HD22 LEU 75 HD22 LEU 75 0.893 -5.352 5.423 577 HD23 LEU 75 HD23 LEU 75 2.140 -5.470 6.664 578 H ALA 76 HN ALA 76 -2.653 -8.843 7.676 579 HA ALA 76 HA ALA 76 -4.861 -6.968 7.168 580 HB1 ALA 76 HB1 ALA 76 -4.938 -9.921 6.650 581 HB2 ALA 76 HB2 ALA 76 -3.847 -8.921 5.691 582 HB3 ALA 76 HB3 ALA 76 -5.581 -8.604 5.668 583 H GLU 77 HN GLU 77 -3.932 -9.501 9.397 584 HA GLU 77 HA GLU 77 -6.468 -10.291 10.418 585 HB2 GLU 77 HB2 GLU 77 -3.664 -10.105 11.529 586 HB3 GLU 77 HB1 GLU 77 -4.991 -10.753 12.494 587 HG2 GLU 77 HG2 GLU 77 -5.430 -12.476 10.842 588 HG3 GLU 77 HG1 GLU 77 -4.242 -11.776 9.741 589 H ARG 78 HN ARG 78 -4.354 -7.570 11.295 590 HA ARG 78 HA ARG 78 -6.601 -6.436 12.884 591 HB2 ARG 78 HB2 ARG 78 -4.634 -5.439 14.259 592 HB3 ARG 78 HB1 ARG 78 -4.996 -7.152 14.472 593 HG2 ARG 78 HG2 ARG 78 -3.249 -7.679 12.754 594 HG3 ARG 78 HG1 ARG 78 -2.829 -5.965 12.714 595 HD2 ARG 78 HD2 ARG 78 -2.707 -7.761 15.167 596 HD3 ARG 78 HD1 ARG 78 -1.315 -7.148 14.252 597 HE ARG 78 HE ARG 78 -2.260 -4.818 14.814 598 HH11 ARG 78 HH11 ARG 78 -4.538 -6.348 16.337 599 HH12 ARG 78 HH12 ARG 78 -4.051 -6.037 17.970 600 HH21 ARG 78 HH21 ARG 78 -0.873 -4.958 17.093 601 HH22 ARG 78 HH22 ARG 78 -1.976 -5.244 18.397 602 H ASN 79 HN ASN 79 -5.296 -6.126 10.077 603 HA ASN 79 HA ASN 79 -4.093 -4.163 9.014 604 HB2 ASN 79 HB2 ASN 79 -6.381 -3.215 8.067 605 HB3 ASN 79 HB1 ASN 79 -5.853 -4.852 7.686 606 HD21 ASN 79 HD21 ASN 79 -7.410 -6.432 8.078 607 HD22 ASN 79 HD22 ASN 79 -8.691 -6.284 9.181 608 H VAL 80 HN VAL 80 -3.145 -2.527 10.139 609 HA VAL 80 HA VAL 80 -4.634 -0.666 11.858 610 HB VAL 80 HB VAL 80 -2.092 -1.707 11.602 611 HG11 VAL 80 HG11 VAL 80 -2.029 0.381 9.759 612 HG12 VAL 80 HG12 VAL 80 -0.643 -0.414 10.488 613 HG13 VAL 80 HG13 VAL 80 -1.279 1.061 11.201 614 HG21 VAL 80 HG21 VAL 80 -3.400 0.362 13.208 615 HG22 VAL 80 HG22 VAL 80 -1.645 0.535 13.138 616 HG23 VAL 80 HG23 VAL 80 -2.361 -0.973 13.710 617 HA PRO 81 HA PRO 81 -5.367 2.522 8.812 618 HB2 PRO 81 HB2 PRO 81 -3.504 4.551 9.023 619 HB3 PRO 81 HB1 PRO 81 -4.894 4.377 10.118 620 HG2 PRO 81 HG2 PRO 81 -2.068 3.460 10.499 621 HG3 PRO 81 HG1 PRO 81 -3.129 4.321 11.631 622 HD2 PRO 81 HD2 PRO 81 -2.796 1.714 11.875 623 HD3 PRO 81 HD1 PRO 81 -4.413 2.409 12.083 624 H PHE 82 HN PHE 82 -4.985 2.038 6.704 625 HA PHE 82 HA PHE 82 -2.458 2.288 5.353 626 HB2 PHE 82 HB2 PHE 82 -1.705 0.023 5.406 627 HB3 PHE 82 HB1 PHE 82 -2.176 0.360 7.069 628 HD1 PHE 82 HD2 PHE 82 -5.223 0.265 6.697 629 HD2 PHE 82 HD1 PHE 82 -2.094 -2.338 5.308 630 HE1 PHE 82 HE2 PHE 82 -6.827 -1.610 6.635 631 HE2 PHE 82 HE1 PHE 82 -3.717 -4.221 5.252 632 HZ PHE 82 HZ PHE 82 -6.072 -3.856 5.909 633 H ILE 83 HN ILE 83 -2.814 -0.137 3.814 634 HA ILE 83 HA ILE 83 -5.445 -0.329 2.646 635 HB ILE 83 HB ILE 83 -3.486 1.622 1.718 636 HG12 ILE 83 HG12 ILE 83 -5.686 2.370 2.292 637 HG13 ILE 83 HG11 ILE 83 -5.558 2.508 0.543 638 HG21 ILE 83 HG21 ILE 83 -4.352 1.189 -0.744 639 HG22 ILE 83 HG22 ILE 83 -4.512 -0.467 -0.158 640 HG23 ILE 83 HG23 ILE 83 -2.938 0.329 -0.133 641 HD11 ILE 83 HD11 ILE 83 -7.615 1.428 0.793 642 HD12 ILE 83 HD12 ILE 83 -7.063 0.481 2.171 643 HD13 ILE 83 HD13 ILE 83 -6.519 0.071 0.545 644 H PHE 84 HN PHE 84 -5.421 -2.136 1.141 645 HA PHE 84 HA PHE 84 -2.782 -3.413 0.639 646 HB2 PHE 84 HB2 PHE 84 -4.003 -3.978 2.884 647 HB3 PHE 84 HB1 PHE 84 -5.019 -4.984 1.854 648 HD1 PHE 84 HD2 PHE 84 -1.564 -4.416 3.064 649 HD2 PHE 84 HD1 PHE 84 -4.161 -6.998 0.812 650 HE1 PHE 84 HE2 PHE 84 0.190 -6.173 3.051 651 HE2 PHE 84 HE1 PHE 84 -2.404 -8.754 0.803 652 HZ PHE 84 HZ PHE 84 -0.232 -8.336 1.920 653 H ALA 85 HN ALA 85 -3.082 -5.435 -0.710 654 HA ALA 85 HA ALA 85 -5.560 -5.647 -2.251 655 HB1 ALA 85 HB1 ALA 85 -4.805 -3.811 -3.458 656 HB2 ALA 85 HB2 ALA 85 -3.961 -5.086 -4.337 657 HB3 ALA 85 HB3 ALA 85 -3.112 -4.154 -3.104 658 H THR 86 HN THR 86 -5.485 -7.453 -3.735 659 HA THR 86 HA THR 86 -3.404 -9.063 -4.573 660 HB THR 86 HB THR 86 -2.485 -9.376 -2.439 661 HG1 THR 86 HG1 THR 86 -4.088 -11.537 -2.041 662 HG21 THR 86 HG21 THR 86 -3.772 -8.591 -0.741 663 HG22 THR 86 HG22 THR 86 -4.406 -10.234 -0.648 664 HG23 THR 86 HG23 THR 86 -5.268 -9.008 -1.576 665 H GLY 87 HN GLY 87 -4.348 -11.678 -3.931 666 HA2 GLY 87 HA2 GLY 87 -6.231 -12.315 -5.768 667 HA3 GLY 87 HA1 GLY 87 -6.194 -13.146 -4.212 668 H TYR 88 HN TYR 88 -7.361 -11.840 -2.394 669 HA TYR 88 HA TYR 88 -10.024 -11.083 -3.471 670 HB2 TYR 88 HB2 TYR 88 -10.655 -11.352 -1.060 671 HB3 TYR 88 HB1 TYR 88 -9.878 -12.785 -1.730 672 HD1 TYR 88 HD1 TYR 88 -9.339 -9.772 0.373 673 HD2 TYR 88 HD2 TYR 88 -7.762 -13.552 -0.919 674 HE1 TYR 88 HE1 TYR 88 -7.591 -9.643 2.125 675 HE2 TYR 88 HE2 TYR 88 -6.011 -13.420 0.833 676 HH TYR 88 HH TYR 88 -5.090 -10.763 2.308 677 H GLY 89 HN GLY 89 -7.274 -9.406 -2.919 678 HA2 GLY 89 HA2 GLY 89 -6.941 -7.076 -2.720 679 HA3 GLY 89 HA1 GLY 89 -8.689 -6.885 -2.588 680 H SER 90 HN SER 90 -9.548 -7.935 -0.434 681 HA SER 90 HA SER 90 -7.758 -7.835 1.854 682 HB2 SER 90 HB2 SER 90 -9.180 -5.449 0.886 683 HB3 SER 90 HB1 SER 90 -9.418 -5.778 2.597 684 HG SER 90 HG SER 90 -6.990 -5.423 1.183 685 H LYS 91 HN LYS 91 -8.846 -8.787 3.670 686 HA LYS 91 HA LYS 91 -11.449 -10.003 3.123 687 HB2 LYS 91 HB2 LYS 91 -10.473 -10.084 5.901 688 HB3 LYS 91 HB1 LYS 91 -10.891 -11.413 4.832 689 HG2 LYS 91 HG2 LYS 91 -8.647 -11.825 4.945 690 HG3 LYS 91 HG1 LYS 91 -8.575 -10.608 3.672 691 HD2 LYS 91 HD2 LYS 91 -6.959 -10.049 5.425 692 HD3 LYS 91 HD1 LYS 91 -8.254 -8.853 5.421 693 HE2 LYS 91 HE2 LYS 91 -7.592 -9.748 7.730 694 HE3 LYS 91 HE1 LYS 91 -9.317 -9.885 7.335 695 HZ1 LYS 91 HZ1 LYS 91 -7.524 -12.041 6.489 696 HZ2 LYS 91 HZ2 LYS 91 -9.160 -12.111 6.941 697 HZ3 LYS 91 HZ3 LYS 91 -7.953 -11.971 8.129 698 H GLY 92 HN GLY 92 -12.574 -7.846 2.858 699 HA2 GLY 92 HA2 GLY 92 -13.813 -6.030 3.723 700 HA3 GLY 92 HA1 GLY 92 -14.121 -7.110 5.090 701 H LEU 93 HN LEU 93 -10.891 -6.256 4.168 702 HA LEU 93 HA LEU 93 -9.758 -5.667 6.532 703 HB2 LEU 93 HB2 LEU 93 -8.194 -4.260 5.334 704 HB3 LEU 93 HB1 LEU 93 -8.697 -5.579 4.293 705 HG LEU 93 HG LEU 93 -8.792 -3.779 2.840 706 HD11 LEU 93 HD11 LEU 93 -11.171 -3.049 2.570 707 HD12 LEU 93 HD12 LEU 93 -11.549 -3.861 4.081 708 HD13 LEU 93 HD13 LEU 93 -10.972 -4.792 2.709 709 HD21 LEU 93 HD21 LEU 93 -9.536 -1.519 3.465 710 HD22 LEU 93 HD22 LEU 93 -8.224 -2.080 4.500 711 HD23 LEU 93 HD23 LEU 93 -9.878 -2.084 5.097 712 H ASP 94 HN ASP 94 -9.789 -4.183 8.113 713 HA ASP 94 HA ASP 94 -11.720 -1.903 7.845 714 HB2 ASP 94 HB2 ASP 94 -12.115 -2.185 10.193 715 HB3 ASP 94 HB1 ASP 94 -12.074 -3.819 9.532 716 H THR 95 HN THR 95 -11.013 0.154 8.759 717 HA THR 95 HA THR 95 -8.354 0.505 9.852 718 HB THR 95 HB THR 95 -7.744 -0.133 7.586 719 HG1 THR 95 HG1 THR 95 -6.716 1.793 6.962 720 HG21 THR 95 HG21 THR 95 -9.344 0.204 6.032 721 HG22 THR 95 HG22 THR 95 -8.673 1.828 5.902 722 HG23 THR 95 HG23 THR 95 -10.062 1.532 6.945 723 H ARG 96 HN ARG 96 -7.817 3.052 8.811 724 HA ARG 96 HA ARG 96 -10.075 4.622 9.962 725 HB2 ARG 96 HB2 ARG 96 -7.259 5.502 9.272 726 HB3 ARG 96 HB1 ARG 96 -8.379 6.268 10.400 727 HG2 ARG 96 HG2 ARG 96 -7.323 3.455 10.778 728 HG3 ARG 96 HG1 ARG 96 -6.555 4.877 11.485 729 HD2 ARG 96 HD2 ARG 96 -9.445 4.056 11.949 730 HD3 ARG 96 HD1 ARG 96 -8.114 3.828 13.102 731 HE ARG 96 HE ARG 96 -8.016 6.532 12.358 732 HH11 ARG 96 HH11 ARG 96 -9.832 4.300 14.212 733 HH12 ARG 96 HH12 ARG 96 -10.785 5.510 15.005 734 HH21 ARG 96 HH21 ARG 96 -9.433 8.138 13.190 735 HH22 ARG 96 HH22 ARG 96 -10.556 7.685 14.429 736 H TYR 97 HN TYR 97 -8.881 3.639 6.981 737 HA TYR 97 HA TYR 97 -9.214 6.160 5.527 738 HB2 TYR 97 HB2 TYR 97 -8.904 3.243 4.772 739 HB3 TYR 97 HB1 TYR 97 -9.054 4.520 3.569 740 HD1 TYR 97 HD2 TYR 97 -7.052 3.603 6.619 741 HD2 TYR 97 HD1 TYR 97 -7.156 5.670 2.853 742 HE1 TYR 97 HE2 TYR 97 -4.641 4.135 6.842 743 HE2 TYR 97 HE1 TYR 97 -4.747 6.203 3.080 744 HH TYR 97 HH TYR 97 -3.105 6.458 5.090 745 H SER 98 HN SER 98 -10.981 3.059 5.248 746 HA SER 98 HA SER 98 -13.601 3.830 5.744 747 HB2 SER 98 HB2 SER 98 -12.475 5.165 3.421 748 HB3 SER 98 HB1 SER 98 -13.910 4.238 2.984 749 HG SER 98 HG SER 98 -14.287 6.429 3.766 750 H ASN 99 HN ASN 99 -11.405 1.704 4.262 751 HA ASN 99 HA ASN 99 -11.661 -0.482 3.424 752 HB2 ASN 99 HB2 ASN 99 -14.417 -0.098 4.637 753 HB3 ASN 99 HB1 ASN 99 -13.629 -1.642 4.307 754 HD21 ASN 99 HD21 ASN 99 -10.983 -0.134 5.153 755 HD22 ASN 99 HD22 ASN 99 -11.028 -0.239 6.842 756 H ILE 100 HN ILE 100 -11.699 0.924 1.314 757 HA ILE 100 HA ILE 100 -14.111 0.086 -0.214 758 HB ILE 100 HB ILE 100 -13.159 2.699 -1.096 759 HG12 ILE 100 HG12 ILE 100 -14.671 3.532 1.088 760 HG13 ILE 100 HG11 ILE 100 -13.562 2.381 1.805 761 HG21 ILE 100 HG21 ILE 100 -15.822 2.792 -0.201 762 HG22 ILE 100 HG22 ILE 100 -15.572 1.157 -0.814 763 HG23 ILE 100 HG23 ILE 100 -15.255 2.547 -1.854 764 HD11 ILE 100 HD11 ILE 100 -11.675 3.619 1.206 765 HD12 ILE 100 HD12 ILE 100 -12.844 4.891 1.554 766 HD13 ILE 100 HD13 ILE 100 -12.514 4.435 -0.113 767 HA PRO 101 HA PRO 101 -10.697 0.795 -3.467 768 HB2 PRO 101 HB2 PRO 101 -8.292 1.833 -2.693 769 HB3 PRO 101 HB1 PRO 101 -9.665 2.834 -3.205 770 HG2 PRO 101 HG2 PRO 101 -8.739 2.174 -0.451 771 HG3 PRO 101 HG1 PRO 101 -9.296 3.719 -1.104 772 HD2 PRO 101 HD2 PRO 101 -10.870 2.151 0.397 773 HD3 PRO 101 HD1 PRO 101 -11.495 3.167 -0.912 774 H LEU 102 HN LEU 102 -10.984 -1.478 -1.831 775 HA LEU 102 HA LEU 102 -8.184 -2.454 -1.526 776 HB2 LEU 102 HB2 LEU 102 -8.923 -3.723 0.257 777 HB3 LEU 102 HB1 LEU 102 -10.126 -2.449 0.310 778 HG LEU 102 HG LEU 102 -11.237 -4.586 0.541 779 HD11 LEU 102 HD11 LEU 102 -12.497 -4.574 -1.819 780 HD12 LEU 102 HD12 LEU 102 -11.683 -3.023 -1.943 781 HD13 LEU 102 HD13 LEU 102 -12.766 -3.337 -0.596 782 HD21 LEU 102 HD21 LEU 102 -10.688 -5.651 -2.126 783 HD22 LEU 102 HD22 LEU 102 -10.670 -6.463 -0.562 784 HD23 LEU 102 HD23 LEU 102 -9.250 -5.572 -1.111 785 H LEU 103 HN LEU 103 -7.382 -4.032 -2.897 786 HA LEU 103 HA LEU 103 -9.116 -5.951 -4.243 787 HB2 LEU 103 HB2 LEU 103 -9.851 -3.715 -5.137 788 HB3 LEU 103 HB1 LEU 103 -8.237 -3.517 -5.808 789 HG LEU 103 HG LEU 103 -9.346 -6.098 -6.504 790 HD11 LEU 103 HD11 LEU 103 -10.945 -4.858 -8.169 791 HD12 LEU 103 HD12 LEU 103 -10.951 -3.613 -6.919 792 HD13 LEU 103 HD13 LEU 103 -11.500 -5.247 -6.541 793 HD21 LEU 103 HD21 LEU 103 -8.474 -3.657 -8.067 794 HD22 LEU 103 HD22 LEU 103 -8.780 -5.246 -8.763 795 HD23 LEU 103 HD23 LEU 103 -7.451 -5.023 -7.625 796 H THR 104 HN THR 104 -7.966 -7.167 -5.975 797 HA THR 104 HA THR 104 -5.241 -7.747 -5.503 798 HB THR 104 HB THR 104 -6.588 -9.284 -6.721 799 HG1 THR 104 HG1 THR 104 -5.051 -9.698 -8.066 800 HG21 THR 104 HG21 THR 104 -8.354 -8.412 -7.812 801 HG22 THR 104 HG22 THR 104 -7.253 -8.133 -9.161 802 HG23 THR 104 HG23 THR 104 -7.555 -6.851 -7.993 803 H LYS 105 HN LYS 105 -5.522 -6.852 -8.831 804 HA LYS 105 HA LYS 105 -4.635 -4.111 -8.606 805 HB2 LYS 105 HB2 LYS 105 -2.787 -6.080 -7.882 806 HB3 LYS 105 HB1 LYS 105 -2.301 -5.604 -9.510 807 HG2 LYS 105 HG2 LYS 105 -1.464 -3.665 -8.734 808 HG3 LYS 105 HG1 LYS 105 -3.013 -3.257 -7.995 809 HD2 LYS 105 HD2 LYS 105 -2.018 -3.540 -5.989 810 HD3 LYS 105 HD1 LYS 105 -1.953 -5.265 -6.355 811 HE2 LYS 105 HE2 LYS 105 0.180 -3.253 -7.158 812 HE3 LYS 105 HE1 LYS 105 0.304 -4.379 -5.791 813 HZ1 LYS 105 HZ1 LYS 105 0.717 -6.074 -7.157 814 HZ2 LYS 105 HZ2 LYS 105 0.923 -4.941 -8.406 815 HZ3 LYS 105 HZ3 LYS 105 -0.586 -5.684 -8.170 816 HA PRO 106 HA PRO 106 -5.281 -5.526 -12.974 817 HB2 PRO 106 HB2 PRO 106 -7.992 -5.311 -13.247 818 HB3 PRO 106 HB1 PRO 106 -7.208 -6.807 -12.705 819 HG2 PRO 106 HG2 PRO 106 -8.837 -4.925 -11.195 820 HG3 PRO 106 HG1 PRO 106 -8.356 -6.576 -10.786 821 HD2 PRO 106 HD2 PRO 106 -7.226 -4.081 -9.854 822 HD3 PRO 106 HD1 PRO 106 -6.871 -5.734 -9.327 823 H PHE 107 HN PHE 107 -5.843 -2.951 -10.951 824 HA PHE 107 HA PHE 107 -5.946 -0.644 -11.258 825 HB2 PHE 107 HB2 PHE 107 -5.292 -1.582 -14.064 826 HB3 PHE 107 HB1 PHE 107 -5.257 0.110 -13.562 827 HD1 PHE 107 HD1 PHE 107 -4.195 0.135 -10.920 828 HD2 PHE 107 HD2 PHE 107 -3.090 -2.409 -14.200 829 HE1 PHE 107 HE1 PHE 107 -1.963 -0.201 -9.901 830 HE2 PHE 107 HE2 PHE 107 -0.851 -2.744 -13.182 831 HZ PHE 107 HZ PHE 107 -0.285 -1.634 -11.034 832 H LEU 108 HN LEU 108 -8.139 -0.589 -10.695 833 HA LEU 108 HA LEU 108 -9.939 0.509 -12.683 834 HB2 LEU 108 HB2 LEU 108 -10.426 -1.632 -13.450 835 HB3 LEU 108 HB1 LEU 108 -10.001 -2.384 -11.915 836 HG LEU 108 HG LEU 108 -12.335 -0.624 -11.689 837 HD11 LEU 108 HD11 LEU 108 -12.678 -3.129 -13.345 838 HD12 LEU 108 HD12 LEU 108 -12.517 -1.531 -14.073 839 HD13 LEU 108 HD13 LEU 108 -13.875 -1.880 -13.003 840 HD21 LEU 108 HD21 LEU 108 -12.250 -3.596 -11.222 841 HD22 LEU 108 HD22 LEU 108 -13.094 -2.353 -10.298 842 HD23 LEU 108 HD23 LEU 108 -11.344 -2.518 -10.160 843 H ASP 109 HN ASP 109 -9.797 -1.273 -9.591 844 HA ASP 109 HA ASP 109 -11.193 1.009 -8.259 845 HB2 ASP 109 HB2 ASP 109 -12.715 -0.935 -8.904 846 HB3 ASP 109 HB1 ASP 109 -11.786 -1.925 -7.778 847 H SER 110 HN SER 110 -8.451 -0.706 -8.442 848 HA SER 110 HA SER 110 -7.996 -1.356 -5.618 849 HB2 SER 110 HB2 SER 110 -7.041 -2.666 -7.459 850 HB3 SER 110 HB1 SER 110 -6.238 -1.233 -8.091 851 HG SER 110 HG SER 110 -5.301 -2.929 -6.340 852 H GLU 111 HN GLU 111 -5.107 -0.181 -6.361 853 HA GLU 111 HA GLU 111 -4.926 1.942 -4.613 854 HB2 GLU 111 HB2 GLU 111 -3.557 0.995 -7.032 855 HB3 GLU 111 HB1 GLU 111 -3.334 2.722 -6.750 856 HG2 GLU 111 HG2 GLU 111 -3.076 1.019 -4.346 857 HG3 GLU 111 HG1 GLU 111 -1.821 0.792 -5.566 858 H LEU 112 HN LEU 112 -5.988 2.118 -7.999 859 HA LEU 112 HA LEU 112 -6.244 4.871 -8.394 860 HB2 LEU 112 HB2 LEU 112 -8.227 2.685 -9.117 861 HB3 LEU 112 HB1 LEU 112 -8.066 4.242 -9.932 862 HG LEU 112 HG LEU 112 -5.764 2.309 -9.677 863 HD11 LEU 112 HD11 LEU 112 -6.425 1.150 -11.532 864 HD12 LEU 112 HD12 LEU 112 -7.156 2.573 -12.277 865 HD13 LEU 112 HD13 LEU 112 -8.035 1.678 -11.037 866 HD21 LEU 112 HD21 LEU 112 -4.874 4.370 -10.280 867 HD22 LEU 112 HD22 LEU 112 -6.336 4.865 -11.132 868 HD23 LEU 112 HD23 LEU 112 -5.237 3.701 -11.871 869 H GLU 113 HN GLU 113 -8.970 2.822 -7.326 870 HA GLU 113 HA GLU 113 -10.658 4.863 -6.381 871 HB2 GLU 113 HB2 GLU 113 -10.250 1.975 -6.066 872 HB3 GLU 113 HB1 GLU 113 -10.976 2.712 -4.632 873 HG2 GLU 113 HG2 GLU 113 -12.276 3.916 -6.798 874 HG3 GLU 113 HG1 GLU 113 -12.158 2.211 -7.230 875 H ALA 114 HN ALA 114 -7.754 3.501 -5.043 876 HA ALA 114 HA ALA 114 -8.094 4.347 -2.304 877 HB1 ALA 114 HB1 ALA 114 -5.393 4.239 -3.551 878 HB2 ALA 114 HB2 ALA 114 -6.373 2.778 -3.668 879 HB3 ALA 114 HB3 ALA 114 -5.981 3.452 -2.087 880 H VAL 115 HN VAL 115 -7.203 6.022 -5.216 881 HA VAL 115 HA VAL 115 -6.307 8.388 -3.612 882 HB VAL 115 HB VAL 115 -6.116 8.068 -6.608 883 HG11 VAL 115 HG11 VAL 115 -5.518 10.181 -5.145 884 HG12 VAL 115 HG12 VAL 115 -4.437 9.681 -6.446 885 HG13 VAL 115 HG13 VAL 115 -4.057 9.263 -4.775 886 HG21 VAL 115 HG21 VAL 115 -5.209 5.993 -5.610 887 HG22 VAL 115 HG22 VAL 115 -4.188 6.952 -4.541 888 HG23 VAL 115 HG23 VAL 115 -3.916 6.983 -6.283 889 H LEU 116 HN LEU 116 -8.796 7.143 -5.694 890 HA LEU 116 HA LEU 116 -9.994 9.733 -6.359 891 HB2 LEU 116 HB2 LEU 116 -10.922 6.844 -6.526 892 HB3 LEU 116 HB1 LEU 116 -11.810 8.206 -7.210 893 HG LEU 116 HG LEU 116 -8.929 7.951 -7.938 894 HD11 LEU 116 HD11 LEU 116 -10.452 5.684 -8.117 895 HD12 LEU 116 HD12 LEU 116 -9.127 6.070 -9.215 896 HD13 LEU 116 HD13 LEU 116 -10.789 6.441 -9.674 897 HD21 LEU 116 HD21 LEU 116 -10.043 9.806 -8.891 898 HD22 LEU 116 HD22 LEU 116 -11.507 8.876 -9.210 899 HD23 LEU 116 HD23 LEU 116 -10.060 8.606 -10.183 900 H VAL 117 HN VAL 117 -10.712 7.044 -4.117 901 HA VAL 117 HA VAL 117 -13.084 8.111 -2.948 902 HB VAL 117 HB VAL 117 -12.522 6.528 -1.138 903 HG11 VAL 117 HG11 VAL 117 -12.212 5.840 -4.004 904 HG12 VAL 117 HG12 VAL 117 -13.351 5.214 -2.813 905 HG13 VAL 117 HG13 VAL 117 -11.695 4.610 -2.851 906 HG21 VAL 117 HG21 VAL 117 -9.791 6.788 -2.369 907 HG22 VAL 117 HG22 VAL 117 -10.235 5.306 -1.522 908 HG23 VAL 117 HG23 VAL 117 -10.252 6.848 -0.669 909 H GLN 118 HN GLN 118 -9.698 8.864 -2.500 910 HA GLN 118 HA GLN 118 -10.430 10.759 -0.300 911 HB2 GLN 118 HB2 GLN 118 -7.865 9.264 -0.931 912 HB3 GLN 118 HB1 GLN 118 -8.038 10.428 0.382 913 HG2 GLN 118 HG2 GLN 118 -9.127 8.940 1.700 914 HG3 GLN 118 HG1 GLN 118 -10.140 8.379 0.371 915 HE21 GLN 118 HE21 GLN 118 -6.595 8.350 0.196 916 HE22 GLN 118 HE22 GLN 118 -6.434 6.661 0.218 917 H ILE 119 HN ILE 119 -10.649 11.455 -3.124 918 HA ILE 119 HA ILE 119 -8.546 12.653 -4.431 919 HB ILE 119 HB ILE 119 -10.176 14.226 -5.290 920 HG12 ILE 119 HG12 ILE 119 -10.971 14.906 -2.979 921 HG13 ILE 119 HG11 ILE 119 -12.244 14.727 -4.183 922 HG21 ILE 119 HG21 ILE 119 -10.526 11.483 -5.247 923 HG22 ILE 119 HG22 ILE 119 -11.401 12.611 -6.282 924 HG23 ILE 119 HG23 ILE 119 -12.109 12.088 -4.756 925 HD11 ILE 119 HD11 ILE 119 -12.490 12.315 -3.314 926 HD12 ILE 119 HD12 ILE 119 -13.076 13.607 -2.267 927 HD13 ILE 119 HD13 ILE 119 -11.524 12.843 -1.936 928 H SER 120 HN SER 120 -9.953 13.688 -1.381 929 HA SER 120 HA SER 120 -7.782 15.732 -1.143 930 HB2 SER 120 HB2 SER 120 -10.709 16.056 -1.217 931 HB3 SER 120 HB1 SER 120 -9.941 16.859 0.149 932 HG SER 120 HG SER 120 -10.101 17.819 -2.200 933 H LYS 121 HN LYS 121 -10.560 14.719 0.867 934 HA LYS 121 HA LYS 121 -10.631 13.878 3.075 935 HB2 LYS 121 HB2 LYS 121 -9.340 12.067 1.984 936 HB3 LYS 121 HB1 LYS 121 -7.847 12.960 2.272 937 HG2 LYS 121 HG2 LYS 121 -7.810 12.459 4.499 938 HG3 LYS 121 HG1 LYS 121 -9.567 12.528 4.646 939 HD2 LYS 121 HD2 LYS 121 -9.491 10.260 4.716 940 HD3 LYS 121 HD1 LYS 121 -9.174 10.344 2.983 941 HE2 LYS 121 HE2 LYS 121 -6.955 10.501 5.048 942 HE3 LYS 121 HE1 LYS 121 -7.477 8.976 4.304 943 HZ1 LYS 121 HZ1 LYS 121 -5.664 10.116 3.068 944 HZ2 LYS 121 HZ2 LYS 121 -6.731 11.402 2.763 945 HZ3 LYS 121 HZ3 LYS 121 -7.061 9.856 2.143 946 H GLU 122 HN GLU 122 -9.912 16.572 2.726 947 HA GLU 122 HA GLU 122 -9.016 17.458 5.194 948 HB2 GLU 122 HB2 GLU 122 -6.564 18.015 4.500 949 HB3 GLU 122 HB1 GLU 122 -6.919 16.358 4.983 950 HG2 GLU 122 HG2 GLU 122 -6.600 15.543 2.877 951 HG3 GLU 122 HG1 GLU 122 -7.362 16.941 2.117 952 H VAL 123 HN VAL 123 -9.079 17.849 1.777 953 HA VAL 123 HA VAL 123 -9.630 19.696 0.480 954 HB VAL 123 HB VAL 123 -10.147 21.097 3.075 955 HG11 VAL 123 HG11 VAL 123 -10.378 22.453 1.051 956 HG12 VAL 123 HG12 VAL 123 -11.969 22.144 1.743 957 HG13 VAL 123 HG13 VAL 123 -11.429 21.233 0.333 958 HG21 VAL 123 HG21 VAL 123 -11.671 19.522 3.606 959 HG22 VAL 123 HG22 VAL 123 -11.284 18.627 2.136 960 HG23 VAL 123 HG23 VAL 123 -12.520 19.884 2.103 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 11.124 22.879 4.616 2 H2 GLY 1 HT2 GLY 1 10.715 24.223 3.660 3 H3 GLY 1 HT3 GLY 1 9.770 22.812 3.597 4 HA2 GLY 1 HA2 GLY 1 10.106 24.208 6.164 5 HA3 GLY 1 HA1 GLY 1 8.957 24.830 4.978 6 H SER 2 HN SER 2 9.899 21.687 6.423 7 HA SER 2 HA SER 2 7.563 20.230 5.859 8 HB2 SER 2 HB2 SER 2 9.740 20.233 7.862 9 HB3 SER 2 HB1 SER 2 8.284 19.376 8.360 10 HG SER 2 HG SER 2 10.138 18.439 6.850 11 H HIS 3 HN HIS 3 5.462 20.669 6.394 12 HA HIS 3 HA HIS 3 4.931 22.072 8.992 13 HB2 HIS 3 HB2 HIS 3 4.682 23.666 7.198 14 HB3 HIS 3 HB1 HIS 3 3.758 22.515 6.232 15 HD1 HIS 3 HD1 HIS 3 1.777 24.300 6.229 16 HD2 HIS 3 HD2 HIS 3 2.718 22.710 9.966 17 HE1 HIS 3 HE1 HIS 3 -0.159 24.872 7.759 18 H MET 4 HN MET 4 2.700 20.889 6.495 19 HA MET 4 HA MET 4 1.208 19.369 8.522 20 HB2 MET 4 HB2 MET 4 -0.444 19.242 6.803 21 HB3 MET 4 HB1 MET 4 0.304 20.827 6.611 22 HG2 MET 4 HG2 MET 4 1.847 19.806 4.898 23 HG3 MET 4 HG1 MET 4 0.891 18.327 5.003 24 HE1 MET 4 HE1 MET 4 1.094 21.880 4.673 25 HE2 MET 4 HE2 MET 4 -0.472 22.485 4.135 26 HE3 MET 4 HE3 MET 4 0.731 21.993 2.945 27 H THR 5 HN THR 5 3.939 18.669 6.783 28 HA THR 5 HA THR 5 3.237 15.754 6.654 29 HB THR 5 HB THR 5 4.982 15.825 4.730 30 HG1 THR 5 HG1 THR 5 4.162 18.509 4.571 31 HG21 THR 5 HG21 THR 5 2.857 17.309 3.537 32 HG22 THR 5 HG22 THR 5 2.166 16.319 4.822 33 HG23 THR 5 HG23 THR 5 3.099 15.562 3.532 34 H GLU 6 HN GLU 6 5.103 14.333 7.055 35 HA GLU 6 HA GLU 6 7.643 15.454 7.934 36 HB2 GLU 6 HB2 GLU 6 7.353 14.917 10.310 37 HB3 GLU 6 HB1 GLU 6 6.092 16.038 9.795 38 HG2 GLU 6 HG2 GLU 6 4.951 13.588 9.255 39 HG3 GLU 6 HG1 GLU 6 5.860 13.261 10.731 40 H ARG 7 HN ARG 7 7.815 13.665 6.143 41 HA ARG 7 HA ARG 7 8.623 11.506 5.606 42 HB2 ARG 7 HB2 ARG 7 9.170 12.012 8.468 43 HB3 ARG 7 HB1 ARG 7 9.196 10.313 8.005 44 HG2 ARG 7 HG2 ARG 7 10.916 10.654 6.413 45 HG3 ARG 7 HG1 ARG 7 10.672 12.401 6.404 46 HD2 ARG 7 HD2 ARG 7 11.464 12.503 8.771 47 HD3 ARG 7 HD1 ARG 7 11.794 10.760 8.706 48 HE ARG 7 HE ARG 7 13.329 11.295 6.752 49 HH11 ARG 7 HH11 ARG 7 12.254 14.262 7.091 50 HH12 ARG 7 HH12 ARG 7 13.702 15.008 7.679 51 HH21 ARG 7 HH21 ARG 7 15.287 12.002 8.358 52 HH22 ARG 7 HH22 ARG 7 15.420 13.729 8.393 53 H ARG 8 HN ARG 8 5.680 12.027 6.492 54 HA ARG 8 HA ARG 8 4.955 9.303 7.449 55 HB2 ARG 8 HB2 ARG 8 4.174 11.674 8.308 56 HB3 ARG 8 HB1 ARG 8 3.028 11.546 6.973 57 HG2 ARG 8 HG2 ARG 8 1.914 9.751 7.913 58 HG3 ARG 8 HG1 ARG 8 3.344 9.184 8.777 59 HD2 ARG 8 HD2 ARG 8 2.614 11.826 9.715 60 HD3 ARG 8 HD1 ARG 8 1.237 10.715 9.858 61 HE ARG 8 HE ARG 8 2.456 9.564 11.516 62 HH11 ARG 8 HH11 ARG 8 4.298 12.167 11.103 63 HH12 ARG 8 HH12 ARG 8 5.844 11.395 11.221 64 HH21 ARG 8 HH21 ARG 8 4.564 8.187 10.936 65 HH22 ARG 8 HH22 ARG 8 5.995 9.144 11.127 66 H LEU 9 HN LEU 9 4.919 11.160 4.500 67 HA LEU 9 HA LEU 9 2.802 9.462 3.338 68 HB2 LEU 9 HB2 LEU 9 4.174 12.037 2.685 69 HB3 LEU 9 HB1 LEU 9 3.333 11.168 1.398 70 HG LEU 9 HG LEU 9 1.414 11.002 3.225 71 HD11 LEU 9 HD11 LEU 9 1.341 13.108 4.564 72 HD12 LEU 9 HD12 LEU 9 2.982 13.470 4.027 73 HD13 LEU 9 HD13 LEU 9 2.675 12.051 5.030 74 HD21 LEU 9 HD21 LEU 9 2.084 12.881 1.109 75 HD22 LEU 9 HD22 LEU 9 1.085 13.644 2.347 76 HD23 LEU 9 HD23 LEU 9 0.517 12.189 1.529 77 H ARG 10 HN ARG 10 4.268 7.528 3.399 78 HA ARG 10 HA ARG 10 6.134 7.479 1.046 79 HB2 ARG 10 HB2 ARG 10 6.304 6.499 3.858 80 HB3 ARG 10 HB1 ARG 10 7.000 5.454 2.618 81 HG2 ARG 10 HG2 ARG 10 8.581 7.196 3.636 82 HG3 ARG 10 HG1 ARG 10 8.492 7.164 1.875 83 HD2 ARG 10 HD2 ARG 10 7.241 9.146 1.768 84 HD3 ARG 10 HD1 ARG 10 6.657 8.977 3.435 85 HE ARG 10 HE ARG 10 9.495 9.156 3.518 86 HH11 ARG 10 HH11 ARG 10 6.585 10.927 3.505 87 HH12 ARG 10 HH12 ARG 10 7.349 12.480 3.567 88 HH21 ARG 10 HH21 ARG 10 10.561 11.209 3.265 89 HH22 ARG 10 HH22 ARG 10 9.598 12.640 3.429 90 H VAL 11 HN VAL 11 5.869 5.677 -0.358 91 HA VAL 11 HA VAL 11 3.465 3.985 0.216 92 HB VAL 11 HB VAL 11 3.295 3.811 -2.248 93 HG11 VAL 11 HG11 VAL 11 2.746 6.014 -0.657 94 HG12 VAL 11 HG12 VAL 11 2.134 5.742 -2.288 95 HG13 VAL 11 HG13 VAL 11 3.588 6.710 -2.042 96 HG21 VAL 11 HG21 VAL 11 5.554 3.965 -2.996 97 HG22 VAL 11 HG22 VAL 11 5.817 5.480 -2.138 98 HG23 VAL 11 HG23 VAL 11 4.781 5.442 -3.560 99 H LEU 12 HN LEU 12 4.404 2.160 1.199 100 HA LEU 12 HA LEU 12 6.676 0.810 -0.185 101 HB2 LEU 12 HB2 LEU 12 5.309 0.789 2.492 102 HB3 LEU 12 HB1 LEU 12 6.220 -0.628 2.001 103 HG LEU 12 HG LEU 12 7.461 1.207 3.345 104 HD11 LEU 12 HD11 LEU 12 9.183 0.888 1.072 105 HD12 LEU 12 HD12 LEU 12 8.252 -0.593 1.298 106 HD13 LEU 12 HD13 LEU 12 9.234 0.041 2.618 107 HD21 LEU 12 HD21 LEU 12 7.614 2.453 0.587 108 HD22 LEU 12 HD22 LEU 12 8.281 3.089 2.090 109 HD23 LEU 12 HD23 LEU 12 6.535 3.044 1.851 110 H VAL 13 HN VAL 13 5.221 0.121 -2.039 111 HA VAL 13 HA VAL 13 3.249 -1.997 -1.229 112 HB VAL 13 HB VAL 13 2.127 -1.440 -3.326 113 HG11 VAL 13 HG11 VAL 13 1.126 0.344 -2.373 114 HG12 VAL 13 HG12 VAL 13 2.582 1.327 -2.537 115 HG13 VAL 13 HG13 VAL 13 2.381 0.275 -1.135 116 HG21 VAL 13 HG21 VAL 13 3.004 0.282 -4.826 117 HG22 VAL 13 HG22 VAL 13 4.211 -0.988 -4.619 118 HG23 VAL 13 HG23 VAL 13 4.383 0.541 -3.758 119 H VAL 14 HN VAL 14 3.436 -4.026 -2.217 120 HA VAL 14 HA VAL 14 5.468 -4.368 -4.326 121 HB VAL 14 HB VAL 14 6.688 -5.978 -2.858 122 HG11 VAL 14 HG11 VAL 14 7.891 -4.312 -1.650 123 HG12 VAL 14 HG12 VAL 14 6.478 -3.261 -1.569 124 HG13 VAL 14 HG13 VAL 14 7.294 -3.527 -3.111 125 HG21 VAL 14 HG21 VAL 14 4.637 -4.985 -0.893 126 HG22 VAL 14 HG22 VAL 14 6.186 -5.635 -0.354 127 HG23 VAL 14 HG23 VAL 14 5.075 -6.652 -1.270 128 H GLU 15 HN GLU 15 5.049 -6.071 -5.585 129 HA GLU 15 HA GLU 15 3.456 -8.385 -4.723 130 HB2 GLU 15 HB2 GLU 15 1.767 -8.026 -6.459 131 HB3 GLU 15 HB1 GLU 15 1.820 -6.607 -5.408 132 HG2 GLU 15 HG2 GLU 15 2.102 -5.396 -7.293 133 HG3 GLU 15 HG1 GLU 15 3.736 -6.059 -7.341 134 H ASP 16 HN ASP 16 3.979 -10.167 -6.083 135 HA ASP 16 HA ASP 16 6.329 -10.688 -7.157 136 HB2 ASP 16 HB2 ASP 16 5.004 -11.878 -9.095 137 HB3 ASP 16 HB1 ASP 16 4.778 -12.373 -7.419 138 H GLU 17 HN GLU 17 4.287 -10.118 -9.925 139 HA GLU 17 HA GLU 17 6.301 -9.200 -11.624 140 HB2 GLU 17 HB2 GLU 17 4.420 -8.433 -13.026 141 HB3 GLU 17 HB1 GLU 17 4.066 -9.994 -12.285 142 HG2 GLU 17 HG2 GLU 17 3.087 -8.409 -10.362 143 HG3 GLU 17 HG1 GLU 17 2.871 -7.320 -11.733 144 H SER 18 HN SER 18 6.038 -6.942 -12.785 145 HA SER 18 HA SER 18 6.489 -4.855 -10.702 146 HB2 SER 18 HB2 SER 18 8.270 -5.438 -12.336 147 HB3 SER 18 HB1 SER 18 7.186 -4.995 -13.653 148 HG SER 18 HG SER 18 7.636 -2.979 -13.284 149 H MET 19 HN MET 19 3.936 -5.871 -12.529 150 HA MET 19 HA MET 19 2.934 -3.657 -13.946 151 HB2 MET 19 HB2 MET 19 2.041 -6.093 -13.462 152 HB3 MET 19 HB1 MET 19 1.188 -5.310 -12.130 153 HG2 MET 19 HG2 MET 19 -0.078 -3.954 -13.570 154 HG3 MET 19 HG1 MET 19 1.056 -4.154 -14.906 155 HE1 MET 19 HE1 MET 19 -2.232 -5.468 -16.129 156 HE2 MET 19 HE2 MET 19 -0.700 -5.460 -17.000 157 HE3 MET 19 HE3 MET 19 -1.107 -4.117 -15.933 158 H ILE 20 HN ILE 20 3.400 -4.129 -10.558 159 HA ILE 20 HA ILE 20 1.646 -1.931 -9.705 160 HB ILE 20 HB ILE 20 1.916 -3.856 -8.296 161 HG12 ILE 20 HG12 ILE 20 3.767 -2.143 -6.766 162 HG13 ILE 20 HG11 ILE 20 2.357 -1.293 -7.407 163 HG21 ILE 20 HG21 ILE 20 4.835 -3.424 -8.811 164 HG22 ILE 20 HG22 ILE 20 3.892 -4.908 -8.937 165 HG23 ILE 20 HG23 ILE 20 4.317 -4.266 -7.351 166 HD11 ILE 20 HD11 ILE 20 1.152 -3.515 -6.448 167 HD12 ILE 20 HD12 ILE 20 1.386 -2.062 -5.482 168 HD13 ILE 20 HD13 ILE 20 2.510 -3.413 -5.331 169 H ALA 21 HN ALA 21 4.954 -2.421 -10.629 170 HA ALA 21 HA ALA 21 6.218 -0.215 -9.320 171 HB1 ALA 21 HB1 ALA 21 6.679 -1.678 -11.936 172 HB2 ALA 21 HB2 ALA 21 7.408 -2.048 -10.376 173 HB3 ALA 21 HB3 ALA 21 7.843 -0.564 -11.222 174 H MET 22 HN MET 22 5.398 -0.395 -12.806 175 HA MET 22 HA MET 22 5.583 2.365 -13.347 176 HB2 MET 22 HB2 MET 22 5.435 0.678 -15.087 177 HB3 MET 22 HB1 MET 22 3.843 0.170 -14.521 178 HG2 MET 22 HG2 MET 22 4.066 3.043 -15.166 179 HG3 MET 22 HG1 MET 22 4.251 1.962 -16.546 180 HE1 MET 22 HE1 MET 22 0.753 3.449 -16.715 181 HE2 MET 22 HE2 MET 22 1.604 2.408 -17.852 182 HE3 MET 22 HE3 MET 22 2.485 3.676 -17.003 183 H LEU 23 HN LEU 23 3.050 0.551 -11.770 184 HA LEU 23 HA LEU 23 0.996 2.617 -11.975 185 HB2 LEU 23 HB2 LEU 23 0.308 0.349 -11.709 186 HB3 LEU 23 HB1 LEU 23 1.461 0.069 -10.412 187 HG LEU 23 HG LEU 23 -1.022 0.318 -9.768 188 HD11 LEU 23 HD11 LEU 23 0.023 2.214 -7.980 189 HD12 LEU 23 HD12 LEU 23 1.409 1.265 -8.518 190 HD13 LEU 23 HD13 LEU 23 0.021 0.461 -7.789 191 HD21 LEU 23 HD21 LEU 23 -1.362 2.930 -9.285 192 HD22 LEU 23 HD22 LEU 23 -1.896 2.189 -10.793 193 HD23 LEU 23 HD23 LEU 23 -0.376 3.072 -10.737 194 H ILE 24 HN ILE 24 3.911 2.517 -10.382 195 HA ILE 24 HA ILE 24 2.943 3.918 -7.943 196 HB ILE 24 HB ILE 24 4.731 1.906 -8.340 197 HG12 ILE 24 HG12 ILE 24 5.319 3.899 -6.174 198 HG13 ILE 24 HG11 ILE 24 3.741 3.112 -6.214 199 HG21 ILE 24 HG21 ILE 24 6.383 3.185 -9.536 200 HG22 ILE 24 HG22 ILE 24 7.010 2.912 -7.913 201 HG23 ILE 24 HG23 ILE 24 6.330 4.480 -8.341 202 HD11 ILE 24 HD11 ILE 24 4.889 0.898 -6.281 203 HD12 ILE 24 HD12 ILE 24 5.259 1.808 -4.815 204 HD13 ILE 24 HD13 ILE 24 6.437 1.728 -6.125 205 H GLU 25 HN GLU 25 5.355 4.312 -10.557 206 HA GLU 25 HA GLU 25 6.211 6.932 -9.857 207 HB2 GLU 25 HB2 GLU 25 6.139 5.218 -12.318 208 HB3 GLU 25 HB1 GLU 25 6.658 6.898 -12.465 209 HG2 GLU 25 HG2 GLU 25 7.860 5.473 -10.181 210 HG3 GLU 25 HG1 GLU 25 8.308 4.817 -11.760 211 H ASP 26 HN ASP 26 3.406 5.821 -11.716 212 HA ASP 26 HA ASP 26 2.715 8.468 -12.702 213 HB2 ASP 26 HB2 ASP 26 0.942 7.309 -13.719 214 HB3 ASP 26 HB1 ASP 26 2.119 6.017 -13.495 215 H THR 27 HN THR 27 1.457 6.426 -10.019 216 HA THR 27 HA THR 27 -0.381 8.453 -9.085 217 HB THR 27 HB THR 27 0.542 6.623 -7.054 218 HG1 THR 27 HG1 THR 27 -0.324 5.400 -9.442 219 HG21 THR 27 HG21 THR 27 -1.670 7.295 -6.851 220 HG22 THR 27 HG22 THR 27 -1.869 5.719 -7.615 221 HG23 THR 27 HG23 THR 27 -1.966 7.188 -8.586 222 H LEU 28 HN LEU 28 2.932 7.494 -8.312 223 HA LEU 28 HA LEU 28 3.354 9.217 -6.059 224 HB2 LEU 28 HB2 LEU 28 4.893 7.456 -6.472 225 HB3 LEU 28 HB1 LEU 28 5.058 7.882 -8.169 226 HG LEU 28 HG LEU 28 6.956 8.478 -6.420 227 HD11 LEU 28 HD11 LEU 28 6.021 10.468 -8.505 228 HD12 LEU 28 HD12 LEU 28 6.936 9.000 -8.845 229 HD13 LEU 28 HD13 LEU 28 7.662 10.289 -7.886 230 HD21 LEU 28 HD21 LEU 28 6.619 10.242 -5.048 231 HD22 LEU 28 HD22 LEU 28 4.901 10.012 -5.360 232 HD23 LEU 28 HD23 LEU 28 5.823 11.178 -6.310 233 H CYS 29 HN CYS 29 3.689 9.664 -9.574 234 HA CYS 29 HA CYS 29 4.955 12.110 -9.810 235 HB2 CYS 29 HB2 CYS 29 4.139 10.932 -11.732 236 HB3 CYS 29 HB1 CYS 29 2.477 11.017 -11.152 237 HG CYS 29 HG CYS 29 2.300 13.413 -11.901 238 H GLU 30 HN GLU 30 1.611 11.508 -8.817 239 HA GLU 30 HA GLU 30 1.024 14.347 -8.404 240 HB2 GLU 30 HB2 GLU 30 -0.733 12.971 -9.252 241 HB3 GLU 30 HB1 GLU 30 -0.417 11.714 -8.056 242 HG2 GLU 30 HG2 GLU 30 -1.884 12.670 -6.644 243 HG3 GLU 30 HG1 GLU 30 -0.945 14.163 -6.666 244 H LEU 31 HN LEU 31 1.291 11.408 -6.391 245 HA LEU 31 HA LEU 31 0.892 12.637 -3.850 246 HB2 LEU 31 HB2 LEU 31 2.196 10.167 -4.934 247 HB3 LEU 31 HB1 LEU 31 2.496 10.586 -3.260 248 HG LEU 31 HG LEU 31 -0.254 10.275 -4.492 249 HD11 LEU 31 HD11 LEU 31 -0.157 8.087 -3.927 250 HD12 LEU 31 HD12 LEU 31 0.497 8.462 -2.332 251 HD13 LEU 31 HD13 LEU 31 1.579 8.306 -3.715 252 HD21 LEU 31 HD21 LEU 31 0.771 11.379 -1.965 253 HD22 LEU 31 HD22 LEU 31 -0.444 10.122 -1.732 254 HD23 LEU 31 HD23 LEU 31 -0.825 11.548 -2.696 255 H GLY 32 HN GLY 32 3.838 12.121 -5.783 256 HA2 GLY 32 HA2 GLY 32 5.959 13.122 -5.581 257 HA3 GLY 32 HA1 GLY 32 5.214 14.324 -4.515 258 H HIS 33 HN HIS 33 4.497 11.138 -3.589 259 HA HIS 33 HA HIS 33 5.456 11.197 -1.024 260 HB2 HIS 33 HB2 HIS 33 4.838 9.168 -3.081 261 HB3 HIS 33 HB1 HIS 33 5.798 8.583 -1.712 262 HD1 HIS 33 HD1 HIS 33 3.011 11.193 -1.628 263 HD2 HIS 33 HD2 HIS 33 3.865 7.399 -0.157 264 HE1 HIS 33 HE1 HIS 33 1.036 10.526 -0.182 265 H GLU 34 HN GLU 34 7.373 9.871 -0.118 266 HA GLU 34 HA GLU 34 9.872 10.849 -1.198 267 HB2 GLU 34 HB2 GLU 34 9.080 10.075 1.190 268 HB3 GLU 34 HB1 GLU 34 9.611 8.485 0.645 269 HG2 GLU 34 HG2 GLU 34 11.651 10.303 -0.099 270 HG3 GLU 34 HG1 GLU 34 11.208 10.707 1.560 271 H VAL 35 HN VAL 35 10.877 7.841 -0.571 272 HA VAL 35 HA VAL 35 11.006 7.118 -3.430 273 HB VAL 35 HB VAL 35 12.857 7.016 -1.590 274 HG11 VAL 35 HG11 VAL 35 11.812 4.230 -1.169 275 HG12 VAL 35 HG12 VAL 35 11.205 5.546 -0.164 276 HG13 VAL 35 HG13 VAL 35 12.926 5.164 -0.171 277 HG21 VAL 35 HG21 VAL 35 14.021 5.551 -2.953 278 HG22 VAL 35 HG22 VAL 35 12.674 5.949 -4.019 279 HG23 VAL 35 HG23 VAL 35 12.658 4.442 -3.105 280 H ALA 36 HN ALA 36 9.590 5.679 -4.363 281 HA ALA 36 HA ALA 36 7.603 4.347 -2.665 282 HB1 ALA 36 HB1 ALA 36 7.820 4.158 -5.655 283 HB2 ALA 36 HB2 ALA 36 7.342 5.678 -4.900 284 HB3 ALA 36 HB3 ALA 36 6.370 4.228 -4.655 285 H ALA 37 HN ALA 37 7.068 2.048 -3.029 286 HA ALA 37 HA ALA 37 9.464 0.397 -3.771 287 HB1 ALA 37 HB1 ALA 37 7.365 -0.533 -1.846 288 HB2 ALA 37 HB2 ALA 37 8.511 0.689 -1.294 289 HB3 ALA 37 HB3 ALA 37 9.094 -0.876 -1.862 290 H THR 38 HN THR 38 9.042 -1.275 -5.206 291 HA THR 38 HA THR 38 6.193 -1.894 -5.832 292 HB THR 38 HB THR 38 7.059 -0.295 -7.461 293 HG1 THR 38 HG1 THR 38 5.746 -1.918 -8.258 294 HG21 THR 38 HG21 THR 38 9.204 -0.327 -8.159 295 HG22 THR 38 HG22 THR 38 9.055 -2.003 -8.691 296 HG23 THR 38 HG23 THR 38 9.486 -1.644 -7.019 297 H ALA 39 HN ALA 39 6.137 -3.841 -7.389 298 HA ALA 39 HA ALA 39 6.433 -6.147 -7.629 299 HB1 ALA 39 HB1 ALA 39 9.176 -6.466 -7.135 300 HB2 ALA 39 HB2 ALA 39 9.005 -4.854 -7.831 301 HB3 ALA 39 HB3 ALA 39 8.398 -6.262 -8.704 302 H SER 40 HN SER 40 6.874 -8.106 -6.307 303 HA SER 40 HA SER 40 6.501 -7.567 -3.476 304 HB2 SER 40 HB2 SER 40 6.376 -9.997 -3.338 305 HB3 SER 40 HB1 SER 40 5.442 -9.423 -4.707 306 HG SER 40 HG SER 40 8.147 -10.252 -4.900 307 H ARG 41 HN ARG 41 8.012 -7.742 -1.818 308 HA ARG 41 HA ARG 41 10.676 -8.858 -2.348 309 HB2 ARG 41 HB2 ARG 41 10.269 -6.315 -3.091 310 HB3 ARG 41 HB1 ARG 41 10.596 -6.037 -1.381 311 HG2 ARG 41 HG2 ARG 41 12.788 -6.141 -1.890 312 HG3 ARG 41 HG1 ARG 41 12.554 -7.867 -2.173 313 HD2 ARG 41 HD2 ARG 41 11.587 -6.609 -4.502 314 HD3 ARG 41 HD1 ARG 41 13.110 -5.785 -4.107 315 HE ARG 41 HE ARG 41 13.070 -8.754 -3.978 316 HH11 ARG 41 HH11 ARG 41 13.753 -5.931 -5.828 317 HH12 ARG 41 HH12 ARG 41 15.128 -6.622 -6.621 318 HH21 ARG 41 HH21 ARG 41 14.968 -9.615 -4.877 319 HH22 ARG 41 HH22 ARG 41 15.815 -8.707 -6.085 320 H MET 42 HN MET 42 11.019 -10.029 -0.496 321 HA MET 42 HA MET 42 9.631 -9.724 1.959 322 HB2 MET 42 HB2 MET 42 12.257 -10.963 1.122 323 HB3 MET 42 HB1 MET 42 11.656 -11.100 2.776 324 HG2 MET 42 HG2 MET 42 9.585 -12.137 1.958 325 HG3 MET 42 HG1 MET 42 10.141 -11.964 0.293 326 HE1 MET 42 HE1 MET 42 10.243 -15.801 1.468 327 HE2 MET 42 HE2 MET 42 9.448 -14.662 0.384 328 HE3 MET 42 HE3 MET 42 9.212 -14.521 2.124 329 H GLN 43 HN GLN 43 12.704 -8.329 0.856 330 HA GLN 43 HA GLN 43 13.524 -7.230 3.390 331 HB2 GLN 43 HB2 GLN 43 14.555 -7.554 0.852 332 HB3 GLN 43 HB1 GLN 43 14.295 -5.811 0.919 333 HG2 GLN 43 HG2 GLN 43 15.464 -5.903 3.216 334 HG3 GLN 43 HG1 GLN 43 15.997 -7.517 2.737 335 HE21 GLN 43 HE21 GLN 43 15.897 -4.179 1.343 336 HE22 GLN 43 HE22 GLN 43 17.414 -4.297 0.590 337 H GLU 44 HN GLU 44 12.120 -5.613 0.510 338 HA GLU 44 HA GLU 44 11.623 -3.116 1.802 339 HB2 GLU 44 HB2 GLU 44 10.196 -4.435 -0.531 340 HB3 GLU 44 HB1 GLU 44 10.253 -2.705 -0.192 341 HG2 GLU 44 HG2 GLU 44 12.835 -4.205 -0.449 342 HG3 GLU 44 HG1 GLU 44 11.950 -3.784 -1.914 343 H ALA 45 HN ALA 45 9.573 -5.988 1.279 344 HA ALA 45 HA ALA 45 7.115 -5.054 2.276 345 HB1 ALA 45 HB1 ALA 45 7.072 -7.560 3.127 346 HB2 ALA 45 HB2 ALA 45 8.604 -7.666 2.264 347 HB3 ALA 45 HB3 ALA 45 7.131 -7.224 1.398 348 H LEU 46 HN LEU 46 9.991 -6.170 4.020 349 HA LEU 46 HA LEU 46 8.851 -6.037 6.657 350 HB2 LEU 46 HB2 LEU 46 10.917 -7.275 5.812 351 HB3 LEU 46 HB1 LEU 46 11.739 -5.715 5.805 352 HG LEU 46 HG LEU 46 10.292 -6.356 8.302 353 HD11 LEU 46 HD11 LEU 46 12.114 -7.863 9.082 354 HD12 LEU 46 HD12 LEU 46 12.767 -7.885 7.445 355 HD13 LEU 46 HD13 LEU 46 11.177 -8.575 7.770 356 HD21 LEU 46 HD21 LEU 46 11.771 -4.357 7.877 357 HD22 LEU 46 HD22 LEU 46 13.139 -5.462 7.763 358 HD23 LEU 46 HD23 LEU 46 12.250 -5.314 9.279 359 H ASP 47 HN ASP 47 10.609 -3.762 4.581 360 HA ASP 47 HA ASP 47 10.943 -1.679 6.534 361 HB2 ASP 47 HB2 ASP 47 12.076 -2.127 4.239 362 HB3 ASP 47 HB1 ASP 47 10.677 -1.301 3.553 363 H ILE 48 HN ILE 48 8.153 -2.872 5.032 364 HA ILE 48 HA ILE 48 6.766 -0.264 5.033 365 HB ILE 48 HB ILE 48 5.305 -1.245 3.556 366 HG12 ILE 48 HG12 ILE 48 5.659 -3.800 5.138 367 HG13 ILE 48 HG11 ILE 48 4.223 -2.790 5.036 368 HG21 ILE 48 HG21 ILE 48 7.265 -3.482 3.274 369 HG22 ILE 48 HG22 ILE 48 7.797 -1.829 2.975 370 HG23 ILE 48 HG23 ILE 48 6.480 -2.519 2.026 371 HD11 ILE 48 HD11 ILE 48 4.468 -3.283 2.434 372 HD12 ILE 48 HD12 ILE 48 3.662 -4.438 3.495 373 HD13 ILE 48 HD13 ILE 48 5.338 -4.703 3.013 374 H ALA 49 HN ALA 49 6.893 -3.333 6.783 375 HA ALA 49 HA ALA 49 4.624 -2.551 8.507 376 HB1 ALA 49 HB1 ALA 49 4.604 -4.811 7.905 377 HB2 ALA 49 HB2 ALA 49 5.329 -4.861 9.511 378 HB3 ALA 49 HB3 ALA 49 6.350 -4.970 8.078 379 H ARG 50 HN ARG 50 7.936 -3.758 9.177 380 HA ARG 50 HA ARG 50 8.080 -2.941 11.878 381 HB2 ARG 50 HB2 ARG 50 9.844 -3.811 9.706 382 HB3 ARG 50 HB1 ARG 50 10.661 -2.771 10.877 383 HG2 ARG 50 HG2 ARG 50 10.914 -4.699 12.058 384 HG3 ARG 50 HG1 ARG 50 9.242 -4.410 12.539 385 HD2 ARG 50 HD2 ARG 50 8.542 -5.730 10.466 386 HD3 ARG 50 HD1 ARG 50 10.241 -6.221 10.325 387 HE ARG 50 HE ARG 50 10.024 -7.079 12.703 388 HH11 ARG 50 HH11 ARG 50 7.153 -5.810 12.762 389 HH12 ARG 50 HH12 ARG 50 6.200 -7.256 12.711 390 HH21 ARG 50 HH21 ARG 50 8.849 -9.283 11.759 391 HH22 ARG 50 HH22 ARG 50 7.161 -9.225 12.143 392 H LYS 51 HN LYS 51 8.381 -1.022 8.974 393 HA LYS 51 HA LYS 51 9.966 1.130 9.946 394 HB2 LYS 51 HB2 LYS 51 9.530 0.865 7.619 395 HB3 LYS 51 HB1 LYS 51 7.784 0.857 7.873 396 HG2 LYS 51 HG2 LYS 51 8.549 3.030 6.986 397 HG3 LYS 51 HG1 LYS 51 7.874 3.205 8.607 398 HD2 LYS 51 HD2 LYS 51 9.830 4.037 9.358 399 HD3 LYS 51 HD1 LYS 51 10.679 2.593 8.807 400 HE2 LYS 51 HE2 LYS 51 10.326 3.810 6.420 401 HE3 LYS 51 HE1 LYS 51 10.397 5.239 7.469 402 HZ1 LYS 51 HZ1 LYS 51 12.548 4.901 7.865 403 HZ2 LYS 51 HZ2 LYS 51 12.540 3.744 6.622 404 HZ3 LYS 51 HZ3 LYS 51 12.311 3.262 8.235 405 H GLY 52 HN GLY 52 6.406 0.731 9.932 406 HA2 GLY 52 HA2 GLY 52 4.882 1.606 11.543 407 HA3 GLY 52 HA1 GLY 52 6.224 2.468 12.301 408 H GLN 53 HN GLN 53 7.237 4.156 10.600 409 HA GLN 53 HA GLN 53 4.957 5.887 9.801 410 HB2 GLN 53 HB2 GLN 53 6.619 7.637 9.835 411 HB3 GLN 53 HB1 GLN 53 6.892 6.629 11.256 412 HG2 GLN 53 HG2 GLN 53 8.509 5.309 9.659 413 HG3 GLN 53 HG1 GLN 53 8.501 6.809 8.730 414 HE21 GLN 53 HE21 GLN 53 10.913 6.050 9.943 415 HE22 GLN 53 HE22 GLN 53 11.244 7.075 11.255 416 H PHE 54 HN PHE 54 5.006 3.855 8.051 417 HA PHE 54 HA PHE 54 6.547 4.822 5.678 418 HB2 PHE 54 HB2 PHE 54 6.357 2.543 4.866 419 HB3 PHE 54 HB1 PHE 54 6.904 2.477 6.537 420 HD1 PHE 54 HD1 PHE 54 5.179 2.072 8.374 421 HD2 PHE 54 HD2 PHE 54 4.344 1.498 4.205 422 HE1 PHE 54 HE1 PHE 54 3.250 0.656 8.956 423 HE2 PHE 54 HE2 PHE 54 2.416 0.083 4.803 424 HZ PHE 54 HZ PHE 54 1.849 -0.342 7.172 425 H ASP 55 HN ASP 55 3.479 4.694 7.103 426 HA ASP 55 HA ASP 55 1.481 5.684 6.333 427 HB2 ASP 55 HB2 ASP 55 3.234 6.767 4.717 428 HB3 ASP 55 HB1 ASP 55 2.559 5.645 3.536 429 H ILE 56 HN ILE 56 2.470 3.766 3.450 430 HA ILE 56 HA ILE 56 0.127 1.987 4.070 431 HB ILE 56 HB ILE 56 0.933 3.255 1.438 432 HG12 ILE 56 HG12 ILE 56 -1.405 3.765 3.307 433 HG13 ILE 56 HG11 ILE 56 -0.048 4.856 3.023 434 HG21 ILE 56 HG21 ILE 56 -0.128 1.362 0.706 435 HG22 ILE 56 HG22 ILE 56 -1.547 2.361 0.999 436 HG23 ILE 56 HG23 ILE 56 -1.050 1.161 2.193 437 HD11 ILE 56 HD11 ILE 56 -2.461 4.732 1.566 438 HD12 ILE 56 HD12 ILE 56 -1.224 4.060 0.505 439 HD13 ILE 56 HD13 ILE 56 -1.027 5.681 1.172 440 H ALA 57 HN ALA 57 0.168 -0.164 3.044 441 HA ALA 57 HA ALA 57 2.748 -1.015 1.836 442 HB1 ALA 57 HB1 ALA 57 2.527 -2.965 3.651 443 HB2 ALA 57 HB2 ALA 57 1.725 -1.680 4.552 444 HB3 ALA 57 HB3 ALA 57 3.390 -1.469 4.009 445 H ILE 58 HN ILE 58 2.325 -2.609 0.268 446 HA ILE 58 HA ILE 58 -0.209 -4.154 0.612 447 HB ILE 58 HB ILE 58 0.700 -2.629 -1.842 448 HG12 ILE 58 HG12 ILE 58 -1.627 -1.537 -1.340 449 HG13 ILE 58 HG11 ILE 58 -1.382 -2.175 0.287 450 HG21 ILE 58 HG21 ILE 58 -1.372 -3.397 -2.864 451 HG22 ILE 58 HG22 ILE 58 -1.828 -4.239 -1.383 452 HG23 ILE 58 HG23 ILE 58 -0.449 -4.801 -2.328 453 HD11 ILE 58 HD11 ILE 58 -0.252 0.180 -0.863 454 HD12 ILE 58 HD12 ILE 58 1.060 -0.960 -0.566 455 HD13 ILE 58 HD13 ILE 58 0.000 -0.472 0.755 456 H ILE 59 HN ILE 59 0.958 -6.095 0.989 457 HA ILE 59 HA ILE 59 2.863 -7.065 -1.082 458 HB ILE 59 HB ILE 59 1.835 -7.937 1.628 459 HG12 ILE 59 HG12 ILE 59 4.531 -8.295 1.594 460 HG13 ILE 59 HG11 ILE 59 4.366 -7.014 0.399 461 HG21 ILE 59 HG21 ILE 59 1.779 -10.064 0.727 462 HG22 ILE 59 HG22 ILE 59 3.497 -9.961 1.111 463 HG23 ILE 59 HG23 ILE 59 2.944 -9.673 -0.539 464 HD11 ILE 59 HD11 ILE 59 4.607 -6.405 2.951 465 HD12 ILE 59 HD12 ILE 59 2.883 -6.774 2.990 466 HD13 ILE 59 HD13 ILE 59 3.488 -5.503 1.928 467 H ASP 60 HN ASP 60 0.771 -6.622 -2.464 468 HA ASP 60 HA ASP 60 -1.587 -8.097 -2.348 469 HB2 ASP 60 HB2 ASP 60 -1.696 -6.556 -4.022 470 HB3 ASP 60 HB1 ASP 60 0.033 -6.653 -4.330 471 H VAL 61 HN VAL 61 -2.205 -9.780 -4.067 472 HA VAL 61 HA VAL 61 -1.995 -11.914 -4.980 473 HB VAL 61 HB VAL 61 0.386 -10.559 -5.400 474 HG11 VAL 61 HG11 VAL 61 1.065 -13.371 -4.486 475 HG12 VAL 61 HG12 VAL 61 1.486 -11.908 -3.597 476 HG13 VAL 61 HG13 VAL 61 2.178 -12.200 -5.190 477 HG21 VAL 61 HG21 VAL 61 0.267 -11.675 -7.369 478 HG22 VAL 61 HG22 VAL 61 -1.254 -12.293 -6.723 479 HG23 VAL 61 HG23 VAL 61 0.219 -13.254 -6.584 480 H ASN 62 HN ASN 62 -3.069 -12.564 -3.011 481 HA ASN 62 HA ASN 62 -1.311 -14.000 -1.053 482 HB2 ASN 62 HB2 ASN 62 -3.938 -12.541 -0.933 483 HB3 ASN 62 HB1 ASN 62 -3.632 -13.827 0.231 484 HD21 ASN 62 HD21 ASN 62 -0.769 -12.193 -0.839 485 HD22 ASN 62 HD22 ASN 62 -0.563 -11.213 0.533 486 H LEU 63 HN LEU 63 -1.390 -15.601 -3.019 487 HA LEU 63 HA LEU 63 -3.622 -17.526 -2.553 488 HB2 LEU 63 HB2 LEU 63 -3.148 -15.814 -4.846 489 HB3 LEU 63 HB1 LEU 63 -3.026 -17.507 -5.319 490 HG LEU 63 HG LEU 63 -5.216 -17.952 -4.260 491 HD11 LEU 63 HD11 LEU 63 -5.652 -16.421 -2.593 492 HD12 LEU 63 HD12 LEU 63 -6.471 -15.579 -3.908 493 HD13 LEU 63 HD13 LEU 63 -4.836 -15.110 -3.444 494 HD21 LEU 63 HD21 LEU 63 -4.692 -16.611 -6.660 495 HD22 LEU 63 HD22 LEU 63 -6.009 -15.689 -5.933 496 HD23 LEU 63 HD23 LEU 63 -6.202 -17.417 -6.231 497 H ASP 64 HN ASP 64 -3.012 -19.658 -3.747 498 HA ASP 64 HA ASP 64 -1.449 -21.394 -4.049 499 HB2 ASP 64 HB2 ASP 64 -0.262 -20.603 -5.812 500 HB3 ASP 64 HB1 ASP 64 -0.577 -18.951 -5.287 501 H GLY 65 HN GLY 65 -1.602 -19.609 -1.485 502 HA2 GLY 65 HA2 GLY 65 -0.471 -20.748 0.526 503 HA3 GLY 65 HA1 GLY 65 1.031 -20.397 -0.327 504 H GLU 66 HN GLU 66 -1.260 -17.980 -0.852 505 HA GLU 66 HA GLU 66 -1.000 -15.681 -0.341 506 HB2 GLU 66 HB2 GLU 66 -2.175 -15.319 1.674 507 HB3 GLU 66 HB1 GLU 66 -2.679 -16.930 1.178 508 HG2 GLU 66 HG2 GLU 66 -2.067 -17.611 3.241 509 HG3 GLU 66 HG1 GLU 66 -0.402 -17.397 2.713 510 HA PRO 67 HA PRO 67 3.326 -16.159 1.284 511 HB2 PRO 67 HB2 PRO 67 4.514 -14.904 -0.844 512 HB3 PRO 67 HB1 PRO 67 4.212 -16.652 -0.783 513 HG2 PRO 67 HG2 PRO 67 2.660 -14.511 -2.157 514 HG3 PRO 67 HG1 PRO 67 3.053 -16.149 -2.706 515 HD2 PRO 67 HD2 PRO 67 0.621 -15.480 -1.709 516 HD3 PRO 67 HD1 PRO 67 1.326 -17.104 -1.533 517 H SER 68 HN SER 68 1.957 -14.458 2.629 518 HA SER 68 HA SER 68 2.869 -11.686 1.940 519 HB2 SER 68 HB2 SER 68 0.902 -10.955 3.070 520 HB3 SER 68 HB1 SER 68 0.388 -12.373 2.161 521 HG SER 68 HG SER 68 0.231 -13.497 3.976 522 H TYR 69 HN TYR 69 3.824 -14.235 3.734 523 HA TYR 69 HA TYR 69 4.978 -14.563 5.740 524 HB2 TYR 69 HB2 TYR 69 6.278 -12.105 6.084 525 HB3 TYR 69 HB1 TYR 69 6.885 -13.486 5.182 526 HD1 TYR 69 HD2 TYR 69 6.195 -13.662 2.673 527 HD2 TYR 69 HD1 TYR 69 5.814 -10.102 5.013 528 HE1 TYR 69 HE2 TYR 69 6.076 -12.300 0.599 529 HE2 TYR 69 HE1 TYR 69 5.690 -8.736 2.961 530 HH TYR 69 HH TYR 69 5.516 -10.245 -0.223 531 HA PRO 70 HA PRO 70 2.926 -12.899 9.181 532 HB2 PRO 70 HB2 PRO 70 4.877 -12.373 11.021 533 HB3 PRO 70 HB1 PRO 70 4.376 -14.018 10.583 534 HG2 PRO 70 HG2 PRO 70 6.741 -12.456 9.667 535 HG3 PRO 70 HG1 PRO 70 6.615 -14.174 10.081 536 HD2 PRO 70 HD2 PRO 70 6.645 -13.263 7.518 537 HD3 PRO 70 HD1 PRO 70 5.802 -14.748 8.012 538 H VAL 71 HN VAL 71 5.059 -10.886 7.464 539 HA VAL 71 HA VAL 71 4.824 -8.515 9.149 540 HB VAL 71 HB VAL 71 5.623 -9.049 6.296 541 HG11 VAL 71 HG11 VAL 71 5.421 -6.864 5.849 542 HG12 VAL 71 HG12 VAL 71 6.565 -6.525 7.146 543 HG13 VAL 71 HG13 VAL 71 4.835 -6.574 7.485 544 HG21 VAL 71 HG21 VAL 71 7.080 -8.502 8.865 545 HG22 VAL 71 HG22 VAL 71 7.853 -8.236 7.302 546 HG23 VAL 71 HG23 VAL 71 7.297 -9.849 7.748 547 H ALA 72 HN ALA 72 3.641 -9.124 5.856 548 HA ALA 72 HA ALA 72 1.708 -7.098 5.695 549 HB1 ALA 72 HB1 ALA 72 1.910 -9.895 4.575 550 HB2 ALA 72 HB2 ALA 72 2.350 -8.381 3.787 551 HB3 ALA 72 HB3 ALA 72 0.654 -8.770 4.070 552 H ASP 73 HN ASP 73 1.162 -10.532 6.594 553 HA ASP 73 HA ASP 73 -1.556 -10.341 7.228 554 HB2 ASP 73 HB2 ASP 73 0.770 -11.985 8.040 555 HB3 ASP 73 HB1 ASP 73 -0.678 -12.143 9.025 556 H ILE 74 HN ILE 74 1.199 -10.019 9.481 557 HA ILE 74 HA ILE 74 -0.233 -9.227 11.793 558 HB ILE 74 HB ILE 74 2.506 -8.627 10.663 559 HG12 ILE 74 HG12 ILE 74 1.635 -10.151 13.139 560 HG13 ILE 74 HG11 ILE 74 1.897 -10.909 11.568 561 HG21 ILE 74 HG21 ILE 74 1.465 -7.771 13.382 562 HG22 ILE 74 HG22 ILE 74 1.800 -6.679 12.037 563 HG23 ILE 74 HG23 ILE 74 3.116 -7.578 12.792 564 HD11 ILE 74 HD11 ILE 74 4.199 -9.407 11.917 565 HD12 ILE 74 HD12 ILE 74 4.056 -11.139 12.216 566 HD13 ILE 74 HD13 ILE 74 3.863 -9.996 13.545 567 H LEU 75 HN LEU 75 1.125 -7.287 9.149 568 HA LEU 75 HA LEU 75 0.332 -4.713 10.036 569 HB2 LEU 75 HB2 LEU 75 1.805 -5.679 8.057 570 HB3 LEU 75 HB1 LEU 75 0.299 -5.549 7.150 571 HG LEU 75 HG LEU 75 0.249 -3.127 8.257 572 HD11 LEU 75 HD11 LEU 75 3.032 -4.131 8.598 573 HD12 LEU 75 HD12 LEU 75 2.139 -2.952 9.557 574 HD13 LEU 75 HD13 LEU 75 2.853 -2.477 8.016 575 HD21 LEU 75 HD21 LEU 75 0.233 -3.174 5.926 576 HD22 LEU 75 HD22 LEU 75 1.681 -4.177 5.835 577 HD23 LEU 75 HD23 LEU 75 1.819 -2.462 6.225 578 H ALA 76 HN ALA 76 -1.443 -7.345 8.577 579 HA ALA 76 HA ALA 76 -3.792 -5.687 7.997 580 HB1 ALA 76 HB1 ALA 76 -3.749 -7.306 6.396 581 HB2 ALA 76 HB2 ALA 76 -4.475 -8.334 7.633 582 HB3 ALA 76 HB3 ALA 76 -2.730 -8.359 7.378 583 H GLU 77 HN GLU 77 -2.497 -7.317 10.675 584 HA GLU 77 HA GLU 77 -4.976 -8.268 11.861 585 HB2 GLU 77 HB2 GLU 77 -2.111 -7.883 12.703 586 HB3 GLU 77 HB1 GLU 77 -3.332 -8.303 13.904 587 HG2 GLU 77 HG2 GLU 77 -3.810 -10.032 11.741 588 HG3 GLU 77 HG1 GLU 77 -2.056 -10.005 11.932 589 H ARG 78 HN ARG 78 -2.726 -5.617 12.721 590 HA ARG 78 HA ARG 78 -4.828 -4.308 14.318 591 HB2 ARG 78 HB2 ARG 78 -2.885 -2.747 14.811 592 HB3 ARG 78 HB1 ARG 78 -2.608 -4.431 15.257 593 HG2 ARG 78 HG2 ARG 78 -1.854 -3.930 12.489 594 HG3 ARG 78 HG1 ARG 78 -0.982 -2.870 13.599 595 HD2 ARG 78 HD2 ARG 78 -1.167 -5.639 14.570 596 HD3 ARG 78 HD1 ARG 78 -0.264 -5.480 13.051 597 HE ARG 78 HE ARG 78 1.260 -3.955 14.154 598 HH11 ARG 78 HH11 ARG 78 -0.345 -6.076 16.183 599 HH12 ARG 78 HH12 ARG 78 -0.002 -5.221 17.650 600 HH21 ARG 78 HH21 ARG 78 1.326 -2.452 16.042 601 HH22 ARG 78 HH22 ARG 78 0.949 -3.176 17.570 602 H ASN 79 HN ASN 79 -3.341 -4.117 11.211 603 HA ASN 79 HA ASN 79 -3.464 -2.514 9.474 604 HB2 ASN 79 HB2 ASN 79 -6.285 -2.282 10.557 605 HB3 ASN 79 HB1 ASN 79 -5.759 -2.230 8.878 606 HD21 ASN 79 HD21 ASN 79 -6.406 -4.393 11.600 607 HD22 ASN 79 HD22 ASN 79 -6.314 -5.833 10.707 608 H VAL 80 HN VAL 80 -2.097 -0.955 10.837 609 HA VAL 80 HA VAL 80 -3.443 1.240 12.225 610 HB VAL 80 HB VAL 80 -1.152 2.016 12.455 611 HG11 VAL 80 HG11 VAL 80 -0.805 -0.962 12.306 612 HG12 VAL 80 HG12 VAL 80 -1.909 -0.253 13.485 613 HG13 VAL 80 HG13 VAL 80 -0.196 0.168 13.515 614 HG21 VAL 80 HG21 VAL 80 0.363 1.822 10.772 615 HG22 VAL 80 HG22 VAL 80 -0.892 1.039 9.811 616 HG23 VAL 80 HG23 VAL 80 0.206 0.067 10.787 617 HA PRO 81 HA PRO 81 -3.808 3.935 8.703 618 HB2 PRO 81 HB2 PRO 81 -1.732 5.683 8.322 619 HB3 PRO 81 HB1 PRO 81 -2.971 5.899 9.575 620 HG2 PRO 81 HG2 PRO 81 -0.196 4.868 9.816 621 HG3 PRO 81 HG1 PRO 81 -1.129 5.875 10.934 622 HD2 PRO 81 HD2 PRO 81 -0.721 3.210 11.274 623 HD3 PRO 81 HD1 PRO 81 -2.127 4.068 11.932 624 H PHE 82 HN PHE 82 -3.764 2.839 6.819 625 HA PHE 82 HA PHE 82 -1.407 2.597 5.154 626 HB2 PHE 82 HB2 PHE 82 -0.775 0.375 5.630 627 HB3 PHE 82 HB1 PHE 82 -1.121 1.036 7.229 628 HD1 PHE 82 HD2 PHE 82 -4.117 1.096 7.163 629 HD2 PHE 82 HD1 PHE 82 -1.358 -1.918 5.838 630 HE1 PHE 82 HE2 PHE 82 -5.853 -0.633 7.515 631 HE2 PHE 82 HE1 PHE 82 -3.104 -3.651 6.192 632 HZ PHE 82 HZ PHE 82 -5.342 -3.010 7.023 633 H ILE 83 HN ILE 83 -2.080 0.059 4.080 634 HA ILE 83 HA ILE 83 -4.841 -0.193 3.341 635 HB ILE 83 HB ILE 83 -2.984 1.522 1.815 636 HG12 ILE 83 HG12 ILE 83 -4.738 2.810 2.638 637 HG13 ILE 83 HG11 ILE 83 -5.341 2.423 1.036 638 HG21 ILE 83 HG21 ILE 83 -4.484 1.034 -0.273 639 HG22 ILE 83 HG22 ILE 83 -4.775 -0.507 0.535 640 HG23 ILE 83 HG23 ILE 83 -3.134 -0.040 0.093 641 HD11 ILE 83 HD11 ILE 83 -6.166 1.264 3.683 642 HD12 ILE 83 HD12 ILE 83 -6.393 0.334 2.201 643 HD13 ILE 83 HD13 ILE 83 -7.177 1.902 2.387 644 H PHE 84 HN PHE 84 -5.064 -1.996 1.778 645 HA PHE 84 HA PHE 84 -2.595 -3.453 1.015 646 HB2 PHE 84 HB2 PHE 84 -3.545 -3.835 3.472 647 HB3 PHE 84 HB1 PHE 84 -4.653 -4.908 2.622 648 HD1 PHE 84 HD1 PHE 84 -3.803 -6.888 1.394 649 HD2 PHE 84 HD2 PHE 84 -1.185 -4.335 3.651 650 HE1 PHE 84 HE1 PHE 84 -2.035 -8.631 1.329 651 HE2 PHE 84 HE2 PHE 84 0.577 -6.082 3.579 652 HZ PHE 84 HZ PHE 84 0.147 -8.221 2.401 653 H ALA 85 HN ALA 85 -3.187 -5.447 -0.292 654 HA ALA 85 HA ALA 85 -5.939 -5.725 -1.214 655 HB1 ALA 85 HB1 ALA 85 -3.814 -4.437 -2.945 656 HB2 ALA 85 HB2 ALA 85 -5.315 -3.696 -2.387 657 HB3 ALA 85 HB3 ALA 85 -5.363 -5.013 -3.559 658 H THR 86 HN THR 86 -6.047 -7.920 -1.406 659 HA THR 86 HA THR 86 -3.851 -9.311 -2.904 660 HB THR 86 HB THR 86 -3.460 -10.761 -1.163 661 HG1 THR 86 HG1 THR 86 -6.056 -10.365 -0.128 662 HG21 THR 86 HG21 THR 86 -4.847 -8.633 0.478 663 HG22 THR 86 HG22 THR 86 -3.243 -8.426 -0.223 664 HG23 THR 86 HG23 THR 86 -3.524 -9.684 0.982 665 H GLY 87 HN GLY 87 -5.030 -11.899 -2.546 666 HA2 GLY 87 HA2 GLY 87 -6.921 -11.957 -4.667 667 HA3 GLY 87 HA1 GLY 87 -6.644 -13.281 -3.531 668 H TYR 88 HN TYR 88 -7.504 -12.328 -1.138 669 HA TYR 88 HA TYR 88 -10.386 -12.301 -1.501 670 HB2 TYR 88 HB2 TYR 88 -10.361 -12.219 0.993 671 HB3 TYR 88 HB1 TYR 88 -9.325 -13.484 0.338 672 HD1 TYR 88 HD2 TYR 88 -9.389 -10.161 1.960 673 HD2 TYR 88 HD1 TYR 88 -6.915 -13.372 0.539 674 HE1 TYR 88 HE2 TYR 88 -7.452 -9.222 3.195 675 HE2 TYR 88 HE1 TYR 88 -4.984 -12.432 1.775 676 HH TYR 88 HH TYR 88 -4.734 -10.901 3.892 677 H GLY 89 HN GLY 89 -7.975 -9.805 -1.142 678 HA2 GLY 89 HA2 GLY 89 -8.296 -7.476 -1.425 679 HA3 GLY 89 HA1 GLY 89 -10.033 -7.762 -1.523 680 H SER 90 HN SER 90 -7.396 -7.920 0.880 681 HA SER 90 HA SER 90 -7.363 -7.280 3.146 682 HB2 SER 90 HB2 SER 90 -8.016 -5.154 1.909 683 HB3 SER 90 HB1 SER 90 -9.689 -5.536 2.305 684 HG SER 90 HG SER 90 -9.339 -4.955 4.295 685 H LYS 91 HN LYS 91 -8.435 -7.758 5.126 686 HA LYS 91 HA LYS 91 -10.885 -9.400 4.831 687 HB2 LYS 91 HB2 LYS 91 -10.142 -10.214 7.106 688 HB3 LYS 91 HB1 LYS 91 -8.957 -10.490 5.828 689 HG2 LYS 91 HG2 LYS 91 -7.441 -9.182 6.864 690 HG3 LYS 91 HG1 LYS 91 -8.602 -7.860 6.989 691 HD2 LYS 91 HD2 LYS 91 -9.635 -9.191 8.939 692 HD3 LYS 91 HD1 LYS 91 -8.142 -10.131 8.922 693 HE2 LYS 91 HE2 LYS 91 -7.234 -8.505 10.225 694 HE3 LYS 91 HE1 LYS 91 -7.309 -7.439 8.807 695 HZ1 LYS 91 HZ1 LYS 91 -9.342 -7.813 10.926 696 HZ2 LYS 91 HZ2 LYS 91 -9.744 -7.153 9.414 697 HZ3 LYS 91 HZ3 LYS 91 -8.614 -6.370 10.412 698 H GLY 92 HN GLY 92 -11.363 -6.662 4.688 699 HA2 GLY 92 HA2 GLY 92 -12.829 -5.095 5.666 700 HA3 GLY 92 HA1 GLY 92 -13.082 -6.235 6.993 701 H LEU 93 HN LEU 93 -9.859 -5.314 6.064 702 HA LEU 93 HA LEU 93 -8.804 -4.706 8.514 703 HB2 LEU 93 HB2 LEU 93 -7.060 -3.829 7.285 704 HB3 LEU 93 HB1 LEU 93 -7.960 -4.578 5.970 705 HG LEU 93 HG LEU 93 -8.208 -1.677 6.825 706 HD11 LEU 93 HD11 LEU 93 -6.505 -1.218 5.427 707 HD12 LEU 93 HD12 LEU 93 -7.261 -2.147 4.132 708 HD13 LEU 93 HD13 LEU 93 -6.211 -2.953 5.299 709 HD21 LEU 93 HD21 LEU 93 -9.171 -2.285 4.180 710 HD22 LEU 93 HD22 LEU 93 -10.059 -1.610 5.545 711 HD23 LEU 93 HD23 LEU 93 -9.955 -3.356 5.340 712 H ASP 94 HN ASP 94 -8.600 -2.846 9.830 713 HA ASP 94 HA ASP 94 -10.753 -0.793 9.430 714 HB2 ASP 94 HB2 ASP 94 -10.650 -0.589 11.886 715 HB3 ASP 94 HB1 ASP 94 -10.879 -2.278 11.432 716 H THR 95 HN THR 95 -10.168 1.426 9.662 717 HA THR 95 HA THR 95 -7.638 2.385 10.581 718 HB THR 95 HB THR 95 -6.747 1.093 8.725 719 HG1 THR 95 HG1 THR 95 -5.628 2.678 7.813 720 HG21 THR 95 HG21 THR 95 -8.589 0.734 7.310 721 HG22 THR 95 HG22 THR 95 -7.537 1.791 6.369 722 HG23 THR 95 HG23 THR 95 -8.944 2.458 7.198 723 H ARG 96 HN ARG 96 -7.172 4.638 9.416 724 HA ARG 96 HA ARG 96 -9.634 6.214 9.602 725 HB2 ARG 96 HB2 ARG 96 -6.711 6.781 9.005 726 HB3 ARG 96 HB1 ARG 96 -7.933 8.053 9.100 727 HG2 ARG 96 HG2 ARG 96 -7.583 6.063 11.342 728 HG3 ARG 96 HG1 ARG 96 -6.596 7.522 11.255 729 HD2 ARG 96 HD2 ARG 96 -9.570 7.801 10.953 730 HD3 ARG 96 HD1 ARG 96 -8.893 7.570 12.577 731 HE ARG 96 HE ARG 96 -7.426 9.555 11.027 732 HH11 ARG 96 HH11 ARG 96 -10.314 10.443 11.023 733 HH12 ARG 96 HH12 ARG 96 -10.385 11.403 12.463 734 HH21 ARG 96 HH21 ARG 96 -7.425 10.146 13.762 735 HH22 ARG 96 HH22 ARG 96 -8.748 11.235 14.015 736 H TYR 97 HN TYR 97 -8.533 4.278 7.205 737 HA TYR 97 HA TYR 97 -8.758 6.115 4.923 738 HB2 TYR 97 HB2 TYR 97 -8.404 3.138 5.333 739 HB3 TYR 97 HB1 TYR 97 -8.539 3.849 3.724 740 HD1 TYR 97 HD2 TYR 97 -6.739 4.596 6.946 741 HD2 TYR 97 HD1 TYR 97 -6.514 4.337 2.665 742 HE1 TYR 97 HE2 TYR 97 -4.357 5.244 7.037 743 HE2 TYR 97 HE1 TYR 97 -4.126 4.992 2.758 744 HH TYR 97 HH TYR 97 -2.677 6.406 4.585 745 H SER 98 HN SER 98 -10.919 4.276 6.860 746 HA SER 98 HA SER 98 -13.277 4.185 6.769 747 HB2 SER 98 HB2 SER 98 -13.296 5.354 4.024 748 HB3 SER 98 HB1 SER 98 -14.337 5.707 5.400 749 HG SER 98 HG SER 98 -13.034 7.277 5.860 750 H ASN 99 HN ASN 99 -11.259 2.294 5.422 751 HA ASN 99 HA ASN 99 -11.315 0.328 4.111 752 HB2 ASN 99 HB2 ASN 99 -14.004 0.580 5.454 753 HB3 ASN 99 HB1 ASN 99 -13.503 -0.893 4.622 754 HD21 ASN 99 HD21 ASN 99 -10.737 0.612 5.908 755 HD22 ASN 99 HD22 ASN 99 -10.634 -0.261 7.354 756 H ILE 100 HN ILE 100 -11.208 1.330 1.976 757 HA ILE 100 HA ILE 100 -13.462 0.590 0.312 758 HB ILE 100 HB ILE 100 -13.708 2.834 -0.719 759 HG12 ILE 100 HG12 ILE 100 -11.486 3.703 0.164 760 HG13 ILE 100 HG11 ILE 100 -12.865 4.786 0.258 761 HG21 ILE 100 HG21 ILE 100 -15.197 3.676 0.950 762 HG22 ILE 100 HG22 ILE 100 -14.304 2.865 2.236 763 HG23 ILE 100 HG23 ILE 100 -15.224 1.917 1.067 764 HD11 ILE 100 HD11 ILE 100 -12.912 3.297 2.656 765 HD12 ILE 100 HD12 ILE 100 -12.512 4.999 2.450 766 HD13 ILE 100 HD13 ILE 100 -11.238 3.791 2.420 767 HA PRO 101 HA PRO 101 -9.846 1.545 -2.518 768 HB2 PRO 101 HB2 PRO 101 -7.420 2.263 -1.503 769 HB3 PRO 101 HB1 PRO 101 -8.715 3.422 -1.833 770 HG2 PRO 101 HG2 PRO 101 -7.680 2.506 0.718 771 HG3 PRO 101 HG1 PRO 101 -8.687 3.910 0.354 772 HD2 PRO 101 HD2 PRO 101 -9.474 1.335 1.403 773 HD3 PRO 101 HD1 PRO 101 -10.446 2.800 1.205 774 H LEU 102 HN LEU 102 -10.193 -0.796 -0.552 775 HA LEU 102 HA LEU 102 -7.546 -2.109 -0.804 776 HB2 LEU 102 HB2 LEU 102 -8.704 -3.819 0.647 777 HB3 LEU 102 HB1 LEU 102 -8.720 -2.197 1.341 778 HG LEU 102 HG LEU 102 -10.996 -2.455 -0.376 779 HD11 LEU 102 HD11 LEU 102 -11.539 -4.375 1.736 780 HD12 LEU 102 HD12 LEU 102 -10.268 -4.951 0.656 781 HD13 LEU 102 HD13 LEU 102 -11.844 -4.506 0.004 782 HD21 LEU 102 HD21 LEU 102 -11.954 -2.458 2.198 783 HD22 LEU 102 HD22 LEU 102 -11.447 -1.010 1.328 784 HD23 LEU 102 HD23 LEU 102 -10.328 -1.815 2.428 785 H LEU 103 HN LEU 103 -7.441 -4.323 -1.789 786 HA LEU 103 HA LEU 103 -9.657 -5.481 -3.200 787 HB2 LEU 103 HB2 LEU 103 -8.617 -3.073 -4.282 788 HB3 LEU 103 HB1 LEU 103 -8.164 -4.374 -5.383 789 HG LEU 103 HG LEU 103 -10.962 -3.772 -4.376 790 HD11 LEU 103 HD11 LEU 103 -11.139 -3.613 -7.026 791 HD12 LEU 103 HD12 LEU 103 -9.424 -3.232 -6.877 792 HD13 LEU 103 HD13 LEU 103 -10.624 -2.231 -6.060 793 HD21 LEU 103 HD21 LEU 103 -9.972 -5.907 -6.296 794 HD22 LEU 103 HD22 LEU 103 -11.657 -5.589 -5.896 795 HD23 LEU 103 HD23 LEU 103 -10.559 -6.206 -4.661 796 H THR 104 HN THR 104 -8.348 -6.278 -5.586 797 HA THR 104 HA THR 104 -6.091 -7.915 -4.558 798 HB THR 104 HB THR 104 -8.318 -9.052 -4.956 799 HG1 THR 104 HG1 THR 104 -6.610 -10.068 -6.892 800 HG21 THR 104 HG21 THR 104 -7.693 -8.228 -7.802 801 HG22 THR 104 HG22 THR 104 -9.095 -7.752 -6.844 802 HG23 THR 104 HG23 THR 104 -8.910 -9.427 -7.363 803 H LYS 105 HN LYS 105 -6.229 -5.283 -6.125 804 HA LYS 105 HA LYS 105 -4.748 -4.316 -7.703 805 HB2 LYS 105 HB2 LYS 105 -3.653 -6.791 -7.025 806 HB3 LYS 105 HB1 LYS 105 -3.676 -6.791 -8.791 807 HG2 LYS 105 HG2 LYS 105 -1.853 -5.477 -8.737 808 HG3 LYS 105 HG1 LYS 105 -2.874 -4.202 -8.069 809 HD2 LYS 105 HD2 LYS 105 -1.863 -4.368 -6.073 810 HD3 LYS 105 HD1 LYS 105 -2.204 -6.097 -6.006 811 HE2 LYS 105 HE2 LYS 105 0.176 -4.755 -7.331 812 HE3 LYS 105 HE1 LYS 105 0.204 -5.885 -5.968 813 HZ1 LYS 105 HZ1 LYS 105 -1.266 -7.157 -7.890 814 HZ2 LYS 105 HZ2 LYS 105 0.348 -7.491 -7.489 815 HZ3 LYS 105 HZ3 LYS 105 -0.009 -6.434 -8.767 816 HA PRO 106 HA PRO 106 -7.449 -6.189 -11.122 817 HB2 PRO 106 HB2 PRO 106 -9.867 -4.984 -10.753 818 HB3 PRO 106 HB1 PRO 106 -9.473 -6.556 -10.034 819 HG2 PRO 106 HG2 PRO 106 -9.537 -3.868 -8.775 820 HG3 PRO 106 HG1 PRO 106 -9.980 -5.443 -8.102 821 HD2 PRO 106 HD2 PRO 106 -7.606 -4.130 -7.592 822 HD3 PRO 106 HD1 PRO 106 -7.859 -5.881 -7.417 823 H PHE 107 HN PHE 107 -6.643 -3.233 -9.698 824 HA PHE 107 HA PHE 107 -6.113 -1.130 -10.549 825 HB2 PHE 107 HB2 PHE 107 -6.186 -2.943 -12.928 826 HB3 PHE 107 HB1 PHE 107 -6.028 -1.205 -13.200 827 HD1 PHE 107 HD2 PHE 107 -4.744 -3.670 -10.692 828 HD2 PHE 107 HD1 PHE 107 -3.816 -0.478 -13.402 829 HE1 PHE 107 HE2 PHE 107 -2.372 -3.777 -9.989 830 HE2 PHE 107 HE1 PHE 107 -1.440 -0.576 -12.696 831 HZ PHE 107 HZ PHE 107 -0.715 -2.223 -10.993 832 H LEU 108 HN LEU 108 -8.000 -0.208 -9.723 833 HA LEU 108 HA LEU 108 -9.643 1.248 -11.512 834 HB2 LEU 108 HB2 LEU 108 -11.767 0.016 -11.293 835 HB3 LEU 108 HB1 LEU 108 -10.544 -1.020 -12.020 836 HG LEU 108 HG LEU 108 -10.242 -1.411 -9.268 837 HD11 LEU 108 HD11 LEU 108 -13.144 -1.866 -9.821 838 HD12 LEU 108 HD12 LEU 108 -12.633 -0.240 -9.366 839 HD13 LEU 108 HD13 LEU 108 -12.325 -1.597 -8.282 840 HD21 LEU 108 HD21 LEU 108 -9.986 -3.158 -10.901 841 HD22 LEU 108 HD22 LEU 108 -11.663 -2.993 -11.422 842 HD23 LEU 108 HD23 LEU 108 -11.295 -3.645 -9.824 843 H ASP 109 HN ASP 109 -9.200 -0.230 -8.358 844 HA ASP 109 HA ASP 109 -10.099 2.273 -7.043 845 HB2 ASP 109 HB2 ASP 109 -11.519 -0.300 -7.144 846 HB3 ASP 109 HB1 ASP 109 -11.277 0.297 -5.501 847 H SER 110 HN SER 110 -7.715 0.108 -7.396 848 HA SER 110 HA SER 110 -7.121 -0.562 -4.613 849 HB2 SER 110 HB2 SER 110 -6.635 -1.874 -6.761 850 HB3 SER 110 HB1 SER 110 -5.317 -0.735 -7.035 851 HG SER 110 HG SER 110 -5.502 -2.829 -5.302 852 H GLU 111 HN GLU 111 -4.148 0.059 -5.658 853 HA GLU 111 HA GLU 111 -3.248 1.923 -3.932 854 HB2 GLU 111 HB2 GLU 111 -2.170 0.708 -5.990 855 HB3 GLU 111 HB1 GLU 111 -2.488 2.231 -6.823 856 HG2 GLU 111 HG2 GLU 111 -0.228 2.244 -5.850 857 HG3 GLU 111 HG1 GLU 111 -1.247 3.446 -5.058 858 H LEU 112 HN LEU 112 -4.941 2.811 -6.957 859 HA LEU 112 HA LEU 112 -4.648 5.617 -6.819 860 HB2 LEU 112 HB2 LEU 112 -7.097 4.020 -7.639 861 HB3 LEU 112 HB1 LEU 112 -6.668 5.637 -8.202 862 HG LEU 112 HG LEU 112 -4.562 3.597 -8.534 863 HD11 LEU 112 HD11 LEU 112 -6.121 2.069 -9.283 864 HD12 LEU 112 HD12 LEU 112 -5.914 2.999 -10.768 865 HD13 LEU 112 HD13 LEU 112 -7.291 3.317 -9.712 866 HD21 LEU 112 HD21 LEU 112 -5.338 4.969 -10.927 867 HD22 LEU 112 HD22 LEU 112 -3.886 5.211 -9.955 868 HD23 LEU 112 HD23 LEU 112 -5.350 6.129 -9.598 869 H GLU 113 HN GLU 113 -7.696 4.011 -5.888 870 HA GLU 113 HA GLU 113 -8.681 6.081 -4.252 871 HB2 GLU 113 HB2 GLU 113 -8.993 3.081 -4.371 872 HB3 GLU 113 HB1 GLU 113 -9.849 4.013 -3.135 873 HG2 GLU 113 HG2 GLU 113 -10.665 5.520 -5.009 874 HG3 GLU 113 HG1 GLU 113 -10.043 4.313 -6.135 875 H ALA 114 HN ALA 114 -6.158 3.752 -3.683 876 HA ALA 114 HA ALA 114 -6.090 3.594 -0.871 877 HB1 ALA 114 HB1 ALA 114 -3.562 3.984 -2.421 878 HB2 ALA 114 HB2 ALA 114 -4.614 2.648 -2.888 879 HB3 ALA 114 HB3 ALA 114 -3.971 2.733 -1.248 880 H VAL 115 HN VAL 115 -4.883 6.173 -3.019 881 HA VAL 115 HA VAL 115 -4.191 7.757 -0.565 882 HB VAL 115 HB VAL 115 -2.950 9.144 -2.392 883 HG11 VAL 115 HG11 VAL 115 -1.365 8.106 -1.158 884 HG12 VAL 115 HG12 VAL 115 -1.313 6.921 -2.463 885 HG13 VAL 115 HG13 VAL 115 -2.312 6.623 -1.040 886 HG21 VAL 115 HG21 VAL 115 -4.235 7.711 -4.185 887 HG22 VAL 115 HG22 VAL 115 -2.963 6.532 -3.871 888 HG23 VAL 115 HG23 VAL 115 -2.548 8.142 -4.458 889 H LEU 116 HN LEU 116 -5.983 7.942 -3.636 890 HA LEU 116 HA LEU 116 -6.835 10.686 -3.168 891 HB2 LEU 116 HB2 LEU 116 -8.173 10.266 -5.203 892 HB3 LEU 116 HB1 LEU 116 -6.507 9.721 -5.402 893 HG LEU 116 HG LEU 116 -7.583 7.467 -4.410 894 HD11 LEU 116 HD11 LEU 116 -9.796 7.722 -6.157 895 HD12 LEU 116 HD12 LEU 116 -9.828 9.138 -5.108 896 HD13 LEU 116 HD13 LEU 116 -9.837 7.521 -4.405 897 HD21 LEU 116 HD21 LEU 116 -6.320 7.533 -6.462 898 HD22 LEU 116 HD22 LEU 116 -7.591 8.445 -7.276 899 HD23 LEU 116 HD23 LEU 116 -7.863 6.762 -6.826 900 H VAL 117 HN VAL 117 -8.004 7.608 -2.073 901 HA VAL 117 HA VAL 117 -10.776 7.944 -1.916 902 HB VAL 117 HB VAL 117 -9.714 5.937 -1.111 903 HG11 VAL 117 HG11 VAL 117 -7.871 5.909 0.233 904 HG12 VAL 117 HG12 VAL 117 -8.542 7.117 1.329 905 HG13 VAL 117 HG13 VAL 117 -7.748 7.623 -0.162 906 HG21 VAL 117 HG21 VAL 117 -11.594 5.995 0.173 907 HG22 VAL 117 HG22 VAL 117 -11.250 7.588 0.827 908 HG23 VAL 117 HG23 VAL 117 -10.431 6.172 1.480 909 H GLN 118 HN GLN 118 -8.252 9.494 0.007 910 HA GLN 118 HA GLN 118 -10.123 10.755 1.870 911 HB2 GLN 118 HB2 GLN 118 -7.401 11.891 1.460 912 HB3 GLN 118 HB1 GLN 118 -8.204 11.428 2.956 913 HG2 GLN 118 HG2 GLN 118 -7.861 8.988 1.762 914 HG3 GLN 118 HG1 GLN 118 -6.432 9.854 1.198 915 HE21 GLN 118 HE21 GLN 118 -8.274 9.641 4.304 916 HE22 GLN 118 HE22 GLN 118 -6.893 9.452 5.273 917 H ILE 119 HN ILE 119 -7.780 12.271 -0.325 918 HA ILE 119 HA ILE 119 -9.096 14.786 -0.434 919 HB ILE 119 HB ILE 119 -6.847 14.776 -1.066 920 HG12 ILE 119 HG12 ILE 119 -6.763 15.688 -3.229 921 HG13 ILE 119 HG11 ILE 119 -7.993 14.588 -3.847 922 HG21 ILE 119 HG21 ILE 119 -7.503 12.155 -2.130 923 HG22 ILE 119 HG22 ILE 119 -5.938 12.798 -1.633 924 HG23 ILE 119 HG23 ILE 119 -6.524 13.072 -3.273 925 HD11 ILE 119 HD11 ILE 119 -8.906 16.323 -1.641 926 HD12 ILE 119 HD12 ILE 119 -9.707 15.915 -3.158 927 HD13 ILE 119 HD13 ILE 119 -8.481 17.182 -3.121 928 H SER 120 HN SER 120 -8.804 12.738 -3.350 929 HA SER 120 HA SER 120 -11.199 13.961 -4.473 930 HB2 SER 120 HB2 SER 120 -9.178 11.889 -5.290 931 HB3 SER 120 HB1 SER 120 -10.602 12.187 -6.282 932 HG SER 120 HG SER 120 -8.363 13.573 -6.195 933 H LYS 121 HN LYS 121 -10.390 10.507 -3.962 934 HA LYS 121 HA LYS 121 -11.792 8.738 -3.239 935 HB2 LYS 121 HB2 LYS 121 -12.594 10.865 -1.814 936 HB3 LYS 121 HB1 LYS 121 -14.050 10.639 -2.795 937 HG2 LYS 121 HG2 LYS 121 -14.140 8.260 -2.133 938 HG3 LYS 121 HG1 LYS 121 -12.717 8.489 -1.121 939 HD2 LYS 121 HD2 LYS 121 -15.403 9.865 -0.774 940 HD3 LYS 121 HD1 LYS 121 -14.736 8.606 0.263 941 HE2 LYS 121 HE2 LYS 121 -12.996 10.047 1.062 942 HE3 LYS 121 HE1 LYS 121 -13.336 11.261 -0.187 943 HZ1 LYS 121 HZ1 LYS 121 -15.237 10.372 1.915 944 HZ2 LYS 121 HZ2 LYS 121 -15.543 11.546 0.725 945 HZ3 LYS 121 HZ3 LYS 121 -14.381 11.834 1.931 946 H GLU 122 HN GLU 122 -11.976 10.455 -5.911 947 HA GLU 122 HA GLU 122 -13.978 8.685 -7.173 948 HB2 GLU 122 HB2 GLU 122 -14.927 10.904 -8.227 949 HB3 GLU 122 HB1 GLU 122 -15.458 10.435 -6.612 950 HG2 GLU 122 HG2 GLU 122 -14.123 12.042 -5.565 951 HG3 GLU 122 HG1 GLU 122 -13.023 12.169 -6.938 952 H VAL 123 HN VAL 123 -11.030 9.359 -7.166 953 HA VAL 123 HA VAL 123 -9.286 9.609 -8.724 954 HB VAL 123 HB VAL 123 -9.592 8.103 -10.398 955 HG11 VAL 123 HG11 VAL 123 -12.512 7.868 -9.747 956 HG12 VAL 123 HG12 VAL 123 -11.308 7.439 -8.532 957 HG13 VAL 123 HG13 VAL 123 -11.335 6.597 -10.081 958 HG21 VAL 123 HG21 VAL 123 -10.497 9.926 -11.856 959 HG22 VAL 123 HG22 VAL 123 -12.117 9.532 -11.281 960 HG23 VAL 123 HG23 VAL 123 -11.196 8.345 -12.205 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 15.537 11.763 12.715 2 H2 GLY 1 HT2 GLY 1 15.360 11.532 14.390 3 H3 GLY 1 HT3 GLY 1 15.642 13.088 13.767 4 HA2 GLY 1 HA2 GLY 1 13.455 12.593 12.437 5 HA3 GLY 1 HA1 GLY 1 13.176 11.512 13.804 6 H SER 2 HN SER 2 12.874 12.418 15.885 7 HA SER 2 HA SER 2 12.044 14.088 17.348 8 HB2 SER 2 HB2 SER 2 14.510 14.517 17.139 9 HB3 SER 2 HB1 SER 2 14.161 15.659 15.845 10 HG SER 2 HG SER 2 14.369 16.576 18.001 11 H HIS 3 HN HIS 3 12.016 16.952 16.793 12 HA HIS 3 HA HIS 3 9.504 17.145 15.379 13 HB2 HIS 3 HB2 HIS 3 11.322 18.769 16.956 14 HB3 HIS 3 HB1 HIS 3 10.708 19.685 15.579 15 HD1 HIS 3 HD1 HIS 3 9.543 20.843 17.926 16 HD2 HIS 3 HD2 HIS 3 7.954 17.297 16.416 17 HE1 HIS 3 HE1 HIS 3 7.198 20.653 18.865 18 H MET 4 HN MET 4 10.882 15.913 13.475 19 HA MET 4 HA MET 4 11.120 17.921 11.341 20 HB2 MET 4 HB2 MET 4 13.330 17.684 12.723 21 HB3 MET 4 HB1 MET 4 13.498 16.147 11.875 22 HG2 MET 4 HG2 MET 4 14.379 17.291 10.146 23 HG3 MET 4 HG1 MET 4 12.785 17.998 9.887 24 HE1 MET 4 HE1 MET 4 14.147 21.377 9.609 25 HE2 MET 4 HE2 MET 4 12.597 20.544 9.681 26 HE3 MET 4 HE3 MET 4 13.915 19.855 8.737 27 H THR 5 HN THR 5 9.210 16.123 11.223 28 HA THR 5 HA THR 5 10.252 13.930 9.460 29 HB THR 5 HB THR 5 7.920 12.964 10.550 30 HG1 THR 5 HG1 THR 5 9.177 13.963 12.798 31 HG21 THR 5 HG21 THR 5 9.529 11.799 12.193 32 HG22 THR 5 HG22 THR 5 10.801 12.742 11.416 33 HG23 THR 5 HG23 THR 5 9.848 11.599 10.469 34 H GLU 6 HN GLU 6 8.600 13.184 7.863 35 HA GLU 6 HA GLU 6 6.238 14.867 7.396 36 HB2 GLU 6 HB2 GLU 6 7.127 15.681 5.197 37 HB3 GLU 6 HB1 GLU 6 8.048 16.296 6.569 38 HG2 GLU 6 HG2 GLU 6 9.299 13.882 5.983 39 HG3 GLU 6 HG1 GLU 6 8.911 14.543 4.393 40 H ARG 7 HN ARG 7 6.913 11.988 7.710 41 HA ARG 7 HA ARG 7 6.629 10.771 5.053 42 HB2 ARG 7 HB2 ARG 7 6.624 9.793 7.919 43 HB3 ARG 7 HB1 ARG 7 6.419 8.703 6.548 44 HG2 ARG 7 HG2 ARG 7 8.664 10.495 6.126 45 HG3 ARG 7 HG1 ARG 7 8.850 9.581 7.625 46 HD2 ARG 7 HD2 ARG 7 7.850 7.777 5.649 47 HD3 ARG 7 HD1 ARG 7 9.233 8.641 4.949 48 HE ARG 7 HE ARG 7 9.785 7.886 7.680 49 HH11 ARG 7 HH11 ARG 7 8.733 5.827 5.312 50 HH12 ARG 7 HH12 ARG 7 10.202 4.917 5.174 51 HH21 ARG 7 HH21 ARG 7 12.045 7.097 7.146 52 HH22 ARG 7 HH22 ARG 7 12.080 5.639 6.211 53 H ARG 8 HN ARG 8 4.496 12.425 6.939 54 HA ARG 8 HA ARG 8 2.200 10.933 7.353 55 HB2 ARG 8 HB2 ARG 8 1.034 13.044 7.090 56 HB3 ARG 8 HB1 ARG 8 2.623 13.380 7.779 57 HG2 ARG 8 HG2 ARG 8 2.904 13.383 4.942 58 HG3 ARG 8 HG1 ARG 8 1.501 14.375 5.342 59 HD2 ARG 8 HD2 ARG 8 2.765 15.978 6.374 60 HD3 ARG 8 HD1 ARG 8 3.879 14.786 7.074 61 HE ARG 8 HE ARG 8 5.173 14.871 5.071 62 HH11 ARG 8 HH21 ARG 8 2.674 14.716 3.282 63 HH12 ARG 8 HH22 ARG 8 2.808 16.207 2.412 64 HH21 ARG 8 HH11 ARG 8 5.134 17.573 4.591 65 HH22 ARG 8 HH12 ARG 8 4.202 17.824 3.153 66 H LEU 9 HN LEU 9 3.640 11.675 4.245 67 HA LEU 9 HA LEU 9 1.298 10.397 2.941 68 HB2 LEU 9 HB2 LEU 9 2.587 12.993 2.579 69 HB3 LEU 9 HB1 LEU 9 2.457 12.102 1.072 70 HG LEU 9 HG LEU 9 0.434 13.309 1.170 71 HD11 LEU 9 HD11 LEU 9 -1.000 11.589 0.898 72 HD12 LEU 9 HD12 LEU 9 -0.835 11.086 2.580 73 HD13 LEU 9 HD13 LEU 9 0.334 10.540 1.379 74 HD21 LEU 9 HD21 LEU 9 -0.210 12.457 3.965 75 HD22 LEU 9 HD22 LEU 9 -0.679 13.923 3.103 76 HD23 LEU 9 HD23 LEU 9 0.961 13.753 3.726 77 H ARG 10 HN ARG 10 2.657 8.416 3.167 78 HA ARG 10 HA ARG 10 4.516 8.125 0.859 79 HB2 ARG 10 HB2 ARG 10 5.215 8.195 3.644 80 HB3 ARG 10 HB1 ARG 10 5.502 6.569 3.026 81 HG2 ARG 10 HG2 ARG 10 7.456 8.160 2.754 82 HG3 ARG 10 HG1 ARG 10 6.910 7.390 1.264 83 HD2 ARG 10 HD2 ARG 10 7.303 9.856 0.998 84 HD3 ARG 10 HD1 ARG 10 5.630 9.414 0.661 85 HE ARG 10 HE ARG 10 5.293 9.975 3.205 86 HH11 ARG 10 HH11 ARG 10 8.258 10.966 3.069 87 HH12 ARG 10 HH12 ARG 10 7.990 12.677 3.042 88 HH21 ARG 10 HH21 ARG 10 4.608 12.392 2.307 89 HH22 ARG 10 HH22 ARG 10 5.916 13.488 2.603 90 H VAL 11 HN VAL 11 3.787 6.496 -0.331 91 HA VAL 11 HA VAL 11 2.111 4.392 0.959 92 HB VAL 11 HB VAL 11 2.339 4.637 -1.995 93 HG11 VAL 11 HG11 VAL 11 0.739 3.143 -0.797 94 HG12 VAL 11 HG12 VAL 11 -0.060 4.301 -1.861 95 HG13 VAL 11 HG13 VAL 11 -0.037 4.576 -0.120 96 HG21 VAL 11 HG21 VAL 11 0.735 6.619 -1.935 97 HG22 VAL 11 HG22 VAL 11 2.406 6.992 -1.513 98 HG23 VAL 11 HG23 VAL 11 1.192 6.833 -0.245 99 H LEU 12 HN LEU 12 3.527 2.709 1.572 100 HA LEU 12 HA LEU 12 5.686 1.926 -0.289 101 HB2 LEU 12 HB2 LEU 12 4.746 0.605 2.278 102 HB3 LEU 12 HB1 LEU 12 6.311 0.426 1.490 103 HG LEU 12 HG LEU 12 6.847 1.937 3.165 104 HD11 LEU 12 HD11 LEU 12 7.295 2.909 0.870 105 HD12 LEU 12 HD12 LEU 12 7.176 4.096 2.169 106 HD13 LEU 12 HD13 LEU 12 5.822 3.860 1.064 107 HD21 LEU 12 HD21 LEU 12 4.444 3.678 2.813 108 HD22 LEU 12 HD22 LEU 12 5.379 3.334 4.266 109 HD23 LEU 12 HD23 LEU 12 4.244 2.138 3.648 110 H VAL 13 HN VAL 13 5.109 0.616 -1.977 111 HA VAL 13 HA VAL 13 2.959 -1.424 -1.522 112 HB VAL 13 HB VAL 13 3.426 0.183 -4.046 113 HG11 VAL 13 HG11 VAL 13 1.568 -0.853 -4.868 114 HG12 VAL 13 HG12 VAL 13 0.758 -0.864 -3.302 115 HG13 VAL 13 HG13 VAL 13 1.975 -2.086 -3.673 116 HG21 VAL 13 HG21 VAL 13 1.476 1.565 -3.284 117 HG22 VAL 13 HG22 VAL 13 2.906 1.768 -2.274 118 HG23 VAL 13 HG23 VAL 13 1.569 0.761 -1.717 119 H VAL 14 HN VAL 14 3.490 -3.466 -2.411 120 HA VAL 14 HA VAL 14 5.722 -3.581 -4.339 121 HB VAL 14 HB VAL 14 6.934 -5.112 -2.732 122 HG11 VAL 14 HG11 VAL 14 8.013 -3.323 -1.606 123 HG12 VAL 14 HG12 VAL 14 6.548 -2.343 -1.615 124 HG13 VAL 14 HG13 VAL 14 7.424 -2.634 -3.118 125 HG21 VAL 14 HG21 VAL 14 4.789 -5.408 -1.341 126 HG22 VAL 14 HG22 VAL 14 5.198 -3.844 -0.633 127 HG23 VAL 14 HG23 VAL 14 6.305 -5.207 -0.463 128 H GLU 15 HN GLU 15 6.061 -5.647 -5.213 129 HA GLU 15 HA GLU 15 4.577 -8.028 -4.610 130 HB2 GLU 15 HB2 GLU 15 3.000 -7.933 -6.498 131 HB3 GLU 15 HB1 GLU 15 2.743 -6.548 -5.431 132 HG2 GLU 15 HG2 GLU 15 2.977 -5.261 -7.264 133 HG3 GLU 15 HG1 GLU 15 4.694 -5.663 -7.198 134 H ASP 16 HN ASP 16 5.762 -9.644 -5.532 135 HA ASP 16 HA ASP 16 8.156 -9.758 -6.606 136 HB2 ASP 16 HB2 ASP 16 7.444 -11.703 -7.941 137 HB3 ASP 16 HB1 ASP 16 6.628 -11.658 -6.378 138 H GLU 17 HN GLU 17 5.425 -8.865 -8.773 139 HA GLU 17 HA GLU 17 7.195 -8.573 -11.070 140 HB2 GLU 17 HB2 GLU 17 4.372 -7.560 -10.670 141 HB3 GLU 17 HB1 GLU 17 5.157 -7.939 -12.199 142 HG2 GLU 17 HG2 GLU 17 5.024 -10.235 -11.861 143 HG3 GLU 17 HG1 GLU 17 4.954 -10.082 -10.108 144 H SER 18 HN SER 18 7.303 -6.513 -12.322 145 HA SER 18 HA SER 18 7.922 -4.216 -10.527 146 HB2 SER 18 HB2 SER 18 8.698 -5.193 -13.248 147 HB3 SER 18 HB1 SER 18 8.801 -3.463 -12.937 148 HG SER 18 HG SER 18 10.724 -4.266 -12.286 149 H MET 19 HN MET 19 5.513 -5.312 -12.725 150 HA MET 19 HA MET 19 4.564 -2.985 -13.964 151 HB2 MET 19 HB2 MET 19 2.391 -4.155 -13.897 152 HB3 MET 19 HB1 MET 19 3.691 -5.302 -14.217 153 HG2 MET 19 HG2 MET 19 3.172 -6.466 -12.365 154 HG3 MET 19 HG1 MET 19 3.362 -5.020 -11.373 155 HE1 MET 19 HE1 MET 19 1.275 -3.112 -12.826 156 HE2 MET 19 HE2 MET 19 1.543 -3.198 -11.086 157 HE3 MET 19 HE3 MET 19 -0.095 -3.292 -11.724 158 H ILE 20 HN ILE 20 4.624 -3.829 -10.591 159 HA ILE 20 HA ILE 20 2.612 -1.876 -9.738 160 HB ILE 20 HB ILE 20 3.076 -3.975 -8.553 161 HG12 ILE 20 HG12 ILE 20 4.184 -2.245 -6.497 162 HG13 ILE 20 HG11 ILE 20 2.905 -1.422 -7.397 163 HG21 ILE 20 HG21 ILE 20 5.340 -3.947 -7.236 164 HG22 ILE 20 HG22 ILE 20 5.853 -2.836 -8.501 165 HG23 ILE 20 HG23 ILE 20 5.329 -4.465 -8.921 166 HD11 ILE 20 HD11 ILE 20 1.570 -3.628 -7.087 167 HD12 ILE 20 HD12 ILE 20 1.728 -2.552 -5.698 168 HD13 ILE 20 HD13 ILE 20 2.745 -3.988 -5.823 169 H ALA 21 HN ALA 21 6.057 -2.005 -10.295 170 HA ALA 21 HA ALA 21 6.983 0.169 -8.736 171 HB1 ALA 21 HB1 ALA 21 8.866 0.039 -10.183 172 HB2 ALA 21 HB2 ALA 21 7.882 -0.489 -11.547 173 HB3 ALA 21 HB3 ALA 21 8.188 -1.587 -10.203 174 H MET 22 HN MET 22 6.396 0.336 -12.260 175 HA MET 22 HA MET 22 6.209 3.179 -12.361 176 HB2 MET 22 HB2 MET 22 6.552 1.540 -14.254 177 HB3 MET 22 HB1 MET 22 4.840 1.130 -14.136 178 HG2 MET 22 HG2 MET 22 4.248 3.491 -14.565 179 HG3 MET 22 HG1 MET 22 5.961 3.890 -14.704 180 HE1 MET 22 HE1 MET 22 3.247 1.585 -17.524 181 HE2 MET 22 HE2 MET 22 2.875 3.167 -16.845 182 HE3 MET 22 HE3 MET 22 3.103 1.789 -15.773 183 H LEU 23 HN LEU 23 3.880 0.703 -11.540 184 HA LEU 23 HA LEU 23 1.460 2.197 -11.794 185 HB2 LEU 23 HB2 LEU 23 1.374 -0.162 -11.458 186 HB3 LEU 23 HB1 LEU 23 2.464 -0.080 -10.080 187 HG LEU 23 HG LEU 23 -0.027 -0.470 -9.580 188 HD11 LEU 23 HD11 LEU 23 1.984 1.072 -8.247 189 HD12 LEU 23 HD12 LEU 23 0.685 0.115 -7.536 190 HD13 LEU 23 HD13 LEU 23 0.414 1.811 -7.936 191 HD21 LEU 23 HD21 LEU 23 -1.520 1.049 -10.298 192 HD22 LEU 23 HD22 LEU 23 -0.220 1.923 -11.104 193 HD23 LEU 23 HD23 LEU 23 -0.661 2.331 -9.446 194 H ILE 24 HN ILE 24 4.164 2.557 -9.714 195 HA ILE 24 HA ILE 24 2.622 3.924 -7.590 196 HB ILE 24 HB ILE 24 4.761 2.274 -7.555 197 HG12 ILE 24 HG12 ILE 24 4.939 4.381 -5.497 198 HG13 ILE 24 HG11 ILE 24 3.316 3.736 -5.744 199 HG21 ILE 24 HG21 ILE 24 5.943 5.068 -7.472 200 HG22 ILE 24 HG22 ILE 24 6.242 3.869 -8.728 201 HG23 ILE 24 HG23 ILE 24 6.799 3.576 -7.085 202 HD11 ILE 24 HD11 ILE 24 4.031 2.125 -4.289 203 HD12 ILE 24 HD12 ILE 24 5.732 2.408 -4.658 204 HD13 ILE 24 HD13 ILE 24 4.746 1.429 -5.744 205 H GLU 25 HN GLU 25 5.186 4.671 -9.979 206 HA GLU 25 HA GLU 25 5.498 7.426 -9.348 207 HB2 GLU 25 HB2 GLU 25 5.762 5.747 -11.844 208 HB3 GLU 25 HB1 GLU 25 6.099 7.479 -11.883 209 HG2 GLU 25 HG2 GLU 25 7.366 6.227 -9.586 210 HG3 GLU 25 HG1 GLU 25 7.871 5.452 -11.089 211 H ASP 26 HN ASP 26 2.972 5.718 -11.116 212 HA ASP 26 HA ASP 26 1.773 8.112 -12.263 213 HB2 ASP 26 HB2 ASP 26 0.276 6.583 -13.197 214 HB3 ASP 26 HB1 ASP 26 1.654 5.535 -12.882 215 H THR 27 HN THR 27 0.939 5.991 -9.488 216 HA THR 27 HA THR 27 -1.287 7.512 -8.561 217 HB THR 27 HB THR 27 -0.634 6.356 -6.366 218 HG1 THR 27 HG1 THR 27 1.405 5.872 -6.335 219 HG21 THR 27 HG21 THR 27 -0.675 4.589 -8.824 220 HG22 THR 27 HG22 THR 27 -2.107 5.343 -8.124 221 HG23 THR 27 HG23 THR 27 -1.196 4.152 -7.197 222 H LEU 28 HN LEU 28 2.150 7.570 -7.603 223 HA LEU 28 HA LEU 28 2.044 9.714 -5.749 224 HB2 LEU 28 HB2 LEU 28 4.030 8.468 -5.835 225 HB3 LEU 28 HB1 LEU 28 4.081 8.489 -7.594 226 HG LEU 28 HG LEU 28 4.233 11.199 -6.690 227 HD11 LEU 28 HD11 LEU 28 5.439 9.325 -4.858 228 HD12 LEU 28 HD12 LEU 28 5.379 11.086 -4.763 229 HD13 LEU 28 HD13 LEU 28 6.689 10.294 -5.639 230 HD21 LEU 28 HD21 LEU 28 6.744 10.499 -7.575 231 HD22 LEU 28 HD22 LEU 28 5.402 10.951 -8.626 232 HD23 LEU 28 HD23 LEU 28 5.737 9.249 -8.306 233 H CYS 29 HN CYS 29 1.913 9.670 -9.257 234 HA CYS 29 HA CYS 29 2.616 12.401 -9.770 235 HB2 CYS 29 HB2 CYS 29 2.297 10.406 -11.363 236 HB3 CYS 29 HB1 CYS 29 0.567 10.729 -11.245 237 HG CYS 29 HG CYS 29 2.449 12.257 -12.991 238 H GLU 30 HN GLU 30 -0.186 10.870 -8.419 239 HA GLU 30 HA GLU 30 -1.979 13.142 -8.841 240 HB2 GLU 30 HB2 GLU 30 -2.706 10.767 -8.882 241 HB3 GLU 30 HB1 GLU 30 -2.215 10.605 -7.195 242 HG2 GLU 30 HG2 GLU 30 -4.386 11.160 -6.776 243 HG3 GLU 30 HG1 GLU 30 -3.802 12.805 -7.034 244 H LEU 31 HN LEU 31 -0.549 11.488 -5.986 245 HA LEU 31 HA LEU 31 -1.329 13.700 -4.210 246 HB2 LEU 31 HB2 LEU 31 0.661 11.615 -3.425 247 HB3 LEU 31 HB1 LEU 31 -0.709 12.246 -2.514 248 HG LEU 31 HG LEU 31 -1.882 10.934 -4.688 249 HD11 LEU 31 HD11 LEU 31 -0.560 9.203 -5.312 250 HD12 LEU 31 HD12 LEU 31 -0.281 8.755 -3.630 251 HD13 LEU 31 HD13 LEU 31 0.754 9.954 -4.407 252 HD21 LEU 31 HD21 LEU 31 -1.610 10.671 -1.780 253 HD22 LEU 31 HD22 LEU 31 -1.887 9.122 -2.577 254 HD23 LEU 31 HD23 LEU 31 -3.036 10.444 -2.792 255 H GLY 32 HN GLY 32 1.611 12.489 -5.773 256 HA2 GLY 32 HA2 GLY 32 3.648 13.643 -6.150 257 HA3 GLY 32 HA1 GLY 32 2.954 15.058 -5.335 258 H HIS 33 HN HIS 33 2.896 11.832 -4.014 259 HA HIS 33 HA HIS 33 3.692 12.433 -1.419 260 HB2 HIS 33 HB2 HIS 33 3.895 10.011 -3.197 261 HB3 HIS 33 HB1 HIS 33 4.458 9.943 -1.519 262 HD1 HIS 33 HD1 HIS 33 1.861 8.422 -2.541 263 HD2 HIS 33 HD2 HIS 33 1.923 12.114 -0.620 264 HE1 HIS 33 HE1 HIS 33 -0.419 8.705 -1.476 265 H GLU 34 HN GLU 34 5.870 11.071 -0.591 266 HA GLU 34 HA GLU 34 8.064 12.663 -1.869 267 HB2 GLU 34 HB2 GLU 34 7.318 12.388 0.709 268 HB3 GLU 34 HB1 GLU 34 8.513 11.092 0.608 269 HG2 GLU 34 HG2 GLU 34 10.109 12.757 -0.429 270 HG3 GLU 34 HG1 GLU 34 8.939 14.018 -0.041 271 H VAL 35 HN VAL 35 7.260 9.290 -0.999 272 HA VAL 35 HA VAL 35 8.730 8.222 -3.220 273 HB VAL 35 HB VAL 35 10.574 9.146 -1.742 274 HG11 VAL 35 HG11 VAL 35 11.126 7.884 0.288 275 HG12 VAL 35 HG12 VAL 35 9.719 6.852 0.049 276 HG13 VAL 35 HG13 VAL 35 9.505 8.563 0.421 277 HG21 VAL 35 HG21 VAL 35 10.382 6.215 -2.448 278 HG22 VAL 35 HG22 VAL 35 11.859 6.901 -1.770 279 HG23 VAL 35 HG23 VAL 35 11.237 7.496 -3.309 280 H ALA 36 HN ALA 36 7.814 6.244 -3.571 281 HA ALA 36 HA ALA 36 6.596 4.836 -1.253 282 HB1 ALA 36 HB1 ALA 36 5.915 5.255 -4.125 283 HB2 ALA 36 HB2 ALA 36 4.857 5.264 -2.713 284 HB3 ALA 36 HB3 ALA 36 5.416 3.734 -3.387 285 H ALA 37 HN ALA 37 6.303 2.314 -2.317 286 HA ALA 37 HA ALA 37 9.132 1.467 -2.897 287 HB1 ALA 37 HB1 ALA 37 7.167 -0.338 -1.554 288 HB2 ALA 37 HB2 ALA 37 7.784 1.025 -0.618 289 HB3 ALA 37 HB3 ALA 37 8.901 -0.170 -1.278 290 H THR 38 HN THR 38 9.338 -0.414 -4.318 291 HA THR 38 HA THR 38 6.846 -1.130 -5.817 292 HB THR 38 HB THR 38 7.942 0.466 -7.185 293 HG1 THR 38 HG1 THR 38 7.539 -1.653 -8.151 294 HG21 THR 38 HG21 THR 38 10.536 -0.970 -6.552 295 HG22 THR 38 HG22 THR 38 10.028 0.568 -5.853 296 HG23 THR 38 HG23 THR 38 10.367 0.452 -7.580 297 H ALA 39 HN ALA 39 7.052 -3.162 -7.028 298 HA ALA 39 HA ALA 39 7.529 -5.471 -7.110 299 HB1 ALA 39 HB1 ALA 39 10.264 -5.470 -6.434 300 HB2 ALA 39 HB2 ALA 39 9.964 -3.923 -7.227 301 HB3 ALA 39 HB3 ALA 39 9.569 -5.431 -8.054 302 H SER 40 HN SER 40 8.010 -7.314 -5.689 303 HA SER 40 HA SER 40 7.505 -6.692 -2.887 304 HB2 SER 40 HB2 SER 40 7.308 -9.065 -2.693 305 HB3 SER 40 HB1 SER 40 6.566 -8.594 -4.207 306 HG SER 40 HG SER 40 8.957 -8.985 -4.922 307 H ARG 41 HN ARG 41 9.059 -6.222 -1.441 308 HA ARG 41 HA ARG 41 11.725 -7.494 -1.716 309 HB2 ARG 41 HB2 ARG 41 11.450 -5.109 -2.682 310 HB3 ARG 41 HB1 ARG 41 11.297 -4.594 -1.001 311 HG2 ARG 41 HG2 ARG 41 13.652 -4.465 -1.933 312 HG3 ARG 41 HG1 ARG 41 13.490 -5.417 -0.457 313 HD2 ARG 41 HD2 ARG 41 13.572 -7.490 -1.685 314 HD3 ARG 41 HD1 ARG 41 13.439 -6.638 -3.237 315 HE ARG 41 HE ARG 41 15.798 -6.432 -1.404 316 HH11 ARG 41 HH21 ARG 41 14.379 -5.009 -4.096 317 HH12 ARG 41 HH22 ARG 41 15.773 -5.135 -5.116 318 HH21 ARG 41 HH11 ARG 41 17.564 -7.084 -2.874 319 HH22 ARG 41 HH12 ARG 41 17.578 -6.306 -4.421 320 H MET 42 HN MET 42 12.151 -8.508 0.226 321 HA MET 42 HA MET 42 10.610 -8.135 2.600 322 HB2 MET 42 HB2 MET 42 13.391 -9.242 2.108 323 HB3 MET 42 HB1 MET 42 12.480 -9.477 3.600 324 HG2 MET 42 HG2 MET 42 10.701 -10.618 2.375 325 HG3 MET 42 HG1 MET 42 11.529 -10.315 0.846 326 HE1 MET 42 HE1 MET 42 12.543 -13.103 4.256 327 HE2 MET 42 HE2 MET 42 11.653 -11.584 4.269 328 HE3 MET 42 HE3 MET 42 13.413 -11.565 4.353 329 H GLN 43 HN GLN 43 13.214 -6.335 1.232 330 HA GLN 43 HA GLN 43 14.177 -5.164 3.737 331 HB2 GLN 43 HB2 GLN 43 15.106 -5.505 1.162 332 HB3 GLN 43 HB1 GLN 43 14.702 -3.788 1.185 333 HG2 GLN 43 HG2 GLN 43 16.354 -3.284 2.675 334 HG3 GLN 43 HG1 GLN 43 16.123 -4.778 3.584 335 HE21 GLN 43 HE21 GLN 43 17.777 -6.272 3.346 336 HE22 GLN 43 HE22 GLN 43 18.839 -6.353 2.025 337 H GLU 44 HN GLU 44 12.881 -3.488 0.857 338 HA GLU 44 HA GLU 44 12.059 -1.158 2.246 339 HB2 GLU 44 HB2 GLU 44 11.307 -2.498 -0.352 340 HB3 GLU 44 HB1 GLU 44 10.558 -0.974 0.123 341 HG2 GLU 44 HG2 GLU 44 13.552 -1.415 -0.034 342 HG3 GLU 44 HG1 GLU 44 12.593 -0.678 -1.318 343 H ALA 45 HN ALA 45 10.312 -4.172 1.548 344 HA ALA 45 HA ALA 45 7.701 -3.355 2.322 345 HB1 ALA 45 HB1 ALA 45 7.439 -5.812 2.786 346 HB2 ALA 45 HB2 ALA 45 9.186 -5.987 2.618 347 HB3 ALA 45 HB3 ALA 45 8.213 -5.487 1.235 348 H LEU 46 HN LEU 46 10.153 -5.050 4.290 349 HA LEU 46 HA LEU 46 9.005 -4.975 6.812 350 HB2 LEU 46 HB2 LEU 46 11.309 -5.772 5.878 351 HB3 LEU 46 HB1 LEU 46 11.860 -4.157 6.334 352 HG LEU 46 HG LEU 46 10.928 -4.585 8.637 353 HD11 LEU 46 HD11 LEU 46 10.932 -7.486 8.239 354 HD12 LEU 46 HD12 LEU 46 9.608 -6.649 7.430 355 HD13 LEU 46 HD13 LEU 46 9.830 -6.473 9.171 356 HD21 LEU 46 HD21 LEU 46 12.944 -5.413 9.294 357 HD22 LEU 46 HD22 LEU 46 13.343 -5.295 7.580 358 HD23 LEU 46 HD23 LEU 46 12.801 -6.832 8.255 359 H ASP 47 HN ASP 47 10.533 -2.326 5.038 360 HA ASP 47 HA ASP 47 10.612 -0.410 7.142 361 HB2 ASP 47 HB2 ASP 47 11.341 -0.589 4.494 362 HB3 ASP 47 HB1 ASP 47 10.027 0.586 4.433 363 H ILE 48 HN ILE 48 8.002 -1.335 4.924 364 HA ILE 48 HA ILE 48 6.233 0.810 5.564 365 HB ILE 48 HB ILE 48 4.697 -0.372 4.250 366 HG12 ILE 48 HG12 ILE 48 5.924 -2.831 5.482 367 HG13 ILE 48 HG11 ILE 48 4.237 -2.333 5.450 368 HG21 ILE 48 HG21 ILE 48 7.158 -1.837 3.342 369 HG22 ILE 48 HG22 ILE 48 7.058 -0.082 3.202 370 HG23 ILE 48 HG23 ILE 48 5.880 -1.104 2.377 371 HD11 ILE 48 HD11 ILE 48 5.874 -3.573 3.240 372 HD12 ILE 48 HD12 ILE 48 4.448 -2.608 2.858 373 HD13 ILE 48 HD13 ILE 48 4.292 -4.057 3.850 374 H ALA 49 HN ALA 49 6.858 -2.370 7.007 375 HA ALA 49 HA ALA 49 4.712 -1.999 8.987 376 HB1 ALA 49 HB1 ALA 49 6.846 -4.123 8.567 377 HB2 ALA 49 HB2 ALA 49 5.176 -4.209 8.007 378 HB3 ALA 49 HB3 ALA 49 5.529 -4.244 9.735 379 H ARG 50 HN ARG 50 8.285 -2.405 8.991 380 HA ARG 50 HA ARG 50 8.977 -2.033 11.645 381 HB2 ARG 50 HB2 ARG 50 10.090 -0.925 9.061 382 HB3 ARG 50 HB1 ARG 50 10.876 -0.568 10.600 383 HG2 ARG 50 HG2 ARG 50 11.422 -2.812 10.986 384 HG3 ARG 50 HG1 ARG 50 10.213 -3.398 9.842 385 HD2 ARG 50 HD2 ARG 50 12.544 -3.545 8.923 386 HD3 ARG 50 HD1 ARG 50 11.518 -2.471 7.960 387 HE ARG 50 HE ARG 50 12.713 -0.908 10.012 388 HH11 ARG 50 HH21 ARG 50 13.598 -2.776 7.248 389 HH12 ARG 50 HH22 ARG 50 14.962 -1.785 6.852 390 HH21 ARG 50 HH11 ARG 50 14.470 0.416 9.481 391 HH22 ARG 50 HH12 ARG 50 15.456 0.015 8.114 392 H LYS 51 HN LYS 51 8.340 0.530 9.289 393 HA LYS 51 HA LYS 51 8.586 2.791 10.949 394 HB2 LYS 51 HB2 LYS 51 8.301 2.912 8.535 395 HB3 LYS 51 HB1 LYS 51 6.708 2.162 8.646 396 HG2 LYS 51 HG2 LYS 51 6.408 4.556 8.388 397 HG3 LYS 51 HG1 LYS 51 5.947 4.110 10.030 398 HD2 LYS 51 HD2 LYS 51 7.837 5.093 10.968 399 HD3 LYS 51 HD1 LYS 51 8.779 4.939 9.484 400 HE2 LYS 51 HE2 LYS 51 7.608 6.759 8.438 401 HE3 LYS 51 HE1 LYS 51 6.379 6.784 9.719 402 HZ1 LYS 51 HZ1 LYS 51 8.694 6.939 11.103 403 HZ2 LYS 51 HZ2 LYS 51 7.720 8.270 10.696 404 HZ3 LYS 51 HZ3 LYS 51 9.055 7.863 9.727 405 H GLY 52 HN GLY 52 5.694 0.770 10.345 406 HA2 GLY 52 HA2 GLY 52 3.834 0.404 11.749 407 HA3 GLY 52 HA1 GLY 52 4.681 1.292 13.018 408 H GLN 53 HN GLN 53 5.057 3.775 11.938 409 HA GLN 53 HA GLN 53 2.266 4.756 11.687 410 HB2 GLN 53 HB2 GLN 53 4.759 6.410 12.066 411 HB3 GLN 53 HB1 GLN 53 3.119 6.758 12.608 412 HG2 GLN 53 HG2 GLN 53 4.768 4.449 13.660 413 HG3 GLN 53 HG1 GLN 53 4.692 6.024 14.444 414 HE21 GLN 53 HE21 GLN 53 2.365 6.798 14.955 415 HE22 GLN 53 HE22 GLN 53 1.249 5.618 15.448 416 H PHE 54 HN PHE 54 4.005 3.618 9.360 417 HA PHE 54 HA PHE 54 4.761 5.835 7.720 418 HB2 PHE 54 HB2 PHE 54 4.664 4.187 5.865 419 HB3 PHE 54 HB1 PHE 54 5.513 3.548 7.256 420 HD1 PHE 54 HD2 PHE 54 2.294 3.421 8.417 421 HD2 PHE 54 HD1 PHE 54 4.722 1.618 5.375 422 HE1 PHE 54 HE2 PHE 54 0.824 1.449 8.420 423 HE2 PHE 54 HE1 PHE 54 3.259 -0.357 5.393 424 HZ PHE 54 HZ PHE 54 1.299 -0.454 6.903 425 H ASP 55 HN ASP 55 2.680 4.386 5.636 426 HA ASP 55 HA ASP 55 0.302 5.940 6.462 427 HB2 ASP 55 HB2 ASP 55 1.482 6.401 3.732 428 HB3 ASP 55 HB1 ASP 55 0.361 7.415 4.629 429 H ILE 56 HN ILE 56 1.855 3.821 4.054 430 HA ILE 56 HA ILE 56 -0.636 2.221 3.982 431 HB ILE 56 HB ILE 56 0.406 3.908 1.712 432 HG12 ILE 56 HG12 ILE 56 -2.190 3.545 3.210 433 HG13 ILE 56 HG11 ILE 56 -1.264 5.023 2.962 434 HG21 ILE 56 HG21 ILE 56 -1.307 1.418 1.587 435 HG22 ILE 56 HG22 ILE 56 0.176 1.764 0.698 436 HG23 ILE 56 HG23 ILE 56 -1.304 2.633 0.308 437 HD11 ILE 56 HD11 ILE 56 -2.595 5.480 1.210 438 HD12 ILE 56 HD12 ILE 56 -3.370 3.901 1.328 439 HD13 ILE 56 HD13 ILE 56 -1.894 4.089 0.382 440 H ALA 57 HN ALA 57 -0.323 0.091 3.002 441 HA ALA 57 HA ALA 57 2.455 -0.587 2.128 442 HB1 ALA 57 HB1 ALA 57 1.358 -2.448 4.103 443 HB2 ALA 57 HB2 ALA 57 1.584 -0.825 4.752 444 HB3 ALA 57 HB3 ALA 57 2.949 -1.691 4.045 445 H ILE 58 HN ILE 58 2.227 -1.983 0.336 446 HA ILE 58 HA ILE 58 -0.177 -3.772 0.377 447 HB ILE 58 HB ILE 58 0.858 -2.061 -1.890 448 HG12 ILE 58 HG12 ILE 58 -1.564 -1.145 -1.582 449 HG13 ILE 58 HG11 ILE 58 -1.462 -1.882 0.020 450 HG21 ILE 58 HG21 ILE 58 -1.326 -2.874 -2.961 451 HG22 ILE 58 HG22 ILE 58 -1.339 -4.128 -1.720 452 HG23 ILE 58 HG23 ILE 58 -0.011 -4.045 -2.876 453 HD11 ILE 58 HD11 ILE 58 -0.272 -0.122 0.746 454 HD12 ILE 58 HD12 ILE 58 -0.336 0.598 -0.863 455 HD13 ILE 58 HD13 ILE 58 0.981 -0.492 -0.438 456 H ILE 59 HN ILE 59 1.090 -5.646 0.784 457 HA ILE 59 HA ILE 59 3.181 -6.402 -1.211 458 HB ILE 59 HB ILE 59 2.150 -7.439 1.445 459 HG12 ILE 59 HG12 ILE 59 4.914 -7.589 1.343 460 HG13 ILE 59 HG11 ILE 59 4.562 -6.168 0.366 461 HG21 ILE 59 HG21 ILE 59 2.484 -9.571 0.789 462 HG22 ILE 59 HG22 ILE 59 4.187 -9.172 0.561 463 HG23 ILE 59 HG23 ILE 59 3.062 -9.043 -0.791 464 HD11 ILE 59 HD11 ILE 59 2.859 -5.988 2.600 465 HD12 ILE 59 HD12 ILE 59 4.282 -5.003 2.264 466 HD13 ILE 59 HD13 ILE 59 4.433 -6.467 3.236 467 H ASP 60 HN ASP 60 1.020 -5.975 -2.531 468 HA ASP 60 HA ASP 60 -1.214 -7.639 -2.539 469 HB2 ASP 60 HB2 ASP 60 -1.622 -6.256 -4.272 470 HB3 ASP 60 HB1 ASP 60 0.034 -5.679 -4.154 471 H VAL 61 HN VAL 61 -1.668 -9.145 -4.526 472 HA VAL 61 HA VAL 61 -1.391 -11.271 -5.428 473 HB VAL 61 HB VAL 61 0.747 -9.621 -6.101 474 HG11 VAL 61 HG11 VAL 61 1.803 -12.318 -5.208 475 HG12 VAL 61 HG12 VAL 61 2.298 -10.739 -4.599 476 HG13 VAL 61 HG13 VAL 61 2.682 -11.205 -6.256 477 HG21 VAL 61 HG21 VAL 61 0.980 -11.127 -8.014 478 HG22 VAL 61 HG22 VAL 61 -0.724 -10.950 -7.596 479 HG23 VAL 61 HG23 VAL 61 0.151 -12.409 -7.131 480 H ASN 62 HN ASN 62 -1.984 -12.622 -3.777 481 HA ASN 62 HA ASN 62 0.218 -13.714 -2.057 482 HB2 ASN 62 HB2 ASN 62 -2.511 -12.666 -1.424 483 HB3 ASN 62 HB1 ASN 62 -1.978 -14.088 -0.533 484 HD21 ASN 62 HD21 ASN 62 -1.314 -10.654 -1.090 485 HD22 ASN 62 HD22 ASN 62 -0.230 -10.474 0.202 486 H LEU 63 HN LEU 63 -0.040 -14.985 -4.310 487 HA LEU 63 HA LEU 63 -1.783 -17.348 -3.740 488 HB2 LEU 63 HB2 LEU 63 -1.917 -15.358 -5.850 489 HB3 LEU 63 HB1 LEU 63 -1.638 -16.958 -6.532 490 HG LEU 63 HG LEU 63 -3.562 -17.847 -5.298 491 HD11 LEU 63 HD11 LEU 63 -3.519 -15.074 -4.134 492 HD12 LEU 63 HD12 LEU 63 -3.739 -16.619 -3.314 493 HD13 LEU 63 HD13 LEU 63 -5.056 -15.929 -4.263 494 HD21 LEU 63 HD21 LEU 63 -3.831 -15.498 -7.129 495 HD22 LEU 63 HD22 LEU 63 -5.295 -16.067 -6.328 496 HD23 LEU 63 HD23 LEU 63 -4.369 -17.161 -7.356 497 H ASP 64 HN ASP 64 -1.094 -19.075 -5.563 498 HA ASP 64 HA ASP 64 0.637 -20.625 -6.036 499 HB2 ASP 64 HB2 ASP 64 1.582 -17.925 -7.031 500 HB3 ASP 64 HB1 ASP 64 2.370 -19.443 -7.476 501 H GLY 65 HN GLY 65 0.843 -19.204 -3.338 502 HA2 GLY 65 HA2 GLY 65 2.797 -20.187 -1.946 503 HA3 GLY 65 HA1 GLY 65 3.812 -19.257 -3.044 504 H GLU 66 HN GLU 66 0.905 -17.660 -2.426 505 HA GLU 66 HA GLU 66 0.740 -15.454 -1.508 506 HB2 GLU 66 HB2 GLU 66 0.201 -15.790 0.835 507 HB3 GLU 66 HB1 GLU 66 -0.300 -17.223 -0.059 508 HG2 GLU 66 HG2 GLU 66 2.113 -18.090 0.561 509 HG3 GLU 66 HG1 GLU 66 2.003 -16.882 1.838 510 HA PRO 67 HA PRO 67 5.278 -14.870 -0.665 511 HB2 PRO 67 HB2 PRO 67 5.675 -12.965 -2.592 512 HB3 PRO 67 HB1 PRO 67 5.834 -14.705 -2.908 513 HG2 PRO 67 HG2 PRO 67 3.570 -12.869 -3.516 514 HG3 PRO 67 HG1 PRO 67 4.234 -14.199 -4.478 515 HD2 PRO 67 HD2 PRO 67 1.952 -14.410 -3.005 516 HD3 PRO 67 HD1 PRO 67 3.016 -15.789 -3.359 517 H SER 68 HN SER 68 3.974 -13.930 1.248 518 HA SER 68 HA SER 68 3.888 -10.941 1.055 519 HB2 SER 68 HB2 SER 68 2.187 -11.459 3.049 520 HB3 SER 68 HB1 SER 68 1.669 -11.540 1.367 521 HG SER 68 HG SER 68 1.096 -13.479 2.102 522 H TYR 69 HN TYR 69 5.649 -13.413 2.276 523 HA TYR 69 HA TYR 69 7.080 -13.716 4.089 524 HB2 TYR 69 HB2 TYR 69 7.588 -11.013 4.822 525 HB3 TYR 69 HB1 TYR 69 8.575 -12.052 3.810 526 HD1 TYR 69 HD2 TYR 69 7.100 -12.335 1.312 527 HD2 TYR 69 HD1 TYR 69 7.450 -8.910 3.870 528 HE1 TYR 69 HE2 TYR 69 6.633 -10.837 -0.608 529 HE2 TYR 69 HE1 TYR 69 6.978 -7.418 1.963 530 HH TYR 69 HH TYR 69 5.873 -8.629 -1.083 531 HA PRO 70 HA PRO 70 4.868 -13.421 7.802 532 HB2 PRO 70 HB2 PRO 70 6.779 -13.005 9.710 533 HB3 PRO 70 HB1 PRO 70 6.567 -14.550 8.862 534 HG2 PRO 70 HG2 PRO 70 8.573 -12.403 8.405 535 HG3 PRO 70 HG1 PRO 70 8.758 -14.161 8.311 536 HD2 PRO 70 HD2 PRO 70 8.487 -12.538 6.125 537 HD3 PRO 70 HD1 PRO 70 8.019 -14.252 6.151 538 H VAL 71 HN VAL 71 6.313 -10.647 6.582 539 HA VAL 71 HA VAL 71 5.510 -8.976 8.888 540 HB VAL 71 HB VAL 71 6.817 -7.273 7.867 541 HG11 VAL 71 HG11 VAL 71 7.902 -9.631 8.547 542 HG12 VAL 71 HG12 VAL 71 8.873 -8.309 7.909 543 HG13 VAL 71 HG13 VAL 71 8.359 -9.614 6.845 544 HG21 VAL 71 HG21 VAL 71 7.656 -7.572 5.504 545 HG22 VAL 71 HG22 VAL 71 5.912 -7.326 5.629 546 HG23 VAL 71 HG23 VAL 71 6.561 -8.943 5.366 547 H ALA 72 HN ALA 72 4.813 -9.161 5.354 548 HA ALA 72 HA ALA 72 2.746 -7.238 5.270 549 HB1 ALA 72 HB1 ALA 72 2.503 -9.766 3.726 550 HB2 ALA 72 HB2 ALA 72 4.020 -8.885 3.544 551 HB3 ALA 72 HB3 ALA 72 2.490 -8.101 3.151 552 H ASP 73 HN ASP 73 2.670 -10.752 5.888 553 HA ASP 73 HA ASP 73 -0.143 -10.954 6.331 554 HB2 ASP 73 HB2 ASP 73 2.338 -12.467 6.926 555 HB3 ASP 73 HB1 ASP 73 0.910 -12.922 7.845 556 H ILE 74 HN ILE 74 2.586 -10.671 8.609 557 HA ILE 74 HA ILE 74 1.162 -10.419 11.039 558 HB ILE 74 HB ILE 74 3.760 -9.388 9.918 559 HG12 ILE 74 HG12 ILE 74 3.059 -11.096 12.335 560 HG13 ILE 74 HG11 ILE 74 3.528 -11.722 10.752 561 HG21 ILE 74 HG21 ILE 74 3.369 -7.521 11.261 562 HG22 ILE 74 HG22 ILE 74 4.171 -8.605 12.398 563 HG23 ILE 74 HG23 ILE 74 2.416 -8.432 12.432 564 HD11 ILE 74 HD11 ILE 74 5.607 -10.110 11.107 565 HD12 ILE 74 HD12 ILE 74 5.587 -11.725 11.815 566 HD13 ILE 74 HD13 ILE 74 5.194 -10.322 12.808 567 H LEU 75 HN LEU 75 2.091 -7.980 8.650 568 HA LEU 75 HA LEU 75 0.982 -5.701 9.939 569 HB2 LEU 75 HB2 LEU 75 2.576 -6.141 7.866 570 HB3 LEU 75 HB1 LEU 75 1.074 -6.049 6.953 571 HG LEU 75 HG LEU 75 0.766 -3.866 8.509 572 HD11 LEU 75 HD11 LEU 75 3.423 -3.071 8.078 573 HD12 LEU 75 HD12 LEU 75 3.537 -4.670 8.814 574 HD13 LEU 75 HD13 LEU 75 2.655 -3.382 9.635 575 HD21 LEU 75 HD21 LEU 75 2.216 -4.255 5.896 576 HD22 LEU 75 HD22 LEU 75 2.012 -2.638 6.571 577 HD23 LEU 75 HD23 LEU 75 0.597 -3.613 6.174 578 H ALA 76 HN ALA 76 -0.510 -8.419 8.494 579 HA ALA 76 HA ALA 76 -3.002 -7.040 7.782 580 HB1 ALA 76 HB1 ALA 76 -1.628 -9.421 7.081 581 HB2 ALA 76 HB2 ALA 76 -3.162 -8.844 6.430 582 HB3 ALA 76 HB3 ALA 76 -3.147 -9.920 7.827 583 H GLU 77 HN GLU 77 -1.817 -9.351 10.232 584 HA GLU 77 HA GLU 77 -4.337 -9.655 11.590 585 HB2 GLU 77 HB2 GLU 77 -2.923 -10.684 13.309 586 HB3 GLU 77 HB1 GLU 77 -2.358 -11.181 11.714 587 HG2 GLU 77 HG2 GLU 77 -0.436 -9.912 11.844 588 HG3 GLU 77 HG1 GLU 77 -1.172 -8.706 12.897 589 H ARG 78 HN ARG 78 -1.957 -7.162 11.532 590 HA ARG 78 HA ARG 78 -3.314 -5.768 13.785 591 HB2 ARG 78 HB2 ARG 78 -1.063 -4.898 14.382 592 HB3 ARG 78 HB1 ARG 78 -1.104 -6.660 14.439 593 HG2 ARG 78 HG2 ARG 78 0.402 -6.848 12.762 594 HG3 ARG 78 HG1 ARG 78 -0.431 -5.646 11.777 595 HD2 ARG 78 HD2 ARG 78 0.734 -3.842 12.781 596 HD3 ARG 78 HD1 ARG 78 1.237 -4.831 14.168 597 HE ARG 78 HE ARG 78 2.201 -6.025 11.745 598 HH11 ARG 78 HH21 ARG 78 2.554 -2.830 12.642 599 HH12 ARG 78 HH22 ARG 78 4.277 -2.873 12.807 600 HH21 ARG 78 HH11 ARG 78 4.489 -6.316 12.483 601 HH22 ARG 78 HH12 ARG 78 5.372 -4.846 12.724 602 H ASN 79 HN ASN 79 -4.137 -5.431 11.181 603 HA ASN 79 HA ASN 79 -2.934 -3.644 9.455 604 HB2 ASN 79 HB2 ASN 79 -5.800 -3.936 10.373 605 HB3 ASN 79 HB1 ASN 79 -5.338 -2.975 8.967 606 HD21 ASN 79 HD21 ASN 79 -6.484 -5.970 9.720 607 HD22 ASN 79 HD22 ASN 79 -5.816 -6.870 8.447 608 H VAL 80 HN VAL 80 -1.827 -1.863 10.165 609 HA VAL 80 HA VAL 80 -3.004 0.015 12.139 610 HB VAL 80 HB VAL 80 -0.502 -0.970 11.547 611 HG11 VAL 80 HG11 VAL 80 -0.002 0.153 9.567 612 HG12 VAL 80 HG12 VAL 80 0.755 1.172 10.788 613 HG13 VAL 80 HG13 VAL 80 -0.781 1.641 10.081 614 HG21 VAL 80 HG21 VAL 80 0.152 1.376 12.794 615 HG22 VAL 80 HG22 VAL 80 -0.487 -0.051 13.611 616 HG23 VAL 80 HG23 VAL 80 -1.573 1.258 13.144 617 HA PRO 81 HA PRO 81 -4.380 2.916 9.063 618 HB2 PRO 81 HB2 PRO 81 -2.677 5.081 8.899 619 HB3 PRO 81 HB1 PRO 81 -3.881 4.874 10.188 620 HG2 PRO 81 HG2 PRO 81 -0.962 4.233 10.212 621 HG3 PRO 81 HG1 PRO 81 -1.947 5.033 11.451 622 HD2 PRO 81 HD2 PRO 81 -1.281 2.466 11.679 623 HD3 PRO 81 HD1 PRO 81 -2.889 3.028 12.187 624 H PHE 82 HN PHE 82 -4.262 2.330 6.952 625 HA PHE 82 HA PHE 82 -1.984 2.654 5.242 626 HB2 PHE 82 HB2 PHE 82 -1.074 0.447 5.284 627 HB3 PHE 82 HB1 PHE 82 -1.288 0.867 6.981 628 HD1 PHE 82 HD2 PHE 82 -4.442 0.592 6.844 629 HD2 PHE 82 HD1 PHE 82 -1.198 -1.964 5.664 630 HE1 PHE 82 HE2 PHE 82 -5.899 -1.368 7.150 631 HE2 PHE 82 HE1 PHE 82 -2.672 -3.936 5.972 632 HZ PHE 82 HZ PHE 82 -5.015 -3.639 6.708 633 H ILE 83 HN ILE 83 -2.389 0.111 3.916 634 HA ILE 83 HA ILE 83 -5.159 -0.260 3.198 635 HB ILE 83 HB ILE 83 -3.445 1.663 1.831 636 HG12 ILE 83 HG12 ILE 83 -5.635 2.268 2.725 637 HG13 ILE 83 HG11 ILE 83 -5.655 2.453 0.974 638 HG21 ILE 83 HG21 ILE 83 -4.472 1.044 -0.456 639 HG22 ILE 83 HG22 ILE 83 -4.769 -0.542 0.256 640 HG23 ILE 83 HG23 ILE 83 -3.120 0.063 0.109 641 HD11 ILE 83 HD11 ILE 83 -7.166 0.787 0.695 642 HD12 ILE 83 HD12 ILE 83 -7.509 1.027 2.407 643 HD13 ILE 83 HD13 ILE 83 -6.396 -0.242 1.898 644 H PHE 84 HN PHE 84 -5.285 -2.077 1.635 645 HA PHE 84 HA PHE 84 -2.741 -3.356 0.851 646 HB2 PHE 84 HB2 PHE 84 -3.613 -3.802 3.331 647 HB3 PHE 84 HB1 PHE 84 -4.620 -4.986 2.501 648 HD1 PHE 84 HD2 PHE 84 -3.438 -6.672 0.921 649 HD2 PHE 84 HD1 PHE 84 -1.347 -4.271 3.810 650 HE1 PHE 84 HE2 PHE 84 -1.507 -8.232 0.826 651 HE2 PHE 84 HE1 PHE 84 0.579 -5.837 3.713 652 HZ PHE 84 HZ PHE 84 0.495 -7.810 2.217 653 H ALA 85 HN ALA 85 -3.196 -5.391 -0.425 654 HA ALA 85 HA ALA 85 -5.876 -5.995 -1.277 655 HB1 ALA 85 HB1 ALA 85 -5.326 -4.989 -3.657 656 HB2 ALA 85 HB2 ALA 85 -4.217 -3.968 -2.742 657 HB3 ALA 85 HB3 ALA 85 -5.943 -3.938 -2.382 658 H THR 86 HN THR 86 -5.792 -8.050 -2.109 659 HA THR 86 HA THR 86 -3.714 -8.895 -3.965 660 HB THR 86 HB THR 86 -2.425 -8.936 -1.918 661 HG1 THR 86 HG1 THR 86 -2.361 -10.783 -3.376 662 HG21 THR 86 HG21 THR 86 -4.580 -9.044 -0.500 663 HG22 THR 86 HG22 THR 86 -3.169 -9.914 0.104 664 HG23 THR 86 HG23 THR 86 -4.469 -10.793 -0.702 665 H GLY 87 HN GLY 87 -4.012 -11.708 -2.789 666 HA2 GLY 87 HA2 GLY 87 -5.926 -12.783 -4.474 667 HA3 GLY 87 HA1 GLY 87 -5.464 -13.541 -2.951 668 H TYR 88 HN TYR 88 -6.542 -11.760 -1.072 669 HA TYR 88 HA TYR 88 -9.450 -12.149 -1.613 670 HB2 TYR 88 HB2 TYR 88 -9.542 -11.947 0.915 671 HB3 TYR 88 HB1 TYR 88 -8.584 -13.302 0.320 672 HD1 TYR 88 HD2 TYR 88 -8.314 -9.771 1.457 673 HD2 TYR 88 HD1 TYR 88 -6.310 -13.523 0.921 674 HE1 TYR 88 HE2 TYR 88 -6.342 -8.881 2.667 675 HE2 TYR 88 HE1 TYR 88 -4.331 -12.639 2.134 676 HH TYR 88 HH TYR 88 -4.081 -10.632 4.018 677 H GLY 89 HN GLY 89 -7.045 -9.694 -0.803 678 HA2 GLY 89 HA2 GLY 89 -7.427 -7.400 -1.523 679 HA3 GLY 89 HA1 GLY 89 -9.150 -7.641 -1.282 680 H SER 90 HN SER 90 -9.546 -8.381 1.180 681 HA SER 90 HA SER 90 -7.841 -7.335 3.231 682 HB2 SER 90 HB2 SER 90 -9.368 -5.441 1.643 683 HB3 SER 90 HB1 SER 90 -9.831 -5.349 3.338 684 HG SER 90 HG SER 90 -7.132 -5.580 2.990 685 H LYS 91 HN LYS 91 -8.671 -9.185 4.340 686 HA LYS 91 HA LYS 91 -11.268 -10.093 4.662 687 HB2 LYS 91 HB2 LYS 91 -10.381 -10.534 7.119 688 HB3 LYS 91 HB1 LYS 91 -9.600 -11.322 5.749 689 HG2 LYS 91 HG2 LYS 91 -7.714 -9.985 5.875 690 HG3 LYS 91 HG1 LYS 91 -8.598 -8.625 6.565 691 HD2 LYS 91 HD2 LYS 91 -8.905 -10.497 8.531 692 HD3 LYS 91 HD1 LYS 91 -7.302 -10.908 7.918 693 HE2 LYS 91 HE2 LYS 91 -6.379 -9.044 8.839 694 HE3 LYS 91 HE1 LYS 91 -7.679 -8.010 8.212 695 HZ1 LYS 91 HZ1 LYS 91 -8.859 -8.210 10.086 696 HZ2 LYS 91 HZ2 LYS 91 -7.403 -8.713 10.803 697 HZ3 LYS 91 HZ3 LYS 91 -8.525 -9.865 10.253 698 H GLY 92 HN GLY 92 -10.172 -8.502 7.577 699 HA2 GLY 92 HA2 GLY 92 -12.438 -6.564 7.377 700 HA3 GLY 92 HA1 GLY 92 -12.164 -7.496 8.854 701 H LEU 93 HN LEU 93 -9.489 -6.391 6.927 702 HA LEU 93 HA LEU 93 -7.971 -5.291 8.935 703 HB2 LEU 93 HB2 LEU 93 -6.782 -4.136 7.190 704 HB3 LEU 93 HB1 LEU 93 -7.384 -5.642 6.513 705 HG LEU 93 HG LEU 93 -7.815 -3.972 4.876 706 HD11 LEU 93 HD11 LEU 93 -10.239 -3.939 4.692 707 HD12 LEU 93 HD12 LEU 93 -10.408 -4.301 6.408 708 HD13 LEU 93 HD13 LEU 93 -9.722 -5.502 5.318 709 HD21 LEU 93 HD21 LEU 93 -8.006 -2.238 7.122 710 HD22 LEU 93 HD22 LEU 93 -9.525 -2.111 6.234 711 HD23 LEU 93 HD23 LEU 93 -7.995 -1.803 5.413 712 H ASP 94 HN ASP 94 -7.885 -3.419 10.085 713 HA ASP 94 HA ASP 94 -10.143 -1.480 9.709 714 HB2 ASP 94 HB2 ASP 94 -9.693 -0.995 12.124 715 HB3 ASP 94 HB1 ASP 94 -10.061 -2.699 11.855 716 H THR 95 HN THR 95 -9.571 0.802 9.814 717 HA THR 95 HA THR 95 -6.819 1.676 10.086 718 HB THR 95 HB THR 95 -6.478 0.511 8.042 719 HG1 THR 95 HG1 THR 95 -6.045 2.138 6.625 720 HG21 THR 95 HG21 THR 95 -9.272 1.184 7.629 721 HG22 THR 95 HG22 THR 95 -8.319 -0.118 6.918 722 HG23 THR 95 HG23 THR 95 -8.312 1.484 6.181 723 H ARG 96 HN ARG 96 -6.596 3.994 9.560 724 HA ARG 96 HA ARG 96 -8.996 5.529 10.159 725 HB2 ARG 96 HB2 ARG 96 -6.250 6.385 9.172 726 HB3 ARG 96 HB1 ARG 96 -7.418 7.401 10.021 727 HG2 ARG 96 HG2 ARG 96 -6.504 4.845 11.303 728 HG3 ARG 96 HG1 ARG 96 -5.453 6.260 11.358 729 HD2 ARG 96 HD2 ARG 96 -8.337 6.169 12.327 730 HD3 ARG 96 HD1 ARG 96 -6.892 6.228 13.357 731 HE ARG 96 HE ARG 96 -8.008 8.480 11.892 732 HH11 ARG 96 HH11 ARG 96 -5.308 8.308 10.710 733 HH12 ARG 96 HH12 ARG 96 -4.333 9.190 11.837 734 HH21 ARG 96 HH21 ARG 96 -6.688 9.067 14.379 735 HH22 ARG 96 HH22 ARG 96 -5.116 9.628 13.913 736 H TYR 97 HN TYR 97 -7.982 4.043 7.365 737 HA TYR 97 HA TYR 97 -8.484 6.156 5.431 738 HB2 TYR 97 HB2 TYR 97 -8.029 3.176 5.419 739 HB3 TYR 97 HB1 TYR 97 -8.405 4.041 3.925 740 HD1 TYR 97 HD2 TYR 97 -6.228 4.473 6.954 741 HD2 TYR 97 HD1 TYR 97 -6.601 4.847 2.694 742 HE1 TYR 97 HE2 TYR 97 -3.897 5.292 6.828 743 HE2 TYR 97 HE1 TYR 97 -4.267 5.675 2.565 744 HH TYR 97 HH TYR 97 -2.581 6.610 3.874 745 H SER 98 HN SER 98 -10.481 3.951 7.203 746 HA SER 98 HA SER 98 -12.857 3.922 7.307 747 HB2 SER 98 HB2 SER 98 -12.997 5.366 4.681 748 HB3 SER 98 HB1 SER 98 -14.060 5.500 6.082 749 HG SER 98 HG SER 98 -12.829 7.051 6.762 750 H ASN 99 HN ASN 99 -11.157 1.943 6.079 751 HA ASN 99 HA ASN 99 -11.186 0.188 4.447 752 HB2 ASN 99 HB2 ASN 99 -13.770 0.328 5.988 753 HB3 ASN 99 HB1 ASN 99 -13.364 -1.063 4.982 754 HD21 ASN 99 HD21 ASN 99 -10.455 0.217 6.136 755 HD22 ASN 99 HD22 ASN 99 -10.264 -0.779 7.492 756 H ILE 100 HN ILE 100 -11.265 1.605 2.446 757 HA ILE 100 HA ILE 100 -13.740 0.991 0.954 758 HB ILE 100 HB ILE 100 -13.776 3.263 -0.050 759 HG12 ILE 100 HG12 ILE 100 -11.370 3.809 0.577 760 HG13 ILE 100 HG11 ILE 100 -12.553 5.079 0.837 761 HG21 ILE 100 HG21 ILE 100 -15.367 3.672 1.445 762 HG22 ILE 100 HG22 ILE 100 -14.162 4.117 2.650 763 HG23 ILE 100 HG23 ILE 100 -14.678 2.440 2.497 764 HD11 ILE 100 HD11 ILE 100 -12.359 3.363 3.165 765 HD12 ILE 100 HD12 ILE 100 -12.188 5.108 3.040 766 HD13 ILE 100 HD13 ILE 100 -10.796 4.067 2.755 767 HA PRO 101 HA PRO 101 -10.363 1.346 -2.243 768 HB2 PRO 101 HB2 PRO 101 -7.810 2.030 -1.560 769 HB3 PRO 101 HB1 PRO 101 -9.078 3.234 -1.851 770 HG2 PRO 101 HG2 PRO 101 -7.775 2.532 0.632 771 HG3 PRO 101 HG1 PRO 101 -8.869 3.870 0.297 772 HD2 PRO 101 HD2 PRO 101 -9.438 1.280 1.534 773 HD3 PRO 101 HD1 PRO 101 -10.395 2.767 1.536 774 H LEU 102 HN LEU 102 -10.838 -1.034 -0.884 775 HA LEU 102 HA LEU 102 -8.145 -2.308 -0.727 776 HB2 LEU 102 HB2 LEU 102 -10.636 -3.636 0.282 777 HB3 LEU 102 HB1 LEU 102 -9.004 -3.715 0.932 778 HG LEU 102 HG LEU 102 -10.494 -1.101 1.037 779 HD11 LEU 102 HD11 LEU 102 -12.155 -2.241 2.135 780 HD12 LEU 102 HD12 LEU 102 -11.023 -2.080 3.478 781 HD13 LEU 102 HD13 LEU 102 -11.094 -3.584 2.561 782 HD21 LEU 102 HD21 LEU 102 -8.064 -2.289 2.109 783 HD22 LEU 102 HD22 LEU 102 -9.086 -1.652 3.396 784 HD23 LEU 102 HD23 LEU 102 -8.561 -0.600 2.087 785 H LEU 103 HN LEU 103 -7.724 -4.251 -1.876 786 HA LEU 103 HA LEU 103 -9.718 -5.750 -3.292 787 HB2 LEU 103 HB2 LEU 103 -9.378 -3.170 -4.261 788 HB3 LEU 103 HB1 LEU 103 -8.436 -4.155 -5.370 789 HG LEU 103 HG LEU 103 -11.346 -4.564 -4.633 790 HD11 LEU 103 HD11 LEU 103 -11.053 -4.323 -7.362 791 HD12 LEU 103 HD12 LEU 103 -9.864 -3.180 -6.735 792 HD13 LEU 103 HD13 LEU 103 -11.560 -3.035 -6.270 793 HD21 LEU 103 HD21 LEU 103 -9.831 -6.650 -5.090 794 HD22 LEU 103 HD22 LEU 103 -9.821 -6.070 -6.756 795 HD23 LEU 103 HD23 LEU 103 -11.346 -6.502 -5.981 796 H THR 104 HN THR 104 -8.151 -5.894 -5.813 797 HA THR 104 HA THR 104 -5.725 -7.279 -4.814 798 HB THR 104 HB THR 104 -7.155 -9.005 -5.485 799 HG1 THR 104 HG1 THR 104 -5.197 -8.912 -6.765 800 HG21 THR 104 HG21 THR 104 -8.422 -8.635 -7.807 801 HG22 THR 104 HG22 THR 104 -8.271 -6.949 -7.323 802 HG23 THR 104 HG23 THR 104 -9.106 -8.092 -6.276 803 H LYS 105 HN LYS 105 -6.605 -6.984 -8.184 804 HA LYS 105 HA LYS 105 -5.105 -4.551 -8.712 805 HB2 LYS 105 HB2 LYS 105 -3.581 -6.780 -8.213 806 HB3 LYS 105 HB1 LYS 105 -3.754 -6.858 -9.968 807 HG2 LYS 105 HG2 LYS 105 -2.158 -5.279 -10.134 808 HG3 LYS 105 HG1 LYS 105 -3.275 -4.145 -9.375 809 HD2 LYS 105 HD2 LYS 105 -2.367 -4.461 -7.251 810 HD3 LYS 105 HD1 LYS 105 -1.702 -6.044 -7.659 811 HE2 LYS 105 HE2 LYS 105 -0.623 -3.834 -9.296 812 HE3 LYS 105 HE1 LYS 105 -0.212 -3.743 -7.573 813 HZ1 LYS 105 HZ1 LYS 105 0.391 -6.118 -7.680 814 HZ2 LYS 105 HZ2 LYS 105 1.378 -5.150 -8.668 815 HZ3 LYS 105 HZ3 LYS 105 0.143 -6.092 -9.358 816 HA PRO 106 HA PRO 106 -7.840 -6.291 -12.071 817 HB2 PRO 106 HB2 PRO 106 -10.105 -4.840 -11.613 818 HB3 PRO 106 HB1 PRO 106 -9.805 -6.406 -10.836 819 HG2 PRO 106 HG2 PRO 106 -9.656 -3.687 -9.707 820 HG3 PRO 106 HG1 PRO 106 -10.003 -5.225 -8.911 821 HD2 PRO 106 HD2 PRO 106 -7.561 -3.826 -8.872 822 HD3 PRO 106 HD1 PRO 106 -7.846 -5.482 -8.309 823 H PHE 107 HN PHE 107 -7.139 -3.178 -10.734 824 HA PHE 107 HA PHE 107 -6.585 -1.121 -11.720 825 HB2 PHE 107 HB2 PHE 107 -6.173 -3.189 -13.839 826 HB3 PHE 107 HB1 PHE 107 -6.096 -1.491 -14.317 827 HD1 PHE 107 HD1 PHE 107 -4.492 0.058 -13.178 828 HD2 PHE 107 HD2 PHE 107 -4.450 -4.182 -12.495 829 HE1 PHE 107 HE1 PHE 107 -2.232 0.241 -12.177 830 HE2 PHE 107 HE2 PHE 107 -2.188 -3.999 -11.496 831 HZ PHE 107 HZ PHE 107 -1.080 -1.781 -11.333 832 H LEU 108 HN LEU 108 -9.179 -1.310 -11.225 833 HA LEU 108 HA LEU 108 -10.458 0.097 -13.514 834 HB2 LEU 108 HB2 LEU 108 -10.904 -2.521 -13.235 835 HB3 LEU 108 HB1 LEU 108 -12.005 -1.972 -11.972 836 HG LEU 108 HG LEU 108 -13.120 -2.184 -14.194 837 HD11 LEU 108 HD11 LEU 108 -13.242 0.712 -13.894 838 HD12 LEU 108 HD12 LEU 108 -13.260 -0.098 -12.327 839 HD13 LEU 108 HD13 LEU 108 -14.476 -0.497 -13.539 840 HD21 LEU 108 HD21 LEU 108 -10.817 -1.241 -15.228 841 HD22 LEU 108 HD22 LEU 108 -11.714 0.275 -15.128 842 HD23 LEU 108 HD23 LEU 108 -12.360 -1.073 -16.066 843 H ASP 109 HN ASP 109 -11.483 -1.235 -10.386 844 HA ASP 109 HA ASP 109 -12.204 1.524 -9.470 845 HB2 ASP 109 HB2 ASP 109 -13.196 -1.279 -8.862 846 HB3 ASP 109 HB1 ASP 109 -13.628 0.101 -7.849 847 H SER 110 HN SER 110 -9.711 -0.486 -9.418 848 HA SER 110 HA SER 110 -9.156 -0.663 -6.535 849 HB2 SER 110 HB2 SER 110 -8.724 -2.514 -8.064 850 HB3 SER 110 HB1 SER 110 -7.737 -1.477 -9.088 851 HG SER 110 HG SER 110 -6.920 -1.420 -6.492 852 H GLU 111 HN GLU 111 -6.498 -0.104 -8.696 853 HA GLU 111 HA GLU 111 -4.993 1.671 -7.312 854 HB2 GLU 111 HB2 GLU 111 -4.240 0.893 -9.414 855 HB3 GLU 111 HB1 GLU 111 -5.666 1.509 -10.249 856 HG2 GLU 111 HG2 GLU 111 -4.896 3.844 -9.640 857 HG3 GLU 111 HG1 GLU 111 -3.389 3.124 -9.073 858 H LEU 112 HN LEU 112 -7.922 2.571 -9.110 859 HA LEU 112 HA LEU 112 -7.634 5.424 -8.823 860 HB2 LEU 112 HB2 LEU 112 -10.266 3.946 -8.907 861 HB3 LEU 112 HB1 LEU 112 -9.848 5.483 -9.657 862 HG LEU 112 HG LEU 112 -9.046 2.705 -10.508 863 HD11 LEU 112 HD11 LEU 112 -9.981 4.951 -12.271 864 HD12 LEU 112 HD12 LEU 112 -11.156 4.083 -11.283 865 HD13 LEU 112 HD13 LEU 112 -10.195 3.212 -12.478 866 HD21 LEU 112 HD21 LEU 112 -7.706 4.130 -12.287 867 HD22 LEU 112 HD22 LEU 112 -6.967 3.747 -10.732 868 HD23 LEU 112 HD23 LEU 112 -7.681 5.337 -11.001 869 H GLU 113 HN GLU 113 -10.043 3.365 -7.172 870 HA GLU 113 HA GLU 113 -10.674 5.094 -5.059 871 HB2 GLU 113 HB2 GLU 113 -10.413 2.064 -5.181 872 HB3 GLU 113 HB1 GLU 113 -11.259 2.928 -3.889 873 HG2 GLU 113 HG2 GLU 113 -12.439 4.105 -5.976 874 HG3 GLU 113 HG1 GLU 113 -12.024 2.577 -6.751 875 H ALA 114 HN ALA 114 -7.905 2.968 -5.503 876 HA ALA 114 HA ALA 114 -6.884 2.897 -2.880 877 HB1 ALA 114 HB1 ALA 114 -5.051 3.343 -5.205 878 HB2 ALA 114 HB2 ALA 114 -6.121 1.941 -5.253 879 HB3 ALA 114 HB3 ALA 114 -4.964 2.123 -3.934 880 H VAL 115 HN VAL 115 -6.509 5.419 -5.366 881 HA VAL 115 HA VAL 115 -5.201 7.148 -3.294 882 HB VAL 115 HB VAL 115 -5.247 7.266 -6.323 883 HG11 VAL 115 HG11 VAL 115 -4.766 9.457 -5.876 884 HG12 VAL 115 HG12 VAL 115 -3.158 8.814 -5.546 885 HG13 VAL 115 HG13 VAL 115 -4.277 9.117 -4.216 886 HG21 VAL 115 HG21 VAL 115 -2.916 6.650 -4.496 887 HG22 VAL 115 HG22 VAL 115 -3.029 6.396 -6.237 888 HG23 VAL 115 HG23 VAL 115 -3.961 5.382 -5.137 889 H LEU 116 HN LEU 116 -7.999 6.936 -5.417 890 HA LEU 116 HA LEU 116 -8.694 9.776 -4.973 891 HB2 LEU 116 HB2 LEU 116 -9.371 7.566 -6.783 892 HB3 LEU 116 HB1 LEU 116 -10.731 8.619 -6.388 893 HG LEU 116 HG LEU 116 -9.604 9.504 -8.341 894 HD11 LEU 116 HD11 LEU 116 -10.322 10.988 -6.274 895 HD12 LEU 116 HD12 LEU 116 -9.444 11.716 -7.620 896 HD13 LEU 116 HD13 LEU 116 -8.588 11.274 -6.142 897 HD21 LEU 116 HD21 LEU 116 -7.402 9.040 -8.551 898 HD22 LEU 116 HD22 LEU 116 -7.255 8.687 -6.830 899 HD23 LEU 116 HD23 LEU 116 -7.100 10.346 -7.405 900 H VAL 117 HN VAL 117 -10.077 6.594 -4.203 901 HA VAL 117 HA VAL 117 -12.559 7.091 -3.216 902 HB VAL 117 HB VAL 117 -11.065 4.994 -3.072 903 HG11 VAL 117 HG11 VAL 117 -10.493 6.183 -0.348 904 HG12 VAL 117 HG12 VAL 117 -9.326 6.120 -1.669 905 HG13 VAL 117 HG13 VAL 117 -9.938 4.627 -0.960 906 HG21 VAL 117 HG21 VAL 117 -12.941 5.775 -0.830 907 HG22 VAL 117 HG22 VAL 117 -12.376 4.128 -1.119 908 HG23 VAL 117 HG23 VAL 117 -13.363 4.942 -2.327 909 H GLN 118 HN GLN 118 -9.558 7.944 -1.498 910 HA GLN 118 HA GLN 118 -10.425 8.840 0.952 911 HB2 GLN 118 HB2 GLN 118 -8.276 9.283 -0.869 912 HB3 GLN 118 HB1 GLN 118 -8.744 10.849 -0.206 913 HG2 GLN 118 HG2 GLN 118 -8.024 8.362 1.353 914 HG3 GLN 118 HG1 GLN 118 -7.100 9.863 1.266 915 HE21 GLN 118 HE21 GLN 118 -9.945 8.336 2.687 916 HE22 GLN 118 HE22 GLN 118 -10.328 9.607 3.743 917 H ILE 119 HN ILE 119 -10.155 11.101 -1.806 918 HA ILE 119 HA ILE 119 -12.088 12.922 -0.555 919 HB ILE 119 HB ILE 119 -11.463 14.383 -2.326 920 HG12 ILE 119 HG12 ILE 119 -10.123 13.332 -4.308 921 HG13 ILE 119 HG11 ILE 119 -10.871 11.819 -3.792 922 HG21 ILE 119 HG21 ILE 119 -9.212 14.515 -1.934 923 HG22 ILE 119 HG22 ILE 119 -8.936 12.824 -2.355 924 HG23 ILE 119 HG23 ILE 119 -9.567 13.245 -0.764 925 HD11 ILE 119 HD11 ILE 119 -12.812 13.989 -3.899 926 HD12 ILE 119 HD12 ILE 119 -12.865 12.406 -4.672 927 HD13 ILE 119 HD13 ILE 119 -12.027 13.744 -5.459 928 H SER 120 HN SER 120 -12.228 10.172 -2.546 929 HA SER 120 HA SER 120 -14.721 10.959 -3.942 930 HB2 SER 120 HB2 SER 120 -12.677 8.823 -4.032 931 HB3 SER 120 HB1 SER 120 -14.312 8.290 -4.410 932 HG SER 120 HG SER 120 -12.704 10.220 -5.686 933 H LYS 121 HN LYS 121 -16.070 11.236 -2.023 934 HA LYS 121 HA LYS 121 -16.733 8.661 -0.639 935 HB2 LYS 121 HB2 LYS 121 -15.716 10.844 0.484 936 HB3 LYS 121 HB1 LYS 121 -17.399 11.376 0.443 937 HG2 LYS 121 HG2 LYS 121 -17.076 10.279 2.555 938 HG3 LYS 121 HG1 LYS 121 -18.014 9.177 1.546 939 HD2 LYS 121 HD2 LYS 121 -16.279 7.876 2.592 940 HD3 LYS 121 HD1 LYS 121 -15.833 8.070 0.897 941 HE2 LYS 121 HE2 LYS 121 -14.739 10.322 2.172 942 HE3 LYS 121 HE1 LYS 121 -14.397 8.961 3.259 943 HZ1 LYS 121 HZ1 LYS 121 -13.832 9.113 0.346 944 HZ2 LYS 121 HZ2 LYS 121 -13.706 7.686 1.260 945 HZ3 LYS 121 HZ3 LYS 121 -12.696 9.008 1.603 946 H GLU 122 HN GLU 122 -18.331 8.126 -2.290 947 HA GLU 122 HA GLU 122 -20.411 8.292 -3.425 948 HB2 GLU 122 HB2 GLU 122 -22.235 8.576 -1.699 949 HB3 GLU 122 HB1 GLU 122 -21.010 7.392 -1.252 950 HG2 GLU 122 HG2 GLU 122 -19.922 8.986 0.217 951 HG3 GLU 122 HG1 GLU 122 -20.987 10.281 -0.335 952 H VAL 123 HN VAL 123 -18.774 10.652 -3.540 953 HA VAL 123 HA VAL 123 -18.919 13.044 -3.636 954 HB VAL 123 HB VAL 123 -20.048 13.478 -5.754 955 HG11 VAL 123 HG11 VAL 123 -17.980 11.924 -5.551 956 HG12 VAL 123 HG12 VAL 123 -18.863 11.934 -7.078 957 HG13 VAL 123 HG13 VAL 123 -19.106 10.620 -5.925 958 HG21 VAL 123 HG21 VAL 123 -22.076 12.538 -6.064 959 HG22 VAL 123 HG22 VAL 123 -21.792 11.364 -4.783 960 HG23 VAL 123 HG23 VAL 123 -21.242 11.026 -6.421 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 9.443 32.037 5.035 2 H2 GLY 1 HT2 GLY 1 10.114 30.995 3.875 3 H3 GLY 1 HT3 GLY 1 11.071 31.576 5.153 4 HA2 GLY 1 HA2 GLY 1 9.286 30.431 6.635 5 HA3 GLY 1 HA1 GLY 1 9.004 29.492 5.169 6 H SER 2 HN SER 2 11.115 28.654 4.117 7 HA SER 2 HA SER 2 12.905 27.119 4.395 8 HB2 SER 2 HB2 SER 2 13.915 29.017 6.484 9 HB3 SER 2 HB1 SER 2 14.783 28.277 5.142 10 HG SER 2 HG SER 2 13.217 30.565 5.236 11 H HIS 3 HN HIS 3 10.568 26.730 6.198 12 HA HIS 3 HA HIS 3 11.945 25.083 8.245 13 HB2 HIS 3 HB2 HIS 3 11.722 26.943 9.594 14 HB3 HIS 3 HB1 HIS 3 10.367 27.579 8.670 15 HD1 HIS 3 HD1 HIS 3 11.155 24.935 11.280 16 HD2 HIS 3 HD2 HIS 3 7.855 26.947 9.717 17 HE1 HIS 3 HE1 HIS 3 9.178 24.306 12.734 18 H MET 4 HN MET 4 9.839 25.093 5.820 19 HA MET 4 HA MET 4 7.608 23.642 7.131 20 HB2 MET 4 HB2 MET 4 8.077 25.223 4.770 21 HB3 MET 4 HB1 MET 4 7.430 23.653 4.293 22 HG2 MET 4 HG2 MET 4 5.415 24.592 4.767 23 HG3 MET 4 HG1 MET 4 5.845 24.248 6.442 24 HE1 MET 4 HE1 MET 4 4.624 28.061 4.805 25 HE2 MET 4 HE2 MET 4 4.156 26.378 4.576 26 HE3 MET 4 HE3 MET 4 5.501 27.043 3.653 27 H THR 5 HN THR 5 7.215 21.419 6.769 28 HA THR 5 HA THR 5 9.301 19.930 5.209 29 HB THR 5 HB THR 5 8.775 18.161 7.104 30 HG1 THR 5 HG1 THR 5 7.762 18.936 8.771 31 HG21 THR 5 HG21 THR 5 10.380 19.976 8.531 32 HG22 THR 5 HG22 THR 5 10.672 20.337 6.830 33 HG23 THR 5 HG23 THR 5 10.934 18.704 7.442 34 H GLU 6 HN GLU 6 8.504 17.761 4.505 35 HA GLU 6 HA GLU 6 5.674 17.124 4.653 36 HB2 GLU 6 HB2 GLU 6 5.362 17.521 2.141 37 HB3 GLU 6 HB1 GLU 6 5.453 18.970 3.143 38 HG2 GLU 6 HG2 GLU 6 8.119 18.267 2.444 39 HG3 GLU 6 HG1 GLU 6 7.157 18.201 0.967 40 H ARG 7 HN ARG 7 8.054 15.650 5.140 41 HA ARG 7 HA ARG 7 8.108 13.729 2.836 42 HB2 ARG 7 HB2 ARG 7 10.382 13.170 3.809 43 HB3 ARG 7 HB1 ARG 7 10.236 14.817 3.200 44 HG2 ARG 7 HG2 ARG 7 10.604 15.697 5.242 45 HG3 ARG 7 HG1 ARG 7 9.405 14.636 5.985 46 HD2 ARG 7 HD2 ARG 7 11.073 12.797 6.042 47 HD3 ARG 7 HD1 ARG 7 12.280 13.887 5.333 48 HE ARG 7 HE ARG 7 12.252 15.195 7.365 49 HH11 ARG 7 HH11 ARG 7 12.357 12.384 8.484 50 HH12 ARG 7 HH12 ARG 7 11.123 12.449 9.698 51 HH21 ARG 7 HH21 ARG 7 9.677 15.343 8.447 52 HH22 ARG 7 HH22 ARG 7 9.602 14.124 9.675 53 H ARG 8 HN ARG 8 6.425 13.977 5.497 54 HA ARG 8 HA ARG 8 7.179 11.567 6.984 55 HB2 ARG 8 HB2 ARG 8 5.925 13.844 7.608 56 HB3 ARG 8 HB1 ARG 8 4.504 12.884 7.199 57 HG2 ARG 8 HG2 ARG 8 4.655 12.218 9.378 58 HG3 ARG 8 HG1 ARG 8 5.858 11.099 8.737 59 HD2 ARG 8 HD2 ARG 8 7.626 12.273 9.646 60 HD3 ARG 8 HD1 ARG 8 6.811 13.839 9.460 61 HE ARG 8 HE ARG 8 5.393 13.238 11.406 62 HH11 ARG 8 HH11 ARG 8 6.122 10.240 11.152 63 HH12 ARG 8 HH12 ARG 8 7.109 10.043 12.561 64 HH21 ARG 8 HH21 ARG 8 7.555 13.447 13.053 65 HH22 ARG 8 HH22 ARG 8 7.920 11.858 13.639 66 H LEU 9 HN LEU 9 5.280 12.179 4.156 67 HA LEU 9 HA LEU 9 3.338 10.074 4.451 68 HB2 LEU 9 HB2 LEU 9 4.495 11.631 2.135 69 HB3 LEU 9 HB1 LEU 9 3.207 10.444 1.918 70 HG LEU 9 HG LEU 9 2.735 12.335 4.125 71 HD11 LEU 9 HD11 LEU 9 3.266 13.261 1.333 72 HD12 LEU 9 HD12 LEU 9 3.561 14.087 2.862 73 HD13 LEU 9 HD13 LEU 9 1.926 13.999 2.209 74 HD21 LEU 9 HD21 LEU 9 0.498 12.375 3.067 75 HD22 LEU 9 HD22 LEU 9 1.063 10.721 3.301 76 HD23 LEU 9 HD23 LEU 9 1.133 11.459 1.701 77 H ARG 10 HN ARG 10 3.474 7.892 3.883 78 HA ARG 10 HA ARG 10 5.933 6.939 2.477 79 HB2 ARG 10 HB2 ARG 10 5.000 5.324 4.785 80 HB3 ARG 10 HB1 ARG 10 6.638 5.700 4.271 81 HG2 ARG 10 HG2 ARG 10 6.401 6.827 6.345 82 HG3 ARG 10 HG1 ARG 10 6.174 8.091 5.135 83 HD2 ARG 10 HD2 ARG 10 3.978 8.397 5.703 84 HD3 ARG 10 HD1 ARG 10 3.696 6.659 5.898 85 HE ARG 10 HE ARG 10 5.339 7.192 8.015 86 HH11 ARG 10 HH21 ARG 10 4.376 10.051 7.774 87 HH12 ARG 10 HH22 ARG 10 3.026 10.054 8.857 88 HH21 ARG 10 HH11 ARG 10 2.790 6.599 8.998 89 HH22 ARG 10 HH12 ARG 10 2.133 8.103 9.557 90 H VAL 11 HN VAL 11 5.312 5.497 0.878 91 HA VAL 11 HA VAL 11 2.747 3.995 1.300 92 HB VAL 11 HB VAL 11 2.513 5.915 -0.249 93 HG11 VAL 11 HG11 VAL 11 3.943 6.314 -1.999 94 HG12 VAL 11 HG12 VAL 11 4.246 4.600 -2.278 95 HG13 VAL 11 HG13 VAL 11 5.070 5.438 -0.965 96 HG21 VAL 11 HG21 VAL 11 1.413 4.723 -1.990 97 HG22 VAL 11 HG22 VAL 11 1.340 3.653 -0.590 98 HG23 VAL 11 HG23 VAL 11 2.525 3.362 -1.862 99 H LEU 12 HN LEU 12 3.647 1.960 1.747 100 HA LEU 12 HA LEU 12 5.792 0.923 -0.044 101 HB2 LEU 12 HB2 LEU 12 4.548 -0.433 2.357 102 HB3 LEU 12 HB1 LEU 12 6.168 -0.652 1.701 103 HG LEU 12 HG LEU 12 5.841 2.112 2.377 104 HD11 LEU 12 HD11 LEU 12 5.736 1.059 4.973 105 HD12 LEU 12 HD12 LEU 12 4.381 0.346 4.098 106 HD13 LEU 12 HD13 LEU 12 4.555 2.095 4.178 107 HD21 LEU 12 HD21 LEU 12 7.420 0.086 3.949 108 HD22 LEU 12 HD22 LEU 12 7.850 1.749 3.552 109 HD23 LEU 12 HD23 LEU 12 7.894 0.506 2.302 110 H VAL 13 HN VAL 13 4.653 0.293 -1.960 111 HA VAL 13 HA VAL 13 2.413 -1.673 -1.565 112 HB VAL 13 HB VAL 13 3.109 -0.021 -4.016 113 HG11 VAL 13 HG11 VAL 13 1.247 -0.920 -4.948 114 HG12 VAL 13 HG12 VAL 13 0.320 -0.752 -3.457 115 HG13 VAL 13 HG13 VAL 13 1.374 -2.147 -3.688 116 HG21 VAL 13 HG21 VAL 13 1.360 0.626 -1.632 117 HG22 VAL 13 HG22 VAL 13 1.175 1.435 -3.188 118 HG23 VAL 13 HG23 VAL 13 2.687 1.580 -2.292 119 H VAL 14 HN VAL 14 2.722 -3.732 -2.503 120 HA VAL 14 HA VAL 14 5.050 -4.045 -4.316 121 HB VAL 14 HB VAL 14 5.955 -5.765 -2.799 122 HG11 VAL 14 HG11 VAL 14 6.990 -4.253 -1.320 123 HG12 VAL 14 HG12 VAL 14 5.554 -3.231 -1.240 124 HG13 VAL 14 HG13 VAL 14 6.535 -3.261 -2.705 125 HG21 VAL 14 HG21 VAL 14 4.745 -5.159 -0.364 126 HG22 VAL 14 HG22 VAL 14 4.538 -6.646 -1.290 127 HG23 VAL 14 HG23 VAL 14 3.406 -5.312 -1.499 128 H GLU 15 HN GLU 15 5.142 -6.041 -5.365 129 HA GLU 15 HA GLU 15 3.175 -8.142 -5.026 130 HB2 GLU 15 HB2 GLU 15 1.918 -7.729 -7.057 131 HB3 GLU 15 HB1 GLU 15 1.883 -6.256 -6.088 132 HG2 GLU 15 HG2 GLU 15 3.045 -5.080 -7.628 133 HG3 GLU 15 HG1 GLU 15 4.174 -6.401 -7.925 134 H ASP 16 HN ASP 16 3.624 -9.896 -6.572 135 HA ASP 16 HA ASP 16 6.383 -10.323 -7.052 136 HB2 ASP 16 HB2 ASP 16 5.481 -12.269 -8.345 137 HB3 ASP 16 HB1 ASP 16 4.769 -12.074 -6.741 138 H GLU 17 HN GLU 17 4.647 -8.083 -8.823 139 HA GLU 17 HA GLU 17 6.235 -8.739 -11.275 140 HB2 GLU 17 HB2 GLU 17 3.425 -7.680 -10.935 141 HB3 GLU 17 HB1 GLU 17 4.263 -7.703 -12.485 142 HG2 GLU 17 HG2 GLU 17 4.132 -9.989 -12.672 143 HG3 GLU 17 HG1 GLU 17 4.242 -10.241 -10.928 144 H SER 18 HN SER 18 6.734 -6.823 -12.627 145 HA SER 18 HA SER 18 7.604 -4.550 -10.978 146 HB2 SER 18 HB2 SER 18 7.811 -4.750 -13.971 147 HB3 SER 18 HB1 SER 18 8.973 -4.090 -12.824 148 HG SER 18 HG SER 18 8.509 -6.707 -13.623 149 H MET 19 HN MET 19 4.741 -5.324 -12.551 150 HA MET 19 HA MET 19 4.011 -2.923 -13.904 151 HB2 MET 19 HB2 MET 19 2.887 -5.396 -13.134 152 HB3 MET 19 HB1 MET 19 1.823 -4.164 -12.456 153 HG2 MET 19 HG2 MET 19 1.702 -3.072 -14.686 154 HG3 MET 19 HG1 MET 19 2.705 -4.363 -15.350 155 HE1 MET 19 HE1 MET 19 -0.268 -2.898 -15.153 156 HE2 MET 19 HE2 MET 19 -1.586 -4.060 -15.289 157 HE3 MET 19 HE3 MET 19 -0.444 -3.873 -16.617 158 H ILE 20 HN ILE 20 4.581 -3.522 -10.584 159 HA ILE 20 HA ILE 20 2.959 -1.178 -9.690 160 HB ILE 20 HB ILE 20 2.703 -3.307 -8.521 161 HG12 ILE 20 HG12 ILE 20 4.354 -1.324 -6.927 162 HG13 ILE 20 HG11 ILE 20 2.606 -1.243 -7.174 163 HG21 ILE 20 HG21 ILE 20 5.697 -3.176 -8.492 164 HG22 ILE 20 HG22 ILE 20 4.646 -4.537 -8.880 165 HG23 ILE 20 HG23 ILE 20 4.860 -4.041 -7.202 166 HD11 ILE 20 HD11 ILE 20 4.078 -2.744 -5.205 167 HD12 ILE 20 HD12 ILE 20 3.156 -3.850 -6.221 168 HD13 ILE 20 HD13 ILE 20 2.333 -2.546 -5.365 169 H ALA 21 HN ALA 21 6.109 -2.011 -10.604 170 HA ALA 21 HA ALA 21 7.631 -0.487 -8.696 171 HB1 ALA 21 HB1 ALA 21 8.279 -2.395 -10.274 172 HB2 ALA 21 HB2 ALA 21 9.425 -1.060 -10.158 173 HB3 ALA 21 HB3 ALA 21 8.349 -1.181 -11.548 174 H MET 22 HN MET 22 7.514 0.300 -12.201 175 HA MET 22 HA MET 22 7.912 3.116 -11.600 176 HB2 MET 22 HB2 MET 22 8.846 2.127 -13.612 177 HB3 MET 22 HB1 MET 22 7.263 1.532 -14.109 178 HG2 MET 22 HG2 MET 22 6.594 4.076 -14.024 179 HG3 MET 22 HG1 MET 22 8.332 4.337 -14.170 180 HE1 MET 22 HE1 MET 22 5.485 4.513 -16.875 181 HE2 MET 22 HE2 MET 22 5.188 3.679 -15.351 182 HE3 MET 22 HE3 MET 22 5.203 2.766 -16.858 183 H LEU 23 HN LEU 23 5.200 1.079 -11.748 184 HA LEU 23 HA LEU 23 3.212 2.975 -12.641 185 HB2 LEU 23 HB2 LEU 23 2.716 0.647 -12.710 186 HB3 LEU 23 HB1 LEU 23 3.291 0.393 -11.066 187 HG LEU 23 HG LEU 23 0.748 0.386 -11.436 188 HD11 LEU 23 HD11 LEU 23 0.877 2.356 -9.399 189 HD12 LEU 23 HD12 LEU 23 2.383 1.442 -9.326 190 HD13 LEU 23 HD13 LEU 23 0.837 0.603 -9.208 191 HD21 LEU 23 HD21 LEU 23 1.377 2.934 -12.543 192 HD22 LEU 23 HD22 LEU 23 0.445 3.218 -11.074 193 HD23 LEU 23 HD23 LEU 23 -0.212 2.200 -12.353 194 H ILE 24 HN ILE 24 5.203 2.900 -9.925 195 HA ILE 24 HA ILE 24 3.232 4.380 -8.243 196 HB ILE 24 HB ILE 24 4.577 2.138 -7.667 197 HG12 ILE 24 HG12 ILE 24 4.603 4.053 -5.403 198 HG13 ILE 24 HG11 ILE 24 3.071 3.930 -6.265 199 HG21 ILE 24 HG21 ILE 24 6.526 2.757 -6.191 200 HG22 ILE 24 HG22 ILE 24 6.480 4.359 -6.916 201 HG23 ILE 24 HG23 ILE 24 6.818 2.954 -7.914 202 HD11 ILE 24 HD11 ILE 24 4.521 1.414 -5.501 203 HD12 ILE 24 HD12 ILE 24 2.792 1.677 -5.724 204 HD13 ILE 24 HD13 ILE 24 3.595 2.278 -4.273 205 H GLU 25 HN GLU 25 6.723 4.354 -9.112 206 HA GLU 25 HA GLU 25 7.537 6.740 -7.956 207 HB2 GLU 25 HB2 GLU 25 8.169 5.386 -10.571 208 HB3 GLU 25 HB1 GLU 25 9.001 6.871 -10.101 209 HG2 GLU 25 HG2 GLU 25 9.289 5.553 -7.794 210 HG3 GLU 25 HG1 GLU 25 9.135 4.153 -8.862 211 H ASP 26 HN ASP 26 5.253 6.367 -10.571 212 HA ASP 26 HA ASP 26 5.474 9.192 -11.356 213 HB2 ASP 26 HB2 ASP 26 4.102 8.535 -13.163 214 HB3 ASP 26 HB1 ASP 26 4.983 7.050 -12.798 215 H THR 27 HN THR 27 3.560 7.231 -9.218 216 HA THR 27 HA THR 27 1.546 9.379 -8.890 217 HB THR 27 HB THR 27 0.619 7.573 -7.282 218 HG1 THR 27 HG1 THR 27 2.082 6.105 -6.933 219 HG21 THR 27 HG21 THR 27 -0.686 7.229 -9.077 220 HG22 THR 27 HG22 THR 27 0.501 6.071 -9.677 221 HG23 THR 27 HG23 THR 27 0.603 7.766 -10.154 222 H LEU 28 HN LEU 28 4.202 7.703 -7.466 223 HA LEU 28 HA LEU 28 4.173 8.805 -4.821 224 HB2 LEU 28 HB2 LEU 28 6.312 7.743 -6.699 225 HB3 LEU 28 HB1 LEU 28 6.579 8.049 -5.003 226 HG LEU 28 HG LEU 28 4.925 5.922 -6.275 227 HD11 LEU 28 HD11 LEU 28 6.040 4.621 -4.438 228 HD12 LEU 28 HD12 LEU 28 6.895 6.095 -3.993 229 HD13 LEU 28 HD13 LEU 28 7.166 5.365 -5.570 230 HD21 LEU 28 HD21 LEU 28 3.964 5.539 -3.935 231 HD22 LEU 28 HD22 LEU 28 3.280 6.890 -4.840 232 HD23 LEU 28 HD23 LEU 28 4.467 7.189 -3.571 233 H CYS 29 HN CYS 29 5.307 9.866 -7.965 234 HA CYS 29 HA CYS 29 7.103 11.923 -7.370 235 HB2 CYS 29 HB2 CYS 29 5.179 11.198 -9.483 236 HB3 CYS 29 HB1 CYS 29 5.597 12.912 -9.445 237 HG CYS 29 HG CYS 29 7.846 12.363 -10.320 238 H GLU 30 HN GLU 30 3.569 12.280 -7.793 239 HA GLU 30 HA GLU 30 3.325 14.968 -6.968 240 HB2 GLU 30 HB2 GLU 30 1.401 14.112 -7.913 241 HB3 GLU 30 HB1 GLU 30 1.629 12.527 -7.181 242 HG2 GLU 30 HG2 GLU 30 -0.349 13.730 -6.254 243 HG3 GLU 30 HG1 GLU 30 0.861 13.374 -5.020 244 H LEU 31 HN LEU 31 2.970 11.987 -4.993 245 HA LEU 31 HA LEU 31 2.703 13.455 -2.496 246 HB2 LEU 31 HB2 LEU 31 2.970 10.635 -3.435 247 HB3 LEU 31 HB1 LEU 31 3.351 10.959 -1.741 248 HG LEU 31 HG LEU 31 0.846 12.130 -2.892 249 HD11 LEU 31 HD11 LEU 31 0.416 9.542 -1.621 250 HD12 LEU 31 HD12 LEU 31 1.374 9.392 -3.094 251 HD13 LEU 31 HD13 LEU 31 -0.216 10.153 -3.150 252 HD21 LEU 31 HD21 LEU 31 1.369 10.864 -0.193 253 HD22 LEU 31 HD22 LEU 31 0.121 12.036 -0.622 254 HD23 LEU 31 HD23 LEU 31 1.811 12.536 -0.540 255 H GLY 32 HN GLY 32 5.397 12.777 -4.471 256 HA2 GLY 32 HA2 GLY 32 7.721 12.736 -4.039 257 HA3 GLY 32 HA1 GLY 32 7.323 14.035 -2.907 258 H HIS 33 HN HIS 33 6.130 10.741 -2.678 259 HA HIS 33 HA HIS 33 6.411 10.276 0.006 260 HB2 HIS 33 HB2 HIS 33 6.583 8.662 -2.479 261 HB3 HIS 33 HB1 HIS 33 7.144 7.864 -1.001 262 HD1 HIS 33 HD1 HIS 33 4.097 8.833 -2.799 263 HD2 HIS 33 HD2 HIS 33 5.097 7.882 1.129 264 HE1 HIS 33 HE1 HIS 33 1.924 8.297 -1.618 265 H GLU 34 HN GLU 34 8.076 9.415 1.386 266 HA GLU 34 HA GLU 34 10.781 10.336 0.710 267 HB2 GLU 34 HB2 GLU 34 9.190 9.774 3.015 268 HB3 GLU 34 HB1 GLU 34 10.645 8.781 3.113 269 HG2 GLU 34 HG2 GLU 34 10.600 11.768 2.602 270 HG3 GLU 34 HG1 GLU 34 11.005 11.004 4.141 271 H VAL 35 HN VAL 35 9.116 7.228 1.147 272 HA VAL 35 HA VAL 35 11.128 5.855 -0.477 273 HB VAL 35 HB VAL 35 12.297 6.032 1.654 274 HG11 VAL 35 HG11 VAL 35 11.180 6.071 3.608 275 HG12 VAL 35 HG12 VAL 35 10.559 4.445 3.323 276 HG13 VAL 35 HG13 VAL 35 9.677 5.846 2.713 277 HG21 VAL 35 HG21 VAL 35 11.449 3.273 2.073 278 HG22 VAL 35 HG22 VAL 35 13.007 3.891 1.526 279 HG23 VAL 35 HG23 VAL 35 11.707 3.625 0.365 280 H ALA 36 HN ALA 36 9.306 5.100 -1.711 281 HA ALA 36 HA ALA 36 7.123 3.705 -0.320 282 HB1 ALA 36 HB1 ALA 36 6.065 3.792 -2.450 283 HB2 ALA 36 HB2 ALA 36 7.607 3.963 -3.288 284 HB3 ALA 36 HB3 ALA 36 6.971 5.299 -2.327 285 H ALA 37 HN ALA 37 6.517 1.644 -2.052 286 HA ALA 37 HA ALA 37 8.985 -0.052 -2.105 287 HB1 ALA 37 HB1 ALA 37 7.363 -0.301 -0.095 288 HB2 ALA 37 HB2 ALA 37 7.865 -1.768 -0.936 289 HB3 ALA 37 HB3 ALA 37 6.278 -1.068 -1.254 290 H THR 38 HN THR 38 9.048 -1.562 -3.769 291 HA THR 38 HA THR 38 6.795 -1.634 -5.716 292 HB THR 38 HB THR 38 9.704 -0.962 -5.978 293 HG1 THR 38 HG1 THR 38 8.891 0.703 -7.031 294 HG21 THR 38 HG21 THR 38 9.434 -2.975 -7.390 295 HG22 THR 38 HG22 THR 38 9.685 -1.531 -8.372 296 HG23 THR 38 HG23 THR 38 8.068 -2.215 -8.205 297 H ALA 39 HN ALA 39 6.696 -3.606 -6.933 298 HA ALA 39 HA ALA 39 6.695 -5.947 -7.099 299 HB1 ALA 39 HB1 ALA 39 8.774 -5.854 -8.105 300 HB2 ALA 39 HB2 ALA 39 9.162 -6.828 -6.686 301 HB3 ALA 39 HB3 ALA 39 9.532 -5.103 -6.701 302 H SER 40 HN SER 40 6.966 -7.973 -5.791 303 HA SER 40 HA SER 40 6.347 -7.447 -2.982 304 HB2 SER 40 HB2 SER 40 5.851 -9.808 -2.964 305 HB3 SER 40 HB1 SER 40 5.242 -9.132 -4.468 306 HG SER 40 HG SER 40 7.001 -11.093 -4.128 307 H ARG 41 HN ARG 41 7.695 -7.786 -1.229 308 HA ARG 41 HA ARG 41 10.237 -9.226 -1.561 309 HB2 ARG 41 HB2 ARG 41 10.224 -6.635 -2.229 310 HB3 ARG 41 HB1 ARG 41 10.394 -6.446 -0.484 311 HG2 ARG 41 HG2 ARG 41 12.626 -6.615 -1.084 312 HG3 ARG 41 HG1 ARG 41 12.250 -8.310 -0.779 313 HD2 ARG 41 HD2 ARG 41 11.738 -8.568 -3.243 314 HD3 ARG 41 HD1 ARG 41 12.368 -6.924 -3.478 315 HE ARG 41 HE ARG 41 14.285 -8.292 -1.933 316 HH11 ARG 41 HH11 ARG 41 12.649 -9.260 -4.760 317 HH12 ARG 41 HH12 ARG 41 14.088 -9.661 -5.637 318 HH21 ARG 41 HH21 ARG 41 16.229 -8.476 -3.182 319 HH22 ARG 41 HH22 ARG 41 16.115 -9.214 -4.744 320 H MET 42 HN MET 42 10.380 -10.442 0.287 321 HA MET 42 HA MET 42 8.757 -10.146 2.583 322 HB2 MET 42 HB2 MET 42 11.492 -11.395 2.181 323 HB3 MET 42 HB1 MET 42 10.453 -11.702 3.575 324 HG2 MET 42 HG2 MET 42 8.706 -12.125 1.513 325 HG3 MET 42 HG1 MET 42 10.216 -12.688 0.799 326 HE1 MET 42 HE1 MET 42 11.316 -15.670 2.551 327 HE2 MET 42 HE2 MET 42 11.940 -14.121 3.111 328 HE3 MET 42 HE3 MET 42 11.576 -14.351 1.402 329 H GLN 43 HN GLN 43 12.027 -8.874 1.929 330 HA GLN 43 HA GLN 43 12.518 -7.820 4.555 331 HB2 GLN 43 HB2 GLN 43 13.976 -8.175 2.344 332 HB3 GLN 43 HB1 GLN 43 13.539 -6.489 2.072 333 HG2 GLN 43 HG2 GLN 43 15.342 -6.041 3.385 334 HG3 GLN 43 HG1 GLN 43 14.248 -6.429 4.713 335 HE21 GLN 43 HE21 GLN 43 17.232 -7.278 3.325 336 HE22 GLN 43 HE22 GLN 43 17.428 -8.789 4.073 337 H GLU 44 HN GLU 44 11.520 -6.122 1.560 338 HA GLU 44 HA GLU 44 10.902 -3.623 2.743 339 HB2 GLU 44 HB2 GLU 44 9.577 -5.019 0.396 340 HB3 GLU 44 HB1 GLU 44 9.648 -3.278 0.666 341 HG2 GLU 44 HG2 GLU 44 12.275 -3.811 0.790 342 HG3 GLU 44 HG1 GLU 44 11.780 -5.138 -0.262 343 H ALA 45 HN ALA 45 8.767 -6.412 2.052 344 HA ALA 45 HA ALA 45 6.297 -5.473 2.909 345 HB1 ALA 45 HB1 ALA 45 5.888 -7.842 3.547 346 HB2 ALA 45 HB2 ALA 45 7.627 -8.135 3.530 347 HB3 ALA 45 HB3 ALA 45 6.787 -7.738 2.032 348 H LEU 46 HN LEU 46 9.089 -6.387 4.847 349 HA LEU 46 HA LEU 46 7.825 -6.290 7.421 350 HB2 LEU 46 HB2 LEU 46 10.032 -7.332 6.715 351 HB3 LEU 46 HB1 LEU 46 10.695 -5.698 6.662 352 HG LEU 46 HG LEU 46 9.867 -5.438 9.067 353 HD11 LEU 46 HD11 LEU 46 9.756 -7.789 10.189 354 HD12 LEU 46 HD12 LEU 46 9.383 -8.369 8.565 355 HD13 LEU 46 HD13 LEU 46 8.328 -7.191 9.345 356 HD21 LEU 46 HD21 LEU 46 12.249 -5.908 8.331 357 HD22 LEU 46 HD22 LEU 46 11.929 -7.616 8.628 358 HD23 LEU 46 HD23 LEU 46 11.859 -6.461 9.959 359 H ASP 47 HN ASP 47 9.546 -3.904 5.428 360 HA ASP 47 HA ASP 47 9.568 -1.778 7.340 361 HB2 ASP 47 HB2 ASP 47 10.210 -2.299 4.558 362 HB3 ASP 47 HB1 ASP 47 9.473 -0.708 4.738 363 H ILE 48 HN ILE 48 6.995 -3.112 5.431 364 HA ILE 48 HA ILE 48 5.423 -0.631 5.651 365 HB ILE 48 HB ILE 48 4.182 -1.420 3.890 366 HG12 ILE 48 HG12 ILE 48 4.625 -4.203 4.987 367 HG13 ILE 48 HG11 ILE 48 3.122 -3.283 4.965 368 HG21 ILE 48 HG21 ILE 48 5.583 -2.345 2.286 369 HG22 ILE 48 HG22 ILE 48 6.410 -3.372 3.456 370 HG23 ILE 48 HG23 ILE 48 6.721 -1.636 3.430 371 HD11 ILE 48 HD11 ILE 48 4.508 -4.700 2.726 372 HD12 ILE 48 HD12 ILE 48 3.631 -3.219 2.341 373 HD13 ILE 48 HD13 ILE 48 2.784 -4.580 3.079 374 H ALA 49 HN ALA 49 5.596 -3.859 7.059 375 HA ALA 49 HA ALA 49 2.981 -3.448 8.350 376 HB1 ALA 49 HB1 ALA 49 3.068 -5.761 8.763 377 HB2 ALA 49 HB2 ALA 49 4.832 -5.785 8.754 378 HB3 ALA 49 HB3 ALA 49 3.944 -5.594 7.241 379 H ARG 50 HN ARG 50 6.154 -4.553 9.593 380 HA ARG 50 HA ARG 50 5.638 -4.175 12.324 381 HB2 ARG 50 HB2 ARG 50 7.977 -4.409 10.526 382 HB3 ARG 50 HB1 ARG 50 8.316 -3.741 12.126 383 HG2 ARG 50 HG2 ARG 50 8.540 -6.088 12.405 384 HG3 ARG 50 HG1 ARG 50 6.939 -5.717 13.048 385 HD2 ARG 50 HD2 ARG 50 6.850 -6.235 10.171 386 HD3 ARG 50 HD1 ARG 50 7.485 -7.619 11.083 387 HE ARG 50 HE ARG 50 4.864 -6.292 11.660 388 HH11 ARG 50 HH21 ARG 50 6.045 -9.170 10.602 389 HH12 ARG 50 HH22 ARG 50 5.360 -10.152 11.854 390 HH21 ARG 50 HH11 ARG 50 4.399 -7.462 13.813 391 HH22 ARG 50 HH12 ARG 50 4.432 -9.188 13.669 392 H LYS 51 HN LYS 51 5.846 -1.638 10.036 393 HA LYS 51 HA LYS 51 7.134 0.327 11.725 394 HB2 LYS 51 HB2 LYS 51 5.396 0.460 9.255 395 HB3 LYS 51 HB1 LYS 51 6.214 1.864 9.942 396 HG2 LYS 51 HG2 LYS 51 7.433 -0.617 8.745 397 HG3 LYS 51 HG1 LYS 51 7.654 1.059 8.244 398 HD2 LYS 51 HD2 LYS 51 8.643 -0.194 10.827 399 HD3 LYS 51 HD1 LYS 51 9.635 0.335 9.469 400 HE2 LYS 51 HE2 LYS 51 7.986 2.545 10.199 401 HE3 LYS 51 HE1 LYS 51 8.722 1.911 11.685 402 HZ1 LYS 51 HZ1 LYS 51 10.863 1.971 10.696 403 HZ2 LYS 51 HZ2 LYS 51 10.160 3.490 10.409 404 HZ3 LYS 51 HZ3 LYS 51 10.230 2.337 9.165 405 H GLY 52 HN GLY 52 3.718 -0.307 10.849 406 HA2 GLY 52 HA2 GLY 52 1.749 0.302 11.988 407 HA3 GLY 52 HA1 GLY 52 2.749 0.581 13.417 408 H GLN 53 HN GLN 53 3.961 2.257 10.762 409 HA GLN 53 HA GLN 53 2.308 4.675 11.015 410 HB2 GLN 53 HB2 GLN 53 4.141 5.995 11.984 411 HB3 GLN 53 HB1 GLN 53 3.794 4.623 13.039 412 HG2 GLN 53 HG2 GLN 53 5.658 3.633 11.202 413 HG3 GLN 53 HG1 GLN 53 6.238 5.254 11.588 414 HE21 GLN 53 HE21 GLN 53 5.055 5.231 14.324 415 HE22 GLN 53 HE22 GLN 53 6.023 4.181 15.242 416 H PHE 54 HN PHE 54 2.751 3.206 8.753 417 HA PHE 54 HA PHE 54 4.841 4.746 7.251 418 HB2 PHE 54 HB2 PHE 54 4.974 2.675 5.856 419 HB3 PHE 54 HB1 PHE 54 5.397 2.384 7.540 420 HD1 PHE 54 HD1 PHE 54 3.810 1.283 9.064 421 HD2 PHE 54 HD2 PHE 54 2.943 1.745 4.893 422 HE1 PHE 54 HE1 PHE 54 1.980 -0.360 9.272 423 HE2 PHE 54 HE2 PHE 54 1.108 0.107 5.103 424 HZ PHE 54 HZ PHE 54 0.618 -0.953 7.283 425 H ASP 55 HN ASP 55 1.845 5.146 7.745 426 HA ASP 55 HA ASP 55 0.050 6.005 6.529 427 HB2 ASP 55 HB2 ASP 55 1.508 7.483 5.505 428 HB3 ASP 55 HB1 ASP 55 2.403 6.207 4.698 429 H ILE 56 HN ILE 56 1.742 3.680 4.238 430 HA ILE 56 HA ILE 56 -0.791 2.132 4.154 431 HB ILE 56 HB ILE 56 0.341 3.629 1.774 432 HG12 ILE 56 HG12 ILE 56 -2.189 3.913 3.417 433 HG13 ILE 56 HG11 ILE 56 -0.936 5.119 3.160 434 HG21 ILE 56 HG21 ILE 56 -0.455 1.633 0.866 435 HG22 ILE 56 HG22 ILE 56 -1.860 2.682 0.744 436 HG23 ILE 56 HG23 ILE 56 -1.758 1.492 2.041 437 HD11 ILE 56 HD11 ILE 56 -3.283 4.719 1.618 438 HD12 ILE 56 HD12 ILE 56 -1.921 4.240 0.605 439 HD13 ILE 56 HD13 ILE 56 -1.973 5.857 1.306 440 H ALA 57 HN ALA 57 -0.605 0.008 3.109 441 HA ALA 57 HA ALA 57 2.099 -0.760 2.094 442 HB1 ALA 57 HB1 ALA 57 1.851 -2.785 3.730 443 HB2 ALA 57 HB2 ALA 57 0.732 -1.731 4.592 444 HB3 ALA 57 HB3 ALA 57 2.412 -1.244 4.378 445 H ILE 58 HN ILE 58 1.733 -2.079 0.265 446 HA ILE 58 HA ILE 58 -0.818 -3.664 0.275 447 HB ILE 58 HB ILE 58 0.492 -2.057 -1.921 448 HG12 ILE 58 HG12 ILE 58 -1.836 -0.990 -1.873 449 HG13 ILE 58 HG11 ILE 58 -2.080 -1.838 -0.346 450 HG21 ILE 58 HG21 ILE 58 -2.023 -3.737 -2.072 451 HG22 ILE 58 HG22 ILE 58 -0.458 -4.267 -2.689 452 HG23 ILE 58 HG23 ILE 58 -1.254 -2.858 -3.393 453 HD11 ILE 58 HD11 ILE 58 -0.821 0.638 -0.698 454 HD12 ILE 58 HD12 ILE 58 0.494 -0.495 -0.396 455 HD13 ILE 58 HD13 ILE 58 -0.823 -0.338 0.769 456 H ILE 59 HN ILE 59 0.149 -5.684 0.725 457 HA ILE 59 HA ILE 59 2.216 -6.718 -1.191 458 HB ILE 59 HB ILE 59 1.080 -7.685 1.472 459 HG12 ILE 59 HG12 ILE 59 3.952 -7.014 0.956 460 HG13 ILE 59 HG11 ILE 59 2.806 -5.689 1.146 461 HG21 ILE 59 HG21 ILE 59 2.607 -9.524 1.370 462 HG22 ILE 59 HG22 ILE 59 3.374 -8.889 -0.085 463 HG23 ILE 59 HG23 ILE 59 1.729 -9.521 -0.159 464 HD11 ILE 59 HD11 ILE 59 3.830 -6.327 3.314 465 HD12 ILE 59 HD12 ILE 59 3.188 -7.951 3.125 466 HD13 ILE 59 HD13 ILE 59 2.087 -6.588 3.315 467 H ASP 60 HN ASP 60 0.267 -6.519 -2.747 468 HA ASP 60 HA ASP 60 -1.898 -8.480 -2.372 469 HB2 ASP 60 HB2 ASP 60 -2.968 -7.183 -3.945 470 HB3 ASP 60 HB1 ASP 60 -1.802 -6.004 -3.354 471 H VAL 61 HN VAL 61 -2.113 -10.348 -3.343 472 HA VAL 61 HA VAL 61 -1.804 -11.453 -5.670 473 HB VAL 61 HB VAL 61 0.332 -10.432 -6.098 474 HG11 VAL 61 HG11 VAL 61 2.035 -10.338 -4.576 475 HG12 VAL 61 HG12 VAL 61 1.871 -12.047 -4.173 476 HG13 VAL 61 HG13 VAL 61 0.821 -10.856 -3.406 477 HG21 VAL 61 HG21 VAL 61 1.606 -12.380 -6.775 478 HG22 VAL 61 HG22 VAL 61 -0.108 -12.734 -6.979 479 HG23 VAL 61 HG23 VAL 61 0.768 -13.386 -5.596 480 H ASN 62 HN ASN 62 -3.147 -12.573 -4.079 481 HA ASN 62 HA ASN 62 -1.834 -14.553 -2.336 482 HB2 ASN 62 HB2 ASN 62 -4.143 -14.962 -1.649 483 HB3 ASN 62 HB1 ASN 62 -3.853 -13.224 -1.719 484 HD21 ASN 62 HD21 ASN 62 -3.933 -13.875 -4.940 485 HD22 ASN 62 HD22 ASN 62 -5.586 -13.768 -5.226 486 H LEU 63 HN LEU 63 -0.984 -15.212 -4.814 487 HA LEU 63 HA LEU 63 -2.607 -17.617 -5.502 488 HB2 LEU 63 HB2 LEU 63 -2.407 -15.146 -6.966 489 HB3 LEU 63 HB1 LEU 63 -1.643 -16.427 -7.905 490 HG LEU 63 HG LEU 63 -3.720 -17.830 -7.471 491 HD11 LEU 63 HD11 LEU 63 -5.576 -15.741 -7.110 492 HD12 LEU 63 HD12 LEU 63 -4.322 -15.477 -5.902 493 HD13 LEU 63 HD13 LEU 63 -5.179 -17.014 -5.956 494 HD21 LEU 63 HD21 LEU 63 -4.880 -16.870 -9.320 495 HD22 LEU 63 HD22 LEU 63 -3.191 -16.431 -9.568 496 HD23 LEU 63 HD23 LEU 63 -4.324 -15.245 -8.922 497 H ASP 64 HN ASP 64 -1.187 -18.627 -7.540 498 HA ASP 64 HA ASP 64 0.753 -19.960 -7.855 499 HB2 ASP 64 HB2 ASP 64 1.074 -17.370 -8.525 500 HB3 ASP 64 HB1 ASP 64 2.341 -17.496 -7.297 501 H GLY 65 HN GLY 65 -0.182 -19.593 -4.981 502 HA2 GLY 65 HA2 GLY 65 1.164 -21.074 -3.367 503 HA3 GLY 65 HA1 GLY 65 2.456 -19.905 -3.626 504 H GLU 66 HN GLU 66 0.032 -17.881 -3.759 505 HA GLU 66 HA GLU 66 -0.750 -16.292 -2.184 506 HB2 GLU 66 HB2 GLU 66 -2.172 -18.410 -1.953 507 HB3 GLU 66 HB1 GLU 66 -1.185 -18.805 -0.546 508 HG2 GLU 66 HG2 GLU 66 -1.787 -16.420 0.282 509 HG3 GLU 66 HG1 GLU 66 -3.073 -16.486 -0.924 510 HA PRO 67 HA PRO 67 3.153 -16.859 0.342 511 HB2 PRO 67 HB2 PRO 67 4.552 -14.774 -0.746 512 HB3 PRO 67 HB1 PRO 67 4.605 -16.421 -1.406 513 HG2 PRO 67 HG2 PRO 67 3.074 -14.053 -2.352 514 HG3 PRO 67 HG1 PRO 67 3.879 -15.322 -3.285 515 HD2 PRO 67 HD2 PRO 67 1.182 -15.232 -2.852 516 HD3 PRO 67 HD1 PRO 67 2.086 -16.730 -3.161 517 H SER 68 HN SER 68 3.152 -13.489 -0.583 518 HA SER 68 HA SER 68 2.635 -11.529 0.626 519 HB2 SER 68 HB2 SER 68 0.468 -11.547 1.415 520 HB3 SER 68 HB1 SER 68 0.436 -13.085 0.558 521 HG SER 68 HG SER 68 -0.303 -13.365 2.668 522 H TYR 69 HN TYR 69 4.232 -14.062 1.895 523 HA TYR 69 HA TYR 69 5.366 -14.547 3.876 524 HB2 TYR 69 HB2 TYR 69 5.767 -11.894 4.823 525 HB3 TYR 69 HB1 TYR 69 6.886 -12.898 3.921 526 HD1 TYR 69 HD1 TYR 69 6.932 -12.794 1.428 527 HD2 TYR 69 HD2 TYR 69 4.561 -10.091 3.772 528 HE1 TYR 69 HE1 TYR 69 6.716 -11.282 -0.523 529 HE2 TYR 69 HE2 TYR 69 4.349 -8.583 1.828 530 HH TYR 69 HH TYR 69 5.663 -8.111 -0.288 531 HA PRO 70 HA PRO 70 2.818 -14.360 7.397 532 HB2 PRO 70 HB2 PRO 70 4.631 -14.273 9.443 533 HB3 PRO 70 HB1 PRO 70 4.359 -15.725 8.460 534 HG2 PRO 70 HG2 PRO 70 6.553 -13.727 8.313 535 HG3 PRO 70 HG1 PRO 70 6.602 -15.478 8.071 536 HD2 PRO 70 HD2 PRO 70 6.604 -13.642 6.034 537 HD3 PRO 70 HD1 PRO 70 6.032 -15.317 5.868 538 H VAL 71 HN VAL 71 4.737 -11.727 6.491 539 HA VAL 71 HA VAL 71 3.979 -10.050 8.795 540 HB VAL 71 HB VAL 71 5.397 -8.386 7.739 541 HG11 VAL 71 HG11 VAL 71 6.516 -11.192 7.478 542 HG12 VAL 71 HG12 VAL 71 6.564 -10.173 8.917 543 HG13 VAL 71 HG13 VAL 71 7.491 -9.723 7.486 544 HG21 VAL 71 HG21 VAL 71 4.663 -8.654 5.427 545 HG22 VAL 71 HG22 VAL 71 5.361 -10.268 5.374 546 HG23 VAL 71 HG23 VAL 71 6.413 -8.865 5.505 547 H ALA 72 HN ALA 72 3.362 -10.100 5.241 548 HA ALA 72 HA ALA 72 1.506 -7.958 5.154 549 HB1 ALA 72 HB1 ALA 72 1.027 -10.444 3.571 550 HB2 ALA 72 HB2 ALA 72 2.603 -9.673 3.396 551 HB3 ALA 72 HB3 ALA 72 1.136 -8.772 3.019 552 H ASP 73 HN ASP 73 0.957 -11.457 5.615 553 HA ASP 73 HA ASP 73 -1.821 -11.457 5.984 554 HB2 ASP 73 HB2 ASP 73 0.518 -13.039 6.875 555 HB3 ASP 73 HB1 ASP 73 -0.999 -13.357 7.705 556 H ILE 74 HN ILE 74 0.695 -11.144 8.495 557 HA ILE 74 HA ILE 74 -1.028 -10.664 10.711 558 HB ILE 74 HB ILE 74 1.794 -9.848 9.989 559 HG12 ILE 74 HG12 ILE 74 0.590 -11.882 11.897 560 HG13 ILE 74 HG11 ILE 74 1.429 -12.233 10.387 561 HG21 ILE 74 HG21 ILE 74 1.823 -8.389 11.702 562 HG22 ILE 74 HG22 ILE 74 1.398 -9.702 12.800 563 HG23 ILE 74 HG23 ILE 74 0.129 -8.734 12.049 564 HD11 ILE 74 HD11 ILE 74 3.177 -10.588 11.877 565 HD12 ILE 74 HD12 ILE 74 3.359 -12.310 11.544 566 HD13 ILE 74 HD13 ILE 74 2.543 -11.778 13.014 567 H LEU 75 HN LEU 75 0.449 -8.453 8.372 568 HA LEU 75 HA LEU 75 -0.447 -5.998 9.493 569 HB2 LEU 75 HB2 LEU 75 1.254 -6.548 7.647 570 HB3 LEU 75 HB1 LEU 75 -0.128 -6.671 6.559 571 HG LEU 75 HG LEU 75 -0.773 -4.371 7.044 572 HD11 LEU 75 HD11 LEU 75 -0.270 -3.884 9.242 573 HD12 LEU 75 HD12 LEU 75 1.116 -3.118 8.465 574 HD13 LEU 75 HD13 LEU 75 1.282 -4.719 9.187 575 HD21 LEU 75 HD21 LEU 75 1.904 -5.111 6.052 576 HD22 LEU 75 HD22 LEU 75 1.788 -3.430 6.575 577 HD23 LEU 75 HD23 LEU 75 0.698 -4.044 5.332 578 H ALA 76 HN ALA 76 -2.115 -8.505 7.748 579 HA ALA 76 HA ALA 76 -4.411 -6.769 7.107 580 HB1 ALA 76 HB1 ALA 76 -5.059 -9.283 6.279 581 HB2 ALA 76 HB2 ALA 76 -3.297 -9.381 6.280 582 HB3 ALA 76 HB3 ALA 76 -4.111 -8.152 5.313 583 H GLU 77 HN GLU 77 -3.478 -9.215 9.454 584 HA GLU 77 HA GLU 77 -6.160 -9.976 10.189 585 HB2 GLU 77 HB2 GLU 77 -5.083 -11.271 11.822 586 HB3 GLU 77 HB1 GLU 77 -3.842 -11.114 10.583 587 HG2 GLU 77 HG2 GLU 77 -2.657 -9.473 11.828 588 HG3 GLU 77 HG1 GLU 77 -4.020 -9.179 12.903 589 H ARG 78 HN ARG 78 -3.921 -7.486 11.340 590 HA ARG 78 HA ARG 78 -5.993 -6.535 13.242 591 HB2 ARG 78 HB2 ARG 78 -4.105 -5.433 14.348 592 HB3 ARG 78 HB1 ARG 78 -3.714 -7.130 14.070 593 HG2 ARG 78 HG2 ARG 78 -2.365 -6.594 12.155 594 HG3 ARG 78 HG1 ARG 78 -2.927 -4.922 12.157 595 HD2 ARG 78 HD2 ARG 78 -1.240 -6.236 14.318 596 HD3 ARG 78 HD1 ARG 78 -0.704 -4.992 13.171 597 HE ARG 78 HE ARG 78 -2.810 -3.722 14.248 598 HH11 ARG 78 HH21 ARG 78 -0.120 -3.055 15.325 599 HH12 ARG 78 HH22 ARG 78 -0.303 -3.377 17.017 600 HH21 ARG 78 HH11 ARG 78 -3.172 -5.286 16.611 601 HH22 ARG 78 HH12 ARG 78 -2.030 -4.647 17.746 602 H ASN 79 HN ASN 79 -3.986 -5.604 10.506 603 HA ASN 79 HA ASN 79 -4.038 -3.742 9.079 604 HB2 ASN 79 HB2 ASN 79 -6.885 -3.529 10.075 605 HB3 ASN 79 HB1 ASN 79 -6.260 -3.135 8.480 606 HD21 ASN 79 HD21 ASN 79 -7.371 -5.750 10.528 607 HD22 ASN 79 HD22 ASN 79 -7.250 -6.975 9.360 608 H VAL 80 HN VAL 80 -3.085 -1.848 9.516 609 HA VAL 80 HA VAL 80 -4.034 -0.173 11.823 610 HB VAL 80 HB VAL 80 -1.732 0.445 12.080 611 HG11 VAL 80 HG11 VAL 80 -2.468 -2.259 12.029 612 HG12 VAL 80 HG12 VAL 80 -1.075 -1.557 12.852 613 HG13 VAL 80 HG13 VAL 80 -0.906 -2.190 11.214 614 HG21 VAL 80 HG21 VAL 80 -0.526 0.894 10.211 615 HG22 VAL 80 HG22 VAL 80 -1.687 0.021 9.214 616 HG23 VAL 80 HG23 VAL 80 -0.350 -0.842 9.968 617 HA PRO 81 HA PRO 81 -4.624 3.122 8.888 618 HB2 PRO 81 HB2 PRO 81 -2.588 4.959 8.872 619 HB3 PRO 81 HB1 PRO 81 -3.817 4.884 10.151 620 HG2 PRO 81 HG2 PRO 81 -1.026 3.851 10.145 621 HG3 PRO 81 HG1 PRO 81 -1.939 4.624 11.450 622 HD2 PRO 81 HD2 PRO 81 -1.534 1.954 11.302 623 HD3 PRO 81 HD1 PRO 81 -2.970 2.661 12.069 624 H PHE 82 HN PHE 82 -4.541 2.419 6.807 625 HA PHE 82 HA PHE 82 -2.216 2.599 5.134 626 HB2 PHE 82 HB2 PHE 82 -1.485 0.316 5.138 627 HB3 PHE 82 HB1 PHE 82 -1.629 0.779 6.830 628 HD1 PHE 82 HD1 PHE 82 -4.889 0.728 6.423 629 HD2 PHE 82 HD2 PHE 82 -1.673 -2.075 5.909 630 HE1 PHE 82 HE1 PHE 82 -6.463 -1.131 6.825 631 HE2 PHE 82 HE2 PHE 82 -3.264 -3.943 6.305 632 HZ PHE 82 HZ PHE 82 -5.648 -3.472 6.758 633 H ILE 83 HN ILE 83 -2.801 0.007 3.851 634 HA ILE 83 HA ILE 83 -5.519 -0.171 2.961 635 HB ILE 83 HB ILE 83 -3.693 1.737 1.746 636 HG12 ILE 83 HG12 ILE 83 -6.409 1.569 0.687 637 HG13 ILE 83 HG11 ILE 83 -6.372 1.563 2.450 638 HG21 ILE 83 HG21 ILE 83 -3.407 -0.142 0.119 639 HG22 ILE 83 HG22 ILE 83 -4.203 1.257 -0.600 640 HG23 ILE 83 HG23 ILE 83 -5.154 -0.149 -0.124 641 HD11 ILE 83 HD11 ILE 83 -5.126 3.629 0.615 642 HD12 ILE 83 HD12 ILE 83 -4.883 3.584 2.363 643 HD13 ILE 83 HD13 ILE 83 -6.495 3.861 1.702 644 H PHE 84 HN PHE 84 -5.619 -1.948 1.324 645 HA PHE 84 HA PHE 84 -3.063 -3.360 0.802 646 HB2 PHE 84 HB2 PHE 84 -4.228 -3.792 3.115 647 HB3 PHE 84 HB1 PHE 84 -5.292 -4.820 2.155 648 HD1 PHE 84 HD2 PHE 84 -4.428 -6.807 1.003 649 HD2 PHE 84 HD1 PHE 84 -1.863 -4.337 3.407 650 HE1 PHE 84 HE2 PHE 84 -2.714 -8.602 1.018 651 HE2 PHE 84 HE1 PHE 84 -0.150 -6.134 3.422 652 HZ PHE 84 HZ PHE 84 -0.577 -8.261 2.226 653 H ALA 85 HN ALA 85 -3.539 -5.458 -0.458 654 HA ALA 85 HA ALA 85 -6.088 -5.562 -1.888 655 HB1 ALA 85 HB1 ALA 85 -3.654 -4.168 -2.873 656 HB2 ALA 85 HB2 ALA 85 -5.352 -3.836 -3.214 657 HB3 ALA 85 HB3 ALA 85 -4.526 -5.148 -4.053 658 H THR 86 HN THR 86 -6.172 -7.318 -3.442 659 HA THR 86 HA THR 86 -4.158 -9.070 -4.251 660 HB THR 86 HB THR 86 -3.474 -9.546 -2.046 661 HG1 THR 86 HG1 THR 86 -5.447 -11.518 -2.449 662 HG21 THR 86 HG21 THR 86 -6.017 -8.654 -1.315 663 HG22 THR 86 HG22 THR 86 -4.778 -9.256 -0.217 664 HG23 THR 86 HG23 THR 86 -6.011 -10.351 -0.841 665 H GLY 87 HN GLY 87 -5.135 -11.409 -4.674 666 HA2 GLY 87 HA2 GLY 87 -7.485 -11.163 -6.187 667 HA3 GLY 87 HA1 GLY 87 -6.953 -12.695 -5.491 668 H TYR 88 HN TYR 88 -7.186 -12.148 -2.782 669 HA TYR 88 HA TYR 88 -9.778 -12.797 -2.073 670 HB2 TYR 88 HB2 TYR 88 -7.718 -12.640 -0.645 671 HB3 TYR 88 HB1 TYR 88 -7.914 -10.891 -0.619 672 HD1 TYR 88 HD1 TYR 88 -11.175 -12.031 -0.734 673 HD2 TYR 88 HD2 TYR 88 -7.821 -11.919 1.945 674 HE1 TYR 88 HE1 TYR 88 -12.713 -12.201 1.195 675 HE2 TYR 88 HE2 TYR 88 -9.359 -12.098 3.875 676 HH TYR 88 HH TYR 88 -11.498 -12.603 4.484 677 H GLY 89 HN GLY 89 -8.492 -9.436 -2.118 678 HA2 GLY 89 HA2 GLY 89 -9.753 -7.579 -3.062 679 HA3 GLY 89 HA1 GLY 89 -11.233 -8.511 -2.833 680 H SER 90 HN SER 90 -9.353 -8.959 -0.148 681 HA SER 90 HA SER 90 -8.993 -7.511 1.818 682 HB2 SER 90 HB2 SER 90 -10.524 -5.749 2.321 683 HB3 SER 90 HB1 SER 90 -10.228 -5.651 0.591 684 HG SER 90 HG SER 90 -12.514 -5.641 1.487 685 H LYS 91 HN LYS 91 -10.855 -7.197 3.745 686 HA LYS 91 HA LYS 91 -12.682 -9.460 3.958 687 HB2 LYS 91 HB2 LYS 91 -11.393 -10.646 5.636 688 HB3 LYS 91 HB1 LYS 91 -10.328 -10.366 4.260 689 HG2 LYS 91 HG2 LYS 91 -8.898 -9.274 5.606 690 HG3 LYS 91 HG1 LYS 91 -10.149 -8.071 5.919 691 HD2 LYS 91 HD2 LYS 91 -11.078 -9.820 7.612 692 HD3 LYS 91 HD1 LYS 91 -9.467 -10.532 7.511 693 HE2 LYS 91 HE2 LYS 91 -8.713 -8.967 8.964 694 HE3 LYS 91 HE1 LYS 91 -9.156 -7.698 7.804 695 HZ1 LYS 91 HZ1 LYS 91 -10.422 -7.376 9.800 696 HZ2 LYS 91 HZ2 LYS 91 -10.947 -8.992 9.792 697 HZ3 LYS 91 HZ3 LYS 91 -11.474 -7.918 8.585 698 H GLY 92 HN GLY 92 -12.946 -6.613 4.244 699 HA2 GLY 92 HA2 GLY 92 -14.133 -5.211 5.742 700 HA3 GLY 92 HA1 GLY 92 -14.044 -6.493 6.956 701 H LEU 93 HN LEU 93 -11.114 -5.631 5.352 702 HA LEU 93 HA LEU 93 -9.509 -5.199 7.538 703 HB2 LEU 93 HB2 LEU 93 -8.181 -4.961 5.721 704 HB3 LEU 93 HB1 LEU 93 -9.559 -4.533 4.713 705 HG LEU 93 HG LEU 93 -8.337 -2.509 6.587 706 HD11 LEU 93 HD11 LEU 93 -6.553 -3.487 5.109 707 HD12 LEU 93 HD12 LEU 93 -6.859 -1.776 4.805 708 HD13 LEU 93 HD13 LEU 93 -7.510 -2.998 3.711 709 HD21 LEU 93 HD21 LEU 93 -9.313 -1.666 3.967 710 HD22 LEU 93 HD22 LEU 93 -9.785 -1.100 5.569 711 HD23 LEU 93 HD23 LEU 93 -10.549 -2.532 4.880 712 H ASP 94 HN ASP 94 -9.202 -3.592 9.049 713 HA ASP 94 HA ASP 94 -11.086 -1.267 8.924 714 HB2 ASP 94 HB2 ASP 94 -10.764 -1.275 11.399 715 HB3 ASP 94 HB1 ASP 94 -11.366 -2.825 10.808 716 H THR 95 HN THR 95 -10.242 0.817 9.503 717 HA THR 95 HA THR 95 -7.482 1.310 10.153 718 HB THR 95 HB THR 95 -7.155 0.348 7.932 719 HG1 THR 95 HG1 THR 95 -6.357 2.286 6.861 720 HG21 THR 95 HG21 THR 95 -8.989 0.485 6.615 721 HG22 THR 95 HG22 THR 95 -8.284 2.015 6.102 722 HG23 THR 95 HG23 THR 95 -9.519 1.995 7.358 723 H ARG 96 HN ARG 96 -7.075 3.731 8.912 724 HA ARG 96 HA ARG 96 -9.348 5.340 9.959 725 HB2 ARG 96 HB2 ARG 96 -6.490 6.033 9.192 726 HB3 ARG 96 HB1 ARG 96 -7.638 7.149 9.935 727 HG2 ARG 96 HG2 ARG 96 -7.619 4.768 11.504 728 HG3 ARG 96 HG1 ARG 96 -5.941 5.235 11.226 729 HD2 ARG 96 HD2 ARG 96 -8.000 7.276 12.086 730 HD3 ARG 96 HD1 ARG 96 -7.113 6.296 13.271 731 HE ARG 96 HE ARG 96 -5.725 7.978 11.216 732 HH11 ARG 96 HH21 ARG 96 -6.472 8.287 14.374 733 HH12 ARG 96 HH22 ARG 96 -4.853 8.261 14.989 734 HH21 ARG 96 HH11 ARG 96 -3.445 7.228 11.994 735 HH22 ARG 96 HH12 ARG 96 -3.142 7.662 13.643 736 H TYR 97 HN TYR 97 -8.597 3.956 7.114 737 HA TYR 97 HA TYR 97 -8.949 6.333 5.381 738 HB2 TYR 97 HB2 TYR 97 -8.614 3.356 4.920 739 HB3 TYR 97 HB1 TYR 97 -8.810 4.514 3.607 740 HD1 TYR 97 HD1 TYR 97 -6.770 4.088 6.740 741 HD2 TYR 97 HD2 TYR 97 -6.895 5.409 2.660 742 HE1 TYR 97 HE1 TYR 97 -4.353 4.637 6.842 743 HE2 TYR 97 HE2 TYR 97 -4.484 5.962 2.762 744 HH TYR 97 HH TYR 97 -2.845 6.596 4.985 745 H SER 98 HN SER 98 -10.630 3.176 5.558 746 HA SER 98 HA SER 98 -13.223 3.810 6.172 747 HB2 SER 98 HB2 SER 98 -12.399 5.032 3.611 748 HB3 SER 98 HB1 SER 98 -13.961 4.210 3.570 749 HG SER 98 HG SER 98 -14.184 6.372 4.243 750 H ASN 99 HN ASN 99 -11.071 1.694 4.800 751 HA ASN 99 HA ASN 99 -11.314 -0.571 4.188 752 HB2 ASN 99 HB2 ASN 99 -14.273 -0.183 4.623 753 HB3 ASN 99 HB1 ASN 99 -13.305 -1.628 4.911 754 HD21 ASN 99 HD21 ASN 99 -11.143 0.166 6.164 755 HD22 ASN 99 HD22 ASN 99 -11.732 0.500 7.720 756 H ILE 100 HN ILE 100 -12.382 1.977 2.443 757 HA ILE 100 HA ILE 100 -13.814 0.418 0.377 758 HB ILE 100 HB ILE 100 -14.491 2.475 -0.488 759 HG12 ILE 100 HG12 ILE 100 -11.937 3.301 -0.415 760 HG13 ILE 100 HG11 ILE 100 -13.278 4.419 -0.596 761 HG21 ILE 100 HG21 ILE 100 -14.094 2.693 2.491 762 HG22 ILE 100 HG22 ILE 100 -15.561 2.302 1.597 763 HG23 ILE 100 HG23 ILE 100 -14.929 3.947 1.578 764 HD11 ILE 100 HD11 ILE 100 -12.960 5.327 1.462 765 HD12 ILE 100 HD12 ILE 100 -11.343 4.639 1.312 766 HD13 ILE 100 HD13 ILE 100 -12.589 3.769 2.194 767 HA PRO 101 HA PRO 101 -9.896 1.509 -2.008 768 HB2 PRO 101 HB2 PRO 101 -7.621 2.090 -0.631 769 HB3 PRO 101 HB1 PRO 101 -8.826 3.319 -1.058 770 HG2 PRO 101 HG2 PRO 101 -8.201 2.156 1.550 771 HG3 PRO 101 HG1 PRO 101 -9.030 3.666 1.156 772 HD2 PRO 101 HD2 PRO 101 -10.187 1.163 1.951 773 HD3 PRO 101 HD1 PRO 101 -11.002 2.687 1.578 774 H LEU 102 HN LEU 102 -10.565 -1.016 -1.411 775 HA LEU 102 HA LEU 102 -7.922 -2.356 -1.078 776 HB2 LEU 102 HB2 LEU 102 -9.317 -4.068 0.349 777 HB3 LEU 102 HB1 LEU 102 -8.738 -2.585 1.097 778 HG LEU 102 HG LEU 102 -10.999 -1.551 0.472 779 HD11 LEU 102 HD11 LEU 102 -12.665 -3.719 0.486 780 HD12 LEU 102 HD12 LEU 102 -11.326 -4.326 -0.488 781 HD13 LEU 102 HD13 LEU 102 -12.176 -2.859 -0.974 782 HD21 LEU 102 HD21 LEU 102 -12.044 -3.356 2.302 783 HD22 LEU 102 HD22 LEU 102 -11.120 -1.908 2.705 784 HD23 LEU 102 HD23 LEU 102 -10.305 -3.467 2.575 785 H LEU 103 HN LEU 103 -7.604 -3.905 -2.612 786 HA LEU 103 HA LEU 103 -9.547 -5.770 -3.556 787 HB2 LEU 103 HB2 LEU 103 -10.614 -4.712 -5.298 788 HB3 LEU 103 HB1 LEU 103 -10.247 -3.283 -4.351 789 HG LEU 103 HG LEU 103 -9.583 -2.758 -6.556 790 HD11 LEU 103 HD11 LEU 103 -7.699 -2.890 -4.496 791 HD12 LEU 103 HD12 LEU 103 -7.574 -1.941 -5.975 792 HD13 LEU 103 HD13 LEU 103 -6.866 -3.553 -5.902 793 HD21 LEU 103 HD21 LEU 103 -9.050 -4.338 -8.056 794 HD22 LEU 103 HD22 LEU 103 -9.272 -5.535 -6.779 795 HD23 LEU 103 HD23 LEU 103 -7.673 -4.860 -7.087 796 H THR 104 HN THR 104 -8.692 -7.046 -5.485 797 HA THR 104 HA THR 104 -5.934 -7.630 -5.284 798 HB THR 104 HB THR 104 -7.343 -9.266 -6.217 799 HG1 THR 104 HG1 THR 104 -6.330 -9.752 -8.043 800 HG21 THR 104 HG21 THR 104 -8.476 -8.464 -8.556 801 HG22 THR 104 HG22 THR 104 -8.491 -6.954 -7.648 802 HG23 THR 104 HG23 THR 104 -9.289 -8.382 -6.993 803 H LYS 105 HN LYS 105 -5.700 -7.481 -8.478 804 HA LYS 105 HA LYS 105 -4.736 -4.635 -8.566 805 HB2 LYS 105 HB2 LYS 105 -3.104 -6.677 -7.997 806 HB3 LYS 105 HB1 LYS 105 -3.058 -6.772 -9.762 807 HG2 LYS 105 HG2 LYS 105 -1.511 -5.118 -9.638 808 HG3 LYS 105 HG1 LYS 105 -2.887 -4.063 -9.309 809 HD2 LYS 105 HD2 LYS 105 -2.580 -4.227 -6.952 810 HD3 LYS 105 HD1 LYS 105 -1.464 -5.571 -7.133 811 HE2 LYS 105 HE2 LYS 105 -0.697 -3.070 -8.542 812 HE3 LYS 105 HE1 LYS 105 -0.587 -3.047 -6.770 813 HZ1 LYS 105 HZ1 LYS 105 0.839 -4.726 -8.695 814 HZ2 LYS 105 HZ2 LYS 105 0.387 -5.446 -7.226 815 HZ3 LYS 105 HZ3 LYS 105 1.378 -4.069 -7.226 816 HA PRO 106 HA PRO 106 -6.488 -6.212 -12.669 817 HB2 PRO 106 HB2 PRO 106 -9.077 -5.340 -12.500 818 HB3 PRO 106 HB1 PRO 106 -8.588 -6.974 -12.008 819 HG2 PRO 106 HG2 PRO 106 -9.158 -4.587 -10.334 820 HG3 PRO 106 HG1 PRO 106 -9.499 -6.297 -10.023 821 HD2 PRO 106 HD2 PRO 106 -7.399 -4.913 -8.914 822 HD3 PRO 106 HD1 PRO 106 -7.432 -6.672 -9.134 823 H PHE 107 HN PHE 107 -6.157 -3.502 -10.708 824 HA PHE 107 HA PHE 107 -5.850 -1.225 -11.147 825 HB2 PHE 107 HB2 PHE 107 -5.381 -2.641 -13.760 826 HB3 PHE 107 HB1 PHE 107 -5.299 -0.880 -13.690 827 HD1 PHE 107 HD1 PHE 107 -4.487 -2.284 -10.513 828 HD2 PHE 107 HD2 PHE 107 -2.827 -1.485 -14.398 829 HE1 PHE 107 HE1 PHE 107 -2.210 -2.398 -9.555 830 HE2 PHE 107 HE2 PHE 107 -0.548 -1.611 -13.435 831 HZ PHE 107 HZ PHE 107 -0.232 -2.057 -11.017 832 H LEU 108 HN LEU 108 -6.896 0.638 -12.411 833 HA LEU 108 HA LEU 108 -8.831 1.696 -13.267 834 HB2 LEU 108 HB2 LEU 108 -9.823 0.482 -14.919 835 HB3 LEU 108 HB1 LEU 108 -8.743 -0.827 -14.468 836 HG LEU 108 HG LEU 108 -10.498 -1.611 -12.832 837 HD11 LEU 108 HD11 LEU 108 -12.308 -0.345 -12.407 838 HD12 LEU 108 HD12 LEU 108 -12.714 -0.300 -14.123 839 HD13 LEU 108 HD13 LEU 108 -11.627 0.911 -13.442 840 HD21 LEU 108 HD21 LEU 108 -11.740 -1.459 -15.550 841 HD22 LEU 108 HD22 LEU 108 -11.587 -2.843 -14.466 842 HD23 LEU 108 HD23 LEU 108 -10.182 -2.265 -15.362 843 H ASP 109 HN ASP 109 -9.632 2.598 -11.401 844 HA ASP 109 HA ASP 109 -11.079 2.836 -9.532 845 HB2 ASP 109 HB2 ASP 109 -12.347 1.175 -11.239 846 HB3 ASP 109 HB1 ASP 109 -12.082 0.052 -9.905 847 H SER 110 HN SER 110 -8.488 0.882 -9.821 848 HA SER 110 HA SER 110 -8.787 -0.580 -7.256 849 HB2 SER 110 HB2 SER 110 -6.855 -0.572 -9.566 850 HB3 SER 110 HB1 SER 110 -6.487 -1.432 -8.073 851 HG SER 110 HG SER 110 -8.504 -1.882 -9.971 852 H GLU 111 HN GLU 111 -5.558 0.228 -7.959 853 HA GLU 111 HA GLU 111 -4.833 1.314 -5.553 854 HB2 GLU 111 HB2 GLU 111 -3.168 2.672 -7.043 855 HB3 GLU 111 HB1 GLU 111 -3.139 0.913 -7.111 856 HG2 GLU 111 HG2 GLU 111 -3.518 1.015 -9.322 857 HG3 GLU 111 HG1 GLU 111 -5.070 1.790 -9.015 858 H LEU 112 HN LEU 112 -5.763 3.338 -8.334 859 HA LEU 112 HA LEU 112 -5.761 5.892 -7.407 860 HB2 LEU 112 HB2 LEU 112 -8.450 5.346 -8.398 861 HB3 LEU 112 HB1 LEU 112 -7.168 6.287 -9.143 862 HG LEU 112 HG LEU 112 -7.273 3.264 -9.237 863 HD11 LEU 112 HD11 LEU 112 -8.086 3.653 -11.594 864 HD12 LEU 112 HD12 LEU 112 -8.316 5.352 -11.176 865 HD13 LEU 112 HD13 LEU 112 -9.252 4.106 -10.351 866 HD21 LEU 112 HD21 LEU 112 -5.439 3.412 -10.626 867 HD22 LEU 112 HD22 LEU 112 -5.166 4.896 -9.712 868 HD23 LEU 112 HD23 LEU 112 -5.940 4.965 -11.294 869 H GLU 113 HN GLU 113 -8.544 3.728 -6.751 870 HA GLU 113 HA GLU 113 -10.048 5.269 -5.012 871 HB2 GLU 113 HB2 GLU 113 -10.054 2.704 -5.816 872 HB3 GLU 113 HB1 GLU 113 -9.392 2.463 -4.196 873 HG2 GLU 113 HG2 GLU 113 -11.773 2.289 -3.992 874 HG3 GLU 113 HG1 GLU 113 -11.326 3.858 -3.323 875 H ALA 114 HN ALA 114 -7.217 3.288 -4.151 876 HA ALA 114 HA ALA 114 -7.077 3.848 -1.388 877 HB1 ALA 114 HB1 ALA 114 -5.730 2.241 -2.822 878 HB2 ALA 114 HB2 ALA 114 -4.775 3.138 -1.641 879 HB3 ALA 114 HB3 ALA 114 -4.764 3.623 -3.338 880 H VAL 115 HN VAL 115 -6.228 5.850 -4.139 881 HA VAL 115 HA VAL 115 -5.073 7.907 -2.304 882 HB VAL 115 HB VAL 115 -5.101 7.784 -5.332 883 HG11 VAL 115 HG11 VAL 115 -2.975 9.158 -4.923 884 HG12 VAL 115 HG12 VAL 115 -3.536 9.327 -3.259 885 HG13 VAL 115 HG13 VAL 115 -4.508 9.963 -4.587 886 HG21 VAL 115 HG21 VAL 115 -2.863 6.870 -3.509 887 HG22 VAL 115 HG22 VAL 115 -2.999 6.644 -5.253 888 HG23 VAL 115 HG23 VAL 115 -4.063 5.754 -4.163 889 H LEU 116 HN LEU 116 -7.869 7.160 -4.195 890 HA LEU 116 HA LEU 116 -8.766 9.973 -4.401 891 HB2 LEU 116 HB2 LEU 116 -9.694 7.255 -5.298 892 HB3 LEU 116 HB1 LEU 116 -10.828 8.605 -5.315 893 HG LEU 116 HG LEU 116 -8.107 8.652 -6.652 894 HD11 LEU 116 HD11 LEU 116 -10.181 8.809 -8.556 895 HD12 LEU 116 HD12 LEU 116 -10.622 7.480 -7.484 896 HD13 LEU 116 HD13 LEU 116 -9.064 7.465 -8.313 897 HD21 LEU 116 HD21 LEU 116 -8.756 10.883 -6.165 898 HD22 LEU 116 HD22 LEU 116 -10.454 10.551 -6.508 899 HD23 LEU 116 HD23 LEU 116 -9.288 10.633 -7.828 900 H VAL 117 HN VAL 117 -9.023 7.306 -2.228 901 HA VAL 117 HA VAL 117 -11.556 8.210 -1.006 902 HB VAL 117 HB VAL 117 -11.220 6.217 0.365 903 HG11 VAL 117 HG11 VAL 117 -10.775 6.103 -2.577 904 HG12 VAL 117 HG12 VAL 117 -12.101 5.452 -1.614 905 HG13 VAL 117 HG13 VAL 117 -10.551 4.613 -1.662 906 HG21 VAL 117 HG21 VAL 117 -8.476 6.807 -0.126 907 HG22 VAL 117 HG22 VAL 117 -8.796 5.196 -0.768 908 HG23 VAL 117 HG23 VAL 117 -9.143 5.556 0.923 909 H GLN 118 HN GLN 118 -8.302 9.102 -0.769 910 HA GLN 118 HA GLN 118 -8.526 9.757 2.131 911 HB2 GLN 118 HB2 GLN 118 -6.564 8.517 0.930 912 HB3 GLN 118 HB1 GLN 118 -6.096 10.130 0.392 913 HG2 GLN 118 HG2 GLN 118 -4.981 9.460 2.526 914 HG3 GLN 118 HG1 GLN 118 -5.971 10.911 2.695 915 HE21 GLN 118 HE21 GLN 118 -7.422 7.689 2.417 916 HE22 GLN 118 HE22 GLN 118 -8.000 7.620 4.011 917 H ILE 119 HN ILE 119 -7.472 11.337 -0.923 918 HA ILE 119 HA ILE 119 -7.748 13.975 0.366 919 HB ILE 119 HB ILE 119 -6.381 14.719 -1.313 920 HG12 ILE 119 HG12 ILE 119 -8.226 14.406 -3.035 921 HG13 ILE 119 HG11 ILE 119 -6.585 14.236 -3.647 922 HG21 ILE 119 HG21 ILE 119 -5.987 11.801 -1.972 923 HG22 ILE 119 HG22 ILE 119 -5.449 12.501 -0.446 924 HG23 ILE 119 HG23 ILE 119 -4.788 13.095 -1.969 925 HD11 ILE 119 HD11 ILE 119 -8.676 12.358 -3.856 926 HD12 ILE 119 HD12 ILE 119 -7.542 11.686 -2.689 927 HD13 ILE 119 HD13 ILE 119 -6.986 12.126 -4.300 928 H SER 120 HN SER 120 -9.998 11.927 -0.776 929 HA SER 120 HA SER 120 -11.955 14.039 -1.206 930 HB2 SER 120 HB2 SER 120 -10.751 12.508 -3.507 931 HB3 SER 120 HB1 SER 120 -12.373 13.187 -3.619 932 HG SER 120 HG SER 120 -11.424 15.005 -4.027 933 H LYS 121 HN LYS 121 -13.210 12.841 0.318 934 HA LYS 121 HA LYS 121 -14.929 10.819 -0.748 935 HB2 LYS 121 HB2 LYS 121 -12.826 9.517 -0.661 936 HB3 LYS 121 HB1 LYS 121 -12.679 9.869 1.060 937 HG2 LYS 121 HG2 LYS 121 -13.889 8.009 1.448 938 HG3 LYS 121 HG1 LYS 121 -15.274 8.855 0.757 939 HD2 LYS 121 HD2 LYS 121 -13.323 7.599 -1.130 940 HD3 LYS 121 HD1 LYS 121 -14.427 6.536 -0.255 941 HE2 LYS 121 HE2 LYS 121 -16.295 8.174 -1.027 942 HE3 LYS 121 HE1 LYS 121 -15.098 8.735 -2.213 943 HZ1 LYS 121 HZ1 LYS 121 -14.777 6.484 -2.957 944 HZ2 LYS 121 HZ2 LYS 121 -16.434 6.851 -3.041 945 HZ3 LYS 121 HZ3 LYS 121 -15.836 5.889 -1.774 946 H GLU 122 HN GLU 122 -15.304 13.164 0.769 947 HA GLU 122 HA GLU 122 -16.225 13.995 2.786 948 HB2 GLU 122 HB2 GLU 122 -18.239 12.790 3.307 949 HB3 GLU 122 HB1 GLU 122 -17.968 12.573 1.580 950 HG2 GLU 122 HG2 GLU 122 -17.219 10.354 1.853 951 HG3 GLU 122 HG1 GLU 122 -16.915 10.572 3.576 952 H VAL 123 HN VAL 123 -13.722 12.522 3.004 953 HA VAL 123 HA VAL 123 -12.327 11.812 4.735 954 HB VAL 123 HB VAL 123 -14.579 13.179 5.901 955 HG11 VAL 123 HG11 VAL 123 -15.148 11.175 7.115 956 HG12 VAL 123 HG12 VAL 123 -14.302 12.242 8.235 957 HG13 VAL 123 HG13 VAL 123 -13.456 10.874 7.513 958 HG21 VAL 123 HG21 VAL 123 -11.671 12.985 6.139 959 HG22 VAL 123 HG22 VAL 123 -12.467 13.339 7.672 960 HG23 VAL 123 HG23 VAL 123 -12.719 14.395 6.282 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 21.354 1.710 11.247 2 H2 GLY 1 HT2 GLY 1 19.901 2.150 10.481 3 H3 GLY 1 HT3 GLY 1 20.126 0.560 11.031 4 HA2 GLY 1 HA2 GLY 1 20.192 1.335 13.323 5 HA3 GLY 1 HA1 GLY 1 19.928 2.979 12.742 6 H SER 2 HN SER 2 18.060 2.463 10.703 7 HA SER 2 HA SER 2 15.694 2.398 10.546 8 HB2 SER 2 HB2 SER 2 14.964 0.144 10.721 9 HB3 SER 2 HB1 SER 2 16.687 0.016 10.396 10 HG SER 2 HG SER 2 16.067 -1.307 12.144 11 H HIS 3 HN HIS 3 15.595 4.176 12.251 12 HA HIS 3 HA HIS 3 14.051 3.197 14.613 13 HB2 HIS 3 HB2 HIS 3 16.724 4.311 14.558 14 HB3 HIS 3 HB1 HIS 3 15.644 5.369 15.466 15 HD1 HIS 3 HD1 HIS 3 16.835 1.767 15.384 16 HD2 HIS 3 HD2 HIS 3 14.886 4.389 17.973 17 HE1 HIS 3 HE1 HIS 3 16.672 0.582 17.616 18 H MET 4 HN MET 4 15.346 6.364 13.549 19 HA MET 4 HA MET 4 12.673 7.572 13.914 20 HB2 MET 4 HB2 MET 4 15.073 8.438 14.559 21 HB3 MET 4 HB1 MET 4 15.127 8.967 12.876 22 HG2 MET 4 HG2 MET 4 14.067 10.828 13.627 23 HG3 MET 4 HG1 MET 4 12.628 9.809 13.657 24 HE1 MET 4 HE1 MET 4 15.763 10.687 15.178 25 HE2 MET 4 HE2 MET 4 15.762 9.731 16.656 26 HE3 MET 4 HE3 MET 4 15.335 11.440 16.720 27 H THR 5 HN THR 5 11.839 9.037 12.148 28 HA THR 5 HA THR 5 12.542 8.024 9.413 29 HB THR 5 HB THR 5 10.113 8.046 8.959 30 HG1 THR 5 HG1 THR 5 9.551 8.364 11.658 31 HG21 THR 5 HG21 THR 5 11.506 6.223 10.516 32 HG22 THR 5 HG22 THR 5 9.920 5.954 9.794 33 HG23 THR 5 HG23 THR 5 10.046 6.525 11.457 34 H GLU 6 HN GLU 6 11.965 9.591 7.673 35 HA GLU 6 HA GLU 6 11.430 12.378 8.561 36 HB2 GLU 6 HB2 GLU 6 13.458 13.168 7.405 37 HB3 GLU 6 HB1 GLU 6 13.874 12.011 8.670 38 HG2 GLU 6 HG2 GLU 6 13.649 10.256 6.701 39 HG3 GLU 6 HG1 GLU 6 13.949 11.671 5.692 40 H ARG 7 HN ARG 7 10.228 10.152 6.775 41 HA ARG 7 HA ARG 7 9.236 11.920 4.681 42 HB2 ARG 7 HB2 ARG 7 11.683 10.701 4.211 43 HB3 ARG 7 HB1 ARG 7 10.547 9.595 3.438 44 HG2 ARG 7 HG2 ARG 7 10.842 11.077 1.695 45 HG3 ARG 7 HG1 ARG 7 9.519 11.892 2.531 46 HD2 ARG 7 HD2 ARG 7 10.847 13.635 3.174 47 HD3 ARG 7 HD1 ARG 7 12.215 12.569 3.551 48 HE ARG 7 HE ARG 7 11.465 13.251 0.729 49 HH11 ARG 7 HH21 ARG 7 13.563 14.759 2.503 50 HH12 ARG 7 HH22 ARG 7 15.024 14.093 1.852 51 HH21 ARG 7 HH11 ARG 7 13.419 11.491 0.215 52 HH22 ARG 7 HH12 ARG 7 14.943 12.237 0.561 53 H ARG 8 HN ARG 8 7.359 11.027 5.982 54 HA ARG 8 HA ARG 8 6.713 8.180 5.419 55 HB2 ARG 8 HB2 ARG 8 4.913 8.678 7.113 56 HB3 ARG 8 HB1 ARG 8 6.549 8.957 7.704 57 HG2 ARG 8 HG2 ARG 8 5.494 11.328 6.400 58 HG3 ARG 8 HG1 ARG 8 4.441 10.802 7.713 59 HD2 ARG 8 HD2 ARG 8 5.928 11.505 9.272 60 HD3 ARG 8 HD1 ARG 8 7.257 10.640 8.473 61 HE ARG 8 HE ARG 8 6.799 12.751 6.769 62 HH11 ARG 8 HH11 ARG 8 7.530 12.349 10.114 63 HH12 ARG 8 HH12 ARG 8 8.192 13.939 10.296 64 HH21 ARG 8 HH21 ARG 8 7.548 14.871 7.020 65 HH22 ARG 8 HH22 ARG 8 8.194 15.371 8.547 66 H LEU 9 HN LEU 9 6.172 11.115 3.904 67 HA LEU 9 HA LEU 9 3.363 10.730 3.184 68 HB2 LEU 9 HB2 LEU 9 5.278 12.786 3.219 69 HB3 LEU 9 HB1 LEU 9 4.933 12.521 1.511 70 HG LEU 9 HG LEU 9 2.450 12.601 2.162 71 HD11 LEU 9 HD11 LEU 9 2.019 13.929 4.248 72 HD12 LEU 9 HD12 LEU 9 3.723 13.750 4.665 73 HD13 LEU 9 HD13 LEU 9 2.685 12.328 4.569 74 HD21 LEU 9 HD21 LEU 9 2.462 15.097 2.193 75 HD22 LEU 9 HD22 LEU 9 3.558 14.441 0.976 76 HD23 LEU 9 HD23 LEU 9 4.199 15.061 2.499 77 H ARG 10 HN ARG 10 3.743 8.436 2.281 78 HA ARG 10 HA ARG 10 4.315 8.637 -0.596 79 HB2 ARG 10 HB2 ARG 10 6.420 8.236 0.987 80 HB3 ARG 10 HB1 ARG 10 5.846 6.577 0.920 81 HG2 ARG 10 HG2 ARG 10 7.546 7.151 -0.861 82 HG3 ARG 10 HG1 ARG 10 6.034 6.493 -1.476 83 HD2 ARG 10 HD2 ARG 10 5.295 8.955 -1.763 84 HD3 ARG 10 HD1 ARG 10 6.996 9.355 -1.558 85 HE ARG 10 HE ARG 10 7.497 8.132 -3.572 86 HH11 ARG 10 HH11 ARG 10 4.129 8.149 -2.751 87 HH12 ARG 10 HH12 ARG 10 3.635 7.591 -4.309 88 HH21 ARG 10 HH21 ARG 10 6.848 7.372 -5.569 89 HH22 ARG 10 HH22 ARG 10 5.160 7.156 -5.895 90 H VAL 11 HN VAL 11 4.190 6.404 -1.621 91 HA VAL 11 HA VAL 11 2.074 4.755 -0.282 92 HB VAL 11 HB VAL 11 1.194 4.385 -2.546 93 HG11 VAL 11 HG11 VAL 11 0.792 6.597 -1.189 94 HG12 VAL 11 HG12 VAL 11 0.266 6.514 -2.870 95 HG13 VAL 11 HG13 VAL 11 1.769 7.338 -2.456 96 HG21 VAL 11 HG21 VAL 11 2.345 5.910 -4.361 97 HG22 VAL 11 HG22 VAL 11 3.034 4.330 -3.988 98 HG23 VAL 11 HG23 VAL 11 3.739 5.786 -3.294 99 H LEU 12 HN LEU 12 3.654 3.311 0.613 100 HA LEU 12 HA LEU 12 5.734 2.121 -1.068 101 HB2 LEU 12 HB2 LEU 12 4.771 1.212 1.654 102 HB3 LEU 12 HB1 LEU 12 6.398 1.100 0.986 103 HG LEU 12 HG LEU 12 4.943 3.621 1.838 104 HD11 LEU 12 HD11 LEU 12 7.541 2.357 2.752 105 HD12 LEU 12 HD12 LEU 12 6.018 2.319 3.638 106 HD13 LEU 12 HD13 LEU 12 6.844 3.853 3.374 107 HD21 LEU 12 HD21 LEU 12 7.471 4.409 1.192 108 HD22 LEU 12 HD22 LEU 12 6.092 4.554 0.103 109 HD23 LEU 12 HD23 LEU 12 7.187 3.178 -0.038 110 H VAL 13 HN VAL 13 4.658 0.953 -2.744 111 HA VAL 13 HA VAL 13 2.771 -1.214 -1.870 112 HB VAL 13 HB VAL 13 3.305 -0.213 -4.679 113 HG11 VAL 13 HG11 VAL 13 1.710 -2.244 -3.630 114 HG12 VAL 13 HG12 VAL 13 1.556 -1.530 -5.235 115 HG13 VAL 13 HG13 VAL 13 0.582 -0.915 -3.899 116 HG21 VAL 13 HG21 VAL 13 1.500 1.413 -4.379 117 HG22 VAL 13 HG22 VAL 13 2.771 1.724 -3.196 118 HG23 VAL 13 HG23 VAL 13 1.290 0.904 -2.703 119 H VAL 14 HN VAL 14 3.273 -3.374 -2.430 120 HA VAL 14 HA VAL 14 5.692 -3.867 -4.057 121 HB VAL 14 HB VAL 14 6.687 -5.100 -2.115 122 HG11 VAL 14 HG11 VAL 14 7.205 -2.688 -2.768 123 HG12 VAL 14 HG12 VAL 14 7.614 -3.156 -1.117 124 HG13 VAL 14 HG13 VAL 14 6.154 -2.217 -1.432 125 HG21 VAL 14 HG21 VAL 14 5.607 -4.059 0.113 126 HG22 VAL 14 HG22 VAL 14 5.072 -5.595 -0.566 127 HG23 VAL 14 HG23 VAL 14 4.162 -4.123 -0.896 128 H GLU 15 HN GLU 15 5.789 -5.907 -4.874 129 HA GLU 15 HA GLU 15 4.326 -8.207 -3.926 130 HB2 GLU 15 HB2 GLU 15 2.654 -8.288 -5.714 131 HB3 GLU 15 HB1 GLU 15 2.485 -6.758 -4.843 132 HG2 GLU 15 HG2 GLU 15 2.534 -5.911 -6.981 133 HG3 GLU 15 HG1 GLU 15 4.276 -6.006 -6.712 134 H ASP 16 HN ASP 16 5.133 -10.033 -4.994 135 HA ASP 16 HA ASP 16 7.611 -10.056 -6.227 136 HB2 ASP 16 HB2 ASP 16 7.047 -12.351 -6.795 137 HB3 ASP 16 HB1 ASP 16 6.341 -11.950 -5.227 138 H GLU 17 HN GLU 17 7.368 -8.230 -7.827 139 HA GLU 17 HA GLU 17 7.436 -9.129 -10.492 140 HB2 GLU 17 HB2 GLU 17 4.767 -8.867 -9.389 141 HB3 GLU 17 HB1 GLU 17 4.967 -7.832 -10.799 142 HG2 GLU 17 HG2 GLU 17 5.229 -9.600 -12.226 143 HG3 GLU 17 HG1 GLU 17 6.065 -10.582 -11.021 144 H SER 18 HN SER 18 7.663 -7.384 -12.040 145 HA SER 18 HA SER 18 8.411 -4.808 -10.781 146 HB2 SER 18 HB2 SER 18 8.606 -5.708 -13.669 147 HB3 SER 18 HB1 SER 18 9.540 -4.438 -12.882 148 HG SER 18 HG SER 18 10.771 -6.308 -12.975 149 H MET 19 HN MET 19 5.724 -6.181 -12.396 150 HA MET 19 HA MET 19 4.723 -4.011 -13.944 151 HB2 MET 19 HB2 MET 19 3.820 -6.297 -13.968 152 HB3 MET 19 HB1 MET 19 3.318 -6.135 -12.285 153 HG2 MET 19 HG2 MET 19 2.065 -3.986 -13.257 154 HG3 MET 19 HG1 MET 19 2.125 -4.933 -14.743 155 HE1 MET 19 HE1 MET 19 0.133 -7.950 -14.307 156 HE2 MET 19 HE2 MET 19 1.532 -7.159 -15.031 157 HE3 MET 19 HE3 MET 19 -0.078 -6.480 -15.265 158 H ILE 20 HN ILE 20 5.054 -4.432 -10.540 159 HA ILE 20 HA ILE 20 3.083 -2.318 -9.864 160 HB ILE 20 HB ILE 20 3.179 -4.283 -8.477 161 HG12 ILE 20 HG12 ILE 20 4.747 -2.219 -6.930 162 HG13 ILE 20 HG11 ILE 20 3.067 -1.937 -7.402 163 HG21 ILE 20 HG21 ILE 20 5.252 -5.282 -8.852 164 HG22 ILE 20 HG22 ILE 20 5.437 -4.660 -7.213 165 HG23 ILE 20 HG23 ILE 20 6.132 -3.779 -8.573 166 HD11 ILE 20 HD11 ILE 20 2.388 -3.995 -6.234 167 HD12 ILE 20 HD12 ILE 20 3.205 -2.889 -5.129 168 HD13 ILE 20 HD13 ILE 20 4.063 -4.291 -5.771 169 H ALA 21 HN ALA 21 6.271 -2.497 -10.849 170 HA ALA 21 HA ALA 21 7.376 -0.408 -9.114 171 HB1 ALA 21 HB1 ALA 21 8.413 -1.622 -11.686 172 HB2 ALA 21 HB2 ALA 21 8.547 -2.416 -10.119 173 HB3 ALA 21 HB3 ALA 21 9.357 -0.874 -10.399 174 H MET 22 HN MET 22 7.367 -0.521 -12.705 175 HA MET 22 HA MET 22 7.441 2.284 -13.058 176 HB2 MET 22 HB2 MET 22 7.667 1.524 -15.185 177 HB3 MET 22 HB1 MET 22 7.295 -0.095 -14.608 178 HG2 MET 22 HG2 MET 22 4.823 0.561 -14.833 179 HG3 MET 22 HG1 MET 22 5.393 1.966 -15.734 180 HE1 MET 22 HE1 MET 22 3.953 0.728 -18.265 181 HE2 MET 22 HE2 MET 22 5.504 1.087 -19.017 182 HE3 MET 22 HE3 MET 22 4.947 2.060 -17.658 183 H LEU 23 HN LEU 23 4.795 0.144 -12.324 184 HA LEU 23 HA LEU 23 2.598 1.873 -13.025 185 HB2 LEU 23 HB2 LEU 23 2.291 -0.492 -12.670 186 HB3 LEU 23 HB1 LEU 23 3.046 -0.417 -11.081 187 HG LEU 23 HG LEU 23 0.491 -0.581 -11.138 188 HD11 LEU 23 HD11 LEU 23 0.737 0.140 -9.029 189 HD12 LEU 23 HD12 LEU 23 0.779 1.811 -9.594 190 HD13 LEU 23 HD13 LEU 23 2.274 0.884 -9.470 191 HD21 LEU 23 HD21 LEU 23 0.884 2.261 -12.118 192 HD22 LEU 23 HD22 LEU 23 -0.622 1.683 -11.408 193 HD23 LEU 23 HD23 LEU 23 -0.023 0.970 -12.905 194 H ILE 24 HN ILE 24 5.042 2.114 -10.676 195 HA ILE 24 HA ILE 24 3.378 3.679 -8.783 196 HB ILE 24 HB ILE 24 5.328 1.812 -8.459 197 HG12 ILE 24 HG12 ILE 24 5.596 3.465 -6.210 198 HG13 ILE 24 HG11 ILE 24 3.992 3.823 -6.850 199 HG21 ILE 24 HG21 ILE 24 7.319 3.104 -7.528 200 HG22 ILE 24 HG22 ILE 24 6.702 4.510 -8.393 201 HG23 ILE 24 HG23 ILE 24 7.186 3.068 -9.286 202 HD11 ILE 24 HD11 ILE 24 4.273 1.026 -7.045 203 HD12 ILE 24 HD12 ILE 24 3.256 1.914 -5.911 204 HD13 ILE 24 HD13 ILE 24 4.895 1.458 -5.453 205 H GLU 25 HN GLU 25 6.415 4.058 -10.668 206 HA GLU 25 HA GLU 25 6.928 6.772 -10.169 207 HB2 GLU 25 HB2 GLU 25 7.447 4.789 -12.300 208 HB3 GLU 25 HB1 GLU 25 7.569 6.471 -12.817 209 HG2 GLU 25 HG2 GLU 25 8.823 6.200 -10.247 210 HG3 GLU 25 HG1 GLU 25 9.478 4.974 -11.337 211 H ASP 26 HN ASP 26 4.596 5.315 -12.414 212 HA ASP 26 HA ASP 26 3.786 7.823 -13.625 213 HB2 ASP 26 HB2 ASP 26 2.340 6.434 -14.828 214 HB3 ASP 26 HB1 ASP 26 3.561 5.269 -14.315 215 H THR 27 HN THR 27 2.659 5.875 -10.882 216 HA THR 27 HA THR 27 0.274 7.336 -10.294 217 HB THR 27 HB THR 27 2.179 5.849 -8.505 218 HG1 THR 27 HG1 THR 27 1.517 4.180 -9.552 219 HG21 THR 27 HG21 THR 27 0.745 6.309 -6.843 220 HG22 THR 27 HG22 THR 27 -0.551 5.543 -7.761 221 HG23 THR 27 HG23 THR 27 -0.232 7.267 -7.955 222 H LEU 28 HN LEU 28 3.578 7.565 -8.959 223 HA LEU 28 HA LEU 28 3.035 9.848 -7.289 224 HB2 LEU 28 HB2 LEU 28 4.972 8.887 -6.590 225 HB3 LEU 28 HB1 LEU 28 5.266 8.148 -8.158 226 HG LEU 28 HG LEU 28 5.671 11.100 -7.918 227 HD11 LEU 28 HD11 LEU 28 7.487 8.975 -6.752 228 HD12 LEU 28 HD12 LEU 28 6.813 10.383 -5.930 229 HD13 LEU 28 HD13 LEU 28 8.047 10.594 -7.172 230 HD21 LEU 28 HD21 LEU 28 7.708 9.431 -9.189 231 HD22 LEU 28 HD22 LEU 28 6.768 10.757 -9.873 232 HD23 LEU 28 HD23 LEU 28 6.100 9.125 -9.844 233 H CYS 29 HN CYS 29 3.835 9.442 -10.681 234 HA CYS 29 HA CYS 29 4.716 12.124 -11.245 235 HB2 CYS 29 HB2 CYS 29 4.250 9.686 -12.591 236 HB3 CYS 29 HB1 CYS 29 3.192 10.858 -13.376 237 HG CYS 29 HG CYS 29 5.952 10.723 -14.099 238 H GLU 30 HN GLU 30 1.679 10.772 -10.410 239 HA GLU 30 HA GLU 30 0.068 12.912 -11.618 240 HB2 GLU 30 HB2 GLU 30 -1.004 10.853 -11.752 241 HB3 GLU 30 HB1 GLU 30 -0.315 10.288 -10.236 242 HG2 GLU 30 HG2 GLU 30 -1.813 11.941 -9.041 243 HG3 GLU 30 HG1 GLU 30 -2.603 12.242 -10.590 244 H LEU 31 HN LEU 31 1.104 11.773 -8.410 245 HA LEU 31 HA LEU 31 -0.205 14.132 -7.131 246 HB2 LEU 31 HB2 LEU 31 1.134 11.658 -5.991 247 HB3 LEU 31 HB1 LEU 31 0.228 12.856 -5.064 248 HG LEU 31 HG LEU 31 -1.504 12.123 -7.138 249 HD11 LEU 31 HD11 LEU 31 0.308 10.168 -7.237 250 HD12 LEU 31 HD12 LEU 31 -1.412 9.824 -7.420 251 HD13 LEU 31 HD13 LEU 31 -0.621 9.561 -5.866 252 HD21 LEU 31 HD21 LEU 31 -2.880 11.841 -5.349 253 HD22 LEU 31 HD22 LEU 31 -1.497 12.334 -4.373 254 HD23 LEU 31 HD23 LEU 31 -1.827 10.621 -4.631 255 H GLY 32 HN GLY 32 2.976 12.573 -7.535 256 HA2 GLY 32 HA2 GLY 32 5.080 13.705 -7.578 257 HA3 GLY 32 HA1 GLY 32 4.280 15.161 -6.973 258 H HIS 33 HN HIS 33 3.983 11.943 -5.554 259 HA HIS 33 HA HIS 33 4.473 12.857 -2.882 260 HB2 HIS 33 HB2 HIS 33 4.262 10.248 -4.345 261 HB3 HIS 33 HB1 HIS 33 4.787 10.254 -2.664 262 HD1 HIS 33 HD1 HIS 33 1.833 9.713 -4.382 263 HD2 HIS 33 HD2 HIS 33 2.783 12.269 -1.225 264 HE1 HIS 33 HE1 HIS 33 -0.355 10.278 -3.238 265 H GLU 34 HN GLU 34 6.245 10.994 -1.779 266 HA GLU 34 HA GLU 34 8.839 12.177 -2.540 267 HB2 GLU 34 HB2 GLU 34 7.632 10.639 -0.306 268 HB3 GLU 34 HB1 GLU 34 9.371 10.448 -0.529 269 HG2 GLU 34 HG2 GLU 34 9.608 12.385 0.605 270 HG3 GLU 34 HG1 GLU 34 8.961 13.190 -0.824 271 H VAL 35 HN VAL 35 8.851 8.877 -1.401 272 HA VAL 35 HA VAL 35 9.604 7.862 -4.115 273 HB VAL 35 HB VAL 35 11.270 8.270 -1.700 274 HG11 VAL 35 HG11 VAL 35 11.341 5.945 -1.397 275 HG12 VAL 35 HG12 VAL 35 12.704 6.225 -2.481 276 HG13 VAL 35 HG13 VAL 35 11.176 5.617 -3.122 277 HG21 VAL 35 HG21 VAL 35 11.687 7.967 -4.677 278 HG22 VAL 35 HG22 VAL 35 13.042 8.098 -3.556 279 HG23 VAL 35 HG23 VAL 35 11.878 9.416 -3.691 280 H ALA 36 HN ALA 36 7.847 6.439 -4.287 281 HA ALA 36 HA ALA 36 6.816 4.901 -2.071 282 HB1 ALA 36 HB1 ALA 36 5.409 5.544 -3.900 283 HB2 ALA 36 HB2 ALA 36 5.552 3.793 -3.962 284 HB3 ALA 36 HB3 ALA 36 6.486 4.796 -5.072 285 H ALA 37 HN ALA 37 6.432 2.392 -2.871 286 HA ALA 37 HA ALA 37 9.179 1.249 -3.275 287 HB1 ALA 37 HB1 ALA 37 6.983 0.747 -1.306 288 HB2 ALA 37 HB2 ALA 37 8.728 0.792 -1.047 289 HB3 ALA 37 HB3 ALA 37 7.983 -0.621 -1.795 290 H THR 38 HN THR 38 9.219 -0.784 -4.396 291 HA THR 38 HA THR 38 6.714 -1.587 -5.801 292 HB THR 38 HB THR 38 7.847 -0.154 -7.337 293 HG1 THR 38 HG1 THR 38 7.311 -2.259 -8.155 294 HG21 THR 38 HG21 THR 38 9.948 0.236 -6.362 295 HG22 THR 38 HG22 THR 38 10.356 -0.680 -7.813 296 HG23 THR 38 HG23 THR 38 10.317 -1.485 -6.245 297 H ALA 39 HN ALA 39 7.000 -3.757 -6.852 298 HA ALA 39 HA ALA 39 7.490 -6.056 -6.644 299 HB1 ALA 39 HB1 ALA 39 9.664 -5.080 -7.470 300 HB2 ALA 39 HB2 ALA 39 9.855 -6.551 -6.515 301 HB3 ALA 39 HB3 ALA 39 10.187 -4.978 -5.789 302 H SER 40 HN SER 40 7.948 -7.724 -4.963 303 HA SER 40 HA SER 40 7.126 -6.758 -2.327 304 HB2 SER 40 HB2 SER 40 6.994 -9.117 -1.816 305 HB3 SER 40 HB1 SER 40 6.285 -8.832 -3.398 306 HG SER 40 HG SER 40 8.711 -9.248 -3.992 307 H ARG 41 HN ARG 41 8.521 -6.116 -0.795 308 HA ARG 41 HA ARG 41 11.158 -7.415 -0.549 309 HB2 ARG 41 HB2 ARG 41 10.974 -5.236 -2.063 310 HB3 ARG 41 HB1 ARG 41 11.004 -4.426 -0.492 311 HG2 ARG 41 HG2 ARG 41 13.247 -4.636 -0.527 312 HG3 ARG 41 HG1 ARG 41 13.013 -6.375 -0.329 313 HD2 ARG 41 HD2 ARG 41 12.835 -6.591 -2.823 314 HD3 ARG 41 HD1 ARG 41 13.243 -4.869 -2.956 315 HE ARG 41 HE ARG 41 15.078 -6.530 -1.333 316 HH11 ARG 41 HH11 ARG 41 15.461 -7.464 -4.083 317 HH12 ARG 41 HH12 ARG 41 16.593 -6.329 -4.739 318 HH21 ARG 41 HH21 ARG 41 16.068 -3.966 -2.256 319 HH22 ARG 41 HH22 ARG 41 16.942 -4.351 -3.701 320 H MET 42 HN MET 42 11.495 -7.812 1.609 321 HA MET 42 HA MET 42 9.689 -6.916 3.640 322 HB2 MET 42 HB2 MET 42 12.516 -8.002 3.855 323 HB3 MET 42 HB1 MET 42 11.284 -8.047 5.118 324 HG2 MET 42 HG2 MET 42 10.025 -9.670 4.028 325 HG3 MET 42 HG1 MET 42 10.646 -9.233 2.438 326 HE1 MET 42 HE1 MET 42 11.635 -12.863 4.429 327 HE2 MET 42 HE2 MET 42 10.206 -12.041 3.811 328 HE3 MET 42 HE3 MET 42 10.850 -11.600 5.390 329 H GLN 43 HN GLN 43 12.846 -5.740 2.526 330 HA GLN 43 HA GLN 43 13.523 -3.938 4.580 331 HB2 GLN 43 HB2 GLN 43 14.159 -4.480 1.820 332 HB3 GLN 43 HB1 GLN 43 14.084 -2.735 2.065 333 HG2 GLN 43 HG2 GLN 43 15.708 -2.819 3.821 334 HG3 GLN 43 HG1 GLN 43 15.611 -4.578 3.913 335 HE21 GLN 43 HE21 GLN 43 18.051 -4.427 3.515 336 HE22 GLN 43 HE22 GLN 43 18.588 -4.303 1.909 337 H GLU 44 HN GLU 44 11.997 -2.866 1.523 338 HA GLU 44 HA GLU 44 11.071 -0.382 2.533 339 HB2 GLU 44 HB2 GLU 44 10.357 -2.207 0.248 340 HB3 GLU 44 HB1 GLU 44 9.434 -0.726 0.514 341 HG2 GLU 44 HG2 GLU 44 12.447 -0.674 0.441 342 HG3 GLU 44 HG1 GLU 44 11.506 -0.597 -1.050 343 H ALA 45 HN ALA 45 9.366 -3.521 2.228 344 HA ALA 45 HA ALA 45 6.798 -2.874 3.074 345 HB1 ALA 45 HB1 ALA 45 7.654 -5.128 2.466 346 HB2 ALA 45 HB2 ALA 45 6.780 -5.172 3.997 347 HB3 ALA 45 HB3 ALA 45 8.543 -5.191 3.989 348 H LEU 46 HN LEU 46 9.590 -3.572 5.154 349 HA LEU 46 HA LEU 46 8.492 -3.189 7.712 350 HB2 LEU 46 HB2 LEU 46 10.783 -3.989 7.092 351 HB3 LEU 46 HB1 LEU 46 11.213 -2.333 6.668 352 HG LEU 46 HG LEU 46 10.741 -1.615 8.984 353 HD11 LEU 46 HD11 LEU 46 10.570 -3.675 10.622 354 HD12 LEU 46 HD12 LEU 46 9.903 -4.488 9.206 355 HD13 LEU 46 HD13 LEU 46 9.118 -3.044 9.846 356 HD21 LEU 46 HD21 LEU 46 13.024 -2.273 8.467 357 HD22 LEU 46 HD22 LEU 46 12.626 -3.976 8.695 358 HD23 LEU 46 HD23 LEU 46 12.623 -2.878 10.075 359 H ASP 47 HN ASP 47 9.664 -0.766 5.394 360 HA ASP 47 HA ASP 47 9.374 1.477 7.191 361 HB2 ASP 47 HB2 ASP 47 9.634 1.157 4.191 362 HB3 ASP 47 HB1 ASP 47 9.645 2.727 4.996 363 H ILE 48 HN ILE 48 7.156 -0.347 5.253 364 HA ILE 48 HA ILE 48 5.171 1.835 5.204 365 HB ILE 48 HB ILE 48 4.249 0.701 3.446 366 HG12 ILE 48 HG12 ILE 48 4.644 -1.733 5.178 367 HG13 ILE 48 HG11 ILE 48 3.145 -1.041 4.566 368 HG21 ILE 48 HG21 ILE 48 6.790 0.605 3.143 369 HG22 ILE 48 HG22 ILE 48 5.821 -0.477 2.145 370 HG23 ILE 48 HG23 ILE 48 6.656 -1.098 3.568 371 HD11 ILE 48 HD11 ILE 48 4.550 -1.675 2.246 372 HD12 ILE 48 HD12 ILE 48 3.242 -2.623 2.950 373 HD13 ILE 48 HD13 ILE 48 4.918 -3.018 3.331 374 H ALA 49 HN ALA 49 5.994 -0.951 7.101 375 HA ALA 49 HA ALA 49 3.274 -1.101 8.210 376 HB1 ALA 49 HB1 ALA 49 4.162 -3.098 9.329 377 HB2 ALA 49 HB2 ALA 49 5.797 -2.660 8.839 378 HB3 ALA 49 HB3 ALA 49 4.608 -3.123 7.623 379 H ARG 50 HN ARG 50 6.485 -1.097 9.775 380 HA ARG 50 HA ARG 50 5.685 -0.208 12.312 381 HB2 ARG 50 HB2 ARG 50 8.027 0.279 12.606 382 HB3 ARG 50 HB1 ARG 50 7.925 -1.081 11.481 383 HG2 ARG 50 HG2 ARG 50 7.868 0.831 9.659 384 HG3 ARG 50 HG1 ARG 50 8.631 1.783 10.933 385 HD2 ARG 50 HD2 ARG 50 9.788 -0.914 10.590 386 HD3 ARG 50 HD1 ARG 50 10.027 0.178 9.210 387 HE ARG 50 HE ARG 50 10.768 0.884 12.025 388 HH11 ARG 50 HH21 ARG 50 10.354 2.804 9.529 389 HH12 ARG 50 HH22 ARG 50 12.015 3.145 9.177 390 HH21 ARG 50 HH11 ARG 50 13.233 0.590 11.179 391 HH22 ARG 50 HH12 ARG 50 13.648 1.893 10.115 392 H LYS 51 HN LYS 51 5.985 1.650 9.363 393 HA LYS 51 HA LYS 51 6.344 4.258 10.461 394 HB2 LYS 51 HB2 LYS 51 6.685 3.744 8.123 395 HB3 LYS 51 HB1 LYS 51 5.012 3.217 7.948 396 HG2 LYS 51 HG2 LYS 51 5.590 5.583 7.112 397 HG3 LYS 51 HG1 LYS 51 4.183 5.421 8.152 398 HD2 LYS 51 HD2 LYS 51 5.380 7.291 8.999 399 HD3 LYS 51 HD1 LYS 51 5.733 5.973 10.111 400 HE2 LYS 51 HE2 LYS 51 7.927 5.725 9.324 401 HE3 LYS 51 HE1 LYS 51 7.548 6.458 7.753 402 HZ1 LYS 51 HZ1 LYS 51 8.338 8.326 8.685 403 HZ2 LYS 51 HZ2 LYS 51 8.177 7.738 10.271 404 HZ3 LYS 51 HZ3 LYS 51 6.837 8.401 9.467 405 H GLY 52 HN GLY 52 3.380 2.340 9.921 406 HA2 GLY 52 HA2 GLY 52 1.130 2.858 10.451 407 HA3 GLY 52 HA1 GLY 52 1.839 3.480 11.945 408 H GLN 53 HN GLN 53 2.654 4.774 8.838 409 HA GLN 53 HA GLN 53 0.792 6.990 8.758 410 HB2 GLN 53 HB2 GLN 53 1.880 7.717 10.747 411 HB3 GLN 53 HB1 GLN 53 3.462 7.211 10.161 412 HG2 GLN 53 HG2 GLN 53 2.941 9.734 10.154 413 HG3 GLN 53 HG1 GLN 53 3.634 9.044 8.689 414 HE21 GLN 53 HE21 GLN 53 2.599 10.816 7.443 415 HE22 GLN 53 HE22 GLN 53 0.939 10.758 7.096 416 H PHE 54 HN PHE 54 2.224 5.001 7.103 417 HA PHE 54 HA PHE 54 4.052 6.505 5.317 418 HB2 PHE 54 HB2 PHE 54 4.211 4.225 4.279 419 HB3 PHE 54 HB1 PHE 54 4.548 4.199 6.012 420 HD1 PHE 54 HD1 PHE 54 2.094 3.346 3.398 421 HD2 PHE 54 HD2 PHE 54 2.965 3.172 7.600 422 HE1 PHE 54 HE1 PHE 54 0.236 1.753 3.723 423 HE2 PHE 54 HE2 PHE 54 1.106 1.574 7.906 424 HZ PHE 54 HZ PHE 54 -0.261 0.864 5.974 425 H ASP 55 HN ASP 55 0.983 6.933 5.588 426 HA ASP 55 HA ASP 55 -0.699 7.600 4.082 427 HB2 ASP 55 HB2 ASP 55 1.844 7.787 2.772 428 HB3 ASP 55 HB1 ASP 55 0.648 7.230 1.602 429 H ILE 56 HN ILE 56 1.100 5.176 2.117 430 HA ILE 56 HA ILE 56 -1.300 3.385 2.242 431 HB ILE 56 HB ILE 56 0.043 4.372 -0.288 432 HG12 ILE 56 HG12 ILE 56 -2.232 5.426 1.355 433 HG13 ILE 56 HG11 ILE 56 -0.990 6.313 0.483 434 HG21 ILE 56 HG21 ILE 56 -1.599 2.169 0.194 435 HG22 ILE 56 HG22 ILE 56 -1.269 2.900 -1.376 436 HG23 ILE 56 HG23 ILE 56 -2.691 3.389 -0.458 437 HD11 ILE 56 HD11 ILE 56 -3.570 5.176 -0.494 438 HD12 ILE 56 HD12 ILE 56 -2.207 5.181 -1.613 439 HD13 ILE 56 HD13 ILE 56 -2.782 6.696 -0.916 440 H ALA 57 HN ALA 57 -0.842 1.131 1.766 441 HA ALA 57 HA ALA 57 1.902 0.414 0.888 442 HB1 ALA 57 HB1 ALA 57 0.786 -0.124 3.644 443 HB2 ALA 57 HB2 ALA 57 2.260 0.755 3.236 444 HB3 ALA 57 HB3 ALA 57 2.176 -0.989 2.990 445 H ILE 58 HN ILE 58 1.837 -1.590 -0.235 446 HA ILE 58 HA ILE 58 -0.515 -3.337 0.355 447 HB ILE 58 HB ILE 58 0.337 -2.344 -2.373 448 HG12 ILE 58 HG12 ILE 58 -2.097 -1.342 -2.104 449 HG13 ILE 58 HG11 ILE 58 -1.730 -1.473 -0.383 450 HG21 ILE 58 HG21 ILE 58 -2.321 -3.453 -2.186 451 HG22 ILE 58 HG22 ILE 58 -1.141 -4.629 -1.609 452 HG23 ILE 58 HG23 ILE 58 -0.988 -3.947 -3.229 453 HD11 ILE 58 HD11 ILE 58 -0.616 0.478 -0.565 454 HD12 ILE 58 HD12 ILE 58 -0.745 0.449 -2.325 455 HD13 ILE 58 HD13 ILE 58 0.586 -0.387 -1.524 456 H ILE 59 HN ILE 59 0.852 -5.013 1.170 457 HA ILE 59 HA ILE 59 2.975 -6.156 -0.589 458 HB ILE 59 HB ILE 59 1.849 -6.599 2.197 459 HG12 ILE 59 HG12 ILE 59 4.294 -6.668 2.743 460 HG13 ILE 59 HG11 ILE 59 4.647 -6.365 1.045 461 HG21 ILE 59 HG21 ILE 59 2.020 -8.844 1.994 462 HG22 ILE 59 HG22 ILE 59 3.762 -8.606 1.846 463 HG23 ILE 59 HG23 ILE 59 2.760 -8.710 0.398 464 HD11 ILE 59 HD11 ILE 59 4.694 -4.206 1.873 465 HD12 ILE 59 HD12 ILE 59 3.480 -4.542 3.107 466 HD13 ILE 59 HD13 ILE 59 2.994 -4.323 1.428 467 H ASP 60 HN ASP 60 0.978 -6.156 -2.152 468 HA ASP 60 HA ASP 60 -1.292 -7.710 -1.873 469 HB2 ASP 60 HB2 ASP 60 -1.494 -6.755 -3.910 470 HB3 ASP 60 HB1 ASP 60 0.222 -6.383 -3.910 471 H VAL 61 HN VAL 61 -1.541 -9.684 -3.632 472 HA VAL 61 HA VAL 61 -1.377 -11.983 -3.801 473 HB VAL 61 HB VAL 61 0.782 -10.816 -4.865 474 HG11 VAL 61 HG11 VAL 61 2.844 -11.597 -4.086 475 HG12 VAL 61 HG12 VAL 61 2.116 -12.938 -3.203 476 HG13 VAL 61 HG13 VAL 61 1.997 -11.302 -2.572 477 HG21 VAL 61 HG21 VAL 61 0.297 -12.587 -6.157 478 HG22 VAL 61 HG22 VAL 61 -0.375 -13.474 -4.789 479 HG23 VAL 61 HG23 VAL 61 1.355 -13.548 -5.123 480 H ASN 62 HN ASN 62 -2.321 -12.131 -1.627 481 HA ASN 62 HA ASN 62 -0.405 -13.281 0.382 482 HB2 ASN 62 HB2 ASN 62 -2.969 -11.698 0.778 483 HB3 ASN 62 HB1 ASN 62 -1.958 -12.339 2.073 484 HD21 ASN 62 HD21 ASN 62 0.613 -11.753 0.878 485 HD22 ASN 62 HD22 ASN 62 0.798 -10.066 0.850 486 H LEU 63 HN LEU 63 -0.755 -15.480 -0.075 487 HA LEU 63 HA LEU 63 -3.349 -16.595 0.740 488 HB2 LEU 63 HB2 LEU 63 -2.930 -15.885 -1.926 489 HB3 LEU 63 HB1 LEU 63 -2.601 -17.617 -1.897 490 HG LEU 63 HG LEU 63 -4.771 -18.023 -0.805 491 HD11 LEU 63 HD11 LEU 63 -6.385 -16.045 -0.753 492 HD12 LEU 63 HD12 LEU 63 -4.977 -15.009 -0.983 493 HD13 LEU 63 HD13 LEU 63 -5.105 -16.016 0.460 494 HD21 LEU 63 HD21 LEU 63 -6.035 -16.586 -2.846 495 HD22 LEU 63 HD22 LEU 63 -5.407 -18.229 -2.965 496 HD23 LEU 63 HD23 LEU 63 -4.404 -16.865 -3.456 497 H ASP 64 HN ASP 64 -3.068 -19.194 -0.051 498 HA ASP 64 HA ASP 64 -1.870 -21.157 0.550 499 HB2 ASP 64 HB2 ASP 64 -0.281 -19.375 -1.097 500 HB3 ASP 64 HB1 ASP 64 0.772 -20.280 -0.003 501 H GLY 65 HN GLY 65 -2.103 -18.747 2.474 502 HA2 GLY 65 HA2 GLY 65 -1.408 -19.370 4.873 503 HA3 GLY 65 HA1 GLY 65 0.230 -19.386 4.221 504 H GLU 66 HN GLU 66 -1.082 -17.073 2.452 505 HA GLU 66 HA GLU 66 -0.811 -14.741 2.470 506 HB2 GLU 66 HB2 GLU 66 -2.882 -14.819 3.599 507 HB3 GLU 66 HB1 GLU 66 -2.158 -15.495 5.057 508 HG2 GLU 66 HG2 GLU 66 -1.148 -13.418 5.642 509 HG3 GLU 66 HG1 GLU 66 -1.452 -12.737 4.043 510 HA PRO 67 HA PRO 67 3.139 -14.886 4.767 511 HB2 PRO 67 HB2 PRO 67 4.550 -13.571 2.815 512 HB3 PRO 67 HB1 PRO 67 4.277 -15.326 2.799 513 HG2 PRO 67 HG2 PRO 67 2.862 -13.180 1.292 514 HG3 PRO 67 HG1 PRO 67 3.352 -14.798 0.763 515 HD2 PRO 67 HD2 PRO 67 0.806 -14.174 1.480 516 HD3 PRO 67 HD1 PRO 67 1.501 -15.799 1.674 517 H SER 68 HN SER 68 3.295 -12.050 2.701 518 HA SER 68 HA SER 68 3.179 -9.748 3.203 519 HB2 SER 68 HB2 SER 68 1.133 -11.145 4.777 520 HB3 SER 68 HB1 SER 68 1.607 -9.597 5.468 521 HG SER 68 HG SER 68 0.642 -8.629 3.873 522 H TYR 69 HN TYR 69 4.902 -11.850 4.891 523 HA TYR 69 HA TYR 69 6.419 -11.764 6.676 524 HB2 TYR 69 HB2 TYR 69 6.959 -8.926 6.520 525 HB3 TYR 69 HB1 TYR 69 7.960 -10.264 5.974 526 HD1 TYR 69 HD1 TYR 69 6.619 -11.463 3.745 527 HD2 TYR 69 HD2 TYR 69 6.727 -7.324 4.858 528 HE1 TYR 69 HE1 TYR 69 6.152 -10.805 1.399 529 HE2 TYR 69 HE2 TYR 69 6.257 -6.664 2.529 530 HH TYR 69 HH TYR 69 5.537 -9.088 0.050 531 HA PRO 70 HA PRO 70 4.636 -10.058 10.279 532 HB2 PRO 70 HB2 PRO 70 6.689 -8.957 11.695 533 HB3 PRO 70 HB1 PRO 70 6.505 -10.708 11.464 534 HG2 PRO 70 HG2 PRO 70 8.351 -8.810 10.141 535 HG3 PRO 70 HG1 PRO 70 8.581 -10.516 10.546 536 HD2 PRO 70 HD2 PRO 70 7.978 -9.524 8.020 537 HD3 PRO 70 HD1 PRO 70 7.772 -11.209 8.545 538 H VAL 71 HN VAL 71 6.050 -7.853 8.084 539 HA VAL 71 HA VAL 71 5.206 -5.505 9.684 540 HB VAL 71 HB VAL 71 6.387 -4.217 7.982 541 HG11 VAL 71 HG11 VAL 71 8.561 -5.878 8.025 542 HG12 VAL 71 HG12 VAL 71 7.594 -6.545 9.340 543 HG13 VAL 71 HG13 VAL 71 8.076 -4.849 9.372 544 HG21 VAL 71 HG21 VAL 71 7.559 -5.593 6.156 545 HG22 VAL 71 HG22 VAL 71 5.828 -5.318 5.956 546 HG23 VAL 71 HG23 VAL 71 6.411 -6.870 6.555 547 H ALA 72 HN ALA 72 4.551 -6.898 6.437 548 HA ALA 72 HA ALA 72 2.394 -5.160 5.743 549 HB1 ALA 72 HB1 ALA 72 2.214 -7.942 4.867 550 HB2 ALA 72 HB2 ALA 72 3.843 -7.287 4.698 551 HB3 ALA 72 HB3 ALA 72 2.486 -6.487 3.911 552 H ASP 73 HN ASP 73 2.521 -8.362 7.317 553 HA ASP 73 HA ASP 73 -0.293 -8.670 7.682 554 HB2 ASP 73 HB2 ASP 73 2.235 -9.769 8.769 555 HB3 ASP 73 HB1 ASP 73 0.789 -10.058 9.725 556 H ILE 74 HN ILE 74 2.245 -7.558 9.937 557 HA ILE 74 HA ILE 74 0.610 -6.832 12.124 558 HB ILE 74 HB ILE 74 3.173 -5.805 10.911 559 HG12 ILE 74 HG12 ILE 74 2.428 -7.067 13.574 560 HG13 ILE 74 HG11 ILE 74 3.190 -7.895 12.217 561 HG21 ILE 74 HG21 ILE 74 1.514 -4.483 13.032 562 HG22 ILE 74 HG22 ILE 74 2.523 -3.750 11.784 563 HG23 ILE 74 HG23 ILE 74 3.269 -4.475 13.208 564 HD11 ILE 74 HD11 ILE 74 5.235 -7.107 12.766 565 HD12 ILE 74 HD12 ILE 74 4.521 -6.614 14.302 566 HD13 ILE 74 HD13 ILE 74 4.624 -5.465 12.967 567 H LEU 75 HN LEU 75 1.488 -5.041 9.204 568 HA LEU 75 HA LEU 75 0.146 -2.612 9.700 569 HB2 LEU 75 HB2 LEU 75 1.746 -3.406 7.835 570 HB3 LEU 75 HB1 LEU 75 0.304 -4.025 7.030 571 HG LEU 75 HG LEU 75 -0.719 -1.758 7.181 572 HD11 LEU 75 HD11 LEU 75 1.614 -0.216 7.708 573 HD12 LEU 75 HD12 LEU 75 1.496 -1.417 8.993 574 HD13 LEU 75 HD13 LEU 75 0.150 -0.319 8.686 575 HD21 LEU 75 HD21 LEU 75 0.312 -1.109 5.239 576 HD22 LEU 75 HD22 LEU 75 1.164 -2.645 5.399 577 HD23 LEU 75 HD23 LEU 75 1.919 -1.155 5.965 578 H ALA 76 HN ALA 76 -1.056 -5.777 9.044 579 HA ALA 76 HA ALA 76 -3.740 -4.803 8.331 580 HB1 ALA 76 HB1 ALA 76 -4.134 -7.273 8.021 581 HB2 ALA 76 HB2 ALA 76 -2.468 -7.545 8.524 582 HB3 ALA 76 HB3 ALA 76 -2.806 -6.644 7.048 583 H GLU 77 HN GLU 77 -1.956 -6.275 10.980 584 HA GLU 77 HA GLU 77 -4.081 -7.202 12.605 585 HB2 GLU 77 HB2 GLU 77 -1.321 -6.093 13.048 586 HB3 GLU 77 HB1 GLU 77 -2.335 -6.482 14.438 587 HG2 GLU 77 HG2 GLU 77 -2.515 -8.650 12.583 588 HG3 GLU 77 HG1 GLU 77 -0.808 -8.275 12.823 589 H ARG 78 HN ARG 78 -3.041 -3.956 11.846 590 HA ARG 78 HA ARG 78 -5.082 -2.895 13.742 591 HB2 ARG 78 HB2 ARG 78 -3.573 -1.015 14.135 592 HB3 ARG 78 HB1 ARG 78 -2.707 -2.523 14.429 593 HG2 ARG 78 HG2 ARG 78 -2.368 -2.035 11.692 594 HG3 ARG 78 HG1 ARG 78 -2.175 -0.456 12.456 595 HD2 ARG 78 HD2 ARG 78 -0.682 -2.998 13.203 596 HD3 ARG 78 HD1 ARG 78 0.004 -1.563 12.415 597 HE ARG 78 HE ARG 78 -0.930 -0.348 14.555 598 HH11 ARG 78 HH21 ARG 78 -1.008 -3.598 15.106 599 HH12 ARG 78 HH22 ARG 78 0.122 -3.611 16.418 600 HH21 ARG 78 HH11 ARG 78 1.125 -0.329 15.940 601 HH22 ARG 78 HH12 ARG 78 1.328 -1.763 16.888 602 H ASN 79 HN ASN 79 -3.814 -2.930 10.529 603 HA ASN 79 HA ASN 79 -4.352 -1.671 8.589 604 HB2 ASN 79 HB2 ASN 79 -7.126 -1.669 9.750 605 HB3 ASN 79 HB1 ASN 79 -6.616 -2.015 8.101 606 HD21 ASN 79 HD21 ASN 79 -5.495 -4.149 7.747 607 HD22 ASN 79 HD22 ASN 79 -5.835 -5.441 8.791 608 H VAL 80 HN VAL 80 -3.338 0.380 9.133 609 HA VAL 80 HA VAL 80 -5.016 2.457 10.437 610 HB VAL 80 HB VAL 80 -2.964 3.598 10.662 611 HG11 VAL 80 HG11 VAL 80 -1.578 2.084 11.691 612 HG12 VAL 80 HG12 VAL 80 -1.702 0.915 10.376 613 HG13 VAL 80 HG13 VAL 80 -3.026 1.088 11.530 614 HG21 VAL 80 HG21 VAL 80 -1.941 3.961 8.649 615 HG22 VAL 80 HG22 VAL 80 -2.425 2.388 8.019 616 HG23 VAL 80 HG23 VAL 80 -1.012 2.522 9.064 617 HA PRO 81 HA PRO 81 -6.053 4.537 6.648 618 HB2 PRO 81 HB2 PRO 81 -4.548 6.818 6.300 619 HB3 PRO 81 HB1 PRO 81 -5.902 6.701 7.442 620 HG2 PRO 81 HG2 PRO 81 -2.976 6.487 7.950 621 HG3 PRO 81 HG1 PRO 81 -4.229 7.296 8.903 622 HD2 PRO 81 HD2 PRO 81 -3.223 4.900 9.580 623 HD3 PRO 81 HD1 PRO 81 -4.907 5.341 9.923 624 H PHE 82 HN PHE 82 -5.576 3.658 4.673 625 HA PHE 82 HA PHE 82 -3.115 3.966 3.233 626 HB2 PHE 82 HB2 PHE 82 -1.991 1.931 3.735 627 HB3 PHE 82 HB1 PHE 82 -2.449 2.580 5.307 628 HD1 PHE 82 HD2 PHE 82 -5.524 1.867 4.845 629 HD2 PHE 82 HD1 PHE 82 -1.864 -0.363 4.561 630 HE1 PHE 82 HE2 PHE 82 -6.759 -0.206 5.373 631 HE2 PHE 82 HE1 PHE 82 -3.109 -2.445 5.092 632 HZ PHE 82 HZ PHE 82 -5.550 -2.367 5.495 633 H ILE 83 HN ILE 83 -3.072 1.256 2.289 634 HA ILE 83 HA ILE 83 -5.731 0.563 1.280 635 HB ILE 83 HB ILE 83 -3.546 1.838 -0.277 636 HG12 ILE 83 HG12 ILE 83 -5.384 3.283 0.425 637 HG13 ILE 83 HG11 ILE 83 -5.434 3.071 -1.322 638 HG21 ILE 83 HG21 ILE 83 -5.256 -0.385 -1.140 639 HG22 ILE 83 HG22 ILE 83 -3.734 0.188 -1.823 640 HG23 ILE 83 HG23 ILE 83 -5.247 0.992 -2.241 641 HD11 ILE 83 HD11 ILE 83 -7.245 1.917 0.771 642 HD12 ILE 83 HD12 ILE 83 -7.002 1.040 -0.740 643 HD13 ILE 83 HD13 ILE 83 -7.656 2.675 -0.769 644 H PHE 84 HN PHE 84 -5.601 -1.576 0.315 645 HA PHE 84 HA PHE 84 -2.970 -2.916 0.184 646 HB2 PHE 84 HB2 PHE 84 -4.207 -2.845 2.586 647 HB3 PHE 84 HB1 PHE 84 -5.027 -4.242 1.894 648 HD1 PHE 84 HD1 PHE 84 -1.694 -2.847 2.805 649 HD2 PHE 84 HD2 PHE 84 -3.884 -6.340 1.578 650 HE1 PHE 84 HE1 PHE 84 0.273 -4.271 3.326 651 HE2 PHE 84 HE2 PHE 84 -1.913 -7.756 2.100 652 HZ PHE 84 HZ PHE 84 0.162 -6.717 2.958 653 H ALA 85 HN ALA 85 -3.202 -5.056 -0.875 654 HA ALA 85 HA ALA 85 -5.880 -5.755 -1.853 655 HB1 ALA 85 HB1 ALA 85 -4.740 -5.618 -4.264 656 HB2 ALA 85 HB2 ALA 85 -3.759 -4.395 -3.457 657 HB3 ALA 85 HB3 ALA 85 -5.511 -4.209 -3.535 658 H THR 86 HN THR 86 -5.857 -7.971 -1.591 659 HA THR 86 HA THR 86 -3.432 -9.434 -2.565 660 HB THR 86 HB THR 86 -3.075 -10.330 -0.519 661 HG1 THR 86 HG1 THR 86 -4.650 -11.814 -0.649 662 HG21 THR 86 HG21 THR 86 -5.209 -8.333 0.278 663 HG22 THR 86 HG22 THR 86 -3.461 -8.103 0.314 664 HG23 THR 86 HG23 THR 86 -4.226 -9.225 1.439 665 H GLY 87 HN GLY 87 -4.027 -11.883 -2.727 666 HA2 GLY 87 HA2 GLY 87 -5.693 -12.477 -4.762 667 HA3 GLY 87 HA1 GLY 87 -5.517 -13.601 -3.416 668 H TYR 88 HN TYR 88 -6.975 -12.843 -1.428 669 HA TYR 88 HA TYR 88 -9.719 -12.793 -2.487 670 HB2 TYR 88 HB2 TYR 88 -10.191 -12.991 0.052 671 HB3 TYR 88 HB1 TYR 88 -9.338 -14.321 -0.725 672 HD1 TYR 88 HD1 TYR 88 -8.378 -10.962 0.681 673 HD2 TYR 88 HD2 TYR 88 -7.613 -15.185 0.537 674 HE1 TYR 88 HE1 TYR 88 -6.470 -10.670 2.236 675 HE2 TYR 88 HE2 TYR 88 -5.706 -14.895 2.091 676 HH TYR 88 HH TYR 88 -4.629 -13.470 3.430 677 H GLY 89 HN GLY 89 -7.729 -10.307 -2.232 678 HA2 GLY 89 HA2 GLY 89 -8.186 -7.999 -2.124 679 HA3 GLY 89 HA1 GLY 89 -9.875 -8.395 -1.806 680 H SER 90 HN SER 90 -6.860 -9.124 -0.035 681 HA SER 90 HA SER 90 -6.252 -8.640 2.193 682 HB2 SER 90 HB2 SER 90 -7.920 -6.456 1.207 683 HB3 SER 90 HB1 SER 90 -8.048 -6.640 2.954 684 HG SER 90 HG SER 90 -5.799 -6.502 3.078 685 H LYS 91 HN LYS 91 -6.997 -9.045 4.373 686 HA LYS 91 HA LYS 91 -9.141 -10.972 4.555 687 HB2 LYS 91 HB2 LYS 91 -8.408 -11.056 6.895 688 HB3 LYS 91 HB1 LYS 91 -7.003 -10.995 5.829 689 HG2 LYS 91 HG2 LYS 91 -6.313 -9.218 7.043 690 HG3 LYS 91 HG1 LYS 91 -7.615 -8.313 6.271 691 HD2 LYS 91 HD2 LYS 91 -9.052 -8.560 8.093 692 HD3 LYS 91 HD1 LYS 91 -8.224 -10.003 8.679 693 HE2 LYS 91 HE2 LYS 91 -6.211 -8.492 9.169 694 HE3 LYS 91 HE1 LYS 91 -7.307 -7.121 8.898 695 HZ1 LYS 91 HZ1 LYS 91 -8.878 -8.292 10.457 696 HZ2 LYS 91 HZ2 LYS 91 -7.486 -7.639 11.179 697 HZ3 LYS 91 HZ3 LYS 91 -7.589 -9.309 10.880 698 H GLY 92 HN GLY 92 -9.384 -7.688 4.324 699 HA2 GLY 92 HA2 GLY 92 -11.663 -6.718 4.584 700 HA3 GLY 92 HA1 GLY 92 -11.807 -7.637 6.085 701 H LEU 93 HN LEU 93 -8.793 -6.178 5.291 702 HA LEU 93 HA LEU 93 -8.170 -4.895 7.590 703 HB2 LEU 93 HB2 LEU 93 -6.582 -3.825 6.300 704 HB3 LEU 93 HB1 LEU 93 -7.119 -5.056 5.168 705 HG LEU 93 HG LEU 93 -7.786 -2.111 5.199 706 HD11 LEU 93 HD11 LEU 93 -7.236 -3.408 2.660 707 HD12 LEU 93 HD12 LEU 93 -5.953 -3.731 3.826 708 HD13 LEU 93 HD13 LEU 93 -6.387 -2.067 3.431 709 HD21 LEU 93 HD21 LEU 93 -9.814 -2.474 4.297 710 HD22 LEU 93 HD22 LEU 93 -9.612 -4.208 4.496 711 HD23 LEU 93 HD23 LEU 93 -9.077 -3.427 3.015 712 H ASP 94 HN ASP 94 -8.493 -2.850 8.551 713 HA ASP 94 HA ASP 94 -11.011 -1.445 7.731 714 HB2 ASP 94 HB2 ASP 94 -11.259 -0.941 10.078 715 HB3 ASP 94 HB1 ASP 94 -10.818 -2.644 9.972 716 H THR 95 HN THR 95 -10.975 0.914 7.793 717 HA THR 95 HA THR 95 -8.690 2.473 8.536 718 HB THR 95 HB THR 95 -7.546 1.277 6.792 719 HG1 THR 95 HG1 THR 95 -7.160 2.980 5.317 720 HG21 THR 95 HG21 THR 95 -8.578 1.481 4.405 721 HG22 THR 95 HG22 THR 95 -10.085 1.782 5.272 722 HG23 THR 95 HG23 THR 95 -9.218 0.264 5.508 723 H ARG 96 HN ARG 96 -8.713 4.614 7.014 724 HA ARG 96 HA ARG 96 -11.352 5.793 7.303 725 HB2 ARG 96 HB2 ARG 96 -8.654 6.580 6.204 726 HB3 ARG 96 HB1 ARG 96 -10.046 7.633 5.947 727 HG2 ARG 96 HG2 ARG 96 -9.441 6.606 8.709 728 HG3 ARG 96 HG1 ARG 96 -8.559 7.994 8.072 729 HD2 ARG 96 HD2 ARG 96 -11.217 8.564 7.432 730 HD3 ARG 96 HD1 ARG 96 -11.302 7.870 9.064 731 HE ARG 96 HE ARG 96 -9.625 9.546 9.780 732 HH11 ARG 96 HH11 ARG 96 -9.972 9.774 6.435 733 HH12 ARG 96 HH12 ARG 96 -10.039 11.504 6.391 734 HH21 ARG 96 HH21 ARG 96 -10.177 11.849 9.840 735 HH22 ARG 96 HH22 ARG 96 -10.162 12.679 8.320 736 H TYR 97 HN TYR 97 -10.105 3.686 5.024 737 HA TYR 97 HA TYR 97 -11.215 4.924 2.612 738 HB2 TYR 97 HB2 TYR 97 -9.961 2.280 3.360 739 HB3 TYR 97 HB1 TYR 97 -10.559 2.599 1.729 740 HD1 TYR 97 HD1 TYR 97 -8.447 4.191 4.380 741 HD2 TYR 97 HD2 TYR 97 -9.115 3.578 0.187 742 HE1 TYR 97 HE1 TYR 97 -6.367 5.441 3.874 743 HE2 TYR 97 HE2 TYR 97 -7.033 4.828 -0.327 744 HH TYR 97 HH TYR 97 -5.246 6.525 2.169 745 H SER 98 HN SER 98 -12.437 2.893 5.143 746 HA SER 98 HA SER 98 -14.608 1.992 5.424 747 HB2 SER 98 HB2 SER 98 -14.766 4.130 3.507 748 HB3 SER 98 HB1 SER 98 -15.875 2.844 3.032 749 HG SER 98 HG SER 98 -15.970 4.566 5.155 750 H ASN 99 HN ASN 99 -12.414 0.732 3.622 751 HA ASN 99 HA ASN 99 -12.230 -1.264 2.348 752 HB2 ASN 99 HB2 ASN 99 -14.794 -1.347 3.876 753 HB3 ASN 99 HB1 ASN 99 -14.539 -2.598 2.659 754 HD21 ASN 99 HD21 ASN 99 -11.676 -1.291 4.160 755 HD22 ASN 99 HD22 ASN 99 -11.379 -2.604 5.193 756 H ILE 100 HN ILE 100 -12.185 -0.339 0.178 757 HA ILE 100 HA ILE 100 -14.631 -0.896 -1.353 758 HB ILE 100 HB ILE 100 -13.993 1.673 -2.267 759 HG12 ILE 100 HG12 ILE 100 -13.547 1.497 0.690 760 HG13 ILE 100 HG11 ILE 100 -12.932 2.663 -0.449 761 HG21 ILE 100 HG21 ILE 100 -16.198 0.775 -0.393 762 HG22 ILE 100 HG22 ILE 100 -16.191 0.560 -2.144 763 HG23 ILE 100 HG23 ILE 100 -16.246 2.183 -1.456 764 HD11 ILE 100 HD11 ILE 100 -15.412 2.705 1.134 765 HD12 ILE 100 HD12 ILE 100 -15.532 3.325 -0.508 766 HD13 ILE 100 HD13 ILE 100 -14.374 4.031 0.615 767 HA PRO 101 HA PRO 101 -11.277 0.029 -4.601 768 HB2 PRO 101 HB2 PRO 101 -8.977 1.288 -3.828 769 HB3 PRO 101 HB1 PRO 101 -10.428 2.154 -4.338 770 HG2 PRO 101 HG2 PRO 101 -9.437 1.618 -1.595 771 HG3 PRO 101 HG1 PRO 101 -10.163 3.086 -2.265 772 HD2 PRO 101 HD2 PRO 101 -11.559 1.344 -0.733 773 HD3 PRO 101 HD1 PRO 101 -12.298 2.306 -2.030 774 H LEU 102 HN LEU 102 -10.786 -1.329 -1.573 775 HA LEU 102 HA LEU 102 -8.139 -2.421 -1.945 776 HB2 LEU 102 HB2 LEU 102 -10.531 -2.940 -0.192 777 HB3 LEU 102 HB1 LEU 102 -9.174 -4.056 -0.140 778 HG LEU 102 HG LEU 102 -7.953 -2.631 1.121 779 HD11 LEU 102 HD11 LEU 102 -8.809 -0.442 -0.792 780 HD12 LEU 102 HD12 LEU 102 -7.260 -1.285 -0.766 781 HD13 LEU 102 HD13 LEU 102 -7.694 -0.197 0.550 782 HD21 LEU 102 HD21 LEU 102 -9.180 -0.992 2.389 783 HD22 LEU 102 HD22 LEU 102 -10.280 -2.329 2.051 784 HD23 LEU 102 HD23 LEU 102 -10.390 -0.838 1.116 785 H LEU 103 HN LEU 103 -7.533 -4.457 -2.851 786 HA LEU 103 HA LEU 103 -9.494 -6.472 -3.596 787 HB2 LEU 103 HB2 LEU 103 -8.902 -5.870 -6.182 788 HB3 LEU 103 HB1 LEU 103 -10.311 -5.249 -5.347 789 HG LEU 103 HG LEU 103 -9.199 -3.169 -4.866 790 HD11 LEU 103 HD11 LEU 103 -6.976 -3.158 -4.517 791 HD12 LEU 103 HD12 LEU 103 -6.756 -3.310 -6.260 792 HD13 LEU 103 HD13 LEU 103 -6.813 -4.751 -5.253 793 HD21 LEU 103 HD21 LEU 103 -9.691 -4.119 -7.466 794 HD22 LEU 103 HD22 LEU 103 -8.168 -3.238 -7.565 795 HD23 LEU 103 HD23 LEU 103 -9.613 -2.435 -6.950 796 H THR 104 HN THR 104 -7.915 -7.217 -6.093 797 HA THR 104 HA THR 104 -5.438 -8.145 -4.718 798 HB THR 104 HB THR 104 -7.041 -9.940 -5.029 799 HG1 THR 104 HG1 THR 104 -4.741 -10.157 -5.776 800 HG21 THR 104 HG21 THR 104 -7.564 -10.325 -7.645 801 HG22 THR 104 HG22 THR 104 -7.423 -8.566 -7.633 802 HG23 THR 104 HG23 THR 104 -8.605 -9.363 -6.595 803 H LYS 105 HN LYS 105 -5.568 -5.711 -6.240 804 HA LYS 105 HA LYS 105 -4.276 -4.636 -7.903 805 HB2 LYS 105 HB2 LYS 105 -2.976 -7.083 -7.110 806 HB3 LYS 105 HB1 LYS 105 -2.694 -6.802 -8.831 807 HG2 LYS 105 HG2 LYS 105 -1.414 -4.968 -8.440 808 HG3 LYS 105 HG1 LYS 105 -2.484 -4.382 -7.169 809 HD2 LYS 105 HD2 LYS 105 -0.558 -4.944 -5.966 810 HD3 LYS 105 HD1 LYS 105 -1.559 -6.381 -5.788 811 HE2 LYS 105 HE2 LYS 105 0.897 -6.792 -6.464 812 HE3 LYS 105 HE1 LYS 105 -0.330 -7.560 -7.487 813 HZ1 LYS 105 HZ1 LYS 105 1.541 -6.080 -8.534 814 HZ2 LYS 105 HZ2 LYS 105 0.483 -4.819 -8.112 815 HZ3 LYS 105 HZ3 LYS 105 -0.038 -6.059 -9.151 816 HA PRO 106 HA PRO 106 -6.677 -7.157 -11.127 817 HB2 PRO 106 HB2 PRO 106 -9.120 -5.928 -11.016 818 HB3 PRO 106 HB1 PRO 106 -8.727 -7.368 -10.057 819 HG2 PRO 106 HG2 PRO 106 -8.841 -4.520 -9.231 820 HG3 PRO 106 HG1 PRO 106 -9.294 -5.975 -8.334 821 HD2 PRO 106 HD2 PRO 106 -6.953 -4.592 -7.954 822 HD3 PRO 106 HD1 PRO 106 -7.186 -6.310 -7.562 823 H PHE 107 HN PHE 107 -5.858 -3.994 -10.288 824 HA PHE 107 HA PHE 107 -5.526 -2.022 -11.526 825 HB2 PHE 107 HB2 PHE 107 -5.172 -4.339 -13.400 826 HB3 PHE 107 HB1 PHE 107 -5.054 -2.693 -14.035 827 HD1 PHE 107 HD2 PHE 107 -3.485 -1.050 -12.860 828 HD2 PHE 107 HD1 PHE 107 -3.376 -5.288 -12.169 829 HE1 PHE 107 HE2 PHE 107 -1.220 -0.832 -11.880 830 HE2 PHE 107 HE1 PHE 107 -1.111 -5.071 -11.185 831 HZ PHE 107 HZ PHE 107 -0.027 -2.836 -11.043 832 H LEU 108 HN LEU 108 -6.456 -0.772 -13.539 833 HA LEU 108 HA LEU 108 -8.415 0.156 -14.499 834 HB2 LEU 108 HB2 LEU 108 -9.157 -2.791 -14.509 835 HB3 LEU 108 HB1 LEU 108 -9.854 -1.542 -15.545 836 HG LEU 108 HG LEU 108 -6.893 -1.768 -15.563 837 HD11 LEU 108 HD11 LEU 108 -8.758 -3.888 -16.630 838 HD12 LEU 108 HD12 LEU 108 -7.300 -4.098 -15.660 839 HD13 LEU 108 HD13 LEU 108 -7.172 -3.605 -17.349 840 HD21 LEU 108 HD21 LEU 108 -9.105 -1.284 -17.570 841 HD22 LEU 108 HD22 LEU 108 -7.417 -1.469 -18.049 842 HD23 LEU 108 HD23 LEU 108 -7.894 -0.138 -16.994 843 H ASP 109 HN ASP 109 -9.182 1.245 -12.629 844 HA ASP 109 HA ASP 109 -10.942 1.759 -11.123 845 HB2 ASP 109 HB2 ASP 109 -12.844 0.566 -11.460 846 HB3 ASP 109 HB1 ASP 109 -11.921 -0.375 -12.624 847 H SER 110 HN SER 110 -8.317 -0.061 -10.765 848 HA SER 110 HA SER 110 -8.821 -1.189 -8.088 849 HB2 SER 110 HB2 SER 110 -7.418 -2.291 -9.820 850 HB3 SER 110 HB1 SER 110 -6.318 -0.915 -9.786 851 HG SER 110 HG SER 110 -5.484 -2.417 -8.403 852 H GLU 111 HN GLU 111 -5.688 0.026 -8.179 853 HA GLU 111 HA GLU 111 -5.706 1.605 -5.936 854 HB2 GLU 111 HB2 GLU 111 -4.103 1.273 -8.323 855 HB3 GLU 111 HB1 GLU 111 -4.062 2.956 -7.797 856 HG2 GLU 111 HG2 GLU 111 -3.519 2.179 -5.489 857 HG3 GLU 111 HG1 GLU 111 -3.439 0.526 -6.098 858 H LEU 112 HN LEU 112 -6.774 2.572 -9.160 859 HA LEU 112 HA LEU 112 -7.037 5.352 -8.869 860 HB2 LEU 112 HB2 LEU 112 -8.943 3.368 -10.159 861 HB3 LEU 112 HB1 LEU 112 -8.826 5.088 -10.555 862 HG LEU 112 HG LEU 112 -6.293 3.560 -10.585 863 HD11 LEU 112 HD11 LEU 112 -7.424 1.890 -11.763 864 HD12 LEU 112 HD12 LEU 112 -6.949 2.972 -13.073 865 HD13 LEU 112 HD13 LEU 112 -8.595 3.021 -12.440 866 HD21 LEU 112 HD21 LEU 112 -7.484 5.970 -11.725 867 HD22 LEU 112 HD22 LEU 112 -6.624 5.022 -12.938 868 HD23 LEU 112 HD23 LEU 112 -5.782 5.568 -11.487 869 H GLU 113 HN GLU 113 -9.472 2.860 -8.055 870 HA GLU 113 HA GLU 113 -11.367 4.571 -6.800 871 HB2 GLU 113 HB2 GLU 113 -10.498 1.680 -6.506 872 HB3 GLU 113 HB1 GLU 113 -11.796 2.336 -5.500 873 HG2 GLU 113 HG2 GLU 113 -11.956 2.901 -8.412 874 HG3 GLU 113 HG1 GLU 113 -12.266 1.239 -7.904 875 H ALA 114 HN ALA 114 -8.278 3.291 -5.781 876 HA ALA 114 HA ALA 114 -8.556 3.701 -2.947 877 HB1 ALA 114 HB1 ALA 114 -6.332 3.044 -2.959 878 HB2 ALA 114 HB2 ALA 114 -5.936 4.066 -4.340 879 HB3 ALA 114 HB3 ALA 114 -6.770 2.531 -4.588 880 H VAL 115 HN VAL 115 -8.091 5.863 -5.603 881 HA VAL 115 HA VAL 115 -7.236 8.063 -3.761 882 HB VAL 115 HB VAL 115 -7.355 8.000 -6.790 883 HG11 VAL 115 HG11 VAL 115 -5.330 9.550 -5.284 884 HG12 VAL 115 HG12 VAL 115 -6.996 10.104 -5.113 885 HG13 VAL 115 HG13 VAL 115 -6.261 10.000 -6.713 886 HG21 VAL 115 HG21 VAL 115 -4.860 7.519 -5.165 887 HG22 VAL 115 HG22 VAL 115 -5.161 7.147 -6.862 888 HG23 VAL 115 HG23 VAL 115 -5.909 6.170 -5.601 889 H LEU 116 HN LEU 116 -9.905 6.906 -5.666 890 HA LEU 116 HA LEU 116 -11.257 9.540 -5.702 891 HB2 LEU 116 HB2 LEU 116 -11.634 6.825 -6.906 892 HB3 LEU 116 HB1 LEU 116 -12.980 7.962 -6.891 893 HG LEU 116 HG LEU 116 -10.672 9.402 -7.711 894 HD11 LEU 116 HD11 LEU 116 -10.868 7.559 -9.885 895 HD12 LEU 116 HD12 LEU 116 -10.534 6.632 -8.423 896 HD13 LEU 116 HD13 LEU 116 -9.450 7.936 -8.906 897 HD21 LEU 116 HD21 LEU 116 -13.358 9.157 -8.347 898 HD22 LEU 116 HD22 LEU 116 -12.558 8.566 -9.803 899 HD23 LEU 116 HD23 LEU 116 -12.202 10.183 -9.197 900 H VAL 117 HN VAL 117 -12.085 6.237 -4.642 901 HA VAL 117 HA VAL 117 -14.520 6.850 -3.337 902 HB VAL 117 HB VAL 117 -13.441 4.645 -4.066 903 HG11 VAL 117 HG11 VAL 117 -11.480 5.421 -2.310 904 HG12 VAL 117 HG12 VAL 117 -11.704 3.789 -2.936 905 HG13 VAL 117 HG13 VAL 117 -12.384 4.232 -1.370 906 HG21 VAL 117 HG21 VAL 117 -15.507 4.423 -2.975 907 HG22 VAL 117 HG22 VAL 117 -14.884 5.084 -1.463 908 HG23 VAL 117 HG23 VAL 117 -14.429 3.459 -1.971 909 H GLN 118 HN GLN 118 -11.251 7.376 -2.194 910 HA GLN 118 HA GLN 118 -12.054 7.406 0.627 911 HB2 GLN 118 HB2 GLN 118 -9.625 8.163 0.856 912 HB3 GLN 118 HB1 GLN 118 -9.875 6.586 0.108 913 HG2 GLN 118 HG2 GLN 118 -9.396 7.386 -2.041 914 HG3 GLN 118 HG1 GLN 118 -9.705 9.065 -1.589 915 HE21 GLN 118 HE21 GLN 118 -7.471 9.454 -2.517 916 HE22 GLN 118 HE22 GLN 118 -6.123 9.164 -1.527 917 H ILE 119 HN ILE 119 -13.540 9.293 -0.927 918 HA ILE 119 HA ILE 119 -12.338 11.944 -0.366 919 HB ILE 119 HB ILE 119 -14.373 12.744 -1.506 920 HG12 ILE 119 HG12 ILE 119 -15.202 9.830 -1.669 921 HG13 ILE 119 HG11 ILE 119 -15.857 10.957 -0.480 922 HG21 ILE 119 HG21 ILE 119 -12.532 10.762 -2.622 923 HG22 ILE 119 HG22 ILE 119 -13.078 12.295 -3.301 924 HG23 ILE 119 HG23 ILE 119 -14.058 10.843 -3.503 925 HD11 ILE 119 HD11 ILE 119 -15.965 12.190 -3.070 926 HD12 ILE 119 HD12 ILE 119 -17.302 11.760 -2.005 927 HD13 ILE 119 HD13 ILE 119 -16.696 10.588 -3.174 928 H SER 120 HN SER 120 -14.573 9.653 0.979 929 HA SER 120 HA SER 120 -14.692 10.606 3.594 930 HB2 SER 120 HB2 SER 120 -16.171 12.277 1.675 931 HB3 SER 120 HB1 SER 120 -17.142 11.778 3.058 932 HG SER 120 HG SER 120 -16.131 13.415 3.948 933 H LYS 121 HN LYS 121 -17.712 10.415 1.805 934 HA LYS 121 HA LYS 121 -19.291 8.657 1.556 935 HB2 LYS 121 HB2 LYS 121 -16.960 7.340 1.540 936 HB3 LYS 121 HB1 LYS 121 -17.555 6.778 3.104 937 HG2 LYS 121 HG2 LYS 121 -19.791 6.362 1.777 938 HG3 LYS 121 HG1 LYS 121 -18.726 6.353 0.372 939 HD2 LYS 121 HD2 LYS 121 -18.833 4.084 1.062 940 HD3 LYS 121 HD1 LYS 121 -17.288 4.669 1.681 941 HE2 LYS 121 HE2 LYS 121 -18.308 3.492 3.506 942 HE3 LYS 121 HE1 LYS 121 -18.562 5.212 3.860 943 HZ1 LYS 121 HZ1 LYS 121 -20.722 4.648 3.936 944 HZ2 LYS 121 HZ2 LYS 121 -20.485 3.190 3.097 945 HZ3 LYS 121 HZ3 LYS 121 -20.638 4.650 2.242 946 H GLU 122 HN GLU 122 -20.490 9.996 3.124 947 HA GLU 122 HA GLU 122 -21.493 10.466 5.221 948 HB2 GLU 122 HB2 GLU 122 -22.547 8.374 6.107 949 HB3 GLU 122 HB1 GLU 122 -22.741 8.543 4.363 950 HG2 GLU 122 HG2 GLU 122 -20.995 6.953 3.934 951 HG3 GLU 122 HG1 GLU 122 -20.503 6.950 5.629 952 H VAL 123 HN VAL 123 -18.578 10.168 5.206 953 HA VAL 123 HA VAL 123 -16.885 10.214 6.806 954 HB VAL 123 HB VAL 123 -19.086 9.680 8.779 955 HG11 VAL 123 HG11 VAL 123 -17.067 9.644 9.952 956 HG12 VAL 123 HG12 VAL 123 -17.540 11.338 10.082 957 HG13 VAL 123 HG13 VAL 123 -16.328 10.849 8.898 958 HG21 VAL 123 HG21 VAL 123 -20.010 11.676 8.289 959 HG22 VAL 123 HG22 VAL 123 -18.912 11.804 6.915 960 HG23 VAL 123 HG23 VAL 123 -18.446 12.468 8.480 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 11.802 8.332 11.711 2 H2 GLY 1 HT2 GLY 1 10.336 8.957 12.301 3 H3 GLY 1 HT3 GLY 1 10.370 7.442 11.533 4 HA2 GLY 1 HA2 GLY 1 10.717 6.436 13.456 5 HA3 GLY 1 HA1 GLY 1 12.202 7.370 13.647 6 H SER 2 HN SER 2 12.088 8.105 15.744 7 HA SER 2 HA SER 2 9.538 9.071 16.868 8 HB2 SER 2 HB2 SER 2 10.934 7.834 18.338 9 HB3 SER 2 HB1 SER 2 12.380 8.699 17.824 10 HG SER 2 HG SER 2 11.952 10.171 19.257 11 H HIS 3 HN HIS 3 11.859 10.402 14.876 12 HA HIS 3 HA HIS 3 12.366 12.977 16.010 13 HB2 HIS 3 HB2 HIS 3 12.448 11.627 13.360 14 HB3 HIS 3 HB1 HIS 3 12.431 13.390 13.331 15 HD1 HIS 3 HD1 HIS 3 14.397 14.617 14.630 16 HD2 HIS 3 HD2 HIS 3 14.864 10.492 14.231 17 HE1 HIS 3 HE1 HIS 3 16.817 14.115 15.176 18 H MET 4 HN MET 4 11.450 14.794 14.070 19 HA MET 4 HA MET 4 8.750 15.284 14.994 20 HB2 MET 4 HB2 MET 4 10.750 16.838 14.240 21 HB3 MET 4 HB1 MET 4 10.015 16.683 12.652 22 HG2 MET 4 HG2 MET 4 8.691 17.699 15.177 23 HG3 MET 4 HG1 MET 4 9.066 18.632 13.729 24 HE1 MET 4 HE1 MET 4 6.877 17.477 15.750 25 HE2 MET 4 HE2 MET 4 5.838 16.205 15.111 26 HE3 MET 4 HE3 MET 4 5.412 17.895 14.851 27 H THR 5 HN THR 5 9.276 15.703 11.526 28 HA THR 5 HA THR 5 7.367 13.461 11.013 29 HB THR 5 HB THR 5 6.473 15.135 9.235 30 HG1 THR 5 HG1 THR 5 8.331 16.555 9.696 31 HG21 THR 5 HG21 THR 5 4.828 14.983 10.776 32 HG22 THR 5 HG22 THR 5 5.482 16.475 11.450 33 HG23 THR 5 HG23 THR 5 5.980 14.918 12.110 34 H GLU 6 HN GLU 6 7.565 12.574 8.833 35 HA GLU 6 HA GLU 6 9.506 13.514 6.934 36 HB2 GLU 6 HB2 GLU 6 11.195 11.693 7.374 37 HB3 GLU 6 HB1 GLU 6 11.085 12.889 8.665 38 HG2 GLU 6 HG2 GLU 6 9.637 11.402 9.963 39 HG3 GLU 6 HG1 GLU 6 9.647 10.219 8.656 40 H ARG 7 HN ARG 7 6.827 12.476 6.876 41 HA ARG 7 HA ARG 7 7.009 10.570 4.724 42 HB2 ARG 7 HB2 ARG 7 5.690 8.846 6.386 43 HB3 ARG 7 HB1 ARG 7 7.421 8.760 6.073 44 HG2 ARG 7 HG2 ARG 7 7.971 9.561 8.151 45 HG3 ARG 7 HG1 ARG 7 6.568 10.625 8.230 46 HD2 ARG 7 HD2 ARG 7 6.368 7.604 8.457 47 HD3 ARG 7 HD1 ARG 7 6.461 8.693 9.857 48 HE ARG 7 HE ARG 7 4.241 8.651 7.867 49 HH11 ARG 7 HH11 ARG 7 5.200 11.280 9.313 50 HH12 ARG 7 HH12 ARG 7 3.991 11.378 10.548 51 HH21 ARG 7 HH21 ARG 7 2.878 8.126 10.086 52 HH22 ARG 7 HH22 ARG 7 2.678 9.591 10.988 53 H ARG 8 HN ARG 8 5.597 13.046 5.436 54 HA ARG 8 HA ARG 8 2.842 12.547 6.083 55 HB2 ARG 8 HB2 ARG 8 4.564 14.717 5.043 56 HB3 ARG 8 HB1 ARG 8 2.859 14.850 4.612 57 HG2 ARG 8 HG2 ARG 8 2.290 15.430 6.713 58 HG3 ARG 8 HG1 ARG 8 3.180 14.066 7.391 59 HD2 ARG 8 HD2 ARG 8 4.669 15.583 8.184 60 HD3 ARG 8 HD1 ARG 8 5.167 15.847 6.501 61 HE ARG 8 HE ARG 8 3.034 17.424 7.888 62 HH11 ARG 8 HH11 ARG 8 5.917 18.289 7.000 63 HH12 ARG 8 HH12 ARG 8 5.513 19.273 5.633 64 HH21 ARG 8 HH21 ARG 8 2.252 18.114 5.426 65 HH22 ARG 8 HH22 ARG 8 3.437 19.180 4.747 66 H LEU 9 HN LEU 9 4.668 12.097 3.168 67 HA LEU 9 HA LEU 9 2.178 11.322 1.764 68 HB2 LEU 9 HB2 LEU 9 3.191 12.494 -0.272 69 HB3 LEU 9 HB1 LEU 9 2.617 13.557 1.010 70 HG LEU 9 HG LEU 9 5.333 12.813 1.571 71 HD11 LEU 9 HD11 LEU 9 5.590 12.390 -0.815 72 HD12 LEU 9 HD12 LEU 9 6.389 13.910 -0.415 73 HD13 LEU 9 HD13 LEU 9 4.811 13.924 -1.203 74 HD21 LEU 9 HD21 LEU 9 4.620 15.527 0.561 75 HD22 LEU 9 HD22 LEU 9 5.504 15.066 2.015 76 HD23 LEU 9 HD23 LEU 9 3.745 14.952 1.981 77 H ARG 10 HN ARG 10 2.820 9.090 2.019 78 HA ARG 10 HA ARG 10 4.966 8.280 0.142 79 HB2 ARG 10 HB2 ARG 10 5.198 8.428 3.013 80 HB3 ARG 10 HB1 ARG 10 5.348 6.749 2.493 81 HG2 ARG 10 HG2 ARG 10 6.989 9.120 1.581 82 HG3 ARG 10 HG1 ARG 10 7.556 7.668 2.406 83 HD2 ARG 10 HD2 ARG 10 6.161 6.868 0.018 84 HD3 ARG 10 HD1 ARG 10 7.375 8.090 -0.403 85 HE ARG 10 HE ARG 10 7.928 5.444 0.762 86 HH11 ARG 10 HH21 ARG 10 9.036 8.619 1.183 87 HH12 ARG 10 HH22 ARG 10 10.698 8.247 0.876 88 HH21 ARG 10 HH11 ARG 10 10.074 4.975 -0.074 89 HH22 ARG 10 HH12 ARG 10 11.286 6.189 0.166 90 H VAL 11 HN VAL 11 4.410 6.411 -0.911 91 HA VAL 11 HA VAL 11 2.292 4.673 0.319 92 HB VAL 11 HB VAL 11 1.248 5.972 -1.397 93 HG11 VAL 11 HG11 VAL 11 3.644 5.286 -3.133 94 HG12 VAL 11 HG12 VAL 11 3.360 6.849 -2.370 95 HG13 VAL 11 HG13 VAL 11 2.262 6.267 -3.622 96 HG21 VAL 11 HG21 VAL 11 2.162 3.449 -2.804 97 HG22 VAL 11 HG22 VAL 11 0.635 4.305 -3.021 98 HG23 VAL 11 HG23 VAL 11 0.959 3.446 -1.515 99 H LEU 12 HN LEU 12 3.445 2.796 0.813 100 HA LEU 12 HA LEU 12 5.569 1.897 -1.068 101 HB2 LEU 12 HB2 LEU 12 4.749 0.635 1.552 102 HB3 LEU 12 HB1 LEU 12 6.337 0.627 0.786 103 HG LEU 12 HG LEU 12 4.955 3.086 1.902 104 HD11 LEU 12 HD11 LEU 12 6.267 2.889 3.808 105 HD12 LEU 12 HD12 LEU 12 7.480 1.899 2.997 106 HD13 LEU 12 HD13 LEU 12 5.932 1.195 3.459 107 HD21 LEU 12 HD21 LEU 12 7.700 3.526 1.599 108 HD22 LEU 12 HD22 LEU 12 6.423 4.168 0.565 109 HD23 LEU 12 HD23 LEU 12 7.234 2.662 0.133 110 H VAL 13 HN VAL 13 4.327 0.974 -2.807 111 HA VAL 13 HA VAL 13 2.420 -1.211 -2.062 112 HB VAL 13 HB VAL 13 1.482 -0.908 -4.172 113 HG11 VAL 13 HG11 VAL 13 1.191 1.473 -4.523 114 HG12 VAL 13 HG12 VAL 13 2.689 1.816 -3.659 115 HG13 VAL 13 HG13 VAL 13 1.298 1.169 -2.790 116 HG21 VAL 13 HG21 VAL 13 4.103 0.267 -5.045 117 HG22 VAL 13 HG22 VAL 13 2.682 0.187 -6.070 118 HG23 VAL 13 HG23 VAL 13 3.458 -1.296 -5.512 119 H VAL 14 HN VAL 14 2.797 -3.344 -2.998 120 HA VAL 14 HA VAL 14 5.365 -3.775 -4.346 121 HB VAL 14 HB VAL 14 4.916 -3.697 -1.471 122 HG11 VAL 14 HG11 VAL 14 6.817 -5.621 -1.371 123 HG12 VAL 14 HG12 VAL 14 5.802 -6.232 -2.675 124 HG13 VAL 14 HG13 VAL 14 5.102 -5.916 -1.091 125 HG21 VAL 14 HG21 VAL 14 7.637 -3.913 -1.993 126 HG22 VAL 14 HG22 VAL 14 6.717 -2.414 -1.861 127 HG23 VAL 14 HG23 VAL 14 6.982 -3.148 -3.442 128 H GLU 15 HN GLU 15 5.638 -5.904 -5.043 129 HA GLU 15 HA GLU 15 3.993 -8.148 -4.292 130 HB2 GLU 15 HB2 GLU 15 2.456 -8.168 -6.093 131 HB3 GLU 15 HB1 GLU 15 2.487 -6.477 -5.591 132 HG2 GLU 15 HG2 GLU 15 3.074 -5.905 -7.685 133 HG3 GLU 15 HG1 GLU 15 4.577 -6.803 -7.490 134 H ASP 16 HN ASP 16 4.468 -10.010 -5.943 135 HA ASP 16 HA ASP 16 7.304 -9.920 -6.565 136 HB2 ASP 16 HB2 ASP 16 6.860 -12.273 -7.237 137 HB3 ASP 16 HB1 ASP 16 6.244 -11.890 -5.627 138 H GLU 17 HN GLU 17 6.978 -8.101 -8.233 139 HA GLU 17 HA GLU 17 7.271 -9.155 -10.859 140 HB2 GLU 17 HB2 GLU 17 4.571 -8.812 -9.871 141 HB3 GLU 17 HB1 GLU 17 4.833 -7.843 -11.319 142 HG2 GLU 17 HG2 GLU 17 4.802 -9.683 -12.618 143 HG3 GLU 17 HG1 GLU 17 6.036 -10.458 -11.623 144 H SER 18 HN SER 18 7.351 -7.428 -12.539 145 HA SER 18 HA SER 18 8.334 -4.885 -11.380 146 HB2 SER 18 HB2 SER 18 9.545 -6.262 -13.117 147 HB3 SER 18 HB1 SER 18 8.244 -5.890 -14.243 148 HG SER 18 HG SER 18 9.588 -4.268 -14.619 149 H MET 19 HN MET 19 5.516 -6.143 -12.956 150 HA MET 19 HA MET 19 4.507 -3.892 -14.336 151 HB2 MET 19 HB2 MET 19 3.667 -6.445 -13.490 152 HB3 MET 19 HB1 MET 19 2.473 -5.325 -12.836 153 HG2 MET 19 HG2 MET 19 1.582 -4.982 -14.876 154 HG3 MET 19 HG1 MET 19 3.164 -4.587 -15.550 155 HE1 MET 19 HE1 MET 19 4.923 -6.622 -16.517 156 HE2 MET 19 HE2 MET 19 3.851 -5.486 -17.332 157 HE3 MET 19 HE3 MET 19 3.899 -7.168 -17.854 158 H ILE 20 HN ILE 20 5.041 -4.333 -10.956 159 HA ILE 20 HA ILE 20 3.142 -2.172 -10.201 160 HB ILE 20 HB ILE 20 3.275 -4.274 -8.913 161 HG12 ILE 20 HG12 ILE 20 4.423 -1.983 -7.301 162 HG13 ILE 20 HG11 ILE 20 2.746 -2.021 -7.857 163 HG21 ILE 20 HG21 ILE 20 5.651 -4.790 -9.300 164 HG22 ILE 20 HG22 ILE 20 5.288 -4.776 -7.580 165 HG23 ILE 20 HG23 ILE 20 6.116 -3.404 -8.317 166 HD11 ILE 20 HD11 ILE 20 2.596 -2.943 -5.701 167 HD12 ILE 20 HD12 ILE 20 4.114 -3.824 -5.868 168 HD13 ILE 20 HD13 ILE 20 2.676 -4.373 -6.729 169 H ALA 21 HN ALA 21 6.200 -2.299 -11.396 170 HA ALA 21 HA ALA 21 7.442 -0.340 -9.561 171 HB1 ALA 21 HB1 ALA 21 9.105 -1.686 -10.327 172 HB2 ALA 21 HB2 ALA 21 9.056 -0.673 -11.772 173 HB3 ALA 21 HB3 ALA 21 8.163 -2.193 -11.727 174 H MET 22 HN MET 22 7.587 -0.222 -13.111 175 HA MET 22 HA MET 22 7.464 2.610 -13.272 176 HB2 MET 22 HB2 MET 22 8.248 1.251 -15.115 177 HB3 MET 22 HB1 MET 22 6.713 0.388 -15.198 178 HG2 MET 22 HG2 MET 22 6.111 1.891 -16.771 179 HG3 MET 22 HG1 MET 22 5.962 3.050 -15.450 180 HE1 MET 22 HE1 MET 22 8.300 1.134 -17.534 181 HE2 MET 22 HE2 MET 22 9.624 2.194 -18.007 182 HE3 MET 22 HE3 MET 22 8.068 2.325 -18.821 183 H LEU 23 HN LEU 23 4.981 0.253 -12.796 184 HA LEU 23 HA LEU 23 2.693 1.764 -13.661 185 HB2 LEU 23 HB2 LEU 23 2.578 -0.610 -13.277 186 HB3 LEU 23 HB1 LEU 23 3.230 -0.443 -11.650 187 HG LEU 23 HG LEU 23 0.704 -0.841 -11.861 188 HD11 LEU 23 HD11 LEU 23 0.694 1.573 -10.320 189 HD12 LEU 23 HD12 LEU 23 2.249 0.772 -10.094 190 HD13 LEU 23 HD13 LEU 23 0.752 -0.093 -9.746 191 HD21 LEU 23 HD21 LEU 23 0.897 1.305 -13.618 192 HD22 LEU 23 HD22 LEU 23 0.209 2.025 -12.163 193 HD23 LEU 23 HD23 LEU 23 -0.595 0.659 -12.938 194 H ILE 24 HN ILE 24 4.941 2.239 -11.156 195 HA ILE 24 HA ILE 24 3.027 3.732 -9.444 196 HB ILE 24 HB ILE 24 4.919 1.894 -8.867 197 HG12 ILE 24 HG12 ILE 24 4.764 4.067 -6.861 198 HG13 ILE 24 HG11 ILE 24 3.212 3.491 -7.471 199 HG21 ILE 24 HG21 ILE 24 6.847 3.141 -9.573 200 HG22 ILE 24 HG22 ILE 24 6.843 3.147 -7.812 201 HG23 ILE 24 HG23 ILE 24 6.313 4.575 -8.697 202 HD11 ILE 24 HD11 ILE 24 3.558 1.994 -5.733 203 HD12 ILE 24 HD12 ILE 24 5.310 2.012 -5.932 204 HD13 ILE 24 HD13 ILE 24 4.303 1.114 -7.067 205 H GLU 25 HN GLU 25 6.250 4.153 -10.992 206 HA GLU 25 HA GLU 25 6.793 6.817 -10.416 207 HB2 GLU 25 HB2 GLU 25 7.133 5.101 -12.869 208 HB3 GLU 25 HB1 GLU 25 7.681 6.778 -12.884 209 HG2 GLU 25 HG2 GLU 25 8.650 5.836 -10.463 210 HG3 GLU 25 HG1 GLU 25 8.852 4.450 -11.538 211 H ASP 26 HN ASP 26 4.328 5.533 -12.548 212 HA ASP 26 HA ASP 26 3.651 8.149 -13.690 213 HB2 ASP 26 HB2 ASP 26 2.307 6.851 -15.089 214 HB3 ASP 26 HB1 ASP 26 3.474 5.635 -14.575 215 H THR 27 HN THR 27 2.122 5.838 -11.405 216 HA THR 27 HA THR 27 -0.092 7.502 -10.715 217 HB THR 27 HB THR 27 1.413 5.353 -9.245 218 HG1 THR 27 HG1 THR 27 0.092 4.017 -10.238 219 HG21 THR 27 HG21 THR 27 -0.325 7.119 -8.087 220 HG22 THR 27 HG22 THR 27 -0.045 5.475 -7.513 221 HG23 THR 27 HG23 THR 27 -1.410 5.818 -8.576 222 H LEU 28 HN LEU 28 3.156 7.098 -9.325 223 HA LEU 28 HA LEU 28 2.893 8.896 -7.123 224 HB2 LEU 28 HB2 LEU 28 4.754 7.350 -7.365 225 HB3 LEU 28 HB1 LEU 28 5.225 8.092 -8.894 226 HG LEU 28 HG LEU 28 5.036 9.985 -6.644 227 HD11 LEU 28 HD11 LEU 28 6.131 7.565 -5.966 228 HD12 LEU 28 HD12 LEU 28 6.590 9.104 -5.237 229 HD13 LEU 28 HD13 LEU 28 7.545 8.436 -6.561 230 HD21 LEU 28 HD21 LEU 28 6.350 9.692 -9.161 231 HD22 LEU 28 HD22 LEU 28 7.598 9.843 -7.924 232 HD23 LEU 28 HD23 LEU 28 6.364 11.092 -8.089 233 H CYS 29 HN CYS 29 3.751 9.403 -10.536 234 HA CYS 29 HA CYS 29 4.580 12.057 -10.551 235 HB2 CYS 29 HB2 CYS 29 4.506 11.473 -12.735 236 HB3 CYS 29 HB1 CYS 29 3.501 10.087 -12.341 237 HG CYS 29 HG CYS 29 1.678 11.261 -13.533 238 H GLU 30 HN GLU 30 1.361 10.748 -10.039 239 HA GLU 30 HA GLU 30 -0.017 13.307 -10.108 240 HB2 GLU 30 HB2 GLU 30 -1.086 11.184 -10.719 241 HB3 GLU 30 HB1 GLU 30 -0.752 10.534 -9.116 242 HG2 GLU 30 HG2 GLU 30 -2.713 11.376 -8.408 243 HG3 GLU 30 HG1 GLU 30 -2.089 12.997 -8.711 244 H LEU 31 HN LEU 31 0.782 10.963 -7.513 245 HA LEU 31 HA LEU 31 -0.072 12.678 -5.350 246 HB2 LEU 31 HB2 LEU 31 1.878 10.353 -5.447 247 HB3 LEU 31 HB1 LEU 31 1.117 10.986 -3.987 248 HG LEU 31 HG LEU 31 -0.783 10.296 -6.133 249 HD11 LEU 31 HD11 LEU 31 1.031 8.534 -6.346 250 HD12 LEU 31 HD12 LEU 31 -0.552 7.898 -5.897 251 HD13 LEU 31 HD13 LEU 31 0.702 8.088 -4.671 252 HD21 LEU 31 HD21 LEU 31 -0.934 10.843 -3.485 253 HD22 LEU 31 HD22 LEU 31 -0.818 9.086 -3.412 254 HD23 LEU 31 HD23 LEU 31 -2.126 9.845 -4.316 255 H GLY 32 HN GLY 32 3.016 12.174 -7.009 256 HA2 GLY 32 HA2 GLY 32 4.976 13.499 -6.924 257 HA3 GLY 32 HA1 GLY 32 4.110 14.630 -5.870 258 H HIS 33 HN HIS 33 3.800 11.410 -4.876 259 HA HIS 33 HA HIS 33 4.743 11.579 -2.308 260 HB2 HIS 33 HB2 HIS 33 4.637 9.442 -4.403 261 HB3 HIS 33 HB1 HIS 33 5.429 9.062 -2.866 262 HD1 HIS 33 HD1 HIS 33 2.521 8.064 -4.006 263 HD2 HIS 33 HD2 HIS 33 3.256 10.814 -0.969 264 HE1 HIS 33 HE1 HIS 33 0.457 8.082 -2.541 265 H GLU 34 HN GLU 34 6.798 10.660 -1.354 266 HA GLU 34 HA GLU 34 9.131 11.946 -2.529 267 HB2 GLU 34 HB2 GLU 34 8.574 11.633 -0.080 268 HB3 GLU 34 HB1 GLU 34 8.932 9.917 -0.282 269 HG2 GLU 34 HG2 GLU 34 10.938 10.952 0.544 270 HG3 GLU 34 HG1 GLU 34 11.209 10.605 -1.165 271 H VAL 35 HN VAL 35 8.749 8.536 -1.534 272 HA VAL 35 HA VAL 35 9.850 7.614 -4.142 273 HB VAL 35 HB VAL 35 11.070 7.317 -1.387 274 HG11 VAL 35 HG11 VAL 35 12.569 5.584 -2.351 275 HG12 VAL 35 HG12 VAL 35 11.602 5.590 -3.826 276 HG13 VAL 35 HG13 VAL 35 10.890 5.048 -2.307 277 HG21 VAL 35 HG21 VAL 35 11.658 9.045 -3.381 278 HG22 VAL 35 HG22 VAL 35 12.666 7.687 -3.871 279 HG23 VAL 35 HG23 VAL 35 12.879 8.414 -2.279 280 H ALA 36 HN ALA 36 7.822 6.526 -4.511 281 HA ALA 36 HA ALA 36 6.443 4.980 -2.542 282 HB1 ALA 36 HB1 ALA 36 5.026 4.528 -4.307 283 HB2 ALA 36 HB2 ALA 36 6.354 4.219 -5.426 284 HB3 ALA 36 HB3 ALA 36 5.911 5.877 -5.020 285 H ALA 37 HN ALA 37 6.097 2.476 -3.127 286 HA ALA 37 HA ALA 37 8.815 1.226 -3.422 287 HB1 ALA 37 HB1 ALA 37 6.589 -0.067 -1.890 288 HB2 ALA 37 HB2 ALA 37 7.407 1.307 -1.146 289 HB3 ALA 37 HB3 ALA 37 8.327 -0.129 -1.597 290 H THR 38 HN THR 38 8.834 -0.722 -4.665 291 HA THR 38 HA THR 38 6.265 -1.671 -5.818 292 HB THR 38 HB THR 38 7.063 -1.329 -8.068 293 HG1 THR 38 HG1 THR 38 9.473 -0.472 -6.842 294 HG21 THR 38 HG21 THR 38 6.138 0.651 -6.893 295 HG22 THR 38 HG22 THR 38 7.305 1.097 -8.133 296 HG23 THR 38 HG23 THR 38 7.772 1.120 -6.433 297 H ALA 39 HN ALA 39 6.346 -3.828 -6.404 298 HA ALA 39 HA ALA 39 7.251 -5.995 -6.828 299 HB1 ALA 39 HB1 ALA 39 9.971 -5.310 -5.928 300 HB2 ALA 39 HB2 ALA 39 9.398 -4.385 -7.317 301 HB3 ALA 39 HB3 ALA 39 9.443 -6.147 -7.387 302 H SER 40 HN SER 40 8.027 -7.749 -5.333 303 HA SER 40 HA SER 40 7.376 -6.989 -2.570 304 HB2 SER 40 HB2 SER 40 6.949 -9.264 -2.269 305 HB3 SER 40 HB1 SER 40 6.458 -8.950 -3.922 306 HG SER 40 HG SER 40 8.317 -9.888 -4.647 307 H ARG 41 HN ARG 41 8.971 -6.191 -1.372 308 HA ARG 41 HA ARG 41 11.608 -7.568 -1.412 309 HB2 ARG 41 HB2 ARG 41 11.145 -5.066 -2.298 310 HB3 ARG 41 HB1 ARG 41 11.316 -4.719 -0.575 311 HG2 ARG 41 HG2 ARG 41 13.522 -4.534 -1.386 312 HG3 ARG 41 HG1 ARG 41 13.464 -6.152 -0.688 313 HD2 ARG 41 HD2 ARG 41 13.062 -7.122 -2.924 314 HD3 ARG 41 HD1 ARG 41 13.110 -5.497 -3.638 315 HE ARG 41 HE ARG 41 15.429 -6.829 -2.298 316 HH11 ARG 41 HH21 ARG 41 14.514 -5.546 -5.188 317 HH12 ARG 41 HH22 ARG 41 15.805 -4.399 -5.324 318 HH21 ARG 41 HH11 ARG 41 16.905 -4.847 -2.068 319 HH22 ARG 41 HH12 ARG 41 17.161 -4.009 -3.561 320 H MET 42 HN MET 42 11.925 -8.587 0.558 321 HA MET 42 HA MET 42 10.275 -8.271 2.841 322 HB2 MET 42 HB2 MET 42 13.083 -9.286 2.369 323 HB3 MET 42 HB1 MET 42 12.310 -9.389 3.952 324 HG2 MET 42 HG2 MET 42 10.364 -10.551 2.814 325 HG3 MET 42 HG1 MET 42 11.360 -10.635 1.361 326 HE1 MET 42 HE1 MET 42 11.809 -12.477 0.764 327 HE2 MET 42 HE2 MET 42 11.175 -13.778 1.769 328 HE3 MET 42 HE3 MET 42 12.907 -13.674 1.462 329 H GLN 43 HN GLN 43 13.124 -6.498 1.788 330 HA GLN 43 HA GLN 43 13.647 -5.170 4.315 331 HB2 GLN 43 HB2 GLN 43 15.343 -5.461 2.580 332 HB3 GLN 43 HB1 GLN 43 14.354 -4.572 1.423 333 HG2 GLN 43 HG2 GLN 43 14.510 -2.774 3.484 334 HG3 GLN 43 HG1 GLN 43 16.089 -3.558 3.584 335 HE21 GLN 43 HE21 GLN 43 17.360 -1.867 2.631 336 HE22 GLN 43 HE22 GLN 43 17.150 -1.350 1.027 337 H GLU 44 HN GLU 44 12.423 -3.813 1.223 338 HA GLU 44 HA GLU 44 11.406 -1.406 2.343 339 HB2 GLU 44 HB2 GLU 44 10.687 -3.028 -0.114 340 HB3 GLU 44 HB1 GLU 44 10.070 -1.404 0.185 341 HG2 GLU 44 HG2 GLU 44 12.113 -0.407 -0.178 342 HG3 GLU 44 HG1 GLU 44 13.017 -1.804 0.405 343 H ALA 45 HN ALA 45 9.737 -4.502 1.614 344 HA ALA 45 HA ALA 45 7.106 -3.877 2.274 345 HB1 ALA 45 HB1 ALA 45 8.766 -6.311 3.017 346 HB2 ALA 45 HB2 ALA 45 7.876 -6.075 1.514 347 HB3 ALA 45 HB3 ALA 45 7.003 -6.266 3.034 348 H LEU 46 HN LEU 46 9.693 -4.809 4.556 349 HA LEU 46 HA LEU 46 8.303 -4.636 6.999 350 HB2 LEU 46 HB2 LEU 46 10.543 -5.440 6.901 351 HB3 LEU 46 HB1 LEU 46 11.111 -3.980 6.095 352 HG LEU 46 HG LEU 46 9.825 -3.562 8.726 353 HD11 LEU 46 HD11 LEU 46 11.905 -4.215 9.926 354 HD12 LEU 46 HD12 LEU 46 12.518 -4.914 8.426 355 HD13 LEU 46 HD13 LEU 46 11.086 -5.597 9.196 356 HD21 LEU 46 HD21 LEU 46 10.789 -1.702 7.515 357 HD22 LEU 46 HD22 LEU 46 12.313 -2.567 7.314 358 HD23 LEU 46 HD23 LEU 46 11.810 -2.025 8.916 359 H ASP 47 HN ASP 47 9.948 -2.064 5.160 360 HA ASP 47 HA ASP 47 9.539 0.092 6.937 361 HB2 ASP 47 HB2 ASP 47 10.115 -0.368 4.080 362 HB3 ASP 47 HB1 ASP 47 9.419 1.212 4.440 363 H ILE 48 HN ILE 48 7.230 -1.546 4.880 364 HA ILE 48 HA ILE 48 5.299 0.676 5.092 365 HB ILE 48 HB ILE 48 4.250 -0.300 3.301 366 HG12 ILE 48 HG12 ILE 48 4.968 -2.964 4.547 367 HG13 ILE 48 HG11 ILE 48 3.372 -2.244 4.391 368 HG21 ILE 48 HG21 ILE 48 5.825 -0.956 1.773 369 HG22 ILE 48 HG22 ILE 48 6.614 -2.061 2.900 370 HG23 ILE 48 HG23 ILE 48 6.891 -0.325 3.029 371 HD11 ILE 48 HD11 ILE 48 4.983 -3.709 2.381 372 HD12 ILE 48 HD12 ILE 48 4.151 -2.276 1.780 373 HD13 ILE 48 HD13 ILE 48 3.231 -3.576 2.539 374 H ALA 49 HN ALA 49 5.779 -2.627 6.311 375 HA ALA 49 HA ALA 49 3.223 -2.493 7.774 376 HB1 ALA 49 HB1 ALA 49 5.300 -4.533 7.091 377 HB2 ALA 49 HB2 ALA 49 3.553 -4.601 6.859 378 HB3 ALA 49 HB3 ALA 49 4.239 -4.848 8.465 379 H ARG 50 HN ARG 50 6.497 -3.497 8.717 380 HA ARG 50 HA ARG 50 6.257 -3.197 11.490 381 HB2 ARG 50 HB2 ARG 50 8.681 -2.551 9.788 382 HB3 ARG 50 HB1 ARG 50 8.679 -3.187 11.438 383 HG2 ARG 50 HG2 ARG 50 7.089 -4.998 10.059 384 HG3 ARG 50 HG1 ARG 50 8.356 -4.616 8.896 385 HD2 ARG 50 HD2 ARG 50 9.092 -6.494 10.269 386 HD3 ARG 50 HD1 ARG 50 10.052 -5.068 10.715 387 HE ARG 50 HE ARG 50 7.941 -4.843 12.425 388 HH11 ARG 50 HH11 ARG 50 7.367 -7.752 12.149 389 HH12 ARG 50 HH12 ARG 50 8.347 -8.448 13.396 390 HH21 ARG 50 HH21 ARG 50 10.325 -5.627 13.786 391 HH22 ARG 50 HH22 ARG 50 10.023 -7.247 14.320 392 H LYS 51 HN LYS 51 6.931 -0.706 9.048 393 HA LYS 51 HA LYS 51 7.755 1.415 10.718 394 HB2 LYS 51 HB2 LYS 51 7.810 1.528 8.303 395 HB3 LYS 51 HB1 LYS 51 6.059 1.321 8.208 396 HG2 LYS 51 HG2 LYS 51 6.615 3.683 7.924 397 HG3 LYS 51 HG1 LYS 51 5.773 3.453 9.457 398 HD2 LYS 51 HD2 LYS 51 7.539 4.254 10.601 399 HD3 LYS 51 HD1 LYS 51 8.612 3.083 9.834 400 HE2 LYS 51 HE2 LYS 51 7.949 5.086 7.888 401 HE3 LYS 51 HE1 LYS 51 8.506 5.894 9.367 402 HZ1 LYS 51 HZ1 LYS 51 10.522 4.884 9.282 403 HZ2 LYS 51 HZ2 LYS 51 10.195 4.882 7.615 404 HZ3 LYS 51 HZ3 LYS 51 9.927 3.481 8.538 405 H GLY 52 HN GLY 52 4.462 0.354 9.857 406 HA2 GLY 52 HA2 GLY 52 2.444 0.653 11.018 407 HA3 GLY 52 HA1 GLY 52 3.385 1.257 12.380 408 H GLN 53 HN GLN 53 4.505 3.531 11.636 409 HA GLN 53 HA GLN 53 2.243 5.336 11.299 410 HB2 GLN 53 HB2 GLN 53 3.851 7.008 11.847 411 HB3 GLN 53 HB1 GLN 53 4.336 5.580 12.761 412 HG2 GLN 53 HG2 GLN 53 5.842 5.020 10.747 413 HG3 GLN 53 HG1 GLN 53 5.557 6.680 10.226 414 HE21 GLN 53 HE21 GLN 53 6.119 8.417 11.916 415 HE22 GLN 53 HE22 GLN 53 7.417 8.107 12.964 416 H PHE 54 HN PHE 54 3.985 3.628 9.020 417 HA PHE 54 HA PHE 54 4.636 5.550 7.045 418 HB2 PHE 54 HB2 PHE 54 4.618 3.694 5.527 419 HB3 PHE 54 HB1 PHE 54 5.151 3.071 7.080 420 HD1 PHE 54 HD1 PHE 54 3.276 2.063 8.632 421 HD2 PHE 54 HD2 PHE 54 2.861 2.654 4.399 422 HE1 PHE 54 HE1 PHE 54 1.490 0.367 8.572 423 HE2 PHE 54 HE2 PHE 54 1.068 0.950 4.356 424 HZ PHE 54 HZ PHE 54 0.385 -0.199 6.430 425 H ASP 55 HN ASP 55 3.194 5.315 4.822 426 HA ASP 55 HA ASP 55 0.572 6.469 5.627 427 HB2 ASP 55 HB2 ASP 55 2.628 7.026 3.680 428 HB3 ASP 55 HB1 ASP 55 1.076 6.808 2.870 429 H ILE 56 HN ILE 56 1.834 4.407 2.946 430 HA ILE 56 HA ILE 56 -0.693 2.795 3.172 431 HB ILE 56 HB ILE 56 0.510 4.146 0.745 432 HG12 ILE 56 HG12 ILE 56 -2.106 4.293 2.253 433 HG13 ILE 56 HG11 ILE 56 -1.001 5.606 1.847 434 HG21 ILE 56 HG21 ILE 56 -1.087 2.917 -0.625 435 HG22 ILE 56 HG22 ILE 56 -1.733 2.104 0.800 436 HG23 ILE 56 HG23 ILE 56 -0.090 1.761 0.258 437 HD11 ILE 56 HD11 ILE 56 -2.999 5.661 0.397 438 HD12 ILE 56 HD12 ILE 56 -2.654 4.016 -0.141 439 HD13 ILE 56 HD13 ILE 56 -1.546 5.327 -0.547 440 H ALA 57 HN ALA 57 -0.500 0.589 2.235 441 HA ALA 57 HA ALA 57 2.245 -0.271 1.464 442 HB1 ALA 57 HB1 ALA 57 0.784 -0.929 4.000 443 HB2 ALA 57 HB2 ALA 57 2.480 -0.501 3.778 444 HB3 ALA 57 HB3 ALA 57 1.905 -2.102 3.311 445 H ILE 58 HN ILE 58 1.975 -1.736 -0.226 446 HA ILE 58 HA ILE 58 -0.466 -3.473 -0.109 447 HB ILE 58 HB ILE 58 0.685 -1.852 -2.387 448 HG12 ILE 58 HG12 ILE 58 -1.866 -1.226 -2.409 449 HG13 ILE 58 HG11 ILE 58 -1.841 -1.844 -0.757 450 HG21 ILE 58 HG21 ILE 58 0.136 -3.806 -3.525 451 HG22 ILE 58 HG22 ILE 58 -1.408 -2.954 -3.562 452 HG23 ILE 58 HG23 ILE 58 -1.136 -4.236 -2.381 453 HD11 ILE 58 HD11 ILE 58 -0.929 0.083 -0.047 454 HD12 ILE 58 HD12 ILE 58 -0.945 0.702 -1.700 455 HD13 ILE 58 HD13 ILE 58 0.457 -0.188 -1.105 456 H ILE 59 HN ILE 59 0.781 -5.333 0.519 457 HA ILE 59 HA ILE 59 2.939 -6.242 -1.343 458 HB ILE 59 HB ILE 59 1.850 -7.140 1.360 459 HG12 ILE 59 HG12 ILE 59 4.730 -6.683 0.871 460 HG13 ILE 59 HG11 ILE 59 3.717 -5.254 0.686 461 HG21 ILE 59 HG21 ILE 59 2.337 -9.225 0.410 462 HG22 ILE 59 HG22 ILE 59 3.885 -8.784 1.124 463 HG23 ILE 59 HG23 ILE 59 3.622 -8.572 -0.605 464 HD11 ILE 59 HD11 ILE 59 4.385 -5.345 2.998 465 HD12 ILE 59 HD12 ILE 59 3.928 -7.042 3.120 466 HD13 ILE 59 HD13 ILE 59 2.685 -5.807 2.931 467 H ASP 60 HN ASP 60 0.619 -5.972 -2.593 468 HA ASP 60 HA ASP 60 -1.450 -7.762 -2.513 469 HB2 ASP 60 HB2 ASP 60 -1.974 -6.613 -4.369 470 HB3 ASP 60 HB1 ASP 60 -0.403 -5.833 -4.230 471 H VAL 61 HN VAL 61 -1.933 -9.381 -4.285 472 HA VAL 61 HA VAL 61 -1.680 -11.525 -5.099 473 HB VAL 61 HB VAL 61 0.433 -9.951 -5.948 474 HG11 VAL 61 HG11 VAL 61 1.566 -12.615 -5.028 475 HG12 VAL 61 HG12 VAL 61 1.956 -11.054 -4.309 476 HG13 VAL 61 HG13 VAL 61 2.413 -11.394 -5.975 477 HG21 VAL 61 HG21 VAL 61 -0.877 -11.213 -7.473 478 HG22 VAL 61 HG22 VAL 61 -0.471 -12.738 -6.686 479 HG23 VAL 61 HG23 VAL 61 0.752 -11.872 -7.617 480 H ASN 62 HN ASN 62 -2.252 -12.792 -3.437 481 HA ASN 62 HA ASN 62 -0.094 -13.817 -1.629 482 HB2 ASN 62 HB2 ASN 62 -2.803 -12.670 -1.121 483 HB3 ASN 62 HB1 ASN 62 -2.331 -14.045 -0.128 484 HD21 ASN 62 HD21 ASN 62 -0.622 -11.105 -1.365 485 HD22 ASN 62 HD22 ASN 62 0.037 -10.684 0.139 486 H LEU 63 HN LEU 63 -0.434 -15.215 -3.861 487 HA LEU 63 HA LEU 63 -2.287 -17.458 -3.140 488 HB2 LEU 63 HB2 LEU 63 -2.232 -15.652 -5.383 489 HB3 LEU 63 HB1 LEU 63 -1.906 -17.287 -5.958 490 HG LEU 63 HG LEU 63 -3.942 -18.122 -5.011 491 HD11 LEU 63 HD11 LEU 63 -4.266 -17.171 -2.926 492 HD12 LEU 63 HD12 LEU 63 -5.425 -16.223 -3.858 493 HD13 LEU 63 HD13 LEU 63 -3.838 -15.553 -3.481 494 HD21 LEU 63 HD21 LEU 63 -5.377 -17.132 -6.502 495 HD22 LEU 63 HD22 LEU 63 -3.906 -16.326 -7.044 496 HD23 LEU 63 HD23 LEU 63 -5.004 -15.504 -5.935 497 H ASP 64 HN ASP 64 -1.590 -19.465 -4.564 498 HA ASP 64 HA ASP 64 0.100 -21.105 -4.823 499 HB2 ASP 64 HB2 ASP 64 0.295 -19.211 -6.670 500 HB3 ASP 64 HB1 ASP 64 1.816 -18.863 -5.840 501 H GLY 65 HN GLY 65 0.171 -19.276 -2.305 502 HA2 GLY 65 HA2 GLY 65 2.015 -20.318 -0.706 503 HA3 GLY 65 HA1 GLY 65 3.077 -19.361 -1.734 504 H GLU 66 HN GLU 66 0.484 -17.495 -1.786 505 HA GLU 66 HA GLU 66 0.063 -15.425 -0.721 506 HB2 GLU 66 HB2 GLU 66 -1.109 -17.054 0.700 507 HB3 GLU 66 HB1 GLU 66 0.373 -17.341 1.613 508 HG2 GLU 66 HG2 GLU 66 0.040 -15.511 2.888 509 HG3 GLU 66 HG1 GLU 66 -0.255 -14.503 1.473 510 HA PRO 67 HA PRO 67 4.611 -15.030 0.367 511 HB2 PRO 67 HB2 PRO 67 5.291 -13.411 -1.734 512 HB3 PRO 67 HB1 PRO 67 5.347 -15.184 -1.820 513 HG2 PRO 67 HG2 PRO 67 3.280 -13.304 -2.847 514 HG3 PRO 67 HG1 PRO 67 3.915 -14.791 -3.570 515 HD2 PRO 67 HD2 PRO 67 1.516 -14.653 -2.286 516 HD3 PRO 67 HD1 PRO 67 2.496 -16.133 -2.383 517 H SER 68 HN SER 68 2.905 -13.728 1.899 518 HA SER 68 HA SER 68 3.346 -10.797 1.413 519 HB2 SER 68 HB2 SER 68 1.238 -10.443 2.433 520 HB3 SER 68 HB1 SER 68 0.995 -11.884 1.453 521 HG SER 68 HG SER 68 0.649 -11.617 4.046 522 H TYR 69 HN TYR 69 4.771 -13.165 3.004 523 HA TYR 69 HA TYR 69 5.964 -13.406 5.006 524 HB2 TYR 69 HB2 TYR 69 6.221 -10.613 5.658 525 HB3 TYR 69 HB1 TYR 69 7.436 -11.698 5.003 526 HD1 TYR 69 HD1 TYR 69 7.099 -12.243 2.385 527 HD2 TYR 69 HD2 TYR 69 5.636 -8.755 4.398 528 HE1 TYR 69 HE1 TYR 69 6.993 -11.027 0.228 529 HE2 TYR 69 HE2 TYR 69 5.534 -7.541 2.267 530 HH TYR 69 HH TYR 69 6.742 -7.741 -0.020 531 HA PRO 70 HA PRO 70 3.359 -12.971 8.467 532 HB2 PRO 70 HB2 PRO 70 5.098 -12.463 10.512 533 HB3 PRO 70 HB1 PRO 70 4.954 -14.053 9.737 534 HG2 PRO 70 HG2 PRO 70 6.996 -11.926 9.327 535 HG3 PRO 70 HG1 PRO 70 7.193 -13.685 9.376 536 HD2 PRO 70 HD2 PRO 70 7.133 -12.247 7.060 537 HD3 PRO 70 HD1 PRO 70 6.611 -13.943 7.175 538 H VAL 71 HN VAL 71 5.091 -10.304 7.289 539 HA VAL 71 HA VAL 71 4.049 -8.485 9.372 540 HB VAL 71 HB VAL 71 5.470 -6.816 8.299 541 HG11 VAL 71 HG11 VAL 71 7.398 -8.973 8.069 542 HG12 VAL 71 HG12 VAL 71 6.344 -9.222 9.461 543 HG13 VAL 71 HG13 VAL 71 7.266 -7.727 9.310 544 HG21 VAL 71 HG21 VAL 71 6.881 -7.643 6.323 545 HG22 VAL 71 HG22 VAL 71 5.193 -7.260 5.979 546 HG23 VAL 71 HG23 VAL 71 5.696 -8.937 6.173 547 H ALA 72 HN ALA 72 3.842 -8.710 5.747 548 HA ALA 72 HA ALA 72 1.856 -6.775 5.335 549 HB1 ALA 72 HB1 ALA 72 1.703 -7.821 3.275 550 HB2 ALA 72 HB2 ALA 72 1.655 -9.432 3.992 551 HB3 ALA 72 HB3 ALA 72 3.189 -8.574 3.852 552 H ASP 73 HN ASP 73 1.509 -10.230 6.181 553 HA ASP 73 HA ASP 73 -1.330 -10.295 6.327 554 HB2 ASP 73 HB2 ASP 73 0.996 -11.808 7.377 555 HB3 ASP 73 HB1 ASP 73 -0.559 -12.135 8.129 556 H ILE 74 HN ILE 74 1.092 -9.893 8.905 557 HA ILE 74 HA ILE 74 -0.656 -9.360 11.072 558 HB ILE 74 HB ILE 74 2.134 -8.501 10.290 559 HG12 ILE 74 HG12 ILE 74 1.057 -10.204 12.566 560 HG13 ILE 74 HG11 ILE 74 1.687 -10.841 11.049 561 HG21 ILE 74 HG21 ILE 74 0.410 -7.319 12.359 562 HG22 ILE 74 HG22 ILE 74 1.920 -6.718 11.676 563 HG23 ILE 74 HG23 ILE 74 1.953 -7.907 12.978 564 HD11 ILE 74 HD11 ILE 74 3.206 -9.243 13.128 565 HD12 ILE 74 HD12 ILE 74 3.856 -9.647 11.540 566 HD13 ILE 74 HD13 ILE 74 3.466 -10.930 12.686 567 H LEU 75 HN LEU 75 0.791 -7.200 8.664 568 HA LEU 75 HA LEU 75 -0.137 -4.705 9.506 569 HB2 LEU 75 HB2 LEU 75 1.319 -5.493 7.517 570 HB3 LEU 75 HB1 LEU 75 -0.198 -5.686 6.641 571 HG LEU 75 HG LEU 75 -0.744 -3.338 6.989 572 HD11 LEU 75 HD11 LEU 75 1.373 -2.036 8.032 573 HD12 LEU 75 HD12 LEU 75 1.528 -3.563 8.900 574 HD13 LEU 75 HD13 LEU 75 0.041 -2.623 9.027 575 HD21 LEU 75 HD21 LEU 75 1.319 -4.290 5.400 576 HD22 LEU 75 HD22 LEU 75 2.060 -2.923 6.233 577 HD23 LEU 75 HD23 LEU 75 0.596 -2.685 5.278 578 H ALA 76 HN ALA 76 -1.914 -7.421 8.229 579 HA ALA 76 HA ALA 76 -4.349 -5.866 7.711 580 HB1 ALA 76 HB1 ALA 76 -4.754 -8.695 7.734 581 HB2 ALA 76 HB2 ALA 76 -3.192 -8.375 6.979 582 HB3 ALA 76 HB3 ALA 76 -4.654 -7.628 6.334 583 H GLU 77 HN GLU 77 -3.010 -7.989 10.200 584 HA GLU 77 HA GLU 77 -5.448 -8.418 11.672 585 HB2 GLU 77 HB2 GLU 77 -2.505 -8.473 12.405 586 HB3 GLU 77 HB1 GLU 77 -3.787 -9.056 13.466 587 HG2 GLU 77 HG2 GLU 77 -4.092 -10.165 10.806 588 HG3 GLU 77 HG1 GLU 77 -2.483 -10.512 11.442 589 H ARG 78 HN ARG 78 -3.618 -5.638 11.159 590 HA ARG 78 HA ARG 78 -4.812 -4.313 13.540 591 HB2 ARG 78 HB2 ARG 78 -2.673 -3.036 13.722 592 HB3 ARG 78 HB1 ARG 78 -2.431 -4.770 13.936 593 HG2 ARG 78 HG2 ARG 78 -2.004 -4.783 11.360 594 HG3 ARG 78 HG1 ARG 78 -1.747 -3.051 11.561 595 HD2 ARG 78 HD2 ARG 78 -0.293 -5.174 13.179 596 HD3 ARG 78 HD1 ARG 78 0.382 -4.370 11.748 597 HE ARG 78 HE ARG 78 -0.678 -2.503 13.731 598 HH11 ARG 78 HH21 ARG 78 1.843 -4.726 13.802 599 HH12 ARG 78 HH22 ARG 78 3.097 -3.559 14.058 600 HH21 ARG 78 HH11 ARG 78 1.017 -0.824 13.581 601 HH22 ARG 78 HH12 ARG 78 2.628 -1.349 13.938 602 H ASN 79 HN ASN 79 -3.314 -3.875 10.352 603 HA ASN 79 HA ASN 79 -3.754 -2.353 8.623 604 HB2 ASN 79 HB2 ASN 79 -6.446 -1.918 9.873 605 HB3 ASN 79 HB1 ASN 79 -6.025 -2.144 8.180 606 HD21 ASN 79 HD21 ASN 79 -6.003 -4.295 7.353 607 HD22 ASN 79 HD22 ASN 79 -6.365 -5.658 8.297 608 H VAL 80 HN VAL 80 -2.341 -0.634 9.267 609 HA VAL 80 HA VAL 80 -3.355 1.484 11.079 610 HB VAL 80 HB VAL 80 -1.118 2.179 11.091 611 HG11 VAL 80 HG11 VAL 80 -1.384 -0.438 11.389 612 HG12 VAL 80 HG12 VAL 80 0.212 0.314 11.360 613 HG13 VAL 80 HG13 VAL 80 -0.417 -0.476 9.914 614 HG21 VAL 80 HG21 VAL 80 -1.065 2.786 8.672 615 HG22 VAL 80 HG22 VAL 80 -0.792 1.094 8.270 616 HG23 VAL 80 HG23 VAL 80 0.420 1.991 9.181 617 HA PRO 81 HA PRO 81 -4.648 4.132 7.769 618 HB2 PRO 81 HB2 PRO 81 -2.917 6.237 7.458 619 HB3 PRO 81 HB1 PRO 81 -4.090 6.132 8.787 620 HG2 PRO 81 HG2 PRO 81 -1.173 5.505 8.787 621 HG3 PRO 81 HG1 PRO 81 -2.150 6.322 10.019 622 HD2 PRO 81 HD2 PRO 81 -1.402 3.735 10.234 623 HD3 PRO 81 HD1 PRO 81 -2.932 4.339 10.905 624 H PHE 82 HN PHE 82 -4.499 3.200 5.782 625 HA PHE 82 HA PHE 82 -2.218 3.494 4.035 626 HB2 PHE 82 HB2 PHE 82 -1.312 1.264 4.225 627 HB3 PHE 82 HB1 PHE 82 -1.384 1.961 5.842 628 HD1 PHE 82 HD2 PHE 82 -4.720 1.491 5.392 629 HD2 PHE 82 HD1 PHE 82 -1.155 -0.891 5.652 630 HE1 PHE 82 HE2 PHE 82 -6.064 -0.423 6.167 631 HE2 PHE 82 HE1 PHE 82 -2.509 -2.811 6.434 632 HZ PHE 82 HZ PHE 82 -4.963 -2.582 6.691 633 H ILE 83 HN ILE 83 -2.698 0.617 3.143 634 HA ILE 83 HA ILE 83 -5.386 0.287 2.249 635 HB ILE 83 HB ILE 83 -3.667 2.179 0.900 636 HG12 ILE 83 HG12 ILE 83 -6.469 1.444 0.121 637 HG13 ILE 83 HG11 ILE 83 -6.156 2.275 1.640 638 HG21 ILE 83 HG21 ILE 83 -4.447 1.373 -1.439 639 HG22 ILE 83 HG22 ILE 83 -4.638 -0.200 -0.666 640 HG23 ILE 83 HG23 ILE 83 -3.053 0.573 -0.714 641 HD11 ILE 83 HD11 ILE 83 -4.706 3.857 0.055 642 HD12 ILE 83 HD12 ILE 83 -6.440 4.109 0.262 643 HD13 ILE 83 HD13 ILE 83 -5.836 3.262 -1.162 644 H PHE 84 HN PHE 84 -5.461 -1.671 0.868 645 HA PHE 84 HA PHE 84 -2.876 -2.990 0.294 646 HB2 PHE 84 HB2 PHE 84 -3.764 -3.199 2.760 647 HB3 PHE 84 HB1 PHE 84 -4.849 -4.395 2.055 648 HD1 PHE 84 HD1 PHE 84 -3.922 -6.438 0.945 649 HD2 PHE 84 HD2 PHE 84 -1.401 -3.626 3.001 650 HE1 PHE 84 HE1 PHE 84 -2.094 -8.118 1.008 651 HE2 PHE 84 HE2 PHE 84 0.424 -5.310 3.059 652 HZ PHE 84 HZ PHE 84 0.074 -7.550 2.062 653 H ALA 85 HN ALA 85 -3.246 -5.145 -0.740 654 HA ALA 85 HA ALA 85 -5.942 -5.628 -1.800 655 HB1 ALA 85 HB1 ALA 85 -3.602 -4.558 -3.365 656 HB2 ALA 85 HB2 ALA 85 -5.276 -4.005 -3.374 657 HB3 ALA 85 HB3 ALA 85 -4.843 -5.518 -4.170 658 H THR 86 HN THR 86 -6.067 -7.760 -2.863 659 HA THR 86 HA THR 86 -3.903 -9.455 -3.463 660 HB THR 86 HB THR 86 -2.985 -9.545 -1.363 661 HG1 THR 86 HG1 THR 86 -3.960 -11.330 -0.190 662 HG21 THR 86 HG21 THR 86 -4.131 -8.075 -0.016 663 HG22 THR 86 HG22 THR 86 -4.727 -9.576 0.687 664 HG23 THR 86 HG23 THR 86 -5.709 -8.706 -0.488 665 H GLY 87 HN GLY 87 -4.619 -11.925 -2.825 666 HA2 GLY 87 HA2 GLY 87 -6.755 -12.585 -4.471 667 HA3 GLY 87 HA1 GLY 87 -6.184 -13.629 -3.172 668 H TYR 88 HN TYR 88 -6.971 -12.221 -0.886 669 HA TYR 88 HA TYR 88 -9.886 -12.617 -1.075 670 HB2 TYR 88 HB2 TYR 88 -9.680 -12.318 1.440 671 HB3 TYR 88 HB1 TYR 88 -8.760 -13.654 0.755 672 HD1 TYR 88 HD2 TYR 88 -8.434 -10.048 1.705 673 HD2 TYR 88 HD1 TYR 88 -6.461 -13.825 1.165 674 HE1 TYR 88 HE2 TYR 88 -6.361 -9.104 2.680 675 HE2 TYR 88 HE1 TYR 88 -4.387 -12.880 2.146 676 HH TYR 88 HH TYR 88 -3.447 -11.117 3.101 677 H GLY 89 HN GLY 89 -7.771 -9.919 -1.256 678 HA2 GLY 89 HA2 GLY 89 -8.344 -7.649 -1.518 679 HA3 GLY 89 HA1 GLY 89 -10.039 -8.112 -1.374 680 H SER 90 HN SER 90 -7.159 -8.091 0.736 681 HA SER 90 HA SER 90 -6.843 -7.188 2.874 682 HB2 SER 90 HB2 SER 90 -9.088 -5.677 1.687 683 HB3 SER 90 HB1 SER 90 -8.947 -5.569 3.436 684 HG SER 90 HG SER 90 -7.080 -4.889 1.431 685 H LYS 91 HN LYS 91 -9.891 -8.859 2.217 686 HA LYS 91 HA LYS 91 -11.106 -10.310 3.615 687 HB2 LYS 91 HB2 LYS 91 -9.439 -11.499 4.574 688 HB3 LYS 91 HB1 LYS 91 -8.394 -10.094 4.659 689 HG2 LYS 91 HG2 LYS 91 -9.993 -9.500 6.737 690 HG3 LYS 91 HG1 LYS 91 -10.209 -11.244 6.737 691 HD2 LYS 91 HD2 LYS 91 -8.125 -11.590 7.539 692 HD3 LYS 91 HD1 LYS 91 -7.415 -10.460 6.385 693 HE2 LYS 91 HE2 LYS 91 -7.086 -9.652 8.707 694 HE3 LYS 91 HE1 LYS 91 -8.170 -8.557 7.824 695 HZ1 LYS 91 HZ1 LYS 91 -9.094 -9.194 9.991 696 HZ2 LYS 91 HZ2 LYS 91 -9.050 -10.829 9.531 697 HZ3 LYS 91 HZ3 LYS 91 -10.066 -9.740 8.712 698 H GLY 92 HN GLY 92 -9.685 -7.652 5.583 699 HA2 GLY 92 HA2 GLY 92 -12.271 -6.475 6.116 700 HA3 GLY 92 HA1 GLY 92 -11.670 -7.375 7.514 701 H LEU 93 HN LEU 93 -9.673 -5.710 5.162 702 HA LEU 93 HA LEU 93 -7.947 -4.475 6.993 703 HB2 LEU 93 HB2 LEU 93 -7.460 -4.735 4.643 704 HB3 LEU 93 HB1 LEU 93 -8.839 -3.730 4.198 705 HG LEU 93 HG LEU 93 -6.897 -2.467 6.043 706 HD11 LEU 93 HD11 LEU 93 -6.156 -3.482 3.329 707 HD12 LEU 93 HD12 LEU 93 -5.152 -3.286 4.763 708 HD13 LEU 93 HD13 LEU 93 -5.589 -1.880 3.794 709 HD21 LEU 93 HD21 LEU 93 -7.495 -1.059 3.593 710 HD22 LEU 93 HD22 LEU 93 -7.973 -0.653 5.242 711 HD23 LEU 93 HD23 LEU 93 -8.980 -1.728 4.270 712 H ASP 94 HN ASP 94 -8.492 -3.047 8.561 713 HA ASP 94 HA ASP 94 -10.631 -1.018 8.031 714 HB2 ASP 94 HB2 ASP 94 -10.494 -0.829 10.568 715 HB3 ASP 94 HB1 ASP 94 -11.013 -2.407 9.974 716 H THR 95 HN THR 95 -10.091 1.245 8.540 717 HA THR 95 HA THR 95 -7.450 2.014 9.443 718 HB THR 95 HB THR 95 -6.728 1.108 7.357 719 HG1 THR 95 HG1 THR 95 -6.252 3.057 6.154 720 HG21 THR 95 HG21 THR 95 -7.826 1.812 5.209 721 HG22 THR 95 HG22 THR 95 -9.093 2.566 6.176 722 HG23 THR 95 HG23 THR 95 -8.847 0.822 6.250 723 H ARG 96 HN ARG 96 -7.029 4.408 8.514 724 HA ARG 96 HA ARG 96 -9.318 6.019 9.357 725 HB2 ARG 96 HB2 ARG 96 -6.487 6.454 8.403 726 HB3 ARG 96 HB1 ARG 96 -7.579 7.826 8.599 727 HG2 ARG 96 HG2 ARG 96 -6.115 7.227 10.622 728 HG3 ARG 96 HG1 ARG 96 -7.838 7.439 10.926 729 HD2 ARG 96 HD2 ARG 96 -8.125 4.947 10.726 730 HD3 ARG 96 HD1 ARG 96 -6.357 4.803 10.620 731 HE ARG 96 HE ARG 96 -6.954 6.460 12.845 732 HH11 ARG 96 HH11 ARG 96 -5.245 3.962 12.919 733 HH12 ARG 96 HH12 ARG 96 -6.143 2.965 14.014 734 HH21 ARG 96 HH21 ARG 96 -9.039 4.855 13.777 735 HH22 ARG 96 HH22 ARG 96 -8.290 3.471 14.499 736 H TYR 97 HN TYR 97 -8.648 4.458 6.506 737 HA TYR 97 HA TYR 97 -9.291 6.636 4.644 738 HB2 TYR 97 HB2 TYR 97 -8.848 3.650 4.470 739 HB3 TYR 97 HB1 TYR 97 -9.277 4.615 3.055 740 HD1 TYR 97 HD1 TYR 97 -6.927 4.887 5.989 741 HD2 TYR 97 HD2 TYR 97 -7.500 5.349 1.757 742 HE1 TYR 97 HE1 TYR 97 -4.577 5.623 5.755 743 HE2 TYR 97 HE2 TYR 97 -5.146 6.085 1.523 744 HH TYR 97 HH TYR 97 -2.856 5.751 4.049 745 H SER 98 HN SER 98 -10.887 3.506 5.320 746 HA SER 98 HA SER 98 -13.458 4.240 5.975 747 HB2 SER 98 HB2 SER 98 -12.764 4.973 3.201 748 HB3 SER 98 HB1 SER 98 -14.306 4.129 3.372 749 HG SER 98 HG SER 98 -13.455 6.441 4.792 750 H ASN 99 HN ASN 99 -11.307 2.057 4.527 751 HA ASN 99 HA ASN 99 -11.382 -0.305 4.527 752 HB2 ASN 99 HB2 ASN 99 -14.336 -0.138 5.099 753 HB3 ASN 99 HB1 ASN 99 -13.186 -1.379 5.592 754 HD21 ASN 99 HD21 ASN 99 -11.215 0.882 6.334 755 HD22 ASN 99 HD22 ASN 99 -11.781 1.437 7.833 756 H ILE 100 HN ILE 100 -12.402 1.661 2.300 757 HA ILE 100 HA ILE 100 -13.868 -0.395 0.700 758 HB ILE 100 HB ILE 100 -14.766 1.414 -0.560 759 HG12 ILE 100 HG12 ILE 100 -12.377 2.637 -0.329 760 HG13 ILE 100 HG11 ILE 100 -13.840 3.508 -0.760 761 HG21 ILE 100 HG21 ILE 100 -14.653 1.911 2.413 762 HG22 ILE 100 HG22 ILE 100 -15.951 1.186 1.465 763 HG23 ILE 100 HG23 ILE 100 -15.633 2.916 1.344 764 HD11 ILE 100 HD11 ILE 100 -12.211 4.231 1.284 765 HD12 ILE 100 HD12 ILE 100 -13.349 3.198 2.137 766 HD13 ILE 100 HD13 ILE 100 -13.935 4.594 1.240 767 HA PRO 101 HA PRO 101 -10.284 1.037 -2.136 768 HB2 PRO 101 HB2 PRO 101 -7.908 1.600 -0.938 769 HB3 PRO 101 HB1 PRO 101 -9.124 2.840 -1.260 770 HG2 PRO 101 HG2 PRO 101 -8.476 1.461 1.286 771 HG3 PRO 101 HG1 PRO 101 -8.953 3.141 1.006 772 HD2 PRO 101 HD2 PRO 101 -10.635 1.174 1.934 773 HD3 PRO 101 HD1 PRO 101 -11.177 2.647 1.102 774 H LEU 102 HN LEU 102 -10.965 -1.490 -1.306 775 HA LEU 102 HA LEU 102 -8.305 -2.810 -0.940 776 HB2 LEU 102 HB2 LEU 102 -10.650 -4.425 -0.224 777 HB3 LEU 102 HB1 LEU 102 -9.195 -4.104 0.711 778 HG LEU 102 HG LEU 102 -11.400 -2.054 0.407 779 HD11 LEU 102 HD11 LEU 102 -11.338 -4.509 1.995 780 HD12 LEU 102 HD12 LEU 102 -12.680 -3.411 1.675 781 HD13 LEU 102 HD13 LEU 102 -11.551 -3.064 2.983 782 HD21 LEU 102 HD21 LEU 102 -9.096 -1.350 1.132 783 HD22 LEU 102 HD22 LEU 102 -9.253 -2.433 2.513 784 HD23 LEU 102 HD23 LEU 102 -10.340 -1.053 2.346 785 H LEU 103 HN LEU 103 -7.722 -4.339 -2.455 786 HA LEU 103 HA LEU 103 -9.701 -5.817 -4.016 787 HB2 LEU 103 HB2 LEU 103 -8.686 -4.602 -6.183 788 HB3 LEU 103 HB1 LEU 103 -10.107 -3.980 -5.349 789 HG LEU 103 HG LEU 103 -8.596 -2.487 -4.007 790 HD11 LEU 103 HD11 LEU 103 -6.572 -4.130 -5.037 791 HD12 LEU 103 HD12 LEU 103 -6.347 -2.644 -4.124 792 HD13 LEU 103 HD13 LEU 103 -6.380 -2.602 -5.886 793 HD21 LEU 103 HD21 LEU 103 -9.581 -2.177 -6.558 794 HD22 LEU 103 HD22 LEU 103 -7.880 -1.754 -6.758 795 HD23 LEU 103 HD23 LEU 103 -8.873 -0.887 -5.586 796 H THR 104 HN THR 104 -8.229 -6.443 -6.266 797 HA THR 104 HA THR 104 -5.654 -7.457 -5.165 798 HB THR 104 HB THR 104 -7.210 -9.279 -5.356 799 HG1 THR 104 HG1 THR 104 -5.612 -10.284 -6.251 800 HG21 THR 104 HG21 THR 104 -8.241 -9.660 -7.715 801 HG22 THR 104 HG22 THR 104 -7.884 -7.952 -7.972 802 HG23 THR 104 HG23 THR 104 -8.967 -8.441 -6.668 803 H LYS 105 HN LYS 105 -5.866 -4.973 -6.534 804 HA LYS 105 HA LYS 105 -4.843 -3.799 -8.315 805 HB2 LYS 105 HB2 LYS 105 -3.393 -6.268 -7.811 806 HB3 LYS 105 HB1 LYS 105 -3.250 -5.774 -9.501 807 HG2 LYS 105 HG2 LYS 105 -2.056 -3.901 -8.988 808 HG3 LYS 105 HG1 LYS 105 -3.005 -3.576 -7.536 809 HD2 LYS 105 HD2 LYS 105 -1.143 -4.277 -6.428 810 HD3 LYS 105 HD1 LYS 105 -1.735 -5.890 -6.827 811 HE2 LYS 105 HE2 LYS 105 0.030 -4.366 -8.755 812 HE3 LYS 105 HE1 LYS 105 0.719 -5.375 -7.466 813 HZ1 LYS 105 HZ1 LYS 105 -1.103 -7.036 -8.328 814 HZ2 LYS 105 HZ2 LYS 105 0.422 -6.952 -9.071 815 HZ3 LYS 105 HZ3 LYS 105 -0.912 -6.165 -9.771 816 HA PRO 106 HA PRO 106 -7.438 -6.280 -11.403 817 HB2 PRO 106 HB2 PRO 106 -9.941 -5.289 -10.948 818 HB3 PRO 106 HB1 PRO 106 -9.324 -6.729 -10.114 819 HG2 PRO 106 HG2 PRO 106 -9.606 -3.951 -9.123 820 HG3 PRO 106 HG1 PRO 106 -9.793 -5.485 -8.262 821 HD2 PRO 106 HD2 PRO 106 -7.565 -3.855 -8.122 822 HD3 PRO 106 HD1 PRO 106 -7.600 -5.582 -7.726 823 H PHE 107 HN PHE 107 -6.814 -3.109 -10.404 824 HA PHE 107 HA PHE 107 -6.733 -1.058 -11.550 825 HB2 PHE 107 HB2 PHE 107 -6.718 -3.178 -13.697 826 HB3 PHE 107 HB1 PHE 107 -6.645 -1.470 -14.126 827 HD1 PHE 107 HD1 PHE 107 -5.234 -1.891 -10.905 828 HD2 PHE 107 HD2 PHE 107 -4.341 -2.439 -15.076 829 HE1 PHE 107 HE1 PHE 107 -2.819 -1.828 -10.389 830 HE2 PHE 107 HE2 PHE 107 -1.917 -2.381 -14.552 831 HZ PHE 107 HZ PHE 107 -1.149 -2.063 -12.213 832 H LEU 108 HN LEU 108 -8.230 -0.624 -14.148 833 HA LEU 108 HA LEU 108 -10.397 0.031 -14.811 834 HB2 LEU 108 HB2 LEU 108 -11.204 -2.153 -14.652 835 HB3 LEU 108 HB1 LEU 108 -10.838 -2.283 -12.939 836 HG LEU 108 HG LEU 108 -12.795 -0.185 -13.486 837 HD11 LEU 108 HD11 LEU 108 -13.638 -3.032 -14.068 838 HD12 LEU 108 HD12 LEU 108 -13.269 -1.864 -15.336 839 HD13 LEU 108 HD13 LEU 108 -14.608 -1.568 -14.227 840 HD21 LEU 108 HD21 LEU 108 -13.782 -1.042 -11.548 841 HD22 LEU 108 HD22 LEU 108 -12.099 -1.513 -11.316 842 HD23 LEU 108 HD23 LEU 108 -13.273 -2.693 -11.901 843 H ASP 109 HN ASP 109 -10.440 -0.501 -11.255 844 HA ASP 109 HA ASP 109 -11.075 2.393 -10.896 845 HB2 ASP 109 HB2 ASP 109 -12.684 -0.022 -10.272 846 HB3 ASP 109 HB1 ASP 109 -12.616 1.191 -8.993 847 H SER 110 HN SER 110 -8.943 0.026 -10.284 848 HA SER 110 HA SER 110 -8.615 -0.003 -7.439 849 HB2 SER 110 HB2 SER 110 -7.660 -1.668 -8.932 850 HB3 SER 110 HB1 SER 110 -6.716 -0.435 -9.761 851 HG SER 110 HG SER 110 -5.904 -1.840 -7.786 852 H GLU 111 HN GLU 111 -5.926 1.222 -9.343 853 HA GLU 111 HA GLU 111 -4.760 3.002 -7.656 854 HB2 GLU 111 HB2 GLU 111 -5.012 2.657 -10.494 855 HB3 GLU 111 HB1 GLU 111 -5.021 4.385 -10.142 856 HG2 GLU 111 HG2 GLU 111 -2.943 4.230 -8.938 857 HG3 GLU 111 HG1 GLU 111 -2.972 2.468 -9.011 858 H LEU 112 HN LEU 112 -7.776 3.561 -9.354 859 HA LEU 112 HA LEU 112 -8.111 6.347 -8.649 860 HB2 LEU 112 HB2 LEU 112 -10.501 4.586 -8.960 861 HB3 LEU 112 HB1 LEU 112 -10.149 6.131 -9.723 862 HG LEU 112 HG LEU 112 -9.126 3.399 -10.478 863 HD11 LEU 112 HD11 LEU 112 -11.296 4.914 -11.323 864 HD12 LEU 112 HD12 LEU 112 -10.554 3.599 -12.232 865 HD13 LEU 112 HD13 LEU 112 -10.069 5.266 -12.541 866 HD21 LEU 112 HD21 LEU 112 -8.076 5.230 -12.304 867 HD22 LEU 112 HD22 LEU 112 -7.168 4.406 -11.037 868 HD23 LEU 112 HD23 LEU 112 -7.828 6.015 -10.743 869 H GLU 113 HN GLU 113 -10.041 3.579 -7.452 870 HA GLU 113 HA GLU 113 -11.117 4.717 -5.158 871 HB2 GLU 113 HB2 GLU 113 -9.995 1.947 -5.718 872 HB3 GLU 113 HB1 GLU 113 -10.870 2.318 -4.227 873 HG2 GLU 113 HG2 GLU 113 -12.768 3.178 -5.661 874 HG3 GLU 113 HG1 GLU 113 -11.914 2.536 -7.064 875 H ALA 114 HN ALA 114 -8.022 2.967 -5.364 876 HA ALA 114 HA ALA 114 -6.991 3.205 -2.827 877 HB1 ALA 114 HB1 ALA 114 -6.034 2.601 -5.294 878 HB2 ALA 114 HB2 ALA 114 -4.989 2.785 -3.886 879 HB3 ALA 114 HB3 ALA 114 -5.194 4.125 -5.015 880 H VAL 115 HN VAL 115 -7.257 5.865 -5.176 881 HA VAL 115 HA VAL 115 -6.201 7.741 -3.096 882 HB VAL 115 HB VAL 115 -6.699 8.235 -6.039 883 HG11 VAL 115 HG11 VAL 115 -4.931 9.931 -5.705 884 HG12 VAL 115 HG12 VAL 115 -4.807 9.467 -4.008 885 HG13 VAL 115 HG13 VAL 115 -6.287 10.211 -4.612 886 HG21 VAL 115 HG21 VAL 115 -3.946 7.748 -5.506 887 HG22 VAL 115 HG22 VAL 115 -5.033 6.790 -6.512 888 HG23 VAL 115 HG23 VAL 115 -4.851 6.409 -4.800 889 H LEU 116 HN LEU 116 -9.029 6.950 -5.007 890 HA LEU 116 HA LEU 116 -10.492 9.419 -4.493 891 HB2 LEU 116 HB2 LEU 116 -10.676 7.348 -6.228 892 HB3 LEU 116 HB1 LEU 116 -11.862 6.827 -5.033 893 HG LEU 116 HG LEU 116 -13.084 8.120 -6.600 894 HD11 LEU 116 HD11 LEU 116 -12.353 10.028 -4.361 895 HD12 LEU 116 HD12 LEU 116 -13.484 8.685 -4.192 896 HD13 LEU 116 HD13 LEU 116 -13.853 10.016 -5.288 897 HD21 LEU 116 HD21 LEU 116 -10.678 9.270 -7.213 898 HD22 LEU 116 HD22 LEU 116 -11.484 10.593 -6.370 899 HD23 LEU 116 HD23 LEU 116 -12.234 9.868 -7.791 900 H VAL 117 HN VAL 117 -10.115 6.306 -2.941 901 HA VAL 117 HA VAL 117 -12.324 6.408 -1.113 902 HB VAL 117 HB VAL 117 -11.067 4.586 -0.066 903 HG11 VAL 117 HG11 VAL 117 -11.921 3.553 -1.899 904 HG12 VAL 117 HG12 VAL 117 -10.257 3.577 -2.480 905 HG13 VAL 117 HG13 VAL 117 -11.382 4.837 -2.980 906 HG21 VAL 117 HG21 VAL 117 -8.850 6.156 -0.970 907 HG22 VAL 117 HG22 VAL 117 -8.705 4.538 -1.649 908 HG23 VAL 117 HG23 VAL 117 -8.833 4.753 0.093 909 H GLN 118 HN GLN 118 -9.528 8.348 -1.233 910 HA GLN 118 HA GLN 118 -9.231 8.617 1.694 911 HB2 GLN 118 HB2 GLN 118 -7.282 8.622 0.214 912 HB3 GLN 118 HB1 GLN 118 -7.943 9.986 -0.688 913 HG2 GLN 118 HG2 GLN 118 -7.969 10.777 2.021 914 HG3 GLN 118 HG1 GLN 118 -6.405 10.007 1.760 915 HE21 GLN 118 HE21 GLN 118 -6.114 10.705 -1.044 916 HE22 GLN 118 HE22 GLN 118 -5.886 12.384 -1.130 917 H ILE 119 HN ILE 119 -11.130 10.045 -0.781 918 HA ILE 119 HA ILE 119 -11.406 12.622 0.653 919 HB ILE 119 HB ILE 119 -12.321 11.479 -1.963 920 HG12 ILE 119 HG12 ILE 119 -10.075 12.264 -2.070 921 HG13 ILE 119 HG11 ILE 119 -11.048 13.564 -2.758 922 HG21 ILE 119 HG21 ILE 119 -13.166 13.942 -2.280 923 HG22 ILE 119 HG22 ILE 119 -13.256 13.935 -0.519 924 HG23 ILE 119 HG23 ILE 119 -14.196 12.773 -1.455 925 HD11 ILE 119 HD11 ILE 119 -11.135 14.407 -0.261 926 HD12 ILE 119 HD12 ILE 119 -9.723 14.752 -1.261 927 HD13 ILE 119 HD13 ILE 119 -9.678 13.428 -0.097 928 H SER 120 HN SER 120 -12.943 9.586 0.421 929 HA SER 120 HA SER 120 -15.672 10.369 0.957 930 HB2 SER 120 HB2 SER 120 -14.043 7.983 0.688 931 HB3 SER 120 HB1 SER 120 -15.159 7.813 2.039 932 HG SER 120 HG SER 120 -16.820 7.936 0.700 933 H LYS 121 HN LYS 121 -16.517 11.103 2.895 934 HA LYS 121 HA LYS 121 -15.488 10.157 5.461 935 HB2 LYS 121 HB2 LYS 121 -14.029 12.109 4.270 936 HB3 LYS 121 HB1 LYS 121 -15.194 13.097 5.154 937 HG2 LYS 121 HG2 LYS 121 -13.560 12.805 6.779 938 HG3 LYS 121 HG1 LYS 121 -14.621 11.441 7.131 939 HD2 LYS 121 HD2 LYS 121 -13.075 9.913 6.475 940 HD3 LYS 121 HD1 LYS 121 -12.593 10.872 5.074 941 HE2 LYS 121 HE2 LYS 121 -11.799 11.641 7.897 942 HE3 LYS 121 HE1 LYS 121 -10.793 10.602 6.869 943 HZ1 LYS 121 HZ1 LYS 121 -11.454 12.538 5.157 944 HZ2 LYS 121 HZ2 LYS 121 -10.035 12.559 6.090 945 HZ3 LYS 121 HZ3 LYS 121 -11.402 13.429 6.600 946 H GLU 122 HN GLU 122 -16.405 12.082 7.142 947 HA GLU 122 HA GLU 122 -18.421 12.658 8.221 948 HB2 GLU 122 HB2 GLU 122 -19.524 14.422 7.048 949 HB3 GLU 122 HB1 GLU 122 -17.853 14.469 6.493 950 HG2 GLU 122 HG2 GLU 122 -18.391 13.737 4.377 951 HG3 GLU 122 HG1 GLU 122 -19.748 12.764 4.936 952 H VAL 123 HN VAL 123 -18.295 10.061 6.772 953 HA VAL 123 HA VAL 123 -19.766 8.501 5.697 954 HB VAL 123 HB VAL 123 -21.301 7.808 7.590 955 HG11 VAL 123 HG11 VAL 123 -19.445 6.757 8.303 956 HG12 VAL 123 HG12 VAL 123 -18.929 8.223 9.136 957 HG13 VAL 123 HG13 VAL 123 -18.452 7.946 7.461 958 HG21 VAL 123 HG21 VAL 123 -21.737 9.211 9.326 959 HG22 VAL 123 HG22 VAL 123 -21.201 10.486 8.234 960 HG23 VAL 123 HG23 VAL 123 -20.071 9.787 9.392 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 14.446 15.529 10.201 2 H2 GLY 1 HT2 GLY 1 13.703 15.205 8.707 3 H3 GLY 1 HT3 GLY 1 13.061 14.550 10.137 4 HA2 GLY 1 HA2 GLY 1 13.123 17.416 9.365 5 HA3 GLY 1 HA1 GLY 1 11.698 16.383 9.478 6 H SER 2 HN SER 2 11.892 18.749 10.979 7 HA SER 2 HA SER 2 12.164 17.648 13.758 8 HB2 SER 2 HB2 SER 2 12.763 20.134 14.241 9 HB3 SER 2 HB1 SER 2 13.983 19.131 13.462 10 HG SER 2 HG SER 2 13.883 20.866 12.173 11 H HIS 3 HN HIS 3 10.066 17.465 14.482 12 HA HIS 3 HA HIS 3 7.775 17.991 14.802 13 HB2 HIS 3 HB2 HIS 3 9.535 19.921 15.788 14 HB3 HIS 3 HB1 HIS 3 8.311 20.863 14.936 15 HD1 HIS 3 HD1 HIS 3 8.863 19.934 18.198 16 HD2 HIS 3 HD2 HIS 3 5.587 19.313 15.693 17 HE1 HIS 3 HE1 HIS 3 6.879 19.496 19.709 18 H MET 4 HN MET 4 8.256 17.690 12.087 19 HA MET 4 HA MET 4 6.837 20.023 10.845 20 HB2 MET 4 HB2 MET 4 9.185 19.504 10.118 21 HB3 MET 4 HB1 MET 4 8.625 17.923 9.575 22 HG2 MET 4 HG2 MET 4 8.040 18.858 7.612 23 HG3 MET 4 HG1 MET 4 6.834 19.815 8.473 24 HE1 MET 4 HE1 MET 4 9.486 19.446 6.442 25 HE2 MET 4 HE2 MET 4 10.889 20.197 7.196 26 HE3 MET 4 HE3 MET 4 9.978 21.080 5.975 27 H THR 5 HN THR 5 6.984 17.417 8.729 28 HA THR 5 HA THR 5 4.333 16.359 9.633 29 HB THR 5 HB THR 5 4.404 16.284 6.831 30 HG1 THR 5 HG1 THR 5 4.745 18.757 6.718 31 HG21 THR 5 HG21 THR 5 2.912 18.491 7.352 32 HG22 THR 5 HG22 THR 5 2.995 17.781 8.964 33 HG23 THR 5 HG23 THR 5 2.339 16.846 7.622 34 H GLU 6 HN GLU 6 3.880 14.188 8.671 35 HA GLU 6 HA GLU 6 6.298 12.736 7.711 36 HB2 GLU 6 HB2 GLU 6 5.961 11.043 9.468 37 HB3 GLU 6 HB1 GLU 6 6.201 12.641 10.182 38 HG2 GLU 6 HG2 GLU 6 4.063 12.755 10.971 39 HG3 GLU 6 HG1 GLU 6 3.391 11.939 9.560 40 H ARG 7 HN ARG 7 3.165 13.474 7.134 41 HA ARG 7 HA ARG 7 2.217 10.778 6.363 42 HB2 ARG 7 HB2 ARG 7 0.975 12.951 7.337 43 HB3 ARG 7 HB1 ARG 7 0.824 13.317 5.617 44 HG2 ARG 7 HG2 ARG 7 -0.164 11.063 5.252 45 HG3 ARG 7 HG1 ARG 7 -0.079 10.767 6.988 46 HD2 ARG 7 HD2 ARG 7 -1.406 13.306 6.223 47 HD3 ARG 7 HD1 ARG 7 -2.277 11.824 5.781 48 HE ARG 7 HE ARG 7 -1.697 12.719 8.515 49 HH11 ARG 7 HH11 ARG 7 -3.730 10.866 6.698 50 HH12 ARG 7 HH12 ARG 7 -3.820 9.525 7.791 51 HH21 ARG 7 HH21 ARG 7 -1.239 10.664 9.812 52 HH22 ARG 7 HH22 ARG 7 -2.408 9.412 9.557 53 H ARG 8 HN ARG 8 4.169 13.174 5.042 54 HA ARG 8 HA ARG 8 3.304 13.004 2.255 55 HB2 ARG 8 HB2 ARG 8 4.469 14.929 3.496 56 HB3 ARG 8 HB1 ARG 8 5.946 13.975 3.366 57 HG2 ARG 8 HG2 ARG 8 5.460 13.835 0.856 58 HG3 ARG 8 HG1 ARG 8 4.256 15.097 1.127 59 HD2 ARG 8 HD2 ARG 8 6.495 16.017 0.439 60 HD3 ARG 8 HD1 ARG 8 5.988 16.588 2.042 61 HE ARG 8 HE ARG 8 7.600 14.106 1.969 62 HH11 ARG 8 HH21 ARG 8 7.078 16.055 4.311 63 HH12 ARG 8 HH22 ARG 8 8.648 16.771 4.468 64 HH21 ARG 8 HH11 ARG 8 9.756 15.657 1.380 65 HH22 ARG 8 HH12 ARG 8 10.163 16.548 2.808 66 H LEU 9 HN LEU 9 4.618 10.701 4.147 67 HA LEU 9 HA LEU 9 6.959 9.770 2.859 68 HB2 LEU 9 HB2 LEU 9 4.677 8.386 4.293 69 HB3 LEU 9 HB1 LEU 9 6.187 7.574 3.876 70 HG LEU 9 HG LEU 9 6.235 10.172 5.385 71 HD11 LEU 9 HD11 LEU 9 5.953 9.095 7.460 72 HD12 LEU 9 HD12 LEU 9 6.225 7.495 6.769 73 HD13 LEU 9 HD13 LEU 9 4.711 8.344 6.456 74 HD21 LEU 9 HD21 LEU 9 8.437 9.651 5.714 75 HD22 LEU 9 HD22 LEU 9 8.197 8.620 4.301 76 HD23 LEU 9 HD23 LEU 9 8.099 7.932 5.923 77 H ARG 10 HN ARG 10 5.591 7.001 2.283 78 HA ARG 10 HA ARG 10 4.154 7.567 -0.199 79 HB2 ARG 10 HB2 ARG 10 6.908 7.439 -0.201 80 HB3 ARG 10 HB1 ARG 10 6.448 5.812 -0.650 81 HG2 ARG 10 HG2 ARG 10 6.494 8.179 -2.303 82 HG3 ARG 10 HG1 ARG 10 6.214 6.520 -2.779 83 HD2 ARG 10 HD2 ARG 10 3.835 7.829 -1.583 84 HD3 ARG 10 HD1 ARG 10 4.391 8.514 -3.101 85 HE ARG 10 HE ARG 10 4.429 5.660 -3.276 86 HH11 ARG 10 HH11 ARG 10 1.963 7.782 -2.387 87 HH12 ARG 10 HH12 ARG 10 0.880 7.329 -3.660 88 HH21 ARG 10 HH21 ARG 10 3.206 5.344 -5.292 89 HH22 ARG 10 HH22 ARG 10 1.586 5.955 -5.307 90 H VAL 11 HN VAL 11 3.881 5.367 -1.401 91 HA VAL 11 HA VAL 11 2.856 3.432 0.593 92 HB VAL 11 HB VAL 11 1.552 2.674 -1.310 93 HG11 VAL 11 HG11 VAL 11 0.253 4.545 -1.302 94 HG12 VAL 11 HG12 VAL 11 1.539 5.532 -1.990 95 HG13 VAL 11 HG13 VAL 11 1.496 5.232 -0.256 96 HG21 VAL 11 HG21 VAL 11 3.793 3.979 -2.749 97 HG22 VAL 11 HG22 VAL 11 2.202 4.222 -3.469 98 HG23 VAL 11 HG23 VAL 11 2.818 2.588 -3.222 99 H LEU 12 HN LEU 12 3.819 1.481 0.950 100 HA LEU 12 HA LEU 12 6.057 0.648 -0.832 101 HB2 LEU 12 HB2 LEU 12 5.146 0.036 1.985 102 HB3 LEU 12 HB1 LEU 12 6.309 -1.003 1.168 103 HG LEU 12 HG LEU 12 7.244 0.904 2.635 104 HD11 LEU 12 HD11 LEU 12 8.365 -0.475 0.712 105 HD12 LEU 12 HD12 LEU 12 9.166 0.978 1.311 106 HD13 LEU 12 HD13 LEU 12 8.247 1.033 -0.194 107 HD21 LEU 12 HD21 LEU 12 7.317 3.097 1.673 108 HD22 LEU 12 HD22 LEU 12 5.628 2.592 1.607 109 HD23 LEU 12 HD23 LEU 12 6.627 2.527 0.153 110 H VAL 13 HN VAL 13 4.937 -0.389 -2.550 111 HA VAL 13 HA VAL 13 2.891 -2.440 -1.798 112 HB VAL 13 HB VAL 13 2.115 -2.139 -4.089 113 HG11 VAL 13 HG11 VAL 13 2.089 0.570 -3.965 114 HG12 VAL 13 HG12 VAL 13 2.557 0.191 -2.308 115 HG13 VAL 13 HG13 VAL 13 1.054 -0.451 -2.968 116 HG21 VAL 13 HG21 VAL 13 4.258 -1.917 -5.194 117 HG22 VAL 13 HG22 VAL 13 4.577 -0.405 -4.360 118 HG23 VAL 13 HG23 VAL 13 3.291 -0.491 -5.562 119 H VAL 14 HN VAL 14 3.103 -4.568 -2.647 120 HA VAL 14 HA VAL 14 5.506 -5.164 -4.247 121 HB VAL 14 HB VAL 14 6.491 -6.502 -2.575 122 HG11 VAL 14 HG11 VAL 14 5.215 -4.225 -1.064 123 HG12 VAL 14 HG12 VAL 14 6.653 -4.084 -2.073 124 HG13 VAL 14 HG13 VAL 14 6.693 -5.077 -0.617 125 HG21 VAL 14 HG21 VAL 14 4.902 -7.891 -1.679 126 HG22 VAL 14 HG22 VAL 14 3.722 -6.590 -1.525 127 HG23 VAL 14 HG23 VAL 14 5.032 -6.734 -0.354 128 H GLU 15 HN GLU 15 5.025 -6.664 -5.726 129 HA GLU 15 HA GLU 15 3.133 -8.868 -5.164 130 HB2 GLU 15 HB2 GLU 15 1.787 -8.290 -7.164 131 HB3 GLU 15 HB1 GLU 15 1.753 -6.982 -5.976 132 HG2 GLU 15 HG2 GLU 15 3.009 -5.572 -7.283 133 HG3 GLU 15 HG1 GLU 15 3.925 -6.892 -8.013 134 H ASP 16 HN ASP 16 3.659 -10.674 -6.426 135 HA ASP 16 HA ASP 16 6.122 -11.341 -7.231 136 HB2 ASP 16 HB2 ASP 16 5.053 -12.877 -8.863 137 HB3 ASP 16 HB1 ASP 16 4.217 -12.820 -7.312 138 H GLU 17 HN GLU 17 4.187 -9.095 -9.234 139 HA GLU 17 HA GLU 17 6.270 -9.375 -11.358 140 HB2 GLU 17 HB2 GLU 17 4.642 -8.428 -12.817 141 HB3 GLU 17 HB1 GLU 17 3.764 -9.546 -11.774 142 HG2 GLU 17 HG2 GLU 17 3.741 -7.163 -10.347 143 HG3 GLU 17 HG1 GLU 17 3.502 -6.651 -12.019 144 H SER 18 HN SER 18 6.866 -7.301 -12.513 145 HA SER 18 HA SER 18 7.738 -5.271 -10.523 146 HB2 SER 18 HB2 SER 18 8.475 -6.076 -13.335 147 HB3 SER 18 HB1 SER 18 9.049 -4.555 -12.657 148 HG SER 18 HG SER 18 10.576 -5.952 -12.046 149 H MET 19 HN MET 19 5.276 -5.652 -12.915 150 HA MET 19 HA MET 19 5.005 -3.083 -14.036 151 HB2 MET 19 HB2 MET 19 2.823 -4.862 -12.897 152 HB3 MET 19 HB1 MET 19 2.619 -3.649 -14.162 153 HG2 MET 19 HG2 MET 19 4.770 -5.473 -14.792 154 HG3 MET 19 HG1 MET 19 3.256 -6.338 -14.518 155 HE1 MET 19 HE1 MET 19 2.191 -6.439 -17.944 156 HE2 MET 19 HE2 MET 19 2.532 -7.178 -16.382 157 HE3 MET 19 HE3 MET 19 3.854 -6.838 -17.494 158 H ILE 20 HN ILE 20 4.607 -4.182 -10.777 159 HA ILE 20 HA ILE 20 3.087 -1.843 -9.944 160 HB ILE 20 HB ILE 20 2.717 -3.961 -8.879 161 HG12 ILE 20 HG12 ILE 20 4.395 -2.574 -6.833 162 HG13 ILE 20 HG11 ILE 20 3.008 -1.717 -7.511 163 HG21 ILE 20 HG21 ILE 20 4.839 -4.769 -7.443 164 HG22 ILE 20 HG22 ILE 20 5.689 -4.009 -8.789 165 HG23 ILE 20 HG23 ILE 20 4.554 -5.326 -9.093 166 HD11 ILE 20 HD11 ILE 20 1.859 -4.114 -6.979 167 HD12 ILE 20 HD12 ILE 20 1.885 -2.780 -5.826 168 HD13 ILE 20 HD13 ILE 20 3.078 -4.074 -5.706 169 H ALA 21 HN ALA 21 6.295 -2.380 -10.682 170 HA ALA 21 HA ALA 21 7.469 -0.788 -8.514 171 HB1 ALA 21 HB1 ALA 21 9.057 -1.388 -10.908 172 HB2 ALA 21 HB2 ALA 21 8.262 -2.803 -10.221 173 HB3 ALA 21 HB3 ALA 21 9.351 -1.835 -9.229 174 H MET 22 HN MET 22 7.987 -0.398 -12.028 175 HA MET 22 HA MET 22 8.576 2.357 -11.862 176 HB2 MET 22 HB2 MET 22 8.368 0.392 -13.822 177 HB3 MET 22 HB1 MET 22 7.131 1.559 -14.294 178 HG2 MET 22 HG2 MET 22 8.954 2.526 -15.330 179 HG3 MET 22 HG1 MET 22 9.092 3.293 -13.748 180 HE1 MET 22 HE1 MET 22 12.511 2.755 -12.909 181 HE2 MET 22 HE2 MET 22 10.974 3.604 -12.771 182 HE3 MET 22 HE3 MET 22 11.888 3.692 -14.276 183 H LEU 23 HN LEU 23 5.553 0.707 -11.644 184 HA LEU 23 HA LEU 23 3.814 2.938 -12.295 185 HB2 LEU 23 HB2 LEU 23 2.936 0.719 -12.400 186 HB3 LEU 23 HB1 LEU 23 3.594 0.301 -10.823 187 HG LEU 23 HG LEU 23 1.065 0.723 -10.957 188 HD11 LEU 23 HD11 LEU 23 3.011 1.392 -8.970 189 HD12 LEU 23 HD12 LEU 23 1.347 0.857 -8.739 190 HD13 LEU 23 HD13 LEU 23 1.706 2.577 -8.897 191 HD21 LEU 23 HD21 LEU 23 2.148 3.450 -11.562 192 HD22 LEU 23 HD22 LEU 23 0.725 3.333 -10.533 193 HD23 LEU 23 HD23 LEU 23 0.693 2.659 -12.162 194 H ILE 24 HN ILE 24 5.977 2.355 -9.756 195 HA ILE 24 HA ILE 24 4.381 3.840 -7.738 196 HB ILE 24 HB ILE 24 5.854 1.619 -7.526 197 HG12 ILE 24 HG12 ILE 24 6.178 3.592 -5.290 198 HG13 ILE 24 HG11 ILE 24 4.545 3.159 -5.792 199 HG21 ILE 24 HG21 ILE 24 7.824 3.869 -7.015 200 HG22 ILE 24 HG22 ILE 24 7.988 2.571 -8.194 201 HG23 ILE 24 HG23 ILE 24 8.058 2.208 -6.473 202 HD11 ILE 24 HD11 ILE 24 6.593 1.518 -4.406 203 HD12 ILE 24 HD12 ILE 24 5.686 0.687 -5.669 204 HD13 ILE 24 HD13 ILE 24 4.834 1.431 -4.317 205 H GLU 25 HN GLU 25 7.601 3.996 -9.297 206 HA GLU 25 HA GLU 25 8.357 6.482 -8.068 207 HB2 GLU 25 HB2 GLU 25 9.228 4.895 -10.480 208 HB3 GLU 25 HB1 GLU 25 10.013 6.417 -10.055 209 HG2 GLU 25 HG2 GLU 25 9.861 5.025 -7.625 210 HG3 GLU 25 HG1 GLU 25 10.295 3.793 -8.816 211 H ASP 26 HN ASP 26 6.226 5.797 -10.722 212 HA ASP 26 HA ASP 26 6.540 8.418 -12.007 213 HB2 ASP 26 HB2 ASP 26 4.963 7.555 -13.543 214 HB3 ASP 26 HB1 ASP 26 5.809 6.111 -12.988 215 H THR 27 HN THR 27 4.101 6.840 -9.925 216 HA THR 27 HA THR 27 2.282 9.025 -9.771 217 HB THR 27 HB THR 27 2.317 7.576 -7.325 218 HG1 THR 27 HG1 THR 27 2.911 5.625 -7.862 219 HG21 THR 27 HG21 THR 27 0.633 6.554 -9.515 220 HG22 THR 27 HG22 THR 27 0.526 8.297 -9.264 221 HG23 THR 27 HG23 THR 27 0.166 7.191 -7.938 222 H LEU 28 HN LEU 28 5.005 8.096 -7.651 223 HA LEU 28 HA LEU 28 4.739 10.281 -5.820 224 HB2 LEU 28 HB2 LEU 28 6.211 8.824 -4.895 225 HB3 LEU 28 HB1 LEU 28 6.516 8.062 -6.447 226 HG LEU 28 HG LEU 28 8.568 9.010 -5.371 227 HD11 LEU 28 HD11 LEU 28 7.692 9.265 -8.048 228 HD12 LEU 28 HD12 LEU 28 9.353 9.199 -7.461 229 HD13 LEU 28 HD13 LEU 28 8.548 10.756 -7.657 230 HD21 LEU 28 HD21 LEU 28 8.181 11.763 -6.057 231 HD22 LEU 28 HD22 LEU 28 8.528 11.070 -4.473 232 HD23 LEU 28 HD23 LEU 28 6.858 11.264 -5.006 233 H CYS 29 HN CYS 29 6.178 9.989 -9.011 234 HA CYS 29 HA CYS 29 7.838 12.294 -9.061 235 HB2 CYS 29 HB2 CYS 29 6.906 10.309 -10.790 236 HB3 CYS 29 HB1 CYS 29 6.304 11.805 -11.500 237 HG CYS 29 HG CYS 29 9.024 10.967 -11.926 238 H GLU 30 HN GLU 30 4.351 11.927 -9.278 239 HA GLU 30 HA GLU 30 3.938 14.742 -10.020 240 HB2 GLU 30 HB2 GLU 30 2.515 13.188 -11.102 241 HB3 GLU 30 HB1 GLU 30 2.238 12.284 -9.614 242 HG2 GLU 30 HG2 GLU 30 1.094 14.369 -8.699 243 HG3 GLU 30 HG1 GLU 30 1.163 15.020 -10.337 244 H LEU 31 HN LEU 31 3.702 12.632 -7.202 245 HA LEU 31 HA LEU 31 2.392 14.769 -5.610 246 HB2 LEU 31 HB2 LEU 31 3.274 11.956 -4.888 247 HB3 LEU 31 HB1 LEU 31 2.173 12.978 -3.961 248 HG LEU 31 HG LEU 31 1.667 12.035 -6.800 249 HD11 LEU 31 HD11 LEU 31 1.652 10.286 -4.897 250 HD12 LEU 31 HD12 LEU 31 0.211 10.394 -5.908 251 HD13 LEU 31 HD13 LEU 31 0.222 11.133 -4.306 252 HD21 LEU 31 HD21 LEU 31 0.437 14.017 -6.527 253 HD22 LEU 31 HD22 LEU 31 0.162 13.724 -4.811 254 HD23 LEU 31 HD23 LEU 31 -0.718 12.786 -6.018 255 H GLY 32 HN GLY 32 5.453 12.936 -5.722 256 HA2 GLY 32 HA2 GLY 32 7.585 13.712 -4.991 257 HA3 GLY 32 HA1 GLY 32 6.798 15.137 -4.295 258 H HIS 33 HN HIS 33 5.682 11.874 -3.711 259 HA HIS 33 HA HIS 33 5.526 12.127 -0.897 260 HB2 HIS 33 HB2 HIS 33 5.453 10.001 -2.983 261 HB3 HIS 33 HB1 HIS 33 5.582 9.467 -1.309 262 HD1 HIS 33 HD1 HIS 33 2.994 9.649 -3.487 263 HD2 HIS 33 HD2 HIS 33 3.592 11.621 0.138 264 HE1 HIS 33 HE1 HIS 33 0.703 10.347 -2.666 265 H GLU 34 HN GLU 34 7.204 9.280 -0.808 266 HA GLU 34 HA GLU 34 9.844 10.662 -0.476 267 HB2 GLU 34 HB2 GLU 34 8.222 10.262 1.592 268 HB3 GLU 34 HB1 GLU 34 8.943 8.654 1.540 269 HG2 GLU 34 HG2 GLU 34 10.226 10.168 3.022 270 HG3 GLU 34 HG1 GLU 34 11.193 9.648 1.642 271 H VAL 35 HN VAL 35 8.674 7.335 0.228 272 HA VAL 35 HA VAL 35 10.871 6.351 -1.576 273 HB VAL 35 HB VAL 35 10.884 4.404 0.004 274 HG11 VAL 35 HG11 VAL 35 11.919 6.965 0.374 275 HG12 VAL 35 HG12 VAL 35 12.406 5.514 1.251 276 HG13 VAL 35 HG13 VAL 35 11.176 6.582 1.927 277 HG21 VAL 35 HG21 VAL 35 8.405 4.999 0.660 278 HG22 VAL 35 HG22 VAL 35 9.175 6.047 1.853 279 HG23 VAL 35 HG23 VAL 35 9.484 4.310 1.874 280 H ALA 36 HN ALA 36 10.108 3.682 -1.655 281 HA ALA 36 HA ALA 36 7.326 3.252 -2.178 282 HB1 ALA 36 HB1 ALA 36 7.285 4.472 -4.110 283 HB2 ALA 36 HB2 ALA 36 8.103 3.074 -4.808 284 HB3 ALA 36 HB3 ALA 36 9.042 4.461 -4.256 285 H ALA 37 HN ALA 37 6.972 1.024 -2.578 286 HA ALA 37 HA ALA 37 9.480 -0.614 -2.879 287 HB1 ALA 37 HB1 ALA 37 7.242 -0.673 -0.981 288 HB2 ALA 37 HB2 ALA 37 8.841 -1.395 -0.843 289 HB3 ALA 37 HB3 ALA 37 7.562 -2.243 -1.710 290 H THR 38 HN THR 38 9.325 -2.424 -4.276 291 HA THR 38 HA THR 38 6.821 -2.604 -5.902 292 HB THR 38 HB THR 38 8.078 -2.387 -7.876 293 HG1 THR 38 HG1 THR 38 9.810 -3.560 -7.852 294 HG21 THR 38 HG21 THR 38 9.595 -0.658 -5.903 295 HG22 THR 38 HG22 THR 38 8.001 -0.261 -6.544 296 HG23 THR 38 HG23 THR 38 9.389 -0.352 -7.627 297 H ALA 39 HN ALA 39 6.715 -4.574 -7.212 298 HA ALA 39 HA ALA 39 6.664 -6.907 -7.352 299 HB1 ALA 39 HB1 ALA 39 9.492 -6.154 -6.788 300 HB2 ALA 39 HB2 ALA 39 8.804 -6.944 -8.208 301 HB3 ALA 39 HB3 ALA 39 9.060 -7.863 -6.724 302 H SER 40 HN SER 40 6.629 -8.871 -5.946 303 HA SER 40 HA SER 40 6.002 -8.118 -3.181 304 HB2 SER 40 HB2 SER 40 5.292 -10.454 -3.042 305 HB3 SER 40 HB1 SER 40 4.651 -9.703 -4.492 306 HG SER 40 HG SER 40 5.552 -11.425 -5.371 307 H ARG 41 HN ARG 41 7.867 -7.676 -2.006 308 HA ARG 41 HA ARG 41 10.002 -9.752 -1.999 309 HB2 ARG 41 HB2 ARG 41 10.247 -7.212 -2.772 310 HB3 ARG 41 HB1 ARG 41 10.426 -6.957 -1.034 311 HG2 ARG 41 HG2 ARG 41 12.625 -7.322 -2.076 312 HG3 ARG 41 HG1 ARG 41 12.234 -8.648 -0.980 313 HD2 ARG 41 HD2 ARG 41 11.819 -10.152 -2.737 314 HD3 ARG 41 HD1 ARG 41 11.528 -8.849 -3.907 315 HE ARG 41 HE ARG 41 14.239 -9.045 -2.699 316 HH11 ARG 41 HH21 ARG 41 12.718 -7.800 -5.306 317 HH12 ARG 41 HH22 ARG 41 13.700 -8.553 -6.518 318 HH21 ARG 41 HH11 ARG 41 15.254 -10.713 -4.293 319 HH22 ARG 41 HH12 ARG 41 15.138 -10.199 -5.943 320 H MET 42 HN MET 42 10.373 -10.752 -0.049 321 HA MET 42 HA MET 42 8.695 -10.235 2.238 322 HB2 MET 42 HB2 MET 42 11.145 -11.918 1.670 323 HB3 MET 42 HB1 MET 42 10.345 -11.933 3.243 324 HG2 MET 42 HG2 MET 42 8.174 -12.342 1.805 325 HG3 MET 42 HG1 MET 42 9.324 -12.899 0.589 326 HE1 MET 42 HE1 MET 42 8.718 -15.504 0.519 327 HE2 MET 42 HE2 MET 42 7.328 -14.687 1.230 328 HE3 MET 42 HE3 MET 42 7.921 -16.186 1.943 329 H GLN 43 HN GLN 43 12.037 -9.431 1.368 330 HA GLN 43 HA GLN 43 12.895 -8.416 3.900 331 HB2 GLN 43 HB2 GLN 43 13.642 -7.627 1.062 332 HB3 GLN 43 HB1 GLN 43 14.615 -7.314 2.500 333 HG2 GLN 43 HG2 GLN 43 13.913 -9.997 1.292 334 HG3 GLN 43 HG1 GLN 43 15.518 -9.300 1.516 335 HE21 GLN 43 HE21 GLN 43 13.829 -11.741 2.740 336 HE22 GLN 43 HE22 GLN 43 14.242 -11.650 4.383 337 H GLU 44 HN GLU 44 11.492 -6.742 1.063 338 HA GLU 44 HA GLU 44 11.344 -4.188 2.425 339 HB2 GLU 44 HB2 GLU 44 10.025 -5.254 -0.092 340 HB3 GLU 44 HB1 GLU 44 10.144 -3.551 0.352 341 HG2 GLU 44 HG2 GLU 44 12.759 -4.663 0.538 342 HG3 GLU 44 HG1 GLU 44 12.079 -5.165 -1.010 343 H ALA 45 HN ALA 45 8.942 -6.658 1.465 344 HA ALA 45 HA ALA 45 6.549 -5.552 2.296 345 HB1 ALA 45 HB1 ALA 45 6.164 -8.030 3.132 346 HB2 ALA 45 HB2 ALA 45 7.775 -8.292 2.464 347 HB3 ALA 45 HB3 ALA 45 6.469 -7.724 1.423 348 H LEU 46 HN LEU 46 8.382 -7.671 4.490 349 HA LEU 46 HA LEU 46 7.226 -7.157 6.931 350 HB2 LEU 46 HB2 LEU 46 9.036 -8.701 6.710 351 HB3 LEU 46 HB1 LEU 46 10.106 -7.462 6.058 352 HG LEU 46 HG LEU 46 8.979 -6.928 8.752 353 HD11 LEU 46 HD11 LEU 46 10.396 -9.390 8.118 354 HD12 LEU 46 HD12 LEU 46 9.646 -8.894 9.636 355 HD13 LEU 46 HD13 LEU 46 11.300 -8.405 9.268 356 HD21 LEU 46 HD21 LEU 46 10.689 -5.578 7.310 357 HD22 LEU 46 HD22 LEU 46 11.850 -6.789 7.853 358 HD23 LEU 46 HD23 LEU 46 11.012 -5.781 9.032 359 H ASP 47 HN ASP 47 9.539 -5.156 5.187 360 HA ASP 47 HA ASP 47 9.956 -3.182 7.206 361 HB2 ASP 47 HB2 ASP 47 10.802 -3.786 4.605 362 HB3 ASP 47 HB1 ASP 47 10.047 -2.198 4.469 363 H ILE 48 HN ILE 48 7.858 -3.051 4.301 364 HA ILE 48 HA ILE 48 6.589 -0.610 4.675 365 HB ILE 48 HB ILE 48 4.929 -1.397 3.259 366 HG12 ILE 48 HG12 ILE 48 5.061 -3.946 4.871 367 HG13 ILE 48 HG11 ILE 48 3.694 -2.857 4.647 368 HG21 ILE 48 HG21 ILE 48 6.777 -3.739 2.925 369 HG22 ILE 48 HG22 ILE 48 7.303 -2.100 2.537 370 HG23 ILE 48 HG23 ILE 48 5.927 -2.810 1.688 371 HD11 ILE 48 HD11 ILE 48 4.925 -4.661 2.536 372 HD12 ILE 48 HD12 ILE 48 3.655 -3.481 2.216 373 HD13 ILE 48 HD13 ILE 48 3.339 -4.850 3.282 374 H ALA 49 HN ALA 49 6.242 -3.504 6.629 375 HA ALA 49 HA ALA 49 3.935 -2.376 8.089 376 HB1 ALA 49 HB1 ALA 49 4.114 -4.785 7.540 377 HB2 ALA 49 HB2 ALA 49 4.064 -4.535 9.284 378 HB3 ALA 49 HB3 ALA 49 5.599 -4.883 8.487 379 H ARG 50 HN ARG 50 7.083 -3.704 9.198 380 HA ARG 50 HA ARG 50 7.006 -2.285 11.697 381 HB2 ARG 50 HB2 ARG 50 9.247 -3.620 10.149 382 HB3 ARG 50 HB1 ARG 50 9.329 -3.168 11.857 383 HG2 ARG 50 HG2 ARG 50 7.929 -4.861 12.514 384 HG3 ARG 50 HG1 ARG 50 6.978 -4.791 11.029 385 HD2 ARG 50 HD2 ARG 50 8.094 -6.674 10.406 386 HD3 ARG 50 HD1 ARG 50 9.506 -5.624 10.167 387 HE ARG 50 HE ARG 50 8.922 -7.152 12.664 388 HH11 ARG 50 HH11 ARG 50 11.292 -6.941 10.475 389 HH12 ARG 50 HH12 ARG 50 12.548 -6.391 11.534 390 HH21 ARG 50 HH21 ARG 50 10.391 -5.677 14.155 391 HH22 ARG 50 HH22 ARG 50 12.038 -5.681 13.621 392 H LYS 51 HN LYS 51 7.998 -1.358 8.517 393 HA LYS 51 HA LYS 51 10.034 0.540 9.015 394 HB2 LYS 51 HB2 LYS 51 9.423 -0.105 6.785 395 HB3 LYS 51 HB1 LYS 51 7.747 0.382 7.035 396 HG2 LYS 51 HG2 LYS 51 8.804 2.103 5.733 397 HG3 LYS 51 HG1 LYS 51 8.576 2.745 7.361 398 HD2 LYS 51 HD2 LYS 51 10.795 3.246 7.257 399 HD3 LYS 51 HD1 LYS 51 11.037 1.527 7.563 400 HE2 LYS 51 HE2 LYS 51 12.204 1.569 5.594 401 HE3 LYS 51 HE1 LYS 51 10.600 1.571 4.834 402 HZ1 LYS 51 HZ1 LYS 51 12.023 4.016 5.740 403 HZ2 LYS 51 HZ2 LYS 51 10.563 3.948 4.875 404 HZ3 LYS 51 HZ3 LYS 51 12.015 3.467 4.136 405 H GLY 52 HN GLY 52 6.488 0.963 9.033 406 HA2 GLY 52 HA2 GLY 52 5.191 2.467 10.298 407 HA3 GLY 52 HA1 GLY 52 6.671 3.022 11.083 408 H GLN 53 HN GLN 53 8.199 4.046 9.115 409 HA GLN 53 HA GLN 53 6.694 6.438 8.302 410 HB2 GLN 53 HB2 GLN 53 8.902 7.266 7.741 411 HB3 GLN 53 HB1 GLN 53 9.031 6.375 9.259 412 HG2 GLN 53 HG2 GLN 53 10.460 4.895 8.350 413 HG3 GLN 53 HG1 GLN 53 9.369 4.594 6.997 414 HE21 GLN 53 HE21 GLN 53 12.456 5.492 7.487 415 HE22 GLN 53 HE22 GLN 53 12.676 6.593 6.213 416 H PHE 54 HN PHE 54 5.630 4.255 7.000 417 HA PHE 54 HA PHE 54 6.514 4.633 4.144 418 HB2 PHE 54 HB2 PHE 54 6.332 2.282 3.862 419 HB3 PHE 54 HB1 PHE 54 7.011 2.410 5.485 420 HD1 PHE 54 HD1 PHE 54 5.451 2.320 7.488 421 HD2 PHE 54 HD2 PHE 54 4.174 1.362 3.512 422 HE1 PHE 54 HE1 PHE 54 3.440 1.219 8.401 423 HE2 PHE 54 HE2 PHE 54 2.161 0.273 4.422 424 HZ PHE 54 HZ PHE 54 1.792 0.177 6.867 425 H ASP 55 HN ASP 55 4.157 5.232 6.351 426 HA ASP 55 HA ASP 55 1.851 5.528 6.361 427 HB2 ASP 55 HB2 ASP 55 1.119 6.728 4.239 428 HB3 ASP 55 HB1 ASP 55 2.490 7.422 5.098 429 H ILE 56 HN ILE 56 2.370 4.219 3.020 430 HA ILE 56 HA ILE 56 0.048 2.405 3.611 431 HB ILE 56 HB ILE 56 0.958 3.487 0.941 432 HG12 ILE 56 HG12 ILE 56 -0.897 4.678 3.019 433 HG13 ILE 56 HG11 ILE 56 0.507 5.427 2.267 434 HG21 ILE 56 HG21 ILE 56 -1.410 1.989 1.988 435 HG22 ILE 56 HG22 ILE 56 -0.521 1.770 0.483 436 HG23 ILE 56 HG23 ILE 56 -1.651 3.110 0.649 437 HD11 ILE 56 HD11 ILE 56 -0.635 5.451 0.098 438 HD12 ILE 56 HD12 ILE 56 -1.610 6.285 1.308 439 HD13 ILE 56 HD13 ILE 56 -2.035 4.647 0.810 440 H ALA 57 HN ALA 57 0.066 0.244 2.804 441 HA ALA 57 HA ALA 57 2.598 -0.686 1.491 442 HB1 ALA 57 HB1 ALA 57 1.394 -1.500 4.113 443 HB2 ALA 57 HB2 ALA 57 3.093 -1.303 3.684 444 HB3 ALA 57 HB3 ALA 57 2.209 -2.732 3.149 445 H ILE 58 HN ILE 58 2.195 -2.461 0.019 446 HA ILE 58 HA ILE 58 -0.605 -3.492 0.061 447 HB ILE 58 HB ILE 58 0.867 -2.129 -2.188 448 HG12 ILE 58 HG12 ILE 58 -1.535 -1.065 -2.243 449 HG13 ILE 58 HG11 ILE 58 -1.659 -1.716 -0.608 450 HG21 ILE 58 HG21 ILE 58 -1.173 -2.813 -3.561 451 HG22 ILE 58 HG22 ILE 58 -1.518 -3.989 -2.291 452 HG23 ILE 58 HG23 ILE 58 -0.020 -4.103 -3.216 453 HD11 ILE 58 HD11 ILE 58 -0.409 0.686 -1.387 454 HD12 ILE 58 HD12 ILE 58 0.897 -0.423 -0.968 455 HD13 ILE 58 HD13 ILE 58 -0.369 -0.067 0.207 456 H ILE 59 HN ILE 59 0.090 -5.540 0.700 457 HA ILE 59 HA ILE 59 2.006 -7.071 -1.027 458 HB ILE 59 HB ILE 59 0.350 -8.073 1.305 459 HG12 ILE 59 HG12 ILE 59 1.231 -6.119 2.292 460 HG13 ILE 59 HG11 ILE 59 2.378 -7.380 2.737 461 HG21 ILE 59 HG21 ILE 59 2.105 -9.311 -0.313 462 HG22 ILE 59 HG22 ILE 59 1.836 -9.782 1.366 463 HG23 ILE 59 HG23 ILE 59 3.194 -8.737 0.947 464 HD11 ILE 59 HD11 ILE 59 3.212 -6.425 0.240 465 HD12 ILE 59 HD12 ILE 59 3.988 -6.153 1.793 466 HD13 ILE 59 HD13 ILE 59 2.804 -4.996 1.181 467 H ASP 60 HN ASP 60 0.447 -6.838 -2.872 468 HA ASP 60 HA ASP 60 -2.224 -7.917 -2.482 469 HB2 ASP 60 HB2 ASP 60 -2.605 -6.738 -4.388 470 HB3 ASP 60 HB1 ASP 60 -0.952 -6.163 -4.213 471 H VAL 61 HN VAL 61 -2.784 -9.351 -4.687 472 HA VAL 61 HA VAL 61 -2.765 -11.538 -5.485 473 HB VAL 61 HB VAL 61 -0.231 -10.365 -5.711 474 HG11 VAL 61 HG11 VAL 61 1.312 -12.315 -5.517 475 HG12 VAL 61 HG12 VAL 61 0.022 -13.233 -4.743 476 HG13 VAL 61 HG13 VAL 61 0.684 -11.804 -3.951 477 HG21 VAL 61 HG21 VAL 61 -1.402 -12.891 -6.902 478 HG22 VAL 61 HG22 VAL 61 0.046 -12.093 -7.516 479 HG23 VAL 61 HG23 VAL 61 -1.505 -11.257 -7.555 480 H ASN 62 HN ASN 62 -3.986 -12.324 -3.718 481 HA ASN 62 HA ASN 62 -2.409 -13.859 -1.685 482 HB2 ASN 62 HB2 ASN 62 -4.292 -11.636 -1.406 483 HB3 ASN 62 HB1 ASN 62 -4.778 -13.041 -0.456 484 HD21 ASN 62 HD21 ASN 62 -2.360 -10.512 -0.765 485 HD22 ASN 62 HD22 ASN 62 -1.492 -10.905 0.638 486 H LEU 63 HN LEU 63 -2.942 -15.636 -3.300 487 HA LEU 63 HA LEU 63 -5.575 -16.826 -2.598 488 HB2 LEU 63 HB2 LEU 63 -5.812 -17.373 -5.086 489 HB3 LEU 63 HB1 LEU 63 -6.029 -15.678 -4.654 490 HG LEU 63 HG LEU 63 -3.304 -16.692 -5.412 491 HD11 LEU 63 HD11 LEU 63 -5.547 -16.883 -7.102 492 HD12 LEU 63 HD12 LEU 63 -3.852 -16.963 -7.585 493 HD13 LEU 63 HD13 LEU 63 -4.706 -15.419 -7.612 494 HD21 LEU 63 HD21 LEU 63 -3.578 -14.191 -6.426 495 HD22 LEU 63 HD22 LEU 63 -3.044 -14.496 -4.774 496 HD23 LEU 63 HD23 LEU 63 -4.731 -14.099 -5.096 497 H ASP 64 HN ASP 64 -5.524 -19.153 -3.868 498 HA ASP 64 HA ASP 64 -4.508 -21.289 -3.734 499 HB2 ASP 64 HB2 ASP 64 -3.180 -19.587 -5.456 500 HB3 ASP 64 HB1 ASP 64 -1.869 -20.176 -4.428 501 H GLY 65 HN GLY 65 -4.257 -19.307 -1.370 502 HA2 GLY 65 HA2 GLY 65 -3.311 -20.605 0.706 503 HA3 GLY 65 HA1 GLY 65 -1.770 -20.343 -0.113 504 H GLU 66 HN GLU 66 -3.076 -17.721 -1.117 505 HA GLU 66 HA GLU 66 -2.937 -15.463 -0.473 506 HB2 GLU 66 HB2 GLU 66 -3.857 -16.728 2.128 507 HB3 GLU 66 HB1 GLU 66 -4.039 -15.029 1.693 508 HG2 GLU 66 HG2 GLU 66 -5.199 -16.100 -0.467 509 HG3 GLU 66 HG1 GLU 66 -5.510 -17.414 0.669 510 HA PRO 67 HA PRO 67 1.102 -16.238 1.681 511 HB2 PRO 67 HB2 PRO 67 2.704 -15.293 -0.320 512 HB3 PRO 67 HB1 PRO 67 2.155 -16.978 -0.239 513 HG2 PRO 67 HG2 PRO 67 1.170 -14.748 -1.931 514 HG3 PRO 67 HG1 PRO 67 1.311 -16.472 -2.302 515 HD2 PRO 67 HD2 PRO 67 -1.039 -15.193 -1.634 516 HD3 PRO 67 HD1 PRO 67 -0.753 -16.940 -1.471 517 H SER 68 HN SER 68 -0.043 -14.349 2.851 518 HA SER 68 HA SER 68 0.963 -11.672 1.963 519 HB2 SER 68 HB2 SER 68 -1.388 -11.691 2.294 520 HB3 SER 68 HB1 SER 68 -1.260 -12.707 3.725 521 HG SER 68 HG SER 68 -1.486 -10.166 3.734 522 H TYR 69 HN TYR 69 1.972 -14.136 3.867 523 HA TYR 69 HA TYR 69 3.299 -14.357 5.777 524 HB2 TYR 69 HB2 TYR 69 4.534 -11.811 5.893 525 HB3 TYR 69 HB1 TYR 69 5.186 -13.280 5.194 526 HD1 TYR 69 HD1 TYR 69 3.856 -13.773 2.750 527 HD2 TYR 69 HD2 TYR 69 4.768 -9.972 4.517 528 HE1 TYR 69 HE1 TYR 69 3.840 -12.719 0.514 529 HE2 TYR 69 HE2 TYR 69 4.742 -8.914 2.288 530 HH TYR 69 HH TYR 69 5.092 -10.477 -0.463 531 HA PRO 70 HA PRO 70 1.428 -12.373 9.174 532 HB2 PRO 70 HB2 PRO 70 3.449 -12.132 10.989 533 HB3 PRO 70 HB1 PRO 70 2.724 -13.692 10.556 534 HG2 PRO 70 HG2 PRO 70 5.304 -12.507 9.703 535 HG3 PRO 70 HG1 PRO 70 4.878 -14.199 9.996 536 HD2 PRO 70 HD2 PRO 70 5.086 -13.021 7.500 537 HD3 PRO 70 HD1 PRO 70 4.188 -14.513 7.854 538 H VAL 71 HN VAL 71 3.605 -10.686 7.275 539 HA VAL 71 HA VAL 71 3.751 -8.326 9.018 540 HB VAL 71 HB VAL 71 5.436 -7.631 7.649 541 HG11 VAL 71 HG11 VAL 71 6.751 -9.406 7.052 542 HG12 VAL 71 HG12 VAL 71 5.447 -10.226 6.197 543 HG13 VAL 71 HG13 VAL 71 5.520 -10.288 7.956 544 HG21 VAL 71 HG21 VAL 71 3.835 -8.654 5.289 545 HG22 VAL 71 HG22 VAL 71 5.399 -7.863 5.157 546 HG23 VAL 71 HG23 VAL 71 4.013 -6.978 5.793 547 H ALA 72 HN ALA 72 2.254 -9.105 5.833 548 HA ALA 72 HA ALA 72 0.753 -6.628 5.731 549 HB1 ALA 72 HB1 ALA 72 0.615 -7.473 3.645 550 HB2 ALA 72 HB2 ALA 72 -0.512 -8.676 4.256 551 HB3 ALA 72 HB3 ALA 72 1.214 -9.035 4.200 552 H ASP 73 HN ASP 73 -0.108 -10.024 6.475 553 HA ASP 73 HA ASP 73 -2.801 -9.706 7.125 554 HB2 ASP 73 HB2 ASP 73 -0.545 -11.430 7.974 555 HB3 ASP 73 HB1 ASP 73 -2.004 -11.512 8.952 556 H ILE 74 HN ILE 74 -0.018 -9.451 9.334 557 HA ILE 74 HA ILE 74 -1.445 -8.523 11.623 558 HB ILE 74 HB ILE 74 1.384 -8.203 10.588 559 HG12 ILE 74 HG12 ILE 74 0.071 -9.878 12.760 560 HG13 ILE 74 HG11 ILE 74 0.738 -10.467 11.239 561 HG21 ILE 74 HG21 ILE 74 1.393 -7.750 13.355 562 HG22 ILE 74 HG22 ILE 74 0.053 -6.774 12.749 563 HG23 ILE 74 HG23 ILE 74 1.676 -6.548 12.095 564 HD11 ILE 74 HD11 ILE 74 2.624 -8.888 12.870 565 HD12 ILE 74 HD12 ILE 74 2.876 -10.408 12.012 566 HD13 ILE 74 HD13 ILE 74 2.114 -10.409 13.603 567 H LEU 75 HN LEU 75 0.085 -6.841 8.906 568 HA LEU 75 HA LEU 75 -0.232 -4.159 9.699 569 HB2 LEU 75 HB2 LEU 75 0.796 -5.376 7.600 570 HB3 LEU 75 HB1 LEU 75 -0.787 -5.101 6.890 571 HG LEU 75 HG LEU 75 -0.426 -2.645 7.785 572 HD11 LEU 75 HD11 LEU 75 1.993 -2.044 7.729 573 HD12 LEU 75 HD12 LEU 75 2.394 -3.752 7.563 574 HD13 LEU 75 HD13 LEU 75 1.623 -3.168 9.036 575 HD21 LEU 75 HD21 LEU 75 1.385 -3.319 5.495 576 HD22 LEU 75 HD22 LEU 75 0.143 -2.072 5.607 577 HD23 LEU 75 HD23 LEU 75 -0.317 -3.754 5.344 578 H ALA 76 HN ALA 76 -2.584 -6.540 8.774 579 HA ALA 76 HA ALA 76 -4.719 -4.540 8.408 580 HB1 ALA 76 HB1 ALA 76 -4.827 -6.257 6.814 581 HB2 ALA 76 HB2 ALA 76 -5.972 -6.821 8.031 582 HB3 ALA 76 HB3 ALA 76 -4.341 -7.490 7.977 583 H GLU 77 HN GLU 77 -3.742 -7.175 10.587 584 HA GLU 77 HA GLU 77 -6.030 -7.200 12.269 585 HB2 GLU 77 HB2 GLU 77 -4.769 -8.797 13.276 586 HB3 GLU 77 HB1 GLU 77 -3.558 -8.463 12.045 587 HG2 GLU 77 HG2 GLU 77 -2.428 -6.884 13.504 588 HG3 GLU 77 HG1 GLU 77 -3.713 -7.019 14.708 589 H ARG 78 HN ARG 78 -3.041 -5.253 12.453 590 HA ARG 78 HA ARG 78 -4.158 -3.654 14.670 591 HB2 ARG 78 HB2 ARG 78 -1.861 -2.610 14.535 592 HB3 ARG 78 HB1 ARG 78 -1.826 -4.355 14.794 593 HG2 ARG 78 HG2 ARG 78 -0.700 -4.664 12.872 594 HG3 ARG 78 HG1 ARG 78 -1.940 -3.793 11.967 595 HD2 ARG 78 HD2 ARG 78 -0.669 -1.911 11.860 596 HD3 ARG 78 HD1 ARG 78 -0.232 -2.019 13.578 597 HE ARG 78 HE ARG 78 1.013 -4.057 11.865 598 HH11 ARG 78 HH21 ARG 78 1.282 -0.717 12.273 599 HH12 ARG 78 HH22 ARG 78 2.969 -0.734 12.667 600 HH21 ARG 78 HH11 ARG 78 3.169 -4.190 12.846 601 HH22 ARG 78 HH12 ARG 78 4.035 -2.697 12.991 602 H ASN 79 HN ASN 79 -3.674 -3.629 11.257 603 HA ASN 79 HA ASN 79 -3.873 -1.921 9.618 604 HB2 ASN 79 HB2 ASN 79 -6.305 -1.052 9.940 605 HB3 ASN 79 HB1 ASN 79 -6.057 -2.784 9.752 606 HD21 ASN 79 HD21 ASN 79 -6.063 -4.104 11.787 607 HD22 ASN 79 HD22 ASN 79 -6.903 -3.538 13.150 608 H VAL 80 HN VAL 80 -2.451 -0.282 9.881 609 HA VAL 80 HA VAL 80 -3.137 1.997 11.698 610 HB VAL 80 HB VAL 80 -0.882 0.416 11.323 611 HG11 VAL 80 HG11 VAL 80 0.755 1.495 10.076 612 HG12 VAL 80 HG12 VAL 80 -0.073 3.048 10.128 613 HG13 VAL 80 HG13 VAL 80 -0.681 1.761 9.090 614 HG21 VAL 80 HG21 VAL 80 -0.447 1.506 13.228 615 HG22 VAL 80 HG22 VAL 80 -1.639 2.739 12.820 616 HG23 VAL 80 HG23 VAL 80 0.034 2.921 12.292 617 HA PRO 81 HA PRO 81 -3.824 4.626 8.173 618 HB2 PRO 81 HB2 PRO 81 -1.693 6.366 7.898 619 HB3 PRO 81 HB1 PRO 81 -3.001 6.587 9.082 620 HG2 PRO 81 HG2 PRO 81 -0.307 5.329 9.466 621 HG3 PRO 81 HG1 PRO 81 -1.136 6.531 10.478 622 HD2 PRO 81 HD2 PRO 81 -1.172 3.994 11.198 623 HD3 PRO 81 HD1 PRO 81 -2.665 4.947 11.319 624 H PHE 82 HN PHE 82 -3.733 3.665 6.223 625 HA PHE 82 HA PHE 82 -1.324 3.344 4.644 626 HB2 PHE 82 HB2 PHE 82 -0.959 0.979 4.986 627 HB3 PHE 82 HB1 PHE 82 -0.973 1.755 6.567 628 HD1 PHE 82 HD2 PHE 82 -4.291 2.028 5.979 629 HD2 PHE 82 HD1 PHE 82 -1.384 -1.109 6.421 630 HE1 PHE 82 HE2 PHE 82 -6.063 0.504 6.776 631 HE2 PHE 82 HE1 PHE 82 -3.176 -2.637 7.219 632 HZ PHE 82 HZ PHE 82 -5.507 -1.827 7.395 633 H ILE 83 HN ILE 83 -2.284 0.668 3.723 634 HA ILE 83 HA ILE 83 -4.967 0.689 2.817 635 HB ILE 83 HB ILE 83 -3.177 2.528 1.583 636 HG12 ILE 83 HG12 ILE 83 -5.916 1.840 0.561 637 HG13 ILE 83 HG11 ILE 83 -5.708 2.604 2.138 638 HG21 ILE 83 HG21 ILE 83 -3.701 1.843 -0.837 639 HG22 ILE 83 HG22 ILE 83 -4.086 0.252 -0.181 640 HG23 ILE 83 HG23 ILE 83 -2.456 0.903 -0.013 641 HD11 ILE 83 HD11 ILE 83 -4.235 3.804 -0.159 642 HD12 ILE 83 HD12 ILE 83 -4.970 4.588 1.238 643 HD13 ILE 83 HD13 ILE 83 -5.981 4.049 -0.102 644 H PHE 84 HN PHE 84 -5.221 -1.072 1.170 645 HA PHE 84 HA PHE 84 -2.834 -2.746 0.660 646 HB2 PHE 84 HB2 PHE 84 -3.973 -2.938 3.030 647 HB3 PHE 84 HB1 PHE 84 -5.154 -3.903 2.154 648 HD1 PHE 84 HD1 PHE 84 -1.600 -3.676 3.201 649 HD2 PHE 84 HD2 PHE 84 -4.587 -6.093 1.277 650 HE1 PHE 84 HE1 PHE 84 -0.137 -5.664 3.398 651 HE2 PHE 84 HE2 PHE 84 -3.107 -8.070 1.471 652 HZ PHE 84 HZ PHE 84 -0.900 -7.853 2.520 653 H ALA 85 HN ALA 85 -3.539 -4.764 -0.575 654 HA ALA 85 HA ALA 85 -6.192 -4.815 -1.753 655 HB1 ALA 85 HB1 ALA 85 -3.873 -3.467 -3.065 656 HB2 ALA 85 HB2 ALA 85 -5.584 -3.048 -3.121 657 HB3 ALA 85 HB3 ALA 85 -4.972 -4.386 -4.092 658 H THR 86 HN THR 86 -6.528 -6.959 -2.299 659 HA THR 86 HA THR 86 -4.320 -8.524 -3.475 660 HB THR 86 HB THR 86 -3.828 -9.792 -1.651 661 HG1 THR 86 HG1 THR 86 -5.505 -10.525 -0.238 662 HG21 THR 86 HG21 THR 86 -3.519 -7.789 -0.467 663 HG22 THR 86 HG22 THR 86 -4.575 -8.719 0.595 664 HG23 THR 86 HG23 THR 86 -5.245 -7.437 -0.403 665 H GLY 87 HN GLY 87 -5.447 -11.058 -3.146 666 HA2 GLY 87 HA2 GLY 87 -7.501 -11.027 -5.139 667 HA3 GLY 87 HA1 GLY 87 -7.029 -12.435 -4.186 668 H TYR 88 HN TYR 88 -7.680 -10.848 -1.623 669 HA TYR 88 HA TYR 88 -10.572 -11.490 -1.768 670 HB2 TYR 88 HB2 TYR 88 -10.450 -11.642 0.645 671 HB3 TYR 88 HB1 TYR 88 -9.109 -12.531 -0.060 672 HD1 TYR 88 HD1 TYR 88 -8.046 -9.337 -0.619 673 HD2 TYR 88 HD2 TYR 88 -8.846 -11.960 2.675 674 HE1 TYR 88 HE1 TYR 88 -6.505 -8.026 0.798 675 HE2 TYR 88 HE2 TYR 88 -7.284 -10.666 4.085 676 HH TYR 88 HH TYR 88 -5.099 -8.437 2.846 677 H GLY 89 HN GLY 89 -8.777 -8.697 -2.164 678 HA2 GLY 89 HA2 GLY 89 -9.412 -6.442 -2.141 679 HA3 GLY 89 HA1 GLY 89 -11.077 -7.020 -2.074 680 H SER 90 HN SER 90 -8.250 -6.940 0.090 681 HA SER 90 HA SER 90 -8.079 -6.131 2.290 682 HB2 SER 90 HB2 SER 90 -9.257 -4.214 2.504 683 HB3 SER 90 HB1 SER 90 -10.078 -4.624 1.005 684 HG SER 90 HG SER 90 -11.750 -5.403 2.124 685 H LYS 91 HN LYS 91 -8.453 -7.158 4.264 686 HA LYS 91 HA LYS 91 -10.446 -9.336 4.267 687 HB2 LYS 91 HB2 LYS 91 -8.880 -10.408 5.548 688 HB3 LYS 91 HB1 LYS 91 -7.808 -9.146 4.952 689 HG2 LYS 91 HG2 LYS 91 -8.332 -7.770 6.938 690 HG3 LYS 91 HG1 LYS 91 -9.345 -9.075 7.558 691 HD2 LYS 91 HD2 LYS 91 -7.432 -10.579 7.649 692 HD3 LYS 91 HD1 LYS 91 -6.400 -9.362 6.896 693 HE2 LYS 91 HE2 LYS 91 -5.890 -8.983 9.136 694 HE3 LYS 91 HE1 LYS 91 -7.278 -7.891 8.960 695 HZ1 LYS 91 HZ1 LYS 91 -8.304 -10.440 9.374 696 HZ2 LYS 91 HZ2 LYS 91 -8.351 -9.123 10.447 697 HZ3 LYS 91 HZ3 LYS 91 -7.075 -10.239 10.526 698 H GLY 92 HN GLY 92 -10.206 -6.151 5.325 699 HA2 GLY 92 HA2 GLY 92 -12.481 -5.477 6.401 700 HA3 GLY 92 HA1 GLY 92 -11.995 -6.603 7.671 701 H LEU 93 HN LEU 93 -9.148 -5.462 6.696 702 HA LEU 93 HA LEU 93 -8.338 -4.055 8.882 703 HB2 LEU 93 HB2 LEU 93 -6.564 -3.353 7.534 704 HB3 LEU 93 HB1 LEU 93 -7.202 -4.711 6.624 705 HG LEU 93 HG LEU 93 -6.811 -2.971 5.044 706 HD11 LEU 93 HD11 LEU 93 -8.779 -3.771 4.233 707 HD12 LEU 93 HD12 LEU 93 -9.355 -2.162 4.662 708 HD13 LEU 93 HD13 LEU 93 -9.639 -3.510 5.741 709 HD21 LEU 93 HD21 LEU 93 -7.303 -1.261 7.219 710 HD22 LEU 93 HD22 LEU 93 -8.537 -0.873 6.020 711 HD23 LEU 93 HD23 LEU 93 -6.833 -0.801 5.582 712 H ASP 94 HN ASP 94 -8.743 -2.118 9.839 713 HA ASP 94 HA ASP 94 -10.593 -0.223 8.424 714 HB2 ASP 94 HB2 ASP 94 -11.229 0.423 10.746 715 HB3 ASP 94 HB1 ASP 94 -11.465 -1.301 10.460 716 H THR 95 HN THR 95 -10.135 2.056 8.635 717 HA THR 95 HA THR 95 -7.777 3.041 10.009 718 HB THR 95 HB THR 95 -6.732 1.751 8.199 719 HG1 THR 95 HG1 THR 95 -5.456 3.371 7.463 720 HG21 THR 95 HG21 THR 95 -8.821 3.105 6.621 721 HG22 THR 95 HG22 THR 95 -8.050 1.539 6.367 722 HG23 THR 95 HG23 THR 95 -7.235 3.015 5.852 723 H ARG 96 HN ARG 96 -7.186 5.298 8.786 724 HA ARG 96 HA ARG 96 -9.606 6.900 8.939 725 HB2 ARG 96 HB2 ARG 96 -6.855 7.641 7.898 726 HB3 ARG 96 HB1 ARG 96 -8.047 8.718 8.626 727 HG2 ARG 96 HG2 ARG 96 -7.438 6.489 10.390 728 HG3 ARG 96 HG1 ARG 96 -5.976 7.377 9.960 729 HD2 ARG 96 HD2 ARG 96 -8.281 9.112 10.594 730 HD3 ARG 96 HD1 ARG 96 -7.691 8.145 11.960 731 HE ARG 96 HE ARG 96 -5.348 9.033 10.952 732 HH11 ARG 96 HH21 ARG 96 -8.221 10.493 12.106 733 HH12 ARG 96 HH22 ARG 96 -7.571 12.100 12.119 734 HH21 ARG 96 HH11 ARG 96 -4.536 11.173 10.717 735 HH22 ARG 96 HH12 ARG 96 -5.487 12.485 11.327 736 H TYR 97 HN TYR 97 -8.418 4.913 6.526 737 HA TYR 97 HA TYR 97 -8.969 6.672 4.231 738 HB2 TYR 97 HB2 TYR 97 -8.315 3.736 4.580 739 HB3 TYR 97 HB1 TYR 97 -8.507 4.509 3.009 740 HD1 TYR 97 HD1 TYR 97 -6.592 4.816 6.226 741 HD2 TYR 97 HD2 TYR 97 -6.699 5.630 2.012 742 HE1 TYR 97 HE1 TYR 97 -4.263 5.655 6.329 743 HE2 TYR 97 HE2 TYR 97 -4.372 6.468 2.115 744 HH TYR 97 HH TYR 97 -2.808 7.193 5.024 745 H SER 98 HN SER 98 -10.425 3.680 5.546 746 HA SER 98 HA SER 98 -12.904 3.557 5.846 747 HB2 SER 98 HB2 SER 98 -13.203 5.669 4.549 748 HB3 SER 98 HB1 SER 98 -12.925 4.740 3.085 749 HG SER 98 HG SER 98 -15.047 4.574 4.930 750 H ASN 99 HN ASN 99 -10.502 2.326 4.007 751 HA ASN 99 HA ASN 99 -10.222 0.204 3.020 752 HB2 ASN 99 HB2 ASN 99 -13.077 -0.291 3.871 753 HB3 ASN 99 HB1 ASN 99 -11.762 -1.459 3.745 754 HD21 ASN 99 HD21 ASN 99 -9.927 0.718 5.003 755 HD22 ASN 99 HD22 ASN 99 -10.274 0.618 6.660 756 H ILE 100 HN ILE 100 -11.774 2.558 1.602 757 HA ILE 100 HA ILE 100 -13.364 0.998 -0.348 758 HB ILE 100 HB ILE 100 -14.034 3.117 -1.212 759 HG12 ILE 100 HG12 ILE 100 -11.480 3.969 -0.791 760 HG13 ILE 100 HG11 ILE 100 -12.828 5.023 -1.175 761 HG21 ILE 100 HG21 ILE 100 -14.586 4.336 1.024 762 HG22 ILE 100 HG22 ILE 100 -13.813 2.942 1.777 763 HG23 ILE 100 HG23 ILE 100 -15.228 2.718 0.749 764 HD11 ILE 100 HD11 ILE 100 -11.710 4.424 1.574 765 HD12 ILE 100 HD12 ILE 100 -13.228 5.282 1.309 766 HD13 ILE 100 HD13 ILE 100 -11.718 5.970 0.730 767 HA PRO 101 HA PRO 101 -9.728 2.331 -3.078 768 HB2 PRO 101 HB2 PRO 101 -7.310 2.737 -1.899 769 HB3 PRO 101 HB1 PRO 101 -8.511 4.022 -2.099 770 HG2 PRO 101 HG2 PRO 101 -7.710 2.569 0.326 771 HG3 PRO 101 HG1 PRO 101 -8.402 4.186 0.153 772 HD2 PRO 101 HD2 PRO 101 -9.747 1.815 0.918 773 HD3 PRO 101 HD1 PRO 101 -10.469 3.401 0.579 774 H LEU 102 HN LEU 102 -9.864 -0.037 -0.730 775 HA LEU 102 HA LEU 102 -7.464 -1.543 -1.395 776 HB2 LEU 102 HB2 LEU 102 -9.983 -2.631 -0.135 777 HB3 LEU 102 HB1 LEU 102 -8.311 -3.073 0.206 778 HG LEU 102 HG LEU 102 -9.822 -0.609 1.059 779 HD11 LEU 102 HD11 LEU 102 -8.533 -1.241 3.198 780 HD12 LEU 102 HD12 LEU 102 -8.155 -2.750 2.370 781 HD13 LEU 102 HD13 LEU 102 -9.834 -2.317 2.690 782 HD21 LEU 102 HD21 LEU 102 -7.960 0.573 0.391 783 HD22 LEU 102 HD22 LEU 102 -6.921 -0.852 0.408 784 HD23 LEU 102 HD23 LEU 102 -7.327 -0.039 1.919 785 H LEU 103 HN LEU 103 -7.350 -3.456 -2.666 786 HA LEU 103 HA LEU 103 -9.670 -4.524 -4.081 787 HB2 LEU 103 HB2 LEU 103 -8.743 -2.111 -4.952 788 HB3 LEU 103 HB1 LEU 103 -7.751 -3.185 -5.920 789 HG LEU 103 HG LEU 103 -9.454 -3.519 -7.344 790 HD11 LEU 103 HD11 LEU 103 -11.520 -4.567 -6.746 791 HD12 LEU 103 HD12 LEU 103 -11.372 -4.042 -5.069 792 HD13 LEU 103 HD13 LEU 103 -10.283 -5.271 -5.707 793 HD21 LEU 103 HD21 LEU 103 -10.452 -1.396 -5.543 794 HD22 LEU 103 HD22 LEU 103 -11.650 -2.139 -6.604 795 HD23 LEU 103 HD23 LEU 103 -10.215 -1.377 -7.290 796 H THR 104 HN THR 104 -8.618 -5.712 -6.238 797 HA THR 104 HA THR 104 -6.381 -7.343 -5.188 798 HB THR 104 HB THR 104 -8.013 -8.824 -5.958 799 HG1 THR 104 HG1 THR 104 -6.618 -9.656 -7.264 800 HG21 THR 104 HG21 THR 104 -8.602 -6.773 -8.107 801 HG22 THR 104 HG22 THR 104 -9.634 -7.225 -6.751 802 HG23 THR 104 HG23 THR 104 -9.343 -8.373 -8.058 803 H LYS 105 HN LYS 105 -6.289 -4.564 -6.284 804 HA LYS 105 HA LYS 105 -4.807 -3.315 -7.572 805 HB2 LYS 105 HB2 LYS 105 -3.017 -4.408 -6.622 806 HB3 LYS 105 HB1 LYS 105 -3.617 -5.999 -7.060 807 HG2 LYS 105 HG2 LYS 105 -2.722 -4.262 -9.297 808 HG3 LYS 105 HG1 LYS 105 -1.476 -4.875 -8.216 809 HD2 LYS 105 HD2 LYS 105 -2.374 -7.176 -8.487 810 HD3 LYS 105 HD1 LYS 105 -3.555 -6.562 -9.643 811 HE2 LYS 105 HE2 LYS 105 -1.848 -5.948 -11.216 812 HE3 LYS 105 HE1 LYS 105 -0.567 -6.172 -10.009 813 HZ1 LYS 105 HZ1 LYS 105 -1.719 -8.530 -9.855 814 HZ2 LYS 105 HZ2 LYS 105 -0.488 -8.208 -10.981 815 HZ3 LYS 105 HZ3 LYS 105 -2.115 -8.176 -11.466 816 HA PRO 106 HA PRO 106 -6.598 -5.399 -11.439 817 HB2 PRO 106 HB2 PRO 106 -8.918 -3.944 -11.653 818 HB3 PRO 106 HB1 PRO 106 -8.837 -5.519 -10.838 819 HG2 PRO 106 HG2 PRO 106 -8.841 -2.781 -9.667 820 HG3 PRO 106 HG1 PRO 106 -9.654 -4.249 -9.104 821 HD2 PRO 106 HD2 PRO 106 -7.360 -3.332 -7.987 822 HD3 PRO 106 HD1 PRO 106 -7.773 -5.055 -8.055 823 H PHE 107 HN PHE 107 -5.945 -2.354 -10.037 824 HA PHE 107 HA PHE 107 -5.016 -0.381 -10.888 825 HB2 PHE 107 HB2 PHE 107 -4.551 -2.468 -12.978 826 HB3 PHE 107 HB1 PHE 107 -4.169 -0.791 -13.371 827 HD1 PHE 107 HD2 PHE 107 -4.028 -2.291 -9.985 828 HD2 PHE 107 HD1 PHE 107 -1.771 -0.932 -13.375 829 HE1 PHE 107 HE2 PHE 107 -1.943 -2.453 -8.655 830 HE2 PHE 107 HE1 PHE 107 0.314 -1.094 -12.047 831 HZ PHE 107 HZ PHE 107 0.235 -1.849 -9.689 832 H LEU 108 HN LEU 108 -6.977 -1.870 -13.517 833 HA LEU 108 HA LEU 108 -7.813 0.330 -14.929 834 HB2 LEU 108 HB2 LEU 108 -8.581 -1.835 -15.513 835 HB3 LEU 108 HB1 LEU 108 -9.244 -2.126 -13.911 836 HG LEU 108 HG LEU 108 -10.851 -1.553 -15.911 837 HD11 LEU 108 HD11 LEU 108 -10.914 -1.185 -13.086 838 HD12 LEU 108 HD12 LEU 108 -12.265 -1.505 -14.173 839 HD13 LEU 108 HD13 LEU 108 -11.787 0.157 -13.825 840 HD21 LEU 108 HD21 LEU 108 -9.306 0.734 -15.972 841 HD22 LEU 108 HD22 LEU 108 -10.710 1.252 -15.040 842 HD23 LEU 108 HD23 LEU 108 -10.924 0.589 -16.657 843 H ASP 109 HN ASP 109 -9.053 -0.654 -11.726 844 HA ASP 109 HA ASP 109 -10.128 2.121 -11.380 845 HB2 ASP 109 HB2 ASP 109 -11.779 0.124 -11.959 846 HB3 ASP 109 HB1 ASP 109 -11.596 -0.232 -10.246 847 H SER 110 HN SER 110 -7.897 0.042 -10.350 848 HA SER 110 HA SER 110 -8.396 0.232 -7.438 849 HB2 SER 110 HB2 SER 110 -7.508 -1.738 -8.926 850 HB3 SER 110 HB1 SER 110 -5.963 -0.922 -8.764 851 HG SER 110 HG SER 110 -6.249 -1.013 -6.494 852 H GLU 111 HN GLU 111 -5.293 0.631 -9.170 853 HA GLU 111 HA GLU 111 -3.896 2.234 -7.474 854 HB2 GLU 111 HB2 GLU 111 -3.216 1.422 -9.733 855 HB3 GLU 111 HB1 GLU 111 -4.207 2.687 -10.460 856 HG2 GLU 111 HG2 GLU 111 -2.790 4.251 -8.848 857 HG3 GLU 111 HG1 GLU 111 -1.629 2.926 -8.963 858 H LEU 112 HN LEU 112 -6.379 3.432 -9.733 859 HA LEU 112 HA LEU 112 -6.133 6.197 -9.247 860 HB2 LEU 112 HB2 LEU 112 -8.732 6.058 -9.711 861 HB3 LEU 112 HB1 LEU 112 -7.580 5.638 -10.972 862 HG LEU 112 HG LEU 112 -8.248 3.367 -9.244 863 HD11 LEU 112 HD11 LEU 112 -10.405 4.845 -9.414 864 HD12 LEU 112 HD12 LEU 112 -10.525 3.126 -9.782 865 HD13 LEU 112 HD13 LEU 112 -10.435 4.301 -11.090 866 HD21 LEU 112 HD21 LEU 112 -8.857 3.439 -12.150 867 HD22 LEU 112 HD22 LEU 112 -7.973 2.235 -11.213 868 HD23 LEU 112 HD23 LEU 112 -7.176 3.730 -11.703 869 H GLU 113 HN GLU 113 -8.637 4.140 -7.648 870 HA GLU 113 HA GLU 113 -9.509 5.953 -5.724 871 HB2 GLU 113 HB2 GLU 113 -9.763 3.241 -6.283 872 HB3 GLU 113 HB1 GLU 113 -9.063 3.249 -4.661 873 HG2 GLU 113 HG2 GLU 113 -11.132 3.668 -3.870 874 HG3 GLU 113 HG1 GLU 113 -11.012 5.265 -4.605 875 H ALA 114 HN ALA 114 -7.013 3.487 -5.018 876 HA ALA 114 HA ALA 114 -6.066 4.182 -2.579 877 HB1 ALA 114 HB1 ALA 114 -4.426 3.702 -5.085 878 HB2 ALA 114 HB2 ALA 114 -5.097 2.462 -4.023 879 HB3 ALA 114 HB3 ALA 114 -3.817 3.527 -3.439 880 H VAL 115 HN VAL 115 -5.620 6.163 -5.486 881 HA VAL 115 HA VAL 115 -3.960 8.084 -3.918 882 HB VAL 115 HB VAL 115 -4.677 8.121 -6.859 883 HG11 VAL 115 HG11 VAL 115 -3.417 9.996 -5.356 884 HG12 VAL 115 HG12 VAL 115 -3.058 9.722 -7.061 885 HG13 VAL 115 HG13 VAL 115 -2.040 8.995 -5.817 886 HG21 VAL 115 HG21 VAL 115 -3.700 5.908 -6.141 887 HG22 VAL 115 HG22 VAL 115 -2.278 6.781 -5.572 888 HG23 VAL 115 HG23 VAL 115 -2.692 6.794 -7.286 889 H LEU 116 HN LEU 116 -7.125 7.766 -5.431 890 HA LEU 116 HA LEU 116 -7.675 10.652 -5.060 891 HB2 LEU 116 HB2 LEU 116 -9.235 10.342 -6.710 892 HB3 LEU 116 HB1 LEU 116 -8.257 8.916 -7.034 893 HG LEU 116 HG LEU 116 -9.871 7.822 -5.225 894 HD11 LEU 116 HD11 LEU 116 -11.987 9.443 -6.461 895 HD12 LEU 116 HD12 LEU 116 -10.953 10.364 -5.368 896 HD13 LEU 116 HD13 LEU 116 -11.800 8.933 -4.783 897 HD21 LEU 116 HD21 LEU 116 -10.204 8.305 -8.166 898 HD22 LEU 116 HD22 LEU 116 -11.506 7.488 -7.301 899 HD23 LEU 116 HD23 LEU 116 -9.884 6.796 -7.313 900 H VAL 117 HN VAL 117 -7.962 7.869 -3.198 901 HA VAL 117 HA VAL 117 -10.507 8.452 -1.895 902 HB VAL 117 HB VAL 117 -9.919 6.169 -1.835 903 HG11 VAL 117 HG11 VAL 117 -7.193 7.205 -1.797 904 HG12 VAL 117 HG12 VAL 117 -7.766 5.615 -2.268 905 HG13 VAL 117 HG13 VAL 117 -7.400 5.951 -0.583 906 HG21 VAL 117 HG21 VAL 117 -9.792 5.638 0.447 907 HG22 VAL 117 HG22 VAL 117 -10.421 7.286 0.467 908 HG23 VAL 117 HG23 VAL 117 -8.716 6.990 0.804 909 H GLN 118 HN GLN 118 -7.227 8.341 -0.486 910 HA GLN 118 HA GLN 118 -6.615 9.331 1.634 911 HB2 GLN 118 HB2 GLN 118 -6.450 10.880 -0.869 912 HB3 GLN 118 HB1 GLN 118 -6.125 11.798 0.604 913 HG2 GLN 118 HG2 GLN 118 -4.471 10.095 1.297 914 HG3 GLN 118 HG1 GLN 118 -4.785 9.193 -0.187 915 HE21 GLN 118 HE21 GLN 118 -4.983 11.394 -2.011 916 HE22 GLN 118 HE22 GLN 118 -3.457 12.126 -2.129 917 H ILE 119 HN ILE 119 -8.544 11.912 0.062 918 HA ILE 119 HA ILE 119 -9.356 12.851 2.743 919 HB ILE 119 HB ILE 119 -9.775 14.837 1.695 920 HG12 ILE 119 HG12 ILE 119 -11.823 14.270 0.602 921 HG13 ILE 119 HG11 ILE 119 -10.788 14.979 -0.635 922 HG21 ILE 119 HG21 ILE 119 -8.160 15.253 0.127 923 HG22 ILE 119 HG22 ILE 119 -8.585 13.845 -0.845 924 HG23 ILE 119 HG23 ILE 119 -7.631 13.646 0.625 925 HD11 ILE 119 HD11 ILE 119 -12.052 12.477 -0.742 926 HD12 ILE 119 HD12 ILE 119 -10.354 12.117 -0.438 927 HD13 ILE 119 HD13 ILE 119 -10.813 13.078 -1.843 928 H SER 120 HN SER 120 -10.425 10.267 1.291 929 HA SER 120 HA SER 120 -13.308 10.778 1.151 930 HB2 SER 120 HB2 SER 120 -11.553 8.974 0.053 931 HB3 SER 120 HB1 SER 120 -12.280 8.012 1.336 932 HG SER 120 HG SER 120 -14.342 8.812 0.480 933 H LYS 121 HN LYS 121 -14.575 8.838 2.471 934 HA LYS 121 HA LYS 121 -13.524 8.234 5.100 935 HB2 LYS 121 HB2 LYS 121 -14.305 10.862 4.541 936 HB3 LYS 121 HB1 LYS 121 -15.662 10.185 5.460 937 HG2 LYS 121 HG2 LYS 121 -12.747 10.203 6.297 938 HG3 LYS 121 HG1 LYS 121 -14.044 11.156 7.013 939 HD2 LYS 121 HD2 LYS 121 -15.205 9.000 7.603 940 HD3 LYS 121 HD1 LYS 121 -13.765 8.138 7.052 941 HE2 LYS 121 HE2 LYS 121 -12.390 9.330 8.716 942 HE3 LYS 121 HE1 LYS 121 -13.820 10.224 9.266 943 HZ1 LYS 121 HZ1 LYS 121 -13.133 7.960 10.382 944 HZ2 LYS 121 HZ2 LYS 121 -13.999 7.308 9.074 945 HZ3 LYS 121 HZ3 LYS 121 -14.763 8.369 10.159 946 H GLU 122 HN GLU 122 -15.029 6.865 6.235 947 HA GLU 122 HA GLU 122 -16.859 5.315 4.830 948 HB2 GLU 122 HB2 GLU 122 -17.882 4.926 7.117 949 HB3 GLU 122 HB1 GLU 122 -16.125 4.773 7.084 950 HG2 GLU 122 HG2 GLU 122 -16.315 7.407 7.622 951 HG3 GLU 122 HG1 GLU 122 -17.821 6.856 8.359 952 H VAL 123 HN VAL 123 -17.291 8.456 6.343 953 HA VAL 123 HA VAL 123 -19.203 9.451 4.631 954 HB VAL 123 HB VAL 123 -20.228 7.348 6.321 955 HG11 VAL 123 HG11 VAL 123 -21.436 10.082 6.728 956 HG12 VAL 123 HG12 VAL 123 -20.999 8.887 7.949 957 HG13 VAL 123 HG13 VAL 123 -22.397 8.614 6.906 958 HG21 VAL 123 HG21 VAL 123 -20.581 7.858 3.840 959 HG22 VAL 123 HG22 VAL 123 -21.756 9.065 4.364 960 HG23 VAL 123 HG23 VAL 123 -22.012 7.361 4.745 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 14.607 20.069 16.781 2 H2 GLY 1 HT2 GLY 1 14.187 21.594 16.161 3 H3 GLY 1 HT3 GLY 1 15.549 20.776 15.560 4 HA2 GLY 1 HA2 GLY 1 13.693 18.942 15.079 5 HA3 GLY 1 HA1 GLY 1 12.736 20.417 14.931 6 H SER 2 HN SER 2 15.175 18.466 13.459 7 HA SER 2 HA SER 2 15.766 20.548 11.412 8 HB2 SER 2 HB2 SER 2 17.615 19.327 12.478 9 HB3 SER 2 HB1 SER 2 16.901 17.792 11.994 10 HG SER 2 HG SER 2 18.117 19.791 10.430 11 H HIS 3 HN HIS 3 13.875 20.513 10.093 12 HA HIS 3 HA HIS 3 12.496 19.696 8.352 13 HB2 HIS 3 HB2 HIS 3 14.927 19.015 7.709 14 HB3 HIS 3 HB1 HIS 3 14.443 17.394 8.204 15 HD1 HIS 3 HD1 HIS 3 12.847 20.134 6.053 16 HD2 HIS 3 HD2 HIS 3 13.503 16.016 6.021 17 HE1 HIS 3 HE1 HIS 3 11.864 19.267 3.884 18 H MET 4 HN MET 4 11.307 19.148 10.642 19 HA MET 4 HA MET 4 11.063 16.448 11.516 20 HB2 MET 4 HB2 MET 4 9.086 18.756 11.474 21 HB3 MET 4 HB1 MET 4 8.922 17.310 12.472 22 HG2 MET 4 HG2 MET 4 11.334 19.135 12.577 23 HG3 MET 4 HG1 MET 4 9.952 19.286 13.662 24 HE1 MET 4 HE1 MET 4 9.972 17.567 16.143 25 HE2 MET 4 HE2 MET 4 9.566 16.054 15.337 26 HE3 MET 4 HE3 MET 4 8.908 17.571 14.729 27 H THR 5 HN THR 5 7.981 16.570 11.087 28 HA THR 5 HA THR 5 7.970 15.584 8.262 29 HB THR 5 HB THR 5 6.166 13.976 9.419 30 HG1 THR 5 HG1 THR 5 6.262 14.451 11.488 31 HG21 THR 5 HG21 THR 5 7.718 12.548 8.638 32 HG22 THR 5 HG22 THR 5 8.646 12.792 10.118 33 HG23 THR 5 HG23 THR 5 8.952 13.805 8.707 34 H GLU 6 HN GLU 6 5.897 15.746 7.236 35 HA GLU 6 HA GLU 6 3.599 16.924 8.510 36 HB2 GLU 6 HB2 GLU 6 3.776 19.136 7.342 37 HB3 GLU 6 HB1 GLU 6 5.057 18.888 8.528 38 HG2 GLU 6 HG2 GLU 6 6.690 18.774 6.940 39 HG3 GLU 6 HG1 GLU 6 5.650 17.944 5.781 40 H ARG 7 HN ARG 7 3.060 14.907 7.293 41 HA ARG 7 HA ARG 7 1.685 14.062 5.532 42 HB2 ARG 7 HB2 ARG 7 1.396 16.613 5.040 43 HB3 ARG 7 HB1 ARG 7 2.614 16.347 3.792 44 HG2 ARG 7 HG2 ARG 7 1.170 14.424 2.958 45 HG3 ARG 7 HG1 ARG 7 -0.091 15.014 4.042 46 HD2 ARG 7 HD2 ARG 7 -0.568 16.807 2.702 47 HD3 ARG 7 HD1 ARG 7 1.140 17.094 2.323 48 HE ARG 7 HE ARG 7 0.615 14.706 1.048 49 HH11 ARG 7 HH21 ARG 7 -1.984 16.713 1.281 50 HH12 ARG 7 HH22 ARG 7 -2.106 17.093 -0.405 51 HH21 ARG 7 HH11 ARG 7 0.948 15.669 -1.223 52 HH22 ARG 7 HH12 ARG 7 -0.443 16.511 -1.819 53 H ARG 8 HN ARG 8 4.301 13.268 6.116 54 HA ARG 8 HA ARG 8 5.736 12.986 3.527 55 HB2 ARG 8 HB2 ARG 8 6.319 12.375 6.435 56 HB3 ARG 8 HB1 ARG 8 7.408 11.882 5.138 57 HG2 ARG 8 HG2 ARG 8 6.878 14.546 4.554 58 HG3 ARG 8 HG1 ARG 8 7.003 14.527 6.314 59 HD2 ARG 8 HD2 ARG 8 9.258 14.463 6.097 60 HD3 ARG 8 HD1 ARG 8 9.097 12.869 5.332 61 HE ARG 8 HE ARG 8 8.732 14.118 3.158 62 HH11 ARG 8 HH11 ARG 8 8.537 16.860 4.385 63 HH12 ARG 8 HH12 ARG 8 10.119 17.497 4.083 64 HH21 ARG 8 HH21 ARG 8 11.524 14.404 3.393 65 HH22 ARG 8 HH22 ARG 8 11.811 16.107 3.530 66 H LEU 9 HN LEU 9 3.198 11.472 4.885 67 HA LEU 9 HA LEU 9 3.820 8.727 5.092 68 HB2 LEU 9 HB2 LEU 9 1.399 10.345 4.311 69 HB3 LEU 9 HB1 LEU 9 1.324 8.585 4.333 70 HG LEU 9 HG LEU 9 1.766 8.482 6.660 71 HD11 LEU 9 HD11 LEU 9 2.525 10.386 7.986 72 HD12 LEU 9 HD12 LEU 9 2.437 11.441 6.576 73 HD13 LEU 9 HD13 LEU 9 3.633 10.145 6.636 74 HD21 LEU 9 HD21 LEU 9 0.123 11.008 6.352 75 HD22 LEU 9 HD22 LEU 9 -0.004 9.795 7.626 76 HD23 LEU 9 HD23 LEU 9 -0.502 9.401 5.980 77 H ARG 10 HN ARG 10 3.312 6.995 3.515 78 HA ARG 10 HA ARG 10 3.171 7.702 0.658 79 HB2 ARG 10 HB2 ARG 10 5.633 7.782 1.449 80 HB3 ARG 10 HB1 ARG 10 5.495 6.036 1.638 81 HG2 ARG 10 HG2 ARG 10 5.895 5.791 -0.574 82 HG3 ARG 10 HG1 ARG 10 4.371 6.602 -0.888 83 HD2 ARG 10 HD2 ARG 10 5.367 8.530 -1.516 84 HD3 ARG 10 HD1 ARG 10 6.618 8.404 -0.287 85 HE ARG 10 HE ARG 10 6.858 6.345 -2.311 86 HH11 ARG 10 HH21 ARG 10 7.257 9.730 -1.841 87 HH12 ARG 10 HH22 ARG 10 8.679 9.833 -2.826 88 HH21 ARG 10 HH11 ARG 10 8.809 6.425 -3.461 89 HH22 ARG 10 HH12 ARG 10 9.562 7.960 -3.738 90 H VAL 11 HN VAL 11 3.302 5.516 -0.616 91 HA VAL 11 HA VAL 11 1.720 3.495 0.907 92 HB VAL 11 HB VAL 11 0.734 3.060 -1.323 93 HG11 VAL 11 HG11 VAL 11 -0.664 4.857 -1.110 94 HG12 VAL 11 HG12 VAL 11 0.660 6.016 -1.246 95 HG13 VAL 11 HG13 VAL 11 0.325 5.236 0.300 96 HG21 VAL 11 HG21 VAL 11 1.721 5.312 -2.756 97 HG22 VAL 11 HG22 VAL 11 1.951 3.608 -3.150 98 HG23 VAL 11 HG23 VAL 11 3.128 4.447 -2.140 99 H LEU 12 HN LEU 12 3.157 1.835 1.474 100 HA LEU 12 HA LEU 12 5.377 1.078 -0.289 101 HB2 LEU 12 HB2 LEU 12 4.153 0.063 2.288 102 HB3 LEU 12 HB1 LEU 12 5.469 -0.789 1.490 103 HG LEU 12 HG LEU 12 6.146 0.868 3.319 104 HD11 LEU 12 HD11 LEU 12 7.291 1.458 0.586 105 HD12 LEU 12 HD12 LEU 12 7.632 -0.029 1.468 106 HD13 LEU 12 HD13 LEU 12 8.122 1.528 2.137 107 HD21 LEU 12 HD21 LEU 12 4.531 2.644 2.610 108 HD22 LEU 12 HD22 LEU 12 5.478 2.869 1.139 109 HD23 LEU 12 HD23 LEU 12 6.192 3.228 2.711 110 H VAL 13 HN VAL 13 4.614 0.128 -2.233 111 HA VAL 13 HA VAL 13 2.593 -2.077 -1.910 112 HB VAL 13 HB VAL 13 3.085 -0.317 -4.328 113 HG11 VAL 13 HG11 VAL 13 0.405 -1.363 -3.905 114 HG12 VAL 13 HG12 VAL 13 1.594 -2.665 -3.950 115 HG13 VAL 13 HG13 VAL 13 1.462 -1.544 -5.305 116 HG21 VAL 13 HG21 VAL 13 0.640 0.310 -2.980 117 HG22 VAL 13 HG22 VAL 13 2.021 1.365 -3.274 118 HG23 VAL 13 HG23 VAL 13 1.950 0.397 -1.802 119 H VAL 14 HN VAL 14 3.350 -4.079 -2.572 120 HA VAL 14 HA VAL 14 5.571 -4.107 -4.559 121 HB VAL 14 HB VAL 14 6.790 -5.595 -3.000 122 HG11 VAL 14 HG11 VAL 14 7.813 -3.849 -1.955 123 HG12 VAL 14 HG12 VAL 14 6.287 -3.176 -1.383 124 HG13 VAL 14 HG13 VAL 14 6.794 -2.920 -3.052 125 HG21 VAL 14 HG21 VAL 14 4.648 -4.767 -1.041 126 HG22 VAL 14 HG22 VAL 14 6.068 -5.744 -0.666 127 HG23 VAL 14 HG23 VAL 14 4.814 -6.381 -1.731 128 H GLU 15 HN GLU 15 5.988 -6.155 -5.480 129 HA GLU 15 HA GLU 15 4.643 -8.589 -4.930 130 HB2 GLU 15 HB2 GLU 15 2.598 -8.135 -5.744 131 HB3 GLU 15 HB1 GLU 15 3.125 -6.591 -6.408 132 HG2 GLU 15 HG2 GLU 15 3.257 -7.453 -8.513 133 HG3 GLU 15 HG1 GLU 15 4.056 -8.914 -7.969 134 H ASP 16 HN ASP 16 5.146 -10.192 -6.515 135 HA ASP 16 HA ASP 16 7.635 -10.577 -7.390 136 HB2 ASP 16 HB2 ASP 16 6.595 -11.965 -9.195 137 HB3 ASP 16 HB1 ASP 16 5.839 -12.153 -7.611 138 H GLU 17 HN GLU 17 5.569 -8.213 -9.096 139 HA GLU 17 HA GLU 17 7.725 -8.105 -11.187 140 HB2 GLU 17 HB2 GLU 17 5.948 -7.426 -12.722 141 HB3 GLU 17 HB1 GLU 17 5.504 -8.925 -11.908 142 HG2 GLU 17 HG2 GLU 17 4.263 -7.486 -10.211 143 HG3 GLU 17 HG1 GLU 17 4.510 -6.133 -11.313 144 H SER 18 HN SER 18 7.846 -5.970 -12.333 145 HA SER 18 HA SER 18 8.126 -3.792 -10.362 146 HB2 SER 18 HB2 SER 18 9.975 -4.123 -11.815 147 HB3 SER 18 HB1 SER 18 8.936 -4.319 -13.224 148 HG SER 18 HG SER 18 10.091 -2.187 -12.742 149 H MET 19 HN MET 19 5.772 -4.845 -12.620 150 HA MET 19 HA MET 19 4.727 -2.516 -13.779 151 HB2 MET 19 HB2 MET 19 3.907 -4.862 -14.063 152 HB3 MET 19 HB1 MET 19 3.223 -4.797 -12.439 153 HG2 MET 19 HG2 MET 19 1.343 -4.069 -13.489 154 HG3 MET 19 HG1 MET 19 2.182 -2.520 -13.559 155 HE1 MET 19 HE1 MET 19 0.678 -1.882 -16.133 156 HE2 MET 19 HE2 MET 19 2.246 -1.573 -16.874 157 HE3 MET 19 HE3 MET 19 2.033 -1.318 -15.144 158 H ILE 20 HN ILE 20 4.806 -3.512 -10.454 159 HA ILE 20 HA ILE 20 2.850 -1.499 -9.537 160 HB ILE 20 HB ILE 20 3.004 -3.754 -8.559 161 HG12 ILE 20 HG12 ILE 20 4.149 -1.906 -6.475 162 HG13 ILE 20 HG11 ILE 20 2.555 -1.586 -7.168 163 HG21 ILE 20 HG21 ILE 20 5.272 -3.826 -7.021 164 HG22 ILE 20 HG22 ILE 20 5.864 -3.038 -8.485 165 HG23 ILE 20 HG23 ILE 20 5.103 -4.625 -8.583 166 HD11 ILE 20 HD11 ILE 20 2.997 -4.392 -6.368 167 HD12 ILE 20 HD12 ILE 20 1.598 -3.352 -6.096 168 HD13 ILE 20 HD13 ILE 20 2.999 -3.243 -5.032 169 H ALA 21 HN ALA 21 6.212 -1.745 -10.143 170 HA ALA 21 HA ALA 21 7.197 0.116 -8.161 171 HB1 ALA 21 HB1 ALA 21 8.479 -0.439 -10.825 172 HB2 ALA 21 HB2 ALA 21 8.314 -1.739 -9.651 173 HB3 ALA 21 HB3 ALA 21 9.230 -0.288 -9.242 174 H MET 22 HN MET 22 7.390 0.632 -11.708 175 HA MET 22 HA MET 22 7.438 3.466 -11.500 176 HB2 MET 22 HB2 MET 22 8.179 1.995 -13.421 177 HB3 MET 22 HB1 MET 22 6.478 1.744 -13.812 178 HG2 MET 22 HG2 MET 22 6.847 3.548 -15.176 179 HG3 MET 22 HG1 MET 22 6.498 4.437 -13.693 180 HE1 MET 22 HE1 MET 22 9.076 2.867 -15.986 181 HE2 MET 22 HE2 MET 22 10.339 4.093 -16.038 182 HE3 MET 22 HE3 MET 22 8.714 4.488 -16.593 183 H LEU 23 HN LEU 23 4.812 1.211 -11.397 184 HA LEU 23 HA LEU 23 2.679 3.007 -12.181 185 HB2 LEU 23 HB2 LEU 23 2.328 0.653 -12.289 186 HB3 LEU 23 HB1 LEU 23 2.963 0.400 -10.669 187 HG LEU 23 HG LEU 23 0.423 0.224 -10.962 188 HD11 LEU 23 HD11 LEU 23 0.500 2.207 -8.916 189 HD12 LEU 23 HD12 LEU 23 2.033 1.334 -8.880 190 HD13 LEU 23 HD13 LEU 23 0.511 0.453 -8.737 191 HD21 LEU 23 HD21 LEU 23 -0.668 1.957 -11.873 192 HD22 LEU 23 HD22 LEU 23 0.844 2.851 -12.017 193 HD23 LEU 23 HD23 LEU 23 -0.126 2.990 -10.551 194 H ILE 24 HN ILE 24 4.770 3.029 -9.551 195 HA ILE 24 HA ILE 24 2.780 4.211 -7.676 196 HB ILE 24 HB ILE 24 4.609 2.261 -7.340 197 HG12 ILE 24 HG12 ILE 24 4.582 3.834 -4.917 198 HG13 ILE 24 HG11 ILE 24 3.003 3.917 -5.703 199 HG21 ILE 24 HG21 ILE 24 6.597 3.563 -7.743 200 HG22 ILE 24 HG22 ILE 24 6.516 3.235 -6.016 201 HG23 ILE 24 HG23 ILE 24 6.060 4.822 -6.634 202 HD11 ILE 24 HD11 ILE 24 3.795 1.859 -4.085 203 HD12 ILE 24 HD12 ILE 24 4.230 1.227 -5.674 204 HD13 ILE 24 HD13 ILE 24 2.566 1.708 -5.340 205 H GLU 25 HN GLU 25 6.056 4.818 -8.978 206 HA GLU 25 HA GLU 25 6.482 7.379 -7.856 207 HB2 GLU 25 HB2 GLU 25 7.340 6.048 -10.435 208 HB3 GLU 25 HB1 GLU 25 8.024 7.575 -9.875 209 HG2 GLU 25 HG2 GLU 25 8.632 6.441 -7.716 210 HG3 GLU 25 HG1 GLU 25 8.093 4.915 -8.420 211 H ASP 26 HN ASP 26 4.252 6.436 -10.322 212 HA ASP 26 HA ASP 26 4.090 9.151 -11.472 213 HB2 ASP 26 HB2 ASP 26 2.733 8.089 -13.124 214 HB3 ASP 26 HB1 ASP 26 3.947 6.880 -12.697 215 H THR 27 HN THR 27 2.422 7.172 -9.135 216 HA THR 27 HA THR 27 0.162 9.084 -9.002 217 HB THR 27 HB THR 27 -0.369 7.244 -7.123 218 HG1 THR 27 HG1 THR 27 0.750 5.442 -7.366 219 HG21 THR 27 HG21 THR 27 -1.956 6.791 -8.649 220 HG22 THR 27 HG22 THR 27 -0.790 5.854 -9.584 221 HG23 THR 27 HG23 THR 27 -0.987 7.579 -9.893 222 H LEU 28 HN LEU 28 2.986 7.867 -7.448 223 HA LEU 28 HA LEU 28 2.794 9.221 -4.903 224 HB2 LEU 28 HB2 LEU 28 5.052 8.105 -6.599 225 HB3 LEU 28 HB1 LEU 28 5.232 8.580 -4.938 226 HG LEU 28 HG LEU 28 4.544 6.046 -5.839 227 HD11 LEU 28 HD11 LEU 28 3.843 5.970 -3.231 228 HD12 LEU 28 HD12 LEU 28 4.710 7.505 -3.275 229 HD13 LEU 28 HD13 LEU 28 5.513 6.021 -3.791 230 HD21 LEU 28 HD21 LEU 28 2.241 6.498 -6.262 231 HD22 LEU 28 HD22 LEU 28 2.092 7.510 -4.826 232 HD23 LEU 28 HD23 LEU 28 2.272 5.765 -4.660 233 H CYS 29 HN CYS 29 3.772 10.047 -8.149 234 HA CYS 29 HA CYS 29 5.461 12.289 -7.680 235 HB2 CYS 29 HB2 CYS 29 4.372 10.884 -9.814 236 HB3 CYS 29 HB1 CYS 29 3.648 12.484 -9.975 237 HG CYS 29 HG CYS 29 5.860 12.915 -11.093 238 H GLU 30 HN GLU 30 2.052 12.433 -8.755 239 HA GLU 30 HA GLU 30 1.488 15.101 -8.262 240 HB2 GLU 30 HB2 GLU 30 -0.103 13.587 -9.281 241 HB3 GLU 30 HB1 GLU 30 -0.180 12.602 -7.820 242 HG2 GLU 30 HG2 GLU 30 -2.092 13.884 -7.536 243 HG3 GLU 30 HG1 GLU 30 -0.915 14.908 -6.714 244 H LEU 31 HN LEU 31 0.975 12.457 -5.879 245 HA LEU 31 HA LEU 31 0.433 14.271 -3.694 246 HB2 LEU 31 HB2 LEU 31 1.172 11.352 -3.968 247 HB3 LEU 31 HB1 LEU 31 0.901 12.092 -2.387 248 HG LEU 31 HG LEU 31 -1.332 12.933 -3.350 249 HD11 LEU 31 HD11 LEU 31 -2.170 11.311 -5.168 250 HD12 LEU 31 HD12 LEU 31 -0.470 10.942 -5.452 251 HD13 LEU 31 HD13 LEU 31 -1.066 12.585 -5.684 252 HD21 LEU 31 HD21 LEU 31 -0.744 10.002 -2.869 253 HD22 LEU 31 HD22 LEU 31 -2.383 10.634 -3.024 254 HD23 LEU 31 HD23 LEU 31 -1.347 11.184 -1.707 255 H GLY 32 HN GLY 32 3.368 12.985 -5.104 256 HA2 GLY 32 HA2 GLY 32 5.625 13.199 -4.468 257 HA3 GLY 32 HA1 GLY 32 5.127 14.792 -3.876 258 H HIS 33 HN HIS 33 4.295 11.487 -2.849 259 HA HIS 33 HA HIS 33 4.252 12.170 -0.062 260 HB2 HIS 33 HB2 HIS 33 4.068 9.795 -1.824 261 HB3 HIS 33 HB1 HIS 33 4.475 9.460 -0.140 262 HD1 HIS 33 HD1 HIS 33 1.666 8.828 -1.516 263 HD2 HIS 33 HD2 HIS 33 2.504 12.094 0.932 264 HE1 HIS 33 HE1 HIS 33 -0.555 9.619 -0.591 265 H GLU 34 HN GLU 34 5.920 9.749 0.828 266 HA GLU 34 HA GLU 34 8.547 11.192 0.716 267 HB2 GLU 34 HB2 GLU 34 7.524 10.919 2.905 268 HB3 GLU 34 HB1 GLU 34 7.382 9.177 2.655 269 HG2 GLU 34 HG2 GLU 34 9.755 8.886 2.684 270 HG3 GLU 34 HG1 GLU 34 10.036 10.623 2.555 271 H VAL 35 HN VAL 35 7.699 7.739 1.259 272 HA VAL 35 HA VAL 35 9.326 6.946 -1.071 273 HB VAL 35 HB VAL 35 10.405 7.228 1.567 274 HG11 VAL 35 HG11 VAL 35 11.386 4.962 1.862 275 HG12 VAL 35 HG12 VAL 35 10.350 4.366 0.564 276 HG13 VAL 35 HG13 VAL 35 9.634 4.960 2.062 277 HG21 VAL 35 HG21 VAL 35 11.636 7.765 -0.429 278 HG22 VAL 35 HG22 VAL 35 11.453 6.125 -1.051 279 HG23 VAL 35 HG23 VAL 35 12.477 6.428 0.353 280 H ALA 36 HN ALA 36 8.307 5.214 -1.953 281 HA ALA 36 HA ALA 36 6.433 3.650 -0.263 282 HB1 ALA 36 HB1 ALA 36 6.542 4.569 -3.109 283 HB2 ALA 36 HB2 ALA 36 5.204 4.657 -1.964 284 HB3 ALA 36 HB3 ALA 36 5.612 3.120 -2.727 285 H ALA 37 HN ALA 37 6.075 1.467 -1.956 286 HA ALA 37 HA ALA 37 8.810 0.212 -1.967 287 HB1 ALA 37 HB1 ALA 37 6.275 -1.337 -1.572 288 HB2 ALA 37 HB2 ALA 37 6.903 -0.385 -0.231 289 HB3 ALA 37 HB3 ALA 37 7.886 -1.666 -0.939 290 H THR 38 HN THR 38 9.273 -1.181 -3.677 291 HA THR 38 HA THR 38 7.331 -1.322 -5.940 292 HB THR 38 HB THR 38 10.181 -0.474 -5.672 293 HG1 THR 38 HG1 THR 38 9.110 1.182 -6.351 294 HG21 THR 38 HG21 THR 38 9.132 -2.043 -8.035 295 HG22 THR 38 HG22 THR 38 10.564 -2.383 -7.065 296 HG23 THR 38 HG23 THR 38 10.539 -0.982 -8.135 297 H ALA 39 HN ALA 39 7.082 -3.337 -6.860 298 HA ALA 39 HA ALA 39 7.177 -5.678 -7.018 299 HB1 ALA 39 HB1 ALA 39 9.195 -6.341 -7.850 300 HB2 ALA 39 HB2 ALA 39 10.090 -5.667 -6.488 301 HB3 ALA 39 HB3 ALA 39 9.543 -4.612 -7.793 302 H SER 40 HN SER 40 7.732 -7.686 -5.747 303 HA SER 40 HA SER 40 7.330 -7.178 -2.908 304 HB2 SER 40 HB2 SER 40 6.903 -9.483 -2.812 305 HB3 SER 40 HB1 SER 40 6.359 -9.010 -4.413 306 HG SER 40 HG SER 40 8.437 -10.640 -3.645 307 H ARG 41 HN ARG 41 8.809 -7.158 -1.332 308 HA ARG 41 HA ARG 41 11.439 -8.439 -1.670 309 HB2 ARG 41 HB2 ARG 41 11.169 -5.909 -2.518 310 HB3 ARG 41 HB1 ARG 41 11.374 -5.580 -0.796 311 HG2 ARG 41 HG2 ARG 41 13.569 -5.538 -1.818 312 HG3 ARG 41 HG1 ARG 41 13.453 -6.996 -0.832 313 HD2 ARG 41 HD2 ARG 41 12.743 -8.221 -2.975 314 HD3 ARG 41 HD1 ARG 41 13.285 -6.775 -3.849 315 HE ARG 41 HE ARG 41 15.510 -7.100 -2.638 316 HH11 ARG 41 HH21 ARG 41 13.719 -9.585 -1.488 317 HH12 ARG 41 HH22 ARG 41 14.713 -10.868 -2.093 318 HH21 ARG 41 HH11 ARG 41 16.620 -8.799 -4.115 319 HH22 ARG 41 HH12 ARG 41 16.354 -10.423 -3.581 320 H MET 42 HN MET 42 11.546 -9.595 0.228 321 HA MET 42 HA MET 42 9.989 -9.197 2.535 322 HB2 MET 42 HB2 MET 42 12.703 -10.432 2.031 323 HB3 MET 42 HB1 MET 42 11.892 -10.555 3.594 324 HG2 MET 42 HG2 MET 42 9.899 -11.527 2.425 325 HG3 MET 42 HG1 MET 42 10.825 -11.522 0.924 326 HE1 MET 42 HE1 MET 42 13.803 -13.169 1.408 327 HE2 MET 42 HE2 MET 42 12.562 -12.510 0.346 328 HE3 MET 42 HE3 MET 42 12.671 -14.252 0.588 329 H GLN 43 HN GLN 43 12.920 -7.546 1.539 330 HA GLN 43 HA GLN 43 13.584 -6.466 4.157 331 HB2 GLN 43 HB2 GLN 43 14.349 -5.960 1.284 332 HB3 GLN 43 HB1 GLN 43 14.944 -4.905 2.566 333 HG2 GLN 43 HG2 GLN 43 15.234 -7.699 3.305 334 HG3 GLN 43 HG1 GLN 43 16.045 -7.362 1.775 335 HE21 GLN 43 HE21 GLN 43 18.213 -6.926 2.219 336 HE22 GLN 43 HE22 GLN 43 18.768 -5.947 3.490 337 H GLU 44 HN GLU 44 12.277 -4.905 1.193 338 HA GLU 44 HA GLU 44 11.618 -2.422 2.416 339 HB2 GLU 44 HB2 GLU 44 10.822 -3.967 -0.025 340 HB3 GLU 44 HB1 GLU 44 9.934 -2.495 0.368 341 HG2 GLU 44 HG2 GLU 44 12.172 -1.317 0.551 342 HG3 GLU 44 HG1 GLU 44 12.907 -2.772 -0.127 343 H ALA 45 HN ALA 45 9.515 -5.240 1.697 344 HA ALA 45 HA ALA 45 7.066 -4.351 2.675 345 HB1 ALA 45 HB1 ALA 45 8.107 -7.044 3.507 346 HB2 ALA 45 HB2 ALA 45 7.994 -6.679 1.785 347 HB3 ALA 45 HB3 ALA 45 6.548 -6.629 2.793 348 H LEU 46 HN LEU 46 9.713 -5.795 4.573 349 HA LEU 46 HA LEU 46 8.630 -5.652 7.157 350 HB2 LEU 46 HB2 LEU 46 10.818 -6.627 6.282 351 HB3 LEU 46 HB1 LEU 46 11.472 -4.993 6.336 352 HG LEU 46 HG LEU 46 11.241 -4.870 8.697 353 HD11 LEU 46 HD11 LEU 46 9.187 -5.703 9.331 354 HD12 LEU 46 HD12 LEU 46 10.187 -7.083 9.784 355 HD13 LEU 46 HD13 LEU 46 9.307 -7.096 8.255 356 HD21 LEU 46 HD21 LEU 46 13.145 -6.117 8.591 357 HD22 LEU 46 HD22 LEU 46 12.406 -7.330 7.545 358 HD23 LEU 46 HD23 LEU 46 12.126 -7.378 9.286 359 H ASP 47 HN ASP 47 10.012 -3.094 5.148 360 HA ASP 47 HA ASP 47 10.081 -1.099 7.254 361 HB2 ASP 47 HB2 ASP 47 11.510 -1.249 5.161 362 HB3 ASP 47 HB1 ASP 47 10.091 -0.729 4.252 363 H ILE 48 HN ILE 48 7.583 -2.419 5.346 364 HA ILE 48 HA ILE 48 5.938 0.037 5.400 365 HB ILE 48 HB ILE 48 4.681 -0.973 3.752 366 HG12 ILE 48 HG12 ILE 48 5.219 -3.543 5.242 367 HG13 ILE 48 HG11 ILE 48 3.671 -2.789 4.862 368 HG21 ILE 48 HG21 ILE 48 7.036 -0.972 3.021 369 HG22 ILE 48 HG22 ILE 48 6.122 -2.290 2.286 370 HG23 ILE 48 HG23 ILE 48 7.217 -2.618 3.622 371 HD11 ILE 48 HD11 ILE 48 5.281 -4.645 3.250 372 HD12 ILE 48 HD12 ILE 48 4.784 -3.213 2.350 373 HD13 ILE 48 HD13 ILE 48 3.570 -4.239 3.114 374 H ALA 49 HN ALA 49 6.228 -3.089 7.001 375 HA ALA 49 HA ALA 49 3.685 -2.678 8.429 376 HB1 ALA 49 HB1 ALA 49 5.766 -4.877 8.341 377 HB2 ALA 49 HB2 ALA 49 4.166 -4.889 7.599 378 HB3 ALA 49 HB3 ALA 49 4.324 -4.955 9.354 379 H ARG 50 HN ARG 50 7.092 -3.340 9.370 380 HA ARG 50 HA ARG 50 6.730 -2.750 12.135 381 HB2 ARG 50 HB2 ARG 50 9.058 -3.061 12.241 382 HB3 ARG 50 HB1 ARG 50 8.610 -3.968 10.795 383 HG2 ARG 50 HG2 ARG 50 9.065 -1.701 9.555 384 HG3 ARG 50 HG1 ARG 50 9.992 -1.305 11.004 385 HD2 ARG 50 HD2 ARG 50 10.668 -3.980 10.238 386 HD3 ARG 50 HD1 ARG 50 10.811 -2.938 8.810 387 HE ARG 50 HE ARG 50 12.178 -2.401 11.420 388 HH11 ARG 50 HH11 ARG 50 12.640 -2.991 8.163 389 HH12 ARG 50 HH12 ARG 50 13.718 -1.664 7.888 390 HH21 ARG 50 HH21 ARG 50 13.221 -0.256 11.014 391 HH22 ARG 50 HH22 ARG 50 14.047 -0.117 9.498 392 H LYS 51 HN LYS 51 7.170 -0.642 9.385 393 HA LYS 51 HA LYS 51 8.249 1.637 10.728 394 HB2 LYS 51 HB2 LYS 51 8.239 1.398 8.319 395 HB3 LYS 51 HB1 LYS 51 6.477 1.293 8.294 396 HG2 LYS 51 HG2 LYS 51 6.651 3.528 7.838 397 HG3 LYS 51 HG1 LYS 51 6.768 3.635 9.591 398 HD2 LYS 51 HD2 LYS 51 8.754 4.658 9.280 399 HD3 LYS 51 HD1 LYS 51 9.377 3.091 8.763 400 HE2 LYS 51 HE2 LYS 51 9.187 3.616 6.495 401 HE3 LYS 51 HE1 LYS 51 7.899 4.804 6.779 402 HZ1 LYS 51 HZ1 LYS 51 10.237 5.696 6.347 403 HZ2 LYS 51 HZ2 LYS 51 10.601 5.164 7.918 404 HZ3 LYS 51 HZ3 LYS 51 9.391 6.331 7.673 405 H GLY 52 HN GLY 52 4.848 0.752 9.986 406 HA2 GLY 52 HA2 GLY 52 2.910 1.237 11.247 407 HA3 GLY 52 HA1 GLY 52 3.928 2.036 12.440 408 H GLN 53 HN GLN 53 5.127 3.831 10.333 409 HA GLN 53 HA GLN 53 2.805 5.697 10.133 410 HB2 GLN 53 HB2 GLN 53 4.897 7.307 9.724 411 HB3 GLN 53 HB1 GLN 53 4.414 6.834 11.348 412 HG2 GLN 53 HG2 GLN 53 6.082 5.045 11.355 413 HG3 GLN 53 HG1 GLN 53 6.528 5.430 9.694 414 HE21 GLN 53 HE21 GLN 53 7.524 5.928 12.830 415 HE22 GLN 53 HE22 GLN 53 8.357 7.394 12.628 416 H PHE 54 HN PHE 54 4.917 3.782 8.240 417 HA PHE 54 HA PHE 54 5.362 5.094 5.844 418 HB2 PHE 54 HB2 PHE 54 5.158 2.890 4.818 419 HB3 PHE 54 HB1 PHE 54 5.836 2.691 6.429 420 HD1 PHE 54 HD1 PHE 54 4.094 2.210 8.368 421 HD2 PHE 54 HD2 PHE 54 3.285 1.647 4.191 422 HE1 PHE 54 HE1 PHE 54 2.266 0.657 8.931 423 HE2 PHE 54 HE2 PHE 54 1.455 0.095 4.769 424 HZ PHE 54 HZ PHE 54 0.947 -0.417 7.129 425 H ASP 55 HN ASP 55 2.280 4.229 7.233 426 HA ASP 55 HA ASP 55 0.200 5.282 6.712 427 HB2 ASP 55 HB2 ASP 55 1.720 6.797 5.222 428 HB3 ASP 55 HB1 ASP 55 1.166 5.762 3.905 429 H ILE 56 HN ILE 56 1.301 3.843 3.597 430 HA ILE 56 HA ILE 56 -0.889 1.826 3.973 431 HB ILE 56 HB ILE 56 -0.052 3.447 1.556 432 HG12 ILE 56 HG12 ILE 56 -2.550 3.419 3.277 433 HG13 ILE 56 HG11 ILE 56 -1.354 4.713 3.178 434 HG21 ILE 56 HG21 ILE 56 -1.706 0.999 1.830 435 HG22 ILE 56 HG22 ILE 56 -0.799 1.605 0.445 436 HG23 ILE 56 HG23 ILE 56 -2.379 2.282 0.824 437 HD11 ILE 56 HD11 ILE 56 -2.494 3.872 0.583 438 HD12 ILE 56 HD12 ILE 56 -2.170 5.492 1.200 439 HD13 ILE 56 HD13 ILE 56 -3.636 4.640 1.686 440 H ALA 57 HN ALA 57 -0.547 -0.278 3.014 441 HA ALA 57 HA ALA 57 2.153 -0.753 1.817 442 HB1 ALA 57 HB1 ALA 57 2.737 -1.376 3.954 443 HB2 ALA 57 HB2 ALA 57 1.964 -2.884 3.463 444 HB3 ALA 57 HB3 ALA 57 1.068 -1.704 4.419 445 H ILE 58 HN ILE 58 1.955 -2.239 0.089 446 HA ILE 58 HA ILE 58 -0.466 -3.991 0.155 447 HB ILE 58 HB ILE 58 0.493 -2.219 -2.105 448 HG12 ILE 58 HG12 ILE 58 -1.988 -1.411 -1.685 449 HG13 ILE 58 HG11 ILE 58 -1.721 -2.098 -0.081 450 HG21 ILE 58 HG21 ILE 58 -1.701 -4.296 -1.930 451 HG22 ILE 58 HG22 ILE 58 -0.386 -4.207 -3.102 452 HG23 ILE 58 HG23 ILE 58 -1.693 -3.026 -3.154 453 HD11 ILE 58 HD11 ILE 58 -0.585 -0.255 0.501 454 HD12 ILE 58 HD12 ILE 58 -0.785 0.404 -1.123 455 HD13 ILE 58 HD13 ILE 58 0.604 -0.615 -0.749 456 H ILE 59 HN ILE 59 0.815 -5.846 0.515 457 HA ILE 59 HA ILE 59 2.883 -6.618 -1.497 458 HB ILE 59 HB ILE 59 1.798 -7.696 1.134 459 HG12 ILE 59 HG12 ILE 59 4.671 -7.683 0.780 460 HG13 ILE 59 HG11 ILE 59 4.006 -6.102 0.368 461 HG21 ILE 59 HG21 ILE 59 3.203 -9.158 -1.067 462 HG22 ILE 59 HG22 ILE 59 1.995 -9.739 0.078 463 HG23 ILE 59 HG23 ILE 59 3.662 -9.515 0.596 464 HD11 ILE 59 HD11 ILE 59 4.544 -6.291 2.790 465 HD12 ILE 59 HD12 ILE 59 3.391 -7.615 2.918 466 HD13 ILE 59 HD13 ILE 59 2.829 -5.998 2.505 467 H ASP 60 HN ASP 60 0.852 -6.292 -2.993 468 HA ASP 60 HA ASP 60 -1.413 -7.950 -2.872 469 HB2 ASP 60 HB2 ASP 60 -1.547 -7.507 -5.313 470 HB3 ASP 60 HB1 ASP 60 -1.271 -6.069 -4.346 471 H VAL 61 HN VAL 61 -1.663 -9.415 -5.110 472 HA VAL 61 HA VAL 61 -1.480 -11.658 -5.681 473 HB VAL 61 HB VAL 61 0.425 -10.238 -6.766 474 HG11 VAL 61 HG11 VAL 61 2.020 -10.541 -4.826 475 HG12 VAL 61 HG12 VAL 61 2.667 -11.023 -6.385 476 HG13 VAL 61 HG13 VAL 61 2.108 -12.247 -5.252 477 HG21 VAL 61 HG21 VAL 61 1.019 -13.128 -6.985 478 HG22 VAL 61 HG22 VAL 61 0.625 -11.958 -8.245 479 HG23 VAL 61 HG23 VAL 61 -0.658 -12.653 -7.253 480 H ASN 62 HN ASN 62 -2.192 -12.501 -3.682 481 HA ASN 62 HA ASN 62 -0.066 -13.906 -2.100 482 HB2 ASN 62 HB2 ASN 62 -2.532 -12.481 -1.049 483 HB3 ASN 62 HB1 ASN 62 -1.350 -13.347 -0.069 484 HD21 ASN 62 HD21 ASN 62 -1.605 -10.607 -2.356 485 HD22 ASN 62 HD22 ASN 62 -0.355 -9.705 -1.648 486 H LEU 63 HN LEU 63 -0.677 -16.020 -1.486 487 HA LEU 63 HA LEU 63 -3.364 -16.969 -1.384 488 HB2 LEU 63 HB2 LEU 63 -2.510 -16.382 -3.980 489 HB3 LEU 63 HB1 LEU 63 -2.304 -18.127 -3.856 490 HG LEU 63 HG LEU 63 -4.645 -18.353 -3.087 491 HD11 LEU 63 HD11 LEU 63 -4.653 -15.943 -2.124 492 HD12 LEU 63 HD12 LEU 63 -6.126 -16.510 -2.905 493 HD13 LEU 63 HD13 LEU 63 -5.030 -15.434 -3.768 494 HD21 LEU 63 HD21 LEU 63 -5.053 -16.677 -5.480 495 HD22 LEU 63 HD22 LEU 63 -5.406 -18.387 -5.231 496 HD23 LEU 63 HD23 LEU 63 -3.770 -17.875 -5.647 497 H ASP 64 HN ASP 64 -3.359 -19.261 -0.846 498 HA ASP 64 HA ASP 64 -2.302 -21.220 0.006 499 HB2 ASP 64 HB2 ASP 64 -1.177 -20.527 -2.462 500 HB3 ASP 64 HB1 ASP 64 0.225 -20.730 -1.405 501 H GLY 65 HN GLY 65 -1.722 -18.255 0.915 502 HA2 GLY 65 HA2 GLY 65 -0.311 -17.186 2.472 503 HA3 GLY 65 HA1 GLY 65 -0.128 -18.799 3.182 504 H GLU 66 HN GLU 66 0.840 -17.400 0.038 505 HA GLU 66 HA GLU 66 3.490 -18.589 0.495 506 HB2 GLU 66 HB2 GLU 66 1.600 -18.625 -1.623 507 HB3 GLU 66 HB1 GLU 66 3.090 -17.890 -2.215 508 HG2 GLU 66 HG2 GLU 66 3.988 -20.046 -0.696 509 HG3 GLU 66 HG1 GLU 66 2.556 -20.678 -1.506 510 HA PRO 67 HA PRO 67 4.747 -14.417 -1.054 511 HB2 PRO 67 HB2 PRO 67 3.108 -13.063 -2.793 512 HB3 PRO 67 HB1 PRO 67 4.145 -14.417 -3.278 513 HG2 PRO 67 HG2 PRO 67 1.274 -14.323 -3.173 514 HG3 PRO 67 HG1 PRO 67 2.315 -15.622 -3.752 515 HD2 PRO 67 HD2 PRO 67 1.006 -15.310 -1.129 516 HD3 PRO 67 HD1 PRO 67 1.578 -16.773 -1.947 517 H SER 68 HN SER 68 3.167 -14.520 1.313 518 HA SER 68 HA SER 68 2.306 -11.658 1.529 519 HB2 SER 68 HB2 SER 68 0.452 -12.592 3.023 520 HB3 SER 68 HB1 SER 68 0.299 -12.945 1.306 521 HG SER 68 HG SER 68 0.902 -14.995 1.661 522 H TYR 69 HN TYR 69 4.032 -14.317 2.843 523 HA TYR 69 HA TYR 69 5.041 -14.756 4.907 524 HB2 TYR 69 HB2 TYR 69 6.119 -12.245 5.474 525 HB3 TYR 69 HB1 TYR 69 6.855 -13.500 4.493 526 HD1 TYR 69 HD2 TYR 69 4.607 -10.547 4.346 527 HD2 TYR 69 HD1 TYR 69 7.197 -13.162 2.163 528 HE1 TYR 69 HE2 TYR 69 4.506 -9.004 2.419 529 HE2 TYR 69 HE1 TYR 69 7.100 -11.621 0.221 530 HH TYR 69 HH TYR 69 6.631 -9.262 -0.236 531 HA PRO 70 HA PRO 70 2.888 -13.323 8.413 532 HB2 PRO 70 HB2 PRO 70 4.794 -13.050 10.343 533 HB3 PRO 70 HB1 PRO 70 4.286 -14.625 9.703 534 HG2 PRO 70 HG2 PRO 70 6.748 -13.086 9.187 535 HG3 PRO 70 HG1 PRO 70 6.478 -14.833 9.157 536 HD2 PRO 70 HD2 PRO 70 6.657 -13.142 6.934 537 HD3 PRO 70 HD1 PRO 70 6.069 -14.818 6.937 538 H VAL 71 HN VAL 71 4.938 -11.184 6.851 539 HA VAL 71 HA VAL 71 4.648 -9.019 8.819 540 HB VAL 71 HB VAL 71 6.753 -9.126 7.669 541 HG11 VAL 71 HG11 VAL 71 6.015 -10.421 5.695 542 HG12 VAL 71 HG12 VAL 71 6.945 -9.003 5.232 543 HG13 VAL 71 HG13 VAL 71 5.191 -8.990 5.084 544 HG21 VAL 71 HG21 VAL 71 4.903 -6.917 6.893 545 HG22 VAL 71 HG22 VAL 71 6.500 -6.970 6.150 546 HG23 VAL 71 HG23 VAL 71 6.347 -6.869 7.904 547 H ALA 72 HN ALA 72 3.526 -9.692 5.473 548 HA ALA 72 HA ALA 72 1.780 -7.404 5.328 549 HB1 ALA 72 HB1 ALA 72 1.566 -8.209 3.215 550 HB2 ALA 72 HB2 ALA 72 1.091 -9.806 3.793 551 HB3 ALA 72 HB3 ALA 72 2.798 -9.382 3.677 552 H ASP 73 HN ASP 73 1.231 -10.899 5.896 553 HA ASP 73 HA ASP 73 -1.541 -10.829 6.332 554 HB2 ASP 73 HB2 ASP 73 0.781 -12.473 7.161 555 HB3 ASP 73 HB1 ASP 73 -0.718 -12.752 8.036 556 H ILE 74 HN ILE 74 1.066 -10.622 8.767 557 HA ILE 74 HA ILE 74 -0.557 -10.070 11.035 558 HB ILE 74 HB ILE 74 2.258 -9.336 10.202 559 HG12 ILE 74 HG12 ILE 74 1.076 -11.278 12.220 560 HG13 ILE 74 HG11 ILE 74 1.830 -11.700 10.683 561 HG21 ILE 74 HG21 ILE 74 1.581 -7.585 11.732 562 HG22 ILE 74 HG22 ILE 74 2.604 -8.713 12.621 563 HG23 ILE 74 HG23 ILE 74 0.853 -8.758 12.828 564 HD11 ILE 74 HD11 ILE 74 3.526 -10.002 12.368 565 HD12 ILE 74 HD12 ILE 74 3.920 -11.503 11.529 566 HD13 ILE 74 HD13 ILE 74 3.141 -11.555 13.110 567 H LEU 75 HN LEU 75 0.847 -7.964 8.570 568 HA LEU 75 HA LEU 75 0.159 -5.438 9.635 569 HB2 LEU 75 HB2 LEU 75 1.546 -6.187 7.577 570 HB3 LEU 75 HB1 LEU 75 0.015 -6.205 6.711 571 HG LEU 75 HG LEU 75 -0.347 -3.839 7.362 572 HD11 LEU 75 HD11 LEU 75 2.290 -4.315 8.748 573 HD12 LEU 75 HD12 LEU 75 0.812 -3.620 9.412 574 HD13 LEU 75 HD13 LEU 75 1.790 -2.691 8.276 575 HD21 LEU 75 HD21 LEU 75 0.665 -4.074 5.234 576 HD22 LEU 75 HD22 LEU 75 2.190 -4.627 5.927 577 HD23 LEU 75 HD23 LEU 75 1.717 -2.934 6.074 578 H ALA 76 HN ALA 76 -1.823 -7.995 8.455 579 HA ALA 76 HA ALA 76 -4.131 -6.268 7.879 580 HB1 ALA 76 HB1 ALA 76 -4.294 -9.240 7.966 581 HB2 ALA 76 HB2 ALA 76 -3.198 -8.538 6.775 582 HB3 ALA 76 HB3 ALA 76 -4.911 -8.120 6.751 583 H GLU 77 HN GLU 77 -3.779 -9.259 9.854 584 HA GLU 77 HA GLU 77 -6.021 -9.132 11.420 585 HB2 GLU 77 HB2 GLU 77 -4.419 -10.014 13.290 586 HB3 GLU 77 HB1 GLU 77 -4.566 -10.930 11.794 587 HG2 GLU 77 HG2 GLU 77 -2.431 -10.459 11.143 588 HG3 GLU 77 HG1 GLU 77 -2.496 -8.820 11.778 589 H ARG 78 HN ARG 78 -3.106 -7.147 11.954 590 HA ARG 78 HA ARG 78 -4.690 -5.509 13.868 591 HB2 ARG 78 HB2 ARG 78 -2.512 -5.046 14.952 592 HB3 ARG 78 HB1 ARG 78 -2.814 -6.782 14.879 593 HG2 ARG 78 HG2 ARG 78 -1.402 -6.981 12.895 594 HG3 ARG 78 HG1 ARG 78 -1.151 -5.234 12.870 595 HD2 ARG 78 HD2 ARG 78 -0.437 -6.865 15.315 596 HD3 ARG 78 HD1 ARG 78 0.709 -6.656 13.973 597 HE ARG 78 HE ARG 78 0.158 -4.119 14.285 598 HH11 ARG 78 HH21 ARG 78 -1.145 -5.729 16.852 599 HH12 ARG 78 HH22 ARG 78 -0.191 -4.966 18.078 600 HH21 ARG 78 HH11 ARG 78 1.966 -3.449 15.827 601 HH22 ARG 78 HH12 ARG 78 1.567 -3.669 17.499 602 H ASN 79 HN ASN 79 -4.629 -5.234 10.994 603 HA ASN 79 HA ASN 79 -2.796 -3.376 9.950 604 HB2 ASN 79 HB2 ASN 79 -4.840 -2.813 8.473 605 HB3 ASN 79 HB1 ASN 79 -4.282 -4.484 8.486 606 HD21 ASN 79 HD21 ASN 79 -6.297 -5.562 8.188 607 HD22 ASN 79 HD22 ASN 79 -7.589 -5.433 9.280 608 H VAL 80 HN VAL 80 -2.483 -1.255 10.202 609 HA VAL 80 HA VAL 80 -4.337 0.335 11.920 610 HB VAL 80 HB VAL 80 -2.340 1.691 12.262 611 HG11 VAL 80 HG11 VAL 80 -0.795 -0.743 12.230 612 HG12 VAL 80 HG12 VAL 80 -2.437 -1.081 12.776 613 HG13 VAL 80 HG13 VAL 80 -1.462 0.127 13.612 614 HG21 VAL 80 HG21 VAL 80 -0.432 1.623 10.888 615 HG22 VAL 80 HG22 VAL 80 -1.731 1.403 9.715 616 HG23 VAL 80 HG23 VAL 80 -0.811 0.010 10.284 617 HA PRO 81 HA PRO 81 -5.278 2.993 8.440 618 HB2 PRO 81 HB2 PRO 81 -3.642 5.175 8.112 619 HB3 PRO 81 HB1 PRO 81 -4.912 5.089 9.349 620 HG2 PRO 81 HG2 PRO 81 -1.980 4.663 9.615 621 HG3 PRO 81 HG1 PRO 81 -3.111 5.466 10.716 622 HD2 PRO 81 HD2 PRO 81 -2.185 2.965 11.114 623 HD3 PRO 81 HD1 PRO 81 -3.781 3.490 11.683 624 H PHE 82 HN PHE 82 -4.973 2.207 6.385 625 HA PHE 82 HA PHE 82 -2.475 2.408 4.929 626 HB2 PHE 82 HB2 PHE 82 -1.638 0.208 5.229 627 HB3 PHE 82 HB1 PHE 82 -2.097 0.724 6.852 628 HD1 PHE 82 HD1 PHE 82 -5.022 0.419 6.870 629 HD2 PHE 82 HD2 PHE 82 -2.021 -2.102 5.106 630 HE1 PHE 82 HE1 PHE 82 -6.555 -1.515 7.038 631 HE2 PHE 82 HE2 PHE 82 -3.560 -4.043 5.282 632 HZ PHE 82 HZ PHE 82 -5.827 -3.747 6.242 633 H ILE 83 HN ILE 83 -2.903 -0.264 3.721 634 HA ILE 83 HA ILE 83 -5.544 -0.569 2.685 635 HB ILE 83 HB ILE 83 -3.874 1.515 1.585 636 HG12 ILE 83 HG12 ILE 83 -6.645 0.704 0.716 637 HG13 ILE 83 HG11 ILE 83 -6.351 1.527 2.245 638 HG21 ILE 83 HG21 ILE 83 -4.147 1.054 -0.793 639 HG22 ILE 83 HG22 ILE 83 -4.963 -0.466 -0.425 640 HG23 ILE 83 HG23 ILE 83 -3.252 -0.270 -0.046 641 HD11 ILE 83 HD11 ILE 83 -5.060 3.269 0.837 642 HD12 ILE 83 HD12 ILE 83 -6.821 3.285 0.742 643 HD13 ILE 83 HD13 ILE 83 -5.874 2.546 -0.550 644 H PHE 84 HN PHE 84 -5.552 -2.270 1.044 645 HA PHE 84 HA PHE 84 -2.976 -3.561 0.391 646 HB2 PHE 84 HB2 PHE 84 -4.113 -4.087 2.757 647 HB3 PHE 84 HB1 PHE 84 -5.020 -5.227 1.766 648 HD1 PHE 84 HD2 PHE 84 -3.635 -6.814 0.217 649 HD2 PHE 84 HD1 PHE 84 -1.946 -4.634 3.516 650 HE1 PHE 84 HE2 PHE 84 -1.714 -8.389 0.285 651 HE2 PHE 84 HE1 PHE 84 -0.034 -6.215 3.580 652 HZ PHE 84 HZ PHE 84 0.078 -8.085 1.961 653 H ALA 85 HN ALA 85 -3.336 -5.456 -1.030 654 HA ALA 85 HA ALA 85 -5.992 -5.803 -2.249 655 HB1 ALA 85 HB1 ALA 85 -5.466 -3.982 -3.589 656 HB2 ALA 85 HB2 ALA 85 -4.612 -5.227 -4.502 657 HB3 ALA 85 HB3 ALA 85 -3.730 -4.202 -3.369 658 H THR 86 HN THR 86 -6.011 -7.749 -3.572 659 HA THR 86 HA THR 86 -3.790 -9.212 -4.494 660 HB THR 86 HB THR 86 -2.858 -9.271 -2.313 661 HG1 THR 86 HG1 THR 86 -4.186 -11.665 -2.042 662 HG21 THR 86 HG21 THR 86 -5.316 -10.398 -1.035 663 HG22 THR 86 HG22 THR 86 -5.257 -8.661 -1.329 664 HG23 THR 86 HG23 THR 86 -4.031 -9.427 -0.322 665 H GLY 87 HN GLY 87 -4.318 -11.817 -3.993 666 HA2 GLY 87 HA2 GLY 87 -6.204 -12.759 -5.641 667 HA3 GLY 87 HA1 GLY 87 -5.955 -13.554 -4.087 668 H TYR 88 HN TYR 88 -7.057 -11.557 -2.385 669 HA TYR 88 HA TYR 88 -9.897 -11.526 -3.339 670 HB2 TYR 88 HB2 TYR 88 -10.520 -11.987 -0.970 671 HB3 TYR 88 HB1 TYR 88 -9.577 -13.276 -1.698 672 HD1 TYR 88 HD1 TYR 88 -7.473 -10.436 -0.977 673 HD2 TYR 88 HD2 TYR 88 -9.365 -13.849 0.822 674 HE1 TYR 88 HE1 TYR 88 -5.896 -10.311 0.916 675 HE2 TYR 88 HE2 TYR 88 -7.772 -13.724 2.715 676 HH TYR 88 HH TYR 88 -5.054 -11.498 2.688 677 H GLY 89 HN GLY 89 -7.513 -9.469 -2.951 678 HA2 GLY 89 HA2 GLY 89 -7.508 -7.134 -2.653 679 HA3 GLY 89 HA1 GLY 89 -9.249 -7.222 -2.370 680 H SER 90 HN SER 90 -9.621 -8.648 -0.186 681 HA SER 90 HA SER 90 -7.675 -8.028 1.919 682 HB2 SER 90 HB2 SER 90 -9.160 -6.461 3.066 683 HB3 SER 90 HB1 SER 90 -8.865 -5.894 1.426 684 HG SER 90 HG SER 90 -11.092 -5.839 1.978 685 H LYS 91 HN LYS 91 -8.024 -9.396 3.703 686 HA LYS 91 HA LYS 91 -10.099 -11.451 3.468 687 HB2 LYS 91 HB2 LYS 91 -8.874 -12.325 5.491 688 HB3 LYS 91 HB1 LYS 91 -7.821 -12.031 4.107 689 HG2 LYS 91 HG2 LYS 91 -6.626 -10.515 5.270 690 HG3 LYS 91 HG1 LYS 91 -8.086 -9.617 5.677 691 HD2 LYS 91 HD2 LYS 91 -8.498 -11.459 7.445 692 HD3 LYS 91 HD1 LYS 91 -6.808 -11.894 7.190 693 HE2 LYS 91 HE2 LYS 91 -6.039 -10.025 8.267 694 HE3 LYS 91 HE1 LYS 91 -7.317 -8.995 7.597 695 HZ1 LYS 91 HZ1 LYS 91 -8.221 -11.103 9.370 696 HZ2 LYS 91 HZ2 LYS 91 -8.716 -9.480 9.271 697 HZ3 LYS 91 HZ3 LYS 91 -7.303 -9.891 10.122 698 H GLY 92 HN GLY 92 -9.526 -8.530 5.228 699 HA2 GLY 92 HA2 GLY 92 -12.105 -8.058 6.157 700 HA3 GLY 92 HA1 GLY 92 -11.339 -9.010 7.436 701 H LEU 93 HN LEU 93 -9.799 -6.710 5.267 702 HA LEU 93 HA LEU 93 -8.239 -5.472 7.278 703 HB2 LEU 93 HB2 LEU 93 -7.569 -4.012 5.495 704 HB3 LEU 93 HB1 LEU 93 -7.834 -5.609 4.813 705 HG LEU 93 HG LEU 93 -8.903 -4.304 3.247 706 HD11 LEU 93 HD11 LEU 93 -10.673 -5.752 3.795 707 HD12 LEU 93 HD12 LEU 93 -11.416 -4.157 3.821 708 HD13 LEU 93 HD13 LEU 93 -10.989 -4.952 5.326 709 HD21 LEU 93 HD21 LEU 93 -10.459 -2.343 4.331 710 HD22 LEU 93 HD22 LEU 93 -8.796 -2.115 3.794 711 HD23 LEU 93 HD23 LEU 93 -9.138 -2.420 5.496 712 H ASP 94 HN ASP 94 -8.987 -4.307 8.932 713 HA ASP 94 HA ASP 94 -11.262 -2.404 8.513 714 HB2 ASP 94 HB2 ASP 94 -11.510 -2.612 10.957 715 HB3 ASP 94 HB1 ASP 94 -11.486 -4.215 10.221 716 H THR 95 HN THR 95 -10.703 -0.205 8.583 717 HA THR 95 HA THR 95 -8.371 0.645 10.180 718 HB THR 95 HB THR 95 -7.430 -0.226 8.072 719 HG1 THR 95 HG1 THR 95 -6.073 1.338 8.155 720 HG21 THR 95 HG21 THR 95 -8.823 -0.028 6.300 721 HG22 THR 95 HG22 THR 95 -8.059 1.550 6.114 722 HG23 THR 95 HG23 THR 95 -9.602 1.410 6.958 723 H ARG 96 HN ARG 96 -7.910 3.089 8.992 724 HA ARG 96 HA ARG 96 -10.301 4.604 9.780 725 HB2 ARG 96 HB2 ARG 96 -7.609 5.495 8.685 726 HB3 ARG 96 HB1 ARG 96 -8.757 6.489 9.583 727 HG2 ARG 96 HG2 ARG 96 -8.389 4.331 11.268 728 HG3 ARG 96 HG1 ARG 96 -6.782 4.557 10.577 729 HD2 ARG 96 HD2 ARG 96 -8.271 6.989 11.511 730 HD3 ARG 96 HD1 ARG 96 -7.502 5.945 12.724 731 HE ARG 96 HE ARG 96 -5.703 6.418 10.521 732 HH11 ARG 96 HH21 ARG 96 -7.353 8.484 12.646 733 HH12 ARG 96 HH22 ARG 96 -5.930 9.288 13.223 734 HH21 ARG 96 HH11 ARG 96 -3.738 7.194 11.547 735 HH22 ARG 96 HH12 ARG 96 -3.890 8.558 12.606 736 H TYR 97 HN TYR 97 -9.145 3.196 6.924 737 HA TYR 97 HA TYR 97 -9.969 5.298 5.061 738 HB2 TYR 97 HB2 TYR 97 -9.162 2.392 4.871 739 HB3 TYR 97 HB1 TYR 97 -9.656 3.307 3.447 740 HD1 TYR 97 HD2 TYR 97 -7.193 3.200 6.243 741 HD2 TYR 97 HD1 TYR 97 -8.202 4.907 2.430 742 HE1 TYR 97 HE2 TYR 97 -4.932 4.199 6.090 743 HE2 TYR 97 HE1 TYR 97 -5.939 5.907 2.280 744 HH TYR 97 HH TYR 97 -4.087 6.586 4.367 745 H SER 98 HN SER 98 -11.832 3.553 7.084 746 HA SER 98 HA SER 98 -14.126 2.990 7.086 747 HB2 SER 98 HB2 SER 98 -13.678 4.997 4.950 748 HB3 SER 98 HB1 SER 98 -15.184 4.084 4.820 749 HG SER 98 HG SER 98 -15.296 4.615 7.209 750 H ASN 99 HN ASN 99 -11.980 1.465 5.398 751 HA ASN 99 HA ASN 99 -11.972 -0.419 3.976 752 HB2 ASN 99 HB2 ASN 99 -14.535 -0.361 5.499 753 HB3 ASN 99 HB1 ASN 99 -14.405 -1.542 4.190 754 HD21 ASN 99 HD21 ASN 99 -11.547 -0.463 5.945 755 HD22 ASN 99 HD22 ASN 99 -11.265 -1.927 6.752 756 H ILE 100 HN ILE 100 -11.820 0.253 1.843 757 HA ILE 100 HA ILE 100 -14.186 0.157 0.206 758 HB ILE 100 HB ILE 100 -13.503 2.725 -0.514 759 HG12 ILE 100 HG12 ILE 100 -13.962 3.434 2.211 760 HG13 ILE 100 HG11 ILE 100 -12.527 2.419 2.180 761 HG21 ILE 100 HG21 ILE 100 -15.672 1.292 0.737 762 HG22 ILE 100 HG22 ILE 100 -15.735 2.675 -0.356 763 HG23 ILE 100 HG23 ILE 100 -15.575 2.933 1.380 764 HD11 ILE 100 HD11 ILE 100 -11.786 3.881 0.176 765 HD12 ILE 100 HD12 ILE 100 -11.676 4.573 1.794 766 HD13 ILE 100 HD13 ILE 100 -13.018 5.013 0.736 767 HA PRO 101 HA PRO 101 -10.505 0.862 -2.618 768 HB2 PRO 101 HB2 PRO 101 -8.074 1.591 -1.626 769 HB3 PRO 101 HB1 PRO 101 -9.359 2.755 -1.989 770 HG2 PRO 101 HG2 PRO 101 -8.336 1.874 0.592 771 HG3 PRO 101 HG1 PRO 101 -9.301 3.299 0.190 772 HD2 PRO 101 HD2 PRO 101 -10.167 0.801 1.330 773 HD3 PRO 101 HD1 PRO 101 -11.109 2.269 1.033 774 H LEU 102 HN LEU 102 -10.962 -1.611 -1.144 775 HA LEU 102 HA LEU 102 -8.208 -2.788 -1.182 776 HB2 LEU 102 HB2 LEU 102 -10.655 -4.092 0.013 777 HB3 LEU 102 HB1 LEU 102 -8.966 -4.349 0.432 778 HG LEU 102 HG LEU 102 -9.777 -3.065 2.217 779 HD11 LEU 102 HD11 LEU 102 -7.897 -1.951 0.526 780 HD12 LEU 102 HD12 LEU 102 -8.255 -1.403 2.163 781 HD13 LEU 102 HD13 LEU 102 -9.033 -0.627 0.785 782 HD21 LEU 102 HD21 LEU 102 -11.846 -2.428 0.587 783 HD22 LEU 102 HD22 LEU 102 -10.984 -0.891 0.622 784 HD23 LEU 102 HD23 LEU 102 -11.536 -1.625 2.126 785 H LEU 103 HN LEU 103 -7.794 -4.511 -2.642 786 HA LEU 103 HA LEU 103 -9.779 -6.215 -3.838 787 HB2 LEU 103 HB2 LEU 103 -10.812 -4.249 -4.688 788 HB3 LEU 103 HB1 LEU 103 -9.272 -3.499 -5.069 789 HG LEU 103 HG LEU 103 -10.619 -4.279 -7.041 790 HD11 LEU 103 HD11 LEU 103 -7.930 -4.224 -6.633 791 HD12 LEU 103 HD12 LEU 103 -8.697 -4.526 -8.192 792 HD13 LEU 103 HD13 LEU 103 -8.155 -5.877 -7.201 793 HD21 LEU 103 HD21 LEU 103 -9.990 -6.943 -7.254 794 HD22 LEU 103 HD22 LEU 103 -11.563 -6.317 -6.771 795 HD23 LEU 103 HD23 LEU 103 -10.396 -6.801 -5.544 796 H THR 104 HN THR 104 -8.772 -7.605 -5.586 797 HA THR 104 HA THR 104 -5.987 -8.087 -5.342 798 HB THR 104 HB THR 104 -7.287 -9.827 -6.273 799 HG1 THR 104 HG1 THR 104 -6.389 -10.160 -8.282 800 HG21 THR 104 HG21 THR 104 -8.447 -7.637 -7.963 801 HG22 THR 104 HG22 THR 104 -9.280 -8.803 -6.941 802 HG23 THR 104 HG23 THR 104 -8.585 -9.315 -8.481 803 H LYS 105 HN LYS 105 -6.291 -7.739 -8.720 804 HA LYS 105 HA LYS 105 -5.186 -4.964 -8.708 805 HB2 LYS 105 HB2 LYS 105 -3.693 -7.457 -8.872 806 HB3 LYS 105 HB1 LYS 105 -3.334 -6.354 -10.202 807 HG2 LYS 105 HG2 LYS 105 -2.064 -5.135 -8.806 808 HG3 LYS 105 HG1 LYS 105 -3.511 -4.769 -7.863 809 HD2 LYS 105 HD2 LYS 105 -1.677 -5.845 -6.529 810 HD3 LYS 105 HD1 LYS 105 -3.200 -6.730 -6.493 811 HE2 LYS 105 HE2 LYS 105 -1.016 -8.093 -6.933 812 HE3 LYS 105 HE1 LYS 105 -2.395 -8.400 -7.999 813 HZ1 LYS 105 HZ1 LYS 105 -0.140 -7.876 -9.075 814 HZ2 LYS 105 HZ2 LYS 105 -0.439 -6.269 -8.610 815 HZ3 LYS 105 HZ3 LYS 105 -1.507 -7.065 -9.666 816 HA PRO 106 HA PRO 106 -6.902 -6.439 -12.950 817 HB2 PRO 106 HB2 PRO 106 -9.586 -5.901 -12.728 818 HB3 PRO 106 HB1 PRO 106 -8.903 -7.516 -12.438 819 HG2 PRO 106 HG2 PRO 106 -9.655 -5.402 -10.468 820 HG3 PRO 106 HG1 PRO 106 -9.949 -7.147 -10.410 821 HD2 PRO 106 HD2 PRO 106 -7.951 -6.010 -9.022 822 HD3 PRO 106 HD1 PRO 106 -7.799 -7.625 -9.729 823 H PHE 107 HN PHE 107 -6.953 -3.936 -10.691 824 HA PHE 107 HA PHE 107 -6.848 -1.620 -10.870 825 HB2 PHE 107 HB2 PHE 107 -6.245 -2.667 -13.603 826 HB3 PHE 107 HB1 PHE 107 -6.499 -0.929 -13.418 827 HD1 PHE 107 HD1 PHE 107 -5.485 -0.350 -10.765 828 HD2 PHE 107 HD2 PHE 107 -3.905 -3.015 -13.741 829 HE1 PHE 107 HE1 PHE 107 -3.233 -0.118 -9.769 830 HE2 PHE 107 HE2 PHE 107 -1.644 -2.782 -12.743 831 HZ PHE 107 HZ PHE 107 -1.300 -1.319 -10.759 832 H LEU 108 HN LEU 108 -9.336 -2.728 -10.603 833 HA LEU 108 HA LEU 108 -11.092 -1.029 -12.346 834 HB2 LEU 108 HB2 LEU 108 -11.092 -3.802 -11.671 835 HB3 LEU 108 HB1 LEU 108 -12.462 -3.074 -10.835 836 HG LEU 108 HG LEU 108 -13.111 -1.991 -13.022 837 HD11 LEU 108 HD11 LEU 108 -10.860 -2.187 -14.072 838 HD12 LEU 108 HD12 LEU 108 -12.126 -2.901 -15.072 839 HD13 LEU 108 HD13 LEU 108 -11.062 -3.939 -14.123 840 HD21 LEU 108 HD21 LEU 108 -12.956 -5.007 -13.216 841 HD22 LEU 108 HD22 LEU 108 -14.230 -3.947 -13.819 842 HD23 LEU 108 HD23 LEU 108 -14.034 -4.190 -12.084 843 H ASP 109 HN ASP 109 -11.002 0.839 -10.973 844 HA ASP 109 HA ASP 109 -11.649 2.159 -9.123 845 HB2 ASP 109 HB2 ASP 109 -13.067 -0.389 -8.257 846 HB3 ASP 109 HB1 ASP 109 -13.428 1.250 -7.724 847 H SER 110 HN SER 110 -9.472 -0.205 -9.141 848 HA SER 110 HA SER 110 -9.055 -0.717 -6.298 849 HB2 SER 110 HB2 SER 110 -8.463 -2.294 -8.094 850 HB3 SER 110 HB1 SER 110 -7.337 -1.120 -8.766 851 HG SER 110 HG SER 110 -6.560 -1.235 -6.369 852 H GLU 111 HN GLU 111 -6.135 0.073 -7.916 853 HA GLU 111 HA GLU 111 -4.998 1.756 -6.087 854 HB2 GLU 111 HB2 GLU 111 -3.557 2.428 -7.857 855 HB3 GLU 111 HB1 GLU 111 -4.171 0.854 -8.359 856 HG2 GLU 111 HG2 GLU 111 -4.586 2.020 -10.299 857 HG3 GLU 111 HG1 GLU 111 -6.085 2.385 -9.445 858 H LEU 112 HN LEU 112 -7.562 2.621 -8.329 859 HA LEU 112 HA LEU 112 -7.414 5.472 -8.093 860 HB2 LEU 112 HB2 LEU 112 -9.841 3.690 -8.474 861 HB3 LEU 112 HB1 LEU 112 -9.647 5.351 -9.041 862 HG LEU 112 HG LEU 112 -7.444 3.714 -9.940 863 HD11 LEU 112 HD11 LEU 112 -8.443 1.838 -10.685 864 HD12 LEU 112 HD12 LEU 112 -9.669 2.785 -11.526 865 HD13 LEU 112 HD13 LEU 112 -9.911 2.329 -9.841 866 HD21 LEU 112 HD21 LEU 112 -7.741 4.966 -11.842 867 HD22 LEU 112 HD22 LEU 112 -8.745 5.945 -10.772 868 HD23 LEU 112 HD23 LEU 112 -9.491 4.749 -11.833 869 H GLU 113 HN GLU 113 -9.850 3.315 -6.567 870 HA GLU 113 HA GLU 113 -10.774 5.144 -4.619 871 HB2 GLU 113 HB2 GLU 113 -11.194 2.493 -5.310 872 HB3 GLU 113 HB1 GLU 113 -10.486 2.358 -3.698 873 HG2 GLU 113 HG2 GLU 113 -12.258 3.363 -2.687 874 HG3 GLU 113 HG1 GLU 113 -12.529 4.471 -4.033 875 H ALA 114 HN ALA 114 -7.773 3.425 -4.833 876 HA ALA 114 HA ALA 114 -7.054 3.383 -2.056 877 HB1 ALA 114 HB1 ALA 114 -6.026 2.541 -4.474 878 HB2 ALA 114 HB2 ALA 114 -5.165 2.467 -2.936 879 HB3 ALA 114 HB3 ALA 114 -4.909 3.830 -4.023 880 H VAL 115 HN VAL 115 -6.761 5.837 -4.589 881 HA VAL 115 HA VAL 115 -5.523 7.721 -2.617 882 HB VAL 115 HB VAL 115 -5.842 8.035 -5.609 883 HG11 VAL 115 HG11 VAL 115 -4.474 9.837 -5.380 884 HG12 VAL 115 HG12 VAL 115 -3.467 9.039 -4.173 885 HG13 VAL 115 HG13 VAL 115 -4.987 9.796 -3.694 886 HG21 VAL 115 HG21 VAL 115 -3.398 7.177 -5.586 887 HG22 VAL 115 HG22 VAL 115 -4.682 5.978 -5.441 888 HG23 VAL 115 HG23 VAL 115 -3.794 6.497 -4.008 889 H LEU 116 HN LEU 116 -8.211 7.412 -4.929 890 HA LEU 116 HA LEU 116 -9.319 10.003 -4.725 891 HB2 LEU 116 HB2 LEU 116 -9.821 7.857 -6.166 892 HB3 LEU 116 HB1 LEU 116 -11.014 7.537 -4.905 893 HG LEU 116 HG LEU 116 -11.684 10.042 -5.285 894 HD11 LEU 116 HD11 LEU 116 -10.235 10.959 -6.805 895 HD12 LEU 116 HD12 LEU 116 -11.367 10.258 -7.962 896 HD13 LEU 116 HD13 LEU 116 -9.877 9.405 -7.556 897 HD21 LEU 116 HD21 LEU 116 -13.481 8.877 -5.990 898 HD22 LEU 116 HD22 LEU 116 -12.466 7.530 -6.506 899 HD23 LEU 116 HD23 LEU 116 -12.773 8.876 -7.605 900 H VAL 117 HN VAL 117 -9.502 7.311 -2.482 901 HA VAL 117 HA VAL 117 -11.793 7.938 -0.976 902 HB VAL 117 HB VAL 117 -10.604 5.916 -0.589 903 HG11 VAL 117 HG11 VAL 117 -8.257 7.775 -0.427 904 HG12 VAL 117 HG12 VAL 117 -8.421 6.267 -1.316 905 HG13 VAL 117 HG13 VAL 117 -8.173 6.236 0.427 906 HG21 VAL 117 HG21 VAL 117 -10.358 5.889 1.757 907 HG22 VAL 117 HG22 VAL 117 -11.450 7.247 1.481 908 HG23 VAL 117 HG23 VAL 117 -9.741 7.541 1.801 909 H GLN 118 HN GLN 118 -8.914 9.864 -1.226 910 HA GLN 118 HA GLN 118 -9.700 11.309 1.272 911 HB2 GLN 118 HB2 GLN 118 -6.990 11.145 -0.077 912 HB3 GLN 118 HB1 GLN 118 -7.333 11.782 1.531 913 HG2 GLN 118 HG2 GLN 118 -8.195 8.977 0.976 914 HG3 GLN 118 HG1 GLN 118 -6.466 9.264 1.156 915 HE21 GLN 118 HE21 GLN 118 -8.759 11.328 2.823 916 HE22 GLN 118 HE22 GLN 118 -8.463 10.724 4.378 917 H ILE 119 HN ILE 119 -8.980 11.671 -2.159 918 HA ILE 119 HA ILE 119 -8.937 14.626 -1.913 919 HB ILE 119 HB ILE 119 -8.415 12.614 -4.066 920 HG12 ILE 119 HG12 ILE 119 -6.188 13.416 -3.965 921 HG13 ILE 119 HG11 ILE 119 -6.677 14.910 -3.170 922 HG21 ILE 119 HG21 ILE 119 -9.491 14.241 -5.368 923 HG22 ILE 119 HG22 ILE 119 -7.810 14.771 -5.424 924 HG23 ILE 119 HG23 ILE 119 -8.947 15.558 -4.330 925 HD11 ILE 119 HD11 ILE 119 -6.945 12.174 -1.898 926 HD12 ILE 119 HD12 ILE 119 -7.172 13.739 -1.118 927 HD13 ILE 119 HD13 ILE 119 -5.563 13.239 -1.640 928 H SER 120 HN SER 120 -11.346 12.499 -1.836 929 HA SER 120 HA SER 120 -13.310 14.382 -2.943 930 HB2 SER 120 HB2 SER 120 -12.207 12.194 -4.476 931 HB3 SER 120 HB1 SER 120 -13.929 11.928 -4.209 932 HG SER 120 HG SER 120 -14.369 13.863 -5.163 933 H LYS 121 HN LYS 121 -12.752 13.160 -0.356 934 HA LYS 121 HA LYS 121 -15.268 11.571 -0.019 935 HB2 LYS 121 HB2 LYS 121 -12.450 11.002 0.529 936 HB3 LYS 121 HB1 LYS 121 -13.477 10.744 1.943 937 HG2 LYS 121 HG2 LYS 121 -14.849 9.705 -0.332 938 HG3 LYS 121 HG1 LYS 121 -13.200 9.080 -0.365 939 HD2 LYS 121 HD2 LYS 121 -14.168 7.509 1.031 940 HD3 LYS 121 HD1 LYS 121 -13.683 8.704 2.235 941 HE2 LYS 121 HE2 LYS 121 -15.888 8.605 2.858 942 HE3 LYS 121 HE1 LYS 121 -16.138 9.674 1.463 943 HZ1 LYS 121 HZ1 LYS 121 -16.302 7.662 0.062 944 HZ2 LYS 121 HZ2 LYS 121 -17.541 7.755 1.221 945 HZ3 LYS 121 HZ3 LYS 121 -16.230 6.703 1.460 946 H GLU 122 HN GLU 122 -16.201 13.709 0.624 947 HA GLU 122 HA GLU 122 -16.694 15.432 2.172 948 HB2 GLU 122 HB2 GLU 122 -17.318 14.459 4.282 949 HB3 GLU 122 HB1 GLU 122 -17.563 13.204 3.069 950 HG2 GLU 122 HG2 GLU 122 -15.576 12.060 3.697 951 HG3 GLU 122 HG1 GLU 122 -14.979 13.439 4.620 952 H VAL 123 HN VAL 123 -13.898 15.167 1.382 953 HA VAL 123 HA VAL 123 -11.713 15.702 2.119 954 HB VAL 123 HB VAL 123 -11.780 17.973 3.150 955 HG11 VAL 123 HG11 VAL 123 -14.003 18.246 1.264 956 HG12 VAL 123 HG12 VAL 123 -12.725 17.193 0.659 957 HG13 VAL 123 HG13 VAL 123 -12.349 18.847 1.144 958 HG21 VAL 123 HG21 VAL 123 -13.777 17.357 4.628 959 HG22 VAL 123 HG22 VAL 123 -14.784 17.623 3.206 960 HG23 VAL 123 HG23 VAL 123 -13.836 18.950 3.875 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 19.432 10.229 11.321 2 H2 GLY 1 HT2 GLY 1 18.237 11.052 10.437 3 H3 GLY 1 HT3 GLY 1 18.197 11.055 12.136 4 HA2 GLY 1 HA2 GLY 1 19.787 12.627 12.341 5 HA3 GLY 1 HA1 GLY 1 20.617 12.088 10.881 6 H SER 2 HN SER 2 17.458 13.514 11.807 7 HA SER 2 HA SER 2 17.816 15.552 9.678 8 HB2 SER 2 HB2 SER 2 15.758 14.915 8.573 9 HB3 SER 2 HB1 SER 2 16.747 13.466 8.728 10 HG SER 2 HG SER 2 14.443 13.356 9.392 11 H HIS 3 HN HIS 3 15.560 16.913 9.732 12 HA HIS 3 HA HIS 3 14.961 17.395 12.635 13 HB2 HIS 3 HB2 HIS 3 16.368 19.060 11.255 14 HB3 HIS 3 HB1 HIS 3 14.869 19.427 10.398 15 HD1 HIS 3 HD1 HIS 3 12.826 20.257 11.966 16 HD2 HIS 3 HD2 HIS 3 16.606 20.332 13.722 17 HE1 HIS 3 HE1 HIS 3 12.635 21.738 14.011 18 H MET 4 HN MET 4 13.536 18.417 9.505 19 HA MET 4 HA MET 4 10.841 18.444 10.472 20 HB2 MET 4 HB2 MET 4 12.057 18.184 7.703 21 HB3 MET 4 HB1 MET 4 10.350 18.517 8.001 22 HG2 MET 4 HG2 MET 4 10.780 20.698 8.343 23 HG3 MET 4 HG1 MET 4 11.995 20.309 9.561 24 HE1 MET 4 HE1 MET 4 11.210 20.543 5.769 25 HE2 MET 4 HE2 MET 4 12.509 21.631 5.283 26 HE3 MET 4 HE3 MET 4 11.365 22.134 6.526 27 H THR 5 HN THR 5 9.224 16.973 8.943 28 HA THR 5 HA THR 5 10.147 14.132 9.227 29 HB THR 5 HB THR 5 7.675 13.776 9.886 30 HG1 THR 5 HG1 THR 5 7.050 15.925 10.961 31 HG21 THR 5 HG21 THR 5 9.907 14.915 11.441 32 HG22 THR 5 HG22 THR 5 8.926 13.483 11.757 33 HG23 THR 5 HG23 THR 5 8.323 15.080 12.200 34 H GLU 6 HN GLU 6 9.114 12.651 7.731 35 HA GLU 6 HA GLU 6 7.482 13.840 5.545 36 HB2 GLU 6 HB2 GLU 6 9.074 12.941 3.872 37 HB3 GLU 6 HB1 GLU 6 9.870 14.104 4.935 38 HG2 GLU 6 HG2 GLU 6 11.387 12.517 5.432 39 HG3 GLU 6 HG1 GLU 6 10.102 11.604 6.224 40 H ARG 7 HN ARG 7 7.549 11.631 7.803 41 HA ARG 7 HA ARG 7 7.139 9.146 6.314 42 HB2 ARG 7 HB2 ARG 7 7.143 10.135 9.126 43 HB3 ARG 7 HB1 ARG 7 6.244 8.651 8.805 44 HG2 ARG 7 HG2 ARG 7 8.237 7.597 8.983 45 HG3 ARG 7 HG1 ARG 7 8.584 8.264 7.387 46 HD2 ARG 7 HD2 ARG 7 9.665 10.214 8.379 47 HD3 ARG 7 HD1 ARG 7 9.220 9.665 10.008 48 HE ARG 7 HE ARG 7 10.527 7.478 8.993 49 HH11 ARG 7 HH21 ARG 7 11.485 10.448 7.843 50 HH12 ARG 7 HH22 ARG 7 13.091 10.395 8.491 51 HH21 ARG 7 HH11 ARG 7 12.505 7.563 10.406 52 HH22 ARG 7 HH12 ARG 7 13.668 8.758 9.940 53 H ARG 8 HN ARG 8 5.259 11.844 6.511 54 HA ARG 8 HA ARG 8 2.676 10.566 7.086 55 HB2 ARG 8 HB2 ARG 8 3.311 12.958 7.593 56 HB3 ARG 8 HB1 ARG 8 3.313 13.265 5.855 57 HG2 ARG 8 HG2 ARG 8 1.102 13.670 6.021 58 HG3 ARG 8 HG1 ARG 8 0.892 11.946 6.330 59 HD2 ARG 8 HD2 ARG 8 1.219 12.363 8.768 60 HD3 ARG 8 HD1 ARG 8 1.327 14.102 8.430 61 HE ARG 8 HE ARG 8 -1.064 12.621 7.453 62 HH11 ARG 8 HH11 ARG 8 0.097 14.131 10.236 63 HH12 ARG 8 HH12 ARG 8 -1.242 15.217 10.408 64 HH21 ARG 8 HH21 ARG 8 -2.667 14.370 7.363 65 HH22 ARG 8 HH22 ARG 8 -2.797 15.362 8.777 66 H LEU 9 HN LEU 9 4.657 11.235 4.272 67 HA LEU 9 HA LEU 9 2.450 10.243 2.537 68 HB2 LEU 9 HB2 LEU 9 4.510 12.388 2.254 69 HB3 LEU 9 HB1 LEU 9 4.001 11.531 0.801 70 HG LEU 9 HG LEU 9 1.628 12.111 2.208 71 HD11 LEU 9 HD11 LEU 9 3.468 14.516 2.023 72 HD12 LEU 9 HD12 LEU 9 2.930 13.756 3.521 73 HD13 LEU 9 HD13 LEU 9 1.762 14.557 2.469 74 HD21 LEU 9 HD21 LEU 9 1.033 12.814 0.129 75 HD22 LEU 9 HD22 LEU 9 2.645 12.293 -0.363 76 HD23 LEU 9 HD23 LEU 9 2.355 13.981 0.057 77 H ARG 10 HN ARG 10 3.380 8.026 3.082 78 HA ARG 10 HA ARG 10 5.637 7.465 1.223 79 HB2 ARG 10 HB2 ARG 10 5.452 7.133 4.156 80 HB3 ARG 10 HB1 ARG 10 6.059 5.713 3.304 81 HG2 ARG 10 HG2 ARG 10 7.171 8.528 3.206 82 HG3 ARG 10 HG1 ARG 10 7.966 7.083 3.833 83 HD2 ARG 10 HD2 ARG 10 7.583 6.152 1.393 84 HD3 ARG 10 HD1 ARG 10 7.466 7.873 0.974 85 HE ARG 10 HE ARG 10 9.790 8.007 1.338 86 HH11 ARG 10 HH11 ARG 10 10.145 5.053 1.221 87 HH12 ARG 10 HH12 ARG 10 10.875 4.703 2.752 88 HH21 ARG 10 HH21 ARG 10 9.982 7.739 4.168 89 HH22 ARG 10 HH22 ARG 10 10.784 6.224 4.418 90 H VAL 11 HN VAL 11 5.538 5.346 0.290 91 HA VAL 11 HA VAL 11 3.225 3.639 1.038 92 HB VAL 11 HB VAL 11 2.140 5.019 -0.512 93 HG11 VAL 11 HG11 VAL 11 3.754 5.197 -2.811 94 HG12 VAL 11 HG12 VAL 11 4.841 5.489 -1.453 95 HG13 VAL 11 HG13 VAL 11 3.401 6.486 -1.662 96 HG21 VAL 11 HG21 VAL 11 1.492 3.468 -2.032 97 HG22 VAL 11 HG22 VAL 11 2.679 2.415 -1.263 98 HG23 VAL 11 HG23 VAL 11 3.114 3.329 -2.708 99 H LEU 12 HN LEU 12 4.352 1.749 1.391 100 HA LEU 12 HA LEU 12 6.530 0.956 -0.461 101 HB2 LEU 12 HB2 LEU 12 5.364 -0.373 2.016 102 HB3 LEU 12 HB1 LEU 12 6.878 -0.798 1.221 103 HG LEU 12 HG LEU 12 7.573 0.556 3.021 104 HD11 LEU 12 HD11 LEU 12 8.347 2.651 2.010 105 HD12 LEU 12 HD12 LEU 12 7.187 2.454 0.696 106 HD13 LEU 12 HD13 LEU 12 8.521 1.314 0.873 107 HD21 LEU 12 HD21 LEU 12 5.585 2.715 2.371 108 HD22 LEU 12 HD22 LEU 12 6.445 2.411 3.873 109 HD23 LEU 12 HD23 LEU 12 5.122 1.352 3.390 110 H VAL 13 HN VAL 13 5.469 0.301 -2.381 111 HA VAL 13 HA VAL 13 3.197 -1.620 -2.142 112 HB VAL 13 HB VAL 13 4.262 -0.459 -4.706 113 HG11 VAL 13 HG11 VAL 13 2.176 -2.089 -4.184 114 HG12 VAL 13 HG12 VAL 13 2.169 -0.925 -5.509 115 HG13 VAL 13 HG13 VAL 13 1.380 -0.528 -3.982 116 HG21 VAL 13 HG21 VAL 13 2.689 1.021 -2.578 117 HG22 VAL 13 HG22 VAL 13 2.731 1.529 -4.266 118 HG23 VAL 13 HG23 VAL 13 4.216 1.504 -3.316 119 H VAL 14 HN VAL 14 3.569 -3.803 -2.635 120 HA VAL 14 HA VAL 14 5.958 -4.420 -4.273 121 HB VAL 14 HB VAL 14 7.049 -5.558 -2.565 122 HG11 VAL 14 HG11 VAL 14 7.008 -4.148 -0.546 123 HG12 VAL 14 HG12 VAL 14 5.522 -3.395 -1.121 124 HG13 VAL 14 HG13 VAL 14 7.023 -3.182 -2.021 125 HG21 VAL 14 HG21 VAL 14 5.945 -6.345 -0.492 126 HG22 VAL 14 HG22 VAL 14 5.191 -7.029 -1.933 127 HG23 VAL 14 HG23 VAL 14 4.420 -5.690 -1.085 128 H GLU 15 HN GLU 15 5.763 -6.242 -5.451 129 HA GLU 15 HA GLU 15 3.893 -8.390 -4.801 130 HB2 GLU 15 HB2 GLU 15 2.389 -8.042 -6.603 131 HB3 GLU 15 HB1 GLU 15 2.619 -6.432 -5.918 132 HG2 GLU 15 HG2 GLU 15 3.390 -5.686 -7.881 133 HG3 GLU 15 HG1 GLU 15 4.661 -6.900 -7.887 134 H ASP 16 HN ASP 16 4.183 -10.196 -6.418 135 HA ASP 16 HA ASP 16 6.925 -10.682 -6.952 136 HB2 ASP 16 HB2 ASP 16 5.994 -12.629 -8.186 137 HB3 ASP 16 HB1 ASP 16 5.285 -12.394 -6.588 138 H GLU 17 HN GLU 17 5.174 -8.452 -8.724 139 HA GLU 17 HA GLU 17 6.795 -9.095 -11.162 140 HB2 GLU 17 HB2 GLU 17 3.903 -8.357 -10.810 141 HB3 GLU 17 HB1 GLU 17 4.727 -7.985 -12.323 142 HG2 GLU 17 HG2 GLU 17 4.591 -10.131 -12.986 143 HG3 GLU 17 HG1 GLU 17 5.355 -10.679 -11.493 144 H SER 18 HN SER 18 6.852 -7.046 -12.646 145 HA SER 18 HA SER 18 7.687 -4.739 -10.955 146 HB2 SER 18 HB2 SER 18 8.577 -4.061 -13.326 147 HB3 SER 18 HB1 SER 18 9.373 -5.377 -12.468 148 HG SER 18 HG SER 18 8.905 -6.006 -14.580 149 H MET 19 HN MET 19 5.026 -5.754 -12.815 150 HA MET 19 HA MET 19 4.161 -3.391 -14.124 151 HB2 MET 19 HB2 MET 19 1.967 -4.441 -13.984 152 HB3 MET 19 HB1 MET 19 3.167 -5.717 -14.202 153 HG2 MET 19 HG2 MET 19 3.170 -5.608 -11.521 154 HG3 MET 19 HG1 MET 19 1.524 -5.048 -11.810 155 HE1 MET 19 HE1 MET 19 -0.484 -6.752 -12.242 156 HE2 MET 19 HE2 MET 19 -0.244 -7.761 -13.666 157 HE3 MET 19 HE3 MET 19 0.166 -6.048 -13.728 158 H ILE 20 HN ILE 20 4.467 -4.165 -10.783 159 HA ILE 20 HA ILE 20 2.613 -2.108 -9.809 160 HB ILE 20 HB ILE 20 2.906 -4.103 -8.534 161 HG12 ILE 20 HG12 ILE 20 4.411 -1.797 -7.278 162 HG13 ILE 20 HG11 ILE 20 2.679 -2.121 -7.151 163 HG21 ILE 20 HG21 ILE 20 4.966 -5.007 -9.249 164 HG22 ILE 20 HG22 ILE 20 5.246 -4.595 -7.561 165 HG23 ILE 20 HG23 ILE 20 5.848 -3.537 -8.837 166 HD11 ILE 20 HD11 ILE 20 4.976 -3.585 -5.875 167 HD12 ILE 20 HD12 ILE 20 3.459 -4.432 -6.179 168 HD13 ILE 20 HD13 ILE 20 3.481 -3.007 -5.141 169 H ALA 21 HN ALA 21 5.933 -2.388 -10.718 170 HA ALA 21 HA ALA 21 7.086 -0.240 -9.215 171 HB1 ALA 21 HB1 ALA 21 7.733 -1.186 -12.016 172 HB2 ALA 21 HB2 ALA 21 8.151 -2.104 -10.570 173 HB3 ALA 21 HB3 ALA 21 8.852 -0.506 -10.833 174 H MET 22 HN MET 22 6.168 -0.215 -12.701 175 HA MET 22 HA MET 22 6.180 2.612 -13.006 176 HB2 MET 22 HB2 MET 22 6.003 0.938 -14.845 177 HB3 MET 22 HB1 MET 22 4.380 0.518 -14.291 178 HG2 MET 22 HG2 MET 22 4.151 2.082 -16.126 179 HG3 MET 22 HG1 MET 22 3.722 2.926 -14.637 180 HE1 MET 22 HE1 MET 22 5.557 2.360 -17.488 181 HE2 MET 22 HE2 MET 22 7.238 2.827 -17.240 182 HE3 MET 22 HE3 MET 22 6.088 4.003 -17.871 183 H LEU 23 HN LEU 23 4.024 0.464 -11.413 184 HA LEU 23 HA LEU 23 1.657 2.110 -11.226 185 HB2 LEU 23 HB2 LEU 23 2.699 -0.427 -10.478 186 HB3 LEU 23 HB1 LEU 23 2.113 0.334 -9.004 187 HG LEU 23 HG LEU 23 0.494 0.089 -11.552 188 HD11 LEU 23 HD11 LEU 23 -0.723 -1.637 -10.031 189 HD12 LEU 23 HD12 LEU 23 0.783 -1.663 -9.116 190 HD13 LEU 23 HD13 LEU 23 0.776 -2.133 -10.815 191 HD21 LEU 23 HD21 LEU 23 -1.221 1.095 -10.389 192 HD22 LEU 23 HD22 LEU 23 0.125 1.835 -9.521 193 HD23 LEU 23 HD23 LEU 23 -0.698 0.430 -8.842 194 H ILE 24 HN ILE 24 4.782 2.242 -9.823 195 HA ILE 24 HA ILE 24 3.965 3.537 -7.310 196 HB ILE 24 HB ILE 24 5.960 1.896 -7.965 197 HG12 ILE 24 HG12 ILE 24 7.187 3.645 -6.126 198 HG13 ILE 24 HG11 ILE 24 5.446 3.822 -5.879 199 HG21 ILE 24 HG21 ILE 24 8.064 3.067 -8.306 200 HG22 ILE 24 HG22 ILE 24 7.239 4.625 -8.282 201 HG23 ILE 24 HG23 ILE 24 6.955 3.497 -9.605 202 HD11 ILE 24 HD11 ILE 24 5.297 1.781 -4.947 203 HD12 ILE 24 HD12 ILE 24 7.060 1.730 -4.947 204 HD13 ILE 24 HD13 ILE 24 6.157 1.043 -6.298 205 H GLU 25 HN GLU 25 5.565 4.422 -10.357 206 HA GLU 25 HA GLU 25 6.070 7.168 -9.590 207 HB2 GLU 25 HB2 GLU 25 5.877 5.665 -12.209 208 HB3 GLU 25 HB1 GLU 25 6.347 7.365 -12.120 209 HG2 GLU 25 HG2 GLU 25 7.794 5.743 -10.174 210 HG3 GLU 25 HG1 GLU 25 8.054 5.175 -11.829 211 H ASP 26 HN ASP 26 3.298 5.457 -10.839 212 HA ASP 26 HA ASP 26 1.896 7.864 -11.735 213 HB2 ASP 26 HB2 ASP 26 0.334 6.318 -12.500 214 HB3 ASP 26 HB1 ASP 26 1.746 5.272 -12.384 215 H THR 27 HN THR 27 1.752 5.676 -8.915 216 HA THR 27 HA THR 27 -0.375 7.018 -7.556 217 HB THR 27 HB THR 27 0.369 4.762 -6.993 218 HG1 THR 27 HG1 THR 27 -0.490 5.998 -5.302 219 HG21 THR 27 HG21 THR 27 2.745 5.001 -7.534 220 HG22 THR 27 HG22 THR 27 2.557 4.395 -5.891 221 HG23 THR 27 HG23 THR 27 2.965 6.088 -6.163 222 H LEU 28 HN LEU 28 3.167 7.394 -7.415 223 HA LEU 28 HA LEU 28 3.247 9.433 -5.392 224 HB2 LEU 28 HB2 LEU 28 5.330 8.552 -5.792 225 HB3 LEU 28 HB1 LEU 28 4.960 8.181 -7.468 226 HG LEU 28 HG LEU 28 5.094 10.906 -7.594 227 HD11 LEU 28 HD11 LEU 28 6.336 11.837 -5.949 228 HD12 LEU 28 HD12 LEU 28 7.489 10.503 -5.966 229 HD13 LEU 28 HD13 LEU 28 6.003 10.371 -5.026 230 HD21 LEU 28 HD21 LEU 28 7.471 9.033 -7.690 231 HD22 LEU 28 HD22 LEU 28 7.303 10.563 -8.551 232 HD23 LEU 28 HD23 LEU 28 6.280 9.191 -8.979 233 H CYS 29 HN CYS 29 2.494 9.438 -8.824 234 HA CYS 29 HA CYS 29 2.799 12.220 -9.401 235 HB2 CYS 29 HB2 CYS 29 2.322 10.238 -10.954 236 HB3 CYS 29 HB1 CYS 29 0.643 10.349 -10.427 237 HG CYS 29 HG CYS 29 0.391 12.119 -12.133 238 H GLU 30 HN GLU 30 0.245 10.363 -7.817 239 HA GLU 30 HA GLU 30 -1.490 12.725 -7.549 240 HB2 GLU 30 HB2 GLU 30 -2.571 10.660 -8.083 241 HB3 GLU 30 HB1 GLU 30 -1.665 9.789 -6.843 242 HG2 GLU 30 HG2 GLU 30 -3.102 10.406 -5.203 243 HG3 GLU 30 HG1 GLU 30 -3.183 12.070 -5.786 244 H LEU 31 HN LEU 31 -0.105 10.283 -5.299 245 HA LEU 31 HA LEU 31 -0.562 11.801 -2.908 246 HB2 LEU 31 HB2 LEU 31 1.396 9.633 -3.712 247 HB3 LEU 31 HB1 LEU 31 1.335 10.278 -2.072 248 HG LEU 31 HG LEU 31 -1.330 9.611 -2.983 249 HD11 LEU 31 HD11 LEU 31 0.481 7.218 -2.745 250 HD12 LEU 31 HD12 LEU 31 0.251 7.990 -4.313 251 HD13 LEU 31 HD13 LEU 31 -1.133 7.318 -3.450 252 HD21 LEU 31 HD21 LEU 31 -0.580 7.894 -0.924 253 HD22 LEU 31 HD22 LEU 31 -1.290 9.495 -0.712 254 HD23 LEU 31 HD23 LEU 31 0.462 9.296 -0.682 255 H GLY 32 HN GLY 32 2.136 11.655 -5.200 256 HA2 GLY 32 HA2 GLY 32 3.985 13.077 -5.467 257 HA3 GLY 32 HA1 GLY 32 3.123 14.261 -4.472 258 H HIS 33 HN HIS 33 3.370 11.163 -3.066 259 HA HIS 33 HA HIS 33 4.735 12.043 -0.767 260 HB2 HIS 33 HB2 HIS 33 5.193 9.454 -0.601 261 HB3 HIS 33 HB1 HIS 33 3.542 10.065 -0.497 262 HD1 HIS 33 HD1 HIS 33 2.063 8.565 -1.804 263 HD2 HIS 33 HD2 HIS 33 5.762 9.060 -3.638 264 HE1 HIS 33 HE1 HIS 33 1.987 7.179 -3.922 265 H GLU 34 HN GLU 34 6.853 10.206 -0.348 266 HA GLU 34 HA GLU 34 8.982 11.618 -1.804 267 HB2 GLU 34 HB2 GLU 34 8.695 9.756 0.521 268 HB3 GLU 34 HB1 GLU 34 10.285 9.922 -0.224 269 HG2 GLU 34 HG2 GLU 34 8.710 12.390 0.432 270 HG3 GLU 34 HG1 GLU 34 9.582 11.554 1.718 271 H VAL 35 HN VAL 35 9.566 8.301 -0.989 272 HA VAL 35 HA VAL 35 9.491 7.545 -3.887 273 HB VAL 35 HB VAL 35 11.671 6.288 -3.253 274 HG11 VAL 35 HG11 VAL 35 11.652 8.261 -4.705 275 HG12 VAL 35 HG12 VAL 35 13.027 8.341 -3.605 276 HG13 VAL 35 HG13 VAL 35 11.593 9.320 -3.297 277 HG21 VAL 35 HG21 VAL 35 12.144 8.372 -1.202 278 HG22 VAL 35 HG22 VAL 35 12.669 6.689 -1.237 279 HG23 VAL 35 HG23 VAL 35 11.030 7.091 -0.725 280 H ALA 36 HN ALA 36 8.219 5.732 -4.100 281 HA ALA 36 HA ALA 36 7.592 4.155 -1.696 282 HB1 ALA 36 HB1 ALA 36 6.097 3.077 -3.633 283 HB2 ALA 36 HB2 ALA 36 6.487 4.603 -4.426 284 HB3 ALA 36 HB3 ALA 36 5.662 4.602 -2.868 285 H ALA 37 HN ALA 37 7.156 1.661 -2.576 286 HA ALA 37 HA ALA 37 9.805 0.746 -3.658 287 HB1 ALA 37 HB1 ALA 37 8.059 -0.853 -1.800 288 HB2 ALA 37 HB2 ALA 37 9.057 0.448 -1.149 289 HB3 ALA 37 HB3 ALA 37 9.812 -0.906 -1.991 290 H THR 38 HN THR 38 9.700 -1.139 -5.024 291 HA THR 38 HA THR 38 6.963 -1.803 -6.033 292 HB THR 38 HB THR 38 8.296 -0.343 -7.540 293 HG1 THR 38 HG1 THR 38 6.870 -2.052 -8.309 294 HG21 THR 38 HG21 THR 38 10.394 -0.995 -8.401 295 HG22 THR 38 HG22 THR 38 10.181 -2.670 -7.889 296 HG23 THR 38 HG23 THR 38 10.499 -1.414 -6.692 297 H ALA 39 HN ALA 39 6.911 -3.888 -7.222 298 HA ALA 39 HA ALA 39 7.061 -6.219 -7.148 299 HB1 ALA 39 HB1 ALA 39 9.963 -5.450 -6.797 300 HB2 ALA 39 HB2 ALA 39 9.128 -5.720 -8.328 301 HB3 ALA 39 HB3 ALA 39 9.397 -7.065 -7.218 302 H SER 40 HN SER 40 7.477 -8.047 -5.687 303 HA SER 40 HA SER 40 7.050 -7.302 -2.913 304 HB2 SER 40 HB2 SER 40 6.662 -9.631 -2.647 305 HB3 SER 40 HB1 SER 40 6.070 -9.230 -4.251 306 HG SER 40 HG SER 40 7.704 -10.290 -5.132 307 H ARG 41 HN ARG 41 8.500 -7.475 -1.195 308 HA ARG 41 HA ARG 41 11.143 -8.687 -1.594 309 HB2 ARG 41 HB2 ARG 41 10.880 -6.170 -2.429 310 HB3 ARG 41 HB1 ARG 41 11.091 -5.830 -0.708 311 HG2 ARG 41 HG2 ARG 41 13.306 -5.851 -1.357 312 HG3 ARG 41 HG1 ARG 41 13.102 -7.563 -0.988 313 HD2 ARG 41 HD2 ARG 41 13.219 -8.184 -3.196 314 HD3 ARG 41 HD1 ARG 41 12.369 -6.727 -3.751 315 HE ARG 41 HE ARG 41 14.819 -5.847 -2.676 316 HH11 ARG 41 HH11 ARG 41 13.904 -5.388 -5.521 317 HH12 ARG 41 HH12 ARG 41 15.153 -6.182 -6.421 318 HH21 ARG 41 HH21 ARG 41 16.346 -7.965 -3.696 319 HH22 ARG 41 HH22 ARG 41 16.536 -7.639 -5.387 320 H MET 42 HN MET 42 11.426 -9.805 0.297 321 HA MET 42 HA MET 42 9.925 -9.410 2.680 322 HB2 MET 42 HB2 MET 42 12.614 -10.707 2.140 323 HB3 MET 42 HB1 MET 42 11.679 -10.941 3.618 324 HG2 MET 42 HG2 MET 42 9.842 -11.920 2.367 325 HG3 MET 42 HG1 MET 42 10.636 -11.549 0.837 326 HE1 MET 42 HE1 MET 42 12.544 -12.156 0.084 327 HE2 MET 42 HE2 MET 42 12.839 -13.884 -0.094 328 HE3 MET 42 HE3 MET 42 13.841 -12.935 1.000 329 H GLN 43 HN GLN 43 13.025 -8.080 1.616 330 HA GLN 43 HA GLN 43 13.888 -7.001 4.136 331 HB2 GLN 43 HB2 GLN 43 14.398 -6.082 1.287 332 HB3 GLN 43 HB1 GLN 43 15.402 -5.709 2.689 333 HG2 GLN 43 HG2 GLN 43 14.902 -8.442 1.480 334 HG3 GLN 43 HG1 GLN 43 16.431 -7.564 1.521 335 HE21 GLN 43 HE21 GLN 43 16.115 -6.615 4.300 336 HE22 GLN 43 HE22 GLN 43 16.310 -7.972 5.301 337 H GLU 44 HN GLU 44 12.702 -5.127 1.316 338 HA GLU 44 HA GLU 44 12.097 -2.779 2.800 339 HB2 GLU 44 HB2 GLU 44 11.279 -3.965 0.159 340 HB3 GLU 44 HB1 GLU 44 10.568 -2.444 0.700 341 HG2 GLU 44 HG2 GLU 44 12.810 -1.468 0.965 342 HG3 GLU 44 HG1 GLU 44 13.540 -2.993 0.461 343 H ALA 45 HN ALA 45 10.014 -5.537 1.854 344 HA ALA 45 HA ALA 45 7.503 -4.661 2.688 345 HB1 ALA 45 HB1 ALA 45 8.945 -7.308 2.990 346 HB2 ALA 45 HB2 ALA 45 7.791 -6.844 1.739 347 HB3 ALA 45 HB3 ALA 45 7.238 -7.125 3.390 348 H LEU 46 HN LEU 46 9.849 -6.364 4.793 349 HA LEU 46 HA LEU 46 8.616 -6.091 7.278 350 HB2 LEU 46 HB2 LEU 46 10.650 -7.294 7.084 351 HB3 LEU 46 HB1 LEU 46 11.473 -5.948 6.307 352 HG LEU 46 HG LEU 46 10.421 -5.402 9.023 353 HD11 LEU 46 HD11 LEU 46 12.756 -7.273 8.517 354 HD12 LEU 46 HD12 LEU 46 11.260 -7.671 9.363 355 HD13 LEU 46 HD13 LEU 46 12.395 -6.522 10.071 356 HD21 LEU 46 HD21 LEU 46 11.741 -3.766 7.729 357 HD22 LEU 46 HD22 LEU 46 13.069 -4.921 7.618 358 HD23 LEU 46 HD23 LEU 46 12.611 -4.251 9.184 359 H ASP 47 HN ASP 47 10.618 -3.725 5.548 360 HA ASP 47 HA ASP 47 10.623 -1.664 7.512 361 HB2 ASP 47 HB2 ASP 47 11.294 -2.090 4.716 362 HB3 ASP 47 HB1 ASP 47 10.623 -0.476 4.962 363 H ILE 48 HN ILE 48 8.150 -2.661 5.209 364 HA ILE 48 HA ILE 48 6.570 -0.225 5.564 365 HB ILE 48 HB ILE 48 5.329 -1.001 3.800 366 HG12 ILE 48 HG12 ILE 48 5.600 -3.751 5.029 367 HG13 ILE 48 HG11 ILE 48 4.142 -2.773 4.862 368 HG21 ILE 48 HG21 ILE 48 7.577 -2.993 3.539 369 HG22 ILE 48 HG22 ILE 48 7.752 -1.273 3.192 370 HG23 ILE 48 HG23 ILE 48 6.634 -2.260 2.249 371 HD11 ILE 48 HD11 ILE 48 3.804 -4.100 3.023 372 HD12 ILE 48 HD12 ILE 48 5.519 -4.472 2.848 373 HD13 ILE 48 HD13 ILE 48 4.886 -2.934 2.260 374 H ALA 49 HN ALA 49 6.804 -3.405 7.013 375 HA ALA 49 HA ALA 49 4.218 -3.065 8.384 376 HB1 ALA 49 HB1 ALA 49 4.743 -5.248 7.509 377 HB2 ALA 49 HB2 ALA 49 4.872 -5.357 9.265 378 HB3 ALA 49 HB3 ALA 49 6.329 -5.229 8.280 379 H ARG 50 HN ARG 50 7.592 -3.754 9.364 380 HA ARG 50 HA ARG 50 7.306 -3.344 12.137 381 HB2 ARG 50 HB2 ARG 50 9.360 -3.642 10.138 382 HB3 ARG 50 HB1 ARG 50 9.857 -2.416 11.309 383 HG2 ARG 50 HG2 ARG 50 10.601 -4.423 12.288 384 HG3 ARG 50 HG1 ARG 50 9.061 -4.127 13.098 385 HD2 ARG 50 HD2 ARG 50 8.407 -5.554 10.747 386 HD3 ARG 50 HD1 ARG 50 9.814 -6.382 11.446 387 HE ARG 50 HE ARG 50 8.200 -5.809 13.637 388 HH11 ARG 50 HH21 ARG 50 8.742 -8.347 11.643 389 HH12 ARG 50 HH22 ARG 50 7.173 -9.070 11.778 390 HH21 ARG 50 HH11 ARG 50 5.766 -6.333 13.384 391 HH22 ARG 50 HH12 ARG 50 5.484 -7.925 12.764 392 H LYS 51 HN LYS 51 7.474 -0.969 9.559 393 HA LYS 51 HA LYS 51 8.392 1.285 11.018 394 HB2 LYS 51 HB2 LYS 51 8.191 1.222 8.596 395 HB3 LYS 51 HB1 LYS 51 6.442 1.017 8.716 396 HG2 LYS 51 HG2 LYS 51 6.273 3.270 8.655 397 HG3 LYS 51 HG1 LYS 51 6.984 3.280 10.264 398 HD2 LYS 51 HD2 LYS 51 9.265 3.154 9.064 399 HD3 LYS 51 HD1 LYS 51 8.379 3.613 7.609 400 HE2 LYS 51 HE2 LYS 51 8.967 5.721 8.420 401 HE3 LYS 51 HE1 LYS 51 7.409 5.501 9.243 402 HZ1 LYS 51 HZ1 LYS 51 8.415 4.908 11.202 403 HZ2 LYS 51 HZ2 LYS 51 9.541 6.040 10.623 404 HZ3 LYS 51 HZ3 LYS 51 9.840 4.376 10.452 405 H GLY 52 HN GLY 52 5.024 0.177 10.466 406 HA2 GLY 52 HA2 GLY 52 3.193 0.442 11.973 407 HA3 GLY 52 HA1 GLY 52 4.223 1.437 13.007 408 H GLN 53 HN GLN 53 5.111 3.357 11.209 409 HA GLN 53 HA GLN 53 2.559 4.670 10.327 410 HB2 GLN 53 HB2 GLN 53 3.724 6.785 11.042 411 HB3 GLN 53 HB1 GLN 53 3.440 5.661 12.371 412 HG2 GLN 53 HG2 GLN 53 5.642 5.528 12.784 413 HG3 GLN 53 HG1 GLN 53 5.953 5.032 11.120 414 HE21 GLN 53 HE21 GLN 53 5.524 7.938 13.178 415 HE22 GLN 53 HE22 GLN 53 6.390 8.981 12.156 416 H PHE 54 HN PHE 54 3.785 3.190 8.456 417 HA PHE 54 HA PHE 54 5.723 4.841 6.936 418 HB2 PHE 54 HB2 PHE 54 5.732 2.803 5.459 419 HB3 PHE 54 HB1 PHE 54 6.152 2.436 7.123 420 HD1 PHE 54 HD2 PHE 54 4.535 1.313 8.607 421 HD2 PHE 54 HD1 PHE 54 3.670 2.055 4.479 422 HE1 PHE 54 HE2 PHE 54 2.623 -0.250 8.736 423 HE2 PHE 54 HE1 PHE 54 1.753 0.495 4.607 424 HZ PHE 54 HZ PHE 54 1.224 -0.665 6.731 425 H ASP 55 HN ASP 55 2.666 5.248 7.380 426 HA ASP 55 HA ASP 55 0.934 6.248 6.201 427 HB2 ASP 55 HB2 ASP 55 2.889 7.526 5.382 428 HB3 ASP 55 HB1 ASP 55 3.030 6.396 4.040 429 H ILE 56 HN ILE 56 2.686 3.989 3.921 430 HA ILE 56 HA ILE 56 0.123 2.548 3.567 431 HB ILE 56 HB ILE 56 1.417 4.257 1.433 432 HG12 ILE 56 HG12 ILE 56 -1.327 4.084 2.718 433 HG13 ILE 56 HG11 ILE 56 -0.210 5.448 2.740 434 HG21 ILE 56 HG21 ILE 56 0.999 2.367 0.159 435 HG22 ILE 56 HG22 ILE 56 -0.586 3.131 0.078 436 HG23 ILE 56 HG23 ILE 56 -0.298 1.816 1.216 437 HD11 ILE 56 HD11 ILE 56 -1.931 4.454 0.487 438 HD12 ILE 56 HD12 ILE 56 -0.454 5.352 0.134 439 HD13 ILE 56 HD13 ILE 56 -1.732 6.099 1.093 440 H ALA 57 HN ALA 57 0.359 0.449 2.584 441 HA ALA 57 HA ALA 57 3.028 -0.346 1.520 442 HB1 ALA 57 HB1 ALA 57 1.789 -1.295 4.108 443 HB2 ALA 57 HB2 ALA 57 3.420 -0.678 3.846 444 HB3 ALA 57 HB3 ALA 57 2.973 -2.273 3.245 445 H ILE 58 HN ILE 58 2.623 -1.848 -0.167 446 HA ILE 58 HA ILE 58 0.015 -3.324 0.005 447 HB ILE 58 HB ILE 58 1.272 -1.766 -2.252 448 HG12 ILE 58 HG12 ILE 58 -1.256 -0.953 -2.159 449 HG13 ILE 58 HG11 ILE 58 -1.148 -1.553 -0.504 450 HG21 ILE 58 HG21 ILE 58 0.507 -3.696 -3.374 451 HG22 ILE 58 HG22 ILE 58 -0.857 -2.583 -3.489 452 HG23 ILE 58 HG23 ILE 58 -0.877 -3.881 -2.296 453 HD11 ILE 58 HD11 ILE 58 0.271 0.736 -1.788 454 HD12 ILE 58 HD12 ILE 58 1.142 -0.176 -0.556 455 HD13 ILE 58 HD13 ILE 58 -0.393 0.593 -0.163 456 H ILE 59 HN ILE 59 0.797 -5.399 0.408 457 HA ILE 59 HA ILE 59 2.846 -6.552 -1.446 458 HB ILE 59 HB ILE 59 1.600 -7.336 1.203 459 HG12 ILE 59 HG12 ILE 59 4.518 -7.409 0.673 460 HG13 ILE 59 HG11 ILE 59 3.775 -5.813 0.626 461 HG21 ILE 59 HG21 ILE 59 2.568 -9.073 -0.905 462 HG22 ILE 59 HG22 ILE 59 1.835 -9.505 0.639 463 HG23 ILE 59 HG23 ILE 59 3.573 -9.223 0.536 464 HD11 ILE 59 HD11 ILE 59 4.339 -6.034 2.890 465 HD12 ILE 59 HD12 ILE 59 3.923 -7.748 2.926 466 HD13 ILE 59 HD13 ILE 59 2.647 -6.533 2.865 467 H ASP 60 HN ASP 60 0.918 -6.093 -3.002 468 HA ASP 60 HA ASP 60 -1.518 -7.534 -2.952 469 HB2 ASP 60 HB2 ASP 60 -1.674 -6.019 -4.621 470 HB3 ASP 60 HB1 ASP 60 0.074 -5.857 -4.697 471 H VAL 61 HN VAL 61 -2.020 -9.052 -4.920 472 HA VAL 61 HA VAL 61 -1.904 -11.181 -5.825 473 HB VAL 61 HB VAL 61 0.346 -9.803 -6.462 474 HG11 VAL 61 HG11 VAL 61 2.322 -11.060 -6.137 475 HG12 VAL 61 HG12 VAL 61 1.433 -12.494 -5.630 476 HG13 VAL 61 HG13 VAL 61 1.550 -11.107 -4.557 477 HG21 VAL 61 HG21 VAL 61 0.500 -12.493 -7.536 478 HG22 VAL 61 HG22 VAL 61 0.031 -10.994 -8.339 479 HG23 VAL 61 HG23 VAL 61 -1.172 -11.935 -7.457 480 H ASN 62 HN ASN 62 -2.841 -11.899 -3.782 481 HA ASN 62 HA ASN 62 -0.963 -13.542 -2.111 482 HB2 ASN 62 HB2 ASN 62 -3.457 -11.949 -1.625 483 HB3 ASN 62 HB1 ASN 62 -3.184 -13.374 -0.622 484 HD21 ASN 62 HD21 ASN 62 -0.967 -10.837 -1.931 485 HD22 ASN 62 HD22 ASN 62 -0.278 -10.459 -0.426 486 H LEU 63 HN LEU 63 -1.559 -14.761 -4.434 487 HA LEU 63 HA LEU 63 -3.685 -16.744 -3.704 488 HB2 LEU 63 HB2 LEU 63 -3.634 -14.780 -5.802 489 HB3 LEU 63 HB1 LEU 63 -3.556 -16.382 -6.535 490 HG LEU 63 HG LEU 63 -5.558 -17.081 -5.352 491 HD11 LEU 63 HD11 LEU 63 -5.483 -16.050 -3.247 492 HD12 LEU 63 HD12 LEU 63 -6.770 -15.152 -4.052 493 HD13 LEU 63 HD13 LEU 63 -5.153 -14.459 -3.932 494 HD21 LEU 63 HD21 LEU 63 -6.255 -16.068 -7.331 495 HD22 LEU 63 HD22 LEU 63 -5.607 -14.493 -6.871 496 HD23 LEU 63 HD23 LEU 63 -7.105 -15.075 -6.147 497 H ASP 64 HN ASP 64 -3.380 -18.817 -4.941 498 HA ASP 64 HA ASP 64 -1.996 -20.614 -5.609 499 HB2 ASP 64 HB2 ASP 64 -1.645 -18.406 -7.279 500 HB3 ASP 64 HB1 ASP 64 0.004 -18.900 -6.883 501 H GLY 65 HN GLY 65 -1.297 -18.877 -3.115 502 HA2 GLY 65 HA2 GLY 65 0.645 -20.266 -1.875 503 HA3 GLY 65 HA1 GLY 65 1.623 -19.288 -2.964 504 H GLU 66 HN GLU 66 -0.782 -17.248 -2.484 505 HA GLU 66 HA GLU 66 -0.855 -15.250 -1.254 506 HB2 GLU 66 HB2 GLU 66 -1.852 -15.798 0.732 507 HB3 GLU 66 HB1 GLU 66 -1.683 -17.444 0.141 508 HG2 GLU 66 HG2 GLU 66 0.677 -17.315 1.305 509 HG3 GLU 66 HG1 GLU 66 -0.064 -16.000 2.213 510 HA PRO 67 HA PRO 67 3.807 -15.447 -0.600 511 HB2 PRO 67 HB2 PRO 67 4.459 -13.826 -2.714 512 HB3 PRO 67 HB1 PRO 67 4.354 -15.594 -2.838 513 HG2 PRO 67 HG2 PRO 67 2.351 -13.523 -3.617 514 HG3 PRO 67 HG1 PRO 67 2.823 -15.006 -4.463 515 HD2 PRO 67 HD2 PRO 67 0.553 -14.835 -3.009 516 HD3 PRO 67 HD1 PRO 67 1.482 -16.346 -3.149 517 H SER 68 HN SER 68 2.176 -14.018 0.999 518 HA SER 68 HA SER 68 2.992 -11.156 0.655 519 HB2 SER 68 HB2 SER 68 0.977 -10.651 1.919 520 HB3 SER 68 HB1 SER 68 0.543 -11.778 0.638 521 HG SER 68 HG SER 68 -0.071 -13.093 2.141 522 H TYR 69 HN TYR 69 4.113 -13.787 2.085 523 HA TYR 69 HA TYR 69 5.287 -14.315 4.040 524 HB2 TYR 69 HB2 TYR 69 6.049 -11.684 4.856 525 HB3 TYR 69 HB1 TYR 69 7.018 -12.864 3.981 526 HD1 TYR 69 HD2 TYR 69 6.279 -13.067 1.365 527 HD2 TYR 69 HD1 TYR 69 5.781 -9.618 3.865 528 HE1 TYR 69 HE2 TYR 69 6.159 -11.625 -0.647 529 HE2 TYR 69 HE1 TYR 69 5.662 -8.175 1.864 530 HH TYR 69 HH TYR 69 5.217 -9.404 -1.260 531 HA PRO 70 HA PRO 70 2.866 -13.616 7.584 532 HB2 PRO 70 HB2 PRO 70 4.696 -13.354 9.603 533 HB3 PRO 70 HB1 PRO 70 4.349 -14.903 8.811 534 HG2 PRO 70 HG2 PRO 70 6.618 -13.020 8.370 535 HG3 PRO 70 HG1 PRO 70 6.616 -14.791 8.420 536 HD2 PRO 70 HD2 PRO 70 6.675 -13.375 6.100 537 HD3 PRO 70 HD1 PRO 70 5.934 -14.985 6.235 538 H VAL 71 HN VAL 71 5.096 -11.266 6.506 539 HA VAL 71 HA VAL 71 4.632 -9.195 8.467 540 HB VAL 71 HB VAL 71 5.382 -9.022 5.548 541 HG11 VAL 71 HG11 VAL 71 5.582 -7.174 7.897 542 HG12 VAL 71 HG12 VAL 71 5.079 -6.819 6.244 543 HG13 VAL 71 HG13 VAL 71 6.785 -7.074 6.611 544 HG21 VAL 71 HG21 VAL 71 6.693 -10.604 7.232 545 HG22 VAL 71 HG22 VAL 71 7.408 -9.073 7.738 546 HG23 VAL 71 HG23 VAL 71 7.557 -9.606 6.063 547 H ALA 72 HN ALA 72 3.607 -9.289 5.061 548 HA ALA 72 HA ALA 72 1.607 -7.316 5.170 549 HB1 ALA 72 HB1 ALA 72 1.027 -9.602 3.439 550 HB2 ALA 72 HB2 ALA 72 2.716 -9.101 3.360 551 HB3 ALA 72 HB3 ALA 72 1.433 -7.945 2.997 552 H ASP 73 HN ASP 73 1.146 -10.872 5.325 553 HA ASP 73 HA ASP 73 -1.605 -10.926 5.760 554 HB2 ASP 73 HB2 ASP 73 0.746 -12.578 6.485 555 HB3 ASP 73 HB1 ASP 73 -0.761 -12.974 7.300 556 H ILE 74 HN ILE 74 0.926 -10.886 8.278 557 HA ILE 74 HA ILE 74 -0.790 -10.545 10.523 558 HB ILE 74 HB ILE 74 2.056 -9.740 9.873 559 HG12 ILE 74 HG12 ILE 74 1.048 -11.765 11.879 560 HG13 ILE 74 HG11 ILE 74 1.297 -12.182 10.182 561 HG21 ILE 74 HG21 ILE 74 0.861 -9.683 12.644 562 HG22 ILE 74 HG22 ILE 74 0.911 -8.241 11.632 563 HG23 ILE 74 HG23 ILE 74 2.410 -9.035 12.109 564 HD11 ILE 74 HD11 ILE 74 3.616 -10.799 10.907 565 HD12 ILE 74 HD12 ILE 74 3.462 -12.541 10.690 566 HD13 ILE 74 HD13 ILE 74 3.270 -11.833 12.293 567 H LEU 75 HN LEU 75 0.876 -8.179 8.458 568 HA LEU 75 HA LEU 75 0.070 -5.757 9.617 569 HB2 LEU 75 HB2 LEU 75 1.475 -6.521 7.474 570 HB3 LEU 75 HB1 LEU 75 -0.031 -6.156 6.641 571 HG LEU 75 HG LEU 75 0.049 -3.907 7.938 572 HD11 LEU 75 HD11 LEU 75 1.866 -4.627 9.483 573 HD12 LEU 75 HD12 LEU 75 2.314 -3.188 8.568 574 HD13 LEU 75 HD13 LEU 75 2.960 -4.762 8.106 575 HD21 LEU 75 HD21 LEU 75 1.625 -4.820 5.582 576 HD22 LEU 75 HD22 LEU 75 2.026 -3.226 6.223 577 HD23 LEU 75 HD23 LEU 75 0.382 -3.573 5.686 578 H ALA 76 HN ALA 76 -1.805 -8.169 7.949 579 HA ALA 76 HA ALA 76 -4.095 -6.463 7.384 580 HB1 ALA 76 HB1 ALA 76 -3.251 -8.534 6.128 581 HB2 ALA 76 HB2 ALA 76 -4.985 -8.467 6.439 582 HB3 ALA 76 HB3 ALA 76 -3.948 -9.480 7.442 583 H GLU 77 HN GLU 77 -3.606 -9.293 9.556 584 HA GLU 77 HA GLU 77 -5.987 -9.359 10.947 585 HB2 GLU 77 HB2 GLU 77 -3.158 -9.511 12.044 586 HB3 GLU 77 HB1 GLU 77 -4.587 -10.133 12.869 587 HG2 GLU 77 HG2 GLU 77 -4.363 -11.048 10.089 588 HG3 GLU 77 HG1 GLU 77 -3.022 -11.574 11.109 589 H ARG 78 HN ARG 78 -3.513 -6.898 11.141 590 HA ARG 78 HA ARG 78 -5.309 -5.200 12.758 591 HB2 ARG 78 HB2 ARG 78 -3.288 -4.652 14.207 592 HB3 ARG 78 HB1 ARG 78 -3.917 -6.286 14.408 593 HG2 ARG 78 HG2 ARG 78 -2.181 -6.861 12.498 594 HG3 ARG 78 HG1 ARG 78 -1.401 -5.378 13.051 595 HD2 ARG 78 HD2 ARG 78 -0.492 -6.540 14.770 596 HD3 ARG 78 HD1 ARG 78 -2.125 -6.881 15.375 597 HE ARG 78 HE ARG 78 -1.086 -8.541 13.139 598 HH11 ARG 78 HH21 ARG 78 -1.360 -8.217 16.532 599 HH12 ARG 78 HH22 ARG 78 -1.764 -9.879 16.806 600 HH21 ARG 78 HH11 ARG 78 -1.905 -10.668 13.427 601 HH22 ARG 78 HH12 ARG 78 -2.074 -11.270 15.043 602 H ASN 79 HN ASN 79 -5.357 -4.352 10.444 603 HA ASN 79 HA ASN 79 -3.017 -3.204 9.252 604 HB2 ASN 79 HB2 ASN 79 -5.993 -2.985 8.895 605 HB3 ASN 79 HB1 ASN 79 -4.893 -2.032 7.905 606 HD21 ASN 79 HD21 ASN 79 -2.936 -3.558 7.042 607 HD22 ASN 79 HD22 ASN 79 -3.456 -5.027 6.371 608 H VAL 80 HN VAL 80 -2.128 -1.242 9.485 609 HA VAL 80 HA VAL 80 -3.299 0.683 11.440 610 HB VAL 80 HB VAL 80 -0.868 -0.511 11.102 611 HG11 VAL 80 HG11 VAL 80 0.671 1.390 10.344 612 HG12 VAL 80 HG12 VAL 80 -0.750 2.085 9.578 613 HG13 VAL 80 HG13 VAL 80 -0.183 0.495 9.093 614 HG21 VAL 80 HG21 VAL 80 -1.942 1.703 12.617 615 HG22 VAL 80 HG22 VAL 80 -0.231 1.959 12.274 616 HG23 VAL 80 HG23 VAL 80 -0.754 0.491 13.099 617 HA PRO 81 HA PRO 81 -4.145 3.667 8.252 618 HB2 PRO 81 HB2 PRO 81 -2.256 5.674 8.205 619 HB3 PRO 81 HB1 PRO 81 -3.567 5.589 9.401 620 HG2 PRO 81 HG2 PRO 81 -0.724 4.710 9.652 621 HG3 PRO 81 HG1 PRO 81 -1.732 5.600 10.809 622 HD2 PRO 81 HD2 PRO 81 -1.291 2.989 11.088 623 HD3 PRO 81 HD1 PRO 81 -2.875 3.685 11.489 624 H PHE 82 HN PHE 82 -3.900 3.024 6.139 625 HA PHE 82 HA PHE 82 -1.402 3.110 4.700 626 HB2 PHE 82 HB2 PHE 82 -0.732 0.845 4.826 627 HB3 PHE 82 HB1 PHE 82 -1.157 1.258 6.487 628 HD1 PHE 82 HD1 PHE 82 -4.166 1.245 6.264 629 HD2 PHE 82 HD2 PHE 82 -1.227 -1.480 4.717 630 HE1 PHE 82 HE1 PHE 82 -5.842 -0.569 6.323 631 HE2 PHE 82 HE2 PHE 82 -2.915 -3.306 4.781 632 HZ PHE 82 HZ PHE 82 -5.217 -2.848 5.567 633 H ILE 83 HN ILE 83 -1.816 0.758 3.213 634 HA ILE 83 HA ILE 83 -4.509 0.759 2.058 635 HB ILE 83 HB ILE 83 -2.106 2.067 0.913 636 HG12 ILE 83 HG12 ILE 83 -3.900 3.476 1.773 637 HG13 ILE 83 HG11 ILE 83 -3.830 3.636 0.020 638 HG21 ILE 83 HG21 ILE 83 -2.357 0.539 -0.844 639 HG22 ILE 83 HG22 ILE 83 -3.415 1.849 -1.369 640 HG23 ILE 83 HG23 ILE 83 -4.100 0.415 -0.604 641 HD11 ILE 83 HD11 ILE 83 -5.565 1.678 0.029 642 HD12 ILE 83 HD12 ILE 83 -6.116 3.314 0.387 643 HD13 ILE 83 HD13 ILE 83 -5.843 2.168 1.699 644 H PHE 84 HN PHE 84 -4.737 -1.154 0.743 645 HA PHE 84 HA PHE 84 -2.365 -2.832 0.202 646 HB2 PHE 84 HB2 PHE 84 -3.423 -3.040 2.634 647 HB3 PHE 84 HB1 PHE 84 -4.595 -4.048 1.792 648 HD1 PHE 84 HD1 PHE 84 -1.039 -3.688 2.749 649 HD2 PHE 84 HD2 PHE 84 -3.957 -6.197 0.833 650 HE1 PHE 84 HE1 PHE 84 0.547 -5.601 2.821 651 HE2 PHE 84 HE2 PHE 84 -2.363 -8.103 0.910 652 HZ PHE 84 HZ PHE 84 -0.117 -7.798 1.889 653 H ALA 85 HN ALA 85 -3.124 -4.898 -0.957 654 HA ALA 85 HA ALA 85 -5.808 -5.043 -1.998 655 HB1 ALA 85 HB1 ALA 85 -3.653 -3.607 -3.537 656 HB2 ALA 85 HB2 ALA 85 -5.308 -3.089 -3.223 657 HB3 ALA 85 HB3 ALA 85 -4.993 -4.383 -4.378 658 H THR 86 HN THR 86 -5.988 -7.232 -2.378 659 HA THR 86 HA THR 86 -3.708 -8.616 -3.746 660 HB THR 86 HB THR 86 -3.440 -10.124 -2.027 661 HG1 THR 86 HG1 THR 86 -6.082 -9.692 -1.131 662 HG21 THR 86 HG21 THR 86 -3.769 -9.089 0.192 663 HG22 THR 86 HG22 THR 86 -4.811 -7.866 -0.535 664 HG23 THR 86 HG23 THR 86 -3.100 -7.930 -0.958 665 H GLY 87 HN GLY 87 -5.004 -11.206 -3.385 666 HA2 GLY 87 HA2 GLY 87 -6.660 -11.276 -5.694 667 HA3 GLY 87 HA1 GLY 87 -6.555 -12.566 -4.495 668 H TYR 88 HN TYR 88 -7.685 -11.742 -2.287 669 HA TYR 88 HA TYR 88 -10.484 -11.555 -2.893 670 HB2 TYR 88 HB2 TYR 88 -10.669 -11.341 -0.406 671 HB3 TYR 88 HB1 TYR 88 -9.627 -12.668 -0.902 672 HD1 TYR 88 HD1 TYR 88 -9.742 -9.298 0.589 673 HD2 TYR 88 HD2 TYR 88 -7.213 -12.575 -0.557 674 HE1 TYR 88 HE1 TYR 88 -7.887 -8.343 1.930 675 HE2 TYR 88 HE2 TYR 88 -5.359 -11.611 0.778 676 HH TYR 88 HH TYR 88 -4.981 -8.777 1.618 677 H GLY 89 HN GLY 89 -8.036 -9.112 -2.220 678 HA2 GLY 89 HA2 GLY 89 -8.212 -6.781 -2.563 679 HA3 GLY 89 HA1 GLY 89 -9.899 -7.014 -3.025 680 H SER 90 HN SER 90 -7.820 -7.216 -0.127 681 HA SER 90 HA SER 90 -8.247 -6.533 2.092 682 HB2 SER 90 HB2 SER 90 -9.861 -4.751 0.312 683 HB3 SER 90 HB1 SER 90 -10.139 -4.658 2.048 684 HG SER 90 HG SER 90 -7.602 -4.481 0.780 685 H LYS 91 HN LYS 91 -9.655 -7.024 3.801 686 HA LYS 91 HA LYS 91 -12.178 -8.420 3.075 687 HB2 LYS 91 HB2 LYS 91 -11.555 -9.609 5.375 688 HB3 LYS 91 HB1 LYS 91 -10.832 -10.147 3.865 689 HG2 LYS 91 HG2 LYS 91 -8.753 -9.348 4.418 690 HG3 LYS 91 HG1 LYS 91 -9.398 -7.957 5.285 691 HD2 LYS 91 HD2 LYS 91 -10.264 -9.831 6.959 692 HD3 LYS 91 HD1 LYS 91 -8.921 -10.739 6.264 693 HE2 LYS 91 HE2 LYS 91 -7.820 -9.650 8.017 694 HE3 LYS 91 HE1 LYS 91 -7.608 -8.446 6.731 695 HZ1 LYS 91 HZ1 LYS 91 -10.168 -8.217 7.963 696 HZ2 LYS 91 HZ2 LYS 91 -8.960 -7.037 7.770 697 HZ3 LYS 91 HZ3 LYS 91 -8.934 -8.073 9.117 698 H GLY 92 HN GLY 92 -10.898 -7.582 6.247 699 HA2 GLY 92 HA2 GLY 92 -13.033 -5.524 6.559 700 HA3 GLY 92 HA1 GLY 92 -12.758 -6.739 7.815 701 H LEU 93 HN LEU 93 -9.985 -5.755 6.086 702 HA LEU 93 HA LEU 93 -8.335 -5.060 8.135 703 HB2 LEU 93 HB2 LEU 93 -7.043 -3.873 6.496 704 HB3 LEU 93 HB1 LEU 93 -7.872 -5.178 5.659 705 HG LEU 93 HG LEU 93 -8.102 -3.272 4.263 706 HD11 LEU 93 HD11 LEU 93 -10.206 -4.527 4.567 707 HD12 LEU 93 HD12 LEU 93 -10.508 -2.819 4.251 708 HD13 LEU 93 HD13 LEU 93 -10.654 -3.450 5.887 709 HD21 LEU 93 HD21 LEU 93 -8.227 -1.120 4.981 710 HD22 LEU 93 HD22 LEU 93 -7.701 -1.797 6.523 711 HD23 LEU 93 HD23 LEU 93 -9.412 -1.503 6.226 712 H ASP 94 HN ASP 94 -7.767 -3.189 9.273 713 HA ASP 94 HA ASP 94 -9.924 -1.113 9.430 714 HB2 ASP 94 HB2 ASP 94 -8.847 -0.833 11.770 715 HB3 ASP 94 HB1 ASP 94 -9.763 -2.311 11.481 716 H THR 95 HN THR 95 -9.217 1.110 9.631 717 HA THR 95 HA THR 95 -6.489 1.947 9.689 718 HB THR 95 HB THR 95 -6.222 0.765 7.626 719 HG1 THR 95 HG1 THR 95 -5.266 2.624 7.263 720 HG21 THR 95 HG21 THR 95 -7.768 0.931 5.771 721 HG22 THR 95 HG22 THR 95 -8.697 2.174 6.609 722 HG23 THR 95 HG23 THR 95 -8.685 0.520 7.221 723 H ARG 96 HN ARG 96 -6.325 4.219 8.517 724 HA ARG 96 HA ARG 96 -8.617 5.819 9.450 725 HB2 ARG 96 HB2 ARG 96 -5.804 6.258 8.471 726 HB3 ARG 96 HB1 ARG 96 -6.923 7.622 8.502 727 HG2 ARG 96 HG2 ARG 96 -5.934 7.726 10.630 728 HG3 ARG 96 HG1 ARG 96 -7.431 6.849 10.942 729 HD2 ARG 96 HD2 ARG 96 -5.685 4.811 10.249 730 HD3 ARG 96 HD1 ARG 96 -4.657 5.919 11.182 731 HE ARG 96 HE ARG 96 -7.154 5.712 12.527 732 HH11 ARG 96 HH11 ARG 96 -6.536 2.828 11.607 733 HH12 ARG 96 HH12 ARG 96 -5.733 2.216 13.014 734 HH21 ARG 96 HH21 ARG 96 -5.201 5.349 14.403 735 HH22 ARG 96 HH22 ARG 96 -4.980 3.641 14.598 736 H TYR 97 HN TYR 97 -8.171 4.027 6.780 737 HA TYR 97 HA TYR 97 -8.932 6.057 4.759 738 HB2 TYR 97 HB2 TYR 97 -8.255 3.108 4.742 739 HB3 TYR 97 HB1 TYR 97 -8.778 3.966 3.292 740 HD1 TYR 97 HD1 TYR 97 -6.392 4.567 6.146 741 HD2 TYR 97 HD2 TYR 97 -7.078 4.728 1.911 742 HE1 TYR 97 HE1 TYR 97 -4.089 5.409 5.805 743 HE2 TYR 97 HE2 TYR 97 -4.777 5.572 1.570 744 HH TYR 97 HH TYR 97 -2.664 5.625 2.661 745 H SER 98 HN SER 98 -10.532 4.196 7.032 746 HA SER 98 HA SER 98 -12.814 3.821 7.399 747 HB2 SER 98 HB2 SER 98 -12.738 5.608 5.033 748 HB3 SER 98 HB1 SER 98 -14.229 4.701 5.268 749 HG SER 98 HG SER 98 -14.575 5.734 7.108 750 H ASN 99 HN ASN 99 -10.950 2.106 5.592 751 HA ASN 99 HA ASN 99 -11.128 0.007 4.551 752 HB2 ASN 99 HB2 ASN 99 -13.738 0.344 6.017 753 HB3 ASN 99 HB1 ASN 99 -13.286 -1.173 5.239 754 HD21 ASN 99 HD21 ASN 99 -10.504 0.495 6.361 755 HD22 ASN 99 HD22 ASN 99 -10.311 -0.337 7.820 756 H ILE 100 HN ILE 100 -11.210 1.326 2.456 757 HA ILE 100 HA ILE 100 -13.247 0.229 0.735 758 HB ILE 100 HB ILE 100 -13.999 2.479 -0.123 759 HG12 ILE 100 HG12 ILE 100 -12.176 3.756 1.058 760 HG13 ILE 100 HG11 ILE 100 -13.796 4.411 1.250 761 HG21 ILE 100 HG21 ILE 100 -15.209 0.854 1.493 762 HG22 ILE 100 HG22 ILE 100 -15.840 2.488 1.294 763 HG23 ILE 100 HG23 ILE 100 -14.875 2.081 2.713 764 HD11 ILE 100 HD11 ILE 100 -12.041 3.098 3.255 765 HD12 ILE 100 HD12 ILE 100 -13.767 2.771 3.372 766 HD13 ILE 100 HD13 ILE 100 -13.180 4.429 3.453 767 HA PRO 101 HA PRO 101 -10.112 2.459 -1.961 768 HB2 PRO 101 HB2 PRO 101 -7.782 3.399 -0.868 769 HB3 PRO 101 HB1 PRO 101 -9.255 4.371 -1.010 770 HG2 PRO 101 HG2 PRO 101 -8.008 3.231 1.360 771 HG3 PRO 101 HG1 PRO 101 -9.222 4.509 1.230 772 HD2 PRO 101 HD2 PRO 101 -9.588 1.746 1.910 773 HD3 PRO 101 HD1 PRO 101 -10.800 3.039 1.868 774 H LEU 102 HN LEU 102 -10.145 -0.259 -1.255 775 HA LEU 102 HA LEU 102 -7.314 -1.007 -1.867 776 HB2 LEU 102 HB2 LEU 102 -8.982 -2.682 -0.001 777 HB3 LEU 102 HB1 LEU 102 -7.229 -2.563 -0.108 778 HG LEU 102 HG LEU 102 -9.049 -0.357 0.895 779 HD11 LEU 102 HD11 LEU 102 -7.907 -0.935 3.098 780 HD12 LEU 102 HD12 LEU 102 -7.355 -2.418 2.320 781 HD13 LEU 102 HD13 LEU 102 -9.081 -2.116 2.517 782 HD21 LEU 102 HD21 LEU 102 -6.434 -0.255 -0.111 783 HD22 LEU 102 HD22 LEU 102 -6.237 -0.269 1.643 784 HD23 LEU 102 HD23 LEU 102 -7.227 0.972 0.876 785 H LEU 103 HN LEU 103 -7.136 -3.177 -2.863 786 HA LEU 103 HA LEU 103 -9.431 -4.734 -3.610 787 HB2 LEU 103 HB2 LEU 103 -9.794 -3.972 -5.879 788 HB3 LEU 103 HB1 LEU 103 -9.913 -2.586 -4.803 789 HG LEU 103 HG LEU 103 -7.464 -3.346 -6.420 790 HD11 LEU 103 HD11 LEU 103 -9.448 -2.480 -7.704 791 HD12 LEU 103 HD12 LEU 103 -8.035 -1.432 -7.791 792 HD13 LEU 103 HD13 LEU 103 -9.375 -1.016 -6.728 793 HD21 LEU 103 HD21 LEU 103 -8.071 -1.164 -4.426 794 HD22 LEU 103 HD22 LEU 103 -6.891 -0.897 -5.709 795 HD23 LEU 103 HD23 LEU 103 -6.640 -2.189 -4.536 796 H THR 104 HN THR 104 -8.328 -5.261 -6.405 797 HA THR 104 HA THR 104 -5.888 -6.749 -5.533 798 HB THR 104 HB THR 104 -8.076 -7.985 -5.939 799 HG1 THR 104 HG1 THR 104 -6.898 -9.629 -6.545 800 HG21 THR 104 HG21 THR 104 -7.460 -7.595 -8.860 801 HG22 THR 104 HG22 THR 104 -8.527 -6.478 -8.009 802 HG23 THR 104 HG23 THR 104 -8.944 -8.189 -8.115 803 H LYS 105 HN LYS 105 -5.826 -4.095 -6.892 804 HA LYS 105 HA LYS 105 -4.594 -3.112 -8.678 805 HB2 LYS 105 HB2 LYS 105 -3.477 -5.687 -7.962 806 HB3 LYS 105 HB1 LYS 105 -3.230 -5.374 -9.681 807 HG2 LYS 105 HG2 LYS 105 -1.798 -3.653 -9.288 808 HG3 LYS 105 HG1 LYS 105 -2.740 -3.056 -7.920 809 HD2 LYS 105 HD2 LYS 105 -1.044 -3.895 -6.659 810 HD3 LYS 105 HD1 LYS 105 -1.828 -5.448 -6.948 811 HE2 LYS 105 HE2 LYS 105 0.251 -4.306 -8.842 812 HE3 LYS 105 HE1 LYS 105 0.662 -5.396 -7.504 813 HZ1 LYS 105 HZ1 LYS 105 -1.513 -6.046 -9.396 814 HZ2 LYS 105 HZ2 LYS 105 -0.657 -7.090 -8.368 815 HZ3 LYS 105 HZ3 LYS 105 0.094 -6.451 -9.750 816 HA PRO 106 HA PRO 106 -7.322 -5.522 -11.757 817 HB2 PRO 106 HB2 PRO 106 -9.655 -4.100 -11.605 818 HB3 PRO 106 HB1 PRO 106 -9.346 -5.547 -10.623 819 HG2 PRO 106 HG2 PRO 106 -9.174 -2.675 -9.868 820 HG3 PRO 106 HG1 PRO 106 -9.756 -4.059 -8.928 821 HD2 PRO 106 HD2 PRO 106 -7.289 -2.926 -8.594 822 HD3 PRO 106 HD1 PRO 106 -7.654 -4.623 -8.218 823 H PHE 107 HN PHE 107 -6.375 -2.355 -10.971 824 HA PHE 107 HA PHE 107 -5.788 -0.500 -12.285 825 HB2 PHE 107 HB2 PHE 107 -5.836 -2.844 -14.158 826 HB3 PHE 107 HB1 PHE 107 -5.573 -1.228 -14.814 827 HD1 PHE 107 HD1 PHE 107 -4.571 -2.402 -11.438 828 HD2 PHE 107 HD2 PHE 107 -3.255 -1.378 -15.393 829 HE1 PHE 107 HE1 PHE 107 -2.233 -2.457 -10.659 830 HE2 PHE 107 HE2 PHE 107 -0.901 -1.431 -14.614 831 HZ PHE 107 HZ PHE 107 -0.384 -1.962 -12.249 832 H LEU 108 HN LEU 108 -6.646 0.577 -14.577 833 HA LEU 108 HA LEU 108 -8.513 1.726 -15.486 834 HB2 LEU 108 HB2 LEU 108 -10.052 -0.799 -14.875 835 HB3 LEU 108 HB1 LEU 108 -10.157 0.233 -16.301 836 HG LEU 108 HG LEU 108 -7.799 -1.532 -15.570 837 HD11 LEU 108 HD11 LEU 108 -8.693 -2.415 -17.972 838 HD12 LEU 108 HD12 LEU 108 -10.216 -1.889 -17.254 839 HD13 LEU 108 HD13 LEU 108 -9.225 -3.096 -16.434 840 HD21 LEU 108 HD21 LEU 108 -8.317 0.464 -17.768 841 HD22 LEU 108 HD22 LEU 108 -7.229 -0.897 -18.039 842 HD23 LEU 108 HD23 LEU 108 -6.878 0.272 -16.766 843 H ASP 109 HN ASP 109 -8.690 3.174 -13.613 844 HA ASP 109 HA ASP 109 -10.048 4.226 -11.984 845 HB2 ASP 109 HB2 ASP 109 -11.868 1.824 -12.120 846 HB3 ASP 109 HB1 ASP 109 -12.288 3.502 -11.791 847 H SER 110 HN SER 110 -8.196 1.632 -11.654 848 HA SER 110 HA SER 110 -9.018 0.533 -9.076 849 HB2 SER 110 HB2 SER 110 -7.873 -0.800 -10.720 850 HB3 SER 110 HB1 SER 110 -6.569 0.376 -10.839 851 HG SER 110 HG SER 110 -5.672 -0.802 -9.355 852 H GLU 111 HN GLU 111 -5.697 1.489 -9.604 853 HA GLU 111 HA GLU 111 -4.944 2.241 -7.104 854 HB2 GLU 111 HB2 GLU 111 -4.165 2.807 -9.833 855 HB3 GLU 111 HB1 GLU 111 -3.820 4.191 -8.794 856 HG2 GLU 111 HG2 GLU 111 -3.088 1.398 -7.939 857 HG3 GLU 111 HG1 GLU 111 -2.017 2.344 -8.974 858 H LEU 112 HN LEU 112 -6.525 4.467 -9.410 859 HA LEU 112 HA LEU 112 -6.480 6.794 -7.829 860 HB2 LEU 112 HB2 LEU 112 -8.724 7.223 -9.075 861 HB3 LEU 112 HB1 LEU 112 -7.258 7.008 -10.025 862 HG LEU 112 HG LEU 112 -8.376 4.426 -9.568 863 HD11 LEU 112 HD11 LEU 112 -10.439 6.019 -9.209 864 HD12 LEU 112 HD12 LEU 112 -10.608 4.606 -10.248 865 HD13 LEU 112 HD13 LEU 112 -10.364 6.198 -10.961 866 HD21 LEU 112 HD21 LEU 112 -8.053 4.258 -11.858 867 HD22 LEU 112 HD22 LEU 112 -7.034 5.657 -11.524 868 HD23 LEU 112 HD23 LEU 112 -8.660 5.885 -12.166 869 H GLU 113 HN GLU 113 -9.184 4.414 -7.933 870 HA GLU 113 HA GLU 113 -10.827 5.416 -5.938 871 HB2 GLU 113 HB2 GLU 113 -10.314 2.945 -7.253 872 HB3 GLU 113 HB1 GLU 113 -10.432 2.593 -5.524 873 HG2 GLU 113 HG2 GLU 113 -12.601 3.593 -5.373 874 HG3 GLU 113 HG1 GLU 113 -12.464 4.298 -6.983 875 H ALA 114 HN ALA 114 -8.008 3.287 -5.455 876 HA ALA 114 HA ALA 114 -7.989 3.044 -2.687 877 HB1 ALA 114 HB1 ALA 114 -6.275 2.638 -4.892 878 HB2 ALA 114 HB2 ALA 114 -6.040 2.037 -3.251 879 HB3 ALA 114 HB3 ALA 114 -5.337 3.581 -3.734 880 H VAL 115 HN VAL 115 -7.012 5.832 -4.640 881 HA VAL 115 HA VAL 115 -6.305 7.311 -2.135 882 HB VAL 115 HB VAL 115 -5.787 8.450 -4.841 883 HG11 VAL 115 HG11 VAL 115 -5.036 9.091 -2.313 884 HG12 VAL 115 HG12 VAL 115 -4.093 9.518 -3.742 885 HG13 VAL 115 HG13 VAL 115 -3.669 8.089 -2.799 886 HG21 VAL 115 HG21 VAL 115 -4.481 5.924 -3.799 887 HG22 VAL 115 HG22 VAL 115 -3.661 6.999 -4.932 888 HG23 VAL 115 HG23 VAL 115 -5.170 6.212 -5.397 889 H LEU 116 HN LEU 116 -8.743 7.089 -4.567 890 HA LEU 116 HA LEU 116 -9.626 9.894 -4.204 891 HB2 LEU 116 HB2 LEU 116 -9.628 8.022 -6.266 892 HB3 LEU 116 HB1 LEU 116 -11.321 8.116 -5.779 893 HG LEU 116 HG LEU 116 -11.000 9.821 -7.435 894 HD11 LEU 116 HD11 LEU 116 -12.057 10.360 -5.053 895 HD12 LEU 116 HD12 LEU 116 -11.852 11.627 -6.263 896 HD13 LEU 116 HD13 LEU 116 -10.683 11.461 -4.953 897 HD21 LEU 116 HD21 LEU 116 -8.784 11.059 -5.811 898 HD22 LEU 116 HD22 LEU 116 -9.165 11.290 -7.517 899 HD23 LEU 116 HD23 LEU 116 -8.425 9.784 -6.975 900 H VAL 117 HN VAL 117 -11.121 6.640 -3.847 901 HA VAL 117 HA VAL 117 -13.616 7.204 -2.884 902 HB VAL 117 HB VAL 117 -12.385 4.979 -3.087 903 HG11 VAL 117 HG11 VAL 117 -11.206 4.152 -1.159 904 HG12 VAL 117 HG12 VAL 117 -11.631 5.584 -0.220 905 HG13 VAL 117 HG13 VAL 117 -10.508 5.716 -1.574 906 HG21 VAL 117 HG21 VAL 117 -14.451 4.489 -2.278 907 HG22 VAL 117 HG22 VAL 117 -14.394 5.790 -1.088 908 HG23 VAL 117 HG23 VAL 117 -13.608 4.248 -0.748 909 H GLN 118 HN GLN 118 -10.606 7.878 -1.179 910 HA GLN 118 HA GLN 118 -11.634 8.264 1.456 911 HB2 GLN 118 HB2 GLN 118 -9.246 8.074 0.644 912 HB3 GLN 118 HB1 GLN 118 -9.385 9.729 0.054 913 HG2 GLN 118 HG2 GLN 118 -9.952 10.475 2.361 914 HG3 GLN 118 HG1 GLN 118 -9.711 8.820 2.930 915 HE21 GLN 118 HE21 GLN 118 -7.731 10.430 0.428 916 HE22 GLN 118 HE22 GLN 118 -6.295 10.419 1.330 917 H ILE 119 HN ILE 119 -10.937 10.733 -1.065 918 HA ILE 119 HA ILE 119 -12.299 12.828 0.425 919 HB ILE 119 HB ILE 119 -10.740 12.451 -2.034 920 HG12 ILE 119 HG12 ILE 119 -9.657 14.458 -1.255 921 HG13 ILE 119 HG11 ILE 119 -11.005 14.820 -0.176 922 HG21 ILE 119 HG21 ILE 119 -12.388 13.460 -3.322 923 HG22 ILE 119 HG22 ILE 119 -11.557 14.889 -2.708 924 HG23 ILE 119 HG23 ILE 119 -13.055 14.347 -1.952 925 HD11 ILE 119 HD11 ILE 119 -10.541 12.799 1.129 926 HD12 ILE 119 HD12 ILE 119 -9.093 13.803 1.041 927 HD13 ILE 119 HD13 ILE 119 -9.234 12.368 0.026 928 H SER 120 HN SER 120 -13.258 10.461 -1.949 929 HA SER 120 HA SER 120 -15.698 11.904 -2.737 930 HB2 SER 120 HB2 SER 120 -14.056 9.894 -3.764 931 HB3 SER 120 HB1 SER 120 -15.544 9.053 -3.341 932 HG SER 120 HG SER 120 -15.163 11.260 -5.069 933 H LYS 121 HN LYS 121 -14.971 10.669 0.115 934 HA LYS 121 HA LYS 121 -17.287 8.887 0.528 935 HB2 LYS 121 HB2 LYS 121 -14.771 9.097 1.574 936 HB3 LYS 121 HB1 LYS 121 -15.711 9.937 2.808 937 HG2 LYS 121 HG2 LYS 121 -17.264 7.709 2.249 938 HG3 LYS 121 HG1 LYS 121 -15.618 7.081 2.165 939 HD2 LYS 121 HD2 LYS 121 -15.276 7.341 4.395 940 HD3 LYS 121 HD1 LYS 121 -16.093 8.903 4.429 941 HE2 LYS 121 HE2 LYS 121 -18.289 7.766 4.362 942 HE3 LYS 121 HE1 LYS 121 -17.465 6.194 4.343 943 HZ1 LYS 121 HZ1 LYS 121 -16.765 8.187 6.393 944 HZ2 LYS 121 HZ2 LYS 121 -16.629 6.494 6.451 945 HZ3 LYS 121 HZ3 LYS 121 -18.151 7.232 6.603 946 H GLU 122 HN GLU 122 -17.928 11.593 -0.300 947 HA GLU 122 HA GLU 122 -19.138 13.518 0.374 948 HB2 GLU 122 HB2 GLU 122 -21.198 12.845 1.431 949 HB3 GLU 122 HB1 GLU 122 -20.690 11.497 0.417 950 HG2 GLU 122 HG2 GLU 122 -19.965 10.225 2.266 951 HG3 GLU 122 HG1 GLU 122 -19.904 11.632 3.326 952 H VAL 123 HN VAL 123 -16.689 12.948 1.848 953 HA VAL 123 HA VAL 123 -15.621 13.425 3.890 954 HB VAL 123 HB VAL 123 -16.645 15.589 2.615 955 HG11 VAL 123 HG11 VAL 123 -17.481 16.226 5.408 956 HG12 VAL 123 HG12 VAL 123 -18.609 15.307 4.416 957 HG13 VAL 123 HG13 VAL 123 -18.060 16.894 3.883 958 HG21 VAL 123 HG21 VAL 123 -15.411 16.905 4.523 959 HG22 VAL 123 HG22 VAL 123 -14.502 15.783 3.511 960 HG23 VAL 123 HG23 VAL 123 -15.022 15.293 5.124 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 22.783 5.212 3.990 2 H2 GLY 1 HT2 GLY 1 21.351 4.580 4.651 3 H3 GLY 1 HT3 GLY 1 22.675 4.924 5.658 4 HA2 GLY 1 HA2 GLY 1 21.177 6.681 5.998 5 HA3 GLY 1 HA1 GLY 1 22.450 7.313 4.953 6 H SER 2 HN SER 2 19.382 5.489 4.561 7 HA SER 2 HA SER 2 18.914 6.621 1.916 8 HB2 SER 2 HB2 SER 2 17.945 4.537 3.601 9 HB3 SER 2 HB1 SER 2 16.565 5.535 3.155 10 HG SER 2 HG SER 2 17.516 5.375 0.946 11 H HIS 3 HN HIS 3 19.284 8.867 3.323 12 HA HIS 3 HA HIS 3 16.905 9.899 4.635 13 HB2 HIS 3 HB2 HIS 3 19.395 11.178 3.463 14 HB3 HIS 3 HB1 HIS 3 18.223 12.032 4.466 15 HD1 HIS 3 HD1 HIS 3 19.950 12.374 6.386 16 HD2 HIS 3 HD2 HIS 3 19.220 8.371 5.475 17 HE1 HIS 3 HE1 HIS 3 20.956 11.017 8.272 18 H MET 4 HN MET 4 18.228 11.968 2.188 19 HA MET 4 HA MET 4 17.093 13.116 0.452 20 HB2 MET 4 HB2 MET 4 17.909 10.892 -0.443 21 HB3 MET 4 HB1 MET 4 16.289 10.254 -0.155 22 HG2 MET 4 HG2 MET 4 16.004 10.936 -2.337 23 HG3 MET 4 HG1 MET 4 15.611 12.456 -1.531 24 HE1 MET 4 HE1 MET 4 16.133 12.261 -4.262 25 HE2 MET 4 HE2 MET 4 17.588 11.331 -4.611 26 HE3 MET 4 HE3 MET 4 17.582 13.072 -4.871 27 H THR 5 HN THR 5 15.464 12.476 2.998 28 HA THR 5 HA THR 5 12.789 12.813 1.703 29 HB THR 5 HB THR 5 11.965 11.554 3.824 30 HG1 THR 5 HG1 THR 5 13.987 11.622 4.883 31 HG21 THR 5 HG21 THR 5 12.195 10.718 1.368 32 HG22 THR 5 HG22 THR 5 12.038 9.512 2.645 33 HG23 THR 5 HG23 THR 5 13.620 9.856 1.948 34 H GLU 6 HN GLU 6 11.383 14.127 2.769 35 HA GLU 6 HA GLU 6 12.255 15.562 5.226 36 HB2 GLU 6 HB2 GLU 6 11.608 17.691 4.074 37 HB3 GLU 6 HB1 GLU 6 12.949 16.884 3.254 38 HG2 GLU 6 HG2 GLU 6 11.726 16.923 1.364 39 HG3 GLU 6 HG1 GLU 6 10.620 15.782 2.125 40 H ARG 7 HN ARG 7 10.366 13.436 4.247 41 HA ARG 7 HA ARG 7 7.957 14.224 5.670 42 HB2 ARG 7 HB2 ARG 7 6.981 13.499 3.089 43 HB3 ARG 7 HB1 ARG 7 6.864 15.075 3.852 44 HG2 ARG 7 HG2 ARG 7 8.838 15.857 2.800 45 HG3 ARG 7 HG1 ARG 7 9.349 14.229 2.360 46 HD2 ARG 7 HD2 ARG 7 8.472 15.368 0.372 47 HD3 ARG 7 HD1 ARG 7 7.343 14.083 0.837 48 HE ARG 7 HE ARG 7 6.046 15.893 2.062 49 HH11 ARG 7 HH11 ARG 7 6.805 16.123 -1.109 50 HH12 ARG 7 HH12 ARG 7 6.699 17.847 -1.237 51 HH21 ARG 7 HH21 ARG 7 6.534 18.355 2.190 52 HH22 ARG 7 HH22 ARG 7 6.541 19.111 0.631 53 H ARG 8 HN ARG 8 7.634 12.286 6.729 54 HA ARG 8 HA ARG 8 8.554 9.742 5.533 55 HB2 ARG 8 HB2 ARG 8 7.309 9.870 8.235 56 HB3 ARG 8 HB1 ARG 8 8.755 9.020 7.707 57 HG2 ARG 8 HG2 ARG 8 8.487 11.982 8.299 58 HG3 ARG 8 HG1 ARG 8 9.451 10.797 9.176 59 HD2 ARG 8 HD2 ARG 8 10.200 10.708 6.398 60 HD3 ARG 8 HD1 ARG 8 10.291 12.383 6.981 61 HE ARG 8 HE ARG 8 11.648 10.073 8.316 62 HH11 ARG 8 HH11 ARG 8 10.797 13.058 9.286 63 HH12 ARG 8 HH12 ARG 8 12.393 13.718 9.424 64 HH21 ARG 8 HH21 ARG 8 13.909 11.072 7.770 65 HH22 ARG 8 HH22 ARG 8 14.158 12.590 8.565 66 H LEU 9 HN LEU 9 5.447 10.970 6.933 67 HA LEU 9 HA LEU 9 3.929 8.598 6.749 68 HB2 LEU 9 HB2 LEU 9 3.380 11.541 6.657 69 HB3 LEU 9 HB1 LEU 9 2.045 10.424 6.372 70 HG LEU 9 HG LEU 9 3.171 9.267 8.550 71 HD11 LEU 9 HD11 LEU 9 4.856 11.079 8.734 72 HD12 LEU 9 HD12 LEU 9 3.787 11.039 10.138 73 HD13 LEU 9 HD13 LEU 9 3.553 12.258 8.885 74 HD21 LEU 9 HD21 LEU 9 0.812 10.561 7.913 75 HD22 LEU 9 HD22 LEU 9 1.402 11.499 9.285 76 HD23 LEU 9 HD23 LEU 9 1.143 9.762 9.449 77 H ARG 10 HN ARG 10 3.776 7.331 4.872 78 HA ARG 10 HA ARG 10 2.618 8.620 2.469 79 HB2 ARG 10 HB2 ARG 10 5.104 8.930 2.470 80 HB3 ARG 10 HB1 ARG 10 5.276 7.183 2.420 81 HG2 ARG 10 HG2 ARG 10 5.353 8.365 0.154 82 HG3 ARG 10 HG1 ARG 10 4.227 7.024 0.285 83 HD2 ARG 10 HD2 ARG 10 2.395 8.657 0.659 84 HD3 ARG 10 HD1 ARG 10 3.584 9.964 0.505 85 HE ARG 10 HE ARG 10 2.447 8.626 -1.713 86 HH11 ARG 10 HH21 ARG 10 4.787 10.806 -1.047 87 HH12 ARG 10 HH22 ARG 10 5.908 10.313 -2.272 88 HH21 ARG 10 HH11 ARG 10 4.204 7.388 -3.027 89 HH22 ARG 10 HH12 ARG 10 5.571 8.384 -3.400 90 H VAL 11 HN VAL 11 2.416 6.867 0.670 91 HA VAL 11 HA VAL 11 1.303 4.417 1.871 92 HB VAL 11 HB VAL 11 0.329 4.175 -0.345 93 HG11 VAL 11 HG11 VAL 11 0.311 7.149 -0.051 94 HG12 VAL 11 HG12 VAL 11 -0.250 6.191 1.319 95 HG13 VAL 11 HG13 VAL 11 -1.041 6.035 -0.249 96 HG21 VAL 11 HG21 VAL 11 2.537 6.084 -1.058 97 HG22 VAL 11 HG22 VAL 11 1.049 6.118 -2.005 98 HG23 VAL 11 HG23 VAL 11 1.998 4.635 -1.908 99 H LEU 12 HN LEU 12 2.928 2.904 2.316 100 HA LEU 12 HA LEU 12 5.208 2.645 0.465 101 HB2 LEU 12 HB2 LEU 12 4.391 1.301 3.053 102 HB3 LEU 12 HB1 LEU 12 5.879 0.931 2.188 103 HG LEU 12 HG LEU 12 6.312 2.554 3.983 104 HD11 LEU 12 HD11 LEU 12 6.763 4.525 2.038 105 HD12 LEU 12 HD12 LEU 12 6.844 2.990 1.177 106 HD13 LEU 12 HD13 LEU 12 7.889 3.276 2.566 107 HD21 LEU 12 HD21 LEU 12 3.919 3.537 3.773 108 HD22 LEU 12 HD22 LEU 12 4.602 4.549 2.500 109 HD23 LEU 12 HD23 LEU 12 5.238 4.650 4.142 110 H VAL 13 HN VAL 13 4.347 1.724 -1.438 111 HA VAL 13 HA VAL 13 2.715 -0.754 -1.266 112 HB VAL 13 HB VAL 13 3.800 0.721 -3.680 113 HG11 VAL 13 HG11 VAL 13 2.584 -1.696 -3.564 114 HG12 VAL 13 HG12 VAL 13 2.400 -0.592 -4.927 115 HG13 VAL 13 HG13 VAL 13 1.167 -0.650 -3.666 116 HG21 VAL 13 HG21 VAL 13 1.102 1.126 -2.365 117 HG22 VAL 13 HG22 VAL 13 1.802 2.061 -3.687 118 HG23 VAL 13 HG23 VAL 13 2.482 2.181 -2.065 119 H VAL 14 HN VAL 14 3.533 -2.751 -2.281 120 HA VAL 14 HA VAL 14 6.333 -2.799 -3.089 121 HB VAL 14 HB VAL 14 6.838 -2.427 -0.869 122 HG11 VAL 14 HG11 VAL 14 4.912 -2.218 0.339 123 HG12 VAL 14 HG12 VAL 14 5.375 -3.818 0.917 124 HG13 VAL 14 HG13 VAL 14 4.182 -3.658 -0.372 125 HG21 VAL 14 HG21 VAL 14 6.568 -5.391 -1.224 126 HG22 VAL 14 HG22 VAL 14 7.097 -4.727 0.320 127 HG23 VAL 14 HG23 VAL 14 8.027 -4.398 -1.142 128 H GLU 15 HN GLU 15 6.309 -4.332 -4.614 129 HA GLU 15 HA GLU 15 5.479 -7.069 -4.023 130 HB2 GLU 15 HB2 GLU 15 3.312 -6.233 -4.576 131 HB3 GLU 15 HB1 GLU 15 3.940 -5.314 -5.951 132 HG2 GLU 15 HG2 GLU 15 4.335 -8.279 -5.848 133 HG3 GLU 15 HG1 GLU 15 2.788 -7.627 -6.356 134 H ASP 16 HN ASP 16 6.484 -8.508 -5.423 135 HA ASP 16 HA ASP 16 8.881 -7.947 -6.676 136 HB2 ASP 16 HB2 ASP 16 8.611 -10.163 -7.640 137 HB3 ASP 16 HB1 ASP 16 7.908 -10.148 -6.021 138 H GLU 17 HN GLU 17 8.327 -5.919 -7.905 139 HA GLU 17 HA GLU 17 8.281 -6.400 -10.717 140 HB2 GLU 17 HB2 GLU 17 5.750 -6.511 -9.422 141 HB3 GLU 17 HB1 GLU 17 5.768 -5.058 -10.413 142 HG2 GLU 17 HG2 GLU 17 5.756 -6.242 -12.344 143 HG3 GLU 17 HG1 GLU 17 6.938 -7.405 -11.741 144 H SER 18 HN SER 18 8.437 -4.432 -11.947 145 HA SER 18 HA SER 18 9.132 -2.057 -10.288 146 HB2 SER 18 HB2 SER 18 10.225 -1.337 -12.404 147 HB3 SER 18 HB1 SER 18 10.758 -2.945 -11.923 148 HG SER 18 HG SER 18 10.214 -3.026 -14.078 149 H MET 19 HN MET 19 6.747 -3.270 -12.496 150 HA MET 19 HA MET 19 5.672 -0.868 -13.564 151 HB2 MET 19 HB2 MET 19 5.211 -3.413 -13.973 152 HB3 MET 19 HB1 MET 19 4.015 -3.229 -12.690 153 HG2 MET 19 HG2 MET 19 3.300 -1.112 -14.125 154 HG3 MET 19 HG1 MET 19 4.058 -2.024 -15.430 155 HE1 MET 19 HE1 MET 19 2.455 -3.617 -16.910 156 HE2 MET 19 HE2 MET 19 2.115 -5.083 -15.993 157 HE3 MET 19 HE3 MET 19 3.712 -4.347 -15.901 158 H ILE 20 HN ILE 20 5.557 -2.192 -10.336 159 HA ILE 20 HA ILE 20 3.223 -0.637 -9.477 160 HB ILE 20 HB ILE 20 3.870 -2.793 -8.458 161 HG12 ILE 20 HG12 ILE 20 4.395 -0.748 -6.324 162 HG13 ILE 20 HG11 ILE 20 2.840 -0.733 -7.165 163 HG21 ILE 20 HG21 ILE 20 6.349 -1.281 -7.593 164 HG22 ILE 20 HG22 ILE 20 6.293 -2.645 -8.706 165 HG23 ILE 20 HG23 ILE 20 5.892 -2.879 -7.006 166 HD11 ILE 20 HD11 ILE 20 2.128 -2.481 -5.946 167 HD12 ILE 20 HD12 ILE 20 3.634 -2.425 -5.032 168 HD13 ILE 20 HD13 ILE 20 3.511 -3.442 -6.467 169 H ALA 21 HN ALA 21 6.689 -0.225 -9.634 170 HA ALA 21 HA ALA 21 7.067 1.874 -7.759 171 HB1 ALA 21 HB1 ALA 21 8.510 1.940 -10.356 172 HB2 ALA 21 HB2 ALA 21 8.584 0.419 -9.465 173 HB3 ALA 21 HB3 ALA 21 9.155 1.910 -8.715 174 H MET 22 HN MET 22 6.535 2.139 -11.299 175 HA MET 22 HA MET 22 6.220 4.980 -11.298 176 HB2 MET 22 HB2 MET 22 6.404 2.961 -13.143 177 HB3 MET 22 HB1 MET 22 4.699 3.392 -13.283 178 HG2 MET 22 HG2 MET 22 5.155 5.497 -14.091 179 HG3 MET 22 HG1 MET 22 6.660 5.634 -13.183 180 HE1 MET 22 HE1 MET 22 6.746 6.858 -15.383 181 HE2 MET 22 HE2 MET 22 6.193 6.072 -16.859 182 HE3 MET 22 HE3 MET 22 7.920 6.255 -16.561 183 H LEU 23 HN LEU 23 4.018 2.353 -10.598 184 HA LEU 23 HA LEU 23 1.550 3.841 -10.787 185 HB2 LEU 23 HB2 LEU 23 1.439 1.478 -10.832 186 HB3 LEU 23 HB1 LEU 23 2.551 1.311 -9.479 187 HG LEU 23 HG LEU 23 0.090 0.808 -9.011 188 HD11 LEU 23 HD11 LEU 23 0.499 2.801 -7.014 189 HD12 LEU 23 HD12 LEU 23 2.076 2.149 -7.459 190 HD13 LEU 23 HD13 LEU 23 0.800 1.067 -6.903 191 HD21 LEU 23 HD21 LEU 23 -0.067 3.661 -9.794 192 HD22 LEU 23 HD22 LEU 23 -0.947 3.236 -8.329 193 HD23 LEU 23 HD23 LEU 23 -1.303 2.406 -9.842 194 H ILE 24 HN ILE 24 4.197 4.132 -8.704 195 HA ILE 24 HA ILE 24 2.553 5.021 -6.395 196 HB ILE 24 HB ILE 24 4.767 3.457 -6.608 197 HG12 ILE 24 HG12 ILE 24 4.679 5.159 -4.174 198 HG13 ILE 24 HG11 ILE 24 3.166 4.373 -4.618 199 HG21 ILE 24 HG21 ILE 24 6.141 5.415 -7.366 200 HG22 ILE 24 HG22 ILE 24 6.733 4.681 -5.876 201 HG23 ILE 24 HG23 ILE 24 5.820 6.188 -5.814 202 HD11 ILE 24 HD11 ILE 24 3.987 2.555 -3.538 203 HD12 ILE 24 HD12 ILE 24 5.625 3.203 -3.530 204 HD13 ILE 24 HD13 ILE 24 5.025 2.343 -4.948 205 H GLU 25 HN GLU 25 5.056 6.228 -8.637 206 HA GLU 25 HA GLU 25 5.162 8.872 -7.449 207 HB2 GLU 25 HB2 GLU 25 5.985 7.772 -10.156 208 HB3 GLU 25 HB1 GLU 25 6.470 9.345 -9.519 209 HG2 GLU 25 HG2 GLU 25 7.206 7.849 -7.423 210 HG3 GLU 25 HG1 GLU 25 7.337 6.614 -8.681 211 H ASP 26 HN ASP 26 2.878 7.319 -9.478 212 HA ASP 26 HA ASP 26 2.000 9.749 -10.876 213 HB2 ASP 26 HB2 ASP 26 0.441 8.264 -11.906 214 HB3 ASP 26 HB1 ASP 26 1.886 7.287 -11.647 215 H THR 27 HN THR 27 0.749 7.701 -8.213 216 HA THR 27 HA THR 27 -1.546 9.339 -7.656 217 HB THR 27 HB THR 27 -0.042 7.653 -5.697 218 HG1 THR 27 HG1 THR 27 -1.699 6.088 -6.873 219 HG21 THR 27 HG21 THR 27 -2.813 8.634 -6.060 220 HG22 THR 27 HG22 THR 27 -1.907 8.342 -4.574 221 HG23 THR 27 HG23 THR 27 -2.640 6.991 -5.440 222 H LEU 28 HN LEU 28 1.609 8.998 -6.035 223 HA LEU 28 HA LEU 28 1.338 11.111 -4.161 224 HB2 LEU 28 HB2 LEU 28 3.155 9.756 -3.779 225 HB3 LEU 28 HB1 LEU 28 3.474 9.512 -5.487 226 HG LEU 28 HG LEU 28 5.234 10.830 -4.204 227 HD11 LEU 28 HD11 LEU 28 4.568 12.827 -6.145 228 HD12 LEU 28 HD12 LEU 28 4.137 11.246 -6.798 229 HD13 LEU 28 HD13 LEU 28 5.786 11.555 -6.253 230 HD21 LEU 28 HD21 LEU 28 2.885 12.365 -3.541 231 HD22 LEU 28 HD22 LEU 28 4.049 13.390 -4.380 232 HD23 LEU 28 HD23 LEU 28 4.527 12.529 -2.918 233 H CYS 29 HN CYS 29 1.989 11.093 -7.604 234 HA CYS 29 HA CYS 29 3.055 13.731 -7.921 235 HB2 CYS 29 HB2 CYS 29 2.089 11.537 -9.506 236 HB3 CYS 29 HB1 CYS 29 1.346 13.021 -10.103 237 HG CYS 29 HG CYS 29 4.089 13.831 -9.881 238 H GLU 30 HN GLU 30 -0.171 12.466 -7.421 239 HA GLU 30 HA GLU 30 -1.467 15.066 -7.908 240 HB2 GLU 30 HB2 GLU 30 -2.586 13.124 -8.758 241 HB3 GLU 30 HB1 GLU 30 -2.367 12.259 -7.236 242 HG2 GLU 30 HG2 GLU 30 -3.830 13.930 -6.108 243 HG3 GLU 30 HG1 GLU 30 -4.112 14.701 -7.670 244 H LEU 31 HN LEU 31 -1.300 12.657 -5.270 245 HA LEU 31 HA LEU 31 -2.441 14.422 -3.276 246 HB2 LEU 31 HB2 LEU 31 -0.805 11.866 -3.123 247 HB3 LEU 31 HB1 LEU 31 -1.631 12.598 -1.748 248 HG LEU 31 HG LEU 31 -3.215 11.049 -2.438 249 HD11 LEU 31 HD11 LEU 31 -4.016 13.515 -2.623 250 HD12 LEU 31 HD12 LEU 31 -5.034 12.249 -3.308 251 HD13 LEU 31 HD13 LEU 31 -4.011 13.223 -4.362 252 HD21 LEU 31 HD21 LEU 31 -3.391 10.132 -4.561 253 HD22 LEU 31 HD22 LEU 31 -1.707 10.651 -4.579 254 HD23 LEU 31 HD23 LEU 31 -2.941 11.638 -5.363 255 H GLY 32 HN GLY 32 0.850 13.641 -4.318 256 HA2 GLY 32 HA2 GLY 32 2.883 14.691 -3.788 257 HA3 GLY 32 HA1 GLY 32 1.931 16.031 -3.136 258 H HIS 33 HN HIS 33 1.490 12.738 -2.014 259 HA HIS 33 HA HIS 33 1.711 13.394 0.736 260 HB2 HIS 33 HB2 HIS 33 1.779 10.902 -0.927 261 HB3 HIS 33 HB1 HIS 33 2.135 10.801 0.795 262 HD1 HIS 33 HD1 HIS 33 -0.663 10.633 -1.395 263 HD2 HIS 33 HD2 HIS 33 0.010 12.314 2.360 264 HE1 HIS 33 HE1 HIS 33 -2.944 10.961 -0.338 265 H GLU 34 HN GLU 34 3.583 11.360 1.668 266 HA GLU 34 HA GLU 34 6.018 12.987 1.428 267 HB2 GLU 34 HB2 GLU 34 5.226 10.671 3.190 268 HB3 GLU 34 HB1 GLU 34 6.576 11.758 3.459 269 HG2 GLU 34 HG2 GLU 34 4.483 13.514 3.037 270 HG3 GLU 34 HG1 GLU 34 3.713 12.226 3.946 271 H VAL 35 HN VAL 35 6.750 9.735 2.272 272 HA VAL 35 HA VAL 35 7.925 9.285 -0.466 273 HB VAL 35 HB VAL 35 9.469 10.051 1.412 274 HG11 VAL 35 HG11 VAL 35 9.887 8.687 3.249 275 HG12 VAL 35 HG12 VAL 35 9.326 7.232 2.424 276 HG13 VAL 35 HG13 VAL 35 8.159 8.413 3.020 277 HG21 VAL 35 HG21 VAL 35 10.588 7.438 0.808 278 HG22 VAL 35 HG22 VAL 35 11.085 9.023 0.214 279 HG23 VAL 35 HG23 VAL 35 9.809 8.130 -0.615 280 H ALA 36 HN ALA 36 6.915 7.530 -1.356 281 HA ALA 36 HA ALA 36 5.764 5.443 0.363 282 HB1 ALA 36 HB1 ALA 36 4.951 4.688 -1.962 283 HB2 ALA 36 HB2 ALA 36 5.693 6.171 -2.561 284 HB3 ALA 36 HB3 ALA 36 4.380 6.254 -1.388 285 H ALA 37 HN ALA 37 5.906 3.206 -1.136 286 HA ALA 37 HA ALA 37 8.824 2.644 -1.561 287 HB1 ALA 37 HB1 ALA 37 6.789 1.365 0.236 288 HB2 ALA 37 HB2 ALA 37 8.483 1.735 0.560 289 HB3 ALA 37 HB3 ALA 37 8.060 0.356 -0.455 290 H THR 38 HN THR 38 9.203 1.226 -3.279 291 HA THR 38 HA THR 38 6.795 0.218 -4.750 292 HB THR 38 HB THR 38 7.628 2.026 -6.004 293 HG1 THR 38 HG1 THR 38 7.528 0.097 -7.232 294 HG21 THR 38 HG21 THR 38 9.645 2.470 -4.710 295 HG22 THR 38 HG22 THR 38 10.072 2.355 -6.417 296 HG23 THR 38 HG23 THR 38 10.404 1.005 -5.332 297 H ALA 39 HN ALA 39 7.066 -1.749 -5.912 298 HA ALA 39 HA ALA 39 7.956 -3.886 -6.394 299 HB1 ALA 39 HB1 ALA 39 10.601 -3.248 -5.258 300 HB2 ALA 39 HB2 ALA 39 10.050 -2.139 -6.515 301 HB3 ALA 39 HB3 ALA 39 10.183 -3.864 -6.856 302 H SER 40 HN SER 40 8.701 -5.841 -5.176 303 HA SER 40 HA SER 40 7.832 -5.639 -2.418 304 HB2 SER 40 HB2 SER 40 8.015 -8.033 -2.412 305 HB3 SER 40 HB1 SER 40 7.238 -7.514 -3.887 306 HG SER 40 HG SER 40 9.315 -9.035 -3.723 307 H ARG 41 HN ARG 41 9.105 -5.766 -0.564 308 HA ARG 41 HA ARG 41 11.951 -6.420 -0.736 309 HB2 ARG 41 HB2 ARG 41 11.292 -3.937 -1.495 310 HB3 ARG 41 HB1 ARG 41 11.317 -3.673 0.251 311 HG2 ARG 41 HG2 ARG 41 13.546 -3.286 -0.182 312 HG3 ARG 41 HG1 ARG 41 13.612 -5.034 0.046 313 HD2 ARG 41 HD2 ARG 41 13.148 -5.173 -2.513 314 HD3 ARG 41 HD1 ARG 41 13.663 -3.474 -2.537 315 HE ARG 41 HE ARG 41 15.838 -4.159 -1.697 316 HH11 ARG 41 HH11 ARG 41 14.213 -6.448 -3.478 317 HH12 ARG 41 HH12 ARG 41 15.130 -7.809 -2.925 318 HH21 ARG 41 HH21 ARG 41 16.779 -6.028 -0.447 319 HH22 ARG 41 HH22 ARG 41 16.588 -7.569 -1.214 320 H MET 42 HN MET 42 12.216 -7.583 1.138 321 HA MET 42 HA MET 42 10.427 -7.489 3.362 322 HB2 MET 42 HB2 MET 42 13.231 -8.536 2.923 323 HB3 MET 42 HB1 MET 42 12.325 -8.835 4.408 324 HG2 MET 42 HG2 MET 42 10.684 -10.109 3.296 325 HG3 MET 42 HG1 MET 42 11.108 -9.446 1.720 326 HE1 MET 42 HE1 MET 42 12.881 -12.206 0.248 327 HE2 MET 42 HE2 MET 42 12.858 -10.449 0.118 328 HE3 MET 42 HE3 MET 42 11.352 -11.325 0.378 329 H GLN 43 HN GLN 43 13.372 -5.683 2.648 330 HA GLN 43 HA GLN 43 13.857 -4.755 5.345 331 HB2 GLN 43 HB2 GLN 43 15.412 -4.863 3.290 332 HB3 GLN 43 HB1 GLN 43 14.624 -3.375 2.764 333 HG2 GLN 43 HG2 GLN 43 15.169 -2.466 5.114 334 HG3 GLN 43 HG1 GLN 43 16.268 -3.838 5.253 335 HE21 GLN 43 HE21 GLN 43 17.372 -1.256 5.271 336 HE22 GLN 43 HE22 GLN 43 18.203 -0.982 3.817 337 H GLU 44 HN GLU 44 12.855 -2.782 2.528 338 HA GLU 44 HA GLU 44 11.845 -0.620 4.072 339 HB2 GLU 44 HB2 GLU 44 11.865 -1.578 1.292 340 HB3 GLU 44 HB1 GLU 44 10.468 -0.572 1.678 341 HG2 GLU 44 HG2 GLU 44 13.321 0.217 2.330 342 HG3 GLU 44 HG1 GLU 44 12.486 0.713 0.857 343 H ALA 45 HN ALA 45 10.093 -3.343 2.520 344 HA ALA 45 HA ALA 45 7.453 -2.728 3.102 345 HB1 ALA 45 HB1 ALA 45 7.149 -5.188 3.265 346 HB2 ALA 45 HB2 ALA 45 8.887 -5.378 3.494 347 HB3 ALA 45 HB3 ALA 45 8.261 -4.767 1.962 348 H LEU 46 HN LEU 46 9.576 -4.561 5.332 349 HA LEU 46 HA LEU 46 7.991 -4.676 7.607 350 HB2 LEU 46 HB2 LEU 46 10.199 -5.652 7.470 351 HB3 LEU 46 HB1 LEU 46 10.939 -4.072 7.230 352 HG LEU 46 HG LEU 46 9.332 -4.103 9.640 353 HD11 LEU 46 HD11 LEU 46 11.693 -5.733 10.180 354 HD12 LEU 46 HD12 LEU 46 10.540 -6.560 9.133 355 HD13 LEU 46 HD13 LEU 46 10.028 -5.965 10.713 356 HD21 LEU 46 HD21 LEU 46 11.827 -3.089 8.604 357 HD22 LEU 46 HD22 LEU 46 12.100 -3.822 10.185 358 HD23 LEU 46 HD23 LEU 46 10.910 -2.533 10.004 359 H ASP 47 HN ASP 47 9.900 -1.952 6.401 360 HA ASP 47 HA ASP 47 9.504 -0.152 8.576 361 HB2 ASP 47 HB2 ASP 47 10.902 -0.218 6.238 362 HB3 ASP 47 HB1 ASP 47 9.634 0.936 5.825 363 H ILE 48 HN ILE 48 7.324 -1.185 6.057 364 HA ILE 48 HA ILE 48 5.583 1.160 6.293 365 HB ILE 48 HB ILE 48 4.389 0.201 4.543 366 HG12 ILE 48 HG12 ILE 48 5.156 -2.415 5.807 367 HG13 ILE 48 HG11 ILE 48 3.563 -1.818 5.368 368 HG21 ILE 48 HG21 ILE 48 7.110 -1.098 4.296 369 HG22 ILE 48 HG22 ILE 48 6.741 0.576 3.901 370 HG23 ILE 48 HG23 ILE 48 6.004 -0.734 2.979 371 HD11 ILE 48 HD11 ILE 48 5.492 -3.328 3.742 372 HD12 ILE 48 HD12 ILE 48 4.864 -1.899 2.920 373 HD13 ILE 48 HD13 ILE 48 3.755 -3.124 3.526 374 H ALA 49 HN ALA 49 5.792 -2.097 7.613 375 HA ALA 49 HA ALA 49 3.125 -1.945 8.817 376 HB1 ALA 49 HB1 ALA 49 3.857 -4.070 8.013 377 HB2 ALA 49 HB2 ALA 49 3.953 -4.179 9.770 378 HB3 ALA 49 HB3 ALA 49 5.416 -3.914 8.823 379 H ARG 50 HN ARG 50 6.302 -2.678 10.285 380 HA ARG 50 HA ARG 50 5.621 -2.113 12.949 381 HB2 ARG 50 HB2 ARG 50 8.154 -2.019 11.327 382 HB3 ARG 50 HB1 ARG 50 8.183 -1.620 13.048 383 HG2 ARG 50 HG2 ARG 50 7.773 -3.775 13.692 384 HG3 ARG 50 HG1 ARG 50 6.705 -4.089 12.323 385 HD2 ARG 50 HD2 ARG 50 8.396 -5.012 11.124 386 HD3 ARG 50 HD1 ARG 50 9.460 -3.632 11.456 387 HE ARG 50 HE ARG 50 9.628 -6.110 12.817 388 HH11 ARG 50 HH21 ARG 50 10.518 -2.898 13.031 389 HH12 ARG 50 HH22 ARG 50 10.819 -2.903 14.736 390 HH21 ARG 50 HH11 ARG 50 9.492 -6.073 15.222 391 HH22 ARG 50 HH12 ARG 50 10.232 -4.704 15.982 392 H LYS 51 HN LYS 51 6.672 0.173 10.424 393 HA LYS 51 HA LYS 51 7.264 2.408 12.043 394 HB2 LYS 51 HB2 LYS 51 7.732 2.386 9.691 395 HB3 LYS 51 HB1 LYS 51 6.037 2.100 9.296 396 HG2 LYS 51 HG2 LYS 51 6.408 4.422 8.889 397 HG3 LYS 51 HG1 LYS 51 5.540 4.334 10.419 398 HD2 LYS 51 HD2 LYS 51 7.204 5.627 11.240 399 HD3 LYS 51 HD1 LYS 51 8.164 4.147 11.231 400 HE2 LYS 51 HE2 LYS 51 8.320 5.061 8.591 401 HE3 LYS 51 HE1 LYS 51 8.462 6.529 9.577 402 HZ1 LYS 51 HZ1 LYS 51 10.599 5.770 9.701 403 HZ2 LYS 51 HZ2 LYS 51 10.156 4.136 9.557 404 HZ3 LYS 51 HZ3 LYS 51 9.941 4.950 11.032 405 H GLY 52 HN GLY 52 4.097 1.489 10.627 406 HA2 GLY 52 HA2 GLY 52 1.938 1.890 11.507 407 HA3 GLY 52 HA1 GLY 52 2.692 2.621 12.921 408 H GLN 53 HN GLN 53 4.207 4.645 11.603 409 HA GLN 53 HA GLN 53 2.124 6.639 11.169 410 HB2 GLN 53 HB2 GLN 53 5.023 7.097 10.531 411 HB3 GLN 53 HB1 GLN 53 3.885 8.159 11.356 412 HG2 GLN 53 HG2 GLN 53 4.081 5.882 12.978 413 HG3 GLN 53 HG1 GLN 53 5.731 6.232 12.484 414 HE21 GLN 53 HE21 GLN 53 2.822 7.910 13.793 415 HE22 GLN 53 HE22 GLN 53 3.702 9.040 14.704 416 H PHE 54 HN PHE 54 4.286 4.746 9.150 417 HA PHE 54 HA PHE 54 4.425 6.109 6.768 418 HB2 PHE 54 HB2 PHE 54 4.610 3.931 5.766 419 HB3 PHE 54 HB1 PHE 54 5.182 3.746 7.424 420 HD1 PHE 54 HD1 PHE 54 3.238 3.191 9.191 421 HD2 PHE 54 HD2 PHE 54 3.056 2.389 4.982 422 HE1 PHE 54 HE1 PHE 54 1.502 1.472 9.593 423 HE2 PHE 54 HE2 PHE 54 1.313 0.685 5.393 424 HZ PHE 54 HZ PHE 54 0.550 0.208 7.685 425 H ASP 55 HN ASP 55 1.591 4.694 8.248 426 HA ASP 55 HA ASP 55 -0.673 5.306 7.869 427 HB2 ASP 55 HB2 ASP 55 0.479 7.311 6.674 428 HB3 ASP 55 HB1 ASP 55 0.122 6.427 5.191 429 H ILE 56 HN ILE 56 0.707 4.513 4.598 430 HA ILE 56 HA ILE 56 -1.255 2.233 4.593 431 HB ILE 56 HB ILE 56 -0.408 3.762 2.148 432 HG12 ILE 56 HG12 ILE 56 -2.414 4.561 4.262 433 HG13 ILE 56 HG11 ILE 56 -1.163 5.548 3.511 434 HG21 ILE 56 HG21 ILE 56 -1.619 1.722 1.757 435 HG22 ILE 56 HG22 ILE 56 -2.737 3.056 1.471 436 HG23 ILE 56 HG23 ILE 56 -2.820 2.140 2.977 437 HD11 ILE 56 HD11 ILE 56 -2.604 4.830 1.315 438 HD12 ILE 56 HD12 ILE 56 -2.892 6.309 2.231 439 HD13 ILE 56 HD13 ILE 56 -3.878 4.878 2.534 440 H ALA 57 HN ALA 57 -0.679 0.328 3.356 441 HA ALA 57 HA ALA 57 2.073 0.245 2.228 442 HB1 ALA 57 HB1 ALA 57 2.601 -0.271 4.466 443 HB2 ALA 57 HB2 ALA 57 2.430 -1.855 3.716 444 HB3 ALA 57 HB3 ALA 57 1.118 -1.197 4.692 445 H ILE 58 HN ILE 58 2.294 -1.467 0.658 446 HA ILE 58 HA ILE 58 -0.033 -3.324 0.527 447 HB ILE 58 HB ILE 58 0.936 -1.379 -1.561 448 HG12 ILE 58 HG12 ILE 58 -1.764 -1.288 -1.559 449 HG13 ILE 58 HG11 ILE 58 -1.496 -1.828 0.098 450 HG21 ILE 58 HG21 ILE 58 -0.044 -4.070 -1.963 451 HG22 ILE 58 HG22 ILE 58 0.456 -2.884 -3.168 452 HG23 ILE 58 HG23 ILE 58 -1.209 -2.904 -2.589 453 HD11 ILE 58 HD11 ILE 58 -0.680 0.739 -1.212 454 HD12 ILE 58 HD12 ILE 58 0.309 0.103 0.100 455 HD13 ILE 58 HD13 ILE 58 -1.392 0.473 0.379 456 H ILE 59 HN ILE 59 1.350 -5.080 1.058 457 HA ILE 59 HA ILE 59 3.631 -5.785 -0.691 458 HB ILE 59 HB ILE 59 2.186 -6.978 1.685 459 HG12 ILE 59 HG12 ILE 59 4.765 -7.078 2.320 460 HG13 ILE 59 HG11 ILE 59 4.882 -5.835 1.073 461 HG21 ILE 59 HG21 ILE 59 4.272 -8.711 1.228 462 HG22 ILE 59 HG22 ILE 59 3.701 -8.397 -0.411 463 HG23 ILE 59 HG23 ILE 59 2.591 -9.036 0.801 464 HD11 ILE 59 HD11 ILE 59 4.494 -4.941 3.401 465 HD12 ILE 59 HD12 ILE 59 2.911 -5.719 3.365 466 HD13 ILE 59 HD13 ILE 59 3.290 -4.437 2.214 467 H ASP 60 HN ASP 60 1.800 -5.380 -2.401 468 HA ASP 60 HA ASP 60 -0.405 -7.149 -2.747 469 HB2 ASP 60 HB2 ASP 60 -0.723 -5.736 -4.484 470 HB3 ASP 60 HB1 ASP 60 0.720 -4.904 -3.923 471 H VAL 61 HN VAL 61 -0.681 -8.901 -4.162 472 HA VAL 61 HA VAL 61 -0.114 -10.738 -5.486 473 HB VAL 61 HB VAL 61 1.928 -9.081 -5.954 474 HG11 VAL 61 HG11 VAL 61 4.044 -9.995 -5.440 475 HG12 VAL 61 HG12 VAL 61 3.374 -11.576 -5.072 476 HG13 VAL 61 HG13 VAL 61 3.156 -10.243 -3.944 477 HG21 VAL 61 HG21 VAL 61 1.862 -10.282 -7.844 478 HG22 VAL 61 HG22 VAL 61 0.874 -11.480 -7.008 479 HG23 VAL 61 HG23 VAL 61 2.630 -11.651 -7.041 480 H ASN 62 HN ASN 62 -1.049 -11.704 -3.517 481 HA ASN 62 HA ASN 62 0.974 -13.274 -1.955 482 HB2 ASN 62 HB2 ASN 62 -1.833 -12.413 -1.180 483 HB3 ASN 62 HB1 ASN 62 -0.668 -13.218 -0.137 484 HD21 ASN 62 HD21 ASN 62 1.555 -11.534 -1.437 485 HD22 ASN 62 HD22 ASN 62 1.414 -10.017 -0.687 486 H LEU 63 HN LEU 63 0.371 -14.307 -4.352 487 HA LEU 63 HA LEU 63 -1.681 -16.435 -3.825 488 HB2 LEU 63 HB2 LEU 63 -1.586 -14.380 -5.778 489 HB3 LEU 63 HB1 LEU 63 -1.188 -15.872 -6.626 490 HG LEU 63 HG LEU 63 -3.234 -16.910 -5.963 491 HD11 LEU 63 HD11 LEU 63 -4.689 -15.026 -4.510 492 HD12 LEU 63 HD12 LEU 63 -3.076 -14.954 -3.801 493 HD13 LEU 63 HD13 LEU 63 -3.946 -16.487 -3.859 494 HD21 LEU 63 HD21 LEU 63 -4.303 -15.722 -7.553 495 HD22 LEU 63 HD22 LEU 63 -3.198 -14.371 -7.301 496 HD23 LEU 63 HD23 LEU 63 -4.683 -14.484 -6.357 497 H ASP 64 HN ASP 64 -1.196 -18.421 -5.251 498 HA ASP 64 HA ASP 64 0.327 -20.149 -5.805 499 HB2 ASP 64 HB2 ASP 64 0.762 -17.873 -7.311 500 HB3 ASP 64 HB1 ASP 64 2.376 -18.230 -6.687 501 H GLY 65 HN GLY 65 0.667 -18.472 -3.165 502 HA2 GLY 65 HA2 GLY 65 2.560 -19.934 -1.831 503 HA3 GLY 65 HA1 GLY 65 3.530 -18.702 -2.637 504 H GLU 66 HN GLU 66 1.330 -16.716 -2.443 505 HA GLU 66 HA GLU 66 0.529 -15.113 -0.903 506 HB2 GLU 66 HB2 GLU 66 0.058 -17.514 0.221 507 HB3 GLU 66 HB1 GLU 66 1.217 -16.886 1.393 508 HG2 GLU 66 HG2 GLU 66 -0.838 -14.937 0.587 509 HG3 GLU 66 HG1 GLU 66 -1.481 -16.351 1.424 510 HA PRO 67 HA PRO 67 5.147 -14.672 0.161 511 HB2 PRO 67 HB2 PRO 67 5.799 -12.931 -1.859 512 HB3 PRO 67 HB1 PRO 67 5.966 -14.694 -1.994 513 HG2 PRO 67 HG2 PRO 67 3.784 -12.919 -2.994 514 HG3 PRO 67 HG1 PRO 67 4.568 -14.296 -3.788 515 HD2 PRO 67 HD2 PRO 67 2.150 -14.508 -2.622 516 HD3 PRO 67 HD1 PRO 67 3.315 -15.849 -2.635 517 H SER 68 HN SER 68 3.624 -13.549 1.823 518 HA SER 68 HA SER 68 3.744 -10.571 1.449 519 HB2 SER 68 HB2 SER 68 1.881 -11.922 3.371 520 HB3 SER 68 HB1 SER 68 1.644 -10.443 2.444 521 HG SER 68 HG SER 68 1.504 -13.136 1.588 522 H TYR 69 HN TYR 69 5.213 -13.086 2.978 523 HA TYR 69 HA TYR 69 6.431 -13.393 4.941 524 HB2 TYR 69 HB2 TYR 69 7.292 -10.798 5.531 525 HB3 TYR 69 HB1 TYR 69 8.111 -11.956 4.498 526 HD1 TYR 69 HD2 TYR 69 6.869 -12.052 1.987 527 HD2 TYR 69 HD1 TYR 69 7.082 -8.702 4.659 528 HE1 TYR 69 HE2 TYR 69 6.542 -10.497 0.075 529 HE2 TYR 69 HE1 TYR 69 6.755 -7.150 2.755 530 HH TYR 69 HH TYR 69 6.138 -8.378 -0.521 531 HA PRO 70 HA PRO 70 4.211 -12.442 8.541 532 HB2 PRO 70 HB2 PRO 70 6.102 -11.843 10.423 533 HB3 PRO 70 HB1 PRO 70 5.839 -13.482 9.796 534 HG2 PRO 70 HG2 PRO 70 7.939 -11.499 9.078 535 HG3 PRO 70 HG1 PRO 70 8.060 -13.256 9.258 536 HD2 PRO 70 HD2 PRO 70 7.900 -11.992 6.842 537 HD3 PRO 70 HD1 PRO 70 7.339 -13.654 7.124 538 H VAL 71 HN VAL 71 5.860 -9.928 6.994 539 HA VAL 71 HA VAL 71 5.146 -7.903 9.019 540 HB VAL 71 HB VAL 71 6.588 -6.504 7.886 541 HG11 VAL 71 HG11 VAL 71 7.751 -8.695 8.363 542 HG12 VAL 71 HG12 VAL 71 8.495 -7.724 7.093 543 HG13 VAL 71 HG13 VAL 71 7.504 -9.118 6.669 544 HG21 VAL 71 HG21 VAL 71 5.613 -7.862 5.369 545 HG22 VAL 71 HG22 VAL 71 6.990 -6.761 5.364 546 HG23 VAL 71 HG23 VAL 71 5.399 -6.183 5.855 547 H ALA 72 HN ALA 72 4.169 -8.914 5.773 548 HA ALA 72 HA ALA 72 2.082 -6.886 5.502 549 HB1 ALA 72 HB1 ALA 72 2.365 -9.510 4.046 550 HB2 ALA 72 HB2 ALA 72 3.459 -8.163 3.729 551 HB3 ALA 72 HB3 ALA 72 1.731 -7.985 3.432 552 H ASP 73 HN ASP 73 2.166 -10.420 6.001 553 HA ASP 73 HA ASP 73 -0.595 -10.854 6.347 554 HB2 ASP 73 HB2 ASP 73 1.962 -12.118 7.150 555 HB3 ASP 73 HB1 ASP 73 0.520 -12.688 7.977 556 H ILE 74 HN ILE 74 1.901 -10.310 8.851 557 HA ILE 74 HA ILE 74 0.229 -10.192 11.127 558 HB ILE 74 HB ILE 74 2.786 -8.840 10.277 559 HG12 ILE 74 HG12 ILE 74 2.085 -10.983 12.312 560 HG13 ILE 74 HG11 ILE 74 2.869 -11.246 10.755 561 HG21 ILE 74 HG21 ILE 74 1.801 -7.269 11.823 562 HG22 ILE 74 HG22 ILE 74 3.054 -8.162 12.685 563 HG23 ILE 74 HG23 ILE 74 1.355 -8.566 12.932 564 HD11 ILE 74 HD11 ILE 74 4.560 -9.415 11.774 565 HD12 ILE 74 HD12 ILE 74 4.760 -11.145 12.056 566 HD13 ILE 74 HD13 ILE 74 3.989 -10.135 13.280 567 H LEU 75 HN LEU 75 1.192 -7.633 8.864 568 HA LEU 75 HA LEU 75 -0.273 -5.490 10.063 569 HB2 LEU 75 HB2 LEU 75 1.611 -5.600 8.286 570 HB3 LEU 75 HB1 LEU 75 0.320 -5.865 7.119 571 HG LEU 75 HG LEU 75 -0.753 -3.746 8.202 572 HD11 LEU 75 HD11 LEU 75 1.280 -2.218 8.893 573 HD12 LEU 75 HD12 LEU 75 2.057 -3.755 9.271 574 HD13 LEU 75 HD13 LEU 75 0.562 -3.300 10.087 575 HD21 LEU 75 HD21 LEU 75 0.440 -2.342 6.618 576 HD22 LEU 75 HD22 LEU 75 0.259 -3.945 5.906 577 HD23 LEU 75 HD23 LEU 75 1.805 -3.458 6.600 578 H ALA 76 HN ALA 76 -1.293 -8.298 8.414 579 HA ALA 76 HA ALA 76 -3.818 -7.157 7.431 580 HB1 ALA 76 HB1 ALA 76 -3.832 -9.016 6.090 581 HB2 ALA 76 HB2 ALA 76 -3.270 -10.069 7.387 582 HB3 ALA 76 HB3 ALA 76 -2.121 -9.058 6.513 583 H GLU 77 HN GLU 77 -2.784 -9.759 9.671 584 HA GLU 77 HA GLU 77 -5.310 -10.484 10.700 585 HB2 GLU 77 HB2 GLU 77 -2.761 -10.237 12.318 586 HB3 GLU 77 HB1 GLU 77 -4.039 -11.437 12.499 587 HG2 GLU 77 HG2 GLU 77 -3.333 -11.824 9.888 588 HG3 GLU 77 HG1 GLU 77 -1.783 -11.360 10.591 589 H ARG 78 HN ARG 78 -3.442 -7.617 11.194 590 HA ARG 78 HA ARG 78 -5.543 -6.502 12.956 591 HB2 ARG 78 HB2 ARG 78 -3.685 -5.531 14.359 592 HB3 ARG 78 HB1 ARG 78 -3.758 -7.293 14.424 593 HG2 ARG 78 HG2 ARG 78 -2.121 -6.380 12.199 594 HG3 ARG 78 HG1 ARG 78 -1.527 -5.755 13.739 595 HD2 ARG 78 HD2 ARG 78 -2.073 -8.670 13.071 596 HD3 ARG 78 HD1 ARG 78 -0.487 -7.927 13.361 597 HE ARG 78 HE ARG 78 -1.651 -7.275 15.665 598 HH11 ARG 78 HH11 ARG 78 -0.407 -10.117 14.728 599 HH12 ARG 78 HH12 ARG 78 -1.406 -11.142 15.704 600 HH21 ARG 78 HH21 ARG 78 -3.632 -8.623 16.544 601 HH22 ARG 78 HH22 ARG 78 -3.237 -10.301 16.717 602 H ASN 79 HN ASN 79 -6.212 -5.256 11.128 603 HA ASN 79 HA ASN 79 -4.270 -3.660 9.653 604 HB2 ASN 79 HB2 ASN 79 -7.223 -4.188 9.578 605 HB3 ASN 79 HB1 ASN 79 -6.519 -2.916 8.578 606 HD21 ASN 79 HD21 ASN 79 -4.033 -4.155 7.904 607 HD22 ASN 79 HD22 ASN 79 -4.357 -5.508 6.937 608 H VAL 80 HN VAL 80 -3.608 -1.716 10.314 609 HA VAL 80 HA VAL 80 -5.314 -0.062 12.128 610 HB VAL 80 HB VAL 80 -3.245 0.961 12.725 611 HG11 VAL 80 HG11 VAL 80 -2.580 -1.878 11.918 612 HG12 VAL 80 HG12 VAL 80 -3.275 -1.365 13.455 613 HG13 VAL 80 HG13 VAL 80 -1.630 -0.893 13.030 614 HG21 VAL 80 HG21 VAL 80 -1.255 0.085 10.986 615 HG22 VAL 80 HG22 VAL 80 -1.983 1.690 10.975 616 HG23 VAL 80 HG23 VAL 80 -2.609 0.431 9.912 617 HA PRO 81 HA PRO 81 -6.045 2.905 8.879 618 HB2 PRO 81 HB2 PRO 81 -4.313 5.041 8.938 619 HB3 PRO 81 HB1 PRO 81 -5.688 4.868 10.048 620 HG2 PRO 81 HG2 PRO 81 -2.807 4.211 10.494 621 HG3 PRO 81 HG1 PRO 81 -3.952 5.029 11.571 622 HD2 PRO 81 HD2 PRO 81 -3.329 2.463 11.909 623 HD3 PRO 81 HD1 PRO 81 -4.976 3.046 12.213 624 H PHE 82 HN PHE 82 -5.600 2.186 6.834 625 HA PHE 82 HA PHE 82 -3.053 2.566 5.509 626 HB2 PHE 82 HB2 PHE 82 -2.091 0.425 5.782 627 HB3 PHE 82 HB1 PHE 82 -2.746 0.768 7.386 628 HD1 PHE 82 HD1 PHE 82 -5.621 0.334 7.045 629 HD2 PHE 82 HD2 PHE 82 -2.322 -1.898 5.448 630 HE1 PHE 82 HE1 PHE 82 -7.071 -1.665 6.871 631 HE2 PHE 82 HE2 PHE 82 -3.774 -3.904 5.275 632 HZ PHE 82 HZ PHE 82 -6.145 -3.787 5.984 633 H ILE 83 HN ILE 83 -3.183 0.068 4.093 634 HA ILE 83 HA ILE 83 -5.722 -0.521 2.949 635 HB ILE 83 HB ILE 83 -4.316 1.817 1.973 636 HG12 ILE 83 HG12 ILE 83 -6.936 0.715 0.994 637 HG13 ILE 83 HG11 ILE 83 -6.787 1.420 2.604 638 HG21 ILE 83 HG21 ILE 83 -4.678 1.332 -0.461 639 HG22 ILE 83 HG22 ILE 83 -5.001 -0.348 -0.031 640 HG23 ILE 83 HG23 ILE 83 -3.405 0.346 0.256 641 HD11 ILE 83 HD11 ILE 83 -7.531 3.130 1.015 642 HD12 ILE 83 HD12 ILE 83 -6.137 2.804 -0.015 643 HD13 ILE 83 HD13 ILE 83 -5.906 3.510 1.585 644 H PHE 84 HN PHE 84 -5.453 -2.211 1.362 645 HA PHE 84 HA PHE 84 -2.703 -3.110 0.720 646 HB2 PHE 84 HB2 PHE 84 -3.599 -3.715 3.096 647 HB3 PHE 84 HB1 PHE 84 -4.606 -4.873 2.242 648 HD1 PHE 84 HD2 PHE 84 -1.694 -4.604 0.318 649 HD2 PHE 84 HD1 PHE 84 -3.075 -6.208 4.052 650 HE1 PHE 84 HE2 PHE 84 0.146 -6.261 0.294 651 HE2 PHE 84 HE1 PHE 84 -1.205 -7.847 4.037 652 HZ PHE 84 HZ PHE 84 0.399 -7.868 2.157 653 H ALA 85 HN ALA 85 -2.747 -4.857 -0.884 654 HA ALA 85 HA ALA 85 -5.308 -5.819 -1.815 655 HB1 ALA 85 HB1 ALA 85 -4.955 -4.787 -4.103 656 HB2 ALA 85 HB2 ALA 85 -3.639 -3.849 -3.397 657 HB3 ALA 85 HB3 ALA 85 -5.291 -3.622 -2.822 658 H THR 86 HN THR 86 -4.985 -7.850 -2.543 659 HA THR 86 HA THR 86 -2.798 -8.618 -4.270 660 HB THR 86 HB THR 86 -1.327 -8.715 -2.495 661 HG1 THR 86 HG1 THR 86 -2.726 -11.099 -1.999 662 HG21 THR 86 HG21 THR 86 -3.440 -8.156 -0.892 663 HG22 THR 86 HG22 THR 86 -1.841 -8.553 -0.296 664 HG23 THR 86 HG23 THR 86 -3.076 -9.803 -0.395 665 H GLY 87 HN GLY 87 -2.749 -11.281 -4.031 666 HA2 GLY 87 HA2 GLY 87 -5.048 -12.296 -5.144 667 HA3 GLY 87 HA1 GLY 87 -3.996 -13.280 -4.123 668 H TYR 88 HN TYR 88 -4.435 -11.953 -1.625 669 HA TYR 88 HA TYR 88 -6.797 -13.252 -0.737 670 HB2 TYR 88 HB2 TYR 88 -6.140 -12.454 1.319 671 HB3 TYR 88 HB1 TYR 88 -4.653 -12.160 0.431 672 HD1 TYR 88 HD2 TYR 88 -4.882 -9.754 -0.992 673 HD2 TYR 88 HD1 TYR 88 -6.724 -10.765 2.753 674 HE1 TYR 88 HE2 TYR 88 -5.018 -7.343 -0.401 675 HE2 TYR 88 HE1 TYR 88 -6.846 -8.364 3.345 676 HH TYR 88 HH TYR 88 -6.591 -6.274 2.599 677 H GLY 89 HN GLY 89 -6.312 -10.065 -2.132 678 HA2 GLY 89 HA2 GLY 89 -7.864 -8.453 -2.843 679 HA3 GLY 89 HA1 GLY 89 -8.991 -9.800 -2.988 680 H SER 90 HN SER 90 -7.508 -8.772 0.008 681 HA SER 90 HA SER 90 -8.378 -7.625 1.867 682 HB2 SER 90 HB2 SER 90 -10.023 -6.091 1.438 683 HB3 SER 90 HB1 SER 90 -9.689 -6.533 -0.235 684 HG SER 90 HG SER 90 -11.956 -6.751 1.004 685 H LYS 91 HN LYS 91 -10.330 -7.896 3.420 686 HA LYS 91 HA LYS 91 -12.045 -10.193 3.203 687 HB2 LYS 91 HB2 LYS 91 -10.692 -11.404 5.112 688 HB3 LYS 91 HB1 LYS 91 -10.160 -11.575 3.442 689 HG2 LYS 91 HG2 LYS 91 -8.214 -10.496 3.850 690 HG3 LYS 91 HG1 LYS 91 -9.030 -9.202 4.730 691 HD2 LYS 91 HD2 LYS 91 -9.297 -10.959 6.628 692 HD3 LYS 91 HD1 LYS 91 -8.034 -11.846 5.777 693 HE2 LYS 91 HE2 LYS 91 -7.790 -8.971 6.751 694 HE3 LYS 91 HE1 LYS 91 -7.043 -10.387 7.517 695 HZ1 LYS 91 HZ1 LYS 91 -6.405 -10.676 4.893 696 HZ2 LYS 91 HZ2 LYS 91 -5.373 -10.059 6.093 697 HZ3 LYS 91 HZ3 LYS 91 -6.275 -9.000 5.117 698 H GLY 92 HN GLY 92 -10.326 -9.469 6.187 699 HA2 GLY 92 HA2 GLY 92 -12.811 -8.242 7.260 700 HA3 GLY 92 HA1 GLY 92 -11.478 -8.876 8.236 701 H LEU 93 HN LEU 93 -10.417 -7.184 5.513 702 HA LEU 93 HA LEU 93 -8.800 -5.310 6.662 703 HB2 LEU 93 HB2 LEU 93 -8.812 -5.629 4.320 704 HB3 LEU 93 HB1 LEU 93 -10.537 -5.322 4.196 705 HG LEU 93 HG LEU 93 -8.670 -3.510 3.497 706 HD11 LEU 93 HD11 LEU 93 -10.630 -2.602 2.934 707 HD12 LEU 93 HD12 LEU 93 -10.736 -1.935 4.561 708 HD13 LEU 93 HD13 LEU 93 -11.472 -3.497 4.196 709 HD21 LEU 93 HD21 LEU 93 -7.987 -2.075 5.151 710 HD22 LEU 93 HD22 LEU 93 -8.145 -3.525 6.142 711 HD23 LEU 93 HD23 LEU 93 -9.439 -2.326 6.117 712 H ASP 94 HN ASP 94 -9.575 -4.318 8.545 713 HA ASP 94 HA ASP 94 -11.970 -2.533 8.262 714 HB2 ASP 94 HB2 ASP 94 -11.872 -2.650 10.805 715 HB3 ASP 94 HB1 ASP 94 -12.209 -4.188 10.010 716 H THR 95 HN THR 95 -11.726 -0.333 8.802 717 HA THR 95 HA THR 95 -9.561 0.886 10.140 718 HB THR 95 HB THR 95 -9.038 -0.105 7.411 719 HG1 THR 95 HG1 THR 95 -6.838 0.595 8.387 720 HG21 THR 95 HG21 THR 95 -7.418 1.932 7.083 721 HG22 THR 95 HG22 THR 95 -8.607 2.790 8.050 722 HG23 THR 95 HG23 THR 95 -9.082 2.037 6.532 723 H ARG 96 HN ARG 96 -9.481 3.308 9.606 724 HA ARG 96 HA ARG 96 -12.125 4.407 9.376 725 HB2 ARG 96 HB2 ARG 96 -9.294 5.453 9.362 726 HB3 ARG 96 HB1 ARG 96 -10.673 6.549 9.217 727 HG2 ARG 96 HG2 ARG 96 -10.432 4.512 11.447 728 HG3 ARG 96 HG1 ARG 96 -9.858 6.174 11.595 729 HD2 ARG 96 HD2 ARG 96 -12.588 6.038 10.529 730 HD3 ARG 96 HD1 ARG 96 -12.447 5.331 12.152 731 HE ARG 96 HE ARG 96 -10.966 7.816 11.944 732 HH11 ARG 96 HH21 ARG 96 -13.632 8.673 10.950 733 HH12 ARG 96 HH22 ARG 96 -14.480 9.042 12.415 734 HH21 ARG 96 HH11 ARG 96 -12.257 7.337 14.454 735 HH22 ARG 96 HH12 ARG 96 -13.700 8.293 14.395 736 H TYR 97 HN TYR 97 -10.536 3.043 6.874 737 HA TYR 97 HA TYR 97 -10.845 5.193 4.896 738 HB2 TYR 97 HB2 TYR 97 -9.885 2.325 4.912 739 HB3 TYR 97 HB1 TYR 97 -10.002 3.257 3.426 740 HD1 TYR 97 HD1 TYR 97 -8.890 4.247 6.902 741 HD2 TYR 97 HD2 TYR 97 -7.838 3.830 2.753 742 HE1 TYR 97 HE1 TYR 97 -6.711 5.302 7.357 743 HE2 TYR 97 HE2 TYR 97 -5.648 4.887 3.219 744 HH TYR 97 HH TYR 97 -4.255 5.093 6.000 745 H SER 98 HN SER 98 -13.043 3.299 6.385 746 HA SER 98 HA SER 98 -15.276 2.747 5.824 747 HB2 SER 98 HB2 SER 98 -14.356 4.627 3.831 748 HB3 SER 98 HB1 SER 98 -15.413 3.435 3.082 749 HG SER 98 HG SER 98 -16.066 4.682 5.530 750 H ASN 99 HN ASN 99 -12.617 1.236 4.829 751 HA ASN 99 HA ASN 99 -12.147 -0.740 3.612 752 HB2 ASN 99 HB2 ASN 99 -14.846 -1.115 4.907 753 HB3 ASN 99 HB1 ASN 99 -13.949 -2.445 4.182 754 HD21 ASN 99 HD21 ASN 99 -11.659 -0.278 5.379 755 HD22 ASN 99 HD22 ASN 99 -11.408 -0.995 6.895 756 H ILE 100 HN ILE 100 -12.398 0.421 1.454 757 HA ILE 100 HA ILE 100 -14.440 -0.999 -0.121 758 HB ILE 100 HB ILE 100 -15.040 1.126 -1.339 759 HG12 ILE 100 HG12 ILE 100 -13.118 2.479 -0.451 760 HG13 ILE 100 HG11 ILE 100 -14.691 3.243 -0.301 761 HG21 ILE 100 HG21 ILE 100 -15.779 1.091 1.587 762 HG22 ILE 100 HG22 ILE 100 -16.445 -0.028 0.397 763 HG23 ILE 100 HG23 ILE 100 -16.747 1.703 0.245 764 HD11 ILE 100 HD11 ILE 100 -12.932 2.154 1.846 765 HD12 ILE 100 HD12 ILE 100 -14.670 1.994 2.052 766 HD13 ILE 100 HD13 ILE 100 -13.958 3.586 1.838 767 HA PRO 101 HA PRO 101 -11.094 0.238 -3.130 768 HB2 PRO 101 HB2 PRO 101 -8.902 1.629 -2.348 769 HB3 PRO 101 HB1 PRO 101 -10.437 2.414 -2.757 770 HG2 PRO 101 HG2 PRO 101 -9.158 2.134 -0.161 771 HG3 PRO 101 HG1 PRO 101 -10.486 3.193 -0.653 772 HD2 PRO 101 HD2 PRO 101 -10.599 0.649 0.745 773 HD3 PRO 101 HD1 PRO 101 -11.882 1.830 0.460 774 H LEU 102 HN LEU 102 -11.014 -2.117 -1.612 775 HA LEU 102 HA LEU 102 -8.074 -2.663 -1.439 776 HB2 LEU 102 HB2 LEU 102 -8.873 -4.496 0.231 777 HB3 LEU 102 HB1 LEU 102 -8.829 -2.830 0.781 778 HG LEU 102 HG LEU 102 -10.899 -4.120 1.431 779 HD11 LEU 102 HD11 LEU 102 -10.672 -1.466 0.423 780 HD12 LEU 102 HD12 LEU 102 -11.803 -2.086 1.625 781 HD13 LEU 102 HD13 LEU 102 -12.233 -2.112 -0.080 782 HD21 LEU 102 HD21 LEU 102 -10.973 -5.225 -0.920 783 HD22 LEU 102 HD22 LEU 102 -11.821 -3.758 -1.407 784 HD23 LEU 102 HD23 LEU 102 -12.493 -4.786 -0.144 785 H LEU 103 HN LEU 103 -7.322 -4.574 -2.446 786 HA LEU 103 HA LEU 103 -9.021 -6.688 -3.423 787 HB2 LEU 103 HB2 LEU 103 -9.355 -6.008 -5.728 788 HB3 LEU 103 HB1 LEU 103 -9.943 -4.712 -4.703 789 HG LEU 103 HG LEU 103 -7.281 -4.798 -6.153 790 HD11 LEU 103 HD11 LEU 103 -9.514 -2.789 -6.424 791 HD12 LEU 103 HD12 LEU 103 -9.484 -4.272 -7.378 792 HD13 LEU 103 HD13 LEU 103 -8.180 -3.101 -7.531 793 HD21 LEU 103 HD21 LEU 103 -8.411 -2.875 -4.111 794 HD22 LEU 103 HD22 LEU 103 -7.194 -2.369 -5.284 795 HD23 LEU 103 HD23 LEU 103 -6.824 -3.645 -4.124 796 H THR 104 HN THR 104 -7.553 -6.637 -6.131 797 HA THR 104 HA THR 104 -4.964 -7.659 -5.080 798 HB THR 104 HB THR 104 -6.689 -8.325 -7.480 799 HG1 THR 104 HG1 THR 104 -6.954 -10.161 -6.444 800 HG21 THR 104 HG21 THR 104 -3.887 -8.273 -7.519 801 HG22 THR 104 HG22 THR 104 -4.939 -9.111 -8.652 802 HG23 THR 104 HG23 THR 104 -4.307 -9.959 -7.241 803 H LYS 105 HN LYS 105 -5.283 -7.058 -8.494 804 HA LYS 105 HA LYS 105 -4.059 -4.372 -8.349 805 HB2 LYS 105 HB2 LYS 105 -2.627 -6.914 -9.121 806 HB3 LYS 105 HB1 LYS 105 -2.077 -5.352 -9.709 807 HG2 LYS 105 HG2 LYS 105 -0.912 -5.191 -7.795 808 HG3 LYS 105 HG1 LYS 105 -2.456 -4.906 -7.002 809 HD2 LYS 105 HD2 LYS 105 -1.144 -6.786 -5.968 810 HD3 LYS 105 HD1 LYS 105 -2.717 -7.289 -6.551 811 HE2 LYS 105 HE2 LYS 105 -1.815 -8.369 -8.463 812 HE3 LYS 105 HE1 LYS 105 -0.272 -7.508 -8.316 813 HZ1 LYS 105 HZ1 LYS 105 0.199 -8.651 -6.315 814 HZ2 LYS 105 HZ2 LYS 105 -0.234 -9.825 -7.460 815 HZ3 LYS 105 HZ3 LYS 105 -1.340 -9.353 -6.259 816 HA PRO 106 HA PRO 106 -6.236 -5.823 -12.341 817 HB2 PRO 106 HB2 PRO 106 -8.697 -4.676 -11.951 818 HB3 PRO 106 HB1 PRO 106 -8.333 -6.351 -11.489 819 HG2 PRO 106 HG2 PRO 106 -8.417 -3.899 -9.796 820 HG3 PRO 106 HG1 PRO 106 -9.015 -5.529 -9.446 821 HD2 PRO 106 HD2 PRO 106 -6.677 -4.593 -8.454 822 HD3 PRO 106 HD1 PRO 106 -6.933 -6.309 -8.846 823 H PHE 107 HN PHE 107 -5.563 -3.104 -10.460 824 HA PHE 107 HA PHE 107 -5.220 -0.823 -10.959 825 HB2 PHE 107 HB2 PHE 107 -4.456 -2.472 -13.334 826 HB3 PHE 107 HB1 PHE 107 -4.431 -0.716 -13.508 827 HD1 PHE 107 HD1 PHE 107 -3.835 -2.493 -10.319 828 HD2 PHE 107 HD2 PHE 107 -2.025 -0.447 -13.632 829 HE1 PHE 107 HE1 PHE 107 -1.693 -2.392 -9.079 830 HE2 PHE 107 HE2 PHE 107 0.120 -0.347 -12.393 831 HZ PHE 107 HZ PHE 107 0.288 -1.318 -10.117 832 H LEU 108 HN LEU 108 -5.843 0.914 -12.780 833 HA LEU 108 HA LEU 108 -7.533 1.970 -14.060 834 HB2 LEU 108 HB2 LEU 108 -8.546 0.515 -15.462 835 HB3 LEU 108 HB1 LEU 108 -7.846 -0.796 -14.522 836 HG LEU 108 HG LEU 108 -9.891 -0.506 -12.961 837 HD11 LEU 108 HD11 LEU 108 -11.713 0.728 -13.685 838 HD12 LEU 108 HD12 LEU 108 -11.260 0.592 -15.384 839 HD13 LEU 108 HD13 LEU 108 -10.401 1.714 -14.329 840 HD21 LEU 108 HD21 LEU 108 -10.920 -2.228 -14.093 841 HD22 LEU 108 HD22 LEU 108 -9.395 -2.209 -14.980 842 HD23 LEU 108 HD23 LEU 108 -10.815 -1.406 -15.650 843 H ASP 109 HN ASP 109 -8.578 -0.094 -11.348 844 HA ASP 109 HA ASP 109 -10.123 2.188 -10.254 845 HB2 ASP 109 HB2 ASP 109 -12.087 0.795 -9.984 846 HB3 ASP 109 HB1 ASP 109 -11.585 0.725 -11.674 847 H SER 110 HN SER 110 -7.714 0.119 -9.770 848 HA SER 110 HA SER 110 -8.425 -0.953 -7.119 849 HB2 SER 110 HB2 SER 110 -7.194 -2.210 -8.852 850 HB3 SER 110 HB1 SER 110 -5.894 -1.028 -8.780 851 HG SER 110 HG SER 110 -5.307 -1.774 -6.854 852 H GLU 111 HN GLU 111 -5.132 -0.016 -7.489 853 HA GLU 111 HA GLU 111 -4.648 1.155 -5.095 854 HB2 GLU 111 HB2 GLU 111 -2.897 0.820 -6.667 855 HB3 GLU 111 HB1 GLU 111 -3.668 1.860 -7.863 856 HG2 GLU 111 HG2 GLU 111 -3.117 3.172 -5.279 857 HG3 GLU 111 HG1 GLU 111 -1.677 2.678 -6.171 858 H LEU 112 HN LEU 112 -5.624 3.111 -7.938 859 HA LEU 112 HA LEU 112 -5.782 5.633 -6.813 860 HB2 LEU 112 HB2 LEU 112 -7.999 5.710 -8.291 861 HB3 LEU 112 HB1 LEU 112 -6.407 5.590 -9.027 862 HG LEU 112 HG LEU 112 -7.630 3.004 -8.314 863 HD11 LEU 112 HD11 LEU 112 -8.864 3.493 -10.712 864 HD12 LEU 112 HD12 LEU 112 -9.031 5.052 -9.911 865 HD13 LEU 112 HD13 LEU 112 -9.667 3.596 -9.147 866 HD21 LEU 112 HD21 LEU 112 -6.696 3.854 -11.036 867 HD22 LEU 112 HD22 LEU 112 -6.489 2.303 -10.222 868 HD23 LEU 112 HD23 LEU 112 -5.502 3.687 -9.749 869 H GLU 113 HN GLU 113 -8.660 3.513 -6.904 870 HA GLU 113 HA GLU 113 -10.383 4.835 -5.219 871 HB2 GLU 113 HB2 GLU 113 -9.649 1.930 -5.539 872 HB3 GLU 113 HB1 GLU 113 -11.011 2.430 -4.529 873 HG2 GLU 113 HG2 GLU 113 -11.802 3.785 -6.558 874 HG3 GLU 113 HG1 GLU 113 -10.633 2.854 -7.493 875 H ALA 114 HN ALA 114 -7.578 2.900 -4.238 876 HA ALA 114 HA ALA 114 -8.007 2.913 -1.418 877 HB1 ALA 114 HB1 ALA 114 -6.118 2.050 -3.326 878 HB2 ALA 114 HB2 ALA 114 -6.109 1.692 -1.599 879 HB3 ALA 114 HB3 ALA 114 -5.219 3.084 -2.216 880 H VAL 115 HN VAL 115 -6.652 5.337 -3.601 881 HA VAL 115 HA VAL 115 -6.030 7.096 -1.261 882 HB VAL 115 HB VAL 115 -4.622 8.285 -2.881 883 HG11 VAL 115 HG11 VAL 115 -3.904 5.553 -3.678 884 HG12 VAL 115 HG12 VAL 115 -4.218 5.712 -1.949 885 HG13 VAL 115 HG13 VAL 115 -2.991 6.719 -2.720 886 HG21 VAL 115 HG21 VAL 115 -5.227 6.280 -5.013 887 HG22 VAL 115 HG22 VAL 115 -4.727 7.964 -5.168 888 HG23 VAL 115 HG23 VAL 115 -6.398 7.573 -4.761 889 H LEU 116 HN LEU 116 -8.298 6.631 -3.797 890 HA LEU 116 HA LEU 116 -9.073 9.467 -4.001 891 HB2 LEU 116 HB2 LEU 116 -9.012 7.880 -5.908 892 HB3 LEU 116 HB1 LEU 116 -10.267 6.920 -5.127 893 HG LEU 116 HG LEU 116 -11.215 9.578 -5.129 894 HD11 LEU 116 HD11 LEU 116 -10.205 8.743 -7.865 895 HD12 LEU 116 HD12 LEU 116 -9.458 9.994 -6.871 896 HD13 LEU 116 HD13 LEU 116 -11.100 10.212 -7.477 897 HD21 LEU 116 HD21 LEU 116 -12.781 7.851 -5.335 898 HD22 LEU 116 HD22 LEU 116 -11.842 7.015 -6.572 899 HD23 LEU 116 HD23 LEU 116 -12.729 8.483 -6.981 900 H VAL 117 HN VAL 117 -10.096 6.639 -2.190 901 HA VAL 117 HA VAL 117 -12.811 7.490 -1.683 902 HB VAL 117 HB VAL 117 -11.975 5.173 -1.484 903 HG11 VAL 117 HG11 VAL 117 -9.738 5.556 -0.686 904 HG12 VAL 117 HG12 VAL 117 -10.580 4.649 0.570 905 HG13 VAL 117 HG13 VAL 117 -10.330 6.385 0.753 906 HG21 VAL 117 HG21 VAL 117 -12.643 5.160 1.218 907 HG22 VAL 117 HG22 VAL 117 -13.778 5.053 -0.128 908 HG23 VAL 117 HG23 VAL 117 -13.425 6.616 0.605 909 H GLN 118 HN GLN 118 -9.815 8.699 -0.537 910 HA GLN 118 HA GLN 118 -10.551 9.403 2.164 911 HB2 GLN 118 HB2 GLN 118 -8.600 10.804 0.321 912 HB3 GLN 118 HB1 GLN 118 -8.508 10.651 2.077 913 HG2 GLN 118 HG2 GLN 118 -8.649 8.031 1.367 914 HG3 GLN 118 HG1 GLN 118 -7.795 8.693 -0.026 915 HE21 GLN 118 HE21 GLN 118 -5.596 9.119 0.234 916 HE22 GLN 118 HE22 GLN 118 -4.781 9.098 1.722 917 H ILE 119 HN ILE 119 -11.872 10.503 -0.705 918 HA ILE 119 HA ILE 119 -12.730 13.050 0.610 919 HB ILE 119 HB ILE 119 -12.575 14.051 -1.745 920 HG12 ILE 119 HG12 ILE 119 -10.651 12.766 -3.025 921 HG13 ILE 119 HG11 ILE 119 -11.291 11.367 -2.170 922 HG21 ILE 119 HG21 ILE 119 -10.022 13.104 -0.410 923 HG22 ILE 119 HG22 ILE 119 -10.960 14.520 0.068 924 HG23 ILE 119 HG23 ILE 119 -10.167 14.477 -1.508 925 HD11 ILE 119 HD11 ILE 119 -12.267 12.238 -4.547 926 HD12 ILE 119 HD12 ILE 119 -13.311 13.122 -3.435 927 HD13 ILE 119 HD13 ILE 119 -13.238 11.362 -3.364 928 H SER 120 HN SER 120 -13.545 10.267 -1.286 929 HA SER 120 HA SER 120 -16.282 10.268 -0.817 930 HB2 SER 120 HB2 SER 120 -16.986 11.215 -3.167 931 HB3 SER 120 HB1 SER 120 -16.665 12.334 -1.847 932 HG SER 120 HG SER 120 -15.439 13.101 -3.451 933 H LYS 121 HN LYS 121 -17.486 8.827 -2.418 934 HA LYS 121 HA LYS 121 -15.943 7.434 -4.464 935 HB2 LYS 121 HB2 LYS 121 -15.643 6.709 -1.738 936 HB3 LYS 121 HB1 LYS 121 -16.611 5.442 -2.491 937 HG2 LYS 121 HG2 LYS 121 -14.810 5.603 -4.404 938 HG3 LYS 121 HG1 LYS 121 -13.815 6.317 -3.134 939 HD2 LYS 121 HD2 LYS 121 -13.491 4.314 -2.147 940 HD3 LYS 121 HD1 LYS 121 -15.217 3.957 -2.172 941 HE2 LYS 121 HE2 LYS 121 -14.296 3.782 -4.866 942 HE3 LYS 121 HE1 LYS 121 -13.170 2.856 -3.854 943 HZ1 LYS 121 HZ1 LYS 121 -14.789 1.456 -3.156 944 HZ2 LYS 121 HZ2 LYS 121 -15.490 1.868 -4.647 945 HZ3 LYS 121 HZ3 LYS 121 -16.009 2.632 -3.221 946 H GLU 122 HN GLU 122 -17.233 5.490 -5.262 947 HA GLU 122 HA GLU 122 -19.910 6.120 -5.868 948 HB2 GLU 122 HB2 GLU 122 -20.008 3.638 -6.394 949 HB3 GLU 122 HB1 GLU 122 -18.612 4.462 -7.089 950 HG2 GLU 122 HG2 GLU 122 -17.546 3.766 -4.714 951 HG3 GLU 122 HG1 GLU 122 -18.727 2.470 -4.879 952 H VAL 123 HN VAL 123 -18.484 4.336 -3.190 953 HA VAL 123 HA VAL 123 -20.514 4.951 -1.337 954 HB VAL 123 HB VAL 123 -22.010 3.646 -2.709 955 HG11 VAL 123 HG11 VAL 123 -21.167 2.048 -4.052 956 HG12 VAL 123 HG12 VAL 123 -20.866 1.043 -2.635 957 HG13 VAL 123 HG13 VAL 123 -19.617 2.143 -3.219 958 HG21 VAL 123 HG21 VAL 123 -21.463 1.460 -0.836 959 HG22 VAL 123 HG22 VAL 123 -22.883 2.499 -0.960 960 HG23 VAL 123 HG23 VAL 123 -21.469 3.042 -0.056 Start of MODEL 21 1 H1 GLY 1 HT1 GLY 1 15.670 28.856 10.452 2 H2 GLY 1 HT2 GLY 1 15.034 29.750 9.155 3 H3 GLY 1 HT3 GLY 1 16.619 29.143 9.076 4 HA2 GLY 1 HA2 GLY 1 14.996 27.851 7.741 5 HA3 GLY 1 HA1 GLY 1 15.851 26.903 8.960 6 H SER 2 HN SER 2 12.803 28.575 8.282 7 HA SER 2 HA SER 2 11.504 27.349 10.643 8 HB2 SER 2 HB2 SER 2 10.333 29.034 8.414 9 HB3 SER 2 HB1 SER 2 9.685 28.808 10.033 10 HG SER 2 HG SER 2 11.718 29.769 10.765 11 H HIS 3 HN HIS 3 8.921 27.148 9.206 12 HA HIS 3 HA HIS 3 7.659 25.489 8.101 13 HB2 HIS 3 HB2 HIS 3 10.256 25.573 6.546 14 HB3 HIS 3 HB1 HIS 3 8.871 24.613 6.024 15 HD1 HIS 3 HD1 HIS 3 9.867 28.202 6.722 16 HD2 HIS 3 HD2 HIS 3 6.818 26.090 4.818 17 HE1 HIS 3 HE1 HIS 3 8.461 29.918 5.503 18 H MET 4 HN MET 4 7.246 23.584 9.134 19 HA MET 4 HA MET 4 9.539 21.713 9.646 20 HB2 MET 4 HB2 MET 4 8.549 22.756 11.651 21 HB3 MET 4 HB1 MET 4 6.952 22.183 11.168 22 HG2 MET 4 HG2 MET 4 7.812 19.838 11.269 23 HG3 MET 4 HG1 MET 4 9.343 20.462 11.883 24 HE1 MET 4 HE1 MET 4 5.681 21.086 12.118 25 HE2 MET 4 HE2 MET 4 5.231 20.957 13.815 26 HE3 MET 4 HE3 MET 4 5.597 19.500 12.896 27 H THR 5 HN THR 5 9.284 19.599 8.933 28 HA THR 5 HA THR 5 6.623 18.801 7.803 29 HB THR 5 HB THR 5 7.902 17.759 5.949 30 HG1 THR 5 HG1 THR 5 10.213 18.749 6.023 31 HG21 THR 5 HG21 THR 5 8.495 19.787 4.799 32 HG22 THR 5 HG22 THR 5 8.759 20.638 6.321 33 HG23 THR 5 HG23 THR 5 7.128 20.164 5.847 34 H GLU 6 HN GLU 6 6.432 16.354 7.683 35 HA GLU 6 HA GLU 6 8.274 14.948 9.568 36 HB2 GLU 6 HB2 GLU 6 6.343 14.151 10.836 37 HB3 GLU 6 HB1 GLU 6 6.311 15.916 10.758 38 HG2 GLU 6 HG2 GLU 6 4.408 15.946 9.520 39 HG3 GLU 6 HG1 GLU 6 4.934 14.594 8.514 40 H ARG 7 HN ARG 7 8.331 14.559 6.803 41 HA ARG 7 HA ARG 7 7.939 12.951 5.082 42 HB2 ARG 7 HB2 ARG 7 8.164 11.080 7.443 43 HB3 ARG 7 HB1 ARG 7 8.833 10.878 5.824 44 HG2 ARG 7 HG2 ARG 7 10.215 12.992 6.315 45 HG3 ARG 7 HG1 ARG 7 9.754 12.757 8.002 46 HD2 ARG 7 HD2 ARG 7 10.613 10.332 7.708 47 HD3 ARG 7 HD1 ARG 7 11.413 10.943 6.246 48 HE ARG 7 HE ARG 7 12.164 11.601 8.980 49 HH11 ARG 7 HH21 ARG 7 13.260 11.707 5.894 50 HH12 ARG 7 HH22 ARG 7 13.978 13.281 5.974 51 HH21 ARG 7 HH11 ARG 7 12.544 14.073 9.031 52 HH22 ARG 7 HH12 ARG 7 13.571 14.621 7.749 53 H ARG 8 HN ARG 8 5.616 13.459 4.746 54 HA ARG 8 HA ARG 8 3.702 11.666 6.155 55 HB2 ARG 8 HB2 ARG 8 3.247 14.059 6.070 56 HB3 ARG 8 HB1 ARG 8 3.399 14.054 4.312 57 HG2 ARG 8 HG2 ARG 8 1.232 13.501 4.114 58 HG3 ARG 8 HG1 ARG 8 1.510 12.036 5.055 59 HD2 ARG 8 HD2 ARG 8 1.070 13.179 7.129 60 HD3 ARG 8 HD1 ARG 8 1.071 14.761 6.322 61 HE ARG 8 HE ARG 8 -0.974 12.636 5.786 62 HH11 ARG 8 HH11 ARG 8 -1.308 15.201 7.534 63 HH12 ARG 8 HH12 ARG 8 -2.219 16.188 6.440 64 HH21 ARG 8 HH21 ARG 8 -1.553 14.206 3.675 65 HH22 ARG 8 HH22 ARG 8 -2.361 15.623 4.258 66 H LEU 9 HN LEU 9 5.370 11.798 3.119 67 HA LEU 9 HA LEU 9 3.285 10.047 1.917 68 HB2 LEU 9 HB2 LEU 9 5.309 11.931 0.700 69 HB3 LEU 9 HB1 LEU 9 4.248 10.889 -0.245 70 HG LEU 9 HG LEU 9 3.070 12.917 -0.191 71 HD11 LEU 9 HD11 LEU 9 1.906 11.817 2.338 72 HD12 LEU 9 HD12 LEU 9 1.894 10.803 0.895 73 HD13 LEU 9 HD13 LEU 9 1.089 12.372 0.877 74 HD21 LEU 9 HD21 LEU 9 4.591 13.329 2.212 75 HD22 LEU 9 HD22 LEU 9 2.889 13.654 2.546 76 HD23 LEU 9 HD23 LEU 9 3.713 14.517 1.247 77 H ARG 10 HN ARG 10 4.045 7.956 2.428 78 HA ARG 10 HA ARG 10 6.633 7.208 1.129 79 HB2 ARG 10 HB2 ARG 10 5.671 6.303 3.868 80 HB3 ARG 10 HB1 ARG 10 7.215 5.909 3.114 81 HG2 ARG 10 HG2 ARG 10 7.757 7.684 4.568 82 HG3 ARG 10 HG1 ARG 10 7.581 8.473 3.000 83 HD2 ARG 10 HD2 ARG 10 5.970 9.804 3.880 84 HD3 ARG 10 HD1 ARG 10 4.987 8.365 4.212 85 HE ARG 10 HE ARG 10 6.902 9.613 6.120 86 HH11 ARG 10 HH21 ARG 10 3.814 8.694 6.132 87 HH12 ARG 10 HH22 ARG 10 3.919 7.513 7.395 88 HH21 ARG 10 HH11 ARG 10 7.382 7.432 7.406 89 HH22 ARG 10 HH12 ARG 10 5.932 6.794 8.108 90 H VAL 11 HN VAL 11 6.591 4.876 0.438 91 HA VAL 11 HA VAL 11 4.087 3.409 0.891 92 HB VAL 11 HB VAL 11 3.705 5.231 -0.868 93 HG11 VAL 11 HG11 VAL 11 5.969 4.693 -1.980 94 HG12 VAL 11 HG12 VAL 11 4.589 4.940 -3.050 95 HG13 VAL 11 HG13 VAL 11 5.147 3.305 -2.695 96 HG21 VAL 11 HG21 VAL 11 2.177 3.351 -0.597 97 HG22 VAL 11 HG22 VAL 11 3.241 2.313 -1.546 98 HG23 VAL 11 HG23 VAL 11 2.408 3.662 -2.317 99 H LEU 12 HN LEU 12 4.952 1.419 1.301 100 HA LEU 12 HA LEU 12 7.114 0.415 -0.513 101 HB2 LEU 12 HB2 LEU 12 6.159 -0.711 2.133 102 HB3 LEU 12 HB1 LEU 12 7.697 -1.018 1.330 103 HG LEU 12 HG LEU 12 6.782 1.495 2.730 104 HD11 LEU 12 HD11 LEU 12 9.127 -0.401 2.936 105 HD12 LEU 12 HD12 LEU 12 7.922 -0.027 4.166 106 HD13 LEU 12 HD13 LEU 12 9.125 1.180 3.717 107 HD21 LEU 12 HD21 LEU 12 9.227 2.180 1.791 108 HD22 LEU 12 HD22 LEU 12 7.733 2.595 0.951 109 HD23 LEU 12 HD23 LEU 12 8.665 1.186 0.445 110 H VAL 13 HN VAL 13 5.677 -0.237 -2.227 111 HA VAL 13 HA VAL 13 3.515 -2.180 -1.530 112 HB VAL 13 HB VAL 13 4.172 -0.891 -4.191 113 HG11 VAL 13 HG11 VAL 13 2.204 -1.770 -4.879 114 HG12 VAL 13 HG12 VAL 13 1.386 -1.315 -3.386 115 HG13 VAL 13 HG13 VAL 13 2.319 -2.809 -3.460 116 HG21 VAL 13 HG21 VAL 13 3.978 0.885 -2.500 117 HG22 VAL 13 HG22 VAL 13 2.460 0.191 -1.931 118 HG23 VAL 13 HG23 VAL 13 2.560 0.886 -3.549 119 H VAL 14 HN VAL 14 3.662 -4.325 -2.213 120 HA VAL 14 HA VAL 14 5.845 -5.019 -4.088 121 HB VAL 14 HB VAL 14 6.958 -6.363 -2.505 122 HG11 VAL 14 HG11 VAL 14 5.921 -4.021 -0.910 123 HG12 VAL 14 HG12 VAL 14 7.249 -3.943 -2.068 124 HG13 VAL 14 HG13 VAL 14 7.411 -4.915 -0.605 125 HG21 VAL 14 HG21 VAL 14 4.574 -6.039 -0.684 126 HG22 VAL 14 HG22 VAL 14 6.015 -7.000 -0.349 127 HG23 VAL 14 HG23 VAL 14 4.916 -7.479 -1.644 128 H GLU 15 HN GLU 15 5.544 -6.902 -5.157 129 HA GLU 15 HA GLU 15 3.735 -9.031 -4.500 130 HB2 GLU 15 HB2 GLU 15 1.817 -7.942 -5.125 131 HB3 GLU 15 HB1 GLU 15 2.714 -6.661 -5.944 132 HG2 GLU 15 HG2 GLU 15 1.376 -7.914 -7.568 133 HG3 GLU 15 HG1 GLU 15 3.091 -8.201 -7.866 134 H ASP 16 HN ASP 16 4.011 -10.752 -6.111 135 HA ASP 16 HA ASP 16 6.517 -10.919 -7.390 136 HB2 ASP 16 HB2 ASP 16 5.514 -12.905 -8.469 137 HB3 ASP 16 HB1 ASP 16 5.080 -12.804 -6.763 138 H GLU 17 HN GLU 17 5.841 -8.458 -8.417 139 HA GLU 17 HA GLU 17 5.705 -9.031 -11.316 140 HB2 GLU 17 HB2 GLU 17 3.672 -7.440 -9.737 141 HB3 GLU 17 HB1 GLU 17 3.865 -7.242 -11.478 142 HG2 GLU 17 HG2 GLU 17 3.459 -9.662 -11.792 143 HG3 GLU 17 HG1 GLU 17 3.224 -9.837 -10.052 144 H SER 18 HN SER 18 6.516 -7.248 -12.584 145 HA SER 18 HA SER 18 8.135 -5.292 -11.012 146 HB2 SER 18 HB2 SER 18 9.148 -4.977 -13.357 147 HB3 SER 18 HB1 SER 18 9.390 -6.554 -12.612 148 HG SER 18 HG SER 18 8.640 -6.970 -14.626 149 H MET 19 HN MET 19 5.249 -5.552 -12.829 150 HA MET 19 HA MET 19 5.138 -2.887 -13.945 151 HB2 MET 19 HB2 MET 19 3.778 -5.141 -14.337 152 HB3 MET 19 HB1 MET 19 2.716 -4.449 -13.111 153 HG2 MET 19 HG2 MET 19 1.757 -3.304 -14.813 154 HG3 MET 19 HG1 MET 19 3.207 -2.301 -14.789 155 HE1 MET 19 HE1 MET 19 1.431 -5.426 -16.403 156 HE2 MET 19 HE2 MET 19 1.640 -4.852 -18.054 157 HE3 MET 19 HE3 MET 19 0.888 -3.803 -16.856 158 H ILE 20 HN ILE 20 4.823 -4.157 -10.752 159 HA ILE 20 HA ILE 20 3.084 -2.021 -9.729 160 HB ILE 20 HB ILE 20 3.044 -4.175 -8.659 161 HG12 ILE 20 HG12 ILE 20 4.720 -2.910 -6.604 162 HG13 ILE 20 HG11 ILE 20 3.505 -1.827 -7.293 163 HG21 ILE 20 HG21 ILE 20 6.033 -3.871 -8.662 164 HG22 ILE 20 HG22 ILE 20 5.053 -5.224 -9.228 165 HG23 ILE 20 HG23 ILE 20 5.245 -4.937 -7.498 166 HD11 ILE 20 HD11 ILE 20 1.744 -3.059 -6.479 167 HD12 ILE 20 HD12 ILE 20 2.942 -3.490 -5.259 168 HD13 ILE 20 HD13 ILE 20 2.618 -4.586 -6.602 169 H ALA 21 HN ALA 21 6.416 -2.474 -10.409 170 HA ALA 21 HA ALA 21 7.484 -0.583 -8.489 171 HB1 ALA 21 HB1 ALA 21 8.644 -1.484 -11.133 172 HB2 ALA 21 HB2 ALA 21 8.609 -2.531 -9.713 173 HB3 ALA 21 HB3 ALA 21 9.522 -1.023 -9.674 174 H MET 22 HN MET 22 7.383 -0.383 -12.065 175 HA MET 22 HA MET 22 7.749 2.429 -12.197 176 HB2 MET 22 HB2 MET 22 7.995 1.041 -14.154 177 HB3 MET 22 HB1 MET 22 6.354 0.416 -13.986 178 HG2 MET 22 HG2 MET 22 5.587 2.862 -14.268 179 HG3 MET 22 HG1 MET 22 7.224 3.176 -14.843 180 HE1 MET 22 HE1 MET 22 6.309 3.152 -18.296 181 HE2 MET 22 HE2 MET 22 7.846 2.787 -17.516 182 HE3 MET 22 HE3 MET 22 6.774 3.997 -16.813 183 H LEU 23 HN LEU 23 4.981 0.498 -11.401 184 HA LEU 23 HA LEU 23 2.942 2.522 -11.821 185 HB2 LEU 23 HB2 LEU 23 2.271 0.251 -11.780 186 HB3 LEU 23 HB1 LEU 23 3.238 -0.101 -10.355 187 HG LEU 23 HG LEU 23 0.703 0.033 -10.026 188 HD11 LEU 23 HD11 LEU 23 2.875 0.924 -8.400 189 HD12 LEU 23 HD12 LEU 23 1.340 0.218 -7.892 190 HD13 LEU 23 HD13 LEU 23 1.486 1.964 -8.086 191 HD21 LEU 23 HD21 LEU 23 1.320 2.830 -10.847 192 HD22 LEU 23 HD22 LEU 23 0.204 2.628 -9.499 193 HD23 LEU 23 HD23 LEU 23 -0.155 1.889 -11.057 194 H ILE 24 HN ILE 24 5.523 2.311 -9.669 195 HA ILE 24 HA ILE 24 4.081 3.651 -7.442 196 HB ILE 24 HB ILE 24 5.887 1.641 -7.461 197 HG12 ILE 24 HG12 ILE 24 6.121 3.647 -5.245 198 HG13 ILE 24 HG11 ILE 24 4.539 2.950 -5.586 199 HG21 ILE 24 HG21 ILE 24 8.059 2.612 -6.608 200 HG22 ILE 24 HG22 ILE 24 7.511 4.185 -7.182 201 HG23 ILE 24 HG23 ILE 24 7.771 2.869 -8.326 202 HD11 ILE 24 HD11 ILE 24 5.302 1.345 -4.120 203 HD12 ILE 24 HD12 ILE 24 6.995 1.641 -4.515 204 HD13 ILE 24 HD13 ILE 24 5.990 0.686 -5.605 205 H GLU 25 HN GLU 25 7.031 4.130 -9.438 206 HA GLU 25 HA GLU 25 7.636 6.741 -8.492 207 HB2 GLU 25 HB2 GLU 25 8.158 5.156 -10.993 208 HB3 GLU 25 HB1 GLU 25 8.689 6.836 -10.900 209 HG2 GLU 25 HG2 GLU 25 9.406 5.590 -8.435 210 HG3 GLU 25 HG1 GLU 25 9.922 4.516 -9.738 211 H ASP 26 HN ASP 26 5.246 5.634 -10.837 212 HA ASP 26 HA ASP 26 4.713 8.292 -11.920 213 HB2 ASP 26 HB2 ASP 26 3.073 7.149 -13.193 214 HB3 ASP 26 HB1 ASP 26 4.299 5.912 -12.915 215 H THR 27 HN THR 27 3.072 6.159 -9.542 216 HA THR 27 HA THR 27 1.011 8.035 -8.857 217 HB THR 27 HB THR 27 1.227 6.534 -6.657 218 HG1 THR 27 HG1 THR 27 2.605 4.951 -6.841 219 HG21 THR 27 HG21 THR 27 0.043 6.203 -9.278 220 HG22 THR 27 HG22 THR 27 -0.611 5.763 -7.701 221 HG23 THR 27 HG23 THR 27 0.430 4.636 -8.570 222 H LEU 28 HN LEU 28 4.294 7.444 -7.731 223 HA LEU 28 HA LEU 28 4.297 9.212 -5.474 224 HB2 LEU 28 HB2 LEU 28 6.123 7.808 -5.479 225 HB3 LEU 28 HB1 LEU 28 6.208 7.761 -7.237 226 HG LEU 28 HG LEU 28 6.944 10.267 -5.724 227 HD11 LEU 28 HD11 LEU 28 8.339 8.594 -4.707 228 HD12 LEU 28 HD12 LEU 28 9.331 9.428 -5.903 229 HD13 LEU 28 HD13 LEU 28 8.667 7.835 -6.265 230 HD21 LEU 28 HD21 LEU 28 6.662 9.750 -8.391 231 HD22 LEU 28 HD22 LEU 28 8.369 9.378 -8.166 232 HD23 LEU 28 HD23 LEU 28 7.753 10.975 -7.743 233 H CYS 29 HN CYS 29 4.420 9.740 -8.928 234 HA CYS 29 HA CYS 29 5.688 12.297 -8.986 235 HB2 CYS 29 HB2 CYS 29 5.038 12.252 -11.208 236 HB3 CYS 29 HB1 CYS 29 4.788 10.555 -10.822 237 HG CYS 29 HG CYS 29 2.591 11.426 -11.944 238 H GLU 30 HN GLU 30 2.514 11.259 -8.003 239 HA GLU 30 HA GLU 30 1.330 13.930 -8.014 240 HB2 GLU 30 HB2 GLU 30 0.160 11.723 -8.446 241 HB3 GLU 30 HB1 GLU 30 0.374 11.358 -6.734 242 HG2 GLU 30 HG2 GLU 30 -1.404 12.623 -6.193 243 HG3 GLU 30 HG1 GLU 30 -0.709 14.014 -7.026 244 H LEU 31 HN LEU 31 2.133 11.528 -5.463 245 HA LEU 31 HA LEU 31 1.824 13.559 -3.352 246 HB2 LEU 31 HB2 LEU 31 2.983 10.761 -3.223 247 HB3 LEU 31 HB1 LEU 31 2.291 11.689 -1.891 248 HG LEU 31 HG LEU 31 0.302 11.601 -3.897 249 HD11 LEU 31 HD11 LEU 31 0.484 9.603 -4.929 250 HD12 LEU 31 HD12 LEU 31 0.615 8.782 -3.374 251 HD13 LEU 31 HD13 LEU 31 2.063 9.395 -4.172 252 HD21 LEU 31 HD21 LEU 31 -0.948 10.971 -2.090 253 HD22 LEU 31 HD22 LEU 31 0.526 11.298 -1.180 254 HD23 LEU 31 HD23 LEU 31 0.145 9.650 -1.679 255 H GLY 32 HN GLY 32 4.494 11.785 -4.895 256 HA2 GLY 32 HA2 GLY 32 6.738 12.641 -5.132 257 HA3 GLY 32 HA1 GLY 32 6.390 13.826 -3.862 258 H HIS 33 HN HIS 33 5.541 10.446 -3.651 259 HA HIS 33 HA HIS 33 6.236 9.807 -1.113 260 HB2 HIS 33 HB2 HIS 33 6.546 8.341 -3.725 261 HB3 HIS 33 HB1 HIS 33 6.954 7.536 -2.202 262 HD1 HIS 33 HD1 HIS 33 4.232 7.709 -4.387 263 HD2 HIS 33 HD2 HIS 33 4.546 8.214 -0.263 264 HE1 HIS 33 HE1 HIS 33 1.907 7.365 -3.446 265 H GLU 34 HN GLU 34 8.135 8.915 -0.055 266 HA GLU 34 HA GLU 34 10.702 9.989 -1.166 267 HB2 GLU 34 HB2 GLU 34 9.393 10.425 1.218 268 HB3 GLU 34 HB1 GLU 34 10.544 9.163 1.660 269 HG2 GLU 34 HG2 GLU 34 12.158 10.725 1.752 270 HG3 GLU 34 HG1 GLU 34 11.955 10.988 0.020 271 H VAL 35 HN VAL 35 9.101 7.137 0.152 272 HA VAL 35 HA VAL 35 11.515 5.519 -0.595 273 HB VAL 35 HB VAL 35 9.665 4.961 1.734 274 HG11 VAL 35 HG11 VAL 35 12.518 4.136 1.119 275 HG12 VAL 35 HG12 VAL 35 11.095 3.120 0.886 276 HG13 VAL 35 HG13 VAL 35 11.567 3.619 2.510 277 HG21 VAL 35 HG21 VAL 35 11.764 5.914 3.020 278 HG22 VAL 35 HG22 VAL 35 10.521 7.017 2.428 279 HG23 VAL 35 HG23 VAL 35 12.022 6.811 1.523 280 H ALA 36 HN ALA 36 10.575 4.725 -2.550 281 HA ALA 36 HA ALA 36 7.908 3.462 -2.370 282 HB1 ALA 36 HB1 ALA 36 9.669 3.883 -4.789 283 HB2 ALA 36 HB2 ALA 36 8.635 5.156 -4.141 284 HB3 ALA 36 HB3 ALA 36 7.920 3.666 -4.754 285 H ALA 37 HN ALA 37 7.651 1.240 -2.598 286 HA ALA 37 HA ALA 37 10.138 -0.379 -3.062 287 HB1 ALA 37 HB1 ALA 37 7.716 -1.163 -1.415 288 HB2 ALA 37 HB2 ALA 37 9.100 -0.319 -0.718 289 HB3 ALA 37 HB3 ALA 37 9.308 -1.923 -1.421 290 H THR 38 HN THR 38 9.858 -2.192 -4.447 291 HA THR 38 HA THR 38 7.179 -2.457 -5.758 292 HB THR 38 HB THR 38 8.189 -2.217 -7.885 293 HG1 THR 38 HG1 THR 38 10.059 -3.085 -8.178 294 HG21 THR 38 HG21 THR 38 9.512 -0.137 -7.749 295 HG22 THR 38 HG22 THR 38 9.737 -0.396 -6.019 296 HG23 THR 38 HG23 THR 38 8.126 -0.075 -6.661 297 H ALA 39 HN ALA 39 7.008 -4.467 -7.067 298 HA ALA 39 HA ALA 39 7.044 -6.814 -7.188 299 HB1 ALA 39 HB1 ALA 39 9.931 -6.622 -6.389 300 HB2 ALA 39 HB2 ALA 39 9.396 -6.000 -7.950 301 HB3 ALA 39 HB3 ALA 39 9.180 -7.707 -7.558 302 H SER 40 HN SER 40 7.081 -8.718 -5.798 303 HA SER 40 HA SER 40 6.703 -8.054 -2.988 304 HB2 SER 40 HB2 SER 40 6.107 -10.379 -2.815 305 HB3 SER 40 HB1 SER 40 5.446 -9.769 -4.317 306 HG SER 40 HG SER 40 6.881 -11.850 -4.118 307 H ARG 41 HN ARG 41 8.438 -7.758 -1.633 308 HA ARG 41 HA ARG 41 10.739 -9.614 -1.905 309 HB2 ARG 41 HB2 ARG 41 10.794 -7.100 -2.849 310 HB3 ARG 41 HB1 ARG 41 11.186 -6.760 -1.161 311 HG2 ARG 41 HG2 ARG 41 13.239 -7.128 -2.485 312 HG3 ARG 41 HG1 ARG 41 13.044 -8.373 -1.251 313 HD2 ARG 41 HD2 ARG 41 13.291 -9.880 -2.943 314 HD3 ARG 41 HD1 ARG 41 11.667 -9.396 -3.468 315 HE ARG 41 HE ARG 41 14.005 -7.777 -4.355 316 HH11 ARG 41 HH11 ARG 41 13.326 -10.526 -5.689 317 HH12 ARG 41 HH12 ARG 41 12.453 -9.970 -7.078 318 HH21 ARG 41 HH21 ARG 41 12.018 -6.758 -5.851 319 HH22 ARG 41 HH22 ARG 41 11.715 -7.838 -7.171 320 H MET 42 HN MET 42 10.882 -10.688 0.024 321 HA MET 42 HA MET 42 9.558 -10.017 2.425 322 HB2 MET 42 HB2 MET 42 12.153 -11.536 1.988 323 HB3 MET 42 HB1 MET 42 11.101 -11.685 3.397 324 HG2 MET 42 HG2 MET 42 9.590 -12.975 2.289 325 HG3 MET 42 HG1 MET 42 9.734 -12.035 0.805 326 HE1 MET 42 HE1 MET 42 12.097 -13.879 3.175 327 HE2 MET 42 HE2 MET 42 12.576 -15.322 2.286 328 HE3 MET 42 HE3 MET 42 10.909 -15.141 2.825 329 H GLN 43 HN GLN 43 12.768 -9.064 1.243 330 HA GLN 43 HA GLN 43 13.765 -7.925 3.674 331 HB2 GLN 43 HB2 GLN 43 14.780 -8.455 1.263 332 HB3 GLN 43 HB1 GLN 43 14.387 -6.757 0.985 333 HG2 GLN 43 HG2 GLN 43 16.122 -6.066 2.249 334 HG3 GLN 43 HG1 GLN 43 15.656 -7.132 3.575 335 HE21 GLN 43 HE21 GLN 43 17.793 -7.959 3.999 336 HE22 GLN 43 HE22 GLN 43 18.629 -8.929 2.885 337 H GLU 44 HN GLU 44 12.323 -6.255 0.840 338 HA GLU 44 HA GLU 44 12.046 -3.736 2.191 339 HB2 GLU 44 HB2 GLU 44 10.467 -4.798 -0.166 340 HB3 GLU 44 HB1 GLU 44 10.853 -3.115 0.189 341 HG2 GLU 44 HG2 GLU 44 12.736 -5.306 -0.701 342 HG3 GLU 44 HG1 GLU 44 12.402 -3.767 -1.496 343 H ALA 45 HN ALA 45 9.664 -6.304 1.415 344 HA ALA 45 HA ALA 45 7.319 -5.210 2.427 345 HB1 ALA 45 HB1 ALA 45 7.216 -7.360 1.478 346 HB2 ALA 45 HB2 ALA 45 6.956 -7.693 3.190 347 HB3 ALA 45 HB3 ALA 45 8.544 -7.962 2.470 348 H LEU 46 HN LEU 46 9.620 -7.156 4.349 349 HA LEU 46 HA LEU 46 8.580 -6.864 6.908 350 HB2 LEU 46 HB2 LEU 46 10.541 -8.192 6.403 351 HB3 LEU 46 HB1 LEU 46 11.427 -6.767 5.866 352 HG LEU 46 HG LEU 46 10.662 -6.043 8.406 353 HD11 LEU 46 HD11 LEU 46 11.440 -8.053 9.775 354 HD12 LEU 46 HD12 LEU 46 11.210 -9.014 8.315 355 HD13 LEU 46 HD13 LEU 46 9.837 -8.189 9.053 356 HD21 LEU 46 HD21 LEU 46 13.043 -6.530 8.987 357 HD22 LEU 46 HD22 LEU 46 12.875 -5.701 7.440 358 HD23 LEU 46 HD23 LEU 46 13.192 -7.435 7.480 359 H ASP 47 HN ASP 47 10.603 -4.564 5.109 360 HA ASP 47 HA ASP 47 10.882 -2.611 7.173 361 HB2 ASP 47 HB2 ASP 47 10.791 -2.294 4.156 362 HB3 ASP 47 HB1 ASP 47 11.510 -1.150 5.288 363 H ILE 48 HN ILE 48 8.235 -3.341 4.987 364 HA ILE 48 HA ILE 48 6.876 -0.800 5.469 365 HB ILE 48 HB ILE 48 5.455 -1.477 3.789 366 HG12 ILE 48 HG12 ILE 48 5.646 -4.200 5.057 367 HG13 ILE 48 HG11 ILE 48 4.220 -3.209 4.766 368 HG21 ILE 48 HG21 ILE 48 6.656 -2.606 2.107 369 HG22 ILE 48 HG22 ILE 48 7.549 -3.575 3.277 370 HG23 ILE 48 HG23 ILE 48 7.891 -1.855 3.114 371 HD11 ILE 48 HD11 ILE 48 3.883 -4.521 2.949 372 HD12 ILE 48 HD12 ILE 48 5.527 -5.156 2.996 373 HD13 ILE 48 HD13 ILE 48 5.200 -3.612 2.208 374 H ALA 49 HN ALA 49 7.025 -3.913 7.015 375 HA ALA 49 HA ALA 49 4.481 -3.434 8.428 376 HB1 ALA 49 HB1 ALA 49 4.827 -5.664 7.625 377 HB2 ALA 49 HB2 ALA 49 5.062 -5.740 9.371 378 HB3 ALA 49 HB3 ALA 49 6.458 -5.718 8.292 379 H ARG 50 HN ARG 50 7.676 -4.560 9.584 380 HA ARG 50 HA ARG 50 7.461 -3.951 12.275 381 HB2 ARG 50 HB2 ARG 50 9.607 -4.156 10.259 382 HB3 ARG 50 HB1 ARG 50 10.061 -3.261 11.714 383 HG2 ARG 50 HG2 ARG 50 10.270 -5.193 12.843 384 HG3 ARG 50 HG1 ARG 50 8.578 -5.571 12.516 385 HD2 ARG 50 HD2 ARG 50 9.104 -7.027 10.835 386 HD3 ARG 50 HD1 ARG 50 10.402 -5.989 10.220 387 HE ARG 50 HE ARG 50 10.754 -8.142 12.108 388 HH11 ARG 50 HH11 ARG 50 12.166 -5.472 10.577 389 HH12 ARG 50 HH12 ARG 50 13.535 -5.385 11.633 390 HH21 ARG 50 HH21 ARG 50 12.341 -7.806 13.812 391 HH22 ARG 50 HH22 ARG 50 13.636 -6.709 13.466 392 H LYS 51 HN LYS 51 8.065 -1.673 9.645 393 HA LYS 51 HA LYS 51 8.908 0.600 11.101 394 HB2 LYS 51 HB2 LYS 51 8.930 0.415 8.674 395 HB3 LYS 51 HB1 LYS 51 7.171 0.288 8.637 396 HG2 LYS 51 HG2 LYS 51 7.199 2.537 8.353 397 HG3 LYS 51 HG1 LYS 51 7.555 2.606 10.076 398 HD2 LYS 51 HD2 LYS 51 9.864 2.138 8.261 399 HD3 LYS 51 HD1 LYS 51 9.143 3.747 8.223 400 HE2 LYS 51 HE2 LYS 51 9.577 2.606 10.932 401 HE3 LYS 51 HE1 LYS 51 11.040 3.047 10.028 402 HZ1 LYS 51 HZ1 LYS 51 9.488 5.108 9.435 403 HZ2 LYS 51 HZ2 LYS 51 10.512 5.099 10.789 404 HZ3 LYS 51 HZ3 LYS 51 8.861 4.745 10.967 405 H GLY 52 HN GLY 52 5.588 -0.606 10.496 406 HA2 GLY 52 HA2 GLY 52 3.527 0.217 11.326 407 HA3 GLY 52 HA1 GLY 52 4.432 0.440 12.832 408 H GLN 53 HN GLN 53 5.443 1.983 9.923 409 HA GLN 53 HA GLN 53 4.135 4.545 10.310 410 HB2 GLN 53 HB2 GLN 53 5.651 4.417 12.263 411 HB3 GLN 53 HB1 GLN 53 7.011 4.084 11.194 412 HG2 GLN 53 HG2 GLN 53 7.121 6.408 11.714 413 HG3 GLN 53 HG1 GLN 53 6.510 6.305 10.066 414 HE21 GLN 53 HE21 GLN 53 4.093 6.524 9.798 415 HE22 GLN 53 HE22 GLN 53 3.219 7.427 10.939 416 H PHE 54 HN PHE 54 4.265 3.053 8.059 417 HA PHE 54 HA PHE 54 6.404 4.317 6.367 418 HB2 PHE 54 HB2 PHE 54 6.212 2.175 5.052 419 HB3 PHE 54 HB1 PHE 54 6.742 1.906 6.713 420 HD1 PHE 54 HD1 PHE 54 5.174 0.983 8.408 421 HD2 PHE 54 HD2 PHE 54 4.026 1.517 4.316 422 HE1 PHE 54 HE1 PHE 54 3.171 -0.413 8.788 423 HE2 PHE 54 HE2 PHE 54 2.027 0.122 4.693 424 HZ PHE 54 HZ PHE 54 1.588 -0.847 6.928 425 H ASP 55 HN ASP 55 3.710 5.351 6.917 426 HA ASP 55 HA ASP 55 1.844 6.210 5.819 427 HB2 ASP 55 HB2 ASP 55 3.979 6.837 4.465 428 HB3 ASP 55 HB1 ASP 55 3.357 5.678 3.306 429 H ILE 56 HN ILE 56 2.938 3.893 3.292 430 HA ILE 56 HA ILE 56 0.478 2.256 3.828 431 HB ILE 56 HB ILE 56 1.258 3.728 1.310 432 HG12 ILE 56 HG12 ILE 56 -1.270 3.611 2.983 433 HG13 ILE 56 HG11 ILE 56 -0.115 4.944 2.942 434 HG21 ILE 56 HG21 ILE 56 -0.554 1.348 1.678 435 HG22 ILE 56 HG22 ILE 56 0.680 1.614 0.447 436 HG23 ILE 56 HG23 ILE 56 -0.834 2.514 0.384 437 HD11 ILE 56 HD11 ILE 56 -1.441 5.791 1.305 438 HD12 ILE 56 HD12 ILE 56 -2.227 4.239 1.019 439 HD13 ILE 56 HD13 ILE 56 -0.670 4.588 0.271 440 H ALA 57 HN ALA 57 0.539 0.083 2.822 441 HA ALA 57 HA ALA 57 3.055 -0.772 1.482 442 HB1 ALA 57 HB1 ALA 57 3.690 -0.927 3.802 443 HB2 ALA 57 HB2 ALA 57 3.342 -2.566 3.256 444 HB3 ALA 57 HB3 ALA 57 2.160 -1.692 4.229 445 H ILE 58 HN ILE 58 2.491 -2.385 -0.005 446 HA ILE 58 HA ILE 58 -0.072 -3.845 0.525 447 HB ILE 58 HB ILE 58 0.870 -2.537 -2.038 448 HG12 ILE 58 HG12 ILE 58 -1.324 -1.229 -1.582 449 HG13 ILE 58 HG11 ILE 58 -1.164 -1.820 0.073 450 HG21 ILE 58 HG21 ILE 58 -0.536 -3.980 -3.048 451 HG22 ILE 58 HG22 ILE 58 -1.856 -3.204 -2.174 452 HG23 ILE 58 HG23 ILE 58 -1.067 -4.628 -1.497 453 HD11 ILE 58 HD11 ILE 58 0.363 -0.225 0.506 454 HD12 ILE 58 HD12 ILE 58 0.171 0.388 -1.135 455 HD13 ILE 58 HD13 ILE 58 1.387 -0.841 -0.790 456 H ILE 59 HN ILE 59 0.342 -5.967 0.575 457 HA ILE 59 HA ILE 59 2.481 -7.147 -1.184 458 HB ILE 59 HB ILE 59 0.948 -8.648 0.929 459 HG12 ILE 59 HG12 ILE 59 1.514 -6.478 2.001 460 HG13 ILE 59 HG11 ILE 59 2.437 -7.807 2.698 461 HG21 ILE 59 HG21 ILE 59 2.912 -9.926 1.068 462 HG22 ILE 59 HG22 ILE 59 3.909 -8.632 0.406 463 HG23 ILE 59 HG23 ILE 59 2.807 -9.522 -0.646 464 HD11 ILE 59 HD11 ILE 59 4.158 -6.344 2.347 465 HD12 ILE 59 HD12 ILE 59 3.349 -5.548 0.996 466 HD13 ILE 59 HD13 ILE 59 4.133 -7.110 0.764 467 H ASP 60 HN ASP 60 0.685 -6.609 -2.867 468 HA ASP 60 HA ASP 60 -1.831 -7.953 -2.829 469 HB2 ASP 60 HB2 ASP 60 -1.911 -6.338 -4.416 470 HB3 ASP 60 HB1 ASP 60 -0.163 -6.359 -4.635 471 H VAL 61 HN VAL 61 -2.510 -9.461 -4.505 472 HA VAL 61 HA VAL 61 -2.382 -11.434 -5.696 473 HB VAL 61 HB VAL 61 0.152 -10.407 -5.821 474 HG11 VAL 61 HG11 VAL 61 0.364 -13.293 -4.896 475 HG12 VAL 61 HG12 VAL 61 0.919 -11.894 -3.980 476 HG13 VAL 61 HG13 VAL 61 1.693 -12.312 -5.507 477 HG21 VAL 61 HG21 VAL 61 -1.050 -11.292 -7.712 478 HG22 VAL 61 HG22 VAL 61 -1.018 -12.921 -7.037 479 HG23 VAL 61 HG23 VAL 61 0.475 -12.169 -7.599 480 H ASN 62 HN ASN 62 -3.588 -12.785 -4.509 481 HA ASN 62 HA ASN 62 -2.273 -14.319 -2.298 482 HB2 ASN 62 HB2 ASN 62 -4.642 -12.557 -2.342 483 HB3 ASN 62 HB1 ASN 62 -4.924 -14.115 -1.583 484 HD21 ASN 62 HD21 ASN 62 -2.149 -11.791 -1.583 485 HD22 ASN 62 HD22 ASN 62 -1.965 -11.798 0.105 486 H LEU 63 HN LEU 63 -2.432 -15.186 -4.933 487 HA LEU 63 HA LEU 63 -4.476 -17.360 -4.785 488 HB2 LEU 63 HB2 LEU 63 -4.340 -15.113 -6.564 489 HB3 LEU 63 HB1 LEU 63 -3.957 -16.561 -7.495 490 HG LEU 63 HG LEU 63 -6.021 -17.625 -6.415 491 HD11 LEU 63 HD11 LEU 63 -6.207 -15.913 -4.601 492 HD12 LEU 63 HD12 LEU 63 -7.698 -16.097 -5.520 493 HD13 LEU 63 HD13 LEU 63 -6.643 -14.716 -5.819 494 HD21 LEU 63 HD21 LEU 63 -5.852 -16.648 -8.771 495 HD22 LEU 63 HD22 LEU 63 -6.607 -15.192 -8.122 496 HD23 LEU 63 HD23 LEU 63 -7.478 -16.725 -8.092 497 H ASP 64 HN ASP 64 -3.692 -18.784 -7.012 498 HA ASP 64 HA ASP 64 -2.005 -20.361 -7.600 499 HB2 ASP 64 HB2 ASP 64 -1.084 -17.583 -7.810 500 HB3 ASP 64 HB1 ASP 64 0.253 -18.722 -7.628 501 H GLY 65 HN GLY 65 -2.470 -19.664 -4.628 502 HA2 GLY 65 HA2 GLY 65 -1.176 -21.294 -3.099 503 HA3 GLY 65 HA1 GLY 65 0.235 -20.365 -3.603 504 H GLU 66 HN GLU 66 -1.264 -17.821 -3.618 505 HA GLU 66 HA GLU 66 -1.735 -16.081 -2.090 506 HB2 GLU 66 HB2 GLU 66 -3.555 -17.824 -1.638 507 HB3 GLU 66 HB1 GLU 66 -2.569 -18.359 -0.277 508 HG2 GLU 66 HG2 GLU 66 -2.656 -16.105 0.695 509 HG3 GLU 66 HG1 GLU 66 -3.609 -15.539 -0.677 510 HA PRO 67 HA PRO 67 2.105 -17.018 0.210 511 HB2 PRO 67 HB2 PRO 67 3.645 -15.097 -0.978 512 HB3 PRO 67 HB1 PRO 67 3.428 -16.716 -1.664 513 HG2 PRO 67 HG2 PRO 67 2.270 -14.145 -2.516 514 HG3 PRO 67 HG1 PRO 67 2.612 -15.600 -3.458 515 HD2 PRO 67 HD2 PRO 67 0.102 -14.770 -2.483 516 HD3 PRO 67 HD1 PRO 67 0.497 -16.339 -3.215 517 H SER 68 HN SER 68 2.529 -13.663 -0.607 518 HA SER 68 HA SER 68 2.350 -11.689 0.672 519 HB2 SER 68 HB2 SER 68 0.238 -12.811 2.396 520 HB3 SER 68 HB1 SER 68 0.202 -11.394 1.350 521 HG SER 68 HG SER 68 -0.346 -12.639 -0.335 522 H TYR 69 HN TYR 69 3.489 -14.517 1.959 523 HA TYR 69 HA TYR 69 4.530 -15.144 3.961 524 HB2 TYR 69 HB2 TYR 69 5.404 -12.599 4.875 525 HB3 TYR 69 HB1 TYR 69 6.322 -13.783 3.955 526 HD1 TYR 69 HD1 TYR 69 6.022 -13.760 1.375 527 HD2 TYR 69 HD2 TYR 69 4.868 -10.525 3.950 528 HE1 TYR 69 HE1 TYR 69 6.059 -12.209 -0.559 529 HE2 TYR 69 HE2 TYR 69 4.902 -8.973 2.019 530 HH TYR 69 HH TYR 69 6.420 -9.502 -0.736 531 HA PRO 70 HA PRO 70 2.093 -14.373 7.505 532 HB2 PRO 70 HB2 PRO 70 3.925 -14.380 9.538 533 HB3 PRO 70 HB1 PRO 70 3.450 -15.854 8.669 534 HG2 PRO 70 HG2 PRO 70 5.883 -14.171 8.354 535 HG3 PRO 70 HG1 PRO 70 5.709 -15.932 8.274 536 HD2 PRO 70 HD2 PRO 70 5.927 -14.328 6.072 537 HD3 PRO 70 HD1 PRO 70 5.098 -15.901 6.069 538 H VAL 71 HN VAL 71 4.424 -12.157 6.449 539 HA VAL 71 HA VAL 71 4.130 -10.156 8.552 540 HB VAL 71 HB VAL 71 5.070 -9.847 5.687 541 HG11 VAL 71 HG11 VAL 71 6.675 -8.328 7.327 542 HG12 VAL 71 HG12 VAL 71 5.109 -8.200 8.127 543 HG13 VAL 71 HG13 VAL 71 5.279 -7.715 6.440 544 HG21 VAL 71 HG21 VAL 71 6.857 -11.139 6.140 545 HG22 VAL 71 HG22 VAL 71 6.090 -11.594 7.662 546 HG23 VAL 71 HG23 VAL 71 7.192 -10.218 7.606 547 H ALA 72 HN ALA 72 3.204 -10.175 5.105 548 HA ALA 72 HA ALA 72 1.455 -7.989 5.086 549 HB1 ALA 72 HB1 ALA 72 0.679 -10.459 3.615 550 HB2 ALA 72 HB2 ALA 72 2.316 -9.861 3.340 551 HB3 ALA 72 HB3 ALA 72 0.932 -8.826 3.006 552 H ASP 73 HN ASP 73 0.544 -11.436 5.520 553 HA ASP 73 HA ASP 73 -2.159 -11.112 6.139 554 HB2 ASP 73 HB2 ASP 73 0.028 -12.981 6.861 555 HB3 ASP 73 HB1 ASP 73 -1.461 -13.123 7.785 556 H ILE 74 HN ILE 74 0.546 -11.200 8.470 557 HA ILE 74 HA ILE 74 -0.905 -10.467 10.797 558 HB ILE 74 HB ILE 74 1.929 -10.186 9.807 559 HG12 ILE 74 HG12 ILE 74 0.894 -11.557 12.293 560 HG13 ILE 74 HG11 ILE 74 0.809 -12.340 10.714 561 HG21 ILE 74 HG21 ILE 74 2.291 -9.544 12.376 562 HG22 ILE 74 HG22 ILE 74 0.693 -8.829 12.166 563 HG23 ILE 74 HG23 ILE 74 2.034 -8.306 11.146 564 HD11 ILE 74 HD11 ILE 74 3.099 -11.996 12.470 565 HD12 ILE 74 HD12 ILE 74 3.420 -11.329 10.868 566 HD13 ILE 74 HD13 ILE 74 2.937 -13.017 11.041 567 H LEU 75 HN LEU 75 0.781 -8.482 8.384 568 HA LEU 75 HA LEU 75 0.288 -5.900 9.408 569 HB2 LEU 75 HB2 LEU 75 1.549 -6.982 7.297 570 HB3 LEU 75 HB1 LEU 75 0.078 -6.467 6.474 571 HG LEU 75 HG LEU 75 0.506 -4.195 7.725 572 HD11 LEU 75 HD11 LEU 75 2.443 -4.035 8.868 573 HD12 LEU 75 HD12 LEU 75 3.350 -4.503 7.429 574 HD13 LEU 75 HD13 LEU 75 2.754 -5.739 8.536 575 HD21 LEU 75 HD21 LEU 75 1.059 -5.188 5.181 576 HD22 LEU 75 HD22 LEU 75 2.575 -4.432 5.670 577 HD23 LEU 75 HD23 LEU 75 1.086 -3.489 5.652 578 H ALA 76 HN ALA 76 -1.834 -8.176 7.781 579 HA ALA 76 HA ALA 76 -3.963 -6.163 7.455 580 HB1 ALA 76 HB1 ALA 76 -5.012 -8.482 6.567 581 HB2 ALA 76 HB2 ALA 76 -3.300 -8.894 6.473 582 HB3 ALA 76 HB3 ALA 76 -3.923 -7.507 5.582 583 H GLU 77 HN GLU 77 -2.966 -8.642 9.653 584 HA GLU 77 HA GLU 77 -5.540 -9.348 10.732 585 HB2 GLU 77 HB2 GLU 77 -2.670 -9.482 11.665 586 HB3 GLU 77 HB1 GLU 77 -3.991 -10.040 12.692 587 HG2 GLU 77 HG2 GLU 77 -4.577 -11.200 10.244 588 HG3 GLU 77 HG1 GLU 77 -2.817 -11.304 10.324 589 H ARG 78 HN ARG 78 -3.371 -6.662 11.197 590 HA ARG 78 HA ARG 78 -5.291 -5.488 13.122 591 HB2 ARG 78 HB2 ARG 78 -3.117 -4.560 14.254 592 HB3 ARG 78 HB1 ARG 78 -3.632 -6.207 14.597 593 HG2 ARG 78 HG2 ARG 78 -2.074 -6.711 12.458 594 HG3 ARG 78 HG1 ARG 78 -1.288 -5.243 13.030 595 HD2 ARG 78 HD2 ARG 78 -0.160 -6.759 14.362 596 HD3 ARG 78 HD1 ARG 78 -1.593 -6.554 15.391 597 HE ARG 78 HE ARG 78 -1.550 -8.667 13.275 598 HH11 ARG 78 HH11 ARG 78 -3.813 -8.058 15.310 599 HH12 ARG 78 HH12 ARG 78 -3.587 -9.370 16.417 600 HH21 ARG 78 HH21 ARG 78 -0.425 -10.172 15.238 601 HH22 ARG 78 HH22 ARG 78 -1.667 -10.564 16.381 602 H ASN 79 HN ASN 79 -3.862 -5.225 10.227 603 HA ASN 79 HA ASN 79 -3.044 -3.399 8.892 604 HB2 ASN 79 HB2 ASN 79 -5.793 -2.485 9.727 605 HB3 ASN 79 HB1 ASN 79 -5.046 -2.393 8.132 606 HD21 ASN 79 HD21 ASN 79 -6.400 -4.687 10.510 607 HD22 ASN 79 HD22 ASN 79 -6.696 -5.926 9.388 608 H VAL 80 HN VAL 80 -1.520 -1.974 9.603 609 HA VAL 80 HA VAL 80 -2.152 0.036 11.694 610 HB VAL 80 HB VAL 80 0.070 -1.441 10.868 611 HG11 VAL 80 HG11 VAL 80 0.662 -0.122 8.994 612 HG12 VAL 80 HG12 VAL 80 1.726 0.431 10.286 613 HG13 VAL 80 HG13 VAL 80 0.320 1.386 9.836 614 HG21 VAL 80 HG21 VAL 80 0.966 0.848 12.338 615 HG22 VAL 80 HG22 VAL 80 0.650 -0.785 12.929 616 HG23 VAL 80 HG23 VAL 80 -0.649 0.410 12.901 617 HA PRO 81 HA PRO 81 -3.055 3.346 8.853 618 HB2 PRO 81 HB2 PRO 81 -0.938 5.103 8.828 619 HB3 PRO 81 HB1 PRO 81 -2.177 5.055 10.101 620 HG2 PRO 81 HG2 PRO 81 0.527 3.760 10.061 621 HG3 PRO 81 HG1 PRO 81 -0.234 4.720 11.347 622 HD2 PRO 81 HD2 PRO 81 -0.249 2.087 11.525 623 HD3 PRO 81 HD1 PRO 81 -1.735 2.985 11.917 624 H PHE 82 HN PHE 82 -3.125 2.704 6.750 625 HA PHE 82 HA PHE 82 -0.923 2.897 4.932 626 HB2 PHE 82 HB2 PHE 82 -0.146 0.640 4.853 627 HB3 PHE 82 HB1 PHE 82 -0.233 1.019 6.570 628 HD1 PHE 82 HD2 PHE 82 -3.458 0.950 6.444 629 HD2 PHE 82 HD1 PHE 82 -0.327 -1.785 5.357 630 HE1 PHE 82 HE2 PHE 82 -5.004 -0.940 6.799 631 HE2 PHE 82 HE1 PHE 82 -1.887 -3.683 5.711 632 HZ PHE 82 HZ PHE 82 -4.220 -3.262 6.427 633 H ILE 83 HN ILE 83 -1.507 0.472 3.524 634 HA ILE 83 HA ILE 83 -4.352 0.383 2.912 635 HB ILE 83 HB ILE 83 -2.442 2.094 1.551 636 HG12 ILE 83 HG12 ILE 83 -4.549 2.905 2.436 637 HG13 ILE 83 HG11 ILE 83 -4.582 3.072 0.680 638 HG21 ILE 83 HG21 ILE 83 -2.394 0.205 -0.055 639 HG22 ILE 83 HG22 ILE 83 -3.187 1.620 -0.746 640 HG23 ILE 83 HG23 ILE 83 -4.153 0.268 -0.156 641 HD11 ILE 83 HD11 ILE 83 -6.430 1.677 2.294 642 HD12 ILE 83 HD12 ILE 83 -5.503 0.442 1.439 643 HD13 ILE 83 HD13 ILE 83 -6.351 1.693 0.532 644 H PHE 84 HN PHE 84 -4.752 -1.447 1.476 645 HA PHE 84 HA PHE 84 -2.415 -3.081 0.673 646 HB2 PHE 84 HB2 PHE 84 -3.126 -3.308 3.159 647 HB3 PHE 84 HB1 PHE 84 -4.513 -4.185 2.521 648 HD1 PHE 84 HD1 PHE 84 -4.031 -6.180 0.934 649 HD2 PHE 84 HD2 PHE 84 -1.063 -4.407 3.489 650 HE1 PHE 84 HE1 PHE 84 -2.681 -8.257 0.814 651 HE2 PHE 84 HE2 PHE 84 0.279 -6.485 3.359 652 HZ PHE 84 HZ PHE 84 -0.532 -8.402 2.011 653 H ALA 85 HN ALA 85 -3.036 -4.898 -0.656 654 HA ALA 85 HA ALA 85 -5.849 -5.205 -1.379 655 HB1 ALA 85 HB1 ALA 85 -4.922 -4.782 -3.877 656 HB2 ALA 85 HB2 ALA 85 -3.824 -3.726 -2.988 657 HB3 ALA 85 HB3 ALA 85 -5.567 -3.477 -2.883 658 H THR 86 HN THR 86 -6.173 -7.116 -2.728 659 HA THR 86 HA THR 86 -4.226 -8.769 -3.893 660 HB THR 86 HB THR 86 -2.991 -9.060 -1.936 661 HG1 THR 86 HG1 THR 86 -4.697 -11.013 -1.089 662 HG21 THR 86 HG21 THR 86 -4.093 -7.849 -0.267 663 HG22 THR 86 HG22 THR 86 -4.352 -9.496 0.300 664 HG23 THR 86 HG23 THR 86 -5.635 -8.650 -0.564 665 H GLY 87 HN GLY 87 -5.022 -11.259 -3.638 666 HA2 GLY 87 HA2 GLY 87 -7.693 -11.354 -4.627 667 HA3 GLY 87 HA1 GLY 87 -6.770 -12.759 -4.082 668 H TYR 88 HN TYR 88 -6.530 -11.152 -1.400 669 HA TYR 88 HA TYR 88 -8.821 -12.470 -0.144 670 HB2 TYR 88 HB2 TYR 88 -6.595 -12.392 0.887 671 HB3 TYR 88 HB1 TYR 88 -6.635 -10.630 0.884 672 HD1 TYR 88 HD2 TYR 88 -9.527 -12.836 1.614 673 HD2 TYR 88 HD1 TYR 88 -6.515 -10.245 3.244 674 HE1 TYR 88 HE2 TYR 88 -10.692 -12.859 3.803 675 HE2 TYR 88 HE1 TYR 88 -7.676 -10.267 5.433 676 HH TYR 88 HH TYR 88 -10.738 -12.049 5.870 677 H GLY 89 HN GLY 89 -7.932 -9.182 -1.078 678 HA2 GLY 89 HA2 GLY 89 -9.500 -7.408 -1.439 679 HA3 GLY 89 HA1 GLY 89 -10.712 -8.329 -0.548 680 H SER 90 HN SER 90 -7.886 -8.465 1.190 681 HA SER 90 HA SER 90 -7.040 -7.266 3.046 682 HB2 SER 90 HB2 SER 90 -7.875 -5.381 1.224 683 HB3 SER 90 HB1 SER 90 -8.805 -4.940 2.654 684 HG SER 90 HG SER 90 -6.439 -4.204 2.259 685 H LYS 91 HN LYS 91 -10.278 -8.149 2.593 686 HA LYS 91 HA LYS 91 -11.960 -8.693 4.158 687 HB2 LYS 91 HB2 LYS 91 -10.779 -9.709 5.804 688 HB3 LYS 91 HB1 LYS 91 -9.395 -8.661 5.524 689 HG2 LYS 91 HG2 LYS 91 -10.203 -7.023 7.062 690 HG3 LYS 91 HG1 LYS 91 -11.805 -7.761 7.120 691 HD2 LYS 91 HD2 LYS 91 -11.134 -8.990 8.881 692 HD3 LYS 91 HD1 LYS 91 -9.953 -9.785 7.841 693 HE2 LYS 91 HE2 LYS 91 -8.205 -8.482 8.602 694 HE3 LYS 91 HE1 LYS 91 -9.242 -7.069 8.875 695 HZ1 LYS 91 HZ1 LYS 91 -9.864 -7.798 10.902 696 HZ2 LYS 91 HZ2 LYS 91 -8.411 -8.676 10.838 697 HZ3 LYS 91 HZ3 LYS 91 -9.881 -9.429 10.440 698 H GLY 92 HN GLY 92 -10.085 -5.987 5.530 699 HA2 GLY 92 HA2 GLY 92 -11.823 -3.872 4.984 700 HA3 GLY 92 HA1 GLY 92 -12.399 -4.578 6.500 701 H LEU 93 HN LEU 93 -9.118 -4.186 5.188 702 HA LEU 93 HA LEU 93 -7.563 -3.831 7.350 703 HB2 LEU 93 HB2 LEU 93 -6.114 -2.681 5.939 704 HB3 LEU 93 HB1 LEU 93 -7.221 -3.398 4.772 705 HG LEU 93 HG LEU 93 -7.402 -0.574 5.870 706 HD11 LEU 93 HD11 LEU 93 -7.096 -0.439 3.135 707 HD12 LEU 93 HD12 LEU 93 -6.053 -1.797 3.560 708 HD13 LEU 93 HD13 LEU 93 -5.796 -0.220 4.306 709 HD21 LEU 93 HD21 LEU 93 -8.963 -1.794 3.581 710 HD22 LEU 93 HD22 LEU 93 -9.258 -0.259 4.398 711 HD23 LEU 93 HD23 LEU 93 -9.583 -1.777 5.229 712 H ASP 94 HN ASP 94 -7.615 -2.651 9.182 713 HA ASP 94 HA ASP 94 -9.374 -0.247 9.279 714 HB2 ASP 94 HB2 ASP 94 -9.112 -0.655 11.770 715 HB3 ASP 94 HB1 ASP 94 -9.861 -1.982 10.881 716 H THR 95 HN THR 95 -8.540 1.768 9.807 717 HA THR 95 HA THR 95 -5.944 2.191 10.950 718 HB THR 95 HB THR 95 -6.014 1.217 8.326 719 HG1 THR 95 HG1 THR 95 -3.764 1.718 8.466 720 HG21 THR 95 HG21 THR 95 -4.904 3.015 7.020 721 HG22 THR 95 HG22 THR 95 -5.291 4.154 8.301 722 HG23 THR 95 HG23 THR 95 -6.584 3.373 7.390 723 H ARG 96 HN ARG 96 -5.189 4.590 10.148 724 HA ARG 96 HA ARG 96 -7.229 6.411 11.023 725 HB2 ARG 96 HB2 ARG 96 -4.476 6.522 9.840 726 HB3 ARG 96 HB1 ARG 96 -5.404 8.019 9.939 727 HG2 ARG 96 HG2 ARG 96 -5.736 6.727 12.431 728 HG3 ARG 96 HG1 ARG 96 -4.017 6.628 12.043 729 HD2 ARG 96 HD2 ARG 96 -4.673 9.227 11.299 730 HD3 ARG 96 HD1 ARG 96 -5.601 8.975 12.791 731 HE ARG 96 HE ARG 96 -3.555 8.648 13.973 732 HH11 ARG 96 HH11 ARG 96 -3.099 8.409 10.570 733 HH12 ARG 96 HH12 ARG 96 -1.396 8.709 10.639 734 HH21 ARG 96 HH21 ARG 96 -1.351 9.208 14.070 735 HH22 ARG 96 HH22 ARG 96 -0.406 9.161 12.619 736 H TYR 97 HN TYR 97 -7.173 4.868 8.114 737 HA TYR 97 HA TYR 97 -7.703 7.137 6.376 738 HB2 TYR 97 HB2 TYR 97 -7.757 4.115 6.141 739 HB3 TYR 97 HB1 TYR 97 -8.151 5.167 4.782 740 HD1 TYR 97 HD2 TYR 97 -5.760 6.608 7.100 741 HD2 TYR 97 HD1 TYR 97 -6.090 4.010 3.688 742 HE1 TYR 97 HE2 TYR 97 -3.367 6.928 6.635 743 HE2 TYR 97 HE1 TYR 97 -3.681 4.349 3.225 744 HH TYR 97 HH TYR 97 -1.940 6.576 4.021 745 H SER 98 HN SER 98 -9.727 4.256 7.112 746 HA SER 98 HA SER 98 -11.953 5.113 8.341 747 HB2 SER 98 HB2 SER 98 -11.742 6.538 5.725 748 HB3 SER 98 HB1 SER 98 -13.348 6.023 6.237 749 HG SER 98 HG SER 98 -11.730 7.224 8.156 750 H ASN 99 HN ASN 99 -10.835 2.621 7.202 751 HA ASN 99 HA ASN 99 -11.600 0.619 6.113 752 HB2 ASN 99 HB2 ASN 99 -13.870 1.882 7.644 753 HB3 ASN 99 HB1 ASN 99 -14.153 0.392 6.750 754 HD21 ASN 99 HD21 ASN 99 -10.916 0.387 7.756 755 HD22 ASN 99 HD22 ASN 99 -11.116 -0.521 9.171 756 H ILE 100 HN ILE 100 -11.359 1.379 3.838 757 HA ILE 100 HA ILE 100 -13.843 1.310 2.387 758 HB ILE 100 HB ILE 100 -13.304 3.776 1.474 759 HG12 ILE 100 HG12 ILE 100 -13.089 4.987 3.909 760 HG13 ILE 100 HG11 ILE 100 -11.974 3.645 4.119 761 HG21 ILE 100 HG21 ILE 100 -15.278 2.549 2.987 762 HG22 ILE 100 HG22 ILE 100 -15.370 4.152 2.258 763 HG23 ILE 100 HG23 ILE 100 -14.848 3.974 3.932 764 HD11 ILE 100 HD11 ILE 100 -11.754 6.012 2.381 765 HD12 ILE 100 HD12 ILE 100 -11.355 4.492 1.580 766 HD13 ILE 100 HD13 ILE 100 -10.486 4.974 3.036 767 HA PRO 101 HA PRO 101 -10.406 1.846 -0.761 768 HB2 PRO 101 HB2 PRO 101 -7.894 2.560 0.035 769 HB3 PRO 101 HB1 PRO 101 -9.204 3.727 -0.205 770 HG2 PRO 101 HG2 PRO 101 -7.930 2.907 2.263 771 HG3 PRO 101 HG1 PRO 101 -9.072 4.226 1.987 772 HD2 PRO 101 HD2 PRO 101 -9.567 1.528 3.015 773 HD3 PRO 101 HD1 PRO 101 -10.586 2.971 3.120 774 H LEU 102 HN LEU 102 -10.574 -0.570 -0.761 775 HA LEU 102 HA LEU 102 -7.918 -1.807 -0.403 776 HB2 LEU 102 HB2 LEU 102 -9.088 -3.750 0.855 777 HB3 LEU 102 HB1 LEU 102 -8.732 -2.283 1.755 778 HG LEU 102 HG LEU 102 -11.048 -3.266 2.117 779 HD11 LEU 102 HD11 LEU 102 -10.185 -0.666 2.091 780 HD12 LEU 102 HD12 LEU 102 -11.766 -1.193 2.672 781 HD13 LEU 102 HD13 LEU 102 -11.586 -0.594 1.024 782 HD21 LEU 102 HD21 LEU 102 -11.258 -3.691 -0.449 783 HD22 LEU 102 HD22 LEU 102 -11.759 -2.000 -0.518 784 HD23 LEU 102 HD23 LEU 102 -12.682 -3.157 0.443 785 H LEU 103 HN LEU 103 -7.677 -3.782 -1.663 786 HA LEU 103 HA LEU 103 -9.823 -5.082 -3.061 787 HB2 LEU 103 HB2 LEU 103 -9.424 -3.897 -5.309 788 HB3 LEU 103 HB1 LEU 103 -10.299 -2.980 -4.094 789 HG LEU 103 HG LEU 103 -7.958 -2.073 -3.405 790 HD11 LEU 103 HD11 LEU 103 -7.433 -3.374 -6.073 791 HD12 LEU 103 HD12 LEU 103 -6.464 -3.452 -4.600 792 HD13 LEU 103 HD13 LEU 103 -6.503 -1.968 -5.553 793 HD21 LEU 103 HD21 LEU 103 -9.622 -1.383 -5.790 794 HD22 LEU 103 HD22 LEU 103 -8.083 -0.545 -5.589 795 HD23 LEU 103 HD23 LEU 103 -9.314 -0.445 -4.328 796 H THR 104 HN THR 104 -8.430 -5.335 -5.664 797 HA THR 104 HA THR 104 -6.028 -6.829 -4.743 798 HB THR 104 HB THR 104 -7.483 -8.470 -5.541 799 HG1 THR 104 HG1 THR 104 -6.028 -9.053 -6.911 800 HG21 THR 104 HG21 THR 104 -8.720 -7.890 -7.844 801 HG22 THR 104 HG22 THR 104 -8.527 -6.250 -7.233 802 HG23 THR 104 HG23 THR 104 -9.402 -7.445 -6.281 803 H LYS 105 HN LYS 105 -6.401 -6.650 -8.151 804 HA LYS 105 HA LYS 105 -4.897 -4.126 -8.412 805 HB2 LYS 105 HB2 LYS 105 -3.492 -6.367 -7.778 806 HB3 LYS 105 HB1 LYS 105 -3.446 -6.439 -9.542 807 HG2 LYS 105 HG2 LYS 105 -1.940 -4.766 -9.612 808 HG3 LYS 105 HG1 LYS 105 -3.016 -3.722 -8.684 809 HD2 LYS 105 HD2 LYS 105 -1.950 -4.144 -6.720 810 HD3 LYS 105 HD1 LYS 105 -1.699 -5.840 -7.116 811 HE2 LYS 105 HE2 LYS 105 -0.112 -3.573 -8.370 812 HE3 LYS 105 HE1 LYS 105 0.458 -4.555 -7.007 813 HZ1 LYS 105 HZ1 LYS 105 0.701 -6.375 -8.294 814 HZ2 LYS 105 HZ2 LYS 105 0.836 -5.248 -9.555 815 HZ3 LYS 105 HZ3 LYS 105 -0.646 -6.023 -9.260 816 HA PRO 106 HA PRO 106 -7.201 -5.682 -12.204 817 HB2 PRO 106 HB2 PRO 106 -9.321 -3.948 -12.098 818 HB3 PRO 106 HB1 PRO 106 -9.359 -5.552 -11.336 819 HG2 PRO 106 HG2 PRO 106 -8.898 -2.882 -10.104 820 HG3 PRO 106 HG1 PRO 106 -9.797 -4.272 -9.477 821 HD2 PRO 106 HD2 PRO 106 -7.272 -3.617 -8.668 822 HD3 PRO 106 HD1 PRO 106 -7.917 -5.270 -8.637 823 H PHE 107 HN PHE 107 -6.503 -2.599 -10.706 824 HA PHE 107 HA PHE 107 -5.434 -0.678 -11.505 825 HB2 PHE 107 HB2 PHE 107 -4.886 -2.769 -13.534 826 HB3 PHE 107 HB1 PHE 107 -4.584 -1.103 -14.023 827 HD1 PHE 107 HD2 PHE 107 -3.565 0.320 -11.855 828 HD2 PHE 107 HD1 PHE 107 -2.997 -3.850 -12.720 829 HE1 PHE 107 HE2 PHE 107 -1.484 0.325 -10.513 830 HE2 PHE 107 HE1 PHE 107 -0.915 -3.844 -11.372 831 HZ PHE 107 HZ PHE 107 -0.155 -1.755 -10.272 832 H LEU 108 HN LEU 108 -8.062 -2.028 -13.452 833 HA LEU 108 HA LEU 108 -8.403 0.544 -14.846 834 HB2 LEU 108 HB2 LEU 108 -10.393 -0.675 -15.860 835 HB3 LEU 108 HB1 LEU 108 -8.825 -1.399 -16.175 836 HG LEU 108 HG LEU 108 -10.894 -2.869 -15.424 837 HD11 LEU 108 HD11 LEU 108 -8.812 -4.005 -13.906 838 HD12 LEU 108 HD12 LEU 108 -8.034 -3.108 -15.211 839 HD13 LEU 108 HD13 LEU 108 -9.229 -4.349 -15.586 840 HD21 LEU 108 HD21 LEU 108 -9.722 -1.987 -12.769 841 HD22 LEU 108 HD22 LEU 108 -10.862 -3.310 -12.998 842 HD23 LEU 108 HD23 LEU 108 -11.351 -1.655 -13.349 843 H ASP 109 HN ASP 109 -9.029 -0.371 -11.793 844 HA ASP 109 HA ASP 109 -10.954 1.736 -11.323 845 HB2 ASP 109 HB2 ASP 109 -12.937 0.496 -11.044 846 HB3 ASP 109 HB1 ASP 109 -12.205 -0.236 -12.472 847 H SER 110 HN SER 110 -8.532 -0.136 -10.124 848 HA SER 110 HA SER 110 -9.606 -0.222 -7.339 849 HB2 SER 110 HB2 SER 110 -7.584 -1.686 -8.956 850 HB3 SER 110 HB1 SER 110 -7.259 -1.523 -7.235 851 HG SER 110 HG SER 110 -9.687 -2.471 -8.367 852 H GLU 111 HN GLU 111 -6.334 0.269 -8.686 853 HA GLU 111 HA GLU 111 -5.071 1.664 -6.713 854 HB2 GLU 111 HB2 GLU 111 -4.038 1.178 -8.836 855 HB3 GLU 111 HB1 GLU 111 -5.184 2.206 -9.694 856 HG2 GLU 111 HG2 GLU 111 -3.365 3.637 -9.554 857 HG3 GLU 111 HG1 GLU 111 -4.217 4.072 -8.072 858 H LEU 112 HN LEU 112 -7.351 3.126 -9.032 859 HA LEU 112 HA LEU 112 -7.204 5.807 -8.125 860 HB2 LEU 112 HB2 LEU 112 -9.662 5.776 -9.018 861 HB3 LEU 112 HB1 LEU 112 -8.352 5.406 -10.136 862 HG LEU 112 HG LEU 112 -9.191 3.001 -8.777 863 HD11 LEU 112 HD11 LEU 112 -11.370 4.218 -10.467 864 HD12 LEU 112 HD12 LEU 112 -11.333 4.478 -8.722 865 HD13 LEU 112 HD13 LEU 112 -11.464 2.842 -9.368 866 HD21 LEU 112 HD21 LEU 112 -8.101 3.678 -11.163 867 HD22 LEU 112 HD22 LEU 112 -9.781 3.459 -11.652 868 HD23 LEU 112 HD23 LEU 112 -8.908 2.135 -10.880 869 H GLU 113 HN GLU 113 -9.240 3.116 -6.940 870 HA GLU 113 HA GLU 113 -10.857 4.529 -5.099 871 HB2 GLU 113 HB2 GLU 113 -10.776 2.049 -5.893 872 HB3 GLU 113 HB1 GLU 113 -9.660 1.819 -4.543 873 HG2 GLU 113 HG2 GLU 113 -11.367 1.797 -3.075 874 HG3 GLU 113 HG1 GLU 113 -11.946 3.354 -3.670 875 H ALA 114 HN ALA 114 -7.938 2.667 -4.163 876 HA ALA 114 HA ALA 114 -7.642 3.487 -1.555 877 HB1 ALA 114 HB1 ALA 114 -5.140 3.604 -3.111 878 HB2 ALA 114 HB2 ALA 114 -6.136 2.188 -3.454 879 HB3 ALA 114 HB3 ALA 114 -5.599 2.511 -1.805 880 H VAL 115 HN VAL 115 -6.761 5.436 -4.419 881 HA VAL 115 HA VAL 115 -5.864 7.633 -2.612 882 HB VAL 115 HB VAL 115 -5.818 7.637 -5.629 883 HG11 VAL 115 HG11 VAL 115 -4.884 9.626 -5.027 884 HG12 VAL 115 HG12 VAL 115 -3.452 8.646 -4.711 885 HG13 VAL 115 HG13 VAL 115 -4.535 9.077 -3.388 886 HG21 VAL 115 HG21 VAL 115 -3.415 6.638 -5.195 887 HG22 VAL 115 HG22 VAL 115 -4.798 5.551 -5.313 888 HG23 VAL 115 HG23 VAL 115 -4.155 5.993 -3.731 889 H LEU 116 HN LEU 116 -8.602 6.674 -4.454 890 HA LEU 116 HA LEU 116 -9.616 9.437 -4.796 891 HB2 LEU 116 HB2 LEU 116 -9.767 7.658 -6.557 892 HB3 LEU 116 HB1 LEU 116 -10.841 6.753 -5.489 893 HG LEU 116 HG LEU 116 -11.819 9.425 -5.613 894 HD11 LEU 116 HD11 LEU 116 -10.535 9.678 -7.691 895 HD12 LEU 116 HD12 LEU 116 -12.259 9.601 -8.051 896 HD13 LEU 116 HD13 LEU 116 -11.238 8.189 -8.323 897 HD21 LEU 116 HD21 LEU 116 -13.816 8.344 -6.127 898 HD22 LEU 116 HD22 LEU 116 -12.903 7.010 -5.423 899 HD23 LEU 116 HD23 LEU 116 -13.027 7.166 -7.176 900 H VAL 117 HN VAL 117 -9.676 7.035 -2.419 901 HA VAL 117 HA VAL 117 -12.416 7.536 -1.462 902 HB VAL 117 HB VAL 117 -11.644 5.964 0.324 903 HG11 VAL 117 HG11 VAL 117 -10.738 4.194 -1.491 904 HG12 VAL 117 HG12 VAL 117 -11.376 5.419 -2.587 905 HG13 VAL 117 HG13 VAL 117 -12.434 4.665 -1.394 906 HG21 VAL 117 HG21 VAL 117 -9.433 5.380 0.599 907 HG22 VAL 117 HG22 VAL 117 -9.209 7.011 -0.026 908 HG23 VAL 117 HG23 VAL 117 -9.045 5.626 -1.103 909 H GLN 118 HN GLN 118 -9.458 9.162 -1.233 910 HA GLN 118 HA GLN 118 -9.928 10.155 1.522 911 HB2 GLN 118 HB2 GLN 118 -7.737 10.931 -0.413 912 HB3 GLN 118 HB1 GLN 118 -7.692 10.967 1.349 913 HG2 GLN 118 HG2 GLN 118 -7.620 8.583 1.494 914 HG3 GLN 118 HG1 GLN 118 -8.039 8.399 -0.208 915 HE21 GLN 118 HE21 GLN 118 -6.283 10.209 -1.445 916 HE22 GLN 118 HE22 GLN 118 -4.679 9.728 -1.160 917 H ILE 119 HN ILE 119 -11.188 10.958 -1.403 918 HA ILE 119 HA ILE 119 -10.982 13.904 -0.924 919 HB ILE 119 HB ILE 119 -11.914 13.896 -3.345 920 HG12 ILE 119 HG12 ILE 119 -11.587 11.871 -4.610 921 HG13 ILE 119 HG11 ILE 119 -10.853 11.058 -3.231 922 HG21 ILE 119 HG21 ILE 119 -9.197 13.026 -2.418 923 HG22 ILE 119 HG22 ILE 119 -9.688 14.551 -3.155 924 HG23 ILE 119 HG23 ILE 119 -9.533 13.101 -4.147 925 HD11 ILE 119 HD11 ILE 119 -13.662 12.132 -3.052 926 HD12 ILE 119 HD12 ILE 119 -12.905 10.852 -2.104 927 HD13 ILE 119 HD13 ILE 119 -13.350 10.559 -3.784 928 H SER 120 HN SER 120 -13.035 11.369 -0.297 929 HA SER 120 HA SER 120 -15.291 13.123 0.293 930 HB2 SER 120 HB2 SER 120 -15.274 11.270 -2.101 931 HB3 SER 120 HB1 SER 120 -16.773 11.835 -1.368 932 HG SER 120 HG SER 120 -15.955 13.987 -1.700 933 H LYS 121 HN LYS 121 -16.336 12.160 2.015 934 HA LYS 121 HA LYS 121 -16.364 9.180 2.191 935 HB2 LYS 121 HB2 LYS 121 -14.372 9.891 3.359 936 HB3 LYS 121 HB1 LYS 121 -15.260 11.160 4.205 937 HG2 LYS 121 HG2 LYS 121 -16.190 9.701 5.706 938 HG3 LYS 121 HG1 LYS 121 -16.307 8.398 4.523 939 HD2 LYS 121 HD2 LYS 121 -14.615 8.005 6.371 940 HD3 LYS 121 HD1 LYS 121 -13.969 7.882 4.736 941 HE2 LYS 121 HE2 LYS 121 -12.395 9.220 5.970 942 HE3 LYS 121 HE1 LYS 121 -13.317 10.367 4.979 943 HZ1 LYS 121 HZ1 LYS 121 -13.442 9.881 7.855 944 HZ2 LYS 121 HZ2 LYS 121 -14.915 10.199 7.069 945 HZ3 LYS 121 HZ3 LYS 121 -13.646 11.327 6.995 946 H GLU 122 HN GLU 122 -17.301 12.116 4.034 947 HA GLU 122 HA GLU 122 -20.129 11.247 3.978 948 HB2 GLU 122 HB2 GLU 122 -20.102 11.454 6.553 949 HB3 GLU 122 HB1 GLU 122 -19.381 10.005 5.858 950 HG2 GLU 122 HG2 GLU 122 -17.431 10.501 6.859 951 HG3 GLU 122 HG1 GLU 122 -17.350 12.005 5.944 952 H VAL 123 HN VAL 123 -18.724 13.541 2.914 953 HA VAL 123 HA VAL 123 -18.681 15.896 4.398 954 HB VAL 123 HB VAL 123 -18.047 15.660 2.031 955 HG11 VAL 123 HG11 VAL 123 -19.462 14.889 0.433 956 HG12 VAL 123 HG12 VAL 123 -20.788 15.906 0.997 957 HG13 VAL 123 HG13 VAL 123 -20.469 14.358 1.780 958 HG21 VAL 123 HG21 VAL 123 -19.173 17.852 3.187 959 HG22 VAL 123 HG22 VAL 123 -20.246 17.638 1.803 960 HG23 VAL 123 HG23 VAL 123 -18.513 17.848 1.550 Start of MODEL 22 1 H1 GLY 1 HT1 GLY 1 23.103 11.301 16.181 2 H2 GLY 1 HT2 GLY 1 24.081 12.272 15.188 3 H3 GLY 1 HT3 GLY 1 24.008 10.594 14.933 4 HA2 GLY 1 HA2 GLY 1 22.574 11.207 13.315 5 HA3 GLY 1 HA1 GLY 1 21.448 11.127 14.669 6 H SER 2 HN SER 2 20.371 12.764 13.087 7 HA SER 2 HA SER 2 20.417 15.360 14.237 8 HB2 SER 2 HB2 SER 2 22.617 14.779 12.541 9 HB3 SER 2 HB1 SER 2 21.582 15.894 11.654 10 HG SER 2 HG SER 2 23.206 16.801 13.173 11 H HIS 3 HN HIS 3 18.310 13.808 13.489 12 HA HIS 3 HA HIS 3 16.791 15.492 11.722 13 HB2 HIS 3 HB2 HIS 3 16.718 14.062 9.762 14 HB3 HIS 3 HB1 HIS 3 18.413 14.362 10.146 15 HD1 HIS 3 HD1 HIS 3 16.991 11.729 8.754 16 HD2 HIS 3 HD2 HIS 3 18.638 12.041 12.570 17 HE1 HIS 3 HE1 HIS 3 17.581 9.375 9.475 18 H MET 4 HN MET 4 14.663 14.257 11.080 19 HA MET 4 HA MET 4 13.997 12.174 13.125 20 HB2 MET 4 HB2 MET 4 11.905 13.452 13.554 21 HB3 MET 4 HB1 MET 4 13.337 14.415 13.920 22 HG2 MET 4 HG2 MET 4 13.180 15.542 11.758 23 HG3 MET 4 HG1 MET 4 11.811 14.528 11.301 24 HE1 MET 4 HE1 MET 4 12.406 17.400 11.287 25 HE2 MET 4 HE2 MET 4 12.349 18.261 12.822 26 HE3 MET 4 HE3 MET 4 10.930 18.243 11.778 27 H THR 5 HN THR 5 11.112 12.811 11.983 28 HA THR 5 HA THR 5 11.450 11.312 9.410 29 HB THR 5 HB THR 5 9.242 10.206 10.182 30 HG1 THR 5 HG1 THR 5 10.068 10.682 12.775 31 HG21 THR 5 HG21 THR 5 11.252 8.904 10.145 32 HG22 THR 5 HG22 THR 5 10.529 8.647 11.733 33 HG23 THR 5 HG23 THR 5 11.899 9.744 11.555 34 H GLU 6 HN GLU 6 9.711 11.715 7.865 35 HA GLU 6 HA GLU 6 7.642 13.689 8.436 36 HB2 GLU 6 HB2 GLU 6 8.630 15.424 6.935 37 HB3 GLU 6 HB1 GLU 6 9.644 15.107 8.343 38 HG2 GLU 6 HG2 GLU 6 10.751 13.315 6.736 39 HG3 GLU 6 HG1 GLU 6 10.097 14.365 5.478 40 H ARG 7 HN ARG 7 7.972 10.995 7.195 41 HA ARG 7 HA ARG 7 7.224 11.549 4.360 42 HB2 ARG 7 HB2 ARG 7 8.119 9.099 5.900 43 HB3 ARG 7 HB1 ARG 7 7.599 9.035 4.216 44 HG2 ARG 7 HG2 ARG 7 9.459 11.186 4.476 45 HG3 ARG 7 HG1 ARG 7 10.166 9.759 5.237 46 HD2 ARG 7 HD2 ARG 7 8.907 8.903 2.818 47 HD3 ARG 7 HD1 ARG 7 9.929 10.306 2.441 48 HE ARG 7 HE ARG 7 10.879 7.786 3.717 49 HH11 ARG 7 HH11 ARG 7 11.764 10.977 3.806 50 HH12 ARG 7 HH12 ARG 7 13.324 10.772 3.080 51 HH21 ARG 7 HH21 ARG 7 12.755 7.476 2.165 52 HH22 ARG 7 HH22 ARG 7 13.886 8.788 2.157 53 H ARG 8 HN ARG 8 5.562 11.649 7.030 54 HA ARG 8 HA ARG 8 3.648 9.707 7.324 55 HB2 ARG 8 HB2 ARG 8 3.949 12.038 8.382 56 HB3 ARG 8 HB1 ARG 8 2.920 12.625 7.075 57 HG2 ARG 8 HG2 ARG 8 1.719 10.272 8.184 58 HG3 ARG 8 HG1 ARG 8 2.114 11.372 9.505 59 HD2 ARG 8 HD2 ARG 8 0.938 12.704 7.142 60 HD3 ARG 8 HD1 ARG 8 -0.157 11.590 7.987 61 HE ARG 8 HE ARG 8 0.730 14.108 9.031 62 HH11 ARG 8 HH21 ARG 8 -0.503 11.020 9.762 63 HH12 ARG 8 HH22 ARG 8 -0.458 11.241 11.479 64 HH21 ARG 8 HH11 ARG 8 1.120 14.322 11.309 65 HH22 ARG 8 HH12 ARG 8 0.456 13.112 12.355 66 H LEU 9 HN LEU 9 3.992 11.711 4.441 67 HA LEU 9 HA LEU 9 1.389 10.672 3.441 68 HB2 LEU 9 HB2 LEU 9 2.878 13.179 3.259 69 HB3 LEU 9 HB1 LEU 9 2.300 12.621 1.688 70 HG LEU 9 HG LEU 9 0.125 12.146 3.312 71 HD11 LEU 9 HD11 LEU 9 1.813 14.102 4.614 72 HD12 LEU 9 HD12 LEU 9 0.293 13.401 5.172 73 HD13 LEU 9 HD13 LEU 9 0.278 14.833 4.142 74 HD21 LEU 9 HD21 LEU 9 0.855 14.546 1.617 75 HD22 LEU 9 HD22 LEU 9 -0.764 14.285 2.266 76 HD23 LEU 9 HD23 LEU 9 -0.073 13.129 1.128 77 H ARG 10 HN ARG 10 3.067 8.660 3.275 78 HA ARG 10 HA ARG 10 4.060 8.632 0.441 79 HB2 ARG 10 HB2 ARG 10 5.520 8.507 2.870 80 HB3 ARG 10 HB1 ARG 10 5.538 6.878 2.192 81 HG2 ARG 10 HG2 ARG 10 7.423 8.301 1.370 82 HG3 ARG 10 HG1 ARG 10 6.377 7.721 0.072 83 HD2 ARG 10 HD2 ARG 10 6.199 9.901 -0.543 84 HD3 ARG 10 HD1 ARG 10 5.168 10.090 0.877 85 HE ARG 10 HE ARG 10 8.137 10.396 1.073 86 HH11 ARG 10 HH21 ARG 10 5.245 10.647 2.731 87 HH12 ARG 10 HH22 ARG 10 5.516 12.245 3.340 88 HH21 ARG 10 HH11 ARG 10 8.366 12.770 1.440 89 HH22 ARG 10 HH12 ARG 10 7.291 13.441 2.620 90 H VAL 11 HN VAL 11 3.045 6.987 -0.680 91 HA VAL 11 HA VAL 11 1.649 4.861 0.831 92 HB VAL 11 HB VAL 11 0.652 4.390 -1.356 93 HG11 VAL 11 HG11 VAL 11 0.018 6.872 -1.948 94 HG12 VAL 11 HG12 VAL 11 0.935 7.252 -0.489 95 HG13 VAL 11 HG13 VAL 11 -0.475 6.196 -0.395 96 HG21 VAL 11 HG21 VAL 11 2.864 6.201 -2.337 97 HG22 VAL 11 HG22 VAL 11 1.416 5.905 -3.292 98 HG23 VAL 11 HG23 VAL 11 2.481 4.567 -2.874 99 H LEU 12 HN LEU 12 3.183 3.317 1.548 100 HA LEU 12 HA LEU 12 5.433 2.542 -0.156 101 HB2 LEU 12 HB2 LEU 12 4.264 1.493 2.438 102 HB3 LEU 12 HB1 LEU 12 5.754 0.902 1.717 103 HG LEU 12 HG LEU 12 6.387 2.540 3.352 104 HD11 LEU 12 HD11 LEU 12 7.839 3.658 2.017 105 HD12 LEU 12 HD12 LEU 12 6.550 4.346 1.030 106 HD13 LEU 12 HD13 LEU 12 7.115 2.703 0.724 107 HD21 LEU 12 HD21 LEU 12 3.997 3.614 3.190 108 HD22 LEU 12 HD22 LEU 12 4.749 4.659 1.987 109 HD23 LEU 12 HD23 LEU 12 5.368 4.626 3.638 110 H VAL 13 HN VAL 13 4.241 1.767 -2.057 111 HA VAL 13 HA VAL 13 2.568 -0.663 -1.703 112 HB VAL 13 HB VAL 13 3.302 0.910 -4.191 113 HG11 VAL 13 HG11 VAL 13 1.921 -0.501 -5.285 114 HG12 VAL 13 HG12 VAL 13 0.668 -0.323 -4.057 115 HG13 VAL 13 HG13 VAL 13 1.948 -1.516 -3.844 116 HG21 VAL 13 HG21 VAL 13 0.640 1.407 -3.208 117 HG22 VAL 13 HG22 VAL 13 1.940 2.564 -3.494 118 HG23 VAL 13 HG23 VAL 13 1.807 1.756 -1.933 119 H VAL 14 HN VAL 14 3.243 -2.685 -2.491 120 HA VAL 14 HA VAL 14 5.728 -2.880 -4.041 121 HB VAL 14 HB VAL 14 6.672 -4.331 -2.121 122 HG11 VAL 14 HG11 VAL 14 7.196 -1.834 -2.852 123 HG12 VAL 14 HG12 VAL 14 7.910 -2.532 -1.398 124 HG13 VAL 14 HG13 VAL 14 6.498 -1.483 -1.270 125 HG21 VAL 14 HG21 VAL 14 5.149 -2.621 -0.260 126 HG22 VAL 14 HG22 VAL 14 5.697 -4.287 -0.067 127 HG23 VAL 14 HG23 VAL 14 4.242 -3.940 -1.001 128 H GLU 15 HN GLU 15 6.014 -4.846 -4.986 129 HA GLU 15 HA GLU 15 4.802 -7.341 -4.303 130 HB2 GLU 15 HB2 GLU 15 3.029 -7.426 -5.946 131 HB3 GLU 15 HB1 GLU 15 2.794 -5.951 -5.000 132 HG2 GLU 15 HG2 GLU 15 2.692 -4.953 -7.054 133 HG3 GLU 15 HG1 GLU 15 4.451 -5.038 -6.969 134 H ASP 16 HN ASP 16 6.270 -8.718 -5.201 135 HA ASP 16 HA ASP 16 8.454 -8.460 -6.667 136 HB2 ASP 16 HB2 ASP 16 8.069 -10.716 -7.521 137 HB3 ASP 16 HB1 ASP 16 7.426 -10.580 -5.884 138 H GLU 17 HN GLU 17 8.218 -6.597 -8.064 139 HA GLU 17 HA GLU 17 8.010 -7.203 -10.823 140 HB2 GLU 17 HB2 GLU 17 5.509 -7.039 -9.465 141 HB3 GLU 17 HB1 GLU 17 5.623 -5.641 -10.535 142 HG2 GLU 17 HG2 GLU 17 5.208 -6.952 -12.314 143 HG3 GLU 17 HG1 GLU 17 6.637 -7.917 -11.939 144 H SER 18 HN SER 18 8.750 -5.472 -12.028 145 HA SER 18 HA SER 18 9.326 -2.933 -10.583 146 HB2 SER 18 HB2 SER 18 11.237 -3.527 -11.728 147 HB3 SER 18 HB1 SER 18 10.345 -4.467 -12.921 148 HG SER 18 HG SER 18 10.400 -2.783 -14.165 149 H MET 19 HN MET 19 7.111 -4.303 -12.821 150 HA MET 19 HA MET 19 6.405 -2.065 -14.425 151 HB2 MET 19 HB2 MET 19 5.672 -4.646 -14.257 152 HB3 MET 19 HB1 MET 19 4.315 -3.932 -13.384 153 HG2 MET 19 HG2 MET 19 3.392 -3.254 -15.317 154 HG3 MET 19 HG1 MET 19 4.851 -2.347 -15.716 155 HE1 MET 19 HE1 MET 19 3.447 -6.413 -17.115 156 HE2 MET 19 HE2 MET 19 2.705 -5.268 -15.999 157 HE3 MET 19 HE3 MET 19 3.980 -6.343 -15.430 158 H ILE 20 HN ILE 20 5.413 -3.043 -11.150 159 HA ILE 20 HA ILE 20 3.387 -1.030 -10.788 160 HB ILE 20 HB ILE 20 3.621 -3.083 -9.441 161 HG12 ILE 20 HG12 ILE 20 4.059 -0.658 -7.687 162 HG13 ILE 20 HG11 ILE 20 2.545 -0.966 -8.542 163 HG21 ILE 20 HG21 ILE 20 6.118 -1.769 -8.342 164 HG22 ILE 20 HG22 ILE 20 6.073 -3.200 -9.370 165 HG23 ILE 20 HG23 ILE 20 5.397 -3.264 -7.743 166 HD11 ILE 20 HD11 ILE 20 3.076 -1.874 -6.025 167 HD12 ILE 20 HD12 ILE 20 3.593 -3.255 -6.993 168 HD13 ILE 20 HD13 ILE 20 1.942 -2.649 -7.132 169 H ALA 21 HN ALA 21 6.868 -1.009 -10.535 170 HA ALA 21 HA ALA 21 7.337 1.211 -8.870 171 HB1 ALA 21 HB1 ALA 21 9.445 1.330 -10.140 172 HB2 ALA 21 HB2 ALA 21 8.724 0.362 -11.426 173 HB3 ALA 21 HB3 ALA 21 9.002 -0.350 -9.836 174 H MET 22 HN MET 22 7.646 1.526 -12.411 175 HA MET 22 HA MET 22 7.152 4.332 -12.387 176 HB2 MET 22 HB2 MET 22 7.864 3.944 -14.506 177 HB3 MET 22 HB1 MET 22 7.694 2.216 -14.243 178 HG2 MET 22 HG2 MET 22 5.192 3.725 -14.871 179 HG3 MET 22 HG1 MET 22 6.360 3.530 -16.172 180 HE1 MET 22 HE1 MET 22 5.680 0.883 -17.799 181 HE2 MET 22 HE2 MET 22 5.254 2.577 -17.557 182 HE3 MET 22 HE3 MET 22 4.022 1.331 -17.372 183 H LEU 23 HN LEU 23 5.042 1.665 -11.996 184 HA LEU 23 HA LEU 23 2.563 2.843 -12.887 185 HB2 LEU 23 HB2 LEU 23 3.493 0.436 -11.926 186 HB3 LEU 23 HB1 LEU 23 2.564 1.025 -10.556 187 HG LEU 23 HG LEU 23 1.196 1.396 -13.126 188 HD11 LEU 23 HD11 LEU 23 1.147 -0.732 -13.919 189 HD12 LEU 23 HD12 LEU 23 1.052 -1.424 -12.299 190 HD13 LEU 23 HD13 LEU 23 2.616 -0.962 -12.970 191 HD21 LEU 23 HD21 LEU 23 0.144 1.678 -10.902 192 HD22 LEU 23 HD22 LEU 23 0.466 -0.017 -10.538 193 HD23 LEU 23 HD23 LEU 23 -0.660 0.410 -11.827 194 H ILE 24 HN ILE 24 4.711 3.573 -10.341 195 HA ILE 24 HA ILE 24 2.591 4.729 -8.606 196 HB ILE 24 HB ILE 24 4.681 3.179 -8.011 197 HG12 ILE 24 HG12 ILE 24 4.215 5.472 -6.139 198 HG13 ILE 24 HG11 ILE 24 2.847 4.445 -6.572 199 HG21 ILE 24 HG21 ILE 24 5.795 5.994 -7.889 200 HG22 ILE 24 HG22 ILE 24 6.436 4.642 -8.818 201 HG23 ILE 24 HG23 ILE 24 6.510 4.613 -7.060 202 HD11 ILE 24 HD11 ILE 24 3.980 2.474 -5.763 203 HD12 ILE 24 HD12 ILE 24 4.096 3.700 -4.501 204 HD13 ILE 24 HD13 ILE 24 5.483 3.368 -5.539 205 H GLU 25 HN GLU 25 5.698 5.697 -10.138 206 HA GLU 25 HA GLU 25 5.779 8.396 -9.430 207 HB2 GLU 25 HB2 GLU 25 6.459 6.825 -11.900 208 HB3 GLU 25 HB1 GLU 25 6.655 8.578 -11.921 209 HG2 GLU 25 HG2 GLU 25 7.715 7.462 -9.462 210 HG3 GLU 25 HG1 GLU 25 8.466 6.702 -10.869 211 H ASP 26 HN ASP 26 3.604 6.777 -11.644 212 HA ASP 26 HA ASP 26 2.450 9.262 -12.696 213 HB2 ASP 26 HB2 ASP 26 1.396 7.787 -14.162 214 HB3 ASP 26 HB1 ASP 26 2.767 6.795 -13.671 215 H THR 27 HN THR 27 1.417 6.636 -10.477 216 HA THR 27 HA THR 27 -1.125 7.722 -9.788 217 HB THR 27 HB THR 27 -0.885 6.271 -7.813 218 HG1 THR 27 HG1 THR 27 1.043 6.234 -7.003 219 HG21 THR 27 HG21 THR 27 0.104 4.200 -9.121 220 HG22 THR 27 HG22 THR 27 0.080 5.318 -10.486 221 HG23 THR 27 HG23 THR 27 -1.416 4.933 -9.635 222 H LEU 28 HN LEU 28 2.153 8.442 -8.718 223 HA LEU 28 HA LEU 28 1.487 10.072 -6.448 224 HB2 LEU 28 HB2 LEU 28 3.733 9.618 -6.463 225 HB3 LEU 28 HB1 LEU 28 3.761 9.456 -8.208 226 HG LEU 28 HG LEU 28 3.687 11.944 -8.408 227 HD11 LEU 28 HD11 LEU 28 3.593 13.333 -6.579 228 HD12 LEU 28 HD12 LEU 28 4.460 12.201 -5.543 229 HD13 LEU 28 HD13 LEU 28 2.749 11.949 -5.886 230 HD21 LEU 28 HD21 LEU 28 5.881 11.338 -8.635 231 HD22 LEU 28 HD22 LEU 28 5.872 10.374 -7.157 232 HD23 LEU 28 HD23 LEU 28 6.044 12.129 -7.066 233 H CYS 29 HN CYS 29 1.928 10.710 -9.918 234 HA CYS 29 HA CYS 29 1.686 13.503 -9.997 235 HB2 CYS 29 HB2 CYS 29 1.488 11.258 -11.746 236 HB3 CYS 29 HB1 CYS 29 0.105 12.302 -12.074 237 HG CYS 29 HG CYS 29 3.015 13.454 -12.081 238 H GLU 30 HN GLU 30 -0.825 11.022 -9.614 239 HA GLU 30 HA GLU 30 -2.941 13.062 -9.459 240 HB2 GLU 30 HB2 GLU 30 -4.407 11.040 -9.336 241 HB3 GLU 30 HB1 GLU 30 -3.346 11.020 -10.743 242 HG2 GLU 30 HG2 GLU 30 -1.834 9.479 -9.665 243 HG3 GLU 30 HG1 GLU 30 -2.689 9.641 -8.130 244 H LEU 31 HN LEU 31 -1.020 11.019 -7.326 245 HA LEU 31 HA LEU 31 -2.816 11.308 -5.011 246 HB2 LEU 31 HB2 LEU 31 0.021 10.363 -5.463 247 HB3 LEU 31 HB1 LEU 31 -0.672 10.470 -3.854 248 HG LEU 31 HG LEU 31 -2.215 8.997 -5.948 249 HD11 LEU 31 HD11 LEU 31 -0.849 7.121 -5.921 250 HD12 LEU 31 HD12 LEU 31 -0.170 7.515 -4.341 251 HD13 LEU 31 HD13 LEU 31 0.385 8.374 -5.778 252 HD21 LEU 31 HD21 LEU 31 -2.361 9.470 -3.161 253 HD22 LEU 31 HD22 LEU 31 -1.898 7.777 -3.339 254 HD23 LEU 31 HD23 LEU 31 -3.371 8.373 -4.104 255 H GLY 32 HN GLY 32 0.252 12.715 -6.143 256 HA2 GLY 32 HA2 GLY 32 1.031 14.936 -5.649 257 HA3 GLY 32 HA1 GLY 32 -0.230 15.079 -4.412 258 H HIS 33 HN HIS 33 0.771 12.121 -3.786 259 HA HIS 33 HA HIS 33 2.109 12.569 -1.384 260 HB2 HIS 33 HB2 HIS 33 2.142 10.358 -3.444 261 HB3 HIS 33 HB1 HIS 33 3.064 10.208 -1.939 262 HD1 HIS 33 HD1 HIS 33 0.186 8.828 -3.036 263 HD2 HIS 33 HD2 HIS 33 0.834 11.413 0.172 264 HE1 HIS 33 HE1 HIS 33 -1.764 8.499 -1.458 265 H GLU 34 HN GLU 34 4.580 11.718 -1.118 266 HA GLU 34 HA GLU 34 6.164 13.538 -2.853 267 HB2 GLU 34 HB2 GLU 34 6.289 13.399 -0.319 268 HB3 GLU 34 HB1 GLU 34 7.067 11.838 -0.521 269 HG2 GLU 34 HG2 GLU 34 8.347 13.705 -2.271 270 HG3 GLU 34 HG1 GLU 34 8.269 14.413 -0.656 271 H VAL 35 HN VAL 35 7.448 10.500 -1.582 272 HA VAL 35 HA VAL 35 7.584 9.321 -4.300 273 HB VAL 35 HB VAL 35 9.766 10.531 -2.706 274 HG11 VAL 35 HG11 VAL 35 10.627 8.425 -2.216 275 HG12 VAL 35 HG12 VAL 35 11.347 8.707 -3.801 276 HG13 VAL 35 HG13 VAL 35 9.917 7.687 -3.651 277 HG21 VAL 35 HG21 VAL 35 10.805 10.265 -5.112 278 HG22 VAL 35 HG22 VAL 35 9.507 11.430 -4.844 279 HG23 VAL 35 HG23 VAL 35 9.150 9.863 -5.569 280 H ALA 36 HN ALA 36 6.264 7.600 -3.606 281 HA ALA 36 HA ALA 36 6.692 6.265 -1.063 282 HB1 ALA 36 HB1 ALA 36 4.538 5.832 -1.514 283 HB2 ALA 36 HB2 ALA 36 5.042 4.780 -2.836 284 HB3 ALA 36 HB3 ALA 36 4.739 6.491 -3.137 285 H ALA 37 HN ALA 37 6.155 3.591 -1.957 286 HA ALA 37 HA ALA 37 8.802 2.857 -3.170 287 HB1 ALA 37 HB1 ALA 37 8.661 0.888 -1.672 288 HB2 ALA 37 HB2 ALA 37 7.107 1.464 -1.069 289 HB3 ALA 37 HB3 ALA 37 8.574 2.391 -0.751 290 H THR 38 HN THR 38 8.734 0.632 -4.153 291 HA THR 38 HA THR 38 6.099 -0.311 -5.094 292 HB THR 38 HB THR 38 7.482 -0.174 -7.457 293 HG1 THR 38 HG1 THR 38 8.444 1.858 -7.497 294 HG21 THR 38 HG21 THR 38 6.140 2.228 -7.391 295 HG22 THR 38 HG22 THR 38 5.354 1.320 -6.100 296 HG23 THR 38 HG23 THR 38 5.397 0.666 -7.736 297 H ALA 39 HN ALA 39 6.514 -2.312 -6.564 298 HA ALA 39 HA ALA 39 7.430 -4.483 -6.739 299 HB1 ALA 39 HB1 ALA 39 10.036 -3.223 -5.893 300 HB2 ALA 39 HB2 ALA 39 9.354 -2.905 -7.488 301 HB3 ALA 39 HB3 ALA 39 9.776 -4.552 -7.021 302 H SER 40 HN SER 40 8.152 -6.212 -5.336 303 HA SER 40 HA SER 40 7.596 -5.635 -2.514 304 HB2 SER 40 HB2 SER 40 7.460 -7.982 -2.318 305 HB3 SER 40 HB1 SER 40 6.780 -7.591 -3.886 306 HG SER 40 HG SER 40 8.553 -9.330 -3.561 307 H ARG 41 HN ARG 41 9.183 -4.882 -1.233 308 HA ARG 41 HA ARG 41 11.902 -6.056 -1.488 309 HB2 ARG 41 HB2 ARG 41 11.277 -3.608 -2.369 310 HB3 ARG 41 HB1 ARG 41 11.501 -3.212 -0.662 311 HG2 ARG 41 HG2 ARG 41 13.603 -2.972 -2.013 312 HG3 ARG 41 HG1 ARG 41 13.752 -4.123 -0.684 313 HD2 ARG 41 HD2 ARG 41 13.967 -5.920 -2.095 314 HD3 ARG 41 HD1 ARG 41 12.820 -5.256 -3.274 315 HE ARG 41 HE ARG 41 15.705 -4.721 -3.200 316 HH11 ARG 41 HH21 ARG 41 13.536 -5.010 -5.484 317 HH12 ARG 41 HH22 ARG 41 13.687 -3.443 -6.205 318 HH21 ARG 41 HH11 ARG 41 15.501 -2.112 -3.565 319 HH22 ARG 41 HH12 ARG 41 14.800 -1.801 -5.119 320 H MET 42 HN MET 42 12.249 -7.144 0.431 321 HA MET 42 HA MET 42 10.769 -6.797 2.827 322 HB2 MET 42 HB2 MET 42 13.351 -8.040 1.976 323 HB3 MET 42 HB1 MET 42 13.044 -7.892 3.707 324 HG2 MET 42 HG2 MET 42 10.630 -8.832 2.824 325 HG3 MET 42 HG1 MET 42 11.741 -9.635 1.711 326 HE1 MET 42 HE1 MET 42 9.879 -10.989 4.552 327 HE2 MET 42 HE2 MET 42 10.885 -12.379 4.152 328 HE3 MET 42 HE3 MET 42 10.255 -11.357 2.863 329 H GLN 43 HN GLN 43 13.688 -5.194 1.652 330 HA GLN 43 HA GLN 43 14.525 -3.959 4.094 331 HB2 GLN 43 HB2 GLN 43 15.809 -4.195 1.950 332 HB3 GLN 43 HB1 GLN 43 14.755 -2.978 1.228 333 HG2 GLN 43 HG2 GLN 43 16.693 -1.796 1.968 334 HG3 GLN 43 HG1 GLN 43 15.439 -1.445 3.158 335 HE21 GLN 43 HE21 GLN 43 17.093 -1.082 4.833 336 HE22 GLN 43 HE22 GLN 43 17.923 -2.389 5.531 337 H GLU 44 HN GLU 44 12.487 -2.720 1.425 338 HA GLU 44 HA GLU 44 11.809 -0.294 2.899 339 HB2 GLU 44 HB2 GLU 44 11.223 -1.553 0.243 340 HB3 GLU 44 HB1 GLU 44 10.200 -0.224 0.792 341 HG2 GLU 44 HG2 GLU 44 13.224 -0.068 0.746 342 HG3 GLU 44 HG1 GLU 44 12.214 0.475 -0.594 343 H ALA 45 HN ALA 45 10.059 -3.228 1.822 344 HA ALA 45 HA ALA 45 7.479 -2.746 2.707 345 HB1 ALA 45 HB1 ALA 45 8.422 -4.817 1.634 346 HB2 ALA 45 HB2 ALA 45 7.345 -5.166 2.986 347 HB3 ALA 45 HB3 ALA 45 9.091 -5.270 3.202 348 H LEU 46 HN LEU 46 10.164 -3.955 4.727 349 HA LEU 46 HA LEU 46 8.876 -4.144 7.217 350 HB2 LEU 46 HB2 LEU 46 11.135 -4.882 6.896 351 HB3 LEU 46 HB1 LEU 46 11.645 -3.295 6.327 352 HG LEU 46 HG LEU 46 10.469 -3.411 9.057 353 HD11 LEU 46 HD11 LEU 46 11.980 -4.823 9.950 354 HD12 LEU 46 HD12 LEU 46 13.305 -3.933 9.200 355 HD13 LEU 46 HD13 LEU 46 12.505 -5.233 8.317 356 HD21 LEU 46 HD21 LEU 46 12.844 -2.020 7.775 357 HD22 LEU 46 HD22 LEU 46 12.318 -1.774 9.441 358 HD23 LEU 46 HD23 LEU 46 11.268 -1.303 8.106 359 H ASP 47 HN ASP 47 10.441 -1.299 5.736 360 HA ASP 47 HA ASP 47 10.011 0.608 7.768 361 HB2 ASP 47 HB2 ASP 47 11.329 0.867 5.662 362 HB3 ASP 47 HB1 ASP 47 9.817 0.953 4.758 363 H ILE 48 HN ILE 48 7.861 -0.288 5.083 364 HA ILE 48 HA ILE 48 5.731 1.515 5.668 365 HB ILE 48 HB ILE 48 4.643 0.432 3.979 366 HG12 ILE 48 HG12 ILE 48 5.386 -2.160 5.344 367 HG13 ILE 48 HG11 ILE 48 3.790 -1.422 5.207 368 HG21 ILE 48 HG21 ILE 48 6.068 -0.722 2.448 369 HG22 ILE 48 HG22 ILE 48 7.164 -1.209 3.734 370 HG23 ILE 48 HG23 ILE 48 7.053 0.490 3.267 371 HD11 ILE 48 HD11 ILE 48 5.310 -3.012 3.210 372 HD12 ILE 48 HD12 ILE 48 4.459 -1.603 2.577 373 HD13 ILE 48 HD13 ILE 48 3.568 -2.856 3.436 374 H ALA 49 HN ALA 49 6.776 -1.402 7.248 375 HA ALA 49 HA ALA 49 4.250 -1.685 8.736 376 HB1 ALA 49 HB1 ALA 49 5.003 -3.784 8.244 377 HB2 ALA 49 HB2 ALA 49 5.934 -3.568 9.724 378 HB3 ALA 49 HB3 ALA 49 6.686 -3.268 8.157 379 H ARG 50 HN ARG 50 7.731 -1.405 9.630 380 HA ARG 50 HA ARG 50 7.157 -0.885 12.402 381 HB2 ARG 50 HB2 ARG 50 9.686 0.130 11.189 382 HB3 ARG 50 HB1 ARG 50 9.450 -0.819 12.654 383 HG2 ARG 50 HG2 ARG 50 9.532 -1.786 9.796 384 HG3 ARG 50 HG1 ARG 50 10.550 -2.273 11.141 385 HD2 ARG 50 HD2 ARG 50 7.629 -2.749 11.491 386 HD3 ARG 50 HD1 ARG 50 8.472 -3.778 10.318 387 HE ARG 50 HE ARG 50 9.838 -3.408 12.909 388 HH11 ARG 50 HH11 ARG 50 9.135 -5.544 10.474 389 HH12 ARG 50 HH12 ARG 50 8.834 -6.913 11.492 390 HH21 ARG 50 HH21 ARG 50 8.868 -5.068 14.428 391 HH22 ARG 50 HH22 ARG 50 8.678 -6.642 13.729 392 H LYS 51 HN LYS 51 7.462 1.178 9.588 393 HA LYS 51 HA LYS 51 7.999 3.679 10.761 394 HB2 LYS 51 HB2 LYS 51 7.958 3.332 8.379 395 HB3 LYS 51 HB1 LYS 51 6.267 2.831 8.427 396 HG2 LYS 51 HG2 LYS 51 6.352 5.131 7.653 397 HG3 LYS 51 HG1 LYS 51 5.681 5.123 9.285 398 HD2 LYS 51 HD2 LYS 51 7.294 6.601 9.845 399 HD3 LYS 51 HD1 LYS 51 8.456 5.287 9.655 400 HE2 LYS 51 HE2 LYS 51 7.626 6.517 7.103 401 HE3 LYS 51 HE1 LYS 51 8.522 7.604 8.183 402 HZ1 LYS 51 HZ1 LYS 51 10.356 6.312 8.126 403 HZ2 LYS 51 HZ2 LYS 51 9.720 5.807 6.634 404 HZ3 LYS 51 HZ3 LYS 51 9.481 4.863 8.026 405 H GLY 52 HN GLY 52 4.791 2.137 10.272 406 HA2 GLY 52 HA2 GLY 52 2.819 2.461 11.547 407 HA3 GLY 52 HA1 GLY 52 3.729 3.535 12.612 408 H GLN 53 HN GLN 53 4.629 5.509 11.002 409 HA GLN 53 HA GLN 53 2.123 6.823 10.090 410 HB2 GLN 53 HB2 GLN 53 4.869 8.064 10.257 411 HB3 GLN 53 HB1 GLN 53 3.302 8.834 10.485 412 HG2 GLN 53 HG2 GLN 53 4.369 6.717 12.363 413 HG3 GLN 53 HG1 GLN 53 4.652 8.437 12.608 414 HE21 GLN 53 HE21 GLN 53 3.184 9.239 14.108 415 HE22 GLN 53 HE22 GLN 53 1.550 8.791 14.212 416 H PHE 54 HN PHE 54 3.536 4.698 8.521 417 HA PHE 54 HA PHE 54 4.915 6.055 6.347 418 HB2 PHE 54 HB2 PHE 54 4.997 3.805 5.379 419 HB3 PHE 54 HB1 PHE 54 5.399 3.731 7.086 420 HD1 PHE 54 HD2 PHE 54 3.754 2.880 8.734 421 HD2 PHE 54 HD1 PHE 54 3.011 2.802 4.518 422 HE1 PHE 54 HE2 PHE 54 1.930 1.252 9.088 423 HE2 PHE 54 HE1 PHE 54 1.191 1.166 4.867 424 HZ PHE 54 HZ PHE 54 0.649 0.381 7.152 425 H ASP 55 HN ASP 55 1.793 6.236 7.163 426 HA ASP 55 HA ASP 55 -0.071 7.021 5.961 427 HB2 ASP 55 HB2 ASP 55 1.924 8.001 4.635 428 HB3 ASP 55 HB1 ASP 55 1.589 6.721 3.474 429 H ILE 56 HN ILE 56 1.492 4.748 3.634 430 HA ILE 56 HA ILE 56 -0.855 2.929 3.938 431 HB ILE 56 HB ILE 56 -0.009 4.360 1.407 432 HG12 ILE 56 HG12 ILE 56 -2.448 4.545 3.194 433 HG13 ILE 56 HG11 ILE 56 -1.282 5.820 2.844 434 HG21 ILE 56 HG21 ILE 56 -0.692 2.206 0.735 435 HG22 ILE 56 HG22 ILE 56 -2.136 3.199 0.545 436 HG23 ILE 56 HG23 ILE 56 -1.970 2.141 1.946 437 HD11 ILE 56 HD11 ILE 56 -3.599 4.946 1.285 438 HD12 ILE 56 HD12 ILE 56 -2.124 5.030 0.323 439 HD13 ILE 56 HD13 ILE 56 -2.691 6.455 1.194 440 H ALA 57 HN ALA 57 -0.529 0.809 2.827 441 HA ALA 57 HA ALA 57 2.212 0.327 1.787 442 HB1 ALA 57 HB1 ALA 57 2.110 -1.728 3.484 443 HB2 ALA 57 HB2 ALA 57 1.070 -0.622 4.377 444 HB3 ALA 57 HB3 ALA 57 2.726 -0.156 3.990 445 H ILE 58 HN ILE 58 2.001 -1.032 0.016 446 HA ILE 58 HA ILE 58 -0.360 -2.877 0.028 447 HB ILE 58 HB ILE 58 0.812 -1.099 -2.113 448 HG12 ILE 58 HG12 ILE 58 -1.720 -0.603 -2.297 449 HG13 ILE 58 HG11 ILE 58 -1.860 -1.457 -0.759 450 HG21 ILE 58 HG21 ILE 58 -1.266 -3.263 -2.548 451 HG22 ILE 58 HG22 ILE 58 0.426 -3.431 -3.017 452 HG23 ILE 58 HG23 ILE 58 -0.577 -2.190 -3.765 453 HD11 ILE 58 HD11 ILE 58 -1.288 1.220 -1.015 454 HD12 ILE 58 HD12 ILE 58 0.317 0.515 -0.820 455 HD13 ILE 58 HD13 ILE 58 -0.922 0.242 0.406 456 H ILE 59 HN ILE 59 0.811 -4.701 0.678 457 HA ILE 59 HA ILE 59 3.050 -5.659 -1.075 458 HB ILE 59 HB ILE 59 1.993 -6.307 1.697 459 HG12 ILE 59 HG12 ILE 59 4.886 -6.105 1.108 460 HG13 ILE 59 HG11 ILE 59 3.961 -4.629 0.840 461 HG21 ILE 59 HG21 ILE 59 2.606 -8.461 1.515 462 HG22 ILE 59 HG22 ILE 59 4.227 -7.967 1.041 463 HG23 ILE 59 HG23 ILE 59 2.985 -8.208 -0.186 464 HD11 ILE 59 HD11 ILE 59 3.174 -4.593 3.088 465 HD12 ILE 59 HD12 ILE 59 4.900 -4.932 3.192 466 HD13 ILE 59 HD13 ILE 59 3.730 -6.236 3.384 467 H ASP 60 HN ASP 60 1.048 -5.686 -2.589 468 HA ASP 60 HA ASP 60 -1.153 -7.387 -2.269 469 HB2 ASP 60 HB2 ASP 60 -1.608 -6.441 -4.254 470 HB3 ASP 60 HB1 ASP 60 -0.026 -5.683 -4.170 471 H VAL 61 HN VAL 61 -1.286 -9.105 -4.326 472 HA VAL 61 HA VAL 61 -1.038 -11.348 -4.787 473 HB VAL 61 HB VAL 61 0.930 -10.223 -5.864 474 HG11 VAL 61 HG11 VAL 61 2.142 -10.829 -3.232 475 HG12 VAL 61 HG12 VAL 61 2.547 -9.580 -4.398 476 HG13 VAL 61 HG13 VAL 61 3.129 -11.228 -4.629 477 HG21 VAL 61 HG21 VAL 61 1.547 -12.229 -6.740 478 HG22 VAL 61 HG22 VAL 61 0.261 -12.856 -5.709 479 HG23 VAL 61 HG23 VAL 61 1.936 -12.911 -5.161 480 H ASN 62 HN ASN 62 -2.026 -11.742 -2.595 481 HA ASN 62 HA ASN 62 -0.074 -13.086 -0.771 482 HB2 ASN 62 HB2 ASN 62 -2.797 -11.843 -0.300 483 HB3 ASN 62 HB1 ASN 62 -1.957 -12.802 0.908 484 HD21 ASN 62 HD21 ASN 62 -1.126 -10.051 -1.304 485 HD22 ASN 62 HD22 ASN 62 -0.251 -9.197 -0.126 486 H LEU 63 HN LEU 63 -0.576 -14.595 -2.871 487 HA LEU 63 HA LEU 63 -2.563 -16.608 -1.912 488 HB2 LEU 63 HB2 LEU 63 -2.674 -14.901 -4.233 489 HB3 LEU 63 HB1 LEU 63 -2.528 -16.580 -4.757 490 HG LEU 63 HG LEU 63 -4.393 -17.146 -3.146 491 HD11 LEU 63 HD11 LEU 63 -4.978 -15.546 -1.665 492 HD12 LEU 63 HD12 LEU 63 -5.660 -14.632 -3.010 493 HD13 LEU 63 HD13 LEU 63 -3.995 -14.346 -2.505 494 HD21 LEU 63 HD21 LEU 63 -4.556 -15.628 -5.662 495 HD22 LEU 63 HD22 LEU 63 -6.022 -15.525 -4.687 496 HD23 LEU 63 HD23 LEU 63 -5.402 -17.099 -5.182 497 H ASP 64 HN ASP 64 -2.153 -18.732 -3.223 498 HA ASP 64 HA ASP 64 -0.623 -20.468 -3.695 499 HB2 ASP 64 HB2 ASP 64 0.075 -18.032 -5.185 500 HB3 ASP 64 HB1 ASP 64 1.434 -19.149 -5.007 501 H GLY 65 HN GLY 65 -0.176 -18.521 -1.254 502 HA2 GLY 65 HA2 GLY 65 1.713 -19.767 0.209 503 HA3 GLY 65 HA1 GLY 65 2.732 -18.816 -0.868 504 H GLU 66 HN GLU 66 0.388 -16.761 -0.800 505 HA GLU 66 HA GLU 66 0.016 -14.759 0.386 506 HB2 GLU 66 HB2 GLU 66 0.553 -16.528 2.785 507 HB3 GLU 66 HB1 GLU 66 -0.524 -15.134 2.700 508 HG2 GLU 66 HG2 GLU 66 -1.305 -16.953 0.645 509 HG3 GLU 66 HG1 GLU 66 -1.139 -17.874 2.141 510 HA PRO 67 HA PRO 67 4.639 -14.488 1.153 511 HB2 PRO 67 HB2 PRO 67 5.238 -12.911 -1.002 512 HB3 PRO 67 HB1 PRO 67 5.250 -14.685 -1.061 513 HG2 PRO 67 HG2 PRO 67 3.186 -12.774 -2.023 514 HG3 PRO 67 HG1 PRO 67 3.727 -14.302 -2.733 515 HD2 PRO 67 HD2 PRO 67 1.411 -14.020 -1.310 516 HD3 PRO 67 HD1 PRO 67 2.302 -15.549 -1.453 517 H SER 68 HN SER 68 2.746 -13.062 2.568 518 HA SER 68 HA SER 68 3.431 -10.179 2.125 519 HB2 SER 68 HB2 SER 68 1.040 -11.592 2.592 520 HB3 SER 68 HB1 SER 68 1.387 -10.765 4.105 521 HG SER 68 HG SER 68 0.243 -9.680 2.137 522 H TYR 69 HN TYR 69 4.741 -12.631 3.687 523 HA TYR 69 HA TYR 69 5.841 -13.000 5.733 524 HB2 TYR 69 HB2 TYR 69 6.551 -10.322 6.359 525 HB3 TYR 69 HB1 TYR 69 7.537 -11.521 5.534 526 HD1 TYR 69 HD1 TYR 69 7.590 -11.595 3.045 527 HD2 TYR 69 HD2 TYR 69 5.427 -8.565 5.176 528 HE1 TYR 69 HE1 TYR 69 7.474 -10.215 0.987 529 HE2 TYR 69 HE2 TYR 69 5.313 -7.187 3.133 530 HH TYR 69 HH TYR 69 6.606 -6.958 0.997 531 HA PRO 70 HA PRO 70 3.403 -11.816 9.169 532 HB2 PRO 70 HB2 PRO 70 5.156 -11.121 11.140 533 HB3 PRO 70 HB1 PRO 70 4.945 -12.794 10.591 534 HG2 PRO 70 HG2 PRO 70 7.111 -10.862 9.987 535 HG3 PRO 70 HG1 PRO 70 7.184 -12.619 10.181 536 HD2 PRO 70 HD2 PRO 70 7.196 -11.291 7.761 537 HD3 PRO 70 HD1 PRO 70 6.747 -12.993 7.983 538 H VAL 71 HN VAL 71 5.465 -9.509 7.731 539 HA VAL 71 HA VAL 71 4.928 -7.193 9.358 540 HB VAL 71 HB VAL 71 6.024 -7.932 6.710 541 HG11 VAL 71 HG11 VAL 71 6.223 -5.333 6.285 542 HG12 VAL 71 HG12 VAL 71 4.736 -5.282 7.232 543 HG13 VAL 71 HG13 VAL 71 4.797 -6.216 5.740 544 HG21 VAL 71 HG21 VAL 71 7.872 -6.543 7.439 545 HG22 VAL 71 HG22 VAL 71 7.400 -7.636 8.739 546 HG23 VAL 71 HG23 VAL 71 6.916 -5.940 8.793 547 H ALA 72 HN ALA 72 3.767 -7.801 6.066 548 HA ALA 72 HA ALA 72 1.537 -6.027 6.123 549 HB1 ALA 72 HB1 ALA 72 1.889 -6.576 3.963 550 HB2 ALA 72 HB2 ALA 72 1.063 -8.100 4.295 551 HB3 ALA 72 HB3 ALA 72 2.820 -8.000 4.431 552 H ASP 73 HN ASP 73 1.698 -9.598 6.382 553 HA ASP 73 HA ASP 73 -0.998 -10.177 6.681 554 HB2 ASP 73 HB2 ASP 73 1.569 -11.265 7.682 555 HB3 ASP 73 HB1 ASP 73 0.111 -11.906 8.420 556 H ILE 74 HN ILE 74 1.287 -9.444 9.318 557 HA ILE 74 HA ILE 74 -0.631 -9.294 11.428 558 HB ILE 74 HB ILE 74 2.049 -7.982 10.905 559 HG12 ILE 74 HG12 ILE 74 1.281 -10.176 12.849 560 HG13 ILE 74 HG11 ILE 74 1.877 -10.492 11.218 561 HG21 ILE 74 HG21 ILE 74 2.095 -7.136 13.109 562 HG22 ILE 74 HG22 ILE 74 0.710 -8.109 13.604 563 HG23 ILE 74 HG23 ILE 74 0.480 -6.725 12.537 564 HD11 ILE 74 HD11 ILE 74 3.795 -8.800 12.001 565 HD12 ILE 74 HD12 ILE 74 3.888 -10.526 12.345 566 HD13 ILE 74 HD13 ILE 74 3.332 -9.410 13.589 567 H LEU 75 HN LEU 75 0.798 -6.804 9.346 568 HA LEU 75 HA LEU 75 -0.467 -4.488 10.232 569 HB2 LEU 75 HB2 LEU 75 1.082 -5.369 8.113 570 HB3 LEU 75 HB1 LEU 75 -0.381 -4.863 7.296 571 HG LEU 75 HG LEU 75 0.060 -2.814 9.118 572 HD11 LEU 75 HD11 LEU 75 2.518 -4.245 8.770 573 HD12 LEU 75 HD12 LEU 75 2.233 -2.767 9.690 574 HD13 LEU 75 HD13 LEU 75 2.667 -2.674 7.983 575 HD21 LEU 75 HD21 LEU 75 1.107 -2.958 6.273 576 HD22 LEU 75 HD22 LEU 75 0.658 -1.499 7.157 577 HD23 LEU 75 HD23 LEU 75 -0.579 -2.663 6.692 578 H ALA 76 HN ALA 76 -1.804 -7.147 8.305 579 HA ALA 76 HA ALA 76 -4.286 -5.888 7.600 580 HB1 ALA 76 HB1 ALA 76 -3.174 -7.869 6.531 581 HB2 ALA 76 HB2 ALA 76 -4.878 -8.130 6.902 582 HB3 ALA 76 HB3 ALA 76 -3.632 -8.820 7.944 583 H GLU 77 HN GLU 77 -3.878 -8.627 9.884 584 HA GLU 77 HA GLU 77 -6.376 -8.565 11.086 585 HB2 GLU 77 HB2 GLU 77 -5.323 -9.720 12.906 586 HB3 GLU 77 HB1 GLU 77 -4.390 -10.119 11.465 587 HG2 GLU 77 HG2 GLU 77 -2.657 -8.582 12.048 588 HG3 GLU 77 HG1 GLU 77 -3.643 -7.835 13.305 589 H ARG 78 HN ARG 78 -3.861 -6.178 11.422 590 HA ARG 78 HA ARG 78 -5.643 -4.539 13.103 591 HB2 ARG 78 HB2 ARG 78 -3.869 -4.245 14.765 592 HB3 ARG 78 HB1 ARG 78 -4.204 -5.967 14.574 593 HG2 ARG 78 HG2 ARG 78 -2.338 -5.689 12.659 594 HG3 ARG 78 HG1 ARG 78 -1.815 -4.395 13.738 595 HD2 ARG 78 HD2 ARG 78 -2.499 -6.947 15.090 596 HD3 ARG 78 HD1 ARG 78 -1.052 -6.991 14.063 597 HE ARG 78 HE ARG 78 -1.203 -4.617 15.767 598 HH11 ARG 78 HH21 ARG 78 1.389 -5.727 14.939 599 HH12 ARG 78 HH22 ARG 78 1.928 -6.567 16.355 600 HH21 ARG 78 HH11 ARG 78 -1.214 -6.645 17.825 601 HH22 ARG 78 HH12 ARG 78 0.450 -7.094 17.991 602 H ASN 79 HN ASN 79 -5.374 -3.666 10.654 603 HA ASN 79 HA ASN 79 -2.859 -2.232 10.227 604 HB2 ASN 79 HB2 ASN 79 -4.950 -3.292 8.672 605 HB3 ASN 79 HB1 ASN 79 -4.981 -1.543 8.423 606 HD21 ASN 79 HD21 ASN 79 -3.533 -4.313 7.250 607 HD22 ASN 79 HD22 ASN 79 -2.120 -3.635 6.611 608 H VAL 80 HN VAL 80 -2.717 0.021 9.985 609 HA VAL 80 HA VAL 80 -4.712 1.587 11.580 610 HB VAL 80 HB VAL 80 -2.776 3.025 12.016 611 HG11 VAL 80 HG11 VAL 80 -2.739 0.151 12.481 612 HG12 VAL 80 HG12 VAL 80 -2.344 1.470 13.581 613 HG13 VAL 80 HG13 VAL 80 -1.118 0.845 12.478 614 HG21 VAL 80 HG21 VAL 80 -1.942 2.292 9.503 615 HG22 VAL 80 HG22 VAL 80 -0.868 1.329 10.516 616 HG23 VAL 80 HG23 VAL 80 -0.905 3.083 10.690 617 HA PRO 81 HA PRO 81 -5.429 4.160 8.010 618 HB2 PRO 81 HB2 PRO 81 -3.840 6.373 7.741 619 HB3 PRO 81 HB1 PRO 81 -5.184 6.270 8.897 620 HG2 PRO 81 HG2 PRO 81 -2.264 5.975 9.356 621 HG3 PRO 81 HG1 PRO 81 -3.499 6.717 10.384 622 HD2 PRO 81 HD2 PRO 81 -2.456 4.244 10.806 623 HD3 PRO 81 HD1 PRO 81 -4.076 4.721 11.348 624 H PHE 82 HN PHE 82 -4.977 3.056 6.210 625 HA PHE 82 HA PHE 82 -2.502 3.458 4.710 626 HB2 PHE 82 HB2 PHE 82 -1.487 1.390 5.162 627 HB3 PHE 82 HB1 PHE 82 -2.140 1.833 6.742 628 HD1 PHE 82 HD2 PHE 82 -4.930 1.227 6.687 629 HD2 PHE 82 HD1 PHE 82 -1.715 -0.890 4.784 630 HE1 PHE 82 HE2 PHE 82 -6.310 -0.832 6.649 631 HE2 PHE 82 HE1 PHE 82 -3.094 -2.944 4.742 632 HZ PHE 82 HZ PHE 82 -5.398 -2.916 5.660 633 H ILE 83 HN ILE 83 -2.748 0.794 3.512 634 HA ILE 83 HA ILE 83 -5.414 0.333 2.520 635 HB ILE 83 HB ILE 83 -3.654 2.247 1.190 636 HG12 ILE 83 HG12 ILE 83 -6.379 1.870 0.205 637 HG13 ILE 83 HG11 ILE 83 -6.289 2.096 1.951 638 HG21 ILE 83 HG21 ILE 83 -4.286 1.552 -1.115 639 HG22 ILE 83 HG22 ILE 83 -4.988 0.079 -0.449 640 HG23 ILE 83 HG23 ILE 83 -3.252 0.359 -0.329 641 HD11 ILE 83 HD11 ILE 83 -6.466 4.209 0.442 642 HD12 ILE 83 HD12 ILE 83 -4.764 3.908 0.093 643 HD13 ILE 83 HD13 ILE 83 -5.283 4.209 1.749 644 H PHE 84 HN PHE 84 -5.398 -1.597 1.210 645 HA PHE 84 HA PHE 84 -2.793 -2.874 0.619 646 HB2 PHE 84 HB2 PHE 84 -3.771 -3.094 3.084 647 HB3 PHE 84 HB1 PHE 84 -4.726 -4.366 2.332 648 HD1 PHE 84 HD1 PHE 84 -3.489 -6.206 1.022 649 HD2 PHE 84 HD2 PHE 84 -1.504 -3.460 3.668 650 HE1 PHE 84 HE1 PHE 84 -1.541 -7.747 1.167 651 HE2 PHE 84 HE2 PHE 84 0.440 -5.002 3.807 652 HZ PHE 84 HZ PHE 84 0.419 -7.134 2.556 653 H ALA 85 HN ALA 85 -3.154 -4.995 -0.506 654 HA ALA 85 HA ALA 85 -5.834 -5.638 -1.422 655 HB1 ALA 85 HB1 ALA 85 -5.477 -4.901 -3.734 656 HB2 ALA 85 HB2 ALA 85 -3.842 -4.385 -3.332 657 HB3 ALA 85 HB3 ALA 85 -5.226 -3.539 -2.643 658 H THR 86 HN THR 86 -5.815 -7.563 -2.845 659 HA THR 86 HA THR 86 -3.377 -8.788 -3.743 660 HB THR 86 HB THR 86 -2.783 -9.120 -1.490 661 HG1 THR 86 HG1 THR 86 -4.214 -11.487 -1.777 662 HG21 THR 86 HG21 THR 86 -4.573 -10.225 0.069 663 HG22 THR 86 HG22 THR 86 -5.730 -9.589 -1.100 664 HG23 THR 86 HG23 THR 86 -4.656 -8.491 -0.234 665 H GLY 87 HN GLY 87 -3.989 -11.468 -3.603 666 HA2 GLY 87 HA2 GLY 87 -5.713 -11.961 -5.691 667 HA3 GLY 87 HA1 GLY 87 -5.450 -13.135 -4.401 668 H TYR 88 HN TYR 88 -6.737 -11.859 -2.243 669 HA TYR 88 HA TYR 88 -9.547 -11.786 -3.276 670 HB2 TYR 88 HB2 TYR 88 -10.145 -12.814 -1.101 671 HB3 TYR 88 HB1 TYR 88 -9.020 -13.799 -2.021 672 HD1 TYR 88 HD2 TYR 88 -7.241 -10.977 -0.715 673 HD2 TYR 88 HD1 TYR 88 -8.886 -14.786 0.417 674 HE1 TYR 88 HE2 TYR 88 -5.729 -11.058 1.232 675 HE2 TYR 88 HE1 TYR 88 -7.360 -14.858 2.363 676 HH TYR 88 HH TYR 88 -5.935 -12.410 3.675 677 H GLY 89 HN GLY 89 -7.624 -9.485 -2.684 678 HA2 GLY 89 HA2 GLY 89 -8.327 -7.262 -2.063 679 HA3 GLY 89 HA1 GLY 89 -9.582 -7.970 -1.054 680 H SER 90 HN SER 90 -9.044 -8.728 0.999 681 HA SER 90 HA SER 90 -6.338 -8.702 2.066 682 HB2 SER 90 HB2 SER 90 -8.225 -6.524 3.005 683 HB3 SER 90 HB1 SER 90 -6.518 -6.702 3.394 684 HG SER 90 HG SER 90 -6.208 -6.487 1.037 685 H LYS 91 HN LYS 91 -9.063 -10.207 2.054 686 HA LYS 91 HA LYS 91 -10.251 -11.551 3.578 687 HB2 LYS 91 HB2 LYS 91 -8.559 -12.636 4.612 688 HB3 LYS 91 HB1 LYS 91 -7.511 -11.236 4.424 689 HG2 LYS 91 HG2 LYS 91 -8.640 -10.263 6.491 690 HG3 LYS 91 HG1 LYS 91 -9.388 -11.844 6.721 691 HD2 LYS 91 HD2 LYS 91 -7.509 -12.372 7.875 692 HD3 LYS 91 HD1 LYS 91 -6.742 -12.498 6.293 693 HE2 LYS 91 HE2 LYS 91 -6.934 -9.749 7.422 694 HE3 LYS 91 HE1 LYS 91 -5.791 -10.852 8.215 695 HZ1 LYS 91 HZ1 LYS 91 -5.855 -9.940 5.421 696 HZ2 LYS 91 HZ2 LYS 91 -5.234 -11.483 5.766 697 HZ3 LYS 91 HZ3 LYS 91 -4.529 -10.105 6.465 698 H GLY 92 HN GLY 92 -10.200 -8.358 3.737 699 HA2 GLY 92 HA2 GLY 92 -11.943 -7.071 4.818 700 HA3 GLY 92 HA1 GLY 92 -12.010 -8.288 6.093 701 H LEU 93 HN LEU 93 -9.291 -6.406 4.724 702 HA LEU 93 HA LEU 93 -7.861 -6.106 7.128 703 HB2 LEU 93 HB2 LEU 93 -6.526 -4.735 5.830 704 HB3 LEU 93 HB1 LEU 93 -7.470 -5.492 4.553 705 HG LEU 93 HG LEU 93 -8.066 -2.805 5.835 706 HD11 LEU 93 HD11 LEU 93 -6.988 -1.818 4.079 707 HD12 LEU 93 HD12 LEU 93 -7.500 -3.062 2.938 708 HD13 LEU 93 HD13 LEU 93 -6.125 -3.354 4.002 709 HD21 LEU 93 HD21 LEU 93 -9.709 -4.641 4.332 710 HD22 LEU 93 HD22 LEU 93 -9.444 -3.179 3.388 711 HD23 LEU 93 HD23 LEU 93 -10.144 -3.070 5.001 712 H ASP 94 HN ASP 94 -7.827 -4.447 8.730 713 HA ASP 94 HA ASP 94 -10.361 -2.857 8.903 714 HB2 ASP 94 HB2 ASP 94 -9.674 -2.832 11.375 715 HB3 ASP 94 HB1 ASP 94 -10.119 -4.405 10.709 716 H THR 95 HN THR 95 -10.210 -0.618 9.472 717 HA THR 95 HA THR 95 -7.864 0.795 10.203 718 HB THR 95 HB THR 95 -6.820 0.076 8.198 719 HG1 THR 95 HG1 THR 95 -6.689 1.971 6.990 720 HG21 THR 95 HG21 THR 95 -8.385 -0.934 6.846 721 HG22 THR 95 HG22 THR 95 -8.217 0.596 5.983 722 HG23 THR 95 HG23 THR 95 -9.568 0.351 7.089 723 H ARG 96 HN ARG 96 -8.023 3.189 9.188 724 HA ARG 96 HA ARG 96 -10.684 4.183 9.875 725 HB2 ARG 96 HB2 ARG 96 -8.091 5.409 8.881 726 HB3 ARG 96 HB1 ARG 96 -9.509 6.371 9.304 727 HG2 ARG 96 HG2 ARG 96 -9.100 6.170 11.515 728 HG3 ARG 96 HG1 ARG 96 -8.868 4.427 11.381 729 HD2 ARG 96 HD2 ARG 96 -6.556 5.001 10.355 730 HD3 ARG 96 HD1 ARG 96 -6.817 6.620 11.037 731 HE ARG 96 HE ARG 96 -7.373 4.459 12.927 732 HH11 ARG 96 HH21 ARG 96 -5.917 7.376 12.743 733 HH12 ARG 96 HH22 ARG 96 -4.463 6.950 13.582 734 HH21 ARG 96 HH11 ARG 96 -5.110 3.544 13.519 735 HH22 ARG 96 HH12 ARG 96 -4.009 4.781 14.026 736 H TYR 97 HN TYR 97 -9.316 2.907 7.058 737 HA TYR 97 HA TYR 97 -10.563 4.733 5.135 738 HB2 TYR 97 HB2 TYR 97 -9.174 2.053 5.035 739 HB3 TYR 97 HB1 TYR 97 -9.858 2.798 3.589 740 HD1 TYR 97 HD1 TYR 97 -7.637 3.613 6.497 741 HD2 TYR 97 HD2 TYR 97 -8.567 4.333 2.369 742 HE1 TYR 97 HE1 TYR 97 -5.639 5.062 6.303 743 HE2 TYR 97 HE2 TYR 97 -6.570 5.781 2.173 744 HH TYR 97 HH TYR 97 -5.119 7.218 4.356 745 H SER 98 HN SER 98 -11.575 1.932 6.927 746 HA SER 98 HA SER 98 -13.752 1.047 7.136 747 HB2 SER 98 HB2 SER 98 -14.599 2.590 4.703 748 HB3 SER 98 HB1 SER 98 -15.520 2.217 6.164 749 HG SER 98 HG SER 98 -14.428 3.775 7.248 750 H ASN 99 HN ASN 99 -11.519 0.106 5.340 751 HA ASN 99 HA ASN 99 -11.181 -1.768 3.959 752 HB2 ASN 99 HB2 ASN 99 -14.128 -1.941 4.554 753 HB3 ASN 99 HB1 ASN 99 -13.270 -3.194 3.663 754 HD21 ASN 99 HD21 ASN 99 -12.916 -1.288 6.697 755 HD22 ASN 99 HD22 ASN 99 -12.312 -2.579 7.612 756 H ILE 100 HN ILE 100 -13.683 0.519 2.976 757 HA ILE 100 HA ILE 100 -14.439 -0.146 0.459 758 HB ILE 100 HB ILE 100 -13.599 2.461 0.023 759 HG12 ILE 100 HG12 ILE 100 -14.555 2.626 2.827 760 HG13 ILE 100 HG11 ILE 100 -12.877 2.129 2.632 761 HG21 ILE 100 HG21 ILE 100 -15.956 2.940 1.058 762 HG22 ILE 100 HG22 ILE 100 -16.051 1.183 1.183 763 HG23 ILE 100 HG23 ILE 100 -15.824 1.944 -0.392 764 HD11 ILE 100 HD11 ILE 100 -13.005 4.568 2.780 765 HD12 ILE 100 HD12 ILE 100 -14.145 4.602 1.435 766 HD13 ILE 100 HD13 ILE 100 -12.480 4.088 1.168 767 HA PRO 101 HA PRO 101 -10.294 1.070 -1.647 768 HB2 PRO 101 HB2 PRO 101 -8.082 1.295 -0.076 769 HB3 PRO 101 HB1 PRO 101 -9.143 2.664 -0.448 770 HG2 PRO 101 HG2 PRO 101 -9.020 0.975 2.000 771 HG3 PRO 101 HG1 PRO 101 -9.254 2.722 1.844 772 HD2 PRO 101 HD2 PRO 101 -11.289 1.001 2.329 773 HD3 PRO 101 HD1 PRO 101 -11.498 2.524 1.443 774 H LEU 102 HN LEU 102 -11.092 -1.541 0.061 775 HA LEU 102 HA LEU 102 -8.524 -2.977 -0.075 776 HB2 LEU 102 HB2 LEU 102 -9.696 -4.661 1.133 777 HB3 LEU 102 HB1 LEU 102 -10.351 -3.136 1.730 778 HG LEU 102 HG LEU 102 -12.027 -3.537 -0.342 779 HD11 LEU 102 HD11 LEU 102 -11.106 -5.636 -1.077 780 HD12 LEU 102 HD12 LEU 102 -12.629 -6.007 -0.268 781 HD13 LEU 102 HD13 LEU 102 -11.098 -6.274 0.566 782 HD21 LEU 102 HD21 LEU 102 -12.058 -3.911 2.512 783 HD22 LEU 102 HD22 LEU 102 -13.090 -5.124 1.754 784 HD23 LEU 102 HD23 LEU 102 -13.378 -3.410 1.456 785 H LEU 103 HN LEU 103 -7.915 -4.334 -1.715 786 HA LEU 103 HA LEU 103 -9.788 -5.801 -3.348 787 HB2 LEU 103 HB2 LEU 103 -9.305 -4.469 -5.486 788 HB3 LEU 103 HB1 LEU 103 -10.389 -3.723 -4.328 789 HG LEU 103 HG LEU 103 -8.845 -2.088 -3.728 790 HD11 LEU 103 HD11 LEU 103 -6.397 -2.297 -4.132 791 HD12 LEU 103 HD12 LEU 103 -6.667 -3.921 -4.762 792 HD13 LEU 103 HD13 LEU 103 -7.009 -3.562 -3.074 793 HD21 LEU 103 HD21 LEU 103 -7.652 -2.589 -6.430 794 HD22 LEU 103 HD22 LEU 103 -8.230 -1.078 -5.727 795 HD23 LEU 103 HD23 LEU 103 -9.384 -2.276 -6.317 796 H THR 104 HN THR 104 -8.116 -5.779 -5.771 797 HA THR 104 HA THR 104 -5.729 -7.166 -4.651 798 HB THR 104 HB THR 104 -7.354 -8.580 -5.847 799 HG1 THR 104 HG1 THR 104 -5.675 -9.547 -6.602 800 HG21 THR 104 HG21 THR 104 -8.503 -7.747 -7.589 801 HG22 THR 104 HG22 THR 104 -7.008 -7.614 -8.515 802 HG23 THR 104 HG23 THR 104 -7.543 -6.267 -7.511 803 H LYS 105 HN LYS 105 -3.969 -7.227 -6.505 804 HA LYS 105 HA LYS 105 -2.552 -4.951 -6.778 805 HB2 LYS 105 HB2 LYS 105 -1.701 -5.882 -8.874 806 HB3 LYS 105 HB1 LYS 105 -2.003 -7.168 -7.708 807 HG2 LYS 105 HG2 LYS 105 -4.423 -6.704 -9.156 808 HG3 LYS 105 HG1 LYS 105 -3.112 -6.868 -10.323 809 HD2 LYS 105 HD2 LYS 105 -3.920 -8.826 -8.156 810 HD3 LYS 105 HD1 LYS 105 -3.948 -9.083 -9.901 811 HE2 LYS 105 HE2 LYS 105 -1.532 -8.898 -8.081 812 HE3 LYS 105 HE1 LYS 105 -1.967 -10.193 -9.210 813 HZ1 LYS 105 HZ1 LYS 105 -1.863 -8.394 -10.982 814 HZ2 LYS 105 HZ2 LYS 105 -0.381 -8.937 -10.355 815 HZ3 LYS 105 HZ3 LYS 105 -1.032 -7.456 -9.839 816 HA PRO 106 HA PRO 106 -5.070 -1.989 -8.915 817 HB2 PRO 106 HB2 PRO 106 -3.051 -0.163 -9.284 818 HB3 PRO 106 HB1 PRO 106 -3.878 -0.378 -7.728 819 HG2 PRO 106 HG2 PRO 106 -1.263 -1.476 -8.655 820 HG3 PRO 106 HG1 PRO 106 -1.691 -0.758 -7.092 821 HD2 PRO 106 HD2 PRO 106 -1.525 -3.416 -7.423 822 HD3 PRO 106 HD1 PRO 106 -2.720 -2.677 -6.338 823 H PHE 107 HN PHE 107 -4.475 -4.108 -10.562 824 HA PHE 107 HA PHE 107 -3.157 -2.838 -12.943 825 HB2 PHE 107 HB2 PHE 107 -3.122 -5.703 -11.941 826 HB3 PHE 107 HB1 PHE 107 -2.426 -5.183 -13.473 827 HD1 PHE 107 HD1 PHE 107 -2.342 -4.127 -9.861 828 HD2 PHE 107 HD2 PHE 107 -0.142 -4.762 -13.480 829 HE1 PHE 107 HE1 PHE 107 -0.255 -3.506 -8.690 830 HE2 PHE 107 HE2 PHE 107 1.949 -4.139 -12.309 831 HZ PHE 107 HZ PHE 107 1.894 -3.508 -9.918 832 H LEU 108 HN LEU 108 -6.042 -4.182 -11.714 833 HA LEU 108 HA LEU 108 -7.099 -4.485 -14.501 834 HB2 LEU 108 HB2 LEU 108 -7.235 -6.376 -12.148 835 HB3 LEU 108 HB1 LEU 108 -8.386 -6.477 -13.481 836 HG LEU 108 HG LEU 108 -5.712 -6.252 -14.532 837 HD11 LEU 108 HD11 LEU 108 -5.410 -8.809 -13.548 838 HD12 LEU 108 HD12 LEU 108 -6.060 -7.950 -12.152 839 HD13 LEU 108 HD13 LEU 108 -4.577 -7.386 -12.921 840 HD21 LEU 108 HD21 LEU 108 -6.379 -8.364 -15.635 841 HD22 LEU 108 HD22 LEU 108 -7.683 -7.179 -15.703 842 HD23 LEU 108 HD23 LEU 108 -7.753 -8.501 -14.538 843 H ASP 109 HN ASP 109 -7.907 -2.215 -13.762 844 HA ASP 109 HA ASP 109 -9.772 -0.907 -13.105 845 HB2 ASP 109 HB2 ASP 109 -11.126 -3.577 -12.654 846 HB3 ASP 109 HB1 ASP 109 -11.864 -2.058 -13.161 847 H SER 110 HN SER 110 -7.935 -2.653 -11.109 848 HA SER 110 HA SER 110 -9.599 -2.447 -8.665 849 HB2 SER 110 HB2 SER 110 -7.011 -3.287 -8.042 850 HB3 SER 110 HB1 SER 110 -8.392 -4.335 -8.348 851 HG SER 110 HG SER 110 -6.247 -3.644 -9.975 852 H GLU 111 HN GLU 111 -6.461 -1.267 -9.918 853 HA GLU 111 HA GLU 111 -5.565 0.392 -7.881 854 HB2 GLU 111 HB2 GLU 111 -4.605 -0.024 -10.198 855 HB3 GLU 111 HB1 GLU 111 -5.745 1.172 -10.805 856 HG2 GLU 111 HG2 GLU 111 -4.775 2.731 -8.974 857 HG3 GLU 111 HG1 GLU 111 -3.431 1.593 -8.915 858 H LEU 112 HN LEU 112 -8.455 0.799 -9.755 859 HA LEU 112 HA LEU 112 -8.797 3.648 -9.369 860 HB2 LEU 112 HB2 LEU 112 -11.265 2.044 -9.565 861 HB3 LEU 112 HB1 LEU 112 -10.694 3.344 -10.599 862 HG LEU 112 HG LEU 112 -9.899 0.428 -10.705 863 HD11 LEU 112 HD11 LEU 112 -12.008 0.895 -11.803 864 HD12 LEU 112 HD12 LEU 112 -10.781 0.685 -13.052 865 HD13 LEU 112 HD13 LEU 112 -11.326 2.304 -12.615 866 HD21 LEU 112 HD21 LEU 112 -7.909 1.158 -11.508 867 HD22 LEU 112 HD22 LEU 112 -8.466 2.830 -11.565 868 HD23 LEU 112 HD23 LEU 112 -8.801 1.742 -12.912 869 H GLU 113 HN GLU 113 -10.910 1.135 -7.990 870 HA GLU 113 HA GLU 113 -12.123 2.446 -5.932 871 HB2 GLU 113 HB2 GLU 113 -10.737 -0.246 -5.657 872 HB3 GLU 113 HB1 GLU 113 -12.184 0.288 -4.790 873 HG2 GLU 113 HG2 GLU 113 -12.969 0.715 -7.357 874 HG3 GLU 113 HG1 GLU 113 -11.900 -0.669 -7.581 875 H ALA 114 HN ALA 114 -8.860 1.014 -5.685 876 HA ALA 114 HA ALA 114 -8.260 1.704 -3.031 877 HB1 ALA 114 HB1 ALA 114 -6.657 0.404 -4.103 878 HB2 ALA 114 HB2 ALA 114 -5.863 1.976 -4.185 879 HB3 ALA 114 HB3 ALA 114 -6.734 1.355 -5.587 880 H VAL 115 HN VAL 115 -7.907 3.770 -5.941 881 HA VAL 115 HA VAL 115 -7.199 6.041 -4.129 882 HB VAL 115 HB VAL 115 -7.098 5.779 -7.151 883 HG11 VAL 115 HG11 VAL 115 -6.574 7.971 -7.129 884 HG12 VAL 115 HG12 VAL 115 -5.239 7.644 -6.024 885 HG13 VAL 115 HG13 VAL 115 -6.843 8.011 -5.387 886 HG21 VAL 115 HG21 VAL 115 -5.516 4.220 -6.383 887 HG22 VAL 115 HG22 VAL 115 -5.150 5.162 -4.938 888 HG23 VAL 115 HG23 VAL 115 -4.550 5.690 -6.510 889 H LEU 116 HN LEU 116 -9.831 4.756 -5.906 890 HA LEU 116 HA LEU 116 -11.212 7.324 -6.326 891 HB2 LEU 116 HB2 LEU 116 -11.412 5.381 -7.860 892 HB3 LEU 116 HB1 LEU 116 -12.103 4.427 -6.547 893 HG LEU 116 HG LEU 116 -13.745 6.562 -6.437 894 HD11 LEU 116 HD11 LEU 116 -13.716 7.847 -8.285 895 HD12 LEU 116 HD12 LEU 116 -13.859 6.428 -9.322 896 HD13 LEU 116 HD13 LEU 116 -12.268 6.987 -8.807 897 HD21 LEU 116 HD21 LEU 116 -15.301 5.224 -7.891 898 HD22 LEU 116 HD22 LEU 116 -14.508 4.262 -6.644 899 HD23 LEU 116 HD23 LEU 116 -13.941 4.183 -8.312 900 H VAL 117 HN VAL 117 -10.925 4.892 -3.883 901 HA VAL 117 HA VAL 117 -13.437 5.319 -2.509 902 HB VAL 117 HB VAL 117 -12.143 4.122 -0.678 903 HG11 VAL 117 HG11 VAL 117 -12.645 3.196 -3.434 904 HG12 VAL 117 HG12 VAL 117 -13.190 2.522 -1.898 905 HG13 VAL 117 HG13 VAL 117 -11.563 2.178 -2.482 906 HG21 VAL 117 HG21 VAL 117 -9.957 5.000 -2.375 907 HG22 VAL 117 HG22 VAL 117 -9.919 3.253 -2.138 908 HG23 VAL 117 HG23 VAL 117 -9.908 4.331 -0.747 909 H GLN 118 HN GLN 118 -10.736 7.354 -2.820 910 HA GLN 118 HA GLN 118 -11.309 8.609 -0.159 911 HB2 GLN 118 HB2 GLN 118 -8.835 8.747 -1.907 912 HB3 GLN 118 HB1 GLN 118 -8.994 9.400 -0.276 913 HG2 GLN 118 HG2 GLN 118 -9.616 6.506 -0.730 914 HG3 GLN 118 HG1 GLN 118 -7.927 7.009 -0.658 915 HE21 GLN 118 HE21 GLN 118 -10.984 7.067 1.210 916 HE22 GLN 118 HE22 GLN 118 -10.240 7.242 2.725 917 H ILE 119 HN ILE 119 -11.382 9.119 -3.587 918 HA ILE 119 HA ILE 119 -11.312 12.046 -3.388 919 HB ILE 119 HB ILE 119 -11.942 11.802 -5.866 920 HG12 ILE 119 HG12 ILE 119 -11.747 9.625 -6.863 921 HG13 ILE 119 HG11 ILE 119 -11.274 8.894 -5.335 922 HG21 ILE 119 HG21 ILE 119 -9.539 11.568 -4.490 923 HG22 ILE 119 HG22 ILE 119 -9.716 11.836 -6.225 924 HG23 ILE 119 HG23 ILE 119 -9.514 10.199 -5.602 925 HD11 ILE 119 HD11 ILE 119 -13.934 10.283 -5.668 926 HD12 ILE 119 HD12 ILE 119 -13.455 9.125 -4.427 927 HD13 ILE 119 HD13 ILE 119 -13.722 8.582 -6.083 928 H SER 120 HN SER 120 -13.561 9.964 -2.375 929 HA SER 120 HA SER 120 -15.716 11.899 -2.445 930 HB2 SER 120 HB2 SER 120 -15.491 9.751 -4.495 931 HB3 SER 120 HB1 SER 120 -17.094 10.036 -3.823 932 HG SER 120 HG SER 120 -15.511 11.628 -5.441 933 H LYS 121 HN LYS 121 -15.755 11.382 -0.181 934 HA LYS 121 HA LYS 121 -17.265 8.916 0.457 935 HB2 LYS 121 HB2 LYS 121 -14.873 8.282 0.523 936 HB3 LYS 121 HB1 LYS 121 -14.556 9.605 1.646 937 HG2 LYS 121 HG2 LYS 121 -14.805 7.489 2.873 938 HG3 LYS 121 HG1 LYS 121 -16.124 8.589 3.273 939 HD2 LYS 121 HD2 LYS 121 -17.552 7.443 1.585 940 HD3 LYS 121 HD1 LYS 121 -16.240 6.302 1.287 941 HE2 LYS 121 HE2 LYS 121 -16.405 6.111 3.993 942 HE3 LYS 121 HE1 LYS 121 -18.099 6.462 3.596 943 HZ1 LYS 121 HZ1 LYS 121 -17.456 4.767 1.641 944 HZ2 LYS 121 HZ2 LYS 121 -18.155 4.273 3.109 945 HZ3 LYS 121 HZ3 LYS 121 -16.476 4.159 2.884 946 H GLU 122 HN GLU 122 -15.522 11.711 1.837 947 HA GLU 122 HA GLU 122 -17.970 12.394 3.390 948 HB2 GLU 122 HB2 GLU 122 -16.115 12.888 5.269 949 HB3 GLU 122 HB1 GLU 122 -16.871 11.305 5.112 950 HG2 GLU 122 HG2 GLU 122 -14.998 10.422 3.912 951 HG3 GLU 122 HG1 GLU 122 -14.303 12.024 3.677 952 H VAL 123 HN VAL 123 -14.651 13.385 2.494 953 HA VAL 123 HA VAL 123 -15.650 16.041 1.727 954 HB VAL 123 HB VAL 123 -14.042 17.138 3.350 955 HG11 VAL 123 HG11 VAL 123 -15.592 17.114 5.128 956 HG12 VAL 123 HG12 VAL 123 -16.036 15.433 4.835 957 HG13 VAL 123 HG13 VAL 123 -16.570 16.692 3.722 958 HG21 VAL 123 HG21 VAL 123 -12.763 15.909 4.782 959 HG22 VAL 123 HG22 VAL 123 -13.037 14.600 3.634 960 HG23 VAL 123 HG23 VAL 123 -14.048 14.737 5.072 Start of MODEL 23 1 H1 GLY 1 HT1 GLY 1 11.411 16.815 18.122 2 H2 GLY 1 HT2 GLY 1 11.821 15.207 18.487 3 H3 GLY 1 HT3 GLY 1 10.908 16.122 19.587 4 HA2 GLY 1 HA2 GLY 1 9.904 14.409 17.733 5 HA3 GLY 1 HA1 GLY 1 8.993 15.660 18.579 6 H SER 2 HN SER 2 10.046 14.603 15.528 7 HA SER 2 HA SER 2 9.901 15.591 13.377 8 HB2 SER 2 HB2 SER 2 7.883 17.344 14.809 9 HB3 SER 2 HB1 SER 2 7.871 16.870 13.112 10 HG SER 2 HG SER 2 7.853 14.626 14.125 11 H HIS 3 HN HIS 3 8.953 18.604 13.424 12 HA HIS 3 HA HIS 3 10.047 20.691 13.277 13 HB2 HIS 3 HB2 HIS 3 10.096 20.482 15.670 14 HB3 HIS 3 HB1 HIS 3 11.422 19.323 15.606 15 HD1 HIS 3 HD1 HIS 3 10.676 22.993 15.081 16 HD2 HIS 3 HD2 HIS 3 13.986 20.478 15.391 17 HE1 HIS 3 HE1 HIS 3 12.709 24.496 15.230 18 H MET 4 HN MET 4 11.244 18.071 11.998 19 HA MET 4 HA MET 4 13.697 19.424 11.003 20 HB2 MET 4 HB2 MET 4 14.303 18.033 12.988 21 HB3 MET 4 HB1 MET 4 13.666 16.615 12.154 22 HG2 MET 4 HG2 MET 4 16.143 16.836 11.910 23 HG3 MET 4 HG1 MET 4 15.303 16.885 10.360 24 HE1 MET 4 HE1 MET 4 17.007 18.261 8.835 25 HE2 MET 4 HE2 MET 4 17.951 17.607 10.171 26 HE3 MET 4 HE3 MET 4 18.195 19.276 9.663 27 H THR 5 HN THR 5 11.301 16.834 10.688 28 HA THR 5 HA THR 5 12.009 16.634 7.780 29 HB THR 5 HB THR 5 11.177 14.246 8.062 30 HG1 THR 5 HG1 THR 5 10.037 14.596 9.992 31 HG21 THR 5 HG21 THR 5 13.349 13.707 8.293 32 HG22 THR 5 HG22 THR 5 13.366 14.267 9.965 33 HG23 THR 5 HG23 THR 5 13.660 15.405 8.649 34 H GLU 6 HN GLU 6 10.092 16.000 6.426 35 HA GLU 6 HA GLU 6 7.435 16.514 7.647 36 HB2 GLU 6 HB2 GLU 6 7.004 18.329 6.037 37 HB3 GLU 6 HB1 GLU 6 8.426 18.703 7.011 38 HG2 GLU 6 HG2 GLU 6 9.673 17.442 5.024 39 HG3 GLU 6 HG1 GLU 6 8.248 17.960 4.122 40 H ARG 7 HN ARG 7 9.143 14.432 5.993 41 HA ARG 7 HA ARG 7 7.068 13.917 3.883 42 HB2 ARG 7 HB2 ARG 7 9.969 13.031 4.036 43 HB3 ARG 7 HB1 ARG 7 8.887 12.830 2.658 44 HG2 ARG 7 HG2 ARG 7 8.765 15.211 2.310 45 HG3 ARG 7 HG1 ARG 7 9.620 15.528 3.823 46 HD2 ARG 7 HD2 ARG 7 11.150 13.729 2.112 47 HD3 ARG 7 HD1 ARG 7 10.807 15.269 1.300 48 HE ARG 7 HE ARG 7 11.598 15.666 4.064 49 HH11 ARG 7 HH21 ARG 7 12.410 17.508 1.878 50 HH12 ARG 7 HH22 ARG 7 14.093 17.148 1.686 51 HH21 ARG 7 HH11 ARG 7 13.916 14.124 3.377 52 HH22 ARG 7 HH12 ARG 7 14.945 15.232 2.531 53 H ARG 8 HN ARG 8 6.667 13.070 6.590 54 HA ARG 8 HA ARG 8 7.569 10.366 7.047 55 HB2 ARG 8 HB2 ARG 8 5.741 12.373 8.200 56 HB3 ARG 8 HB1 ARG 8 5.260 10.703 8.504 57 HG2 ARG 8 HG2 ARG 8 7.181 10.223 9.715 58 HG3 ARG 8 HG1 ARG 8 8.131 11.465 8.897 59 HD2 ARG 8 HD2 ARG 8 7.706 12.266 11.141 60 HD3 ARG 8 HD1 ARG 8 6.640 13.189 10.062 61 HE ARG 8 HE ARG 8 5.646 10.699 11.380 62 HH11 ARG 8 HH11 ARG 8 4.790 13.483 9.738 63 HH12 ARG 8 HH12 ARG 8 3.517 13.948 10.816 64 HH21 ARG 8 HH21 ARG 8 4.287 11.540 13.186 65 HH22 ARG 8 HH22 ARG 8 3.236 12.852 12.769 66 H LEU 9 HN LEU 9 5.349 11.598 4.812 67 HA LEU 9 HA LEU 9 3.435 9.402 4.885 68 HB2 LEU 9 HB2 LEU 9 3.964 11.463 2.730 69 HB3 LEU 9 HB1 LEU 9 2.457 10.593 3.024 70 HG LEU 9 HG LEU 9 3.040 11.771 5.481 71 HD11 LEU 9 HD11 LEU 9 4.137 13.716 5.170 72 HD12 LEU 9 HD12 LEU 9 3.087 14.154 3.821 73 HD13 LEU 9 HD13 LEU 9 4.518 13.160 3.539 74 HD21 LEU 9 HD21 LEU 9 1.212 13.458 4.515 75 HD22 LEU 9 HD22 LEU 9 0.805 11.778 4.865 76 HD23 LEU 9 HD23 LEU 9 1.157 12.274 3.209 77 H ARG 10 HN ARG 10 3.589 7.497 3.732 78 HA ARG 10 HA ARG 10 5.519 7.317 1.468 79 HB2 ARG 10 HB2 ARG 10 6.607 6.735 3.674 80 HB3 ARG 10 HB1 ARG 10 5.463 5.400 3.817 81 HG2 ARG 10 HG2 ARG 10 7.652 4.701 2.833 82 HG3 ARG 10 HG1 ARG 10 6.290 4.413 1.749 83 HD2 ARG 10 HD2 ARG 10 7.164 5.802 0.188 84 HD3 ARG 10 HD1 ARG 10 7.358 7.098 1.387 85 HE ARG 10 HE ARG 10 9.484 5.417 0.494 86 HH11 ARG 10 HH21 ARG 10 8.701 7.694 2.782 87 HH12 ARG 10 HH22 ARG 10 9.859 7.183 3.965 88 HH21 ARG 10 HH11 ARG 10 10.701 4.275 2.276 89 HH22 ARG 10 HH12 ARG 10 10.986 5.245 3.681 90 H VAL 11 HN VAL 11 5.086 5.504 0.058 91 HA VAL 11 HA VAL 11 2.522 4.048 0.593 92 HB VAL 11 HB VAL 11 2.048 5.879 -0.906 93 HG11 VAL 11 HG11 VAL 11 4.354 6.404 -1.554 94 HG12 VAL 11 HG12 VAL 11 3.354 6.201 -2.993 95 HG13 VAL 11 HG13 VAL 11 4.446 4.913 -2.491 96 HG21 VAL 11 HG21 VAL 11 0.815 4.155 -1.795 97 HG22 VAL 11 HG22 VAL 11 2.231 3.135 -2.044 98 HG23 VAL 11 HG23 VAL 11 1.880 4.445 -3.171 99 H LEU 12 HN LEU 12 3.963 2.257 1.222 100 HA LEU 12 HA LEU 12 5.828 1.167 -0.776 101 HB2 LEU 12 HB2 LEU 12 4.928 -0.191 1.755 102 HB3 LEU 12 HB1 LEU 12 6.524 -0.195 1.009 103 HG LEU 12 HG LEU 12 5.961 2.511 1.593 104 HD11 LEU 12 HD11 LEU 12 4.445 0.848 3.290 105 HD12 LEU 12 HD12 LEU 12 4.700 2.587 3.403 106 HD13 LEU 12 HD13 LEU 12 5.790 1.484 4.234 107 HD21 LEU 12 HD21 LEU 12 8.034 2.375 2.522 108 HD22 LEU 12 HD22 LEU 12 8.032 0.739 1.862 109 HD23 LEU 12 HD23 LEU 12 7.580 1.011 3.545 110 H VAL 13 HN VAL 13 4.463 0.457 -2.525 111 HA VAL 13 HA VAL 13 2.471 -1.685 -1.840 112 HB VAL 13 HB VAL 13 2.857 -0.172 -4.445 113 HG11 VAL 13 HG11 VAL 13 0.994 -1.264 -5.158 114 HG12 VAL 13 HG12 VAL 13 0.199 -1.118 -3.589 115 HG13 VAL 13 HG13 VAL 13 1.372 -2.407 -3.868 116 HG21 VAL 13 HG21 VAL 13 0.698 1.015 -3.426 117 HG22 VAL 13 HG22 VAL 13 2.319 1.609 -3.072 118 HG23 VAL 13 HG23 VAL 13 1.478 0.593 -1.902 119 H VAL 14 HN VAL 14 3.086 -3.760 -2.336 120 HA VAL 14 HA VAL 14 5.135 -4.079 -4.472 121 HB VAL 14 HB VAL 14 6.590 -5.202 -3.029 122 HG11 VAL 14 HG11 VAL 14 6.165 -2.735 -2.424 123 HG12 VAL 14 HG12 VAL 14 7.001 -3.728 -1.229 124 HG13 VAL 14 HG13 VAL 14 5.288 -3.365 -1.029 125 HG21 VAL 14 HG21 VAL 14 5.949 -6.191 -0.896 126 HG22 VAL 14 HG22 VAL 14 4.851 -6.764 -2.154 127 HG23 VAL 14 HG23 VAL 14 4.330 -5.503 -1.036 128 H GLU 15 HN GLU 15 4.859 -5.800 -5.721 129 HA GLU 15 HA GLU 15 3.475 -8.229 -4.952 130 HB2 GLU 15 HB2 GLU 15 1.527 -7.941 -6.348 131 HB3 GLU 15 HB1 GLU 15 1.656 -6.501 -5.334 132 HG2 GLU 15 HG2 GLU 15 1.556 -5.311 -7.245 133 HG3 GLU 15 HG1 GLU 15 3.198 -5.875 -7.561 134 H ASP 16 HN ASP 16 3.704 -9.835 -6.674 135 HA ASP 16 HA ASP 16 6.163 -9.712 -8.070 136 HB2 ASP 16 HB2 ASP 16 5.371 -11.819 -9.031 137 HB3 ASP 16 HB1 ASP 16 4.981 -11.713 -7.312 138 H GLU 17 HN GLU 17 4.968 -7.364 -9.094 139 HA GLU 17 HA GLU 17 5.031 -8.001 -11.968 140 HB2 GLU 17 HB2 GLU 17 2.564 -6.823 -10.658 141 HB3 GLU 17 HB1 GLU 17 2.808 -6.970 -12.390 142 HG2 GLU 17 HG2 GLU 17 3.035 -9.442 -12.109 143 HG3 GLU 17 HG1 GLU 17 2.638 -9.253 -10.403 144 H SER 18 HN SER 18 4.981 -5.963 -13.285 145 HA SER 18 HA SER 18 6.270 -3.732 -11.782 146 HB2 SER 18 HB2 SER 18 7.438 -4.688 -13.715 147 HB3 SER 18 HB1 SER 18 6.019 -4.435 -14.727 148 HG SER 18 HG SER 18 7.487 -2.405 -13.383 149 H MET 19 HN MET 19 3.307 -4.627 -13.280 150 HA MET 19 HA MET 19 2.300 -2.127 -14.191 151 HB2 MET 19 HB2 MET 19 1.369 -4.486 -14.454 152 HB3 MET 19 HB1 MET 19 0.772 -4.347 -12.800 153 HG2 MET 19 HG2 MET 19 -0.911 -2.939 -13.391 154 HG3 MET 19 HG1 MET 19 0.103 -2.055 -14.532 155 HE1 MET 19 HE1 MET 19 -1.047 -5.392 -13.661 156 HE2 MET 19 HE2 MET 19 -0.266 -6.180 -15.032 157 HE3 MET 19 HE3 MET 19 -2.020 -6.009 -15.001 158 H ILE 20 HN ILE 20 2.924 -3.324 -10.992 159 HA ILE 20 HA ILE 20 1.098 -1.444 -9.651 160 HB ILE 20 HB ILE 20 1.585 -3.653 -8.731 161 HG12 ILE 20 HG12 ILE 20 2.862 -1.423 -7.124 162 HG13 ILE 20 HG11 ILE 20 1.151 -1.863 -7.117 163 HG21 ILE 20 HG21 ILE 20 3.742 -4.170 -9.561 164 HG22 ILE 20 HG22 ILE 20 3.954 -4.019 -7.817 165 HG23 ILE 20 HG23 ILE 20 4.438 -2.699 -8.882 166 HD11 ILE 20 HD11 ILE 20 3.013 -2.837 -5.350 167 HD12 ILE 20 HD12 ILE 20 2.973 -4.112 -6.569 168 HD13 ILE 20 HD13 ILE 20 1.490 -3.637 -5.741 169 H ALA 21 HN ALA 21 4.246 -1.414 -10.977 170 HA ALA 21 HA ALA 21 5.473 0.543 -9.238 171 HB1 ALA 21 HB1 ALA 21 6.380 0.452 -12.008 172 HB2 ALA 21 HB2 ALA 21 6.141 -1.165 -11.344 173 HB3 ALA 21 HB3 ALA 21 7.234 -0.035 -10.544 174 H MET 22 HN MET 22 4.370 0.886 -12.638 175 HA MET 22 HA MET 22 4.355 3.747 -12.610 176 HB2 MET 22 HB2 MET 22 4.316 2.520 -14.685 177 HB3 MET 22 HB1 MET 22 2.865 1.637 -14.203 178 HG2 MET 22 HG2 MET 22 2.518 4.549 -14.128 179 HG3 MET 22 HG1 MET 22 2.892 3.936 -15.740 180 HE1 MET 22 HE1 MET 22 -0.781 4.603 -15.845 181 HE2 MET 22 HE2 MET 22 0.730 5.409 -15.430 182 HE3 MET 22 HE3 MET 22 -0.410 4.981 -14.157 183 H LEU 23 HN LEU 23 2.159 1.384 -11.361 184 HA LEU 23 HA LEU 23 -0.179 3.096 -11.153 185 HB2 LEU 23 HB2 LEU 23 -0.507 0.743 -11.152 186 HB3 LEU 23 HB1 LEU 23 0.803 0.475 -10.009 187 HG LEU 23 HG LEU 23 -1.594 0.228 -9.118 188 HD11 LEU 23 HD11 LEU 23 0.782 1.330 -7.968 189 HD12 LEU 23 HD12 LEU 23 -0.468 0.359 -7.193 190 HD13 LEU 23 HD13 LEU 23 -0.618 2.116 -7.236 191 HD21 LEU 23 HD21 LEU 23 -1.714 2.908 -10.133 192 HD22 LEU 23 HD22 LEU 23 -1.927 2.957 -8.385 193 HD23 LEU 23 HD23 LEU 23 -2.994 1.965 -9.376 194 H ILE 24 HN ILE 24 2.833 3.165 -9.676 195 HA ILE 24 HA ILE 24 1.812 4.216 -7.082 196 HB ILE 24 HB ILE 24 3.725 2.373 -7.738 197 HG12 ILE 24 HG12 ILE 24 4.216 4.042 -5.308 198 HG13 ILE 24 HG11 ILE 24 2.634 3.279 -5.479 199 HG21 ILE 24 HG21 ILE 24 5.286 3.936 -8.716 200 HG22 ILE 24 HG22 ILE 24 5.922 3.455 -7.144 201 HG23 ILE 24 HG23 ILE 24 5.138 5.022 -7.335 202 HD11 ILE 24 HD11 ILE 24 3.973 1.122 -6.023 203 HD12 ILE 24 HD12 ILE 24 3.902 1.649 -4.342 204 HD13 ILE 24 HD13 ILE 24 5.343 1.970 -5.305 205 H GLU 25 HN GLU 25 4.103 5.031 -9.710 206 HA GLU 25 HA GLU 25 4.934 7.571 -8.800 207 HB2 GLU 25 HB2 GLU 25 4.633 6.145 -11.408 208 HB3 GLU 25 HB1 GLU 25 4.952 7.879 -11.470 209 HG2 GLU 25 HG2 GLU 25 6.626 6.410 -9.539 210 HG3 GLU 25 HG1 GLU 25 6.895 5.960 -11.223 211 H ASP 26 HN ASP 26 1.912 6.590 -10.325 212 HA ASP 26 HA ASP 26 1.014 9.273 -10.970 213 HB2 ASP 26 HB2 ASP 26 -0.943 8.127 -11.668 214 HB3 ASP 26 HB1 ASP 26 0.330 6.924 -11.876 215 H THR 27 HN THR 27 0.252 7.014 -8.265 216 HA THR 27 HA THR 27 -1.460 8.899 -6.918 217 HB THR 27 HB THR 27 -1.438 7.273 -5.169 218 HG1 THR 27 HG1 THR 27 0.355 6.334 -4.648 219 HG21 THR 27 HG21 THR 27 -0.881 5.249 -7.179 220 HG22 THR 27 HG22 THR 27 -1.831 6.573 -7.853 221 HG23 THR 27 HG23 THR 27 -2.420 5.694 -6.441 222 H LEU 28 HN LEU 28 2.010 8.180 -6.825 223 HA LEU 28 HA LEU 28 2.594 9.801 -4.504 224 HB2 LEU 28 HB2 LEU 28 4.415 8.497 -4.930 225 HB3 LEU 28 HB1 LEU 28 3.982 8.308 -6.623 226 HG LEU 28 HG LEU 28 5.088 10.935 -5.655 227 HD11 LEU 28 HD11 LEU 28 6.458 8.494 -5.339 228 HD12 LEU 28 HD12 LEU 28 7.153 10.115 -5.275 229 HD13 LEU 28 HD13 LEU 28 7.129 9.224 -6.797 230 HD21 LEU 28 HD21 LEU 28 4.818 9.429 -8.237 231 HD22 LEU 28 HD22 LEU 28 6.121 10.605 -8.072 232 HD23 LEU 28 HD23 LEU 28 4.443 11.115 -7.886 233 H CYS 29 HN CYS 29 1.782 10.467 -7.784 234 HA CYS 29 HA CYS 29 3.030 13.022 -8.139 235 HB2 CYS 29 HB2 CYS 29 1.940 11.504 -9.850 236 HB3 CYS 29 HB1 CYS 29 0.381 12.020 -9.214 237 HG CYS 29 HG CYS 29 1.009 14.494 -9.926 238 H GLU 30 HN GLU 30 0.175 11.945 -6.417 239 HA GLU 30 HA GLU 30 -0.759 14.715 -5.960 240 HB2 GLU 30 HB2 GLU 30 -2.294 12.805 -4.485 241 HB3 GLU 30 HB1 GLU 30 -2.792 13.709 -5.905 242 HG2 GLU 30 HG2 GLU 30 -1.439 11.821 -7.183 243 HG3 GLU 30 HG1 GLU 30 -1.741 10.915 -5.700 244 H LEU 31 HN LEU 31 0.300 11.852 -4.199 245 HA LEU 31 HA LEU 31 0.333 13.129 -1.585 246 HB2 LEU 31 HB2 LEU 31 1.018 10.542 -2.887 247 HB3 LEU 31 HB1 LEU 31 1.785 10.876 -1.340 248 HG LEU 31 HG LEU 31 -1.073 11.521 -1.366 249 HD11 LEU 31 HD11 LEU 31 -1.900 9.598 -2.198 250 HD12 LEU 31 HD12 LEU 31 -0.895 8.665 -1.088 251 HD13 LEU 31 HD13 LEU 31 -0.267 9.128 -2.669 252 HD21 LEU 31 HD21 LEU 31 -0.535 11.288 0.818 253 HD22 LEU 31 HD22 LEU 31 1.026 10.584 0.395 254 HD23 LEU 31 HD23 LEU 31 -0.395 9.550 0.545 255 H GLY 32 HN GLY 32 2.770 12.329 -4.057 256 HA2 GLY 32 HA2 GLY 32 4.951 13.195 -4.328 257 HA3 GLY 32 HA1 GLY 32 4.590 14.355 -3.039 258 H HIS 33 HN HIS 33 4.018 10.984 -2.512 259 HA HIS 33 HA HIS 33 5.198 10.589 -0.097 260 HB2 HIS 33 HB2 HIS 33 5.203 8.848 -2.573 261 HB3 HIS 33 HB1 HIS 33 5.722 8.243 -0.996 262 HD1 HIS 33 HD1 HIS 33 2.897 8.002 -2.953 263 HD2 HIS 33 HD2 HIS 33 3.417 9.291 0.975 264 HE1 HIS 33 HE1 HIS 33 0.655 7.720 -1.808 265 H GLU 34 HN GLU 34 7.304 9.872 0.651 266 HA GLU 34 HA GLU 34 9.559 11.285 -0.338 267 HB2 GLU 34 HB2 GLU 34 8.953 9.921 1.882 268 HB3 GLU 34 HB1 GLU 34 9.869 8.658 1.059 269 HG2 GLU 34 HG2 GLU 34 11.015 11.421 1.161 270 HG3 GLU 34 HG1 GLU 34 11.106 10.412 2.607 271 H VAL 35 HN VAL 35 9.183 7.731 -0.444 272 HA VAL 35 HA VAL 35 10.143 7.698 -3.261 273 HB VAL 35 HB VAL 35 11.833 5.931 -2.521 274 HG11 VAL 35 HG11 VAL 35 12.681 8.092 -3.074 275 HG12 VAL 35 HG12 VAL 35 13.392 7.693 -1.510 276 HG13 VAL 35 HG13 VAL 35 12.027 8.806 -1.601 277 HG21 VAL 35 HG21 VAL 35 10.809 6.905 0.140 278 HG22 VAL 35 HG22 VAL 35 12.474 6.348 -0.014 279 HG23 VAL 35 HG23 VAL 35 11.141 5.254 -0.383 280 H ALA 36 HN ALA 36 8.257 6.723 -4.009 281 HA ALA 36 HA ALA 36 6.655 4.816 -2.672 282 HB1 ALA 36 HB1 ALA 36 6.506 4.349 -5.447 283 HB2 ALA 36 HB2 ALA 36 6.957 6.044 -5.270 284 HB3 ALA 36 HB3 ALA 36 5.493 5.435 -4.497 285 H ALA 37 HN ALA 37 6.431 2.535 -3.008 286 HA ALA 37 HA ALA 37 8.923 1.136 -3.933 287 HB1 ALA 37 HB1 ALA 37 8.941 0.032 -1.941 288 HB2 ALA 37 HB2 ALA 37 7.198 -0.237 -1.986 289 HB3 ALA 37 HB3 ALA 37 7.840 1.293 -1.385 290 H THR 38 HN THR 38 8.531 -0.330 -5.561 291 HA THR 38 HA THR 38 5.701 -1.201 -6.002 292 HB THR 38 HB THR 38 6.355 0.441 -7.634 293 HG1 THR 38 HG1 THR 38 6.827 -2.025 -8.916 294 HG21 THR 38 HG21 THR 38 8.403 -0.074 -9.086 295 HG22 THR 38 HG22 THR 38 8.861 -1.230 -7.836 296 HG23 THR 38 HG23 THR 38 8.722 0.485 -7.444 297 H ALA 39 HN ALA 39 5.656 -3.151 -7.532 298 HA ALA 39 HA ALA 39 6.043 -5.447 -7.788 299 HB1 ALA 39 HB1 ALA 39 8.796 -5.692 -7.568 300 HB2 ALA 39 HB2 ALA 39 8.566 -4.025 -8.097 301 HB3 ALA 39 HB3 ALA 39 7.903 -5.353 -9.050 302 H SER 40 HN SER 40 6.675 -7.374 -6.557 303 HA SER 40 HA SER 40 6.455 -6.927 -3.694 304 HB2 SER 40 HB2 SER 40 6.385 -9.342 -3.631 305 HB3 SER 40 HB1 SER 40 5.448 -8.798 -5.013 306 HG SER 40 HG SER 40 6.748 -9.964 -6.171 307 H ARG 41 HN ARG 41 8.136 -6.562 -2.336 308 HA ARG 41 HA ARG 41 10.763 -7.810 -2.894 309 HB2 ARG 41 HB2 ARG 41 10.363 -5.329 -3.701 310 HB3 ARG 41 HB1 ARG 41 10.587 -4.952 -1.991 311 HG2 ARG 41 HG2 ARG 41 12.748 -4.787 -3.030 312 HG3 ARG 41 HG1 ARG 41 12.747 -6.280 -2.091 313 HD2 ARG 41 HD2 ARG 41 13.029 -7.551 -3.954 314 HD3 ARG 41 HD1 ARG 41 11.759 -6.673 -4.829 315 HE ARG 41 HE ARG 41 14.510 -5.540 -4.474 316 HH11 ARG 41 HH21 ARG 41 13.338 -7.248 -6.886 317 HH12 ARG 41 HH22 ARG 41 13.149 -5.974 -8.045 318 HH21 ARG 41 HH11 ARG 41 13.557 -3.435 -5.719 319 HH22 ARG 41 HH12 ARG 41 13.271 -3.817 -7.384 320 H MET 42 HN MET 42 11.441 -8.811 -1.036 321 HA MET 42 HA MET 42 10.039 -8.627 1.448 322 HB2 MET 42 HB2 MET 42 12.824 -9.615 0.765 323 HB3 MET 42 HB1 MET 42 11.936 -10.020 2.233 324 HG2 MET 42 HG2 MET 42 10.129 -10.598 0.198 325 HG3 MET 42 HG1 MET 42 11.677 -11.136 -0.453 326 HE1 MET 42 HE1 MET 42 10.203 -14.304 0.411 327 HE2 MET 42 HE2 MET 42 11.936 -14.133 0.146 328 HE3 MET 42 HE3 MET 42 10.810 -13.112 -0.746 329 H GLN 43 HN GLN 43 12.981 -7.027 0.259 330 HA GLN 43 HA GLN 43 13.875 -5.927 2.743 331 HB2 GLN 43 HB2 GLN 43 15.160 -6.078 0.616 332 HB3 GLN 43 HB1 GLN 43 14.108 -4.846 -0.083 333 HG2 GLN 43 HG2 GLN 43 16.195 -3.833 0.753 334 HG3 GLN 43 HG1 GLN 43 14.808 -3.253 1.675 335 HE21 GLN 43 HE21 GLN 43 17.870 -4.814 1.948 336 HE22 GLN 43 HE22 GLN 43 17.748 -5.253 3.584 337 H GLU 44 HN GLU 44 12.257 -4.125 0.095 338 HA GLU 44 HA GLU 44 11.595 -1.840 1.623 339 HB2 GLU 44 HB2 GLU 44 10.556 -3.188 -0.853 340 HB3 GLU 44 HB1 GLU 44 9.709 -1.775 -0.221 341 HG2 GLU 44 HG2 GLU 44 11.222 -0.515 -1.319 342 HG3 GLU 44 HG1 GLU 44 12.403 -1.051 -0.123 343 H ALA 45 HN ALA 45 9.661 -4.772 0.956 344 HA ALA 45 HA ALA 45 7.240 -4.172 2.187 345 HB1 ALA 45 HB1 ALA 45 8.971 -6.658 2.200 346 HB2 ALA 45 HB2 ALA 45 7.610 -6.296 1.138 347 HB3 ALA 45 HB3 ALA 45 7.328 -6.656 2.841 348 H LEU 46 HN LEU 46 10.179 -5.407 3.763 349 HA LEU 46 HA LEU 46 9.371 -5.465 6.449 350 HB2 LEU 46 HB2 LEU 46 11.553 -6.159 5.291 351 HB3 LEU 46 HB1 LEU 46 12.034 -4.467 5.402 352 HG LEU 46 HG LEU 46 11.963 -4.514 7.796 353 HD11 LEU 46 HD11 LEU 46 10.483 -7.094 7.347 354 HD12 LEU 46 HD12 LEU 46 10.038 -5.727 8.367 355 HD13 LEU 46 HD13 LEU 46 11.329 -6.817 8.868 356 HD21 LEU 46 HD21 LEU 46 13.855 -5.761 6.505 357 HD22 LEU 46 HD22 LEU 46 13.101 -7.224 7.138 358 HD23 LEU 46 HD23 LEU 46 13.728 -6.005 8.247 359 H ASP 47 HN ASP 47 10.510 -2.734 4.488 360 HA ASP 47 HA ASP 47 10.537 -0.799 6.619 361 HB2 ASP 47 HB2 ASP 47 11.743 -0.814 4.362 362 HB3 ASP 47 HB1 ASP 47 10.203 -0.334 3.648 363 H ILE 48 HN ILE 48 7.957 -2.247 4.857 364 HA ILE 48 HA ILE 48 6.185 0.076 5.215 365 HB ILE 48 HB ILE 48 4.882 -0.873 3.583 366 HG12 ILE 48 HG12 ILE 48 5.597 -3.554 4.787 367 HG13 ILE 48 HG11 ILE 48 4.031 -2.745 4.798 368 HG21 ILE 48 HG21 ILE 48 7.285 -0.871 2.805 369 HG22 ILE 48 HG22 ILE 48 6.204 -1.948 1.926 370 HG23 ILE 48 HG23 ILE 48 7.308 -2.599 3.137 371 HD11 ILE 48 HD11 ILE 48 5.328 -4.310 2.637 372 HD12 ILE 48 HD12 ILE 48 4.514 -2.835 2.118 373 HD13 ILE 48 HD13 ILE 48 3.616 -4.079 2.987 374 H ALA 49 HN ALA 49 6.854 -3.030 6.686 375 HA ALA 49 HA ALA 49 4.352 -2.872 8.234 376 HB1 ALA 49 HB1 ALA 49 6.569 -4.900 8.530 377 HB2 ALA 49 HB2 ALA 49 5.450 -4.966 7.168 378 HB3 ALA 49 HB3 ALA 49 4.842 -5.118 8.816 379 H ARG 50 HN ARG 50 7.746 -3.522 9.175 380 HA ARG 50 HA ARG 50 7.512 -2.833 11.891 381 HB2 ARG 50 HB2 ARG 50 9.903 -2.807 11.838 382 HB3 ARG 50 HB1 ARG 50 9.407 -3.938 10.573 383 HG2 ARG 50 HG2 ARG 50 9.480 -1.825 9.023 384 HG3 ARG 50 HG1 ARG 50 10.501 -1.149 10.293 385 HD2 ARG 50 HD2 ARG 50 11.141 -3.918 9.364 386 HD3 ARG 50 HD1 ARG 50 11.565 -2.570 8.289 387 HE ARG 50 HE ARG 50 12.380 -2.580 11.171 388 HH11 ARG 50 HH11 ARG 50 12.967 -0.166 9.530 389 HH12 ARG 50 HH12 ARG 50 14.586 -0.465 8.993 390 HH21 ARG 50 HH21 ARG 50 14.497 -3.845 9.750 391 HH22 ARG 50 HH22 ARG 50 15.450 -2.547 9.112 392 H LYS 51 HN LYS 51 7.974 -0.725 9.089 393 HA LYS 51 HA LYS 51 8.791 1.658 10.376 394 HB2 LYS 51 HB2 LYS 51 8.777 1.423 7.982 395 HB3 LYS 51 HB1 LYS 51 7.043 1.089 7.969 396 HG2 LYS 51 HG2 LYS 51 7.573 3.435 7.303 397 HG3 LYS 51 HG1 LYS 51 6.563 3.349 8.749 398 HD2 LYS 51 HD2 LYS 51 8.163 4.282 10.050 399 HD3 LYS 51 HD1 LYS 51 9.432 3.276 9.349 400 HE2 LYS 51 HE2 LYS 51 8.398 5.298 7.474 401 HE3 LYS 51 HE1 LYS 51 9.179 5.991 8.910 402 HZ1 LYS 51 HZ1 LYS 51 10.846 5.486 7.254 403 HZ2 LYS 51 HZ2 LYS 51 10.302 3.880 7.140 404 HZ3 LYS 51 HZ3 LYS 51 11.029 4.435 8.572 405 H GLY 52 HN GLY 52 5.498 0.392 9.808 406 HA2 GLY 52 HA2 GLY 52 3.515 0.832 11.000 407 HA3 GLY 52 HA1 GLY 52 4.483 1.709 12.185 408 H GLN 53 HN GLN 53 5.391 3.875 11.257 409 HA GLN 53 HA GLN 53 3.093 5.429 10.309 410 HB2 GLN 53 HB2 GLN 53 4.605 7.302 10.736 411 HB3 GLN 53 HB1 GLN 53 4.737 6.145 12.060 412 HG2 GLN 53 HG2 GLN 53 6.903 5.697 11.589 413 HG3 GLN 53 HG1 GLN 53 6.577 5.553 9.861 414 HE21 GLN 53 HE21 GLN 53 7.478 7.839 12.418 415 HE22 GLN 53 HE22 GLN 53 7.904 9.108 11.374 416 H PHE 54 HN PHE 54 3.631 3.663 8.267 417 HA PHE 54 HA PHE 54 5.291 5.187 6.302 418 HB2 PHE 54 HB2 PHE 54 5.330 3.052 5.090 419 HB3 PHE 54 HB1 PHE 54 5.893 2.847 6.738 420 HD1 PHE 54 HD1 PHE 54 4.517 1.726 8.414 421 HD2 PHE 54 HD2 PHE 54 3.194 2.095 4.354 422 HE1 PHE 54 HE1 PHE 54 2.769 0.020 8.827 423 HE2 PHE 54 HE2 PHE 54 1.459 0.377 4.768 424 HZ PHE 54 HZ PHE 54 1.247 -0.662 6.999 425 H ASP 55 HN ASP 55 2.219 5.189 7.236 426 HA ASP 55 HA ASP 55 0.251 5.944 6.244 427 HB2 ASP 55 HB2 ASP 55 1.753 7.528 5.189 428 HB3 ASP 55 HB1 ASP 55 2.145 6.364 3.933 429 H ILE 56 HN ILE 56 1.998 3.812 3.826 430 HA ILE 56 HA ILE 56 -0.481 2.169 3.735 431 HB ILE 56 HB ILE 56 0.614 3.711 1.368 432 HG12 ILE 56 HG12 ILE 56 -1.953 3.883 2.976 433 HG13 ILE 56 HG11 ILE 56 -0.726 5.133 2.789 434 HG21 ILE 56 HG21 ILE 56 -0.207 1.960 0.181 435 HG22 ILE 56 HG22 ILE 56 -1.797 2.581 0.621 436 HG23 ILE 56 HG23 ILE 56 -1.055 1.304 1.581 437 HD11 ILE 56 HD11 ILE 56 -2.863 4.280 0.908 438 HD12 ILE 56 HD12 ILE 56 -1.310 4.713 0.193 439 HD13 ILE 56 HD13 ILE 56 -2.181 5.883 1.185 440 H ALA 57 HN ALA 57 -0.177 0.028 2.874 441 HA ALA 57 HA ALA 57 2.474 -0.619 1.687 442 HB1 ALA 57 HB1 ALA 57 2.594 -2.497 3.487 443 HB2 ALA 57 HB2 ALA 57 1.432 -1.509 4.372 444 HB3 ALA 57 HB3 ALA 57 3.021 -0.857 3.973 445 H ILE 58 HN ILE 58 2.120 -2.185 0.067 446 HA ILE 58 HA ILE 58 -0.335 -3.881 0.388 447 HB ILE 58 HB ILE 58 0.615 -2.207 -1.934 448 HG12 ILE 58 HG12 ILE 58 -1.973 -1.649 -1.655 449 HG13 ILE 58 HG11 ILE 58 -1.676 -2.225 -0.013 450 HG21 ILE 58 HG21 ILE 58 -0.303 -3.677 -3.364 451 HG22 ILE 58 HG22 ILE 58 -1.846 -3.501 -2.531 452 HG23 ILE 58 HG23 ILE 58 -0.711 -4.752 -2.028 453 HD11 ILE 58 HD11 ILE 58 -0.739 0.240 -1.341 454 HD12 ILE 58 HD12 ILE 58 0.499 -0.611 -0.415 455 HD13 ILE 58 HD13 ILE 58 -0.990 -0.092 0.372 456 H ILE 59 HN ILE 59 0.709 -5.854 0.752 457 HA ILE 59 HA ILE 59 2.749 -6.776 -1.230 458 HB ILE 59 HB ILE 59 1.888 -7.402 1.563 459 HG12 ILE 59 HG12 ILE 59 4.370 -8.003 1.668 460 HG13 ILE 59 HG11 ILE 59 4.468 -7.429 0.004 461 HG21 ILE 59 HG21 ILE 59 3.073 -9.691 1.318 462 HG22 ILE 59 HG22 ILE 59 2.642 -9.562 -0.388 463 HG23 ILE 59 HG23 ILE 59 1.380 -9.575 0.846 464 HD11 ILE 59 HD11 ILE 59 3.222 -5.319 0.978 465 HD12 ILE 59 HD12 ILE 59 4.966 -5.482 1.178 466 HD13 ILE 59 HD13 ILE 59 3.884 -5.889 2.509 467 H ASP 60 HN ASP 60 0.546 -6.341 -2.523 468 HA ASP 60 HA ASP 60 -1.745 -7.865 -2.496 469 HB2 ASP 60 HB2 ASP 60 -1.698 -6.266 -4.129 470 HB3 ASP 60 HB1 ASP 60 -0.018 -6.575 -4.543 471 H VAL 61 HN VAL 61 -2.336 -9.601 -4.147 472 HA VAL 61 HA VAL 61 -2.201 -11.834 -4.814 473 HB VAL 61 HB VAL 61 0.020 -10.375 -5.673 474 HG11 VAL 61 HG11 VAL 61 1.557 -11.512 -4.198 475 HG12 VAL 61 HG12 VAL 61 1.774 -12.196 -5.809 476 HG13 VAL 61 HG13 VAL 61 0.856 -13.082 -4.593 477 HG21 VAL 61 HG21 VAL 61 -1.776 -12.084 -6.726 478 HG22 VAL 61 HG22 VAL 61 -0.352 -13.125 -6.726 479 HG23 VAL 61 HG23 VAL 61 -0.317 -11.582 -7.580 480 H ASN 62 HN ASN 62 -2.737 -13.098 -3.088 481 HA ASN 62 HA ASN 62 -0.536 -13.962 -1.254 482 HB2 ASN 62 HB2 ASN 62 -3.124 -12.606 -0.725 483 HB3 ASN 62 HB1 ASN 62 -2.729 -13.941 0.360 484 HD21 ASN 62 HD21 ASN 62 -1.808 -10.682 -0.606 485 HD22 ASN 62 HD22 ASN 62 -0.620 -10.465 0.586 486 H LEU 63 HN LEU 63 -1.076 -15.576 -3.318 487 HA LEU 63 HA LEU 63 -2.468 -17.869 -2.067 488 HB2 LEU 63 HB2 LEU 63 -3.851 -18.131 -4.166 489 HB3 LEU 63 HB1 LEU 63 -4.253 -16.693 -3.227 490 HG LEU 63 HG LEU 63 -2.160 -16.465 -5.357 491 HD11 LEU 63 HD11 LEU 63 -3.580 -17.032 -7.009 492 HD12 LEU 63 HD12 LEU 63 -4.650 -15.727 -6.495 493 HD13 LEU 63 HD13 LEU 63 -4.860 -17.350 -5.838 494 HD21 LEU 63 HD21 LEU 63 -3.759 -14.267 -5.478 495 HD22 LEU 63 HD22 LEU 63 -2.377 -14.400 -4.390 496 HD23 LEU 63 HD23 LEU 63 -4.003 -14.740 -3.797 497 H ASP 64 HN ASP 64 -2.401 -19.632 -4.193 498 HA ASP 64 HA ASP 64 -0.814 -21.056 -5.253 499 HB2 ASP 64 HB2 ASP 64 -1.147 -18.688 -6.555 500 HB3 ASP 64 HB1 ASP 64 0.595 -18.641 -6.264 501 H GLY 65 HN GLY 65 -0.149 -19.843 -2.534 502 HA2 GLY 65 HA2 GLY 65 2.042 -20.915 -1.594 503 HA3 GLY 65 HA1 GLY 65 2.824 -19.787 -2.703 504 H GLU 66 HN GLU 66 0.503 -17.881 -2.135 505 HA GLU 66 HA GLU 66 0.127 -16.059 -0.695 506 HB2 GLU 66 HB2 GLU 66 -0.161 -18.318 0.724 507 HB3 GLU 66 HB1 GLU 66 1.221 -17.642 1.586 508 HG2 GLU 66 HG2 GLU 66 0.026 -15.835 2.376 509 HG3 GLU 66 HG1 GLU 66 -1.057 -15.809 0.983 510 HA PRO 67 HA PRO 67 4.779 -15.402 -0.628 511 HB2 PRO 67 HB2 PRO 67 4.878 -13.611 -2.693 512 HB3 PRO 67 HB1 PRO 67 5.027 -15.364 -2.930 513 HG2 PRO 67 HG2 PRO 67 2.666 -13.594 -3.329 514 HG3 PRO 67 HG1 PRO 67 3.222 -14.966 -4.300 515 HD2 PRO 67 HD2 PRO 67 1.160 -15.125 -2.528 516 HD3 PRO 67 HD1 PRO 67 2.198 -16.507 -2.945 517 H SER 68 HN SER 68 3.371 -14.329 1.325 518 HA SER 68 HA SER 68 3.563 -11.366 0.930 519 HB2 SER 68 HB2 SER 68 1.723 -11.399 2.748 520 HB3 SER 68 HB1 SER 68 1.271 -11.914 1.124 521 HG SER 68 HG SER 68 0.604 -13.344 2.859 522 H TYR 69 HN TYR 69 5.047 -13.893 2.418 523 HA TYR 69 HA TYR 69 6.360 -14.173 4.336 524 HB2 TYR 69 HB2 TYR 69 7.321 -11.588 4.782 525 HB3 TYR 69 HB1 TYR 69 8.031 -12.780 3.704 526 HD1 TYR 69 HD1 TYR 69 6.734 -12.915 1.301 527 HD2 TYR 69 HD2 TYR 69 6.902 -9.499 3.890 528 HE1 TYR 69 HE1 TYR 69 6.229 -11.429 -0.621 529 HE2 TYR 69 HE2 TYR 69 6.390 -8.013 1.971 530 HH TYR 69 HH TYR 69 5.671 -9.345 -1.237 531 HA PRO 70 HA PRO 70 4.278 -12.951 7.950 532 HB2 PRO 70 HB2 PRO 70 6.258 -12.552 9.787 533 HB3 PRO 70 HB1 PRO 70 5.823 -14.156 9.165 534 HG2 PRO 70 HG2 PRO 70 8.132 -12.434 8.494 535 HG3 PRO 70 HG1 PRO 70 8.006 -14.198 8.528 536 HD2 PRO 70 HD2 PRO 70 7.949 -12.613 6.239 537 HD3 PRO 70 HD1 PRO 70 7.399 -14.299 6.347 538 H VAL 71 HN VAL 71 6.106 -10.637 6.341 539 HA VAL 71 HA VAL 71 5.814 -8.544 8.381 540 HB VAL 71 HB VAL 71 7.257 -7.334 7.082 541 HG11 VAL 71 HG11 VAL 71 7.632 -9.905 5.545 542 HG12 VAL 71 HG12 VAL 71 8.117 -9.742 7.232 543 HG13 VAL 71 HG13 VAL 71 8.851 -8.715 6.001 544 HG21 VAL 71 HG21 VAL 71 5.706 -8.388 4.712 545 HG22 VAL 71 HG22 VAL 71 7.198 -7.470 4.521 546 HG23 VAL 71 HG23 VAL 71 5.801 -6.733 5.305 547 H ALA 72 HN ALA 72 4.291 -9.399 5.286 548 HA ALA 72 HA ALA 72 2.366 -7.190 5.410 549 HB1 ALA 72 HB1 ALA 72 2.577 -7.793 3.242 550 HB2 ALA 72 HB2 ALA 72 1.439 -9.080 3.642 551 HB3 ALA 72 HB3 ALA 72 3.174 -9.397 3.659 552 H ASP 73 HN ASP 73 2.150 -10.761 5.675 553 HA ASP 73 HA ASP 73 -0.509 -11.088 6.369 554 HB2 ASP 73 HB2 ASP 73 2.070 -12.360 7.070 555 HB3 ASP 73 HB1 ASP 73 0.682 -12.840 8.035 556 H ILE 74 HN ILE 74 2.156 -10.471 8.663 557 HA ILE 74 HA ILE 74 0.551 -10.133 10.997 558 HB ILE 74 HB ILE 74 3.206 -8.958 10.133 559 HG12 ILE 74 HG12 ILE 74 2.496 -11.391 11.797 560 HG13 ILE 74 HG11 ILE 74 3.170 -11.410 10.167 561 HG21 ILE 74 HG21 ILE 74 1.894 -7.881 12.131 562 HG22 ILE 74 HG22 ILE 74 3.598 -8.278 12.338 563 HG23 ILE 74 HG23 ILE 74 2.358 -9.348 12.991 564 HD11 ILE 74 HD11 ILE 74 5.103 -11.657 11.447 565 HD12 ILE 74 HD12 ILE 74 4.486 -10.643 12.751 566 HD13 ILE 74 HD13 ILE 74 5.046 -9.905 11.251 567 H LEU 75 HN LEU 75 1.942 -7.707 8.773 568 HA LEU 75 HA LEU 75 0.960 -5.342 9.863 569 HB2 LEU 75 HB2 LEU 75 2.387 -5.810 7.791 570 HB3 LEU 75 HB1 LEU 75 0.875 -6.066 6.920 571 HG LEU 75 HG LEU 75 0.141 -3.779 7.662 572 HD11 LEU 75 HD11 LEU 75 1.310 -3.024 9.463 573 HD12 LEU 75 HD12 LEU 75 2.470 -2.468 8.255 574 HD13 LEU 75 HD13 LEU 75 2.723 -4.008 9.079 575 HD21 LEU 75 HD21 LEU 75 2.148 -4.503 5.720 576 HD22 LEU 75 HD22 LEU 75 2.487 -2.886 6.338 577 HD23 LEU 75 HD23 LEU 75 0.919 -3.242 5.613 578 H ALA 76 HN ALA 76 -0.798 -7.902 8.234 579 HA ALA 76 HA ALA 76 -3.263 -6.332 8.010 580 HB1 ALA 76 HB1 ALA 76 -3.364 -7.814 6.297 581 HB2 ALA 76 HB2 ALA 76 -3.807 -9.016 7.510 582 HB3 ALA 76 HB3 ALA 76 -2.121 -8.835 7.024 583 H GLU 77 HN GLU 77 -1.767 -8.579 10.230 584 HA GLU 77 HA GLU 77 -4.127 -9.481 11.587 585 HB2 GLU 77 HB2 GLU 77 -2.544 -10.706 12.658 586 HB3 GLU 77 HB1 GLU 77 -1.364 -9.915 11.620 587 HG2 GLU 77 HG2 GLU 77 -0.873 -8.260 13.274 588 HG3 GLU 77 HG1 GLU 77 -2.277 -8.710 14.243 589 H ARG 78 HN ARG 78 -2.440 -6.472 11.563 590 HA ARG 78 HA ARG 78 -4.047 -5.537 13.890 591 HB2 ARG 78 HB2 ARG 78 -2.177 -4.032 14.389 592 HB3 ARG 78 HB1 ARG 78 -1.595 -5.692 14.297 593 HG2 ARG 78 HG2 ARG 78 -1.283 -4.984 11.714 594 HG3 ARG 78 HG1 ARG 78 -1.080 -3.402 12.470 595 HD2 ARG 78 HD2 ARG 78 0.364 -5.621 13.809 596 HD3 ARG 78 HD1 ARG 78 0.967 -5.183 12.199 597 HE ARG 78 HE ARG 78 0.981 -3.439 14.572 598 HH11 ARG 78 HH21 ARG 78 3.296 -3.625 12.707 599 HH12 ARG 78 HH22 ARG 78 3.154 -2.163 11.788 600 HH21 ARG 78 HH11 ARG 78 -0.137 -1.586 12.716 601 HH22 ARG 78 HH12 ARG 78 1.210 -1.009 11.793 602 H ASN 79 HN ASN 79 -2.831 -4.878 10.670 603 HA ASN 79 HA ASN 79 -3.440 -3.281 9.059 604 HB2 ASN 79 HB2 ASN 79 -6.046 -3.127 10.563 605 HB3 ASN 79 HB1 ASN 79 -5.771 -3.144 8.823 606 HD21 ASN 79 HD21 ASN 79 -5.484 -5.209 7.775 607 HD22 ASN 79 HD22 ASN 79 -5.731 -6.678 8.588 608 H VAL 80 HN VAL 80 -2.035 -1.578 9.798 609 HA VAL 80 HA VAL 80 -3.103 0.470 11.664 610 HB VAL 80 HB VAL 80 -0.632 -0.645 11.001 611 HG11 VAL 80 HG11 VAL 80 -0.830 1.025 8.960 612 HG12 VAL 80 HG12 VAL 80 0.700 0.815 9.806 613 HG13 VAL 80 HG13 VAL 80 -0.310 2.211 10.156 614 HG21 VAL 80 HG21 VAL 80 -0.445 0.231 13.065 615 HG22 VAL 80 HG22 VAL 80 -1.660 1.466 12.733 616 HG23 VAL 80 HG23 VAL 80 0.020 1.736 12.273 617 HA PRO 81 HA PRO 81 -4.423 3.266 8.455 618 HB2 PRO 81 HB2 PRO 81 -2.620 5.354 8.272 619 HB3 PRO 81 HB1 PRO 81 -3.872 5.244 9.530 620 HG2 PRO 81 HG2 PRO 81 -0.993 4.413 9.661 621 HG3 PRO 81 HG1 PRO 81 -1.936 5.367 10.825 622 HD2 PRO 81 HD2 PRO 81 -1.535 2.803 11.294 623 HD3 PRO 81 HD1 PRO 81 -3.149 3.486 11.568 624 H PHE 82 HN PHE 82 -4.263 2.466 6.433 625 HA PHE 82 HA PHE 82 -1.909 2.683 4.782 626 HB2 PHE 82 HB2 PHE 82 -1.084 0.450 4.946 627 HB3 PHE 82 HB1 PHE 82 -1.286 1.022 6.601 628 HD1 PHE 82 HD1 PHE 82 -4.546 0.763 6.059 629 HD2 PHE 82 HD2 PHE 82 -1.149 -1.863 5.963 630 HE1 PHE 82 HE1 PHE 82 -6.022 -1.152 6.557 631 HE2 PHE 82 HE2 PHE 82 -2.635 -3.783 6.460 632 HZ PHE 82 HZ PHE 82 -5.067 -3.433 6.753 633 H ILE 83 HN ILE 83 -2.425 -0.022 3.671 634 HA ILE 83 HA ILE 83 -5.126 -0.281 2.784 635 HB ILE 83 HB ILE 83 -3.330 1.590 1.459 636 HG12 ILE 83 HG12 ILE 83 -6.149 1.243 0.611 637 HG13 ILE 83 HG11 ILE 83 -5.891 1.631 2.312 638 HG21 ILE 83 HG21 ILE 83 -4.703 -0.572 -0.169 639 HG22 ILE 83 HG22 ILE 83 -2.988 -0.167 -0.174 640 HG23 ILE 83 HG23 ILE 83 -4.159 0.954 -0.867 641 HD11 ILE 83 HD11 ILE 83 -4.469 3.562 1.615 642 HD12 ILE 83 HD12 ILE 83 -6.131 3.705 1.044 643 HD13 ILE 83 HD13 ILE 83 -4.857 3.203 -0.068 644 H PHE 84 HN PHE 84 -5.278 -2.203 1.554 645 HA PHE 84 HA PHE 84 -2.818 -3.574 0.653 646 HB2 PHE 84 HB2 PHE 84 -3.467 -3.775 3.221 647 HB3 PHE 84 HB1 PHE 84 -4.615 -4.960 2.608 648 HD1 PHE 84 HD1 PHE 84 -3.609 -6.766 0.950 649 HD2 PHE 84 HD2 PHE 84 -1.282 -4.444 3.719 650 HE1 PHE 84 HE1 PHE 84 -1.802 -8.468 0.867 651 HE2 PHE 84 HE2 PHE 84 0.522 -6.142 3.629 652 HZ PHE 84 HZ PHE 84 0.266 -8.147 2.201 653 H ALA 85 HN ALA 85 -3.426 -5.569 -0.596 654 HA ALA 85 HA ALA 85 -6.243 -6.136 -1.034 655 HB1 ALA 85 HB1 ALA 85 -6.593 -4.970 -3.003 656 HB2 ALA 85 HB2 ALA 85 -4.890 -5.019 -3.452 657 HB3 ALA 85 HB3 ALA 85 -5.444 -3.884 -2.222 658 H THR 86 HN THR 86 -6.335 -8.277 -1.705 659 HA THR 86 HA THR 86 -4.551 -9.350 -3.730 660 HB THR 86 HB THR 86 -3.126 -9.113 -1.677 661 HG1 THR 86 HG1 THR 86 -3.359 -11.122 -3.333 662 HG21 THR 86 HG21 THR 86 -4.904 -11.300 -0.600 663 HG22 THR 86 HG22 THR 86 -4.902 -9.630 -0.056 664 HG23 THR 86 HG23 THR 86 -3.477 -10.628 0.185 665 H GLY 87 HN GLY 87 -4.698 -12.042 -2.322 666 HA2 GLY 87 HA2 GLY 87 -7.087 -12.984 -3.552 667 HA3 GLY 87 HA1 GLY 87 -6.110 -13.898 -2.405 668 H TYR 88 HN TYR 88 -6.434 -12.243 -0.087 669 HA TYR 88 HA TYR 88 -9.019 -13.199 0.749 670 HB2 TYR 88 HB2 TYR 88 -8.371 -12.442 2.883 671 HB3 TYR 88 HB1 TYR 88 -6.860 -12.857 2.088 672 HD1 TYR 88 HD2 TYR 88 -6.753 -10.363 0.269 673 HD2 TYR 88 HD1 TYR 88 -7.498 -10.888 4.458 674 HE1 TYR 88 HE2 TYR 88 -5.897 -8.076 0.706 675 HE2 TYR 88 HE1 TYR 88 -6.632 -8.607 4.902 676 HH TYR 88 HH TYR 88 -6.392 -6.289 2.805 677 H GLY 89 HN GLY 89 -8.125 -10.283 -0.869 678 HA2 GLY 89 HA2 GLY 89 -9.390 -8.365 -1.378 679 HA3 GLY 89 HA1 GLY 89 -10.779 -9.445 -1.252 680 H SER 90 HN SER 90 -8.511 -8.478 1.256 681 HA SER 90 HA SER 90 -8.802 -7.221 3.202 682 HB2 SER 90 HB2 SER 90 -10.236 -5.422 3.010 683 HB3 SER 90 HB1 SER 90 -10.200 -5.924 1.325 684 HG SER 90 HG SER 90 -12.334 -5.610 2.246 685 H LYS 91 HN LYS 91 -8.956 -9.131 4.522 686 HA LYS 91 HA LYS 91 -11.352 -10.678 4.888 687 HB2 LYS 91 HB2 LYS 91 -10.078 -11.511 6.857 688 HB3 LYS 91 HB1 LYS 91 -9.051 -11.420 5.424 689 HG2 LYS 91 HG2 LYS 91 -7.687 -9.926 6.419 690 HG3 LYS 91 HG1 LYS 91 -9.052 -8.885 6.826 691 HD2 LYS 91 HD2 LYS 91 -9.540 -10.436 8.764 692 HD3 LYS 91 HD1 LYS 91 -8.014 -11.247 8.415 693 HE2 LYS 91 HE2 LYS 91 -6.744 -9.498 9.220 694 HE3 LYS 91 HE1 LYS 91 -7.908 -8.272 8.682 695 HZ1 LYS 91 HZ1 LYS 91 -8.508 -8.258 10.839 696 HZ2 LYS 91 HZ2 LYS 91 -7.828 -9.782 11.157 697 HZ3 LYS 91 HZ3 LYS 91 -9.365 -9.666 10.444 698 H GLY 92 HN GLY 92 -10.339 -7.608 5.970 699 HA2 GLY 92 HA2 GLY 92 -12.636 -6.600 7.048 700 HA3 GLY 92 HA1 GLY 92 -11.952 -7.501 8.407 701 H LEU 93 HN LEU 93 -10.207 -5.814 5.846 702 HA LEU 93 HA LEU 93 -8.204 -4.676 7.416 703 HB2 LEU 93 HB2 LEU 93 -8.349 -4.821 4.932 704 HB3 LEU 93 HB1 LEU 93 -9.553 -3.533 4.949 705 HG LEU 93 HG LEU 93 -7.041 -2.961 6.418 706 HD11 LEU 93 HD11 LEU 93 -7.009 -3.914 3.678 707 HD12 LEU 93 HD12 LEU 93 -5.655 -3.465 4.715 708 HD13 LEU 93 HD13 LEU 93 -6.478 -2.234 3.758 709 HD21 LEU 93 HD21 LEU 93 -9.248 -1.593 5.162 710 HD22 LEU 93 HD22 LEU 93 -7.725 -0.994 4.503 711 HD23 LEU 93 HD23 LEU 93 -8.014 -0.946 6.241 712 H ASP 94 HN ASP 94 -8.502 -3.391 9.187 713 HA ASP 94 HA ASP 94 -10.696 -1.355 9.123 714 HB2 ASP 94 HB2 ASP 94 -10.282 -1.363 11.621 715 HB3 ASP 94 HB1 ASP 94 -10.802 -2.921 10.979 716 H THR 95 HN THR 95 -10.162 0.812 9.424 717 HA THR 95 HA THR 95 -7.603 1.813 10.266 718 HB THR 95 HB THR 95 -6.889 0.661 8.227 719 HG1 THR 95 HG1 THR 95 -5.775 2.293 7.498 720 HG21 THR 95 HG21 THR 95 -9.182 2.182 7.009 721 HG22 THR 95 HG22 THR 95 -8.897 0.448 6.995 722 HG23 THR 95 HG23 THR 95 -7.880 1.513 6.026 723 H ARG 96 HN ARG 96 -7.373 4.188 9.278 724 HA ARG 96 HA ARG 96 -9.913 5.563 9.764 725 HB2 ARG 96 HB2 ARG 96 -7.099 6.397 8.984 726 HB3 ARG 96 HB1 ARG 96 -8.396 7.556 9.286 727 HG2 ARG 96 HG2 ARG 96 -8.678 6.683 11.563 728 HG3 ARG 96 HG1 ARG 96 -7.421 5.481 11.273 729 HD2 ARG 96 HD2 ARG 96 -5.711 7.119 11.185 730 HD3 ARG 96 HD1 ARG 96 -6.874 8.438 10.936 731 HE ARG 96 HE ARG 96 -7.583 7.195 13.366 732 HH11 ARG 96 HH21 ARG 96 -6.565 10.100 12.705 733 HH12 ARG 96 HH22 ARG 96 -5.309 10.231 13.891 734 HH21 ARG 96 HH11 ARG 96 -5.239 6.837 14.591 735 HH22 ARG 96 HH12 ARG 96 -4.558 8.387 14.954 736 H TYR 97 HN TYR 97 -8.772 3.942 7.140 737 HA TYR 97 HA TYR 97 -9.341 5.900 5.038 738 HB2 TYR 97 HB2 TYR 97 -8.666 2.965 5.191 739 HB3 TYR 97 HB1 TYR 97 -8.964 3.780 3.665 740 HD1 TYR 97 HD2 TYR 97 -7.024 4.470 6.821 741 HD2 TYR 97 HD1 TYR 97 -7.089 4.504 2.525 742 HE1 TYR 97 HE2 TYR 97 -4.684 5.282 6.791 743 HE2 TYR 97 HE1 TYR 97 -4.749 5.313 2.497 744 HH TYR 97 HH TYR 97 -2.688 5.081 4.881 745 H SER 98 HN SER 98 -11.415 4.178 7.008 746 HA SER 98 HA SER 98 -13.772 3.995 6.816 747 HB2 SER 98 HB2 SER 98 -13.538 4.253 3.834 748 HB3 SER 98 HB1 SER 98 -14.839 4.791 4.895 749 HG SER 98 HG SER 98 -13.803 6.637 4.598 750 H ASN 99 HN ASN 99 -11.311 2.162 5.559 751 HA ASN 99 HA ASN 99 -11.148 -0.172 5.263 752 HB2 ASN 99 HB2 ASN 99 -14.106 -0.201 5.819 753 HB3 ASN 99 HB1 ASN 99 -12.923 -1.444 6.219 754 HD21 ASN 99 HD21 ASN 99 -11.060 0.917 7.090 755 HD22 ASN 99 HD22 ASN 99 -11.649 1.335 8.622 756 H ILE 100 HN ILE 100 -12.272 1.788 3.091 757 HA ILE 100 HA ILE 100 -13.562 -0.302 1.391 758 HB ILE 100 HB ILE 100 -14.830 1.348 0.406 759 HG12 ILE 100 HG12 ILE 100 -12.635 2.716 -0.145 760 HG13 ILE 100 HG11 ILE 100 -14.193 3.524 -0.112 761 HG21 ILE 100 HG21 ILE 100 -15.548 2.944 2.186 762 HG22 ILE 100 HG22 ILE 100 -14.155 2.448 3.147 763 HG23 ILE 100 HG23 ILE 100 -15.417 1.280 2.757 764 HD11 ILE 100 HD11 ILE 100 -12.709 3.394 2.461 765 HD12 ILE 100 HD12 ILE 100 -13.717 4.680 1.808 766 HD13 ILE 100 HD13 ILE 100 -12.066 4.469 1.224 767 HA PRO 101 HA PRO 101 -10.039 1.546 -1.333 768 HB2 PRO 101 HB2 PRO 101 -7.699 1.991 -0.012 769 HB3 PRO 101 HB1 PRO 101 -8.914 3.237 -0.278 770 HG2 PRO 101 HG2 PRO 101 -8.275 1.721 2.169 771 HG3 PRO 101 HG1 PRO 101 -8.866 3.376 1.977 772 HD2 PRO 101 HD2 PRO 101 -10.413 1.201 2.723 773 HD3 PRO 101 HD1 PRO 101 -11.030 2.733 2.075 774 H LEU 102 HN LEU 102 -10.556 -1.232 -0.350 775 HA LEU 102 HA LEU 102 -7.853 -2.286 -1.000 776 HB2 LEU 102 HB2 LEU 102 -8.204 -3.990 0.891 777 HB3 LEU 102 HB1 LEU 102 -7.798 -2.346 1.360 778 HG LEU 102 HG LEU 102 -9.677 -3.466 2.674 779 HD11 LEU 102 HD11 LEU 102 -9.279 -0.833 1.915 780 HD12 LEU 102 HD12 LEU 102 -10.365 -1.388 3.191 781 HD13 LEU 102 HD13 LEU 102 -10.987 -1.103 1.568 782 HD21 LEU 102 HD21 LEU 102 -11.798 -3.764 1.707 783 HD22 LEU 102 HD22 LEU 102 -10.706 -4.374 0.469 784 HD23 LEU 102 HD23 LEU 102 -11.408 -2.764 0.309 785 H LEU 103 HN LEU 103 -7.830 -4.522 -1.687 786 HA LEU 103 HA LEU 103 -10.097 -6.190 -2.049 787 HB2 LEU 103 HB2 LEU 103 -10.607 -5.711 -4.447 788 HB3 LEU 103 HB1 LEU 103 -10.998 -4.360 -3.392 789 HG LEU 103 HG LEU 103 -8.311 -4.515 -4.736 790 HD11 LEU 103 HD11 LEU 103 -9.247 -3.199 -6.601 791 HD12 LEU 103 HD12 LEU 103 -10.856 -3.339 -5.894 792 HD13 LEU 103 HD13 LEU 103 -10.034 -4.775 -6.499 793 HD21 LEU 103 HD21 LEU 103 -8.217 -2.699 -3.339 794 HD22 LEU 103 HD22 LEU 103 -9.970 -2.495 -3.324 795 HD23 LEU 103 HD23 LEU 103 -9.031 -1.916 -4.694 796 H THR 104 HN THR 104 -9.012 -6.527 -5.071 797 HA THR 104 HA THR 104 -6.587 -8.049 -4.220 798 HB THR 104 HB THR 104 -8.329 -9.611 -4.649 799 HG1 THR 104 HG1 THR 104 -7.248 -9.540 -7.213 800 HG21 THR 104 HG21 THR 104 -9.112 -7.591 -6.632 801 HG22 THR 104 HG22 THR 104 -10.116 -8.717 -5.722 802 HG23 THR 104 HG23 THR 104 -9.299 -9.250 -7.193 803 H LYS 105 HN LYS 105 -7.194 -5.348 -5.818 804 HA LYS 105 HA LYS 105 -5.896 -4.144 -7.379 805 HB2 LYS 105 HB2 LYS 105 -4.312 -6.342 -6.399 806 HB3 LYS 105 HB1 LYS 105 -3.917 -6.022 -8.089 807 HG2 LYS 105 HG2 LYS 105 -3.124 -3.911 -7.645 808 HG3 LYS 105 HG1 LYS 105 -4.230 -3.666 -6.290 809 HD2 LYS 105 HD2 LYS 105 -2.601 -4.265 -4.866 810 HD3 LYS 105 HD1 LYS 105 -2.568 -5.855 -5.626 811 HE2 LYS 105 HE2 LYS 105 -0.957 -3.421 -6.464 812 HE3 LYS 105 HE1 LYS 105 -0.329 -4.950 -5.815 813 HZ1 LYS 105 HZ1 LYS 105 -0.191 -5.370 -8.048 814 HZ2 LYS 105 HZ2 LYS 105 -1.522 -4.393 -8.435 815 HZ3 LYS 105 HZ3 LYS 105 -1.766 -5.931 -7.752 816 HA PRO 106 HA PRO 106 -7.537 -6.929 -10.814 817 HB2 PRO 106 HB2 PRO 106 -9.988 -5.758 -11.200 818 HB3 PRO 106 HB1 PRO 106 -9.750 -7.160 -10.135 819 HG2 PRO 106 HG2 PRO 106 -10.052 -4.286 -9.441 820 HG3 PRO 106 HG1 PRO 106 -10.648 -5.722 -8.596 821 HD2 PRO 106 HD2 PRO 106 -8.439 -4.302 -7.816 822 HD3 PRO 106 HD1 PRO 106 -8.689 -6.020 -7.455 823 H PHE 107 HN PHE 107 -7.083 -3.717 -9.868 824 HA PHE 107 HA PHE 107 -6.298 -1.830 -10.973 825 HB2 PHE 107 HB2 PHE 107 -5.752 -4.148 -12.751 826 HB3 PHE 107 HB1 PHE 107 -5.542 -2.541 -13.448 827 HD1 PHE 107 HD1 PHE 107 -4.292 -0.799 -11.945 828 HD2 PHE 107 HD2 PHE 107 -4.025 -5.053 -11.458 829 HE1 PHE 107 HE1 PHE 107 -2.194 -0.518 -10.666 830 HE2 PHE 107 HE2 PHE 107 -1.920 -4.779 -10.183 831 HZ PHE 107 HZ PHE 107 -0.997 -2.501 -9.784 832 H LEU 108 HN LEU 108 -6.576 -1.117 -13.717 833 HA LEU 108 HA LEU 108 -8.107 0.268 -14.842 834 HB2 LEU 108 HB2 LEU 108 -10.198 -1.396 -15.415 835 HB3 LEU 108 HB1 LEU 108 -8.666 -1.409 -16.273 836 HG LEU 108 HG LEU 108 -7.961 -3.125 -14.385 837 HD11 LEU 108 HD11 LEU 108 -9.621 -3.997 -13.104 838 HD12 LEU 108 HD12 LEU 108 -10.717 -4.113 -14.481 839 HD13 LEU 108 HD13 LEU 108 -10.574 -2.595 -13.593 840 HD21 LEU 108 HD21 LEU 108 -9.874 -4.434 -16.187 841 HD22 LEU 108 HD22 LEU 108 -8.128 -4.646 -16.053 842 HD23 LEU 108 HD23 LEU 108 -8.784 -3.315 -17.007 843 H ASP 109 HN ASP 109 -8.348 0.214 -11.899 844 HA ASP 109 HA ASP 109 -10.224 1.986 -11.177 845 HB2 ASP 109 HB2 ASP 109 -11.576 -0.518 -12.041 846 HB3 ASP 109 HB1 ASP 109 -12.205 0.234 -10.579 847 H SER 110 HN SER 110 -8.181 -0.414 -10.240 848 HA SER 110 HA SER 110 -9.369 -0.957 -7.592 849 HB2 SER 110 HB2 SER 110 -8.301 -2.736 -8.846 850 HB3 SER 110 HB1 SER 110 -6.818 -1.796 -8.990 851 HG SER 110 HG SER 110 -6.313 -2.293 -6.994 852 H GLU 111 HN GLU 111 -5.922 -0.642 -7.786 853 HA GLU 111 HA GLU 111 -5.335 0.657 -5.487 854 HB2 GLU 111 HB2 GLU 111 -4.194 0.506 -8.183 855 HB3 GLU 111 HB1 GLU 111 -3.650 1.923 -7.285 856 HG2 GLU 111 HG2 GLU 111 -3.639 -0.845 -6.068 857 HG3 GLU 111 HG1 GLU 111 -2.265 -0.213 -6.976 858 H LEU 112 HN LEU 112 -6.219 2.371 -8.464 859 HA LEU 112 HA LEU 112 -6.027 5.045 -7.750 860 HB2 LEU 112 HB2 LEU 112 -8.676 4.260 -8.865 861 HB3 LEU 112 HB1 LEU 112 -7.526 5.447 -9.462 862 HG LEU 112 HG LEU 112 -7.370 2.444 -9.775 863 HD11 LEU 112 HD11 LEU 112 -7.447 4.554 -11.936 864 HD12 LEU 112 HD12 LEU 112 -8.927 3.902 -11.233 865 HD13 LEU 112 HD13 LEU 112 -7.805 2.832 -12.070 866 HD21 LEU 112 HD21 LEU 112 -5.274 2.773 -10.922 867 HD22 LEU 112 HD22 LEU 112 -5.139 3.623 -9.383 868 HD23 LEU 112 HD23 LEU 112 -5.450 4.527 -10.864 869 H GLU 113 HN GLU 113 -8.866 2.989 -7.054 870 HA GLU 113 HA GLU 113 -10.272 4.791 -5.374 871 HB2 GLU 113 HB2 GLU 113 -10.055 1.822 -5.735 872 HB3 GLU 113 HB1 GLU 113 -11.007 2.450 -4.383 873 HG2 GLU 113 HG2 GLU 113 -11.825 4.055 -6.454 874 HG3 GLU 113 HG1 GLU 113 -11.580 2.508 -7.265 875 H ALA 114 HN ALA 114 -7.892 2.280 -4.598 876 HA ALA 114 HA ALA 114 -7.801 2.329 -1.867 877 HB1 ALA 114 HB1 ALA 114 -5.210 2.715 -3.329 878 HB2 ALA 114 HB2 ALA 114 -6.224 1.342 -3.771 879 HB3 ALA 114 HB3 ALA 114 -5.634 1.505 -2.118 880 H VAL 115 HN VAL 115 -6.516 4.893 -3.974 881 HA VAL 115 HA VAL 115 -6.036 6.526 -1.507 882 HB VAL 115 HB VAL 115 -4.681 7.911 -3.241 883 HG11 VAL 115 HG11 VAL 115 -3.130 6.888 -1.955 884 HG12 VAL 115 HG12 VAL 115 -3.052 5.645 -3.204 885 HG13 VAL 115 HG13 VAL 115 -4.112 5.432 -1.811 886 HG21 VAL 115 HG21 VAL 115 -4.241 7.008 -5.315 887 HG22 VAL 115 HG22 VAL 115 -5.857 6.349 -5.080 888 HG23 VAL 115 HG23 VAL 115 -4.443 5.349 -4.752 889 H LEU 116 HN LEU 116 -8.077 6.168 -4.240 890 HA LEU 116 HA LEU 116 -8.952 9.005 -4.211 891 HB2 LEU 116 HB2 LEU 116 -8.525 7.457 -6.261 892 HB3 LEU 116 HB1 LEU 116 -10.098 6.762 -5.867 893 HG LEU 116 HG LEU 116 -10.516 9.517 -5.722 894 HD11 LEU 116 HD11 LEU 116 -8.177 9.346 -7.062 895 HD12 LEU 116 HD12 LEU 116 -9.387 10.582 -7.411 896 HD13 LEU 116 HD13 LEU 116 -9.297 9.129 -8.408 897 HD21 LEU 116 HD21 LEU 116 -12.241 8.890 -7.034 898 HD22 LEU 116 HD22 LEU 116 -11.545 7.269 -7.041 899 HD23 LEU 116 HD23 LEU 116 -11.154 8.402 -8.335 900 H VAL 117 HN VAL 117 -9.751 6.127 -2.602 901 HA VAL 117 HA VAL 117 -12.642 6.373 -2.506 902 HB VAL 117 HB VAL 117 -12.333 4.715 -0.663 903 HG11 VAL 117 HG11 VAL 117 -11.181 4.496 -3.349 904 HG12 VAL 117 HG12 VAL 117 -12.303 3.425 -2.510 905 HG13 VAL 117 HG13 VAL 117 -10.572 3.304 -2.201 906 HG21 VAL 117 HG21 VAL 117 -9.382 4.849 -1.090 907 HG22 VAL 117 HG22 VAL 117 -10.288 4.289 0.313 908 HG23 VAL 117 HG23 VAL 117 -10.130 6.011 -0.001 909 H GLN 118 HN GLN 118 -10.002 7.783 -0.664 910 HA GLN 118 HA GLN 118 -11.701 8.626 1.542 911 HB2 GLN 118 HB2 GLN 118 -9.270 7.893 1.610 912 HB3 GLN 118 HB1 GLN 118 -8.866 9.414 0.821 913 HG2 GLN 118 HG2 GLN 118 -8.673 9.347 3.381 914 HG3 GLN 118 HG1 GLN 118 -9.574 10.695 2.691 915 HE21 GLN 118 HE21 GLN 118 -12.072 10.227 2.518 916 HE22 GLN 118 HE22 GLN 118 -12.766 9.385 3.815 917 H ILE 119 HN ILE 119 -10.058 10.219 -1.210 918 HA ILE 119 HA ILE 119 -10.549 12.911 -0.667 919 HB ILE 119 HB ILE 119 -10.667 13.106 -3.176 920 HG12 ILE 119 HG12 ILE 119 -10.088 10.430 -3.876 921 HG13 ILE 119 HG11 ILE 119 -11.519 10.366 -2.849 922 HG21 ILE 119 HG21 ILE 119 -8.477 13.057 -2.294 923 HG22 ILE 119 HG22 ILE 119 -8.461 11.789 -3.520 924 HG23 ILE 119 HG23 ILE 119 -8.613 11.366 -1.814 925 HD11 ILE 119 HD11 ILE 119 -12.349 10.677 -5.058 926 HD12 ILE 119 HD12 ILE 119 -11.141 11.912 -5.417 927 HD13 ILE 119 HD13 ILE 119 -12.455 12.263 -4.293 928 H SER 120 HN SER 120 -12.895 10.443 -1.588 929 HA SER 120 HA SER 120 -15.154 11.917 -0.680 930 HB2 SER 120 HB2 SER 120 -14.053 12.824 -3.128 931 HB3 SER 120 HB1 SER 120 -15.548 11.988 -3.541 932 HG SER 120 HG SER 120 -16.650 13.502 -2.568 933 H LYS 121 HN LYS 121 -14.794 10.160 -3.773 934 HA LYS 121 HA LYS 121 -15.549 8.004 -4.397 935 HB2 LYS 121 HB2 LYS 121 -14.547 7.529 -2.056 936 HB3 LYS 121 HB1 LYS 121 -16.217 7.557 -1.484 937 HG2 LYS 121 HG2 LYS 121 -16.510 5.949 -3.635 938 HG3 LYS 121 HG1 LYS 121 -14.842 5.564 -3.205 939 HD2 LYS 121 HD2 LYS 121 -15.429 4.661 -1.160 940 HD3 LYS 121 HD1 LYS 121 -16.873 5.665 -1.012 941 HE2 LYS 121 HE2 LYS 121 -17.550 3.345 -1.452 942 HE3 LYS 121 HE1 LYS 121 -17.913 4.327 -2.886 943 HZ1 LYS 121 HZ1 LYS 121 -16.017 3.581 -3.978 944 HZ2 LYS 121 HZ2 LYS 121 -16.594 2.172 -3.224 945 HZ3 LYS 121 HZ3 LYS 121 -15.284 3.022 -2.555 946 H GLU 122 HN GLU 122 -17.257 10.491 -3.740 947 HA GLU 122 HA GLU 122 -19.869 9.147 -4.184 948 HB2 GLU 122 HB2 GLU 122 -20.758 10.877 -2.443 949 HB3 GLU 122 HB1 GLU 122 -19.931 9.445 -1.832 950 HG2 GLU 122 HG2 GLU 122 -18.179 10.648 -1.039 951 HG3 GLU 122 HG1 GLU 122 -18.123 11.678 -2.469 952 H VAL 123 HN VAL 123 -17.824 10.857 -5.641 953 HA VAL 123 HA VAL 123 -17.733 12.848 -6.919 954 HB VAL 123 HB VAL 123 -20.103 12.856 -8.218 955 HG11 VAL 123 HG11 VAL 123 -17.550 11.679 -8.552 956 HG12 VAL 123 HG12 VAL 123 -18.750 12.024 -9.798 957 HG13 VAL 123 HG13 VAL 123 -18.734 10.451 -9.002 958 HG21 VAL 123 HG21 VAL 123 -19.911 10.114 -6.921 959 HG22 VAL 123 HG22 VAL 123 -21.009 10.541 -8.234 960 HG23 VAL 123 HG23 VAL 123 -21.190 11.299 -6.651 Start of MODEL 24 1 H1 GLY 1 HT1 GLY 1 11.638 16.988 10.863 2 H2 GLY 1 HT2 GLY 1 10.803 17.946 9.734 3 H3 GLY 1 HT3 GLY 1 10.201 17.769 11.312 4 HA2 GLY 1 HA2 GLY 1 11.365 19.934 10.802 5 HA3 GLY 1 HA1 GLY 1 11.897 19.070 12.246 6 H SER 2 HN SER 2 13.795 17.593 11.944 7 HA SER 2 HA SER 2 15.723 18.793 9.993 8 HB2 SER 2 HB2 SER 2 16.417 17.055 12.352 9 HB3 SER 2 HB1 SER 2 17.369 18.338 11.612 10 HG SER 2 HG SER 2 16.394 18.968 13.604 11 H HIS 3 HN HIS 3 14.652 17.298 8.344 12 HA HIS 3 HA HIS 3 16.172 14.785 8.169 13 HB2 HIS 3 HB2 HIS 3 13.710 14.850 9.485 14 HB3 HIS 3 HB1 HIS 3 13.313 14.252 7.875 15 HD1 HIS 3 HD1 HIS 3 12.916 11.842 8.781 16 HD2 HIS 3 HD2 HIS 3 16.786 13.262 9.401 17 HE1 HIS 3 HE1 HIS 3 14.314 9.840 9.451 18 H MET 4 HN MET 4 15.266 13.555 6.095 19 HA MET 4 HA MET 4 15.071 15.587 3.933 20 HB2 MET 4 HB2 MET 4 16.702 13.539 4.177 21 HB3 MET 4 HB1 MET 4 15.327 12.607 3.585 22 HG2 MET 4 HG2 MET 4 15.770 15.043 2.033 23 HG3 MET 4 HG1 MET 4 17.166 13.967 2.006 24 HE1 MET 4 HE1 MET 4 14.681 13.737 -1.185 25 HE2 MET 4 HE2 MET 4 16.415 13.839 -0.886 26 HE3 MET 4 HE3 MET 4 15.332 15.031 -0.170 27 H THR 5 HN THR 5 12.712 14.944 5.633 28 HA THR 5 HA THR 5 10.907 13.914 3.475 29 HB THR 5 HB THR 5 9.600 13.019 5.554 30 HG1 THR 5 HG1 THR 5 10.676 12.959 7.381 31 HG21 THR 5 HG21 THR 5 10.994 11.735 3.793 32 HG22 THR 5 HG22 THR 5 10.664 10.930 5.327 33 HG23 THR 5 HG23 THR 5 12.241 11.665 5.038 34 H GLU 6 HN GLU 6 8.742 14.823 3.583 35 HA GLU 6 HA GLU 6 8.468 17.232 5.331 36 HB2 GLU 6 HB2 GLU 6 7.698 18.464 3.318 37 HB3 GLU 6 HB1 GLU 6 9.350 17.864 3.136 38 HG2 GLU 6 HG2 GLU 6 7.304 15.947 2.253 39 HG3 GLU 6 HG1 GLU 6 7.317 17.444 1.322 40 H ARG 7 HN ARG 7 6.955 14.630 3.504 41 HA ARG 7 HA ARG 7 4.375 15.248 4.897 42 HB2 ARG 7 HB2 ARG 7 5.061 14.909 2.067 43 HB3 ARG 7 HB1 ARG 7 3.749 13.845 2.577 44 HG2 ARG 7 HG2 ARG 7 3.819 16.821 3.148 45 HG3 ARG 7 HG1 ARG 7 2.972 16.105 1.775 46 HD2 ARG 7 HD2 ARG 7 1.390 15.028 3.149 47 HD3 ARG 7 HD1 ARG 7 2.436 15.119 4.581 48 HE ARG 7 HE ARG 7 2.034 17.776 3.816 49 HH11 ARG 7 HH21 ARG 7 1.084 16.542 6.426 50 HH12 ARG 7 HH22 ARG 7 -0.619 16.848 6.345 51 HH21 ARG 7 HH11 ARG 7 -0.608 17.544 2.951 52 HH22 ARG 7 HH12 ARG 7 -1.575 17.418 4.383 53 H ARG 8 HN ARG 8 4.879 13.739 6.562 54 HA ARG 8 HA ARG 8 5.983 11.225 6.505 55 HB2 ARG 8 HB2 ARG 8 3.416 12.016 7.917 56 HB3 ARG 8 HB1 ARG 8 4.555 10.774 8.438 57 HG2 ARG 8 HG2 ARG 8 5.730 12.335 9.550 58 HG3 ARG 8 HG1 ARG 8 6.048 13.163 8.025 59 HD2 ARG 8 HD2 ARG 8 4.881 14.877 9.013 60 HD3 ARG 8 HD1 ARG 8 3.458 13.937 8.522 61 HE ARG 8 HE ARG 8 4.244 12.780 10.926 62 HH11 ARG 8 HH11 ARG 8 2.961 15.724 9.717 63 HH12 ARG 8 HH12 ARG 8 2.541 16.347 11.277 64 HH21 ARG 8 HH21 ARG 8 3.900 13.663 13.005 65 HH22 ARG 8 HH22 ARG 8 3.063 15.174 13.141 66 H LEU 9 HN LEU 9 2.921 12.130 5.052 67 HA LEU 9 HA LEU 9 1.671 9.587 4.890 68 HB2 LEU 9 HB2 LEU 9 1.439 12.261 3.808 69 HB3 LEU 9 HB1 LEU 9 1.056 11.060 2.571 70 HG LEU 9 HG LEU 9 -0.945 11.707 3.910 71 HD11 LEU 9 HD11 LEU 9 -0.031 8.861 4.423 72 HD12 LEU 9 HD12 LEU 9 -0.707 9.430 2.897 73 HD13 LEU 9 HD13 LEU 9 -1.698 9.431 4.357 74 HD21 LEU 9 HD21 LEU 9 0.950 11.162 6.076 75 HD22 LEU 9 HD22 LEU 9 -0.587 10.325 6.297 76 HD23 LEU 9 HD23 LEU 9 -0.556 12.079 6.113 77 H ARG 10 HN ARG 10 2.370 7.768 3.850 78 HA ARG 10 HA ARG 10 3.525 7.980 1.148 79 HB2 ARG 10 HB2 ARG 10 5.420 8.277 2.740 80 HB3 ARG 10 HB1 ARG 10 5.038 6.707 3.446 81 HG2 ARG 10 HG2 ARG 10 6.830 6.470 1.786 82 HG3 ARG 10 HG1 ARG 10 5.383 5.642 1.234 83 HD2 ARG 10 HD2 ARG 10 5.059 8.242 0.270 84 HD3 ARG 10 HD1 ARG 10 6.765 7.898 -0.002 85 HE ARG 10 HE ARG 10 5.437 5.577 -0.775 86 HH11 ARG 10 HH11 ARG 10 5.784 8.870 -1.683 87 HH12 ARG 10 HH12 ARG 10 5.103 8.652 -3.259 88 HH21 ARG 10 HH21 ARG 10 4.353 5.307 -2.762 89 HH22 ARG 10 HH22 ARG 10 4.315 6.626 -3.882 90 H VAL 11 HN VAL 11 3.879 5.716 0.238 91 HA VAL 11 HA VAL 11 2.174 3.682 1.589 92 HB VAL 11 HB VAL 11 0.677 3.621 -0.163 93 HG11 VAL 11 HG11 VAL 11 1.828 6.327 -0.865 94 HG12 VAL 11 HG12 VAL 11 0.950 6.049 0.639 95 HG13 VAL 11 HG13 VAL 11 0.140 5.816 -0.911 96 HG21 VAL 11 HG21 VAL 11 2.420 2.898 -1.805 97 HG22 VAL 11 HG22 VAL 11 2.838 4.591 -2.057 98 HG23 VAL 11 HG23 VAL 11 1.242 4.003 -2.511 99 H LEU 12 HN LEU 12 3.417 1.871 1.812 100 HA LEU 12 HA LEU 12 5.612 1.355 -0.135 101 HB2 LEU 12 HB2 LEU 12 4.781 0.273 2.571 102 HB3 LEU 12 HB1 LEU 12 6.058 -0.481 1.624 103 HG LEU 12 HG LEU 12 6.705 1.300 3.419 104 HD11 LEU 12 HD11 LEU 12 8.027 0.297 1.350 105 HD12 LEU 12 HD12 LEU 12 8.687 1.636 2.290 106 HD13 LEU 12 HD13 LEU 12 7.883 1.950 0.752 107 HD21 LEU 12 HD21 LEU 12 6.729 3.606 2.581 108 HD22 LEU 12 HD22 LEU 12 5.072 3.006 2.661 109 HD23 LEU 12 HD23 LEU 12 5.903 3.095 1.108 110 H VAL 13 HN VAL 13 4.548 0.440 -1.965 111 HA VAL 13 HA VAL 13 2.638 -1.797 -1.416 112 HB VAL 13 HB VAL 13 1.761 -1.284 -3.640 113 HG11 VAL 13 HG11 VAL 13 1.565 1.384 -3.137 114 HG12 VAL 13 HG12 VAL 13 2.091 0.795 -1.560 115 HG13 VAL 13 HG13 VAL 13 0.618 0.158 -2.293 116 HG21 VAL 13 HG21 VAL 13 2.757 0.753 -4.826 117 HG22 VAL 13 HG22 VAL 13 3.725 -0.720 -4.883 118 HG23 VAL 13 HG23 VAL 13 4.148 0.571 -3.761 119 H VAL 14 HN VAL 14 3.222 -3.847 -1.991 120 HA VAL 14 HA VAL 14 5.493 -4.133 -3.912 121 HB VAL 14 HB VAL 14 6.411 -5.795 -2.268 122 HG11 VAL 14 HG11 VAL 14 6.446 -3.606 -0.477 123 HG12 VAL 14 HG12 VAL 14 6.369 -2.937 -2.105 124 HG13 VAL 14 HG13 VAL 14 7.670 -4.042 -1.668 125 HG21 VAL 14 HG21 VAL 14 3.850 -5.390 -1.094 126 HG22 VAL 14 HG22 VAL 14 5.063 -4.814 0.049 127 HG23 VAL 14 HG23 VAL 14 5.132 -6.473 -0.549 128 H GLU 15 HN GLU 15 5.414 -5.897 -5.212 129 HA GLU 15 HA GLU 15 3.654 -8.198 -4.746 130 HB2 GLU 15 HB2 GLU 15 2.268 -7.768 -6.741 131 HB3 GLU 15 HB1 GLU 15 2.143 -6.421 -5.607 132 HG2 GLU 15 HG2 GLU 15 2.922 -4.988 -7.135 133 HG3 GLU 15 HG1 GLU 15 4.364 -5.966 -7.372 134 H ASP 16 HN ASP 16 4.687 -9.939 -5.647 135 HA ASP 16 HA ASP 16 7.142 -10.297 -6.555 136 HB2 ASP 16 HB2 ASP 16 6.322 -12.148 -7.934 137 HB3 ASP 16 HB1 ASP 16 5.385 -12.005 -6.447 138 H GLU 17 HN GLU 17 4.680 -8.997 -8.836 139 HA GLU 17 HA GLU 17 6.667 -8.878 -10.997 140 HB2 GLU 17 HB2 GLU 17 3.786 -8.042 -10.635 141 HB3 GLU 17 HB1 GLU 17 4.665 -7.756 -12.138 142 HG2 GLU 17 HG2 GLU 17 4.654 -9.962 -12.715 143 HG3 GLU 17 HG1 GLU 17 4.905 -10.496 -11.051 144 H SER 18 HN SER 18 7.435 -6.945 -11.990 145 HA SER 18 HA SER 18 7.853 -4.677 -10.148 146 HB2 SER 18 HB2 SER 18 9.531 -4.081 -11.726 147 HB3 SER 18 HB1 SER 18 9.532 -5.842 -11.733 148 HG SER 18 HG SER 18 8.646 -5.848 -13.675 149 H MET 19 HN MET 19 5.412 -5.525 -12.245 150 HA MET 19 HA MET 19 4.906 -3.146 -13.741 151 HB2 MET 19 HB2 MET 19 3.853 -5.590 -13.649 152 HB3 MET 19 HB1 MET 19 2.705 -4.808 -12.561 153 HG2 MET 19 HG2 MET 19 1.615 -4.236 -14.472 154 HG3 MET 19 HG1 MET 19 2.847 -2.981 -14.594 155 HE1 MET 19 HE1 MET 19 1.197 -4.750 -17.263 156 HE2 MET 19 HE2 MET 19 1.102 -5.742 -15.810 157 HE3 MET 19 HE3 MET 19 1.898 -6.375 -17.248 158 H ILE 20 HN ILE 20 4.854 -3.702 -10.366 159 HA ILE 20 HA ILE 20 2.868 -1.565 -9.830 160 HB ILE 20 HB ILE 20 2.702 -3.582 -8.520 161 HG12 ILE 20 HG12 ILE 20 4.135 -1.833 -6.572 162 HG13 ILE 20 HG11 ILE 20 2.786 -1.108 -7.455 163 HG21 ILE 20 HG21 ILE 20 4.777 -4.651 -8.640 164 HG22 ILE 20 HG22 ILE 20 4.802 -4.036 -6.988 165 HG23 ILE 20 HG23 ILE 20 5.667 -3.176 -8.262 166 HD11 ILE 20 HD11 ILE 20 2.774 -3.339 -5.468 167 HD12 ILE 20 HD12 ILE 20 1.596 -3.400 -6.779 168 HD13 ILE 20 HD13 ILE 20 1.624 -2.019 -5.681 169 H ALA 21 HN ALA 21 6.152 -1.716 -10.434 170 HA ALA 21 HA ALA 21 6.882 0.220 -8.340 171 HB1 ALA 21 HB1 ALA 21 9.068 -0.402 -8.868 172 HB2 ALA 21 HB2 ALA 21 8.653 -0.762 -10.544 173 HB3 ALA 21 HB3 ALA 21 8.162 -1.864 -9.258 174 H MET 22 HN MET 22 7.517 0.116 -11.863 175 HA MET 22 HA MET 22 8.154 2.835 -12.143 176 HB2 MET 22 HB2 MET 22 8.382 1.119 -13.902 177 HB3 MET 22 HB1 MET 22 6.626 0.994 -14.019 178 HG2 MET 22 HG2 MET 22 6.910 3.659 -14.371 179 HG3 MET 22 HG1 MET 22 8.444 3.107 -15.045 180 HE1 MET 22 HE1 MET 22 7.910 4.218 -16.864 181 HE2 MET 22 HE2 MET 22 6.285 4.346 -17.531 182 HE3 MET 22 HE3 MET 22 7.470 3.298 -18.309 183 H LEU 23 HN LEU 23 5.099 1.337 -11.560 184 HA LEU 23 HA LEU 23 3.456 3.605 -12.364 185 HB2 LEU 23 HB2 LEU 23 1.806 2.048 -12.008 186 HB3 LEU 23 HB1 LEU 23 3.165 0.930 -11.939 187 HG LEU 23 HG LEU 23 3.216 1.171 -9.464 188 HD11 LEU 23 HD11 LEU 23 2.186 2.987 -8.605 189 HD12 LEU 23 HD12 LEU 23 0.680 2.103 -8.853 190 HD13 LEU 23 HD13 LEU 23 1.245 3.243 -10.075 191 HD21 LEU 23 HD21 LEU 23 1.509 -0.388 -9.152 192 HD22 LEU 23 HD22 LEU 23 1.736 -0.475 -10.899 193 HD23 LEU 23 HD23 LEU 23 0.401 0.463 -10.229 194 H ILE 24 HN ILE 24 5.536 2.983 -9.785 195 HA ILE 24 HA ILE 24 4.018 4.563 -7.804 196 HB ILE 24 HB ILE 24 5.545 2.339 -7.675 197 HG12 ILE 24 HG12 ILE 24 5.562 4.319 -5.397 198 HG13 ILE 24 HG11 ILE 24 4.062 3.568 -5.946 199 HG21 ILE 24 HG21 ILE 24 7.679 3.283 -8.169 200 HG22 ILE 24 HG22 ILE 24 7.652 3.042 -6.423 201 HG23 ILE 24 HG23 ILE 24 7.409 4.653 -7.091 202 HD11 ILE 24 HD11 ILE 24 6.538 2.164 -4.915 203 HD12 ILE 24 HD12 ILE 24 5.181 1.328 -5.670 204 HD13 ILE 24 HD13 ILE 24 4.945 2.209 -4.160 205 H GLU 25 HN GLU 25 7.260 4.677 -9.352 206 HA GLU 25 HA GLU 25 8.150 7.119 -8.291 207 HB2 GLU 25 HB2 GLU 25 8.517 5.714 -10.941 208 HB3 GLU 25 HB1 GLU 25 9.391 7.198 -10.557 209 HG2 GLU 25 HG2 GLU 25 9.788 5.753 -8.271 210 HG3 GLU 25 HG1 GLU 25 9.758 4.471 -9.484 211 H ASP 26 HN ASP 26 5.923 6.538 -10.994 212 HA ASP 26 HA ASP 26 5.805 9.286 -11.876 213 HB2 ASP 26 HB2 ASP 26 4.293 8.414 -13.409 214 HB3 ASP 26 HB1 ASP 26 5.092 6.928 -12.906 215 H THR 27 HN THR 27 3.811 7.345 -9.635 216 HA THR 27 HA THR 27 1.850 9.352 -9.084 217 HB THR 27 HB THR 27 1.994 7.844 -6.816 218 HG1 THR 27 HG1 THR 27 3.588 6.506 -7.167 219 HG21 THR 27 HG21 THR 27 0.707 7.547 -9.462 220 HG22 THR 27 HG22 THR 27 -0.010 7.529 -7.851 221 HG23 THR 27 HG23 THR 27 0.763 6.077 -8.487 222 H LEU 28 HN LEU 28 4.616 8.291 -7.078 223 HA LEU 28 HA LEU 28 4.627 10.338 -5.158 224 HB2 LEU 28 HB2 LEU 28 6.298 8.884 -4.638 225 HB3 LEU 28 HB1 LEU 28 6.397 8.326 -6.301 226 HG LEU 28 HG LEU 28 7.766 10.395 -6.814 227 HD11 LEU 28 HD11 LEU 28 6.854 11.334 -4.456 228 HD12 LEU 28 HD12 LEU 28 8.374 11.876 -5.169 229 HD13 LEU 28 HD13 LEU 28 8.381 10.638 -3.913 230 HD21 LEU 28 HD21 LEU 28 9.120 8.830 -4.632 231 HD22 LEU 28 HD22 LEU 28 9.755 9.330 -6.200 232 HD23 LEU 28 HD23 LEU 28 8.604 7.998 -6.099 233 H CYS 29 HN CYS 29 5.494 10.469 -8.551 234 HA CYS 29 HA CYS 29 7.103 12.840 -8.534 235 HB2 CYS 29 HB2 CYS 29 6.172 10.956 -10.352 236 HB3 CYS 29 HB1 CYS 29 5.389 12.446 -10.876 237 HG CYS 29 HG CYS 29 7.778 12.358 -11.970 238 H GLU 30 HN GLU 30 3.589 12.348 -8.844 239 HA GLU 30 HA GLU 30 3.097 15.220 -9.098 240 HB2 GLU 30 HB2 GLU 30 1.774 13.551 -10.320 241 HB3 GLU 30 HB1 GLU 30 1.286 12.809 -8.795 242 HG2 GLU 30 HG2 GLU 30 -0.513 14.193 -8.941 243 HG3 GLU 30 HG1 GLU 30 0.606 15.429 -8.367 244 H LEU 31 HN LEU 31 3.017 12.751 -6.585 245 HA LEU 31 HA LEU 31 1.667 14.599 -4.695 246 HB2 LEU 31 HB2 LEU 31 2.731 11.785 -4.299 247 HB3 LEU 31 HB1 LEU 31 1.545 12.623 -3.291 248 HG LEU 31 HG LEU 31 0.890 12.408 -6.184 249 HD11 LEU 31 HD11 LEU 31 0.051 10.022 -4.739 250 HD12 LEU 31 HD12 LEU 31 1.807 10.125 -4.858 251 HD13 LEU 31 HD13 LEU 31 0.822 10.155 -6.320 252 HD21 LEU 31 HD21 LEU 31 -0.642 13.460 -4.569 253 HD22 LEU 31 HD22 LEU 31 -0.646 11.988 -3.597 254 HD23 LEU 31 HD23 LEU 31 -1.360 11.981 -5.209 255 H GLY 32 HN GLY 32 4.828 12.993 -5.152 256 HA2 GLY 32 HA2 GLY 32 6.928 13.529 -4.228 257 HA3 GLY 32 HA1 GLY 32 6.242 15.097 -3.779 258 H HIS 33 HN HIS 33 5.235 11.833 -2.835 259 HA HIS 33 HA HIS 33 4.931 12.613 -0.050 260 HB2 HIS 33 HB2 HIS 33 4.522 10.257 -1.830 261 HB3 HIS 33 HB1 HIS 33 4.643 9.936 -0.102 262 HD1 HIS 33 HD1 HIS 33 2.085 10.303 -2.366 263 HD2 HIS 33 HD2 HIS 33 2.920 12.332 1.180 264 HE1 HIS 33 HE1 HIS 33 -0.098 11.330 -1.599 265 H GLU 34 HN GLU 34 5.899 10.219 1.224 266 HA GLU 34 HA GLU 34 8.695 10.966 1.587 267 HB2 GLU 34 HB2 GLU 34 7.003 10.148 3.306 268 HB3 GLU 34 HB1 GLU 34 7.228 8.534 2.645 269 HG2 GLU 34 HG2 GLU 34 9.574 8.550 3.209 270 HG3 GLU 34 HG1 GLU 34 9.507 10.259 3.643 271 H VAL 35 HN VAL 35 8.207 7.536 1.612 272 HA VAL 35 HA VAL 35 9.734 7.267 -0.950 273 HB VAL 35 HB VAL 35 11.071 5.547 0.193 274 HG11 VAL 35 HG11 VAL 35 10.915 8.003 1.957 275 HG12 VAL 35 HG12 VAL 35 11.671 8.005 0.363 276 HG13 VAL 35 HG13 VAL 35 12.325 6.990 1.649 277 HG21 VAL 35 HG21 VAL 35 10.120 4.487 1.943 278 HG22 VAL 35 HG22 VAL 35 8.885 5.736 2.097 279 HG23 VAL 35 HG23 VAL 35 10.441 5.930 2.907 280 H ALA 36 HN ALA 36 8.760 5.828 -2.343 281 HA ALA 36 HA ALA 36 6.498 4.209 -1.354 282 HB1 ALA 36 HB1 ALA 36 5.713 4.383 -3.533 283 HB2 ALA 36 HB2 ALA 36 7.337 4.402 -4.217 284 HB3 ALA 36 HB3 ALA 36 6.693 5.847 -3.437 285 H ALA 37 HN ALA 37 6.290 1.946 -2.082 286 HA ALA 37 HA ALA 37 8.973 0.653 -2.541 287 HB1 ALA 37 HB1 ALA 37 7.184 0.435 -0.387 288 HB2 ALA 37 HB2 ALA 37 8.564 -0.611 -0.714 289 HB3 ALA 37 HB3 ALA 37 6.964 -1.048 -1.312 290 H THR 38 HN THR 38 8.954 -1.217 -3.912 291 HA THR 38 HA THR 38 6.427 -1.774 -5.387 292 HB THR 38 HB THR 38 7.425 -1.343 -7.461 293 HG1 THR 38 HG1 THR 38 9.283 -2.347 -7.549 294 HG21 THR 38 HG21 THR 38 7.250 0.723 -5.934 295 HG22 THR 38 HG22 THR 38 8.276 0.872 -7.361 296 HG23 THR 38 HG23 THR 38 9.002 0.603 -5.778 297 H ALA 39 HN ALA 39 6.662 -3.770 -6.734 298 HA ALA 39 HA ALA 39 7.079 -6.072 -6.870 299 HB1 ALA 39 HB1 ALA 39 9.194 -5.716 -7.689 300 HB2 ALA 39 HB2 ALA 39 9.610 -6.519 -6.174 301 HB3 ALA 39 HB3 ALA 39 9.683 -4.759 -6.290 302 H SER 40 HN SER 40 7.163 -7.947 -5.512 303 HA SER 40 HA SER 40 6.511 -7.430 -2.718 304 HB2 SER 40 HB2 SER 40 6.155 -9.814 -2.673 305 HB3 SER 40 HB1 SER 40 5.501 -9.183 -4.170 306 HG SER 40 HG SER 40 6.841 -11.092 -4.395 307 H ARG 41 HN ARG 41 8.422 -6.518 -1.812 308 HA ARG 41 HA ARG 41 10.809 -8.292 -1.754 309 HB2 ARG 41 HB2 ARG 41 10.609 -5.832 -2.769 310 HB3 ARG 41 HB1 ARG 41 10.879 -5.386 -1.081 311 HG2 ARG 41 HG2 ARG 41 13.075 -5.555 -1.721 312 HG3 ARG 41 HG1 ARG 41 12.798 -7.255 -1.332 313 HD2 ARG 41 HD2 ARG 41 12.527 -7.856 -3.608 314 HD3 ARG 41 HD1 ARG 41 12.261 -6.174 -4.106 315 HE ARG 41 HE ARG 41 14.627 -5.741 -3.765 316 HH11 ARG 41 HH11 ARG 41 13.829 -8.750 -2.392 317 HH12 ARG 41 HH12 ARG 41 15.330 -9.512 -2.806 318 HH21 ARG 41 HH21 ARG 41 16.493 -6.815 -4.651 319 HH22 ARG 41 HH22 ARG 41 16.836 -8.415 -4.084 320 H MET 42 HN MET 42 10.969 -9.316 0.222 321 HA MET 42 HA MET 42 9.591 -8.653 2.598 322 HB2 MET 42 HB2 MET 42 12.258 -10.006 2.073 323 HB3 MET 42 HB1 MET 42 11.451 -10.030 3.641 324 HG2 MET 42 HG2 MET 42 9.395 -10.909 2.300 325 HG3 MET 42 HG1 MET 42 10.583 -11.301 1.057 326 HE1 MET 42 HE1 MET 42 9.323 -13.867 4.331 327 HE2 MET 42 HE2 MET 42 8.632 -13.347 2.796 328 HE3 MET 42 HE3 MET 42 8.811 -12.188 4.111 329 H GLN 43 HN GLN 43 12.720 -7.559 1.351 330 HA GLN 43 HA GLN 43 13.776 -6.203 3.579 331 HB2 GLN 43 HB2 GLN 43 14.349 -6.542 0.905 332 HB3 GLN 43 HB1 GLN 43 13.995 -4.816 0.984 333 HG2 GLN 43 HG2 GLN 43 15.683 -4.440 2.622 334 HG3 GLN 43 HG1 GLN 43 15.861 -6.167 2.941 335 HE21 GLN 43 HE21 GLN 43 18.152 -4.688 2.225 336 HE22 GLN 43 HE22 GLN 43 18.643 -5.129 0.661 337 H GLU 44 HN GLU 44 11.890 -4.662 0.946 338 HA GLU 44 HA GLU 44 11.441 -2.215 2.349 339 HB2 GLU 44 HB2 GLU 44 10.166 -3.654 0.023 340 HB3 GLU 44 HB1 GLU 44 9.554 -2.091 0.569 341 HG2 GLU 44 HG2 GLU 44 11.916 -1.205 0.369 342 HG3 GLU 44 HG1 GLU 44 12.344 -2.723 -0.421 343 H ALA 45 HN ALA 45 9.352 -5.086 1.887 344 HA ALA 45 HA ALA 45 7.009 -4.354 3.131 345 HB1 ALA 45 HB1 ALA 45 8.438 -6.729 2.516 346 HB2 ALA 45 HB2 ALA 45 6.717 -6.571 2.862 347 HB3 ALA 45 HB3 ALA 45 7.852 -6.902 4.171 348 H LEU 46 HN LEU 46 9.696 -5.858 4.947 349 HA LEU 46 HA LEU 46 8.853 -5.442 7.563 350 HB2 LEU 46 HB2 LEU 46 10.892 -6.563 7.214 351 HB3 LEU 46 HB1 LEU 46 11.502 -5.318 6.132 352 HG LEU 46 HG LEU 46 10.950 -4.641 9.007 353 HD11 LEU 46 HD11 LEU 46 12.937 -5.552 9.775 354 HD12 LEU 46 HD12 LEU 46 13.682 -5.538 8.177 355 HD13 LEU 46 HD13 LEU 46 12.488 -6.770 8.582 356 HD21 LEU 46 HD21 LEU 46 11.716 -2.680 8.180 357 HD22 LEU 46 HD22 LEU 46 12.209 -3.440 6.667 358 HD23 LEU 46 HD23 LEU 46 13.298 -3.448 8.054 359 H ASP 47 HN ASP 47 10.418 -3.152 5.377 360 HA ASP 47 HA ASP 47 10.601 -0.943 7.186 361 HB2 ASP 47 HB2 ASP 47 11.840 -0.323 5.406 362 HB3 ASP 47 HB1 ASP 47 11.165 -1.641 4.460 363 H ILE 48 HN ILE 48 7.911 -2.289 5.471 364 HA ILE 48 HA ILE 48 6.339 0.200 5.660 365 HB ILE 48 HB ILE 48 4.957 -0.746 4.092 366 HG12 ILE 48 HG12 ILE 48 5.486 -3.420 5.413 367 HG13 ILE 48 HG11 ILE 48 3.987 -2.491 5.429 368 HG21 ILE 48 HG21 ILE 48 6.183 -2.091 2.521 369 HG22 ILE 48 HG22 ILE 48 7.290 -2.633 3.777 370 HG23 ILE 48 HG23 ILE 48 7.307 -0.949 3.257 371 HD11 ILE 48 HD11 ILE 48 5.265 -3.872 3.051 372 HD12 ILE 48 HD12 ILE 48 3.940 -2.722 2.896 373 HD13 ILE 48 HD13 ILE 48 3.703 -4.227 3.782 374 H ALA 49 HN ALA 49 6.687 -2.882 7.328 375 HA ALA 49 HA ALA 49 4.205 -2.421 8.853 376 HB1 ALA 49 HB1 ALA 49 6.010 -4.633 9.588 377 HB2 ALA 49 HB2 ALA 49 5.515 -4.633 7.895 378 HB3 ALA 49 HB3 ALA 49 4.298 -4.677 9.171 379 H ARG 50 HN ARG 50 7.453 -3.440 9.938 380 HA ARG 50 HA ARG 50 7.198 -2.553 12.609 381 HB2 ARG 50 HB2 ARG 50 9.414 -3.216 10.705 382 HB3 ARG 50 HB1 ARG 50 9.840 -2.511 12.268 383 HG2 ARG 50 HG2 ARG 50 9.188 -4.372 13.434 384 HG3 ARG 50 HG1 ARG 50 7.857 -4.723 12.331 385 HD2 ARG 50 HD2 ARG 50 9.397 -6.476 11.901 386 HD3 ARG 50 HD1 ARG 50 9.756 -5.305 10.617 387 HE ARG 50 HE ARG 50 11.720 -4.610 11.841 388 HH11 ARG 50 HH11 ARG 50 11.523 -7.732 12.168 389 HH12 ARG 50 HH12 ARG 50 12.043 -7.875 13.814 390 HH21 ARG 50 HH21 ARG 50 11.688 -4.496 14.501 391 HH22 ARG 50 HH22 ARG 50 12.135 -6.046 15.133 392 H LYS 51 HN LYS 51 7.649 -0.682 9.765 393 HA LYS 51 HA LYS 51 9.207 1.485 10.766 394 HB2 LYS 51 HB2 LYS 51 9.002 1.387 8.462 395 HB3 LYS 51 HB1 LYS 51 7.304 0.925 8.531 396 HG2 LYS 51 HG2 LYS 51 6.598 3.065 8.533 397 HG3 LYS 51 HG1 LYS 51 7.870 3.605 9.617 398 HD2 LYS 51 HD2 LYS 51 8.469 2.887 6.750 399 HD3 LYS 51 HD1 LYS 51 7.904 4.500 7.190 400 HE2 LYS 51 HE2 LYS 51 9.824 4.963 8.474 401 HE3 LYS 51 HE1 LYS 51 10.233 3.245 8.647 402 HZ1 LYS 51 HZ1 LYS 51 10.160 3.479 5.997 403 HZ2 LYS 51 HZ2 LYS 51 11.581 3.678 6.907 404 HZ3 LYS 51 HZ3 LYS 51 10.692 5.036 6.404 405 H GLY 52 HN GLY 52 5.622 1.148 10.564 406 HA2 GLY 52 HA2 GLY 52 3.949 2.372 11.689 407 HA3 GLY 52 HA1 GLY 52 5.143 2.614 12.971 408 H GLN 53 HN GLN 53 4.382 3.765 9.687 409 HA GLN 53 HA GLN 53 4.277 6.538 10.236 410 HB2 GLN 53 HB2 GLN 53 6.463 6.782 10.912 411 HB3 GLN 53 HB1 GLN 53 6.961 5.279 10.143 412 HG2 GLN 53 HG2 GLN 53 8.040 7.242 9.087 413 HG3 GLN 53 HG1 GLN 53 6.996 6.389 7.950 414 HE21 GLN 53 HE21 GLN 53 6.052 7.997 6.657 415 HE22 GLN 53 HE22 GLN 53 5.310 9.401 7.256 416 H PHE 54 HN PHE 54 5.263 3.980 8.108 417 HA PHE 54 HA PHE 54 5.178 5.247 5.548 418 HB2 PHE 54 HB2 PHE 54 5.328 2.974 4.825 419 HB3 PHE 54 HB1 PHE 54 6.076 2.953 6.426 420 HD1 PHE 54 HD1 PHE 54 4.570 2.362 8.453 421 HD2 PHE 54 HD2 PHE 54 3.414 1.677 4.388 422 HE1 PHE 54 HE1 PHE 54 2.798 0.836 9.224 423 HE2 PHE 54 HE2 PHE 54 1.642 0.147 5.156 424 HZ PHE 54 HZ PHE 54 1.324 -0.286 7.571 425 H ASP 55 HN ASP 55 2.763 4.551 7.791 426 HA ASP 55 HA ASP 55 0.488 4.427 7.844 427 HB2 ASP 55 HB2 ASP 55 -0.646 6.036 6.375 428 HB3 ASP 55 HB1 ASP 55 0.811 6.724 7.083 429 H ILE 56 HN ILE 56 1.192 4.151 4.288 430 HA ILE 56 HA ILE 56 -0.756 1.889 4.340 431 HB ILE 56 HB ILE 56 0.196 3.740 2.150 432 HG12 ILE 56 HG12 ILE 56 -2.534 3.629 3.423 433 HG13 ILE 56 HG11 ILE 56 -1.237 4.588 4.136 434 HG21 ILE 56 HG21 ILE 56 -1.636 1.373 2.186 435 HG22 ILE 56 HG22 ILE 56 -0.513 1.902 0.933 436 HG23 ILE 56 HG23 ILE 56 -2.050 2.740 1.150 437 HD11 ILE 56 HD11 ILE 56 -2.928 5.276 1.931 438 HD12 ILE 56 HD12 ILE 56 -1.279 5.120 1.324 439 HD13 ILE 56 HD13 ILE 56 -1.630 6.231 2.648 440 H ALA 57 HN ALA 57 -0.294 -0.109 3.520 441 HA ALA 57 HA ALA 57 2.338 -0.518 2.133 442 HB1 ALA 57 HB1 ALA 57 2.995 -1.280 4.214 443 HB2 ALA 57 HB2 ALA 57 2.193 -2.746 3.652 444 HB3 ALA 57 HB3 ALA 57 1.341 -1.629 4.715 445 H ILE 58 HN ILE 58 2.131 -2.064 0.419 446 HA ILE 58 HA ILE 58 -0.479 -3.534 0.380 447 HB ILE 58 HB ILE 58 0.851 -1.841 -1.728 448 HG12 ILE 58 HG12 ILE 58 -1.612 -1.019 -1.786 449 HG13 ILE 58 HG11 ILE 58 -1.777 -1.875 -0.252 450 HG21 ILE 58 HG21 ILE 58 0.253 -3.666 -3.055 451 HG22 ILE 58 HG22 ILE 58 -1.222 -2.700 -3.096 452 HG23 ILE 58 HG23 ILE 58 -1.112 -4.095 -2.023 453 HD11 ILE 58 HD11 ILE 58 -0.732 0.716 -0.646 454 HD12 ILE 58 HD12 ILE 58 0.649 -0.307 -0.249 455 HD13 ILE 58 HD13 ILE 58 -0.728 -0.218 0.849 456 H ILE 59 HN ILE 59 0.433 -5.543 0.880 457 HA ILE 59 HA ILE 59 2.462 -6.698 -1.007 458 HB ILE 59 HB ILE 59 1.355 -7.418 1.726 459 HG12 ILE 59 HG12 ILE 59 4.257 -7.374 1.171 460 HG13 ILE 59 HG11 ILE 59 3.451 -5.820 0.978 461 HG21 ILE 59 HG21 ILE 59 1.574 -9.579 1.008 462 HG22 ILE 59 HG22 ILE 59 3.283 -9.276 1.319 463 HG23 ILE 59 HG23 ILE 59 2.647 -9.134 -0.320 464 HD11 ILE 59 HD11 ILE 59 3.489 -7.572 3.447 465 HD12 ILE 59 HD12 ILE 59 2.423 -6.178 3.265 466 HD13 ILE 59 HD13 ILE 59 4.173 -5.957 3.267 467 H ASP 60 HN ASP 60 0.517 -6.357 -2.474 468 HA ASP 60 HA ASP 60 -1.968 -7.689 -2.332 469 HB2 ASP 60 HB2 ASP 60 -2.007 -7.196 -4.703 470 HB3 ASP 60 HB1 ASP 60 -1.148 -5.893 -3.878 471 H VAL 61 HN VAL 61 -2.185 -9.020 -4.653 472 HA VAL 61 HA VAL 61 -2.338 -11.160 -5.477 473 HB VAL 61 HB VAL 61 -0.296 -10.266 -6.376 474 HG11 VAL 61 HG11 VAL 61 1.884 -11.207 -5.345 475 HG12 VAL 61 HG12 VAL 61 0.921 -11.470 -3.895 476 HG13 VAL 61 HG13 VAL 61 1.122 -9.845 -4.532 477 HG21 VAL 61 HG21 VAL 61 -1.012 -12.513 -7.042 478 HG22 VAL 61 HG22 VAL 61 -0.127 -13.206 -5.682 479 HG23 VAL 61 HG23 VAL 61 0.750 -12.424 -6.997 480 H ASN 62 HN ASN 62 -3.430 -11.888 -3.451 481 HA ASN 62 HA ASN 62 -1.858 -13.676 -1.677 482 HB2 ASN 62 HB2 ASN 62 -3.987 -13.914 -0.544 483 HB3 ASN 62 HB1 ASN 62 -3.802 -12.212 -0.958 484 HD21 ASN 62 HD21 ASN 62 -4.379 -13.228 -3.958 485 HD22 ASN 62 HD22 ASN 62 -6.058 -13.294 -3.982 486 H LEU 63 HN LEU 63 -2.042 -14.208 -4.621 487 HA LEU 63 HA LEU 63 -3.159 -16.958 -4.496 488 HB2 LEU 63 HB2 LEU 63 -4.396 -16.529 -6.582 489 HB3 LEU 63 HB1 LEU 63 -4.891 -15.367 -5.353 490 HG LEU 63 HG LEU 63 -2.611 -14.608 -7.134 491 HD11 LEU 63 HD11 LEU 63 -4.386 -15.589 -8.636 492 HD12 LEU 63 HD12 LEU 63 -4.089 -13.872 -8.909 493 HD13 LEU 63 HD13 LEU 63 -5.509 -14.387 -8.000 494 HD21 LEU 63 HD21 LEU 63 -4.913 -13.235 -5.735 495 HD22 LEU 63 HD22 LEU 63 -3.952 -12.404 -6.957 496 HD23 LEU 63 HD23 LEU 63 -3.184 -12.996 -5.484 497 H ASP 64 HN ASP 64 -2.538 -18.003 -6.800 498 HA ASP 64 HA ASP 64 -0.751 -18.652 -8.218 499 HB2 ASP 64 HB2 ASP 64 0.060 -15.751 -7.856 500 HB3 ASP 64 HB1 ASP 64 0.375 -16.785 -9.254 501 H GLY 65 HN GLY 65 -0.462 -18.198 -5.086 502 HA2 GLY 65 HA2 GLY 65 1.760 -19.511 -4.415 503 HA3 GLY 65 HA1 GLY 65 2.474 -17.976 -4.909 504 H GLU 66 HN GLU 66 0.124 -16.458 -3.948 505 HA GLU 66 HA GLU 66 -0.494 -15.339 -1.965 506 HB2 GLU 66 HB2 GLU 66 -0.762 -18.137 -1.679 507 HB3 GLU 66 HB1 GLU 66 -0.031 -17.572 -0.177 508 HG2 GLU 66 HG2 GLU 66 -1.913 -16.486 0.468 509 HG3 GLU 66 HG1 GLU 66 -2.206 -15.852 -1.150 510 HA PRO 67 HA PRO 67 3.922 -15.276 -0.526 511 HB2 PRO 67 HB2 PRO 67 4.940 -13.326 -2.156 512 HB3 PRO 67 HB1 PRO 67 4.923 -15.043 -2.595 513 HG2 PRO 67 HG2 PRO 67 3.342 -12.844 -3.673 514 HG3 PRO 67 HG1 PRO 67 3.628 -14.457 -4.338 515 HD2 PRO 67 HD2 PRO 67 1.321 -13.481 -2.917 516 HD3 PRO 67 HD1 PRO 67 1.560 -15.056 -3.694 517 H SER 68 HN SER 68 2.448 -14.273 1.235 518 HA SER 68 HA SER 68 2.664 -11.276 1.257 519 HB2 SER 68 HB2 SER 68 0.889 -12.152 3.252 520 HB3 SER 68 HB1 SER 68 0.449 -11.463 1.693 521 HG SER 68 HG SER 68 -0.465 -13.396 1.562 522 H TYR 69 HN TYR 69 3.935 -14.099 2.575 523 HA TYR 69 HA TYR 69 5.149 -14.637 4.494 524 HB2 TYR 69 HB2 TYR 69 6.517 -12.332 5.104 525 HB3 TYR 69 HB1 TYR 69 6.980 -13.478 3.856 526 HD1 TYR 69 HD2 TYR 69 5.685 -13.056 1.493 527 HD2 TYR 69 HD1 TYR 69 6.390 -10.125 4.542 528 HE1 TYR 69 HE2 TYR 69 5.443 -11.239 -0.187 529 HE2 TYR 69 HE1 TYR 69 6.146 -8.312 2.872 530 HH TYR 69 HH TYR 69 6.403 -8.054 0.413 531 HA PRO 70 HA PRO 70 3.253 -13.465 8.216 532 HB2 PRO 70 HB2 PRO 70 5.296 -13.229 10.019 533 HB3 PRO 70 HB1 PRO 70 4.741 -14.785 9.367 534 HG2 PRO 70 HG2 PRO 70 7.094 -13.137 8.581 535 HG3 PRO 70 HG1 PRO 70 6.950 -14.895 8.740 536 HD2 PRO 70 HD2 PRO 70 6.889 -13.605 6.348 537 HD3 PRO 70 HD1 PRO 70 6.049 -15.141 6.647 538 H VAL 71 HN VAL 71 5.046 -11.177 6.598 539 HA VAL 71 HA VAL 71 4.943 -9.117 8.697 540 HB VAL 71 HB VAL 71 5.609 -9.149 5.772 541 HG11 VAL 71 HG11 VAL 71 6.687 -6.902 6.309 542 HG12 VAL 71 HG12 VAL 71 5.776 -6.938 7.820 543 HG13 VAL 71 HG13 VAL 71 4.923 -6.913 6.276 544 HG21 VAL 71 HG21 VAL 71 7.030 -10.095 7.967 545 HG22 VAL 71 HG22 VAL 71 7.736 -8.508 7.658 546 HG23 VAL 71 HG23 VAL 71 7.708 -9.726 6.382 547 H ALA 72 HN ALA 72 3.674 -9.332 5.380 548 HA ALA 72 HA ALA 72 1.717 -7.329 5.494 549 HB1 ALA 72 HB1 ALA 72 2.618 -9.352 3.785 550 HB2 ALA 72 HB2 ALA 72 1.400 -8.134 3.406 551 HB3 ALA 72 HB3 ALA 72 0.908 -9.709 4.024 552 H ASP 73 HN ASP 73 1.310 -10.844 6.099 553 HA ASP 73 HA ASP 73 -1.413 -10.796 6.780 554 HB2 ASP 73 HB2 ASP 73 0.972 -12.445 7.385 555 HB3 ASP 73 HB1 ASP 73 -0.443 -12.730 8.389 556 H ILE 74 HN ILE 74 1.399 -10.540 8.965 557 HA ILE 74 HA ILE 74 -0.027 -10.028 11.374 558 HB ILE 74 HB ILE 74 2.700 -9.509 10.256 559 HG12 ILE 74 HG12 ILE 74 3.251 -10.613 12.513 560 HG13 ILE 74 HG11 ILE 74 1.514 -10.846 12.702 561 HG21 ILE 74 HG21 ILE 74 1.562 -8.081 12.670 562 HG22 ILE 74 HG22 ILE 74 2.424 -7.380 11.300 563 HG23 ILE 74 HG23 ILE 74 3.292 -8.366 12.477 564 HD11 ILE 74 HD11 ILE 74 3.412 -12.305 11.021 565 HD12 ILE 74 HD12 ILE 74 2.013 -11.740 10.117 566 HD13 ILE 74 HD13 ILE 74 1.788 -12.764 11.529 567 H LEU 75 HN LEU 75 1.185 -7.882 8.848 568 HA LEU 75 HA LEU 75 0.438 -5.365 9.867 569 HB2 LEU 75 HB2 LEU 75 1.651 -6.331 7.679 570 HB3 LEU 75 HB1 LEU 75 0.064 -6.055 6.971 571 HG LEU 75 HG LEU 75 0.165 -3.702 7.892 572 HD11 LEU 75 HD11 LEU 75 1.857 -3.079 9.246 573 HD12 LEU 75 HD12 LEU 75 3.056 -3.661 8.090 574 HD13 LEU 75 HD13 LEU 75 2.368 -4.768 9.278 575 HD21 LEU 75 HD21 LEU 75 0.656 -3.649 5.646 576 HD22 LEU 75 HD22 LEU 75 1.937 -4.852 5.794 577 HD23 LEU 75 HD23 LEU 75 2.242 -3.177 6.257 578 H ALA 76 HN ALA 76 -1.501 -8.023 8.811 579 HA ALA 76 HA ALA 76 -3.910 -6.394 8.365 580 HB1 ALA 76 HB1 ALA 76 -4.340 -9.222 8.302 581 HB2 ALA 76 HB2 ALA 76 -2.810 -8.872 7.496 582 HB3 ALA 76 HB3 ALA 76 -4.296 -8.097 6.944 583 H GLU 77 HN GLU 77 -3.156 -9.328 10.318 584 HA GLU 77 HA GLU 77 -5.378 -9.428 11.957 585 HB2 GLU 77 HB2 GLU 77 -4.062 -10.790 13.303 586 HB3 GLU 77 HB1 GLU 77 -3.054 -10.732 11.860 587 HG2 GLU 77 HG2 GLU 77 -1.674 -8.980 12.834 588 HG3 GLU 77 HG1 GLU 77 -2.744 -8.865 14.231 589 H ARG 78 HN ARG 78 -2.725 -7.113 12.166 590 HA ARG 78 HA ARG 78 -4.296 -5.574 14.169 591 HB2 ARG 78 HB2 ARG 78 -2.204 -5.068 15.308 592 HB3 ARG 78 HB1 ARG 78 -2.312 -6.818 15.112 593 HG2 ARG 78 HG2 ARG 78 -0.417 -6.842 13.901 594 HG3 ARG 78 HG1 ARG 78 -1.090 -5.668 12.769 595 HD2 ARG 78 HD2 ARG 78 0.845 -4.598 13.683 596 HD3 ARG 78 HD1 ARG 78 -0.517 -3.892 14.577 597 HE ARG 78 HE ARG 78 0.561 -6.340 15.780 598 HH11 ARG 78 HH11 ARG 78 -0.586 -3.390 16.585 599 HH12 ARG 78 HH12 ARG 78 0.668 -2.964 17.702 600 HH21 ARG 78 HH21 ARG 78 2.742 -5.586 16.786 601 HH22 ARG 78 HH22 ARG 78 2.554 -4.201 17.810 602 H ASN 79 HN ASN 79 -4.587 -5.102 11.480 603 HA ASN 79 HA ASN 79 -2.703 -3.331 10.285 604 HB2 ASN 79 HB2 ASN 79 -4.743 -2.774 8.859 605 HB3 ASN 79 HB1 ASN 79 -4.329 -4.486 8.963 606 HD21 ASN 79 HD21 ASN 79 -6.003 -5.856 9.618 607 HD22 ASN 79 HD22 ASN 79 -7.417 -5.344 10.405 608 H VAL 80 HN VAL 80 -2.250 -1.285 10.746 609 HA VAL 80 HA VAL 80 -4.039 0.332 12.496 610 HB VAL 80 HB VAL 80 -1.992 1.570 12.881 611 HG11 VAL 80 HG11 VAL 80 -0.859 -0.070 13.982 612 HG12 VAL 80 HG12 VAL 80 -0.717 -1.077 12.541 613 HG13 VAL 80 HG13 VAL 80 -2.217 -1.073 13.470 614 HG21 VAL 80 HG21 VAL 80 -1.354 1.675 10.445 615 HG22 VAL 80 HG22 VAL 80 -0.797 0.006 10.564 616 HG23 VAL 80 HG23 VAL 80 0.004 1.270 11.497 617 HA PRO 81 HA PRO 81 -4.890 3.178 9.145 618 HB2 PRO 81 HB2 PRO 81 -3.170 5.302 8.918 619 HB3 PRO 81 HB1 PRO 81 -4.434 5.205 10.160 620 HG2 PRO 81 HG2 PRO 81 -1.523 4.629 10.376 621 HG3 PRO 81 HG1 PRO 81 -2.598 5.448 11.519 622 HD2 PRO 81 HD2 PRO 81 -1.810 2.898 11.826 623 HD3 PRO 81 HD1 PRO 81 -3.386 3.470 12.400 624 H PHE 82 HN PHE 82 -4.603 2.483 7.042 625 HA PHE 82 HA PHE 82 -2.131 2.700 5.575 626 HB2 PHE 82 HB2 PHE 82 -1.284 0.499 5.773 627 HB3 PHE 82 HB1 PHE 82 -1.746 0.915 7.424 628 HD1 PHE 82 HD2 PHE 82 -4.798 0.685 7.006 629 HD2 PHE 82 HD1 PHE 82 -1.529 -1.887 5.932 630 HE1 PHE 82 HE2 PHE 82 -6.319 -1.257 7.066 631 HE2 PHE 82 HE1 PHE 82 -3.060 -3.836 5.995 632 HZ PHE 82 HZ PHE 82 -5.450 -3.524 6.556 633 H ILE 83 HN ILE 83 -2.563 0.135 4.217 634 HA ILE 83 HA ILE 83 -5.254 0.000 3.183 635 HB ILE 83 HB ILE 83 -3.447 2.004 2.232 636 HG12 ILE 83 HG12 ILE 83 -5.788 1.953 0.662 637 HG13 ILE 83 HG11 ILE 83 -6.243 1.387 2.270 638 HG21 ILE 83 HG21 ILE 83 -3.578 1.621 -0.191 639 HG22 ILE 83 HG22 ILE 83 -4.385 0.079 0.096 640 HG23 ILE 83 HG23 ILE 83 -2.707 0.300 0.591 641 HD11 ILE 83 HD11 ILE 83 -6.058 3.464 3.118 642 HD12 ILE 83 HD12 ILE 83 -5.815 4.056 1.474 643 HD13 ILE 83 HD13 ILE 83 -4.424 3.629 2.472 644 H PHE 84 HN PHE 84 -5.347 -1.665 1.481 645 HA PHE 84 HA PHE 84 -2.861 -3.162 0.893 646 HB2 PHE 84 HB2 PHE 84 -4.093 -3.611 3.214 647 HB3 PHE 84 HB1 PHE 84 -5.115 -4.621 2.198 648 HD1 PHE 84 HD2 PHE 84 -4.160 -6.564 0.984 649 HD2 PHE 84 HD1 PHE 84 -1.779 -4.200 3.670 650 HE1 PHE 84 HE2 PHE 84 -2.448 -8.362 1.050 651 HE2 PHE 84 HE1 PHE 84 -0.067 -6.003 3.738 652 HZ PHE 84 HZ PHE 84 -0.403 -8.075 2.418 653 H ALA 85 HN ALA 85 -3.280 -4.863 -0.755 654 HA ALA 85 HA ALA 85 -5.998 -4.915 -1.883 655 HB1 ALA 85 HB1 ALA 85 -5.325 -2.981 -2.982 656 HB2 ALA 85 HB2 ALA 85 -4.837 -4.212 -4.146 657 HB3 ALA 85 HB3 ALA 85 -3.640 -3.495 -3.068 658 H THR 86 HN THR 86 -6.282 -7.056 -2.211 659 HA THR 86 HA THR 86 -4.330 -8.548 -3.877 660 HB THR 86 HB THR 86 -3.450 -9.158 -1.804 661 HG1 THR 86 HG1 THR 86 -5.325 -11.065 -1.422 662 HG21 THR 86 HG21 THR 86 -6.280 -8.992 -0.729 663 HG22 THR 86 HG22 THR 86 -4.946 -7.893 -0.380 664 HG23 THR 86 HG23 THR 86 -4.902 -9.552 0.218 665 H GLY 87 HN GLY 87 -5.501 -11.065 -3.657 666 HA2 GLY 87 HA2 GLY 87 -7.442 -11.410 -5.436 667 HA3 GLY 87 HA1 GLY 87 -7.555 -12.295 -3.918 668 H TYR 88 HN TYR 88 -8.847 -11.288 -2.178 669 HA TYR 88 HA TYR 88 -11.378 -10.316 -3.137 670 HB2 TYR 88 HB2 TYR 88 -11.448 -11.502 -1.130 671 HB3 TYR 88 HB1 TYR 88 -9.971 -10.760 -0.525 672 HD1 TYR 88 HD1 TYR 88 -12.990 -9.058 -1.926 673 HD2 TYR 88 HD2 TYR 88 -10.632 -9.871 1.565 674 HE1 TYR 88 HE1 TYR 88 -14.345 -7.431 -0.634 675 HE2 TYR 88 HE2 TYR 88 -11.979 -8.239 2.858 676 HH TYR 88 HH TYR 88 -13.463 -6.498 2.638 677 H GLY 89 HN GLY 89 -8.415 -8.745 -2.185 678 HA2 GLY 89 HA2 GLY 89 -7.933 -6.446 -2.728 679 HA3 GLY 89 HA1 GLY 89 -9.666 -6.123 -2.782 680 H SER 90 HN SER 90 -9.644 -7.929 -0.205 681 HA SER 90 HA SER 90 -8.464 -6.096 1.759 682 HB2 SER 90 HB2 SER 90 -10.421 -4.881 1.370 683 HB3 SER 90 HB1 SER 90 -11.385 -6.321 1.101 684 HG SER 90 HG SER 90 -11.489 -5.051 3.212 685 H LYS 91 HN LYS 91 -10.283 -7.023 3.842 686 HA LYS 91 HA LYS 91 -10.552 -9.832 4.040 687 HB2 LYS 91 HB2 LYS 91 -8.460 -10.273 5.401 688 HB3 LYS 91 HB1 LYS 91 -8.143 -9.914 3.707 689 HG2 LYS 91 HG2 LYS 91 -6.834 -8.198 4.335 690 HG3 LYS 91 HG1 LYS 91 -8.234 -7.428 5.085 691 HD2 LYS 91 HD2 LYS 91 -7.801 -9.019 7.073 692 HD3 LYS 91 HD1 LYS 91 -6.216 -9.280 6.344 693 HE2 LYS 91 HE2 LYS 91 -7.379 -6.658 7.332 694 HE3 LYS 91 HE1 LYS 91 -5.903 -7.473 7.886 695 HZ1 LYS 91 HZ1 LYS 91 -5.026 -6.021 6.366 696 HZ2 LYS 91 HZ2 LYS 91 -6.398 -6.049 5.365 697 HZ3 LYS 91 HZ3 LYS 91 -5.314 -7.355 5.361 698 H GLY 92 HN GLY 92 -11.821 -7.368 4.937 699 HA2 GLY 92 HA2 GLY 92 -13.033 -6.752 6.875 700 HA3 GLY 92 HA1 GLY 92 -12.230 -8.066 7.741 701 H LEU 93 HN LEU 93 -10.085 -6.052 6.027 702 HA LEU 93 HA LEU 93 -8.595 -5.289 8.287 703 HB2 LEU 93 HB2 LEU 93 -7.273 -4.114 6.753 704 HB3 LEU 93 HB1 LEU 93 -8.053 -5.328 5.754 705 HG LEU 93 HG LEU 93 -8.120 -3.238 4.569 706 HD11 LEU 93 HD11 LEU 93 -10.911 -3.262 5.610 707 HD12 LEU 93 HD12 LEU 93 -10.293 -4.733 4.870 708 HD13 LEU 93 HD13 LEU 93 -10.324 -3.233 3.955 709 HD21 LEU 93 HD21 LEU 93 -9.807 -1.658 6.305 710 HD22 LEU 93 HD22 LEU 93 -8.249 -1.245 5.588 711 HD23 LEU 93 HD23 LEU 93 -8.312 -2.096 7.132 712 H ASP 94 HN ASP 94 -8.586 -3.554 9.635 713 HA ASP 94 HA ASP 94 -10.878 -1.633 9.426 714 HB2 ASP 94 HB2 ASP 94 -10.328 -1.425 11.946 715 HB3 ASP 94 HB1 ASP 94 -11.029 -2.953 11.412 716 H THR 95 HN THR 95 -10.384 0.627 9.763 717 HA THR 95 HA THR 95 -7.762 1.591 10.446 718 HB THR 95 HB THR 95 -7.209 0.444 8.345 719 HG1 THR 95 HG1 THR 95 -5.935 2.054 8.179 720 HG21 THR 95 HG21 THR 95 -9.442 0.522 7.318 721 HG22 THR 95 HG22 THR 95 -8.228 1.186 6.226 722 HG23 THR 95 HG23 THR 95 -9.292 2.268 7.122 723 H ARG 96 HN ARG 96 -7.501 3.945 9.801 724 HA ARG 96 HA ARG 96 -9.955 5.433 10.280 725 HB2 ARG 96 HB2 ARG 96 -7.078 6.083 9.570 726 HB3 ARG 96 HB1 ARG 96 -8.294 7.348 9.748 727 HG2 ARG 96 HG2 ARG 96 -8.779 6.542 12.048 728 HG3 ARG 96 HG1 ARG 96 -7.500 5.338 11.876 729 HD2 ARG 96 HD2 ARG 96 -5.795 6.963 11.860 730 HD3 ARG 96 HD1 ARG 96 -6.912 8.261 11.393 731 HE ARG 96 HE ARG 96 -7.577 7.008 13.953 732 HH11 ARG 96 HH11 ARG 96 -4.955 8.811 12.869 733 HH12 ARG 96 HH12 ARG 96 -5.169 10.119 13.984 734 HH21 ARG 96 HH21 ARG 96 -8.221 8.968 15.157 735 HH22 ARG 96 HH22 ARG 96 -7.017 10.206 15.282 736 H TYR 97 HN TYR 97 -8.651 3.965 7.545 737 HA TYR 97 HA TYR 97 -9.287 6.031 5.589 738 HB2 TYR 97 HB2 TYR 97 -8.418 3.147 5.575 739 HB3 TYR 97 HB1 TYR 97 -8.853 3.965 4.076 740 HD1 TYR 97 HD2 TYR 97 -7.836 6.454 3.897 741 HD2 TYR 97 HD1 TYR 97 -6.157 3.237 6.197 742 HE1 TYR 97 HE2 TYR 97 -5.631 7.578 3.860 743 HE2 TYR 97 HE1 TYR 97 -3.952 4.373 6.156 744 HH TYR 97 HH TYR 97 -3.493 7.479 5.500 745 H SER 98 HN SER 98 -11.343 4.300 7.449 746 HA SER 98 HA SER 98 -13.657 3.944 7.240 747 HB2 SER 98 HB2 SER 98 -12.911 5.782 5.186 748 HB3 SER 98 HB1 SER 98 -14.076 4.649 4.506 749 HG SER 98 HG SER 98 -15.531 5.675 5.597 750 H ASN 99 HN ASN 99 -11.353 2.133 6.052 751 HA ASN 99 HA ASN 99 -11.278 -0.037 5.128 752 HB2 ASN 99 HB2 ASN 99 -14.165 0.298 5.969 753 HB3 ASN 99 HB1 ASN 99 -13.454 -1.258 5.528 754 HD21 ASN 99 HD21 ASN 99 -12.591 1.544 7.649 755 HD22 ASN 99 HD22 ASN 99 -12.037 0.583 8.924 756 H ILE 100 HN ILE 100 -12.307 2.377 3.367 757 HA ILE 100 HA ILE 100 -13.755 0.727 1.346 758 HB ILE 100 HB ILE 100 -14.751 2.637 0.579 759 HG12 ILE 100 HG12 ILE 100 -12.404 3.673 0.071 760 HG13 ILE 100 HG11 ILE 100 -13.781 4.743 0.280 761 HG21 ILE 100 HG21 ILE 100 -13.926 3.262 3.408 762 HG22 ILE 100 HG22 ILE 100 -15.435 2.546 2.851 763 HG23 ILE 100 HG23 ILE 100 -15.085 4.242 2.517 764 HD11 ILE 100 HD11 ILE 100 -12.891 5.691 2.116 765 HD12 ILE 100 HD12 ILE 100 -11.383 4.885 1.679 766 HD13 ILE 100 HD13 ILE 100 -12.495 4.123 2.813 767 HA PRO 101 HA PRO 101 -9.899 2.083 -1.104 768 HB2 PRO 101 HB2 PRO 101 -7.575 2.323 0.303 769 HB3 PRO 101 HB1 PRO 101 -8.672 3.684 0.037 770 HG2 PRO 101 HG2 PRO 101 -8.187 2.116 2.475 771 HG3 PRO 101 HG1 PRO 101 -8.741 3.785 2.286 772 HD2 PRO 101 HD2 PRO 101 -10.328 1.531 2.893 773 HD3 PRO 101 HD1 PRO 101 -10.894 3.158 2.481 774 H LEU 102 HN LEU 102 -10.480 -0.283 -1.344 775 HA LEU 102 HA LEU 102 -8.172 -2.017 -0.609 776 HB2 LEU 102 HB2 LEU 102 -9.586 -3.617 0.450 777 HB3 LEU 102 HB1 LEU 102 -10.092 -2.061 1.102 778 HG LEU 102 HG LEU 102 -11.431 -3.464 -1.236 779 HD11 LEU 102 HD11 LEU 102 -13.309 -3.398 0.701 780 HD12 LEU 102 HD12 LEU 102 -11.868 -3.568 1.704 781 HD13 LEU 102 HD13 LEU 102 -12.231 -4.772 0.467 782 HD21 LEU 102 HD21 LEU 102 -11.739 -0.829 0.105 783 HD22 LEU 102 HD22 LEU 102 -13.228 -1.681 -0.301 784 HD23 LEU 102 HD23 LEU 102 -12.066 -1.286 -1.566 785 H LEU 103 HN LEU 103 -7.746 -3.584 -2.231 786 HA LEU 103 HA LEU 103 -9.776 -4.473 -4.122 787 HB2 LEU 103 HB2 LEU 103 -9.139 -3.078 -6.011 788 HB3 LEU 103 HB1 LEU 103 -9.498 -2.019 -4.645 789 HG LEU 103 HG LEU 103 -6.891 -2.426 -4.167 790 HD11 LEU 103 HD11 LEU 103 -7.359 -3.065 -7.049 791 HD12 LEU 103 HD12 LEU 103 -6.182 -3.740 -5.924 792 HD13 LEU 103 HD13 LEU 103 -5.914 -2.146 -6.623 793 HD21 LEU 103 HD21 LEU 103 -8.227 -0.451 -6.015 794 HD22 LEU 103 HD22 LEU 103 -6.510 -0.335 -5.631 795 HD23 LEU 103 HD23 LEU 103 -7.711 -0.213 -4.345 796 H THR 104 HN THR 104 -8.550 -5.373 -6.238 797 HA THR 104 HA THR 104 -6.194 -6.882 -5.243 798 HB THR 104 HB THR 104 -8.149 -7.158 -7.538 799 HG1 THR 104 HG1 THR 104 -8.836 -8.079 -5.673 800 HG21 THR 104 HG21 THR 104 -5.381 -8.014 -7.456 801 HG22 THR 104 HG22 THR 104 -6.540 -8.107 -8.782 802 HG23 THR 104 HG23 THR 104 -6.473 -9.393 -7.577 803 H LYS 105 HN LYS 105 -6.746 -6.225 -8.638 804 HA LYS 105 HA LYS 105 -4.837 -4.053 -8.888 805 HB2 LYS 105 HB2 LYS 105 -3.975 -6.825 -8.691 806 HB3 LYS 105 HB1 LYS 105 -3.420 -6.069 -10.184 807 HG2 LYS 105 HG2 LYS 105 -1.866 -4.897 -9.058 808 HG3 LYS 105 HG1 LYS 105 -3.108 -4.207 -8.016 809 HD2 LYS 105 HD2 LYS 105 -1.324 -5.512 -6.789 810 HD3 LYS 105 HD1 LYS 105 -2.964 -6.065 -6.485 811 HE2 LYS 105 HE2 LYS 105 -1.442 -7.982 -6.896 812 HE3 LYS 105 HE1 LYS 105 -2.655 -7.872 -8.179 813 HZ1 LYS 105 HZ1 LYS 105 -1.077 -6.522 -9.464 814 HZ2 LYS 105 HZ2 LYS 105 -0.481 -8.082 -9.160 815 HZ3 LYS 105 HZ3 LYS 105 0.097 -6.760 -8.264 816 HA PRO 106 HA PRO 106 -7.451 -5.512 -12.565 817 HB2 PRO 106 HB2 PRO 106 -9.341 -3.525 -12.463 818 HB3 PRO 106 HB1 PRO 106 -9.551 -5.094 -11.661 819 HG2 PRO 106 HG2 PRO 106 -8.674 -2.484 -10.505 820 HG3 PRO 106 HG1 PRO 106 -9.795 -3.689 -9.846 821 HD2 PRO 106 HD2 PRO 106 -7.242 -3.498 -8.999 822 HD3 PRO 106 HD1 PRO 106 -8.096 -5.056 -9.092 823 H PHE 107 HN PHE 107 -5.887 -2.805 -11.222 824 HA PHE 107 HA PHE 107 -4.739 -0.989 -12.141 825 HB2 PHE 107 HB2 PHE 107 -4.610 -3.274 -14.037 826 HB3 PHE 107 HB1 PHE 107 -4.034 -1.716 -14.639 827 HD1 PHE 107 HD1 PHE 107 -3.962 -2.584 -11.059 828 HD2 PHE 107 HD2 PHE 107 -1.666 -2.380 -14.686 829 HE1 PHE 107 HE1 PHE 107 -1.874 -2.831 -9.747 830 HE2 PHE 107 HE2 PHE 107 0.423 -2.627 -13.371 831 HZ PHE 107 HZ PHE 107 0.323 -2.846 -10.902 832 H LEU 108 HN LEU 108 -6.687 0.275 -12.045 833 HA LEU 108 HA LEU 108 -7.299 1.639 -14.515 834 HB2 LEU 108 HB2 LEU 108 -9.885 1.036 -14.052 835 HB3 LEU 108 HB1 LEU 108 -8.887 0.064 -15.126 836 HG LEU 108 HG LEU 108 -8.328 -1.299 -12.955 837 HD11 LEU 108 HD11 LEU 108 -10.097 0.660 -11.924 838 HD12 LEU 108 HD12 LEU 108 -9.441 -0.744 -11.083 839 HD13 LEU 108 HD13 LEU 108 -10.982 -0.866 -11.930 840 HD21 LEU 108 HD21 LEU 108 -10.868 -1.309 -14.566 841 HD22 LEU 108 HD22 LEU 108 -10.628 -2.498 -13.287 842 HD23 LEU 108 HD23 LEU 108 -9.503 -2.422 -14.645 843 H ASP 109 HN ASP 109 -8.204 0.864 -11.205 844 HA ASP 109 HA ASP 109 -8.288 3.756 -10.532 845 HB2 ASP 109 HB2 ASP 109 -10.442 3.435 -9.381 846 HB3 ASP 109 HB1 ASP 109 -10.601 2.990 -11.080 847 H SER 110 HN SER 110 -6.875 0.916 -10.011 848 HA SER 110 HA SER 110 -7.069 0.162 -7.347 849 HB2 SER 110 HB2 SER 110 -4.620 0.337 -9.116 850 HB3 SER 110 HB1 SER 110 -4.778 -0.697 -7.701 851 HG SER 110 HG SER 110 -5.363 -1.416 -10.048 852 H GLU 111 HN GLU 111 -3.875 1.265 -7.583 853 HA GLU 111 HA GLU 111 -3.545 2.576 -5.234 854 HB2 GLU 111 HB2 GLU 111 -2.362 2.660 -7.885 855 HB3 GLU 111 HB1 GLU 111 -2.233 4.235 -7.102 856 HG2 GLU 111 HG2 GLU 111 -1.632 2.347 -5.099 857 HG3 GLU 111 HG1 GLU 111 -0.768 1.802 -6.538 858 H LEU 112 HN LEU 112 -4.867 4.116 -8.140 859 HA LEU 112 HA LEU 112 -5.239 6.752 -7.268 860 HB2 LEU 112 HB2 LEU 112 -7.571 5.418 -8.592 861 HB3 LEU 112 HB1 LEU 112 -6.774 6.931 -9.006 862 HG LEU 112 HG LEU 112 -5.802 4.129 -9.577 863 HD11 LEU 112 HD11 LEU 112 -6.884 4.470 -11.526 864 HD12 LEU 112 HD12 LEU 112 -5.781 5.806 -11.856 865 HD13 LEU 112 HD13 LEU 112 -7.314 6.111 -11.038 866 HD21 LEU 112 HD21 LEU 112 -4.411 6.801 -9.669 867 HD22 LEU 112 HD22 LEU 112 -3.973 5.550 -10.832 868 HD23 LEU 112 HD23 LEU 112 -3.789 5.251 -9.105 869 H GLU 113 HN GLU 113 -7.636 4.111 -6.919 870 HA GLU 113 HA GLU 113 -9.484 5.311 -5.197 871 HB2 GLU 113 HB2 GLU 113 -8.494 2.628 -5.852 872 HB3 GLU 113 HB1 GLU 113 -9.171 2.739 -4.223 873 HG2 GLU 113 HG2 GLU 113 -11.243 3.648 -5.079 874 HG3 GLU 113 HG1 GLU 113 -10.573 3.763 -6.706 875 H ALA 114 HN ALA 114 -6.417 3.716 -4.370 876 HA ALA 114 HA ALA 114 -6.423 3.798 -1.595 877 HB1 ALA 114 HB1 ALA 114 -4.589 3.387 -3.545 878 HB2 ALA 114 HB2 ALA 114 -4.144 3.569 -1.847 879 HB3 ALA 114 HB3 ALA 114 -4.027 4.946 -2.943 880 H VAL 115 HN VAL 115 -5.981 6.540 -3.795 881 HA VAL 115 HA VAL 115 -5.964 8.395 -1.446 882 HB VAL 115 HB VAL 115 -5.227 8.825 -4.359 883 HG11 VAL 115 HG11 VAL 115 -5.637 10.632 -2.191 884 HG12 VAL 115 HG12 VAL 115 -5.007 10.996 -3.797 885 HG13 VAL 115 HG13 VAL 115 -3.902 10.557 -2.494 886 HG21 VAL 115 HG21 VAL 115 -2.904 8.599 -3.586 887 HG22 VAL 115 HG22 VAL 115 -3.810 7.129 -3.226 888 HG23 VAL 115 HG23 VAL 115 -3.468 8.290 -1.944 889 H LEU 116 HN LEU 116 -7.778 7.405 -4.254 890 HA LEU 116 HA LEU 116 -9.534 9.778 -4.228 891 HB2 LEU 116 HB2 LEU 116 -8.681 8.356 -6.230 892 HB3 LEU 116 HB1 LEU 116 -9.914 7.192 -5.743 893 HG LEU 116 HG LEU 116 -10.939 9.928 -5.835 894 HD11 LEU 116 HD11 LEU 116 -10.950 9.384 -8.546 895 HD12 LEU 116 HD12 LEU 116 -9.310 8.942 -8.073 896 HD13 LEU 116 HD13 LEU 116 -9.911 10.569 -7.754 897 HD21 LEU 116 HD21 LEU 116 -12.567 8.640 -7.402 898 HD22 LEU 116 HD22 LEU 116 -12.506 8.172 -5.703 899 HD23 LEU 116 HD23 LEU 116 -11.662 7.207 -6.914 900 H VAL 117 HN VAL 117 -9.322 6.873 -2.516 901 HA VAL 117 HA VAL 117 -12.093 6.098 -2.276 902 HB VAL 117 HB VAL 117 -11.146 4.974 -0.181 903 HG11 VAL 117 HG11 VAL 117 -9.301 3.819 -1.854 904 HG12 VAL 117 HG12 VAL 117 -10.417 4.569 -2.994 905 HG13 VAL 117 HG13 VAL 117 -11.015 3.411 -1.807 906 HG21 VAL 117 HG21 VAL 117 -8.401 5.291 -0.865 907 HG22 VAL 117 HG22 VAL 117 -9.210 5.743 0.633 908 HG23 VAL 117 HG23 VAL 117 -9.101 6.900 -0.691 909 H GLN 118 HN GLN 118 -10.549 8.890 -1.109 910 HA GLN 118 HA GLN 118 -11.909 9.001 1.476 911 HB2 GLN 118 HB2 GLN 118 -10.163 10.776 -0.195 912 HB3 GLN 118 HB1 GLN 118 -10.980 11.440 1.224 913 HG2 GLN 118 HG2 GLN 118 -9.965 9.801 2.670 914 HG3 GLN 118 HG1 GLN 118 -9.320 8.908 1.292 915 HE21 GLN 118 HE21 GLN 118 -7.285 9.543 0.495 916 HE22 GLN 118 HE22 GLN 118 -6.439 10.913 1.032 917 H ILE 119 HN ILE 119 -13.573 8.809 -1.072 918 HA ILE 119 HA ILE 119 -15.349 11.136 -0.467 919 HB ILE 119 HB ILE 119 -15.841 11.164 -2.934 920 HG12 ILE 119 HG12 ILE 119 -14.065 9.994 -4.353 921 HG13 ILE 119 HG11 ILE 119 -13.632 9.099 -2.899 922 HG21 ILE 119 HG21 ILE 119 -13.358 11.906 -3.514 923 HG22 ILE 119 HG22 ILE 119 -13.137 11.719 -1.775 924 HG23 ILE 119 HG23 ILE 119 -14.342 12.848 -2.393 925 HD11 ILE 119 HD11 ILE 119 -15.603 8.364 -4.701 926 HD12 ILE 119 HD12 ILE 119 -16.518 9.119 -3.396 927 HD13 ILE 119 HD13 ILE 119 -15.449 7.759 -3.051 928 H SER 120 HN SER 120 -14.976 7.815 -0.506 929 HA SER 120 HA SER 120 -17.570 6.996 -1.537 930 HB2 SER 120 HB2 SER 120 -15.477 5.694 0.237 931 HB3 SER 120 HB1 SER 120 -16.870 4.841 -0.424 932 HG SER 120 HG SER 120 -16.107 5.237 -2.479 933 H LYS 121 HN LYS 121 -17.356 5.395 1.357 934 HA LYS 121 HA LYS 121 -18.330 5.674 3.482 935 HB2 LYS 121 HB2 LYS 121 -17.623 8.256 2.655 936 HB3 LYS 121 HB1 LYS 121 -19.318 8.388 3.135 937 HG2 LYS 121 HG2 LYS 121 -18.888 7.797 5.336 938 HG3 LYS 121 HG1 LYS 121 -17.448 6.869 4.916 939 HD2 LYS 121 HD2 LYS 121 -17.676 9.893 4.818 940 HD3 LYS 121 HD1 LYS 121 -16.844 8.971 6.070 941 HE2 LYS 121 HE2 LYS 121 -15.416 7.960 4.196 942 HE3 LYS 121 HE1 LYS 121 -16.097 9.219 3.145 943 HZ1 LYS 121 HZ1 LYS 121 -13.977 9.573 4.791 944 HZ2 LYS 121 HZ2 LYS 121 -15.256 10.177 5.731 945 HZ3 LYS 121 HZ3 LYS 121 -14.956 10.820 4.188 946 H GLU 122 HN GLU 122 -20.109 7.333 0.880 947 HA GLU 122 HA GLU 122 -22.740 7.112 1.731 948 HB2 GLU 122 HB2 GLU 122 -23.069 6.484 -0.835 949 HB3 GLU 122 HB1 GLU 122 -22.438 8.069 -0.392 950 HG2 GLU 122 HG2 GLU 122 -20.313 7.583 -1.126 951 HG3 GLU 122 HG1 GLU 122 -20.444 5.878 -0.711 952 H VAL 123 HN VAL 123 -20.567 4.631 0.538 953 HA VAL 123 HA VAL 123 -21.593 2.501 1.990 954 HB VAL 123 HB VAL 123 -22.671 1.403 -0.259 955 HG11 VAL 123 HG11 VAL 123 -24.339 1.197 1.217 956 HG12 VAL 123 HG12 VAL 123 -24.782 2.884 0.954 957 HG13 VAL 123 HG13 VAL 123 -23.624 2.463 2.215 958 HG21 VAL 123 HG21 VAL 123 -22.317 3.877 -1.214 959 HG22 VAL 123 HG22 VAL 123 -23.863 4.141 -0.407 960 HG23 VAL 123 HG23 VAL 123 -23.722 2.908 -1.661 Start of MODEL 25 1 H1 GLY 1 HT1 GLY 1 -0.388 18.375 18.970 2 H2 GLY 1 HT2 GLY 1 0.034 18.679 17.353 3 H3 GLY 1 HT3 GLY 1 0.286 17.138 18.024 4 HA2 GLY 1 HA2 GLY 1 -2.442 18.032 18.211 5 HA3 GLY 1 HA1 GLY 1 -1.862 17.854 16.555 6 H SER 2 HN SER 2 -0.623 15.741 16.148 7 HA SER 2 HA SER 2 -1.489 13.495 17.894 8 HB2 SER 2 HB2 SER 2 -2.208 13.837 14.964 9 HB3 SER 2 HB1 SER 2 -2.506 12.378 15.904 10 HG SER 2 HG SER 2 -3.578 14.975 16.281 11 H HIS 3 HN HIS 3 -0.426 13.486 14.501 12 HA HIS 3 HA HIS 3 1.865 11.763 15.237 13 HB2 HIS 3 HB2 HIS 3 2.014 11.535 12.768 14 HB3 HIS 3 HB1 HIS 3 0.377 11.224 13.347 15 HD1 HIS 3 HD1 HIS 3 2.431 13.783 11.506 16 HD2 HIS 3 HD2 HIS 3 -1.548 13.154 12.572 17 HE1 HIS 3 HE1 HIS 3 1.072 15.490 10.224 18 H MET 4 HN MET 4 3.897 12.602 15.507 19 HA MET 4 HA MET 4 4.387 15.436 14.767 20 HB2 MET 4 HB2 MET 4 6.223 15.237 16.310 21 HB3 MET 4 HB1 MET 4 4.856 14.399 17.040 22 HG2 MET 4 HG2 MET 4 6.111 12.537 17.174 23 HG3 MET 4 HG1 MET 4 6.196 12.498 15.413 24 HE1 MET 4 HE1 MET 4 9.458 13.009 18.315 25 HE2 MET 4 HE2 MET 4 7.905 12.181 18.351 26 HE3 MET 4 HE3 MET 4 7.986 13.901 18.727 27 H THR 5 HN THR 5 4.219 13.733 12.517 28 HA THR 5 HA THR 5 7.090 13.425 11.702 29 HB THR 5 HB THR 5 6.251 11.692 10.192 30 HG1 THR 5 HG1 THR 5 3.690 12.254 11.253 31 HG21 THR 5 HG21 THR 5 6.615 10.543 12.130 32 HG22 THR 5 HG22 THR 5 4.858 10.385 12.116 33 HG23 THR 5 HG23 THR 5 5.624 11.644 13.086 34 H GLU 6 HN GLU 6 7.482 13.947 9.357 35 HA GLU 6 HA GLU 6 5.451 15.620 8.017 36 HB2 GLU 6 HB2 GLU 6 6.832 17.623 8.080 37 HB3 GLU 6 HB1 GLU 6 6.620 17.044 9.732 38 HG2 GLU 6 HG2 GLU 6 8.870 15.671 8.847 39 HG3 GLU 6 HG1 GLU 6 9.069 17.282 8.155 40 H ARG 7 HN ARG 7 6.716 13.173 7.209 41 HA ARG 7 HA ARG 7 7.627 13.876 4.577 42 HB2 ARG 7 HB2 ARG 7 10.034 13.184 4.949 43 HB3 ARG 7 HB1 ARG 7 9.582 14.698 5.734 44 HG2 ARG 7 HG2 ARG 7 10.446 13.754 7.608 45 HG3 ARG 7 HG1 ARG 7 8.937 12.842 7.663 46 HD2 ARG 7 HD2 ARG 7 11.008 11.392 7.808 47 HD3 ARG 7 HD1 ARG 7 9.964 10.993 6.429 48 HE ARG 7 HE ARG 7 11.874 13.041 5.713 49 HH11 ARG 7 HH11 ARG 7 12.237 9.913 6.938 50 HH12 ARG 7 HH12 ARG 7 13.190 9.327 5.615 51 HH21 ARG 7 HH21 ARG 7 12.784 12.187 3.704 52 HH22 ARG 7 HH22 ARG 7 13.488 10.607 3.782 53 H ARG 8 HN ARG 8 5.969 11.864 6.130 54 HA ARG 8 HA ARG 8 7.307 9.306 5.395 55 HB2 ARG 8 HB2 ARG 8 4.640 9.743 6.762 56 HB3 ARG 8 HB1 ARG 8 5.679 8.322 6.852 57 HG2 ARG 8 HG2 ARG 8 6.533 11.047 7.858 58 HG3 ARG 8 HG1 ARG 8 5.751 9.847 8.885 59 HD2 ARG 8 HD2 ARG 8 7.579 8.401 8.826 60 HD3 ARG 8 HD1 ARG 8 8.154 9.036 7.271 61 HE ARG 8 HE ARG 8 8.697 11.175 8.545 62 HH11 ARG 8 HH21 ARG 8 7.424 9.314 10.900 63 HH12 ARG 8 HH22 ARG 8 8.834 9.222 11.902 64 HH21 ARG 8 HH11 ARG 8 10.947 10.569 9.505 65 HH22 ARG 8 HH12 ARG 8 10.825 9.946 11.116 66 H LEU 9 HN LEU 9 5.410 11.551 3.880 67 HA LEU 9 HA LEU 9 3.229 10.169 2.743 68 HB2 LEU 9 HB2 LEU 9 4.951 12.508 2.142 69 HB3 LEU 9 HB1 LEU 9 3.975 11.903 0.804 70 HG LEU 9 HG LEU 9 2.865 13.671 2.272 71 HD11 LEU 9 HD11 LEU 9 1.351 11.064 2.307 72 HD12 LEU 9 HD12 LEU 9 1.740 11.863 0.784 73 HD13 LEU 9 HD13 LEU 9 0.743 12.688 1.983 74 HD21 LEU 9 HD21 LEU 9 3.787 12.546 4.397 75 HD22 LEU 9 HD22 LEU 9 2.500 11.359 4.190 76 HD23 LEU 9 HD23 LEU 9 2.101 13.058 4.444 77 H ARG 10 HN ARG 10 4.092 7.964 2.283 78 HA ARG 10 HA ARG 10 5.021 7.822 -0.478 79 HB2 ARG 10 HB2 ARG 10 6.989 8.136 1.216 80 HB3 ARG 10 HB1 ARG 10 6.703 6.437 1.587 81 HG2 ARG 10 HG2 ARG 10 8.447 6.901 -0.218 82 HG3 ARG 10 HG1 ARG 10 7.177 5.760 -0.647 83 HD2 ARG 10 HD2 ARG 10 6.181 8.319 -1.373 84 HD3 ARG 10 HD1 ARG 10 7.839 8.253 -1.938 85 HE ARG 10 HE ARG 10 6.718 5.739 -2.509 86 HH11 ARG 10 HH11 ARG 10 7.944 7.569 -4.567 87 HH12 ARG 10 HH12 ARG 10 6.597 7.869 -5.613 88 HH21 ARG 10 HH21 ARG 10 4.237 6.758 -3.328 89 HH22 ARG 10 HH22 ARG 10 4.496 7.417 -4.908 90 H VAL 11 HN VAL 11 4.966 5.638 -1.360 91 HA VAL 11 HA VAL 11 3.313 3.767 0.302 92 HB VAL 11 HB VAL 11 1.948 3.426 -1.698 93 HG11 VAL 11 HG11 VAL 11 2.334 6.409 -1.546 94 HG12 VAL 11 HG12 VAL 11 1.734 5.527 -0.142 95 HG13 VAL 11 HG13 VAL 11 0.832 5.491 -1.657 96 HG21 VAL 11 HG21 VAL 11 2.675 5.339 -3.528 97 HG22 VAL 11 HG22 VAL 11 3.135 3.639 -3.639 98 HG23 VAL 11 HG23 VAL 11 4.249 4.811 -2.935 99 H LEU 12 HN LEU 12 4.770 2.073 0.647 100 HA LEU 12 HA LEU 12 6.548 1.190 -1.546 101 HB2 LEU 12 HB2 LEU 12 6.070 0.061 1.237 102 HB3 LEU 12 HB1 LEU 12 7.470 -0.239 0.206 103 HG LEU 12 HG LEU 12 6.711 2.556 1.057 104 HD11 LEU 12 HD11 LEU 12 7.325 0.641 2.900 105 HD12 LEU 12 HD12 LEU 12 7.734 2.347 3.084 106 HD13 LEU 12 HD13 LEU 12 8.937 1.212 2.469 107 HD21 LEU 12 HD21 LEU 12 8.269 2.366 -0.809 108 HD22 LEU 12 HD22 LEU 12 9.263 1.228 0.099 109 HD23 LEU 12 HD23 LEU 12 9.150 2.909 0.620 110 H VAL 13 HN VAL 13 5.215 0.183 -3.117 111 HA VAL 13 HA VAL 13 3.272 -1.874 -2.153 112 HB VAL 13 HB VAL 13 3.660 -0.553 -4.858 113 HG11 VAL 13 HG11 VAL 13 2.284 -2.873 -4.230 114 HG12 VAL 13 HG12 VAL 13 1.963 -1.844 -5.626 115 HG13 VAL 13 HG13 VAL 13 1.030 -1.637 -4.144 116 HG21 VAL 13 HG21 VAL 13 2.622 0.480 -2.423 117 HG22 VAL 13 HG22 VAL 13 1.242 0.171 -3.477 118 HG23 VAL 13 HG23 VAL 13 2.550 1.223 -4.021 119 H VAL 14 HN VAL 14 3.514 -4.051 -2.840 120 HA VAL 14 HA VAL 14 5.749 -4.635 -4.695 121 HB VAL 14 HB VAL 14 6.919 -5.895 -3.063 122 HG11 VAL 14 HG11 VAL 14 7.077 -3.411 -2.832 123 HG12 VAL 14 HG12 VAL 14 7.434 -4.301 -1.354 124 HG13 VAL 14 HG13 VAL 14 5.868 -3.514 -1.552 125 HG21 VAL 14 HG21 VAL 14 6.028 -6.422 -0.858 126 HG22 VAL 14 HG22 VAL 14 4.915 -6.999 -2.099 127 HG23 VAL 14 HG23 VAL 14 4.561 -5.512 -1.220 128 H GLU 15 HN GLU 15 5.455 -6.455 -5.853 129 HA GLU 15 HA GLU 15 3.621 -8.610 -5.022 130 HB2 GLU 15 HB2 GLU 15 1.950 -8.152 -6.522 131 HB3 GLU 15 HB1 GLU 15 2.594 -6.510 -6.466 132 HG2 GLU 15 HG2 GLU 15 3.903 -6.880 -8.462 133 HG3 GLU 15 HG1 GLU 15 3.555 -8.606 -8.442 134 H ASP 16 HN ASP 16 4.036 -10.561 -6.323 135 HA ASP 16 HA ASP 16 6.648 -11.162 -6.968 136 HB2 ASP 16 HB2 ASP 16 5.524 -12.801 -8.626 137 HB3 ASP 16 HB1 ASP 16 5.070 -12.891 -6.925 138 H GLU 17 HN GLU 17 4.251 -10.182 -9.478 139 HA GLU 17 HA GLU 17 6.315 -9.942 -11.506 140 HB2 GLU 17 HB2 GLU 17 3.516 -8.813 -11.587 141 HB3 GLU 17 HB1 GLU 17 4.478 -9.438 -12.927 142 HG2 GLU 17 HG2 GLU 17 3.566 -11.468 -12.605 143 HG3 GLU 17 HG1 GLU 17 4.291 -11.520 -10.999 144 H SER 18 HN SER 18 6.598 -7.927 -12.801 145 HA SER 18 HA SER 18 7.132 -5.619 -11.026 146 HB2 SER 18 HB2 SER 18 7.764 -6.216 -13.935 147 HB3 SER 18 HB1 SER 18 8.397 -4.851 -13.020 148 HG SER 18 HG SER 18 9.751 -6.143 -12.051 149 H MET 19 HN MET 19 4.534 -6.650 -12.895 150 HA MET 19 HA MET 19 3.695 -4.424 -14.400 151 HB2 MET 19 HB2 MET 19 2.502 -6.552 -14.339 152 HB3 MET 19 HB1 MET 19 2.157 -6.347 -12.622 153 HG2 MET 19 HG2 MET 19 0.846 -4.292 -13.170 154 HG3 MET 19 HG1 MET 19 1.117 -4.611 -14.883 155 HE1 MET 19 HE1 MET 19 0.751 -7.511 -12.264 156 HE2 MET 19 HE2 MET 19 -0.987 -7.489 -11.982 157 HE3 MET 19 HE3 MET 19 -0.014 -6.084 -11.551 158 H ILE 20 HN ILE 20 3.964 -4.874 -10.974 159 HA ILE 20 HA ILE 20 2.323 -2.569 -10.204 160 HB ILE 20 HB ILE 20 2.552 -4.552 -8.801 161 HG12 ILE 20 HG12 ILE 20 4.167 -2.332 -7.525 162 HG13 ILE 20 HG11 ILE 20 2.411 -2.267 -7.717 163 HG21 ILE 20 HG21 ILE 20 5.482 -3.963 -9.107 164 HG22 ILE 20 HG22 ILE 20 4.633 -5.482 -9.385 165 HG23 ILE 20 HG23 ILE 20 4.888 -4.902 -7.739 166 HD11 ILE 20 HD11 ILE 20 3.654 -3.322 -5.528 167 HD12 ILE 20 HD12 ILE 20 3.449 -4.767 -6.517 168 HD13 ILE 20 HD13 ILE 20 2.045 -3.801 -6.065 169 H ALA 21 HN ALA 21 5.581 -3.173 -11.179 170 HA ALA 21 HA ALA 21 6.923 -1.014 -9.830 171 HB1 ALA 21 HB1 ALA 21 7.678 -3.170 -11.174 172 HB2 ALA 21 HB2 ALA 21 8.718 -1.748 -11.110 173 HB3 ALA 21 HB3 ALA 21 7.717 -2.045 -12.530 174 H MET 22 HN MET 22 6.295 -1.215 -13.357 175 HA MET 22 HA MET 22 6.572 1.577 -13.847 176 HB2 MET 22 HB2 MET 22 6.698 0.003 -15.644 177 HB3 MET 22 HB1 MET 22 5.132 -0.697 -15.235 178 HG2 MET 22 HG2 MET 22 4.055 1.487 -15.807 179 HG3 MET 22 HG1 MET 22 5.630 2.089 -16.326 180 HE1 MET 22 HE1 MET 22 2.715 1.502 -17.240 181 HE2 MET 22 HE2 MET 22 2.445 -0.125 -17.861 182 HE3 MET 22 HE3 MET 22 2.807 1.189 -18.977 183 H LEU 23 HN LEU 23 3.915 -0.324 -12.649 184 HA LEU 23 HA LEU 23 1.772 1.534 -13.157 185 HB2 LEU 23 HB2 LEU 23 1.302 -0.767 -12.735 186 HB3 LEU 23 HB1 LEU 23 2.308 -0.786 -11.292 187 HG LEU 23 HG LEU 23 -0.244 -0.745 -10.955 188 HD11 LEU 23 HD11 LEU 23 0.441 1.487 -9.349 189 HD12 LEU 23 HD12 LEU 23 1.913 0.537 -9.557 190 HD13 LEU 23 HD13 LEU 23 0.465 -0.217 -8.895 191 HD21 LEU 23 HD21 LEU 23 0.056 1.587 -12.558 192 HD22 LEU 23 HD22 LEU 23 -0.418 2.121 -10.947 193 HD23 LEU 23 HD23 LEU 23 -1.416 0.963 -11.822 194 H ILE 24 HN ILE 24 4.461 1.726 -11.127 195 HA ILE 24 HA ILE 24 3.058 3.415 -9.111 196 HB ILE 24 HB ILE 24 5.096 1.417 -9.075 197 HG12 ILE 24 HG12 ILE 24 4.617 2.966 -6.612 198 HG13 ILE 24 HG11 ILE 24 3.154 2.404 -7.421 199 HG21 ILE 24 HG21 ILE 24 6.055 4.156 -8.206 200 HG22 ILE 24 HG22 ILE 24 6.824 3.072 -9.364 201 HG23 ILE 24 HG23 ILE 24 6.787 2.651 -7.652 202 HD11 ILE 24 HD11 ILE 24 5.142 0.878 -5.935 203 HD12 ILE 24 HD12 ILE 24 4.882 0.219 -7.550 204 HD13 ILE 24 HD13 ILE 24 3.521 0.405 -6.444 205 H GLU 25 HN GLU 25 6.094 3.429 -11.026 206 HA GLU 25 HA GLU 25 6.960 6.035 -10.602 207 HB2 GLU 25 HB2 GLU 25 7.170 3.968 -12.659 208 HB3 GLU 25 HB1 GLU 25 7.343 5.590 -13.327 209 HG2 GLU 25 HG2 GLU 25 8.803 5.247 -10.810 210 HG3 GLU 25 HG1 GLU 25 9.350 4.146 -12.074 211 H ASP 26 HN ASP 26 4.367 4.952 -12.767 212 HA ASP 26 HA ASP 26 3.919 7.581 -13.923 213 HB2 ASP 26 HB2 ASP 26 2.339 6.426 -15.197 214 HB3 ASP 26 HB1 ASP 26 3.396 5.102 -14.709 215 H THR 27 HN THR 27 2.256 5.643 -11.411 216 HA THR 27 HA THR 27 0.181 7.517 -10.857 217 HB THR 27 HB THR 27 0.563 6.245 -8.497 218 HG1 THR 27 HG1 THR 27 2.582 5.423 -9.479 219 HG21 THR 27 HG21 THR 27 -0.889 4.488 -9.371 220 HG22 THR 27 HG22 THR 27 -0.441 4.909 -11.024 221 HG23 THR 27 HG23 THR 27 -1.374 6.043 -10.047 222 H LEU 28 HN LEU 28 3.417 7.094 -9.382 223 HA LEU 28 HA LEU 28 3.192 9.181 -7.448 224 HB2 LEU 28 HB2 LEU 28 5.416 8.667 -7.072 225 HB3 LEU 28 HB1 LEU 28 4.967 7.252 -8.015 226 HG LEU 28 HG LEU 28 5.686 8.649 -10.080 227 HD11 LEU 28 HD11 LEU 28 6.701 10.652 -9.765 228 HD12 LEU 28 HD12 LEU 28 7.631 10.056 -8.390 229 HD13 LEU 28 HD13 LEU 28 5.975 10.618 -8.158 230 HD21 LEU 28 HD21 LEU 28 6.929 6.728 -8.775 231 HD22 LEU 28 HD22 LEU 28 7.988 8.035 -8.247 232 HD23 LEU 28 HD23 LEU 28 7.812 7.683 -9.966 233 H CYS 29 HN CYS 29 3.966 9.209 -10.898 234 HA CYS 29 HA CYS 29 5.101 11.735 -11.267 235 HB2 CYS 29 HB2 CYS 29 4.589 10.014 -13.008 236 HB3 CYS 29 HB1 CYS 29 2.884 10.452 -12.897 237 HG CYS 29 HG CYS 29 3.970 13.001 -13.490 238 H GLU 30 HN GLU 30 1.749 10.890 -10.546 239 HA GLU 30 HA GLU 30 0.829 13.665 -10.798 240 HB2 GLU 30 HB2 GLU 30 -0.558 11.790 -11.537 241 HB3 GLU 30 HB1 GLU 30 -0.474 11.068 -9.931 242 HG2 GLU 30 HG2 GLU 30 -2.056 12.465 -9.086 243 HG3 GLU 30 HG1 GLU 30 -1.423 13.864 -9.957 244 H LEU 31 HN LEU 31 1.235 11.228 -8.211 245 HA LEU 31 HA LEU 31 0.397 12.994 -6.070 246 HB2 LEU 31 HB2 LEU 31 2.143 10.512 -5.995 247 HB3 LEU 31 HB1 LEU 31 1.175 11.163 -4.668 248 HG LEU 31 HG LEU 31 -0.261 10.565 -7.206 249 HD11 LEU 31 HD11 LEU 31 0.054 8.263 -5.369 250 HD12 LEU 31 HD12 LEU 31 1.477 8.654 -6.334 251 HD13 LEU 31 HD13 LEU 31 -0.055 8.291 -7.129 252 HD21 LEU 31 HD21 LEU 31 -1.695 9.513 -5.160 253 HD22 LEU 31 HD22 LEU 31 -1.779 11.216 -5.609 254 HD23 LEU 31 HD23 LEU 31 -0.745 10.706 -4.275 255 H GLY 32 HN GLY 32 3.566 12.051 -7.411 256 HA2 GLY 32 HA2 GLY 32 5.608 13.248 -7.272 257 HA3 GLY 32 HA1 GLY 32 4.777 14.481 -6.311 258 H HIS 33 HN HIS 33 4.129 11.373 -5.165 259 HA HIS 33 HA HIS 33 5.107 11.670 -2.584 260 HB2 HIS 33 HB2 HIS 33 4.588 9.369 -4.441 261 HB3 HIS 33 HB1 HIS 33 5.287 9.038 -2.851 262 HD1 HIS 33 HD1 HIS 33 2.113 9.153 -4.372 263 HD2 HIS 33 HD2 HIS 33 3.597 10.681 -0.788 264 HE1 HIS 33 HE1 HIS 33 0.108 9.542 -2.875 265 H GLU 34 HN GLU 34 6.987 10.170 -1.656 266 HA GLU 34 HA GLU 34 9.478 11.163 -2.767 267 HB2 GLU 34 HB2 GLU 34 8.564 9.381 -0.549 268 HB3 GLU 34 HB1 GLU 34 10.264 9.301 -1.013 269 HG2 GLU 34 HG2 GLU 34 10.480 11.733 -0.714 270 HG3 GLU 34 HG1 GLU 34 8.770 11.839 -0.287 271 H VAL 35 HN VAL 35 9.608 7.802 -1.925 272 HA VAL 35 HA VAL 35 9.810 7.008 -4.799 273 HB VAL 35 HB VAL 35 11.854 5.631 -3.901 274 HG11 VAL 35 HG11 VAL 35 11.581 8.079 -5.185 275 HG12 VAL 35 HG12 VAL 35 13.072 7.151 -5.039 276 HG13 VAL 35 HG13 VAL 35 12.710 8.424 -3.875 277 HG21 VAL 35 HG21 VAL 35 11.491 6.117 -1.518 278 HG22 VAL 35 HG22 VAL 35 11.639 7.846 -1.834 279 HG23 VAL 35 HG23 VAL 35 13.035 6.788 -2.044 280 H ALA 36 HN ALA 36 8.055 5.608 -4.843 281 HA ALA 36 HA ALA 36 7.246 3.958 -2.615 282 HB1 ALA 36 HB1 ALA 36 5.789 2.968 -4.477 283 HB2 ALA 36 HB2 ALA 36 6.593 4.099 -5.564 284 HB3 ALA 36 HB3 ALA 36 5.631 4.705 -4.216 285 H ALA 37 HN ALA 37 6.814 1.466 -3.412 286 HA ALA 37 HA ALA 37 9.493 0.390 -4.250 287 HB1 ALA 37 HB1 ALA 37 8.492 -1.588 -2.746 288 HB2 ALA 37 HB2 ALA 37 7.588 -0.252 -2.036 289 HB3 ALA 37 HB3 ALA 37 9.351 -0.229 -2.021 290 H THR 38 HN THR 38 9.390 -1.639 -5.440 291 HA THR 38 HA THR 38 6.720 -2.246 -6.632 292 HB THR 38 HB THR 38 7.856 -0.908 -8.232 293 HG1 THR 38 HG1 THR 38 8.718 -3.466 -9.006 294 HG21 THR 38 HG21 THR 38 10.055 -0.880 -7.179 295 HG22 THR 38 HG22 THR 38 10.226 -1.362 -8.866 296 HG23 THR 38 HG23 THR 38 10.303 -2.577 -7.590 297 H ALA 39 HN ALA 39 6.704 -4.337 -7.767 298 HA ALA 39 HA ALA 39 6.840 -6.668 -7.670 299 HB1 ALA 39 HB1 ALA 39 9.121 -5.769 -8.591 300 HB2 ALA 39 HB2 ALA 39 8.964 -7.468 -8.145 301 HB3 ALA 39 HB3 ALA 39 9.745 -6.335 -7.042 302 H SER 40 HN SER 40 7.232 -8.491 -6.136 303 HA SER 40 HA SER 40 6.905 -7.602 -3.367 304 HB2 SER 40 HB2 SER 40 6.446 -9.937 -2.990 305 HB3 SER 40 HB1 SER 40 5.666 -9.465 -4.493 306 HG SER 40 HG SER 40 7.142 -11.470 -4.312 307 H ARG 41 HN ARG 41 8.533 -7.541 -1.829 308 HA ARG 41 HA ARG 41 11.003 -9.092 -2.267 309 HB2 ARG 41 HB2 ARG 41 10.830 -6.648 -3.345 310 HB3 ARG 41 HB1 ARG 41 11.287 -6.175 -1.707 311 HG2 ARG 41 HG2 ARG 41 13.291 -6.482 -3.103 312 HG3 ARG 41 HG1 ARG 41 13.239 -7.687 -1.816 313 HD2 ARG 41 HD2 ARG 41 13.301 -9.339 -3.364 314 HD3 ARG 41 HD1 ARG 41 11.804 -8.718 -4.087 315 HE ARG 41 HE ARG 41 13.960 -7.006 -4.846 316 HH11 ARG 41 HH11 ARG 41 12.820 -10.237 -5.286 317 HH12 ARG 41 HH12 ARG 41 13.427 -10.368 -6.903 318 HH21 ARG 41 HH21 ARG 41 14.720 -7.154 -6.971 319 HH22 ARG 41 HH22 ARG 41 14.504 -8.630 -7.852 320 H MET 42 HN MET 42 11.337 -10.036 -0.289 321 HA MET 42 HA MET 42 10.124 -9.223 2.150 322 HB2 MET 42 HB2 MET 42 12.494 -10.938 1.394 323 HB3 MET 42 HB1 MET 42 12.007 -10.739 3.078 324 HG2 MET 42 HG2 MET 42 9.626 -11.367 2.222 325 HG3 MET 42 HG1 MET 42 10.475 -12.005 0.815 326 HE1 MET 42 HE1 MET 42 9.970 -13.465 4.958 327 HE2 MET 42 HE2 MET 42 9.815 -11.828 4.325 328 HE3 MET 42 HE3 MET 42 11.356 -12.367 4.990 329 H GLN 43 HN GLN 43 13.250 -8.387 0.705 330 HA GLN 43 HA GLN 43 14.422 -7.133 2.997 331 HB2 GLN 43 HB2 GLN 43 14.719 -6.807 0.000 332 HB3 GLN 43 HB1 GLN 43 15.751 -5.958 1.149 333 HG2 GLN 43 HG2 GLN 43 15.690 -8.672 1.975 334 HG3 GLN 43 HG1 GLN 43 15.948 -8.681 0.230 335 HE21 GLN 43 HE21 GLN 43 17.994 -8.003 -0.552 336 HE22 GLN 43 HE22 GLN 43 19.246 -7.448 0.450 337 H GLU 44 HN GLU 44 12.772 -5.625 0.180 338 HA GLU 44 HA GLU 44 12.602 -3.044 1.488 339 HB2 GLU 44 HB2 GLU 44 11.361 -4.274 -0.985 340 HB3 GLU 44 HB1 GLU 44 11.166 -2.576 -0.547 341 HG2 GLU 44 HG2 GLU 44 13.752 -4.021 -1.176 342 HG3 GLU 44 HG1 GLU 44 13.015 -2.705 -2.090 343 H ALA 45 HN ALA 45 10.289 -5.674 0.786 344 HA ALA 45 HA ALA 45 7.884 -4.568 1.655 345 HB1 ALA 45 HB1 ALA 45 9.120 -7.306 2.074 346 HB2 ALA 45 HB2 ALA 45 8.022 -6.813 0.784 347 HB3 ALA 45 HB3 ALA 45 7.429 -6.959 2.438 348 H LEU 46 HN LEU 46 10.140 -6.388 3.755 349 HA LEU 46 HA LEU 46 9.047 -5.903 6.265 350 HB2 LEU 46 HB2 LEU 46 11.119 -7.203 5.572 351 HB3 LEU 46 HB1 LEU 46 11.972 -5.663 5.515 352 HG LEU 46 HG LEU 46 11.031 -5.364 7.944 353 HD11 LEU 46 HD11 LEU 46 11.112 -8.384 7.700 354 HD12 LEU 46 HD12 LEU 46 9.620 -7.444 7.735 355 HD13 LEU 46 HD13 LEU 46 10.694 -7.445 9.133 356 HD21 LEU 46 HD21 LEU 46 13.114 -6.097 8.757 357 HD22 LEU 46 HD22 LEU 46 13.446 -5.796 7.052 358 HD23 LEU 46 HD23 LEU 46 13.188 -7.445 7.622 359 H ASP 47 HN ASP 47 10.878 -3.701 4.196 360 HA ASP 47 HA ASP 47 11.279 -1.603 6.102 361 HB2 ASP 47 HB2 ASP 47 11.955 -2.228 3.482 362 HB3 ASP 47 HB1 ASP 47 10.929 -0.804 3.309 363 H ILE 48 HN ILE 48 8.482 -2.597 4.265 364 HA ILE 48 HA ILE 48 7.136 -0.009 4.638 365 HB ILE 48 HB ILE 48 5.619 -0.787 3.058 366 HG12 ILE 48 HG12 ILE 48 6.166 -3.508 4.248 367 HG13 ILE 48 HG11 ILE 48 4.643 -2.635 4.169 368 HG21 ILE 48 HG21 ILE 48 7.826 -2.715 2.399 369 HG22 ILE 48 HG22 ILE 48 8.092 -0.973 2.320 370 HG23 ILE 48 HG23 ILE 48 6.857 -1.723 1.308 371 HD11 ILE 48 HD11 ILE 48 5.612 -3.010 1.488 372 HD12 ILE 48 HD12 ILE 48 4.146 -3.647 2.218 373 HD13 ILE 48 HD13 ILE 48 5.648 -4.562 2.322 374 H ALA 49 HN ALA 49 7.119 -3.276 6.030 375 HA ALA 49 HA ALA 49 4.681 -2.625 7.547 376 HB1 ALA 49 HB1 ALA 49 4.407 -4.871 7.534 377 HB2 ALA 49 HB2 ALA 49 6.043 -5.147 8.129 378 HB3 ALA 49 HB3 ALA 49 5.761 -4.901 6.407 379 H ARG 50 HN ARG 50 8.035 -3.623 8.328 380 HA ARG 50 HA ARG 50 7.622 -3.245 11.170 381 HB2 ARG 50 HB2 ARG 50 10.339 -3.255 9.912 382 HB3 ARG 50 HB1 ARG 50 9.785 -4.073 11.371 383 HG2 ARG 50 HG2 ARG 50 9.341 -4.883 8.493 384 HG3 ARG 50 HG1 ARG 50 10.117 -5.799 9.777 385 HD2 ARG 50 HD2 ARG 50 7.243 -5.012 10.142 386 HD3 ARG 50 HD1 ARG 50 7.634 -6.364 9.066 387 HE ARG 50 HE ARG 50 9.178 -6.873 11.293 388 HH11 ARG 50 HH11 ARG 50 6.904 -5.285 12.642 389 HH12 ARG 50 HH12 ARG 50 5.874 -6.579 13.155 390 HH21 ARG 50 HH21 ARG 50 7.401 -8.945 11.129 391 HH22 ARG 50 HH22 ARG 50 6.162 -8.657 12.305 392 H LYS 51 HN LYS 51 7.867 -0.996 8.756 393 HA LYS 51 HA LYS 51 9.695 0.883 10.007 394 HB2 LYS 51 HB2 LYS 51 9.366 0.798 7.610 395 HB3 LYS 51 HB1 LYS 51 7.633 1.064 7.798 396 HG2 LYS 51 HG2 LYS 51 8.736 3.153 7.158 397 HG3 LYS 51 HG1 LYS 51 8.107 3.278 8.800 398 HD2 LYS 51 HD2 LYS 51 10.194 3.344 9.745 399 HD3 LYS 51 HD1 LYS 51 10.885 2.258 8.537 400 HE2 LYS 51 HE2 LYS 51 10.181 4.550 7.081 401 HE3 LYS 51 HE1 LYS 51 10.894 5.168 8.584 402 HZ1 LYS 51 HZ1 LYS 51 12.063 3.054 6.854 403 HZ2 LYS 51 HZ2 LYS 51 12.730 3.618 8.311 404 HZ3 LYS 51 HZ3 LYS 51 12.620 4.652 6.967 405 H GLY 52 HN GLY 52 6.147 0.556 9.790 406 HA2 GLY 52 HA2 GLY 52 4.467 1.444 11.180 407 HA3 GLY 52 HA1 GLY 52 5.736 1.842 12.338 408 H GLN 53 HN GLN 53 6.333 3.087 9.229 409 HA GLN 53 HA GLN 53 4.840 5.588 9.526 410 HB2 GLN 53 HB2 GLN 53 6.884 6.955 9.893 411 HB3 GLN 53 HB1 GLN 53 6.619 5.824 11.220 412 HG2 GLN 53 HG2 GLN 53 8.327 4.362 10.465 413 HG3 GLN 53 HG1 GLN 53 8.376 5.114 8.871 414 HE21 GLN 53 HE21 GLN 53 9.751 6.920 8.583 415 HE22 GLN 53 HE22 GLN 53 10.669 7.609 9.833 416 H PHE 54 HN PHE 54 4.646 4.079 7.358 417 HA PHE 54 HA PHE 54 6.485 5.326 5.342 418 HB2 PHE 54 HB2 PHE 54 6.135 3.145 4.091 419 HB3 PHE 54 HB1 PHE 54 7.022 2.987 5.607 420 HD1 PHE 54 HD2 PHE 54 5.780 2.221 7.688 421 HD2 PHE 54 HD1 PHE 54 4.063 2.047 3.766 422 HE1 PHE 54 HE2 PHE 54 4.092 0.609 8.501 423 HE2 PHE 54 HE1 PHE 54 2.375 0.444 4.573 424 HZ PHE 54 HZ PHE 54 2.388 -0.291 6.938 425 H ASP 55 HN ASP 55 3.422 5.349 6.503 426 HA ASP 55 HA ASP 55 1.470 6.336 5.659 427 HB2 ASP 55 HB2 ASP 55 3.341 7.538 4.316 428 HB3 ASP 55 HB1 ASP 55 2.795 6.535 2.980 429 H ILE 56 HN ILE 56 2.947 4.002 3.286 430 HA ILE 56 HA ILE 56 0.415 2.479 3.386 431 HB ILE 56 HB ILE 56 1.308 4.125 1.022 432 HG12 ILE 56 HG12 ILE 56 -1.211 3.776 2.658 433 HG13 ILE 56 HG11 ILE 56 -0.288 5.250 2.369 434 HG21 ILE 56 HG21 ILE 56 -0.424 2.863 -0.306 435 HG22 ILE 56 HG22 ILE 56 -0.514 1.695 1.011 436 HG23 ILE 56 HG23 ILE 56 0.989 1.895 0.112 437 HD11 ILE 56 HD11 ILE 56 -2.426 4.068 0.778 438 HD12 ILE 56 HD12 ILE 56 -0.985 4.390 -0.187 439 HD13 ILE 56 HD13 ILE 56 -1.753 5.698 0.714 440 H ALA 57 HN ALA 57 0.625 0.320 2.678 441 HA ALA 57 HA ALA 57 3.178 -0.477 1.325 442 HB1 ALA 57 HB1 ALA 57 2.139 -1.306 4.032 443 HB2 ALA 57 HB2 ALA 57 3.775 -0.819 3.587 444 HB3 ALA 57 HB3 ALA 57 3.158 -2.397 3.100 445 H ILE 58 HN ILE 58 2.651 -1.992 -0.290 446 HA ILE 58 HA ILE 58 0.061 -3.442 0.118 447 HB ILE 58 HB ILE 58 1.188 -2.055 -2.315 448 HG12 ILE 58 HG12 ILE 58 -1.129 -0.951 -2.119 449 HG13 ILE 58 HG11 ILE 58 -1.205 -1.666 -0.508 450 HG21 ILE 58 HG21 ILE 58 -0.841 -2.873 -3.482 451 HG22 ILE 58 HG22 ILE 58 -1.260 -3.829 -2.062 452 HG23 ILE 58 HG23 ILE 58 0.197 -4.207 -2.978 453 HD11 ILE 58 HD11 ILE 58 0.044 0.750 -1.221 454 HD12 ILE 58 HD12 ILE 58 1.359 -0.388 -0.931 455 HD13 ILE 58 HD13 ILE 58 0.160 -0.084 0.327 456 H ILE 59 HN ILE 59 1.049 -5.432 0.683 457 HA ILE 59 HA ILE 59 2.905 -6.710 -1.259 458 HB ILE 59 HB ILE 59 1.770 -7.324 1.473 459 HG12 ILE 59 HG12 ILE 59 4.581 -7.809 1.044 460 HG13 ILE 59 HG11 ILE 59 4.152 -6.212 0.443 461 HG21 ILE 59 HG21 ILE 59 1.619 -9.494 0.713 462 HG22 ILE 59 HG22 ILE 59 3.345 -9.464 1.074 463 HG23 ILE 59 HG23 ILE 59 2.785 -9.232 -0.583 464 HD11 ILE 59 HD11 ILE 59 4.649 -6.829 3.092 465 HD12 ILE 59 HD12 ILE 59 2.889 -6.831 3.006 466 HD13 ILE 59 HD13 ILE 59 3.789 -5.403 2.518 467 H ASP 60 HN ASP 60 0.902 -6.143 -2.687 468 HA ASP 60 HA ASP 60 -1.534 -7.580 -2.434 469 HB2 ASP 60 HB2 ASP 60 -1.506 -5.686 -3.822 470 HB3 ASP 60 HB1 ASP 60 -0.039 -6.200 -4.649 471 H VAL 61 HN VAL 61 -2.324 -9.216 -3.897 472 HA VAL 61 HA VAL 61 -2.208 -11.181 -5.141 473 HB VAL 61 HB VAL 61 0.113 -9.872 -5.755 474 HG11 VAL 61 HG11 VAL 61 1.006 -12.661 -4.984 475 HG12 VAL 61 HG12 VAL 61 1.290 -11.268 -3.947 476 HG13 VAL 61 HG13 VAL 61 1.999 -11.324 -5.560 477 HG21 VAL 61 HG21 VAL 61 0.255 -11.399 -7.602 478 HG22 VAL 61 HG22 VAL 61 -1.452 -11.252 -7.185 479 HG23 VAL 61 HG23 VAL 61 -0.542 -12.678 -6.686 480 H ASN 62 HN ASN 62 -3.128 -11.869 -3.046 481 HA ASN 62 HA ASN 62 -1.278 -13.666 -1.528 482 HB2 ASN 62 HB2 ASN 62 -3.663 -12.013 -0.765 483 HB3 ASN 62 HB1 ASN 62 -3.251 -13.430 0.186 484 HD21 ASN 62 HD21 ASN 62 -1.145 -10.964 -1.399 485 HD22 ASN 62 HD22 ASN 62 -0.312 -10.556 0.019 486 H LEU 63 HN LEU 63 -1.775 -15.095 -3.450 487 HA LEU 63 HA LEU 63 -4.228 -16.699 -2.908 488 HB2 LEU 63 HB2 LEU 63 -3.673 -14.931 -5.126 489 HB3 LEU 63 HB1 LEU 63 -3.768 -16.591 -5.715 490 HG LEU 63 HG LEU 63 -5.949 -16.872 -4.620 491 HD11 LEU 63 HD11 LEU 63 -6.955 -14.525 -3.870 492 HD12 LEU 63 HD12 LEU 63 -5.259 -14.149 -3.567 493 HD13 LEU 63 HD13 LEU 63 -6.023 -15.506 -2.739 494 HD21 LEU 63 HD21 LEU 63 -5.621 -15.779 -6.952 495 HD22 LEU 63 HD22 LEU 63 -6.049 -14.268 -6.149 496 HD23 LEU 63 HD23 LEU 63 -7.199 -15.605 -6.184 497 H ASP 64 HN ASP 64 -3.916 -18.694 -4.686 498 HA ASP 64 HA ASP 64 -2.614 -20.646 -5.026 499 HB2 ASP 64 HB2 ASP 64 -0.986 -18.217 -5.662 500 HB3 ASP 64 HB1 ASP 64 -0.142 -19.769 -5.635 501 H GLY 65 HN GLY 65 -2.685 -19.256 -2.266 502 HA2 GLY 65 HA2 GLY 65 -1.643 -20.766 -0.448 503 HA3 GLY 65 HA1 GLY 65 -0.112 -20.303 -1.189 504 H GLU 66 HN GLU 66 -1.932 -17.652 -1.588 505 HA GLU 66 HA GLU 66 -1.627 -15.512 -0.602 506 HB2 GLU 66 HB2 GLU 66 -2.865 -15.539 1.609 507 HB3 GLU 66 HB1 GLU 66 -3.721 -16.328 0.285 508 HG2 GLU 66 HG2 GLU 66 -3.025 -18.520 1.066 509 HG3 GLU 66 HG1 GLU 66 -1.997 -17.797 2.304 510 HA PRO 67 HA PRO 67 2.236 -16.575 1.653 511 HB2 PRO 67 HB2 PRO 67 3.816 -14.854 0.217 512 HB3 PRO 67 HB1 PRO 67 3.482 -16.521 -0.291 513 HG2 PRO 67 HG2 PRO 67 2.278 -13.977 -1.250 514 HG3 PRO 67 HG1 PRO 67 2.700 -15.441 -2.153 515 HD2 PRO 67 HD2 PRO 67 0.159 -14.804 -1.387 516 HD3 PRO 67 HD1 PRO 67 0.720 -16.464 -1.669 517 H SER 68 HN SER 68 2.797 -13.318 0.535 518 HA SER 68 HA SER 68 2.722 -11.235 1.655 519 HB2 SER 68 HB2 SER 68 0.708 -10.872 2.685 520 HB3 SER 68 HB1 SER 68 0.337 -12.468 2.041 521 HG SER 68 HG SER 68 -0.083 -12.287 4.298 522 H TYR 69 HN TYR 69 3.997 -13.987 2.933 523 HA TYR 69 HA TYR 69 5.229 -14.550 4.864 524 HB2 TYR 69 HB2 TYR 69 6.617 -12.155 5.270 525 HB3 TYR 69 HB1 TYR 69 7.095 -13.472 4.206 526 HD1 TYR 69 HD1 TYR 69 5.431 -10.202 4.420 527 HD2 TYR 69 HD2 TYR 69 6.836 -13.280 1.789 528 HE1 TYR 69 HE1 TYR 69 5.178 -8.663 2.509 529 HE2 TYR 69 HE2 TYR 69 6.574 -11.742 -0.142 530 HH TYR 69 HH TYR 69 6.422 -9.427 -0.642 531 HA PRO 70 HA PRO 70 3.734 -12.974 8.660 532 HB2 PRO 70 HB2 PRO 70 5.924 -12.697 10.262 533 HB3 PRO 70 HB1 PRO 70 5.274 -14.274 9.777 534 HG2 PRO 70 HG2 PRO 70 7.633 -12.804 8.742 535 HG3 PRO 70 HG1 PRO 70 7.393 -14.543 8.962 536 HD2 PRO 70 HD2 PRO 70 7.220 -13.235 6.551 537 HD3 PRO 70 HD1 PRO 70 6.451 -14.793 6.906 538 H VAL 71 HN VAL 71 5.443 -10.940 6.690 539 HA VAL 71 HA VAL 71 5.675 -8.688 8.579 540 HB VAL 71 HB VAL 71 6.224 -9.211 5.679 541 HG11 VAL 71 HG11 VAL 71 6.701 -6.582 7.098 542 HG12 VAL 71 HG12 VAL 71 5.337 -6.865 6.017 543 HG13 VAL 71 HG13 VAL 71 6.985 -6.935 5.394 544 HG21 VAL 71 HG21 VAL 71 7.820 -10.036 7.372 545 HG22 VAL 71 HG22 VAL 71 7.994 -8.391 7.983 546 HG23 VAL 71 HG23 VAL 71 8.535 -8.788 6.351 547 H ALA 72 HN ALA 72 4.146 -9.131 5.415 548 HA ALA 72 HA ALA 72 2.320 -6.979 5.477 549 HB1 ALA 72 HB1 ALA 72 3.059 -8.653 3.649 550 HB2 ALA 72 HB2 ALA 72 1.385 -8.106 3.629 551 HB3 ALA 72 HB3 ALA 72 1.786 -9.693 4.286 552 H ASP 73 HN ASP 73 1.842 -10.404 6.370 553 HA ASP 73 HA ASP 73 -0.864 -10.174 7.151 554 HB2 ASP 73 HB2 ASP 73 1.445 -11.969 7.616 555 HB3 ASP 73 HB1 ASP 73 0.091 -12.158 8.719 556 H ILE 74 HN ILE 74 2.098 -10.061 9.161 557 HA ILE 74 HA ILE 74 0.844 -9.476 11.659 558 HB ILE 74 HB ILE 74 3.528 -9.037 10.393 559 HG12 ILE 74 HG12 ILE 74 4.205 -10.291 12.507 560 HG13 ILE 74 HG11 ILE 74 2.491 -10.412 12.895 561 HG21 ILE 74 HG21 ILE 74 3.737 -7.068 11.538 562 HG22 ILE 74 HG22 ILE 74 4.048 -8.146 12.898 563 HG23 ILE 74 HG23 ILE 74 2.438 -7.466 12.663 564 HD11 ILE 74 HD11 ILE 74 2.419 -12.282 11.636 565 HD12 ILE 74 HD12 ILE 74 4.066 -12.014 11.065 566 HD13 ILE 74 HD13 ILE 74 2.712 -11.275 10.223 567 H LEU 75 HN LEU 75 1.999 -7.430 9.030 568 HA LEU 75 HA LEU 75 1.493 -4.865 10.045 569 HB2 LEU 75 HB2 LEU 75 2.426 -5.854 7.789 570 HB3 LEU 75 HB1 LEU 75 0.758 -5.722 7.244 571 HG LEU 75 HG LEU 75 0.745 -3.329 7.769 572 HD11 LEU 75 HD11 LEU 75 2.158 -3.159 9.678 573 HD12 LEU 75 HD12 LEU 75 3.052 -2.339 8.401 574 HD13 LEU 75 HD13 LEU 75 3.491 -3.981 8.867 575 HD21 LEU 75 HD21 LEU 75 3.028 -2.872 6.324 576 HD22 LEU 75 HD22 LEU 75 1.500 -3.383 5.606 577 HD23 LEU 75 HD23 LEU 75 2.746 -4.577 5.971 578 H ALA 76 HN ALA 76 -0.646 -7.435 9.139 579 HA ALA 76 HA ALA 76 -3.067 -5.800 9.059 580 HB1 ALA 76 HB1 ALA 76 -2.952 -8.795 9.221 581 HB2 ALA 76 HB2 ALA 76 -2.339 -8.000 7.773 582 HB3 ALA 76 HB3 ALA 76 -4.020 -7.778 8.257 583 H GLU 77 HN GLU 77 -1.304 -7.878 11.301 584 HA GLU 77 HA GLU 77 -3.317 -8.427 13.219 585 HB2 GLU 77 HB2 GLU 77 -0.335 -8.081 13.203 586 HB3 GLU 77 HB1 GLU 77 -1.155 -8.254 14.754 587 HG2 GLU 77 HG2 GLU 77 -2.188 -10.196 12.887 588 HG3 GLU 77 HG1 GLU 77 -0.428 -10.320 12.971 589 H ARG 78 HN ARG 78 -1.642 -5.485 12.447 590 HA ARG 78 HA ARG 78 -3.253 -4.033 14.457 591 HB2 ARG 78 HB2 ARG 78 -1.246 -2.902 15.287 592 HB3 ARG 78 HB1 ARG 78 -1.039 -4.646 15.448 593 HG2 ARG 78 HG2 ARG 78 0.075 -4.538 13.122 594 HG3 ARG 78 HG1 ARG 78 0.168 -2.798 13.390 595 HD2 ARG 78 HD2 ARG 78 2.237 -4.092 14.119 596 HD3 ARG 78 HD1 ARG 78 1.495 -3.119 15.405 597 HE ARG 78 HE ARG 78 0.839 -6.022 15.073 598 HH11 ARG 78 HH11 ARG 78 0.472 -3.307 17.001 599 HH12 ARG 78 HH12 ARG 78 0.896 -4.086 18.489 600 HH21 ARG 78 HH21 ARG 78 1.932 -7.021 16.967 601 HH22 ARG 78 HH22 ARG 78 1.728 -6.183 18.469 602 H ASN 79 HN ASN 79 -3.511 -4.218 11.640 603 HA ASN 79 HA ASN 79 -2.573 -2.727 9.711 604 HB2 ASN 79 HB2 ASN 79 -5.329 -2.161 10.847 605 HB3 ASN 79 HB1 ASN 79 -4.839 -2.000 9.160 606 HD21 ASN 79 HD21 ASN 79 -5.781 -4.295 11.645 607 HD22 ASN 79 HD22 ASN 79 -5.777 -5.667 10.646 608 H VAL 80 HN VAL 80 -1.006 -1.179 10.479 609 HA VAL 80 HA VAL 80 -1.787 1.183 12.013 610 HB VAL 80 HB VAL 80 0.513 -0.229 11.240 611 HG11 VAL 80 HG11 VAL 80 0.326 1.344 9.131 612 HG12 VAL 80 HG12 VAL 80 1.886 1.064 9.897 613 HG13 VAL 80 HG13 VAL 80 1.003 2.551 10.224 614 HG21 VAL 80 HG21 VAL 80 1.484 2.127 12.332 615 HG22 VAL 80 HG22 VAL 80 0.936 0.716 13.236 616 HG23 VAL 80 HG23 VAL 80 -0.174 2.051 12.929 617 HA PRO 81 HA PRO 81 -3.113 3.786 8.683 618 HB2 PRO 81 HB2 PRO 81 -1.242 5.792 8.358 619 HB3 PRO 81 HB1 PRO 81 -2.450 5.780 9.662 620 HG2 PRO 81 HG2 PRO 81 0.402 4.861 9.731 621 HG3 PRO 81 HG1 PRO 81 -0.473 5.878 10.891 622 HD2 PRO 81 HD2 PRO 81 -0.115 3.307 11.413 623 HD3 PRO 81 HD1 PRO 81 -1.683 4.063 11.762 624 H PHE 82 HN PHE 82 -3.048 3.053 6.604 625 HA PHE 82 HA PHE 82 -0.688 3.094 4.952 626 HB2 PHE 82 HB2 PHE 82 -0.112 0.763 5.016 627 HB3 PHE 82 HB1 PHE 82 -0.173 1.336 6.681 628 HD1 PHE 82 HD2 PHE 82 -3.493 1.410 6.156 629 HD2 PHE 82 HD1 PHE 82 -0.345 -1.515 6.150 630 HE1 PHE 82 HE2 PHE 82 -5.131 -0.346 6.710 631 HE2 PHE 82 HE1 PHE 82 -1.997 -3.274 6.707 632 HZ PHE 82 HZ PHE 82 -4.386 -2.693 6.986 633 H ILE 83 HN ILE 83 -1.490 0.454 3.763 634 HA ILE 83 HA ILE 83 -4.205 0.591 2.846 635 HB ILE 83 HB ILE 83 -2.174 2.259 1.666 636 HG12 ILE 83 HG12 ILE 83 -4.313 3.175 2.177 637 HG13 ILE 83 HG11 ILE 83 -4.232 3.127 0.418 638 HG21 ILE 83 HG21 ILE 83 -1.937 0.305 0.116 639 HG22 ILE 83 HG22 ILE 83 -2.495 1.772 -0.687 640 HG23 ILE 83 HG23 ILE 83 -3.642 0.489 -0.299 641 HD11 ILE 83 HD11 ILE 83 -5.801 1.386 2.291 642 HD12 ILE 83 HD12 ILE 83 -5.296 0.736 0.731 643 HD13 ILE 83 HD13 ILE 83 -6.318 2.169 0.801 644 H PHE 84 HN PHE 84 -4.557 -1.181 1.263 645 HA PHE 84 HA PHE 84 -2.237 -2.921 0.687 646 HB2 PHE 84 HB2 PHE 84 -3.406 -3.126 3.076 647 HB3 PHE 84 HB1 PHE 84 -4.514 -4.143 2.162 648 HD1 PHE 84 HD1 PHE 84 -3.494 -6.059 0.738 649 HD2 PHE 84 HD2 PHE 84 -1.316 -3.960 3.795 650 HE1 PHE 84 HE1 PHE 84 -1.866 -7.934 0.877 651 HE2 PHE 84 HE2 PHE 84 0.311 -5.840 3.923 652 HZ PHE 84 HZ PHE 84 0.029 -7.810 2.446 653 H ALA 85 HN ALA 85 -2.914 -4.846 -0.584 654 HA ALA 85 HA ALA 85 -5.577 -4.742 -1.829 655 HB1 ALA 85 HB1 ALA 85 -4.553 -4.426 -4.085 656 HB2 ALA 85 HB2 ALA 85 -2.971 -4.293 -3.325 657 HB3 ALA 85 HB3 ALA 85 -4.199 -3.068 -3.019 658 H THR 86 HN THR 86 -5.971 -6.727 -3.121 659 HA THR 86 HA THR 86 -4.179 -8.786 -3.732 660 HB THR 86 HB THR 86 -3.364 -8.978 -1.548 661 HG1 THR 86 HG1 THR 86 -5.293 -10.678 -0.799 662 HG21 THR 86 HG21 THR 86 -5.333 -9.111 0.322 663 HG22 THR 86 HG22 THR 86 -6.071 -8.000 -0.833 664 HG23 THR 86 HG23 THR 86 -4.508 -7.615 -0.110 665 H GLY 87 HN GLY 87 -5.487 -11.114 -2.939 666 HA2 GLY 87 HA2 GLY 87 -7.561 -11.511 -4.686 667 HA3 GLY 87 HA1 GLY 87 -7.511 -12.336 -3.125 668 H TYR 88 HN TYR 88 -8.237 -10.686 -1.243 669 HA TYR 88 HA TYR 88 -10.963 -9.846 -1.997 670 HB2 TYR 88 HB2 TYR 88 -11.055 -9.426 0.526 671 HB3 TYR 88 HB1 TYR 88 -10.727 -11.085 0.038 672 HD1 TYR 88 HD1 TYR 88 -8.711 -7.947 0.572 673 HD2 TYR 88 HD2 TYR 88 -9.096 -12.152 1.278 674 HE1 TYR 88 HE1 TYR 88 -6.596 -7.918 1.847 675 HE2 TYR 88 HE2 TYR 88 -6.978 -12.134 2.560 676 HH TYR 88 HH TYR 88 -5.043 -9.163 2.851 677 H GLY 89 HN GLY 89 -7.886 -8.367 -1.668 678 HA2 GLY 89 HA2 GLY 89 -7.435 -6.080 -2.241 679 HA3 GLY 89 HA1 GLY 89 -9.138 -5.706 -1.984 680 H SER 90 HN SER 90 -9.815 -6.237 0.435 681 HA SER 90 HA SER 90 -7.664 -5.168 2.210 682 HB2 SER 90 HB2 SER 90 -10.153 -4.067 1.468 683 HB3 SER 90 HB1 SER 90 -10.343 -4.595 3.131 684 HG SER 90 HG SER 90 -9.493 -2.471 2.988 685 H LYS 91 HN LYS 91 -7.809 -5.842 4.446 686 HA LYS 91 HA LYS 91 -9.325 -8.368 4.873 687 HB2 LYS 91 HB2 LYS 91 -7.158 -8.826 6.329 688 HB3 LYS 91 HB1 LYS 91 -7.118 -9.098 4.586 689 HG2 LYS 91 HG2 LYS 91 -5.861 -7.185 4.177 690 HG3 LYS 91 HG1 LYS 91 -6.452 -6.362 5.619 691 HD2 LYS 91 HD2 LYS 91 -5.176 -8.228 6.914 692 HD3 LYS 91 HD1 LYS 91 -4.314 -8.466 5.394 693 HE2 LYS 91 HE2 LYS 91 -4.390 -5.980 7.126 694 HE3 LYS 91 HE1 LYS 91 -2.977 -6.859 6.513 695 HZ1 LYS 91 HZ1 LYS 91 -3.131 -5.154 4.998 696 HZ2 LYS 91 HZ2 LYS 91 -4.828 -5.094 5.059 697 HZ3 LYS 91 HZ3 LYS 91 -4.046 -6.350 4.221 698 H GLY 92 HN GLY 92 -10.808 -6.548 5.865 699 HA2 GLY 92 HA2 GLY 92 -11.638 -5.463 7.780 700 HA3 GLY 92 HA1 GLY 92 -10.758 -6.699 8.686 701 H LEU 93 HN LEU 93 -8.905 -4.756 6.544 702 HA LEU 93 HA LEU 93 -7.082 -3.872 8.481 703 HB2 LEU 93 HB2 LEU 93 -6.216 -2.499 6.706 704 HB3 LEU 93 HB1 LEU 93 -6.831 -3.977 5.985 705 HG LEU 93 HG LEU 93 -7.591 -2.279 4.549 706 HD11 LEU 93 HD11 LEU 93 -9.449 -3.746 5.079 707 HD12 LEU 93 HD12 LEU 93 -10.050 -2.100 4.898 708 HD13 LEU 93 HD13 LEU 93 -9.851 -2.791 6.502 709 HD21 LEU 93 HD21 LEU 93 -7.619 -0.141 5.200 710 HD22 LEU 93 HD22 LEU 93 -7.376 -0.655 6.870 711 HD23 LEU 93 HD23 LEU 93 -9.010 -0.458 6.236 712 H ASP 94 HN ASP 94 -7.216 -2.404 10.070 713 HA ASP 94 HA ASP 94 -9.413 -0.372 9.983 714 HB2 ASP 94 HB2 ASP 94 -9.067 -0.327 12.426 715 HB3 ASP 94 HB1 ASP 94 -9.288 -1.992 11.888 716 H THR 95 HN THR 95 -8.825 1.816 9.938 717 HA THR 95 HA THR 95 -6.264 2.818 10.800 718 HB THR 95 HB THR 95 -5.426 1.491 8.982 719 HG1 THR 95 HG1 THR 95 -4.539 3.063 7.718 720 HG21 THR 95 HG21 THR 95 -6.367 1.932 6.640 721 HG22 THR 95 HG22 THR 95 -7.732 2.685 7.463 722 HG23 THR 95 HG23 THR 95 -7.370 0.983 7.737 723 H ARG 96 HN ARG 96 -5.850 4.944 9.201 724 HA ARG 96 HA ARG 96 -8.237 6.604 9.633 725 HB2 ARG 96 HB2 ARG 96 -5.602 7.338 8.324 726 HB3 ARG 96 HB1 ARG 96 -6.706 8.400 9.199 727 HG2 ARG 96 HG2 ARG 96 -5.133 6.114 10.431 728 HG3 ARG 96 HG1 ARG 96 -4.739 7.825 10.581 729 HD2 ARG 96 HD2 ARG 96 -6.829 8.261 11.756 730 HD3 ARG 96 HD1 ARG 96 -7.353 6.583 11.510 731 HE ARG 96 HE ARG 96 -5.291 7.480 13.407 732 HH11 ARG 96 HH11 ARG 96 -7.445 5.323 13.778 733 HH12 ARG 96 HH12 ARG 96 -6.467 3.895 13.809 734 HH21 ARG 96 HH21 ARG 96 -3.668 5.462 12.502 735 HH22 ARG 96 HH22 ARG 96 -4.331 3.974 13.091 736 H TYR 97 HN TYR 97 -7.353 4.489 7.239 737 HA TYR 97 HA TYR 97 -7.976 6.178 4.906 738 HB2 TYR 97 HB2 TYR 97 -7.375 3.263 5.412 739 HB3 TYR 97 HB1 TYR 97 -7.830 3.845 3.810 740 HD1 TYR 97 HD1 TYR 97 -5.465 4.572 6.617 741 HD2 TYR 97 HD2 TYR 97 -6.199 4.742 2.391 742 HE1 TYR 97 HE1 TYR 97 -3.152 5.391 6.252 743 HE2 TYR 97 HE2 TYR 97 -3.886 5.558 2.021 744 HH TYR 97 HH TYR 97 -1.476 5.367 4.317 745 H SER 98 HN SER 98 -9.972 5.191 7.247 746 HA SER 98 HA SER 98 -12.300 4.840 7.337 747 HB2 SER 98 HB2 SER 98 -11.673 6.094 4.737 748 HB3 SER 98 HB1 SER 98 -13.230 5.264 4.795 749 HG SER 98 HG SER 98 -13.512 6.454 6.849 750 H ASN 99 HN ASN 99 -10.207 2.792 6.037 751 HA ASN 99 HA ASN 99 -10.317 0.552 5.331 752 HB2 ASN 99 HB2 ASN 99 -12.953 1.110 6.679 753 HB3 ASN 99 HB1 ASN 99 -12.492 -0.519 6.167 754 HD21 ASN 99 HD21 ASN 99 -9.696 1.255 6.938 755 HD22 ASN 99 HD22 ASN 99 -9.492 0.719 8.525 756 H ILE 100 HN ILE 100 -11.342 2.721 3.418 757 HA ILE 100 HA ILE 100 -13.098 0.920 1.787 758 HB ILE 100 HB ILE 100 -14.101 2.841 0.831 759 HG12 ILE 100 HG12 ILE 100 -11.735 4.054 0.841 760 HG13 ILE 100 HG11 ILE 100 -13.232 4.973 0.784 761 HG21 ILE 100 HG21 ILE 100 -15.147 3.814 2.712 762 HG22 ILE 100 HG22 ILE 100 -13.715 3.619 3.720 763 HG23 ILE 100 HG23 ILE 100 -14.652 2.208 3.242 764 HD11 ILE 100 HD11 ILE 100 -12.272 4.308 3.497 765 HD12 ILE 100 HD12 ILE 100 -12.944 5.814 2.876 766 HD13 ILE 100 HD13 ILE 100 -11.250 5.420 2.586 767 HA PRO 101 HA PRO 101 -9.862 2.593 -1.277 768 HB2 PRO 101 HB2 PRO 101 -7.366 3.139 -0.328 769 HB3 PRO 101 HB1 PRO 101 -8.644 4.361 -0.434 770 HG2 PRO 101 HG2 PRO 101 -7.609 2.920 1.927 771 HG3 PRO 101 HG1 PRO 101 -8.286 4.549 1.795 772 HD2 PRO 101 HD2 PRO 101 -9.618 2.301 2.765 773 HD3 PRO 101 HD1 PRO 101 -10.368 3.821 2.258 774 H LEU 102 HN LEU 102 -10.391 0.103 -0.912 775 HA LEU 102 HA LEU 102 -7.777 -1.362 -0.694 776 HB2 LEU 102 HB2 LEU 102 -8.936 -3.156 0.325 777 HB3 LEU 102 HB1 LEU 102 -9.646 -1.722 1.048 778 HG LEU 102 HG LEU 102 -11.438 -3.240 0.515 779 HD11 LEU 102 HD11 LEU 102 -11.473 -1.211 -1.713 780 HD12 LEU 102 HD12 LEU 102 -11.769 -0.802 -0.026 781 HD13 LEU 102 HD13 LEU 102 -12.846 -1.917 -0.865 782 HD21 LEU 102 HD21 LEU 102 -11.219 -3.347 -2.372 783 HD22 LEU 102 HD22 LEU 102 -11.384 -4.668 -1.215 784 HD23 LEU 102 HD23 LEU 102 -9.788 -4.029 -1.603 785 H LEU 103 HN LEU 103 -7.323 -3.021 -2.238 786 HA LEU 103 HA LEU 103 -9.273 -3.654 -4.334 787 HB2 LEU 103 HB2 LEU 103 -7.449 -2.508 -6.019 788 HB3 LEU 103 HB1 LEU 103 -8.911 -1.700 -5.459 789 HG LEU 103 HG LEU 103 -7.687 -0.601 -3.669 790 HD11 LEU 103 HD11 LEU 103 -6.004 -1.862 -2.819 791 HD12 LEU 103 HD12 LEU 103 -5.021 -1.060 -4.043 792 HD13 LEU 103 HD13 LEU 103 -5.694 -2.659 -4.362 793 HD21 LEU 103 HD21 LEU 103 -7.292 0.896 -5.328 794 HD22 LEU 103 HD22 LEU 103 -6.874 -0.371 -6.479 795 HD23 LEU 103 HD23 LEU 103 -5.659 0.233 -5.358 796 H THR 104 HN THR 104 -8.004 -4.826 -6.262 797 HA THR 104 HA THR 104 -5.791 -6.412 -5.034 798 HB THR 104 HB THR 104 -7.996 -7.595 -5.321 799 HG1 THR 104 HG1 THR 104 -7.028 -9.380 -6.096 800 HG21 THR 104 HG21 THR 104 -8.898 -7.990 -7.487 801 HG22 THR 104 HG22 THR 104 -7.452 -7.371 -8.283 802 HG23 THR 104 HG23 THR 104 -8.538 -6.265 -7.441 803 H LYS 105 HN LYS 105 -5.820 -3.973 -6.873 804 HA LYS 105 HA LYS 105 -4.537 -3.229 -8.703 805 HB2 LYS 105 HB2 LYS 105 -3.287 -5.633 -7.565 806 HB3 LYS 105 HB1 LYS 105 -2.803 -5.306 -9.229 807 HG2 LYS 105 HG2 LYS 105 -1.474 -3.629 -8.541 808 HG3 LYS 105 HG1 LYS 105 -2.853 -2.827 -7.789 809 HD2 LYS 105 HD2 LYS 105 -2.058 -3.343 -5.752 810 HD3 LYS 105 HD1 LYS 105 -2.129 -5.055 -6.153 811 HE2 LYS 105 HE2 LYS 105 0.172 -3.279 -7.016 812 HE3 LYS 105 HE1 LYS 105 0.187 -4.215 -5.508 813 HZ1 LYS 105 HZ1 LYS 105 0.107 -6.204 -6.623 814 HZ2 LYS 105 HZ2 LYS 105 1.043 -5.290 -7.708 815 HZ3 LYS 105 HZ3 LYS 105 -0.610 -5.540 -8.009 816 HA PRO 106 HA PRO 106 -6.794 -6.330 -11.514 817 HB2 PRO 106 HB2 PRO 106 -9.266 -5.168 -11.678 818 HB3 PRO 106 HB1 PRO 106 -8.873 -6.420 -10.484 819 HG2 PRO 106 HG2 PRO 106 -9.079 -3.476 -10.140 820 HG3 PRO 106 HG1 PRO 106 -9.526 -4.780 -9.030 821 HD2 PRO 106 HD2 PRO 106 -7.225 -3.294 -8.817 822 HD3 PRO 106 HD1 PRO 106 -7.435 -4.926 -8.157 823 H PHE 107 HN PHE 107 -6.192 -3.003 -11.154 824 HA PHE 107 HA PHE 107 -5.735 -1.284 -12.688 825 HB2 PHE 107 HB2 PHE 107 -5.503 -3.830 -14.285 826 HB3 PHE 107 HB1 PHE 107 -5.254 -2.268 -15.060 827 HD1 PHE 107 HD2 PHE 107 -4.382 -3.495 -11.626 828 HD2 PHE 107 HD1 PHE 107 -2.936 -1.983 -15.374 829 HE1 PHE 107 HE2 PHE 107 -2.093 -3.414 -10.699 830 HE2 PHE 107 HE1 PHE 107 -0.638 -1.897 -14.443 831 HZ PHE 107 HZ PHE 107 -0.216 -2.612 -12.106 832 H LEU 108 HN LEU 108 -8.517 -1.978 -12.116 833 HA LEU 108 HA LEU 108 -9.819 -1.148 -14.695 834 HB2 LEU 108 HB2 LEU 108 -10.359 -3.211 -12.653 835 HB3 LEU 108 HB1 LEU 108 -11.776 -2.267 -13.112 836 HG LEU 108 HG LEU 108 -11.302 -2.757 -15.499 837 HD11 LEU 108 HD11 LEU 108 -8.843 -3.089 -15.200 838 HD12 LEU 108 HD12 LEU 108 -9.605 -4.414 -16.078 839 HD13 LEU 108 HD13 LEU 108 -9.181 -4.610 -14.378 840 HD21 LEU 108 HD21 LEU 108 -11.600 -5.373 -15.163 841 HD22 LEU 108 HD22 LEU 108 -12.872 -4.256 -14.668 842 HD23 LEU 108 HD23 LEU 108 -11.759 -4.913 -13.468 843 H ASP 109 HN ASP 109 -11.114 -1.351 -11.428 844 HA ASP 109 HA ASP 109 -11.498 1.625 -11.378 845 HB2 ASP 109 HB2 ASP 109 -13.432 -0.219 -11.728 846 HB3 ASP 109 HB1 ASP 109 -13.357 -0.234 -9.966 847 H SER 110 HN SER 110 -9.677 -0.669 -10.097 848 HA SER 110 HA SER 110 -10.098 -0.439 -7.231 849 HB2 SER 110 HB2 SER 110 -8.540 -1.855 -9.206 850 HB3 SER 110 HB1 SER 110 -7.524 -1.368 -7.857 851 HG SER 110 HG SER 110 -10.018 -2.718 -7.662 852 H GLU 111 HN GLU 111 -7.033 0.222 -8.880 853 HA GLU 111 HA GLU 111 -5.703 1.760 -7.091 854 HB2 GLU 111 HB2 GLU 111 -5.868 1.553 -10.001 855 HB3 GLU 111 HB1 GLU 111 -5.288 3.135 -9.477 856 HG2 GLU 111 HG2 GLU 111 -3.273 2.245 -9.023 857 HG3 GLU 111 HG1 GLU 111 -4.022 1.166 -7.845 858 H LEU 112 HN LEU 112 -7.993 3.199 -9.430 859 HA LEU 112 HA LEU 112 -7.876 5.863 -8.665 860 HB2 LEU 112 HB2 LEU 112 -10.486 5.692 -9.131 861 HB3 LEU 112 HB1 LEU 112 -9.319 5.439 -10.425 862 HG LEU 112 HG LEU 112 -9.891 2.998 -8.915 863 HD11 LEU 112 HD11 LEU 112 -12.135 3.272 -8.771 864 HD12 LEU 112 HD12 LEU 112 -12.148 3.117 -10.526 865 HD13 LEU 112 HD13 LEU 112 -12.099 4.714 -9.785 866 HD21 LEU 112 HD21 LEU 112 -10.488 3.327 -11.811 867 HD22 LEU 112 HD22 LEU 112 -9.589 2.054 -10.984 868 HD23 LEU 112 HD23 LEU 112 -8.819 3.607 -11.312 869 H GLU 113 HN GLU 113 -10.267 3.576 -7.230 870 HA GLU 113 HA GLU 113 -11.359 5.078 -5.215 871 HB2 GLU 113 HB2 GLU 113 -11.299 2.448 -5.845 872 HB3 GLU 113 HB1 GLU 113 -10.306 2.415 -4.384 873 HG2 GLU 113 HG2 GLU 113 -12.039 3.283 -3.040 874 HG3 GLU 113 HG1 GLU 113 -12.943 3.877 -4.433 875 H ALA 114 HN ALA 114 -8.283 3.284 -4.831 876 HA ALA 114 HA ALA 114 -7.510 3.977 -2.281 877 HB1 ALA 114 HB1 ALA 114 -5.227 4.359 -3.870 878 HB2 ALA 114 HB2 ALA 114 -6.269 3.296 -4.818 879 HB3 ALA 114 HB3 ALA 114 -5.786 2.834 -3.185 880 H VAL 115 HN VAL 115 -7.210 6.065 -5.168 881 HA VAL 115 HA VAL 115 -6.321 8.305 -3.397 882 HB VAL 115 HB VAL 115 -6.315 7.862 -6.396 883 HG11 VAL 115 HG11 VAL 115 -4.606 9.902 -6.022 884 HG12 VAL 115 HG12 VAL 115 -5.725 10.237 -4.701 885 HG13 VAL 115 HG13 VAL 115 -6.318 10.159 -6.360 886 HG21 VAL 115 HG21 VAL 115 -4.543 6.577 -5.729 887 HG22 VAL 115 HG22 VAL 115 -4.409 7.393 -4.171 888 HG23 VAL 115 HG23 VAL 115 -3.727 8.136 -5.618 889 H LEU 116 HN LEU 116 -8.958 7.321 -5.506 890 HA LEU 116 HA LEU 116 -10.212 9.872 -5.895 891 HB2 LEU 116 HB2 LEU 116 -10.568 7.175 -6.564 892 HB3 LEU 116 HB1 LEU 116 -12.016 7.599 -5.654 893 HG LEU 116 HG LEU 116 -12.532 8.146 -7.890 894 HD11 LEU 116 HD11 LEU 116 -11.660 10.879 -7.387 895 HD12 LEU 116 HD12 LEU 116 -12.354 10.140 -5.944 896 HD13 LEU 116 HD13 LEU 116 -13.295 10.221 -7.433 897 HD21 LEU 116 HD21 LEU 116 -9.921 8.122 -8.405 898 HD22 LEU 116 HD22 LEU 116 -10.115 9.869 -8.266 899 HD23 LEU 116 HD23 LEU 116 -11.044 8.971 -9.467 900 H VAL 117 HN VAL 117 -10.342 7.527 -3.289 901 HA VAL 117 HA VAL 117 -12.647 8.650 -1.936 902 HB VAL 117 HB VAL 117 -11.834 6.305 -1.822 903 HG11 VAL 117 HG11 VAL 117 -9.749 5.740 -1.074 904 HG12 VAL 117 HG12 VAL 117 -9.720 7.029 0.129 905 HG13 VAL 117 HG13 VAL 117 -9.358 7.389 -1.559 906 HG21 VAL 117 HG21 VAL 117 -11.689 6.378 0.863 907 HG22 VAL 117 HG22 VAL 117 -13.201 6.638 -0.008 908 HG23 VAL 117 HG23 VAL 117 -12.272 8.016 0.574 909 H GLN 118 HN GLN 118 -9.356 9.695 -2.090 910 HA GLN 118 HA GLN 118 -9.682 11.110 0.529 911 HB2 GLN 118 HB2 GLN 118 -7.372 9.980 -1.004 912 HB3 GLN 118 HB1 GLN 118 -7.091 11.282 0.157 913 HG2 GLN 118 HG2 GLN 118 -8.522 8.683 0.750 914 HG3 GLN 118 HG1 GLN 118 -6.874 9.078 1.240 915 HE21 GLN 118 HE21 GLN 118 -10.251 9.560 1.983 916 HE22 GLN 118 HE22 GLN 118 -10.020 10.536 3.352 917 H ILE 119 HN ILE 119 -10.832 12.147 -1.936 918 HA ILE 119 HA ILE 119 -9.128 14.590 -2.291 919 HB ILE 119 HB ILE 119 -10.788 14.700 -4.403 920 HG12 ILE 119 HG12 ILE 119 -11.088 12.376 -5.296 921 HG13 ILE 119 HG11 ILE 119 -10.584 11.755 -3.725 922 HG21 ILE 119 HG21 ILE 119 -9.018 13.780 -5.729 923 HG22 ILE 119 HG22 ILE 119 -8.442 12.789 -4.388 924 HG23 ILE 119 HG23 ILE 119 -8.257 14.542 -4.332 925 HD11 ILE 119 HD11 ILE 119 -12.682 13.799 -3.541 926 HD12 ILE 119 HD12 ILE 119 -12.596 12.209 -2.782 927 HD13 ILE 119 HD13 ILE 119 -13.186 12.366 -4.437 928 H SER 120 HN SER 120 -11.298 13.704 -0.291 929 HA SER 120 HA SER 120 -12.614 16.276 -0.043 930 HB2 SER 120 HB2 SER 120 -14.917 14.877 -0.432 931 HB3 SER 120 HB1 SER 120 -14.125 15.808 -1.700 932 HG SER 120 HG SER 120 -14.650 13.319 -1.824 933 H LYS 121 HN LYS 121 -14.381 13.312 0.570 934 HA LYS 121 HA LYS 121 -14.819 12.144 2.579 935 HB2 LYS 121 HB2 LYS 121 -12.144 13.066 2.719 936 HB3 LYS 121 HB1 LYS 121 -12.875 13.451 4.279 937 HG2 LYS 121 HG2 LYS 121 -13.657 10.803 3.348 938 HG3 LYS 121 HG1 LYS 121 -11.906 10.954 3.486 939 HD2 LYS 121 HD2 LYS 121 -12.739 12.199 5.780 940 HD3 LYS 121 HD1 LYS 121 -13.962 10.940 5.601 941 HE2 LYS 121 HE2 LYS 121 -12.463 9.250 5.997 942 HE3 LYS 121 HE1 LYS 121 -11.155 10.080 5.129 943 HZ1 LYS 121 HZ1 LYS 121 -10.818 11.549 6.925 944 HZ2 LYS 121 HZ2 LYS 121 -10.919 10.003 7.624 945 HZ3 LYS 121 HZ3 LYS 121 -12.244 11.063 7.705 946 H GLU 122 HN GLU 122 -16.782 12.993 3.196 947 HA GLU 122 HA GLU 122 -18.352 14.408 4.214 948 HB2 GLU 122 HB2 GLU 122 -17.818 14.818 6.452 949 HB3 GLU 122 HB1 GLU 122 -16.669 13.552 6.042 950 HG2 GLU 122 HG2 GLU 122 -14.914 14.915 6.426 951 HG3 GLU 122 HG1 GLU 122 -15.594 16.201 5.438 952 H VAL 123 HN VAL 123 -16.387 15.473 2.151 953 HA VAL 123 HA VAL 123 -15.595 17.571 1.361 954 HB VAL 123 HB VAL 123 -17.745 18.969 1.039 955 HG11 VAL 123 HG11 VAL 123 -17.127 16.211 0.115 956 HG12 VAL 123 HG12 VAL 123 -17.349 17.688 -0.822 957 HG13 VAL 123 HG13 VAL 123 -18.753 16.801 -0.227 958 HG21 VAL 123 HG21 VAL 123 -19.825 17.821 1.635 959 HG22 VAL 123 HG22 VAL 123 -18.860 18.077 3.088 960 HG23 VAL 123 HG23 VAL 123 -18.912 16.483 2.335 Start of MODEL 26 1 H1 GLY 1 HT1 GLY 1 12.513 20.412 7.066 2 H2 GLY 1 HT2 GLY 1 13.680 19.299 7.598 3 H3 GLY 1 HT3 GLY 1 14.067 20.427 6.387 4 HA2 GLY 1 HA2 GLY 1 15.019 21.078 8.513 5 HA3 GLY 1 HA1 GLY 1 13.823 22.245 7.950 6 H SER 2 HN SER 2 11.595 22.005 8.840 7 HA SER 2 HA SER 2 11.585 21.796 11.687 8 HB2 SER 2 HB2 SER 2 10.017 23.027 10.071 9 HB3 SER 2 HB1 SER 2 9.218 21.477 9.829 10 HG SER 2 HG SER 2 8.389 21.600 11.773 11 H HIS 3 HN HIS 3 10.082 20.231 12.883 12 HA HIS 3 HA HIS 3 10.751 17.462 12.082 13 HB2 HIS 3 HB2 HIS 3 10.650 18.891 14.444 14 HB3 HIS 3 HB1 HIS 3 9.154 17.963 14.511 15 HD1 HIS 3 HD1 HIS 3 10.647 15.620 12.703 16 HD2 HIS 3 HD2 HIS 3 11.731 17.089 16.451 17 HE1 HIS 3 HE1 HIS 3 12.062 13.825 13.794 18 H MET 4 HN MET 4 8.316 16.555 13.666 19 HA MET 4 HA MET 4 6.022 16.065 13.315 20 HB2 MET 4 HB2 MET 4 6.296 18.633 12.543 21 HB3 MET 4 HB1 MET 4 5.870 17.916 10.989 22 HG2 MET 4 HG2 MET 4 3.776 18.456 11.925 23 HG3 MET 4 HG1 MET 4 3.959 16.742 12.301 24 HE1 MET 4 HE1 MET 4 2.374 19.416 13.465 25 HE2 MET 4 HE2 MET 4 2.263 19.121 15.198 26 HE3 MET 4 HE3 MET 4 1.845 17.839 14.066 27 H THR 5 HN THR 5 7.406 16.803 10.074 28 HA THR 5 HA THR 5 6.680 13.998 9.282 29 HB THR 5 HB THR 5 6.131 14.978 7.078 30 HG1 THR 5 HG1 THR 5 7.283 16.747 6.814 31 HG21 THR 5 HG21 THR 5 4.103 15.098 8.061 32 HG22 THR 5 HG22 THR 5 4.439 16.811 8.307 33 HG23 THR 5 HG23 THR 5 4.794 15.650 9.586 34 H GLU 6 HN GLU 6 8.118 13.069 7.614 35 HA GLU 6 HA GLU 6 10.575 14.508 6.901 36 HB2 GLU 6 HB2 GLU 6 12.048 13.019 8.178 37 HB3 GLU 6 HB1 GLU 6 10.902 13.800 9.268 38 HG2 GLU 6 HG2 GLU 6 9.424 11.699 8.864 39 HG3 GLU 6 HG1 GLU 6 10.909 10.955 8.271 40 H ARG 7 HN ARG 7 8.988 13.590 4.999 41 HA ARG 7 HA ARG 7 8.848 12.126 3.147 42 HB2 ARG 7 HB2 ARG 7 11.610 11.594 4.265 43 HB3 ARG 7 HB1 ARG 7 11.060 10.979 2.705 44 HG2 ARG 7 HG2 ARG 7 11.074 13.057 1.723 45 HG3 ARG 7 HG1 ARG 7 10.656 13.884 3.225 46 HD2 ARG 7 HD2 ARG 7 13.185 12.735 3.705 47 HD3 ARG 7 HD1 ARG 7 13.281 13.442 2.079 48 HE ARG 7 HE ARG 7 13.172 14.972 4.470 49 HH11 ARG 7 HH11 ARG 7 12.125 14.845 1.206 50 HH12 ARG 7 HH12 ARG 7 11.481 16.453 1.205 51 HH21 ARG 7 HH21 ARG 7 12.121 17.005 4.565 52 HH22 ARG 7 HH22 ARG 7 11.481 17.675 3.102 53 H ARG 8 HN ARG 8 7.871 11.123 5.811 54 HA ARG 8 HA ARG 8 8.536 8.224 5.638 55 HB2 ARG 8 HB2 ARG 8 8.056 10.128 7.688 56 HB3 ARG 8 HB1 ARG 8 6.774 8.919 7.786 57 HG2 ARG 8 HG2 ARG 8 8.653 8.163 9.129 58 HG3 ARG 8 HG1 ARG 8 8.529 7.131 7.704 59 HD2 ARG 8 HD2 ARG 8 10.176 9.058 6.729 60 HD3 ARG 8 HD1 ARG 8 10.649 9.075 8.440 61 HE ARG 8 HE ARG 8 10.558 6.403 7.954 62 HH11 ARG 8 HH21 ARG 8 13.229 7.584 8.151 63 HH12 ARG 8 HH22 ARG 8 13.917 7.289 6.589 64 HH21 ARG 8 HH11 ARG 8 10.859 6.628 5.080 65 HH22 ARG 8 HH12 ARG 8 12.570 6.753 4.843 66 H LEU 9 HN LEU 9 5.695 10.387 5.411 67 HA LEU 9 HA LEU 9 3.812 8.166 5.320 68 HB2 LEU 9 HB2 LEU 9 3.799 11.130 5.276 69 HB3 LEU 9 HB1 LEU 9 2.381 10.323 4.605 70 HG LEU 9 HG LEU 9 2.557 8.865 6.802 71 HD11 LEU 9 HD11 LEU 9 3.341 11.237 8.270 72 HD12 LEU 9 HD12 LEU 9 4.642 10.720 7.198 73 HD13 LEU 9 HD13 LEU 9 3.981 9.598 8.387 74 HD21 LEU 9 HD21 LEU 9 1.573 11.732 6.944 75 HD22 LEU 9 HD22 LEU 9 0.947 10.345 7.837 76 HD23 LEU 9 HD23 LEU 9 0.717 10.448 6.091 77 H ARG 10 HN ARG 10 4.113 6.889 3.427 78 HA ARG 10 HA ARG 10 3.056 8.090 0.959 79 HB2 ARG 10 HB2 ARG 10 5.491 8.613 1.019 80 HB3 ARG 10 HB1 ARG 10 5.832 6.894 1.055 81 HG2 ARG 10 HG2 ARG 10 5.554 6.710 -1.169 82 HG3 ARG 10 HG1 ARG 10 3.987 7.490 -1.095 83 HD2 ARG 10 HD2 ARG 10 4.850 9.341 -2.035 84 HD3 ARG 10 HD1 ARG 10 6.040 9.467 -0.748 85 HE ARG 10 HE ARG 10 6.588 7.462 -2.828 86 HH11 ARG 10 HH21 ARG 10 6.717 10.809 -2.235 87 HH12 ARG 10 HH22 ARG 10 8.348 11.004 -2.786 88 HH21 ARG 10 HH11 ARG 10 8.867 7.616 -3.293 89 HH22 ARG 10 HH12 ARG 10 9.558 9.201 -3.389 90 H VAL 11 HN VAL 11 2.760 6.327 -0.730 91 HA VAL 11 HA VAL 11 1.676 3.957 0.522 92 HB VAL 11 HB VAL 11 0.990 3.497 -1.786 93 HG11 VAL 11 HG11 VAL 11 -0.022 5.425 -0.414 94 HG12 VAL 11 HG12 VAL 11 -0.280 5.481 -2.158 95 HG13 VAL 11 HG13 VAL 11 0.955 6.499 -1.416 96 HG21 VAL 11 HG21 VAL 11 2.703 3.909 -3.261 97 HG22 VAL 11 HG22 VAL 11 3.316 5.270 -2.322 98 HG23 VAL 11 HG23 VAL 11 1.924 5.488 -3.384 99 H LEU 12 HN LEU 12 3.413 2.645 1.407 100 HA LEU 12 HA LEU 12 5.706 1.917 -0.274 101 HB2 LEU 12 HB2 LEU 12 4.547 1.097 2.401 102 HB3 LEU 12 HB1 LEU 12 5.936 0.264 1.710 103 HG LEU 12 HG LEU 12 6.587 2.101 3.273 104 HD11 LEU 12 HD11 LEU 12 8.306 3.011 1.842 105 HD12 LEU 12 HD12 LEU 12 7.344 2.692 0.398 106 HD13 LEU 12 HD13 LEU 12 8.009 1.349 1.329 107 HD21 LEU 12 HD21 LEU 12 5.515 3.955 1.129 108 HD22 LEU 12 HD22 LEU 12 6.167 4.396 2.708 109 HD23 LEU 12 HD23 LEU 12 4.616 3.563 2.597 110 H VAL 13 HN VAL 13 4.513 1.063 -2.135 111 HA VAL 13 HA VAL 13 2.865 -1.371 -1.648 112 HB VAL 13 HB VAL 13 3.363 0.191 -4.202 113 HG11 VAL 13 HG11 VAL 13 1.792 -1.147 -5.154 114 HG12 VAL 13 HG12 VAL 13 0.782 -1.142 -3.711 115 HG13 VAL 13 HG13 VAL 13 2.152 -2.247 -3.823 116 HG21 VAL 13 HG21 VAL 13 0.900 0.516 -2.521 117 HG22 VAL 13 HG22 VAL 13 1.621 1.642 -3.669 118 HG23 VAL 13 HG23 VAL 13 2.350 1.416 -2.080 119 H VAL 14 HN VAL 14 3.490 -3.382 -2.513 120 HA VAL 14 HA VAL 14 5.992 -3.464 -4.095 121 HB VAL 14 HB VAL 14 7.059 -4.861 -2.459 122 HG11 VAL 14 HG11 VAL 14 5.699 -2.631 -0.939 123 HG12 VAL 14 HG12 VAL 14 7.002 -2.359 -2.094 124 HG13 VAL 14 HG13 VAL 14 7.298 -3.311 -0.641 125 HG21 VAL 14 HG21 VAL 14 5.088 -6.146 -1.756 126 HG22 VAL 14 HG22 VAL 14 4.417 -4.711 -0.980 127 HG23 VAL 14 HG23 VAL 14 5.885 -5.454 -0.342 128 H GLU 15 HN GLU 15 5.864 -4.962 -5.629 129 HA GLU 15 HA GLU 15 4.469 -7.516 -5.244 130 HB2 GLU 15 HB2 GLU 15 2.823 -7.130 -6.940 131 HB3 GLU 15 HB1 GLU 15 2.767 -5.729 -5.870 132 HG2 GLU 15 HG2 GLU 15 2.946 -4.535 -7.794 133 HG3 GLU 15 HG1 GLU 15 4.657 -4.943 -7.686 134 H ASP 16 HN ASP 16 5.753 -8.983 -6.211 135 HA ASP 16 HA ASP 16 8.079 -9.083 -7.344 136 HB2 ASP 16 HB2 ASP 16 7.134 -10.728 -9.087 137 HB3 ASP 16 HB1 ASP 16 6.741 -11.027 -7.393 138 H GLU 17 HN GLU 17 5.404 -8.148 -9.585 139 HA GLU 17 HA GLU 17 7.216 -7.507 -11.730 140 HB2 GLU 17 HB2 GLU 17 4.349 -6.702 -11.182 141 HB3 GLU 17 HB1 GLU 17 5.153 -6.568 -12.743 142 HG2 GLU 17 HG2 GLU 17 4.863 -8.762 -13.182 143 HG3 GLU 17 HG1 GLU 17 5.458 -9.229 -11.588 144 H SER 18 HN SER 18 7.499 -5.360 -12.698 145 HA SER 18 HA SER 18 7.979 -3.276 -10.625 146 HB2 SER 18 HB2 SER 18 9.388 -2.322 -12.459 147 HB3 SER 18 HB1 SER 18 9.826 -3.982 -12.067 148 HG SER 18 HG SER 18 9.580 -4.147 -14.179 149 H MET 19 HN MET 19 5.537 -4.101 -12.730 150 HA MET 19 HA MET 19 4.866 -1.649 -14.030 151 HB2 MET 19 HB2 MET 19 2.636 -2.683 -14.164 152 HB3 MET 19 HB1 MET 19 3.878 -3.901 -14.455 153 HG2 MET 19 HG2 MET 19 3.495 -4.973 -12.449 154 HG3 MET 19 HG1 MET 19 2.993 -3.492 -11.634 155 HE1 MET 19 HE1 MET 19 2.417 -6.085 -14.137 156 HE2 MET 19 HE2 MET 19 1.439 -5.039 -15.163 157 HE3 MET 19 HE3 MET 19 0.674 -6.351 -14.269 158 H ILE 20 HN ILE 20 4.899 -2.540 -10.731 159 HA ILE 20 HA ILE 20 2.859 -0.597 -9.861 160 HB ILE 20 HB ILE 20 3.010 -2.621 -8.624 161 HG12 ILE 20 HG12 ILE 20 4.581 -0.538 -7.086 162 HG13 ILE 20 HG11 ILE 20 2.819 -0.598 -7.213 163 HG21 ILE 20 HG21 ILE 20 5.063 -3.592 -9.213 164 HG22 ILE 20 HG22 ILE 20 5.263 -3.212 -7.504 165 HG23 ILE 20 HG23 ILE 20 5.980 -2.164 -8.727 166 HD11 ILE 20 HD11 ILE 20 3.882 -1.658 -5.112 167 HD12 ILE 20 HD12 ILE 20 4.409 -2.953 -6.187 168 HD13 ILE 20 HD13 ILE 20 2.689 -2.621 -5.983 169 H ALA 21 HN ALA 21 6.315 -0.810 -10.262 170 HA ALA 21 HA ALA 21 7.143 1.322 -8.542 171 HB1 ALA 21 HB1 ALA 21 9.026 0.327 -9.266 172 HB2 ALA 21 HB2 ALA 21 8.816 1.152 -10.811 173 HB3 ALA 21 HB3 ALA 21 8.146 -0.463 -10.573 174 H MET 22 HN MET 22 7.210 1.496 -12.113 175 HA MET 22 HA MET 22 7.173 4.334 -12.236 176 HB2 MET 22 HB2 MET 22 7.406 2.204 -13.969 177 HB3 MET 22 HB1 MET 22 5.853 2.891 -14.446 178 HG2 MET 22 HG2 MET 22 6.949 4.500 -15.568 179 HG3 MET 22 HG1 MET 22 7.616 5.074 -14.040 180 HE1 MET 22 HE1 MET 22 9.825 4.910 -17.128 181 HE2 MET 22 HE2 MET 22 8.089 4.611 -17.117 182 HE3 MET 22 HE3 MET 22 9.196 3.317 -17.572 183 H LEU 23 HN LEU 23 4.594 2.011 -11.885 184 HA LEU 23 HA LEU 23 2.383 3.753 -12.572 185 HB2 LEU 23 HB2 LEU 23 2.125 1.372 -12.631 186 HB3 LEU 23 HB1 LEU 23 2.815 1.187 -11.023 187 HG LEU 23 HG LEU 23 0.269 0.933 -11.247 188 HD11 LEU 23 HD11 LEU 23 1.918 2.141 -9.235 189 HD12 LEU 23 HD12 LEU 23 0.465 1.164 -9.032 190 HD13 LEU 23 HD13 LEU 23 0.330 2.912 -9.217 191 HD21 LEU 23 HD21 LEU 23 -0.952 2.651 -12.025 192 HD22 LEU 23 HD22 LEU 23 0.551 3.478 -12.430 193 HD23 LEU 23 HD23 LEU 23 -0.215 3.756 -10.866 194 H ILE 24 HN ILE 24 4.595 3.759 -10.017 195 HA ILE 24 HA ILE 24 2.672 4.881 -8.047 196 HB ILE 24 HB ILE 24 4.737 3.046 -7.946 197 HG12 ILE 24 HG12 ILE 24 4.186 4.447 -5.406 198 HG13 ILE 24 HG11 ILE 24 2.752 3.953 -6.308 199 HG21 ILE 24 HG21 ILE 24 5.753 5.703 -6.927 200 HG22 ILE 24 HG22 ILE 24 6.545 4.584 -8.036 201 HG23 ILE 24 HG23 ILE 24 6.372 4.162 -6.335 202 HD11 ILE 24 HD11 ILE 24 3.457 1.655 -6.340 203 HD12 ILE 24 HD12 ILE 24 3.654 2.216 -4.679 204 HD13 ILE 24 HD13 ILE 24 5.060 2.076 -5.735 205 H GLU 25 HN GLU 25 5.921 5.672 -9.374 206 HA GLU 25 HA GLU 25 6.147 8.258 -8.249 207 HB2 GLU 25 HB2 GLU 25 7.215 6.862 -10.693 208 HB3 GLU 25 HB1 GLU 25 7.618 8.555 -10.401 209 HG2 GLU 25 HG2 GLU 25 8.020 7.392 -7.920 210 HG3 GLU 25 HG1 GLU 25 8.590 6.150 -9.037 211 H ASP 26 HN ASP 26 4.184 7.134 -10.902 212 HA ASP 26 HA ASP 26 3.761 9.798 -12.058 213 HB2 ASP 26 HB2 ASP 26 2.343 8.592 -13.576 214 HB3 ASP 26 HB1 ASP 26 3.687 7.507 -13.218 215 H THR 27 HN THR 27 2.111 7.638 -9.791 216 HA THR 27 HA THR 27 -0.287 9.265 -9.584 217 HB THR 27 HB THR 27 -0.641 7.721 -7.606 218 HG1 THR 27 HG1 THR 27 0.926 6.343 -7.071 219 HG21 THR 27 HG21 THR 27 -1.172 7.190 -10.078 220 HG22 THR 27 HG22 THR 27 -1.098 5.835 -8.951 221 HG23 THR 27 HG23 THR 27 0.261 6.163 -10.025 222 H LEU 28 HN LEU 28 2.569 8.674 -7.538 223 HA LEU 28 HA LEU 28 1.999 10.523 -5.441 224 HB2 LEU 28 HB2 LEU 28 3.802 9.271 -4.860 225 HB3 LEU 28 HB1 LEU 28 4.177 8.914 -6.540 226 HG LEU 28 HG LEU 28 4.827 11.607 -5.347 227 HD11 LEU 28 HD11 LEU 28 6.471 9.064 -5.281 228 HD12 LEU 28 HD12 LEU 28 5.892 9.988 -3.896 229 HD13 LEU 28 HD13 LEU 28 7.124 10.671 -4.960 230 HD21 LEU 28 HD21 LEU 28 6.747 10.711 -7.207 231 HD22 LEU 28 HD22 LEU 28 5.500 11.927 -7.481 232 HD23 LEU 28 HD23 LEU 28 5.187 10.239 -7.881 233 H CYS 29 HN CYS 29 3.398 10.934 -8.677 234 HA CYS 29 HA CYS 29 4.619 13.409 -8.618 235 HB2 CYS 29 HB2 CYS 29 3.007 11.834 -10.517 236 HB3 CYS 29 HB1 CYS 29 3.063 13.558 -10.884 237 HG CYS 29 HG CYS 29 5.426 11.615 -11.080 238 H GLU 30 HN GLU 30 1.124 12.776 -8.554 239 HA GLU 30 HA GLU 30 0.447 15.622 -8.504 240 HB2 GLU 30 HB2 GLU 30 -1.031 14.173 -9.681 241 HB3 GLU 30 HB1 GLU 30 -1.038 12.995 -8.369 242 HG2 GLU 30 HG2 GLU 30 -2.297 14.475 -6.943 243 HG3 GLU 30 HG1 GLU 30 -2.127 15.807 -8.087 244 H LEU 31 HN LEU 31 0.325 12.853 -6.261 245 HA LEU 31 HA LEU 31 -0.756 14.381 -4.048 246 HB2 LEU 31 HB2 LEU 31 0.737 11.739 -4.178 247 HB3 LEU 31 HB1 LEU 31 -0.243 12.298 -2.818 248 HG LEU 31 HG LEU 31 -1.403 12.094 -5.596 249 HD11 LEU 31 HD11 LEU 31 -1.922 9.846 -5.325 250 HD12 LEU 31 HD12 LEU 31 -1.794 9.921 -3.567 251 HD13 LEU 31 HD13 LEU 31 -0.335 9.902 -4.558 252 HD21 LEU 31 HD21 LEU 31 -2.845 13.299 -4.181 253 HD22 LEU 31 HD22 LEU 31 -2.426 12.324 -2.772 254 HD23 LEU 31 HD23 LEU 31 -3.454 11.649 -4.036 255 H GLY 32 HN GLY 32 2.536 13.500 -5.086 256 HA2 GLY 32 HA2 GLY 32 4.613 14.306 -4.326 257 HA3 GLY 32 HA1 GLY 32 3.727 15.655 -3.596 258 H HIS 33 HN HIS 33 3.171 12.256 -2.958 259 HA HIS 33 HA HIS 33 2.979 12.451 -0.163 260 HB2 HIS 33 HB2 HIS 33 3.394 10.395 -2.265 261 HB3 HIS 33 HB1 HIS 33 3.707 9.876 -0.610 262 HD1 HIS 33 HD1 HIS 33 1.201 9.136 -2.574 263 HD2 HIS 33 HD2 HIS 33 1.153 11.678 0.730 264 HE1 HIS 33 HE1 HIS 33 -1.209 9.248 -1.797 265 H GLU 34 HN GLU 34 4.828 10.403 0.774 266 HA GLU 34 HA GLU 34 7.277 12.096 1.022 267 HB2 GLU 34 HB2 GLU 34 5.699 10.237 2.664 268 HB3 GLU 34 HB1 GLU 34 7.430 10.149 2.914 269 HG2 GLU 34 HG2 GLU 34 7.047 11.898 4.339 270 HG3 GLU 34 HG1 GLU 34 7.078 12.845 2.852 271 H VAL 35 HN VAL 35 7.149 8.579 1.583 272 HA VAL 35 HA VAL 35 9.123 8.164 -0.636 273 HB VAL 35 HB VAL 35 10.212 8.552 1.592 274 HG11 VAL 35 HG11 VAL 35 9.172 5.887 2.479 275 HG12 VAL 35 HG12 VAL 35 8.151 7.308 2.702 276 HG13 VAL 35 HG13 VAL 35 9.747 7.242 3.449 277 HG21 VAL 35 HG21 VAL 35 10.401 5.856 0.243 278 HG22 VAL 35 HG22 VAL 35 11.458 6.284 1.588 279 HG23 VAL 35 HG23 VAL 35 11.497 7.230 0.100 280 H ALA 36 HN ALA 36 8.000 6.717 -1.937 281 HA ALA 36 HA ALA 36 6.214 4.709 -0.745 282 HB1 ALA 36 HB1 ALA 36 5.919 4.254 -3.300 283 HB2 ALA 36 HB2 ALA 36 6.835 5.746 -3.497 284 HB3 ALA 36 HB3 ALA 36 5.296 5.762 -2.637 285 H ALA 37 HN ALA 37 6.308 2.651 -2.380 286 HA ALA 37 HA ALA 37 9.083 1.650 -2.651 287 HB1 ALA 37 HB1 ALA 37 8.583 0.961 -0.426 288 HB2 ALA 37 HB2 ALA 37 8.215 -0.456 -1.409 289 HB3 ALA 37 HB3 ALA 37 6.910 0.582 -0.836 290 H THR 38 HN THR 38 9.144 -0.144 -4.139 291 HA THR 38 HA THR 38 6.577 -0.822 -5.486 292 HB THR 38 HB THR 38 7.539 0.968 -6.774 293 HG1 THR 38 HG1 THR 38 8.372 -1.446 -7.995 294 HG21 THR 38 HG21 THR 38 9.810 1.139 -7.366 295 HG22 THR 38 HG22 THR 38 10.110 -0.574 -7.067 296 HG23 THR 38 HG23 THR 38 9.875 0.530 -5.713 297 H ALA 39 HN ALA 39 6.895 -2.689 -7.010 298 HA ALA 39 HA ALA 39 7.518 -4.937 -7.349 299 HB1 ALA 39 HB1 ALA 39 9.731 -3.369 -7.536 300 HB2 ALA 39 HB2 ALA 39 9.756 -5.116 -7.777 301 HB3 ALA 39 HB3 ALA 39 10.207 -4.434 -6.214 302 H SER 40 HN SER 40 7.787 -6.873 -6.064 303 HA SER 40 HA SER 40 7.124 -6.470 -3.248 304 HB2 SER 40 HB2 SER 40 6.989 -8.931 -3.279 305 HB3 SER 40 HB1 SER 40 6.084 -8.211 -4.599 306 HG SER 40 HG SER 40 7.904 -10.033 -4.810 307 H ARG 41 HN ARG 41 8.548 -6.518 -1.559 308 HA ARG 41 HA ARG 41 11.182 -7.804 -1.925 309 HB2 ARG 41 HB2 ARG 41 10.910 -5.197 -2.498 310 HB3 ARG 41 HB1 ARG 41 11.110 -5.069 -0.749 311 HG2 ARG 41 HG2 ARG 41 13.320 -4.953 -1.573 312 HG3 ARG 41 HG1 ARG 41 13.146 -6.635 -1.066 313 HD2 ARG 41 HD2 ARG 41 14.008 -6.947 -3.213 314 HD3 ARG 41 HD1 ARG 41 12.273 -6.909 -3.586 315 HE ARG 41 HE ARG 41 12.968 -4.243 -3.615 316 HH11 ARG 41 HH21 ARG 41 14.205 -7.104 -5.099 317 HH12 ARG 41 HH22 ARG 41 14.772 -6.281 -6.513 318 HH21 ARG 41 HH11 ARG 41 13.684 -3.163 -5.465 319 HH22 ARG 41 HH12 ARG 41 14.476 -4.053 -6.722 320 H MET 42 HN MET 42 11.399 -9.088 -0.153 321 HA MET 42 HA MET 42 9.788 -9.054 2.161 322 HB2 MET 42 HB2 MET 42 12.676 -9.953 1.976 323 HB3 MET 42 HB1 MET 42 11.407 -10.633 2.995 324 HG2 MET 42 HG2 MET 42 10.874 -12.060 1.337 325 HG3 MET 42 HG1 MET 42 10.434 -10.684 0.327 326 HE1 MET 42 HE1 MET 42 13.640 -13.457 0.710 327 HE2 MET 42 HE2 MET 42 13.115 -12.390 2.011 328 HE3 MET 42 HE3 MET 42 14.600 -12.032 1.131 329 H GLN 43 HN GLN 43 12.885 -7.422 1.536 330 HA GLN 43 HA GLN 43 13.239 -6.438 4.237 331 HB2 GLN 43 HB2 GLN 43 14.389 -5.991 1.507 332 HB3 GLN 43 HB1 GLN 43 14.767 -4.821 2.773 333 HG2 GLN 43 HG2 GLN 43 15.415 -6.805 4.238 334 HG3 GLN 43 HG1 GLN 43 15.319 -7.796 2.783 335 HE21 GLN 43 HE21 GLN 43 17.092 -7.723 1.333 336 HE22 GLN 43 HE22 GLN 43 18.433 -6.701 1.536 337 H GLU 44 HN GLU 44 12.502 -4.590 1.234 338 HA GLU 44 HA GLU 44 11.665 -2.217 2.540 339 HB2 GLU 44 HB2 GLU 44 10.718 -3.415 -0.084 340 HB3 GLU 44 HB1 GLU 44 10.616 -1.715 0.365 341 HG2 GLU 44 HG2 GLU 44 13.286 -3.067 0.489 342 HG3 GLU 44 HG1 GLU 44 12.650 -2.591 -1.087 343 H ALA 45 HN ALA 45 9.740 -5.026 1.438 344 HA ALA 45 HA ALA 45 7.152 -4.197 2.076 345 HB1 ALA 45 HB1 ALA 45 8.577 -6.835 2.559 346 HB2 ALA 45 HB2 ALA 45 7.658 -6.376 1.125 347 HB3 ALA 45 HB3 ALA 45 6.828 -6.642 2.658 348 H LEU 46 HN LEU 46 9.727 -5.300 4.232 349 HA LEU 46 HA LEU 46 8.170 -5.195 6.660 350 HB2 LEU 46 HB2 LEU 46 10.242 -6.536 6.233 351 HB3 LEU 46 HB1 LEU 46 11.160 -5.034 6.170 352 HG LEU 46 HG LEU 46 9.436 -5.519 8.562 353 HD11 LEU 46 HD11 LEU 46 12.197 -6.729 8.235 354 HD12 LEU 46 HD12 LEU 46 10.702 -7.658 8.116 355 HD13 LEU 46 HD13 LEU 46 11.133 -6.871 9.635 356 HD21 LEU 46 HD21 LEU 46 11.532 -4.422 9.581 357 HD22 LEU 46 HD22 LEU 46 10.561 -3.424 8.499 358 HD23 LEU 46 HD23 LEU 46 12.056 -4.156 7.918 359 H ASP 47 HN ASP 47 10.187 -2.953 4.834 360 HA ASP 47 HA ASP 47 10.450 -0.899 6.806 361 HB2 ASP 47 HB2 ASP 47 10.595 -1.116 3.812 362 HB3 ASP 47 HB1 ASP 47 10.660 0.478 4.562 363 H ILE 48 HN ILE 48 7.698 -2.025 5.152 364 HA ILE 48 HA ILE 48 6.280 0.559 5.268 365 HB ILE 48 HB ILE 48 4.869 -0.368 3.694 366 HG12 ILE 48 HG12 ILE 48 5.305 -3.019 5.079 367 HG13 ILE 48 HG11 ILE 48 3.814 -2.103 4.949 368 HG21 ILE 48 HG21 ILE 48 7.294 -0.632 3.003 369 HG22 ILE 48 HG22 ILE 48 6.116 -1.600 2.118 370 HG23 ILE 48 HG23 ILE 48 7.109 -2.346 3.371 371 HD11 ILE 48 HD11 ILE 48 4.286 -2.405 2.339 372 HD12 ILE 48 HD12 ILE 48 3.450 -3.648 3.267 373 HD13 ILE 48 HD13 ILE 48 5.170 -3.819 2.912 374 H ALA 49 HN ALA 49 6.060 -2.768 6.605 375 HA ALA 49 HA ALA 49 3.816 -2.129 8.327 376 HB1 ALA 49 HB1 ALA 49 4.095 -4.386 7.683 377 HB2 ALA 49 HB2 ALA 49 4.655 -4.375 9.355 378 HB3 ALA 49 HB3 ALA 49 5.823 -4.366 8.034 379 H ARG 50 HN ARG 50 7.316 -2.616 8.952 380 HA ARG 50 HA ARG 50 7.129 -1.940 11.750 381 HB2 ARG 50 HB2 ARG 50 9.223 -2.478 9.692 382 HB3 ARG 50 HB1 ARG 50 9.734 -1.680 11.183 383 HG2 ARG 50 HG2 ARG 50 9.943 -4.090 11.467 384 HG3 ARG 50 HG1 ARG 50 8.624 -3.508 12.484 385 HD2 ARG 50 HD2 ARG 50 7.808 -4.274 9.742 386 HD3 ARG 50 HD1 ARG 50 8.366 -5.616 10.764 387 HE ARG 50 HE ARG 50 6.545 -3.747 12.109 388 HH11 ARG 50 HH21 ARG 50 7.265 -6.947 11.594 389 HH12 ARG 50 HH22 ARG 50 5.627 -7.503 11.508 390 HH21 ARG 50 HH11 ARG 50 4.270 -4.313 11.418 391 HH22 ARG 50 HH12 ARG 50 3.931 -6.011 11.408 392 H LYS 51 HN LYS 51 6.602 0.087 9.206 393 HA LYS 51 HA LYS 51 8.281 2.326 10.068 394 HB2 LYS 51 HB2 LYS 51 7.765 1.837 7.711 395 HB3 LYS 51 HB1 LYS 51 6.052 2.076 8.032 396 HG2 LYS 51 HG2 LYS 51 6.758 4.148 7.156 397 HG3 LYS 51 HG1 LYS 51 6.750 4.407 8.895 398 HD2 LYS 51 HD2 LYS 51 8.823 5.289 7.957 399 HD3 LYS 51 HD1 LYS 51 9.181 3.881 8.958 400 HE2 LYS 51 HE2 LYS 51 9.774 2.574 7.146 401 HE3 LYS 51 HE1 LYS 51 8.639 3.396 6.055 402 HZ1 LYS 51 HZ1 LYS 51 10.785 4.167 5.477 403 HZ2 LYS 51 HZ2 LYS 51 11.219 4.424 7.100 404 HZ3 LYS 51 HZ3 LYS 51 10.062 5.422 6.357 405 H GLY 52 HN GLY 52 4.765 1.660 9.895 406 HA2 GLY 52 HA2 GLY 52 3.083 2.359 11.406 407 HA3 GLY 52 HA1 GLY 52 4.320 3.186 12.350 408 H GLN 53 HN GLN 53 5.286 4.659 9.891 409 HA GLN 53 HA GLN 53 3.026 6.611 9.726 410 HB2 GLN 53 HB2 GLN 53 5.331 8.032 9.169 411 HB3 GLN 53 HB1 GLN 53 4.540 7.953 10.738 412 HG2 GLN 53 HG2 GLN 53 5.956 5.962 11.298 413 HG3 GLN 53 HG1 GLN 53 6.806 6.185 9.771 414 HE21 GLN 53 HE21 GLN 53 5.706 8.997 11.634 415 HE22 GLN 53 HE22 GLN 53 7.250 9.499 12.114 416 H PHE 54 HN PHE 54 4.284 4.305 7.870 417 HA PHE 54 HA PHE 54 4.979 5.698 5.401 418 HB2 PHE 54 HB2 PHE 54 4.837 3.456 4.450 419 HB3 PHE 54 HB1 PHE 54 5.628 3.356 6.014 420 HD1 PHE 54 HD2 PHE 54 2.572 3.891 7.248 421 HD2 PHE 54 HD1 PHE 54 4.513 0.958 4.810 422 HE1 PHE 54 HE2 PHE 54 0.925 2.224 7.962 423 HE2 PHE 54 HE1 PHE 54 2.865 -0.721 5.552 424 HZ PHE 54 HZ PHE 54 1.058 -0.096 7.116 425 H ASP 55 HN ASP 55 2.073 5.624 7.030 426 HA ASP 55 HA ASP 55 -0.073 6.274 6.309 427 HB2 ASP 55 HB2 ASP 55 1.664 7.571 4.757 428 HB3 ASP 55 HB1 ASP 55 0.955 6.539 3.514 429 H ILE 56 HN ILE 56 1.439 4.378 3.598 430 HA ILE 56 HA ILE 56 -0.815 2.421 3.902 431 HB ILE 56 HB ILE 56 0.002 3.747 1.307 432 HG12 ILE 56 HG12 ILE 56 -2.241 4.373 3.248 433 HG13 ILE 56 HG11 ILE 56 -0.939 5.449 2.740 434 HG21 ILE 56 HG21 ILE 56 -2.424 2.839 0.812 435 HG22 ILE 56 HG22 ILE 56 -2.069 1.751 2.153 436 HG23 ILE 56 HG23 ILE 56 -1.040 1.752 0.721 437 HD11 ILE 56 HD11 ILE 56 -2.080 4.656 0.338 438 HD12 ILE 56 HD12 ILE 56 -2.364 6.193 1.154 439 HD13 ILE 56 HD13 ILE 56 -3.471 4.843 1.406 440 H ALA 57 HN ALA 57 -0.416 0.339 2.730 441 HA ALA 57 HA ALA 57 2.297 -0.053 1.599 442 HB1 ALA 57 HB1 ALA 57 3.040 -0.524 3.702 443 HB2 ALA 57 HB2 ALA 57 2.273 -2.082 3.405 444 HB3 ALA 57 HB3 ALA 57 1.416 -0.833 4.310 445 H ILE 58 HN ILE 58 2.255 -1.805 0.101 446 HA ILE 58 HA ILE 58 -0.131 -3.587 0.330 447 HB ILE 58 HB ILE 58 0.813 -1.979 -2.045 448 HG12 ILE 58 HG12 ILE 58 -1.742 -1.442 -1.939 449 HG13 ILE 58 HG11 ILE 58 -1.639 -2.073 -0.295 450 HG21 ILE 58 HG21 ILE 58 -0.648 -4.540 -1.910 451 HG22 ILE 58 HG22 ILE 58 0.199 -3.799 -3.267 452 HG23 ILE 58 HG23 ILE 58 -1.445 -3.296 -2.873 453 HD11 ILE 58 HD11 ILE 58 -0.921 0.519 -1.201 454 HD12 ILE 58 HD12 ILE 58 0.573 -0.302 -0.750 455 HD13 ILE 58 HD13 ILE 58 -0.736 -0.146 0.422 456 H ILE 59 HN ILE 59 1.229 -5.320 0.976 457 HA ILE 59 HA ILE 59 3.316 -6.307 -0.878 458 HB ILE 59 HB ILE 59 2.128 -7.329 1.729 459 HG12 ILE 59 HG12 ILE 59 4.960 -6.465 1.503 460 HG13 ILE 59 HG11 ILE 59 3.757 -5.183 1.391 461 HG21 ILE 59 HG21 ILE 59 4.642 -8.290 0.359 462 HG22 ILE 59 HG22 ILE 59 3.082 -9.078 0.130 463 HG23 ILE 59 HG23 ILE 59 3.814 -9.019 1.733 464 HD11 ILE 59 HD11 ILE 59 2.705 -6.116 3.499 465 HD12 ILE 59 HD12 ILE 59 4.309 -5.419 3.722 466 HD13 ILE 59 HD13 ILE 59 4.110 -7.169 3.652 467 H ASP 60 HN ASP 60 1.453 -6.271 -2.516 468 HA ASP 60 HA ASP 60 -0.801 -8.011 -2.334 469 HB2 ASP 60 HB2 ASP 60 -1.049 -7.460 -4.604 470 HB3 ASP 60 HB1 ASP 60 -0.339 -6.048 -3.846 471 H VAL 61 HN VAL 61 -0.578 -9.248 -4.885 472 HA VAL 61 HA VAL 61 -0.356 -11.526 -5.481 473 HB VAL 61 HB VAL 61 1.393 -9.948 -6.462 474 HG11 VAL 61 HG11 VAL 61 3.602 -11.429 -5.269 475 HG12 VAL 61 HG12 VAL 61 2.727 -10.496 -4.062 476 HG13 VAL 61 HG13 VAL 61 3.405 -9.689 -5.471 477 HG21 VAL 61 HG21 VAL 61 2.463 -11.737 -7.642 478 HG22 VAL 61 HG22 VAL 61 0.852 -12.320 -7.217 479 HG23 VAL 61 HG23 VAL 61 2.255 -12.846 -6.287 480 H ASN 62 HN ASN 62 -1.070 -12.305 -3.299 481 HA ASN 62 HA ASN 62 1.159 -13.648 -1.803 482 HB2 ASN 62 HB2 ASN 62 -1.551 -12.614 -0.905 483 HB3 ASN 62 HB1 ASN 62 -0.428 -13.492 0.132 484 HD21 ASN 62 HD21 ASN 62 1.956 -12.133 -1.180 485 HD22 ASN 62 HD22 ASN 62 1.964 -10.561 -0.545 486 H LEU 63 HN LEU 63 0.983 -15.538 -3.217 487 HA LEU 63 HA LEU 63 -1.257 -17.320 -2.436 488 HB2 LEU 63 HB2 LEU 63 -1.174 -15.834 -4.858 489 HB3 LEU 63 HB1 LEU 63 -0.842 -17.514 -5.282 490 HG LEU 63 HG LEU 63 -2.873 -17.906 -3.556 491 HD11 LEU 63 HD11 LEU 63 -3.210 -15.130 -4.700 492 HD12 LEU 63 HD12 LEU 63 -3.363 -15.645 -3.019 493 HD13 LEU 63 HD13 LEU 63 -4.593 -16.102 -4.197 494 HD21 LEU 63 HD21 LEU 63 -4.211 -17.307 -5.944 495 HD22 LEU 63 HD22 LEU 63 -3.503 -18.862 -5.505 496 HD23 LEU 63 HD23 LEU 63 -2.567 -17.702 -6.447 497 H ASP 64 HN ASP 64 -0.776 -19.518 -3.865 498 HA ASP 64 HA ASP 64 0.718 -21.368 -3.868 499 HB2 ASP 64 HB2 ASP 64 1.277 -19.503 -5.763 500 HB3 ASP 64 HB1 ASP 64 2.828 -19.550 -4.916 501 H GLY 65 HN GLY 65 0.719 -19.700 -1.414 502 HA2 GLY 65 HA2 GLY 65 2.298 -20.643 0.408 503 HA3 GLY 65 HA1 GLY 65 3.576 -19.924 -0.574 504 H GLU 66 HN GLU 66 1.397 -17.781 -1.199 505 HA GLU 66 HA GLU 66 0.973 -15.604 -0.428 506 HB2 GLU 66 HB2 GLU 66 0.742 -17.412 1.959 507 HB3 GLU 66 HB1 GLU 66 0.559 -15.671 2.171 508 HG2 GLU 66 HG2 GLU 66 -1.165 -15.716 0.325 509 HG3 GLU 66 HG1 GLU 66 -1.079 -17.478 0.375 510 HA PRO 67 HA PRO 67 5.409 -15.225 0.943 511 HB2 PRO 67 HB2 PRO 67 6.207 -13.654 -1.154 512 HB3 PRO 67 HB1 PRO 67 6.250 -15.428 -1.199 513 HG2 PRO 67 HG2 PRO 67 4.246 -13.555 -2.359 514 HG3 PRO 67 HG1 PRO 67 4.911 -15.055 -3.028 515 HD2 PRO 67 HD2 PRO 67 2.456 -14.905 -1.871 516 HD3 PRO 67 HD1 PRO 67 3.444 -16.379 -1.871 517 H SER 68 HN SER 68 3.337 -13.860 2.140 518 HA SER 68 HA SER 68 3.881 -10.950 1.743 519 HB2 SER 68 HB2 SER 68 1.590 -12.593 2.264 520 HB3 SER 68 HB1 SER 68 1.815 -11.517 3.641 521 HG SER 68 HG SER 68 1.839 -9.775 2.199 522 H TYR 69 HN TYR 69 5.385 -13.220 3.299 523 HA TYR 69 HA TYR 69 6.501 -13.502 5.339 524 HB2 TYR 69 HB2 TYR 69 6.730 -10.728 6.040 525 HB3 TYR 69 HB1 TYR 69 7.952 -11.784 5.353 526 HD1 TYR 69 HD2 TYR 69 8.313 -11.889 2.922 527 HD2 TYR 69 HD1 TYR 69 5.427 -9.211 4.635 528 HE1 TYR 69 HE2 TYR 69 8.207 -10.622 0.795 529 HE2 TYR 69 HE1 TYR 69 5.328 -7.948 2.518 530 HH TYR 69 HH TYR 69 7.550 -8.608 -0.120 531 HA PRO 70 HA PRO 70 3.906 -12.981 8.805 532 HB2 PRO 70 HB2 PRO 70 5.624 -12.389 10.842 533 HB3 PRO 70 HB1 PRO 70 5.541 -13.994 10.089 534 HG2 PRO 70 HG2 PRO 70 7.533 -11.829 9.711 535 HG3 PRO 70 HG1 PRO 70 7.752 -13.585 9.689 536 HD2 PRO 70 HD2 PRO 70 7.616 -11.984 7.442 537 HD3 PRO 70 HD1 PRO 70 7.298 -13.731 7.467 538 H VAL 71 HN VAL 71 5.594 -10.323 7.566 539 HA VAL 71 HA VAL 71 4.594 -8.419 9.577 540 HB VAL 71 HB VAL 71 5.766 -6.747 8.165 541 HG11 VAL 71 HG11 VAL 71 7.952 -8.559 8.157 542 HG12 VAL 71 HG12 VAL 71 6.922 -8.998 9.520 543 HG13 VAL 71 HG13 VAL 71 7.549 -7.355 9.382 544 HG21 VAL 71 HG21 VAL 71 7.241 -7.909 6.317 545 HG22 VAL 71 HG22 VAL 71 5.585 -7.430 5.945 546 HG23 VAL 71 HG23 VAL 71 5.954 -9.106 6.328 547 H ALA 72 HN ALA 72 4.115 -8.931 6.038 548 HA ALA 72 HA ALA 72 1.977 -7.089 5.696 549 HB1 ALA 72 HB1 ALA 72 1.926 -8.060 3.629 550 HB2 ALA 72 HB2 ALA 72 1.875 -9.693 4.296 551 HB3 ALA 72 HB3 ALA 72 3.411 -8.831 4.183 552 H ASP 73 HN ASP 73 1.893 -10.604 6.405 553 HA ASP 73 HA ASP 73 -0.907 -10.876 6.656 554 HB2 ASP 73 HB2 ASP 73 1.542 -12.226 7.634 555 HB3 ASP 73 HB1 ASP 73 0.036 -12.671 8.423 556 H ILE 74 HN ILE 74 1.509 -10.314 9.215 557 HA ILE 74 HA ILE 74 -0.276 -9.980 11.398 558 HB ILE 74 HB ILE 74 2.449 -8.889 10.677 559 HG12 ILE 74 HG12 ILE 74 1.472 -10.887 12.753 560 HG13 ILE 74 HG11 ILE 74 2.208 -11.307 11.207 561 HG21 ILE 74 HG21 ILE 74 2.089 -8.614 13.455 562 HG22 ILE 74 HG22 ILE 74 0.642 -7.917 12.728 563 HG23 ILE 74 HG23 ILE 74 2.235 -7.312 12.274 564 HD11 ILE 74 HD11 ILE 74 3.504 -10.626 13.683 565 HD12 ILE 74 HD12 ILE 74 3.946 -9.443 12.452 566 HD13 ILE 74 HD13 ILE 74 4.236 -11.160 12.170 567 H LEU 75 HN LEU 75 1.058 -7.611 9.109 568 HA LEU 75 HA LEU 75 -0.170 -5.262 10.124 569 HB2 LEU 75 HB2 LEU 75 1.608 -5.795 8.261 570 HB3 LEU 75 HB1 LEU 75 0.210 -5.874 7.193 571 HG LEU 75 HG LEU 75 -0.359 -3.560 8.422 572 HD11 LEU 75 HD11 LEU 75 2.000 -2.394 8.470 573 HD12 LEU 75 HD12 LEU 75 2.575 -4.029 8.795 574 HD13 LEU 75 HD13 LEU 75 1.422 -3.266 9.889 575 HD21 LEU 75 HD21 LEU 75 0.697 -4.390 5.946 576 HD22 LEU 75 HD22 LEU 75 1.680 -3.015 6.449 577 HD23 LEU 75 HD23 LEU 75 -0.070 -2.843 6.306 578 H ALA 76 HN ALA 76 -1.485 -7.999 8.406 579 HA ALA 76 HA ALA 76 -3.934 -6.608 7.592 580 HB1 ALA 76 HB1 ALA 76 -4.412 -9.187 7.064 581 HB2 ALA 76 HB2 ALA 76 -2.663 -9.287 7.263 582 HB3 ALA 76 HB3 ALA 76 -3.350 -8.218 6.042 583 H GLU 77 HN GLU 77 -3.230 -9.446 9.699 584 HA GLU 77 HA GLU 77 -5.693 -9.942 10.841 585 HB2 GLU 77 HB2 GLU 77 -3.008 -9.681 12.244 586 HB3 GLU 77 HB1 GLU 77 -4.391 -10.574 12.875 587 HG2 GLU 77 HG2 GLU 77 -2.887 -11.164 10.307 588 HG3 GLU 77 HG1 GLU 77 -2.871 -12.134 11.779 589 H ARG 78 HN ARG 78 -3.623 -7.200 11.380 590 HA ARG 78 HA ARG 78 -5.799 -5.773 12.781 591 HB2 ARG 78 HB2 ARG 78 -3.987 -4.881 14.350 592 HB3 ARG 78 HB1 ARG 78 -4.391 -6.581 14.574 593 HG2 ARG 78 HG2 ARG 78 -2.426 -6.793 12.705 594 HG3 ARG 78 HG1 ARG 78 -1.891 -5.354 13.570 595 HD2 ARG 78 HD2 ARG 78 -0.954 -7.400 14.613 596 HD3 ARG 78 HD1 ARG 78 -2.089 -6.604 15.722 597 HE ARG 78 HE ARG 78 -3.414 -8.518 13.976 598 HH11 ARG 78 HH21 ARG 78 -3.979 -7.879 16.919 599 HH12 ARG 78 HH22 ARG 78 -3.543 -9.378 17.670 600 HH21 ARG 78 HH11 ARG 78 -1.809 -10.558 14.903 601 HH22 ARG 78 HH12 ARG 78 -2.311 -10.898 16.526 602 H ASN 79 HN ASN 79 -6.054 -3.838 11.661 603 HA ASN 79 HA ASN 79 -3.750 -2.988 9.986 604 HB2 ASN 79 HB2 ASN 79 -6.714 -3.132 9.607 605 HB3 ASN 79 HB1 ASN 79 -5.752 -2.048 8.606 606 HD21 ASN 79 HD21 ASN 79 -3.626 -3.268 7.725 607 HD22 ASN 79 HD22 ASN 79 -3.915 -4.816 7.095 608 H VAL 80 HN VAL 80 -2.972 -0.996 10.223 609 HA VAL 80 HA VAL 80 -4.398 1.003 11.925 610 HB VAL 80 HB VAL 80 -2.212 1.962 12.133 611 HG11 VAL 80 HG11 VAL 80 -1.272 0.241 13.239 612 HG12 VAL 80 HG12 VAL 80 -1.039 -0.676 11.750 613 HG13 VAL 80 HG13 VAL 80 -2.580 -0.758 12.605 614 HG21 VAL 80 HG21 VAL 80 -1.784 2.026 9.659 615 HG22 VAL 80 HG22 VAL 80 -1.376 0.313 9.722 616 HG23 VAL 80 HG23 VAL 80 -0.380 1.488 10.578 617 HA PRO 81 HA PRO 81 -5.188 3.572 8.352 618 HB2 PRO 81 HB2 PRO 81 -3.406 5.637 8.057 619 HB3 PRO 81 HB1 PRO 81 -4.691 5.629 9.282 620 HG2 PRO 81 HG2 PRO 81 -1.794 5.027 9.575 621 HG3 PRO 81 HG1 PRO 81 -2.888 5.875 10.677 622 HD2 PRO 81 HD2 PRO 81 -2.101 3.302 11.026 623 HD3 PRO 81 HD1 PRO 81 -3.647 3.931 11.631 624 H PHE 82 HN PHE 82 -4.895 2.668 6.340 625 HA PHE 82 HA PHE 82 -2.392 2.775 4.880 626 HB2 PHE 82 HB2 PHE 82 -1.575 0.595 5.300 627 HB3 PHE 82 HB1 PHE 82 -2.129 1.123 6.893 628 HD1 PHE 82 HD1 PHE 82 -4.976 0.867 6.876 629 HD2 PHE 82 HD2 PHE 82 -2.074 -1.681 4.996 630 HE1 PHE 82 HE1 PHE 82 -6.607 -0.990 6.892 631 HE2 PHE 82 HE2 PHE 82 -3.709 -3.546 5.022 632 HZ PHE 82 HZ PHE 82 -5.971 -3.200 5.968 633 H ILE 83 HN ILE 83 -2.763 0.162 3.706 634 HA ILE 83 HA ILE 83 -5.386 -0.305 2.693 635 HB ILE 83 HB ILE 83 -3.837 1.811 1.492 636 HG12 ILE 83 HG12 ILE 83 -6.512 0.769 0.630 637 HG13 ILE 83 HG11 ILE 83 -6.315 1.636 2.150 638 HG21 ILE 83 HG21 ILE 83 -4.504 -0.577 -0.224 639 HG22 ILE 83 HG22 ILE 83 -2.996 0.333 -0.168 640 HG23 ILE 83 HG23 ILE 83 -4.428 1.046 -0.910 641 HD11 ILE 83 HD11 ILE 83 -6.976 3.164 0.308 642 HD12 ILE 83 HD12 ILE 83 -5.520 2.704 -0.576 643 HD13 ILE 83 HD13 ILE 83 -5.385 3.567 0.956 644 H PHE 84 HN PHE 84 -5.313 -2.144 1.233 645 HA PHE 84 HA PHE 84 -2.657 -3.322 0.652 646 HB2 PHE 84 HB2 PHE 84 -3.604 -3.673 3.063 647 HB3 PHE 84 HB1 PHE 84 -4.676 -4.826 2.283 648 HD1 PHE 84 HD2 PHE 84 -1.731 -4.845 0.379 649 HD2 PHE 84 HD1 PHE 84 -3.244 -6.156 4.179 650 HE1 PHE 84 HE2 PHE 84 0.010 -6.588 0.478 651 HE2 PHE 84 HE1 PHE 84 -1.460 -7.887 4.278 652 HZ PHE 84 HZ PHE 84 0.163 -8.095 2.431 653 H ALA 85 HN ALA 85 -2.807 -5.084 -0.835 654 HA ALA 85 HA ALA 85 -5.414 -6.026 -1.741 655 HB1 ALA 85 HB1 ALA 85 -5.546 -4.437 -3.355 656 HB2 ALA 85 HB2 ALA 85 -4.164 -5.225 -4.118 657 HB3 ALA 85 HB3 ALA 85 -3.910 -3.878 -3.008 658 H THR 86 HN THR 86 -5.085 -8.205 -2.241 659 HA THR 86 HA THR 86 -2.519 -9.026 -3.473 660 HB THR 86 HB THR 86 -1.719 -10.203 -1.666 661 HG1 THR 86 HG1 THR 86 -2.939 -11.399 -0.397 662 HG21 THR 86 HG21 THR 86 -2.098 -9.014 0.449 663 HG22 THR 86 HG22 THR 86 -3.531 -8.247 -0.234 664 HG23 THR 86 HG23 THR 86 -1.937 -7.868 -0.880 665 H GLY 87 HN GLY 87 -2.890 -11.802 -2.842 666 HA2 GLY 87 HA2 GLY 87 -4.751 -12.524 -4.913 667 HA3 GLY 87 HA1 GLY 87 -3.938 -13.651 -3.824 668 H TYR 88 HN TYR 88 -5.006 -12.333 -1.389 669 HA TYR 88 HA TYR 88 -7.424 -13.854 -1.157 670 HB2 TYR 88 HB2 TYR 88 -7.419 -13.076 1.067 671 HB3 TYR 88 HB1 TYR 88 -5.720 -13.055 0.613 672 HD1 TYR 88 HD1 TYR 88 -5.510 -10.608 -1.010 673 HD2 TYR 88 HD2 TYR 88 -7.722 -11.337 2.592 674 HE1 TYR 88 HE1 TYR 88 -5.371 -8.202 -0.439 675 HE2 TYR 88 HE2 TYR 88 -7.587 -8.926 3.157 676 HH TYR 88 HH TYR 88 -6.718 -6.957 2.602 677 H GLY 89 HN GLY 89 -6.830 -10.550 -2.227 678 HA2 GLY 89 HA2 GLY 89 -8.342 -8.985 -3.099 679 HA3 GLY 89 HA1 GLY 89 -9.481 -10.322 -3.275 680 H SER 90 HN SER 90 -8.018 -8.451 -0.621 681 HA SER 90 HA SER 90 -9.059 -7.327 1.159 682 HB2 SER 90 HB2 SER 90 -11.763 -8.031 0.118 683 HB3 SER 90 HB1 SER 90 -11.167 -6.485 0.709 684 HG SER 90 HG SER 90 -11.381 -6.348 -1.505 685 H LYS 91 HN LYS 91 -11.062 -7.834 2.769 686 HA LYS 91 HA LYS 91 -11.859 -10.509 3.262 687 HB2 LYS 91 HB2 LYS 91 -9.834 -11.408 3.756 688 HB3 LYS 91 HB1 LYS 91 -9.071 -9.826 3.777 689 HG2 LYS 91 HG2 LYS 91 -10.782 -10.631 6.100 690 HG3 LYS 91 HG1 LYS 91 -9.155 -11.292 5.967 691 HD2 LYS 91 HD2 LYS 91 -8.491 -8.777 5.526 692 HD3 LYS 91 HD1 LYS 91 -10.011 -8.447 6.353 693 HE2 LYS 91 HE2 LYS 91 -7.701 -10.085 7.461 694 HE3 LYS 91 HE1 LYS 91 -8.223 -8.483 8.019 695 HZ1 LYS 91 HZ1 LYS 91 -10.482 -9.506 8.330 696 HZ2 LYS 91 HZ2 LYS 91 -9.291 -10.039 9.419 697 HZ3 LYS 91 HZ3 LYS 91 -9.753 -11.023 8.114 698 H GLY 92 HN GLY 92 -10.976 -7.342 4.506 699 HA2 GLY 92 HA2 GLY 92 -13.092 -6.408 5.744 700 HA3 GLY 92 HA1 GLY 92 -12.752 -7.730 6.863 701 H LEU 93 HN LEU 93 -10.822 -5.194 5.213 702 HA LEU 93 HA LEU 93 -9.072 -4.967 7.559 703 HB2 LEU 93 HB2 LEU 93 -7.653 -4.234 5.957 704 HB3 LEU 93 HB1 LEU 93 -8.926 -4.548 4.784 705 HG LEU 93 HG LEU 93 -8.671 -1.931 6.298 706 HD11 LEU 93 HD11 LEU 93 -7.167 -1.178 4.788 707 HD12 LEU 93 HD12 LEU 93 -8.052 -1.888 3.443 708 HD13 LEU 93 HD13 LEU 93 -6.908 -2.869 4.360 709 HD21 LEU 93 HD21 LEU 93 -9.964 -2.069 3.648 710 HD22 LEU 93 HD22 LEU 93 -10.490 -1.244 5.116 711 HD23 LEU 93 HD23 LEU 93 -10.801 -2.967 4.914 712 H ASP 94 HN ASP 94 -9.034 -3.247 9.004 713 HA ASP 94 HA ASP 94 -11.342 -1.339 8.850 714 HB2 ASP 94 HB2 ASP 94 -11.019 -1.216 11.308 715 HB3 ASP 94 HB1 ASP 94 -11.240 -2.886 10.783 716 H THR 95 HN THR 95 -10.874 0.922 9.097 717 HA THR 95 HA THR 95 -8.243 1.898 9.796 718 HB THR 95 HB THR 95 -7.687 0.802 7.697 719 HG1 THR 95 HG1 THR 95 -6.585 2.447 7.016 720 HG21 THR 95 HG21 THR 95 -9.759 0.631 6.568 721 HG22 THR 95 HG22 THR 95 -8.806 1.743 5.584 722 HG23 THR 95 HG23 THR 95 -10.046 2.369 6.671 723 H ARG 96 HN ARG 96 -7.983 4.246 8.976 724 HA ARG 96 HA ARG 96 -10.466 5.721 9.546 725 HB2 ARG 96 HB2 ARG 96 -7.577 6.439 8.939 726 HB3 ARG 96 HB1 ARG 96 -8.816 7.642 9.318 727 HG2 ARG 96 HG2 ARG 96 -7.980 7.268 11.446 728 HG3 ARG 96 HG1 ARG 96 -9.248 6.044 11.400 729 HD2 ARG 96 HD2 ARG 96 -7.749 4.302 11.283 730 HD3 ARG 96 HD1 ARG 96 -6.580 5.239 10.331 731 HE ARG 96 HE ARG 96 -5.913 6.392 12.398 732 HH11 ARG 96 HH21 ARG 96 -8.600 4.406 13.000 733 HH12 ARG 96 HH22 ARG 96 -8.047 3.854 14.546 734 HH21 ARG 96 HH11 ARG 96 -4.954 5.402 14.287 735 HH22 ARG 96 HH12 ARG 96 -5.983 4.419 15.275 736 H TYR 97 HN TYR 97 -9.502 4.190 6.862 737 HA TYR 97 HA TYR 97 -9.703 6.378 4.906 738 HB2 TYR 97 HB2 TYR 97 -9.377 3.374 4.867 739 HB3 TYR 97 HB1 TYR 97 -9.564 4.294 3.376 740 HD1 TYR 97 HD2 TYR 97 -7.879 5.733 6.335 741 HD2 TYR 97 HD1 TYR 97 -7.318 3.758 2.562 742 HE1 TYR 97 HE2 TYR 97 -5.488 6.315 6.404 743 HE2 TYR 97 HE1 TYR 97 -4.912 4.348 2.633 744 HH TYR 97 HH TYR 97 -3.551 6.388 3.902 745 H SER 98 HN SER 98 -11.512 3.350 5.387 746 HA SER 98 HA SER 98 -14.116 4.299 5.574 747 HB2 SER 98 HB2 SER 98 -12.909 4.869 3.007 748 HB3 SER 98 HB1 SER 98 -14.308 3.813 2.800 749 HG SER 98 HG SER 98 -14.261 6.411 3.316 750 H ASN 99 HN ASN 99 -11.927 1.806 4.939 751 HA ASN 99 HA ASN 99 -12.213 -0.526 5.178 752 HB2 ASN 99 HB2 ASN 99 -15.192 -0.037 5.175 753 HB3 ASN 99 HB1 ASN 99 -14.284 -1.289 6.020 754 HD21 ASN 99 HD21 ASN 99 -12.210 0.840 6.806 755 HD22 ASN 99 HD22 ASN 99 -12.934 1.663 8.100 756 H ILE 100 HN ILE 100 -12.600 1.135 2.550 757 HA ILE 100 HA ILE 100 -13.820 -1.132 1.021 758 HB ILE 100 HB ILE 100 -14.104 1.073 -0.610 759 HG12 ILE 100 HG12 ILE 100 -15.279 2.710 0.966 760 HG13 ILE 100 HG11 ILE 100 -14.438 1.905 2.287 761 HG21 ILE 100 HG21 ILE 100 -16.453 0.884 0.915 762 HG22 ILE 100 HG22 ILE 100 -15.724 -0.720 0.984 763 HG23 ILE 100 HG23 ILE 100 -16.084 0.017 -0.577 764 HD11 ILE 100 HD11 ILE 100 -12.498 2.424 0.281 765 HD12 ILE 100 HD12 ILE 100 -12.631 3.178 1.869 766 HD13 ILE 100 HD13 ILE 100 -13.434 3.905 0.478 767 HA PRO 101 HA PRO 101 -10.189 0.411 -1.630 768 HB2 PRO 101 HB2 PRO 101 -7.914 1.122 -0.346 769 HB3 PRO 101 HB1 PRO 101 -9.191 2.285 -0.730 770 HG2 PRO 101 HG2 PRO 101 -8.524 1.007 1.857 771 HG3 PRO 101 HG1 PRO 101 -9.160 2.623 1.522 772 HD2 PRO 101 HD2 PRO 101 -10.652 0.452 2.409 773 HD3 PRO 101 HD1 PRO 101 -11.292 1.919 1.654 774 H LEU 102 HN LEU 102 -10.345 -2.000 -1.769 775 HA LEU 102 HA LEU 102 -7.838 -3.321 -0.848 776 HB2 LEU 102 HB2 LEU 102 -10.441 -3.586 0.335 777 HB3 LEU 102 HB1 LEU 102 -10.037 -5.111 -0.449 778 HG LEU 102 HG LEU 102 -8.000 -5.316 0.824 779 HD11 LEU 102 HD11 LEU 102 -7.222 -3.025 0.839 780 HD12 LEU 102 HD12 LEU 102 -7.417 -3.531 2.516 781 HD13 LEU 102 HD13 LEU 102 -8.635 -2.505 1.758 782 HD21 LEU 102 HD21 LEU 102 -9.069 -5.958 2.720 783 HD22 LEU 102 HD22 LEU 102 -10.527 -5.317 1.965 784 HD23 LEU 102 HD23 LEU 102 -9.594 -4.312 3.070 785 H LEU 103 HN LEU 103 -7.162 -4.976 -2.352 786 HA LEU 103 HA LEU 103 -9.014 -6.227 -4.192 787 HB2 LEU 103 HB2 LEU 103 -8.073 -4.909 -6.231 788 HB3 LEU 103 HB1 LEU 103 -9.315 -4.157 -5.234 789 HG LEU 103 HG LEU 103 -7.258 -3.189 -3.898 790 HD11 LEU 103 HD11 LEU 103 -5.641 -4.598 -5.252 791 HD12 LEU 103 HD12 LEU 103 -5.270 -2.873 -5.217 792 HD13 LEU 103 HD13 LEU 103 -6.037 -3.582 -6.639 793 HD21 LEU 103 HD21 LEU 103 -7.334 -1.808 -6.468 794 HD22 LEU 103 HD22 LEU 103 -7.885 -1.258 -4.886 795 HD23 LEU 103 HD23 LEU 103 -8.942 -2.246 -5.894 796 H THR 104 HN THR 104 -7.569 -6.818 -6.379 797 HA THR 104 HA THR 104 -5.016 -7.973 -5.353 798 HB THR 104 HB THR 104 -6.386 -9.839 -5.637 799 HG1 THR 104 HG1 THR 104 -5.537 -9.393 -8.297 800 HG21 THR 104 HG21 THR 104 -8.423 -8.836 -6.334 801 HG22 THR 104 HG22 THR 104 -8.015 -9.980 -7.611 802 HG23 THR 104 HG23 THR 104 -7.713 -8.260 -7.842 803 H LYS 105 HN LYS 105 -5.664 -5.448 -6.935 804 HA LYS 105 HA LYS 105 -4.648 -4.204 -8.646 805 HB2 LYS 105 HB2 LYS 105 -2.803 -6.531 -8.212 806 HB3 LYS 105 HB1 LYS 105 -2.456 -5.347 -9.470 807 HG2 LYS 105 HG2 LYS 105 -1.780 -3.830 -7.957 808 HG3 LYS 105 HG1 LYS 105 -3.259 -4.036 -7.013 809 HD2 LYS 105 HD2 LYS 105 -0.888 -5.910 -6.938 810 HD3 LYS 105 HD1 LYS 105 -1.228 -4.677 -5.722 811 HE2 LYS 105 HE2 LYS 105 -2.479 -6.255 -4.672 812 HE3 LYS 105 HE1 LYS 105 -3.639 -6.075 -5.992 813 HZ1 LYS 105 HZ1 LYS 105 -2.432 -8.372 -5.505 814 HZ2 LYS 105 HZ2 LYS 105 -1.251 -7.682 -6.509 815 HZ3 LYS 105 HZ3 LYS 105 -2.831 -7.905 -7.081 816 HA PRO 106 HA PRO 106 -6.123 -7.217 -11.964 817 HB2 PRO 106 HB2 PRO 106 -8.825 -6.787 -11.952 818 HB3 PRO 106 HB1 PRO 106 -8.062 -8.084 -11.011 819 HG2 PRO 106 HG2 PRO 106 -9.091 -5.454 -10.116 820 HG3 PRO 106 HG1 PRO 106 -9.082 -7.009 -9.275 821 HD2 PRO 106 HD2 PRO 106 -7.309 -4.947 -8.784 822 HD3 PRO 106 HD1 PRO 106 -7.024 -6.651 -8.388 823 H PHE 107 HN PHE 107 -6.150 -4.032 -11.004 824 HA PHE 107 HA PHE 107 -6.466 -1.968 -12.079 825 HB2 PHE 107 HB2 PHE 107 -5.225 -3.910 -13.984 826 HB3 PHE 107 HB1 PHE 107 -5.667 -2.312 -14.596 827 HD1 PHE 107 HD1 PHE 107 -4.185 -3.725 -11.443 828 HD2 PHE 107 HD2 PHE 107 -3.965 -0.718 -14.505 829 HE1 PHE 107 HE1 PHE 107 -2.205 -2.739 -10.326 830 HE2 PHE 107 HE2 PHE 107 -1.980 0.267 -13.388 831 HZ PHE 107 HZ PHE 107 -1.096 -0.737 -11.298 832 H LEU 108 HN LEU 108 -8.776 -3.761 -11.940 833 HA LEU 108 HA LEU 108 -10.413 -2.519 -14.097 834 HB2 LEU 108 HB2 LEU 108 -9.722 -5.352 -13.686 835 HB3 LEU 108 HB1 LEU 108 -11.460 -5.078 -13.779 836 HG LEU 108 HG LEU 108 -10.713 -5.468 -16.022 837 HD11 LEU 108 HD11 LEU 108 -11.923 -3.755 -16.838 838 HD12 LEU 108 HD12 LEU 108 -10.668 -2.594 -16.405 839 HD13 LEU 108 HD13 LEU 108 -11.891 -3.052 -15.222 840 HD21 LEU 108 HD21 LEU 108 -8.872 -3.250 -16.340 841 HD22 LEU 108 HD22 LEU 108 -8.634 -4.956 -16.720 842 HD23 LEU 108 HD23 LEU 108 -8.307 -4.361 -15.095 843 H ASP 109 HN ASP 109 -11.539 -1.200 -12.622 844 HA ASP 109 HA ASP 109 -13.130 -0.665 -10.968 845 HB2 ASP 109 HB2 ASP 109 -14.447 -2.423 -12.014 846 HB3 ASP 109 HB1 ASP 109 -13.552 -3.663 -11.139 847 H SER 110 HN SER 110 -10.291 -2.089 -10.429 848 HA SER 110 HA SER 110 -10.713 -2.623 -7.519 849 HB2 SER 110 HB2 SER 110 -9.095 -3.680 -9.691 850 HB3 SER 110 HB1 SER 110 -8.107 -3.280 -8.290 851 HG SER 110 HG SER 110 -10.499 -4.545 -7.733 852 H GLU 111 HN GLU 111 -7.797 -1.521 -9.238 853 HA GLU 111 HA GLU 111 -6.527 -0.001 -7.400 854 HB2 GLU 111 HB2 GLU 111 -6.541 -0.234 -10.154 855 HB3 GLU 111 HB1 GLU 111 -6.872 1.483 -9.915 856 HG2 GLU 111 HG2 GLU 111 -4.908 1.574 -8.348 857 HG3 GLU 111 HG1 GLU 111 -4.533 -0.089 -8.802 858 H LEU 112 HN LEU 112 -9.386 1.123 -9.194 859 HA LEU 112 HA LEU 112 -9.588 3.769 -8.367 860 HB2 LEU 112 HB2 LEU 112 -12.171 3.040 -8.195 861 HB3 LEU 112 HB1 LEU 112 -11.332 3.154 -9.737 862 HG LEU 112 HG LEU 112 -11.022 0.550 -8.402 863 HD11 LEU 112 HD11 LEU 112 -13.605 0.543 -9.683 864 HD12 LEU 112 HD12 LEU 112 -13.603 1.732 -8.382 865 HD13 LEU 112 HD13 LEU 112 -13.192 0.053 -8.040 866 HD21 LEU 112 HD21 LEU 112 -12.215 0.933 -11.107 867 HD22 LEU 112 HD22 LEU 112 -10.930 -0.160 -10.593 868 HD23 LEU 112 HD23 LEU 112 -10.579 1.543 -10.869 869 H GLU 113 HN GLU 113 -11.336 1.185 -6.564 870 HA GLU 113 HA GLU 113 -11.992 2.593 -4.278 871 HB2 GLU 113 HB2 GLU 113 -12.153 0.474 -3.208 872 HB3 GLU 113 HB1 GLU 113 -12.378 0.128 -4.924 873 HG2 GLU 113 HG2 GLU 113 -9.878 -0.345 -5.023 874 HG3 GLU 113 HG1 GLU 113 -9.882 -0.285 -3.268 875 H ALA 114 HN ALA 114 -8.780 1.404 -5.144 876 HA ALA 114 HA ALA 114 -7.461 1.674 -2.651 877 HB1 ALA 114 HB1 ALA 114 -6.831 1.057 -5.263 878 HB2 ALA 114 HB2 ALA 114 -5.654 1.220 -3.960 879 HB3 ALA 114 HB3 ALA 114 -5.979 2.584 -5.030 880 H VAL 115 HN VAL 115 -7.917 4.118 -5.237 881 HA VAL 115 HA VAL 115 -7.010 6.229 -3.321 882 HB VAL 115 HB VAL 115 -7.425 6.226 -6.330 883 HG11 VAL 115 HG11 VAL 115 -5.830 8.299 -5.963 884 HG12 VAL 115 HG12 VAL 115 -6.525 8.289 -4.342 885 HG13 VAL 115 HG13 VAL 115 -7.571 8.480 -5.749 886 HG21 VAL 115 HG21 VAL 115 -5.346 5.147 -4.697 887 HG22 VAL 115 HG22 VAL 115 -4.708 6.584 -5.496 888 HG23 VAL 115 HG23 VAL 115 -5.389 5.270 -6.456 889 H LEU 116 HN LEU 116 -9.772 5.112 -5.180 890 HA LEU 116 HA LEU 116 -11.355 7.508 -5.049 891 HB2 LEU 116 HB2 LEU 116 -11.484 4.940 -6.132 892 HB3 LEU 116 HB1 LEU 116 -12.827 4.990 -4.990 893 HG LEU 116 HG LEU 116 -12.329 7.252 -6.913 894 HD11 LEU 116 HD11 LEU 116 -13.611 4.585 -7.398 895 HD12 LEU 116 HD12 LEU 116 -12.625 5.563 -8.484 896 HD13 LEU 116 HD13 LEU 116 -14.300 6.014 -8.168 897 HD21 LEU 116 HD21 LEU 116 -14.730 6.213 -5.381 898 HD22 LEU 116 HD22 LEU 116 -14.798 7.533 -6.549 899 HD23 LEU 116 HD23 LEU 116 -13.847 7.709 -5.073 900 H VAL 117 HN VAL 117 -10.587 5.073 -2.709 901 HA VAL 117 HA VAL 117 -12.803 5.106 -0.973 902 HB VAL 117 HB VAL 117 -11.034 3.590 -0.564 903 HG11 VAL 117 HG11 VAL 117 -8.776 5.101 0.147 904 HG12 VAL 117 HG12 VAL 117 -9.410 5.878 -1.305 905 HG13 VAL 117 HG13 VAL 117 -8.997 4.164 -1.331 906 HG21 VAL 117 HG21 VAL 117 -11.903 5.224 1.458 907 HG22 VAL 117 HG22 VAL 117 -10.154 5.422 1.580 908 HG23 VAL 117 HG23 VAL 117 -10.870 3.814 1.698 909 H GLN 118 HN GLN 118 -10.646 7.699 -1.740 910 HA GLN 118 HA GLN 118 -11.868 9.316 0.460 911 HB2 GLN 118 HB2 GLN 118 -9.387 10.446 0.117 912 HB3 GLN 118 HB1 GLN 118 -9.772 9.264 1.361 913 HG2 GLN 118 HG2 GLN 118 -8.722 7.528 0.232 914 HG3 GLN 118 HG1 GLN 118 -8.955 8.275 -1.348 915 HE21 GLN 118 HE21 GLN 118 -7.290 9.619 -2.147 916 HE22 GLN 118 HE22 GLN 118 -5.884 9.998 -1.274 917 H ILE 119 HN ILE 119 -10.321 9.318 -2.745 918 HA ILE 119 HA ILE 119 -10.684 10.753 -4.596 919 HB ILE 119 HB ILE 119 -12.899 11.964 -2.984 920 HG12 ILE 119 HG12 ILE 119 -13.817 9.777 -4.617 921 HG13 ILE 119 HG11 ILE 119 -12.601 9.189 -3.485 922 HG21 ILE 119 HG21 ILE 119 -12.182 12.769 -5.317 923 HG22 ILE 119 HG22 ILE 119 -13.892 12.397 -5.095 924 HG23 ILE 119 HG23 ILE 119 -12.838 11.242 -5.911 925 HD11 ILE 119 HD11 ILE 119 -15.327 10.129 -2.963 926 HD12 ILE 119 HD12 ILE 119 -14.126 10.895 -1.923 927 HD13 ILE 119 HD13 ILE 119 -14.271 9.138 -1.958 928 H SER 120 HN SER 120 -11.572 12.628 -1.704 929 HA SER 120 HA SER 120 -9.246 14.428 -2.118 930 HB2 SER 120 HB2 SER 120 -11.599 16.010 -1.661 931 HB3 SER 120 HB1 SER 120 -10.528 16.037 -3.057 932 HG SER 120 HG SER 120 -12.993 14.900 -2.745 933 H LYS 121 HN LYS 121 -12.321 14.598 -0.310 934 HA LYS 121 HA LYS 121 -12.724 14.721 2.010 935 HB2 LYS 121 HB2 LYS 121 -10.704 12.770 1.472 936 HB3 LYS 121 HB1 LYS 121 -10.240 13.622 2.946 937 HG2 LYS 121 HG2 LYS 121 -12.128 12.938 4.105 938 HG3 LYS 121 HG1 LYS 121 -13.092 12.760 2.639 939 HD2 LYS 121 HD2 LYS 121 -12.286 10.639 2.198 940 HD3 LYS 121 HD1 LYS 121 -10.727 10.960 2.959 941 HE2 LYS 121 HE2 LYS 121 -11.459 9.992 4.868 942 HE3 LYS 121 HE1 LYS 121 -12.789 11.163 4.959 943 HZ1 LYS 121 HZ1 LYS 121 -13.701 9.697 3.003 944 HZ2 LYS 121 HZ2 LYS 121 -13.973 9.255 4.621 945 HZ3 LYS 121 HZ3 LYS 121 -12.739 8.503 3.728 946 H GLU 122 HN GLU 122 -12.606 16.910 2.501 947 HA GLU 122 HA GLU 122 -11.656 19.017 2.998 948 HB2 GLU 122 HB2 GLU 122 -10.269 18.865 4.974 949 HB3 GLU 122 HB1 GLU 122 -11.431 17.544 5.059 950 HG2 GLU 122 HG2 GLU 122 -9.804 15.937 4.388 951 HG3 GLU 122 HG1 GLU 122 -8.664 17.188 3.892 952 H VAL 123 HN VAL 123 -10.755 17.834 0.584 953 HA VAL 123 HA VAL 123 -8.183 17.477 -0.091 954 HB VAL 123 HB VAL 123 -9.908 17.710 -1.745 955 HG11 VAL 123 HG11 VAL 123 -10.280 20.532 -1.916 956 HG12 VAL 123 HG12 VAL 123 -10.526 20.066 -0.233 957 HG13 VAL 123 HG13 VAL 123 -11.478 19.303 -1.508 958 HG21 VAL 123 HG21 VAL 123 -8.553 20.120 -2.659 959 HG22 VAL 123 HG22 VAL 123 -8.481 18.486 -3.316 960 HG23 VAL 123 HG23 VAL 123 -7.406 18.954 -2.000
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