NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
626228 | 5y4b | 36111 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 36 HT1 MET 36 -17.465 5.003 -6.402 2 H2 MET 36 HT2 MET 36 -16.144 5.496 -5.455 3 H3 MET 36 HT3 MET 36 -17.729 5.678 -4.869 4 HA MET 36 HA MET 36 -16.006 3.505 -4.544 5 HB2 MET 36 HB2 MET 36 -18.719 4.389 -3.685 6 HB3 MET 36 HB1 MET 36 -18.332 2.682 -3.469 7 HG2 MET 36 HG2 MET 36 -17.696 3.893 -1.457 8 HG3 MET 36 HG1 MET 36 -16.234 3.358 -2.285 9 HE1 MET 36 HE1 MET 36 -15.826 6.667 -0.359 10 HE2 MET 36 HE2 MET 36 -14.535 5.735 -1.113 11 HE3 MET 36 HE3 MET 36 -15.860 4.898 -0.305 12 HA PRO 37 HA PRO 37 -19.198 0.741 -6.839 13 HB2 PRO 37 HB2 PRO 37 -21.291 2.010 -8.098 14 HB3 PRO 37 HB1 PRO 37 -21.365 1.398 -6.433 15 HG2 PRO 37 HG2 PRO 37 -20.883 4.173 -7.411 16 HG3 PRO 37 HG1 PRO 37 -21.871 3.612 -6.049 17 HD2 PRO 37 HD2 PRO 37 -19.398 4.664 -5.685 18 HD3 PRO 37 HD1 PRO 37 -20.037 3.376 -4.638 19 H VAL 38 HN VAL 38 -18.322 3.861 -8.141 20 HA VAL 38 HA VAL 38 -17.471 2.563 -10.634 21 HB VAL 38 HB VAL 38 -19.584 3.502 -11.267 22 HG11 VAL 38 HG11 VAL 38 -18.792 5.545 -9.334 23 HG12 VAL 38 HG12 VAL 38 -20.403 5.101 -9.900 24 HG13 VAL 38 HG13 VAL 38 -19.425 6.240 -10.824 25 HG21 VAL 38 HG21 VAL 38 -18.198 3.999 -13.066 26 HG22 VAL 38 HG22 VAL 38 -17.113 4.987 -12.088 27 HG23 VAL 38 HG23 VAL 38 -18.669 5.637 -12.605 28 H THR 39 HN THR 39 -15.584 3.334 -11.438 29 HA THR 39 HA THR 39 -14.263 5.464 -9.875 30 HB THR 39 HB THR 39 -13.037 3.239 -11.528 31 HG1 THR 39 HG1 THR 39 -12.897 3.645 -8.739 32 HG21 THR 39 HG21 THR 39 -11.692 5.302 -11.507 33 HG22 THR 39 HG22 THR 39 -10.923 4.042 -10.541 34 HG23 THR 39 HG23 THR 39 -11.799 5.352 -9.748 35 H GLU 40 HN GLU 40 -13.638 7.294 -10.874 36 HA GLU 40 HA GLU 40 -14.621 7.979 -13.408 37 HB2 GLU 40 HB2 GLU 40 -13.925 9.576 -11.586 38 HB3 GLU 40 HB1 GLU 40 -12.248 9.230 -12.006 39 HG2 GLU 40 HG2 GLU 40 -12.826 11.201 -13.210 40 HG3 GLU 40 HG1 GLU 40 -12.845 9.901 -14.393 41 H GLN 41 HN GLN 41 -11.347 6.961 -12.391 42 HA GLN 41 HA GLN 41 -10.155 7.206 -14.957 43 HB2 GLN 41 HB2 GLN 41 -9.432 5.574 -12.515 44 HB3 GLN 41 HB1 GLN 41 -8.432 5.618 -13.969 45 HG2 GLN 41 HG2 GLN 41 -7.541 7.304 -12.533 46 HG3 GLN 41 HG1 GLN 41 -8.480 8.166 -13.751 47 HE21 GLN 41 HE21 GLN 41 -9.367 9.922 -12.617 48 HE22 GLN 41 HE22 GLN 41 -10.242 9.781 -11.171 49 H GLY 42 HN GLY 42 -11.696 4.533 -13.257 50 HA2 GLY 42 HA2 GLY 42 -11.242 2.538 -15.233 51 HA3 GLY 42 HA1 GLY 42 -12.427 2.458 -13.931 52 H LEU 43 HN LEU 43 -13.635 5.010 -14.785 53 HA LEU 43 HA LEU 43 -15.729 4.021 -16.356 54 HB2 LEU 43 HB2 LEU 43 -15.894 6.034 -14.881 55 HB3 LEU 43 HB1 LEU 43 -14.877 6.908 -16.023 56 HG LEU 43 HG LEU 43 -16.501 6.567 -17.801 57 HD11 LEU 43 HD11 LEU 43 -18.084 5.100 -15.681 58 HD12 LEU 43 HD12 LEU 43 -17.350 4.387 -17.120 59 HD13 LEU 43 HD13 LEU 43 -18.690 5.523 -17.283 60 HD21 LEU 43 HD21 LEU 43 -18.547 7.540 -16.156 61 HD22 LEU 43 HD22 LEU 43 -17.329 8.509 -16.986 62 HD23 LEU 43 HD23 LEU 43 -17.057 7.989 -15.323 63 H ARG 44 HN ARG 44 -12.840 5.848 -17.271 64 HA ARG 44 HA ARG 44 -13.503 6.318 -19.954 65 HB2 ARG 44 HB2 ARG 44 -11.581 7.353 -18.780 66 HB3 ARG 44 HB1 ARG 44 -10.770 5.786 -18.759 67 HG2 ARG 44 HG2 ARG 44 -10.763 5.718 -21.203 68 HG3 ARG 44 HG1 ARG 44 -11.652 7.239 -21.272 69 HD2 ARG 44 HD2 ARG 44 -9.277 7.673 -21.629 70 HD3 ARG 44 HD1 ARG 44 -9.771 8.358 -20.084 71 HE ARG 44 HE ARG 44 -8.428 6.782 -19.001 72 HH11 ARG 44 HH11 ARG 44 -8.793 6.073 -22.368 73 HH12 ARG 44 HH12 ARG 44 -7.565 4.852 -22.386 74 HH21 ARG 44 HH21 ARG 44 -6.815 5.184 -19.017 75 HH22 ARG 44 HH22 ARG 44 -6.444 4.348 -20.488 76 H GLU 45 HN GLU 45 -11.897 3.563 -18.403 77 HA GLU 45 HA GLU 45 -11.368 2.118 -20.778 78 HB2 GLU 45 HB2 GLU 45 -11.668 1.227 -17.900 79 HB3 GLU 45 HB1 GLU 45 -11.175 0.150 -19.205 80 HG2 GLU 45 HG2 GLU 45 -9.242 1.574 -19.691 81 HG3 GLU 45 HG1 GLU 45 -9.750 2.718 -18.448 82 H ARG 46 HN ARG 46 -14.092 2.159 -18.531 83 HA ARG 46 HA ARG 46 -15.498 -0.021 -19.650 84 HB2 ARG 46 HB2 ARG 46 -15.968 0.875 -17.394 85 HB3 ARG 46 HB1 ARG 46 -16.583 2.362 -18.119 86 HG2 ARG 46 HG2 ARG 46 -18.365 1.156 -19.230 87 HG3 ARG 46 HG1 ARG 46 -17.693 -0.394 -18.716 88 HD2 ARG 46 HD2 ARG 46 -18.635 1.757 -16.802 89 HD3 ARG 46 HD1 ARG 46 -19.625 0.389 -17.310 90 HE ARG 46 HE ARG 46 -17.205 -0.645 -16.356 91 HH11 ARG 46 HH11 ARG 46 -19.930 1.157 -15.230 92 HH12 ARG 46 HH12 ARG 46 -19.829 0.566 -13.607 93 HH21 ARG 46 HH21 ARG 46 -17.072 -1.437 -14.229 94 HH22 ARG 46 HH22 ARG 46 -18.214 -0.906 -13.040 95 H ILE 47 HN ILE 47 -15.587 3.460 -20.212 96 HA ILE 47 HA ILE 47 -17.718 3.450 -22.046 97 HB ILE 47 HB ILE 47 -15.396 5.347 -21.680 98 HG12 ILE 47 HG12 ILE 47 -17.043 5.137 -19.841 99 HG13 ILE 47 HG11 ILE 47 -17.068 6.731 -20.598 100 HG21 ILE 47 HG21 ILE 47 -16.645 6.915 -23.075 101 HG22 ILE 47 HG22 ILE 47 -17.905 5.710 -23.338 102 HG23 ILE 47 HG23 ILE 47 -16.288 5.454 -23.996 103 HD11 ILE 47 HD1 ILE 47 -19.248 4.953 -20.262 104 HD12 ILE 47 HD2 ILE 47 -18.886 4.973 -21.988 105 HD13 ILE 47 HD3 ILE 47 -19.241 6.480 -21.141 106 H GLU 48 HN GLU 48 -14.228 3.198 -22.462 107 HA GLU 48 HA GLU 48 -14.168 3.178 -25.273 108 HB2 GLU 48 HB2 GLU 48 -12.164 3.471 -23.879 109 HB3 GLU 48 HB1 GLU 48 -12.302 1.805 -23.310 110 HG2 GLU 48 HG2 GLU 48 -12.076 1.013 -25.673 111 HG3 GLU 48 HG1 GLU 48 -11.917 2.688 -26.197 112 H SER 49 HN SER 49 -14.567 0.614 -22.880 113 HA SER 49 HA SER 49 -14.764 -1.439 -24.920 114 HB2 SER 49 HB2 SER 49 -15.103 -2.971 -23.064 115 HB3 SER 49 HB1 SER 49 -13.751 -1.905 -22.690 116 HG SER 49 HG SER 49 -15.943 -2.286 -21.291 117 H ALA 50 HN ALA 50 -16.835 0.879 -23.558 118 HA ALA 50 HA ALA 50 -19.230 -0.785 -23.891 119 HB1 ALA 50 HB1 ALA 50 -18.909 2.090 -22.993 120 HB2 ALA 50 HB2 ALA 50 -19.107 0.694 -21.935 121 HB3 ALA 50 HB3 ALA 50 -20.423 1.187 -23.001 122 H ILE 51 HN ILE 51 -17.267 1.239 -25.739 123 HA ILE 51 HA ILE 51 -19.286 1.324 -27.853 124 HB ILE 51 HB ILE 51 -19.289 3.629 -28.168 125 HG12 ILE 51 HG12 ILE 51 -16.821 3.862 -26.400 126 HG13 ILE 51 HG11 ILE 51 -16.781 3.839 -28.169 127 HG21 ILE 51 HG21 ILE 51 -19.884 4.598 -26.070 128 HG22 ILE 51 HG22 ILE 51 -18.818 3.507 -25.183 129 HG23 ILE 51 HG23 ILE 51 -20.286 2.886 -25.939 130 HD11 ILE 51 HD1 ILE 51 -18.207 5.830 -28.244 131 HD12 ILE 51 HD2 ILE 51 -16.751 6.148 -27.298 132 HD13 ILE 51 HD3 ILE 51 -18.287 5.856 -26.483 133 HA PRO 52 HA PRO 52 -15.931 0.413 -30.507 134 HB2 PRO 52 HB2 PRO 52 -16.384 2.174 -32.613 135 HB3 PRO 52 HB1 PRO 52 -17.240 0.635 -32.385 136 HG2 PRO 52 HG2 PRO 52 -18.092 3.402 -31.658 137 HG3 PRO 52 HG1 PRO 52 -19.040 2.078 -32.361 138 HD2 PRO 52 HD2 PRO 52 -19.238 2.671 -29.748 139 HD3 PRO 52 HD1 PRO 52 -19.277 0.980 -30.309 140 H GLN 53 HN GLN 53 -13.822 0.979 -30.672 141 HA GLN 53 HA GLN 53 -12.618 2.972 -29.290 142 HB2 GLN 53 HB2 GLN 53 -10.769 2.833 -31.077 143 HB3 GLN 53 HB1 GLN 53 -11.216 1.337 -30.243 144 HG2 GLN 53 HG2 GLN 53 -12.729 0.762 -32.127 145 HG3 GLN 53 HG1 GLN 53 -12.241 2.235 -32.960 146 HE21 GLN 53 HE21 GLN 53 -10.853 1.625 -34.633 147 HE22 GLN 53 HE22 GLN 53 -9.584 0.509 -34.478 148 H VAL 54 HN VAL 54 -13.895 4.845 -29.392 149 HA VAL 54 HA VAL 54 -14.397 6.252 -31.815 150 HB VAL 54 HB VAL 54 -15.066 8.106 -30.351 151 HG11 VAL 54 HG11 VAL 54 -16.870 6.956 -29.222 152 HG12 VAL 54 HG12 VAL 54 -15.959 5.442 -29.204 153 HG13 VAL 54 HG13 VAL 54 -16.547 6.101 -30.730 154 HG21 VAL 54 HG21 VAL 54 -13.748 8.305 -28.501 155 HG22 VAL 54 HG22 VAL 54 -13.402 6.577 -28.443 156 HG23 VAL 54 HG23 VAL 54 -14.914 7.196 -27.780 157 H TYR 55 HN TYR 55 -13.666 8.706 -31.730 158 HA TYR 55 HA TYR 55 -10.934 8.713 -32.465 159 HB2 TYR 55 HB2 TYR 55 -12.853 10.963 -31.851 160 HB3 TYR 55 HB1 TYR 55 -11.196 11.242 -32.390 161 HD1 TYR 55 HD1 TYR 55 -14.485 9.863 -33.324 162 HD2 TYR 55 HD2 TYR 55 -10.500 10.729 -34.658 163 HE1 TYR 55 HE1 TYR 55 -15.191 9.482 -35.672 164 HE2 TYR 55 HE2 TYR 55 -11.200 10.348 -37.006 165 HH TYR 55 HH TYR 55 -14.511 9.291 -37.785 166 H HIS 56 HN HIS 56 -12.567 9.841 -29.523 167 HA HIS 56 HA HIS 56 -10.196 9.382 -27.955 168 HB2 HIS 56 HB2 HIS 56 -9.716 11.602 -28.976 169 HB3 HIS 56 HB1 HIS 56 -11.181 12.227 -28.210 170 HD2 HIS 56 HD2 HIS 56 -7.534 11.196 -27.206 171 HE1 HIS 56 HE1 HIS 56 -9.486 12.596 -23.734 172 HE2 HIS 56 HE2 HIS 56 -7.253 11.867 -24.698 173 H ILE 57 HN ILE 57 -10.682 9.062 -25.836 174 HA ILE 57 HA ILE 57 -13.435 9.722 -24.975 175 HB ILE 57 HB ILE 57 -11.810 7.250 -24.324 176 HG12 ILE 57 HG12 ILE 57 -14.511 7.496 -25.663 177 HG13 ILE 57 HG11 ILE 57 -13.000 7.427 -26.573 178 HG21 ILE 57 HG21 ILE 57 -14.635 7.841 -23.447 179 HG22 ILE 57 HG22 ILE 57 -13.250 8.300 -22.456 180 HG23 ILE 57 HG23 ILE 57 -13.534 6.602 -22.843 181 HD11 ILE 57 HD1 ILE 57 -13.940 5.333 -24.592 182 HD12 ILE 57 HD2 ILE 57 -12.470 5.256 -25.563 183 HD13 ILE 57 HD3 ILE 57 -14.048 5.189 -26.347 184 H ILE 58 HN ILE 58 -13.539 11.004 -23.243 185 HA ILE 58 HA ILE 58 -11.262 10.999 -21.359 186 HB ILE 58 HB ILE 58 -11.157 12.982 -22.886 187 HG12 ILE 58 HG12 ILE 58 -11.903 13.758 -20.054 188 HG13 ILE 58 HG11 ILE 58 -10.377 12.973 -20.461 189 HG21 ILE 58 HG21 ILE 58 -13.940 13.001 -22.421 190 HG22 ILE 58 HG22 ILE 58 -13.009 14.180 -23.344 191 HG23 ILE 58 HG23 ILE 58 -13.312 14.443 -21.626 192 HD11 ILE 58 HD1 ILE 58 -10.545 15.615 -20.389 193 HD12 ILE 58 HD2 ILE 58 -11.199 15.400 -22.013 194 HD13 ILE 58 HD3 ILE 58 -9.581 14.814 -21.629 195 H VAL 59 HN VAL 59 -11.848 10.829 -19.271 196 HA VAL 59 HA VAL 59 -14.703 11.266 -18.622 197 HB VAL 59 HB VAL 59 -12.767 9.287 -17.399 198 HG11 VAL 59 HG11 VAL 59 -14.175 9.435 -15.639 199 HG12 VAL 59 HG12 VAL 59 -15.346 8.607 -16.664 200 HG13 VAL 59 HG13 VAL 59 -15.357 10.367 -16.558 201 HG21 VAL 59 HG21 VAL 59 -14.703 7.757 -18.400 202 HG22 VAL 59 HG22 VAL 59 -13.342 8.271 -19.397 203 HG23 VAL 59 HG23 VAL 59 -14.885 9.119 -19.506 204 H THR 60 HN THR 60 -15.039 12.911 -17.284 205 HA THR 60 HA THR 60 -12.978 13.550 -15.268 206 HB THR 60 HB THR 60 -14.533 15.553 -16.922 207 HG1 THR 60 HG1 THR 60 -12.799 14.562 -18.017 208 HG21 THR 60 HG21 THR 60 -13.006 17.174 -15.736 209 HG22 THR 60 HG22 THR 60 -12.526 15.849 -14.674 210 HG23 THR 60 HG23 THR 60 -14.200 16.405 -14.689 211 H ASP 61 HN ASP 61 -13.739 13.779 -13.247 212 HA ASP 61 HA ASP 61 -16.618 13.516 -12.824 213 HB2 ASP 61 HB2 ASP 61 -15.059 12.094 -11.538 214 HB3 ASP 61 HB1 ASP 61 -14.348 13.542 -10.821 215 H LEU 62 HN LEU 62 -17.780 15.336 -12.825 216 HA LEU 62 HA LEU 62 -16.744 17.930 -12.461 217 HB2 LEU 62 HB2 LEU 62 -18.855 17.506 -13.630 218 HB3 LEU 62 HB1 LEU 62 -19.585 16.939 -12.126 219 HG LEU 62 HG LEU 62 -19.227 19.147 -11.105 220 HD11 LEU 62 HD11 LEU 62 -18.018 19.776 -13.810 221 HD12 LEU 62 HD12 LEU 62 -17.232 19.879 -12.234 222 HD13 LEU 62 HD13 LEU 62 -18.509 21.019 -12.659 223 HD21 LEU 62 HD21 LEU 62 -20.956 20.295 -12.276 224 HD22 LEU 62 HD22 LEU 62 -21.272 18.584 -12.562 225 HD23 LEU 62 HD23 LEU 62 -20.505 19.559 -13.814 226 H SER 63 HN SER 63 -18.418 15.744 -10.212 227 HA SER 63 HA SER 63 -18.388 17.596 -8.029 228 HB2 SER 63 HB2 SER 63 -19.175 15.748 -6.698 229 HB3 SER 63 HB1 SER 63 -19.987 15.679 -8.260 230 HG SER 63 HG SER 63 -18.969 13.882 -8.701 231 H TYR 64 HN TYR 64 -17.201 17.251 -6.007 232 HA TYR 64 HA TYR 64 -14.405 17.017 -6.457 233 HB2 TYR 64 HB2 TYR 64 -15.332 18.437 -4.680 234 HB3 TYR 64 HB1 TYR 64 -15.964 17.007 -3.858 235 HD1 TYR 64 HD1 TYR 64 -12.839 18.688 -4.980 236 HD2 TYR 64 HD2 TYR 64 -14.567 15.643 -2.493 237 HE1 TYR 64 HE1 TYR 64 -10.649 18.361 -3.860 238 HE2 TYR 64 HE2 TYR 64 -12.379 15.315 -1.373 239 HH TYR 64 HH TYR 64 -10.003 17.387 -1.343 240 H GLY 65 HN GLY 65 -13.104 15.287 -6.392 241 HA2 GLY 65 HA2 GLY 65 -12.411 13.100 -6.215 242 HA3 GLY 65 HA1 GLY 65 -13.316 13.078 -4.702 243 H CYS 66 HN CYS 66 -14.464 11.231 -4.737 244 HA CYS 66 HA CYS 66 -15.671 10.256 -7.195 245 HB2 CYS 66 HB2 CYS 66 -16.213 8.296 -5.964 246 HB3 CYS 66 HB1 CYS 66 -14.620 8.789 -5.385 247 HG CYS 66 HG CYS 66 -15.938 8.472 -3.219 248 H GLY 67 HN GLY 67 -17.948 9.832 -7.412 249 HA2 GLY 67 HA2 GLY 67 -19.947 10.601 -5.620 250 HA3 GLY 67 HA1 GLY 67 -19.602 12.002 -6.634 251 H GLN 68 HN GLN 68 -22.096 10.963 -6.767 252 HA GLN 68 HA GLN 68 -22.409 8.963 -8.788 253 HB2 GLN 68 HB2 GLN 68 -24.763 9.553 -8.735 254 HB3 GLN 68 HB1 GLN 68 -24.142 9.475 -7.086 255 HG2 GLN 68 HG2 GLN 68 -23.856 11.925 -7.075 256 HG3 GLN 68 HG1 GLN 68 -24.484 12.006 -8.721 257 HE21 GLN 68 HE21 GLN 68 -26.118 13.476 -7.430 258 HE22 GLN 68 HE22 GLN 68 -27.484 12.687 -6.804 259 H SER 69 HN SER 69 -22.230 12.480 -8.787 260 HA SER 69 HA SER 69 -23.103 12.830 -11.484 261 HB2 SER 69 HB2 SER 69 -23.191 14.669 -9.882 262 HB3 SER 69 HB1 SER 69 -21.442 14.615 -9.693 263 HG SER 69 HG SER 69 -22.197 16.216 -11.202 264 H PHE 70 HN PHE 70 -22.004 12.758 -13.345 265 HA PHE 70 HA PHE 70 -19.069 12.636 -13.284 266 HB2 PHE 70 HB2 PHE 70 -20.861 10.617 -14.647 267 HB3 PHE 70 HB1 PHE 70 -19.120 10.750 -14.914 268 HD1 PHE 70 HD1 PHE 70 -21.750 9.727 -12.563 269 HD2 PHE 70 HD2 PHE 70 -17.525 10.255 -13.115 270 HE1 PHE 70 HE1 PHE 70 -21.313 8.358 -10.540 271 HE2 PHE 70 HE2 PHE 70 -17.087 8.887 -11.095 272 HZ PHE 70 HZ PHE 70 -18.980 7.938 -9.808 273 H ASP 71 HN ASP 71 -18.045 13.310 -15.187 274 HA ASP 71 HA ASP 71 -19.771 14.347 -17.330 275 HB2 ASP 71 HB2 ASP 71 -19.336 16.227 -15.782 276 HB3 ASP 71 HB1 ASP 71 -17.602 15.973 -15.972 277 H ILE 72 HN ILE 72 -19.069 13.173 -19.027 278 HA ILE 72 HA ILE 72 -16.148 13.071 -19.526 279 HB ILE 72 HB ILE 72 -16.461 10.841 -20.502 280 HG12 ILE 72 HG12 ILE 72 -19.327 11.047 -19.526 281 HG13 ILE 72 HG11 ILE 72 -18.851 11.296 -21.211 282 HG21 ILE 72 HG21 ILE 72 -16.396 9.771 -18.476 283 HG22 ILE 72 HG22 ILE 72 -17.903 10.505 -17.928 284 HG23 ILE 72 HG23 ILE 72 -16.397 11.417 -17.843 285 HD11 ILE 72 HD1 ILE 72 -17.794 8.827 -19.976 286 HD12 ILE 72 HD2 ILE 72 -18.508 9.073 -21.570 287 HD13 ILE 72 HD3 ILE 72 -19.547 8.869 -20.161 288 H VAL 73 HN VAL 73 -15.489 13.114 -21.681 289 HA VAL 73 HA VAL 73 -17.548 14.011 -23.595 290 HB VAL 73 HB VAL 73 -14.782 15.152 -23.154 291 HG11 VAL 73 HG11 VAL 73 -16.149 14.861 -25.557 292 HG12 VAL 73 HG12 VAL 73 -14.848 16.006 -25.233 293 HG13 VAL 73 HG13 VAL 73 -16.529 16.504 -25.045 294 HG21 VAL 73 HG21 VAL 73 -16.932 17.052 -23.259 295 HG22 VAL 73 HG22 VAL 73 -15.857 16.692 -21.907 296 HG23 VAL 73 HG23 VAL 73 -17.358 15.785 -22.108 297 H VAL 74 HN VAL 74 -17.548 12.975 -25.501 298 HA VAL 74 HA VAL 74 -15.104 11.580 -26.369 299 HB VAL 74 HB VAL 74 -16.380 9.856 -25.280 300 HG11 VAL 74 HG11 VAL 74 -18.737 9.395 -26.105 301 HG12 VAL 74 HG12 VAL 74 -18.678 10.960 -26.917 302 HG13 VAL 74 HG13 VAL 74 -18.557 10.874 -25.160 303 HG21 VAL 74 HG21 VAL 74 -15.498 9.687 -27.820 304 HG22 VAL 74 HG22 VAL 74 -17.212 9.379 -28.102 305 HG23 VAL 74 HG23 VAL 74 -16.297 8.340 -27.008 306 H VAL 75 HN VAL 75 -14.801 11.509 -28.568 307 HA VAL 75 HA VAL 75 -16.869 12.861 -30.195 308 HB VAL 75 HB VAL 75 -13.862 12.889 -30.536 309 HG11 VAL 75 HG11 VAL 75 -16.013 13.316 -32.402 310 HG12 VAL 75 HG12 VAL 75 -14.276 13.429 -32.680 311 HG13 VAL 75 HG13 VAL 75 -15.172 14.841 -32.122 312 HG21 VAL 75 HG21 VAL 75 -15.788 15.143 -29.899 313 HG22 VAL 75 HG22 VAL 75 -14.026 15.227 -29.942 314 HG23 VAL 75 HG23 VAL 75 -14.833 14.297 -28.681 315 H SER 76 HN SER 76 -17.708 11.726 -31.825 316 HA SER 76 HA SER 76 -16.169 9.735 -33.249 317 HB2 SER 76 HB2 SER 76 -17.583 7.839 -32.730 318 HB3 SER 76 HB1 SER 76 -16.934 8.492 -31.229 319 HG SER 76 HG SER 76 -18.874 9.376 -30.768 320 H ASP 77 HN ASP 77 -17.516 8.701 -34.983 321 HA ASP 77 HA ASP 77 -19.006 10.740 -36.345 322 HB2 ASP 77 HB2 ASP 77 -18.546 7.826 -37.019 323 HB3 ASP 77 HB1 ASP 77 -19.312 9.000 -38.087 324 H PHE 78 HN PHE 78 -19.815 8.591 -33.949 325 HA PHE 78 HA PHE 78 -22.318 7.580 -34.683 326 HB2 PHE 78 HB2 PHE 78 -20.949 7.081 -32.576 327 HB3 PHE 78 HB1 PHE 78 -21.665 8.550 -31.903 328 HD1 PHE 78 HD1 PHE 78 -22.412 6.462 -30.295 329 HD2 PHE 78 HD2 PHE 78 -23.985 7.325 -34.199 330 HE1 PHE 78 HE1 PHE 78 -24.473 5.196 -29.750 331 HE2 PHE 78 HE2 PHE 78 -26.044 6.063 -33.651 332 HZ PHE 78 HZ PHE 78 -26.291 4.999 -31.427 333 H PHE 79 HN PHE 79 -21.321 10.780 -33.791 334 HA PHE 79 HA PHE 79 -24.030 11.726 -33.322 335 HB2 PHE 79 HB2 PHE 79 -22.237 12.708 -32.013 336 HB3 PHE 79 HB1 PHE 79 -21.382 13.180 -33.484 337 HD1 PHE 79 HD1 PHE 79 -24.595 13.675 -31.631 338 HD2 PHE 79 HD2 PHE 79 -21.866 15.219 -34.567 339 HE1 PHE 79 HE1 PHE 79 -25.890 15.789 -31.725 340 HE2 PHE 79 HE2 PHE 79 -23.160 17.332 -34.661 341 HZ PHE 79 HZ PHE 79 -25.172 17.617 -33.240 342 H GLN 80 HN GLN 80 -22.402 10.881 -36.026 343 HA GLN 80 HA GLN 80 -23.039 13.146 -37.709 344 HB2 GLN 80 HB2 GLN 80 -22.166 10.333 -38.411 345 HB3 GLN 80 HB1 GLN 80 -22.249 11.690 -39.535 346 HG2 GLN 80 HG2 GLN 80 -20.527 11.573 -37.043 347 HG3 GLN 80 HG1 GLN 80 -19.949 11.370 -38.696 348 HE21 GLN 80 HE21 GLN 80 -20.105 13.650 -36.305 349 HE22 GLN 80 HE22 GLN 80 -20.166 15.055 -37.255 350 H GLY 81 HN GLY 81 -25.019 13.561 -38.430 351 HA2 GLY 81 HA2 GLY 81 -27.040 13.192 -39.515 352 HA3 GLY 81 HA1 GLY 81 -26.689 11.465 -39.523 353 H LYS 82 HN LYS 82 -26.175 12.562 -36.443 354 HA LYS 82 HA LYS 82 -28.974 12.125 -35.614 355 HB2 LYS 82 HB2 LYS 82 -26.507 10.822 -34.443 356 HB3 LYS 82 HB1 LYS 82 -28.101 10.785 -33.688 357 HG2 LYS 82 HG2 LYS 82 -29.039 9.657 -35.643 358 HG3 LYS 82 HG1 LYS 82 -27.489 9.763 -36.477 359 HD2 LYS 82 HD2 LYS 82 -27.666 7.542 -35.543 360 HD3 LYS 82 HD1 LYS 82 -26.474 8.430 -34.592 361 HE2 LYS 82 HE2 LYS 82 -28.162 8.917 -32.882 362 HE3 LYS 82 HE1 LYS 82 -29.395 8.102 -33.843 363 HZ1 LYS 82 HZ1 LYS 82 -28.781 6.397 -32.506 364 HZ2 LYS 82 HZ2 LYS 82 -27.197 6.972 -32.286 365 HZ3 LYS 82 HZ3 LYS 82 -27.623 6.174 -33.724 366 H SER 83 HN SER 83 -29.608 13.158 -33.719 367 HA SER 83 HA SER 83 -28.122 15.558 -33.088 368 HB2 SER 83 HB2 SER 83 -30.732 14.466 -32.018 369 HB3 SER 83 HB1 SER 83 -30.046 16.027 -31.573 370 HG SER 83 HG SER 83 -31.072 16.682 -33.291 371 H LYS 84 HN LYS 84 -27.737 16.191 -30.810 372 HA LYS 84 HA LYS 84 -26.068 14.352 -29.489 373 HB2 LYS 84 HB2 LYS 84 -25.879 16.794 -29.213 374 HB3 LYS 84 HB1 LYS 84 -27.419 16.812 -28.353 375 HG2 LYS 84 HG2 LYS 84 -26.485 15.313 -26.634 376 HG3 LYS 84 HG1 LYS 84 -24.945 15.283 -27.494 377 HD2 LYS 84 HD2 LYS 84 -24.720 17.717 -27.198 378 HD3 LYS 84 HD1 LYS 84 -26.268 17.763 -26.353 379 HE2 LYS 84 HE2 LYS 84 -24.458 17.722 -24.714 380 HE3 LYS 84 HE1 LYS 84 -25.343 16.197 -24.647 381 HZ1 LYS 84 HZ1 LYS 84 -23.413 15.805 -26.546 382 HZ2 LYS 84 HZ2 LYS 84 -23.395 15.212 -24.954 383 HZ3 LYS 84 HZ3 LYS 84 -22.616 16.675 -25.329 384 H LEU 85 HN LEU 85 -29.436 15.288 -28.910 385 HA LEU 85 HA LEU 85 -29.819 13.862 -26.509 386 HB2 LEU 85 HB2 LEU 85 -31.747 14.672 -28.691 387 HB3 LEU 85 HB1 LEU 85 -32.256 13.927 -27.174 388 HG LEU 85 HG LEU 85 -30.574 16.441 -27.319 389 HD11 LEU 85 HD11 LEU 85 -33.285 16.168 -27.998 390 HD12 LEU 85 HD12 LEU 85 -32.444 17.668 -27.609 391 HD13 LEU 85 HD13 LEU 85 -33.290 16.777 -26.343 392 HD21 LEU 85 HD21 LEU 85 -31.074 14.646 -25.243 393 HD22 LEU 85 HD22 LEU 85 -32.225 15.952 -24.959 394 HD23 LEU 85 HD23 LEU 85 -30.500 16.304 -25.062 395 H MET 86 HN MET 86 -30.146 12.910 -29.897 396 HA MET 86 HA MET 86 -31.288 10.362 -29.463 397 HB2 MET 86 HB2 MET 86 -29.569 11.423 -31.715 398 HB3 MET 86 HB1 MET 86 -30.363 9.847 -31.743 399 HG2 MET 86 HG2 MET 86 -31.761 12.519 -31.415 400 HG3 MET 86 HG1 MET 86 -31.747 11.541 -32.884 401 HE1 MET 86 HE1 MET 86 -32.523 8.268 -31.558 402 HE2 MET 86 HE2 MET 86 -32.106 9.281 -32.938 403 HE3 MET 86 HE3 MET 86 -33.782 8.806 -32.679 404 H ARG 87 HN ARG 87 -27.948 11.501 -29.554 405 HA ARG 87 HA ARG 87 -26.661 8.997 -29.553 406 HB2 ARG 87 HB2 ARG 87 -25.768 11.646 -28.426 407 HB3 ARG 87 HB1 ARG 87 -24.735 10.220 -28.546 408 HG2 ARG 87 HG2 ARG 87 -25.410 10.160 -31.028 409 HG3 ARG 87 HG1 ARG 87 -25.995 11.805 -30.777 410 HD2 ARG 87 HD2 ARG 87 -23.786 12.085 -31.503 411 HD3 ARG 87 HD1 ARG 87 -23.684 12.277 -29.755 412 HE ARG 87 HE ARG 87 -22.731 9.974 -31.318 413 HH11 ARG 87 HH11 ARG 87 -23.263 11.523 -28.270 414 HH12 ARG 87 HH12 ARG 87 -22.166 10.499 -27.405 415 HH21 ARG 87 HH21 ARG 87 -21.297 8.627 -30.189 416 HH22 ARG 87 HH22 ARG 87 -21.054 8.859 -28.490 417 H SER 88 HN SER 88 -27.975 10.967 -26.932 418 HA SER 88 HA SER 88 -26.850 9.612 -24.748 419 HB2 SER 88 HB2 SER 88 -28.075 11.733 -24.520 420 HB3 SER 88 HB1 SER 88 -29.572 10.924 -24.978 421 HG SER 88 HG SER 88 -29.563 9.826 -23.101 422 H ARG 89 HN ARG 89 -29.850 8.996 -26.563 423 HA ARG 89 HA ARG 89 -30.782 6.857 -24.983 424 HB2 ARG 89 HB2 ARG 89 -32.140 8.028 -26.696 425 HB3 ARG 89 HB1 ARG 89 -31.147 7.293 -27.956 426 HG2 ARG 89 HG2 ARG 89 -31.806 5.050 -27.178 427 HG3 ARG 89 HG1 ARG 89 -32.799 5.776 -25.913 428 HD2 ARG 89 HD2 ARG 89 -34.111 6.953 -27.682 429 HD3 ARG 89 HD1 ARG 89 -33.169 6.102 -28.903 430 HE ARG 89 HE ARG 89 -34.261 4.195 -27.146 431 HH11 ARG 89 HH11 ARG 89 -35.227 6.541 -29.501 432 HH12 ARG 89 HH12 ARG 89 -36.649 5.675 -29.981 433 HH21 ARG 89 HH21 ARG 89 -36.123 3.057 -27.770 434 HH22 ARG 89 HH22 ARG 89 -37.156 3.703 -29.001 435 H ALA 90 HN ALA 90 -28.716 6.916 -27.881 436 HA ALA 90 HA ALA 90 -28.397 4.114 -28.120 437 HB1 ALA 90 HB1 ALA 90 -26.048 5.335 -29.083 438 HB2 ALA 90 HB2 ALA 90 -27.352 6.482 -29.388 439 HB3 ALA 90 HB3 ALA 90 -27.456 4.839 -30.019 440 H VAL 91 HN VAL 91 -26.581 6.591 -26.392 441 HA VAL 91 HA VAL 91 -24.422 4.978 -25.558 442 HB VAL 91 HB VAL 91 -25.636 7.471 -24.356 443 HG11 VAL 91 HG11 VAL 91 -24.371 7.113 -22.522 444 HG12 VAL 91 HG12 VAL 91 -22.937 7.081 -23.548 445 HG13 VAL 91 HG13 VAL 91 -23.800 5.585 -23.193 446 HG21 VAL 91 HG21 VAL 91 -23.773 8.568 -25.414 447 HG22 VAL 91 HG22 VAL 91 -24.509 7.522 -26.630 448 HG23 VAL 91 HG23 VAL 91 -23.026 7.021 -25.817 449 H ASN 92 HN ASN 92 -27.556 5.698 -24.051 450 HA ASN 92 HA ASN 92 -27.109 4.381 -21.612 451 HB2 ASN 92 HB2 ASN 92 -29.052 5.845 -22.035 452 HB3 ASN 92 HB1 ASN 92 -29.693 4.660 -23.173 453 HD21 ASN 92 HD21 ASN 92 -31.293 3.403 -22.229 454 HD22 ASN 92 HD22 ASN 92 -31.323 2.920 -20.602 455 H LYS 93 HN LYS 93 -28.413 3.186 -24.705 456 HA LYS 93 HA LYS 93 -28.889 0.537 -23.818 457 HB2 LYS 93 HB2 LYS 93 -28.394 1.706 -26.561 458 HB3 LYS 93 HB1 LYS 93 -28.804 0.011 -26.295 459 HG2 LYS 93 HG2 LYS 93 -30.884 0.696 -25.152 460 HG3 LYS 93 HG1 LYS 93 -30.473 2.390 -25.429 461 HD2 LYS 93 HD2 LYS 93 -30.542 2.051 -27.847 462 HD3 LYS 93 HD1 LYS 93 -30.852 0.328 -27.620 463 HE2 LYS 93 HE2 LYS 93 -32.958 1.491 -28.078 464 HE3 LYS 93 HE1 LYS 93 -32.955 0.888 -26.421 465 HZ1 LYS 93 HZ1 LYS 93 -32.776 3.635 -27.402 466 HZ2 LYS 93 HZ2 LYS 93 -31.926 3.250 -25.982 467 HZ3 LYS 93 HZ3 LYS 93 -33.608 3.017 -26.060 468 H ALA 94 HN ALA 94 -26.116 2.095 -25.387 469 HA ALA 94 HA ALA 94 -24.538 -0.247 -25.649 470 HB1 ALA 94 HB1 ALA 94 -24.008 2.694 -25.733 471 HB2 ALA 94 HB2 ALA 94 -23.754 1.471 -26.978 472 HB3 ALA 94 HB3 ALA 94 -22.641 1.586 -25.615 473 H VAL 95 HN VAL 95 -24.790 2.220 -23.131 474 HA VAL 95 HA VAL 95 -23.227 0.448 -21.348 475 HB VAL 95 HB VAL 95 -23.276 3.372 -20.803 476 HG11 VAL 95 HG11 VAL 95 -20.839 1.647 -20.821 477 HG12 VAL 95 HG12 VAL 95 -22.073 1.303 -19.609 478 HG13 VAL 95 HG13 VAL 95 -21.322 2.897 -19.674 479 HG21 VAL 95 HG21 VAL 95 -22.683 3.744 -23.004 480 HG22 VAL 95 HG22 VAL 95 -22.067 2.106 -23.224 481 HG23 VAL 95 HG23 VAL 95 -21.098 3.304 -22.366 482 H LYS 96 HN LYS 96 -25.818 -0.050 -21.392 483 HA LYS 96 HA LYS 96 -27.504 1.553 -19.801 484 HB2 LYS 96 HB2 LYS 96 -28.315 -0.265 -21.271 485 HB3 LYS 96 HB1 LYS 96 -27.585 -1.448 -20.184 486 HG2 LYS 96 HG2 LYS 96 -29.003 -0.666 -18.341 487 HG3 LYS 96 HG1 LYS 96 -29.704 0.571 -19.386 488 HD2 LYS 96 HD2 LYS 96 -30.565 -1.196 -20.889 489 HD3 LYS 96 HD1 LYS 96 -29.892 -2.426 -19.819 490 HE2 LYS 96 HE2 LYS 96 -31.959 -0.358 -19.013 491 HE3 LYS 96 HE1 LYS 96 -32.304 -2.049 -19.377 492 HZ1 LYS 96 HZ1 LYS 96 -31.849 -1.247 -16.936 493 HZ2 LYS 96 HZ2 LYS 96 -30.229 -1.459 -17.400 494 HZ3 LYS 96 HZ3 LYS 96 -31.314 -2.764 -17.475 495 H GLU 97 HN GLU 97 -25.347 -1.144 -18.977 496 HA GLU 97 HA GLU 97 -26.060 -1.387 -16.266 497 HB2 GLU 97 HB2 GLU 97 -23.965 -2.573 -15.998 498 HB3 GLU 97 HB1 GLU 97 -24.660 -3.014 -17.559 499 HG2 GLU 97 HG2 GLU 97 -23.218 -1.337 -18.668 500 HG3 GLU 97 HG1 GLU 97 -22.505 -0.926 -17.109 501 H GLU 98 HN GLU 98 -23.885 0.809 -17.935 502 HA GLU 98 HA GLU 98 -22.527 1.830 -15.675 503 HB2 GLU 98 HB2 GLU 98 -21.730 2.222 -17.951 504 HB3 GLU 98 HB1 GLU 98 -23.174 3.171 -18.310 505 HG2 GLU 98 HG2 GLU 98 -21.389 4.711 -17.769 506 HG3 GLU 98 HG1 GLU 98 -22.536 4.719 -16.431 507 H LEU 99 HN LEU 99 -25.521 2.792 -17.296 508 HA LEU 99 HA LEU 99 -26.018 5.129 -15.791 509 HB2 LEU 99 HB2 LEU 99 -27.186 4.493 -17.914 510 HB3 LEU 99 HB1 LEU 99 -28.061 3.266 -16.997 511 HG LEU 99 HG LEU 99 -28.052 6.145 -16.108 512 HD11 LEU 99 HD11 LEU 99 -30.040 4.850 -18.003 513 HD12 LEU 99 HD12 LEU 99 -28.838 6.056 -18.467 514 HD13 LEU 99 HD13 LEU 99 -30.133 6.487 -17.350 515 HD21 LEU 99 HD21 LEU 99 -30.463 5.078 -15.465 516 HD22 LEU 99 HD22 LEU 99 -29.053 4.987 -14.409 517 HD23 LEU 99 HD23 LEU 99 -29.469 3.622 -15.445 518 H GLN 100 HN GLN 100 -26.910 1.730 -15.281 519 HA GLN 100 HA GLN 100 -28.607 2.125 -13.059 520 HB2 GLN 100 HB2 GLN 100 -26.901 -0.229 -13.895 521 HB3 GLN 100 HB1 GLN 100 -28.030 -0.284 -12.540 522 HG2 GLN 100 HG2 GLN 100 -29.896 0.229 -14.002 523 HG3 GLN 100 HG1 GLN 100 -28.809 0.492 -15.364 524 HE21 GLN 100 HE21 GLN 100 -31.000 -1.553 -15.090 525 HE22 GLN 100 HE22 GLN 100 -30.240 -3.054 -15.313 526 H GLU 101 HN GLU 101 -25.119 1.643 -13.322 527 HA GLU 101 HA GLU 101 -24.674 1.599 -10.484 528 HB2 GLU 101 HB2 GLU 101 -23.137 0.552 -12.197 529 HB3 GLU 101 HB1 GLU 101 -22.637 2.186 -12.640 530 HG2 GLU 101 HG2 GLU 101 -21.077 1.250 -10.995 531 HG3 GLU 101 HG1 GLU 101 -21.960 2.604 -10.293 532 H ILE 102 HN ILE 102 -24.883 4.042 -12.972 533 HA ILE 102 HA ILE 102 -23.941 6.087 -11.056 534 HB ILE 102 HB ILE 102 -24.402 6.335 -14.035 535 HG12 ILE 102 HG12 ILE 102 -22.613 4.711 -13.533 536 HG13 ILE 102 HG11 ILE 102 -21.935 6.200 -14.194 537 HG21 ILE 102 HG21 ILE 102 -22.524 8.190 -13.163 538 HG22 ILE 102 HG22 ILE 102 -23.722 8.177 -11.868 539 HG23 ILE 102 HG23 ILE 102 -24.220 8.530 -13.523 540 HD11 ILE 102 HD1 ILE 102 -21.649 5.038 -11.506 541 HD12 ILE 102 HD2 ILE 102 -21.983 6.770 -11.524 542 HD13 ILE 102 HD3 ILE 102 -20.580 6.133 -12.382 543 H HIS 103 HN HIS 103 -25.440 7.288 -10.053 544 HA HIS 103 HA HIS 103 -28.216 7.073 -10.589 545 HB2 HIS 103 HB2 HIS 103 -26.600 9.038 -8.957 546 HB3 HIS 103 HB1 HIS 103 -28.364 9.068 -9.028 547 HD2 HIS 103 HD2 HIS 103 -27.835 5.453 -9.121 548 HE1 HIS 103 HE1 HIS 103 -27.471 6.330 -5.007 549 HE2 HIS 103 HE2 HIS 103 -27.796 4.468 -6.703 550 H ALA 104 HN ALA 104 -25.787 9.501 -11.411 551 HA ALA 104 HA ALA 104 -27.378 10.390 -13.656 552 HB1 ALA 104 HB1 ALA 104 -28.372 11.743 -11.881 553 HB2 ALA 104 HB2 ALA 104 -27.407 12.765 -12.946 554 HB3 ALA 104 HB3 ALA 104 -26.773 12.287 -11.371 555 H PHE 105 HN PHE 105 -25.994 10.707 -15.260 556 HA PHE 105 HA PHE 105 -23.386 11.938 -14.736 557 HB2 PHE 105 HB2 PHE 105 -22.183 10.209 -15.952 558 HB3 PHE 105 HB1 PHE 105 -23.040 9.480 -14.594 559 HD1 PHE 105 HD1 PHE 105 -22.848 9.783 -18.239 560 HD2 PHE 105 HD2 PHE 105 -25.098 8.150 -14.964 561 HE1 PHE 105 HE1 PHE 105 -24.058 8.296 -19.812 562 HE2 PHE 105 HE2 PHE 105 -26.308 6.663 -16.538 563 HZ PHE 105 HZ PHE 105 -25.788 6.736 -18.961 564 H SER 106 HN SER 106 -22.322 12.646 -16.733 565 HA SER 106 HA SER 106 -24.261 13.061 -18.931 566 HB2 SER 106 HB2 SER 106 -23.143 15.231 -19.336 567 HB3 SER 106 HB1 SER 106 -23.852 15.156 -17.721 568 HG SER 106 HG SER 106 -21.500 14.194 -17.387 569 H CYS 107 HN CYS 107 -23.437 13.026 -21.046 570 HA CYS 107 HA CYS 107 -20.645 12.132 -21.354 571 HB2 CYS 107 HB2 CYS 107 -21.431 10.437 -23.019 572 HB3 CYS 107 HB1 CYS 107 -21.944 10.093 -21.366 573 HG CYS 107 HG CYS 107 -23.815 11.094 -23.642 574 H LYS 108 HN LYS 108 -20.384 14.372 -22.059 575 HA LYS 108 HA LYS 108 -21.789 15.463 -24.249 576 HB2 LYS 108 HB2 LYS 108 -19.025 16.024 -23.152 577 HB3 LYS 108 HB1 LYS 108 -19.788 16.990 -24.416 578 HG2 LYS 108 HG2 LYS 108 -21.675 17.483 -22.910 579 HG3 LYS 108 HG1 LYS 108 -20.927 16.507 -21.646 580 HD2 LYS 108 HD2 LYS 108 -18.972 18.009 -21.634 581 HD3 LYS 108 HD1 LYS 108 -19.712 18.986 -22.903 582 HE2 LYS 108 HE2 LYS 108 -21.616 19.485 -21.419 583 HE3 LYS 108 HE1 LYS 108 -20.887 18.501 -20.150 584 HZ1 LYS 108 HZ1 LYS 108 -19.105 20.475 -21.235 585 HZ2 LYS 108 HZ2 LYS 108 -19.472 20.117 -19.615 586 HZ3 LYS 108 HZ3 LYS 108 -20.480 21.152 -20.509 587 H CYS 109 HN CYS 109 -21.557 15.227 -26.407 588 HA CYS 109 HA CYS 109 -19.185 13.826 -27.437 589 HB2 CYS 109 HB2 CYS 109 -20.958 12.140 -27.131 590 HB3 CYS 109 HB1 CYS 109 -22.032 13.099 -28.148 591 HG CYS 109 HG CYS 109 -19.333 12.179 -29.389 592 H TYR 110 HN TYR 110 -18.388 14.721 -29.245 593 HA TYR 110 HA TYR 110 -20.149 16.271 -30.997 594 HB2 TYR 110 HB2 TYR 110 -18.650 18.208 -30.994 595 HB3 TYR 110 HB1 TYR 110 -19.263 17.907 -29.366 596 HD1 TYR 110 HD1 TYR 110 -16.330 17.718 -31.582 597 HD2 TYR 110 HD2 TYR 110 -17.807 17.028 -27.609 598 HE1 TYR 110 HE1 TYR 110 -14.003 17.494 -30.756 599 HE2 TYR 110 HE2 TYR 110 -15.479 16.805 -26.784 600 HH TYR 110 HH TYR 110 -12.730 17.544 -28.812 601 H THR 111 HN THR 111 -19.121 16.795 -33.058 602 HA THR 111 HA THR 111 -16.713 15.232 -33.682 603 HB THR 111 HB THR 111 -19.178 15.093 -35.413 604 HG1 THR 111 HG1 THR 111 -19.107 14.095 -33.121 605 HG21 THR 111 HG21 THR 111 -16.943 14.650 -36.435 606 HG22 THR 111 HG22 THR 111 -17.999 13.238 -36.452 607 HG23 THR 111 HG23 THR 111 -16.703 13.355 -35.262 608 H GLU 112 HN GLU 112 -16.984 18.025 -33.369 609 HA GLU 112 HA GLU 112 -16.236 19.921 -34.441 610 HB2 GLU 112 HB2 GLU 112 -14.724 18.434 -35.704 611 HB3 GLU 112 HB1 GLU 112 -16.010 18.127 -36.872 612 HG2 GLU 112 HG2 GLU 112 -16.101 20.522 -37.416 613 HG3 GLU 112 HG1 GLU 112 -14.826 20.844 -36.242 614 H GLU 113 HN GLU 113 -18.925 18.091 -35.373 615 HA GLU 113 HA GLU 113 -20.016 19.678 -37.429 616 HB2 GLU 113 HB2 GLU 113 -21.245 17.900 -35.341 617 HB3 GLU 113 HB1 GLU 113 -22.200 18.751 -36.548 618 HG2 GLU 113 HG2 GLU 113 -19.881 16.923 -37.238 619 HG3 GLU 113 HG1 GLU 113 -21.561 16.391 -37.207 620 H GLU 114 HN GLU 114 -20.340 19.852 -33.895 621 HA GLU 114 HA GLU 114 -22.254 21.931 -33.834 622 HB2 GLU 114 HB2 GLU 114 -20.145 21.057 -31.848 623 HB3 GLU 114 HB1 GLU 114 -21.338 22.308 -31.497 624 HG2 GLU 114 HG2 GLU 114 -23.160 20.732 -31.894 625 HG3 GLU 114 HG1 GLU 114 -22.011 19.480 -32.365 626 H TRP 115 HN TRP 115 -18.755 21.880 -33.964 627 HA TRP 115 HA TRP 115 -18.343 24.669 -33.611 628 HB2 TRP 115 HB2 TRP 115 -16.518 23.056 -33.330 629 HB3 TRP 115 HB1 TRP 115 -16.593 22.662 -35.048 630 HD1 TRP 115 HD1 TRP 115 -15.224 24.123 -36.636 631 HE1 TRP 115 HE1 TRP 115 -13.889 26.317 -36.417 632 HE3 TRP 115 HE3 TRP 115 -16.539 25.491 -31.892 633 HZ2 TRP 115 HZ2 TRP 115 -13.437 28.379 -34.487 634 HZ3 TRP 115 HZ3 TRP 115 -15.641 27.573 -30.891 635 HH2 TRP 115 HH2 TRP 115 -14.093 29.018 -32.181 636 H SER 116 HN SER 116 -18.800 22.640 -36.467 637 HA SER 116 HA SER 116 -19.546 23.188 -38.575 638 HB2 SER 116 HB2 SER 116 -21.029 24.843 -37.494 639 HB3 SER 116 HB1 SER 116 -19.717 26.019 -37.510 640 HG SER 116 HG SER 116 -21.170 26.182 -39.316 641 H LYS 117 HN LYS 117 -18.806 24.435 -40.524 642 HA LYS 117 HA LYS 117 -16.003 24.331 -40.730 643 HB2 LYS 117 HB2 LYS 117 -17.526 24.092 -42.659 644 HB3 LYS 117 HB1 LYS 117 -17.952 25.798 -42.520 645 HG2 LYS 117 HG2 LYS 117 -15.612 26.436 -42.907 646 HG3 LYS 117 HG1 LYS 117 -15.150 24.735 -42.999 647 HD2 LYS 117 HD2 LYS 117 -16.648 24.439 -44.946 648 HD3 LYS 117 HD1 LYS 117 -17.084 26.146 -44.862 649 HE2 LYS 117 HE2 LYS 117 -14.735 26.779 -45.241 650 HE3 LYS 117 HE1 LYS 117 -14.281 25.076 -45.301 651 HZ1 LYS 117 HZ1 LYS 117 -15.061 26.602 -47.418 652 HZ2 LYS 117 HZ2 LYS 117 -16.450 25.692 -47.059 653 HZ3 LYS 117 HZ3 LYS 117 -14.979 24.907 -47.389 654 H ILE 118 HN ILE 118 -18.218 27.099 -40.416 655 HA ILE 118 HA ILE 118 -17.451 29.406 -40.518 656 HB ILE 118 HB ILE 118 -17.171 29.939 -38.103 657 HG12 ILE 118 HG12 ILE 118 -17.321 26.937 -37.708 658 HG13 ILE 118 HG11 ILE 118 -15.809 27.845 -37.633 659 HG21 ILE 118 HG21 ILE 118 -19.310 27.948 -38.902 660 HG22 ILE 118 HG22 ILE 118 -19.421 29.708 -38.921 661 HG23 ILE 118 HG23 ILE 118 -19.344 28.846 -37.385 662 HD11 ILE 118 HD1 ILE 118 -17.002 29.337 -35.904 663 HD12 ILE 118 HD2 ILE 118 -16.533 27.719 -35.380 664 HD13 ILE 118 HD3 ILE 118 -18.210 28.054 -35.815 665 H VAL 119 HN VAL 119 -15.431 29.567 -37.990 666 HA VAL 119 HA VAL 119 -12.990 29.271 -39.629 667 HB VAL 119 HB VAL 119 -13.607 31.543 -37.728 668 HG11 VAL 119 HG11 VAL 119 -11.460 32.074 -39.512 669 HG12 VAL 119 HG12 VAL 119 -11.170 30.485 -38.805 670 HG13 VAL 119 HG13 VAL 119 -11.389 31.888 -37.761 671 HG21 VAL 119 HG21 VAL 119 -14.608 31.198 -40.268 672 HG22 VAL 119 HG22 VAL 119 -13.123 32.098 -40.582 673 HG23 VAL 119 HG23 VAL 119 -14.345 32.762 -39.497 674 H VAL 120 HN VAL 120 -12.387 27.359 -38.616 675 HA VAL 120 HA VAL 120 -12.362 27.073 -35.753 676 HB VAL 120 HB VAL 120 -12.670 25.154 -37.306 677 HG11 VAL 120 HG11 VAL 120 -11.239 24.835 -39.010 678 HG12 VAL 120 HG12 VAL 120 -9.895 24.684 -37.878 679 HG13 VAL 120 HG13 VAL 120 -10.347 26.270 -38.503 680 HG21 VAL 120 HG21 VAL 120 -10.550 25.296 -35.206 681 HG22 VAL 120 HG22 VAL 120 -10.650 23.818 -36.162 682 HG23 VAL 120 HG23 VAL 120 -12.045 24.360 -35.229 683 H LEU 121 HN LEU 121 -10.115 28.065 -38.221 684 HA LEU 121 HA LEU 121 -7.911 28.726 -38.149 685 HB2 LEU 121 HB2 LEU 121 -8.738 29.654 -35.390 686 HB3 LEU 121 HB1 LEU 121 -7.374 30.246 -36.331 687 HG LEU 121 HG LEU 121 -10.273 30.429 -37.168 688 HD11 LEU 121 HD11 LEU 121 -9.343 31.912 -35.226 689 HD12 LEU 121 HD12 LEU 121 -10.228 32.691 -36.537 690 HD13 LEU 121 HD13 LEU 121 -8.466 32.746 -36.510 691 HD21 LEU 121 HD21 LEU 121 -7.737 30.729 -38.578 692 HD22 LEU 121 HD22 LEU 121 -8.697 32.206 -38.646 693 HD23 LEU 121 HD23 LEU 121 -9.375 30.686 -39.229 694 H GLU 122 HN GLU 122 -8.630 26.023 -37.051 695 HA GLU 122 HA GLU 122 -7.572 24.250 -36.041 696 HB2 GLU 122 HB2 GLU 122 -5.723 24.999 -37.530 697 HB3 GLU 122 HB1 GLU 122 -5.133 26.036 -36.231 698 HG2 GLU 122 HG2 GLU 122 -4.817 24.083 -34.784 699 HG3 GLU 122 HG1 GLU 122 -5.462 23.027 -36.038 700 H HIS 123 HN HIS 123 -5.665 26.917 -34.655 701 HA HIS 123 HA HIS 123 -5.088 27.296 -32.439 702 HB2 HIS 123 HB2 HIS 123 -7.209 28.530 -32.728 703 HB3 HIS 123 HB1 HIS 123 -8.101 27.100 -32.211 704 HD2 HIS 123 HD2 HIS 123 -8.429 26.954 -29.467 705 HE1 HIS 123 HE1 HIS 123 -5.427 29.713 -28.370 706 HE2 HIS 123 HE2 HIS 123 -7.294 28.231 -27.492 707 H HIS 124 HN HIS 124 -4.995 24.512 -33.160 708 HA HIS 124 HA HIS 124 -6.256 22.910 -31.162 709 HB2 HIS 124 HB2 HIS 124 -5.426 22.071 -33.386 710 HB3 HIS 124 HB1 HIS 124 -3.782 22.242 -32.772 711 HD2 HIS 124 HD2 HIS 124 -2.922 19.905 -31.582 712 HE1 HIS 124 HE1 HIS 124 -6.692 18.364 -30.473 713 HE2 HIS 124 HE2 HIS 124 -4.193 17.914 -30.469 714 H HIS 125 HN HIS 125 -5.568 22.316 -29.176 715 HA HIS 125 HA HIS 125 -4.445 22.607 -27.173 716 HB2 HIS 125 HB2 HIS 125 -2.239 21.676 -27.193 717 HB3 HIS 125 HB1 HIS 125 -3.169 20.813 -28.418 718 HD2 HIS 125 HD2 HIS 125 -2.344 21.293 -31.095 719 HE1 HIS 125 HE1 HIS 125 0.923 23.781 -30.123 720 HE2 HIS 125 HE2 HIS 125 -0.224 22.518 -32.002 721 H HIS 126 HN HIS 126 -1.860 23.490 -26.615 722 HA HIS 126 HA HIS 126 -1.512 26.128 -27.786 723 HB2 HIS 126 HB2 HIS 126 -1.744 27.326 -25.666 724 HB3 HIS 126 HB1 HIS 126 -3.254 26.512 -26.074 725 HD2 HIS 126 HD2 HIS 126 -0.632 26.527 -23.237 726 HE1 HIS 126 HE1 HIS 126 -3.200 23.255 -22.506 727 HE2 HIS 126 HE2 HIS 126 -1.341 24.684 -21.527 728 H HIS 127 HN HIS 127 0.425 27.215 -26.934 729 HA HIS 127 HA HIS 127 2.544 25.291 -26.484 730 HB2 HIS 127 HB2 HIS 127 4.045 27.162 -26.782 731 HB3 HIS 127 HB1 HIS 127 2.790 27.250 -28.019 732 HD2 HIS 127 HD2 HIS 127 1.091 29.490 -27.828 733 HE1 HIS 127 HE1 HIS 127 2.873 31.160 -24.384 734 HE2 HIS 127 HE2 HIS 127 1.185 31.560 -26.238 735 H HIS 128 HN HIS 128 4.192 25.670 -24.787 736 HA HIS 128 HA HIS 128 2.874 26.086 -22.220 737 HB2 HIS 128 HB2 HIS 128 4.451 24.147 -22.748 738 HB3 HIS 128 HB1 HIS 128 5.759 25.327 -22.675 739 HD2 HIS 128 HD2 HIS 128 3.467 23.342 -20.255 740 HE1 HIS 128 HE1 HIS 128 5.725 26.023 -17.902 741 HE2 HIS 128 HE2 HIS 128 4.141 24.040 -17.831 Start of MODEL 2 1 H1 MET 36 HT1 MET 36 -30.645 0.809 -5.064 2 H2 MET 36 HT2 MET 36 -31.287 1.133 -6.604 3 H3 MET 36 HT3 MET 36 -30.014 2.080 -5.992 4 HA MET 36 HA MET 36 -29.429 -0.739 -6.082 5 HB2 MET 36 HB2 MET 36 -30.616 -0.826 -8.113 6 HB3 MET 36 HB1 MET 36 -30.167 0.823 -8.552 7 HG2 MET 36 HG2 MET 36 -27.802 0.092 -8.785 8 HG3 MET 36 HG1 MET 36 -28.296 -1.561 -8.421 9 HE1 MET 36 HE1 MET 36 -30.101 -2.598 -9.299 10 HE2 MET 36 HE2 MET 36 -29.695 -3.159 -10.919 11 HE3 MET 36 HE3 MET 36 -31.097 -2.119 -10.681 12 HA PRO 37 HA PRO 37 -25.777 1.766 -5.227 13 HB2 PRO 37 HB2 PRO 37 -24.559 -0.944 -5.097 14 HB3 PRO 37 HB1 PRO 37 -24.546 0.357 -3.891 15 HG2 PRO 37 HG2 PRO 37 -26.041 -1.807 -3.547 16 HG3 PRO 37 HG1 PRO 37 -26.624 -0.204 -3.068 17 HD2 PRO 37 HD2 PRO 37 -27.351 -1.823 -5.492 18 HD3 PRO 37 HD1 PRO 37 -28.390 -0.818 -4.454 19 H VAL 38 HN VAL 38 -24.004 2.393 -6.442 20 HA VAL 38 HA VAL 38 -23.322 0.802 -8.827 21 HB VAL 38 HB VAL 38 -24.939 2.576 -9.491 22 HG11 VAL 38 HG11 VAL 38 -24.588 4.820 -9.056 23 HG12 VAL 38 HG12 VAL 38 -22.835 4.638 -8.972 24 HG13 VAL 38 HG13 VAL 38 -23.843 4.124 -7.618 25 HG21 VAL 38 HG21 VAL 38 -22.857 1.743 -10.858 26 HG22 VAL 38 HG22 VAL 38 -22.235 3.363 -10.545 27 HG23 VAL 38 HG23 VAL 38 -23.751 3.156 -11.421 28 H THR 39 HN THR 39 -21.196 1.088 -9.578 29 HA THR 39 HA THR 39 -19.439 2.712 -7.841 30 HB THR 39 HB THR 39 -17.755 0.929 -7.952 31 HG1 THR 39 HG1 THR 39 -19.614 -0.875 -8.946 32 HG21 THR 39 HG21 THR 39 -18.901 0.563 -6.002 33 HG22 THR 39 HG22 THR 39 -19.387 -0.909 -6.843 34 HG23 THR 39 HG23 THR 39 -20.464 0.487 -6.814 35 H GLU 40 HN GLU 40 -17.453 3.392 -8.846 36 HA GLU 40 HA GLU 40 -17.796 4.343 -11.486 37 HB2 GLU 40 HB2 GLU 40 -16.378 5.465 -9.807 38 HB3 GLU 40 HB1 GLU 40 -15.240 4.118 -9.883 39 HG2 GLU 40 HG2 GLU 40 -14.850 4.541 -12.261 40 HG3 GLU 40 HG1 GLU 40 -16.039 5.843 -12.248 41 H GLN 41 HN GLN 41 -16.006 1.610 -10.153 42 HA GLN 41 HA GLN 41 -14.636 0.854 -12.497 43 HB2 GLN 41 HB2 GLN 41 -15.566 -0.746 -10.106 44 HB3 GLN 41 HB1 GLN 41 -14.546 -1.411 -11.383 45 HG2 GLN 41 HG2 GLN 41 -12.845 0.301 -10.949 46 HG3 GLN 41 HG1 GLN 41 -13.871 1.031 -9.715 47 HE21 GLN 41 HE21 GLN 41 -11.542 0.350 -8.637 48 HE22 GLN 41 HE22 GLN 41 -11.601 -1.130 -7.807 49 H GLY 42 HN GLY 42 -17.848 0.050 -11.277 50 HA2 GLY 42 HA2 GLY 42 -18.520 -1.968 -13.122 51 HA3 GLY 42 HA1 GLY 42 -19.674 -0.947 -12.266 52 H LEU 43 HN LEU 43 -18.629 1.538 -13.321 53 HA LEU 43 HA LEU 43 -20.201 1.806 -15.644 54 HB2 LEU 43 HB2 LEU 43 -18.198 3.493 -14.215 55 HB3 LEU 43 HB1 LEU 43 -18.644 3.949 -15.859 56 HG LEU 43 HG LEU 43 -21.001 3.962 -15.251 57 HD11 LEU 43 HD11 LEU 43 -20.166 3.448 -12.396 58 HD12 LEU 43 HD12 LEU 43 -20.677 2.148 -13.476 59 HD13 LEU 43 HD13 LEU 43 -21.793 3.452 -13.072 60 HD21 LEU 43 HD21 LEU 43 -20.783 6.094 -14.498 61 HD22 LEU 43 HD22 LEU 43 -19.053 5.779 -14.364 62 HD23 LEU 43 HD23 LEU 43 -20.105 5.542 -12.967 63 H ARG 44 HN ARG 44 -16.734 1.281 -15.226 64 HA ARG 44 HA ARG 44 -15.914 1.665 -17.862 65 HB2 ARG 44 HB2 ARG 44 -14.369 1.289 -15.959 66 HB3 ARG 44 HB1 ARG 44 -14.886 -0.395 -15.893 67 HG2 ARG 44 HG2 ARG 44 -14.081 -0.754 -18.186 68 HG3 ARG 44 HG1 ARG 44 -13.597 0.938 -18.294 69 HD2 ARG 44 HD2 ARG 44 -12.018 0.609 -16.427 70 HD3 ARG 44 HD1 ARG 44 -12.505 -1.079 -16.309 71 HE ARG 44 HE ARG 44 -11.677 -0.618 -18.949 72 HH11 ARG 44 HH11 ARG 44 -10.418 -0.635 -15.726 73 HH12 ARG 44 HH12 ARG 44 -8.816 -1.081 -16.206 74 HH21 ARG 44 HH21 ARG 44 -9.572 -1.187 -19.588 75 HH22 ARG 44 HH22 ARG 44 -8.336 -1.394 -18.392 76 H GLU 45 HN GLU 45 -17.264 -1.217 -16.282 77 HA GLU 45 HA GLU 45 -17.000 -2.929 -18.527 78 HB2 GLU 45 HB2 GLU 45 -18.878 -3.002 -16.161 79 HB3 GLU 45 HB1 GLU 45 -18.772 -4.286 -17.367 80 HG2 GLU 45 HG2 GLU 45 -16.395 -4.601 -16.862 81 HG3 GLU 45 HG1 GLU 45 -16.451 -3.274 -15.699 82 H ARG 46 HN ARG 46 -19.634 -0.771 -17.437 83 HA ARG 46 HA ARG 46 -21.493 -1.610 -19.421 84 HB2 ARG 46 HB2 ARG 46 -21.273 0.876 -17.718 85 HB3 ARG 46 HB1 ARG 46 -22.615 0.590 -18.825 86 HG2 ARG 46 HG2 ARG 46 -23.150 -1.511 -17.661 87 HG3 ARG 46 HG1 ARG 46 -21.781 -1.262 -16.577 88 HD2 ARG 46 HD2 ARG 46 -22.794 0.807 -15.734 89 HD3 ARG 46 HD1 ARG 46 -24.145 0.616 -16.849 90 HE ARG 46 HE ARG 46 -25.013 -1.050 -15.452 91 HH11 ARG 46 HH11 ARG 46 -21.798 -0.145 -14.546 92 HH12 ARG 46 HH12 ARG 46 -21.840 -0.985 -13.032 93 HH21 ARG 46 HH21 ARG 46 -25.078 -2.147 -13.463 94 HH22 ARG 46 HH22 ARG 46 -23.697 -2.118 -12.419 95 H ILE 47 HN ILE 47 -19.161 1.023 -19.213 96 HA ILE 47 HA ILE 47 -19.830 2.249 -21.668 97 HB ILE 47 HB ILE 47 -17.455 2.346 -19.841 98 HG12 ILE 47 HG12 ILE 47 -18.253 4.503 -19.332 99 HG13 ILE 47 HG11 ILE 47 -19.187 4.602 -20.826 100 HG21 ILE 47 HG21 ILE 47 -17.755 3.584 -22.584 101 HG22 ILE 47 HG22 ILE 47 -16.430 2.583 -21.988 102 HG23 ILE 47 HG23 ILE 47 -16.648 4.220 -21.367 103 HD11 ILE 47 HD1 ILE 47 -20.720 4.271 -18.976 104 HD12 ILE 47 HD2 ILE 47 -19.806 2.875 -18.414 105 HD13 ILE 47 HD3 ILE 47 -20.683 2.794 -19.941 106 H GLU 48 HN GLU 48 -17.389 -0.124 -20.751 107 HA GLU 48 HA GLU 48 -16.094 -0.321 -23.236 108 HB2 GLU 48 HB2 GLU 48 -15.172 -1.237 -21.140 109 HB3 GLU 48 HB1 GLU 48 -16.451 -2.454 -21.108 110 HG2 GLU 48 HG2 GLU 48 -15.656 -3.340 -23.281 111 HG3 GLU 48 HG1 GLU 48 -14.394 -2.109 -23.320 112 H SER 49 HN SER 49 -18.904 -1.994 -21.888 113 HA SER 49 HA SER 49 -19.240 -3.615 -24.270 114 HB2 SER 49 HB2 SER 49 -21.176 -4.534 -23.144 115 HB3 SER 49 HB1 SER 49 -19.847 -4.454 -21.991 116 HG SER 49 HG SER 49 -22.110 -2.780 -22.244 117 H ALA 50 HN ALA 50 -19.935 -0.424 -23.392 118 HA ALA 50 HA ALA 50 -22.403 -0.294 -24.968 119 HB1 ALA 50 HB1 ALA 50 -22.732 1.161 -23.249 120 HB2 ALA 50 HB2 ALA 50 -21.859 2.273 -24.304 121 HB3 ALA 50 HB3 ALA 50 -21.005 1.427 -23.014 122 H ILE 51 HN ILE 51 -19.089 -0.126 -25.497 123 HA ILE 51 HA ILE 51 -19.491 0.880 -28.184 124 HB ILE 51 HB ILE 51 -18.157 2.795 -28.083 125 HG12 ILE 51 HG12 ILE 51 -17.240 1.906 -25.326 126 HG13 ILE 51 HG11 ILE 51 -16.296 1.765 -26.813 127 HG21 ILE 51 HG21 ILE 51 -20.291 3.233 -27.022 128 HG22 ILE 51 HG22 ILE 51 -19.041 4.119 -26.148 129 HG23 ILE 51 HG23 ILE 51 -19.695 2.625 -25.477 130 HD11 ILE 51 HD1 ILE 51 -15.670 3.787 -25.532 131 HD12 ILE 51 HD2 ILE 51 -17.331 4.364 -25.646 132 HD13 ILE 51 HD3 ILE 51 -16.355 4.203 -27.105 133 HA PRO 52 HA PRO 52 -16.110 -1.659 -29.348 134 HB2 PRO 52 HB2 PRO 52 -14.566 0.743 -30.238 135 HB3 PRO 52 HB1 PRO 52 -15.006 -0.716 -31.151 136 HG2 PRO 52 HG2 PRO 52 -16.282 1.544 -31.596 137 HG3 PRO 52 HG1 PRO 52 -17.172 0.013 -31.530 138 HD2 PRO 52 HD2 PRO 52 -16.996 2.173 -29.444 139 HD3 PRO 52 HD1 PRO 52 -18.396 1.187 -29.934 140 H GLN 53 HN GLN 53 -14.329 -2.571 -28.413 141 HA GLN 53 HA GLN 53 -13.280 -1.342 -26.028 142 HB2 GLN 53 HB2 GLN 53 -12.649 -3.941 -27.440 143 HB3 GLN 53 HB1 GLN 53 -11.909 -3.447 -25.914 144 HG2 GLN 53 HG2 GLN 53 -14.080 -3.350 -24.831 145 HG3 GLN 53 HG1 GLN 53 -14.897 -3.680 -26.358 146 HE21 GLN 53 HE21 GLN 53 -14.850 -5.306 -23.795 147 HE22 GLN 53 HE22 GLN 53 -14.308 -6.844 -24.268 148 H VAL 54 HN VAL 54 -12.273 0.523 -26.879 149 HA VAL 54 HA VAL 54 -9.641 -0.022 -28.104 150 HB VAL 54 HB VAL 54 -9.809 2.050 -29.369 151 HG11 VAL 54 HG11 VAL 54 -11.905 -0.055 -29.610 152 HG12 VAL 54 HG12 VAL 54 -10.663 0.432 -30.764 153 HG13 VAL 54 HG13 VAL 54 -12.123 1.405 -30.577 154 HG21 VAL 54 HG21 VAL 54 -11.259 3.677 -28.799 155 HG22 VAL 54 HG22 VAL 54 -11.747 2.676 -27.431 156 HG23 VAL 54 HG23 VAL 54 -12.624 2.574 -28.956 157 H TYR 55 HN TYR 55 -9.656 3.143 -27.851 158 HA TYR 55 HA TYR 55 -8.741 3.144 -25.040 159 HB2 TYR 55 HB2 TYR 55 -7.629 4.711 -27.380 160 HB3 TYR 55 HB1 TYR 55 -7.096 4.859 -25.702 161 HD1 TYR 55 HD1 TYR 55 -7.124 2.712 -28.686 162 HD2 TYR 55 HD2 TYR 55 -5.864 3.045 -24.593 163 HE1 TYR 55 HE1 TYR 55 -5.615 0.770 -28.993 164 HE2 TYR 55 HE2 TYR 55 -4.354 1.100 -24.901 165 HH TYR 55 HH TYR 55 -4.181 -0.614 -28.027 166 H HIS 56 HN HIS 56 -11.100 4.268 -27.045 167 HA HIS 56 HA HIS 56 -11.308 6.965 -26.164 168 HB2 HIS 56 HB2 HIS 56 -13.527 6.878 -27.244 169 HB3 HIS 56 HB1 HIS 56 -12.258 6.248 -28.285 170 HD2 HIS 56 HD2 HIS 56 -13.214 3.647 -25.686 171 HE1 HIS 56 HE1 HIS 56 -15.380 2.693 -29.179 172 HE2 HIS 56 HE2 HIS 56 -14.670 1.858 -26.886 173 H ILE 57 HN ILE 57 -11.217 4.644 -24.164 174 HA ILE 57 HA ILE 57 -13.720 5.333 -22.746 175 HB ILE 57 HB ILE 57 -13.441 2.932 -23.425 176 HG12 ILE 57 HG12 ILE 57 -13.312 3.343 -20.435 177 HG13 ILE 57 HG11 ILE 57 -14.729 3.744 -21.407 178 HG21 ILE 57 HG21 ILE 57 -10.917 3.008 -23.065 179 HG22 ILE 57 HG22 ILE 57 -11.740 1.589 -22.417 180 HG23 ILE 57 HG23 ILE 57 -11.252 2.895 -21.337 181 HD11 ILE 57 HD1 ILE 57 -15.206 1.546 -20.714 182 HD12 ILE 57 HD2 ILE 57 -13.525 1.035 -20.863 183 HD13 ILE 57 HD3 ILE 57 -14.499 1.299 -22.310 184 H ILE 58 HN ILE 58 -13.369 6.714 -21.115 185 HA ILE 58 HA ILE 58 -11.000 6.309 -19.416 186 HB ILE 58 HB ILE 58 -11.889 8.964 -20.565 187 HG12 ILE 58 HG12 ILE 58 -9.256 7.483 -20.834 188 HG13 ILE 58 HG11 ILE 58 -10.545 7.399 -22.036 189 HG21 ILE 58 HG21 ILE 58 -9.714 8.276 -18.564 190 HG22 ILE 58 HG22 ILE 58 -11.181 9.196 -18.229 191 HG23 ILE 58 HG23 ILE 58 -9.948 9.861 -19.300 192 HD11 ILE 58 HD1 ILE 58 -10.414 9.763 -22.459 193 HD12 ILE 58 HD2 ILE 58 -8.768 9.133 -22.520 194 HD13 ILE 58 HD3 ILE 58 -9.327 10.003 -21.091 195 H VAL 59 HN VAL 59 -11.524 6.266 -17.304 196 HA VAL 59 HA VAL 59 -14.099 7.491 -16.511 197 HB VAL 59 HB VAL 59 -12.718 5.055 -15.367 198 HG11 VAL 59 HG11 VAL 59 -14.811 6.826 -14.348 199 HG12 VAL 59 HG12 VAL 59 -13.894 5.571 -13.513 200 HG13 VAL 59 HG13 VAL 59 -15.329 5.143 -14.444 201 HG21 VAL 59 HG21 VAL 59 -15.410 5.167 -16.719 202 HG22 VAL 59 HG22 VAL 59 -14.384 3.763 -16.424 203 HG23 VAL 59 HG23 VAL 59 -13.931 4.943 -17.653 204 H THR 60 HN THR 60 -13.807 9.247 -15.297 205 HA THR 60 HA THR 60 -11.614 9.253 -13.318 206 HB THR 60 HB THR 60 -12.445 11.590 -15.059 207 HG1 THR 60 HG1 THR 60 -9.850 10.748 -15.050 208 HG21 THR 60 HG21 THR 60 -11.818 12.348 -12.843 209 HG22 THR 60 HG22 THR 60 -10.483 12.685 -13.944 210 HG23 THR 60 HG23 THR 60 -10.395 11.308 -12.847 211 H ASP 61 HN ASP 61 -12.271 9.731 -11.303 212 HA ASP 61 HA ASP 61 -15.056 10.550 -10.915 213 HB2 ASP 61 HB2 ASP 61 -14.159 8.628 -9.639 214 HB3 ASP 61 HB1 ASP 61 -12.971 9.700 -8.894 215 H LEU 62 HN LEU 62 -15.374 12.702 -10.996 216 HA LEU 62 HA LEU 62 -13.401 14.653 -10.441 217 HB2 LEU 62 HB2 LEU 62 -16.416 14.821 -10.574 218 HB3 LEU 62 HB1 LEU 62 -15.376 16.228 -10.357 219 HG LEU 62 HG LEU 62 -15.099 14.273 -12.655 220 HD11 LEU 62 HD11 LEU 62 -16.201 15.975 -14.029 221 HD12 LEU 62 HD12 LEU 62 -16.405 17.011 -12.617 222 HD13 LEU 62 HD13 LEU 62 -17.273 15.479 -12.721 223 HD21 LEU 62 HD21 LEU 62 -13.047 15.470 -12.192 224 HD22 LEU 62 HD22 LEU 62 -13.916 16.997 -12.042 225 HD23 LEU 62 HD23 LEU 62 -13.787 16.206 -13.613 226 H SER 63 HN SER 63 -16.001 13.268 -8.469 227 HA SER 63 HA SER 63 -15.340 14.941 -6.193 228 HB2 SER 63 HB2 SER 63 -17.149 13.810 -5.077 229 HB3 SER 63 HB1 SER 63 -17.674 14.182 -6.715 230 HG SER 63 HG SER 63 -16.909 11.991 -7.225 231 H TYR 64 HN TYR 64 -14.123 12.100 -7.534 232 HA TYR 64 HA TYR 64 -12.754 10.424 -6.759 233 HB2 TYR 64 HB2 TYR 64 -12.005 12.647 -4.845 234 HB3 TYR 64 HB1 TYR 64 -11.087 11.153 -5.060 235 HD1 TYR 64 HD1 TYR 64 -12.048 14.361 -6.577 236 HD2 TYR 64 HD2 TYR 64 -9.902 10.686 -7.158 237 HE1 TYR 64 HE1 TYR 64 -10.902 15.341 -8.547 238 HE2 TYR 64 HE2 TYR 64 -8.757 11.666 -9.128 239 HH TYR 64 HH TYR 64 -9.566 14.930 -10.287 240 H GLY 65 HN GLY 65 -15.352 10.158 -5.842 241 HA2 GLY 65 HA2 GLY 65 -14.881 8.732 -3.330 242 HA3 GLY 65 HA1 GLY 65 -16.123 9.981 -3.314 243 H CYS 66 HN CYS 66 -16.622 7.243 -2.803 244 HA CYS 66 HA CYS 66 -17.778 6.077 -5.198 245 HB2 CYS 66 HB2 CYS 66 -16.737 4.653 -3.460 246 HB3 CYS 66 HB1 CYS 66 -17.969 5.181 -2.311 247 HG CYS 66 HG CYS 66 -18.359 3.013 -4.345 248 H GLY 67 HN GLY 67 -19.823 6.299 -5.865 249 HA2 GLY 67 HA2 GLY 67 -22.126 6.625 -5.755 250 HA3 GLY 67 HA1 GLY 67 -21.979 6.875 -4.017 251 H GLN 68 HN GLN 68 -19.689 8.750 -5.490 252 HA GLN 68 HA GLN 68 -21.326 11.160 -5.161 253 HB2 GLN 68 HB2 GLN 68 -18.345 10.739 -5.435 254 HB3 GLN 68 HB1 GLN 68 -19.104 12.328 -5.355 255 HG2 GLN 68 HG2 GLN 68 -20.092 11.765 -3.175 256 HG3 GLN 68 HG1 GLN 68 -19.361 10.162 -3.249 257 HE21 GLN 68 HE21 GLN 68 -17.758 10.273 -1.630 258 HE22 GLN 68 HE22 GLN 68 -16.546 11.460 -1.579 259 H SER 69 HN SER 69 -19.795 12.863 -6.835 260 HA SER 69 HA SER 69 -21.178 12.543 -9.284 261 HB2 SER 69 HB2 SER 69 -19.933 14.473 -10.029 262 HB3 SER 69 HB1 SER 69 -20.351 14.716 -8.335 263 HG SER 69 HG SER 69 -17.910 14.459 -9.523 264 H PHE 70 HN PHE 70 -20.333 12.138 -11.381 265 HA PHE 70 HA PHE 70 -17.784 10.652 -11.447 266 HB2 PHE 70 HB2 PHE 70 -20.380 9.802 -12.754 267 HB3 PHE 70 HB1 PHE 70 -18.820 9.003 -12.961 268 HD1 PHE 70 HD1 PHE 70 -21.739 9.364 -10.856 269 HD2 PHE 70 HD2 PHE 70 -17.654 8.040 -10.919 270 HE1 PHE 70 HE1 PHE 70 -22.129 8.061 -8.782 271 HE2 PHE 70 HE2 PHE 70 -18.044 6.737 -8.846 272 HZ PHE 70 HZ PHE 70 -20.282 6.747 -7.778 273 H ASP 71 HN ASP 71 -16.656 10.732 -13.407 274 HA ASP 71 HA ASP 71 -17.749 12.374 -15.570 275 HB2 ASP 71 HB2 ASP 71 -16.618 13.968 -14.069 276 HB3 ASP 71 HB1 ASP 71 -15.133 13.028 -14.194 277 H ILE 72 HN ILE 72 -17.438 11.211 -17.361 278 HA ILE 72 HA ILE 72 -14.908 9.689 -17.638 279 HB ILE 72 HB ILE 72 -16.175 8.021 -18.936 280 HG12 ILE 72 HG12 ILE 72 -18.630 9.595 -18.100 281 HG13 ILE 72 HG11 ILE 72 -17.920 9.663 -19.717 282 HG21 ILE 72 HG21 ILE 72 -17.484 7.067 -17.073 283 HG22 ILE 72 HG22 ILE 72 -17.418 8.615 -16.231 284 HG23 ILE 72 HG23 ILE 72 -15.939 7.693 -16.498 285 HD11 ILE 72 HD1 ILE 72 -18.472 6.953 -18.614 286 HD12 ILE 72 HD2 ILE 72 -18.631 7.551 -20.266 287 HD13 ILE 72 HD3 ILE 72 -19.873 7.924 -19.070 288 H VAL 73 HN VAL 73 -13.966 9.612 -19.650 289 HA VAL 73 HA VAL 73 -15.044 11.493 -21.648 290 HB VAL 73 HB VAL 73 -12.179 11.204 -20.725 291 HG11 VAL 73 HG11 VAL 73 -13.163 11.773 -23.308 292 HG12 VAL 73 HG12 VAL 73 -11.515 11.989 -22.719 293 HG13 VAL 73 HG13 VAL 73 -12.669 13.318 -22.617 294 HG21 VAL 73 HG21 VAL 73 -14.390 13.054 -20.190 295 HG22 VAL 73 HG22 VAL 73 -12.943 13.877 -20.775 296 HG23 VAL 73 HG23 VAL 73 -12.859 12.863 -19.335 297 H VAL 74 HN VAL 74 -15.057 10.822 -23.718 298 HA VAL 74 HA VAL 74 -13.729 8.248 -24.278 299 HB VAL 74 HB VAL 74 -16.091 7.845 -24.277 300 HG11 VAL 74 HG11 VAL 74 -16.195 10.385 -25.920 301 HG12 VAL 74 HG12 VAL 74 -16.969 10.070 -24.366 302 HG13 VAL 74 HG13 VAL 74 -17.553 9.264 -25.823 303 HG21 VAL 74 HG21 VAL 74 -16.511 7.584 -26.839 304 HG22 VAL 74 HG22 VAL 74 -15.176 6.685 -26.122 305 HG23 VAL 74 HG23 VAL 74 -14.858 8.173 -27.014 306 H VAL 75 HN VAL 75 -12.404 8.145 -25.958 307 HA VAL 75 HA VAL 75 -12.418 10.379 -27.895 308 HB VAL 75 HB VAL 75 -10.023 9.066 -26.620 309 HG11 VAL 75 HG11 VAL 75 -9.562 9.405 -28.973 310 HG12 VAL 75 HG12 VAL 75 -8.733 10.664 -28.056 311 HG13 VAL 75 HG13 VAL 75 -10.229 11.041 -28.913 312 HG21 VAL 75 HG21 VAL 75 -11.570 11.458 -26.093 313 HG22 VAL 75 HG22 VAL 75 -9.914 11.881 -26.528 314 HG23 VAL 75 HG23 VAL 75 -10.218 10.788 -25.179 315 H SER 76 HN SER 76 -13.269 9.466 -29.661 316 HA SER 76 HA SER 76 -11.720 7.389 -30.992 317 HB2 SER 76 HB2 SER 76 -13.611 5.883 -31.322 318 HB3 SER 76 HB1 SER 76 -13.316 6.098 -29.607 319 HG SER 76 HG SER 76 -15.426 6.472 -29.735 320 H ASP 77 HN ASP 77 -12.670 6.903 -33.187 321 HA ASP 77 HA ASP 77 -13.123 9.353 -34.575 322 HB2 ASP 77 HB2 ASP 77 -13.218 6.464 -35.446 323 HB3 ASP 77 HB1 ASP 77 -13.478 7.813 -36.549 324 H PHE 78 HN PHE 78 -15.182 7.363 -32.837 325 HA PHE 78 HA PHE 78 -17.530 7.277 -34.357 326 HB2 PHE 78 HB2 PHE 78 -17.179 6.086 -32.199 327 HB3 PHE 78 HB1 PHE 78 -17.307 7.633 -31.360 328 HD1 PHE 78 HD1 PHE 78 -19.143 5.191 -33.476 329 HD2 PHE 78 HD2 PHE 78 -19.417 8.690 -31.000 330 HE1 PHE 78 HE1 PHE 78 -21.616 4.994 -33.472 331 HE2 PHE 78 HE2 PHE 78 -21.885 8.494 -30.997 332 HZ PHE 78 HZ PHE 78 -22.988 6.646 -32.230 333 H PHE 79 HN PHE 79 -15.977 9.910 -32.705 334 HA PHE 79 HA PHE 79 -18.322 11.632 -32.755 335 HB2 PHE 79 HB2 PHE 79 -16.519 11.730 -30.979 336 HB3 PHE 79 HB1 PHE 79 -15.456 12.414 -32.205 337 HD1 PHE 79 HD1 PHE 79 -18.390 12.975 -30.093 338 HD2 PHE 79 HD2 PHE 79 -15.909 14.633 -33.171 339 HE1 PHE 79 HE1 PHE 79 -19.393 15.201 -29.695 340 HE2 PHE 79 HE2 PHE 79 -16.912 16.867 -32.778 341 HZ PHE 79 HZ PHE 79 -18.657 17.152 -31.042 342 H GLN 80 HN GLN 80 -16.282 10.539 -35.081 343 HA GLN 80 HA GLN 80 -15.752 13.014 -36.477 344 HB2 GLN 80 HB2 GLN 80 -15.525 10.125 -37.345 345 HB3 GLN 80 HB1 GLN 80 -14.974 11.506 -38.293 346 HG2 GLN 80 HG2 GLN 80 -13.446 12.158 -36.472 347 HG3 GLN 80 HG1 GLN 80 -14.008 10.792 -35.508 348 HE21 GLN 80 HE21 GLN 80 -14.080 9.625 -38.592 349 HE22 GLN 80 HE22 GLN 80 -12.516 8.973 -38.692 350 H GLY 81 HN GLY 81 -17.011 14.009 -37.929 351 HA2 GLY 81 HA2 GLY 81 -18.717 14.412 -39.427 352 HA3 GLY 81 HA1 GLY 81 -18.903 12.667 -39.595 353 H LYS 82 HN LYS 82 -19.076 14.169 -36.450 354 HA LYS 82 HA LYS 82 -22.003 14.180 -36.496 355 HB2 LYS 82 HB2 LYS 82 -21.207 11.873 -35.812 356 HB3 LYS 82 HB1 LYS 82 -20.508 12.631 -34.380 357 HG2 LYS 82 HG2 LYS 82 -22.555 13.100 -33.449 358 HG3 LYS 82 HG1 LYS 82 -23.351 13.274 -35.015 359 HD2 LYS 82 HD2 LYS 82 -24.166 11.242 -33.977 360 HD3 LYS 82 HD1 LYS 82 -23.123 10.790 -35.325 361 HE2 LYS 82 HE2 LYS 82 -21.253 10.429 -33.773 362 HE3 LYS 82 HE1 LYS 82 -22.274 10.907 -32.416 363 HZ1 LYS 82 HZ1 LYS 82 -23.027 8.843 -32.308 364 HZ2 LYS 82 HZ2 LYS 82 -22.054 8.390 -33.625 365 HZ3 LYS 82 HZ3 LYS 82 -23.633 8.959 -33.887 366 H SER 83 HN SER 83 -22.916 15.594 -35.097 367 HA SER 83 HA SER 83 -21.266 17.661 -34.018 368 HB2 SER 83 HB2 SER 83 -23.469 18.204 -34.864 369 HB3 SER 83 HB1 SER 83 -24.224 17.100 -33.718 370 HG SER 83 HG SER 83 -22.523 19.163 -32.829 371 H LYS 84 HN LYS 84 -21.368 18.388 -31.749 372 HA LYS 84 HA LYS 84 -20.532 16.372 -29.975 373 HB2 LYS 84 HB2 LYS 84 -21.478 19.200 -29.475 374 HB3 LYS 84 HB1 LYS 84 -20.801 18.163 -28.218 375 HG2 LYS 84 HG2 LYS 84 -18.726 17.922 -29.517 376 HG3 LYS 84 HG1 LYS 84 -19.397 18.942 -30.791 377 HD2 LYS 84 HD2 LYS 84 -19.591 20.813 -29.190 378 HD3 LYS 84 HD1 LYS 84 -18.917 19.793 -27.918 379 HE2 LYS 84 HE2 LYS 84 -16.838 19.533 -29.214 380 HE3 LYS 84 HE1 LYS 84 -17.507 20.540 -30.498 381 HZ1 LYS 84 HZ1 LYS 84 -16.080 21.808 -29.010 382 HZ2 LYS 84 HZ2 LYS 84 -17.067 21.398 -27.690 383 HZ3 LYS 84 HZ3 LYS 84 -17.679 22.368 -28.943 384 H LEU 85 HN LEU 85 -23.663 17.984 -30.381 385 HA LEU 85 HA LEU 85 -24.942 16.874 -28.122 386 HB2 LEU 85 HB2 LEU 85 -26.019 17.859 -30.768 387 HB3 LEU 85 HB1 LEU 85 -27.051 17.362 -29.427 388 HG LEU 85 HG LEU 85 -24.892 19.471 -29.177 389 HD11 LEU 85 HD11 LEU 85 -26.758 20.077 -30.783 390 HD12 LEU 85 HD12 LEU 85 -26.617 21.138 -29.381 391 HD13 LEU 85 HD13 LEU 85 -27.879 19.907 -29.432 392 HD21 LEU 85 HD21 LEU 85 -27.206 18.591 -27.425 393 HD22 LEU 85 HD22 LEU 85 -26.235 20.032 -27.123 394 HD23 LEU 85 HD23 LEU 85 -25.487 18.435 -27.064 395 H MET 86 HN MET 86 -24.644 15.737 -31.466 396 HA MET 86 HA MET 86 -26.340 13.481 -31.200 397 HB2 MET 86 HB2 MET 86 -24.075 14.077 -33.111 398 HB3 MET 86 HB1 MET 86 -25.116 12.659 -33.239 399 HG2 MET 86 HG2 MET 86 -26.079 15.534 -33.242 400 HG3 MET 86 HG1 MET 86 -25.921 14.512 -34.673 401 HE1 MET 86 HE1 MET 86 -28.712 14.817 -35.254 402 HE2 MET 86 HE2 MET 86 -28.254 16.035 -34.066 403 HE3 MET 86 HE3 MET 86 -29.720 15.087 -33.825 404 H ARG 87 HN ARG 87 -22.883 13.963 -30.671 405 HA ARG 87 HA ARG 87 -22.105 11.282 -30.389 406 HB2 ARG 87 HB2 ARG 87 -20.512 13.161 -30.549 407 HB3 ARG 87 HB1 ARG 87 -21.005 13.708 -28.948 408 HG2 ARG 87 HG2 ARG 87 -19.020 12.416 -28.618 409 HG3 ARG 87 HG1 ARG 87 -20.356 11.389 -28.101 410 HD2 ARG 87 HD2 ARG 87 -20.356 10.311 -30.349 411 HD3 ARG 87 HD1 ARG 87 -18.968 11.304 -30.794 412 HE ARG 87 HE ARG 87 -17.617 9.970 -29.424 413 HH11 ARG 87 HH11 ARG 87 -20.981 9.249 -29.053 414 HH12 ARG 87 HH12 ARG 87 -20.710 7.781 -28.175 415 HH21 ARG 87 HH21 ARG 87 -17.256 8.038 -28.301 416 HH22 ARG 87 HH22 ARG 87 -18.599 7.096 -27.747 417 H SER 88 HN SER 88 -23.350 13.599 -27.993 418 HA SER 88 HA SER 88 -23.052 11.983 -25.709 419 HB2 SER 88 HB2 SER 88 -25.071 14.143 -26.340 420 HB3 SER 88 HB1 SER 88 -24.865 13.420 -24.747 421 HG SER 88 HG SER 88 -23.414 15.335 -25.969 422 H ARG 89 HN ARG 89 -25.717 12.258 -28.045 423 HA ARG 89 HA ARG 89 -27.538 10.579 -26.691 424 HB2 ARG 89 HB2 ARG 89 -28.161 12.054 -28.576 425 HB3 ARG 89 HB1 ARG 89 -27.243 11.018 -29.669 426 HG2 ARG 89 HG2 ARG 89 -28.681 9.107 -29.091 427 HG3 ARG 89 HG1 ARG 89 -29.592 10.123 -27.972 428 HD2 ARG 89 HD2 ARG 89 -30.256 11.590 -29.835 429 HD3 ARG 89 HD1 ARG 89 -29.337 10.590 -30.957 430 HE ARG 89 HE ARG 89 -31.169 8.943 -29.585 431 HH11 ARG 89 HH11 ARG 89 -31.056 11.546 -31.862 432 HH12 ARG 89 HH12 ARG 89 -32.522 11.091 -32.664 433 HH21 ARG 89 HH21 ARG 89 -33.092 8.338 -30.635 434 HH22 ARG 89 HH22 ARG 89 -33.675 9.275 -31.970 435 H ALA 90 HN ALA 90 -25.080 9.870 -29.164 436 HA ALA 90 HA ALA 90 -25.666 7.119 -29.430 437 HB1 ALA 90 HB1 ALA 90 -23.808 8.951 -30.510 438 HB2 ALA 90 HB2 ALA 90 -24.101 7.289 -31.023 439 HB3 ALA 90 HB3 ALA 90 -22.862 7.633 -29.817 440 H VAL 91 HN VAL 91 -23.434 8.853 -27.331 441 HA VAL 91 HA VAL 91 -22.290 6.504 -26.161 442 HB VAL 91 HB VAL 91 -21.369 8.981 -26.257 443 HG11 VAL 91 HG11 VAL 91 -21.710 10.125 -24.070 444 HG12 VAL 91 HG12 VAL 91 -22.934 8.922 -23.662 445 HG13 VAL 91 HG13 VAL 91 -23.191 10.019 -25.017 446 HG21 VAL 91 HG21 VAL 91 -20.863 7.737 -23.602 447 HG22 VAL 91 HG22 VAL 91 -19.719 8.231 -24.851 448 HG23 VAL 91 HG23 VAL 91 -20.593 6.708 -25.008 449 H ASN 92 HN ASN 92 -24.679 8.898 -25.076 450 HA ASN 92 HA ASN 92 -25.266 7.657 -22.603 451 HB2 ASN 92 HB2 ASN 92 -25.856 9.995 -23.086 452 HB3 ASN 92 HB1 ASN 92 -27.023 9.457 -24.295 453 HD21 ASN 92 HD21 ASN 92 -27.896 10.969 -22.052 454 HD22 ASN 92 HD22 ASN 92 -28.819 9.964 -21.042 455 H LYS 93 HN LYS 93 -26.606 7.348 -25.838 456 HA LYS 93 HA LYS 93 -28.804 5.708 -25.249 457 HB2 LYS 93 HB2 LYS 93 -28.512 6.786 -27.427 458 HB3 LYS 93 HB1 LYS 93 -27.100 5.776 -27.748 459 HG2 LYS 93 HG2 LYS 93 -28.475 3.769 -27.582 460 HG3 LYS 93 HG1 LYS 93 -29.895 4.750 -27.225 461 HD2 LYS 93 HD2 LYS 93 -29.712 5.840 -29.425 462 HD3 LYS 93 HD1 LYS 93 -28.264 4.898 -29.778 463 HE2 LYS 93 HE2 LYS 93 -30.215 3.866 -30.847 464 HE3 LYS 93 HE1 LYS 93 -29.594 2.809 -29.581 465 HZ1 LYS 93 HZ1 LYS 93 -31.356 3.263 -28.212 466 HZ2 LYS 93 HZ2 LYS 93 -32.117 3.331 -29.728 467 HZ3 LYS 93 HZ3 LYS 93 -31.685 4.765 -28.926 468 H ALA 94 HN ALA 94 -25.441 4.917 -25.955 469 HA ALA 94 HA ALA 94 -25.725 2.115 -26.030 470 HB1 ALA 94 HB1 ALA 94 -23.709 3.503 -26.733 471 HB2 ALA 94 HB2 ALA 94 -23.360 2.020 -25.843 472 HB3 ALA 94 HB3 ALA 94 -23.289 3.580 -25.022 473 H VAL 95 HN VAL 95 -25.160 4.360 -23.353 474 HA VAL 95 HA VAL 95 -25.610 2.109 -21.487 475 HB VAL 95 HB VAL 95 -24.091 4.351 -20.378 476 HG11 VAL 95 HG11 VAL 95 -24.560 1.842 -19.610 477 HG12 VAL 95 HG12 VAL 95 -23.040 2.643 -19.212 478 HG13 VAL 95 HG13 VAL 95 -23.117 1.525 -20.574 479 HG21 VAL 95 HG21 VAL 95 -21.989 3.287 -21.623 480 HG22 VAL 95 HG22 VAL 95 -22.894 4.619 -22.344 481 HG23 VAL 95 HG23 VAL 95 -23.191 2.964 -22.872 482 H LYS 96 HN LYS 96 -27.805 3.386 -22.316 483 HA LYS 96 HA LYS 96 -28.544 5.696 -20.862 484 HB2 LYS 96 HB2 LYS 96 -30.096 3.537 -22.250 485 HB3 LYS 96 HB1 LYS 96 -30.930 4.751 -21.279 486 HG2 LYS 96 HG2 LYS 96 -29.889 6.540 -22.592 487 HG3 LYS 96 HG1 LYS 96 -29.010 5.340 -23.538 488 HD2 LYS 96 HD2 LYS 96 -30.896 4.644 -24.686 489 HD3 LYS 96 HD1 LYS 96 -31.982 5.054 -23.360 490 HE2 LYS 96 HE2 LYS 96 -32.336 6.620 -25.200 491 HE3 LYS 96 HE1 LYS 96 -31.606 7.470 -23.840 492 HZ1 LYS 96 HZ1 LYS 96 -29.464 7.291 -24.889 493 HZ2 LYS 96 HZ2 LYS 96 -30.561 8.027 -25.958 494 HZ3 LYS 96 HZ3 LYS 96 -30.120 6.400 -26.174 495 H GLU 97 HN GLU 97 -28.747 2.268 -20.127 496 HA GLU 97 HA GLU 97 -30.370 2.408 -17.846 497 HB2 GLU 97 HB2 GLU 97 -28.128 0.496 -18.545 498 HB3 GLU 97 HB1 GLU 97 -29.244 0.264 -17.199 499 HG2 GLU 97 HG2 GLU 97 -30.100 0.593 -20.089 500 HG3 GLU 97 HG1 GLU 97 -29.936 -0.961 -19.272 501 H GLU 98 HN GLU 98 -26.939 3.023 -18.310 502 HA GLU 98 HA GLU 98 -26.109 3.017 -15.624 503 HB2 GLU 98 HB2 GLU 98 -24.541 3.110 -17.516 504 HB3 GLU 98 HB1 GLU 98 -25.115 4.730 -17.913 505 HG2 GLU 98 HG2 GLU 98 -24.381 5.545 -15.714 506 HG3 GLU 98 HG1 GLU 98 -23.829 3.925 -15.289 507 H LEU 99 HN LEU 99 -27.448 5.618 -17.650 508 HA LEU 99 HA LEU 99 -27.270 7.647 -15.661 509 HB2 LEU 99 HB2 LEU 99 -28.691 7.340 -18.268 510 HB3 LEU 99 HB1 LEU 99 -29.199 8.632 -17.180 511 HG LEU 99 HG LEU 99 -26.563 9.019 -17.011 512 HD11 LEU 99 HD11 LEU 99 -25.529 8.662 -19.240 513 HD12 LEU 99 HD12 LEU 99 -26.976 7.793 -19.753 514 HD13 LEU 99 HD13 LEU 99 -25.966 7.142 -18.461 515 HD21 LEU 99 HD21 LEU 99 -28.711 10.046 -18.724 516 HD22 LEU 99 HD22 LEU 99 -27.096 10.350 -19.368 517 HD23 LEU 99 HD23 LEU 99 -27.525 10.921 -17.755 518 H GLN 100 HN GLN 100 -29.556 5.103 -16.274 519 HA GLN 100 HA GLN 100 -31.816 6.153 -14.981 520 HB2 GLN 100 HB2 GLN 100 -30.835 3.313 -15.308 521 HB3 GLN 100 HB1 GLN 100 -32.405 3.718 -14.612 522 HG2 GLN 100 HG2 GLN 100 -31.441 4.525 -17.372 523 HG3 GLN 100 HG1 GLN 100 -32.602 3.244 -17.026 524 HE21 GLN 100 HE21 GLN 100 -34.520 4.124 -15.510 525 HE22 GLN 100 HE22 GLN 100 -35.161 5.622 -15.984 526 H GLU 101 HN GLU 101 -29.000 4.420 -13.706 527 HA GLU 101 HA GLU 101 -30.053 4.500 -10.994 528 HB2 GLU 101 HB2 GLU 101 -27.383 3.570 -12.071 529 HB3 GLU 101 HB1 GLU 101 -27.919 3.400 -10.399 530 HG2 GLU 101 HG2 GLU 101 -29.383 2.259 -12.796 531 HG3 GLU 101 HG1 GLU 101 -28.307 1.335 -11.749 532 H ILE 102 HN ILE 102 -27.788 6.242 -13.007 533 HA ILE 102 HA ILE 102 -27.345 8.139 -10.786 534 HB ILE 102 HB ILE 102 -25.060 8.523 -11.798 535 HG12 ILE 102 HG12 ILE 102 -25.590 5.846 -13.106 536 HG13 ILE 102 HG11 ILE 102 -25.686 7.376 -13.976 537 HG21 ILE 102 HG21 ILE 102 -24.254 7.096 -10.219 538 HG22 ILE 102 HG22 ILE 102 -24.978 5.692 -11.005 539 HG23 ILE 102 HG23 ILE 102 -25.944 6.691 -9.919 540 HD11 ILE 102 HD1 ILE 102 -23.467 7.127 -14.348 541 HD12 ILE 102 HD2 ILE 102 -23.331 5.855 -13.135 542 HD13 ILE 102 HD3 ILE 102 -23.252 7.548 -12.649 543 H HIS 103 HN HIS 103 -27.186 10.316 -11.341 544 HA HIS 103 HA HIS 103 -27.511 11.082 -14.146 545 HB2 HIS 103 HB2 HIS 103 -29.814 10.722 -13.167 546 HB3 HIS 103 HB1 HIS 103 -29.468 12.046 -12.052 547 HD2 HIS 103 HD2 HIS 103 -30.477 11.531 -15.772 548 HE1 HIS 103 HE1 HIS 103 -29.826 15.664 -15.209 549 HE2 HIS 103 HE2 HIS 103 -30.711 13.912 -16.820 550 H ALA 104 HN ALA 104 -25.840 11.427 -11.458 551 HA ALA 104 HA ALA 104 -25.577 14.363 -11.649 552 HB1 ALA 104 HB1 ALA 104 -26.149 13.376 -9.407 553 HB2 ALA 104 HB2 ALA 104 -24.659 14.318 -9.423 554 HB3 ALA 104 HB3 ALA 104 -24.587 12.556 -9.433 555 H PHE 105 HN PHE 105 -24.420 12.801 -13.661 556 HA PHE 105 HA PHE 105 -21.583 13.386 -13.185 557 HB2 PHE 105 HB2 PHE 105 -20.837 11.245 -13.981 558 HB3 PHE 105 HB1 PHE 105 -21.991 10.950 -12.679 559 HD1 PHE 105 HD1 PHE 105 -21.344 10.680 -16.267 560 HD2 PHE 105 HD2 PHE 105 -24.298 10.189 -13.188 561 HE1 PHE 105 HE1 PHE 105 -22.747 9.361 -17.826 562 HE2 PHE 105 HE2 PHE 105 -25.704 8.873 -14.752 563 HZ PHE 105 HZ PHE 105 -24.927 8.456 -17.068 564 H SER 106 HN SER 106 -20.340 13.481 -15.196 565 HA SER 106 HA SER 106 -22.036 13.934 -17.577 566 HB2 SER 106 HB2 SER 106 -20.535 15.808 -18.176 567 HB3 SER 106 HB1 SER 106 -21.364 16.097 -16.648 568 HG SER 106 HG SER 106 -19.055 14.733 -16.283 569 H CYS 107 HN CYS 107 -21.100 13.430 -19.577 570 HA CYS 107 HA CYS 107 -18.514 12.008 -19.475 571 HB2 CYS 107 HB2 CYS 107 -20.858 11.073 -21.135 572 HB3 CYS 107 HB1 CYS 107 -19.359 10.210 -20.782 573 HG CYS 107 HG CYS 107 -21.800 10.356 -18.943 574 H LYS 108 HN LYS 108 -17.596 13.950 -20.344 575 HA LYS 108 HA LYS 108 -18.519 15.123 -22.766 576 HB2 LYS 108 HB2 LYS 108 -15.898 15.256 -21.276 577 HB3 LYS 108 HB1 LYS 108 -16.182 16.138 -22.777 578 HG2 LYS 108 HG2 LYS 108 -16.833 17.731 -21.216 579 HG3 LYS 108 HG1 LYS 108 -18.373 16.932 -21.532 580 HD2 LYS 108 HD2 LYS 108 -18.165 15.577 -19.550 581 HD3 LYS 108 HD1 LYS 108 -16.506 16.119 -19.290 582 HE2 LYS 108 HE2 LYS 108 -17.982 17.345 -17.788 583 HE3 LYS 108 HE1 LYS 108 -17.358 18.453 -19.010 584 HZ1 LYS 108 HZ1 LYS 108 -19.587 17.487 -20.175 585 HZ2 LYS 108 HZ2 LYS 108 -19.495 18.955 -19.326 586 HZ3 LYS 108 HZ3 LYS 108 -20.056 17.555 -18.546 587 H CYS 109 HN CYS 109 -17.955 14.747 -24.865 588 HA CYS 109 HA CYS 109 -16.196 12.420 -25.364 589 HB2 CYS 109 HB2 CYS 109 -18.578 13.409 -26.944 590 HB3 CYS 109 HB1 CYS 109 -17.538 12.065 -27.415 591 HG CYS 109 HG CYS 109 -19.102 10.714 -26.030 592 H TYR 110 HN TYR 110 -14.410 12.781 -26.519 593 HA TYR 110 HA TYR 110 -14.348 15.062 -28.373 594 HB2 TYR 110 HB2 TYR 110 -12.209 14.433 -26.320 595 HB3 TYR 110 HB1 TYR 110 -12.071 15.648 -27.593 596 HD1 TYR 110 HD1 TYR 110 -13.187 14.994 -24.254 597 HD2 TYR 110 HD2 TYR 110 -13.913 17.468 -27.688 598 HE1 TYR 110 HE1 TYR 110 -14.363 16.641 -22.820 599 HE2 TYR 110 HE2 TYR 110 -15.088 19.113 -26.256 600 HH TYR 110 HH TYR 110 -16.126 18.433 -23.148 601 H THR 111 HN THR 111 -12.906 14.843 -30.118 602 HA THR 111 HA THR 111 -11.435 12.327 -30.357 603 HB THR 111 HB THR 111 -13.572 13.159 -32.329 604 HG1 THR 111 HG1 THR 111 -13.479 11.500 -30.169 605 HG21 THR 111 HG21 THR 111 -11.342 12.072 -33.149 606 HG22 THR 111 HG22 THR 111 -12.872 11.394 -33.703 607 HG23 THR 111 HG23 THR 111 -11.978 10.607 -32.401 608 H GLU 112 HN GLU 112 -12.134 15.565 -31.385 609 HA GLU 112 HA GLU 112 -9.760 16.589 -31.939 610 HB2 GLU 112 HB2 GLU 112 -10.306 14.486 -33.941 611 HB3 GLU 112 HB1 GLU 112 -9.708 16.016 -34.588 612 HG2 GLU 112 HG2 GLU 112 -7.765 15.943 -33.163 613 HG3 GLU 112 HG1 GLU 112 -8.392 14.552 -32.283 614 H GLU 113 HN GLU 113 -12.973 16.109 -33.108 615 HA GLU 113 HA GLU 113 -13.145 18.282 -34.913 616 HB2 GLU 113 HB2 GLU 113 -15.266 16.886 -33.269 617 HB3 GLU 113 HB1 GLU 113 -15.607 18.103 -34.504 618 HG2 GLU 113 HG2 GLU 113 -15.783 16.128 -35.742 619 HG3 GLU 113 HG1 GLU 113 -14.102 16.577 -36.024 620 H GLU 114 HN GLU 114 -13.595 18.019 -31.428 621 HA GLU 114 HA GLU 114 -14.818 20.438 -30.859 622 HB2 GLU 114 HB2 GLU 114 -13.820 20.270 -28.646 623 HB3 GLU 114 HB1 GLU 114 -14.284 18.656 -29.186 624 HG2 GLU 114 HG2 GLU 114 -11.531 19.578 -29.866 625 HG3 GLU 114 HG1 GLU 114 -11.850 19.174 -28.180 626 H TRP 115 HN TRP 115 -11.676 19.834 -32.106 627 HA TRP 115 HA TRP 115 -10.468 22.302 -31.258 628 HB2 TRP 115 HB2 TRP 115 -8.582 21.361 -32.070 629 HB3 TRP 115 HB1 TRP 115 -9.550 19.910 -32.358 630 HD1 TRP 115 HD1 TRP 115 -7.333 22.134 -34.134 631 HE1 TRP 115 HE1 TRP 115 -7.732 22.076 -36.680 632 HE3 TRP 115 HE3 TRP 115 -11.880 19.819 -34.257 633 HZ2 TRP 115 HZ2 TRP 115 -9.724 21.170 -38.525 634 HZ3 TRP 115 HZ3 TRP 115 -13.011 19.379 -36.416 635 HH2 TRP 115 HH2 TRP 115 -11.940 20.051 -38.549 636 H SER 116 HN SER 116 -13.002 21.772 -33.228 637 HA SER 116 HA SER 116 -12.347 23.264 -35.553 638 HB2 SER 116 HB2 SER 116 -14.704 23.228 -36.034 639 HB3 SER 116 HB1 SER 116 -14.257 21.662 -35.364 640 HG SER 116 HG SER 116 -16.163 23.098 -34.513 641 H LYS 117 HN LYS 117 -13.274 25.370 -36.146 642 HA LYS 117 HA LYS 117 -13.283 27.650 -35.757 643 HB2 LYS 117 HB2 LYS 117 -15.555 26.550 -34.778 644 HB3 LYS 117 HB1 LYS 117 -14.934 27.329 -33.325 645 HG2 LYS 117 HG2 LYS 117 -14.650 29.442 -34.665 646 HG3 LYS 117 HG1 LYS 117 -15.466 28.638 -36.007 647 HD2 LYS 117 HD2 LYS 117 -17.136 29.901 -34.815 648 HD3 LYS 117 HD1 LYS 117 -17.406 28.197 -34.441 649 HE2 LYS 117 HE2 LYS 117 -16.217 28.429 -32.323 650 HE3 LYS 117 HE1 LYS 117 -15.803 30.100 -32.705 651 HZ1 LYS 117 HZ1 LYS 117 -18.627 29.424 -32.830 652 HZ2 LYS 117 HZ2 LYS 117 -17.867 30.820 -32.231 653 HZ3 LYS 117 HZ3 LYS 117 -17.937 29.413 -31.281 654 H ILE 118 HN ILE 118 -13.674 29.025 -33.295 655 HA ILE 118 HA ILE 118 -12.327 30.034 -31.715 656 HB ILE 118 HB ILE 118 -11.858 27.116 -31.057 657 HG12 ILE 118 HG12 ILE 118 -13.810 29.081 -29.830 658 HG13 ILE 118 HG11 ILE 118 -14.255 27.985 -31.140 659 HG21 ILE 118 HG21 ILE 118 -11.734 28.482 -28.711 660 HG22 ILE 118 HG22 ILE 118 -11.028 29.669 -29.807 661 HG23 ILE 118 HG23 ILE 118 -10.314 28.063 -29.668 662 HD11 ILE 118 HD1 ILE 118 -12.913 26.888 -28.687 663 HD12 ILE 118 HD2 ILE 118 -14.003 26.081 -29.814 664 HD13 ILE 118 HD3 ILE 118 -14.640 27.243 -28.648 665 H VAL 119 HN VAL 119 -10.235 27.242 -31.738 666 HA VAL 119 HA VAL 119 -7.885 28.770 -32.084 667 HB VAL 119 HB VAL 119 -8.398 25.806 -32.399 668 HG11 VAL 119 HG11 VAL 119 -5.671 26.540 -31.778 669 HG12 VAL 119 HG12 VAL 119 -6.176 27.291 -33.292 670 HG13 VAL 119 HG13 VAL 119 -6.278 25.541 -33.099 671 HG21 VAL 119 HG21 VAL 119 -7.495 25.651 -30.166 672 HG22 VAL 119 HG22 VAL 119 -8.748 26.894 -30.144 673 HG23 VAL 119 HG23 VAL 119 -7.045 27.357 -30.174 674 H VAL 120 HN VAL 120 -9.740 26.755 -34.344 675 HA VAL 120 HA VAL 120 -8.209 27.992 -36.554 676 HB VAL 120 HB VAL 120 -9.433 25.231 -36.366 677 HG11 VAL 120 HG11 VAL 120 -9.743 26.314 -38.607 678 HG12 VAL 120 HG12 VAL 120 -8.688 24.900 -38.656 679 HG13 VAL 120 HG13 VAL 120 -7.994 26.521 -38.702 680 HG21 VAL 120 HG21 VAL 120 -6.640 25.519 -37.183 681 HG22 VAL 120 HG22 VAL 120 -7.338 24.502 -35.922 682 HG23 VAL 120 HG23 VAL 120 -6.940 26.186 -35.578 683 H LEU 121 HN LEU 121 -9.342 29.131 -37.979 684 HA LEU 121 HA LEU 121 -11.125 29.758 -39.347 685 HB2 LEU 121 HB2 LEU 121 -12.000 27.402 -39.092 686 HB3 LEU 121 HB1 LEU 121 -12.869 27.947 -37.660 687 HG LEU 121 HG LEU 121 -14.041 29.648 -39.029 688 HD11 LEU 121 HD11 LEU 121 -13.682 28.804 -41.637 689 HD12 LEU 121 HD12 LEU 121 -12.047 28.740 -40.979 690 HD13 LEU 121 HD13 LEU 121 -12.960 30.248 -40.925 691 HD21 LEU 121 HD21 LEU 121 -15.469 27.869 -38.990 692 HD22 LEU 121 HD22 LEU 121 -14.212 26.726 -39.464 693 HD23 LEU 121 HD23 LEU 121 -15.019 27.709 -40.687 694 H GLU 122 HN GLU 122 -10.247 30.738 -36.610 695 HA GLU 122 HA GLU 122 -12.460 31.766 -35.197 696 HB2 GLU 122 HB2 GLU 122 -10.228 31.714 -34.222 697 HB3 GLU 122 HB1 GLU 122 -9.643 32.845 -35.442 698 HG2 GLU 122 HG2 GLU 122 -10.121 34.091 -33.420 699 HG3 GLU 122 HG1 GLU 122 -11.336 34.506 -34.628 700 H HIS 123 HN HIS 123 -10.514 33.131 -37.830 701 HA HIS 123 HA HIS 123 -11.978 35.609 -37.888 702 HB2 HIS 123 HB2 HIS 123 -9.998 34.348 -39.792 703 HB3 HIS 123 HB1 HIS 123 -10.726 35.933 -40.058 704 HD2 HIS 123 HD2 HIS 123 -10.364 36.134 -36.445 705 HE1 HIS 123 HE1 HIS 123 -6.455 37.002 -37.779 706 HE2 HIS 123 HE2 HIS 123 -8.032 37.107 -35.791 707 H HIS 124 HN HIS 124 -13.428 36.308 -39.501 708 HA HIS 124 HA HIS 124 -14.850 34.099 -40.854 709 HB2 HIS 124 HB2 HIS 124 -15.825 36.818 -39.952 710 HB3 HIS 124 HB1 HIS 124 -16.791 35.671 -40.880 711 HD2 HIS 124 HD2 HIS 124 -17.845 33.535 -39.382 712 HE1 HIS 124 HE1 HIS 124 -16.076 34.590 -35.697 713 HE2 HIS 124 HE2 HIS 124 -17.736 33.032 -36.822 714 H HIS 125 HN HIS 125 -15.218 34.179 -43.022 715 HA HIS 125 HA HIS 125 -13.569 35.922 -44.598 716 HB2 HIS 125 HB2 HIS 125 -15.704 33.928 -45.395 717 HB3 HIS 125 HB1 HIS 125 -14.620 34.747 -46.521 718 HD2 HIS 125 HD2 HIS 125 -14.620 31.628 -44.287 719 HE1 HIS 125 HE1 HIS 125 -10.594 32.308 -45.359 720 HE2 HIS 125 HE2 HIS 125 -12.199 30.650 -44.301 721 H HIS 126 HN HIS 126 -14.179 37.584 -45.965 722 HA HIS 126 HA HIS 126 -16.992 38.470 -45.822 723 HB2 HIS 126 HB2 HIS 126 -15.516 39.751 -44.220 724 HB3 HIS 126 HB1 HIS 126 -14.629 40.345 -45.624 725 HD2 HIS 126 HD2 HIS 126 -17.987 41.002 -43.781 726 HE1 HIS 126 HE1 HIS 126 -17.964 43.424 -47.237 727 HE2 HIS 126 HE2 HIS 126 -19.183 42.936 -45.064 728 H HIS 127 HN HIS 127 -17.830 38.929 -47.767 729 HA HIS 127 HA HIS 127 -17.990 39.292 -50.028 730 HB2 HIS 127 HB2 HIS 127 -15.697 40.943 -49.158 731 HB3 HIS 127 HB1 HIS 127 -15.774 40.597 -50.886 732 HD2 HIS 127 HD2 HIS 127 -17.629 42.134 -52.256 733 HE1 HIS 127 HE1 HIS 127 -19.721 43.633 -48.910 734 HE2 HIS 127 HE2 HIS 127 -19.504 43.756 -51.437 735 H HIS 128 HN HIS 128 -17.867 37.135 -50.654 736 HA HIS 128 HA HIS 128 -17.039 35.447 -51.987 737 HB2 HIS 128 HB2 HIS 128 -14.552 37.161 -52.199 738 HB3 HIS 128 HB1 HIS 128 -14.951 35.771 -53.207 739 HD2 HIS 128 HD2 HIS 128 -15.473 39.539 -53.260 740 HE1 HIS 128 HE1 HIS 128 -18.427 37.947 -55.822 741 HE2 HIS 128 HE2 HIS 128 -17.268 40.080 -55.078 Start of MODEL 3 1 H1 MET 36 HT1 MET 36 -29.123 -1.137 -7.598 2 H2 MET 36 HT2 MET 36 -28.067 -1.293 -6.276 3 H3 MET 36 HT3 MET 36 -28.787 -2.672 -6.957 4 HA MET 36 HA MET 36 -26.443 -2.414 -7.607 5 HB2 MET 36 HB2 MET 36 -28.755 -2.532 -9.466 6 HB3 MET 36 HB1 MET 36 -27.182 -2.244 -10.210 7 HG2 MET 36 HG2 MET 36 -26.269 -4.230 -9.070 8 HG3 MET 36 HG1 MET 36 -27.835 -4.518 -8.311 9 HE1 MET 36 HE1 MET 36 -27.645 -6.835 -9.094 10 HE2 MET 36 HE2 MET 36 -26.268 -6.740 -10.187 11 HE3 MET 36 HE3 MET 36 -27.789 -7.423 -10.756 12 HA PRO 37 HA PRO 37 -26.071 2.152 -8.083 13 HB2 PRO 37 HB2 PRO 37 -23.576 2.271 -6.957 14 HB3 PRO 37 HB1 PRO 37 -25.080 2.307 -6.014 15 HG2 PRO 37 HG2 PRO 37 -23.225 0.030 -6.534 16 HG3 PRO 37 HG1 PRO 37 -24.073 0.483 -5.044 17 HD2 PRO 37 HD2 PRO 37 -24.957 -1.525 -6.665 18 HD3 PRO 37 HD1 PRO 37 -26.062 -0.516 -5.702 19 H VAL 38 HN VAL 38 -24.859 3.362 -9.558 20 HA VAL 38 HA VAL 38 -23.802 1.988 -11.792 21 HB VAL 38 HB VAL 38 -24.816 4.253 -11.892 22 HG11 VAL 38 HG11 VAL 38 -23.500 6.185 -11.168 23 HG12 VAL 38 HG12 VAL 38 -22.208 5.123 -10.608 24 HG13 VAL 38 HG13 VAL 38 -23.775 5.109 -9.799 25 HG21 VAL 38 HG21 VAL 38 -23.253 3.394 -13.660 26 HG22 VAL 38 HG22 VAL 38 -21.929 4.205 -12.826 27 HG23 VAL 38 HG23 VAL 38 -23.244 5.152 -13.520 28 H THR 39 HN THR 39 -22.296 3.486 -8.984 29 HA THR 39 HA THR 39 -20.129 3.500 -8.219 30 HB THR 39 HB THR 39 -18.980 1.264 -9.475 31 HG1 THR 39 HG1 THR 39 -21.706 0.849 -8.819 32 HG21 THR 39 HG21 THR 39 -18.559 1.300 -7.238 33 HG22 THR 39 HG22 THR 39 -19.998 0.284 -7.156 34 HG23 THR 39 HG23 THR 39 -20.124 2.016 -6.854 35 H GLU 40 HN GLU 40 -18.479 4.748 -8.817 36 HA GLU 40 HA GLU 40 -18.113 5.608 -11.476 37 HB2 GLU 40 HB2 GLU 40 -17.452 6.946 -9.520 38 HB3 GLU 40 HB1 GLU 40 -16.191 5.774 -9.143 39 HG2 GLU 40 HG2 GLU 40 -15.157 7.577 -10.363 40 HG3 GLU 40 HG1 GLU 40 -15.236 6.192 -11.447 41 H GLN 41 HN GLN 41 -16.323 3.249 -9.498 42 HA GLN 41 HA GLN 41 -14.315 2.678 -11.420 43 HB2 GLN 41 HB2 GLN 41 -15.437 1.055 -9.130 44 HB3 GLN 41 HB1 GLN 41 -14.041 0.558 -10.086 45 HG2 GLN 41 HG2 GLN 41 -14.267 3.159 -8.545 46 HG3 GLN 41 HG1 GLN 41 -13.357 1.744 -8.019 47 HE21 GLN 41 HE21 GLN 41 -12.763 4.681 -9.267 48 HE22 GLN 41 HE22 GLN 41 -11.449 4.334 -10.284 49 H GLY 42 HN GLY 42 -17.453 1.249 -10.716 50 HA2 GLY 42 HA2 GLY 42 -17.349 -0.872 -12.614 51 HA3 GLY 42 HA1 GLY 42 -18.801 -0.235 -11.841 52 H LEU 43 HN LEU 43 -18.166 2.494 -12.768 53 HA LEU 43 HA LEU 43 -19.776 2.586 -15.030 54 HB2 LEU 43 HB2 LEU 43 -19.419 4.525 -13.573 55 HB3 LEU 43 HB1 LEU 43 -17.731 4.600 -14.077 56 HG LEU 43 HG LEU 43 -18.411 4.994 -16.399 57 HD11 LEU 43 HD11 LEU 43 -20.568 3.691 -16.186 58 HD12 LEU 43 HD12 LEU 43 -20.718 5.221 -17.040 59 HD13 LEU 43 HD13 LEU 43 -21.257 5.092 -15.366 60 HD21 LEU 43 HD21 LEU 43 -19.021 7.248 -16.121 61 HD22 LEU 43 HD22 LEU 43 -18.298 6.852 -14.562 62 HD23 LEU 43 HD23 LEU 43 -20.053 6.896 -14.736 63 H ARG 44 HN ARG 44 -16.247 2.577 -14.778 64 HA ARG 44 HA ARG 44 -15.671 3.092 -17.471 65 HB2 ARG 44 HB2 ARG 44 -13.997 3.094 -15.650 66 HB3 ARG 44 HB1 ARG 44 -14.143 1.341 -15.530 67 HG2 ARG 44 HG2 ARG 44 -13.422 1.112 -17.877 68 HG3 ARG 44 HG1 ARG 44 -13.268 2.864 -18.003 69 HD2 ARG 44 HD2 ARG 44 -11.599 2.813 -16.152 70 HD3 ARG 44 HD1 ARG 44 -11.707 1.055 -16.139 71 HE ARG 44 HE ARG 44 -10.364 2.694 -18.131 72 HH11 ARG 44 HH11 ARG 44 -11.759 -0.358 -17.290 73 HH12 ARG 44 HH12 ARG 44 -10.855 -1.252 -18.467 74 HH21 ARG 44 HH21 ARG 44 -9.175 1.530 -19.677 75 HH22 ARG 44 HH22 ARG 44 -9.393 -0.183 -19.818 76 H GLU 45 HN GLU 45 -16.268 0.046 -15.765 77 HA GLU 45 HA GLU 45 -15.805 -1.675 -17.961 78 HB2 GLU 45 HB2 GLU 45 -17.439 -2.034 -15.440 79 HB3 GLU 45 HB1 GLU 45 -17.154 -3.322 -16.612 80 HG2 GLU 45 HG2 GLU 45 -15.411 -3.683 -15.117 81 HG3 GLU 45 HG1 GLU 45 -14.625 -2.645 -16.307 82 H ARG 46 HN ARG 46 -18.699 -0.078 -16.722 83 HA ARG 46 HA ARG 46 -20.537 -1.369 -18.459 84 HB2 ARG 46 HB2 ARG 46 -21.101 -0.132 -16.320 85 HB3 ARG 46 HB1 ARG 46 -20.868 1.366 -17.224 86 HG2 ARG 46 HG2 ARG 46 -22.588 0.687 -18.837 87 HG3 ARG 46 HG1 ARG 46 -22.806 -0.837 -17.985 88 HD2 ARG 46 HD2 ARG 46 -23.406 0.505 -15.925 89 HD3 ARG 46 HD1 ARG 46 -23.403 1.942 -16.944 90 HE ARG 46 HE ARG 46 -25.410 -0.150 -16.910 91 HH11 ARG 46 HH11 ARG 46 -23.910 2.406 -18.680 92 HH12 ARG 46 HH12 ARG 46 -25.284 2.699 -19.696 93 HH21 ARG 46 HH21 ARG 46 -27.214 0.216 -18.233 94 HH22 ARG 46 HH22 ARG 46 -27.157 1.456 -19.441 95 H ILE 47 HN ILE 47 -18.751 1.666 -18.603 96 HA ILE 47 HA ILE 47 -19.881 2.640 -20.992 97 HB ILE 47 HB ILE 47 -17.201 3.143 -19.704 98 HG12 ILE 47 HG12 ILE 47 -19.255 3.802 -18.459 99 HG13 ILE 47 HG11 ILE 47 -18.273 5.188 -18.935 100 HG21 ILE 47 HG21 ILE 47 -18.531 4.866 -21.797 101 HG22 ILE 47 HG22 ILE 47 -17.394 3.595 -22.244 102 HG23 ILE 47 HG23 ILE 47 -16.866 4.931 -21.223 103 HD11 ILE 47 HD1 ILE 47 -19.743 5.462 -20.947 104 HD12 ILE 47 HD2 ILE 47 -20.608 5.683 -19.427 105 HD13 ILE 47 HD3 ILE 47 -20.773 4.174 -20.325 106 H GLU 48 HN GLU 48 -17.024 0.673 -20.335 107 HA GLU 48 HA GLU 48 -16.038 0.531 -22.966 108 HB2 GLU 48 HB2 GLU 48 -14.732 -0.163 -21.017 109 HB3 GLU 48 HB1 GLU 48 -15.848 -1.500 -20.718 110 HG2 GLU 48 HG2 GLU 48 -15.290 -2.451 -22.934 111 HG3 GLU 48 HG1 GLU 48 -14.198 -1.102 -23.245 112 H SER 49 HN SER 49 -18.347 -1.509 -21.207 113 HA SER 49 HA SER 49 -18.819 -3.113 -23.599 114 HB2 SER 49 HB2 SER 49 -20.224 -4.478 -22.189 115 HB3 SER 49 HB1 SER 49 -18.716 -4.161 -21.337 116 HG SER 49 HG SER 49 -19.772 -2.564 -20.156 117 H ALA 50 HN ALA 50 -19.961 -0.206 -22.286 118 HA ALA 50 HA ALA 50 -22.677 -0.554 -23.356 119 HB1 ALA 50 HB1 ALA 50 -22.978 1.790 -22.444 120 HB2 ALA 50 HB2 ALA 50 -21.347 1.656 -21.784 121 HB3 ALA 50 HB3 ALA 50 -22.613 0.554 -21.241 122 H ILE 51 HN ILE 51 -19.725 0.230 -24.566 123 HA ILE 51 HA ILE 51 -20.924 1.931 -26.661 124 HB ILE 51 HB ILE 51 -18.980 3.291 -26.753 125 HG12 ILE 51 HG12 ILE 51 -17.666 1.479 -24.705 126 HG13 ILE 51 HG11 ILE 51 -17.396 1.325 -26.440 127 HG21 ILE 51 HG21 ILE 51 -20.022 2.693 -24.014 128 HG22 ILE 51 HG22 ILE 51 -20.165 4.169 -24.967 129 HG23 ILE 51 HG23 ILE 51 -18.644 3.782 -24.164 130 HD11 ILE 51 HD1 ILE 51 -15.665 2.725 -25.257 131 HD12 ILE 51 HD2 ILE 51 -16.939 3.893 -24.908 132 HD13 ILE 51 HD3 ILE 51 -16.488 3.554 -26.577 133 HA PRO 52 HA PRO 52 -19.219 -0.653 -29.770 134 HB2 PRO 52 HB2 PRO 52 -17.501 1.489 -30.866 135 HB3 PRO 52 HB1 PRO 52 -18.855 0.629 -31.625 136 HG2 PRO 52 HG2 PRO 52 -19.069 3.171 -30.837 137 HG3 PRO 52 HG1 PRO 52 -20.427 2.037 -30.734 138 HD2 PRO 52 HD2 PRO 52 -18.632 3.028 -28.542 139 HD3 PRO 52 HD1 PRO 52 -20.383 2.706 -28.507 140 H GLN 53 HN GLN 53 -17.513 -0.066 -27.243 141 HA GLN 53 HA GLN 53 -15.581 -0.902 -26.341 142 HB2 GLN 53 HB2 GLN 53 -15.022 -2.184 -29.017 143 HB3 GLN 53 HB1 GLN 53 -14.506 -2.720 -27.413 144 HG2 GLN 53 HG2 GLN 53 -17.332 -2.713 -28.506 145 HG3 GLN 53 HG1 GLN 53 -16.348 -4.124 -28.129 146 HE21 GLN 53 HE21 GLN 53 -18.936 -2.593 -26.943 147 HE22 GLN 53 HE22 GLN 53 -18.684 -2.772 -25.275 148 H VAL 54 HN VAL 54 -15.762 1.154 -28.937 149 HA VAL 54 HA VAL 54 -14.083 2.241 -30.226 150 HB VAL 54 HB VAL 54 -13.328 4.091 -28.773 151 HG11 VAL 54 HG11 VAL 54 -16.162 3.090 -28.591 152 HG12 VAL 54 HG12 VAL 54 -15.516 4.383 -29.603 153 HG13 VAL 54 HG13 VAL 54 -15.691 4.631 -27.866 154 HG21 VAL 54 HG21 VAL 54 -14.469 3.748 -26.346 155 HG22 VAL 54 HG22 VAL 54 -12.783 3.343 -26.671 156 HG23 VAL 54 HG23 VAL 54 -14.016 2.082 -26.698 157 H TYR 55 HN TYR 55 -11.786 3.373 -28.556 158 HA TYR 55 HA TYR 55 -10.010 1.030 -28.822 159 HB2 TYR 55 HB2 TYR 55 -9.481 2.676 -30.517 160 HB3 TYR 55 HB1 TYR 55 -9.438 3.962 -29.309 161 HD1 TYR 55 HD1 TYR 55 -7.801 0.761 -30.319 162 HD2 TYR 55 HD2 TYR 55 -7.476 4.405 -28.067 163 HE1 TYR 55 HE1 TYR 55 -5.409 0.275 -29.877 164 HE2 TYR 55 HE2 TYR 55 -5.086 3.919 -27.625 165 HH TYR 55 HH TYR 55 -3.717 1.116 -27.803 166 H HIS 56 HN HIS 56 -10.683 3.997 -26.998 167 HA HIS 56 HA HIS 56 -9.752 2.731 -24.563 168 HB2 HIS 56 HB2 HIS 56 -7.660 3.613 -25.645 169 HB3 HIS 56 HB1 HIS 56 -8.345 5.235 -25.516 170 HD2 HIS 56 HD2 HIS 56 -7.227 2.338 -23.033 171 HE1 HIS 56 HE1 HIS 56 -7.250 6.006 -20.945 172 HE2 HIS 56 HE2 HIS 56 -6.700 3.533 -20.772 173 H ILE 57 HN ILE 57 -10.914 3.470 -22.870 174 HA ILE 57 HA ILE 57 -12.100 6.162 -23.052 175 HB ILE 57 HB ILE 57 -14.247 5.318 -22.249 176 HG12 ILE 57 HG12 ILE 57 -13.051 2.556 -22.608 177 HG13 ILE 57 HG11 ILE 57 -13.256 3.341 -21.042 178 HG21 ILE 57 HG21 ILE 57 -14.919 4.893 -24.369 179 HG22 ILE 57 HG22 ILE 57 -13.907 3.454 -24.483 180 HG23 ILE 57 HG23 ILE 57 -13.217 5.044 -24.806 181 HD11 ILE 57 HD1 ILE 57 -15.581 3.046 -22.934 182 HD12 ILE 57 HD2 ILE 57 -15.604 3.301 -21.188 183 HD13 ILE 57 HD3 ILE 57 -15.128 1.735 -21.844 184 H ILE 58 HN ILE 58 -11.998 7.287 -21.184 185 HA ILE 58 HA ILE 58 -11.358 5.810 -18.708 186 HB ILE 58 HB ILE 58 -10.117 8.418 -19.617 187 HG12 ILE 58 HG12 ILE 58 -9.261 6.435 -20.819 188 HG13 ILE 58 HG11 ILE 58 -8.041 7.073 -19.714 189 HG21 ILE 58 HG21 ILE 58 -10.335 8.446 -17.226 190 HG22 ILE 58 HG22 ILE 58 -8.669 7.975 -17.569 191 HG23 ILE 58 HG23 ILE 58 -9.853 6.753 -17.102 192 HD11 ILE 58 HD1 ILE 58 -7.921 5.031 -18.771 193 HD12 ILE 58 HD2 ILE 58 -9.287 4.461 -19.731 194 HD13 ILE 58 HD3 ILE 58 -9.569 5.266 -18.187 195 H VAL 59 HN VAL 59 -12.616 6.328 -16.991 196 HA VAL 59 HA VAL 59 -14.290 8.750 -17.245 197 HB VAL 59 HB VAL 59 -14.919 6.168 -15.798 198 HG11 VAL 59 HG11 VAL 59 -15.939 8.846 -15.470 199 HG12 VAL 59 HG12 VAL 59 -16.428 7.371 -14.637 200 HG13 VAL 59 HG13 VAL 59 -17.206 7.826 -16.151 201 HG21 VAL 59 HG21 VAL 59 -16.883 6.502 -17.629 202 HG22 VAL 59 HG22 VAL 59 -15.410 5.592 -17.965 203 HG23 VAL 59 HG23 VAL 59 -15.549 7.272 -18.488 204 H THR 60 HN THR 60 -14.093 10.268 -15.755 205 HA THR 60 HA THR 60 -12.722 9.600 -13.225 206 HB THR 60 HB THR 60 -12.495 12.163 -14.815 207 HG1 THR 60 HG1 THR 60 -10.953 11.108 -15.741 208 HG21 THR 60 HG21 THR 60 -11.059 11.296 -12.294 209 HG22 THR 60 HG22 THR 60 -12.436 12.397 -12.315 210 HG23 THR 60 HG23 THR 60 -10.929 12.857 -13.106 211 H ASP 61 HN ASP 61 -13.726 10.172 -11.409 212 HA ASP 61 HA ASP 61 -16.288 11.561 -11.615 213 HB2 ASP 61 HB2 ASP 61 -16.172 9.439 -10.354 214 HB3 ASP 61 HB1 ASP 61 -14.984 10.161 -9.265 215 H LEU 62 HN LEU 62 -16.143 13.718 -11.565 216 HA LEU 62 HA LEU 62 -14.141 15.003 -9.846 217 HB2 LEU 62 HB2 LEU 62 -15.881 15.937 -12.109 218 HB3 LEU 62 HB1 LEU 62 -15.164 17.102 -10.998 219 HG LEU 62 HG LEU 62 -13.816 16.510 -13.118 220 HD11 LEU 62 HD11 LEU 62 -13.023 17.562 -10.870 221 HD12 LEU 62 HD12 LEU 62 -11.806 16.927 -11.977 222 HD13 LEU 62 HD13 LEU 62 -12.297 15.982 -10.572 223 HD21 LEU 62 HD21 LEU 62 -14.257 14.002 -12.741 224 HD22 LEU 62 HD22 LEU 62 -13.044 14.097 -11.464 225 HD23 LEU 62 HD23 LEU 62 -12.599 14.459 -13.131 226 H SER 63 HN SER 63 -17.198 13.842 -9.538 227 HA SER 63 HA SER 63 -17.904 15.886 -7.534 228 HB2 SER 63 HB2 SER 63 -19.784 14.295 -9.280 229 HB3 SER 63 HB1 SER 63 -20.276 15.380 -7.983 230 HG SER 63 HG SER 63 -19.858 16.036 -10.446 231 H TYR 64 HN TYR 64 -19.876 14.744 -6.189 232 HA TYR 64 HA TYR 64 -18.870 13.229 -4.237 233 HB2 TYR 64 HB2 TYR 64 -21.296 13.993 -4.536 234 HB3 TYR 64 HB1 TYR 64 -21.547 12.480 -5.412 235 HD1 TYR 64 HD1 TYR 64 -20.262 13.846 -2.179 236 HD2 TYR 64 HD2 TYR 64 -21.960 10.478 -4.232 237 HE1 TYR 64 HE1 TYR 64 -20.506 12.652 -0.019 238 HE2 TYR 64 HE2 TYR 64 -22.201 9.280 -2.074 239 HH TYR 64 HH TYR 64 -20.649 9.855 0.528 240 H GLY 65 HN GLY 65 -18.846 10.936 -3.716 241 HA2 GLY 65 HA2 GLY 65 -17.487 9.384 -5.616 242 HA3 GLY 65 HA1 GLY 65 -18.199 8.767 -4.126 243 H CYS 66 HN CYS 66 -20.906 9.405 -4.678 244 HA CYS 66 HA CYS 66 -21.503 7.877 -7.121 245 HB2 CYS 66 HB2 CYS 66 -21.491 6.292 -5.213 246 HB3 CYS 66 HB1 CYS 66 -22.715 7.279 -4.408 247 HG CYS 66 HG CYS 66 -23.214 5.394 -6.778 248 H GLY 67 HN GLY 67 -23.245 8.597 -8.214 249 HA2 GLY 67 HA2 GLY 67 -25.424 9.559 -8.400 250 HA3 GLY 67 HA1 GLY 67 -25.152 10.392 -6.870 251 H GLN 68 HN GLN 68 -22.323 10.973 -8.026 252 HA GLN 68 HA GLN 68 -22.999 12.948 -10.068 253 HB2 GLN 68 HB2 GLN 68 -21.822 13.679 -7.382 254 HB3 GLN 68 HB1 GLN 68 -21.805 14.743 -8.791 255 HG2 GLN 68 HG2 GLN 68 -24.245 14.681 -8.910 256 HG3 GLN 68 HG1 GLN 68 -24.301 13.554 -7.555 257 HE21 GLN 68 HE21 GLN 68 -24.731 16.768 -8.236 258 HE22 GLN 68 HE22 GLN 68 -24.300 17.434 -6.735 259 H SER 69 HN SER 69 -21.474 12.963 -11.592 260 HA SER 69 HA SER 69 -18.743 13.094 -11.245 261 HB2 SER 69 HB2 SER 69 -17.893 10.992 -11.087 262 HB3 SER 69 HB1 SER 69 -19.434 10.673 -10.313 263 HG SER 69 HG SER 69 -18.747 9.270 -12.137 264 H PHE 70 HN PHE 70 -18.337 14.123 -13.082 265 HA PHE 70 HA PHE 70 -18.996 12.760 -15.581 266 HB2 PHE 70 HB2 PHE 70 -19.929 14.811 -16.547 267 HB3 PHE 70 HB1 PHE 70 -20.846 14.270 -15.149 268 HD1 PHE 70 HD1 PHE 70 -18.771 16.904 -16.557 269 HD2 PHE 70 HD2 PHE 70 -20.541 15.425 -12.931 270 HE1 PHE 70 HE1 PHE 70 -18.403 19.106 -15.476 271 HE2 PHE 70 HE2 PHE 70 -20.172 17.629 -11.852 272 HZ PHE 70 HZ PHE 70 -19.106 19.470 -13.127 273 H ASP 71 HN ASP 71 -16.760 12.360 -15.803 274 HA ASP 71 HA ASP 71 -15.367 14.477 -17.147 275 HB2 ASP 71 HB2 ASP 71 -14.921 15.059 -14.801 276 HB3 ASP 71 HB1 ASP 71 -14.246 13.452 -14.537 277 H ILE 72 HN ILE 72 -15.800 12.559 -18.645 278 HA ILE 72 HA ILE 72 -13.559 10.626 -18.401 279 HB ILE 72 HB ILE 72 -14.909 8.879 -19.201 280 HG12 ILE 72 HG12 ILE 72 -17.038 10.843 -20.002 281 HG13 ILE 72 HG11 ILE 72 -15.795 10.293 -21.119 282 HG21 ILE 72 HG21 ILE 72 -15.661 9.962 -16.932 283 HG22 ILE 72 HG22 ILE 72 -16.701 8.755 -17.690 284 HG23 ILE 72 HG23 ILE 72 -17.076 10.469 -17.855 285 HD11 ILE 72 HD1 ILE 72 -16.598 7.908 -20.231 286 HD12 ILE 72 HD2 ILE 72 -17.431 8.718 -21.558 287 HD13 ILE 72 HD3 ILE 72 -18.091 8.795 -19.924 288 H VAL 73 HN VAL 73 -12.555 10.001 -20.321 289 HA VAL 73 HA VAL 73 -13.071 11.797 -22.608 290 HB VAL 73 HB VAL 73 -10.415 10.817 -21.546 291 HG11 VAL 73 HG11 VAL 73 -11.310 11.948 -24.117 292 HG12 VAL 73 HG12 VAL 73 -9.865 11.010 -23.742 293 HG13 VAL 73 HG13 VAL 73 -9.903 12.742 -23.412 294 HG21 VAL 73 HG21 VAL 73 -12.050 13.198 -21.098 295 HG22 VAL 73 HG22 VAL 73 -10.460 13.603 -21.748 296 HG23 VAL 73 HG23 VAL 73 -10.590 12.671 -20.257 297 H VAL 74 HN VAL 74 -13.422 10.806 -24.492 298 HA VAL 74 HA VAL 74 -12.614 7.969 -24.738 299 HB VAL 74 HB VAL 74 -15.120 9.310 -25.786 300 HG11 VAL 74 HG11 VAL 74 -15.592 6.744 -26.203 301 HG12 VAL 74 HG12 VAL 74 -13.831 6.652 -26.268 302 HG13 VAL 74 HG13 VAL 74 -14.703 7.694 -27.393 303 HG21 VAL 74 HG21 VAL 74 -16.289 7.901 -24.207 304 HG22 VAL 74 HG22 VAL 74 -15.040 8.777 -23.321 305 HG23 VAL 74 HG23 VAL 74 -14.792 7.085 -23.755 306 H VAL 75 HN VAL 75 -11.326 7.535 -26.424 307 HA VAL 75 HA VAL 75 -11.274 9.458 -28.677 308 HB VAL 75 HB VAL 75 -8.965 7.900 -27.485 309 HG11 VAL 75 HG11 VAL 75 -7.662 8.575 -29.250 310 HG12 VAL 75 HG12 VAL 75 -8.577 10.063 -29.494 311 HG13 VAL 75 HG13 VAL 75 -9.211 8.529 -30.094 312 HG21 VAL 75 HG21 VAL 75 -9.137 10.893 -27.670 313 HG22 VAL 75 HG22 VAL 75 -8.228 9.897 -26.533 314 HG23 VAL 75 HG23 VAL 75 -9.975 10.066 -26.356 315 H SER 76 HN SER 76 -11.913 8.548 -30.544 316 HA SER 76 HA SER 76 -10.891 6.190 -31.613 317 HB2 SER 76 HB2 SER 76 -12.457 5.459 -29.545 318 HB3 SER 76 HB1 SER 76 -13.668 5.492 -30.827 319 HG SER 76 HG SER 76 -12.812 3.522 -31.039 320 H ASP 77 HN ASP 77 -12.525 5.251 -33.332 321 HA ASP 77 HA ASP 77 -13.117 7.378 -35.103 322 HB2 ASP 77 HB2 ASP 77 -13.861 4.449 -35.109 323 HB3 ASP 77 HB1 ASP 77 -14.307 5.551 -36.411 324 H PHE 78 HN PHE 78 -14.730 6.331 -32.388 325 HA PHE 78 HA PHE 78 -17.439 6.372 -33.053 326 HB2 PHE 78 HB2 PHE 78 -17.818 6.672 -30.729 327 HB3 PHE 78 HB1 PHE 78 -16.286 5.807 -30.829 328 HD1 PHE 78 HD1 PHE 78 -17.920 8.941 -29.881 329 HD2 PHE 78 HD2 PHE 78 -14.148 6.998 -30.527 330 HE1 PHE 78 HE1 PHE 78 -16.768 10.732 -28.610 331 HE2 PHE 78 HE2 PHE 78 -13.000 8.783 -29.259 332 HZ PHE 78 HZ PHE 78 -14.312 10.655 -28.293 333 H PHE 79 HN PHE 79 -15.137 8.976 -32.746 334 HA PHE 79 HA PHE 79 -17.270 10.988 -32.921 335 HB2 PHE 79 HB2 PHE 79 -15.635 11.448 -31.219 336 HB3 PHE 79 HB1 PHE 79 -14.313 11.225 -32.360 337 HD1 PHE 79 HD1 PHE 79 -17.320 13.333 -31.688 338 HD2 PHE 79 HD2 PHE 79 -13.511 13.030 -33.646 339 HE1 PHE 79 HE1 PHE 79 -17.440 15.736 -32.289 340 HE2 PHE 79 HE2 PHE 79 -13.631 15.432 -34.252 341 HZ PHE 79 HZ PHE 79 -15.595 16.786 -33.572 342 H GLN 80 HN GLN 80 -16.204 9.124 -35.108 343 HA GLN 80 HA GLN 80 -15.288 11.158 -37.033 344 HB2 GLN 80 HB2 GLN 80 -15.262 8.137 -37.104 345 HB3 GLN 80 HB1 GLN 80 -14.826 9.144 -38.484 346 HG2 GLN 80 HG2 GLN 80 -13.031 10.186 -37.216 347 HG3 GLN 80 HG1 GLN 80 -13.512 9.319 -35.757 348 HE21 GLN 80 HE21 GLN 80 -10.881 9.080 -37.011 349 HE22 GLN 80 HE22 GLN 80 -10.720 7.470 -37.527 350 H GLY 81 HN GLY 81 -16.669 11.981 -38.454 351 HA2 GLY 81 HA2 GLY 81 -18.338 11.970 -40.097 352 HA3 GLY 81 HA1 GLY 81 -18.846 10.377 -39.541 353 H LYS 82 HN LYS 82 -18.551 12.047 -36.778 354 HA LYS 82 HA LYS 82 -21.252 13.227 -36.911 355 HB2 LYS 82 HB2 LYS 82 -20.177 11.362 -34.800 356 HB3 LYS 82 HB1 LYS 82 -21.632 12.333 -34.591 357 HG2 LYS 82 HG2 LYS 82 -22.630 11.270 -36.580 358 HG3 LYS 82 HG1 LYS 82 -21.177 10.293 -36.787 359 HD2 LYS 82 HD2 LYS 82 -21.537 9.259 -34.589 360 HD3 LYS 82 HD1 LYS 82 -22.971 10.256 -34.342 361 HE2 LYS 82 HE2 LYS 82 -24.031 9.229 -36.310 362 HE3 LYS 82 HE1 LYS 82 -22.595 8.238 -36.575 363 HZ1 LYS 82 HZ1 LYS 82 -23.530 8.033 -33.895 364 HZ2 LYS 82 HZ2 LYS 82 -23.254 6.805 -35.036 365 HZ3 LYS 82 HZ3 LYS 82 -24.750 7.611 -34.995 366 H SER 83 HN SER 83 -21.659 14.939 -35.507 367 HA SER 83 HA SER 83 -19.321 16.486 -34.781 368 HB2 SER 83 HB2 SER 83 -22.281 17.064 -34.553 369 HB3 SER 83 HB1 SER 83 -21.011 18.205 -34.120 370 HG SER 83 HG SER 83 -20.257 17.565 -36.406 371 H LYS 84 HN LYS 84 -19.489 17.704 -32.605 372 HA LYS 84 HA LYS 84 -19.142 15.849 -30.518 373 HB2 LYS 84 HB2 LYS 84 -18.107 18.097 -30.553 374 HB3 LYS 84 HB1 LYS 84 -19.697 18.819 -30.290 375 HG2 LYS 84 HG2 LYS 84 -19.914 17.604 -28.163 376 HG3 LYS 84 HG1 LYS 84 -18.346 16.842 -28.428 377 HD2 LYS 84 HD2 LYS 84 -17.252 19.043 -28.405 378 HD3 LYS 84 HD1 LYS 84 -18.816 19.826 -28.178 379 HE2 LYS 84 HE2 LYS 84 -17.670 19.608 -26.021 380 HE3 LYS 84 HE1 LYS 84 -19.109 18.589 -26.048 381 HZ1 LYS 84 HZ1 LYS 84 -16.766 17.267 -27.044 382 HZ2 LYS 84 HZ2 LYS 84 -17.890 16.751 -25.879 383 HZ3 LYS 84 HZ3 LYS 84 -16.602 17.763 -25.431 384 H LEU 85 HN LEU 85 -21.908 17.871 -31.412 385 HA LEU 85 HA LEU 85 -23.514 17.370 -29.150 386 HB2 LEU 85 HB2 LEU 85 -24.090 18.152 -31.994 387 HB3 LEU 85 HB1 LEU 85 -25.412 17.799 -30.882 388 HG LEU 85 HG LEU 85 -24.515 19.481 -29.299 389 HD11 LEU 85 HD11 LEU 85 -22.409 19.685 -31.439 390 HD12 LEU 85 HD12 LEU 85 -22.207 19.585 -29.690 391 HD13 LEU 85 HD13 LEU 85 -22.779 21.080 -30.427 392 HD21 LEU 85 HD21 LEU 85 -25.555 21.221 -30.384 393 HD22 LEU 85 HD22 LEU 85 -26.013 19.932 -31.497 394 HD23 LEU 85 HD23 LEU 85 -24.640 20.976 -31.871 395 H MET 86 HN MET 86 -23.138 15.629 -32.212 396 HA MET 86 HA MET 86 -25.207 13.749 -31.812 397 HB2 MET 86 HB2 MET 86 -22.662 13.597 -33.443 398 HB3 MET 86 HB1 MET 86 -23.917 12.355 -33.469 399 HG2 MET 86 HG2 MET 86 -25.575 13.994 -34.199 400 HG3 MET 86 HG1 MET 86 -24.375 15.282 -34.101 401 HE1 MET 86 HE1 MET 86 -24.633 11.840 -37.107 402 HE2 MET 86 HE2 MET 86 -25.736 12.231 -35.791 403 HE3 MET 86 HE3 MET 86 -24.158 11.536 -35.430 404 H ARG 87 HN ARG 87 -21.816 13.809 -30.841 405 HA ARG 87 HA ARG 87 -21.573 11.149 -29.959 406 HB2 ARG 87 HB2 ARG 87 -20.236 13.704 -29.051 407 HB3 ARG 87 HB1 ARG 87 -19.787 12.112 -28.439 408 HG2 ARG 87 HG2 ARG 87 -19.928 12.530 -31.403 409 HG3 ARG 87 HG1 ARG 87 -18.526 13.129 -30.516 410 HD2 ARG 87 HD2 ARG 87 -18.065 10.856 -31.266 411 HD3 ARG 87 HD1 ARG 87 -18.241 10.868 -29.514 412 HE ARG 87 HE ARG 87 -20.140 9.553 -29.749 413 HH11 ARG 87 HH11 ARG 87 -19.258 11.025 -32.752 414 HH12 ARG 87 HH12 ARG 87 -20.419 10.140 -33.681 415 HH21 ARG 87 HH21 ARG 87 -21.690 8.417 -30.961 416 HH22 ARG 87 HH22 ARG 87 -21.800 8.672 -32.670 417 H SER 88 HN SER 88 -22.703 14.076 -28.292 418 HA SER 88 HA SER 88 -22.970 12.927 -25.731 419 HB2 SER 88 HB2 SER 88 -24.478 15.208 -27.022 420 HB3 SER 88 HB1 SER 88 -24.558 14.800 -25.309 421 HG SER 88 HG SER 88 -22.575 16.039 -26.759 422 H ARG 89 HN ARG 89 -25.253 13.205 -28.442 423 HA ARG 89 HA ARG 89 -27.481 12.069 -27.124 424 HB2 ARG 89 HB2 ARG 89 -27.635 13.298 -29.273 425 HB3 ARG 89 HB1 ARG 89 -26.798 11.967 -30.074 426 HG2 ARG 89 HG2 ARG 89 -28.597 10.420 -29.416 427 HG3 ARG 89 HG1 ARG 89 -29.431 11.736 -28.588 428 HD2 ARG 89 HD2 ARG 89 -30.418 11.434 -30.795 429 HD3 ARG 89 HD1 ARG 89 -29.558 12.971 -30.750 430 HE ARG 89 HE ARG 89 -27.837 10.911 -31.692 431 HH11 ARG 89 HH11 ARG 89 -30.568 12.846 -32.573 432 HH12 ARG 89 HH12 ARG 89 -30.221 12.808 -34.269 433 HH21 ARG 89 HH21 ARG 89 -27.367 10.870 -33.912 434 HH22 ARG 89 HH22 ARG 89 -28.408 11.690 -35.026 435 H ALA 90 HN ALA 90 -24.923 10.649 -29.123 436 HA ALA 90 HA ALA 90 -25.875 7.988 -29.080 437 HB1 ALA 90 HB1 ALA 90 -23.016 8.027 -29.177 438 HB2 ALA 90 HB2 ALA 90 -23.626 9.392 -30.112 439 HB3 ALA 90 HB3 ALA 90 -24.154 7.755 -30.498 440 H VAL 91 HN VAL 91 -23.721 9.797 -26.939 441 HA VAL 91 HA VAL 91 -22.900 7.623 -25.331 442 HB VAL 91 HB VAL 91 -23.086 10.586 -24.768 443 HG11 VAL 91 HG11 VAL 91 -22.924 9.975 -22.582 444 HG12 VAL 91 HG12 VAL 91 -21.270 9.513 -22.988 445 HG13 VAL 91 HG13 VAL 91 -22.550 8.300 -22.990 446 HG21 VAL 91 HG21 VAL 91 -21.189 10.581 -25.987 447 HG22 VAL 91 HG22 VAL 91 -21.245 8.823 -26.128 448 HG23 VAL 91 HG23 VAL 91 -20.452 9.571 -24.741 449 H ASN 92 HN ASN 92 -25.566 9.945 -25.012 450 HA ASN 92 HA ASN 92 -26.503 9.029 -22.520 451 HB2 ASN 92 HB2 ASN 92 -27.887 10.378 -24.839 452 HB3 ASN 92 HB1 ASN 92 -28.694 10.033 -23.313 453 HD21 ASN 92 HD21 ASN 92 -28.271 12.724 -24.252 454 HD22 ASN 92 HD22 ASN 92 -27.188 13.483 -23.189 455 H LYS 93 HN LYS 93 -27.348 8.077 -25.847 456 HA LYS 93 HA LYS 93 -29.325 6.175 -25.077 457 HB2 LYS 93 HB2 LYS 93 -27.686 6.459 -27.603 458 HB3 LYS 93 HB1 LYS 93 -29.002 5.301 -27.405 459 HG2 LYS 93 HG2 LYS 93 -29.329 8.278 -26.962 460 HG3 LYS 93 HG1 LYS 93 -29.683 7.479 -28.497 461 HD2 LYS 93 HD2 LYS 93 -31.312 6.016 -27.352 462 HD3 LYS 93 HD1 LYS 93 -30.965 6.827 -25.825 463 HE2 LYS 93 HE2 LYS 93 -32.980 7.800 -26.790 464 HE3 LYS 93 HE1 LYS 93 -31.679 8.988 -26.867 465 HZ1 LYS 93 HZ1 LYS 93 -31.425 7.581 -29.183 466 HZ2 LYS 93 HZ2 LYS 93 -32.142 9.113 -29.022 467 HZ3 LYS 93 HZ3 LYS 93 -33.106 7.714 -28.995 468 H ALA 94 HN ALA 94 -25.869 5.939 -25.829 469 HA ALA 94 HA ALA 94 -25.671 3.122 -25.622 470 HB1 ALA 94 HB1 ALA 94 -23.941 5.239 -26.220 471 HB2 ALA 94 HB2 ALA 94 -23.550 3.519 -26.226 472 HB3 ALA 94 HB3 ALA 94 -23.260 4.484 -24.780 473 H VAL 95 HN VAL 95 -25.258 5.736 -23.273 474 HA VAL 95 HA VAL 95 -25.383 3.705 -21.123 475 HB VAL 95 HB VAL 95 -23.924 6.160 -20.446 476 HG11 VAL 95 HG11 VAL 95 -22.395 4.499 -19.439 477 HG12 VAL 95 HG12 VAL 95 -23.290 3.198 -20.224 478 HG13 VAL 95 HG13 VAL 95 -24.069 4.183 -18.988 479 HG21 VAL 95 HG21 VAL 95 -21.835 5.368 -21.626 480 HG22 VAL 95 HG22 VAL 95 -23.076 5.997 -22.710 481 HG23 VAL 95 HG23 VAL 95 -22.845 4.256 -22.549 482 H LYS 96 HN LYS 96 -27.695 4.729 -21.918 483 HA LYS 96 HA LYS 96 -28.473 7.222 -20.859 484 HB2 LYS 96 HB2 LYS 96 -29.782 5.934 -22.529 485 HB3 LYS 96 HB1 LYS 96 -30.195 4.770 -21.270 486 HG2 LYS 96 HG2 LYS 96 -31.286 6.523 -19.960 487 HG3 LYS 96 HG1 LYS 96 -30.818 7.735 -21.154 488 HD2 LYS 96 HD2 LYS 96 -32.129 6.511 -22.874 489 HD3 LYS 96 HD1 LYS 96 -32.650 5.367 -21.636 490 HE2 LYS 96 HE2 LYS 96 -33.145 8.357 -21.560 491 HE3 LYS 96 HE1 LYS 96 -34.339 7.146 -22.023 492 HZ1 LYS 96 HZ1 LYS 96 -32.936 7.113 -19.413 493 HZ2 LYS 96 HZ2 LYS 96 -34.303 6.214 -19.871 494 HZ3 LYS 96 HZ3 LYS 96 -34.422 7.895 -19.649 495 H GLU 97 HN GLU 97 -28.450 3.974 -19.476 496 HA GLU 97 HA GLU 97 -29.853 4.506 -17.103 497 HB2 GLU 97 HB2 GLU 97 -29.288 2.228 -17.893 498 HB3 GLU 97 HB1 GLU 97 -27.593 2.536 -17.515 499 HG2 GLU 97 HG2 GLU 97 -28.169 2.905 -15.154 500 HG3 GLU 97 HG1 GLU 97 -29.874 2.639 -15.518 501 H GLU 98 HN GLU 98 -26.469 4.962 -17.969 502 HA GLU 98 HA GLU 98 -25.408 5.449 -15.418 503 HB2 GLU 98 HB2 GLU 98 -24.025 5.158 -17.431 504 HB3 GLU 98 HB1 GLU 98 -24.610 6.698 -18.059 505 HG2 GLU 98 HG2 GLU 98 -23.671 7.854 -16.091 506 HG3 GLU 98 HG1 GLU 98 -23.079 6.315 -15.469 507 H LEU 99 HN LEU 99 -26.967 7.655 -17.735 508 HA LEU 99 HA LEU 99 -26.495 10.036 -16.292 509 HB2 LEU 99 HB2 LEU 99 -28.685 9.267 -18.232 510 HB3 LEU 99 HB1 LEU 99 -28.482 10.894 -17.583 511 HG LEU 99 HG LEU 99 -26.276 9.395 -19.016 512 HD11 LEU 99 HD11 LEU 99 -27.378 11.651 -20.458 513 HD12 LEU 99 HD12 LEU 99 -28.632 10.451 -20.146 514 HD13 LEU 99 HD13 LEU 99 -27.160 9.988 -21.002 515 HD21 LEU 99 HD21 LEU 99 -25.017 11.129 -18.326 516 HD22 LEU 99 HD22 LEU 99 -26.407 11.815 -17.485 517 HD23 LEU 99 HD23 LEU 99 -26.097 12.239 -19.168 518 H GLN 100 HN GLN 100 -29.145 7.683 -16.196 519 HA GLN 100 HA GLN 100 -30.763 9.119 -14.352 520 HB2 GLN 100 HB2 GLN 100 -30.635 6.180 -15.055 521 HB3 GLN 100 HB1 GLN 100 -31.856 6.885 -13.995 522 HG2 GLN 100 HG2 GLN 100 -31.331 7.732 -16.859 523 HG3 GLN 100 HG1 GLN 100 -32.668 6.711 -16.331 524 HE21 GLN 100 HE21 GLN 100 -32.257 9.741 -17.338 525 HE22 GLN 100 HE22 GLN 100 -33.322 10.578 -16.316 526 H GLU 101 HN GLU 101 -28.240 6.673 -13.986 527 HA GLU 101 HA GLU 101 -28.558 6.546 -11.110 528 HB2 GLU 101 HB2 GLU 101 -26.425 5.400 -12.928 529 HB3 GLU 101 HB1 GLU 101 -26.591 5.055 -11.206 530 HG2 GLU 101 HG2 GLU 101 -28.750 4.532 -13.268 531 HG3 GLU 101 HG1 GLU 101 -27.638 3.307 -12.659 532 H ILE 102 HN ILE 102 -26.996 8.624 -13.293 533 HA ILE 102 HA ILE 102 -25.330 9.673 -11.081 534 HB ILE 102 HB ILE 102 -24.063 8.446 -12.972 535 HG12 ILE 102 HG12 ILE 102 -22.297 10.224 -12.981 536 HG13 ILE 102 HG11 ILE 102 -23.457 11.330 -12.243 537 HG21 ILE 102 HG21 ILE 102 -24.276 11.028 -14.456 538 HG22 ILE 102 HG22 ILE 102 -25.594 9.869 -14.638 539 HG23 ILE 102 HG23 ILE 102 -23.946 9.406 -15.067 540 HD11 ILE 102 HD1 ILE 102 -21.885 10.120 -10.630 541 HD12 ILE 102 HD2 ILE 102 -22.777 8.649 -11.023 542 HD13 ILE 102 HD3 ILE 102 -23.606 10.007 -10.264 543 H HIS 103 HN HIS 103 -25.741 11.740 -10.623 544 HA HIS 103 HA HIS 103 -27.716 13.227 -12.005 545 HB2 HIS 103 HB2 HIS 103 -25.668 14.035 -9.932 546 HB3 HIS 103 HB1 HIS 103 -26.932 15.114 -10.530 547 HD2 HIS 103 HD2 HIS 103 -26.515 12.314 -7.923 548 HE1 HIS 103 HE1 HIS 103 -30.668 12.954 -8.337 549 HE2 HIS 103 HE2 HIS 103 -28.883 11.802 -6.947 550 H ALA 104 HN ALA 104 -24.179 13.328 -12.007 551 HA ALA 104 HA ALA 104 -24.311 15.060 -14.397 552 HB1 ALA 104 HB1 ALA 104 -23.537 16.257 -12.305 553 HB2 ALA 104 HB2 ALA 104 -22.404 16.294 -13.657 554 HB3 ALA 104 HB3 ALA 104 -22.136 15.188 -12.310 555 H PHE 105 HN PHE 105 -23.415 14.174 -16.124 556 HA PHE 105 HA PHE 105 -21.068 12.443 -15.825 557 HB2 PHE 105 HB2 PHE 105 -22.842 10.822 -15.839 558 HB3 PHE 105 HB1 PHE 105 -23.645 11.627 -17.187 559 HD1 PHE 105 HD1 PHE 105 -20.441 9.940 -16.247 560 HD2 PHE 105 HD2 PHE 105 -23.152 11.020 -19.398 561 HE1 PHE 105 HE1 PHE 105 -19.112 8.593 -17.852 562 HE2 PHE 105 HE2 PHE 105 -21.825 9.675 -21.003 563 HZ PHE 105 HZ PHE 105 -19.804 8.461 -20.230 564 H SER 106 HN SER 106 -19.575 12.880 -17.372 565 HA SER 106 HA SER 106 -20.451 14.172 -19.872 566 HB2 SER 106 HB2 SER 106 -18.426 15.628 -19.739 567 HB3 SER 106 HB1 SER 106 -19.604 15.962 -18.463 568 HG SER 106 HG SER 106 -17.114 14.665 -18.347 569 H CYS 107 HN CYS 107 -19.143 13.758 -21.663 570 HA CYS 107 HA CYS 107 -16.839 11.995 -21.371 571 HB2 CYS 107 HB2 CYS 107 -18.627 10.374 -21.548 572 HB3 CYS 107 HB1 CYS 107 -19.310 11.233 -22.925 573 HG CYS 107 HG CYS 107 -17.883 9.467 -24.069 574 H LYS 108 HN LYS 108 -15.607 13.658 -22.145 575 HA LYS 108 HA LYS 108 -16.205 15.199 -24.436 576 HB2 LYS 108 HB2 LYS 108 -13.557 14.482 -23.154 577 HB3 LYS 108 HB1 LYS 108 -13.731 15.663 -24.452 578 HG2 LYS 108 HG2 LYS 108 -15.277 16.984 -23.054 579 HG3 LYS 108 HG1 LYS 108 -15.112 15.803 -21.754 580 HD2 LYS 108 HD2 LYS 108 -12.691 16.266 -21.632 581 HD3 LYS 108 HD1 LYS 108 -12.851 17.446 -22.935 582 HE2 LYS 108 HE2 LYS 108 -14.398 18.774 -21.553 583 HE3 LYS 108 HE1 LYS 108 -14.255 17.595 -20.251 584 HZ1 LYS 108 HZ1 LYS 108 -12.782 19.661 -20.171 585 HZ2 LYS 108 HZ2 LYS 108 -11.869 18.906 -21.389 586 HZ3 LYS 108 HZ3 LYS 108 -12.052 18.159 -19.874 587 H CYS 109 HN CYS 109 -15.812 14.861 -26.608 588 HA CYS 109 HA CYS 109 -14.737 12.196 -27.333 589 HB2 CYS 109 HB2 CYS 109 -16.720 13.889 -28.874 590 HB3 CYS 109 HB1 CYS 109 -16.216 12.243 -29.254 591 HG CYS 109 HG CYS 109 -17.693 11.342 -27.448 592 H TYR 110 HN TYR 110 -12.773 12.300 -28.281 593 HA TYR 110 HA TYR 110 -12.326 14.403 -30.279 594 HB2 TYR 110 HB2 TYR 110 -10.372 13.744 -28.068 595 HB3 TYR 110 HB1 TYR 110 -10.043 14.813 -29.435 596 HD1 TYR 110 HD1 TYR 110 -11.258 14.663 -26.098 597 HD2 TYR 110 HD2 TYR 110 -11.797 16.729 -29.826 598 HE1 TYR 110 HE1 TYR 110 -12.333 16.549 -24.899 599 HE2 TYR 110 HE2 TYR 110 -12.870 18.615 -28.626 600 HH TYR 110 HH TYR 110 -12.579 19.365 -25.751 601 H THR 111 HN THR 111 -10.926 13.886 -31.948 602 HA THR 111 HA THR 111 -9.578 11.300 -31.943 603 HB THR 111 HB THR 111 -10.635 10.569 -34.036 604 HG1 THR 111 HG1 THR 111 -11.616 13.078 -33.919 605 HG21 THR 111 HG21 THR 111 -12.431 11.152 -31.680 606 HG22 THR 111 HG22 THR 111 -11.584 9.651 -32.055 607 HG23 THR 111 HG23 THR 111 -12.946 10.167 -33.050 608 H GLU 112 HN GLU 112 -8.834 14.167 -32.084 609 HA GLU 112 HA GLU 112 -7.187 15.381 -33.128 610 HB2 GLU 112 HB2 GLU 112 -6.982 12.903 -34.858 611 HB3 GLU 112 HB1 GLU 112 -5.913 14.298 -34.997 612 HG2 GLU 112 HG2 GLU 112 -5.185 14.022 -32.685 613 HG3 GLU 112 HG1 GLU 112 -6.319 12.690 -32.460 614 H GLU 113 HN GLU 113 -10.020 14.300 -34.562 615 HA GLU 113 HA GLU 113 -9.830 15.486 -37.133 616 HB2 GLU 113 HB2 GLU 113 -12.249 14.895 -35.423 617 HB3 GLU 113 HB1 GLU 113 -12.295 15.407 -37.112 618 HG2 GLU 113 HG2 GLU 113 -10.833 12.945 -36.125 619 HG3 GLU 113 HG1 GLU 113 -12.457 12.916 -36.813 620 H GLU 114 HN GLU 114 -10.896 16.691 -33.984 621 HA GLU 114 HA GLU 114 -12.004 19.131 -34.843 622 HB2 GLU 114 HB2 GLU 114 -11.758 19.864 -32.551 623 HB3 GLU 114 HB1 GLU 114 -12.234 18.165 -32.550 624 HG2 GLU 114 HG2 GLU 114 -9.876 17.500 -32.262 625 HG3 GLU 114 HG1 GLU 114 -9.396 19.196 -32.256 626 H TRP 115 HN TRP 115 -8.752 18.051 -34.618 627 HA TRP 115 HA TRP 115 -7.698 20.791 -34.834 628 HB2 TRP 115 HB2 TRP 115 -6.499 19.471 -33.237 629 HB3 TRP 115 HB1 TRP 115 -6.357 18.116 -34.361 630 HD1 TRP 115 HD1 TRP 115 -5.052 21.683 -33.761 631 HE1 TRP 115 HE1 TRP 115 -2.855 21.988 -35.075 632 HE3 TRP 115 HE3 TRP 115 -4.935 17.269 -36.331 633 HZ2 TRP 115 HZ2 TRP 115 -1.257 20.551 -36.966 634 HZ3 TRP 115 HZ3 TRP 115 -3.069 16.766 -37.882 635 HH2 TRP 115 HH2 TRP 115 -1.230 18.399 -38.203 636 H SER 116 HN SER 116 -8.916 18.500 -36.819 637 HA SER 116 HA SER 116 -7.039 18.254 -38.895 638 HB2 SER 116 HB2 SER 116 -8.955 17.650 -40.305 639 HB3 SER 116 HB1 SER 116 -9.027 16.838 -38.743 640 HG SER 116 HG SER 116 -10.972 17.693 -38.770 641 H LYS 117 HN LYS 117 -9.398 20.763 -38.147 642 HA LYS 117 HA LYS 117 -9.013 22.160 -40.647 643 HB2 LYS 117 HB2 LYS 117 -10.403 22.946 -38.080 644 HB3 LYS 117 HB1 LYS 117 -10.383 23.938 -39.538 645 HG2 LYS 117 HG2 LYS 117 -11.436 22.101 -40.806 646 HG3 LYS 117 HG1 LYS 117 -11.461 21.109 -39.347 647 HD2 LYS 117 HD2 LYS 117 -12.892 22.781 -38.230 648 HD3 LYS 117 HD1 LYS 117 -12.872 23.773 -39.690 649 HE2 LYS 117 HE2 LYS 117 -13.927 21.941 -40.958 650 HE3 LYS 117 HE1 LYS 117 -13.943 20.940 -39.505 651 HZ1 LYS 117 HZ1 LYS 117 -15.903 21.846 -39.063 652 HZ2 LYS 117 HZ2 LYS 117 -15.739 23.006 -40.293 653 HZ3 LYS 117 HZ3 LYS 117 -15.098 23.305 -38.748 654 H ILE 118 HN ILE 118 -7.271 21.926 -37.762 655 HA ILE 118 HA ILE 118 -5.588 23.182 -36.802 656 HB ILE 118 HB ILE 118 -4.687 22.467 -39.084 657 HG12 ILE 118 HG12 ILE 118 -2.735 24.033 -38.899 658 HG13 ILE 118 HG11 ILE 118 -3.663 24.985 -37.736 659 HG21 ILE 118 HG21 ILE 118 -4.246 24.604 -40.519 660 HG22 ILE 118 HG22 ILE 118 -5.638 25.263 -39.662 661 HG23 ILE 118 HG23 ILE 118 -5.816 23.808 -40.642 662 HD11 ILE 118 HD1 ILE 118 -3.190 22.025 -37.356 663 HD12 ILE 118 HD2 ILE 118 -3.707 23.209 -36.156 664 HD13 ILE 118 HD3 ILE 118 -2.051 23.233 -36.763 665 H VAL 119 HN VAL 119 -8.270 24.513 -37.362 666 HA VAL 119 HA VAL 119 -7.324 27.305 -37.089 667 HB VAL 119 HB VAL 119 -9.441 28.012 -38.166 668 HG11 VAL 119 HG11 VAL 119 -8.107 28.058 -39.982 669 HG12 VAL 119 HG12 VAL 119 -8.686 26.439 -40.377 670 HG13 VAL 119 HG13 VAL 119 -7.218 26.641 -39.422 671 HG21 VAL 119 HG21 VAL 119 -10.331 25.808 -39.543 672 HG22 VAL 119 HG22 VAL 119 -11.079 26.433 -38.073 673 HG23 VAL 119 HG23 VAL 119 -9.922 25.107 -37.978 674 H VAL 120 HN VAL 120 -7.288 26.808 -34.785 675 HA VAL 120 HA VAL 120 -9.999 26.986 -33.614 676 HB VAL 120 HB VAL 120 -9.180 24.785 -33.089 677 HG11 VAL 120 HG11 VAL 120 -6.818 25.391 -31.577 678 HG12 VAL 120 HG12 VAL 120 -6.649 26.087 -33.189 679 HG13 VAL 120 HG13 VAL 120 -6.970 24.364 -33.003 680 HG21 VAL 120 HG21 VAL 120 -8.344 25.838 -30.526 681 HG22 VAL 120 HG22 VAL 120 -9.848 25.017 -30.946 682 HG23 VAL 120 HG23 VAL 120 -9.710 26.764 -31.147 683 H LEU 121 HN LEU 121 -10.301 28.784 -32.484 684 HA LEU 121 HA LEU 121 -8.711 29.896 -30.545 685 HB2 LEU 121 HB2 LEU 121 -6.971 30.227 -32.235 686 HB3 LEU 121 HB1 LEU 121 -8.101 31.131 -33.241 687 HG LEU 121 HG LEU 121 -8.334 32.823 -31.466 688 HD11 LEU 121 HD11 LEU 121 -6.293 32.419 -29.694 689 HD12 LEU 121 HD12 LEU 121 -6.836 30.763 -29.963 690 HD13 LEU 121 HD13 LEU 121 -7.972 31.979 -29.378 691 HD21 LEU 121 HD21 LEU 121 -5.438 32.175 -32.105 692 HD22 LEU 121 HD22 LEU 121 -6.056 33.753 -31.614 693 HD23 LEU 121 HD23 LEU 121 -6.538 33.058 -33.161 694 H GLU 122 HN GLU 122 -10.873 30.478 -33.241 695 HA GLU 122 HA GLU 122 -12.277 32.503 -31.591 696 HB2 GLU 122 HB2 GLU 122 -11.980 32.449 -34.604 697 HB3 GLU 122 HB1 GLU 122 -12.970 33.595 -33.700 698 HG2 GLU 122 HG2 GLU 122 -9.989 33.233 -33.298 699 HG3 GLU 122 HG1 GLU 122 -10.709 34.497 -34.291 700 H HIS 123 HN HIS 123 -14.523 32.456 -31.596 701 HA HIS 123 HA HIS 123 -15.742 29.919 -31.871 702 HB2 HIS 123 HB2 HIS 123 -16.891 32.692 -31.534 703 HB3 HIS 123 HB1 HIS 123 -17.886 31.237 -31.562 704 HD2 HIS 123 HD2 HIS 123 -15.038 29.861 -29.776 705 HE1 HIS 123 HE1 HIS 123 -17.049 31.982 -26.730 706 HE2 HIS 123 HE2 HIS 123 -15.282 30.220 -27.200 707 H HIS 124 HN HIS 124 -15.707 32.787 -33.940 708 HA HIS 124 HA HIS 124 -16.335 33.107 -36.124 709 HB2 HIS 124 HB2 HIS 124 -14.789 31.236 -36.530 710 HB3 HIS 124 HB1 HIS 124 -16.098 30.089 -36.243 711 HD2 HIS 124 HD2 HIS 124 -17.535 29.490 -38.528 712 HE1 HIS 124 HE1 HIS 124 -16.305 32.773 -40.882 713 HE2 HIS 124 HE2 HIS 124 -17.654 30.620 -40.879 714 H HIS 125 HN HIS 125 -18.361 32.882 -34.132 715 HA HIS 125 HA HIS 125 -20.561 31.399 -35.347 716 HB2 HIS 125 HB2 HIS 125 -20.408 31.365 -32.924 717 HB3 HIS 125 HB1 HIS 125 -20.402 33.128 -32.865 718 HD2 HIS 125 HD2 HIS 125 -22.933 34.224 -32.673 719 HE1 HIS 125 HE1 HIS 125 -25.139 30.823 -33.851 720 HE2 HIS 125 HE2 HIS 125 -25.316 33.207 -32.996 721 H HIS 126 HN HIS 126 -22.093 32.283 -36.626 722 HA HIS 126 HA HIS 126 -21.905 35.180 -37.143 723 HB2 HIS 126 HB2 HIS 126 -23.162 32.963 -38.778 724 HB3 HIS 126 HB1 HIS 126 -23.107 34.664 -39.241 725 HD2 HIS 126 HD2 HIS 126 -20.943 31.556 -39.632 726 HE1 HIS 126 HE1 HIS 126 -18.348 34.832 -40.231 727 HE2 HIS 126 HE2 HIS 126 -18.585 32.314 -40.458 728 H HIS 127 HN HIS 127 -23.480 36.514 -36.538 729 HA HIS 127 HA HIS 127 -25.635 35.700 -34.920 730 HB2 HIS 127 HB2 HIS 127 -24.672 37.983 -34.900 731 HB3 HIS 127 HB1 HIS 127 -25.354 38.267 -36.501 732 HD2 HIS 127 HD2 HIS 127 -26.579 37.961 -32.781 733 HE1 HIS 127 HE1 HIS 127 -29.884 39.073 -35.161 734 HE2 HIS 127 HE2 HIS 127 -29.075 38.729 -32.779 735 H HIS 128 HN HIS 128 -25.515 36.629 -38.349 736 HA HIS 128 HA HIS 128 -28.087 35.232 -38.729 737 HB2 HIS 128 HB2 HIS 128 -27.349 38.019 -39.476 738 HB3 HIS 128 HB1 HIS 128 -28.319 37.098 -40.625 739 HD2 HIS 128 HD2 HIS 128 -28.844 39.102 -37.411 740 HE1 HIS 128 HE1 HIS 128 -32.297 36.719 -37.877 741 HE2 HIS 128 HE2 HIS 128 -31.285 38.663 -36.593 Start of MODEL 4 1 H1 MET 36 HT1 MET 36 -26.616 3.633 -6.833 2 H2 MET 36 HT2 MET 36 -28.301 3.422 -6.860 3 H3 MET 36 HT3 MET 36 -27.522 3.880 -5.421 4 HA MET 36 HA MET 36 -28.395 5.493 -7.638 5 HB2 MET 36 HB2 MET 36 -28.434 5.488 -4.804 6 HB3 MET 36 HB1 MET 36 -27.512 6.911 -5.291 7 HG2 MET 36 HG2 MET 36 -29.334 7.604 -6.784 8 HG3 MET 36 HG1 MET 36 -30.255 6.163 -6.349 9 HE1 MET 36 HE1 MET 36 -32.547 7.974 -5.013 10 HE2 MET 36 HE2 MET 36 -31.572 8.332 -6.436 11 HE3 MET 36 HE3 MET 36 -31.705 9.525 -5.147 12 HA PRO 37 HA PRO 37 -24.083 7.520 -7.008 13 HB2 PRO 37 HB2 PRO 37 -22.293 6.250 -5.377 14 HB3 PRO 37 HB1 PRO 37 -23.458 7.455 -4.789 15 HG2 PRO 37 HG2 PRO 37 -23.595 4.478 -4.676 16 HG3 PRO 37 HG1 PRO 37 -24.032 5.674 -3.445 17 HD2 PRO 37 HD2 PRO 37 -25.888 4.435 -5.005 18 HD3 PRO 37 HD1 PRO 37 -26.106 6.088 -4.387 19 H VAL 38 HN VAL 38 -22.189 7.222 -8.252 20 HA VAL 38 HA VAL 38 -21.692 4.475 -9.219 21 HB VAL 38 HB VAL 38 -22.990 5.527 -10.949 22 HG11 VAL 38 HG11 VAL 38 -20.991 7.802 -10.932 23 HG12 VAL 38 HG12 VAL 38 -22.538 7.872 -10.088 24 HG13 VAL 38 HG13 VAL 38 -22.497 7.704 -11.844 25 HG21 VAL 38 HG21 VAL 38 -21.005 5.930 -12.683 26 HG22 VAL 38 HG22 VAL 38 -21.352 4.316 -12.063 27 HG23 VAL 38 HG23 VAL 38 -20.035 5.264 -11.370 28 H THR 39 HN THR 39 -19.579 3.920 -9.368 29 HA THR 39 HA THR 39 -17.612 5.819 -8.388 30 HB THR 39 HB THR 39 -16.084 3.898 -8.418 31 HG1 THR 39 HG1 THR 39 -17.152 3.019 -10.364 32 HG21 THR 39 HG21 THR 39 -17.738 4.217 -6.552 33 HG22 THR 39 HG22 THR 39 -17.232 2.544 -6.776 34 HG23 THR 39 HG23 THR 39 -18.804 3.077 -7.372 35 H GLU 40 HN GLU 40 -15.860 6.613 -9.528 36 HA GLU 40 HA GLU 40 -16.209 7.072 -12.299 37 HB2 GLU 40 HB2 GLU 40 -14.955 8.590 -10.810 38 HB3 GLU 40 HB1 GLU 40 -13.713 7.355 -10.620 39 HG2 GLU 40 HG2 GLU 40 -13.255 7.409 -13.030 40 HG3 GLU 40 HG1 GLU 40 -14.529 8.605 -13.257 41 H GLN 41 HN GLN 41 -14.085 4.858 -10.493 42 HA GLN 41 HA GLN 41 -12.743 3.818 -12.772 43 HB2 GLN 41 HB2 GLN 41 -11.975 2.060 -11.270 44 HB3 GLN 41 HB1 GLN 41 -11.897 3.616 -10.444 45 HG2 GLN 41 HG2 GLN 41 -14.078 3.150 -9.375 46 HG3 GLN 41 HG1 GLN 41 -14.130 1.583 -10.180 47 HE21 GLN 41 HE21 GLN 41 -13.830 2.428 -7.198 48 HE22 GLN 41 HE22 GLN 41 -12.497 1.519 -6.670 49 H GLY 42 HN GLY 42 -15.599 2.788 -10.960 50 HA2 GLY 42 HA2 GLY 42 -16.062 0.364 -12.343 51 HA3 GLY 42 HA1 GLY 42 -17.264 1.270 -11.425 52 H LEU 43 HN LEU 43 -17.014 3.697 -12.936 53 HA LEU 43 HA LEU 43 -18.947 3.252 -14.919 54 HB2 LEU 43 HB2 LEU 43 -18.621 5.440 -13.834 55 HB3 LEU 43 HB1 LEU 43 -17.042 5.583 -14.607 56 HG LEU 43 HG LEU 43 -18.080 5.507 -16.820 57 HD11 LEU 43 HD11 LEU 43 -20.712 5.440 -15.330 58 HD12 LEU 43 HD12 LEU 43 -19.990 4.059 -16.158 59 HD13 LEU 43 HD13 LEU 43 -20.495 5.475 -17.080 60 HD21 LEU 43 HD21 LEU 43 -17.974 7.654 -15.276 61 HD22 LEU 43 HD22 LEU 43 -19.730 7.507 -15.301 62 HD23 LEU 43 HD23 LEU 43 -18.843 7.719 -16.809 63 H ARG 44 HN ARG 44 -15.440 3.675 -15.164 64 HA ARG 44 HA ARG 44 -15.262 3.692 -17.969 65 HB2 ARG 44 HB2 ARG 44 -13.404 4.307 -16.449 66 HB3 ARG 44 HB1 ARG 44 -13.252 2.615 -15.978 67 HG2 ARG 44 HG2 ARG 44 -12.726 1.974 -18.272 68 HG3 ARG 44 HG1 ARG 44 -12.989 3.628 -18.825 69 HD2 ARG 44 HD2 ARG 44 -10.598 3.243 -18.557 70 HD3 ARG 44 HD1 ARG 44 -11.145 4.386 -17.334 71 HE ARG 44 HE ARG 44 -11.241 1.713 -16.338 72 HH11 ARG 44 HH11 ARG 44 -9.113 4.318 -17.151 73 HH12 ARG 44 HH12 ARG 44 -7.894 3.862 -16.006 74 HH21 ARG 44 HH21 ARG 44 -9.652 1.113 -14.833 75 HH22 ARG 44 HH22 ARG 44 -8.200 2.047 -14.694 76 H GLU 45 HN GLU 45 -15.232 1.026 -15.638 77 HA GLU 45 HA GLU 45 -14.710 -1.038 -17.507 78 HB2 GLU 45 HB2 GLU 45 -16.075 -1.070 -14.807 79 HB3 GLU 45 HB1 GLU 45 -15.718 -2.527 -15.734 80 HG2 GLU 45 HG2 GLU 45 -13.332 -1.993 -15.718 81 HG3 GLU 45 HG1 GLU 45 -13.655 -0.479 -14.874 82 H ARG 46 HN ARG 46 -17.710 0.408 -16.295 83 HA ARG 46 HA ARG 46 -19.463 -1.412 -17.592 84 HB2 ARG 46 HB2 ARG 46 -20.144 0.003 -15.683 85 HB3 ARG 46 HB1 ARG 46 -19.977 1.436 -16.698 86 HG2 ARG 46 HG2 ARG 46 -21.681 0.545 -18.243 87 HG3 ARG 46 HG1 ARG 46 -21.846 -0.892 -17.233 88 HD2 ARG 46 HD2 ARG 46 -22.578 0.499 -15.345 89 HD3 ARG 46 HD1 ARG 46 -22.378 1.951 -16.323 90 HE ARG 46 HE ARG 46 -24.358 1.421 -17.449 91 HH11 ARG 46 HH11 ARG 46 -23.276 -1.179 -15.437 92 HH12 ARG 46 HH12 ARG 46 -24.743 -2.087 -15.586 93 HH21 ARG 46 HH21 ARG 46 -26.283 0.235 -17.650 94 HH22 ARG 46 HH22 ARG 46 -26.446 -1.287 -16.838 95 H ILE 47 HN ILE 47 -18.215 1.795 -18.435 96 HA ILE 47 HA ILE 47 -19.646 2.057 -20.852 97 HB ILE 47 HB ILE 47 -17.066 3.321 -19.929 98 HG12 ILE 47 HG12 ILE 47 -19.137 3.802 -18.641 99 HG13 ILE 47 HG11 ILE 47 -18.492 5.228 -19.454 100 HG21 ILE 47 HG21 ILE 47 -18.801 4.427 -22.102 101 HG22 ILE 47 HG22 ILE 47 -17.626 3.173 -22.495 102 HG23 ILE 47 HG23 ILE 47 -17.086 4.698 -21.794 103 HD11 ILE 47 HD1 ILE 47 -21.100 4.140 -19.681 104 HD12 ILE 47 HD2 ILE 47 -20.298 3.844 -21.224 105 HD13 ILE 47 HD3 ILE 47 -20.420 5.487 -20.593 106 H GLU 48 HN GLU 48 -16.407 0.843 -20.109 107 HA GLU 48 HA GLU 48 -15.544 0.402 -22.749 108 HB2 GLU 48 HB2 GLU 48 -14.038 0.354 -20.794 109 HB3 GLU 48 HB1 GLU 48 -14.814 -1.129 -20.231 110 HG2 GLU 48 HG2 GLU 48 -14.141 -2.266 -22.335 111 HG3 GLU 48 HG1 GLU 48 -13.371 -0.778 -22.883 112 H SER 49 HN SER 49 -17.304 -1.654 -20.460 113 HA SER 49 HA SER 49 -17.419 -3.904 -22.243 114 HB2 SER 49 HB2 SER 49 -18.887 -4.890 -20.588 115 HB3 SER 49 HB1 SER 49 -17.559 -4.091 -19.748 116 HG SER 49 HG SER 49 -18.897 -2.582 -19.045 117 H ALA 50 HN ALA 50 -19.173 -0.943 -21.873 118 HA ALA 50 HA ALA 50 -21.511 -2.024 -23.296 119 HB1 ALA 50 HB1 ALA 50 -22.531 0.147 -22.841 120 HB2 ALA 50 HB2 ALA 50 -20.999 0.753 -22.211 121 HB3 ALA 50 HB3 ALA 50 -21.860 -0.527 -21.356 122 H ILE 51 HN ILE 51 -18.536 -0.801 -24.064 123 HA ILE 51 HA ILE 51 -19.356 -0.230 -26.795 124 HB ILE 51 HB ILE 51 -19.570 1.948 -25.544 125 HG12 ILE 51 HG12 ILE 51 -17.340 1.918 -27.596 126 HG13 ILE 51 HG11 ILE 51 -19.044 1.728 -28.009 127 HG21 ILE 51 HG21 ILE 51 -17.130 1.124 -24.443 128 HG22 ILE 51 HG22 ILE 51 -17.901 2.696 -24.240 129 HG23 ILE 51 HG23 ILE 51 -16.713 2.458 -25.521 130 HD11 ILE 51 HD1 ILE 51 -17.588 4.139 -27.037 131 HD12 ILE 51 HD2 ILE 51 -19.254 3.928 -26.502 132 HD13 ILE 51 HD3 ILE 51 -18.885 4.012 -28.226 133 HA PRO 52 HA PRO 52 -15.517 -2.226 -27.633 134 HB2 PRO 52 HB2 PRO 52 -15.299 -0.395 -29.969 135 HB3 PRO 52 HB1 PRO 52 -15.337 -2.169 -29.927 136 HG2 PRO 52 HG2 PRO 52 -17.424 -0.759 -30.779 137 HG3 PRO 52 HG1 PRO 52 -17.635 -2.249 -29.845 138 HD2 PRO 52 HD2 PRO 52 -17.921 0.595 -28.955 139 HD3 PRO 52 HD1 PRO 52 -18.875 -0.833 -28.495 140 H GLN 53 HN GLN 53 -13.306 -1.899 -27.383 141 HA GLN 53 HA GLN 53 -12.441 0.339 -25.935 142 HB2 GLN 53 HB2 GLN 53 -10.191 -0.556 -26.216 143 HB3 GLN 53 HB1 GLN 53 -11.321 -1.877 -25.905 144 HG2 GLN 53 HG2 GLN 53 -11.465 -2.307 -28.343 145 HG3 GLN 53 HG1 GLN 53 -10.301 -1.014 -28.629 146 HE21 GLN 53 HE21 GLN 53 -8.358 -2.030 -29.170 147 HE22 GLN 53 HE22 GLN 53 -7.672 -3.321 -28.309 148 H VAL 54 HN VAL 54 -12.798 -0.137 -29.319 149 HA VAL 54 HA VAL 54 -10.881 1.663 -30.325 150 HB VAL 54 HB VAL 54 -12.137 0.084 -31.745 151 HG11 VAL 54 HG11 VAL 54 -14.511 1.736 -32.039 152 HG12 VAL 54 HG12 VAL 54 -14.348 1.141 -30.388 153 HG13 VAL 54 HG13 VAL 54 -14.392 0.002 -31.734 154 HG21 VAL 54 HG21 VAL 54 -11.119 1.934 -32.888 155 HG22 VAL 54 HG22 VAL 54 -12.388 3.038 -32.357 156 HG23 VAL 54 HG23 VAL 54 -12.750 1.784 -33.542 157 H TYR 55 HN TYR 55 -13.958 2.152 -28.787 158 HA TYR 55 HA TYR 55 -14.295 4.868 -29.659 159 HB2 TYR 55 HB2 TYR 55 -15.610 3.197 -27.524 160 HB3 TYR 55 HB1 TYR 55 -16.029 4.887 -27.814 161 HD1 TYR 55 HD1 TYR 55 -15.779 1.556 -29.460 162 HD2 TYR 55 HD2 TYR 55 -17.474 5.501 -29.590 163 HE1 TYR 55 HE1 TYR 55 -17.244 0.865 -31.335 164 HE2 TYR 55 HE2 TYR 55 -18.937 4.810 -31.471 165 HH TYR 55 HH TYR 55 -19.776 2.966 -32.565 166 H HIS 56 HN HIS 56 -11.713 4.388 -28.521 167 HA HIS 56 HA HIS 56 -10.654 4.815 -26.314 168 HB2 HIS 56 HB2 HIS 56 -9.905 6.040 -28.451 169 HB3 HIS 56 HB1 HIS 56 -10.802 7.422 -27.818 170 HD2 HIS 56 HD2 HIS 56 -7.373 5.756 -27.349 171 HE1 HIS 56 HE1 HIS 56 -7.867 8.397 -24.093 172 HE2 HIS 56 HE2 HIS 56 -6.206 6.928 -25.328 173 H ILE 57 HN ILE 57 -11.608 5.023 -24.391 174 HA ILE 57 HA ILE 57 -13.394 7.343 -23.959 175 HB ILE 57 HB ILE 57 -13.374 4.626 -22.634 176 HG12 ILE 57 HG12 ILE 57 -15.553 5.962 -24.251 177 HG13 ILE 57 HG11 ILE 57 -14.368 4.871 -24.968 178 HG21 ILE 57 HG21 ILE 57 -13.926 6.419 -21.029 179 HG22 ILE 57 HG22 ILE 57 -15.356 5.456 -21.407 180 HG23 ILE 57 HG23 ILE 57 -15.143 7.045 -22.144 181 HD11 ILE 57 HD1 ILE 57 -16.762 4.103 -23.846 182 HD12 ILE 57 HD2 ILE 57 -15.622 3.808 -22.533 183 HD13 ILE 57 HD3 ILE 57 -15.380 3.038 -24.103 184 H ILE 58 HN ILE 58 -12.735 8.828 -22.556 185 HA ILE 58 HA ILE 58 -10.635 8.082 -20.611 186 HB ILE 58 HB ILE 58 -11.009 10.725 -22.050 187 HG12 ILE 58 HG12 ILE 58 -8.709 8.752 -22.155 188 HG13 ILE 58 HG11 ILE 58 -10.006 8.791 -23.349 189 HG21 ILE 58 HG21 ILE 58 -8.547 10.249 -20.525 190 HG22 ILE 58 HG22 ILE 58 -9.990 10.302 -19.512 191 HG23 ILE 58 HG23 ILE 58 -9.593 11.669 -20.553 192 HD11 ILE 58 HD1 ILE 58 -7.972 10.942 -22.741 193 HD12 ILE 58 HD2 ILE 58 -9.447 11.275 -23.651 194 HD13 ILE 58 HD3 ILE 58 -8.265 10.125 -24.277 195 H VAL 59 HN VAL 59 -11.148 8.391 -18.526 196 HA VAL 59 HA VAL 59 -13.529 10.048 -17.932 197 HB VAL 59 HB VAL 59 -12.366 7.715 -16.392 198 HG11 VAL 59 HG11 VAL 59 -14.688 7.995 -15.233 199 HG12 VAL 59 HG12 VAL 59 -14.619 9.639 -15.868 200 HG13 VAL 59 HG13 VAL 59 -13.370 9.068 -14.762 201 HG21 VAL 59 HG21 VAL 59 -14.758 6.834 -17.041 202 HG22 VAL 59 HG22 VAL 59 -13.447 6.737 -18.217 203 HG23 VAL 59 HG23 VAL 59 -14.641 8.030 -18.332 204 H THR 60 HN THR 60 -13.196 11.852 -16.812 205 HA THR 60 HA THR 60 -10.805 12.033 -15.086 206 HB THR 60 HB THR 60 -11.942 14.211 -16.860 207 HG1 THR 60 HG1 THR 60 -9.333 13.506 -17.132 208 HG21 THR 60 HG21 THR 60 -9.549 15.125 -15.998 209 HG22 THR 60 HG22 THR 60 -10.031 14.179 -14.590 210 HG23 THR 60 HG23 THR 60 -11.066 15.483 -15.173 211 H ASP 61 HN ASP 61 -11.216 12.628 -13.042 212 HA ASP 61 HA ASP 61 -13.960 13.273 -12.303 213 HB2 ASP 61 HB2 ASP 61 -13.140 13.038 -9.996 214 HB3 ASP 61 HB1 ASP 61 -12.703 11.637 -10.975 215 H LEU 62 HN LEU 62 -14.559 15.334 -12.544 216 HA LEU 62 HA LEU 62 -12.806 17.556 -12.514 217 HB2 LEU 62 HB2 LEU 62 -15.806 17.359 -12.198 218 HB3 LEU 62 HB1 LEU 62 -14.936 18.890 -12.302 219 HG LEU 62 HG LEU 62 -14.740 16.697 -14.382 220 HD11 LEU 62 HD11 LEU 62 -16.234 18.050 -15.748 221 HD12 LEU 62 HD12 LEU 62 -16.329 19.277 -14.485 222 HD13 LEU 62 HD13 LEU 62 -17.034 17.683 -14.219 223 HD21 LEU 62 HD21 LEU 62 -14.118 19.211 -15.455 224 HD22 LEU 62 HD22 LEU 62 -12.973 17.934 -15.046 225 HD23 LEU 62 HD23 LEU 62 -13.340 19.196 -13.871 226 H SER 63 HN SER 63 -14.857 16.084 -10.038 227 HA SER 63 HA SER 63 -13.740 17.963 -8.052 228 HB2 SER 63 HB2 SER 63 -16.174 18.002 -8.152 229 HB3 SER 63 HB1 SER 63 -16.237 16.252 -7.958 230 HG SER 63 HG SER 63 -15.987 16.516 -5.891 231 H TYR 64 HN TYR 64 -12.517 17.217 -6.406 232 HA TYR 64 HA TYR 64 -11.348 14.654 -6.533 233 HB2 TYR 64 HB2 TYR 64 -10.215 16.554 -5.484 234 HB3 TYR 64 HB1 TYR 64 -11.451 16.614 -4.225 235 HD1 TYR 64 HD1 TYR 64 -8.882 14.366 -5.750 236 HD2 TYR 64 HD2 TYR 64 -11.266 15.274 -2.294 237 HE1 TYR 64 HE1 TYR 64 -7.638 12.664 -4.445 238 HE2 TYR 64 HE2 TYR 64 -10.023 13.571 -0.988 239 HH TYR 64 HH TYR 64 -7.779 12.462 -1.081 240 H GLY 65 HN GLY 65 -11.889 12.740 -5.668 241 HA2 GLY 65 HA2 GLY 65 -12.889 11.214 -4.211 242 HA3 GLY 65 HA1 GLY 65 -13.725 12.550 -3.422 243 H CYS 66 HN CYS 66 -15.339 10.566 -3.703 244 HA CYS 66 HA CYS 66 -16.607 10.354 -6.276 245 HB2 CYS 66 HB2 CYS 66 -16.685 8.455 -4.779 246 HB3 CYS 66 HB1 CYS 66 -17.456 9.424 -3.523 247 HG CYS 66 HG CYS 66 -19.473 8.381 -4.655 248 H GLY 67 HN GLY 67 -18.198 11.568 -7.096 249 HA2 GLY 67 HA2 GLY 67 -20.257 12.807 -5.628 250 HA3 GLY 67 HA1 GLY 67 -18.998 14.001 -5.931 251 H GLN 68 HN GLN 68 -21.159 14.785 -7.057 252 HA GLN 68 HA GLN 68 -21.613 13.630 -9.682 253 HB2 GLN 68 HB2 GLN 68 -23.471 14.616 -8.374 254 HB3 GLN 68 HB1 GLN 68 -22.674 16.187 -8.453 255 HG2 GLN 68 HG2 GLN 68 -24.386 16.027 -10.199 256 HG3 GLN 68 HG1 GLN 68 -22.781 16.101 -10.928 257 HE21 GLN 68 HE21 GLN 68 -25.204 13.660 -9.838 258 HE22 GLN 68 HE22 GLN 68 -24.831 12.540 -11.057 259 H SER 69 HN SER 69 -20.387 14.081 -11.385 260 HA SER 69 HA SER 69 -19.804 16.269 -12.702 261 HB2 SER 69 HB2 SER 69 -17.589 17.129 -11.723 262 HB3 SER 69 HB1 SER 69 -19.066 17.585 -10.875 263 HG SER 69 HG SER 69 -16.989 15.980 -10.081 264 H PHE 70 HN PHE 70 -19.746 13.985 -13.730 265 HA PHE 70 HA PHE 70 -16.958 13.016 -13.870 266 HB2 PHE 70 HB2 PHE 70 -19.555 11.675 -14.648 267 HB3 PHE 70 HB1 PHE 70 -17.953 10.967 -14.864 268 HD1 PHE 70 HD1 PHE 70 -20.611 11.755 -12.496 269 HD2 PHE 70 HD2 PHE 70 -16.533 10.457 -12.869 270 HE1 PHE 70 HE1 PHE 70 -20.648 10.963 -10.146 271 HE2 PHE 70 HE2 PHE 70 -16.571 9.665 -10.519 272 HZ PHE 70 HZ PHE 70 -18.628 9.918 -9.157 273 H ASP 71 HN ASP 71 -15.833 13.729 -15.553 274 HA ASP 71 HA ASP 71 -17.266 14.421 -18.037 275 HB2 ASP 71 HB2 ASP 71 -15.965 16.254 -17.006 276 HB3 ASP 71 HB1 ASP 71 -14.505 15.272 -17.121 277 H ILE 72 HN ILE 72 -17.241 12.782 -19.449 278 HA ILE 72 HA ILE 72 -14.712 11.279 -19.792 279 HB ILE 72 HB ILE 72 -16.088 9.331 -20.430 280 HG12 ILE 72 HG12 ILE 72 -18.446 11.024 -19.545 281 HG13 ILE 72 HG11 ILE 72 -18.023 10.747 -21.237 282 HG21 ILE 72 HG21 ILE 72 -15.521 10.104 -17.930 283 HG22 ILE 72 HG22 ILE 72 -16.497 8.672 -18.256 284 HG23 ILE 72 HG23 ILE 72 -17.281 10.192 -17.828 285 HD11 ILE 72 HD1 ILE 72 -18.958 8.695 -21.214 286 HD12 ILE 72 HD2 ILE 72 -19.634 9.108 -19.638 287 HD13 ILE 72 HD3 ILE 72 -18.096 8.252 -19.742 288 H VAL 73 HN VAL 73 -14.097 10.717 -21.854 289 HA VAL 73 HA VAL 73 -15.584 12.033 -24.037 290 HB VAL 73 HB VAL 73 -12.593 11.995 -23.577 291 HG11 VAL 73 HG11 VAL 73 -13.660 13.528 -25.831 292 HG12 VAL 73 HG12 VAL 73 -13.889 11.787 -26.005 293 HG13 VAL 73 HG13 VAL 73 -12.270 12.444 -25.765 294 HG21 VAL 73 HG21 VAL 73 -14.792 13.992 -23.337 295 HG22 VAL 73 HG22 VAL 73 -13.277 14.564 -24.037 296 HG23 VAL 73 HG23 VAL 73 -13.293 13.858 -22.420 297 H VAL 74 HN VAL 74 -15.957 10.812 -25.793 298 HA VAL 74 HA VAL 74 -14.512 8.240 -26.013 299 HB VAL 74 HB VAL 74 -16.720 7.697 -25.287 300 HG11 VAL 74 HG11 VAL 74 -18.699 8.577 -26.644 301 HG12 VAL 74 HG12 VAL 74 -17.575 9.732 -27.359 302 HG13 VAL 74 HG13 VAL 74 -17.885 9.762 -25.623 303 HG21 VAL 74 HG21 VAL 74 -15.689 6.734 -27.583 304 HG22 VAL 74 HG22 VAL 74 -17.175 7.440 -28.220 305 HG23 VAL 74 HG23 VAL 74 -17.253 6.209 -26.958 306 H VAL 75 HN VAL 75 -13.617 7.806 -27.953 307 HA VAL 75 HA VAL 75 -14.438 9.480 -30.244 308 HB VAL 75 HB VAL 75 -11.641 8.673 -29.428 309 HG11 VAL 75 HG11 VAL 75 -11.068 8.829 -31.595 310 HG12 VAL 75 HG12 VAL 75 -11.691 10.479 -31.631 311 HG13 VAL 75 HG13 VAL 75 -12.752 9.127 -32.028 312 HG21 VAL 75 HG21 VAL 75 -11.415 11.247 -29.619 313 HG22 VAL 75 HG22 VAL 75 -12.258 10.605 -28.209 314 HG23 VAL 75 HG23 VAL 75 -13.178 11.269 -29.560 315 H SER 76 HN SER 76 -15.026 8.369 -31.983 316 HA SER 76 HA SER 76 -13.811 5.838 -32.682 317 HB2 SER 76 HB2 SER 76 -15.447 5.075 -31.042 318 HB3 SER 76 HB1 SER 76 -16.727 5.935 -31.889 319 HG SER 76 HG SER 76 -16.875 4.033 -32.833 320 H ASP 77 HN ASP 77 -14.639 5.026 -34.751 321 HA ASP 77 HA ASP 77 -15.048 7.149 -36.620 322 HB2 ASP 77 HB2 ASP 77 -15.080 4.144 -36.890 323 HB3 ASP 77 HB1 ASP 77 -15.313 5.234 -38.255 324 H PHE 78 HN PHE 78 -17.152 5.539 -34.575 325 HA PHE 78 HA PHE 78 -19.441 5.087 -36.114 326 HB2 PHE 78 HB2 PHE 78 -19.258 4.371 -33.784 327 HB3 PHE 78 HB1 PHE 78 -19.244 6.054 -33.253 328 HD1 PHE 78 HD1 PHE 78 -21.300 3.494 -35.022 329 HD2 PHE 78 HD2 PHE 78 -21.261 7.275 -32.984 330 HE1 PHE 78 HE1 PHE 78 -23.780 3.521 -35.022 331 HE2 PHE 78 HE2 PHE 78 -23.741 7.301 -32.983 332 HZ PHE 78 HZ PHE 78 -25.001 5.424 -34.003 333 H PHE 79 HN PHE 79 -17.914 8.040 -35.244 334 HA PHE 79 HA PHE 79 -20.284 9.682 -35.552 335 HB2 PHE 79 HB2 PHE 79 -18.488 10.380 -34.025 336 HB3 PHE 79 HB1 PHE 79 -17.357 10.438 -35.375 337 HD1 PHE 79 HD1 PHE 79 -20.605 11.847 -34.181 338 HD2 PHE 79 HD2 PHE 79 -17.166 12.383 -36.688 339 HE1 PHE 79 HE1 PHE 79 -21.343 14.154 -34.690 340 HE2 PHE 79 HE2 PHE 79 -17.906 14.693 -37.203 341 HZ PHE 79 HZ PHE 79 -19.994 15.579 -36.203 342 H GLN 80 HN GLN 80 -18.493 7.983 -37.692 343 HA GLN 80 HA GLN 80 -18.251 10.007 -39.767 344 HB2 GLN 80 HB2 GLN 80 -17.774 7.018 -39.743 345 HB3 GLN 80 HB1 GLN 80 -17.526 8.040 -41.160 346 HG2 GLN 80 HG2 GLN 80 -15.908 9.405 -39.893 347 HG3 GLN 80 HG1 GLN 80 -16.154 8.383 -38.477 348 HE21 GLN 80 HE21 GLN 80 -14.233 7.191 -38.305 349 HE22 GLN 80 HE22 GLN 80 -13.538 6.309 -39.578 350 H GLY 81 HN GLY 81 -19.935 10.613 -40.957 351 HA2 GLY 81 HA2 GLY 81 -21.749 10.399 -42.394 352 HA3 GLY 81 HA1 GLY 81 -21.754 8.664 -42.085 353 H LYS 82 HN LYS 82 -21.611 10.243 -39.169 354 HA LYS 82 HA LYS 82 -24.553 10.265 -38.873 355 HB2 LYS 82 HB2 LYS 82 -22.480 9.194 -36.945 356 HB3 LYS 82 HB1 LYS 82 -24.179 9.434 -36.538 357 HG2 LYS 82 HG2 LYS 82 -24.832 7.905 -38.368 358 HG3 LYS 82 HG1 LYS 82 -23.130 7.653 -38.757 359 HD2 LYS 82 HD2 LYS 82 -22.735 6.719 -36.520 360 HD3 LYS 82 HD1 LYS 82 -24.419 7.013 -36.087 361 HE2 LYS 82 HE2 LYS 82 -24.134 4.671 -36.743 362 HE3 LYS 82 HE1 LYS 82 -25.132 5.507 -37.933 363 HZ1 LYS 82 HZ1 LYS 82 -23.071 4.035 -38.621 364 HZ2 LYS 82 HZ2 LYS 82 -22.245 5.498 -38.369 365 HZ3 LYS 82 HZ3 LYS 82 -23.515 5.418 -39.496 366 H SER 83 HN SER 83 -25.416 11.784 -37.454 367 HA SER 83 HA SER 83 -23.897 14.214 -37.205 368 HB2 SER 83 HB2 SER 83 -25.927 15.182 -36.339 369 HB3 SER 83 HB1 SER 83 -26.350 14.151 -37.703 370 HG SER 83 HG SER 83 -27.711 13.755 -35.933 371 H LYS 84 HN LYS 84 -23.987 15.424 -35.063 372 HA LYS 84 HA LYS 84 -22.434 14.058 -33.155 373 HB2 LYS 84 HB2 LYS 84 -24.012 16.631 -32.955 374 HB3 LYS 84 HB1 LYS 84 -22.916 16.051 -31.699 375 HG2 LYS 84 HG2 LYS 84 -21.056 16.036 -33.311 376 HG3 LYS 84 HG1 LYS 84 -22.142 16.604 -34.580 377 HD2 LYS 84 HD2 LYS 84 -22.592 18.655 -33.281 378 HD3 LYS 84 HD1 LYS 84 -21.499 18.091 -32.016 379 HE2 LYS 84 HE2 LYS 84 -19.634 18.074 -33.626 380 HE3 LYS 84 HE1 LYS 84 -20.722 18.628 -34.898 381 HZ1 LYS 84 HZ1 LYS 84 -19.401 20.133 -32.889 382 HZ2 LYS 84 HZ2 LYS 84 -21.081 20.367 -32.796 383 HZ3 LYS 84 HZ3 LYS 84 -20.256 20.679 -34.248 384 H LEU 85 HN LEU 85 -25.892 14.696 -33.357 385 HA LEU 85 HA LEU 85 -26.637 13.924 -30.758 386 HB2 LEU 85 HB2 LEU 85 -28.130 13.794 -33.382 387 HB3 LEU 85 HB1 LEU 85 -28.874 13.443 -31.821 388 HG LEU 85 HG LEU 85 -27.436 16.036 -32.441 389 HD11 LEU 85 HD11 LEU 85 -30.373 15.312 -32.591 390 HD12 LEU 85 HD12 LEU 85 -29.362 15.961 -33.883 391 HD13 LEU 85 HD13 LEU 85 -29.790 16.974 -32.504 392 HD21 LEU 85 HD21 LEU 85 -27.623 16.312 -30.211 393 HD22 LEU 85 HD22 LEU 85 -28.521 14.801 -30.057 394 HD23 LEU 85 HD23 LEU 85 -29.375 16.304 -30.408 395 H MET 86 HN MET 86 -26.103 12.042 -33.699 396 HA MET 86 HA MET 86 -27.125 9.579 -32.801 397 HB2 MET 86 HB2 MET 86 -24.903 10.205 -34.760 398 HB3 MET 86 HB1 MET 86 -25.573 8.593 -34.516 399 HG2 MET 86 HG2 MET 86 -27.143 11.042 -35.375 400 HG3 MET 86 HG1 MET 86 -26.656 9.713 -36.429 401 HE1 MET 86 HE1 MET 86 -28.517 11.135 -33.742 402 HE2 MET 86 HE2 MET 86 -29.774 10.020 -33.210 403 HE3 MET 86 HE3 MET 86 -29.956 10.879 -34.738 404 H ARG 87 HN ARG 87 -23.941 11.103 -32.398 405 HA ARG 87 HA ARG 87 -22.570 8.882 -31.325 406 HB2 ARG 87 HB2 ARG 87 -22.252 11.854 -30.900 407 HB3 ARG 87 HB1 ARG 87 -21.138 10.668 -30.224 408 HG2 ARG 87 HG2 ARG 87 -21.818 10.778 -33.166 409 HG3 ARG 87 HG1 ARG 87 -20.458 11.657 -32.466 410 HD2 ARG 87 HD2 ARG 87 -20.845 8.692 -32.057 411 HD3 ARG 87 HD1 ARG 87 -19.936 9.352 -33.413 412 HE ARG 87 HE ARG 87 -18.813 10.565 -31.246 413 HH11 ARG 87 HH11 ARG 87 -19.519 7.305 -32.142 414 HH12 ARG 87 HH12 ARG 87 -18.179 6.627 -31.282 415 HH21 ARG 87 HH21 ARG 87 -17.051 9.687 -30.106 416 HH22 ARG 87 HH22 ARG 87 -16.780 7.977 -30.127 417 H SER 88 HN SER 88 -24.423 11.457 -29.726 418 HA SER 88 HA SER 88 -23.993 10.528 -27.073 419 HB2 SER 88 HB2 SER 88 -26.212 12.232 -28.225 420 HB3 SER 88 HB1 SER 88 -25.965 11.946 -26.504 421 HG SER 88 HG SER 88 -24.887 13.829 -27.835 422 H ARG 89 HN ARG 89 -26.573 9.941 -29.436 423 HA ARG 89 HA ARG 89 -28.264 8.448 -27.744 424 HB2 ARG 89 HB2 ARG 89 -28.958 9.373 -29.932 425 HB3 ARG 89 HB1 ARG 89 -27.914 8.203 -30.738 426 HG2 ARG 89 HG2 ARG 89 -29.189 6.350 -29.785 427 HG3 ARG 89 HG1 ARG 89 -30.195 7.478 -28.876 428 HD2 ARG 89 HD2 ARG 89 -31.384 6.792 -30.891 429 HD3 ARG 89 HD1 ARG 89 -30.942 8.492 -31.025 430 HE ARG 89 HE ARG 89 -29.473 7.933 -32.753 431 HH11 ARG 89 HH11 ARG 89 -30.659 5.127 -31.109 432 HH12 ARG 89 HH12 ARG 89 -30.041 4.011 -32.280 433 HH21 ARG 89 HH21 ARG 89 -28.662 6.475 -34.293 434 HH22 ARG 89 HH22 ARG 89 -28.911 4.774 -34.083 435 H ALA 90 HN ALA 90 -25.697 7.415 -29.984 436 HA ALA 90 HA ALA 90 -26.011 4.639 -29.557 437 HB1 ALA 90 HB1 ALA 90 -24.749 5.618 -31.449 438 HB2 ALA 90 HB2 ALA 90 -23.794 4.433 -30.560 439 HB3 ALA 90 HB3 ALA 90 -23.503 6.156 -30.321 440 H VAL 91 HN VAL 91 -23.933 7.025 -28.009 441 HA VAL 91 HA VAL 91 -22.630 5.152 -26.278 442 HB VAL 91 HB VAL 91 -21.620 7.339 -26.957 443 HG11 VAL 91 HG11 VAL 91 -22.394 9.385 -25.961 444 HG12 VAL 91 HG12 VAL 91 -23.554 8.521 -24.951 445 HG13 VAL 91 HG13 VAL 91 -23.795 8.607 -26.696 446 HG21 VAL 91 HG21 VAL 91 -21.053 5.984 -24.831 447 HG22 VAL 91 HG22 VAL 91 -21.970 7.211 -23.956 448 HG23 VAL 91 HG23 VAL 91 -20.532 7.670 -24.869 449 H ASN 92 HN ASN 92 -25.137 7.623 -25.793 450 HA ASN 92 HA ASN 92 -25.624 7.041 -23.074 451 HB2 ASN 92 HB2 ASN 92 -26.371 9.135 -24.109 452 HB3 ASN 92 HB1 ASN 92 -27.488 8.240 -25.141 453 HD21 ASN 92 HD21 ASN 92 -28.789 10.042 -23.635 454 HD22 ASN 92 HD22 ASN 92 -29.535 9.337 -22.284 455 H LYS 93 HN LYS 93 -27.013 5.835 -26.078 456 HA LYS 93 HA LYS 93 -29.087 4.290 -24.977 457 HB2 LYS 93 HB2 LYS 93 -28.935 4.784 -27.374 458 HB3 LYS 93 HB1 LYS 93 -27.467 3.814 -27.490 459 HG2 LYS 93 HG2 LYS 93 -28.683 1.837 -26.788 460 HG3 LYS 93 HG1 LYS 93 -30.160 2.779 -26.597 461 HD2 LYS 93 HD2 LYS 93 -30.108 3.331 -29.012 462 HD3 LYS 93 HD1 LYS 93 -28.643 2.368 -29.193 463 HE2 LYS 93 HE2 LYS 93 -29.863 0.352 -28.464 464 HE3 LYS 93 HE1 LYS 93 -31.331 1.309 -28.259 465 HZ1 LYS 93 HZ1 LYS 93 -29.937 1.377 -30.842 466 HZ2 LYS 93 HZ2 LYS 93 -31.591 1.571 -30.502 467 HZ3 LYS 93 HZ3 LYS 93 -30.889 0.024 -30.465 468 H ALA 94 HN ALA 94 -25.712 3.474 -25.718 469 HA ALA 94 HA ALA 94 -25.847 0.752 -24.997 470 HB1 ALA 94 HB1 ALA 94 -23.877 1.149 -26.082 471 HB2 ALA 94 HB2 ALA 94 -23.284 1.342 -24.432 472 HB3 ALA 94 HB3 ALA 94 -23.701 2.762 -25.391 473 H VAL 95 HN VAL 95 -25.144 3.664 -23.112 474 HA VAL 95 HA VAL 95 -25.377 2.032 -20.657 475 HB VAL 95 HB VAL 95 -23.803 3.607 -19.584 476 HG11 VAL 95 HG11 VAL 95 -23.228 1.659 -21.615 477 HG12 VAL 95 HG12 VAL 95 -22.281 2.062 -20.183 478 HG13 VAL 95 HG13 VAL 95 -22.016 2.937 -21.692 479 HG21 VAL 95 HG21 VAL 95 -22.609 4.737 -21.919 480 HG22 VAL 95 HG22 VAL 95 -23.363 5.584 -20.570 481 HG23 VAL 95 HG23 VAL 95 -24.332 5.110 -21.965 482 H LYS 96 HN LYS 96 -27.634 3.128 -21.812 483 HA LYS 96 HA LYS 96 -28.290 5.734 -20.961 484 HB2 LYS 96 HB2 LYS 96 -30.596 5.099 -21.360 485 HB3 LYS 96 HB1 LYS 96 -29.583 4.408 -22.629 486 HG2 LYS 96 HG2 LYS 96 -29.523 2.261 -21.394 487 HG3 LYS 96 HG1 LYS 96 -30.575 2.954 -20.159 488 HD2 LYS 96 HD2 LYS 96 -32.286 3.391 -21.931 489 HD3 LYS 96 HD1 LYS 96 -31.250 2.552 -23.087 490 HE2 LYS 96 HE2 LYS 96 -32.361 1.339 -20.538 491 HE3 LYS 96 HE1 LYS 96 -32.985 1.044 -22.162 492 HZ1 LYS 96 HZ1 LYS 96 -31.046 -0.397 -20.945 493 HZ2 LYS 96 HZ2 LYS 96 -30.146 0.652 -21.933 494 HZ3 LYS 96 HZ3 LYS 96 -31.330 -0.357 -22.617 495 H GLU 97 HN GLU 97 -28.399 2.622 -19.334 496 HA GLU 97 HA GLU 97 -29.947 3.417 -17.091 497 HB2 GLU 97 HB2 GLU 97 -27.886 1.233 -17.434 498 HB3 GLU 97 HB1 GLU 97 -28.851 1.446 -15.973 499 HG2 GLU 97 HG2 GLU 97 -30.918 1.221 -17.298 500 HG3 GLU 97 HG1 GLU 97 -29.956 1.003 -18.761 501 H GLU 98 HN GLU 98 -26.505 3.499 -17.816 502 HA GLU 98 HA GLU 98 -25.561 4.246 -15.264 503 HB2 GLU 98 HB2 GLU 98 -24.077 3.451 -17.056 504 HB3 GLU 98 HB1 GLU 98 -24.412 4.916 -17.982 505 HG2 GLU 98 HG2 GLU 98 -22.323 5.229 -16.791 506 HG3 GLU 98 HG1 GLU 98 -23.545 6.265 -16.053 507 H LEU 99 HN LEU 99 -26.796 6.105 -17.982 508 HA LEU 99 HA LEU 99 -26.130 8.684 -17.069 509 HB2 LEU 99 HB2 LEU 99 -28.225 7.596 -18.927 510 HB3 LEU 99 HB1 LEU 99 -28.234 9.304 -18.486 511 HG LEU 99 HG LEU 99 -25.633 9.067 -19.080 512 HD11 LEU 99 HD11 LEU 99 -26.909 6.654 -20.141 513 HD12 LEU 99 HD12 LEU 99 -25.195 7.027 -19.948 514 HD13 LEU 99 HD13 LEU 99 -26.065 7.583 -21.378 515 HD21 LEU 99 HD21 LEU 99 -27.144 10.669 -20.112 516 HD22 LEU 99 HD22 LEU 99 -27.911 9.391 -21.053 517 HD23 LEU 99 HD23 LEU 99 -26.240 9.847 -21.383 518 H GLN 100 HN GLN 100 -28.817 6.539 -16.324 519 HA GLN 100 HA GLN 100 -30.511 8.383 -15.049 520 HB2 GLN 100 HB2 GLN 100 -30.061 5.430 -14.593 521 HB3 GLN 100 HB1 GLN 100 -31.343 6.348 -13.803 522 HG2 GLN 100 HG2 GLN 100 -32.275 6.972 -15.977 523 HG3 GLN 100 HG1 GLN 100 -30.959 6.139 -16.802 524 HE21 GLN 100 HE21 GLN 100 -33.256 5.119 -17.618 525 HE22 GLN 100 HE22 GLN 100 -33.678 3.683 -16.815 526 H GLU 101 HN GLU 101 -27.729 6.545 -13.851 527 HA GLU 101 HA GLU 101 -28.057 7.336 -11.115 528 HB2 GLU 101 HB2 GLU 101 -25.690 6.217 -12.629 529 HB3 GLU 101 HB1 GLU 101 -25.699 6.505 -10.888 530 HG2 GLU 101 HG2 GLU 101 -27.608 4.988 -10.624 531 HG3 GLU 101 HG1 GLU 101 -27.664 4.733 -12.367 532 H ILE 102 HN ILE 102 -26.385 8.647 -13.908 533 HA ILE 102 HA ILE 102 -25.392 10.875 -12.233 534 HB ILE 102 HB ILE 102 -23.829 11.272 -14.196 535 HG12 ILE 102 HG12 ILE 102 -24.668 8.454 -14.916 536 HG13 ILE 102 HG11 ILE 102 -25.212 9.888 -15.785 537 HG21 ILE 102 HG21 ILE 102 -22.509 10.309 -12.633 538 HG22 ILE 102 HG22 ILE 102 -22.739 8.803 -13.523 539 HG23 ILE 102 HG23 ILE 102 -23.777 9.183 -12.148 540 HD11 ILE 102 HD1 ILE 102 -23.323 9.819 -17.007 541 HD12 ILE 102 HD2 ILE 102 -22.730 8.458 -16.055 542 HD13 ILE 102 HD3 ILE 102 -22.395 10.109 -15.535 543 H HIS 103 HN HIS 103 -26.369 12.774 -12.483 544 HA HIS 103 HA HIS 103 -27.963 13.216 -14.930 545 HB2 HIS 103 HB2 HIS 103 -28.194 14.401 -12.158 546 HB3 HIS 103 HB1 HIS 103 -29.142 14.943 -13.544 547 HD2 HIS 103 HD2 HIS 103 -29.127 11.383 -14.290 548 HE1 HIS 103 HE1 HIS 103 -32.121 11.654 -11.325 549 HE2 HIS 103 HE2 HIS 103 -31.139 10.177 -13.142 550 H ALA 104 HN ALA 104 -25.308 14.368 -13.033 551 HA ALA 104 HA ALA 104 -25.046 16.709 -14.824 552 HB1 ALA 104 HB1 ALA 104 -24.740 17.978 -13.007 553 HB2 ALA 104 HB2 ALA 104 -23.398 16.953 -12.495 554 HB3 ALA 104 HB3 ALA 104 -25.044 16.570 -11.990 555 H PHE 105 HN PHE 105 -24.009 15.163 -16.320 556 HA PHE 105 HA PHE 105 -21.130 15.050 -15.778 557 HB2 PHE 105 HB2 PHE 105 -20.938 12.732 -16.455 558 HB3 PHE 105 HB1 PHE 105 -22.078 12.837 -15.113 559 HD1 PHE 105 HD1 PHE 105 -21.683 12.222 -18.711 560 HD2 PHE 105 HD2 PHE 105 -24.495 12.557 -15.481 561 HE1 PHE 105 HE1 PHE 105 -23.431 11.171 -20.122 562 HE2 PHE 105 HE2 PHE 105 -26.240 11.509 -16.900 563 HZ PHE 105 HZ PHE 105 -25.704 10.815 -19.211 564 H SER 106 HN SER 106 -19.859 14.695 -17.736 565 HA SER 106 HA SER 106 -21.310 15.594 -20.154 566 HB2 SER 106 HB2 SER 106 -19.193 16.610 -20.877 567 HB3 SER 106 HB1 SER 106 -19.692 17.247 -19.310 568 HG SER 106 HG SER 106 -17.398 16.344 -19.748 569 H CYS 107 HN CYS 107 -20.771 14.668 -22.145 570 HA CYS 107 HA CYS 107 -18.952 12.364 -22.136 571 HB2 CYS 107 HB2 CYS 107 -20.654 10.959 -23.263 572 HB3 CYS 107 HB1 CYS 107 -21.141 11.405 -21.627 573 HG CYS 107 HG CYS 107 -23.015 11.841 -23.626 574 H LYS 108 HN LYS 108 -18.169 14.605 -23.279 575 HA LYS 108 HA LYS 108 -19.080 15.200 -25.857 576 HB2 LYS 108 HB2 LYS 108 -16.324 15.479 -24.636 577 HB3 LYS 108 HB1 LYS 108 -16.799 16.189 -26.179 578 HG2 LYS 108 HG2 LYS 108 -18.625 17.419 -25.034 579 HG3 LYS 108 HG1 LYS 108 -18.092 16.746 -23.492 580 HD2 LYS 108 HD2 LYS 108 -16.296 18.374 -25.309 581 HD3 LYS 108 HD1 LYS 108 -17.217 19.069 -23.975 582 HE2 LYS 108 HE2 LYS 108 -16.099 17.466 -22.420 583 HE3 LYS 108 HE1 LYS 108 -15.106 16.902 -23.763 584 HZ1 LYS 108 HZ1 LYS 108 -15.121 19.554 -22.467 585 HZ2 LYS 108 HZ2 LYS 108 -14.518 19.357 -24.043 586 HZ3 LYS 108 HZ3 LYS 108 -13.810 18.515 -22.748 587 H CYS 109 HN CYS 109 -18.713 14.311 -27.837 588 HA CYS 109 HA CYS 109 -16.927 11.955 -27.957 589 HB2 CYS 109 HB2 CYS 109 -19.492 12.468 -29.482 590 HB3 CYS 109 HB1 CYS 109 -18.444 11.063 -29.682 591 HG CYS 109 HG CYS 109 -19.060 11.091 -26.820 592 H TYR 110 HN TYR 110 -15.341 11.986 -29.431 593 HA TYR 110 HA TYR 110 -15.538 13.911 -31.657 594 HB2 TYR 110 HB2 TYR 110 -13.101 13.429 -29.921 595 HB3 TYR 110 HB1 TYR 110 -13.139 14.442 -31.366 596 HD1 TYR 110 HD1 TYR 110 -14.124 14.151 -27.847 597 HD2 TYR 110 HD2 TYR 110 -14.441 16.539 -31.403 598 HE1 TYR 110 HE1 TYR 110 -14.962 16.054 -26.495 599 HE2 TYR 110 HE2 TYR 110 -15.279 18.441 -30.051 600 HH TYR 110 HH TYR 110 -14.946 19.090 -27.388 601 H THR 111 HN THR 111 -14.608 13.277 -33.588 602 HA THR 111 HA THR 111 -13.265 10.667 -33.680 603 HB THR 111 HB THR 111 -15.667 11.374 -35.379 604 HG1 THR 111 HG1 THR 111 -15.299 9.456 -33.326 605 HG21 THR 111 HG21 THR 111 -15.357 8.852 -35.941 606 HG22 THR 111 HG22 THR 111 -13.709 9.088 -35.359 607 HG23 THR 111 HG23 THR 111 -14.302 10.022 -36.731 608 H GLU 112 HN GLU 112 -12.430 13.480 -34.063 609 HA GLU 112 HA GLU 112 -10.762 14.380 -35.420 610 HB2 GLU 112 HB2 GLU 112 -11.588 12.394 -37.549 611 HB3 GLU 112 HB1 GLU 112 -10.095 13.330 -37.468 612 HG2 GLU 112 HG2 GLU 112 -10.928 11.270 -35.403 613 HG3 GLU 112 HG1 GLU 112 -9.797 10.959 -36.720 614 H GLU 113 HN GLU 113 -13.952 13.594 -36.629 615 HA GLU 113 HA GLU 113 -14.076 15.531 -38.691 616 HB2 GLU 113 HB2 GLU 113 -16.235 14.212 -37.049 617 HB3 GLU 113 HB1 GLU 113 -16.552 15.305 -38.396 618 HG2 GLU 113 HG2 GLU 113 -16.588 13.235 -39.477 619 HG3 GLU 113 HG1 GLU 113 -14.907 13.717 -39.703 620 H GLU 114 HN GLU 114 -14.745 15.649 -35.236 621 HA GLU 114 HA GLU 114 -16.084 18.102 -35.102 622 HB2 GLU 114 HB2 GLU 114 -14.171 16.831 -33.123 623 HB3 GLU 114 HB1 GLU 114 -15.229 18.194 -32.758 624 HG2 GLU 114 HG2 GLU 114 -16.180 15.488 -33.742 625 HG3 GLU 114 HG1 GLU 114 -16.209 16.011 -32.058 626 H TRP 115 HN TRP 115 -12.733 17.343 -35.607 627 HA TRP 115 HA TRP 115 -11.790 20.050 -35.100 628 HB2 TRP 115 HB2 TRP 115 -10.241 18.285 -34.621 629 HB3 TRP 115 HB1 TRP 115 -10.442 17.589 -36.230 630 HD1 TRP 115 HD1 TRP 115 -8.996 20.689 -34.471 631 HE1 TRP 115 HE1 TRP 115 -7.220 21.750 -36.009 632 HE3 TRP 115 HE3 TRP 115 -9.578 17.783 -38.631 633 HZ2 TRP 115 HZ2 TRP 115 -6.180 21.409 -38.652 634 HZ3 TRP 115 HZ3 TRP 115 -8.181 18.171 -40.641 635 HH2 TRP 115 HH2 TRP 115 -6.484 19.978 -40.657 636 H SER 116 HN SER 116 -13.646 18.804 -37.454 637 HA SER 116 HA SER 116 -12.383 19.621 -39.847 638 HB2 SER 116 HB2 SER 116 -14.568 19.420 -40.860 639 HB3 SER 116 HB1 SER 116 -14.354 18.098 -39.717 640 HG SER 116 HG SER 116 -15.493 20.518 -38.861 641 H LYS 117 HN LYS 117 -12.840 21.465 -41.168 642 HA LYS 117 HA LYS 117 -12.720 23.772 -41.388 643 HB2 LYS 117 HB2 LYS 117 -15.412 23.362 -40.071 644 HB3 LYS 117 HB1 LYS 117 -14.910 24.846 -40.882 645 HG2 LYS 117 HG2 LYS 117 -14.557 23.586 -42.980 646 HG3 LYS 117 HG1 LYS 117 -15.075 22.104 -42.176 647 HD2 LYS 117 HD2 LYS 117 -17.283 23.116 -41.729 648 HD3 LYS 117 HD1 LYS 117 -16.767 24.593 -42.543 649 HE2 LYS 117 HE2 LYS 117 -16.421 23.328 -44.633 650 HE3 LYS 117 HE1 LYS 117 -16.931 21.847 -43.822 651 HZ1 LYS 117 HZ1 LYS 117 -19.047 23.096 -43.292 652 HZ2 LYS 117 HZ2 LYS 117 -18.823 22.642 -44.913 653 HZ3 LYS 117 HZ3 LYS 117 -18.547 24.249 -44.432 654 H ILE 118 HN ILE 118 -11.715 22.612 -38.779 655 HA ILE 118 HA ILE 118 -11.275 23.300 -36.589 656 HB ILE 118 HB ILE 118 -10.496 25.646 -38.332 657 HG12 ILE 118 HG12 ILE 118 -8.813 23.410 -37.168 658 HG13 ILE 118 HG11 ILE 118 -9.506 23.353 -38.791 659 HG21 ILE 118 HG21 ILE 118 -10.407 25.252 -35.445 660 HG22 ILE 118 HG22 ILE 118 -10.092 26.709 -36.385 661 HG23 ILE 118 HG23 ILE 118 -8.804 25.530 -36.125 662 HD11 ILE 118 HD1 ILE 118 -8.108 25.865 -38.197 663 HD12 ILE 118 HD2 ILE 118 -7.990 24.817 -39.612 664 HD13 ILE 118 HD3 ILE 118 -7.061 24.446 -38.159 665 H VAL 119 HN VAL 119 -14.050 23.816 -37.390 666 HA VAL 119 HA VAL 119 -14.902 26.390 -36.605 667 HB VAL 119 HB VAL 119 -16.317 23.721 -36.594 668 HG11 VAL 119 HG11 VAL 119 -18.224 25.746 -36.687 669 HG12 VAL 119 HG12 VAL 119 -17.089 26.302 -35.457 670 HG13 VAL 119 HG13 VAL 119 -17.868 24.728 -35.292 671 HG21 VAL 119 HG21 VAL 119 -16.908 24.220 -38.743 672 HG22 VAL 119 HG22 VAL 119 -15.498 25.278 -38.691 673 HG23 VAL 119 HG23 VAL 119 -17.106 25.935 -38.390 674 H VAL 120 HN VAL 120 -14.498 23.378 -34.773 675 HA VAL 120 HA VAL 120 -15.572 24.166 -32.333 676 HB VAL 120 HB VAL 120 -14.793 21.863 -32.890 677 HG11 VAL 120 HG11 VAL 120 -12.700 22.242 -33.955 678 HG12 VAL 120 HG12 VAL 120 -12.300 21.475 -32.419 679 HG13 VAL 120 HG13 VAL 120 -12.105 23.217 -32.611 680 HG21 VAL 120 HG21 VAL 120 -13.664 21.482 -30.618 681 HG22 VAL 120 HG22 VAL 120 -15.238 22.278 -30.579 682 HG23 VAL 120 HG23 VAL 120 -13.764 23.229 -30.393 683 H LEU 121 HN LEU 121 -12.511 24.999 -33.811 684 HA LEU 121 HA LEU 121 -11.155 25.958 -31.530 685 HB2 LEU 121 HB2 LEU 121 -10.006 25.569 -33.649 686 HB3 LEU 121 HB1 LEU 121 -10.952 26.845 -34.417 687 HG LEU 121 HG LEU 121 -10.000 28.499 -32.854 688 HD11 LEU 121 HD11 LEU 121 -9.473 27.442 -30.865 689 HD12 LEU 121 HD12 LEU 121 -7.874 27.496 -31.608 690 HD13 LEU 121 HD13 LEU 121 -8.827 26.013 -31.673 691 HD21 LEU 121 HD21 LEU 121 -8.761 27.374 -35.017 692 HD22 LEU 121 HD22 LEU 121 -7.533 27.147 -33.772 693 HD23 LEU 121 HD23 LEU 121 -8.131 28.766 -34.137 694 H GLU 122 HN GLU 122 -13.329 27.558 -33.831 695 HA GLU 122 HA GLU 122 -14.237 29.688 -33.825 696 HB2 GLU 122 HB2 GLU 122 -15.630 28.441 -32.190 697 HB3 GLU 122 HB1 GLU 122 -14.564 28.990 -30.896 698 HG2 GLU 122 HG2 GLU 122 -15.088 31.330 -31.433 699 HG3 GLU 122 HG1 GLU 122 -16.128 30.803 -32.756 700 H HIS 123 HN HIS 123 -12.494 31.028 -34.265 701 HA HIS 123 HA HIS 123 -10.558 31.824 -32.345 702 HB2 HIS 123 HB2 HIS 123 -9.867 33.461 -33.977 703 HB3 HIS 123 HB1 HIS 123 -10.284 31.979 -34.838 704 HD2 HIS 123 HD2 HIS 123 -12.584 32.165 -36.487 705 HE1 HIS 123 HE1 HIS 123 -13.328 36.260 -35.772 706 HE2 HIS 123 HE2 HIS 123 -13.981 34.257 -37.190 707 H HIS 124 HN HIS 124 -13.810 32.764 -32.903 708 HA HIS 124 HA HIS 124 -13.674 35.432 -31.906 709 HB2 HIS 124 HB2 HIS 124 -15.559 34.428 -33.276 710 HB3 HIS 124 HB1 HIS 124 -16.076 33.600 -31.806 711 HD2 HIS 124 HD2 HIS 124 -16.219 37.151 -33.381 712 HE1 HIS 124 HE1 HIS 124 -17.851 37.442 -29.499 713 HE2 HIS 124 HE2 HIS 124 -17.509 38.670 -31.695 714 H HIS 125 HN HIS 125 -13.775 36.208 -29.863 715 HA HIS 125 HA HIS 125 -13.681 36.238 -27.571 716 HB2 HIS 125 HB2 HIS 125 -15.565 33.944 -28.061 717 HB3 HIS 125 HB1 HIS 125 -15.095 34.408 -26.425 718 HD2 HIS 125 HD2 HIS 125 -15.117 37.743 -27.778 719 HE1 HIS 125 HE1 HIS 125 -19.245 37.011 -27.280 720 HE2 HIS 125 HE2 HIS 125 -17.496 38.813 -27.650 721 H HIS 126 HN HIS 126 -12.416 35.473 -25.911 722 HA HIS 126 HA HIS 126 -10.662 33.218 -26.609 723 HB2 HIS 126 HB2 HIS 126 -10.352 35.451 -24.590 724 HB3 HIS 126 HB1 HIS 126 -9.193 34.139 -24.807 725 HD2 HIS 126 HD2 HIS 126 -9.950 37.575 -26.335 726 HE1 HIS 126 HE1 HIS 126 -7.418 35.594 -29.073 727 HE2 HIS 126 HE2 HIS 126 -8.463 37.828 -28.467 728 H HIS 127 HN HIS 127 -13.464 33.521 -25.094 729 HA HIS 127 HA HIS 127 -14.577 32.374 -23.443 730 HB2 HIS 127 HB2 HIS 127 -12.275 30.463 -23.909 731 HB3 HIS 127 HB1 HIS 127 -13.713 30.083 -22.961 732 HD2 HIS 127 HD2 HIS 127 -15.966 29.401 -24.478 733 HE1 HIS 127 HE1 HIS 127 -14.302 30.208 -28.274 734 HE2 HIS 127 HE2 HIS 127 -16.311 29.238 -27.062 735 H HIS 128 HN HIS 128 -12.766 34.415 -22.608 736 HA HIS 128 HA HIS 128 -11.552 33.342 -20.158 737 HB2 HIS 128 HB2 HIS 128 -11.319 35.987 -21.591 738 HB3 HIS 128 HB1 HIS 128 -10.679 35.735 -19.967 739 HD2 HIS 128 HD2 HIS 128 -9.995 32.437 -21.389 740 HE1 HIS 128 HE1 HIS 128 -6.771 34.749 -22.833 741 HE2 HIS 128 HE2 HIS 128 -7.624 32.383 -22.482 Start of MODEL 5 1 H1 MET 36 HT1 MET 36 -28.977 1.390 -6.739 2 H2 MET 36 HT2 MET 36 -27.808 0.895 -5.610 3 H3 MET 36 HT3 MET 36 -28.990 -0.200 -6.149 4 HA MET 36 HA MET 36 -27.275 -0.877 -7.451 5 HB2 MET 36 HB2 MET 36 -28.221 1.516 -9.048 6 HB3 MET 36 HB1 MET 36 -27.620 -0.021 -9.672 7 HG2 MET 36 HG2 MET 36 -29.553 -1.180 -8.634 8 HG3 MET 36 HG1 MET 36 -30.166 0.375 -8.072 9 HE1 MET 36 HE1 MET 36 -29.755 2.445 -10.674 10 HE2 MET 36 HE2 MET 36 -30.759 2.189 -9.249 11 HE3 MET 36 HE3 MET 36 -31.502 2.232 -10.846 12 HA PRO 37 HA PRO 37 -24.077 2.169 -6.061 13 HB2 PRO 37 HB2 PRO 37 -22.543 -0.370 -5.905 14 HB3 PRO 37 HB1 PRO 37 -22.724 0.918 -4.696 15 HG2 PRO 37 HG2 PRO 37 -23.942 -1.426 -4.401 16 HG3 PRO 37 HG1 PRO 37 -24.727 0.089 -3.918 17 HD2 PRO 37 HD2 PRO 37 -25.212 -1.582 -6.370 18 HD3 PRO 37 HD1 PRO 37 -26.383 -0.714 -5.346 19 H VAL 38 HN VAL 38 -22.316 2.971 -7.220 20 HA VAL 38 HA VAL 38 -21.580 1.525 -9.689 21 HB VAL 38 HB VAL 38 -23.074 3.315 -10.342 22 HG11 VAL 38 HG11 VAL 38 -22.911 4.709 -8.344 23 HG12 VAL 38 HG12 VAL 38 -22.504 5.677 -9.761 24 HG13 VAL 38 HG13 VAL 38 -21.225 5.078 -8.706 25 HG21 VAL 38 HG21 VAL 38 -20.181 3.409 -10.943 26 HG22 VAL 38 HG22 VAL 38 -21.060 4.886 -11.337 27 HG23 VAL 38 HG23 VAL 38 -21.555 3.349 -12.046 28 H THR 39 HN THR 39 -19.440 1.509 -10.184 29 HA THR 39 HA THR 39 -17.633 2.988 -8.368 30 HB THR 39 HB THR 39 -17.187 0.300 -9.683 31 HG1 THR 39 HG1 THR 39 -17.017 0.233 -7.062 32 HG21 THR 39 HG21 THR 39 -15.465 2.158 -8.076 33 HG22 THR 39 HG22 THR 39 -15.050 1.214 -9.506 34 HG23 THR 39 HG23 THR 39 -15.224 0.416 -7.943 35 H GLU 40 HN GLU 40 -16.030 4.191 -9.255 36 HA GLU 40 HA GLU 40 -16.203 5.061 -11.908 37 HB2 GLU 40 HB2 GLU 40 -15.078 6.335 -10.117 38 HB3 GLU 40 HB1 GLU 40 -13.795 5.127 -10.075 39 HG2 GLU 40 HG2 GLU 40 -13.225 5.614 -12.409 40 HG3 GLU 40 HG1 GLU 40 -14.541 6.782 -12.501 41 H GLN 41 HN GLN 41 -14.006 2.679 -10.430 42 HA GLN 41 HA GLN 41 -12.569 2.105 -12.816 43 HB2 GLN 41 HB2 GLN 41 -12.980 0.524 -10.271 44 HB3 GLN 41 HB1 GLN 41 -11.898 0.020 -11.571 45 HG2 GLN 41 HG2 GLN 41 -10.635 2.115 -11.357 46 HG3 GLN 41 HG1 GLN 41 -11.730 2.657 -10.084 47 HE21 GLN 41 HE21 GLN 41 -9.351 2.656 -9.031 48 HE22 GLN 41 HE22 GLN 41 -8.960 1.239 -8.184 49 H GLY 42 HN GLY 42 -15.383 0.608 -11.259 50 HA2 GLY 42 HA2 GLY 42 -15.657 -1.529 -13.117 51 HA3 GLY 42 HA1 GLY 42 -16.904 -0.957 -12.008 52 H LEU 43 HN LEU 43 -16.880 1.765 -12.982 53 HA LEU 43 HA LEU 43 -18.838 1.584 -14.996 54 HB2 LEU 43 HB2 LEU 43 -18.634 3.511 -13.462 55 HB3 LEU 43 HB1 LEU 43 -17.122 3.960 -14.247 56 HG LEU 43 HG LEU 43 -18.288 4.237 -16.386 57 HD11 LEU 43 HD11 LEU 43 -20.777 3.566 -14.794 58 HD12 LEU 43 HD12 LEU 43 -20.029 2.529 -16.014 59 HD13 LEU 43 HD13 LEU 43 -20.741 4.074 -16.484 60 HD21 LEU 43 HD21 LEU 43 -19.177 5.709 -13.938 61 HD22 LEU 43 HD22 LEU 43 -20.010 6.052 -15.455 62 HD23 LEU 43 HD23 LEU 43 -18.269 6.303 -15.328 63 H ARG 44 HN ARG 44 -15.376 2.301 -15.157 64 HA ARG 44 HA ARG 44 -15.227 2.947 -17.887 65 HB2 ARG 44 HB2 ARG 44 -13.386 3.311 -16.267 66 HB3 ARG 44 HB1 ARG 44 -13.132 1.567 -16.190 67 HG2 ARG 44 HG2 ARG 44 -12.654 1.514 -18.603 68 HG3 ARG 44 HG1 ARG 44 -12.934 3.252 -18.704 69 HD2 ARG 44 HD2 ARG 44 -11.088 3.609 -17.069 70 HD3 ARG 44 HD1 ARG 44 -10.775 1.876 -17.084 71 HE ARG 44 HE ARG 44 -10.116 3.778 -19.185 72 HH11 ARG 44 HH11 ARG 44 -10.621 0.487 -18.243 73 HH12 ARG 44 HH12 ARG 44 -9.677 -0.174 -19.537 74 HH21 ARG 44 HH21 ARG 44 -8.877 2.920 -20.884 75 HH22 ARG 44 HH22 ARG 44 -8.689 1.204 -21.032 76 H GLU 45 HN GLU 45 -15.057 -0.169 -16.214 77 HA GLU 45 HA GLU 45 -14.410 -1.741 -18.480 78 HB2 GLU 45 HB2 GLU 45 -15.811 -2.443 -15.892 79 HB3 GLU 45 HB1 GLU 45 -15.318 -3.632 -17.097 80 HG2 GLU 45 HG2 GLU 45 -13.430 -1.657 -15.784 81 HG3 GLU 45 HG1 GLU 45 -13.640 -3.329 -15.255 82 H ARG 46 HN ARG 46 -17.496 -0.765 -17.036 83 HA ARG 46 HA ARG 46 -19.132 -2.328 -18.760 84 HB2 ARG 46 HB2 ARG 46 -19.715 0.124 -17.091 85 HB3 ARG 46 HB1 ARG 46 -20.949 -0.776 -17.972 86 HG2 ARG 46 HG2 ARG 46 -19.084 -2.032 -15.939 87 HG3 ARG 46 HG1 ARG 46 -20.713 -1.459 -15.560 88 HD2 ARG 46 HD2 ARG 46 -21.636 -2.980 -17.281 89 HD3 ARG 46 HD1 ARG 46 -20.012 -3.572 -17.617 90 HE ARG 46 HE ARG 46 -21.615 -4.148 -15.235 91 HH11 ARG 46 HH11 ARG 46 -18.601 -4.313 -16.930 92 HH12 ARG 46 HH12 ARG 46 -17.971 -5.605 -15.965 93 HH21 ARG 46 HH21 ARG 46 -20.793 -5.842 -13.965 94 HH22 ARG 46 HH22 ARG 46 -19.211 -6.471 -14.286 95 H ILE 47 HN ILE 47 -18.028 1.042 -18.818 96 HA ILE 47 HA ILE 47 -19.465 1.806 -21.133 97 HB ILE 47 HB ILE 47 -16.933 2.908 -19.925 98 HG12 ILE 47 HG12 ILE 47 -19.007 2.987 -18.534 99 HG13 ILE 47 HG11 ILE 47 -18.429 4.595 -18.987 100 HG21 ILE 47 HG21 ILE 47 -17.919 3.362 -22.482 101 HG22 ILE 47 HG22 ILE 47 -16.825 4.423 -21.597 102 HG23 ILE 47 HG23 ILE 47 -18.565 4.707 -21.544 103 HD11 ILE 47 HD1 ILE 47 -20.048 4.613 -20.869 104 HD12 ILE 47 HD2 ILE 47 -20.856 4.460 -19.309 105 HD13 ILE 47 HD3 ILE 47 -20.653 3.044 -20.341 106 H GLU 48 HN GLU 48 -16.169 0.596 -20.638 107 HA GLU 48 HA GLU 48 -15.304 0.760 -23.321 108 HB2 GLU 48 HB2 GLU 48 -13.770 0.403 -21.427 109 HB3 GLU 48 HB1 GLU 48 -14.463 -1.200 -21.165 110 HG2 GLU 48 HG2 GLU 48 -13.758 -1.880 -23.428 111 HG3 GLU 48 HG1 GLU 48 -13.105 -0.268 -23.723 112 H SER 49 HN SER 49 -16.975 -1.790 -21.512 113 HA SER 49 HA SER 49 -16.960 -3.658 -23.702 114 HB2 SER 49 HB2 SER 49 -18.563 -3.574 -21.138 115 HB3 SER 49 HB1 SER 49 -18.589 -4.910 -22.286 116 HG SER 49 HG SER 49 -16.951 -5.549 -21.109 117 H ALA 50 HN ALA 50 -18.906 -0.954 -22.742 118 HA ALA 50 HA ALA 50 -21.157 -1.818 -24.438 119 HB1 ALA 50 HB1 ALA 50 -20.914 -0.217 -22.113 120 HB2 ALA 50 HB2 ALA 50 -22.380 -0.597 -23.013 121 HB3 ALA 50 HB3 ALA 50 -21.447 0.846 -23.412 122 H ILE 51 HN ILE 51 -18.241 -0.312 -24.850 123 HA ILE 51 HA ILE 51 -19.048 0.777 -27.415 124 HB ILE 51 HB ILE 51 -19.438 2.629 -25.740 125 HG12 ILE 51 HG12 ILE 51 -17.212 3.166 -27.731 126 HG13 ILE 51 HG11 ILE 51 -18.907 2.965 -28.188 127 HG21 ILE 51 HG21 ILE 51 -17.810 3.262 -24.311 128 HG22 ILE 51 HG22 ILE 51 -16.592 3.275 -25.584 129 HG23 ILE 51 HG23 ILE 51 -16.981 1.770 -24.751 130 HD11 ILE 51 HD1 ILE 51 -17.591 5.305 -27.146 131 HD12 ILE 51 HD2 ILE 51 -18.870 4.808 -26.038 132 HD13 ILE 51 HD3 ILE 51 -19.245 5.140 -27.732 133 HA PRO 52 HA PRO 52 -15.058 -0.754 -28.480 134 HB2 PRO 52 HB2 PRO 52 -14.956 1.415 -30.500 135 HB3 PRO 52 HB1 PRO 52 -14.908 -0.344 -30.728 136 HG2 PRO 52 HG2 PRO 52 -17.057 1.113 -31.371 137 HG3 PRO 52 HG1 PRO 52 -17.187 -0.543 -30.750 138 HD2 PRO 52 HD2 PRO 52 -17.699 2.052 -29.329 139 HD3 PRO 52 HD1 PRO 52 -18.524 0.483 -29.157 140 H GLN 53 HN GLN 53 -12.878 -0.274 -28.159 141 HA GLN 53 HA GLN 53 -12.230 1.811 -26.383 142 HB2 GLN 53 HB2 GLN 53 -9.929 1.118 -26.665 143 HB3 GLN 53 HB1 GLN 53 -10.953 -0.324 -26.636 144 HG2 GLN 53 HG2 GLN 53 -10.951 -0.346 -29.119 145 HG3 GLN 53 HG1 GLN 53 -9.876 1.051 -29.119 146 HE21 GLN 53 HE21 GLN 53 -8.371 -0.529 -30.309 147 HE22 GLN 53 HE22 GLN 53 -7.408 -1.559 -29.364 148 H VAL 54 HN VAL 54 -12.513 1.751 -29.803 149 HA VAL 54 HA VAL 54 -10.711 3.784 -30.540 150 HB VAL 54 HB VAL 54 -11.919 2.280 -32.129 151 HG11 VAL 54 HG11 VAL 54 -14.263 3.839 -32.520 152 HG12 VAL 54 HG12 VAL 54 -14.184 3.447 -30.803 153 HG13 VAL 54 HG13 VAL 54 -14.161 2.156 -32.004 154 HG21 VAL 54 HG21 VAL 54 -11.427 5.127 -32.354 155 HG22 VAL 54 HG22 VAL 54 -12.765 4.650 -33.398 156 HG23 VAL 54 HG23 VAL 54 -11.195 3.864 -33.562 157 H TYR 55 HN TYR 55 -13.581 3.890 -28.709 158 HA TYR 55 HA TYR 55 -14.207 6.660 -29.304 159 HB2 TYR 55 HB2 TYR 55 -15.359 4.628 -27.412 160 HB3 TYR 55 HB1 TYR 55 -15.880 6.314 -27.415 161 HD1 TYR 55 HD1 TYR 55 -15.501 3.308 -29.593 162 HD2 TYR 55 HD2 TYR 55 -17.419 7.108 -29.023 163 HE1 TYR 55 HE1 TYR 55 -16.990 2.843 -31.520 164 HE2 TYR 55 HE2 TYR 55 -18.908 6.645 -30.953 165 HH TYR 55 HH TYR 55 -18.835 3.515 -32.620 166 H HIS 56 HN HIS 56 -11.661 5.561 -27.903 167 HA HIS 56 HA HIS 56 -10.466 5.988 -25.904 168 HB2 HIS 56 HB2 HIS 56 -9.773 7.627 -27.608 169 HB3 HIS 56 HB1 HIS 56 -11.058 8.717 -27.077 170 HD2 HIS 56 HD2 HIS 56 -10.318 10.360 -24.972 171 HE1 HIS 56 HE1 HIS 56 -6.834 8.279 -23.809 172 HE2 HIS 56 HE2 HIS 56 -8.243 10.349 -23.388 173 H ILE 57 HN ILE 57 -11.537 5.515 -24.039 174 HA ILE 57 HA ILE 57 -13.499 7.478 -23.041 175 HB ILE 57 HB ILE 57 -12.999 4.600 -22.232 176 HG12 ILE 57 HG12 ILE 57 -15.418 5.823 -23.580 177 HG13 ILE 57 HG11 ILE 57 -14.100 5.072 -24.485 178 HG21 ILE 57 HG21 ILE 57 -13.771 6.078 -20.369 179 HG22 ILE 57 HG22 ILE 57 -14.960 4.852 -20.809 180 HG23 ILE 57 HG23 ILE 57 -15.172 6.519 -21.345 181 HD11 ILE 57 HD1 ILE 57 -16.312 3.770 -23.353 182 HD12 ILE 57 HD2 ILE 57 -14.961 3.368 -22.299 183 HD13 ILE 57 HD3 ILE 57 -14.873 3.006 -24.022 184 H ILE 58 HN ILE 58 -12.896 8.807 -21.480 185 HA ILE 58 HA ILE 58 -10.687 7.992 -19.693 186 HB ILE 58 HB ILE 58 -11.286 10.770 -20.726 187 HG12 ILE 58 HG12 ILE 58 -10.260 9.302 -22.420 188 HG13 ILE 58 HG11 ILE 58 -9.100 10.509 -21.865 189 HG21 ILE 58 HG21 ILE 58 -9.526 9.672 -18.586 190 HG22 ILE 58 HG22 ILE 58 -10.332 11.237 -18.685 191 HG23 ILE 58 HG23 ILE 58 -8.854 10.946 -19.602 192 HD11 ILE 58 HD1 ILE 58 -9.079 7.577 -21.504 193 HD12 ILE 58 HD2 ILE 58 -8.656 8.505 -20.065 194 HD13 ILE 58 HD3 ILE 58 -7.733 8.716 -21.553 195 H VAL 59 HN VAL 59 -11.150 8.003 -17.585 196 HA VAL 59 HA VAL 59 -13.609 9.400 -16.717 197 HB VAL 59 HB VAL 59 -12.360 6.867 -15.620 198 HG11 VAL 59 HG11 VAL 59 -14.791 6.978 -14.489 199 HG12 VAL 59 HG12 VAL 59 -14.498 8.709 -14.656 200 HG13 VAL 59 HG13 VAL 59 -13.375 7.709 -13.734 201 HG21 VAL 59 HG21 VAL 59 -13.803 7.044 -17.882 202 HG22 VAL 59 HG22 VAL 59 -15.130 7.005 -16.720 203 HG23 VAL 59 HG23 VAL 59 -13.964 5.682 -16.774 204 H THR 60 HN THR 60 -13.368 10.963 -15.267 205 HA THR 60 HA THR 60 -10.973 10.936 -13.538 206 HB THR 60 HB THR 60 -12.138 13.352 -14.940 207 HG1 THR 60 HG1 THR 60 -9.510 12.510 -15.242 208 HG21 THR 60 HG21 THR 60 -10.790 13.208 -12.506 209 HG22 THR 60 HG22 THR 60 -10.949 14.640 -13.522 210 HG23 THR 60 HG23 THR 60 -9.527 13.608 -13.669 211 H ASP 61 HN ASP 61 -11.411 11.190 -11.434 212 HA ASP 61 HA ASP 61 -14.171 11.726 -10.636 213 HB2 ASP 61 HB2 ASP 61 -12.942 9.824 -9.635 214 HB3 ASP 61 HB1 ASP 61 -11.768 10.958 -8.962 215 H LEU 62 HN LEU 62 -14.706 13.817 -10.492 216 HA LEU 62 HA LEU 62 -12.713 15.753 -9.533 217 HB2 LEU 62 HB2 LEU 62 -15.120 15.866 -11.232 218 HB3 LEU 62 HB1 LEU 62 -14.935 17.223 -10.119 219 HG LEU 62 HG LEU 62 -13.813 17.504 -12.393 220 HD11 LEU 62 HD11 LEU 62 -12.312 18.910 -11.406 221 HD12 LEU 62 HD12 LEU 62 -11.620 17.629 -10.410 222 HD13 LEU 62 HD13 LEU 62 -13.119 18.416 -9.918 223 HD21 LEU 62 HD21 LEU 62 -11.429 16.057 -11.580 224 HD22 LEU 62 HD22 LEU 62 -12.318 15.968 -13.101 225 HD23 LEU 62 HD23 LEU 62 -12.803 14.962 -11.737 226 H SER 63 HN SER 63 -16.146 14.962 -8.954 227 HA SER 63 HA SER 63 -16.379 16.488 -6.588 228 HB2 SER 63 HB2 SER 63 -17.964 14.105 -7.565 229 HB3 SER 63 HB1 SER 63 -18.415 15.098 -6.182 230 HG SER 63 HG SER 63 -19.331 16.308 -7.638 231 H TYR 64 HN TYR 64 -15.544 13.105 -7.176 232 HA TYR 64 HA TYR 64 -14.224 11.724 -5.838 233 HB2 TYR 64 HB2 TYR 64 -14.659 13.687 -3.583 234 HB3 TYR 64 HB1 TYR 64 -13.427 12.432 -3.697 235 HD1 TYR 64 HD1 TYR 64 -13.893 15.850 -3.970 236 HD2 TYR 64 HD2 TYR 64 -12.087 12.582 -6.093 237 HE1 TYR 64 HE1 TYR 64 -12.374 17.437 -5.121 238 HE2 TYR 64 HE2 TYR 64 -10.568 14.169 -7.243 239 HH TYR 64 HH TYR 64 -10.684 17.663 -6.534 240 H GLY 65 HN GLY 65 -14.707 11.151 -3.098 241 HA2 GLY 65 HA2 GLY 65 -16.180 10.061 -1.696 242 HA3 GLY 65 HA1 GLY 65 -17.501 10.831 -2.576 243 H CYS 66 HN CYS 66 -15.090 8.949 -4.247 244 HA CYS 66 HA CYS 66 -15.155 6.870 -5.248 245 HB2 CYS 66 HB2 CYS 66 -17.697 6.396 -3.676 246 HB3 CYS 66 HB1 CYS 66 -16.672 5.178 -4.442 247 HG CYS 66 HG CYS 66 -16.170 6.447 -1.727 248 H GLY 67 HN GLY 67 -18.435 6.222 -5.216 249 HA2 GLY 67 HA2 GLY 67 -18.695 7.138 -7.990 250 HA3 GLY 67 HA1 GLY 67 -19.718 5.947 -7.186 251 H GLN 68 HN GLN 68 -19.380 9.208 -8.083 252 HA GLN 68 HA GLN 68 -22.008 9.831 -7.014 253 HB2 GLN 68 HB2 GLN 68 -19.523 11.294 -6.110 254 HB3 GLN 68 HB1 GLN 68 -21.147 11.966 -5.960 255 HG2 GLN 68 HG2 GLN 68 -21.844 10.096 -4.570 256 HG3 GLN 68 HG1 GLN 68 -20.293 9.294 -4.814 257 HE21 GLN 68 HE21 GLN 68 -21.573 10.338 -2.257 258 HE22 GLN 68 HE22 GLN 68 -20.410 11.380 -1.593 259 H SER 69 HN SER 69 -19.149 11.581 -8.254 260 HA SER 69 HA SER 69 -20.623 12.274 -10.680 261 HB2 SER 69 HB2 SER 69 -21.195 14.088 -9.133 262 HB3 SER 69 HB1 SER 69 -19.486 14.361 -8.807 263 HG SER 69 HG SER 69 -19.315 14.679 -11.157 264 H PHE 70 HN PHE 70 -19.323 12.447 -12.426 265 HA PHE 70 HA PHE 70 -16.487 12.996 -12.137 266 HB2 PHE 70 HB2 PHE 70 -15.784 10.908 -13.244 267 HB3 PHE 70 HB1 PHE 70 -16.573 10.581 -11.698 268 HD1 PHE 70 HD1 PHE 70 -16.899 10.404 -15.365 269 HD2 PHE 70 HD2 PHE 70 -18.803 9.593 -11.601 270 HE1 PHE 70 HE1 PHE 70 -18.583 8.993 -16.518 271 HE2 PHE 70 HE2 PHE 70 -20.484 8.182 -12.755 272 HZ PHE 70 HZ PHE 70 -20.374 7.883 -15.215 273 H ASP 71 HN ASP 71 -15.416 13.248 -14.213 274 HA ASP 71 HA ASP 71 -17.325 13.916 -16.368 275 HB2 ASP 71 HB2 ASP 71 -16.206 15.887 -15.419 276 HB3 ASP 71 HB1 ASP 71 -14.636 15.164 -15.766 277 H ILE 72 HN ILE 72 -17.229 12.551 -18.028 278 HA ILE 72 HA ILE 72 -14.597 11.409 -18.751 279 HB ILE 72 HB ILE 72 -15.785 9.375 -19.482 280 HG12 ILE 72 HG12 ILE 72 -18.216 10.609 -18.156 281 HG13 ILE 72 HG11 ILE 72 -17.969 10.582 -19.908 282 HG21 ILE 72 HG21 ILE 72 -15.199 8.745 -17.399 283 HG22 ILE 72 HG22 ILE 72 -16.842 9.139 -16.910 284 HG23 ILE 72 HG23 ILE 72 -15.565 10.342 -16.744 285 HD11 ILE 72 HD1 ILE 72 -18.421 8.352 -20.060 286 HD12 ILE 72 HD2 ILE 72 -19.255 8.612 -18.528 287 HD13 ILE 72 HD3 ILE 72 -17.608 7.981 -18.540 288 H VAL 73 HN VAL 73 -14.236 11.024 -20.982 289 HA VAL 73 HA VAL 73 -16.167 12.215 -22.853 290 HB VAL 73 HB VAL 73 -14.531 13.982 -22.216 291 HG11 VAL 73 HG11 VAL 73 -12.388 13.358 -21.915 292 HG12 VAL 73 HG12 VAL 73 -12.262 13.141 -23.660 293 HG13 VAL 73 HG13 VAL 73 -12.702 11.778 -22.631 294 HG21 VAL 73 HG21 VAL 73 -15.294 14.474 -24.325 295 HG22 VAL 73 HG22 VAL 73 -14.875 12.884 -24.959 296 HG23 VAL 73 HG23 VAL 73 -13.624 14.110 -24.758 297 H VAL 74 HN VAL 74 -16.106 11.363 -24.916 298 HA VAL 74 HA VAL 74 -14.197 9.161 -25.356 299 HB VAL 74 HB VAL 74 -15.977 7.914 -26.477 300 HG11 VAL 74 HG11 VAL 74 -15.614 7.656 -24.019 301 HG12 VAL 74 HG12 VAL 74 -17.285 7.351 -24.496 302 HG13 VAL 74 HG13 VAL 74 -16.848 8.884 -23.740 303 HG21 VAL 74 HG21 VAL 74 -17.560 10.389 -25.786 304 HG22 VAL 74 HG22 VAL 74 -18.352 8.842 -26.086 305 HG23 VAL 74 HG23 VAL 74 -17.390 9.602 -27.355 306 H VAL 75 HN VAL 75 -13.429 8.870 -27.442 307 HA VAL 75 HA VAL 75 -14.193 10.954 -29.398 308 HB VAL 75 HB VAL 75 -11.431 9.914 -28.744 309 HG11 VAL 75 HG11 VAL 75 -12.545 11.333 -31.131 310 HG12 VAL 75 HG12 VAL 75 -11.258 10.129 -31.041 311 HG13 VAL 75 HG13 VAL 75 -10.941 11.798 -30.560 312 HG21 VAL 75 HG21 VAL 75 -11.559 11.686 -27.324 313 HG22 VAL 75 HG22 VAL 75 -12.995 12.331 -28.120 314 HG23 VAL 75 HG23 VAL 75 -11.394 12.671 -28.778 315 H SER 76 HN SER 76 -15.086 10.066 -31.132 316 HA SER 76 HA SER 76 -13.853 7.808 -32.450 317 HB2 SER 76 HB2 SER 76 -15.221 6.656 -30.770 318 HB3 SER 76 HB1 SER 76 -16.642 7.535 -31.317 319 HG SER 76 HG SER 76 -16.819 5.910 -32.646 320 H ASP 77 HN ASP 77 -15.076 7.240 -34.471 321 HA ASP 77 HA ASP 77 -15.789 9.646 -35.871 322 HB2 ASP 77 HB2 ASP 77 -15.774 6.731 -36.665 323 HB3 ASP 77 HB1 ASP 77 -16.238 8.031 -37.762 324 H PHE 78 HN PHE 78 -17.495 7.698 -33.803 325 HA PHE 78 HA PHE 78 -19.976 7.281 -35.030 326 HB2 PHE 78 HB2 PHE 78 -19.209 6.435 -32.766 327 HB3 PHE 78 HB1 PHE 78 -19.602 8.036 -32.133 328 HD1 PHE 78 HD1 PHE 78 -21.089 5.281 -34.198 329 HD2 PHE 78 HD2 PHE 78 -21.783 8.468 -31.408 330 HE1 PHE 78 HE1 PHE 78 -23.477 4.629 -34.050 331 HE2 PHE 78 HE2 PHE 78 -24.174 7.822 -31.262 332 HZ PHE 78 HZ PHE 78 -25.020 5.902 -32.583 333 H PHE 79 HN PHE 79 -18.519 10.185 -33.757 334 HA PHE 79 HA PHE 79 -21.015 11.684 -33.831 335 HB2 PHE 79 HB2 PHE 79 -19.375 12.207 -32.092 336 HB3 PHE 79 HB1 PHE 79 -18.167 12.580 -33.321 337 HD1 PHE 79 HD1 PHE 79 -21.544 13.565 -32.067 338 HD2 PHE 79 HD2 PHE 79 -18.066 14.728 -34.302 339 HE1 PHE 79 HE1 PHE 79 -22.410 15.885 -32.207 340 HE2 PHE 79 HE2 PHE 79 -18.931 17.048 -34.442 341 HZ PHE 79 HZ PHE 79 -21.104 17.626 -33.393 342 H GLN 80 HN GLN 80 -18.975 10.576 -36.142 343 HA GLN 80 HA GLN 80 -18.799 12.970 -37.775 344 HB2 GLN 80 HB2 GLN 80 -17.073 11.118 -37.765 345 HB3 GLN 80 HB1 GLN 80 -18.255 10.114 -38.605 346 HG2 GLN 80 HG2 GLN 80 -17.590 12.852 -39.655 347 HG3 GLN 80 HG1 GLN 80 -16.533 11.489 -40.016 348 HE21 GLN 80 HE21 GLN 80 -18.290 12.992 -41.918 349 HE22 GLN 80 HE22 GLN 80 -19.342 11.834 -42.578 350 H GLY 81 HN GLY 81 -20.521 13.715 -38.821 351 HA2 GLY 81 HA2 GLY 81 -22.248 13.711 -40.380 352 HA3 GLY 81 HA1 GLY 81 -22.101 11.956 -40.493 353 H LYS 82 HN LYS 82 -22.216 12.739 -37.278 354 HA LYS 82 HA LYS 82 -25.162 12.521 -37.169 355 HB2 LYS 82 HB2 LYS 82 -23.136 11.040 -35.477 356 HB3 LYS 82 HB1 LYS 82 -24.875 11.049 -35.180 357 HG2 LYS 82 HG2 LYS 82 -25.274 10.076 -37.404 358 HG3 LYS 82 HG1 LYS 82 -23.541 10.090 -37.730 359 HD2 LYS 82 HD2 LYS 82 -24.061 7.867 -37.006 360 HD3 LYS 82 HD1 LYS 82 -23.263 8.654 -35.643 361 HE2 LYS 82 HE2 LYS 82 -25.397 9.103 -34.578 362 HE3 LYS 82 HE1 LYS 82 -26.271 8.495 -35.984 363 HZ1 LYS 82 HZ1 LYS 82 -24.318 6.715 -34.758 364 HZ2 LYS 82 HZ2 LYS 82 -25.817 6.357 -35.466 365 HZ3 LYS 82 HZ3 LYS 82 -25.748 6.990 -33.892 366 H SER 83 HN SER 83 -26.177 13.577 -35.463 367 HA SER 83 HA SER 83 -24.843 15.898 -34.469 368 HB2 SER 83 HB2 SER 83 -27.232 15.948 -34.949 369 HB3 SER 83 HB1 SER 83 -27.524 14.695 -33.747 370 HG SER 83 HG SER 83 -27.583 17.216 -33.310 371 H LYS 84 HN LYS 84 -24.365 16.437 -32.307 372 HA LYS 84 HA LYS 84 -23.104 14.446 -30.781 373 HB2 LYS 84 HB2 LYS 84 -22.554 16.840 -30.601 374 HB3 LYS 84 HB1 LYS 84 -24.131 17.145 -29.870 375 HG2 LYS 84 HG2 LYS 84 -23.575 15.649 -28.002 376 HG3 LYS 84 HG1 LYS 84 -22.011 15.294 -28.736 377 HD2 LYS 84 HD2 LYS 84 -21.368 17.656 -28.556 378 HD3 LYS 84 HD1 LYS 84 -22.943 18.047 -27.865 379 HE2 LYS 84 HE2 LYS 84 -21.308 17.809 -26.066 380 HE3 LYS 84 HE1 LYS 84 -22.466 16.482 -25.984 381 HZ1 LYS 84 HZ1 LYS 84 -20.937 15.007 -26.948 382 HZ2 LYS 84 HZ2 LYS 84 -20.055 15.864 -25.776 383 HZ3 LYS 84 HZ3 LYS 84 -19.891 16.256 -27.422 384 H LEU 85 HN LEU 85 -26.344 15.834 -30.587 385 HA LEU 85 HA LEU 85 -27.129 14.722 -28.129 386 HB2 LEU 85 HB2 LEU 85 -28.714 15.476 -30.587 387 HB3 LEU 85 HB1 LEU 85 -29.467 14.947 -29.082 388 HG LEU 85 HG LEU 85 -27.509 17.253 -29.245 389 HD11 LEU 85 HD11 LEU 85 -29.908 17.355 -30.442 390 HD12 LEU 85 HD12 LEU 85 -29.243 18.735 -29.568 391 HD13 LEU 85 HD13 LEU 85 -30.425 17.684 -28.788 392 HD21 LEU 85 HD21 LEU 85 -28.728 15.755 -27.114 393 HD22 LEU 85 HD22 LEU 85 -29.333 17.413 -27.073 394 HD23 LEU 85 HD23 LEU 85 -27.598 17.106 -26.999 395 H MET 86 HN MET 86 -27.178 13.415 -31.411 396 HA MET 86 HA MET 86 -28.690 11.098 -30.881 397 HB2 MET 86 HB2 MET 86 -26.523 11.569 -32.944 398 HB3 MET 86 HB1 MET 86 -27.644 10.207 -32.945 399 HG2 MET 86 HG2 MET 86 -29.549 11.815 -33.031 400 HG3 MET 86 HG1 MET 86 -28.395 13.139 -33.123 401 HE1 MET 86 HE1 MET 86 -29.349 9.952 -36.250 402 HE2 MET 86 HE2 MET 86 -30.000 10.151 -34.624 403 HE3 MET 86 HE3 MET 86 -28.378 9.497 -34.842 404 H ARG 87 HN ARG 87 -25.239 11.776 -30.620 405 HA ARG 87 HA ARG 87 -24.347 9.148 -30.150 406 HB2 ARG 87 HB2 ARG 87 -23.242 11.831 -29.356 407 HB3 ARG 87 HB1 ARG 87 -22.417 10.322 -28.967 408 HG2 ARG 87 HG2 ARG 87 -22.779 9.815 -31.528 409 HG3 ARG 87 HG1 ARG 87 -22.946 11.562 -31.652 410 HD2 ARG 87 HD2 ARG 87 -20.615 10.950 -32.004 411 HD3 ARG 87 HD1 ARG 87 -20.760 11.831 -30.482 412 HE ARG 87 HE ARG 87 -20.967 8.988 -30.113 413 HH11 ARG 87 HH11 ARG 87 -18.788 11.624 -30.637 414 HH12 ARG 87 HH12 ARG 87 -17.447 10.852 -29.867 415 HH21 ARG 87 HH21 ARG 87 -19.211 7.969 -29.095 416 HH22 ARG 87 HH22 ARG 87 -17.685 8.782 -28.992 417 H SER 88 HN SER 88 -25.652 11.615 -27.994 418 HA SER 88 HA SER 88 -24.994 10.459 -25.532 419 HB2 SER 88 HB2 SER 88 -27.432 12.083 -26.309 420 HB3 SER 88 HB1 SER 88 -26.954 11.723 -24.653 421 HG SER 88 HG SER 88 -25.154 12.938 -24.903 422 H ARG 89 HN ARG 89 -27.803 9.927 -27.641 423 HA ARG 89 HA ARG 89 -29.171 8.144 -25.916 424 HB2 ARG 89 HB2 ARG 89 -29.242 8.535 -28.911 425 HB3 ARG 89 HB1 ARG 89 -30.298 7.402 -28.066 426 HG2 ARG 89 HG2 ARG 89 -31.103 9.283 -26.635 427 HG3 ARG 89 HG1 ARG 89 -30.118 10.392 -27.590 428 HD2 ARG 89 HD2 ARG 89 -32.248 8.593 -28.769 429 HD3 ARG 89 HD1 ARG 89 -32.527 10.273 -28.316 430 HE ARG 89 HE ARG 89 -30.287 10.191 -30.009 431 HH11 ARG 89 HH11 ARG 89 -33.690 9.568 -30.042 432 HH12 ARG 89 HH12 ARG 89 -33.886 9.960 -31.718 433 HH21 ARG 89 HH21 ARG 89 -30.536 10.703 -32.206 434 HH22 ARG 89 HH22 ARG 89 -32.099 10.603 -32.944 435 H ALA 90 HN ALA 90 -26.784 7.643 -28.488 436 HA ALA 90 HA ALA 90 -26.888 4.830 -28.571 437 HB1 ALA 90 HB1 ALA 90 -25.732 5.860 -30.345 438 HB2 ALA 90 HB2 ALA 90 -24.447 5.121 -29.391 439 HB3 ALA 90 HB3 ALA 90 -24.760 6.850 -29.258 440 H VAL 91 HN VAL 91 -24.875 7.034 -26.644 441 HA VAL 91 HA VAL 91 -23.485 4.915 -25.298 442 HB VAL 91 HB VAL 91 -22.521 7.183 -25.614 443 HG11 VAL 91 HG11 VAL 91 -23.330 9.020 -24.209 444 HG12 VAL 91 HG12 VAL 91 -24.577 7.975 -23.528 445 HG13 VAL 91 HG13 VAL 91 -24.639 8.429 -25.232 446 HG21 VAL 91 HG21 VAL 91 -22.721 5.714 -23.069 447 HG22 VAL 91 HG22 VAL 91 -22.219 7.394 -22.882 448 HG23 VAL 91 HG23 VAL 91 -21.291 6.306 -23.915 449 H ASN 92 HN ASN 92 -26.178 7.074 -24.492 450 HA ASN 92 HA ASN 92 -26.515 6.232 -21.819 451 HB2 ASN 92 HB2 ASN 92 -28.440 7.429 -23.819 452 HB3 ASN 92 HB1 ASN 92 -28.867 7.118 -22.136 453 HD21 ASN 92 HD21 ASN 92 -25.918 7.764 -21.408 454 HD22 ASN 92 HD22 ASN 92 -25.874 9.458 -21.414 455 H LYS 93 HN LYS 93 -27.909 5.067 -24.856 456 HA LYS 93 HA LYS 93 -29.706 3.206 -23.724 457 HB2 LYS 93 HB2 LYS 93 -28.360 3.336 -26.421 458 HB3 LYS 93 HB1 LYS 93 -29.546 2.100 -26.003 459 HG2 LYS 93 HG2 LYS 93 -31.196 3.858 -25.486 460 HG3 LYS 93 HG1 LYS 93 -30.015 5.095 -25.899 461 HD2 LYS 93 HD2 LYS 93 -29.881 4.214 -28.198 462 HD3 LYS 93 HD1 LYS 93 -31.058 2.964 -27.788 463 HE2 LYS 93 HE2 LYS 93 -32.728 4.704 -27.266 464 HE3 LYS 93 HE1 LYS 93 -31.554 5.955 -27.673 465 HZ1 LYS 93 HZ1 LYS 93 -31.488 4.369 -29.846 466 HZ2 LYS 93 HZ2 LYS 93 -32.417 5.785 -29.711 467 HZ3 LYS 93 HZ3 LYS 93 -33.124 4.269 -29.406 468 H ALA 94 HN ALA 94 -26.318 2.972 -24.677 469 HA ALA 94 HA ALA 94 -26.016 0.189 -24.416 470 HB1 ALA 94 HB1 ALA 94 -23.619 0.656 -24.221 471 HB2 ALA 94 HB2 ALA 94 -23.965 2.357 -23.911 472 HB3 ALA 94 HB3 ALA 94 -24.339 1.653 -25.484 473 H VAL 95 HN VAL 95 -25.718 2.806 -22.053 474 HA VAL 95 HA VAL 95 -25.936 0.810 -19.905 475 HB VAL 95 HB VAL 95 -24.222 2.510 -18.725 476 HG11 VAL 95 HG11 VAL 95 -22.964 0.632 -18.624 477 HG12 VAL 95 HG12 VAL 95 -22.760 0.588 -20.377 478 HG13 VAL 95 HG13 VAL 95 -24.199 -0.115 -19.638 479 HG21 VAL 95 HG21 VAL 95 -22.819 3.614 -20.147 480 HG22 VAL 95 HG22 VAL 95 -24.160 3.471 -21.283 481 HG23 VAL 95 HG23 VAL 95 -22.837 2.307 -21.331 482 H LYS 96 HN LYS 96 -28.070 2.227 -20.709 483 HA LYS 96 HA LYS 96 -28.415 4.781 -19.556 484 HB2 LYS 96 HB2 LYS 96 -30.789 4.419 -19.891 485 HB3 LYS 96 HB1 LYS 96 -29.917 3.759 -21.276 486 HG2 LYS 96 HG2 LYS 96 -30.033 1.504 -20.274 487 HG3 LYS 96 HG1 LYS 96 -30.923 2.163 -18.902 488 HD2 LYS 96 HD2 LYS 96 -32.720 2.908 -20.416 489 HD3 LYS 96 HD1 LYS 96 -31.833 2.255 -21.794 490 HE2 LYS 96 HE2 LYS 96 -31.954 -0.003 -20.807 491 HE3 LYS 96 HE1 LYS 96 -32.837 0.647 -19.426 492 HZ1 LYS 96 HZ1 LYS 96 -33.764 0.056 -22.087 493 HZ2 LYS 96 HZ2 LYS 96 -34.249 1.584 -21.522 494 HZ3 LYS 96 HZ3 LYS 96 -34.636 0.185 -20.639 495 H GLU 97 HN GLU 97 -28.717 1.535 -18.268 496 HA GLU 97 HA GLU 97 -30.113 2.174 -15.891 497 HB2 GLU 97 HB2 GLU 97 -28.227 -0.094 -16.553 498 HB3 GLU 97 HB1 GLU 97 -29.167 0.002 -15.063 499 HG2 GLU 97 HG2 GLU 97 -30.365 0.076 -17.847 500 HG3 GLU 97 HG1 GLU 97 -30.280 -1.367 -16.840 501 H GLU 98 HN GLU 98 -26.684 2.096 -16.707 502 HA GLU 98 HA GLU 98 -25.657 2.438 -14.102 503 HB2 GLU 98 HB2 GLU 98 -24.541 3.216 -16.803 504 HB3 GLU 98 HB1 GLU 98 -23.631 3.330 -15.295 505 HG2 GLU 98 HG2 GLU 98 -23.009 1.213 -16.045 506 HG3 GLU 98 HG1 GLU 98 -24.367 0.826 -14.990 507 H LEU 99 HN LEU 99 -27.013 4.672 -16.417 508 HA LEU 99 HA LEU 99 -25.998 7.086 -15.399 509 HB2 LEU 99 HB2 LEU 99 -28.474 6.350 -16.936 510 HB3 LEU 99 HB1 LEU 99 -28.236 8.000 -16.358 511 HG LEU 99 HG LEU 99 -25.899 7.835 -17.447 512 HD11 LEU 99 HD11 LEU 99 -25.455 5.722 -18.161 513 HD12 LEU 99 HD12 LEU 99 -26.413 6.185 -19.567 514 HD13 LEU 99 HD13 LEU 99 -27.164 5.293 -18.245 515 HD21 LEU 99 HD21 LEU 99 -28.311 7.754 -19.283 516 HD22 LEU 99 HD22 LEU 99 -26.782 8.582 -19.578 517 HD23 LEU 99 HD23 LEU 99 -27.863 9.156 -18.310 518 H GLN 100 HN GLN 100 -28.799 5.142 -14.463 519 HA GLN 100 HA GLN 100 -29.981 6.980 -12.684 520 HB2 GLN 100 HB2 GLN 100 -29.987 3.954 -12.732 521 HB3 GLN 100 HB1 GLN 100 -30.981 4.916 -11.635 522 HG2 GLN 100 HG2 GLN 100 -32.041 6.035 -13.550 523 HG3 GLN 100 HG1 GLN 100 -31.029 5.111 -14.660 524 HE21 GLN 100 HE21 GLN 100 -33.572 4.638 -15.226 525 HE22 GLN 100 HE22 GLN 100 -34.154 3.198 -14.543 526 H GLU 101 HN GLU 101 -27.452 4.539 -12.208 527 HA GLU 101 HA GLU 101 -27.230 5.144 -9.379 528 HB2 GLU 101 HB2 GLU 101 -25.444 3.490 -9.372 529 HB3 GLU 101 HB1 GLU 101 -26.835 2.849 -10.246 530 HG2 GLU 101 HG2 GLU 101 -25.796 3.476 -12.382 531 HG3 GLU 101 HG1 GLU 101 -24.411 4.150 -11.525 532 H ILE 102 HN ILE 102 -25.684 6.026 -12.378 533 HA ILE 102 HA ILE 102 -23.287 7.104 -11.326 534 HB ILE 102 HB ILE 102 -24.835 7.689 -13.850 535 HG12 ILE 102 HG12 ILE 102 -23.685 5.430 -13.431 536 HG13 ILE 102 HG11 ILE 102 -23.217 6.280 -14.902 537 HG21 ILE 102 HG21 ILE 102 -23.556 9.675 -13.318 538 HG22 ILE 102 HG22 ILE 102 -22.707 8.800 -14.593 539 HG23 ILE 102 HG23 ILE 102 -22.135 8.708 -12.927 540 HD11 ILE 102 HD1 ILE 102 -21.380 5.293 -13.276 541 HD12 ILE 102 HD2 ILE 102 -21.684 6.777 -12.374 542 HD13 ILE 102 HD3 ILE 102 -21.139 6.859 -14.046 543 H HIS 103 HN HIS 103 -26.448 8.550 -12.018 544 HA HIS 103 HA HIS 103 -27.461 10.372 -11.006 545 HB2 HIS 103 HB2 HIS 103 -24.810 10.737 -9.588 546 HB3 HIS 103 HB1 HIS 103 -26.293 11.614 -9.237 547 HD2 HIS 103 HD2 HIS 103 -24.575 8.384 -8.155 548 HE1 HIS 103 HE1 HIS 103 -28.633 7.945 -7.077 549 HE2 HIS 103 HE2 HIS 103 -26.304 6.973 -6.799 550 H ALA 104 HN ALA 104 -24.545 12.125 -10.616 551 HA ALA 104 HA ALA 104 -25.164 13.663 -13.053 552 HB1 ALA 104 HB1 ALA 104 -23.851 14.378 -10.437 553 HB2 ALA 104 HB2 ALA 104 -25.260 15.115 -11.201 554 HB3 ALA 104 HB3 ALA 104 -23.649 15.389 -11.868 555 H PHE 105 HN PHE 105 -23.935 13.113 -14.735 556 HA PHE 105 HA PHE 105 -21.031 13.003 -14.378 557 HB2 PHE 105 HB2 PHE 105 -20.782 10.903 -15.531 558 HB3 PHE 105 HB1 PHE 105 -21.893 10.657 -14.189 559 HD1 PHE 105 HD1 PHE 105 -21.524 10.770 -17.822 560 HD2 PHE 105 HD2 PHE 105 -24.340 10.472 -14.593 561 HE1 PHE 105 HE1 PHE 105 -23.266 10.001 -19.411 562 HE2 PHE 105 HE2 PHE 105 -26.080 9.700 -16.180 563 HZ PHE 105 HZ PHE 105 -25.543 9.465 -18.590 564 H SER 106 HN SER 106 -19.880 13.139 -16.451 565 HA SER 106 HA SER 106 -21.550 14.353 -18.570 566 HB2 SER 106 HB2 SER 106 -19.647 15.834 -19.087 567 HB3 SER 106 HB1 SER 106 -20.215 16.069 -17.429 568 HG SER 106 HG SER 106 -17.825 15.101 -18.372 569 H CYS 107 HN CYS 107 -20.939 13.952 -20.701 570 HA CYS 107 HA CYS 107 -18.794 12.000 -21.170 571 HB2 CYS 107 HB2 CYS 107 -20.319 10.674 -22.625 572 HB3 CYS 107 HB1 CYS 107 -20.796 10.636 -20.926 573 HG CYS 107 HG CYS 107 -22.600 12.524 -21.537 574 H LYS 108 HN LYS 108 -17.981 14.189 -21.895 575 HA LYS 108 HA LYS 108 -19.053 15.494 -24.159 576 HB2 LYS 108 HB2 LYS 108 -16.241 15.410 -23.048 577 HB3 LYS 108 HB1 LYS 108 -16.752 16.484 -24.350 578 HG2 LYS 108 HG2 LYS 108 -18.467 17.463 -22.865 579 HG3 LYS 108 HG1 LYS 108 -17.944 16.395 -21.562 580 HD2 LYS 108 HD2 LYS 108 -15.687 17.398 -21.645 581 HD3 LYS 108 HD1 LYS 108 -16.215 18.472 -22.939 582 HE2 LYS 108 HE2 LYS 108 -17.916 19.449 -21.442 583 HE3 LYS 108 HE1 LYS 108 -17.389 18.377 -20.146 584 HZ1 LYS 108 HZ1 LYS 108 -15.200 19.379 -20.241 585 HZ2 LYS 108 HZ2 LYS 108 -16.380 20.568 -19.963 586 HZ3 LYS 108 HZ3 LYS 108 -15.690 20.398 -21.505 587 H CYS 109 HN CYS 109 -18.722 15.225 -26.321 588 HA CYS 109 HA CYS 109 -17.121 12.882 -27.143 589 HB2 CYS 109 HB2 CYS 109 -19.663 13.997 -28.350 590 HB3 CYS 109 HB1 CYS 109 -18.701 12.703 -29.066 591 HG CYS 109 HG CYS 109 -19.311 11.159 -27.097 592 H TYR 110 HN TYR 110 -15.499 13.245 -28.524 593 HA TYR 110 HA TYR 110 -15.547 15.709 -30.144 594 HB2 TYR 110 HB2 TYR 110 -13.173 14.655 -28.589 595 HB3 TYR 110 HB1 TYR 110 -13.147 16.031 -29.695 596 HD1 TYR 110 HD1 TYR 110 -12.573 15.895 -26.593 597 HD2 TYR 110 HD2 TYR 110 -15.975 17.037 -28.953 598 HE1 TYR 110 HE1 TYR 110 -13.341 17.385 -24.764 599 HE2 TYR 110 HE2 TYR 110 -16.744 18.527 -27.125 600 HH TYR 110 HH TYR 110 -15.368 19.790 -25.085 601 H THR 111 HN THR 111 -14.666 15.534 -32.181 602 HA THR 111 HA THR 111 -13.159 13.206 -32.983 603 HB THR 111 HB THR 111 -15.912 13.606 -34.175 604 HG1 THR 111 HG1 THR 111 -16.397 12.642 -32.344 605 HG21 THR 111 HG21 THR 111 -14.625 11.037 -34.557 606 HG22 THR 111 HG22 THR 111 -13.603 12.345 -35.153 607 HG23 THR 111 HG23 THR 111 -15.247 12.161 -35.765 608 H GLU 112 HN GLU 112 -12.524 15.919 -33.033 609 HA GLU 112 HA GLU 112 -11.451 17.344 -34.482 610 HB2 GLU 112 HB2 GLU 112 -10.943 15.382 -35.888 611 HB3 GLU 112 HB1 GLU 112 -12.522 15.528 -36.656 612 HG2 GLU 112 HG2 GLU 112 -10.901 16.606 -38.084 613 HG3 GLU 112 HG1 GLU 112 -11.909 17.854 -37.353 614 H GLU 113 HN GLU 113 -14.741 16.318 -35.164 615 HA GLU 113 HA GLU 113 -15.534 18.556 -36.710 616 HB2 GLU 113 HB2 GLU 113 -17.114 16.647 -34.980 617 HB3 GLU 113 HB1 GLU 113 -17.835 17.897 -36.006 618 HG2 GLU 113 HG2 GLU 113 -15.999 15.676 -36.963 619 HG3 GLU 113 HG1 GLU 113 -17.750 15.698 -37.165 620 H GLU 114 HN GLU 114 -15.549 17.904 -33.231 621 HA GLU 114 HA GLU 114 -17.022 19.988 -32.224 622 HB2 GLU 114 HB2 GLU 114 -15.656 19.869 -30.237 623 HB3 GLU 114 HB1 GLU 114 -15.804 18.237 -30.890 624 HG2 GLU 114 HG2 GLU 114 -13.613 18.440 -31.970 625 HG3 GLU 114 HG1 GLU 114 -13.463 20.098 -31.389 626 H TRP 115 HN TRP 115 -13.785 20.100 -33.607 627 HA TRP 115 HA TRP 115 -13.247 22.829 -32.933 628 HB2 TRP 115 HB2 TRP 115 -11.361 21.486 -33.427 629 HB3 TRP 115 HB1 TRP 115 -12.057 20.920 -34.946 630 HD1 TRP 115 HD1 TRP 115 -11.404 22.242 -37.035 631 HE1 TRP 115 HE1 TRP 115 -10.273 24.511 -37.503 632 HE3 TRP 115 HE3 TRP 115 -11.126 24.086 -32.281 633 HZ2 TRP 115 HZ2 TRP 115 -9.370 26.804 -36.052 634 HZ3 TRP 115 HZ3 TRP 115 -10.128 26.314 -31.853 635 HH2 TRP 115 HH2 TRP 115 -9.250 27.674 -33.731 636 H SER 116 HN SER 116 -14.679 21.187 -35.711 637 HA SER 116 HA SER 116 -14.798 23.368 -37.462 638 HB2 SER 116 HB2 SER 116 -16.592 20.966 -37.219 639 HB3 SER 116 HB1 SER 116 -16.659 22.115 -38.553 640 HG SER 116 HG SER 116 -15.147 20.045 -38.431 641 H LYS 117 HN LYS 117 -17.017 22.269 -34.951 642 HA LYS 117 HA LYS 117 -18.640 24.697 -35.385 643 HB2 LYS 117 HB2 LYS 117 -19.353 22.077 -34.049 644 HB3 LYS 117 HB1 LYS 117 -20.412 23.485 -34.124 645 HG2 LYS 117 HG2 LYS 117 -20.401 23.407 -36.569 646 HG3 LYS 117 HG1 LYS 117 -19.265 22.058 -36.541 647 HD2 LYS 117 HD2 LYS 117 -21.504 21.174 -36.871 648 HD3 LYS 117 HD1 LYS 117 -20.956 20.727 -35.255 649 HE2 LYS 117 HE2 LYS 117 -22.196 22.621 -34.295 650 HE3 LYS 117 HE1 LYS 117 -22.725 23.103 -35.907 651 HZ1 LYS 117 HZ1 LYS 117 -23.866 21.190 -34.196 652 HZ2 LYS 117 HZ2 LYS 117 -23.320 20.398 -35.597 653 HZ3 LYS 117 HZ3 LYS 117 -24.408 21.698 -35.721 654 H ILE 118 HN ILE 118 -19.388 25.853 -33.522 655 HA ILE 118 HA ILE 118 -19.258 26.699 -31.375 656 HB ILE 118 HB ILE 118 -17.249 24.616 -30.590 657 HG12 ILE 118 HG12 ILE 118 -19.950 23.728 -30.108 658 HG13 ILE 118 HG11 ILE 118 -19.729 24.008 -31.834 659 HG21 ILE 118 HG21 ILE 118 -17.807 25.299 -28.517 660 HG22 ILE 118 HG22 ILE 118 -19.529 25.125 -28.856 661 HG23 ILE 118 HG23 ILE 118 -18.694 26.621 -29.276 662 HD11 ILE 118 HD1 ILE 118 -18.584 22.082 -31.989 663 HD12 ILE 118 HD2 ILE 118 -18.756 21.828 -30.252 664 HD13 ILE 118 HD3 ILE 118 -17.374 22.726 -30.879 665 H VAL 119 HN VAL 119 -16.391 25.737 -33.122 666 HA VAL 119 HA VAL 119 -15.083 28.223 -32.224 667 HB VAL 119 HB VAL 119 -12.909 27.017 -32.198 668 HG11 VAL 119 HG11 VAL 119 -13.344 25.780 -30.077 669 HG12 VAL 119 HG12 VAL 119 -15.077 25.913 -30.381 670 HG13 VAL 119 HG13 VAL 119 -14.117 27.366 -30.098 671 HG21 VAL 119 HG21 VAL 119 -14.711 24.823 -33.073 672 HG22 VAL 119 HG22 VAL 119 -13.495 24.381 -31.874 673 HG23 VAL 119 HG23 VAL 119 -13.001 25.079 -33.416 674 H VAL 120 HN VAL 120 -13.444 29.009 -33.728 675 HA VAL 120 HA VAL 120 -12.651 29.516 -35.831 676 HB VAL 120 HB VAL 120 -12.653 26.777 -35.771 677 HG11 VAL 120 HG11 VAL 120 -14.980 27.158 -37.014 678 HG12 VAL 120 HG12 VAL 120 -13.891 25.864 -37.504 679 HG13 VAL 120 HG13 VAL 120 -13.929 27.376 -38.411 680 HG21 VAL 120 HG21 VAL 120 -11.874 28.756 -37.921 681 HG22 VAL 120 HG22 VAL 120 -11.481 27.041 -38.045 682 HG23 VAL 120 HG23 VAL 120 -10.837 28.000 -36.711 683 H LEU 121 HN LEU 121 -15.764 29.278 -34.950 684 HA LEU 121 HA LEU 121 -17.224 29.353 -37.361 685 HB2 LEU 121 HB2 LEU 121 -17.740 30.350 -34.573 686 HB3 LEU 121 HB1 LEU 121 -18.867 30.724 -35.874 687 HG LEU 121 HG LEU 121 -19.358 28.596 -34.544 688 HD11 LEU 121 HD11 LEU 121 -20.575 28.161 -36.386 689 HD12 LEU 121 HD12 LEU 121 -19.155 27.439 -37.143 690 HD13 LEU 121 HD13 LEU 121 -19.486 29.158 -37.350 691 HD21 LEU 121 HD21 LEU 121 -16.939 27.673 -36.127 692 HD22 LEU 121 HD22 LEU 121 -18.026 26.611 -35.231 693 HD23 LEU 121 HD23 LEU 121 -17.042 27.796 -34.370 694 H GLU 122 HN GLU 122 -15.724 31.903 -35.420 695 HA GLU 122 HA GLU 122 -15.839 33.680 -37.765 696 HB2 GLU 122 HB2 GLU 122 -17.731 34.278 -36.276 697 HB3 GLU 122 HB1 GLU 122 -16.591 34.520 -34.951 698 HG2 GLU 122 HG2 GLU 122 -15.445 36.275 -36.237 699 HG3 GLU 122 HG1 GLU 122 -16.550 36.020 -37.587 700 H HIS 123 HN HIS 123 -13.724 33.893 -38.207 701 HA HIS 123 HA HIS 123 -11.985 34.967 -36.108 702 HB2 HIS 123 HB2 HIS 123 -11.387 32.478 -37.709 703 HB3 HIS 123 HB1 HIS 123 -10.150 33.399 -36.853 704 HD2 HIS 123 HD2 HIS 123 -10.036 32.906 -34.108 705 HE1 HIS 123 HE1 HIS 123 -13.524 30.547 -33.835 706 HE2 HIS 123 HE2 HIS 123 -11.504 31.403 -32.558 707 H HIS 124 HN HIS 124 -10.133 36.077 -36.916 708 HA HIS 124 HA HIS 124 -10.436 36.909 -39.737 709 HB2 HIS 124 HB2 HIS 124 -10.777 38.699 -38.062 710 HB3 HIS 124 HB1 HIS 124 -9.151 38.409 -37.441 711 HD2 HIS 124 HD2 HIS 124 -10.875 40.104 -40.519 712 HE1 HIS 124 HE1 HIS 124 -6.706 40.632 -40.924 713 HE2 HIS 124 HE2 HIS 124 -8.973 41.285 -41.863 714 H HIS 125 HN HIS 125 -8.922 36.198 -41.092 715 HA HIS 125 HA HIS 125 -6.282 35.453 -39.985 716 HB2 HIS 125 HB2 HIS 125 -7.610 33.641 -41.092 717 HB3 HIS 125 HB1 HIS 125 -7.537 34.566 -42.592 718 HD2 HIS 125 HD2 HIS 125 -5.250 34.064 -44.070 719 HE1 HIS 125 HE1 HIS 125 -2.941 32.311 -41.000 720 HE2 HIS 125 HE2 HIS 125 -3.000 32.886 -43.473 721 H HIS 126 HN HIS 126 -5.139 37.334 -40.136 722 HA HIS 126 HA HIS 126 -5.302 39.212 -42.228 723 HB2 HIS 126 HB2 HIS 126 -4.304 39.733 -40.048 724 HB3 HIS 126 HB1 HIS 126 -2.983 38.612 -40.376 725 HD2 HIS 126 HD2 HIS 126 -0.863 39.782 -41.713 726 HE1 HIS 126 HE1 HIS 126 -2.867 43.233 -43.089 727 HE2 HIS 126 HE2 HIS 126 -0.619 42.058 -42.969 728 H HIS 127 HN HIS 127 -2.975 36.572 -41.668 729 HA HIS 127 HA HIS 127 -2.608 36.235 -44.523 730 HB2 HIS 127 HB2 HIS 127 -0.202 36.642 -44.513 731 HB3 HIS 127 HB1 HIS 127 -1.057 38.098 -44.008 732 HD2 HIS 127 HD2 HIS 127 1.676 35.762 -42.673 733 HE1 HIS 127 HE1 HIS 127 0.373 38.056 -39.376 734 HE2 HIS 127 HE2 HIS 127 2.157 36.449 -40.200 735 H HIS 128 HN HIS 128 -1.106 34.406 -44.991 736 HA HIS 128 HA HIS 128 -1.311 32.391 -42.848 737 HB2 HIS 128 HB2 HIS 128 -1.232 30.718 -44.581 738 HB3 HIS 128 HB1 HIS 128 -2.434 31.924 -45.043 739 HD2 HIS 128 HD2 HIS 128 0.889 30.454 -46.379 740 HE1 HIS 128 HE1 HIS 128 -0.088 33.733 -48.851 741 HE2 HIS 128 HE2 HIS 128 1.453 31.731 -48.584 Start of MODEL 6 1 H1 MET 36 HT1 MET 36 -21.259 5.953 -2.982 2 H2 MET 36 HT2 MET 36 -21.971 4.503 -3.509 3 H3 MET 36 HT3 MET 36 -22.413 5.978 -4.226 4 HA MET 36 HA MET 36 -20.493 6.156 -5.437 5 HB2 MET 36 HB2 MET 36 -19.384 4.652 -3.121 6 HB3 MET 36 HB1 MET 36 -18.586 4.407 -4.676 7 HG2 MET 36 HG2 MET 36 -18.263 6.811 -4.935 8 HG3 MET 36 HG1 MET 36 -19.158 7.118 -3.447 9 HE1 MET 36 HE1 MET 36 -16.311 5.688 -5.235 10 HE2 MET 36 HE2 MET 36 -16.271 4.266 -4.196 11 HE3 MET 36 HE3 MET 36 -14.986 5.465 -4.086 12 HA PRO 37 HA PRO 37 -22.422 1.987 -6.637 13 HB2 PRO 37 HB2 PRO 37 -24.099 3.004 -8.561 14 HB3 PRO 37 HB1 PRO 37 -24.574 2.774 -6.864 15 HG2 PRO 37 HG2 PRO 37 -23.675 5.253 -8.260 16 HG3 PRO 37 HG1 PRO 37 -24.987 5.034 -7.086 17 HD2 PRO 37 HD2 PRO 37 -22.588 6.070 -6.363 18 HD3 PRO 37 HD1 PRO 37 -23.536 5.046 -5.258 19 H VAL 38 HN VAL 38 -21.037 4.736 -8.272 20 HA VAL 38 HA VAL 38 -19.842 2.917 -10.257 21 HB VAL 38 HB VAL 38 -21.834 4.150 -11.233 22 HG11 VAL 38 HG11 VAL 38 -21.593 6.513 -11.694 23 HG12 VAL 38 HG12 VAL 38 -19.965 6.529 -11.014 24 HG13 VAL 38 HG13 VAL 38 -21.360 6.275 -9.963 25 HG21 VAL 38 HG21 VAL 38 -20.452 4.958 -13.243 26 HG22 VAL 38 HG22 VAL 38 -20.223 3.276 -12.761 27 HG23 VAL 38 HG23 VAL 38 -19.027 4.493 -12.312 28 H THR 39 HN THR 39 -17.782 3.476 -10.918 29 HA THR 39 HA THR 39 -16.594 5.854 -9.626 30 HB THR 39 HB THR 39 -14.549 4.546 -9.226 31 HG1 THR 39 HG1 THR 39 -15.593 2.933 -10.953 32 HG21 THR 39 HG21 THR 39 -15.646 2.864 -7.565 33 HG22 THR 39 HG22 THR 39 -17.164 3.601 -8.080 34 HG23 THR 39 HG23 THR 39 -15.914 4.592 -7.324 35 H GLU 40 HN GLU 40 -14.648 6.645 -10.699 36 HA GLU 40 HA GLU 40 -14.962 6.865 -13.491 37 HB2 GLU 40 HB2 GLU 40 -13.829 8.548 -12.123 38 HB3 GLU 40 HB1 GLU 40 -12.537 7.403 -11.777 39 HG2 GLU 40 HG2 GLU 40 -12.003 7.266 -14.183 40 HG3 GLU 40 HG1 GLU 40 -13.298 8.404 -14.534 41 H GLN 41 HN GLN 41 -12.714 4.919 -11.525 42 HA GLN 41 HA GLN 41 -11.276 3.828 -13.703 43 HB2 GLN 41 HB2 GLN 41 -11.760 2.841 -10.885 44 HB3 GLN 41 HB1 GLN 41 -10.671 2.036 -12.017 45 HG2 GLN 41 HG2 GLN 41 -9.361 4.108 -12.244 46 HG3 GLN 41 HG1 GLN 41 -10.460 4.933 -11.141 47 HE21 GLN 41 HE21 GLN 41 -7.491 3.432 -11.205 48 HE22 GLN 41 HE22 GLN 41 -7.395 2.938 -9.585 49 H GLY 42 HN GLY 42 -14.096 2.682 -11.892 50 HA2 GLY 42 HA2 GLY 42 -14.399 0.228 -13.307 51 HA3 GLY 42 HA1 GLY 42 -15.617 1.001 -12.292 52 H LEU 43 HN LEU 43 -15.733 3.463 -13.677 53 HA LEU 43 HA LEU 43 -17.697 2.898 -15.599 54 HB2 LEU 43 HB2 LEU 43 -17.575 5.039 -14.376 55 HB3 LEU 43 HB1 LEU 43 -16.090 5.435 -15.239 56 HG LEU 43 HG LEU 43 -17.271 5.323 -17.383 57 HD11 LEU 43 HD11 LEU 43 -19.727 4.787 -15.690 58 HD12 LEU 43 HD12 LEU 43 -18.919 3.607 -16.727 59 HD13 LEU 43 HD13 LEU 43 -19.706 5.017 -17.438 60 HD21 LEU 43 HD21 LEU 43 -17.627 7.273 -15.372 61 HD22 LEU 43 HD22 LEU 43 -19.217 7.048 -16.101 62 HD23 LEU 43 HD23 LEU 43 -17.840 7.493 -17.108 63 H ARG 44 HN ARG 44 -14.287 3.763 -15.948 64 HA ARG 44 HA ARG 44 -14.227 4.015 -18.745 65 HB2 ARG 44 HB2 ARG 44 -12.387 4.714 -17.244 66 HB3 ARG 44 HB1 ARG 44 -12.043 3.020 -16.900 67 HG2 ARG 44 HG2 ARG 44 -11.534 2.598 -19.248 68 HG3 ARG 44 HG1 ARG 44 -11.984 4.251 -19.672 69 HD2 ARG 44 HD2 ARG 44 -9.559 4.104 -19.500 70 HD3 ARG 44 HD1 ARG 44 -10.174 5.089 -18.177 71 HE ARG 44 HE ARG 44 -9.964 2.367 -17.368 72 HH11 ARG 44 HH11 ARG 44 -8.110 5.194 -18.111 73 HH12 ARG 44 HH12 ARG 44 -6.795 4.776 -17.064 74 HH21 ARG 44 HH21 ARG 44 -8.242 1.812 -15.994 75 HH22 ARG 44 HH22 ARG 44 -6.869 2.861 -15.865 76 H GLU 45 HN GLU 45 -13.778 1.205 -16.637 77 HA GLU 45 HA GLU 45 -13.115 -0.627 -18.692 78 HB2 GLU 45 HB2 GLU 45 -14.304 -1.040 -15.944 79 HB3 GLU 45 HB1 GLU 45 -13.809 -2.360 -17.003 80 HG2 GLU 45 HG2 GLU 45 -11.520 -1.504 -17.060 81 HG3 GLU 45 HG1 GLU 45 -11.993 -0.115 -16.080 82 H ARG 46 HN ARG 46 -16.209 0.309 -17.224 83 HA ARG 46 HA ARG 46 -17.764 -1.637 -18.596 84 HB2 ARG 46 HB2 ARG 46 -18.480 0.985 -17.273 85 HB3 ARG 46 HB1 ARG 46 -19.678 -0.117 -17.949 86 HG2 ARG 46 HG2 ARG 46 -17.649 -0.884 -15.826 87 HG3 ARG 46 HG1 ARG 46 -19.330 -0.444 -15.498 88 HD2 ARG 46 HD2 ARG 46 -20.075 -2.295 -16.980 89 HD3 ARG 46 HD1 ARG 46 -18.395 -2.763 -17.214 90 HE ARG 46 HE ARG 46 -19.037 -2.654 -14.434 91 HH11 ARG 46 HH11 ARG 46 -19.469 -4.494 -17.333 92 HH12 ARG 46 HH12 ARG 46 -19.655 -6.008 -16.511 93 HH21 ARG 46 HH21 ARG 46 -19.281 -4.638 -13.347 94 HH22 ARG 46 HH22 ARG 46 -19.549 -6.089 -14.256 95 H ILE 47 HN ILE 47 -16.983 1.758 -19.216 96 HA ILE 47 HA ILE 47 -18.596 2.013 -21.523 97 HB ILE 47 HB ILE 47 -16.147 3.545 -20.648 98 HG12 ILE 47 HG12 ILE 47 -18.157 3.590 -19.172 99 HG13 ILE 47 HG11 ILE 47 -17.782 5.168 -19.867 100 HG21 ILE 47 HG21 ILE 47 -18.215 4.182 -22.771 101 HG22 ILE 47 HG22 ILE 47 -16.538 3.744 -23.084 102 HG23 ILE 47 HG23 ILE 47 -16.916 5.252 -22.252 103 HD11 ILE 47 HD1 ILE 47 -20.225 3.753 -20.029 104 HD12 ILE 47 HD2 ILE 47 -19.523 3.700 -21.647 105 HD13 ILE 47 HD3 ILE 47 -19.806 5.252 -20.856 106 H GLU 48 HN GLU 48 -15.192 1.221 -21.034 107 HA GLU 48 HA GLU 48 -14.439 1.094 -23.744 108 HB2 GLU 48 HB2 GLU 48 -12.819 1.175 -21.883 109 HB3 GLU 48 HB1 GLU 48 -13.313 -0.444 -21.383 110 HG2 GLU 48 HG2 GLU 48 -12.601 -1.329 -23.592 111 HG3 GLU 48 HG1 GLU 48 -12.112 0.293 -24.077 112 H SER 49 HN SER 49 -15.714 -1.330 -21.514 113 HA SER 49 HA SER 49 -15.620 -3.433 -23.482 114 HB2 SER 49 HB2 SER 49 -16.922 -3.260 -20.756 115 HB3 SER 49 HB1 SER 49 -16.935 -4.704 -21.764 116 HG SER 49 HG SER 49 -15.142 -4.230 -20.091 117 H ALA 50 HN ALA 50 -17.789 -0.869 -22.645 118 HA ALA 50 HA ALA 50 -20.055 -2.232 -23.935 119 HB1 ALA 50 HB1 ALA 50 -20.353 -0.930 -21.808 120 HB2 ALA 50 HB2 ALA 50 -21.397 -0.407 -23.131 121 HB3 ALA 50 HB3 ALA 50 -19.961 0.531 -22.716 122 H ILE 51 HN ILE 51 -17.435 -0.478 -24.864 123 HA ILE 51 HA ILE 51 -18.577 0.107 -27.453 124 HB ILE 51 HB ILE 51 -19.178 2.105 -26.054 125 HG12 ILE 51 HG12 ILE 51 -17.117 2.689 -28.199 126 HG13 ILE 51 HG11 ILE 51 -18.772 2.170 -28.545 127 HG21 ILE 51 HG21 ILE 51 -16.371 1.849 -25.367 128 HG22 ILE 51 HG22 ILE 51 -17.611 2.858 -24.622 129 HG23 ILE 51 HG23 ILE 51 -16.713 3.452 -26.017 130 HD11 ILE 51 HD1 ILE 51 -17.779 4.774 -27.537 131 HD12 ILE 51 HD2 ILE 51 -19.265 4.180 -26.800 132 HD13 ILE 51 HD3 ILE 51 -19.180 4.417 -28.547 133 HA PRO 52 HA PRO 52 -14.457 -0.899 -28.668 134 HB2 PRO 52 HB2 PRO 52 -14.862 1.025 -30.902 135 HB3 PRO 52 HB1 PRO 52 -14.486 -0.709 -30.960 136 HG2 PRO 52 HG2 PRO 52 -16.904 0.182 -31.584 137 HG3 PRO 52 HG1 PRO 52 -16.688 -1.332 -30.685 138 HD2 PRO 52 HD2 PRO 52 -17.508 1.369 -29.653 139 HD3 PRO 52 HD1 PRO 52 -18.120 -0.243 -29.206 140 H GLN 53 HN GLN 53 -12.362 -0.070 -28.567 141 HA GLN 53 HA GLN 53 -11.921 2.255 -27.054 142 HB2 GLN 53 HB2 GLN 53 -9.562 1.894 -27.503 143 HB3 GLN 53 HB1 GLN 53 -10.343 0.330 -27.236 144 HG2 GLN 53 HG2 GLN 53 -10.527 0.010 -29.679 145 HG3 GLN 53 HG1 GLN 53 -9.748 1.567 -29.944 146 HE21 GLN 53 HE21 GLN 53 -8.078 0.174 -31.133 147 HE22 GLN 53 HE22 GLN 53 -6.853 -0.552 -30.210 148 H VAL 54 HN VAL 54 -12.378 1.799 -30.438 149 HA VAL 54 HA VAL 54 -11.015 4.030 -31.480 150 HB VAL 54 HB VAL 54 -11.976 2.204 -32.864 151 HG11 VAL 54 HG11 VAL 54 -14.159 1.665 -32.744 152 HG12 VAL 54 HG12 VAL 54 -14.639 3.333 -33.054 153 HG13 VAL 54 HG13 VAL 54 -14.301 2.806 -31.406 154 HG21 VAL 54 HG21 VAL 54 -13.265 4.005 -34.421 155 HG22 VAL 54 HG22 VAL 54 -11.509 3.945 -34.283 156 HG23 VAL 54 HG23 VAL 54 -12.429 5.105 -33.325 157 H TYR 55 HN TYR 55 -13.799 3.788 -29.533 158 HA TYR 55 HA TYR 55 -14.962 6.311 -30.331 159 HB2 TYR 55 HB2 TYR 55 -15.583 4.304 -28.189 160 HB3 TYR 55 HB1 TYR 55 -16.395 5.870 -28.259 161 HD1 TYR 55 HD1 TYR 55 -15.677 2.781 -30.212 162 HD2 TYR 55 HD2 TYR 55 -18.137 6.281 -29.823 163 HE1 TYR 55 HE1 TYR 55 -17.198 1.906 -31.963 164 HE2 TYR 55 HE2 TYR 55 -19.658 5.407 -31.577 165 HH TYR 55 HH TYR 55 -20.023 2.553 -32.439 166 H HIS 56 HN HIS 56 -12.183 5.862 -28.976 167 HA HIS 56 HA HIS 56 -10.931 6.780 -27.232 168 HB2 HIS 56 HB2 HIS 56 -12.338 9.186 -28.418 169 HB3 HIS 56 HB1 HIS 56 -10.848 9.230 -27.473 170 HD2 HIS 56 HD2 HIS 56 -8.525 8.399 -28.873 171 HE1 HIS 56 HE1 HIS 56 -10.441 7.672 -32.565 172 HE2 HIS 56 HE2 HIS 56 -8.189 7.847 -31.404 173 H ILE 57 HN ILE 57 -11.554 6.244 -25.187 174 HA ILE 57 HA ILE 57 -13.890 7.656 -24.057 175 HB ILE 57 HB ILE 57 -12.430 5.180 -23.113 176 HG12 ILE 57 HG12 ILE 57 -15.208 5.424 -24.299 177 HG13 ILE 57 HG11 ILE 57 -13.787 4.995 -25.252 178 HG21 ILE 57 HG21 ILE 57 -15.113 5.646 -22.085 179 HG22 ILE 57 HG22 ILE 57 -14.014 6.956 -21.653 180 HG23 ILE 57 HG23 ILE 57 -13.625 5.293 -21.209 181 HD11 ILE 57 HD1 ILE 57 -15.205 3.054 -24.295 182 HD12 ILE 57 HD2 ILE 57 -14.496 3.482 -22.738 183 HD13 ILE 57 HD3 ILE 57 -13.458 2.971 -24.069 184 H ILE 58 HN ILE 58 -13.452 9.348 -22.808 185 HA ILE 58 HA ILE 58 -11.066 9.246 -21.074 186 HB ILE 58 HB ILE 58 -12.053 11.643 -22.644 187 HG12 ILE 58 HG12 ILE 58 -9.417 10.155 -22.798 188 HG13 ILE 58 HG11 ILE 58 -10.765 9.856 -23.894 189 HG21 ILE 58 HG21 ILE 58 -10.759 12.959 -21.325 190 HG22 ILE 58 HG22 ILE 58 -9.457 11.770 -21.276 191 HG23 ILE 58 HG23 ILE 58 -10.822 11.629 -20.169 192 HD11 ILE 58 HD1 ILE 58 -9.071 11.477 -24.800 193 HD12 ILE 58 HD2 ILE 58 -9.492 12.575 -23.486 194 HD13 ILE 58 HD3 ILE 58 -10.701 12.141 -24.694 195 H VAL 59 HN VAL 59 -11.623 9.441 -18.987 196 HA VAL 59 HA VAL 59 -14.126 10.892 -18.358 197 HB VAL 59 HB VAL 59 -12.916 8.529 -16.907 198 HG11 VAL 59 HG11 VAL 59 -15.067 8.635 -15.620 199 HG12 VAL 59 HG12 VAL 59 -15.413 10.175 -16.407 200 HG13 VAL 59 HG13 VAL 59 -14.014 10.022 -15.343 201 HG21 VAL 59 HG21 VAL 59 -13.984 7.411 -18.575 202 HG22 VAL 59 HG22 VAL 59 -14.918 8.829 -19.055 203 HG23 VAL 59 HG23 VAL 59 -15.452 7.839 -17.697 204 H THR 60 HN THR 60 -13.924 12.601 -17.037 205 HA THR 60 HA THR 60 -11.456 12.822 -15.418 206 HB THR 60 HB THR 60 -12.927 15.049 -16.852 207 HG1 THR 60 HG1 THR 60 -11.068 15.095 -18.108 208 HG21 THR 60 HG21 THR 60 -11.414 16.551 -15.881 209 HG22 THR 60 HG22 THR 60 -10.269 15.275 -15.463 210 HG23 THR 60 HG23 THR 60 -11.764 15.454 -14.546 211 H ASP 61 HN ASP 61 -11.767 13.167 -13.292 212 HA ASP 61 HA ASP 61 -14.501 13.443 -12.319 213 HB2 ASP 61 HB2 ASP 61 -12.956 11.836 -11.258 214 HB3 ASP 61 HB1 ASP 61 -11.890 13.170 -10.811 215 H LEU 62 HN LEU 62 -15.296 15.456 -12.364 216 HA LEU 62 HA LEU 62 -13.727 17.579 -11.054 217 HB2 LEU 62 HB2 LEU 62 -15.165 17.767 -13.698 218 HB3 LEU 62 HB1 LEU 62 -14.653 19.175 -12.784 219 HG LEU 62 HG LEU 62 -12.787 16.942 -13.623 220 HD11 LEU 62 HD11 LEU 62 -13.593 18.013 -15.633 221 HD12 LEU 62 HD12 LEU 62 -11.978 18.641 -15.305 222 HD13 LEU 62 HD13 LEU 62 -13.398 19.613 -14.918 223 HD21 LEU 62 HD21 LEU 62 -11.836 18.100 -11.786 224 HD22 LEU 62 HD22 LEU 62 -12.455 19.657 -12.339 225 HD23 LEU 62 HD23 LEU 62 -11.124 18.882 -13.197 226 H SER 63 HN SER 63 -14.913 19.047 -9.858 227 HA SER 63 HA SER 63 -16.708 19.919 -8.708 228 HB2 SER 63 HB2 SER 63 -17.746 20.057 -10.989 229 HB3 SER 63 HB1 SER 63 -18.432 18.457 -10.719 230 HG SER 63 HG SER 63 -18.794 20.655 -8.961 231 H TYR 64 HN TYR 64 -19.008 18.996 -7.794 232 HA TYR 64 HA TYR 64 -19.603 17.693 -5.941 233 HB2 TYR 64 HB2 TYR 64 -19.456 15.751 -8.258 234 HB3 TYR 64 HB1 TYR 64 -20.298 15.434 -6.738 235 HD1 TYR 64 HD1 TYR 64 -20.294 17.409 -9.846 236 HD2 TYR 64 HD2 TYR 64 -22.332 16.652 -6.142 237 HE1 TYR 64 HE1 TYR 64 -22.279 18.635 -10.688 238 HE2 TYR 64 HE2 TYR 64 -24.317 17.878 -6.983 239 HH TYR 64 HH TYR 64 -24.994 19.386 -8.602 240 H GLY 65 HN GLY 65 -18.289 14.807 -7.196 241 HA2 GLY 65 HA2 GLY 65 -15.706 14.824 -6.047 242 HA3 GLY 65 HA1 GLY 65 -16.851 14.159 -4.882 243 H CYS 66 HN CYS 66 -15.311 12.264 -5.287 244 HA CYS 66 HA CYS 66 -15.515 10.842 -7.759 245 HB2 CYS 66 HB2 CYS 66 -14.298 9.096 -6.661 246 HB3 CYS 66 HB1 CYS 66 -13.633 10.626 -6.088 247 HG CYS 66 HG CYS 66 -15.842 9.320 -4.343 248 H GLY 67 HN GLY 67 -16.697 8.982 -8.232 249 HA2 GLY 67 HA2 GLY 67 -18.272 7.282 -7.865 250 HA3 GLY 67 HA1 GLY 67 -18.694 8.027 -6.326 251 H GLN 68 HN GLN 68 -18.700 10.653 -8.049 252 HA GLN 68 HA GLN 68 -21.146 10.305 -9.591 253 HB2 GLN 68 HB2 GLN 68 -21.055 12.020 -7.102 254 HB3 GLN 68 HB1 GLN 68 -22.344 12.068 -8.305 255 HG2 GLN 68 HG2 GLN 68 -21.510 9.579 -6.790 256 HG3 GLN 68 HG1 GLN 68 -22.885 10.593 -6.357 257 HE21 GLN 68 HE21 GLN 68 -24.332 11.052 -8.508 258 HE22 GLN 68 HE22 GLN 68 -24.706 9.650 -9.389 259 H SER 69 HN SER 69 -21.669 12.164 -10.880 260 HA SER 69 HA SER 69 -21.160 13.975 -12.198 261 HB2 SER 69 HB2 SER 69 -19.209 14.889 -10.110 262 HB3 SER 69 HB1 SER 69 -20.228 15.854 -11.175 263 HG SER 69 HG SER 69 -20.942 14.336 -8.901 264 H PHE 70 HN PHE 70 -20.132 12.534 -13.705 265 HA PHE 70 HA PHE 70 -17.253 13.072 -13.866 266 HB2 PHE 70 HB2 PHE 70 -18.572 10.384 -14.276 267 HB3 PHE 70 HB1 PHE 70 -16.923 10.750 -14.787 268 HD1 PHE 70 HD1 PHE 70 -19.093 9.952 -11.968 269 HD2 PHE 70 HD2 PHE 70 -15.213 11.407 -13.097 270 HE1 PHE 70 HE1 PHE 70 -18.246 9.475 -9.685 271 HE2 PHE 70 HE2 PHE 70 -14.371 10.933 -10.818 272 HZ PHE 70 HZ PHE 70 -15.884 9.964 -9.118 273 H ASP 71 HN ASP 71 -16.778 14.099 -15.649 274 HA ASP 71 HA ASP 71 -18.628 14.008 -17.907 275 HB2 ASP 71 HB2 ASP 71 -17.822 16.207 -17.160 276 HB3 ASP 71 HB1 ASP 71 -16.157 15.713 -17.488 277 H ILE 72 HN ILE 72 -18.358 12.564 -19.457 278 HA ILE 72 HA ILE 72 -15.607 11.616 -20.027 279 HB ILE 72 HB ILE 72 -16.626 9.521 -20.806 280 HG12 ILE 72 HG12 ILE 72 -19.244 10.723 -19.855 281 HG13 ILE 72 HG11 ILE 72 -18.765 10.621 -21.554 282 HG21 ILE 72 HG21 ILE 72 -16.160 10.086 -18.279 283 HG22 ILE 72 HG22 ILE 72 -17.059 8.625 -18.688 284 HG23 ILE 72 HG23 ILE 72 -17.919 10.065 -18.146 285 HD11 ILE 72 HD1 ILE 72 -18.623 8.120 -19.929 286 HD12 ILE 72 HD2 ILE 72 -19.028 8.331 -21.632 287 HD13 ILE 72 HD3 ILE 72 -20.222 8.703 -20.390 288 H VAL 73 HN VAL 73 -14.964 11.328 -22.137 289 HA VAL 73 HA VAL 73 -16.669 12.642 -24.156 290 HB VAL 73 HB VAL 73 -13.671 12.816 -23.789 291 HG11 VAL 73 HG11 VAL 73 -14.203 12.612 -26.152 292 HG12 VAL 73 HG12 VAL 73 -13.786 14.288 -25.796 293 HG13 VAL 73 HG13 VAL 73 -15.474 13.822 -25.999 294 HG21 VAL 73 HG21 VAL 73 -15.410 14.273 -22.456 295 HG22 VAL 73 HG22 VAL 73 -15.609 15.107 -23.996 296 HG23 VAL 73 HG23 VAL 73 -14.028 15.060 -23.218 297 H VAL 74 HN VAL 74 -17.059 11.510 -25.954 298 HA VAL 74 HA VAL 74 -15.381 9.134 -26.483 299 HB VAL 74 HB VAL 74 -17.470 8.295 -25.716 300 HG11 VAL 74 HG11 VAL 74 -18.499 10.672 -27.154 301 HG12 VAL 74 HG12 VAL 74 -19.105 9.891 -25.693 302 HG13 VAL 74 HG13 VAL 74 -19.506 9.229 -27.277 303 HG21 VAL 74 HG21 VAL 74 -16.548 7.839 -28.289 304 HG22 VAL 74 HG22 VAL 74 -18.255 8.197 -28.542 305 HG23 VAL 74 HG23 VAL 74 -17.779 6.883 -27.466 306 H VAL 75 HN VAL 75 -14.516 8.995 -28.466 307 HA VAL 75 HA VAL 75 -15.606 10.768 -30.565 308 HB VAL 75 HB VAL 75 -12.724 10.085 -29.978 309 HG11 VAL 75 HG11 VAL 75 -12.378 11.765 -31.901 310 HG12 VAL 75 HG12 VAL 75 -14.058 11.433 -32.321 311 HG13 VAL 75 HG13 VAL 75 -12.871 10.128 -32.334 312 HG21 VAL 75 HG21 VAL 75 -14.168 11.960 -28.745 313 HG22 VAL 75 HG22 VAL 75 -13.815 12.859 -30.220 314 HG23 VAL 75 HG23 VAL 75 -12.495 12.257 -29.216 315 H SER 76 HN SER 76 -16.425 9.664 -32.197 316 HA SER 76 HA SER 76 -14.994 7.425 -33.355 317 HB2 SER 76 HB2 SER 76 -16.776 5.807 -33.111 318 HB3 SER 76 HB1 SER 76 -16.290 6.371 -31.520 319 HG SER 76 HG SER 76 -18.117 7.509 -31.347 320 H ASP 77 HN ASP 77 -16.123 6.602 -35.315 321 HA ASP 77 HA ASP 77 -16.999 8.779 -36.931 322 HB2 ASP 77 HB2 ASP 77 -16.936 5.801 -37.383 323 HB3 ASP 77 HB1 ASP 77 -17.481 6.954 -38.597 324 H PHE 78 HN PHE 78 -18.609 6.750 -34.757 325 HA PHE 78 HA PHE 78 -21.125 6.402 -35.944 326 HB2 PHE 78 HB2 PHE 78 -20.350 5.338 -33.809 327 HB3 PHE 78 HB1 PHE 78 -20.578 6.897 -33.008 328 HD1 PHE 78 HD1 PHE 78 -22.281 4.088 -34.708 329 HD2 PHE 78 HD2 PHE 78 -22.807 7.782 -32.582 330 HE1 PHE 78 HE1 PHE 78 -24.699 3.598 -34.452 331 HE2 PHE 78 HE2 PHE 78 -25.223 7.288 -32.324 332 HZ PHE 78 HZ PHE 78 -26.169 5.196 -33.259 333 H PHE 79 HN PHE 79 -19.647 9.177 -34.402 334 HA PHE 79 HA PHE 79 -22.154 10.658 -34.312 335 HB2 PHE 79 HB2 PHE 79 -20.274 10.910 -32.618 336 HB3 PHE 79 HB1 PHE 79 -19.379 11.757 -33.865 337 HD1 PHE 79 HD1 PHE 79 -23.036 11.807 -33.118 338 HD2 PHE 79 HD2 PHE 79 -19.345 14.000 -33.169 339 HE1 PHE 79 HE1 PHE 79 -24.263 13.891 -32.570 340 HE2 PHE 79 HE2 PHE 79 -20.571 16.084 -32.619 341 HZ PHE 79 HZ PHE 79 -23.033 16.029 -32.317 342 H GLN 80 HN GLN 80 -20.136 9.812 -36.754 343 HA GLN 80 HA GLN 80 -20.141 12.393 -38.120 344 HB2 GLN 80 HB2 GLN 80 -18.191 10.839 -38.275 345 HB3 GLN 80 HB1 GLN 80 -19.225 9.685 -39.115 346 HG2 GLN 80 HG2 GLN 80 -17.960 10.998 -40.742 347 HG3 GLN 80 HG1 GLN 80 -19.675 11.390 -40.863 348 HE21 GLN 80 HE21 GLN 80 -19.790 13.603 -41.303 349 HE22 GLN 80 HE22 GLN 80 -18.917 14.798 -40.471 350 H GLY 81 HN GLY 81 -21.923 13.026 -39.158 351 HA2 GLY 81 HA2 GLY 81 -23.628 12.943 -40.739 352 HA3 GLY 81 HA1 GLY 81 -23.282 11.232 -40.983 353 H LYS 82 HN LYS 82 -23.519 11.801 -37.715 354 HA LYS 82 HA LYS 82 -26.405 11.164 -37.679 355 HB2 LYS 82 HB2 LYS 82 -24.206 9.963 -35.985 356 HB3 LYS 82 HB1 LYS 82 -25.926 9.738 -35.671 357 HG2 LYS 82 HG2 LYS 82 -26.197 8.771 -37.941 358 HG3 LYS 82 HG1 LYS 82 -24.464 8.957 -38.212 359 HD2 LYS 82 HD2 LYS 82 -23.988 7.464 -36.320 360 HD3 LYS 82 HD1 LYS 82 -25.712 7.300 -35.998 361 HE2 LYS 82 HE2 LYS 82 -24.935 5.371 -37.279 362 HE3 LYS 82 HE1 LYS 82 -26.015 6.346 -38.277 363 HZ1 LYS 82 HZ1 LYS 82 -23.783 7.491 -38.944 364 HZ2 LYS 82 HZ2 LYS 82 -24.271 6.047 -39.695 365 HZ3 LYS 82 HZ3 LYS 82 -23.107 6.014 -38.456 366 H SER 83 HN SER 83 -27.616 11.991 -36.012 367 HA SER 83 HA SER 83 -26.748 14.478 -34.917 368 HB2 SER 83 HB2 SER 83 -29.091 14.137 -35.481 369 HB3 SER 83 HB1 SER 83 -29.204 12.809 -34.328 370 HG SER 83 HG SER 83 -29.004 15.569 -33.899 371 H LYS 84 HN LYS 84 -26.535 15.043 -32.716 372 HA LYS 84 HA LYS 84 -24.950 13.313 -31.167 373 HB2 LYS 84 HB2 LYS 84 -24.932 15.783 -30.947 374 HB3 LYS 84 HB1 LYS 84 -26.534 15.709 -30.212 375 HG2 LYS 84 HG2 LYS 84 -25.656 14.323 -28.389 376 HG3 LYS 84 HG1 LYS 84 -24.058 14.328 -29.139 377 HD2 LYS 84 HD2 LYS 84 -23.970 16.791 -28.921 378 HD3 LYS 84 HD1 LYS 84 -25.551 16.771 -28.138 379 HE2 LYS 84 HE2 LYS 84 -23.092 15.326 -27.111 380 HE3 LYS 84 HE1 LYS 84 -23.695 16.860 -26.485 381 HZ1 LYS 84 HZ1 LYS 84 -24.622 15.283 -25.084 382 HZ2 LYS 84 HZ2 LYS 84 -24.942 14.190 -26.343 383 HZ3 LYS 84 HZ3 LYS 84 -25.878 15.598 -26.179 384 H LEU 85 HN LEU 85 -28.414 13.958 -31.145 385 HA LEU 85 HA LEU 85 -29.057 12.676 -28.728 386 HB2 LEU 85 HB2 LEU 85 -30.558 13.209 -31.279 387 HB3 LEU 85 HB1 LEU 85 -31.302 12.269 -29.986 388 HG LEU 85 HG LEU 85 -30.850 14.133 -28.405 389 HD11 LEU 85 HD11 LEU 85 -29.744 15.401 -30.918 390 HD12 LEU 85 HD12 LEU 85 -28.939 15.188 -29.363 391 HD13 LEU 85 HD13 LEU 85 -30.248 16.358 -29.525 392 HD21 LEU 85 HD21 LEU 85 -32.621 14.264 -30.748 393 HD22 LEU 85 HD22 LEU 85 -32.292 15.843 -30.035 394 HD23 LEU 85 HD23 LEU 85 -32.988 14.558 -29.048 395 H MET 86 HN MET 86 -28.717 11.408 -32.034 396 HA MET 86 HA MET 86 -29.535 8.758 -31.453 397 HB2 MET 86 HB2 MET 86 -27.770 9.901 -33.627 398 HB3 MET 86 HB1 MET 86 -28.237 8.201 -33.557 399 HG2 MET 86 HG2 MET 86 -30.185 10.525 -33.613 400 HG3 MET 86 HG1 MET 86 -29.760 9.531 -35.010 401 HE1 MET 86 HE1 MET 86 -33.205 9.455 -33.551 402 HE2 MET 86 HE2 MET 86 -33.014 8.308 -34.875 403 HE3 MET 86 HE3 MET 86 -32.169 9.853 -34.930 404 H ARG 87 HN ARG 87 -26.409 10.389 -31.376 405 HA ARG 87 HA ARG 87 -24.774 8.142 -30.907 406 HB2 ARG 87 HB2 ARG 87 -23.837 10.312 -31.517 407 HB3 ARG 87 HB1 ARG 87 -24.391 11.005 -29.995 408 HG2 ARG 87 HG2 ARG 87 -22.071 10.433 -29.725 409 HG3 ARG 87 HG1 ARG 87 -23.004 9.246 -28.813 410 HD2 ARG 87 HD2 ARG 87 -22.892 7.723 -30.809 411 HD3 ARG 87 HD1 ARG 87 -21.818 8.894 -31.577 412 HE ARG 87 HE ARG 87 -20.107 8.225 -30.134 413 HH11 ARG 87 HH11 ARG 87 -23.179 6.944 -29.198 414 HH12 ARG 87 HH12 ARG 87 -22.524 5.846 -28.029 415 HH21 ARG 87 HH21 ARG 87 -19.236 6.767 -28.610 416 HH22 ARG 87 HH22 ARG 87 -20.295 5.750 -27.693 417 H SER 88 HN SER 88 -26.487 10.305 -28.691 418 HA SER 88 HA SER 88 -25.471 9.266 -26.287 419 HB2 SER 88 HB2 SER 88 -27.436 10.270 -25.234 420 HB3 SER 88 HB1 SER 88 -26.765 11.367 -26.439 421 HG SER 88 HG SER 88 -29.051 9.706 -26.610 422 H ARG 89 HN ARG 89 -28.128 8.191 -28.370 423 HA ARG 89 HA ARG 89 -29.225 6.312 -26.556 424 HB2 ARG 89 HB2 ARG 89 -29.223 6.463 -29.570 425 HB3 ARG 89 HB1 ARG 89 -30.108 5.231 -28.668 426 HG2 ARG 89 HG2 ARG 89 -31.382 6.960 -27.498 427 HG3 ARG 89 HG1 ARG 89 -30.449 8.221 -28.306 428 HD2 ARG 89 HD2 ARG 89 -32.575 7.915 -29.462 429 HD3 ARG 89 HD1 ARG 89 -31.250 7.383 -30.493 430 HE ARG 89 HE ARG 89 -32.047 5.202 -30.327 431 HH11 ARG 89 HH11 ARG 89 -33.584 7.306 -28.048 432 HH12 ARG 89 HH12 ARG 89 -34.789 6.149 -27.587 433 HH21 ARG 89 HH21 ARG 89 -33.620 3.684 -29.728 434 HH22 ARG 89 HH22 ARG 89 -34.808 4.098 -28.538 435 H ALA 90 HN ALA 90 -26.715 6.032 -29.065 436 HA ALA 90 HA ALA 90 -26.331 3.244 -28.800 437 HB1 ALA 90 HB1 ALA 90 -24.278 5.317 -29.609 438 HB2 ALA 90 HB2 ALA 90 -25.496 4.650 -30.695 439 HB3 ALA 90 HB3 ALA 90 -24.261 3.598 -30.006 440 H VAL 91 HN VAL 91 -24.709 6.020 -27.293 441 HA VAL 91 HA VAL 91 -22.941 4.404 -25.725 442 HB VAL 91 HB VAL 91 -22.698 6.903 -26.455 443 HG11 VAL 91 HG11 VAL 91 -24.801 7.687 -25.468 444 HG12 VAL 91 HG12 VAL 91 -23.434 8.468 -24.672 445 HG13 VAL 91 HG13 VAL 91 -24.277 7.144 -23.874 446 HG21 VAL 91 HG21 VAL 91 -21.058 5.687 -25.086 447 HG22 VAL 91 HG22 VAL 91 -22.047 5.933 -23.646 448 HG23 VAL 91 HG23 VAL 91 -21.284 7.313 -24.438 449 H ASN 92 HN ASN 92 -25.904 6.218 -25.044 450 HA ASN 92 HA ASN 92 -26.092 5.576 -22.301 451 HB2 ASN 92 HB2 ASN 92 -27.346 7.429 -23.328 452 HB3 ASN 92 HB1 ASN 92 -28.308 6.268 -24.247 453 HD21 ASN 92 HD21 ASN 92 -29.678 7.966 -22.502 454 HD22 ASN 92 HD22 ASN 92 -30.219 7.091 -21.152 455 H LYS 93 HN LYS 93 -27.468 4.054 -25.189 456 HA LYS 93 HA LYS 93 -28.988 2.096 -23.832 457 HB2 LYS 93 HB2 LYS 93 -27.812 2.181 -26.618 458 HB3 LYS 93 HB1 LYS 93 -28.850 0.874 -26.053 459 HG2 LYS 93 HG2 LYS 93 -29.643 3.794 -25.964 460 HG3 LYS 93 HG1 LYS 93 -30.062 2.707 -27.289 461 HD2 LYS 93 HD2 LYS 93 -31.179 1.197 -25.663 462 HD3 LYS 93 HD1 LYS 93 -30.820 2.350 -24.376 463 HE2 LYS 93 HE2 LYS 93 -32.408 3.028 -26.866 464 HE3 LYS 93 HE1 LYS 93 -33.133 2.602 -25.316 465 HZ1 LYS 93 HZ1 LYS 93 -31.183 4.810 -25.642 466 HZ2 LYS 93 HZ2 LYS 93 -32.164 4.480 -24.294 467 HZ3 LYS 93 HZ3 LYS 93 -32.862 5.037 -25.740 468 H ALA 94 HN ALA 94 -25.652 2.134 -25.018 469 HA ALA 94 HA ALA 94 -25.048 -0.572 -24.489 470 HB1 ALA 94 HB1 ALA 94 -23.702 1.623 -25.534 471 HB2 ALA 94 HB2 ALA 94 -23.039 0.005 -25.310 472 HB3 ALA 94 HB3 ALA 94 -22.805 1.233 -24.067 473 H VAL 95 HN VAL 95 -24.827 2.338 -22.485 474 HA VAL 95 HA VAL 95 -24.671 0.638 -20.095 475 HB VAL 95 HB VAL 95 -22.990 2.649 -19.361 476 HG11 VAL 95 HG11 VAL 95 -21.594 0.892 -19.005 477 HG12 VAL 95 HG12 VAL 95 -21.584 0.452 -20.714 478 HG13 VAL 95 HG13 VAL 95 -22.894 -0.097 -19.671 479 HG21 VAL 95 HG21 VAL 95 -21.827 1.952 -22.003 480 HG22 VAL 95 HG22 VAL 95 -21.711 3.451 -21.084 481 HG23 VAL 95 HG23 VAL 95 -23.158 3.109 -22.029 482 H LYS 96 HN LYS 96 -26.990 1.642 -20.631 483 HA LYS 96 HA LYS 96 -27.476 4.344 -19.930 484 HB2 LYS 96 HB2 LYS 96 -29.793 3.737 -19.862 485 HB3 LYS 96 HB1 LYS 96 -29.053 2.810 -21.167 486 HG2 LYS 96 HG2 LYS 96 -28.847 0.858 -19.702 487 HG3 LYS 96 HG1 LYS 96 -29.520 1.779 -18.356 488 HD2 LYS 96 HD2 LYS 96 -31.303 0.448 -19.319 489 HD3 LYS 96 HD1 LYS 96 -31.597 2.138 -19.725 490 HE2 LYS 96 HE2 LYS 96 -30.620 1.810 -21.943 491 HE3 LYS 96 HE1 LYS 96 -30.224 0.139 -21.545 492 HZ1 LYS 96 HZ1 LYS 96 -32.228 -0.409 -22.268 493 HZ2 LYS 96 HZ2 LYS 96 -32.670 1.218 -22.473 494 HZ3 LYS 96 HZ3 LYS 96 -32.907 0.452 -20.974 495 H GLU 97 HN GLU 97 -27.017 1.443 -18.054 496 HA GLU 97 HA GLU 97 -28.234 2.263 -15.643 497 HB2 GLU 97 HB2 GLU 97 -25.936 0.373 -16.185 498 HB3 GLU 97 HB1 GLU 97 -26.673 0.582 -14.597 499 HG2 GLU 97 HG2 GLU 97 -28.859 -0.077 -15.509 500 HG3 GLU 97 HG1 GLU 97 -28.147 -0.254 -17.111 501 H GLU 98 HN GLU 98 -24.948 2.715 -16.903 502 HA GLU 98 HA GLU 98 -23.864 3.901 -14.565 503 HB2 GLU 98 HB2 GLU 98 -23.073 4.073 -17.478 504 HB3 GLU 98 HB1 GLU 98 -22.137 4.806 -16.174 505 HG2 GLU 98 HG2 GLU 98 -21.108 2.724 -16.376 506 HG3 GLU 98 HG1 GLU 98 -22.277 2.420 -15.093 507 H LEU 99 HN LEU 99 -25.457 5.235 -17.429 508 HA LEU 99 HA LEU 99 -25.026 7.966 -16.834 509 HB2 LEU 99 HB2 LEU 99 -27.168 6.579 -18.450 510 HB3 LEU 99 HB1 LEU 99 -27.009 8.333 -18.348 511 HG LEU 99 HG LEU 99 -24.767 6.492 -19.219 512 HD11 LEU 99 HD11 LEU 99 -26.525 8.236 -20.963 513 HD12 LEU 99 HD12 LEU 99 -26.778 6.503 -20.758 514 HD13 LEU 99 HD13 LEU 99 -25.287 7.096 -21.491 515 HD21 LEU 99 HD21 LEU 99 -23.601 8.393 -18.778 516 HD22 LEU 99 HD22 LEU 99 -25.063 9.375 -18.693 517 HD23 LEU 99 HD23 LEU 99 -24.338 9.007 -20.258 518 H GLN 100 HN GLN 100 -27.602 5.713 -15.949 519 HA GLN 100 HA GLN 100 -29.341 7.602 -14.772 520 HB2 GLN 100 HB2 GLN 100 -28.943 4.650 -14.264 521 HB3 GLN 100 HB1 GLN 100 -30.239 5.600 -13.536 522 HG2 GLN 100 HG2 GLN 100 -31.073 6.213 -15.758 523 HG3 GLN 100 HG1 GLN 100 -29.749 5.328 -16.516 524 HE21 GLN 100 HE21 GLN 100 -31.968 4.293 -17.433 525 HE22 GLN 100 HE22 GLN 100 -32.484 2.909 -16.598 526 H GLU 101 HN GLU 101 -26.627 5.737 -13.484 527 HA GLU 101 HA GLU 101 -27.011 6.631 -10.776 528 HB2 GLU 101 HB2 GLU 101 -24.688 5.267 -12.154 529 HB3 GLU 101 HB1 GLU 101 -24.753 5.609 -10.424 530 HG2 GLU 101 HG2 GLU 101 -26.797 4.269 -10.213 531 HG3 GLU 101 HG1 GLU 101 -26.787 3.958 -11.949 532 H ILE 102 HN ILE 102 -25.626 7.998 -13.586 533 HA ILE 102 HA ILE 102 -24.333 10.080 -11.927 534 HB ILE 102 HB ILE 102 -22.646 8.639 -13.041 535 HG12 ILE 102 HG12 ILE 102 -22.781 11.377 -14.334 536 HG13 ILE 102 HG11 ILE 102 -22.341 11.136 -12.642 537 HG21 ILE 102 HG21 ILE 102 -24.419 8.508 -15.097 538 HG22 ILE 102 HG22 ILE 102 -22.700 8.159 -15.275 539 HG23 ILE 102 HG23 ILE 102 -23.326 9.751 -15.704 540 HD11 ILE 102 HD1 ILE 102 -20.522 11.152 -14.650 541 HD12 ILE 102 HD2 ILE 102 -20.909 9.433 -14.604 542 HD13 ILE 102 HD3 ILE 102 -20.303 10.239 -13.159 543 H HIS 103 HN HIS 103 -25.195 12.019 -12.235 544 HA HIS 103 HA HIS 103 -26.265 12.708 -14.890 545 HB2 HIS 103 HB2 HIS 103 -28.099 11.971 -13.293 546 HB3 HIS 103 HB1 HIS 103 -27.717 13.403 -12.335 547 HD2 HIS 103 HD2 HIS 103 -27.362 14.195 -16.058 548 HE1 HIS 103 HE1 HIS 103 -31.260 15.409 -14.983 549 HE2 HIS 103 HE2 HIS 103 -29.486 15.523 -16.796 550 H ALA 104 HN ALA 104 -24.554 13.568 -12.054 551 HA ALA 104 HA ALA 104 -24.751 16.371 -12.098 552 HB1 ALA 104 HB1 ALA 104 -22.454 16.214 -10.968 553 HB2 ALA 104 HB2 ALA 104 -22.652 14.466 -11.106 554 HB3 ALA 104 HB3 ALA 104 -23.808 15.412 -10.170 555 H PHE 105 HN PHE 105 -22.626 14.149 -13.777 556 HA PHE 105 HA PHE 105 -21.486 16.391 -15.289 557 HB2 PHE 105 HB2 PHE 105 -20.329 14.122 -14.114 558 HB3 PHE 105 HB1 PHE 105 -20.090 14.034 -15.852 559 HD1 PHE 105 HD1 PHE 105 -17.975 14.586 -13.598 560 HD2 PHE 105 HD2 PHE 105 -20.219 17.147 -16.218 561 HE1 PHE 105 HE1 PHE 105 -16.210 16.317 -13.423 562 HE2 PHE 105 HE2 PHE 105 -18.450 18.876 -16.039 563 HZ PHE 105 HZ PHE 105 -16.448 18.460 -14.643 564 H SER 106 HN SER 106 -20.968 15.924 -17.559 565 HA SER 106 HA SER 106 -23.100 14.291 -18.805 566 HB2 SER 106 HB2 SER 106 -21.873 16.857 -19.831 567 HB3 SER 106 HB1 SER 106 -23.063 15.887 -20.666 568 HG SER 106 HG SER 106 -23.587 17.783 -19.014 569 H CYS 107 HN CYS 107 -22.625 13.156 -20.685 570 HA CYS 107 HA CYS 107 -19.761 12.611 -21.075 571 HB2 CYS 107 HB2 CYS 107 -20.691 10.606 -22.372 572 HB3 CYS 107 HB1 CYS 107 -20.958 10.606 -20.627 573 HG CYS 107 HG CYS 107 -23.295 10.158 -21.539 574 H LYS 108 HN LYS 108 -19.267 14.416 -22.367 575 HA LYS 108 HA LYS 108 -20.738 15.161 -24.666 576 HB2 LYS 108 HB2 LYS 108 -17.852 15.628 -23.891 577 HB3 LYS 108 HB1 LYS 108 -18.627 16.371 -25.292 578 HG2 LYS 108 HG2 LYS 108 -20.310 17.406 -23.837 579 HG3 LYS 108 HG1 LYS 108 -19.578 16.640 -22.427 580 HD2 LYS 108 HD2 LYS 108 -17.465 17.849 -22.877 581 HD3 LYS 108 HD1 LYS 108 -18.224 18.640 -24.261 582 HE2 LYS 108 HE2 LYS 108 -19.240 18.830 -21.412 583 HE3 LYS 108 HE1 LYS 108 -18.250 20.058 -22.201 584 HZ1 LYS 108 HZ1 LYS 108 -20.891 20.098 -22.244 585 HZ2 LYS 108 HZ2 LYS 108 -20.618 19.168 -23.639 586 HZ3 LYS 108 HZ3 LYS 108 -19.946 20.723 -23.507 587 H CYS 109 HN CYS 109 -20.508 14.580 -26.829 588 HA CYS 109 HA CYS 109 -18.449 12.575 -27.495 589 HB2 CYS 109 HB2 CYS 109 -20.582 11.394 -26.974 590 HB3 CYS 109 HB1 CYS 109 -21.366 12.316 -28.263 591 HG CYS 109 HG CYS 109 -18.905 10.501 -28.919 592 H TYR 110 HN TYR 110 -17.382 13.137 -29.302 593 HA TYR 110 HA TYR 110 -18.817 14.489 -31.454 594 HB2 TYR 110 HB2 TYR 110 -17.153 16.272 -31.631 595 HB3 TYR 110 HB1 TYR 110 -17.935 16.310 -30.049 596 HD1 TYR 110 HD1 TYR 110 -14.831 15.544 -31.876 597 HD2 TYR 110 HD2 TYR 110 -16.736 15.628 -28.026 598 HE1 TYR 110 HE1 TYR 110 -12.622 15.297 -30.777 599 HE2 TYR 110 HE2 TYR 110 -14.525 15.382 -26.928 600 HH TYR 110 HH TYR 110 -12.206 14.361 -27.678 601 H THR 111 HN THR 111 -17.517 14.611 -33.461 602 HA THR 111 HA THR 111 -15.084 13.087 -33.634 603 HB THR 111 HB THR 111 -17.673 11.837 -34.531 604 HG1 THR 111 HG1 THR 111 -17.059 11.162 -32.553 605 HG21 THR 111 HG21 THR 111 -16.579 11.215 -36.416 606 HG22 THR 111 HG22 THR 111 -15.666 10.140 -35.359 607 HG23 THR 111 HG23 THR 111 -15.015 11.725 -35.777 608 H GLU 112 HN GLU 112 -14.997 15.441 -34.443 609 HA GLU 112 HA GLU 112 -14.527 16.791 -36.253 610 HB2 GLU 112 HB2 GLU 112 -15.080 14.226 -37.771 611 HB3 GLU 112 HB1 GLU 112 -14.512 15.712 -38.530 612 HG2 GLU 112 HG2 GLU 112 -12.504 15.690 -37.126 613 HG3 GLU 112 HG1 GLU 112 -13.080 14.246 -36.297 614 H GLU 113 HN GLU 113 -17.477 15.225 -35.753 615 HA GLU 113 HA GLU 113 -19.061 16.158 -37.870 616 HB2 GLU 113 HB2 GLU 113 -19.767 14.440 -36.209 617 HB3 GLU 113 HB1 GLU 113 -19.877 15.719 -34.977 618 HG2 GLU 113 HG2 GLU 113 -21.560 16.886 -36.345 619 HG3 GLU 113 HG1 GLU 113 -21.427 15.656 -37.593 620 H GLU 114 HN GLU 114 -18.310 17.548 -34.709 621 HA GLU 114 HA GLU 114 -18.914 20.210 -35.767 622 HB2 GLU 114 HB2 GLU 114 -20.083 19.177 -33.170 623 HB3 GLU 114 HB1 GLU 114 -20.298 20.791 -33.853 624 HG2 GLU 114 HG2 GLU 114 -21.370 19.765 -35.853 625 HG3 GLU 114 HG1 GLU 114 -21.222 18.184 -35.080 626 H TRP 115 HN TRP 115 -16.574 18.512 -34.835 627 HA TRP 115 HA TRP 115 -14.716 18.691 -33.454 628 HB2 TRP 115 HB2 TRP 115 -13.840 21.037 -33.362 629 HB3 TRP 115 HB1 TRP 115 -14.289 20.487 -34.982 630 HD1 TRP 115 HD1 TRP 115 -15.458 22.816 -32.168 631 HE1 TRP 115 HE1 TRP 115 -17.209 24.452 -33.123 632 HE3 TRP 115 HE3 TRP 115 -16.018 20.866 -36.849 633 HZ2 TRP 115 HZ2 TRP 115 -18.655 24.875 -35.556 634 HZ3 TRP 115 HZ3 TRP 115 -17.581 21.902 -38.465 635 HH2 TRP 115 HH2 TRP 115 -18.899 23.903 -37.827 636 H SER 116 HN SER 116 -17.494 18.945 -32.192 637 HA SER 116 HA SER 116 -18.420 19.386 -30.137 638 HB2 SER 116 HB2 SER 116 -16.872 17.663 -29.465 639 HB3 SER 116 HB1 SER 116 -15.540 18.809 -29.410 640 HG SER 116 HG SER 116 -16.122 19.045 -27.402 641 H LYS 117 HN LYS 117 -17.465 20.608 -27.836 642 HA LYS 117 HA LYS 117 -17.693 23.360 -28.433 643 HB2 LYS 117 HB2 LYS 117 -18.314 22.384 -26.254 644 HB3 LYS 117 HB1 LYS 117 -16.611 22.056 -25.926 645 HG2 LYS 117 HG2 LYS 117 -16.100 24.452 -26.066 646 HG3 LYS 117 HG1 LYS 117 -17.786 24.803 -26.450 647 HD2 LYS 117 HD2 LYS 117 -18.480 23.872 -24.276 648 HD3 LYS 117 HD1 LYS 117 -16.797 23.512 -23.890 649 HE2 LYS 117 HE2 LYS 117 -17.456 25.623 -22.840 650 HE3 LYS 117 HE1 LYS 117 -16.257 25.927 -24.097 651 HZ1 LYS 117 HZ1 LYS 117 -17.724 27.373 -24.902 652 HZ2 LYS 117 HZ2 LYS 117 -18.990 26.775 -23.940 653 HZ3 LYS 117 HZ3 LYS 117 -18.624 26.033 -25.424 654 H ILE 118 HN ILE 118 -14.886 21.336 -27.659 655 HA ILE 118 HA ILE 118 -12.853 23.061 -27.313 656 HB ILE 118 HB ILE 118 -11.399 21.487 -28.557 657 HG12 ILE 118 HG12 ILE 118 -14.003 20.124 -29.319 658 HG13 ILE 118 HG11 ILE 118 -13.043 21.109 -30.426 659 HG21 ILE 118 HG21 ILE 118 -11.708 19.704 -27.068 660 HG22 ILE 118 HG22 ILE 118 -13.466 19.843 -27.113 661 HG23 ILE 118 HG23 ILE 118 -12.510 21.035 -26.233 662 HD11 ILE 118 HD1 ILE 118 -11.379 19.538 -30.606 663 HD12 ILE 118 HD2 ILE 118 -12.715 18.450 -30.229 664 HD13 ILE 118 HD3 ILE 118 -11.605 18.958 -28.956 665 H VAL 119 HN VAL 119 -12.161 24.837 -28.279 666 HA VAL 119 HA VAL 119 -13.148 25.735 -30.784 667 HB VAL 119 HB VAL 119 -12.349 27.229 -28.948 668 HG11 VAL 119 HG11 VAL 119 -9.915 27.585 -28.733 669 HG12 VAL 119 HG12 VAL 119 -9.622 26.291 -29.895 670 HG13 VAL 119 HG13 VAL 119 -10.347 25.923 -28.329 671 HG21 VAL 119 HG21 VAL 119 -11.031 27.486 -31.668 672 HG22 VAL 119 HG22 VAL 119 -11.119 28.793 -30.487 673 HG23 VAL 119 HG23 VAL 119 -12.598 28.136 -31.188 674 H VAL 120 HN VAL 120 -10.244 24.033 -29.788 675 HA VAL 120 HA VAL 120 -8.417 23.270 -30.982 676 HB VAL 120 HB VAL 120 -10.018 21.588 -31.606 677 HG11 VAL 120 HG11 VAL 120 -10.935 23.583 -33.699 678 HG12 VAL 120 HG12 VAL 120 -11.849 23.062 -32.284 679 HG13 VAL 120 HG13 VAL 120 -11.500 21.916 -33.579 680 HG21 VAL 120 HG21 VAL 120 -8.607 20.821 -33.190 681 HG22 VAL 120 HG22 VAL 120 -7.894 22.431 -33.278 682 HG23 VAL 120 HG23 VAL 120 -9.222 21.995 -34.354 683 H LEU 121 HN LEU 121 -8.424 25.951 -31.176 684 HA LEU 121 HA LEU 121 -8.225 27.792 -32.665 685 HB2 LEU 121 HB2 LEU 121 -5.955 27.369 -33.856 686 HB3 LEU 121 HB1 LEU 121 -5.995 27.372 -32.093 687 HG LEU 121 HG LEU 121 -6.487 24.779 -33.496 688 HD11 LEU 121 HD11 LEU 121 -3.769 24.735 -33.068 689 HD12 LEU 121 HD12 LEU 121 -4.016 26.369 -33.687 690 HD13 LEU 121 HD13 LEU 121 -4.534 24.977 -34.639 691 HD21 LEU 121 HD21 LEU 121 -6.367 24.136 -31.339 692 HD22 LEU 121 HD22 LEU 121 -5.893 25.761 -30.846 693 HD23 LEU 121 HD23 LEU 121 -4.664 24.596 -31.338 694 H GLU 122 HN GLU 122 -10.246 26.714 -33.865 695 HA GLU 122 HA GLU 122 -9.847 25.459 -36.359 696 HB2 GLU 122 HB2 GLU 122 -12.022 25.507 -35.196 697 HB3 GLU 122 HB1 GLU 122 -12.133 27.244 -35.489 698 HG2 GLU 122 HG2 GLU 122 -12.084 26.866 -37.909 699 HG3 GLU 122 HG1 GLU 122 -11.907 25.131 -37.652 700 H HIS 123 HN HIS 123 -10.154 28.875 -35.457 701 HA HIS 123 HA HIS 123 -9.937 29.806 -38.173 702 HB2 HIS 123 HB2 HIS 123 -9.789 31.210 -35.500 703 HB3 HIS 123 HB1 HIS 123 -9.655 32.050 -37.045 704 HD2 HIS 123 HD2 HIS 123 -12.091 32.485 -38.350 705 HE1 HIS 123 HE1 HIS 123 -14.515 30.269 -35.698 706 HE2 HIS 123 HE2 HIS 123 -14.534 31.835 -37.696 707 H HIS 124 HN HIS 124 -8.166 30.742 -39.176 708 HA HIS 124 HA HIS 124 -5.623 29.681 -38.559 709 HB2 HIS 124 HB2 HIS 124 -6.467 31.964 -40.355 710 HB3 HIS 124 HB1 HIS 124 -4.813 31.357 -40.265 711 HD2 HIS 124 HD2 HIS 124 -8.110 30.491 -42.043 712 HE1 HIS 124 HE1 HIS 124 -5.586 27.139 -42.513 713 HE2 HIS 124 HE2 HIS 124 -7.759 28.214 -43.271 714 H HIS 125 HN HIS 125 -7.102 32.837 -37.937 715 HA HIS 125 HA HIS 125 -5.211 33.296 -35.778 716 HB2 HIS 125 HB2 HIS 125 -4.111 34.184 -37.872 717 HB3 HIS 125 HB1 HIS 125 -5.436 35.343 -37.990 718 HD2 HIS 125 HD2 HIS 125 -2.145 34.860 -35.999 719 HE1 HIS 125 HE1 HIS 125 -4.122 38.201 -34.337 720 HE2 HIS 125 HE2 HIS 125 -1.948 36.887 -34.363 721 H HIS 126 HN HIS 126 -6.074 34.535 -34.175 722 HA HIS 126 HA HIS 126 -8.358 36.255 -34.699 723 HB2 HIS 126 HB2 HIS 126 -9.803 35.120 -33.050 724 HB3 HIS 126 HB1 HIS 126 -9.435 34.071 -34.418 725 HD2 HIS 126 HD2 HIS 126 -7.865 31.807 -33.794 726 HE1 HIS 126 HE1 HIS 126 -7.521 32.587 -29.659 727 HE2 HIS 126 HE2 HIS 126 -7.077 30.878 -31.485 728 H HIS 127 HN HIS 127 -8.895 37.601 -32.893 729 HA HIS 127 HA HIS 127 -6.579 38.149 -31.216 730 HB2 HIS 127 HB2 HIS 127 -7.782 40.189 -30.590 731 HB3 HIS 127 HB1 HIS 127 -7.720 40.012 -32.343 732 HD2 HIS 127 HD2 HIS 127 -10.215 39.803 -33.579 733 HE1 HIS 127 HE1 HIS 127 -12.535 39.610 -30.058 734 HE2 HIS 127 HE2 HIS 127 -12.631 39.790 -32.590 735 H HIS 128 HN HIS 128 -9.314 36.261 -30.987 736 HA HIS 128 HA HIS 128 -9.892 34.910 -29.158 737 HB2 HIS 128 HB2 HIS 128 -8.687 37.003 -27.345 738 HB3 HIS 128 HB1 HIS 128 -9.077 35.327 -26.962 739 HD2 HIS 128 HD2 HIS 128 -6.062 37.328 -28.155 740 HE1 HIS 128 HE1 HIS 128 -5.257 33.321 -29.213 741 HE2 HIS 128 HE2 HIS 128 -4.251 35.642 -28.990 Start of MODEL 7 1 H1 MET 36 HT1 MET 36 -28.805 9.233 -9.551 2 H2 MET 36 HT2 MET 36 -27.847 10.256 -8.589 3 H3 MET 36 HT3 MET 36 -29.447 9.910 -8.134 4 HA MET 36 HA MET 36 -28.336 8.498 -6.755 5 HB2 MET 36 HB2 MET 36 -29.003 7.169 -9.356 6 HB3 MET 36 HB1 MET 36 -28.211 6.224 -8.093 7 HG2 MET 36 HG2 MET 36 -29.985 6.853 -6.501 8 HG3 MET 36 HG1 MET 36 -30.777 7.807 -7.756 9 HE1 MET 36 HE1 MET 36 -33.215 4.869 -7.419 10 HE2 MET 36 HE2 MET 36 -32.907 6.593 -7.227 11 HE3 MET 36 HE3 MET 36 -32.212 5.448 -6.082 12 HA PRO 37 HA PRO 37 -23.945 8.659 -7.233 13 HB2 PRO 37 HB2 PRO 37 -23.944 6.336 -5.374 14 HB3 PRO 37 HB1 PRO 37 -23.168 7.924 -5.199 15 HG2 PRO 37 HG2 PRO 37 -25.325 7.287 -3.786 16 HG3 PRO 37 HG1 PRO 37 -25.090 8.926 -4.422 17 HD2 PRO 37 HD2 PRO 37 -26.887 6.750 -5.450 18 HD3 PRO 37 HD1 PRO 37 -27.176 8.504 -5.348 19 H VAL 38 HN VAL 38 -22.347 7.609 -8.409 20 HA VAL 38 HA VAL 38 -22.792 4.825 -9.214 21 HB VAL 38 HB VAL 38 -23.810 5.993 -11.029 22 HG11 VAL 38 HG11 VAL 38 -21.941 8.034 -10.290 23 HG12 VAL 38 HG12 VAL 38 -23.296 8.148 -11.411 24 HG13 VAL 38 HG13 VAL 38 -21.704 7.661 -11.997 25 HG21 VAL 38 HG21 VAL 38 -22.628 4.459 -12.232 26 HG22 VAL 38 HG22 VAL 38 -21.126 4.808 -11.379 27 HG23 VAL 38 HG23 VAL 38 -21.636 5.836 -12.719 28 H THR 39 HN THR 39 -20.951 3.670 -9.318 29 HA THR 39 HA THR 39 -18.511 4.821 -8.391 30 HB THR 39 HB THR 39 -18.937 2.120 -9.691 31 HG1 THR 39 HG1 THR 39 -19.593 1.440 -7.774 32 HG21 THR 39 HG21 THR 39 -16.600 2.625 -9.526 33 HG22 THR 39 HG22 THR 39 -16.978 1.564 -8.171 34 HG23 THR 39 HG23 THR 39 -16.798 3.301 -7.910 35 H GLU 40 HN GLU 40 -16.883 5.712 -9.501 36 HA GLU 40 HA GLU 40 -17.090 6.278 -12.262 37 HB2 GLU 40 HB2 GLU 40 -15.808 7.673 -10.683 38 HB3 GLU 40 HB1 GLU 40 -14.645 6.366 -10.489 39 HG2 GLU 40 HG2 GLU 40 -14.110 6.459 -12.884 40 HG3 GLU 40 HG1 GLU 40 -15.298 7.742 -13.105 41 H GLN 41 HN GLN 41 -15.168 3.892 -10.464 42 HA GLN 41 HA GLN 41 -13.753 2.857 -12.683 43 HB2 GLN 41 HB2 GLN 41 -13.098 2.438 -10.341 44 HB3 GLN 41 HB1 GLN 41 -14.546 1.456 -10.120 45 HG2 GLN 41 HG2 GLN 41 -13.792 -0.090 -11.870 46 HG3 GLN 41 HG1 GLN 41 -12.363 0.904 -12.149 47 HE21 GLN 41 HE21 GLN 41 -12.078 -1.816 -11.369 48 HE22 GLN 41 HE22 GLN 41 -11.449 -1.868 -9.794 49 H GLY 42 HN GLY 42 -16.810 1.895 -11.162 50 HA2 GLY 42 HA2 GLY 42 -17.302 -0.374 -12.775 51 HA3 GLY 42 HA1 GLY 42 -18.519 0.527 -11.870 52 H LEU 43 HN LEU 43 -18.010 3.054 -13.170 53 HA LEU 43 HA LEU 43 -19.806 2.874 -15.329 54 HB2 LEU 43 HB2 LEU 43 -19.430 4.951 -14.037 55 HB3 LEU 43 HB1 LEU 43 -17.808 5.062 -14.718 56 HG LEU 43 HG LEU 43 -18.732 5.212 -16.976 57 HD11 LEU 43 HD11 LEU 43 -20.729 3.818 -16.585 58 HD12 LEU 43 HD12 LEU 43 -21.161 5.363 -17.321 59 HD13 LEU 43 HD13 LEU 43 -21.423 5.104 -15.596 60 HD21 LEU 43 HD21 LEU 43 -18.557 7.240 -15.347 61 HD22 LEU 43 HD22 LEU 43 -20.318 7.152 -15.298 62 HD23 LEU 43 HD23 LEU 43 -19.493 7.448 -16.828 63 H ARG 44 HN ARG 44 -16.274 3.049 -15.241 64 HA ARG 44 HA ARG 44 -15.813 3.295 -17.998 65 HB2 ARG 44 HB2 ARG 44 -14.065 3.577 -16.263 66 HB3 ARG 44 HB1 ARG 44 -14.115 1.842 -15.952 67 HG2 ARG 44 HG2 ARG 44 -13.435 1.370 -18.250 68 HG3 ARG 44 HG1 ARG 44 -13.472 3.091 -18.639 69 HD2 ARG 44 HD2 ARG 44 -11.697 1.868 -16.510 70 HD3 ARG 44 HD1 ARG 44 -11.168 2.228 -18.151 71 HE ARG 44 HE ARG 44 -12.277 4.575 -17.121 72 HH11 ARG 44 HH11 ARG 44 -9.669 2.395 -16.471 73 HH12 ARG 44 HH12 ARG 44 -8.639 3.609 -15.792 74 HH21 ARG 44 HH21 ARG 44 -10.931 6.175 -16.230 75 HH22 ARG 44 HH22 ARG 44 -9.354 5.750 -15.655 76 H GLU 45 HN GLU 45 -16.234 0.419 -15.966 77 HA GLU 45 HA GLU 45 -15.724 -1.499 -17.983 78 HB2 GLU 45 HB2 GLU 45 -17.309 -1.645 -15.412 79 HB3 GLU 45 HB1 GLU 45 -17.005 -3.040 -16.448 80 HG2 GLU 45 HG2 GLU 45 -14.597 -2.751 -16.203 81 HG3 GLU 45 HG1 GLU 45 -14.842 -1.276 -15.264 82 H ARG 46 HN ARG 46 -18.686 0.096 -16.867 83 HA ARG 46 HA ARG 46 -20.481 -1.402 -18.479 84 HB2 ARG 46 HB2 ARG 46 -20.703 1.320 -17.188 85 HB3 ARG 46 HB1 ARG 46 -22.032 0.540 -18.048 86 HG2 ARG 46 HG2 ARG 46 -20.547 -0.709 -15.716 87 HG3 ARG 46 HG1 ARG 46 -22.091 0.141 -15.578 88 HD2 ARG 46 HD2 ARG 46 -21.593 -2.292 -17.316 89 HD3 ARG 46 HD1 ARG 46 -22.402 -2.314 -15.754 90 HE ARG 46 HE ARG 46 -23.503 -1.342 -18.266 91 HH11 ARG 46 HH11 ARG 46 -23.666 -1.422 -14.811 92 HH12 ARG 46 HH12 ARG 46 -25.346 -1.006 -14.742 93 HH21 ARG 46 HH21 ARG 46 -25.708 -0.797 -18.185 94 HH22 ARG 46 HH22 ARG 46 -26.501 -0.652 -16.652 95 H ILE 47 HN ILE 47 -18.765 1.663 -18.934 96 HA ILE 47 HA ILE 47 -19.949 2.356 -21.402 97 HB ILE 47 HB ILE 47 -17.276 3.071 -20.200 98 HG12 ILE 47 HG12 ILE 47 -19.318 3.835 -19.011 99 HG13 ILE 47 HG11 ILE 47 -18.397 5.181 -19.688 100 HG21 ILE 47 HG21 ILE 47 -17.421 4.975 -21.897 101 HG22 ILE 47 HG22 ILE 47 -18.669 4.028 -22.708 102 HG23 ILE 47 HG23 ILE 47 -17.033 3.387 -22.556 103 HD11 ILE 47 HD1 ILE 47 -20.206 5.827 -20.859 104 HD12 ILE 47 HD2 ILE 47 -21.125 4.479 -20.187 105 HD13 ILE 47 HD3 ILE 47 -20.219 4.269 -21.685 106 H GLU 48 HN GLU 48 -17.008 0.552 -20.581 107 HA GLU 48 HA GLU 48 -16.082 0.138 -23.218 108 HB2 GLU 48 HB2 GLU 48 -14.697 -0.254 -21.216 109 HB3 GLU 48 HB1 GLU 48 -15.726 -1.619 -20.766 110 HG2 GLU 48 HG2 GLU 48 -15.139 -2.746 -22.906 111 HG3 GLU 48 HG1 GLU 48 -14.138 -1.367 -23.358 112 H SER 49 HN SER 49 -18.284 -1.716 -21.146 113 HA SER 49 HA SER 49 -18.707 -3.713 -23.230 114 HB2 SER 49 HB2 SER 49 -20.091 -4.845 -21.604 115 HB3 SER 49 HB1 SER 49 -18.603 -4.336 -20.810 116 HG SER 49 HG SER 49 -20.096 -3.582 -19.463 117 H ALA 50 HN ALA 50 -19.969 -0.682 -22.324 118 HA ALA 50 HA ALA 50 -22.629 -1.244 -23.450 119 HB1 ALA 50 HB1 ALA 50 -23.093 1.117 -22.763 120 HB2 ALA 50 HB2 ALA 50 -21.452 1.210 -22.128 121 HB3 ALA 50 HB3 ALA 50 -22.606 0.078 -21.425 122 H ILE 51 HN ILE 51 -19.591 -0.259 -24.494 123 HA ILE 51 HA ILE 51 -20.760 0.849 -26.964 124 HB ILE 51 HB ILE 51 -19.896 2.693 -25.489 125 HG12 ILE 51 HG12 ILE 51 -18.252 2.306 -28.009 126 HG13 ILE 51 HG11 ILE 51 -19.962 2.755 -28.030 127 HG21 ILE 51 HG21 ILE 51 -17.802 0.909 -25.063 128 HG22 ILE 51 HG22 ILE 51 -17.818 2.611 -24.600 129 HG23 ILE 51 HG23 ILE 51 -17.101 2.121 -26.133 130 HD11 ILE 51 HD1 ILE 51 -19.563 4.869 -27.242 131 HD12 ILE 51 HD2 ILE 51 -17.995 4.591 -27.997 132 HD13 ILE 51 HD3 ILE 51 -18.191 4.358 -26.260 133 HA PRO 52 HA PRO 52 -18.531 -2.310 -29.060 134 HB2 PRO 52 HB2 PRO 52 -17.759 -0.099 -30.895 135 HB3 PRO 52 HB1 PRO 52 -18.515 -1.661 -31.265 136 HG2 PRO 52 HG2 PRO 52 -19.844 0.733 -31.153 137 HG3 PRO 52 HG1 PRO 52 -20.598 -0.857 -30.977 138 HD2 PRO 52 HD2 PRO 52 -20.278 1.217 -28.979 139 HD3 PRO 52 HD1 PRO 52 -21.146 -0.326 -28.838 140 H GLN 53 HN GLN 53 -16.993 -2.274 -27.188 141 HA GLN 53 HA GLN 53 -14.946 -1.411 -26.218 142 HB2 GLN 53 HB2 GLN 53 -14.354 -3.343 -28.473 143 HB3 GLN 53 HB1 GLN 53 -13.246 -2.949 -27.152 144 HG2 GLN 53 HG2 GLN 53 -14.868 -3.766 -25.510 145 HG3 GLN 53 HG1 GLN 53 -16.014 -4.124 -26.800 146 HE21 GLN 53 HE21 GLN 53 -15.512 -6.344 -25.437 147 HE22 GLN 53 HE22 GLN 53 -14.358 -7.340 -26.185 148 H VAL 54 HN VAL 54 -15.446 0.814 -27.401 149 HA VAL 54 HA VAL 54 -14.322 1.665 -29.727 150 HB VAL 54 HB VAL 54 -14.037 3.869 -28.684 151 HG11 VAL 54 HG11 VAL 54 -16.426 2.226 -28.611 152 HG12 VAL 54 HG12 VAL 54 -16.272 3.957 -28.947 153 HG13 VAL 54 HG13 VAL 54 -16.443 3.396 -27.286 154 HG21 VAL 54 HG21 VAL 54 -13.227 3.795 -26.561 155 HG22 VAL 54 HG22 VAL 54 -13.868 2.176 -26.281 156 HG23 VAL 54 HG23 VAL 54 -14.913 3.584 -26.087 157 H TYR 55 HN TYR 55 -12.305 3.238 -29.768 158 HA TYR 55 HA TYR 55 -10.023 1.604 -29.665 159 HB2 TYR 55 HB2 TYR 55 -10.312 4.613 -29.827 160 HB3 TYR 55 HB1 TYR 55 -8.770 3.769 -30.004 161 HD1 TYR 55 HD1 TYR 55 -12.037 4.460 -31.535 162 HD2 TYR 55 HD2 TYR 55 -8.348 2.296 -31.928 163 HE1 TYR 55 HE1 TYR 55 -12.560 4.001 -33.915 164 HE2 TYR 55 HE2 TYR 55 -8.870 1.837 -34.308 165 HH TYR 55 HH TYR 55 -11.699 3.269 -35.877 166 H HIS 56 HN HIS 56 -11.145 4.146 -27.457 167 HA HIS 56 HA HIS 56 -9.781 2.899 -25.241 168 HB2 HIS 56 HB2 HIS 56 -7.958 4.212 -26.351 169 HB3 HIS 56 HB1 HIS 56 -8.909 5.679 -26.080 170 HD2 HIS 56 HD2 HIS 56 -9.127 3.231 -23.112 171 HE1 HIS 56 HE1 HIS 56 -6.227 6.118 -22.073 172 HE2 HIS 56 HE2 HIS 56 -7.642 4.200 -21.196 173 H ILE 57 HN ILE 57 -10.679 3.469 -23.306 174 HA ILE 57 HA ILE 57 -12.694 5.634 -23.355 175 HB ILE 57 HB ILE 57 -12.818 2.978 -21.918 176 HG12 ILE 57 HG12 ILE 57 -14.704 4.162 -23.965 177 HG13 ILE 57 HG11 ILE 57 -13.366 3.097 -24.408 178 HG21 ILE 57 HG21 ILE 57 -14.841 5.232 -21.916 179 HG22 ILE 57 HG22 ILE 57 -13.692 4.952 -20.608 180 HG23 ILE 57 HG23 ILE 57 -14.911 3.735 -20.987 181 HD11 ILE 57 HD1 ILE 57 -14.285 1.273 -23.195 182 HD12 ILE 57 HD2 ILE 57 -15.659 1.990 -24.037 183 HD13 ILE 57 HD3 ILE 57 -15.406 2.317 -22.322 184 H ILE 58 HN ILE 58 -12.315 7.224 -21.954 185 HA ILE 58 HA ILE 58 -10.586 6.649 -19.620 186 HB ILE 58 HB ILE 58 -10.795 9.205 -21.232 187 HG12 ILE 58 HG12 ILE 58 -8.439 7.334 -20.852 188 HG13 ILE 58 HG11 ILE 58 -9.518 7.261 -22.246 189 HG21 ILE 58 HG21 ILE 58 -9.234 8.468 -18.742 190 HG22 ILE 58 HG22 ILE 58 -10.414 9.766 -18.921 191 HG23 ILE 58 HG23 ILE 58 -8.856 9.872 -19.740 192 HD11 ILE 58 HD1 ILE 58 -7.278 8.964 -21.884 193 HD12 ILE 58 HD2 ILE 58 -8.711 9.989 -21.825 194 HD13 ILE 58 HD3 ILE 58 -8.420 8.960 -23.228 195 H VAL 59 HN VAL 59 -11.478 6.999 -17.685 196 HA VAL 59 HA VAL 59 -13.896 8.708 -17.559 197 HB VAL 59 HB VAL 59 -13.198 6.277 -15.890 198 HG11 VAL 59 HG11 VAL 59 -15.756 7.894 -15.904 199 HG12 VAL 59 HG12 VAL 59 -14.457 8.171 -14.744 200 HG13 VAL 59 HG13 VAL 59 -15.293 6.619 -14.778 201 HG21 VAL 59 HG21 VAL 59 -15.320 5.414 -17.012 202 HG22 VAL 59 HG22 VAL 59 -13.916 5.570 -18.069 203 HG23 VAL 59 HG23 VAL 59 -15.190 6.784 -18.112 204 H THR 60 HN THR 60 -13.499 10.553 -16.535 205 HA THR 60 HA THR 60 -11.731 10.510 -14.173 206 HB THR 60 HB THR 60 -11.798 12.656 -16.309 207 HG1 THR 60 HG1 THR 60 -9.405 11.657 -15.923 208 HG21 THR 60 HG21 THR 60 -11.046 13.978 -14.645 209 HG22 THR 60 HG22 THR 60 -9.585 12.990 -14.640 210 HG23 THR 60 HG23 THR 60 -10.908 12.615 -13.536 211 H ASP 61 HN ASP 61 -12.625 11.382 -12.405 212 HA ASP 61 HA ASP 61 -15.218 12.727 -12.677 213 HB2 ASP 61 HB2 ASP 61 -15.001 10.863 -11.069 214 HB3 ASP 61 HB1 ASP 61 -13.757 11.769 -10.202 215 H LEU 62 HN LEU 62 -15.042 14.857 -13.044 216 HA LEU 62 HA LEU 62 -12.853 16.473 -12.277 217 HB2 LEU 62 HB2 LEU 62 -15.653 17.053 -13.205 218 HB3 LEU 62 HB1 LEU 62 -14.581 18.360 -12.697 219 HG LEU 62 HG LEU 62 -14.512 17.851 -15.174 220 HD11 LEU 62 HD11 LEU 62 -12.386 18.631 -15.169 221 HD12 LEU 62 HD12 LEU 62 -11.780 17.199 -14.337 222 HD13 LEU 62 HD13 LEU 62 -12.483 18.525 -13.412 223 HD21 LEU 62 HD21 LEU 62 -13.362 15.831 -15.897 224 HD22 LEU 62 HD22 LEU 62 -14.723 15.369 -14.876 225 HD23 LEU 62 HD23 LEU 62 -13.085 15.348 -14.224 226 H SER 63 HN SER 63 -16.020 15.907 -10.798 227 HA SER 63 HA SER 63 -15.621 17.782 -8.668 228 HB2 SER 63 HB2 SER 63 -17.577 15.490 -8.941 229 HB3 SER 63 HB1 SER 63 -17.633 16.726 -7.688 230 HG SER 63 HG SER 63 -18.792 17.738 -9.133 231 H TYR 64 HN TYR 64 -15.328 17.282 -6.436 232 HA TYR 64 HA TYR 64 -13.241 15.473 -5.896 233 HB2 TYR 64 HB2 TYR 64 -13.667 17.429 -4.488 234 HB3 TYR 64 HB1 TYR 64 -15.217 16.747 -3.988 235 HD1 TYR 64 HD1 TYR 64 -11.540 16.101 -3.979 236 HD2 TYR 64 HD2 TYR 64 -15.346 15.200 -2.204 237 HE1 TYR 64 HE1 TYR 64 -10.401 14.823 -2.184 238 HE2 TYR 64 HE2 TYR 64 -14.207 13.922 -0.410 239 HH TYR 64 HH TYR 64 -10.803 13.188 -0.556 240 H GLY 65 HN GLY 65 -13.188 13.406 -5.164 241 HA2 GLY 65 HA2 GLY 65 -13.903 11.279 -4.643 242 HA3 GLY 65 HA1 GLY 65 -15.354 12.024 -3.971 243 H CYS 66 HN CYS 66 -17.045 10.967 -4.823 244 HA CYS 66 HA CYS 66 -17.371 10.987 -7.730 245 HB2 CYS 66 HB2 CYS 66 -17.958 8.614 -7.824 246 HB3 CYS 66 HB1 CYS 66 -16.306 8.808 -7.231 247 HG CYS 66 HG CYS 66 -17.401 7.207 -5.539 248 H GLY 67 HN GLY 67 -19.592 10.468 -8.370 249 HA2 GLY 67 HA2 GLY 67 -21.906 10.212 -7.932 250 HA3 GLY 67 HA1 GLY 67 -21.600 10.597 -6.238 251 H GLN 68 HN GLN 68 -19.825 12.877 -7.373 252 HA GLN 68 HA GLN 68 -21.940 14.872 -7.324 253 HB2 GLN 68 HB2 GLN 68 -19.802 15.178 -6.075 254 HB3 GLN 68 HB1 GLN 68 -18.956 15.255 -7.619 255 HG2 GLN 68 HG2 GLN 68 -19.438 17.521 -6.833 256 HG3 GLN 68 HG1 GLN 68 -20.380 17.178 -8.283 257 HE21 GLN 68 HE21 GLN 68 -22.398 18.146 -8.006 258 HE22 GLN 68 HE22 GLN 68 -23.329 18.055 -6.589 259 H SER 69 HN SER 69 -19.240 14.061 -9.517 260 HA SER 69 HA SER 69 -20.914 14.617 -11.825 261 HB2 SER 69 HB2 SER 69 -20.073 16.857 -11.248 262 HB3 SER 69 HB1 SER 69 -18.421 16.250 -11.295 263 HG SER 69 HG SER 69 -18.748 15.743 -13.487 264 H PHE 70 HN PHE 70 -20.107 13.720 -13.734 265 HA PHE 70 HA PHE 70 -17.594 12.187 -13.484 266 HB2 PHE 70 HB2 PHE 70 -20.207 11.223 -14.672 267 HB3 PHE 70 HB1 PHE 70 -18.673 10.348 -14.747 268 HD1 PHE 70 HD1 PHE 70 -21.499 11.320 -12.641 269 HD2 PHE 70 HD2 PHE 70 -17.610 9.497 -12.667 270 HE1 PHE 70 HE1 PHE 70 -21.926 10.374 -10.389 271 HE2 PHE 70 HE2 PHE 70 -18.037 8.551 -10.415 272 HZ PHE 70 HZ PHE 70 -20.195 8.990 -9.276 273 H ASP 71 HN ASP 71 -16.383 11.961 -15.364 274 HA ASP 71 HA ASP 71 -17.386 13.206 -17.822 275 HB2 ASP 71 HB2 ASP 71 -16.238 15.004 -16.565 276 HB3 ASP 71 HB1 ASP 71 -14.778 14.019 -16.521 277 H ILE 72 HN ILE 72 -17.172 11.585 -19.239 278 HA ILE 72 HA ILE 72 -14.638 10.043 -19.222 279 HB ILE 72 HB ILE 72 -15.922 8.175 -20.176 280 HG12 ILE 72 HG12 ILE 72 -18.367 9.922 -19.745 281 HG13 ILE 72 HG11 ILE 72 -17.610 9.659 -21.322 282 HG21 ILE 72 HG21 ILE 72 -15.766 8.592 -17.655 283 HG22 ILE 72 HG22 ILE 72 -17.072 7.534 -18.186 284 HG23 ILE 72 HG23 ILE 72 -17.415 9.210 -17.757 285 HD11 ILE 72 HD1 ILE 72 -18.489 7.580 -21.521 286 HD12 ILE 72 HD2 ILE 72 -19.588 8.071 -20.232 287 HD13 ILE 72 HD3 ILE 72 -18.121 7.171 -19.846 288 H VAL 73 HN VAL 73 -13.580 9.719 -21.127 289 HA VAL 73 HA VAL 73 -14.704 11.043 -23.516 290 HB VAL 73 HB VAL 73 -11.869 11.185 -22.473 291 HG11 VAL 73 HG11 VAL 73 -13.017 12.284 -25.051 292 HG12 VAL 73 HG12 VAL 73 -12.000 10.849 -24.946 293 HG13 VAL 73 HG13 VAL 73 -11.350 12.426 -24.498 294 HG21 VAL 73 HG21 VAL 73 -12.702 13.043 -21.484 295 HG22 VAL 73 HG22 VAL 73 -14.226 12.910 -22.363 296 HG23 VAL 73 HG23 VAL 73 -12.846 13.720 -23.106 297 H VAL 74 HN VAL 74 -14.684 9.841 -25.320 298 HA VAL 74 HA VAL 74 -12.907 7.480 -25.414 299 HB VAL 74 HB VAL 74 -14.743 6.211 -26.471 300 HG11 VAL 74 HG11 VAL 74 -15.732 7.383 -23.867 301 HG12 VAL 74 HG12 VAL 74 -14.335 6.309 -23.935 302 HG13 VAL 74 HG13 VAL 74 -15.917 5.732 -24.459 303 HG21 VAL 74 HG21 VAL 74 -16.942 7.093 -26.672 304 HG22 VAL 74 HG22 VAL 74 -15.890 8.377 -27.267 305 HG23 VAL 74 HG23 VAL 74 -16.568 8.474 -25.642 306 H VAL 75 HN VAL 75 -12.399 6.734 -27.557 307 HA VAL 75 HA VAL 75 -12.710 8.844 -29.611 308 HB VAL 75 HB VAL 75 -10.369 7.000 -29.092 309 HG11 VAL 75 HG11 VAL 75 -11.052 7.506 -31.553 310 HG12 VAL 75 HG12 VAL 75 -9.376 7.784 -31.076 311 HG13 VAL 75 HG13 VAL 75 -10.493 9.143 -31.207 312 HG21 VAL 75 HG21 VAL 75 -10.567 9.004 -27.623 313 HG22 VAL 75 HG22 VAL 75 -10.617 10.025 -29.060 314 HG23 VAL 75 HG23 VAL 75 -9.164 9.096 -28.687 315 H SER 76 HN SER 76 -13.752 8.247 -31.393 316 HA SER 76 HA SER 76 -13.474 5.596 -32.514 317 HB2 SER 76 HB2 SER 76 -15.168 5.141 -30.802 318 HB3 SER 76 HB1 SER 76 -16.156 6.468 -31.409 319 HG SER 76 HG SER 76 -15.586 3.965 -32.542 320 H ASP 77 HN ASP 77 -14.613 5.391 -34.576 321 HA ASP 77 HA ASP 77 -14.434 7.785 -36.119 322 HB2 ASP 77 HB2 ASP 77 -15.462 5.016 -36.743 323 HB3 ASP 77 HB1 ASP 77 -15.425 6.321 -37.926 324 H PHE 78 HN PHE 78 -16.838 6.586 -34.109 325 HA PHE 78 HA PHE 78 -19.225 7.164 -35.455 326 HB2 PHE 78 HB2 PHE 78 -18.974 6.016 -33.211 327 HB3 PHE 78 HB1 PHE 78 -18.734 7.623 -32.504 328 HD1 PHE 78 HD1 PHE 78 -21.136 5.319 -34.071 329 HD2 PHE 78 HD2 PHE 78 -20.561 9.276 -32.517 330 HE1 PHE 78 HE1 PHE 78 -23.592 5.659 -34.032 331 HE2 PHE 78 HE2 PHE 78 -23.017 9.619 -32.469 332 HZ PHE 78 HZ PHE 78 -24.533 7.810 -33.229 333 H PHE 79 HN PHE 79 -16.898 9.252 -33.874 334 HA PHE 79 HA PHE 79 -18.634 11.585 -34.010 335 HB2 PHE 79 HB2 PHE 79 -17.154 11.473 -32.126 336 HB3 PHE 79 HB1 PHE 79 -15.754 11.217 -33.168 337 HD1 PHE 79 HD1 PHE 79 -18.496 13.673 -32.475 338 HD2 PHE 79 HD2 PHE 79 -14.514 13.046 -33.960 339 HE1 PHE 79 HE1 PHE 79 -18.180 16.124 -32.680 340 HE2 PHE 79 HE2 PHE 79 -14.203 15.498 -34.160 341 HZ PHE 79 HZ PHE 79 -16.038 17.037 -33.519 342 H GLN 80 HN GLN 80 -16.969 9.906 -36.266 343 HA GLN 80 HA GLN 80 -15.965 12.251 -37.725 344 HB2 GLN 80 HB2 GLN 80 -15.724 9.275 -38.219 345 HB3 GLN 80 HB1 GLN 80 -15.115 10.503 -39.329 346 HG2 GLN 80 HG2 GLN 80 -13.657 11.405 -37.598 347 HG3 GLN 80 HG1 GLN 80 -14.325 10.286 -36.411 348 HE21 GLN 80 HE21 GLN 80 -11.517 10.618 -37.792 349 HE22 GLN 80 HE22 GLN 80 -11.138 9.027 -38.246 350 H GLY 81 HN GLY 81 -17.363 13.285 -38.991 351 HA2 GLY 81 HA2 GLY 81 -18.845 13.592 -40.753 352 HA3 GLY 81 HA1 GLY 81 -18.970 11.840 -40.916 353 H LYS 82 HN LYS 82 -19.403 12.637 -37.715 354 HA LYS 82 HA LYS 82 -22.337 12.850 -38.019 355 HB2 LYS 82 HB2 LYS 82 -20.772 11.120 -36.095 356 HB3 LYS 82 HB1 LYS 82 -22.506 11.413 -35.967 357 HG2 LYS 82 HG2 LYS 82 -22.831 10.483 -38.232 358 HG3 LYS 82 HG1 LYS 82 -21.097 10.180 -38.354 359 HD2 LYS 82 HD2 LYS 82 -21.202 8.655 -36.438 360 HD3 LYS 82 HD1 LYS 82 -22.924 8.988 -36.247 361 HE2 LYS 82 HE2 LYS 82 -22.625 6.888 -37.463 362 HE3 LYS 82 HE1 LYS 82 -23.322 8.103 -38.536 363 HZ1 LYS 82 HZ1 LYS 82 -21.593 7.096 -39.738 364 HZ2 LYS 82 HZ2 LYS 82 -20.515 7.168 -38.427 365 HZ3 LYS 82 HZ3 LYS 82 -20.970 8.591 -39.236 366 H SER 83 HN SER 83 -23.406 14.126 -36.537 367 HA SER 83 HA SER 83 -21.914 16.235 -35.333 368 HB2 SER 83 HB2 SER 83 -24.158 16.646 -36.160 369 HB3 SER 83 HB1 SER 83 -24.821 15.448 -35.053 370 HG SER 83 HG SER 83 -24.686 16.846 -33.478 371 H LYS 84 HN LYS 84 -21.719 16.748 -33.116 372 HA LYS 84 HA LYS 84 -20.998 14.610 -31.434 373 HB2 LYS 84 HB2 LYS 84 -21.626 17.496 -30.785 374 HB3 LYS 84 HB1 LYS 84 -20.921 16.346 -29.641 375 HG2 LYS 84 HG2 LYS 84 -19.018 15.987 -31.156 376 HG3 LYS 84 HG1 LYS 84 -19.713 17.127 -32.307 377 HD2 LYS 84 HD2 LYS 84 -19.581 18.921 -30.622 378 HD3 LYS 84 HD1 LYS 84 -18.885 17.785 -29.466 379 HE2 LYS 84 HE2 LYS 84 -16.971 17.414 -30.977 380 HE3 LYS 84 HE1 LYS 84 -17.666 18.544 -32.138 381 HZ1 LYS 84 HZ1 LYS 84 -17.296 19.457 -29.384 382 HZ2 LYS 84 HZ2 LYS 84 -17.191 20.328 -30.839 383 HZ3 LYS 84 HZ3 LYS 84 -15.916 19.313 -30.358 384 H LEU 85 HN LEU 85 -23.986 16.428 -31.783 385 HA LEU 85 HA LEU 85 -25.299 15.594 -29.441 386 HB2 LEU 85 HB2 LEU 85 -26.369 16.353 -32.163 387 HB3 LEU 85 HB1 LEU 85 -27.400 16.053 -30.763 388 HG LEU 85 HG LEU 85 -25.135 18.064 -30.770 389 HD11 LEU 85 HD11 LEU 85 -26.853 18.742 -32.388 390 HD12 LEU 85 HD12 LEU 85 -26.927 19.771 -30.958 391 HD13 LEU 85 HD13 LEU 85 -28.112 18.485 -31.180 392 HD21 LEU 85 HD21 LEU 85 -26.578 16.874 -28.694 393 HD22 LEU 85 HD22 LEU 85 -27.366 18.435 -28.925 394 HD23 LEU 85 HD23 LEU 85 -25.637 18.362 -28.585 395 H MET 86 HN MET 86 -24.985 14.081 -32.616 396 HA MET 86 HA MET 86 -26.832 11.983 -32.261 397 HB2 MET 86 HB2 MET 86 -24.306 12.148 -33.917 398 HB3 MET 86 HB1 MET 86 -25.456 10.812 -34.006 399 HG2 MET 86 HG2 MET 86 -26.093 13.731 -34.527 400 HG3 MET 86 HG1 MET 86 -25.932 12.475 -35.759 401 HE1 MET 86 HE1 MET 86 -26.977 10.417 -35.733 402 HE2 MET 86 HE2 MET 86 -28.720 10.220 -35.568 403 HE3 MET 86 HE3 MET 86 -27.666 9.860 -34.203 404 H ARG 87 HN ARG 87 -23.452 12.344 -31.321 405 HA ARG 87 HA ARG 87 -22.900 9.685 -30.597 406 HB2 ARG 87 HB2 ARG 87 -21.831 12.329 -29.606 407 HB3 ARG 87 HB1 ARG 87 -21.235 10.783 -29.004 408 HG2 ARG 87 HG2 ARG 87 -20.432 10.133 -31.124 409 HG3 ARG 87 HG1 ARG 87 -21.377 11.367 -31.960 410 HD2 ARG 87 HD2 ARG 87 -18.833 11.760 -31.589 411 HD3 ARG 87 HD1 ARG 87 -19.951 13.085 -31.297 412 HE ARG 87 HE ARG 87 -18.990 11.361 -29.089 413 HH11 ARG 87 HH11 ARG 87 -19.523 14.445 -30.581 414 HH12 ARG 87 HH12 ARG 87 -19.065 15.353 -29.187 415 HH21 ARG 87 HH21 ARG 87 -18.384 12.561 -27.253 416 HH22 ARG 87 HH22 ARG 87 -18.419 14.291 -27.304 417 H SER 88 HN SER 88 -24.436 12.333 -28.809 418 HA SER 88 HA SER 88 -24.514 11.130 -26.271 419 HB2 SER 88 HB2 SER 88 -26.418 13.085 -27.577 420 HB3 SER 88 HB1 SER 88 -26.464 12.653 -25.870 421 HG SER 88 HG SER 88 -24.276 13.380 -25.749 422 H ARG 89 HN ARG 89 -26.775 10.946 -29.002 423 HA ARG 89 HA ARG 89 -28.788 9.453 -27.710 424 HB2 ARG 89 HB2 ARG 89 -29.077 10.585 -29.899 425 HB3 ARG 89 HB1 ARG 89 -28.006 9.392 -30.636 426 HG2 ARG 89 HG2 ARG 89 -29.545 7.586 -29.938 427 HG3 ARG 89 HG1 ARG 89 -30.622 8.788 -29.226 428 HD2 ARG 89 HD2 ARG 89 -31.462 8.238 -31.430 429 HD3 ARG 89 HD1 ARG 89 -30.807 9.872 -31.479 430 HE ARG 89 HE ARG 89 -28.797 8.003 -32.212 431 HH11 ARG 89 HH11 ARG 89 -31.731 9.474 -33.308 432 HH12 ARG 89 HH12 ARG 89 -31.331 9.344 -34.989 433 HH21 ARG 89 HH21 ARG 89 -28.265 7.827 -34.414 434 HH22 ARG 89 HH22 ARG 89 -29.369 8.412 -35.614 435 H ALA 90 HN ALA 90 -25.957 8.429 -29.609 436 HA ALA 90 HA ALA 90 -26.470 5.647 -29.464 437 HB1 ALA 90 HB1 ALA 90 -24.872 6.764 -31.053 438 HB2 ALA 90 HB2 ALA 90 -24.199 5.362 -30.220 439 HB3 ALA 90 HB3 ALA 90 -23.769 6.989 -29.695 440 H VAL 91 HN VAL 91 -24.596 7.846 -27.417 441 HA VAL 91 HA VAL 91 -23.516 5.878 -25.698 442 HB VAL 91 HB VAL 91 -24.056 8.824 -25.316 443 HG11 VAL 91 HG11 VAL 91 -22.527 6.921 -23.509 444 HG12 VAL 91 HG12 VAL 91 -24.098 7.630 -23.135 445 HG13 VAL 91 HG13 VAL 91 -22.678 8.665 -23.290 446 HG21 VAL 91 HG21 VAL 91 -21.424 8.629 -25.301 447 HG22 VAL 91 HG22 VAL 91 -22.294 8.613 -26.835 448 HG23 VAL 91 HG23 VAL 91 -21.733 7.098 -26.123 449 H ASN 92 HN ASN 92 -26.461 7.848 -25.518 450 HA ASN 92 HA ASN 92 -27.308 7.058 -22.962 451 HB2 ASN 92 HB2 ASN 92 -28.326 8.918 -24.221 452 HB3 ASN 92 HB1 ASN 92 -28.999 7.766 -25.376 453 HD21 ASN 92 HD21 ASN 92 -30.793 9.396 -23.980 454 HD22 ASN 92 HD22 ASN 92 -31.636 8.470 -22.834 455 H LYS 93 HN LYS 93 -28.038 5.656 -26.157 456 HA LYS 93 HA LYS 93 -29.689 3.559 -25.180 457 HB2 LYS 93 HB2 LYS 93 -28.098 3.867 -27.730 458 HB3 LYS 93 HB1 LYS 93 -29.169 2.501 -27.415 459 HG2 LYS 93 HG2 LYS 93 -31.059 4.051 -27.092 460 HG3 LYS 93 HG1 LYS 93 -29.991 5.422 -27.407 461 HD2 LYS 93 HD2 LYS 93 -29.522 4.540 -29.667 462 HD3 LYS 93 HD1 LYS 93 -30.596 3.176 -29.355 463 HE2 LYS 93 HE2 LYS 93 -32.487 4.728 -29.037 464 HE3 LYS 93 HE1 LYS 93 -31.416 6.096 -29.342 465 HZ1 LYS 93 HZ1 LYS 93 -30.938 4.574 -31.479 466 HZ2 LYS 93 HZ2 LYS 93 -32.101 5.812 -31.443 467 HZ3 LYS 93 HZ3 LYS 93 -32.567 4.196 -31.201 468 H ALA 94 HN ALA 94 -26.218 3.785 -25.888 469 HA ALA 94 HA ALA 94 -25.602 1.060 -25.436 470 HB1 ALA 94 HB1 ALA 94 -24.145 3.555 -25.840 471 HB2 ALA 94 HB2 ALA 94 -23.724 1.914 -26.333 472 HB3 ALA 94 HB3 ALA 94 -23.330 2.475 -24.708 473 H VAL 95 HN VAL 95 -25.636 3.891 -23.299 474 HA VAL 95 HA VAL 95 -25.521 2.032 -20.993 475 HB VAL 95 HB VAL 95 -24.486 4.755 -20.544 476 HG11 VAL 95 HG11 VAL 95 -22.843 2.389 -19.940 477 HG12 VAL 95 HG12 VAL 95 -24.461 2.324 -19.242 478 HG13 VAL 95 HG13 VAL 95 -23.394 3.677 -18.869 479 HG21 VAL 95 HG21 VAL 95 -22.209 3.690 -21.517 480 HG22 VAL 95 HG22 VAL 95 -23.274 4.696 -22.501 481 HG23 VAL 95 HG23 VAL 95 -23.360 2.939 -22.620 482 H LYS 96 HN LYS 96 -27.932 2.751 -22.057 483 HA LYS 96 HA LYS 96 -29.067 5.128 -21.039 484 HB2 LYS 96 HB2 LYS 96 -31.217 4.086 -21.506 485 HB3 LYS 96 HB1 LYS 96 -30.095 3.727 -22.819 486 HG2 LYS 96 HG2 LYS 96 -29.605 1.530 -21.793 487 HG3 LYS 96 HG1 LYS 96 -30.753 1.886 -20.501 488 HD2 LYS 96 HD2 LYS 96 -32.569 2.074 -22.159 489 HD3 LYS 96 HD1 LYS 96 -31.424 1.723 -23.455 490 HE2 LYS 96 HE2 LYS 96 -30.946 -0.474 -22.445 491 HE3 LYS 96 HE1 LYS 96 -32.086 -0.126 -21.145 492 HZ1 LYS 96 HZ1 LYS 96 -33.878 -0.262 -22.558 493 HZ2 LYS 96 HZ2 LYS 96 -32.863 -1.467 -23.193 494 HZ3 LYS 96 HZ3 LYS 96 -32.958 0.051 -23.949 495 H GLU 97 HN GLU 97 -28.612 1.928 -19.650 496 HA GLU 97 HA GLU 97 -30.291 2.259 -17.387 497 HB2 GLU 97 HB2 GLU 97 -27.873 0.510 -17.873 498 HB3 GLU 97 HB1 GLU 97 -28.860 0.422 -16.414 499 HG2 GLU 97 HG2 GLU 97 -29.875 0.046 -19.246 500 HG3 GLU 97 HG1 GLU 97 -29.583 -1.249 -18.086 501 H GLU 98 HN GLU 98 -26.862 2.928 -17.957 502 HA GLU 98 HA GLU 98 -26.278 3.725 -15.284 503 HB2 GLU 98 HB2 GLU 98 -24.866 4.310 -17.894 504 HB3 GLU 98 HB1 GLU 98 -24.227 4.721 -16.302 505 HG2 GLU 98 HG2 GLU 98 -25.008 1.918 -17.150 506 HG3 GLU 98 HG1 GLU 98 -23.360 2.540 -17.189 507 H LEU 99 HN LEU 99 -27.653 5.317 -18.051 508 HA LEU 99 HA LEU 99 -27.114 7.995 -17.394 509 HB2 LEU 99 HB2 LEU 99 -28.013 7.301 -19.578 510 HB3 LEU 99 HB1 LEU 99 -29.525 6.839 -18.797 511 HG LEU 99 HG LEU 99 -29.870 9.158 -18.054 512 HD11 LEU 99 HD11 LEU 99 -27.247 9.610 -19.505 513 HD12 LEU 99 HD12 LEU 99 -27.580 9.887 -17.796 514 HD13 LEU 99 HD13 LEU 99 -28.329 10.914 -19.017 515 HD21 LEU 99 HD21 LEU 99 -29.634 10.100 -20.626 516 HD22 LEU 99 HD22 LEU 99 -30.977 9.115 -20.043 517 HD23 LEU 99 HD23 LEU 99 -29.623 8.355 -20.881 518 H GLN 100 HN GLN 100 -29.783 5.852 -16.448 519 HA GLN 100 HA GLN 100 -31.332 7.775 -15.082 520 HB2 GLN 100 HB2 GLN 100 -32.571 5.972 -14.270 521 HB3 GLN 100 HB1 GLN 100 -31.845 5.286 -15.723 522 HG2 GLN 100 HG2 GLN 100 -29.994 4.376 -14.323 523 HG3 GLN 100 HG1 GLN 100 -30.813 4.980 -12.891 524 HE21 GLN 100 HE21 GLN 100 -30.269 2.113 -14.005 525 HE22 GLN 100 HE22 GLN 100 -31.788 1.365 -13.891 526 H GLU 101 HN GLU 101 -28.659 5.705 -14.017 527 HA GLU 101 HA GLU 101 -28.790 6.589 -11.278 528 HB2 GLU 101 HB2 GLU 101 -27.889 4.358 -11.971 529 HB3 GLU 101 HB1 GLU 101 -26.512 5.194 -12.693 530 HG2 GLU 101 HG2 GLU 101 -25.923 6.161 -10.522 531 HG3 GLU 101 HG1 GLU 101 -27.332 5.403 -9.783 532 H ILE 102 HN ILE 102 -27.155 7.578 -14.209 533 HA ILE 102 HA ILE 102 -25.536 9.522 -12.671 534 HB ILE 102 HB ILE 102 -25.308 8.659 -15.569 535 HG12 ILE 102 HG12 ILE 102 -23.497 7.996 -13.231 536 HG13 ILE 102 HG11 ILE 102 -24.771 6.915 -13.794 537 HG21 ILE 102 HG21 ILE 102 -23.153 10.032 -14.010 538 HG22 ILE 102 HG22 ILE 102 -24.486 11.008 -14.630 539 HG23 ILE 102 HG23 ILE 102 -23.487 10.069 -15.741 540 HD11 ILE 102 HD1 ILE 102 -22.721 6.237 -14.869 541 HD12 ILE 102 HD2 ILE 102 -22.377 7.893 -15.369 542 HD13 ILE 102 HD3 ILE 102 -23.729 7.018 -16.090 543 H HIS 103 HN HIS 103 -26.212 11.559 -12.593 544 HA HIS 103 HA HIS 103 -28.160 12.480 -14.610 545 HB2 HIS 103 HB2 HIS 103 -27.601 13.392 -11.780 546 HB3 HIS 103 HB1 HIS 103 -28.668 14.260 -12.889 547 HD2 HIS 103 HD2 HIS 103 -31.215 13.133 -13.173 548 HE1 HIS 103 HE1 HIS 103 -30.516 9.661 -10.876 549 HE2 HIS 103 HE2 HIS 103 -32.289 11.011 -12.094 550 H ALA 104 HN ALA 104 -25.096 13.208 -13.057 551 HA ALA 104 HA ALA 104 -24.728 15.441 -14.966 552 HB1 ALA 104 HB1 ALA 104 -23.151 15.291 -12.430 553 HB2 ALA 104 HB2 ALA 104 -24.823 15.845 -12.351 554 HB3 ALA 104 HB3 ALA 104 -23.657 16.704 -13.356 555 H PHE 105 HN PHE 105 -23.713 14.271 -16.572 556 HA PHE 105 HA PHE 105 -20.962 13.485 -15.981 557 HB2 PHE 105 HB2 PHE 105 -21.165 11.329 -17.080 558 HB3 PHE 105 HB1 PHE 105 -22.304 11.422 -15.741 559 HD1 PHE 105 HD1 PHE 105 -21.919 11.298 -19.382 560 HD2 PHE 105 HD2 PHE 105 -24.724 11.740 -16.160 561 HE1 PHE 105 HE1 PHE 105 -23.790 10.870 -20.951 562 HE2 PHE 105 HE2 PHE 105 -26.595 11.309 -17.728 563 HZ PHE 105 HZ PHE 105 -26.128 10.874 -20.124 564 H SER 106 HN SER 106 -19.665 13.213 -17.942 565 HA SER 106 HA SER 106 -20.835 14.584 -20.288 566 HB2 SER 106 HB2 SER 106 -18.681 15.696 -20.649 567 HB3 SER 106 HB1 SER 106 -19.342 16.118 -19.070 568 HG SER 106 HG SER 106 -17.415 15.477 -18.456 569 H CYS 107 HN CYS 107 -20.061 13.921 -22.318 570 HA CYS 107 HA CYS 107 -18.396 11.483 -22.326 571 HB2 CYS 107 HB2 CYS 107 -19.849 10.532 -24.066 572 HB3 CYS 107 HB1 CYS 107 -20.752 10.831 -22.578 573 HG CYS 107 HG CYS 107 -21.333 13.243 -23.919 574 H LYS 108 HN LYS 108 -17.071 13.697 -22.760 575 HA LYS 108 HA LYS 108 -17.146 14.816 -25.352 576 HB2 LYS 108 HB2 LYS 108 -15.942 15.804 -23.405 577 HB3 LYS 108 HB1 LYS 108 -14.742 14.517 -23.534 578 HG2 LYS 108 HG2 LYS 108 -14.149 15.230 -25.783 579 HG3 LYS 108 HG1 LYS 108 -15.430 16.443 -25.771 580 HD2 LYS 108 HD2 LYS 108 -13.345 17.562 -25.263 581 HD3 LYS 108 HD1 LYS 108 -14.304 17.503 -23.784 582 HE2 LYS 108 HE2 LYS 108 -13.044 15.572 -22.992 583 HE3 LYS 108 HE1 LYS 108 -12.141 15.504 -24.506 584 HZ1 LYS 108 HZ1 LYS 108 -10.694 16.726 -23.300 585 HZ2 LYS 108 HZ2 LYS 108 -11.888 17.354 -22.267 586 HZ3 LYS 108 HZ3 LYS 108 -11.676 18.007 -23.821 587 H CYS 109 HN CYS 109 -16.529 14.030 -27.263 588 HA CYS 109 HA CYS 109 -14.693 11.713 -27.313 589 HB2 CYS 109 HB2 CYS 109 -17.128 12.164 -29.053 590 HB3 CYS 109 HB1 CYS 109 -15.988 10.831 -29.220 591 HG CYS 109 HG CYS 109 -16.767 9.889 -26.934 592 H TYR 110 HN TYR 110 -13.271 11.595 -29.066 593 HA TYR 110 HA TYR 110 -13.274 13.768 -31.019 594 HB2 TYR 110 HB2 TYR 110 -10.937 14.354 -30.564 595 HB3 TYR 110 HB1 TYR 110 -11.948 14.651 -29.146 596 HD1 TYR 110 HD1 TYR 110 -9.331 12.518 -30.611 597 HD2 TYR 110 HD2 TYR 110 -11.820 13.200 -27.177 598 HE1 TYR 110 HE1 TYR 110 -7.909 10.988 -29.274 599 HE2 TYR 110 HE2 TYR 110 -10.397 11.671 -25.841 600 HH TYR 110 HH TYR 110 -8.653 10.307 -25.851 601 H THR 111 HN THR 111 -11.722 13.396 -32.772 602 HA THR 111 HA THR 111 -10.512 10.767 -32.979 603 HB THR 111 HB THR 111 -12.485 11.433 -35.130 604 HG1 THR 111 HG1 THR 111 -13.822 9.882 -33.779 605 HG21 THR 111 HG21 THR 111 -10.895 9.622 -35.503 606 HG22 THR 111 HG22 THR 111 -12.512 8.949 -35.292 607 HG23 THR 111 HG23 THR 111 -11.347 8.878 -33.969 608 H GLU 112 HN GLU 112 -9.324 13.270 -32.968 609 HA GLU 112 HA GLU 112 -7.659 14.358 -34.126 610 HB2 GLU 112 HB2 GLU 112 -7.184 12.174 -35.199 611 HB3 GLU 112 HB1 GLU 112 -8.395 12.537 -36.427 612 HG2 GLU 112 HG2 GLU 112 -7.143 14.527 -37.113 613 HG3 GLU 112 HG1 GLU 112 -5.946 14.224 -35.855 614 H GLU 113 HN GLU 113 -10.891 14.076 -35.184 615 HA GLU 113 HA GLU 113 -10.909 15.923 -37.326 616 HB2 GLU 113 HB2 GLU 113 -13.060 15.074 -35.384 617 HB3 GLU 113 HB1 GLU 113 -13.348 16.142 -36.762 618 HG2 GLU 113 HG2 GLU 113 -12.203 13.336 -36.917 619 HG3 GLU 113 HG1 GLU 113 -13.858 13.783 -37.326 620 H GLU 114 HN GLU 114 -11.200 16.293 -33.828 621 HA GLU 114 HA GLU 114 -12.024 18.955 -33.693 622 HB2 GLU 114 HB2 GLU 114 -11.090 18.977 -31.457 623 HB3 GLU 114 HB1 GLU 114 -11.814 17.395 -31.749 624 HG2 GLU 114 HG2 GLU 114 -9.580 16.498 -32.345 625 HG3 GLU 114 HG1 GLU 114 -8.869 18.075 -32.001 626 H TRP 115 HN TRP 115 -9.066 17.631 -34.805 627 HA TRP 115 HA TRP 115 -7.468 20.020 -34.336 628 HB2 TRP 115 HB2 TRP 115 -5.717 18.709 -34.879 629 HB3 TRP 115 HB1 TRP 115 -6.861 17.367 -34.759 630 HD1 TRP 115 HD1 TRP 115 -4.293 18.077 -36.921 631 HE1 TRP 115 HE1 TRP 115 -4.794 17.576 -39.399 632 HE3 TRP 115 HE3 TRP 115 -9.392 17.888 -36.773 633 HZ2 TRP 115 HZ2 TRP 115 -7.059 17.155 -41.095 634 HZ3 TRP 115 HZ3 TRP 115 -10.697 17.438 -38.830 635 HH2 TRP 115 HH2 TRP 115 -9.537 17.072 -40.990 636 H SER 116 HN SER 116 -10.032 19.890 -36.080 637 HA SER 116 HA SER 116 -9.354 20.340 -38.767 638 HB2 SER 116 HB2 SER 116 -11.660 19.984 -38.028 639 HB3 SER 116 HB1 SER 116 -11.631 21.511 -37.151 640 HG SER 116 HG SER 116 -11.619 21.014 -39.921 641 H LYS 117 HN LYS 117 -9.631 22.590 -36.020 642 HA LYS 117 HA LYS 117 -8.326 24.664 -37.689 643 HB2 LYS 117 HB2 LYS 117 -10.088 25.006 -35.255 644 HB3 LYS 117 HB1 LYS 117 -9.326 26.311 -36.158 645 HG2 LYS 117 HG2 LYS 117 -10.536 25.607 -38.202 646 HG3 LYS 117 HG1 LYS 117 -11.341 24.340 -37.274 647 HD2 LYS 117 HD2 LYS 117 -11.489 27.278 -36.559 648 HD3 LYS 117 HD1 LYS 117 -12.698 26.456 -37.547 649 HE2 LYS 117 HE2 LYS 117 -13.018 24.809 -35.679 650 HE3 LYS 117 HE1 LYS 117 -11.934 25.787 -34.690 651 HZ1 LYS 117 HZ1 LYS 117 -14.003 27.321 -35.953 652 HZ2 LYS 117 HZ2 LYS 117 -13.516 27.289 -34.325 653 HZ3 LYS 117 HZ3 LYS 117 -14.616 26.133 -34.910 654 H ILE 118 HN ILE 118 -6.408 25.475 -37.018 655 HA ILE 118 HA ILE 118 -4.872 24.106 -35.092 656 HB ILE 118 HB ILE 118 -4.479 26.825 -36.366 657 HG12 ILE 118 HG12 ILE 118 -4.513 24.888 -37.916 658 HG13 ILE 118 HG11 ILE 118 -2.895 25.589 -37.798 659 HG21 ILE 118 HG21 ILE 118 -3.055 26.967 -34.544 660 HG22 ILE 118 HG22 ILE 118 -2.011 26.127 -35.692 661 HG23 ILE 118 HG23 ILE 118 -2.856 25.216 -34.433 662 HD11 ILE 118 HD1 ILE 118 -2.463 23.845 -35.955 663 HD12 ILE 118 HD2 ILE 118 -2.551 23.247 -37.612 664 HD13 ILE 118 HD3 ILE 118 -3.928 23.049 -36.530 665 H VAL 119 HN VAL 119 -6.531 27.251 -34.961 666 HA VAL 119 HA VAL 119 -5.697 27.961 -32.357 667 HB VAL 119 HB VAL 119 -8.135 28.729 -33.971 668 HG11 VAL 119 HG11 VAL 119 -7.430 30.603 -31.896 669 HG12 VAL 119 HG12 VAL 119 -7.728 29.017 -31.184 670 HG13 VAL 119 HG13 VAL 119 -8.971 29.787 -32.169 671 HG21 VAL 119 HG21 VAL 119 -6.453 30.915 -33.549 672 HG22 VAL 119 HG22 VAL 119 -6.567 29.969 -35.032 673 HG23 VAL 119 HG23 VAL 119 -5.342 29.574 -33.827 674 H VAL 120 HN VAL 120 -8.632 26.326 -33.501 675 HA VAL 120 HA VAL 120 -10.326 25.253 -32.346 676 HB VAL 120 HB VAL 120 -8.399 23.619 -32.446 677 HG11 VAL 120 HG11 VAL 120 -6.819 24.732 -30.990 678 HG12 VAL 120 HG12 VAL 120 -7.270 23.208 -30.226 679 HG13 VAL 120 HG13 VAL 120 -7.969 24.722 -29.653 680 HG21 VAL 120 HG21 VAL 120 -9.399 22.536 -30.102 681 HG22 VAL 120 HG22 VAL 120 -10.148 22.385 -31.692 682 HG23 VAL 120 HG23 VAL 120 -10.677 23.653 -30.586 683 H LEU 121 HN LEU 121 -9.105 27.830 -31.126 684 HA LEU 121 HA LEU 121 -10.191 27.439 -28.412 685 HB2 LEU 121 HB2 LEU 121 -7.934 29.201 -29.365 686 HB3 LEU 121 HB1 LEU 121 -8.699 29.374 -27.805 687 HG LEU 121 HG LEU 121 -7.523 26.768 -28.759 688 HD11 LEU 121 HD11 LEU 121 -5.498 27.717 -28.433 689 HD12 LEU 121 HD12 LEU 121 -5.911 27.774 -26.720 690 HD13 LEU 121 HD13 LEU 121 -6.215 29.174 -27.749 691 HD21 LEU 121 HD21 LEU 121 -8.765 27.801 -26.240 692 HD22 LEU 121 HD22 LEU 121 -7.463 26.619 -26.100 693 HD23 LEU 121 HD23 LEU 121 -8.927 26.218 -26.999 694 H GLU 122 HN GLU 122 -10.698 28.861 -31.379 695 HA GLU 122 HA GLU 122 -11.751 31.396 -30.565 696 HB2 GLU 122 HB2 GLU 122 -12.611 31.537 -32.839 697 HB3 GLU 122 HB1 GLU 122 -10.961 30.916 -32.874 698 HG2 GLU 122 HG2 GLU 122 -11.854 28.603 -33.000 699 HG3 GLU 122 HG1 GLU 122 -13.491 29.254 -33.036 700 H HIS 123 HN HIS 123 -13.555 31.696 -29.454 701 HA HIS 123 HA HIS 123 -16.014 30.377 -30.159 702 HB2 HIS 123 HB2 HIS 123 -16.400 29.337 -27.949 703 HB3 HIS 123 HB1 HIS 123 -15.024 28.612 -28.783 704 HD2 HIS 123 HD2 HIS 123 -12.568 28.906 -27.462 705 HE1 HIS 123 HE1 HIS 123 -13.958 31.369 -24.326 706 HE2 HIS 123 HE2 HIS 123 -11.967 30.052 -25.194 707 H HIS 124 HN HIS 124 -14.452 33.010 -29.316 708 HA HIS 124 HA HIS 124 -15.910 34.144 -27.175 709 HB2 HIS 124 HB2 HIS 124 -14.345 35.343 -29.456 710 HB3 HIS 124 HB1 HIS 124 -15.138 36.339 -28.236 711 HD2 HIS 124 HD2 HIS 124 -13.760 36.516 -25.817 712 HE1 HIS 124 HE1 HIS 124 -10.826 33.597 -26.649 713 HE2 HIS 124 HE2 HIS 124 -11.562 35.374 -24.991 714 H HIS 125 HN HIS 125 -16.440 34.096 -30.667 715 HA HIS 125 HA HIS 125 -19.222 34.910 -30.205 716 HB2 HIS 125 HB2 HIS 125 -19.146 36.564 -32.003 717 HB3 HIS 125 HB1 HIS 125 -17.974 36.984 -30.754 718 HD2 HIS 125 HD2 HIS 125 -18.032 36.180 -34.526 719 HE1 HIS 125 HE1 HIS 125 -13.977 36.175 -33.349 720 HE2 HIS 125 HE2 HIS 125 -15.551 36.132 -35.341 721 H HIS 126 HN HIS 126 -20.570 34.564 -32.166 722 HA HIS 126 HA HIS 126 -19.474 32.423 -33.887 723 HB2 HIS 126 HB2 HIS 126 -22.252 32.557 -32.690 724 HB3 HIS 126 HB1 HIS 126 -21.671 31.322 -33.806 725 HD2 HIS 126 HD2 HIS 126 -21.795 31.906 -30.043 726 HE1 HIS 126 HE1 HIS 126 -18.783 29.011 -30.651 727 HE2 HIS 126 HE2 HIS 126 -20.230 30.154 -28.905 728 H HIS 127 HN HIS 127 -20.031 32.492 -36.028 729 HA HIS 127 HA HIS 127 -20.990 35.004 -37.050 730 HB2 HIS 127 HB2 HIS 127 -20.548 34.068 -39.231 731 HB3 HIS 127 HB1 HIS 127 -19.223 33.612 -38.161 732 HD2 HIS 127 HD2 HIS 127 -21.912 31.906 -40.344 733 HE1 HIS 127 HE1 HIS 127 -20.152 28.874 -37.993 734 HE2 HIS 127 HE2 HIS 127 -21.699 29.334 -39.953 735 H HIS 128 HN HIS 128 -22.792 35.223 -38.537 736 HA HIS 128 HA HIS 128 -24.974 33.302 -37.981 737 HB2 HIS 128 HB2 HIS 128 -25.207 36.302 -38.335 738 HB3 HIS 128 HB1 HIS 128 -26.539 35.185 -38.038 739 HD2 HIS 128 HD2 HIS 128 -24.075 37.276 -36.008 740 HE1 HIS 128 HE1 HIS 128 -25.562 34.350 -33.352 741 HE2 HIS 128 HE2 HIS 128 -24.239 36.511 -33.517 Start of MODEL 8 1 H1 MET 36 HT1 MET 36 -21.325 1.664 -2.736 2 H2 MET 36 HT2 MET 36 -22.557 1.688 -3.905 3 H3 MET 36 HT3 MET 36 -21.994 3.142 -3.229 4 HA MET 36 HA MET 36 -20.431 3.331 -4.761 5 HB2 MET 36 HB2 MET 36 -18.711 1.570 -4.999 6 HB3 MET 36 HB1 MET 36 -19.045 1.909 -3.301 7 HG2 MET 36 HG2 MET 36 -20.582 -0.030 -3.222 8 HG3 MET 36 HG1 MET 36 -20.214 -0.380 -4.911 9 HE1 MET 36 HE1 MET 36 -17.452 -1.991 -5.408 10 HE2 MET 36 HE2 MET 36 -16.582 -0.503 -5.040 11 HE3 MET 36 HE3 MET 36 -18.159 -0.424 -5.822 12 HA PRO 37 HA PRO 37 -23.310 0.742 -7.522 13 HB2 PRO 37 HB2 PRO 37 -24.566 2.936 -8.629 14 HB3 PRO 37 HB1 PRO 37 -25.188 2.028 -7.237 15 HG2 PRO 37 HG2 PRO 37 -23.670 4.593 -7.305 16 HG3 PRO 37 HG1 PRO 37 -25.034 4.113 -6.278 17 HD2 PRO 37 HD2 PRO 37 -22.491 4.109 -5.351 18 HD3 PRO 37 HD1 PRO 37 -23.686 2.905 -4.812 19 H VAL 38 HN VAL 38 -21.444 3.699 -7.975 20 HA VAL 38 HA VAL 38 -20.334 2.603 -10.450 21 HB VAL 38 HB VAL 38 -22.239 3.991 -11.180 22 HG11 VAL 38 HG11 VAL 38 -20.888 6.484 -10.283 23 HG12 VAL 38 HG12 VAL 38 -21.709 5.546 -9.032 24 HG13 VAL 38 HG13 VAL 38 -22.611 6.125 -10.433 25 HG21 VAL 38 HG21 VAL 38 -19.491 5.172 -11.699 26 HG22 VAL 38 HG22 VAL 38 -20.924 5.522 -12.664 27 HG23 VAL 38 HG23 VAL 38 -20.266 3.885 -12.622 28 H THR 39 HN THR 39 -18.224 3.191 -10.798 29 HA THR 39 HA THR 39 -17.070 5.201 -8.961 30 HB THR 39 HB THR 39 -15.082 3.775 -8.716 31 HG1 THR 39 HG1 THR 39 -16.416 2.372 -10.654 32 HG21 THR 39 HG21 THR 39 -16.791 3.552 -7.019 33 HG22 THR 39 HG22 THR 39 -16.175 1.941 -7.388 34 HG23 THR 39 HG23 THR 39 -17.727 2.463 -8.043 35 H GLU 40 HN GLU 40 -15.256 6.343 -9.762 36 HA GLU 40 HA GLU 40 -15.337 6.947 -12.522 37 HB2 GLU 40 HB2 GLU 40 -14.564 8.535 -10.814 38 HB3 GLU 40 HB1 GLU 40 -13.155 7.516 -10.503 39 HG2 GLU 40 HG2 GLU 40 -12.410 7.803 -12.829 40 HG3 GLU 40 HG1 GLU 40 -13.830 8.790 -13.173 41 H GLN 41 HN GLN 41 -13.033 5.038 -10.590 42 HA GLN 41 HA GLN 41 -11.335 4.383 -12.789 43 HB2 GLN 41 HB2 GLN 41 -11.736 3.072 -10.091 44 HB3 GLN 41 HB1 GLN 41 -10.473 2.618 -11.237 45 HG2 GLN 41 HG2 GLN 41 -10.854 5.386 -10.062 46 HG3 GLN 41 HG1 GLN 41 -9.630 4.224 -9.551 47 HE21 GLN 41 HE21 GLN 41 -9.678 6.974 -11.180 48 HE22 GLN 41 HE22 GLN 41 -8.584 6.647 -12.436 49 H GLY 42 HN GLY 42 -14.038 2.745 -11.194 50 HA2 GLY 42 HA2 GLY 42 -13.913 0.369 -12.771 51 HA3 GLY 42 HA1 GLY 42 -15.272 0.878 -11.768 52 H LEU 43 HN LEU 43 -15.539 3.463 -13.088 53 HA LEU 43 HA LEU 43 -17.417 2.792 -15.060 54 HB2 LEU 43 HB2 LEU 43 -17.468 4.929 -13.846 55 HB3 LEU 43 HB1 LEU 43 -15.972 5.416 -14.644 56 HG LEU 43 HG LEU 43 -17.064 5.279 -16.830 57 HD11 LEU 43 HD11 LEU 43 -19.478 4.832 -16.985 58 HD12 LEU 43 HD12 LEU 43 -19.537 4.548 -15.245 59 HD13 LEU 43 HD13 LEU 43 -18.625 3.453 -16.288 60 HD21 LEU 43 HD21 LEU 43 -19.162 6.879 -15.773 61 HD22 LEU 43 HD22 LEU 43 -17.626 7.433 -16.439 62 HD23 LEU 43 HD23 LEU 43 -17.769 7.098 -14.713 63 H ARG 44 HN ARG 44 -14.039 3.814 -15.346 64 HA ARG 44 HA ARG 44 -13.946 4.091 -18.133 65 HB2 ARG 44 HB2 ARG 44 -12.131 4.799 -16.594 66 HB3 ARG 44 HB1 ARG 44 -11.748 3.103 -16.294 67 HG2 ARG 44 HG2 ARG 44 -11.233 2.761 -18.661 68 HG3 ARG 44 HG1 ARG 44 -11.701 4.422 -19.025 69 HD2 ARG 44 HD2 ARG 44 -9.477 3.670 -17.111 70 HD3 ARG 44 HD1 ARG 44 -9.220 4.102 -18.799 71 HE ARG 44 HE ARG 44 -10.713 6.162 -17.640 72 HH11 ARG 44 HH11 ARG 44 -7.620 4.645 -17.319 73 HH12 ARG 44 HH12 ARG 44 -6.820 6.078 -16.764 74 HH21 ARG 44 HH21 ARG 44 -9.672 8.045 -16.916 75 HH22 ARG 44 HH22 ARG 44 -7.982 8.003 -16.537 76 H GLU 45 HN GLU 45 -13.438 1.240 -16.075 77 HA GLU 45 HA GLU 45 -12.762 -0.550 -18.167 78 HB2 GLU 45 HB2 GLU 45 -13.920 -1.025 -15.413 79 HB3 GLU 45 HB1 GLU 45 -13.403 -2.316 -16.498 80 HG2 GLU 45 HG2 GLU 45 -11.134 -1.396 -16.560 81 HG3 GLU 45 HG1 GLU 45 -11.636 -0.051 -15.532 82 H ARG 46 HN ARG 46 -15.829 0.342 -16.636 83 HA ARG 46 HA ARG 46 -17.443 -1.566 -17.966 84 HB2 ARG 46 HB2 ARG 46 -18.169 -0.374 -15.933 85 HB3 ARG 46 HB1 ARG 46 -18.216 1.137 -16.844 86 HG2 ARG 46 HG2 ARG 46 -19.908 0.199 -18.354 87 HG3 ARG 46 HG1 ARG 46 -19.844 -1.339 -17.493 88 HD2 ARG 46 HD2 ARG 46 -20.608 -0.240 -15.436 89 HD3 ARG 46 HD1 ARG 46 -20.628 1.313 -16.264 90 HE ARG 46 HE ARG 46 -22.613 0.676 -17.325 91 HH11 ARG 46 HH11 ARG 46 -21.105 -1.977 -15.695 92 HH12 ARG 46 HH12 ARG 46 -22.462 -3.038 -15.872 93 HH21 ARG 46 HH21 ARG 46 -24.398 -0.710 -17.563 94 HH22 ARG 46 HH22 ARG 46 -24.327 -2.320 -16.929 95 H ILE 47 HN ILE 47 -16.575 1.790 -18.677 96 HA ILE 47 HA ILE 47 -18.192 2.098 -20.958 97 HB ILE 47 HB ILE 47 -15.614 3.460 -20.166 98 HG12 ILE 47 HG12 ILE 47 -17.552 3.741 -18.645 99 HG13 ILE 47 HG11 ILE 47 -17.116 5.252 -19.445 100 HG21 ILE 47 HG21 ILE 47 -16.216 5.157 -21.824 101 HG22 ILE 47 HG22 ILE 47 -17.665 4.249 -22.259 102 HG23 ILE 47 HG23 ILE 47 -16.068 3.588 -22.615 103 HD11 ILE 47 HD1 ILE 47 -19.301 5.372 -20.040 104 HD12 ILE 47 HD2 ILE 47 -19.586 3.681 -19.631 105 HD13 ILE 47 HD3 ILE 47 -18.919 4.108 -21.207 106 H GLU 48 HN GLU 48 -14.834 1.048 -20.532 107 HA GLU 48 HA GLU 48 -14.139 0.790 -23.252 108 HB2 GLU 48 HB2 GLU 48 -12.489 0.703 -21.440 109 HB3 GLU 48 HB1 GLU 48 -13.180 -0.815 -20.857 110 HG2 GLU 48 HG2 GLU 48 -12.250 -0.534 -23.727 111 HG3 GLU 48 HG1 GLU 48 -11.097 -0.916 -22.443 112 H SER 49 HN SER 49 -15.700 -1.448 -20.987 113 HA SER 49 HA SER 49 -15.918 -3.518 -23.031 114 HB2 SER 49 HB2 SER 49 -16.912 -3.387 -20.176 115 HB3 SER 49 HB1 SER 49 -17.085 -4.786 -21.233 116 HG SER 49 HG SER 49 -15.221 -5.096 -20.107 117 H ALA 50 HN ALA 50 -17.655 -0.768 -22.011 118 HA ALA 50 HA ALA 50 -20.249 -1.854 -22.875 119 HB1 ALA 50 HB1 ALA 50 -21.009 0.501 -22.208 120 HB2 ALA 50 HB2 ALA 50 -19.383 0.719 -21.558 121 HB3 ALA 50 HB3 ALA 50 -20.431 -0.542 -20.908 122 H ILE 51 HN ILE 51 -17.571 -0.361 -24.218 123 HA ILE 51 HA ILE 51 -19.052 0.265 -26.647 124 HB ILE 51 HB ILE 51 -19.084 2.382 -25.380 125 HG12 ILE 51 HG12 ILE 51 -17.090 2.538 -27.666 126 HG13 ILE 51 HG11 ILE 51 -18.825 2.291 -27.905 127 HG21 ILE 51 HG21 ILE 51 -16.310 1.609 -24.917 128 HG22 ILE 51 HG22 ILE 51 -17.302 2.785 -24.055 129 HG23 ILE 51 HG23 ILE 51 -16.442 3.262 -25.518 130 HD11 ILE 51 HD1 ILE 51 -19.367 4.402 -26.975 131 HD12 ILE 51 HD2 ILE 51 -17.976 4.712 -28.017 132 HD13 ILE 51 HD3 ILE 51 -17.762 4.590 -26.268 133 HA PRO 52 HA PRO 52 -15.498 -1.644 -28.423 134 HB2 PRO 52 HB2 PRO 52 -16.084 0.103 -30.764 135 HB3 PRO 52 HB1 PRO 52 -15.968 -1.666 -30.678 136 HG2 PRO 52 HG2 PRO 52 -18.312 -0.444 -30.923 137 HG3 PRO 52 HG1 PRO 52 -18.131 -1.904 -29.927 138 HD2 PRO 52 HD2 PRO 52 -18.381 0.959 -29.069 139 HD3 PRO 52 HD1 PRO 52 -19.042 -0.510 -28.312 140 H GLN 53 HN GLN 53 -13.329 -1.193 -28.666 141 HA GLN 53 HA GLN 53 -12.169 1.052 -27.599 142 HB2 GLN 53 HB2 GLN 53 -10.129 0.425 -28.919 143 HB3 GLN 53 HB1 GLN 53 -10.860 -0.926 -28.043 144 HG2 GLN 53 HG2 GLN 53 -12.058 -1.586 -30.125 145 HG3 GLN 53 HG1 GLN 53 -11.249 -0.279 -30.985 146 HE21 GLN 53 HE21 GLN 53 -9.505 -1.061 -32.162 147 HE22 GLN 53 HE22 GLN 53 -8.480 -2.319 -31.666 148 H VAL 54 HN VAL 54 -13.501 2.809 -28.387 149 HA VAL 54 HA VAL 54 -13.471 3.574 -31.139 150 HB VAL 54 HB VAL 54 -14.486 5.666 -30.335 151 HG11 VAL 54 HG11 VAL 54 -16.424 4.525 -30.220 152 HG12 VAL 54 HG12 VAL 54 -16.014 3.922 -28.616 153 HG13 VAL 54 HG13 VAL 54 -15.499 3.032 -30.050 154 HG21 VAL 54 HG21 VAL 54 -12.981 5.380 -28.127 155 HG22 VAL 54 HG22 VAL 54 -14.474 4.656 -27.529 156 HG23 VAL 54 HG23 VAL 54 -14.474 6.317 -28.124 157 H TYR 55 HN TYR 55 -12.953 6.313 -30.974 158 HA TYR 55 HA TYR 55 -10.195 6.396 -31.516 159 HB2 TYR 55 HB2 TYR 55 -11.717 8.067 -32.421 160 HB3 TYR 55 HB1 TYR 55 -12.090 8.645 -30.796 161 HD1 TYR 55 HD1 TYR 55 -9.300 8.219 -33.236 162 HD2 TYR 55 HD2 TYR 55 -10.720 10.246 -29.726 163 HE1 TYR 55 HE1 TYR 55 -7.341 9.738 -33.320 164 HE2 TYR 55 HE2 TYR 55 -8.762 11.765 -29.810 165 HH TYR 55 HH TYR 55 -6.936 12.266 -32.381 166 H HIS 56 HN HIS 56 -11.996 7.522 -28.647 167 HA HIS 56 HA HIS 56 -10.036 6.744 -26.798 168 HB2 HIS 56 HB2 HIS 56 -8.759 8.573 -27.994 169 HB3 HIS 56 HB1 HIS 56 -9.948 9.714 -27.352 170 HD2 HIS 56 HD2 HIS 56 -9.094 6.923 -24.833 171 HE1 HIS 56 HE1 HIS 56 -6.760 10.268 -23.744 172 HE2 HIS 56 HE2 HIS 56 -7.540 7.966 -23.010 173 H ILE 57 HN ILE 57 -10.850 6.871 -24.751 174 HA ILE 57 HA ILE 57 -13.201 8.611 -24.335 175 HB ILE 57 HB ILE 57 -14.283 6.849 -23.063 176 HG12 ILE 57 HG12 ILE 57 -11.914 5.117 -23.838 177 HG13 ILE 57 HG11 ILE 57 -12.157 5.812 -22.234 178 HG21 ILE 57 HG21 ILE 57 -15.143 6.010 -24.970 179 HG22 ILE 57 HG22 ILE 57 -13.641 5.160 -25.334 180 HG23 ILE 57 HG23 ILE 57 -13.847 6.838 -25.834 181 HD11 ILE 57 HD1 ILE 57 -14.067 4.510 -21.816 182 HD12 ILE 57 HD2 ILE 57 -12.979 3.389 -22.636 183 HD13 ILE 57 HD3 ILE 57 -14.302 4.144 -23.525 184 H ILE 58 HN ILE 58 -13.072 9.850 -22.563 185 HA ILE 58 HA ILE 58 -11.087 9.124 -20.494 186 HB ILE 58 HB ILE 58 -11.778 11.900 -21.483 187 HG12 ILE 58 HG12 ILE 58 -10.412 10.612 -23.087 188 HG13 ILE 58 HG11 ILE 58 -9.452 11.885 -22.331 189 HG21 ILE 58 HG21 ILE 58 -10.564 12.737 -19.747 190 HG22 ILE 58 HG22 ILE 58 -9.399 11.413 -19.798 191 HG23 ILE 58 HG23 ILE 58 -10.944 11.196 -18.977 192 HD11 ILE 58 HD1 ILE 58 -9.180 8.961 -22.127 193 HD12 ILE 58 HD2 ILE 58 -9.094 9.801 -20.579 194 HD13 ILE 58 HD3 ILE 58 -7.975 10.223 -21.876 195 H VAL 59 HN VAL 59 -11.837 9.022 -18.460 196 HA VAL 59 HA VAL 59 -14.525 10.155 -17.939 197 HB VAL 59 HB VAL 59 -13.176 7.765 -16.655 198 HG11 VAL 59 HG11 VAL 59 -14.568 8.421 -14.956 199 HG12 VAL 59 HG12 VAL 59 -15.780 7.611 -15.951 200 HG13 VAL 59 HG13 VAL 59 -15.602 9.365 -16.031 201 HG21 VAL 59 HG21 VAL 59 -14.673 8.053 -19.077 202 HG22 VAL 59 HG22 VAL 59 -15.674 7.179 -17.916 203 HG23 VAL 59 HG23 VAL 59 -14.073 6.568 -18.338 204 H THR 60 HN THR 60 -14.501 11.858 -16.631 205 HA THR 60 HA THR 60 -12.459 11.978 -14.496 206 HB THR 60 HB THR 60 -13.459 14.280 -16.188 207 HG1 THR 60 HG1 THR 60 -10.882 13.125 -15.938 208 HG21 THR 60 HG21 THR 60 -12.191 15.713 -14.838 209 HG22 THR 60 HG22 THR 60 -11.232 14.392 -14.170 210 HG23 THR 60 HG23 THR 60 -12.906 14.614 -13.659 211 H ASP 61 HN ASP 61 -13.260 12.265 -12.507 212 HA ASP 61 HA ASP 61 -16.133 12.758 -12.225 213 HB2 ASP 61 HB2 ASP 61 -15.101 10.871 -11.004 214 HB3 ASP 61 HB1 ASP 61 -14.059 12.011 -10.149 215 H LEU 62 HN LEU 62 -16.666 14.858 -12.231 216 HA LEU 62 HA LEU 62 -14.968 16.978 -11.438 217 HB2 LEU 62 HB2 LEU 62 -17.955 16.801 -11.833 218 HB3 LEU 62 HB1 LEU 62 -17.136 18.305 -11.412 219 HG LEU 62 HG LEU 62 -17.331 18.258 -13.810 220 HD11 LEU 62 HD11 LEU 62 -14.977 18.621 -12.538 221 HD12 LEU 62 HD12 LEU 62 -15.147 18.779 -14.285 222 HD13 LEU 62 HD13 LEU 62 -14.530 17.280 -13.592 223 HD21 LEU 62 HD21 LEU 62 -15.831 15.643 -13.912 224 HD22 LEU 62 HD22 LEU 62 -16.819 16.399 -15.163 225 HD23 LEU 62 HD23 LEU 62 -17.589 15.664 -13.758 226 H SER 63 HN SER 63 -17.511 15.196 -9.753 227 HA SER 63 HA SER 63 -17.414 16.800 -7.383 228 HB2 SER 63 HB2 SER 63 -18.865 15.126 -6.420 229 HB3 SER 63 HB1 SER 63 -19.387 15.427 -8.075 230 HG SER 63 HG SER 63 -17.727 13.307 -7.160 231 H TYR 64 HN TYR 64 -16.846 15.845 -5.228 232 HA TYR 64 HA TYR 64 -14.213 14.558 -5.437 233 HB2 TYR 64 HB2 TYR 64 -15.607 15.975 -3.151 234 HB3 TYR 64 HB1 TYR 64 -14.018 15.215 -3.023 235 HD1 TYR 64 HD1 TYR 64 -15.086 18.285 -2.940 236 HD2 TYR 64 HD2 TYR 64 -12.929 15.845 -5.740 237 HE1 TYR 64 HE1 TYR 64 -14.036 20.317 -3.901 238 HE2 TYR 64 HE2 TYR 64 -11.878 17.876 -6.700 239 HH TYR 64 HH TYR 64 -13.005 20.939 -6.199 240 H GLY 65 HN GLY 65 -13.859 12.515 -4.818 241 HA2 GLY 65 HA2 GLY 65 -14.129 10.517 -3.640 242 HA3 GLY 65 HA1 GLY 65 -15.589 11.177 -2.903 243 H CYS 66 HN CYS 66 -15.718 8.619 -3.720 244 HA CYS 66 HA CYS 66 -16.469 7.172 -5.453 245 HB2 CYS 66 HB2 CYS 66 -18.290 7.971 -3.763 246 HB3 CYS 66 HB1 CYS 66 -18.918 8.884 -5.138 247 HG CYS 66 HG CYS 66 -19.017 5.832 -4.827 248 H GLY 67 HN GLY 67 -18.927 8.304 -6.943 249 HA2 GLY 67 HA2 GLY 67 -17.696 10.081 -8.893 250 HA3 GLY 67 HA1 GLY 67 -18.073 8.460 -9.479 251 H GLN 68 HN GLN 68 -19.769 10.775 -7.346 252 HA GLN 68 HA GLN 68 -22.351 10.080 -8.247 253 HB2 GLN 68 HB2 GLN 68 -21.886 11.263 -6.113 254 HB3 GLN 68 HB1 GLN 68 -21.444 12.702 -7.036 255 HG2 GLN 68 HG2 GLN 68 -23.686 12.798 -8.015 256 HG3 GLN 68 HG1 GLN 68 -24.139 11.321 -7.165 257 HE21 GLN 68 HE21 GLN 68 -25.815 13.243 -6.472 258 HE22 GLN 68 HE22 GLN 68 -25.416 13.983 -4.997 259 H SER 69 HN SER 69 -20.108 12.649 -9.225 260 HA SER 69 HA SER 69 -21.677 12.967 -11.700 261 HB2 SER 69 HB2 SER 69 -22.310 14.821 -10.216 262 HB3 SER 69 HB1 SER 69 -20.612 15.238 -10.005 263 HG SER 69 HG SER 69 -21.965 16.347 -11.712 264 H PHE 70 HN PHE 70 -20.445 12.955 -13.479 265 HA PHE 70 HA PHE 70 -17.670 13.831 -13.399 266 HB2 PHE 70 HB2 PHE 70 -16.820 11.688 -14.310 267 HB3 PHE 70 HB1 PHE 70 -17.471 11.502 -12.679 268 HD1 PHE 70 HD1 PHE 70 -18.064 10.848 -16.268 269 HD2 PHE 70 HD2 PHE 70 -19.530 10.285 -12.269 270 HE1 PHE 70 HE1 PHE 70 -19.668 9.143 -17.092 271 HE2 PHE 70 HE2 PHE 70 -21.131 8.584 -13.096 272 HZ PHE 70 HZ PHE 70 -21.200 8.012 -15.507 273 H ASP 71 HN ASP 71 -16.717 13.992 -15.528 274 HA ASP 71 HA ASP 71 -18.747 14.101 -17.675 275 HB2 ASP 71 HB2 ASP 71 -17.965 16.338 -16.971 276 HB3 ASP 71 HB1 ASP 71 -16.308 15.861 -17.332 277 H ILE 72 HN ILE 72 -18.413 12.362 -18.934 278 HA ILE 72 HA ILE 72 -15.646 11.500 -19.503 279 HB ILE 72 HB ILE 72 -16.680 9.438 -20.338 280 HG12 ILE 72 HG12 ILE 72 -19.330 10.707 -19.591 281 HG13 ILE 72 HG11 ILE 72 -18.720 10.585 -21.246 282 HG21 ILE 72 HG21 ILE 72 -17.052 10.478 -17.636 283 HG22 ILE 72 HG22 ILE 72 -16.525 8.877 -18.154 284 HG23 ILE 72 HG23 ILE 72 -18.246 9.244 -18.041 285 HD11 ILE 72 HD1 ILE 72 -18.726 8.179 -21.150 286 HD12 ILE 72 HD2 ILE 72 -20.299 8.725 -20.570 287 HD13 ILE 72 HD3 ILE 72 -19.070 8.194 -19.421 288 H VAL 73 HN VAL 73 -14.834 11.368 -21.554 289 HA VAL 73 HA VAL 73 -16.423 12.741 -23.631 290 HB VAL 73 HB VAL 73 -13.430 12.703 -23.187 291 HG11 VAL 73 HG11 VAL 73 -13.187 13.926 -25.192 292 HG12 VAL 73 HG12 VAL 73 -14.918 14.240 -25.307 293 HG13 VAL 73 HG13 VAL 73 -14.294 12.619 -25.610 294 HG21 VAL 73 HG21 VAL 73 -14.618 15.303 -23.434 295 HG22 VAL 73 HG22 VAL 73 -13.788 14.608 -22.040 296 HG23 VAL 73 HG23 VAL 73 -15.526 14.384 -22.234 297 H VAL 74 HN VAL 74 -16.880 11.615 -25.415 298 HA VAL 74 HA VAL 74 -15.300 9.172 -25.960 299 HB VAL 74 HB VAL 74 -18.266 9.659 -26.335 300 HG11 VAL 74 HG11 VAL 74 -16.435 7.447 -27.270 301 HG12 VAL 74 HG12 VAL 74 -17.607 8.369 -28.213 302 HG13 VAL 74 HG13 VAL 74 -18.163 7.182 -27.033 303 HG21 VAL 74 HG21 VAL 74 -16.671 8.567 -24.208 304 HG22 VAL 74 HG22 VAL 74 -17.642 7.274 -24.914 305 HG23 VAL 74 HG23 VAL 74 -18.426 8.725 -24.292 306 H VAL 75 HN VAL 75 -14.362 9.078 -27.906 307 HA VAL 75 HA VAL 75 -15.333 10.924 -30.004 308 HB VAL 75 HB VAL 75 -12.493 10.047 -29.443 309 HG11 VAL 75 HG11 VAL 75 -12.219 12.004 -31.230 310 HG12 VAL 75 HG12 VAL 75 -13.824 11.458 -31.720 311 HG13 VAL 75 HG13 VAL 75 -12.466 10.333 -31.739 312 HG21 VAL 75 HG21 VAL 75 -12.671 12.823 -29.425 313 HG22 VAL 75 HG22 VAL 75 -12.573 11.791 -27.998 314 HG23 VAL 75 HG23 VAL 75 -14.145 12.314 -28.603 315 H SER 76 HN SER 76 -16.175 9.886 -31.683 316 HA SER 76 HA SER 76 -14.829 7.625 -32.879 317 HB2 SER 76 HB2 SER 76 -16.612 5.998 -32.604 318 HB3 SER 76 HB1 SER 76 -16.075 6.539 -31.015 319 HG SER 76 HG SER 76 -18.477 6.502 -31.699 320 H ASP 77 HN ASP 77 -15.924 6.919 -34.879 321 HA ASP 77 HA ASP 77 -16.925 9.161 -36.341 322 HB2 ASP 77 HB2 ASP 77 -16.677 6.226 -37.009 323 HB3 ASP 77 HB1 ASP 77 -17.291 7.428 -38.141 324 H PHE 78 HN PHE 78 -18.374 6.948 -34.261 325 HA PHE 78 HA PHE 78 -20.879 6.475 -35.422 326 HB2 PHE 78 HB2 PHE 78 -20.059 5.359 -33.368 327 HB3 PHE 78 HB1 PHE 78 -20.235 6.885 -32.490 328 HD1 PHE 78 HD1 PHE 78 -22.089 4.262 -34.378 329 HD2 PHE 78 HD2 PHE 78 -22.373 7.630 -31.738 330 HE1 PHE 78 HE1 PHE 78 -24.489 3.763 -34.002 331 HE2 PHE 78 HE2 PHE 78 -24.772 7.133 -31.356 332 HZ PHE 78 HZ PHE 78 -25.831 5.198 -32.490 333 H PHE 79 HN PHE 79 -19.536 9.305 -33.903 334 HA PHE 79 HA PHE 79 -22.108 10.636 -33.626 335 HB2 PHE 79 HB2 PHE 79 -20.407 11.128 -31.977 336 HB3 PHE 79 HB1 PHE 79 -19.269 11.600 -33.233 337 HD1 PHE 79 HD1 PHE 79 -22.603 12.451 -31.786 338 HD2 PHE 79 HD2 PHE 79 -19.215 13.816 -34.042 339 HE1 PHE 79 HE1 PHE 79 -23.497 14.762 -31.729 340 HE2 PHE 79 HE2 PHE 79 -20.108 16.128 -33.986 341 HZ PHE 79 HZ PHE 79 -22.250 16.601 -32.830 342 H GLN 80 HN GLN 80 -20.235 9.912 -36.212 343 HA GLN 80 HA GLN 80 -20.308 12.458 -37.588 344 HB2 GLN 80 HB2 GLN 80 -19.639 9.648 -38.484 345 HB3 GLN 80 HB1 GLN 80 -19.584 11.048 -39.557 346 HG2 GLN 80 HG2 GLN 80 -17.929 12.127 -38.135 347 HG3 GLN 80 HG1 GLN 80 -18.049 10.825 -36.952 348 HE21 GLN 80 HE21 GLN 80 -15.649 11.680 -38.553 349 HE22 GLN 80 HE22 GLN 80 -15.164 10.294 -39.406 350 H GLY 81 HN GLY 81 -21.988 13.257 -38.664 351 HA2 GLY 81 HA2 GLY 81 -23.851 13.308 -40.062 352 HA3 GLY 81 HA1 GLY 81 -23.845 11.544 -40.085 353 H LYS 82 HN LYS 82 -23.585 12.443 -36.928 354 HA LYS 82 HA LYS 82 -26.505 12.551 -36.516 355 HB2 LYS 82 HB2 LYS 82 -24.496 10.814 -35.076 356 HB3 LYS 82 HB1 LYS 82 -26.140 11.091 -34.498 357 HG2 LYS 82 HG2 LYS 82 -27.034 10.202 -36.626 358 HG3 LYS 82 HG1 LYS 82 -25.387 9.906 -37.188 359 HD2 LYS 82 HD2 LYS 82 -25.003 8.343 -35.350 360 HD3 LYS 82 HD1 LYS 82 -26.604 8.683 -34.694 361 HE2 LYS 82 HE2 LYS 82 -26.676 6.605 -35.978 362 HE3 LYS 82 HE1 LYS 82 -27.615 7.847 -36.807 363 HZ1 LYS 82 HZ1 LYS 82 -24.831 7.792 -37.543 364 HZ2 LYS 82 HZ2 LYS 82 -26.215 7.864 -38.527 365 HZ3 LYS 82 HZ3 LYS 82 -25.664 6.369 -37.938 366 H SER 83 HN SER 83 -27.207 13.667 -34.677 367 HA SER 83 HA SER 83 -25.451 15.796 -33.831 368 HB2 SER 83 HB2 SER 83 -27.789 16.301 -34.231 369 HB3 SER 83 HB1 SER 83 -28.290 15.091 -33.053 370 HG SER 83 HG SER 83 -27.712 17.622 -32.627 371 H LYS 84 HN LYS 84 -25.421 16.371 -31.437 372 HA LYS 84 HA LYS 84 -24.050 14.384 -30.002 373 HB2 LYS 84 HB2 LYS 84 -23.799 16.800 -29.570 374 HB3 LYS 84 HB1 LYS 84 -25.435 16.844 -28.911 375 HG2 LYS 84 HG2 LYS 84 -24.796 15.239 -27.168 376 HG3 LYS 84 HG1 LYS 84 -23.169 15.135 -27.842 377 HD2 LYS 84 HD2 LYS 84 -22.852 17.557 -27.421 378 HD3 LYS 84 HD1 LYS 84 -24.465 17.633 -26.712 379 HE2 LYS 84 HE2 LYS 84 -22.207 15.881 -25.701 380 HE3 LYS 84 HE1 LYS 84 -22.702 17.410 -24.977 381 HZ1 LYS 84 HZ1 LYS 84 -23.663 15.106 -24.170 382 HZ2 LYS 84 HZ2 LYS 84 -24.773 15.401 -25.422 383 HZ3 LYS 84 HZ3 LYS 84 -24.598 16.520 -24.155 384 H LEU 85 HN LEU 85 -27.433 15.393 -29.958 385 HA LEU 85 HA LEU 85 -28.264 13.980 -27.674 386 HB2 LEU 85 HB2 LEU 85 -29.725 14.761 -30.206 387 HB3 LEU 85 HB1 LEU 85 -30.530 14.024 -28.821 388 HG LEU 85 HG LEU 85 -28.849 16.534 -28.612 389 HD11 LEU 85 HD11 LEU 85 -31.489 17.269 -28.238 390 HD12 LEU 85 HD12 LEU 85 -31.593 16.133 -29.583 391 HD13 LEU 85 HD13 LEU 85 -30.555 17.554 -29.706 392 HD21 LEU 85 HD21 LEU 85 -30.280 14.765 -26.775 393 HD22 LEU 85 HD22 LEU 85 -30.790 16.448 -26.619 394 HD23 LEU 85 HD23 LEU 85 -29.090 16.019 -26.420 395 H MET 86 HN MET 86 -28.031 12.993 -31.074 396 HA MET 86 HA MET 86 -29.179 10.414 -30.729 397 HB2 MET 86 HB2 MET 86 -27.246 11.462 -32.816 398 HB3 MET 86 HB1 MET 86 -28.087 9.914 -32.911 399 HG2 MET 86 HG2 MET 86 -30.265 11.148 -32.730 400 HG3 MET 86 HG1 MET 86 -29.361 12.656 -32.793 401 HE1 MET 86 HE1 MET 86 -31.643 12.076 -35.138 402 HE2 MET 86 HE2 MET 86 -30.649 13.046 -36.221 403 HE3 MET 86 HE3 MET 86 -30.718 13.447 -34.507 404 H ARG 87 HN ARG 87 -25.862 11.642 -30.552 405 HA ARG 87 HA ARG 87 -24.524 9.170 -30.382 406 HB2 ARG 87 HB2 ARG 87 -23.357 11.296 -30.759 407 HB3 ARG 87 HB1 ARG 87 -23.772 11.824 -29.130 408 HG2 ARG 87 HG2 ARG 87 -21.518 10.944 -29.075 409 HG3 ARG 87 HG1 ARG 87 -22.568 9.790 -28.256 410 HD2 ARG 87 HD2 ARG 87 -22.725 8.478 -30.349 411 HD3 ARG 87 HD1 ARG 87 -21.617 9.611 -31.127 412 HE ARG 87 HE ARG 87 -19.854 8.664 -29.909 413 HH11 ARG 87 HH11 ARG 87 -22.942 7.523 -28.843 414 HH12 ARG 87 HH12 ARG 87 -22.290 6.251 -27.865 415 HH21 ARG 87 HH21 ARG 87 -18.990 6.997 -28.627 416 HH22 ARG 87 HH22 ARG 87 -20.053 5.953 -27.743 417 H SER 88 HN SER 88 -25.903 11.269 -27.875 418 HA SER 88 HA SER 88 -25.049 9.800 -25.634 419 HB2 SER 88 HB2 SER 88 -27.470 11.562 -26.042 420 HB3 SER 88 HB1 SER 88 -26.999 10.897 -24.480 421 HG SER 88 HG SER 88 -25.829 12.889 -26.023 422 H ARG 89 HN ARG 89 -27.902 9.493 -27.707 423 HA ARG 89 HA ARG 89 -29.312 7.603 -26.166 424 HB2 ARG 89 HB2 ARG 89 -30.280 8.812 -28.100 425 HB3 ARG 89 HB1 ARG 89 -29.236 7.891 -29.183 426 HG2 ARG 89 HG2 ARG 89 -31.424 6.830 -29.128 427 HG3 ARG 89 HG1 ARG 89 -30.268 5.785 -28.299 428 HD2 ARG 89 HD2 ARG 89 -30.999 6.672 -26.129 429 HD3 ARG 89 HD1 ARG 89 -32.125 7.756 -26.942 430 HE ARG 89 HE ARG 89 -32.764 5.198 -27.815 431 HH11 ARG 89 HH11 ARG 89 -32.546 6.917 -24.819 432 HH12 ARG 89 HH12 ARG 89 -33.794 5.999 -24.043 433 HH21 ARG 89 HH21 ARG 89 -34.404 3.994 -26.806 434 HH22 ARG 89 HH22 ARG 89 -34.846 4.345 -25.168 435 H ALA 90 HN ALA 90 -26.936 7.160 -28.795 436 HA ALA 90 HA ALA 90 -27.008 4.326 -28.786 437 HB1 ALA 90 HB1 ALA 90 -24.574 5.931 -29.526 438 HB2 ALA 90 HB2 ALA 90 -26.012 5.937 -30.545 439 HB3 ALA 90 HB3 ALA 90 -25.160 4.425 -30.231 440 H VAL 91 HN VAL 91 -24.906 6.663 -27.141 441 HA VAL 91 HA VAL 91 -23.266 4.689 -25.893 442 HB VAL 91 HB VAL 91 -22.761 7.199 -26.315 443 HG11 VAL 91 HG11 VAL 91 -24.745 8.050 -25.138 444 HG12 VAL 91 HG12 VAL 91 -23.271 8.630 -24.368 445 HG13 VAL 91 HG13 VAL 91 -24.189 7.310 -23.641 446 HG21 VAL 91 HG21 VAL 91 -21.652 7.053 -23.791 447 HG22 VAL 91 HG22 VAL 91 -20.969 6.308 -25.236 448 HG23 VAL 91 HG23 VAL 91 -21.984 5.359 -24.150 449 H ASN 92 HN ASN 92 -26.188 6.410 -24.991 450 HA ASN 92 HA ASN 92 -26.244 5.759 -22.257 451 HB2 ASN 92 HB2 ASN 92 -28.450 6.328 -24.239 452 HB3 ASN 92 HB1 ASN 92 -28.745 6.080 -22.518 453 HD21 ASN 92 HD21 ASN 92 -29.287 8.593 -23.825 454 HD22 ASN 92 HD22 ASN 92 -28.221 9.749 -23.188 455 H LYS 93 HN LYS 93 -27.411 4.017 -25.112 456 HA LYS 93 HA LYS 93 -28.766 1.952 -23.751 457 HB2 LYS 93 HB2 LYS 93 -27.414 2.023 -26.453 458 HB3 LYS 93 HB1 LYS 93 -28.365 0.651 -25.880 459 HG2 LYS 93 HG2 LYS 93 -30.320 2.125 -25.585 460 HG3 LYS 93 HG1 LYS 93 -29.374 3.499 -26.157 461 HD2 LYS 93 HD2 LYS 93 -29.036 2.369 -28.325 462 HD3 LYS 93 HD1 LYS 93 -29.981 0.993 -27.755 463 HE2 LYS 93 HE2 LYS 93 -31.944 2.456 -27.458 464 HE3 LYS 93 HE1 LYS 93 -31.001 3.837 -28.020 465 HZ1 LYS 93 HZ1 LYS 93 -30.613 2.016 -29.972 466 HZ2 LYS 93 HZ2 LYS 93 -31.761 3.267 -30.024 467 HZ3 LYS 93 HZ3 LYS 93 -32.221 1.709 -29.527 468 H ALA 94 HN ALA 94 -25.385 2.284 -24.774 469 HA ALA 94 HA ALA 94 -24.556 -0.323 -24.071 470 HB1 ALA 94 HB1 ALA 94 -23.323 2.112 -24.962 471 HB2 ALA 94 HB2 ALA 94 -22.693 0.466 -25.033 472 HB3 ALA 94 HB3 ALA 94 -22.404 1.461 -23.605 473 H VAL 95 HN VAL 95 -24.751 2.693 -22.251 474 HA VAL 95 HA VAL 95 -24.276 1.160 -19.768 475 HB VAL 95 HB VAL 95 -23.255 3.202 -18.824 476 HG11 VAL 95 HG11 VAL 95 -21.241 2.521 -19.587 477 HG12 VAL 95 HG12 VAL 95 -21.638 2.961 -21.250 478 HG13 VAL 95 HG13 VAL 95 -22.139 1.396 -20.607 479 HG21 VAL 95 HG21 VAL 95 -22.739 5.090 -20.285 480 HG22 VAL 95 HG22 VAL 95 -24.478 4.799 -20.313 481 HG23 VAL 95 HG23 VAL 95 -23.472 4.263 -21.660 482 H LYS 96 HN LYS 96 -26.818 1.388 -20.789 483 HA LYS 96 HA LYS 96 -28.283 3.645 -19.973 484 HB2 LYS 96 HB2 LYS 96 -29.140 1.879 -21.502 485 HB3 LYS 96 HB1 LYS 96 -29.246 0.778 -20.128 486 HG2 LYS 96 HG2 LYS 96 -30.802 2.319 -19.000 487 HG3 LYS 96 HG1 LYS 96 -30.693 3.433 -20.363 488 HD2 LYS 96 HD2 LYS 96 -31.595 0.559 -20.660 489 HD3 LYS 96 HD1 LYS 96 -32.716 1.895 -20.390 490 HE2 LYS 96 HE2 LYS 96 -31.763 3.028 -22.416 491 HE3 LYS 96 HE1 LYS 96 -30.802 1.579 -22.718 492 HZ1 LYS 96 HZ1 LYS 96 -33.759 1.590 -22.473 493 HZ2 LYS 96 HZ2 LYS 96 -32.775 0.289 -22.951 494 HZ3 LYS 96 HZ3 LYS 96 -32.931 1.653 -23.952 495 H GLU 97 HN GLU 97 -27.443 0.652 -18.273 496 HA GLU 97 HA GLU 97 -28.997 1.065 -15.963 497 HB2 GLU 97 HB2 GLU 97 -26.389 -0.408 -16.399 498 HB3 GLU 97 HB1 GLU 97 -27.277 -0.444 -14.875 499 HG2 GLU 97 HG2 GLU 97 -28.461 -1.228 -17.552 500 HG3 GLU 97 HG1 GLU 97 -27.813 -2.376 -16.381 501 H GLU 98 HN GLU 98 -25.696 2.084 -16.784 502 HA GLU 98 HA GLU 98 -25.091 3.234 -14.256 503 HB2 GLU 98 HB2 GLU 98 -23.970 3.696 -17.025 504 HB3 GLU 98 HB1 GLU 98 -23.327 4.477 -15.580 505 HG2 GLU 98 HG2 GLU 98 -23.601 1.478 -15.929 506 HG3 GLU 98 HG1 GLU 98 -22.109 2.382 -16.178 507 H LEU 99 HN LEU 99 -26.484 4.528 -17.246 508 HA LEU 99 HA LEU 99 -26.520 7.248 -16.475 509 HB2 LEU 99 HB2 LEU 99 -26.847 6.491 -18.800 510 HB3 LEU 99 HB1 LEU 99 -28.389 5.781 -18.329 511 HG LEU 99 HG LEU 99 -27.841 8.678 -17.765 512 HD11 LEU 99 HD11 LEU 99 -27.485 7.897 -20.275 513 HD12 LEU 99 HD12 LEU 99 -28.392 9.365 -19.912 514 HD13 LEU 99 HD13 LEU 99 -29.247 7.868 -20.283 515 HD21 LEU 99 HD21 LEU 99 -30.227 6.871 -18.058 516 HD22 LEU 99 HD22 LEU 99 -30.406 8.611 -18.288 517 HD23 LEU 99 HD23 LEU 99 -29.828 7.981 -16.747 518 H GLN 100 HN GLN 100 -28.898 4.638 -16.103 519 HA GLN 100 HA GLN 100 -30.992 6.203 -15.044 520 HB2 GLN 100 HB2 GLN 100 -30.280 3.287 -14.670 521 HB3 GLN 100 HB1 GLN 100 -31.766 4.010 -14.055 522 HG2 GLN 100 HG2 GLN 100 -32.394 4.690 -16.331 523 HG3 GLN 100 HG1 GLN 100 -30.892 4.015 -16.959 524 HE21 GLN 100 HE21 GLN 100 -32.956 2.856 -18.164 525 HE22 GLN 100 HE22 GLN 100 -33.354 1.346 -17.496 526 H GLU 101 HN GLU 101 -28.265 4.554 -13.514 527 HA GLU 101 HA GLU 101 -29.076 5.226 -10.837 528 HB2 GLU 101 HB2 GLU 101 -27.675 3.251 -11.305 529 HB3 GLU 101 HB1 GLU 101 -26.385 4.310 -11.877 530 HG2 GLU 101 HG2 GLU 101 -25.914 3.740 -9.579 531 HG3 GLU 101 HG1 GLU 101 -26.402 5.432 -9.627 532 H ILE 102 HN ILE 102 -27.029 6.642 -13.322 533 HA ILE 102 HA ILE 102 -26.348 8.843 -11.445 534 HB ILE 102 HB ILE 102 -24.950 7.968 -13.992 535 HG12 ILE 102 HG12 ILE 102 -23.984 7.801 -11.123 536 HG13 ILE 102 HG11 ILE 102 -24.769 6.452 -11.946 537 HG21 ILE 102 HG21 ILE 102 -24.917 10.429 -12.520 538 HG22 ILE 102 HG22 ILE 102 -23.943 9.982 -13.921 539 HG23 ILE 102 HG23 ILE 102 -23.364 9.624 -12.293 540 HD11 ILE 102 HD1 ILE 102 -22.733 5.901 -12.736 541 HD12 ILE 102 HD2 ILE 102 -22.037 7.433 -12.208 542 HD13 ILE 102 HD3 ILE 102 -22.852 7.324 -13.770 543 H HIS 103 HN HIS 103 -27.356 10.712 -11.780 544 HA HIS 103 HA HIS 103 -28.481 11.247 -14.464 545 HB2 HIS 103 HB2 HIS 103 -29.396 12.199 -11.739 546 HB3 HIS 103 HB1 HIS 103 -30.092 12.729 -13.273 547 HD2 HIS 103 HD2 HIS 103 -31.772 10.831 -14.534 548 HE1 HIS 103 HE1 HIS 103 -31.466 7.873 -11.539 549 HE2 HIS 103 HE2 HIS 103 -32.686 8.547 -13.660 550 H ALA 104 HN ALA 104 -25.866 11.968 -12.742 551 HA ALA 104 HA ALA 104 -25.813 14.779 -13.661 552 HB1 ALA 104 HB1 ALA 104 -25.814 14.953 -11.314 553 HB2 ALA 104 HB2 ALA 104 -24.108 15.061 -11.747 554 HB3 ALA 104 HB3 ALA 104 -24.765 13.548 -11.120 555 H PHE 105 HN PHE 105 -25.057 13.110 -15.540 556 HA PHE 105 HA PHE 105 -22.139 13.438 -15.590 557 HB2 PHE 105 HB2 PHE 105 -21.695 11.184 -16.243 558 HB3 PHE 105 HB1 PHE 105 -22.718 11.085 -14.811 559 HD1 PHE 105 HD1 PHE 105 -22.467 10.449 -18.388 560 HD2 PHE 105 HD2 PHE 105 -25.157 10.571 -15.041 561 HE1 PHE 105 HE1 PHE 105 -24.136 9.157 -19.687 562 HE2 PHE 105 HE2 PHE 105 -26.826 9.277 -16.346 563 HZ PHE 105 HZ PHE 105 -26.313 8.570 -18.663 564 H SER 106 HN SER 106 -21.270 13.320 -17.773 565 HA SER 106 HA SER 106 -23.299 13.603 -19.904 566 HB2 SER 106 HB2 SER 106 -20.883 15.383 -19.500 567 HB3 SER 106 HB1 SER 106 -21.995 15.455 -20.862 568 HG SER 106 HG SER 106 -22.694 16.941 -19.377 569 H CYS 107 HN CYS 107 -22.641 12.936 -21.966 570 HA CYS 107 HA CYS 107 -20.288 11.176 -21.962 571 HB2 CYS 107 HB2 CYS 107 -21.323 10.215 -24.024 572 HB3 CYS 107 HB1 CYS 107 -22.316 10.046 -22.575 573 HG CYS 107 HG CYS 107 -23.228 12.559 -23.774 574 H LYS 108 HN LYS 108 -20.242 14.149 -22.310 575 HA LYS 108 HA LYS 108 -19.941 15.467 -24.478 576 HB2 LYS 108 HB2 LYS 108 -18.600 15.945 -22.418 577 HB3 LYS 108 HB1 LYS 108 -17.393 14.793 -22.994 578 HG2 LYS 108 HG2 LYS 108 -17.040 16.109 -25.015 579 HG3 LYS 108 HG1 LYS 108 -18.320 17.226 -24.544 580 HD2 LYS 108 HD2 LYS 108 -17.034 17.820 -22.509 581 HD3 LYS 108 HD1 LYS 108 -15.738 16.742 -23.029 582 HE2 LYS 108 HE2 LYS 108 -16.760 19.119 -24.606 583 HE3 LYS 108 HE1 LYS 108 -15.281 19.101 -23.644 584 HZ1 LYS 108 HZ1 LYS 108 -14.726 18.653 -25.908 585 HZ2 LYS 108 HZ2 LYS 108 -15.891 17.420 -26.014 586 HZ3 LYS 108 HZ3 LYS 108 -14.522 17.217 -25.028 587 H CYS 109 HN CYS 109 -20.273 14.144 -26.317 588 HA CYS 109 HA CYS 109 -17.887 12.651 -27.230 589 HB2 CYS 109 HB2 CYS 109 -19.899 11.252 -26.946 590 HB3 CYS 109 HB1 CYS 109 -20.781 12.306 -28.055 591 HG CYS 109 HG CYS 109 -18.942 10.086 -28.904 592 H TYR 110 HN TYR 110 -16.855 13.361 -28.983 593 HA TYR 110 HA TYR 110 -18.264 14.998 -30.956 594 HB2 TYR 110 HB2 TYR 110 -16.536 16.739 -30.916 595 HB3 TYR 110 HB1 TYR 110 -17.327 16.615 -29.341 596 HD1 TYR 110 HD1 TYR 110 -14.248 15.911 -31.250 597 HD2 TYR 110 HD2 TYR 110 -16.159 15.703 -27.408 598 HE1 TYR 110 HE1 TYR 110 -12.055 15.461 -30.183 599 HE2 TYR 110 HE2 TYR 110 -13.965 15.255 -26.343 600 HH TYR 110 HH TYR 110 -11.057 14.733 -28.273 601 H THR 111 HN THR 111 -16.937 15.353 -32.919 602 HA THR 111 HA THR 111 -14.779 13.387 -33.264 603 HB THR 111 HB THR 111 -15.742 12.602 -35.369 604 HG1 THR 111 HG1 THR 111 -17.071 14.737 -35.341 605 HG21 THR 111 HG21 THR 111 -17.763 11.450 -34.372 606 HG22 THR 111 HG22 THR 111 -17.528 12.443 -32.932 607 HG23 THR 111 HG23 THR 111 -16.283 11.297 -33.426 608 H GLU 112 HN GLU 112 -15.193 16.438 -33.169 609 HA GLU 112 HA GLU 112 -13.716 18.038 -34.080 610 HB2 GLU 112 HB2 GLU 112 -12.574 16.111 -35.315 611 HB3 GLU 112 HB1 GLU 112 -13.701 16.433 -36.633 612 HG2 GLU 112 HG2 GLU 112 -11.709 17.676 -37.103 613 HG3 GLU 112 HG1 GLU 112 -12.931 18.835 -36.580 614 H GLU 113 HN GLU 113 -16.696 16.866 -34.998 615 HA GLU 113 HA GLU 113 -17.381 18.499 -37.200 616 HB2 GLU 113 HB2 GLU 113 -19.050 17.258 -35.012 617 HB3 GLU 113 HB1 GLU 113 -19.735 18.150 -36.375 618 HG2 GLU 113 HG2 GLU 113 -17.865 15.782 -36.678 619 HG3 GLU 113 HG1 GLU 113 -19.623 15.646 -36.727 620 H GLU 114 HN GLU 114 -17.483 19.041 -33.710 621 HA GLU 114 HA GLU 114 -18.936 21.438 -33.676 622 HB2 GLU 114 HB2 GLU 114 -16.725 20.435 -31.869 623 HB3 GLU 114 HB1 GLU 114 -17.686 21.877 -31.531 624 HG2 GLU 114 HG2 GLU 114 -19.739 20.546 -31.541 625 HG3 GLU 114 HG1 GLU 114 -18.825 19.101 -31.964 626 H TRP 115 HN TRP 115 -15.713 20.746 -34.711 627 HA TRP 115 HA TRP 115 -14.596 23.348 -34.443 628 HB2 TRP 115 HB2 TRP 115 -12.739 22.437 -35.391 629 HB3 TRP 115 HB1 TRP 115 -13.580 20.914 -35.087 630 HD1 TRP 115 HD1 TRP 115 -15.662 20.788 -37.314 631 HE1 TRP 115 HE1 TRP 115 -15.000 20.632 -39.800 632 HE3 TRP 115 HE3 TRP 115 -10.921 22.663 -37.077 633 HZ2 TRP 115 HZ2 TRP 115 -12.753 21.226 -41.467 634 HZ3 TRP 115 HZ3 TRP 115 -9.543 22.859 -39.127 635 HH2 TRP 115 HH2 TRP 115 -10.453 22.144 -41.320 636 H SER 116 HN SER 116 -17.197 22.415 -36.200 637 HA SER 116 HA SER 116 -17.051 23.187 -38.755 638 HB2 SER 116 HB2 SER 116 -19.171 22.570 -37.804 639 HB3 SER 116 HB1 SER 116 -19.173 23.995 -36.770 640 HG SER 116 HG SER 116 -20.233 24.823 -38.399 641 H LYS 117 HN LYS 117 -18.666 25.738 -37.113 642 HA LYS 117 HA LYS 117 -17.387 27.781 -38.571 643 HB2 LYS 117 HB2 LYS 117 -19.636 28.007 -37.566 644 HB3 LYS 117 HB1 LYS 117 -18.904 28.008 -35.962 645 HG2 LYS 117 HG2 LYS 117 -17.626 30.025 -36.514 646 HG3 LYS 117 HG1 LYS 117 -18.295 30.019 -38.147 647 HD2 LYS 117 HD2 LYS 117 -20.569 30.272 -37.216 648 HD3 LYS 117 HD1 LYS 117 -19.897 30.297 -35.585 649 HE2 LYS 117 HE2 LYS 117 -18.592 32.313 -36.151 650 HE3 LYS 117 HE1 LYS 117 -19.256 32.287 -37.784 651 HZ1 LYS 117 HZ1 LYS 117 -20.661 33.736 -36.722 652 HZ2 LYS 117 HZ2 LYS 117 -20.596 32.904 -35.242 653 HZ3 LYS 117 HZ3 LYS 117 -21.507 32.277 -36.531 654 H ILE 118 HN ILE 118 -16.920 26.642 -35.240 655 HA ILE 118 HA ILE 118 -14.870 28.558 -34.644 656 HB ILE 118 HB ILE 118 -14.531 27.195 -32.611 657 HG12 ILE 118 HG12 ILE 118 -16.660 25.378 -33.780 658 HG13 ILE 118 HG11 ILE 118 -14.936 25.002 -33.792 659 HG21 ILE 118 HG21 ILE 118 -17.305 27.955 -33.498 660 HG22 ILE 118 HG22 ILE 118 -16.256 28.758 -32.329 661 HG23 ILE 118 HG23 ILE 118 -17.048 27.241 -31.906 662 HD11 ILE 118 HD1 ILE 118 -16.316 24.044 -31.852 663 HD12 ILE 118 HD2 ILE 118 -16.390 25.699 -31.244 664 HD13 ILE 118 HD3 ILE 118 -14.831 24.896 -31.427 665 H VAL 119 HN VAL 119 -12.698 28.397 -34.863 666 HA VAL 119 HA VAL 119 -11.652 25.883 -36.021 667 HB VAL 119 HB VAL 119 -10.686 28.725 -36.437 668 HG11 VAL 119 HG11 VAL 119 -9.388 27.367 -38.304 669 HG12 VAL 119 HG12 VAL 119 -9.612 26.026 -37.181 670 HG13 VAL 119 HG13 VAL 119 -8.742 27.471 -36.666 671 HG21 VAL 119 HG21 VAL 119 -11.526 27.112 -38.743 672 HG22 VAL 119 HG22 VAL 119 -11.939 28.775 -38.328 673 HG23 VAL 119 HG23 VAL 119 -12.836 27.437 -37.609 674 H VAL 120 HN VAL 120 -10.240 24.825 -34.803 675 HA VAL 120 HA VAL 120 -8.831 26.303 -32.667 676 HB VAL 120 HB VAL 120 -10.398 24.658 -31.775 677 HG11 VAL 120 HG11 VAL 120 -8.806 22.461 -33.070 678 HG12 VAL 120 HG12 VAL 120 -10.117 23.233 -33.964 679 HG13 VAL 120 HG13 VAL 120 -10.452 22.418 -32.437 680 HG21 VAL 120 HG21 VAL 120 -8.910 23.709 -30.247 681 HG22 VAL 120 HG22 VAL 120 -7.927 25.012 -30.915 682 HG23 VAL 120 HG23 VAL 120 -7.705 23.358 -31.486 683 H LEU 121 HN LEU 121 -8.514 24.301 -35.456 684 HA LEU 121 HA LEU 121 -5.953 23.212 -35.018 685 HB2 LEU 121 HB2 LEU 121 -7.420 22.437 -36.821 686 HB3 LEU 121 HB1 LEU 121 -7.278 24.003 -37.622 687 HG LEU 121 HG LEU 121 -4.840 23.677 -37.833 688 HD11 LEU 121 HD11 LEU 121 -4.652 20.879 -37.318 689 HD12 LEU 121 HD12 LEU 121 -5.359 21.635 -35.890 690 HD13 LEU 121 HD13 LEU 121 -3.802 22.192 -36.501 691 HD21 LEU 121 HD21 LEU 121 -5.284 22.675 -39.803 692 HD22 LEU 121 HD22 LEU 121 -6.887 22.260 -39.196 693 HD23 LEU 121 HD23 LEU 121 -5.547 21.132 -38.990 694 H GLU 122 HN GLU 122 -6.992 26.265 -36.506 695 HA GLU 122 HA GLU 122 -4.234 27.099 -36.924 696 HB2 GLU 122 HB2 GLU 122 -6.892 28.454 -37.429 697 HB3 GLU 122 HB1 GLU 122 -5.332 29.203 -37.769 698 HG2 GLU 122 HG2 GLU 122 -4.757 27.407 -39.311 699 HG3 GLU 122 HG1 GLU 122 -6.246 26.550 -38.916 700 H HIS 123 HN HIS 123 -3.318 27.353 -34.912 701 HA HIS 123 HA HIS 123 -4.557 28.639 -32.713 702 HB2 HIS 123 HB2 HIS 123 -1.668 28.093 -33.394 703 HB3 HIS 123 HB1 HIS 123 -2.161 28.866 -31.887 704 HD2 HIS 123 HD2 HIS 123 -3.209 27.117 -29.965 705 HE1 HIS 123 HE1 HIS 123 -3.185 23.638 -32.357 706 HE2 HIS 123 HE2 HIS 123 -3.567 24.530 -30.010 707 H HIS 124 HN HIS 124 -2.479 29.801 -35.324 708 HA HIS 124 HA HIS 124 -2.073 32.419 -34.329 709 HB2 HIS 124 HB2 HIS 124 -2.073 31.347 -37.161 710 HB3 HIS 124 HB1 HIS 124 -1.549 32.970 -36.715 711 HD2 HIS 124 HD2 HIS 124 -0.092 29.427 -36.888 712 HE1 HIS 124 HE1 HIS 124 2.591 31.694 -34.545 713 HE2 HIS 124 HE2 HIS 124 2.267 29.493 -35.770 714 H HIS 125 HN HIS 125 -4.578 30.993 -36.381 715 HA HIS 125 HA HIS 125 -5.906 33.455 -36.960 716 HB2 HIS 125 HB2 HIS 125 -6.224 31.529 -38.403 717 HB3 HIS 125 HB1 HIS 125 -6.875 30.589 -37.061 718 HD2 HIS 125 HD2 HIS 125 -9.619 30.835 -36.780 719 HE1 HIS 125 HE1 HIS 125 -10.138 34.303 -39.133 720 HE2 HIS 125 HE2 HIS 125 -11.346 32.502 -37.811 721 H HIS 126 HN HIS 126 -7.334 34.577 -35.781 722 HA HIS 126 HA HIS 126 -8.467 33.288 -33.369 723 HB2 HIS 126 HB2 HIS 126 -7.493 36.136 -33.695 724 HB3 HIS 126 HB1 HIS 126 -8.356 35.527 -32.285 725 HD2 HIS 126 HD2 HIS 126 -6.803 33.940 -30.538 726 HE1 HIS 126 HE1 HIS 126 -3.210 34.181 -32.741 727 HE2 HIS 126 HE2 HIS 126 -4.243 33.420 -30.550 728 H HIS 127 HN HIS 127 -10.597 33.772 -32.858 729 HA HIS 127 HA HIS 127 -12.073 35.658 -34.532 730 HB2 HIS 127 HB2 HIS 127 -13.731 34.009 -35.223 731 HB3 HIS 127 HB1 HIS 127 -12.134 33.518 -35.788 732 HD2 HIS 127 HD2 HIS 127 -14.981 32.133 -33.598 733 HE1 HIS 127 HE1 HIS 127 -11.638 29.639 -32.939 734 HE2 HIS 127 HE2 HIS 127 -14.135 29.895 -32.550 735 H HIS 128 HN HIS 128 -14.329 35.919 -33.764 736 HA HIS 128 HA HIS 128 -14.638 35.182 -30.919 737 HB2 HIS 128 HB2 HIS 128 -13.917 37.523 -31.051 738 HB3 HIS 128 HB1 HIS 128 -15.237 37.876 -32.167 739 HD2 HIS 128 HD2 HIS 128 -17.592 38.583 -30.894 740 HE1 HIS 128 HE1 HIS 128 -16.621 37.166 -27.038 741 HE2 HIS 128 HE2 HIS 128 -18.360 38.414 -28.404 Start of MODEL 9 1 H1 MET 36 HT1 MET 36 -28.192 -3.225 -5.778 2 H2 MET 36 HT2 MET 36 -27.921 -1.549 -5.812 3 H3 MET 36 HT3 MET 36 -26.938 -2.551 -4.856 4 HA MET 36 HA MET 36 -25.991 -3.584 -6.781 5 HB2 MET 36 HB2 MET 36 -27.362 -1.700 -8.630 6 HB3 MET 36 HB1 MET 36 -26.854 -3.368 -8.896 7 HG2 MET 36 HG2 MET 36 -29.213 -2.528 -7.185 8 HG3 MET 36 HG1 MET 36 -29.332 -3.148 -8.832 9 HE1 MET 36 HE1 MET 36 -30.890 -5.679 -7.831 10 HE2 MET 36 HE2 MET 36 -30.962 -4.105 -7.044 11 HE3 MET 36 HE3 MET 36 -30.661 -5.549 -6.082 12 HA PRO 37 HA PRO 37 -23.969 0.486 -5.881 13 HB2 PRO 37 HB2 PRO 37 -21.695 -0.583 -4.833 14 HB3 PRO 37 HB1 PRO 37 -23.166 -0.319 -3.872 15 HG2 PRO 37 HG2 PRO 37 -22.160 -2.832 -5.136 16 HG3 PRO 37 HG1 PRO 37 -22.858 -2.578 -3.522 17 HD2 PRO 37 HD2 PRO 37 -24.323 -3.589 -5.584 18 HD3 PRO 37 HD1 PRO 37 -25.041 -2.576 -4.310 19 H VAL 38 HN VAL 38 -22.204 1.472 -6.964 20 HA VAL 38 HA VAL 38 -20.777 -0.172 -8.948 21 HB VAL 38 HB VAL 38 -22.597 0.781 -10.202 22 HG11 VAL 38 HG11 VAL 38 -22.138 3.579 -9.973 23 HG12 VAL 38 HG12 VAL 38 -22.259 2.939 -8.334 24 HG13 VAL 38 HG13 VAL 38 -23.573 2.678 -9.482 25 HG21 VAL 38 HG21 VAL 38 -20.293 0.866 -11.198 26 HG22 VAL 38 HG22 VAL 38 -20.143 2.520 -10.607 27 HG23 VAL 38 HG23 VAL 38 -21.362 2.125 -11.819 28 H THR 39 HN THR 39 -18.765 0.714 -9.641 29 HA THR 39 HA THR 39 -17.755 2.873 -7.882 30 HB THR 39 HB THR 39 -15.548 1.784 -8.025 31 HG1 THR 39 HG1 THR 39 -15.250 0.309 -9.463 32 HG21 THR 39 HG21 THR 39 -16.121 -0.241 -6.685 33 HG22 THR 39 HG22 THR 39 -17.814 -0.015 -7.128 34 HG23 THR 39 HG23 THR 39 -16.988 1.199 -6.151 35 H GLU 40 HN GLU 40 -16.358 4.406 -8.787 36 HA GLU 40 HA GLU 40 -16.853 5.111 -11.478 37 HB2 GLU 40 HB2 GLU 40 -16.231 6.764 -9.768 38 HB3 GLU 40 HB1 GLU 40 -14.635 6.039 -9.639 39 HG2 GLU 40 HG2 GLU 40 -14.177 6.567 -11.994 40 HG3 GLU 40 HG1 GLU 40 -15.798 7.234 -12.175 41 H GLN 41 HN GLN 41 -14.089 3.571 -9.887 42 HA GLN 41 HA GLN 41 -12.450 3.385 -12.206 43 HB2 GLN 41 HB2 GLN 41 -11.081 1.899 -10.901 44 HB3 GLN 41 HB1 GLN 41 -11.669 3.164 -9.821 45 HG2 GLN 41 HG2 GLN 41 -12.059 1.205 -8.587 46 HG3 GLN 41 HG1 GLN 41 -13.626 1.519 -9.331 47 HE21 GLN 41 HE21 GLN 41 -14.147 -0.803 -9.256 48 HE22 GLN 41 HE22 GLN 41 -13.424 -1.885 -10.345 49 H GLY 42 HN GLY 42 -14.767 1.176 -10.691 50 HA2 GLY 42 HA2 GLY 42 -14.330 -1.014 -12.448 51 HA3 GLY 42 HA1 GLY 42 -15.751 -0.778 -11.428 52 H LEU 43 HN LEU 43 -16.351 1.848 -12.588 53 HA LEU 43 HA LEU 43 -18.155 1.111 -14.567 54 HB2 LEU 43 HB2 LEU 43 -18.019 3.296 -13.178 55 HB3 LEU 43 HB1 LEU 43 -16.956 3.864 -14.472 56 HG LEU 43 HG LEU 43 -18.670 3.572 -16.119 57 HD11 LEU 43 HD11 LEU 43 -19.674 1.505 -15.512 58 HD12 LEU 43 HD12 LEU 43 -20.960 2.698 -15.339 59 HD13 LEU 43 HD13 LEU 43 -20.113 2.103 -13.911 60 HD21 LEU 43 HD21 LEU 43 -19.002 5.244 -13.854 61 HD22 LEU 43 HD22 LEU 43 -20.599 4.623 -14.258 62 HD23 LEU 43 HD23 LEU 43 -19.661 5.491 -15.471 63 H ARG 44 HN ARG 44 -14.789 1.820 -14.825 64 HA ARG 44 HA ARG 44 -14.615 2.500 -17.547 65 HB2 ARG 44 HB2 ARG 44 -12.738 2.748 -15.958 66 HB3 ARG 44 HB1 ARG 44 -12.603 0.992 -15.860 67 HG2 ARG 44 HG2 ARG 44 -12.159 0.887 -18.286 68 HG3 ARG 44 HG1 ARG 44 -12.302 2.642 -18.389 69 HD2 ARG 44 HD2 ARG 44 -10.401 2.902 -16.854 70 HD3 ARG 44 HD1 ARG 44 -10.267 1.152 -16.707 71 HE ARG 44 HE ARG 44 -10.116 1.819 -19.436 72 HH11 ARG 44 HH11 ARG 44 -8.375 2.229 -16.473 73 HH12 ARG 44 HH12 ARG 44 -6.821 2.294 -17.235 74 HH21 ARG 44 HH21 ARG 44 -8.079 1.900 -20.441 75 HH22 ARG 44 HH22 ARG 44 -6.653 2.107 -19.480 76 H GLU 45 HN GLU 45 -14.539 -0.642 -15.895 77 HA GLU 45 HA GLU 45 -14.135 -2.227 -18.209 78 HB2 GLU 45 HB2 GLU 45 -13.680 -3.435 -16.307 79 HB3 GLU 45 HB1 GLU 45 -15.022 -2.731 -15.404 80 HG2 GLU 45 HG2 GLU 45 -15.550 -5.053 -15.913 81 HG3 GLU 45 HG1 GLU 45 -16.598 -3.983 -16.854 82 H ARG 46 HN ARG 46 -17.047 -1.162 -16.488 83 HA ARG 46 HA ARG 46 -18.930 -2.601 -18.021 84 HB2 ARG 46 HB2 ARG 46 -19.509 -1.597 -15.865 85 HB3 ARG 46 HB1 ARG 46 -19.251 0.013 -16.535 86 HG2 ARG 46 HG2 ARG 46 -21.639 -0.498 -16.568 87 HG3 ARG 46 HG1 ARG 46 -21.030 -0.441 -18.225 88 HD2 ARG 46 HD2 ARG 46 -20.844 -2.893 -18.252 89 HD3 ARG 46 HD1 ARG 46 -21.414 -2.964 -16.587 90 HE ARG 46 HE ARG 46 -23.357 -1.579 -18.018 91 HH11 ARG 46 HH11 ARG 46 -21.838 -4.688 -18.035 92 HH12 ARG 46 HH12 ARG 46 -23.226 -5.516 -18.660 93 HH21 ARG 46 HH21 ARG 46 -25.180 -2.658 -18.839 94 HH22 ARG 46 HH22 ARG 46 -25.118 -4.367 -19.115 95 H ILE 47 HN ILE 47 -17.560 0.660 -18.354 96 HA ILE 47 HA ILE 47 -19.114 1.472 -20.559 97 HB ILE 47 HB ILE 47 -16.367 2.308 -19.651 98 HG12 ILE 47 HG12 ILE 47 -18.251 2.770 -18.120 99 HG13 ILE 47 HG11 ILE 47 -17.572 4.262 -18.792 100 HG21 ILE 47 HG21 ILE 47 -18.168 3.369 -21.835 101 HG22 ILE 47 HG22 ILE 47 -16.478 2.879 -21.968 102 HG23 ILE 47 HG23 ILE 47 -16.906 4.350 -21.096 103 HD11 ILE 47 HD1 ILE 47 -19.835 4.654 -19.136 104 HD12 ILE 47 HD2 ILE 47 -20.204 2.942 -19.347 105 HD13 ILE 47 HD3 ILE 47 -19.426 3.843 -20.648 106 H GLU 48 HN GLU 48 -15.965 -0.147 -20.331 107 HA GLU 48 HA GLU 48 -15.351 -0.201 -23.087 108 HB2 GLU 48 HB2 GLU 48 -13.704 -0.744 -21.358 109 HB3 GLU 48 HB1 GLU 48 -14.621 -2.180 -20.897 110 HG2 GLU 48 HG2 GLU 48 -13.725 -1.775 -23.762 111 HG3 GLU 48 HG1 GLU 48 -12.609 -2.439 -22.565 112 H SER 49 HN SER 49 -17.210 -2.420 -21.029 113 HA SER 49 HA SER 49 -17.712 -4.304 -23.151 114 HB2 SER 49 HB2 SER 49 -18.897 -3.950 -20.395 115 HB3 SER 49 HB1 SER 49 -19.394 -5.227 -21.502 116 HG SER 49 HG SER 49 -17.326 -5.211 -19.877 117 H ALA 50 HN ALA 50 -19.146 -1.351 -21.995 118 HA ALA 50 HA ALA 50 -21.664 -1.870 -23.442 119 HB1 ALA 50 HB1 ALA 50 -22.574 -0.125 -22.226 120 HB2 ALA 50 HB2 ALA 50 -21.033 0.723 -22.088 121 HB3 ALA 50 HB3 ALA 50 -21.350 -0.700 -21.094 122 H ILE 51 HN ILE 51 -18.628 -0.704 -24.114 123 HA ILE 51 HA ILE 51 -19.485 0.456 -26.619 124 HB ILE 51 HB ILE 51 -19.625 2.336 -24.912 125 HG12 ILE 51 HG12 ILE 51 -17.555 2.684 -27.111 126 HG13 ILE 51 HG11 ILE 51 -19.301 2.641 -27.386 127 HG21 ILE 51 HG21 ILE 51 -16.816 2.936 -24.939 128 HG22 ILE 51 HG22 ILE 51 -17.044 1.327 -24.267 129 HG23 ILE 51 HG23 ILE 51 -17.873 2.698 -23.549 130 HD11 ILE 51 HD1 ILE 51 -19.616 4.733 -26.588 131 HD12 ILE 51 HD2 ILE 51 -17.886 4.922 -26.880 132 HD13 ILE 51 HD3 ILE 51 -18.468 4.500 -25.268 133 HA PRO 52 HA PRO 52 -15.676 -1.455 -27.765 134 HB2 PRO 52 HB2 PRO 52 -15.226 -0.007 -30.085 135 HB3 PRO 52 HB1 PRO 52 -16.329 -1.393 -29.964 136 HG2 PRO 52 HG2 PRO 52 -16.933 1.521 -29.923 137 HG3 PRO 52 HG1 PRO 52 -17.830 0.189 -30.674 138 HD2 PRO 52 HD2 PRO 52 -18.625 1.305 -28.346 139 HD3 PRO 52 HD1 PRO 52 -18.872 -0.416 -28.684 140 H GLN 53 HN GLN 53 -13.430 -1.028 -27.860 141 HA GLN 53 HA GLN 53 -12.314 0.762 -26.176 142 HB2 GLN 53 HB2 GLN 53 -10.218 0.523 -27.415 143 HB3 GLN 53 HB1 GLN 53 -11.069 -1.025 -27.331 144 HG2 GLN 53 HG2 GLN 53 -11.984 -0.640 -29.595 145 HG3 GLN 53 HG1 GLN 53 -11.135 0.902 -29.676 146 HE21 GLN 53 HE21 GLN 53 -10.822 -1.848 -31.157 147 HE22 GLN 53 HE22 GLN 53 -9.151 -2.130 -31.072 148 H VAL 54 HN VAL 54 -13.771 1.513 -29.193 149 HA VAL 54 HA VAL 54 -13.836 3.432 -30.485 150 HB VAL 54 HB VAL 54 -14.317 5.463 -29.053 151 HG11 VAL 54 HG11 VAL 54 -16.428 4.690 -29.132 152 HG12 VAL 54 HG12 VAL 54 -16.099 3.592 -27.793 153 HG13 VAL 54 HG13 VAL 54 -15.797 3.073 -29.450 154 HG21 VAL 54 HG21 VAL 54 -14.511 5.115 -26.641 155 HG22 VAL 54 HG22 VAL 54 -12.862 4.756 -27.151 156 HG23 VAL 54 HG23 VAL 54 -13.986 3.440 -26.815 157 H TYR 55 HN TYR 55 -12.952 5.953 -30.292 158 HA TYR 55 HA TYR 55 -10.224 5.789 -30.989 159 HB2 TYR 55 HB2 TYR 55 -11.617 7.619 -31.788 160 HB3 TYR 55 HB1 TYR 55 -11.871 8.184 -30.138 161 HD1 TYR 55 HD1 TYR 55 -9.235 7.620 -32.723 162 HD2 TYR 55 HD2 TYR 55 -10.318 9.620 -29.078 163 HE1 TYR 55 HE1 TYR 55 -7.175 8.996 -32.865 164 HE2 TYR 55 HE2 TYR 55 -8.257 10.995 -29.219 165 HH TYR 55 HH TYR 55 -6.103 10.791 -32.029 166 H HIS 56 HN HIS 56 -11.777 7.021 -28.009 167 HA HIS 56 HA HIS 56 -9.692 6.049 -26.336 168 HB2 HIS 56 HB2 HIS 56 -8.681 8.123 -27.549 169 HB3 HIS 56 HB1 HIS 56 -9.725 9.052 -26.463 170 HD2 HIS 56 HD2 HIS 56 -6.289 7.383 -26.382 171 HE1 HIS 56 HE1 HIS 56 -7.398 7.920 -22.346 172 HE2 HIS 56 HE2 HIS 56 -5.478 7.339 -23.900 173 H ILE 57 HN ILE 57 -10.185 6.260 -24.146 174 HA ILE 57 HA ILE 57 -12.656 7.725 -23.470 175 HB ILE 57 HB ILE 57 -13.246 5.340 -23.773 176 HG12 ILE 57 HG12 ILE 57 -13.192 6.057 -20.842 177 HG13 ILE 57 HG11 ILE 57 -14.295 6.804 -21.999 178 HG21 ILE 57 HG21 ILE 57 -12.139 3.611 -22.689 179 HG22 ILE 57 HG22 ILE 57 -11.553 4.662 -21.399 180 HG23 ILE 57 HG23 ILE 57 -10.795 4.711 -22.991 181 HD11 ILE 57 HD1 ILE 57 -14.102 3.805 -21.779 182 HD12 ILE 57 HD2 ILE 57 -15.428 4.782 -22.408 183 HD13 ILE 57 HD3 ILE 57 -15.124 4.721 -20.672 184 H ILE 58 HN ILE 58 -12.447 8.946 -21.708 185 HA ILE 58 HA ILE 58 -10.231 8.360 -19.840 186 HB ILE 58 HB ILE 58 -11.276 11.075 -20.678 187 HG12 ILE 58 HG12 ILE 58 -9.871 9.944 -22.388 188 HG13 ILE 58 HG11 ILE 58 -9.043 11.336 -21.686 189 HG21 ILE 58 HG21 ILE 58 -9.558 11.974 -19.228 190 HG22 ILE 58 HG22 ILE 58 -8.944 10.358 -18.879 191 HG23 ILE 58 HG23 ILE 58 -10.529 10.847 -18.280 192 HD11 ILE 58 HD1 ILE 58 -8.056 9.630 -20.001 193 HD12 ILE 58 HD2 ILE 58 -7.401 9.645 -21.639 194 HD13 ILE 58 HD3 ILE 58 -8.564 8.407 -21.164 195 H VAL 59 HN VAL 59 -10.757 8.118 -17.765 196 HA VAL 59 HA VAL 59 -13.462 8.928 -16.926 197 HB VAL 59 HB VAL 59 -11.718 6.710 -15.842 198 HG11 VAL 59 HG11 VAL 59 -14.336 6.375 -14.961 199 HG12 VAL 59 HG12 VAL 59 -14.053 8.107 -14.791 200 HG13 VAL 59 HG13 VAL 59 -12.983 6.957 -13.989 201 HG21 VAL 59 HG21 VAL 59 -12.548 5.775 -17.781 202 HG22 VAL 59 HG22 VAL 59 -13.942 6.855 -17.828 203 HG23 VAL 59 HG23 VAL 59 -13.928 5.479 -16.723 204 H THR 60 HN THR 60 -13.473 10.660 -15.662 205 HA THR 60 HA THR 60 -11.341 10.963 -13.648 206 HB THR 60 HB THR 60 -12.480 13.183 -15.360 207 HG1 THR 60 HG1 THR 60 -10.192 11.605 -15.439 208 HG21 THR 60 HG21 THR 60 -10.701 14.528 -14.207 209 HG22 THR 60 HG22 THR 60 -10.432 13.158 -13.127 210 HG23 THR 60 HG23 THR 60 -11.987 13.989 -13.128 211 H ASP 61 HN ASP 61 -12.019 11.568 -11.649 212 HA ASP 61 HA ASP 61 -14.855 11.503 -11.117 213 HB2 ASP 61 HB2 ASP 61 -14.165 11.739 -8.766 214 HB3 ASP 61 HB1 ASP 61 -13.262 10.458 -9.574 215 H LEU 62 HN LEU 62 -16.166 13.200 -11.190 216 HA LEU 62 HA LEU 62 -15.317 15.788 -10.189 217 HB2 LEU 62 HB2 LEU 62 -15.169 15.248 -12.965 218 HB3 LEU 62 HB1 LEU 62 -16.571 16.287 -12.722 219 HG LEU 62 HG LEU 62 -14.600 17.676 -13.044 220 HD11 LEU 62 HD11 LEU 62 -15.002 19.118 -11.281 221 HD12 LEU 62 HD12 LEU 62 -14.966 17.827 -10.081 222 HD13 LEU 62 HD13 LEU 62 -16.390 18.044 -11.100 223 HD21 LEU 62 HD21 LEU 62 -13.052 15.799 -12.186 224 HD22 LEU 62 HD22 LEU 62 -13.401 16.422 -10.573 225 HD23 LEU 62 HD23 LEU 62 -12.612 17.453 -11.766 226 H SER 63 HN SER 63 -17.887 15.095 -12.507 227 HA SER 63 HA SER 63 -19.894 16.308 -10.931 228 HB2 SER 63 HB2 SER 63 -20.108 16.149 -13.355 229 HB3 SER 63 HB1 SER 63 -20.132 14.390 -13.262 230 HG SER 63 HG SER 63 -22.096 16.253 -12.664 231 H TYR 64 HN TYR 64 -21.411 15.480 -9.565 232 HA TYR 64 HA TYR 64 -20.987 13.488 -7.835 233 HB2 TYR 64 HB2 TYR 64 -23.651 14.168 -9.104 234 HB3 TYR 64 HB1 TYR 64 -23.468 13.182 -7.651 235 HD1 TYR 64 HD1 TYR 64 -23.185 16.564 -9.071 236 HD2 TYR 64 HD2 TYR 64 -22.662 14.154 -5.553 237 HE1 TYR 64 HE1 TYR 64 -23.018 18.618 -7.687 238 HE2 TYR 64 HE2 TYR 64 -22.496 16.206 -4.171 239 HH TYR 64 HH TYR 64 -23.456 18.760 -4.548 240 H GLY 65 HN GLY 65 -21.529 11.271 -7.608 241 HA2 GLY 65 HA2 GLY 65 -22.700 9.442 -9.125 242 HA3 GLY 65 HA1 GLY 65 -21.274 9.780 -10.108 243 H CYS 66 HN CYS 66 -21.034 7.377 -9.619 244 HA CYS 66 HA CYS 66 -20.174 6.618 -6.985 245 HB2 CYS 66 HB2 CYS 66 -19.745 4.475 -7.920 246 HB3 CYS 66 HB1 CYS 66 -21.194 5.079 -8.728 247 HG CYS 66 HG CYS 66 -18.371 4.891 -10.032 248 H GLY 67 HN GLY 67 -18.050 5.853 -6.428 249 HA2 GLY 67 HA2 GLY 67 -15.772 6.106 -6.232 250 HA3 GLY 67 HA1 GLY 67 -15.737 6.246 -7.989 251 H GLN 68 HN GLN 68 -17.392 8.380 -5.688 252 HA GLN 68 HA GLN 68 -17.087 10.599 -5.156 253 HB2 GLN 68 HB2 GLN 68 -14.337 10.087 -6.309 254 HB3 GLN 68 HB1 GLN 68 -14.822 11.604 -5.556 255 HG2 GLN 68 HG2 GLN 68 -15.322 10.435 -3.460 256 HG3 GLN 68 HG1 GLN 68 -14.916 8.889 -4.204 257 HE21 GLN 68 HE21 GLN 68 -13.353 9.192 -2.107 258 HE22 GLN 68 HE22 GLN 68 -11.821 9.819 -2.481 259 H SER 69 HN SER 69 -18.729 10.490 -7.068 260 HA SER 69 HA SER 69 -19.613 11.642 -8.851 261 HB2 SER 69 HB2 SER 69 -17.602 13.401 -9.666 262 HB3 SER 69 HB1 SER 69 -19.008 13.774 -8.683 263 HG SER 69 HG SER 69 -17.690 14.019 -7.076 264 H PHE 70 HN PHE 70 -19.778 11.199 -10.995 265 HA PHE 70 HA PHE 70 -17.450 9.823 -12.212 266 HB2 PHE 70 HB2 PHE 70 -19.649 8.566 -11.894 267 HB3 PHE 70 HB1 PHE 70 -20.336 9.651 -13.106 268 HD1 PHE 70 HD1 PHE 70 -17.469 7.316 -12.535 269 HD2 PHE 70 HD2 PHE 70 -20.074 9.171 -15.398 270 HE1 PHE 70 HE1 PHE 70 -16.496 5.910 -14.332 271 HE2 PHE 70 HE2 PHE 70 -19.110 7.764 -17.194 272 HZ PHE 70 HZ PHE 70 -17.315 6.134 -16.662 273 H ASP 71 HN ASP 71 -16.346 11.103 -13.531 274 HA ASP 71 HA ASP 71 -17.824 12.746 -15.477 275 HB2 ASP 71 HB2 ASP 71 -17.039 14.238 -13.672 276 HB3 ASP 71 HB1 ASP 71 -15.394 13.680 -13.943 277 H ILE 72 HN ILE 72 -17.406 11.462 -17.211 278 HA ILE 72 HA ILE 72 -14.543 11.007 -17.865 279 HB ILE 72 HB ILE 72 -15.180 8.880 -18.865 280 HG12 ILE 72 HG12 ILE 72 -18.016 9.468 -17.960 281 HG13 ILE 72 HG11 ILE 72 -17.450 9.681 -19.624 282 HG21 ILE 72 HG21 ILE 72 -15.061 9.318 -16.208 283 HG22 ILE 72 HG22 ILE 72 -15.401 7.721 -16.877 284 HG23 ILE 72 HG23 ILE 72 -16.714 8.750 -16.312 285 HD11 ILE 72 HD1 ILE 72 -18.580 7.451 -19.124 286 HD12 ILE 72 HD2 ILE 72 -17.176 7.063 -18.131 287 HD13 ILE 72 HD3 ILE 72 -16.979 7.348 -19.860 288 H VAL 73 HN VAL 73 -14.038 10.904 -20.111 289 HA VAL 73 HA VAL 73 -15.937 12.414 -21.809 290 HB VAL 73 HB VAL 73 -12.914 12.572 -21.764 291 HG11 VAL 73 HG11 VAL 73 -13.331 13.039 -23.970 292 HG12 VAL 73 HG12 VAL 73 -13.704 14.626 -23.301 293 HG13 VAL 73 HG13 VAL 73 -15.006 13.495 -23.664 294 HG21 VAL 73 HG21 VAL 73 -15.054 14.020 -20.404 295 HG22 VAL 73 HG22 VAL 73 -14.057 15.094 -21.385 296 HG23 VAL 73 HG23 VAL 73 -13.312 14.094 -20.139 297 H VAL 74 HN VAL 74 -16.507 11.450 -23.665 298 HA VAL 74 HA VAL 74 -14.926 9.116 -24.562 299 HB VAL 74 HB VAL 74 -17.896 9.669 -24.798 300 HG11 VAL 74 HG11 VAL 74 -18.044 7.509 -25.911 301 HG12 VAL 74 HG12 VAL 74 -16.305 7.266 -25.739 302 HG13 VAL 74 HG13 VAL 74 -16.917 8.533 -26.802 303 HG21 VAL 74 HG21 VAL 74 -18.089 7.677 -23.360 304 HG22 VAL 74 HG22 VAL 74 -17.122 8.920 -22.566 305 HG23 VAL 74 HG23 VAL 74 -16.332 7.533 -23.314 306 H VAL 75 HN VAL 75 -13.992 9.272 -26.488 307 HA VAL 75 HA VAL 75 -15.118 11.167 -28.459 308 HB VAL 75 HB VAL 75 -12.210 10.679 -27.798 309 HG11 VAL 75 HG11 VAL 75 -11.650 11.453 -29.841 310 HG12 VAL 75 HG12 VAL 75 -12.789 12.793 -29.708 311 HG13 VAL 75 HG13 VAL 75 -13.337 11.227 -30.305 312 HG21 VAL 75 HG21 VAL 75 -14.199 12.636 -27.004 313 HG22 VAL 75 HG22 VAL 75 -12.872 13.416 -27.863 314 HG23 VAL 75 HG23 VAL 75 -12.543 12.443 -26.429 315 H SER 76 HN SER 76 -15.517 10.329 -30.403 316 HA SER 76 HA SER 76 -13.956 8.249 -31.592 317 HB2 SER 76 HB2 SER 76 -15.153 6.861 -29.955 318 HB3 SER 76 HB1 SER 76 -16.693 7.466 -30.562 319 HG SER 76 HG SER 76 -16.417 5.677 -31.730 320 H ASP 77 HN ASP 77 -15.138 7.354 -33.594 321 HA ASP 77 HA ASP 77 -15.984 9.571 -35.182 322 HB2 ASP 77 HB2 ASP 77 -15.855 6.603 -35.697 323 HB3 ASP 77 HB1 ASP 77 -16.390 7.763 -36.913 324 H PHE 78 HN PHE 78 -17.645 7.465 -33.100 325 HA PHE 78 HA PHE 78 -20.120 7.112 -34.344 326 HB2 PHE 78 HB2 PHE 78 -19.503 6.007 -32.238 327 HB3 PHE 78 HB1 PHE 78 -19.553 7.562 -31.402 328 HD1 PHE 78 HD1 PHE 78 -21.610 5.087 -33.275 329 HD2 PHE 78 HD2 PHE 78 -21.617 8.538 -30.718 330 HE1 PHE 78 HE1 PHE 78 -24.056 4.838 -32.947 331 HE2 PHE 78 HE2 PHE 78 -24.062 8.291 -30.389 332 HZ PHE 78 HZ PHE 78 -25.282 6.441 -31.504 333 H PHE 79 HN PHE 79 -18.641 9.984 -33.170 334 HA PHE 79 HA PHE 79 -21.126 11.438 -32.779 335 HB2 PHE 79 HB2 PHE 79 -19.804 13.101 -31.900 336 HB3 PHE 79 HB1 PHE 79 -18.671 11.766 -31.735 337 HD1 PHE 79 HD1 PHE 79 -18.761 15.047 -32.652 338 HD2 PHE 79 HD2 PHE 79 -17.549 11.253 -34.263 339 HE1 PHE 79 HE1 PHE 79 -17.175 16.187 -34.178 340 HE2 PHE 79 HE2 PHE 79 -15.968 12.405 -35.788 341 HZ PHE 79 HZ PHE 79 -15.786 14.878 -35.747 342 H GLN 80 HN GLN 80 -19.521 10.380 -35.460 343 HA GLN 80 HA GLN 80 -19.487 12.659 -37.141 344 HB2 GLN 80 HB2 GLN 80 -19.720 9.705 -37.764 345 HB3 GLN 80 HB1 GLN 80 -19.540 10.950 -39.000 346 HG2 GLN 80 HG2 GLN 80 -17.414 11.656 -38.039 347 HG3 GLN 80 HG1 GLN 80 -17.608 10.523 -36.703 348 HE21 GLN 80 HE21 GLN 80 -15.499 10.638 -38.906 349 HE22 GLN 80 HE22 GLN 80 -15.538 9.093 -39.610 350 H GLY 81 HN GLY 81 -21.120 13.791 -37.943 351 HA2 GLY 81 HA2 GLY 81 -23.184 14.319 -38.826 352 HA3 GLY 81 HA1 GLY 81 -23.510 12.589 -38.960 353 H LYS 82 HN LYS 82 -22.531 13.582 -35.850 354 HA LYS 82 HA LYS 82 -25.330 13.815 -34.934 355 HB2 LYS 82 HB2 LYS 82 -23.160 12.074 -33.739 356 HB3 LYS 82 HB1 LYS 82 -24.697 12.424 -32.949 357 HG2 LYS 82 HG2 LYS 82 -25.910 11.446 -34.861 358 HG3 LYS 82 HG1 LYS 82 -24.377 11.095 -35.657 359 HD2 LYS 82 HD2 LYS 82 -23.726 9.641 -33.768 360 HD3 LYS 82 HD1 LYS 82 -25.264 9.987 -32.976 361 HE2 LYS 82 HE2 LYS 82 -26.478 9.008 -34.885 362 HE3 LYS 82 HE1 LYS 82 -24.945 8.668 -35.688 363 HZ1 LYS 82 HZ1 LYS 82 -25.820 7.569 -33.072 364 HZ2 LYS 82 HZ2 LYS 82 -24.325 7.260 -33.819 365 HZ3 LYS 82 HZ3 LYS 82 -25.766 6.719 -34.539 366 H SER 83 HN SER 83 -25.664 15.131 -33.143 367 HA SER 83 HA SER 83 -23.523 17.038 -32.611 368 HB2 SER 83 HB2 SER 83 -26.431 16.983 -31.802 369 HB3 SER 83 HB1 SER 83 -25.304 18.257 -31.345 370 HG SER 83 HG SER 83 -25.113 18.846 -33.438 371 H LYS 84 HN LYS 84 -23.602 17.877 -30.194 372 HA LYS 84 HA LYS 84 -22.413 15.895 -28.597 373 HB2 LYS 84 HB2 LYS 84 -22.470 17.532 -26.811 374 HB3 LYS 84 HB1 LYS 84 -22.106 18.365 -28.323 375 HG2 LYS 84 HG2 LYS 84 -24.494 18.988 -28.545 376 HG3 LYS 84 HG1 LYS 84 -24.837 18.185 -27.011 377 HD2 LYS 84 HD2 LYS 84 -23.273 19.709 -25.859 378 HD3 LYS 84 HD1 LYS 84 -22.931 20.514 -27.390 379 HE2 LYS 84 HE2 LYS 84 -25.305 21.163 -27.586 380 HE3 LYS 84 HE1 LYS 84 -25.650 20.356 -26.056 381 HZ1 LYS 84 HZ1 LYS 84 -24.921 22.109 -24.936 382 HZ2 LYS 84 HZ2 LYS 84 -24.814 22.956 -26.405 383 HZ3 LYS 84 HZ3 LYS 84 -23.457 22.139 -25.793 384 H LEU 85 HN LEU 85 -25.725 17.093 -28.752 385 HA LEU 85 HA LEU 85 -26.711 15.764 -26.456 386 HB2 LEU 85 HB2 LEU 85 -28.079 16.715 -28.973 387 HB3 LEU 85 HB1 LEU 85 -28.941 16.059 -27.581 388 HG LEU 85 HG LEU 85 -27.026 18.399 -27.428 389 HD11 LEU 85 HD11 LEU 85 -29.067 18.863 -28.814 390 HD12 LEU 85 HD12 LEU 85 -28.987 19.828 -27.339 391 HD13 LEU 85 HD13 LEU 85 -30.056 18.428 -27.421 392 HD21 LEU 85 HD21 LEU 85 -28.725 18.544 -25.293 393 HD22 LEU 85 HD22 LEU 85 -27.148 17.755 -25.242 394 HD23 LEU 85 HD23 LEU 85 -28.606 16.798 -25.506 395 H MET 86 HN MET 86 -26.416 14.820 -29.847 396 HA MET 86 HA MET 86 -27.875 12.409 -29.680 397 HB2 MET 86 HB2 MET 86 -25.621 13.242 -31.526 398 HB3 MET 86 HB1 MET 86 -26.557 11.760 -31.721 399 HG2 MET 86 HG2 MET 86 -27.722 14.560 -31.673 400 HG3 MET 86 HG1 MET 86 -27.456 13.595 -33.126 401 HE1 MET 86 HE1 MET 86 -29.731 11.114 -33.517 402 HE2 MET 86 HE2 MET 86 -28.890 10.399 -32.147 403 HE3 MET 86 HE3 MET 86 -27.994 11.373 -33.312 404 H ARG 87 HN ARG 87 -24.498 13.203 -29.054 405 HA ARG 87 HA ARG 87 -23.460 10.603 -28.823 406 HB2 ARG 87 HB2 ARG 87 -22.700 13.221 -27.517 407 HB3 ARG 87 HB1 ARG 87 -21.751 11.746 -27.328 408 HG2 ARG 87 HG2 ARG 87 -22.490 12.927 -30.016 409 HG3 ARG 87 HG1 ARG 87 -20.964 13.254 -29.200 410 HD2 ARG 87 HD2 ARG 87 -21.996 10.526 -30.032 411 HD3 ARG 87 HD1 ARG 87 -20.688 11.422 -30.789 412 HE ARG 87 HE ARG 87 -20.546 9.934 -28.313 413 HH11 ARG 87 HH11 ARG 87 -19.219 12.462 -30.263 414 HH12 ARG 87 HH12 ARG 87 -17.649 12.386 -29.540 415 HH21 ARG 87 HH21 ARG 87 -18.497 9.834 -27.351 416 HH22 ARG 87 HH22 ARG 87 -17.240 10.898 -27.887 417 H SER 88 HN SER 88 -24.916 12.726 -26.382 418 HA SER 88 HA SER 88 -24.515 11.033 -24.151 419 HB2 SER 88 HB2 SER 88 -26.594 13.163 -24.676 420 HB3 SER 88 HB1 SER 88 -26.374 12.370 -23.119 421 HG SER 88 HG SER 88 -24.763 13.667 -22.791 422 H ARG 89 HN ARG 89 -27.236 11.356 -26.412 423 HA ARG 89 HA ARG 89 -28.977 9.541 -25.132 424 HB2 ARG 89 HB2 ARG 89 -29.703 11.127 -26.881 425 HB3 ARG 89 HB1 ARG 89 -28.788 10.211 -28.080 426 HG2 ARG 89 HG2 ARG 89 -30.149 8.214 -27.608 427 HG3 ARG 89 HG1 ARG 89 -31.057 9.112 -26.392 428 HD2 ARG 89 HD2 ARG 89 -31.825 10.690 -28.118 429 HD3 ARG 89 HD1 ARG 89 -30.902 9.816 -29.336 430 HE ARG 89 HE ARG 89 -32.626 7.991 -28.068 431 HH11 ARG 89 HH11 ARG 89 -32.708 10.797 -30.094 432 HH12 ARG 89 HH12 ARG 89 -34.188 10.356 -30.878 433 HH21 ARG 89 HH21 ARG 89 -34.565 7.407 -29.094 434 HH22 ARG 89 HH22 ARG 89 -35.239 8.437 -30.312 435 H ALA 90 HN ALA 90 -26.598 9.065 -27.735 436 HA ALA 90 HA ALA 90 -27.139 6.326 -28.165 437 HB1 ALA 90 HB1 ALA 90 -24.459 7.674 -28.535 438 HB2 ALA 90 HB2 ALA 90 -25.799 7.875 -29.663 439 HB3 ALA 90 HB3 ALA 90 -25.096 6.278 -29.405 440 H VAL 91 HN VAL 91 -24.833 7.978 -26.034 441 HA VAL 91 HA VAL 91 -23.643 5.572 -25.048 442 HB VAL 91 HB VAL 91 -22.535 7.810 -24.999 443 HG11 VAL 91 HG11 VAL 91 -23.194 9.310 -23.101 444 HG12 VAL 91 HG12 VAL 91 -24.613 8.298 -22.848 445 HG13 VAL 91 HG13 VAL 91 -24.422 9.190 -24.356 446 HG21 VAL 91 HG21 VAL 91 -21.588 7.521 -22.725 447 HG22 VAL 91 HG22 VAL 91 -21.750 5.971 -23.555 448 HG23 VAL 91 HG23 VAL 91 -22.918 6.438 -22.317 449 H ASN 92 HN ASN 92 -26.272 7.668 -23.988 450 HA ASN 92 HA ASN 92 -26.658 6.560 -21.428 451 HB2 ASN 92 HB2 ASN 92 -28.548 7.936 -23.341 452 HB3 ASN 92 HB1 ASN 92 -29.021 7.447 -21.714 453 HD21 ASN 92 HD21 ASN 92 -26.804 8.095 -20.182 454 HD22 ASN 92 HD22 ASN 92 -26.483 9.759 -20.285 455 H LYS 93 HN LYS 93 -27.967 5.679 -24.599 456 HA LYS 93 HA LYS 93 -29.775 3.697 -23.701 457 HB2 LYS 93 HB2 LYS 93 -28.331 4.080 -26.330 458 HB3 LYS 93 HB1 LYS 93 -29.544 2.826 -26.068 459 HG2 LYS 93 HG2 LYS 93 -31.224 4.503 -25.522 460 HG3 LYS 93 HG1 LYS 93 -30.021 5.789 -25.628 461 HD2 LYS 93 HD2 LYS 93 -31.254 5.761 -27.709 462 HD3 LYS 93 HD1 LYS 93 -29.641 5.124 -28.030 463 HE2 LYS 93 HE2 LYS 93 -30.492 2.829 -27.893 464 HE3 LYS 93 HE1 LYS 93 -32.101 3.433 -27.500 465 HZ1 LYS 93 HZ1 LYS 93 -30.806 4.425 -29.930 466 HZ2 LYS 93 HZ2 LYS 93 -32.453 4.159 -29.611 467 HZ3 LYS 93 HZ3 LYS 93 -31.428 2.847 -29.951 468 H ALA 94 HN ALA 94 -26.379 3.542 -24.717 469 HA ALA 94 HA ALA 94 -26.110 0.728 -24.488 470 HB1 ALA 94 HB1 ALA 94 -24.135 1.231 -25.413 471 HB2 ALA 94 HB2 ALA 94 -23.623 1.978 -23.899 472 HB3 ALA 94 HB3 ALA 94 -24.429 2.948 -25.132 473 H VAL 95 HN VAL 95 -25.644 3.399 -22.217 474 HA VAL 95 HA VAL 95 -25.211 1.410 -20.075 475 HB VAL 95 HB VAL 95 -24.085 3.196 -18.827 476 HG11 VAL 95 HG11 VAL 95 -23.017 1.744 -20.787 477 HG12 VAL 95 HG12 VAL 95 -22.086 3.003 -19.976 478 HG13 VAL 95 HG13 VAL 95 -22.834 3.328 -21.539 479 HG21 VAL 95 HG21 VAL 95 -23.859 5.026 -21.101 480 HG22 VAL 95 HG22 VAL 95 -24.218 5.379 -19.411 481 HG23 VAL 95 HG23 VAL 95 -25.511 4.884 -20.503 482 H LYS 96 HN LYS 96 -27.814 2.081 -21.054 483 HA LYS 96 HA LYS 96 -29.141 4.057 -19.559 484 HB2 LYS 96 HB2 LYS 96 -30.140 2.918 -21.507 485 HB3 LYS 96 HB1 LYS 96 -30.231 1.419 -20.581 486 HG2 LYS 96 HG2 LYS 96 -31.705 2.510 -18.937 487 HG3 LYS 96 HG1 LYS 96 -31.602 4.022 -19.841 488 HD2 LYS 96 HD2 LYS 96 -32.613 2.918 -21.807 489 HD3 LYS 96 HD1 LYS 96 -32.727 1.410 -20.898 490 HE2 LYS 96 HE2 LYS 96 -34.196 2.509 -19.250 491 HE3 LYS 96 HE1 LYS 96 -34.078 4.021 -20.147 492 HZ1 LYS 96 HZ1 LYS 96 -34.952 2.718 -22.103 493 HZ2 LYS 96 HZ2 LYS 96 -36.059 3.012 -20.848 494 HZ3 LYS 96 HZ3 LYS 96 -35.335 1.483 -21.007 495 H GLU 97 HN GLU 97 -28.611 0.605 -18.871 496 HA GLU 97 HA GLU 97 -30.038 0.559 -16.421 497 HB2 GLU 97 HB2 GLU 97 -27.815 -1.200 -17.476 498 HB3 GLU 97 HB1 GLU 97 -28.714 -1.531 -15.995 499 HG2 GLU 97 HG2 GLU 97 -29.996 -1.163 -18.717 500 HG3 GLU 97 HG1 GLU 97 -29.628 -2.730 -17.999 501 H GLU 98 HN GLU 98 -26.668 1.222 -17.236 502 HA GLU 98 HA GLU 98 -25.631 1.271 -14.617 503 HB2 GLU 98 HB2 GLU 98 -24.764 2.692 -17.142 504 HB3 GLU 98 HB1 GLU 98 -23.837 2.723 -15.640 505 HG2 GLU 98 HG2 GLU 98 -24.638 0.226 -17.165 506 HG3 GLU 98 HG1 GLU 98 -23.027 0.940 -17.145 507 H LEU 99 HN LEU 99 -27.224 3.737 -16.583 508 HA LEU 99 HA LEU 99 -26.694 5.969 -14.941 509 HB2 LEU 99 HB2 LEU 99 -27.614 6.150 -17.227 510 HB3 LEU 99 HB1 LEU 99 -29.115 5.419 -16.660 511 HG LEU 99 HG LEU 99 -28.019 7.880 -15.323 512 HD11 LEU 99 HD11 LEU 99 -28.468 9.166 -17.113 513 HD12 LEU 99 HD12 LEU 99 -30.118 8.545 -17.157 514 HD13 LEU 99 HD13 LEU 99 -28.839 7.718 -18.049 515 HD21 LEU 99 HD21 LEU 99 -30.329 6.192 -15.068 516 HD22 LEU 99 HD22 LEU 99 -30.856 7.802 -15.558 517 HD23 LEU 99 HD23 LEU 99 -29.888 7.597 -14.097 518 H GLN 100 HN GLN 100 -29.331 3.602 -14.926 519 HA GLN 100 HA GLN 100 -30.864 4.796 -12.864 520 HB2 GLN 100 HB2 GLN 100 -30.655 1.940 -13.837 521 HB3 GLN 100 HB1 GLN 100 -31.820 2.472 -12.625 522 HG2 GLN 100 HG2 GLN 100 -32.839 4.015 -14.187 523 HG3 GLN 100 HG1 GLN 100 -31.582 3.703 -15.383 524 HE21 GLN 100 HE21 GLN 100 -34.588 3.192 -15.516 525 HE22 GLN 100 HE22 GLN 100 -34.720 1.545 -15.906 526 H GLU 101 HN GLU 101 -28.238 2.421 -12.849 527 HA GLU 101 HA GLU 101 -28.365 1.961 -10.018 528 HB2 GLU 101 HB2 GLU 101 -27.447 0.281 -11.587 529 HB3 GLU 101 HB1 GLU 101 -26.113 1.376 -11.948 530 HG2 GLU 101 HG2 GLU 101 -25.410 1.342 -9.603 531 HG3 GLU 101 HG1 GLU 101 -26.782 0.316 -9.188 532 H ILE 102 HN ILE 102 -26.707 4.193 -12.143 533 HA ILE 102 HA ILE 102 -25.006 5.146 -9.945 534 HB ILE 102 HB ILE 102 -25.172 6.002 -12.848 535 HG12 ILE 102 HG12 ILE 102 -23.020 4.412 -11.419 536 HG13 ILE 102 HG11 ILE 102 -24.319 3.660 -12.345 537 HG21 ILE 102 HG21 ILE 102 -23.774 7.065 -10.481 538 HG22 ILE 102 HG22 ILE 102 -24.118 7.842 -12.026 539 HG23 ILE 102 HG23 ILE 102 -22.724 6.774 -11.867 540 HD11 ILE 102 HD1 ILE 102 -22.315 5.662 -13.428 541 HD12 ILE 102 HD2 ILE 102 -23.620 4.918 -14.351 542 HD13 ILE 102 HD3 ILE 102 -22.300 3.925 -13.734 543 H HIS 103 HN HIS 103 -25.514 6.834 -8.717 544 HA HIS 103 HA HIS 103 -28.000 8.144 -8.851 545 HB2 HIS 103 HB2 HIS 103 -26.690 7.983 -6.777 546 HB3 HIS 103 HB1 HIS 103 -25.455 9.036 -7.473 547 HD2 HIS 103 HD2 HIS 103 -25.950 11.731 -7.085 548 HE1 HIS 103 HE1 HIS 103 -30.018 11.436 -5.995 549 HE2 HIS 103 HE2 HIS 103 -28.057 13.029 -6.253 550 H ALA 104 HN ALA 104 -24.749 9.253 -9.829 551 HA ALA 104 HA ALA 104 -25.939 10.995 -11.827 552 HB1 ALA 104 HB1 ALA 104 -24.007 12.496 -10.232 553 HB2 ALA 104 HB2 ALA 104 -25.472 12.087 -9.338 554 HB3 ALA 104 HB3 ALA 104 -25.584 12.992 -10.847 555 H PHE 105 HN PHE 105 -24.693 11.085 -13.579 556 HA PHE 105 HA PHE 105 -21.790 10.850 -13.358 557 HB2 PHE 105 HB2 PHE 105 -21.683 8.991 -14.990 558 HB3 PHE 105 HB1 PHE 105 -22.504 8.507 -13.511 559 HD1 PHE 105 HD1 PHE 105 -24.730 10.670 -14.986 560 HD2 PHE 105 HD2 PHE 105 -23.118 6.742 -15.575 561 HE1 PHE 105 HE1 PHE 105 -26.726 10.069 -16.293 562 HE2 PHE 105 HE2 PHE 105 -25.130 6.126 -16.890 563 HZ PHE 105 HZ PHE 105 -26.934 7.790 -17.246 564 H SER 106 HN SER 106 -20.709 11.294 -15.431 565 HA SER 106 HA SER 106 -22.408 12.699 -17.388 566 HB2 SER 106 HB2 SER 106 -20.684 14.473 -17.551 567 HB3 SER 106 HB1 SER 106 -21.423 14.407 -15.945 568 HG SER 106 HG SER 106 -18.949 14.416 -16.310 569 H CYS 107 HN CYS 107 -21.607 12.729 -19.520 570 HA CYS 107 HA CYS 107 -19.170 11.177 -20.066 571 HB2 CYS 107 HB2 CYS 107 -20.396 9.892 -21.826 572 HB3 CYS 107 HB1 CYS 107 -20.905 9.502 -20.182 573 HG CYS 107 HG CYS 107 -23.156 10.478 -20.621 574 H LYS 108 HN LYS 108 -18.329 13.256 -20.651 575 HA LYS 108 HA LYS 108 -19.483 14.977 -22.545 576 HB2 LYS 108 HB2 LYS 108 -16.593 14.490 -21.807 577 HB3 LYS 108 HB1 LYS 108 -17.117 15.785 -22.874 578 HG2 LYS 108 HG2 LYS 108 -18.574 16.673 -21.091 579 HG3 LYS 108 HG1 LYS 108 -18.051 15.373 -20.020 580 HD2 LYS 108 HD2 LYS 108 -15.721 16.175 -20.180 581 HD3 LYS 108 HD1 LYS 108 -16.245 17.478 -21.247 582 HE2 LYS 108 HE2 LYS 108 -17.690 18.373 -19.470 583 HE3 LYS 108 HE1 LYS 108 -17.199 17.060 -18.399 584 HZ1 LYS 108 HZ1 LYS 108 -15.499 18.318 -17.793 585 HZ2 LYS 108 HZ2 LYS 108 -15.869 19.496 -18.959 586 HZ3 LYS 108 HZ3 LYS 108 -14.868 18.184 -19.361 587 H CYS 109 HN CYS 109 -19.285 15.160 -24.771 588 HA CYS 109 HA CYS 109 -18.011 12.871 -26.148 589 HB2 CYS 109 HB2 CYS 109 -19.824 12.930 -27.792 590 HB3 CYS 109 HB1 CYS 109 -20.471 12.664 -26.175 591 HG CYS 109 HG CYS 109 -21.733 14.646 -27.582 592 H TYR 110 HN TYR 110 -16.360 13.545 -27.330 593 HA TYR 110 HA TYR 110 -16.633 15.939 -28.979 594 HB2 TYR 110 HB2 TYR 110 -14.401 15.495 -26.997 595 HB3 TYR 110 HB1 TYR 110 -14.367 16.718 -28.274 596 HD1 TYR 110 HD1 TYR 110 -16.008 15.658 -25.134 597 HD2 TYR 110 HD2 TYR 110 -15.789 18.676 -28.182 598 HE1 TYR 110 HE1 TYR 110 -17.329 17.203 -23.708 599 HE2 TYR 110 HE2 TYR 110 -17.109 20.215 -26.755 600 HH TYR 110 HH TYR 110 -17.658 20.541 -24.425 601 H THR 111 HN THR 111 -14.991 16.104 -30.652 602 HA THR 111 HA THR 111 -13.266 13.851 -31.172 603 HB THR 111 HB THR 111 -15.736 14.286 -32.819 604 HG1 THR 111 HG1 THR 111 -16.244 12.757 -31.465 605 HG21 THR 111 HG21 THR 111 -14.569 12.314 -34.140 606 HG22 THR 111 HG22 THR 111 -13.103 13.067 -33.509 607 HG23 THR 111 HG23 THR 111 -14.201 13.996 -34.529 608 H GLU 112 HN GLU 112 -14.746 16.859 -32.219 609 HA GLU 112 HA GLU 112 -12.609 18.370 -32.757 610 HB2 GLU 112 HB2 GLU 112 -12.748 16.222 -34.757 611 HB3 GLU 112 HB1 GLU 112 -12.579 17.840 -35.438 612 HG2 GLU 112 HG2 GLU 112 -10.814 16.748 -33.227 613 HG3 GLU 112 HG1 GLU 112 -10.383 16.726 -34.934 614 H GLU 113 HN GLU 113 -15.667 17.255 -33.971 615 HA GLU 113 HA GLU 113 -16.328 19.434 -35.640 616 HB2 GLU 113 HB2 GLU 113 -18.059 17.536 -34.050 617 HB3 GLU 113 HB1 GLU 113 -18.699 18.721 -35.186 618 HG2 GLU 113 HG2 GLU 113 -17.424 17.720 -37.012 619 HG3 GLU 113 HG1 GLU 113 -16.655 16.593 -35.900 620 H GLU 114 HN GLU 114 -16.616 18.913 -32.173 621 HA GLU 114 HA GLU 114 -18.286 21.056 -31.510 622 HB2 GLU 114 HB2 GLU 114 -15.991 19.841 -29.944 623 HB3 GLU 114 HB1 GLU 114 -17.197 20.935 -29.268 624 HG2 GLU 114 HG2 GLU 114 -17.839 18.290 -30.605 625 HG3 GLU 114 HG1 GLU 114 -17.739 18.529 -28.863 626 H TRP 115 HN TRP 115 -15.060 21.023 -32.675 627 HA TRP 115 HA TRP 115 -14.043 23.401 -31.560 628 HB2 TRP 115 HB2 TRP 115 -12.331 23.223 -33.120 629 HB3 TRP 115 HB1 TRP 115 -12.914 21.555 -33.055 630 HD1 TRP 115 HD1 TRP 115 -15.269 21.390 -34.875 631 HE1 TRP 115 HE1 TRP 115 -15.174 21.961 -37.384 632 HE3 TRP 115 HE3 TRP 115 -11.110 24.348 -34.942 633 HZ2 TRP 115 HZ2 TRP 115 -13.544 23.474 -39.186 634 HZ3 TRP 115 HZ3 TRP 115 -10.307 25.341 -37.066 635 HH2 TRP 115 HH2 TRP 115 -11.518 24.907 -39.186 636 H SER 116 HN SER 116 -16.216 22.812 -34.259 637 HA SER 116 HA SER 116 -17.438 24.222 -35.594 638 HB2 SER 116 HB2 SER 116 -18.386 24.963 -33.493 639 HB3 SER 116 HB1 SER 116 -17.014 26.035 -33.208 640 HG SER 116 HG SER 116 -18.835 26.184 -35.387 641 H LYS 117 HN LYS 117 -17.375 26.332 -36.797 642 HA LYS 117 HA LYS 117 -14.841 26.727 -37.973 643 HB2 LYS 117 HB2 LYS 117 -17.386 28.343 -38.065 644 HB3 LYS 117 HB1 LYS 117 -15.958 28.747 -39.018 645 HG2 LYS 117 HG2 LYS 117 -17.282 26.025 -39.082 646 HG3 LYS 117 HG1 LYS 117 -17.663 27.312 -40.226 647 HD2 LYS 117 HD2 LYS 117 -14.873 26.209 -39.769 648 HD3 LYS 117 HD1 LYS 117 -15.937 25.711 -41.084 649 HE2 LYS 117 HE2 LYS 117 -16.054 28.075 -41.852 650 HE3 LYS 117 HE1 LYS 117 -14.915 28.521 -40.581 651 HZ1 LYS 117 HZ1 LYS 117 -14.337 27.542 -43.117 652 HZ2 LYS 117 HZ2 LYS 117 -13.905 26.321 -42.018 653 HZ3 LYS 117 HZ3 LYS 117 -13.247 27.880 -41.861 654 H ILE 118 HN ILE 118 -16.608 28.560 -35.511 655 HA ILE 118 HA ILE 118 -15.919 30.692 -34.636 656 HB ILE 118 HB ILE 118 -14.114 28.532 -33.512 657 HG12 ILE 118 HG12 ILE 118 -16.774 29.590 -32.505 658 HG13 ILE 118 HG11 ILE 118 -16.598 28.107 -33.450 659 HG21 ILE 118 HG21 ILE 118 -13.250 30.126 -32.182 660 HG22 ILE 118 HG22 ILE 118 -14.869 30.536 -31.616 661 HG23 ILE 118 HG23 ILE 118 -14.199 31.347 -33.031 662 HD11 ILE 118 HD1 ILE 118 -16.360 27.109 -31.420 663 HD12 ILE 118 HD2 ILE 118 -15.938 28.622 -30.619 664 HD13 ILE 118 HD3 ILE 118 -14.709 27.724 -31.508 665 H VAL 119 HN VAL 119 -12.768 29.693 -33.957 666 HA VAL 119 HA VAL 119 -11.638 31.206 -36.222 667 HB VAL 119 HB VAL 119 -10.097 32.344 -34.663 668 HG11 VAL 119 HG11 VAL 119 -12.754 32.926 -35.180 669 HG12 VAL 119 HG12 VAL 119 -11.592 34.031 -34.444 670 HG13 VAL 119 HG13 VAL 119 -12.656 33.064 -33.424 671 HG21 VAL 119 HG21 VAL 119 -11.015 30.372 -32.868 672 HG22 VAL 119 HG22 VAL 119 -11.641 31.901 -32.252 673 HG23 VAL 119 HG23 VAL 119 -9.908 31.698 -32.510 674 H VAL 120 HN VAL 120 -9.363 30.804 -36.604 675 HA VAL 120 HA VAL 120 -8.021 28.655 -35.233 676 HB VAL 120 HB VAL 120 -9.267 27.135 -36.489 677 HG11 VAL 120 HG11 VAL 120 -9.022 28.210 -39.176 678 HG12 VAL 120 HG12 VAL 120 -9.821 29.361 -38.107 679 HG13 VAL 120 HG13 VAL 120 -10.475 27.734 -38.296 680 HG21 VAL 120 HG21 VAL 120 -7.436 27.235 -38.711 681 HG22 VAL 120 HG22 VAL 120 -7.470 26.100 -37.364 682 HG23 VAL 120 HG23 VAL 120 -6.569 27.602 -37.221 683 H LEU 121 HN LEU 121 -7.728 29.363 -38.683 684 HA LEU 121 HA LEU 121 -5.003 30.308 -38.218 685 HB2 LEU 121 HB2 LEU 121 -6.511 29.598 -40.740 686 HB3 LEU 121 HB1 LEU 121 -4.862 30.210 -40.721 687 HG LEU 121 HG LEU 121 -5.738 27.758 -39.180 688 HD11 LEU 121 HD11 LEU 121 -4.122 26.855 -41.202 689 HD12 LEU 121 HD12 LEU 121 -5.034 28.122 -42.022 690 HD13 LEU 121 HD13 LEU 121 -5.884 26.792 -41.235 691 HD21 LEU 121 HD21 LEU 121 -3.277 29.330 -39.437 692 HD22 LEU 121 HD22 LEU 121 -3.032 27.614 -39.759 693 HD23 LEU 121 HD23 LEU 121 -3.720 28.133 -38.221 694 H GLU 122 HN GLU 122 -8.032 31.659 -38.406 695 HA GLU 122 HA GLU 122 -8.788 33.816 -38.658 696 HB2 GLU 122 HB2 GLU 122 -6.835 34.315 -37.185 697 HB3 GLU 122 HB1 GLU 122 -5.850 34.547 -38.629 698 HG2 GLU 122 HG2 GLU 122 -7.328 36.355 -39.378 699 HG3 GLU 122 HG1 GLU 122 -8.366 36.105 -37.976 700 H HIS 123 HN HIS 123 -9.295 32.862 -40.860 701 HA HIS 123 HA HIS 123 -7.702 33.519 -43.117 702 HB2 HIS 123 HB2 HIS 123 -10.614 32.797 -42.806 703 HB3 HIS 123 HB1 HIS 123 -9.877 33.119 -44.375 704 HD2 HIS 123 HD2 HIS 123 -8.356 31.009 -45.399 705 HE1 HIS 123 HE1 HIS 123 -8.519 28.526 -41.987 706 HE2 HIS 123 HE2 HIS 123 -7.786 28.657 -44.414 707 H HIS 124 HN HIS 124 -10.097 35.249 -41.270 708 HA HIS 124 HA HIS 124 -10.831 37.227 -43.117 709 HB2 HIS 124 HB2 HIS 124 -11.976 36.913 -40.968 710 HB3 HIS 124 HB1 HIS 124 -10.535 37.456 -40.110 711 HD2 HIS 124 HD2 HIS 124 -10.406 40.208 -39.789 712 HE1 HIS 124 HE1 HIS 124 -13.380 41.261 -42.594 713 HE2 HIS 124 HE2 HIS 124 -11.801 42.160 -40.820 714 H HIS 125 HN HIS 125 -8.151 37.150 -40.779 715 HA HIS 125 HA HIS 125 -7.137 39.724 -41.290 716 HB2 HIS 125 HB2 HIS 125 -6.443 38.359 -39.366 717 HB3 HIS 125 HB1 HIS 125 -5.636 37.232 -40.454 718 HD2 HIS 125 HD2 HIS 125 -3.033 37.961 -41.076 719 HE1 HIS 125 HE1 HIS 125 -3.210 41.952 -39.712 720 HE2 HIS 125 HE2 HIS 125 -1.684 40.157 -40.663 721 H HIS 126 HN HIS 126 -6.344 36.580 -42.757 722 HA HIS 126 HA HIS 126 -5.463 37.940 -45.180 723 HB2 HIS 126 HB2 HIS 126 -3.280 36.848 -45.231 724 HB3 HIS 126 HB1 HIS 126 -3.419 37.834 -43.776 725 HD2 HIS 126 HD2 HIS 126 -3.193 36.410 -41.383 726 HE1 HIS 126 HE1 HIS 126 -3.200 32.535 -43.059 727 HE2 HIS 126 HE2 HIS 126 -2.892 33.860 -40.915 728 H HIS 127 HN HIS 127 -5.017 36.376 -46.938 729 HA HIS 127 HA HIS 127 -5.815 34.678 -48.271 730 HB2 HIS 127 HB2 HIS 127 -5.272 33.178 -45.701 731 HB3 HIS 127 HB1 HIS 127 -5.625 32.399 -47.243 732 HD2 HIS 127 HD2 HIS 127 -3.477 32.350 -49.057 733 HE1 HIS 127 HE1 HIS 127 -0.761 34.545 -46.685 734 HE2 HIS 127 HE2 HIS 127 -1.013 33.175 -48.809 735 H HIS 128 HN HIS 128 -7.846 36.246 -47.169 736 HA HIS 128 HA HIS 128 -9.886 34.856 -45.838 737 HB2 HIS 128 HB2 HIS 128 -9.910 37.291 -46.118 738 HB3 HIS 128 HB1 HIS 128 -10.120 37.099 -47.859 739 HD2 HIS 128 HD2 HIS 128 -12.774 36.898 -48.631 740 HE1 HIS 128 HE1 HIS 128 -14.423 36.054 -44.837 741 HE2 HIS 128 HE2 HIS 128 -14.973 36.518 -47.272 Start of MODEL 10 1 H1 MET 36 HT1 MET 36 -26.460 -1.639 -6.433 2 H2 MET 36 HT2 MET 36 -26.382 -2.946 -5.349 3 H3 MET 36 HT3 MET 36 -26.875 -3.199 -6.955 4 HA MET 36 HA MET 36 -24.227 -3.027 -5.845 5 HB2 MET 36 HB2 MET 36 -25.367 -4.037 -8.468 6 HB3 MET 36 HB1 MET 36 -23.725 -4.323 -7.891 7 HG2 MET 36 HG2 MET 36 -26.263 -5.193 -6.478 8 HG3 MET 36 HG1 MET 36 -25.176 -6.250 -7.380 9 HE1 MET 36 HE1 MET 36 -22.224 -6.839 -5.709 10 HE2 MET 36 HE2 MET 36 -21.975 -5.136 -6.086 11 HE3 MET 36 HE3 MET 36 -22.876 -6.156 -7.205 12 HA PRO 37 HA PRO 37 -23.507 0.978 -7.764 13 HB2 PRO 37 HB2 PRO 37 -20.723 0.339 -6.923 14 HB3 PRO 37 HB1 PRO 37 -21.713 1.766 -6.553 15 HG2 PRO 37 HG2 PRO 37 -21.227 -0.073 -4.703 16 HG3 PRO 37 HG1 PRO 37 -22.808 0.721 -4.814 17 HD2 PRO 37 HD2 PRO 37 -22.015 -2.031 -5.726 18 HD3 PRO 37 HD1 PRO 37 -23.518 -1.494 -4.941 19 H VAL 38 HN VAL 38 -22.691 1.621 -9.741 20 HA VAL 38 HA VAL 38 -22.074 -0.336 -11.673 21 HB VAL 38 HB VAL 38 -23.054 1.838 -12.253 22 HG11 VAL 38 HG11 VAL 38 -21.889 3.243 -10.633 23 HG12 VAL 38 HG12 VAL 38 -21.561 3.844 -12.258 24 HG13 VAL 38 HG13 VAL 38 -20.341 2.899 -11.405 25 HG21 VAL 38 HG21 VAL 38 -21.144 2.453 -14.012 26 HG22 VAL 38 HG22 VAL 38 -22.071 0.959 -14.160 27 HG23 VAL 38 HG23 VAL 38 -20.461 0.929 -13.443 28 H THR 39 HN THR 39 -20.009 1.870 -9.820 29 HA THR 39 HA THR 39 -17.777 1.630 -9.249 30 HB THR 39 HB THR 39 -17.183 -0.623 -11.042 31 HG1 THR 39 HG1 THR 39 -18.859 -1.748 -10.542 32 HG21 THR 39 HG21 THR 39 -15.991 0.430 -8.903 33 HG22 THR 39 HG22 THR 39 -15.885 -1.294 -9.256 34 HG23 THR 39 HG23 THR 39 -17.040 -0.709 -8.060 35 H GLU 40 HN GLU 40 -16.026 2.668 -10.082 36 HA GLU 40 HA GLU 40 -16.226 3.957 -12.577 37 HB2 GLU 40 HB2 GLU 40 -14.874 4.812 -10.696 38 HB3 GLU 40 HB1 GLU 40 -13.759 3.462 -10.899 39 HG2 GLU 40 HG2 GLU 40 -13.248 4.206 -13.185 40 HG3 GLU 40 HG1 GLU 40 -14.385 5.540 -13.009 41 H GLN 41 HN GLN 41 -14.343 1.114 -11.552 42 HA GLN 41 HA GLN 41 -13.009 0.699 -14.012 43 HB2 GLN 41 HB2 GLN 41 -12.313 -0.356 -11.892 44 HB3 GLN 41 HB1 GLN 41 -13.780 -1.335 -11.907 45 HG2 GLN 41 HG2 GLN 41 -13.096 -2.312 -14.075 46 HG3 GLN 41 HG1 GLN 41 -11.614 -1.357 -14.029 47 HE21 GLN 41 HE21 GLN 41 -9.865 -2.529 -13.251 48 HE22 GLN 41 HE22 GLN 41 -9.960 -3.786 -12.115 49 H GLY 42 HN GLY 42 -16.066 -0.527 -12.726 50 HA2 GLY 42 HA2 GLY 42 -16.685 -2.308 -14.826 51 HA3 GLY 42 HA1 GLY 42 -17.850 -1.584 -13.720 52 H LEU 43 HN LEU 43 -17.215 1.141 -14.394 53 HA LEU 43 HA LEU 43 -19.035 1.583 -16.498 54 HB2 LEU 43 HB2 LEU 43 -18.513 3.249 -14.732 55 HB3 LEU 43 HB1 LEU 43 -16.908 3.456 -15.435 56 HG LEU 43 HG LEU 43 -17.912 4.161 -17.561 57 HD11 LEU 43 HD11 LEU 43 -19.964 2.869 -17.460 58 HD12 LEU 43 HD12 LEU 43 -20.369 4.579 -17.626 59 HD13 LEU 43 HD13 LEU 43 -20.510 3.786 -16.056 60 HD21 LEU 43 HD21 LEU 43 -17.416 5.894 -15.889 61 HD22 LEU 43 HD22 LEU 43 -18.991 5.638 -15.138 62 HD23 LEU 43 HD23 LEU 43 -18.890 6.314 -16.763 63 H ARG 44 HN ARG 44 -15.498 1.551 -16.443 64 HA ARG 44 HA ARG 44 -15.055 2.432 -19.070 65 HB2 ARG 44 HB2 ARG 44 -13.276 2.214 -17.351 66 HB3 ARG 44 HB1 ARG 44 -13.407 0.459 -17.465 67 HG2 ARG 44 HG2 ARG 44 -12.753 0.513 -19.810 68 HG3 ARG 44 HG1 ARG 44 -12.744 2.277 -19.800 69 HD2 ARG 44 HD2 ARG 44 -10.977 0.559 -18.037 70 HD3 ARG 44 HD1 ARG 44 -10.460 1.264 -19.566 71 HE ARG 44 HE ARG 44 -11.485 3.344 -18.003 72 HH11 ARG 44 HH11 ARG 44 -8.920 1.022 -17.952 73 HH12 ARG 44 HH12 ARG 44 -7.839 2.030 -17.048 74 HH21 ARG 44 HH21 ARG 44 -10.073 4.672 -16.817 75 HH22 ARG 44 HH22 ARG 44 -8.492 4.096 -16.407 76 H GLU 45 HN GLU 45 -15.655 -0.795 -17.759 77 HA GLU 45 HA GLU 45 -15.211 -2.242 -20.145 78 HB2 GLU 45 HB2 GLU 45 -16.908 -2.828 -17.709 79 HB3 GLU 45 HB1 GLU 45 -16.659 -3.986 -19.016 80 HG2 GLU 45 HG2 GLU 45 -14.251 -3.946 -18.647 81 HG3 GLU 45 HG1 GLU 45 -14.430 -2.693 -17.418 82 H ARG 46 HN ARG 46 -18.133 -0.760 -18.769 83 HA ARG 46 HA ARG 46 -19.908 -1.751 -20.755 84 HB2 ARG 46 HB2 ARG 46 -20.099 0.549 -18.800 85 HB3 ARG 46 HB1 ARG 46 -21.415 0.098 -19.884 86 HG2 ARG 46 HG2 ARG 46 -21.427 -2.179 -18.932 87 HG3 ARG 46 HG1 ARG 46 -20.101 -1.734 -17.859 88 HD2 ARG 46 HD2 ARG 46 -21.516 0.007 -16.829 89 HD3 ARG 46 HD1 ARG 46 -22.843 -0.446 -17.895 90 HE ARG 46 HE ARG 46 -21.991 -2.746 -16.506 91 HH11 ARG 46 HH11 ARG 46 -23.491 0.325 -15.971 92 HH12 ARG 46 HH12 ARG 46 -24.408 -0.206 -14.601 93 HH21 ARG 46 HH21 ARG 46 -23.185 -3.451 -14.710 94 HH22 ARG 46 HH22 ARG 46 -24.233 -2.347 -13.886 95 H ILE 47 HN ILE 47 -18.107 1.275 -20.361 96 HA ILE 47 HA ILE 47 -19.201 2.577 -22.612 97 HB ILE 47 HB ILE 47 -16.580 2.969 -21.166 98 HG12 ILE 47 HG12 ILE 47 -18.678 3.382 -19.909 99 HG13 ILE 47 HG11 ILE 47 -17.748 4.858 -20.168 100 HG21 ILE 47 HG21 ILE 47 -17.908 4.502 -23.402 101 HG22 ILE 47 HG22 ILE 47 -16.249 3.906 -23.329 102 HG23 ILE 47 HG23 ILE 47 -16.746 5.257 -22.309 103 HD11 ILE 47 HD1 ILE 47 -20.007 5.431 -20.682 104 HD12 ILE 47 HD2 ILE 47 -20.245 3.950 -21.606 105 HD13 ILE 47 HD3 ILE 47 -19.213 5.228 -22.244 106 H GLU 48 HN GLU 48 -16.298 0.627 -22.155 107 HA GLU 48 HA GLU 48 -15.249 0.892 -24.759 108 HB2 GLU 48 HB2 GLU 48 -13.938 0.038 -22.868 109 HB3 GLU 48 HB1 GLU 48 -14.953 -1.409 -22.804 110 HG2 GLU 48 HG2 GLU 48 -13.546 -0.590 -25.360 111 HG3 GLU 48 HG1 GLU 48 -12.707 -1.544 -24.134 112 H SER 49 HN SER 49 -17.525 -1.411 -23.329 113 HA SER 49 HA SER 49 -17.788 -2.856 -25.841 114 HB2 SER 49 HB2 SER 49 -19.227 -3.152 -23.192 115 HB3 SER 49 HB1 SER 49 -19.465 -4.202 -24.587 116 HG SER 49 HG SER 49 -17.553 -4.288 -22.727 117 H ALA 50 HN ALA 50 -19.062 -0.037 -24.447 118 HA ALA 50 HA ALA 50 -21.659 -0.316 -25.790 119 HB1 ALA 50 HB1 ALA 50 -20.454 1.742 -23.944 120 HB2 ALA 50 HB2 ALA 50 -21.841 0.691 -23.651 121 HB3 ALA 50 HB3 ALA 50 -21.970 2.028 -24.796 122 H ILE 51 HN ILE 51 -18.531 0.761 -26.455 123 HA ILE 51 HA ILE 51 -19.353 1.848 -28.996 124 HB ILE 51 HB ILE 51 -19.018 4.076 -28.680 125 HG12 ILE 51 HG12 ILE 51 -16.950 3.506 -26.523 126 HG13 ILE 51 HG11 ILE 51 -16.561 3.691 -28.235 127 HG21 ILE 51 HG21 ILE 51 -20.641 3.670 -26.968 128 HG22 ILE 51 HG22 ILE 51 -19.465 4.789 -26.280 129 HG23 ILE 51 HG23 ILE 51 -19.411 3.078 -25.852 130 HD11 ILE 51 HD1 ILE 51 -16.239 5.796 -26.985 131 HD12 ILE 51 HD2 ILE 51 -17.944 5.779 -26.533 132 HD13 ILE 51 HD3 ILE 51 -17.481 5.951 -28.226 133 HA PRO 52 HA PRO 52 -15.350 0.526 -30.231 134 HB2 PRO 52 HB2 PRO 52 -14.489 2.562 -31.868 135 HB3 PRO 52 HB1 PRO 52 -15.729 1.381 -32.339 136 HG2 PRO 52 HG2 PRO 52 -16.060 4.164 -31.309 137 HG3 PRO 52 HG1 PRO 52 -16.918 3.339 -32.620 138 HD2 PRO 52 HD2 PRO 52 -18.024 3.631 -30.170 139 HD3 PRO 52 HD1 PRO 52 -18.320 2.186 -31.165 140 H GLN 53 HN GLN 53 -13.097 0.775 -29.884 141 HA GLN 53 HA GLN 53 -12.218 1.865 -27.547 142 HB2 GLN 53 HB2 GLN 53 -9.942 1.765 -28.465 143 HB3 GLN 53 HB1 GLN 53 -10.874 0.336 -28.920 144 HG2 GLN 53 HG2 GLN 53 -11.394 1.412 -31.108 145 HG3 GLN 53 HG1 GLN 53 -10.376 2.777 -30.652 146 HE21 GLN 53 HE21 GLN 53 -9.139 2.038 -32.695 147 HE22 GLN 53 HE22 GLN 53 -7.965 0.828 -32.494 148 H VAL 54 HN VAL 54 -13.151 3.611 -30.319 149 HA VAL 54 HA VAL 54 -12.906 5.810 -30.963 150 HB VAL 54 HB VAL 54 -13.176 7.374 -28.927 151 HG11 VAL 54 HG11 VAL 54 -15.026 6.554 -30.394 152 HG12 VAL 54 HG12 VAL 54 -15.531 6.777 -28.718 153 HG13 VAL 54 HG13 VAL 54 -15.205 5.156 -29.332 154 HG21 VAL 54 HG21 VAL 54 -12.240 5.834 -27.251 155 HG22 VAL 54 HG22 VAL 54 -13.508 4.660 -27.603 156 HG23 VAL 54 HG23 VAL 54 -13.918 6.209 -26.867 157 H TYR 55 HN TYR 55 -11.740 7.973 -30.187 158 HA TYR 55 HA TYR 55 -8.979 7.554 -30.640 159 HB2 TYR 55 HB2 TYR 55 -10.016 9.674 -31.211 160 HB3 TYR 55 HB1 TYR 55 -10.405 9.972 -29.517 161 HD1 TYR 55 HD1 TYR 55 -7.570 9.498 -31.891 162 HD2 TYR 55 HD2 TYR 55 -8.817 10.925 -28.037 163 HE1 TYR 55 HE1 TYR 55 -5.341 10.528 -31.550 164 HE2 TYR 55 HE2 TYR 55 -6.587 11.957 -27.696 165 HH TYR 55 HH TYR 55 -4.123 11.887 -30.256 166 H HIS 56 HN HIS 56 -10.707 8.449 -27.650 167 HA HIS 56 HA HIS 56 -8.927 6.943 -26.007 168 HB2 HIS 56 HB2 HIS 56 -7.518 8.958 -26.594 169 HB3 HIS 56 HB1 HIS 56 -8.692 9.939 -25.711 170 HD2 HIS 56 HD2 HIS 56 -5.738 7.517 -24.970 171 HE1 HIS 56 HE1 HIS 56 -7.462 8.556 -21.259 172 HE2 HIS 56 HE2 HIS 56 -5.492 7.406 -22.372 173 H ILE 57 HN ILE 57 -9.645 6.812 -23.853 174 HA ILE 57 HA ILE 57 -12.114 8.312 -23.230 175 HB ILE 57 HB ILE 57 -12.675 5.993 -23.950 176 HG12 ILE 57 HG12 ILE 57 -13.067 6.375 -20.974 177 HG13 ILE 57 HG11 ILE 57 -13.958 7.290 -22.193 178 HG21 ILE 57 HG21 ILE 57 -10.378 5.373 -22.435 179 HG22 ILE 57 HG22 ILE 57 -11.459 4.237 -23.243 180 HG23 ILE 57 HG23 ILE 57 -11.737 4.672 -21.557 181 HD11 ILE 57 HD1 ILE 57 -15.131 5.199 -21.343 182 HD12 ILE 57 HD2 ILE 57 -13.874 4.266 -22.155 183 HD13 ILE 57 HD3 ILE 57 -14.948 5.303 -23.094 184 H ILE 58 HN ILE 58 -12.096 9.243 -21.282 185 HA ILE 58 HA ILE 58 -10.102 8.324 -19.301 186 HB ILE 58 HB ILE 58 -10.923 11.172 -19.914 187 HG12 ILE 58 HG12 ILE 58 -8.224 9.816 -20.182 188 HG13 ILE 58 HG11 ILE 58 -9.343 10.027 -21.529 189 HG21 ILE 58 HG21 ILE 58 -8.964 11.583 -18.270 190 HG22 ILE 58 HG22 ILE 58 -9.224 9.916 -17.759 191 HG23 ILE 58 HG23 ILE 58 -10.516 11.102 -17.585 192 HD11 ILE 58 HD1 ILE 58 -9.176 12.548 -20.276 193 HD12 ILE 58 HD2 ILE 58 -8.493 12.088 -21.836 194 HD13 ILE 58 HD3 ILE 58 -7.519 11.949 -20.372 195 H VAL 59 HN VAL 59 -10.875 7.884 -17.321 196 HA VAL 59 HA VAL 59 -13.615 8.798 -16.678 197 HB VAL 59 HB VAL 59 -12.219 6.243 -15.845 198 HG11 VAL 59 HG11 VAL 59 -14.872 7.490 -15.120 199 HG12 VAL 59 HG12 VAL 59 -13.620 6.877 -14.041 200 HG13 VAL 59 HG13 VAL 59 -14.597 5.753 -14.987 201 HG21 VAL 59 HG21 VAL 59 -13.405 6.784 -18.245 202 HG22 VAL 59 HG22 VAL 59 -14.789 6.213 -17.315 203 HG23 VAL 59 HG23 VAL 59 -13.370 5.183 -17.510 204 H THR 60 HN THR 60 -13.783 10.076 -14.955 205 HA THR 60 HA THR 60 -11.643 9.998 -12.916 206 HB THR 60 HB THR 60 -13.037 12.464 -13.982 207 HG1 THR 60 HG1 THR 60 -11.241 12.794 -15.088 208 HG21 THR 60 HG21 THR 60 -10.646 12.851 -12.385 209 HG22 THR 60 HG22 THR 60 -11.883 11.987 -11.473 210 HG23 THR 60 HG23 THR 60 -12.246 13.562 -12.182 211 H ASP 61 HN ASP 61 -12.317 9.855 -10.851 212 HA ASP 61 HA ASP 61 -15.188 9.705 -10.355 213 HB2 ASP 61 HB2 ASP 61 -13.686 7.979 -9.428 214 HB3 ASP 61 HB1 ASP 61 -12.843 9.221 -8.502 215 H LEU 62 HN LEU 62 -16.185 11.593 -10.032 216 HA LEU 62 HA LEU 62 -14.822 13.688 -8.463 217 HB2 LEU 62 HB2 LEU 62 -15.661 14.274 -10.755 218 HB3 LEU 62 HB1 LEU 62 -17.299 13.957 -10.180 219 HG LEU 62 HG LEU 62 -15.537 15.819 -8.619 220 HD11 LEU 62 HD11 LEU 62 -17.293 17.127 -10.575 221 HD12 LEU 62 HD12 LEU 62 -15.963 16.240 -11.319 222 HD13 LEU 62 HD13 LEU 62 -15.627 17.502 -10.134 223 HD21 LEU 62 HD21 LEU 62 -18.185 16.737 -8.848 224 HD22 LEU 62 HD22 LEU 62 -17.474 15.912 -7.462 225 HD23 LEU 62 HD23 LEU 62 -18.319 14.984 -8.701 226 H SER 63 HN SER 63 -15.470 14.074 -6.451 227 HA SER 63 HA SER 63 -16.975 14.402 -4.691 228 HB2 SER 63 HB2 SER 63 -18.788 14.473 -6.507 229 HB3 SER 63 HB1 SER 63 -19.009 12.756 -6.187 230 HG SER 63 HG SER 63 -19.132 14.842 -4.259 231 H TYR 64 HN TYR 64 -18.964 11.900 -4.588 232 HA TYR 64 HA TYR 64 -17.258 10.374 -2.827 233 HB2 TYR 64 HB2 TYR 64 -20.127 10.015 -3.715 234 HB3 TYR 64 HB1 TYR 64 -19.323 8.986 -2.527 235 HD1 TYR 64 HD1 TYR 64 -20.823 12.258 -3.170 236 HD2 TYR 64 HD2 TYR 64 -18.543 9.934 -0.368 237 HE1 TYR 64 HE1 TYR 64 -21.309 13.922 -1.395 238 HE2 TYR 64 HE2 TYR 64 -19.030 11.597 1.406 239 HH TYR 64 HH TYR 64 -19.690 13.871 1.661 240 H GLY 65 HN GLY 65 -16.502 8.306 -3.126 241 HA2 GLY 65 HA2 GLY 65 -16.132 7.452 -5.863 242 HA3 GLY 65 HA1 GLY 65 -15.472 6.677 -4.422 243 H CYS 66 HN CYS 66 -16.266 4.866 -6.067 244 HA CYS 66 HA CYS 66 -17.638 3.039 -6.311 245 HB2 CYS 66 HB2 CYS 66 -18.987 4.179 -3.851 246 HB3 CYS 66 HB1 CYS 66 -19.284 2.575 -4.524 247 HG CYS 66 HG CYS 66 -16.567 3.463 -3.257 248 H GLY 67 HN GLY 67 -18.174 4.747 -8.157 249 HA2 GLY 67 HA2 GLY 67 -19.784 5.455 -9.642 250 HA3 GLY 67 HA1 GLY 67 -20.922 4.445 -8.752 251 H GLN 68 HN GLN 68 -22.646 5.655 -8.257 252 HA GLN 68 HA GLN 68 -23.930 7.350 -7.385 253 HB2 GLN 68 HB2 GLN 68 -21.316 7.960 -5.996 254 HB3 GLN 68 HB1 GLN 68 -22.811 8.839 -5.677 255 HG2 GLN 68 HG2 GLN 68 -23.926 6.795 -4.983 256 HG3 GLN 68 HG1 GLN 68 -22.521 5.832 -5.439 257 HE21 GLN 68 HE21 GLN 68 -23.838 6.310 -2.709 258 HE22 GLN 68 HE22 GLN 68 -22.560 6.826 -1.718 259 H SER 69 HN SER 69 -21.237 9.508 -7.099 260 HA SER 69 HA SER 69 -22.135 10.902 -9.549 261 HB2 SER 69 HB2 SER 69 -21.162 12.087 -6.946 262 HB3 SER 69 HB1 SER 69 -21.498 13.013 -8.404 263 HG SER 69 HG SER 69 -23.232 11.720 -6.638 264 H PHE 70 HN PHE 70 -20.640 11.024 -11.077 265 HA PHE 70 HA PHE 70 -17.875 11.576 -10.409 266 HB2 PHE 70 HB2 PHE 70 -16.969 9.634 -11.608 267 HB3 PHE 70 HB1 PHE 70 -17.950 9.120 -10.233 268 HD1 PHE 70 HD1 PHE 70 -17.780 9.365 -13.908 269 HD2 PHE 70 HD2 PHE 70 -20.123 8.067 -10.550 270 HE1 PHE 70 HE1 PHE 70 -19.238 8.056 -15.430 271 HE2 PHE 70 HE2 PHE 70 -21.579 6.758 -12.070 272 HZ PHE 70 HZ PHE 70 -21.138 6.754 -14.511 273 H ASP 71 HN ASP 71 -16.565 12.021 -12.346 274 HA ASP 71 HA ASP 71 -18.228 12.700 -14.693 275 HB2 ASP 71 HB2 ASP 71 -16.955 14.772 -14.958 276 HB3 ASP 71 HB1 ASP 71 -17.712 14.731 -13.367 277 H ILE 72 HN ILE 72 -17.352 12.274 -16.673 278 HA ILE 72 HA ILE 72 -14.550 11.325 -16.799 279 HB ILE 72 HB ILE 72 -15.268 9.496 -18.283 280 HG12 ILE 72 HG12 ILE 72 -18.094 10.325 -17.547 281 HG13 ILE 72 HG11 ILE 72 -17.332 10.683 -19.101 282 HG21 ILE 72 HG21 ILE 72 -17.048 9.194 -15.900 283 HG22 ILE 72 HG22 ILE 72 -15.325 9.452 -15.618 284 HG23 ILE 72 HG23 ILE 72 -15.866 8.070 -16.571 285 HD11 ILE 72 HD1 ILE 72 -17.403 7.858 -18.061 286 HD12 ILE 72 HD2 ILE 72 -17.253 8.422 -19.726 287 HD13 ILE 72 HD3 ILE 72 -18.803 8.536 -18.893 288 H VAL 73 HN VAL 73 -13.537 11.526 -18.819 289 HA VAL 73 HA VAL 73 -14.932 13.317 -20.708 290 HB VAL 73 HB VAL 73 -12.072 13.483 -19.743 291 HG11 VAL 73 HG11 VAL 73 -12.786 13.890 -22.292 292 HG12 VAL 73 HG12 VAL 73 -11.585 14.896 -21.481 293 HG13 VAL 73 HG13 VAL 73 -13.251 15.456 -21.629 294 HG21 VAL 73 HG21 VAL 73 -14.602 14.941 -19.227 295 HG22 VAL 73 HG22 VAL 73 -13.184 15.954 -19.500 296 HG23 VAL 73 HG23 VAL 73 -13.180 14.761 -18.201 297 H VAL 74 HN VAL 74 -14.927 12.661 -22.766 298 HA VAL 74 HA VAL 74 -12.851 10.769 -23.659 299 HB VAL 74 HB VAL 74 -14.734 9.360 -23.131 300 HG11 VAL 74 HG11 VAL 74 -16.855 10.111 -23.236 301 HG12 VAL 74 HG12 VAL 74 -16.699 10.427 -24.964 302 HG13 VAL 74 HG13 VAL 74 -16.229 11.662 -23.796 303 HG21 VAL 74 HG21 VAL 74 -15.496 8.910 -25.672 304 HG22 VAL 74 HG22 VAL 74 -13.897 8.459 -25.078 305 HG23 VAL 74 HG23 VAL 74 -14.112 9.956 -25.985 306 H VAL 75 HN VAL 75 -12.139 11.111 -25.727 307 HA VAL 75 HA VAL 75 -13.530 13.223 -27.265 308 HB VAL 75 HB VAL 75 -10.567 12.611 -27.137 309 HG11 VAL 75 HG11 VAL 75 -10.304 13.845 -29.011 310 HG12 VAL 75 HG12 VAL 75 -11.398 15.096 -28.419 311 HG13 VAL 75 HG13 VAL 75 -12.043 13.683 -29.253 312 HG21 VAL 75 HG21 VAL 75 -12.292 14.259 -25.547 313 HG22 VAL 75 HG22 VAL 75 -11.249 15.310 -26.506 314 HG23 VAL 75 HG23 VAL 75 -10.539 14.096 -25.443 315 H SER 76 HN SER 76 -14.304 12.607 -29.191 316 HA SER 76 HA SER 76 -12.877 10.727 -30.857 317 HB2 SER 76 HB2 SER 76 -14.623 9.051 -30.982 318 HB3 SER 76 HB1 SER 76 -14.125 9.229 -29.301 319 HG SER 76 HG SER 76 -16.066 9.877 -28.849 320 H ASP 77 HN ASP 77 -13.984 10.435 -32.972 321 HA ASP 77 HA ASP 77 -15.005 12.944 -33.913 322 HB2 ASP 77 HB2 ASP 77 -15.178 11.798 -36.077 323 HB3 ASP 77 HB1 ASP 77 -13.624 11.523 -35.302 324 H PHE 78 HN PHE 78 -16.435 10.392 -32.331 325 HA PHE 78 HA PHE 78 -18.910 10.058 -33.624 326 HB2 PHE 78 HB2 PHE 78 -18.040 8.657 -31.730 327 HB3 PHE 78 HB1 PHE 78 -18.410 9.995 -30.637 328 HD1 PHE 78 HD1 PHE 78 -19.863 7.510 -32.978 329 HD2 PHE 78 HD2 PHE 78 -20.682 10.511 -30.015 330 HE1 PHE 78 HE1 PHE 78 -22.228 6.765 -32.878 331 HE2 PHE 78 HE2 PHE 78 -23.044 9.767 -29.915 332 HZ PHE 78 HZ PHE 78 -23.817 7.893 -31.345 333 H PHE 79 HN PHE 79 -17.570 12.693 -31.866 334 HA PHE 79 HA PHE 79 -20.216 13.901 -31.402 335 HB2 PHE 79 HB2 PHE 79 -18.597 14.014 -29.569 336 HB3 PHE 79 HB1 PHE 79 -17.451 14.847 -30.613 337 HD1 PHE 79 HD1 PHE 79 -20.978 15.111 -29.365 338 HD2 PHE 79 HD2 PHE 79 -17.447 17.183 -30.662 339 HE1 PHE 79 HE1 PHE 79 -22.031 17.276 -28.772 340 HE2 PHE 79 HE2 PHE 79 -18.501 19.347 -30.073 341 HZ PHE 79 HZ PHE 79 -20.794 19.395 -29.129 342 H GLN 80 HN GLN 80 -18.097 13.714 -33.925 343 HA GLN 80 HA GLN 80 -17.978 16.452 -34.750 344 HB2 GLN 80 HB2 GLN 80 -16.399 14.729 -35.563 345 HB3 GLN 80 HB1 GLN 80 -17.729 13.919 -36.393 346 HG2 GLN 80 HG2 GLN 80 -18.118 15.908 -37.768 347 HG3 GLN 80 HG1 GLN 80 -16.846 16.774 -36.906 348 HE21 GLN 80 HE21 GLN 80 -16.600 16.466 -39.692 349 HE22 GLN 80 HE22 GLN 80 -15.353 15.367 -40.029 350 H GLY 81 HN GLY 81 -19.667 17.628 -35.373 351 HA2 GLY 81 HA2 GLY 81 -21.517 18.250 -36.623 352 HA3 GLY 81 HA1 GLY 81 -21.553 16.630 -37.321 353 H LYS 82 HN LYS 82 -21.327 16.324 -34.019 354 HA LYS 82 HA LYS 82 -24.265 16.070 -33.743 355 HB2 LYS 82 HB2 LYS 82 -22.073 14.446 -32.424 356 HB3 LYS 82 HB1 LYS 82 -23.800 14.237 -32.133 357 HG2 LYS 82 HG2 LYS 82 -22.430 13.942 -34.829 358 HG3 LYS 82 HG1 LYS 82 -22.934 12.604 -33.799 359 HD2 LYS 82 HD2 LYS 82 -25.279 13.396 -33.935 360 HD3 LYS 82 HD1 LYS 82 -24.765 14.701 -35.007 361 HE2 LYS 82 HE2 LYS 82 -24.372 11.748 -35.582 362 HE3 LYS 82 HE1 LYS 82 -25.669 12.735 -36.256 363 HZ1 LYS 82 HZ1 LYS 82 -22.968 12.528 -37.087 364 HZ2 LYS 82 HZ2 LYS 82 -23.337 14.140 -36.695 365 HZ3 LYS 82 HZ3 LYS 82 -24.264 13.310 -37.852 366 H SER 83 HN SER 83 -25.233 17.033 -32.044 367 HA SER 83 HA SER 83 -23.722 18.929 -30.487 368 HB2 SER 83 HB2 SER 83 -25.854 19.593 -29.573 369 HB3 SER 83 HB1 SER 83 -26.048 19.351 -31.307 370 HG SER 83 HG SER 83 -26.417 17.049 -29.953 371 H LYS 84 HN LYS 84 -23.958 19.033 -28.087 372 HA LYS 84 HA LYS 84 -22.943 16.700 -26.881 373 HB2 LYS 84 HB2 LYS 84 -22.570 18.985 -26.003 374 HB3 LYS 84 HB1 LYS 84 -24.273 19.073 -25.552 375 HG2 LYS 84 HG2 LYS 84 -23.999 17.153 -24.050 376 HG3 LYS 84 HG1 LYS 84 -22.307 17.005 -24.526 377 HD2 LYS 84 HD2 LYS 84 -21.865 19.276 -23.652 378 HD3 LYS 84 HD1 LYS 84 -23.552 19.408 -23.156 379 HE2 LYS 84 HE2 LYS 84 -23.278 17.472 -21.661 380 HE3 LYS 84 HE1 LYS 84 -21.596 17.312 -22.168 381 HZ1 LYS 84 HZ1 LYS 84 -21.333 19.686 -21.398 382 HZ2 LYS 84 HZ2 LYS 84 -21.545 18.520 -20.180 383 HZ3 LYS 84 HZ3 LYS 84 -22.841 19.519 -20.639 384 H LEU 85 HN LEU 85 -26.202 18.146 -26.801 385 HA LEU 85 HA LEU 85 -27.357 16.208 -25.091 386 HB2 LEU 85 HB2 LEU 85 -28.551 18.046 -27.169 387 HB3 LEU 85 HB1 LEU 85 -29.524 17.022 -26.114 388 HG LEU 85 HG LEU 85 -27.471 18.996 -25.082 389 HD11 LEU 85 HD11 LEU 85 -29.590 20.297 -24.431 390 HD12 LEU 85 HD12 LEU 85 -30.435 19.289 -25.605 391 HD13 LEU 85 HD13 LEU 85 -29.128 20.349 -26.132 392 HD21 LEU 85 HD21 LEU 85 -28.689 16.847 -23.856 393 HD22 LEU 85 HD22 LEU 85 -29.768 18.176 -23.431 394 HD23 LEU 85 HD23 LEU 85 -28.056 18.260 -23.012 395 H MET 86 HN MET 86 -27.108 16.432 -28.625 396 HA MET 86 HA MET 86 -28.656 14.126 -29.202 397 HB2 MET 86 HB2 MET 86 -26.500 15.545 -30.780 398 HB3 MET 86 HB1 MET 86 -27.467 14.215 -31.418 399 HG2 MET 86 HG2 MET 86 -28.575 16.828 -30.343 400 HG3 MET 86 HG1 MET 86 -28.437 16.401 -32.050 401 HE1 MET 86 HE1 MET 86 -30.781 14.152 -33.052 402 HE2 MET 86 HE2 MET 86 -29.816 13.055 -32.069 403 HE3 MET 86 HE3 MET 86 -29.031 14.380 -32.925 404 H ARG 87 HN ARG 87 -25.209 14.641 -28.638 405 HA ARG 87 HA ARG 87 -24.294 12.067 -29.326 406 HB2 ARG 87 HB2 ARG 87 -22.833 14.065 -28.918 407 HB3 ARG 87 HB1 ARG 87 -23.135 13.875 -27.192 408 HG2 ARG 87 HG2 ARG 87 -22.265 11.536 -27.360 409 HG3 ARG 87 HG1 ARG 87 -21.844 11.858 -29.042 410 HD2 ARG 87 HD2 ARG 87 -19.872 12.242 -27.737 411 HD3 ARG 87 HD1 ARG 87 -20.480 13.817 -28.234 412 HE ARG 87 HE ARG 87 -20.965 14.291 -26.004 413 HH11 ARG 87 HH11 ARG 87 -20.283 10.929 -26.466 414 HH12 ARG 87 HH12 ARG 87 -20.234 10.563 -24.774 415 HH21 ARG 87 HH21 ARG 87 -20.899 13.817 -23.778 416 HH22 ARG 87 HH22 ARG 87 -20.583 12.197 -23.253 417 H SER 88 HN SER 88 -25.515 13.416 -26.284 418 HA SER 88 HA SER 88 -24.963 11.226 -24.620 419 HB2 SER 88 HB2 SER 88 -26.704 12.141 -23.150 420 HB3 SER 88 HB1 SER 88 -25.666 13.424 -23.765 421 HG SER 88 HG SER 88 -27.546 14.237 -24.305 422 H ARG 89 HN ARG 89 -27.643 11.877 -26.825 423 HA ARG 89 HA ARG 89 -29.359 9.798 -25.977 424 HB2 ARG 89 HB2 ARG 89 -30.051 11.638 -27.487 425 HB3 ARG 89 HB1 ARG 89 -29.036 10.951 -28.756 426 HG2 ARG 89 HG2 ARG 89 -30.341 8.868 -28.696 427 HG3 ARG 89 HG1 ARG 89 -31.345 9.526 -27.404 428 HD2 ARG 89 HD2 ARG 89 -32.093 11.338 -28.888 429 HD3 ARG 89 HD1 ARG 89 -31.072 10.713 -30.180 430 HE ARG 89 HE ARG 89 -32.771 8.639 -29.334 431 HH11 ARG 89 HH11 ARG 89 -32.897 11.753 -30.839 432 HH12 ARG 89 HH12 ARG 89 -34.314 11.399 -31.770 433 HH21 ARG 89 HH21 ARG 89 -34.623 8.163 -30.563 434 HH22 ARG 89 HH22 ARG 89 -35.291 9.367 -31.614 435 H ALA 90 HN ALA 90 -26.828 9.902 -28.484 436 HA ALA 90 HA ALA 90 -27.166 7.218 -29.342 437 HB1 ALA 90 HB1 ALA 90 -25.701 9.377 -30.211 438 HB2 ALA 90 HB2 ALA 90 -25.560 7.736 -30.841 439 HB3 ALA 90 HB3 ALA 90 -24.449 8.299 -29.593 440 H VAL 91 HN VAL 91 -24.999 8.735 -26.997 441 HA VAL 91 HA VAL 91 -23.623 6.314 -26.336 442 HB VAL 91 HB VAL 91 -22.728 8.668 -26.023 443 HG11 VAL 91 HG11 VAL 91 -23.402 9.923 -24.117 444 HG12 VAL 91 HG12 VAL 91 -24.353 8.579 -23.479 445 HG13 VAL 91 HG13 VAL 91 -24.890 9.432 -24.926 446 HG21 VAL 91 HG21 VAL 91 -21.650 8.067 -23.805 447 HG22 VAL 91 HG22 VAL 91 -21.552 6.805 -25.035 448 HG23 VAL 91 HG23 VAL 91 -22.736 6.678 -23.733 449 H ASN 92 HN ASN 92 -26.397 8.036 -25.056 450 HA ASN 92 HA ASN 92 -26.686 6.719 -22.605 451 HB2 ASN 92 HB2 ASN 92 -27.964 8.731 -23.205 452 HB3 ASN 92 HB1 ASN 92 -28.841 7.813 -24.431 453 HD21 ASN 92 HD21 ASN 92 -30.247 9.058 -22.277 454 HD22 ASN 92 HD22 ASN 92 -30.868 7.841 -21.268 455 H LYS 93 HN LYS 93 -28.070 5.929 -25.793 456 HA LYS 93 HA LYS 93 -29.483 3.630 -24.912 457 HB2 LYS 93 HB2 LYS 93 -29.712 3.092 -27.258 458 HB3 LYS 93 HB1 LYS 93 -29.916 4.831 -27.053 459 HG2 LYS 93 HG2 LYS 93 -27.569 5.187 -27.691 460 HG3 LYS 93 HG1 LYS 93 -27.356 3.451 -27.908 461 HD2 LYS 93 HD2 LYS 93 -29.099 3.462 -29.661 462 HD3 LYS 93 HD1 LYS 93 -29.296 5.202 -29.448 463 HE2 LYS 93 HE2 LYS 93 -26.947 5.559 -30.096 464 HE3 LYS 93 HE1 LYS 93 -26.729 3.821 -30.292 465 HZ1 LYS 93 HZ1 LYS 93 -27.453 5.475 -32.262 466 HZ2 LYS 93 HZ2 LYS 93 -28.977 4.951 -31.723 467 HZ3 LYS 93 HZ3 LYS 93 -27.818 3.819 -32.234 468 H ALA 94 HN ALA 94 -26.187 4.185 -25.955 469 HA ALA 94 HA ALA 94 -25.434 1.500 -26.407 470 HB1 ALA 94 HB1 ALA 94 -24.103 3.497 -27.102 471 HB2 ALA 94 HB2 ALA 94 -23.152 2.290 -26.238 472 HB3 ALA 94 HB3 ALA 94 -23.680 3.756 -25.410 473 H VAL 95 HN VAL 95 -25.479 3.516 -23.512 474 HA VAL 95 HA VAL 95 -25.017 1.083 -21.895 475 HB VAL 95 HB VAL 95 -24.032 3.609 -20.730 476 HG11 VAL 95 HG11 VAL 95 -22.083 2.026 -20.252 477 HG12 VAL 95 HG12 VAL 95 -23.045 0.760 -21.014 478 HG13 VAL 95 HG13 VAL 95 -23.636 1.561 -19.558 479 HG21 VAL 95 HG21 VAL 95 -22.962 2.490 -23.302 480 HG22 VAL 95 HG22 VAL 95 -21.846 3.197 -22.135 481 HG23 VAL 95 HG23 VAL 95 -23.148 4.176 -22.816 482 H LYS 96 HN LYS 96 -27.534 1.621 -22.296 483 HA LYS 96 HA LYS 96 -28.738 3.627 -20.707 484 HB2 LYS 96 HB2 LYS 96 -30.804 2.436 -21.079 485 HB3 LYS 96 HB1 LYS 96 -29.856 2.378 -22.565 486 HG2 LYS 96 HG2 LYS 96 -29.072 0.128 -22.020 487 HG3 LYS 96 HG1 LYS 96 -29.924 0.181 -20.476 488 HD2 LYS 96 HD2 LYS 96 -31.294 -1.054 -22.048 489 HD3 LYS 96 HD1 LYS 96 -32.070 0.501 -21.745 490 HE2 LYS 96 HE2 LYS 96 -31.107 1.408 -23.813 491 HE3 LYS 96 HE1 LYS 96 -30.275 -0.117 -24.110 492 HZ1 LYS 96 HZ1 LYS 96 -33.214 0.284 -23.973 493 HZ2 LYS 96 HZ2 LYS 96 -32.445 -1.219 -24.170 494 HZ3 LYS 96 HZ3 LYS 96 -32.306 -0.026 -25.373 495 H GLU 97 HN GLU 97 -27.580 0.413 -19.990 496 HA GLU 97 HA GLU 97 -28.947 -0.021 -17.555 497 HB2 GLU 97 HB2 GLU 97 -26.269 -1.042 -18.526 498 HB3 GLU 97 HB1 GLU 97 -27.087 -1.622 -17.076 499 HG2 GLU 97 HG2 GLU 97 -28.302 -1.663 -19.853 500 HG3 GLU 97 HG1 GLU 97 -27.531 -3.049 -19.084 501 H GLU 98 HN GLU 98 -25.982 1.683 -18.358 502 HA GLU 98 HA GLU 98 -24.950 2.050 -15.767 503 HB2 GLU 98 HB2 GLU 98 -23.649 2.561 -17.776 504 HB3 GLU 98 HB1 GLU 98 -24.761 3.870 -18.181 505 HG2 GLU 98 HG2 GLU 98 -22.810 4.814 -17.075 506 HG3 GLU 98 HG1 GLU 98 -24.202 4.958 -16.003 507 H LEU 99 HN LEU 99 -27.339 3.896 -17.615 508 HA LEU 99 HA LEU 99 -27.560 6.081 -15.853 509 HB2 LEU 99 HB2 LEU 99 -29.565 4.833 -17.738 510 HB3 LEU 99 HB1 LEU 99 -29.835 6.349 -16.877 511 HG LEU 99 HG LEU 99 -27.467 5.837 -18.693 512 HD11 LEU 99 HD11 LEU 99 -29.533 5.817 -20.003 513 HD12 LEU 99 HD12 LEU 99 -28.649 7.315 -20.293 514 HD13 LEU 99 HD13 LEU 99 -30.058 7.315 -19.232 515 HD21 LEU 99 HD21 LEU 99 -27.185 7.548 -16.909 516 HD22 LEU 99 HD22 LEU 99 -28.599 8.398 -17.533 517 HD23 LEU 99 HD23 LEU 99 -27.149 8.247 -18.526 518 H GLN 100 HN GLN 100 -29.215 2.948 -15.925 519 HA GLN 100 HA GLN 100 -31.078 3.490 -13.866 520 HB2 GLN 100 HB2 GLN 100 -31.233 1.564 -15.425 521 HB3 GLN 100 HB1 GLN 100 -29.840 0.835 -14.625 522 HG2 GLN 100 HG2 GLN 100 -31.070 0.812 -12.489 523 HG3 GLN 100 HG1 GLN 100 -32.463 1.547 -13.282 524 HE21 GLN 100 HE21 GLN 100 -33.961 -0.183 -13.229 525 HE22 GLN 100 HE22 GLN 100 -33.665 -1.703 -13.924 526 H GLU 101 HN GLU 101 -27.788 2.180 -13.824 527 HA GLU 101 HA GLU 101 -27.790 1.765 -10.968 528 HB2 GLU 101 HB2 GLU 101 -25.579 1.701 -13.029 529 HB3 GLU 101 HB1 GLU 101 -25.347 1.330 -11.320 530 HG2 GLU 101 HG2 GLU 101 -27.002 -0.479 -11.466 531 HG3 GLU 101 HG1 GLU 101 -27.286 -0.094 -13.164 532 H ILE 102 HN ILE 102 -26.920 4.320 -13.182 533 HA ILE 102 HA ILE 102 -26.144 5.979 -10.863 534 HB ILE 102 HB ILE 102 -24.205 5.143 -12.384 535 HG12 ILE 102 HG12 ILE 102 -23.149 7.443 -12.264 536 HG13 ILE 102 HG11 ILE 102 -24.713 8.054 -11.718 537 HG21 ILE 102 HG21 ILE 102 -25.751 5.993 -14.410 538 HG22 ILE 102 HG22 ILE 102 -23.990 6.027 -14.500 539 HG23 ILE 102 HG23 ILE 102 -24.881 7.492 -14.092 540 HD11 ILE 102 HD1 ILE 102 -24.414 7.229 -9.638 541 HD12 ILE 102 HD2 ILE 102 -22.730 6.970 -10.091 542 HD13 ILE 102 HD3 ILE 102 -23.900 5.661 -10.260 543 H HIS 103 HN HIS 103 -27.186 7.896 -10.784 544 HA HIS 103 HA HIS 103 -28.698 8.719 -13.191 545 HB2 HIS 103 HB2 HIS 103 -29.337 9.221 -10.274 546 HB3 HIS 103 HB1 HIS 103 -30.292 9.783 -11.648 547 HD2 HIS 103 HD2 HIS 103 -30.079 6.705 -9.404 548 HE1 HIS 103 HE1 HIS 103 -32.145 5.458 -12.867 549 HE2 HIS 103 HE2 HIS 103 -31.518 4.818 -10.491 550 H ALA 104 HN ALA 104 -26.384 9.628 -10.791 551 HA ALA 104 HA ALA 104 -26.374 12.399 -11.830 552 HB1 ALA 104 HB1 ALA 104 -25.139 12.916 -9.677 553 HB2 ALA 104 HB2 ALA 104 -25.543 11.282 -9.146 554 HB3 ALA 104 HB3 ALA 104 -26.828 12.444 -9.481 555 H PHE 105 HN PHE 105 -25.043 11.842 -13.627 556 HA PHE 105 HA PHE 105 -22.208 11.621 -12.905 557 HB2 PHE 105 HB2 PHE 105 -21.769 9.810 -14.401 558 HB3 PHE 105 HB1 PHE 105 -23.124 9.306 -13.391 559 HD1 PHE 105 HD1 PHE 105 -22.017 10.137 -16.750 560 HD2 PHE 105 HD2 PHE 105 -25.469 9.423 -14.296 561 HE1 PHE 105 HE1 PHE 105 -23.396 9.835 -18.785 562 HE2 PHE 105 HE2 PHE 105 -26.849 9.120 -16.333 563 HZ PHE 105 HZ PHE 105 -25.812 9.324 -18.578 564 H SER 106 HN SER 106 -20.784 12.192 -14.735 565 HA SER 106 HA SER 106 -22.174 13.843 -16.764 566 HB2 SER 106 HB2 SER 106 -20.266 15.409 -16.671 567 HB3 SER 106 HB1 SER 106 -21.081 15.290 -15.111 568 HG SER 106 HG SER 106 -18.536 14.668 -15.791 569 H CYS 107 HN CYS 107 -21.255 13.898 -18.832 570 HA CYS 107 HA CYS 107 -18.994 12.089 -19.360 571 HB2 CYS 107 HB2 CYS 107 -20.236 11.083 -21.260 572 HB3 CYS 107 HB1 CYS 107 -20.972 10.716 -19.698 573 HG CYS 107 HG CYS 107 -22.123 12.777 -21.745 574 H LYS 108 HN LYS 108 -18.069 14.333 -19.548 575 HA LYS 108 HA LYS 108 -18.884 16.067 -21.631 576 HB2 LYS 108 HB2 LYS 108 -16.233 15.769 -20.200 577 HB3 LYS 108 HB1 LYS 108 -16.614 17.083 -21.314 578 HG2 LYS 108 HG2 LYS 108 -18.531 17.730 -19.905 579 HG3 LYS 108 HG1 LYS 108 -18.154 16.417 -18.789 580 HD2 LYS 108 HD2 LYS 108 -15.950 17.421 -18.340 581 HD3 LYS 108 HD1 LYS 108 -16.316 18.736 -19.458 582 HE2 LYS 108 HE2 LYS 108 -18.245 19.389 -18.062 583 HE3 LYS 108 HE1 LYS 108 -17.877 18.075 -16.942 584 HZ1 LYS 108 HZ1 LYS 108 -15.524 19.476 -17.292 585 HZ2 LYS 108 HZ2 LYS 108 -16.513 19.458 -15.911 586 HZ3 LYS 108 HZ3 LYS 108 -16.726 20.656 -17.097 587 H CYS 109 HN CYS 109 -18.296 16.172 -23.759 588 HA CYS 109 HA CYS 109 -16.315 14.219 -24.758 589 HB2 CYS 109 HB2 CYS 109 -18.574 13.365 -25.196 590 HB3 CYS 109 HB1 CYS 109 -18.992 14.865 -26.025 591 HG CYS 109 HG CYS 109 -17.008 14.247 -27.753 592 H TYR 110 HN TYR 110 -14.745 15.176 -25.916 593 HA TYR 110 HA TYR 110 -15.389 17.738 -27.236 594 HB2 TYR 110 HB2 TYR 110 -12.763 16.959 -25.935 595 HB3 TYR 110 HB1 TYR 110 -13.111 18.481 -26.763 596 HD1 TYR 110 HD1 TYR 110 -13.740 16.462 -23.754 597 HD2 TYR 110 HD2 TYR 110 -14.599 20.153 -25.768 598 HE1 TYR 110 HE1 TYR 110 -14.683 17.383 -21.655 599 HE2 TYR 110 HE2 TYR 110 -15.544 21.076 -23.665 600 HH TYR 110 HH TYR 110 -15.194 19.454 -20.623 601 H THR 111 HN THR 111 -14.708 17.965 -29.307 602 HA THR 111 HA THR 111 -13.017 15.840 -30.456 603 HB THR 111 HB THR 111 -15.638 16.877 -31.544 604 HG1 THR 111 HG1 THR 111 -14.767 14.634 -30.263 605 HG21 THR 111 HG21 THR 111 -13.350 15.455 -32.866 606 HG22 THR 111 HG22 THR 111 -14.363 16.757 -33.491 607 HG23 THR 111 HG23 THR 111 -15.001 15.116 -33.385 608 H GLU 112 HN GLU 112 -14.312 19.095 -30.620 609 HA GLU 112 HA GLU 112 -12.219 20.617 -31.154 610 HB2 GLU 112 HB2 GLU 112 -11.325 19.239 -32.884 611 HB3 GLU 112 HB1 GLU 112 -12.878 19.149 -33.712 612 HG2 GLU 112 HG2 GLU 112 -11.442 20.729 -34.870 613 HG3 GLU 112 HG1 GLU 112 -12.758 21.613 -34.101 614 H GLU 113 HN GLU 113 -15.457 19.879 -31.696 615 HA GLU 113 HA GLU 113 -16.312 22.039 -33.281 616 HB2 GLU 113 HB2 GLU 113 -17.750 20.493 -31.123 617 HB3 GLU 113 HB1 GLU 113 -18.519 21.663 -32.200 618 HG2 GLU 113 HG2 GLU 113 -17.800 20.336 -34.161 619 HG3 GLU 113 HG1 GLU 113 -17.025 19.173 -33.087 620 H GLU 114 HN GLU 114 -15.743 21.735 -29.801 621 HA GLU 114 HA GLU 114 -16.933 24.142 -28.976 622 HB2 GLU 114 HB2 GLU 114 -14.570 22.610 -27.875 623 HB3 GLU 114 HB1 GLU 114 -15.293 23.996 -27.058 624 HG2 GLU 114 HG2 GLU 114 -17.469 22.841 -27.012 625 HG3 GLU 114 HG1 GLU 114 -16.756 21.459 -27.845 626 H TRP 115 HN TRP 115 -14.058 23.525 -30.762 627 HA TRP 115 HA TRP 115 -12.688 25.966 -30.164 628 HB2 TRP 115 HB2 TRP 115 -11.045 25.006 -31.377 629 HB3 TRP 115 HB1 TRP 115 -12.104 23.603 -31.558 630 HD1 TRP 115 HD1 TRP 115 -10.140 25.741 -33.627 631 HE1 TRP 115 HE1 TRP 115 -11.067 25.939 -36.024 632 HE3 TRP 115 HE3 TRP 115 -14.857 23.927 -32.899 633 HZ2 TRP 115 HZ2 TRP 115 -13.495 25.404 -37.442 634 HZ3 TRP 115 HZ3 TRP 115 -16.459 23.791 -34.784 635 HH2 TRP 115 HH2 TRP 115 -15.784 24.527 -37.053 636 H SER 116 HN SER 116 -15.631 25.672 -31.366 637 HA SER 116 HA SER 116 -15.674 26.971 -33.841 638 HB2 SER 116 HB2 SER 116 -18.010 27.485 -33.331 639 HB3 SER 116 HB1 SER 116 -17.623 25.834 -32.852 640 HG SER 116 HG SER 116 -17.070 27.599 -30.877 641 H LYS 117 HN LYS 117 -15.121 28.135 -30.646 642 HA LYS 117 HA LYS 117 -15.160 30.930 -31.615 643 HB2 LYS 117 HB2 LYS 117 -15.687 29.819 -28.856 644 HB3 LYS 117 HB1 LYS 117 -15.429 31.533 -29.181 645 HG2 LYS 117 HG2 LYS 117 -17.328 31.517 -30.763 646 HG3 LYS 117 HG1 LYS 117 -17.595 29.808 -30.417 647 HD2 LYS 117 HD2 LYS 117 -18.075 30.304 -28.085 648 HD3 LYS 117 HD1 LYS 117 -17.674 32.005 -28.330 649 HE2 LYS 117 HE2 LYS 117 -20.099 31.717 -28.387 650 HE3 LYS 117 HE1 LYS 117 -19.512 32.176 -29.985 651 HZ1 LYS 117 HZ1 LYS 117 -20.665 29.664 -29.082 652 HZ2 LYS 117 HZ2 LYS 117 -19.356 29.533 -30.157 653 HZ3 LYS 117 HZ3 LYS 117 -20.740 30.410 -30.605 654 H ILE 118 HN ILE 118 -13.437 32.246 -31.094 655 HA ILE 118 HA ILE 118 -11.372 32.100 -29.416 656 HB ILE 118 HB ILE 118 -11.207 29.825 -31.316 657 HG12 ILE 118 HG12 ILE 118 -9.661 30.213 -28.763 658 HG13 ILE 118 HG11 ILE 118 -11.393 29.877 -28.700 659 HG21 ILE 118 HG21 ILE 118 -8.709 29.897 -31.279 660 HG22 ILE 118 HG22 ILE 118 -8.799 31.518 -30.590 661 HG23 ILE 118 HG23 ILE 118 -9.419 31.215 -32.213 662 HD11 ILE 118 HD1 ILE 118 -10.312 28.065 -30.583 663 HD12 ILE 118 HD2 ILE 118 -10.925 27.690 -28.973 664 HD13 ILE 118 HD3 ILE 118 -9.214 28.049 -29.201 665 H VAL 119 HN VAL 119 -12.442 32.465 -32.668 666 HA VAL 119 HA VAL 119 -12.105 34.243 -34.115 667 HB VAL 119 HB VAL 119 -9.765 35.213 -32.510 668 HG11 VAL 119 HG11 VAL 119 -10.022 36.798 -34.107 669 HG12 VAL 119 HG12 VAL 119 -11.447 37.305 -33.202 670 HG13 VAL 119 HG13 VAL 119 -11.616 36.194 -34.561 671 HG21 VAL 119 HG21 VAL 119 -12.143 36.485 -31.588 672 HG22 VAL 119 HG22 VAL 119 -11.019 35.500 -30.654 673 HG23 VAL 119 HG23 VAL 119 -12.403 34.746 -31.447 674 H VAL 120 HN VAL 120 -10.721 31.584 -33.962 675 HA VAL 120 HA VAL 120 -8.469 32.231 -35.758 676 HB VAL 120 HB VAL 120 -8.665 30.030 -33.689 677 HG11 VAL 120 HG11 VAL 120 -6.416 29.377 -34.512 678 HG12 VAL 120 HG12 VAL 120 -6.558 30.569 -35.804 679 HG13 VAL 120 HG13 VAL 120 -7.648 29.183 -35.757 680 HG21 VAL 120 HG21 VAL 120 -8.018 32.309 -32.885 681 HG22 VAL 120 HG22 VAL 120 -6.684 32.303 -34.040 682 HG23 VAL 120 HG23 VAL 120 -6.712 31.134 -32.721 683 H LEU 121 HN LEU 121 -8.546 31.280 -37.703 684 HA LEU 121 HA LEU 121 -9.210 29.912 -39.426 685 HB2 LEU 121 HB2 LEU 121 -10.120 28.194 -37.113 686 HB3 LEU 121 HB1 LEU 121 -10.279 27.711 -38.797 687 HG LEU 121 HG LEU 121 -7.652 28.546 -37.549 688 HD11 LEU 121 HD11 LEU 121 -9.140 26.067 -37.310 689 HD12 LEU 121 HD12 LEU 121 -7.622 26.531 -36.540 690 HD13 LEU 121 HD13 LEU 121 -7.610 25.800 -38.144 691 HD21 LEU 121 HD21 LEU 121 -7.703 28.784 -39.969 692 HD22 LEU 121 HD22 LEU 121 -8.407 27.177 -40.150 693 HD23 LEU 121 HD23 LEU 121 -6.751 27.355 -39.570 694 H GLU 122 HN GLU 122 -10.793 32.091 -38.653 695 HA GLU 122 HA GLU 122 -13.543 31.485 -38.392 696 HB2 GLU 122 HB2 GLU 122 -12.148 33.914 -39.536 697 HB3 GLU 122 HB1 GLU 122 -13.881 33.819 -39.222 698 HG2 GLU 122 HG2 GLU 122 -11.736 33.375 -37.127 699 HG3 GLU 122 HG1 GLU 122 -12.609 34.889 -37.353 700 H HIS 123 HN HIS 123 -11.453 31.943 -41.203 701 HA HIS 123 HA HIS 123 -13.715 31.176 -42.948 702 HB2 HIS 123 HB2 HIS 123 -11.186 32.700 -43.613 703 HB3 HIS 123 HB1 HIS 123 -12.424 32.230 -44.778 704 HD2 HIS 123 HD2 HIS 123 -11.722 35.104 -42.341 705 HE1 HIS 123 HE1 HIS 123 -15.797 35.426 -43.397 706 HE2 HIS 123 HE2 HIS 123 -13.859 36.603 -42.254 707 H HIS 124 HN HIS 124 -13.476 29.516 -44.399 708 HA HIS 124 HA HIS 124 -11.059 27.847 -44.049 709 HB2 HIS 124 HB2 HIS 124 -13.875 27.036 -44.813 710 HB3 HIS 124 HB1 HIS 124 -12.500 25.942 -44.674 711 HD2 HIS 124 HD2 HIS 124 -15.218 27.399 -42.424 712 HE1 HIS 124 HE1 HIS 124 -12.194 26.012 -39.825 713 HE2 HIS 124 HE2 HIS 124 -14.587 26.858 -39.950 714 H HIS 125 HN HIS 125 -10.120 26.890 -45.871 715 HA HIS 125 HA HIS 125 -11.066 27.878 -48.490 716 HB2 HIS 125 HB2 HIS 125 -8.194 27.797 -47.533 717 HB3 HIS 125 HB1 HIS 125 -8.724 28.250 -49.152 718 HD2 HIS 125 HD2 HIS 125 -8.138 29.926 -45.765 719 HE1 HIS 125 HE1 HIS 125 -10.556 32.590 -47.973 720 HE2 HIS 125 HE2 HIS 125 -9.132 32.337 -45.887 721 H HIS 126 HN HIS 126 -10.702 26.496 -50.243 722 HA HIS 126 HA HIS 126 -10.743 23.728 -49.697 723 HB2 HIS 126 HB2 HIS 126 -10.279 25.285 -52.243 724 HB3 HIS 126 HB1 HIS 126 -10.352 23.523 -52.203 725 HD2 HIS 126 HD2 HIS 126 -12.883 24.193 -49.684 726 HE1 HIS 126 HE1 HIS 126 -15.010 24.838 -53.273 727 HE2 HIS 126 HE2 HIS 126 -15.241 24.452 -50.774 728 H HIS 127 HN HIS 127 -8.161 25.909 -50.732 729 HA HIS 127 HA HIS 127 -6.185 23.932 -51.187 730 HB2 HIS 127 HB2 HIS 127 -5.944 26.851 -50.419 731 HB3 HIS 127 HB1 HIS 127 -4.585 25.838 -50.904 732 HD2 HIS 127 HD2 HIS 127 -7.314 27.963 -52.557 733 HE1 HIS 127 HE1 HIS 127 -5.726 25.513 -55.605 734 HE2 HIS 127 HE2 HIS 127 -7.218 27.511 -55.126 735 H HIS 128 HN HIS 128 -7.128 25.770 -48.311 736 HA HIS 128 HA HIS 128 -6.619 25.501 -46.086 737 HB2 HIS 128 HB2 HIS 128 -7.533 23.272 -46.385 738 HB3 HIS 128 HB1 HIS 128 -6.001 22.696 -47.045 739 HD2 HIS 128 HD2 HIS 128 -4.220 21.796 -45.117 740 HE1 HIS 128 HE1 HIS 128 -6.171 23.401 -41.736 741 HE2 HIS 128 HE2 HIS 128 -4.243 21.943 -42.511 Start of MODEL 11 1 H1 MET 36 HT1 MET 36 -29.575 8.933 -5.845 2 H2 MET 36 HT2 MET 36 -29.031 9.609 -7.306 3 H3 MET 36 HT3 MET 36 -28.015 9.591 -5.944 4 HA MET 36 HA MET 36 -28.348 7.033 -6.074 5 HB2 MET 36 HB2 MET 36 -28.736 7.885 -8.958 6 HB3 MET 36 HB1 MET 36 -28.698 6.236 -8.333 7 HG2 MET 36 HG2 MET 36 -30.759 8.332 -7.585 8 HG3 MET 36 HG1 MET 36 -31.021 7.017 -8.732 9 HE1 MET 36 HE1 MET 36 -32.789 7.657 -6.206 10 HE2 MET 36 HE2 MET 36 -33.122 6.036 -5.601 11 HE3 MET 36 HE3 MET 36 -33.132 6.340 -7.337 12 HA PRO 37 HA PRO 37 -24.133 8.653 -6.789 13 HB2 PRO 37 HB2 PRO 37 -22.943 6.934 -5.024 14 HB3 PRO 37 HB1 PRO 37 -23.709 8.459 -4.536 15 HG2 PRO 37 HG2 PRO 37 -24.773 5.678 -4.399 16 HG3 PRO 37 HG1 PRO 37 -24.909 6.998 -3.224 17 HD2 PRO 37 HD2 PRO 37 -26.940 6.331 -4.916 18 HD3 PRO 37 HD1 PRO 37 -26.682 7.992 -4.336 19 H VAL 38 HN VAL 38 -22.398 7.806 -7.967 20 HA VAL 38 HA VAL 38 -22.588 4.980 -8.793 21 HB VAL 38 HB VAL 38 -23.617 6.205 -10.594 22 HG11 VAL 38 HG11 VAL 38 -22.018 7.964 -11.738 23 HG12 VAL 38 HG12 VAL 38 -21.311 8.063 -10.126 24 HG13 VAL 38 HG13 VAL 38 -23.017 8.441 -10.366 25 HG21 VAL 38 HG21 VAL 38 -22.465 4.897 -12.026 26 HG22 VAL 38 HG22 VAL 38 -21.145 4.780 -10.862 27 HG23 VAL 38 HG23 VAL 38 -21.159 6.082 -12.053 28 H THR 39 HN THR 39 -20.661 3.947 -8.976 29 HA THR 39 HA THR 39 -18.319 5.298 -7.962 30 HB THR 39 HB THR 39 -18.691 3.018 -7.270 31 HG1 THR 39 HG1 THR 39 -16.508 3.866 -8.420 32 HG21 THR 39 HG21 THR 39 -20.041 2.133 -9.020 33 HG22 THR 39 HG22 THR 39 -18.545 1.200 -9.066 34 HG23 THR 39 HG23 THR 39 -18.818 2.485 -10.241 35 H GLU 40 HN GLU 40 -16.737 6.211 -9.121 36 HA GLU 40 HA GLU 40 -16.922 6.556 -11.912 37 HB2 GLU 40 HB2 GLU 40 -15.723 8.124 -10.469 38 HB3 GLU 40 HB1 GLU 40 -14.535 6.883 -10.085 39 HG2 GLU 40 HG2 GLU 40 -13.870 6.760 -12.451 40 HG3 GLU 40 HG1 GLU 40 -15.088 7.958 -12.864 41 H GLN 41 HN GLN 41 -14.896 4.380 -9.947 42 HA GLN 41 HA GLN 41 -13.492 3.261 -12.147 43 HB2 GLN 41 HB2 GLN 41 -12.764 1.561 -10.580 44 HB3 GLN 41 HB1 GLN 41 -12.762 3.119 -9.756 45 HG2 GLN 41 HG2 GLN 41 -14.965 2.619 -8.782 46 HG3 GLN 41 HG1 GLN 41 -14.984 1.063 -9.610 47 HE21 GLN 41 HE21 GLN 41 -15.049 -0.034 -7.479 48 HE22 GLN 41 HE22 GLN 41 -13.642 -0.147 -6.535 49 H GLY 42 HN GLY 42 -16.425 2.337 -10.416 50 HA2 GLY 42 HA2 GLY 42 -16.892 -0.126 -11.729 51 HA3 GLY 42 HA1 GLY 42 -18.102 0.835 -10.884 52 H LEU 43 HN LEU 43 -17.750 3.192 -12.482 53 HA LEU 43 HA LEU 43 -19.650 2.722 -14.494 54 HB2 LEU 43 HB2 LEU 43 -19.244 4.946 -13.469 55 HB3 LEU 43 HB1 LEU 43 -17.684 5.019 -14.299 56 HG LEU 43 HG LEU 43 -18.793 4.867 -16.468 57 HD11 LEU 43 HD11 LEU 43 -21.339 4.768 -14.827 58 HD12 LEU 43 HD12 LEU 43 -20.685 3.460 -15.814 59 HD13 LEU 43 HD13 LEU 43 -21.275 4.935 -16.582 60 HD21 LEU 43 HD21 LEU 43 -18.706 7.069 -14.932 61 HD22 LEU 43 HD22 LEU 43 -20.454 6.929 -15.097 62 HD23 LEU 43 HD23 LEU 43 -19.444 7.079 -16.534 63 H ARG 44 HN ARG 44 -16.131 2.933 -14.619 64 HA ARG 44 HA ARG 44 -15.820 2.891 -17.408 65 HB2 ARG 44 HB2 ARG 44 -13.985 3.350 -15.813 66 HB3 ARG 44 HB1 ARG 44 -14.018 1.661 -15.311 67 HG2 ARG 44 HG2 ARG 44 -13.447 0.933 -17.569 68 HG3 ARG 44 HG1 ARG 44 -13.517 2.596 -18.151 69 HD2 ARG 44 HD2 ARG 44 -11.623 1.623 -15.995 70 HD3 ARG 44 HD1 ARG 44 -11.184 1.804 -17.691 71 HE ARG 44 HE ARG 44 -12.256 4.246 -16.876 72 HH11 ARG 44 HH11 ARG 44 -9.608 2.157 -16.104 73 HH12 ARG 44 HH12 ARG 44 -8.560 3.443 -15.605 74 HH21 ARG 44 HH21 ARG 44 -10.893 5.936 -16.216 75 HH22 ARG 44 HH22 ARG 44 -9.288 5.584 -15.669 76 H GLU 45 HN GLU 45 -16.157 0.252 -15.063 77 HA GLU 45 HA GLU 45 -15.708 -1.868 -16.878 78 HB2 GLU 45 HB2 GLU 45 -17.258 -1.733 -14.281 79 HB3 GLU 45 HB1 GLU 45 -16.961 -3.233 -15.160 80 HG2 GLU 45 HG2 GLU 45 -14.547 -2.905 -14.979 81 HG3 GLU 45 HG1 GLU 45 -14.794 -1.347 -14.189 82 H ARG 46 HN ARG 46 -18.663 -0.171 -15.875 83 HA ARG 46 HA ARG 46 -20.452 -1.842 -17.322 84 HB2 ARG 46 HB2 ARG 46 -20.715 0.977 -16.250 85 HB3 ARG 46 HB1 ARG 46 -22.043 0.100 -17.008 86 HG2 ARG 46 HG2 ARG 46 -20.479 -0.903 -14.608 87 HG3 ARG 46 HG1 ARG 46 -22.048 -0.097 -14.514 88 HD2 ARG 46 HD2 ARG 46 -23.007 -1.863 -15.982 89 HD3 ARG 46 HD1 ARG 46 -21.450 -2.687 -15.972 90 HE ARG 46 HE ARG 46 -22.310 -2.252 -13.305 91 HH11 ARG 46 HH11 ARG 46 -23.009 -4.095 -16.150 92 HH12 ARG 46 HH12 ARG 46 -23.670 -5.441 -15.284 93 HH21 ARG 46 HH21 ARG 46 -23.177 -4.016 -12.161 94 HH22 ARG 46 HH22 ARG 46 -23.765 -5.397 -13.027 95 H ILE 47 HN ILE 47 -18.829 1.210 -18.029 96 HA ILE 47 HA ILE 47 -20.058 1.656 -20.533 97 HB ILE 47 HB ILE 47 -17.429 2.632 -19.414 98 HG12 ILE 47 HG12 ILE 47 -19.535 3.283 -18.247 99 HG13 ILE 47 HG11 ILE 47 -18.699 4.661 -18.965 100 HG21 ILE 47 HG21 ILE 47 -17.149 3.977 -21.265 101 HG22 ILE 47 HG22 ILE 47 -18.872 4.014 -21.626 102 HG23 ILE 47 HG23 ILE 47 -17.920 2.592 -22.035 103 HD11 ILE 47 HD1 ILE 47 -20.214 4.497 -20.944 104 HD12 ILE 47 HD2 ILE 47 -21.094 4.807 -19.448 105 HD13 ILE 47 HD3 ILE 47 -21.078 3.185 -20.139 106 H GLU 48 HN GLU 48 -17.061 0.075 -19.574 107 HA GLU 48 HA GLU 48 -16.013 -0.430 -22.122 108 HB2 GLU 48 HB2 GLU 48 -14.719 -0.727 -20.047 109 HB3 GLU 48 HB1 GLU 48 -15.734 -2.099 -19.601 110 HG2 GLU 48 HG2 GLU 48 -15.021 -3.286 -21.659 111 HG3 GLU 48 HG1 GLU 48 -14.027 -1.902 -22.112 112 H SER 49 HN SER 49 -18.320 -2.221 -20.140 113 HA SER 49 HA SER 49 -18.506 -4.436 -21.949 114 HB2 SER 49 HB2 SER 49 -20.402 -5.125 -20.588 115 HB3 SER 49 HB1 SER 49 -19.106 -4.580 -19.527 116 HG SER 49 HG SER 49 -21.472 -3.231 -20.297 117 H ALA 50 HN ALA 50 -19.798 -1.224 -21.855 118 HA ALA 50 HA ALA 50 -21.996 -1.944 -23.674 119 HB1 ALA 50 HB1 ALA 50 -21.704 0.887 -23.255 120 HB2 ALA 50 HB2 ALA 50 -21.639 0.044 -21.708 121 HB3 ALA 50 HB3 ALA 50 -23.028 -0.176 -22.773 122 H ILE 51 HN ILE 51 -18.776 -1.230 -23.894 123 HA ILE 51 HA ILE 51 -19.020 -0.566 -26.726 124 HB ILE 51 HB ILE 51 -18.954 1.641 -25.743 125 HG12 ILE 51 HG12 ILE 51 -16.151 0.972 -26.704 126 HG13 ILE 51 HG11 ILE 51 -17.541 1.129 -27.784 127 HG21 ILE 51 HG21 ILE 51 -16.368 1.658 -24.530 128 HG22 ILE 51 HG22 ILE 51 -17.303 0.345 -23.814 129 HG23 ILE 51 HG23 ILE 51 -17.930 1.993 -23.784 130 HD11 ILE 51 HD1 ILE 51 -17.129 3.338 -27.840 131 HD12 ILE 51 HD2 ILE 51 -15.940 3.208 -26.543 132 HD13 ILE 51 HD3 ILE 51 -17.649 3.401 -26.154 133 HA PRO 52 HA PRO 52 -15.694 -3.477 -26.900 134 HB2 PRO 52 HB2 PRO 52 -14.962 -1.955 -29.364 135 HB3 PRO 52 HB1 PRO 52 -15.280 -3.690 -29.164 136 HG2 PRO 52 HG2 PRO 52 -17.060 -2.134 -30.342 137 HG3 PRO 52 HG1 PRO 52 -17.573 -3.412 -29.224 138 HD2 PRO 52 HD2 PRO 52 -17.403 -0.450 -28.744 139 HD3 PRO 52 HD1 PRO 52 -18.639 -1.615 -28.205 140 H GLN 53 HN GLN 53 -13.548 -3.522 -26.295 141 HA GLN 53 HA GLN 53 -12.355 -1.389 -25.005 142 HB2 GLN 53 HB2 GLN 53 -10.219 -2.681 -25.265 143 HB3 GLN 53 HB1 GLN 53 -11.574 -3.640 -24.655 144 HG2 GLN 53 HG2 GLN 53 -12.000 -4.505 -26.918 145 HG3 GLN 53 HG1 GLN 53 -10.681 -3.526 -27.555 146 HE21 GLN 53 HE21 GLN 53 -11.039 -6.572 -27.356 147 HE22 GLN 53 HE22 GLN 53 -9.622 -7.102 -26.586 148 H VAL 54 HN VAL 54 -12.763 0.393 -26.442 149 HA VAL 54 HA VAL 54 -10.587 0.761 -28.391 150 HB VAL 54 HB VAL 54 -12.146 1.950 -29.886 151 HG11 VAL 54 HG11 VAL 54 -13.197 -0.816 -29.242 152 HG12 VAL 54 HG12 VAL 54 -11.672 -0.536 -30.083 153 HG13 VAL 54 HG13 VAL 54 -13.190 -0.005 -30.809 154 HG21 VAL 54 HG21 VAL 54 -13.817 1.850 -27.596 155 HG22 VAL 54 HG22 VAL 54 -14.609 0.887 -28.843 156 HG23 VAL 54 HG23 VAL 54 -14.185 2.568 -29.164 157 H TYR 55 HN TYR 55 -10.316 3.099 -28.941 158 HA TYR 55 HA TYR 55 -9.985 4.610 -26.551 159 HB2 TYR 55 HB2 TYR 55 -9.781 5.453 -29.455 160 HB3 TYR 55 HB1 TYR 55 -9.260 6.430 -28.080 161 HD1 TYR 55 HD1 TYR 55 -8.567 3.439 -30.105 162 HD2 TYR 55 HD2 TYR 55 -7.307 5.801 -26.747 163 HE1 TYR 55 HE1 TYR 55 -6.393 2.247 -30.082 164 HE2 TYR 55 HE2 TYR 55 -5.132 4.608 -26.723 165 HH TYR 55 HH TYR 55 -3.881 3.027 -29.111 166 H HIS 56 HN HIS 56 -12.668 4.053 -28.467 167 HA HIS 56 HA HIS 56 -13.948 6.561 -28.455 168 HB2 HIS 56 HB2 HIS 56 -14.630 4.600 -29.846 169 HB3 HIS 56 HB1 HIS 56 -15.277 3.871 -28.392 170 HD2 HIS 56 HD2 HIS 56 -16.071 6.930 -30.752 171 HE1 HIS 56 HE1 HIS 56 -19.330 6.399 -28.121 172 HE2 HIS 56 HE2 HIS 56 -18.496 7.685 -30.146 173 H ILE 57 HN ILE 57 -13.046 4.601 -25.919 174 HA ILE 57 HA ILE 57 -15.118 5.794 -24.164 175 HB ILE 57 HB ILE 57 -15.511 3.425 -24.288 176 HG12 ILE 57 HG12 ILE 57 -13.915 3.946 -21.773 177 HG13 ILE 57 HG11 ILE 57 -15.537 4.587 -22.041 178 HG21 ILE 57 HG21 ILE 57 -13.187 2.261 -23.201 179 HG22 ILE 57 HG22 ILE 57 -12.622 3.346 -24.473 180 HG23 ILE 57 HG23 ILE 57 -13.794 2.083 -24.848 181 HD11 ILE 57 HD1 ILE 57 -15.909 2.570 -20.854 182 HD12 ILE 57 HD2 ILE 57 -14.679 1.704 -21.774 183 HD13 ILE 57 HD3 ILE 57 -16.207 2.135 -22.537 184 H ILE 58 HN ILE 58 -14.262 7.274 -22.868 185 HA ILE 58 HA ILE 58 -11.629 6.740 -21.660 186 HB ILE 58 HB ILE 58 -12.494 9.404 -22.818 187 HG12 ILE 58 HG12 ILE 58 -11.860 7.730 -24.535 188 HG13 ILE 58 HG11 ILE 58 -10.657 9.013 -24.421 189 HG21 ILE 58 HG21 ILE 58 -10.121 8.468 -21.213 190 HG22 ILE 58 HG22 ILE 58 -11.129 9.893 -20.959 191 HG23 ILE 58 HG23 ILE 58 -9.985 9.849 -22.301 192 HD11 ILE 58 HD1 ILE 58 -10.443 6.341 -23.002 193 HD12 ILE 58 HD2 ILE 58 -9.216 7.605 -23.051 194 HD13 ILE 58 HD3 ILE 58 -9.639 6.727 -24.522 195 H VAL 59 HN VAL 59 -11.658 6.956 -19.496 196 HA VAL 59 HA VAL 59 -13.917 8.463 -18.316 197 HB VAL 59 HB VAL 59 -12.378 6.117 -17.181 198 HG11 VAL 59 HG11 VAL 59 -13.017 7.216 -15.268 199 HG12 VAL 59 HG12 VAL 59 -14.504 6.327 -15.594 200 HG13 VAL 59 HG13 VAL 59 -14.371 8.026 -16.055 201 HG21 VAL 59 HG21 VAL 59 -13.806 5.071 -18.647 202 HG22 VAL 59 HG22 VAL 59 -14.941 6.420 -18.668 203 HG23 VAL 59 HG23 VAL 59 -14.931 5.296 -17.309 204 H THR 60 HN THR 60 -13.298 10.340 -17.475 205 HA THR 60 HA THR 60 -10.711 10.471 -16.062 206 HB THR 60 HB THR 60 -11.833 12.591 -17.912 207 HG1 THR 60 HG1 THR 60 -9.572 10.889 -18.070 208 HG21 THR 60 HG21 THR 60 -10.027 12.740 -15.692 209 HG22 THR 60 HG22 THR 60 -10.516 14.028 -16.793 210 HG23 THR 60 HG23 THR 60 -9.118 13.023 -17.176 211 H ASP 61 HN ASP 61 -10.796 11.401 -14.080 212 HA ASP 61 HA ASP 61 -13.397 12.225 -13.084 213 HB2 ASP 61 HB2 ASP 61 -12.246 12.377 -10.911 214 HB3 ASP 61 HB1 ASP 61 -11.949 10.823 -11.693 215 H LEU 62 HN LEU 62 -14.056 14.233 -13.563 216 HA LEU 62 HA LEU 62 -12.250 16.468 -12.926 217 HB2 LEU 62 HB2 LEU 62 -12.216 15.986 -15.417 218 HB3 LEU 62 HB1 LEU 62 -13.923 16.428 -15.439 219 HG LEU 62 HG LEU 62 -11.960 18.291 -14.147 220 HD11 LEU 62 HD11 LEU 62 -12.461 18.017 -17.127 221 HD12 LEU 62 HD12 LEU 62 -10.920 17.807 -16.296 222 HD13 LEU 62 HD13 LEU 62 -11.670 19.401 -16.373 223 HD21 LEU 62 HD21 LEU 62 -14.673 18.404 -15.434 224 HD22 LEU 62 HD22 LEU 62 -13.683 19.863 -15.396 225 HD23 LEU 62 HD23 LEU 62 -14.143 19.071 -13.889 226 H SER 63 HN SER 63 -13.251 17.865 -11.622 227 HA SER 63 HA SER 63 -14.972 19.329 -10.962 228 HB2 SER 63 HB2 SER 63 -16.115 18.699 -13.190 229 HB3 SER 63 HB1 SER 63 -16.994 17.504 -12.245 230 HG SER 63 HG SER 63 -17.419 20.129 -12.449 231 H TYR 64 HN TYR 64 -17.595 18.222 -10.202 232 HA TYR 64 HA TYR 64 -16.708 16.531 -7.941 233 HB2 TYR 64 HB2 TYR 64 -18.946 18.565 -8.073 234 HB3 TYR 64 HB1 TYR 64 -18.614 17.518 -6.690 235 HD1 TYR 64 HD1 TYR 64 -17.411 20.372 -8.686 236 HD2 TYR 64 HD2 TYR 64 -16.631 17.841 -5.304 237 HE1 TYR 64 HE1 TYR 64 -15.699 21.975 -7.882 238 HE2 TYR 64 HE2 TYR 64 -14.918 19.444 -4.500 239 HH TYR 64 HH TYR 64 -14.644 22.250 -5.010 240 H GLY 65 HN GLY 65 -17.982 14.787 -7.332 241 HA2 GLY 65 HA2 GLY 65 -20.478 14.000 -7.931 242 HA3 GLY 65 HA1 GLY 65 -19.646 13.673 -9.446 243 H CYS 66 HN CYS 66 -19.391 11.518 -9.541 244 HA CYS 66 HA CYS 66 -19.185 9.751 -7.383 245 HB2 CYS 66 HB2 CYS 66 -18.287 8.140 -9.044 246 HB3 CYS 66 HB1 CYS 66 -19.729 8.977 -9.624 247 HG CYS 66 HG CYS 66 -17.608 8.972 -11.375 248 H GLY 67 HN GLY 67 -17.695 11.063 -6.043 249 HA2 GLY 67 HA2 GLY 67 -15.667 10.977 -4.914 250 HA3 GLY 67 HA1 GLY 67 -15.032 9.950 -6.199 251 H GLN 68 HN GLN 68 -16.456 12.508 -7.686 252 HA GLN 68 HA GLN 68 -15.189 14.818 -7.548 253 HB2 GLN 68 HB2 GLN 68 -13.168 12.751 -8.175 254 HB3 GLN 68 HB1 GLN 68 -13.091 14.222 -9.143 255 HG2 GLN 68 HG2 GLN 68 -12.900 15.600 -7.184 256 HG3 GLN 68 HG1 GLN 68 -13.249 14.242 -6.119 257 HE21 GLN 68 HE21 GLN 68 -10.936 15.395 -5.445 258 HE22 GLN 68 HE22 GLN 68 -9.587 14.554 -6.041 259 H SER 69 HN SER 69 -17.334 13.516 -8.910 260 HA SER 69 HA SER 69 -18.543 13.879 -10.847 261 HB2 SER 69 HB2 SER 69 -17.490 16.075 -11.013 262 HB3 SER 69 HB1 SER 69 -16.055 15.350 -11.725 263 HG SER 69 HG SER 69 -17.062 15.166 -13.570 264 H PHE 70 HN PHE 70 -18.082 13.585 -13.427 265 HA PHE 70 HA PHE 70 -16.167 11.427 -13.867 266 HB2 PHE 70 HB2 PHE 70 -18.302 10.394 -12.988 267 HB3 PHE 70 HB1 PHE 70 -19.095 10.998 -14.442 268 HD1 PHE 70 HD1 PHE 70 -16.676 8.602 -13.096 269 HD2 PHE 70 HD2 PHE 70 -18.525 10.104 -16.665 270 HE1 PHE 70 HE1 PHE 70 -15.829 6.642 -14.354 271 HE2 PHE 70 HE2 PHE 70 -17.681 8.141 -17.928 272 HZ PHE 70 HZ PHE 70 -16.331 6.410 -16.771 273 H ASP 71 HN ASP 71 -15.184 12.774 -15.382 274 HA ASP 71 HA ASP 71 -16.785 13.707 -17.654 275 HB2 ASP 71 HB2 ASP 71 -15.194 15.295 -16.643 276 HB3 ASP 71 HB1 ASP 71 -13.868 14.179 -16.977 277 H ILE 72 HN ILE 72 -17.150 12.110 -19.067 278 HA ILE 72 HA ILE 72 -14.890 10.370 -19.858 279 HB ILE 72 HB ILE 72 -16.530 8.919 -19.061 280 HG12 ILE 72 HG12 ILE 72 -17.015 9.343 -22.021 281 HG13 ILE 72 HG11 ILE 72 -15.941 8.162 -21.259 282 HG21 ILE 72 HG21 ILE 72 -18.676 10.517 -20.482 283 HG22 ILE 72 HG22 ILE 72 -18.230 10.783 -18.796 284 HG23 ILE 72 HG23 ILE 72 -18.902 9.231 -19.296 285 HD11 ILE 72 HD1 ILE 72 -17.812 6.957 -20.331 286 HD12 ILE 72 HD2 ILE 72 -18.142 7.208 -22.045 287 HD13 ILE 72 HD3 ILE 72 -18.941 8.216 -20.837 288 H VAL 73 HN VAL 73 -14.202 10.360 -21.877 289 HA VAL 73 HA VAL 73 -15.796 11.835 -23.875 290 HB VAL 73 HB VAL 73 -12.784 11.808 -23.560 291 HG11 VAL 73 HG11 VAL 73 -13.157 11.937 -25.865 292 HG12 VAL 73 HG12 VAL 73 -13.127 13.635 -25.390 293 HG13 VAL 73 HG13 VAL 73 -14.667 12.823 -25.665 294 HG21 VAL 73 HG21 VAL 73 -13.602 13.326 -21.955 295 HG22 VAL 73 HG22 VAL 73 -14.969 13.797 -22.965 296 HG23 VAL 73 HG23 VAL 73 -13.343 14.354 -23.365 297 H VAL 74 HN VAL 74 -16.242 10.747 -25.693 298 HA VAL 74 HA VAL 74 -14.969 8.126 -26.028 299 HB VAL 74 HB VAL 74 -16.876 7.467 -27.260 300 HG11 VAL 74 HG11 VAL 74 -17.260 7.909 -24.796 301 HG12 VAL 74 HG12 VAL 74 -18.717 7.949 -25.789 302 HG13 VAL 74 HG13 VAL 74 -17.969 9.456 -25.260 303 HG21 VAL 74 HG21 VAL 74 -16.937 9.404 -28.763 304 HG22 VAL 74 HG22 VAL 74 -17.565 10.404 -27.451 305 HG23 VAL 74 HG23 VAL 74 -18.538 9.085 -28.097 306 H VAL 75 HN VAL 75 -13.497 7.827 -27.512 307 HA VAL 75 HA VAL 75 -13.477 9.593 -29.883 308 HB VAL 75 HB VAL 75 -11.111 8.763 -28.200 309 HG11 VAL 75 HG11 VAL 75 -9.675 9.532 -29.889 310 HG12 VAL 75 HG12 VAL 75 -10.964 10.402 -30.724 311 HG13 VAL 75 HG13 VAL 75 -10.896 8.638 -30.797 312 HG21 VAL 75 HG21 VAL 75 -12.801 10.974 -28.096 313 HG22 VAL 75 HG22 VAL 75 -11.422 11.552 -29.030 314 HG23 VAL 75 HG23 VAL 75 -11.177 10.885 -27.414 315 H SER 76 HN SER 76 -13.455 8.578 -31.775 316 HA SER 76 HA SER 76 -11.933 6.389 -32.520 317 HB2 SER 76 HB2 SER 76 -13.476 4.506 -32.429 318 HB3 SER 76 HB1 SER 76 -13.204 5.138 -30.811 319 HG SER 76 HG SER 76 -15.272 6.307 -32.219 320 H ASP 77 HN ASP 77 -13.360 5.021 -34.316 321 HA ASP 77 HA ASP 77 -13.954 7.013 -36.311 322 HB2 ASP 77 HB2 ASP 77 -14.029 3.994 -36.343 323 HB3 ASP 77 HB1 ASP 77 -14.447 4.987 -37.736 324 H PHE 78 HN PHE 78 -15.744 5.678 -33.854 325 HA PHE 78 HA PHE 78 -18.230 5.063 -34.991 326 HB2 PHE 78 HB2 PHE 78 -17.513 4.739 -32.580 327 HB3 PHE 78 HB1 PHE 78 -17.844 6.459 -32.340 328 HD1 PHE 78 HD1 PHE 78 -19.377 3.256 -33.479 329 HD2 PHE 78 HD2 PHE 78 -20.068 7.239 -32.028 330 HE1 PHE 78 HE1 PHE 78 -21.790 2.744 -33.230 331 HE2 PHE 78 HE2 PHE 78 -22.482 6.724 -31.781 332 HZ PHE 78 HZ PHE 78 -23.342 4.480 -32.380 333 H PHE 79 HN PHE 79 -16.662 8.120 -34.408 334 HA PHE 79 HA PHE 79 -19.087 9.668 -34.823 335 HB2 PHE 79 HB2 PHE 79 -17.331 10.416 -33.250 336 HB3 PHE 79 HB1 PHE 79 -16.220 10.606 -34.611 337 HD1 PHE 79 HD1 PHE 79 -19.878 11.350 -34.472 338 HD2 PHE 79 HD2 PHE 79 -15.904 12.961 -34.750 339 HE1 PHE 79 HE1 PHE 79 -20.821 13.603 -34.902 340 HE2 PHE 79 HE2 PHE 79 -16.852 15.214 -35.181 341 HZ PHE 79 HZ PHE 79 -19.308 15.534 -35.258 342 H GLN 80 HN GLN 80 -17.175 7.993 -36.881 343 HA GLN 80 HA GLN 80 -17.001 10.008 -38.979 344 HB2 GLN 80 HB2 GLN 80 -16.270 7.076 -38.866 345 HB3 GLN 80 HB1 GLN 80 -16.107 8.060 -40.322 346 HG2 GLN 80 HG2 GLN 80 -14.573 9.566 -39.197 347 HG3 GLN 80 HG1 GLN 80 -14.826 8.739 -37.661 348 HE21 GLN 80 HE21 GLN 80 -12.293 9.053 -39.312 349 HE22 GLN 80 HE22 GLN 80 -11.740 7.467 -39.557 350 H GLY 81 HN GLY 81 -18.686 10.468 -40.223 351 HA2 GLY 81 HA2 GLY 81 -20.428 10.106 -41.711 352 HA3 GLY 81 HA1 GLY 81 -20.294 8.376 -41.403 353 H LYS 82 HN LYS 82 -20.390 9.889 -38.466 354 HA LYS 82 HA LYS 82 -23.336 9.673 -38.290 355 HB2 LYS 82 HB2 LYS 82 -21.239 8.764 -36.313 356 HB3 LYS 82 HB1 LYS 82 -22.953 8.886 -35.924 357 HG2 LYS 82 HG2 LYS 82 -23.476 7.316 -37.768 358 HG3 LYS 82 HG1 LYS 82 -21.756 7.190 -38.140 359 HD2 LYS 82 HD2 LYS 82 -21.324 6.295 -35.885 360 HD3 LYS 82 HD1 LYS 82 -23.040 6.429 -35.499 361 HE2 LYS 82 HE2 LYS 82 -23.577 4.857 -37.323 362 HE3 LYS 82 HE1 LYS 82 -21.864 4.725 -37.717 363 HZ1 LYS 82 HZ1 LYS 82 -22.587 2.899 -36.314 364 HZ2 LYS 82 HZ2 LYS 82 -23.107 3.991 -35.121 365 HZ3 LYS 82 HZ3 LYS 82 -21.455 3.863 -35.498 366 H SER 83 HN SER 83 -24.402 11.229 -37.168 367 HA SER 83 HA SER 83 -23.050 13.715 -36.721 368 HB2 SER 83 HB2 SER 83 -25.222 14.571 -36.115 369 HB3 SER 83 HB1 SER 83 -25.417 13.513 -37.509 370 HG SER 83 HG SER 83 -26.542 13.330 -35.104 371 H LYS 84 HN LYS 84 -23.207 14.919 -34.657 372 HA LYS 84 HA LYS 84 -21.986 13.509 -32.555 373 HB2 LYS 84 HB2 LYS 84 -22.168 15.548 -31.299 374 HB3 LYS 84 HB1 LYS 84 -21.866 15.992 -32.979 375 HG2 LYS 84 HG2 LYS 84 -24.331 16.277 -33.299 376 HG3 LYS 84 HG1 LYS 84 -24.554 15.969 -31.577 377 HD2 LYS 84 HD2 LYS 84 -22.815 18.183 -32.702 378 HD3 LYS 84 HD1 LYS 84 -24.468 18.409 -32.131 379 HE2 LYS 84 HE2 LYS 84 -23.778 17.517 -29.903 380 HE3 LYS 84 HE1 LYS 84 -22.115 17.435 -30.486 381 HZ1 LYS 84 HZ1 LYS 84 -21.931 19.703 -30.569 382 HZ2 LYS 84 HZ2 LYS 84 -22.950 19.525 -29.221 383 HZ3 LYS 84 HZ3 LYS 84 -23.600 19.957 -30.731 384 H LEU 85 HN LEU 85 -25.335 14.289 -33.227 385 HA LEU 85 HA LEU 85 -26.420 13.657 -30.693 386 HB2 LEU 85 HB2 LEU 85 -27.618 13.609 -33.461 387 HB3 LEU 85 HB1 LEU 85 -28.553 13.332 -31.991 388 HG LEU 85 HG LEU 85 -26.863 15.799 -32.473 389 HD11 LEU 85 HD11 LEU 85 -28.553 16.672 -33.673 390 HD12 LEU 85 HD12 LEU 85 -29.700 16.287 -32.389 391 HD13 LEU 85 HD13 LEU 85 -29.348 15.098 -33.643 392 HD21 LEU 85 HD21 LEU 85 -27.213 15.312 -30.116 393 HD22 LEU 85 HD22 LEU 85 -28.935 15.045 -30.388 394 HD23 LEU 85 HD23 LEU 85 -28.254 16.662 -30.566 395 H MET 86 HN MET 86 -25.772 11.713 -33.568 396 HA MET 86 HA MET 86 -27.045 9.342 -32.724 397 HB2 MET 86 HB2 MET 86 -24.711 9.807 -34.591 398 HB3 MET 86 HB1 MET 86 -25.486 8.239 -34.366 399 HG2 MET 86 HG2 MET 86 -26.873 10.771 -35.294 400 HG3 MET 86 HG1 MET 86 -26.429 9.406 -36.322 401 HE1 MET 86 HE1 MET 86 -27.476 7.085 -36.277 402 HE2 MET 86 HE2 MET 86 -28.502 6.483 -34.979 403 HE3 MET 86 HE3 MET 86 -26.842 6.960 -34.630 404 H ARG 87 HN ARG 87 -23.757 10.572 -32.233 405 HA ARG 87 HA ARG 87 -22.672 8.240 -31.068 406 HB2 ARG 87 HB2 ARG 87 -21.971 11.155 -30.736 407 HB3 ARG 87 HB1 ARG 87 -21.019 9.835 -30.050 408 HG2 ARG 87 HG2 ARG 87 -20.841 8.852 -32.345 409 HG3 ARG 87 HG1 ARG 87 -21.638 10.292 -32.977 410 HD2 ARG 87 HD2 ARG 87 -19.075 10.290 -31.379 411 HD3 ARG 87 HD1 ARG 87 -19.181 10.429 -33.122 412 HE ARG 87 HE ARG 87 -20.798 12.438 -32.109 413 HH11 ARG 87 HH11 ARG 87 -17.471 11.483 -31.939 414 HH12 ARG 87 HH12 ARG 87 -16.878 13.097 -31.744 415 HH21 ARG 87 HH21 ARG 87 -20.020 14.554 -31.831 416 HH22 ARG 87 HH22 ARG 87 -18.317 14.831 -31.677 417 H SER 88 HN SER 88 -24.317 11.044 -29.678 418 HA SER 88 HA SER 88 -23.985 10.361 -26.957 419 HB2 SER 88 HB2 SER 88 -24.727 12.592 -27.665 420 HB3 SER 88 HB1 SER 88 -26.237 11.910 -28.263 421 HG SER 88 HG SER 88 -25.531 12.601 -25.748 422 H ARG 89 HN ARG 89 -26.598 9.619 -29.253 423 HA ARG 89 HA ARG 89 -28.268 8.249 -27.429 424 HB2 ARG 89 HB2 ARG 89 -29.010 9.034 -29.663 425 HB3 ARG 89 HB1 ARG 89 -27.994 7.802 -30.411 426 HG2 ARG 89 HG2 ARG 89 -29.255 6.035 -29.249 427 HG3 ARG 89 HG1 ARG 89 -30.260 7.257 -28.467 428 HD2 ARG 89 HD2 ARG 89 -30.030 6.897 -31.467 429 HD3 ARG 89 HD1 ARG 89 -31.339 6.247 -30.486 430 HE ARG 89 HE ARG 89 -31.184 8.988 -29.946 431 HH11 ARG 89 HH11 ARG 89 -31.815 6.843 -32.588 432 HH12 ARG 89 HH12 ARG 89 -32.878 7.940 -33.406 433 HH21 ARG 89 HH21 ARG 89 -32.568 10.435 -31.019 434 HH22 ARG 89 HH22 ARG 89 -33.304 9.973 -32.518 435 H ALA 90 HN ALA 90 -25.698 7.112 -29.613 436 HA ALA 90 HA ALA 90 -26.006 4.354 -29.139 437 HB1 ALA 90 HB1 ALA 90 -24.608 5.460 -30.950 438 HB2 ALA 90 HB2 ALA 90 -23.831 4.108 -30.129 439 HB3 ALA 90 HB3 ALA 90 -23.387 5.762 -29.714 440 H VAL 91 HN VAL 91 -23.932 6.768 -27.539 441 HA VAL 91 HA VAL 91 -22.885 4.856 -25.664 442 HB VAL 91 HB VAL 91 -21.803 7.064 -26.474 443 HG11 VAL 91 HG11 VAL 91 -23.460 8.082 -24.150 444 HG12 VAL 91 HG12 VAL 91 -23.776 8.461 -25.844 445 HG13 VAL 91 HG13 VAL 91 -22.279 9.002 -25.083 446 HG21 VAL 91 HG21 VAL 91 -20.993 5.472 -24.668 447 HG22 VAL 91 HG22 VAL 91 -21.820 6.500 -23.496 448 HG23 VAL 91 HG23 VAL 91 -20.491 7.150 -24.456 449 H ASN 92 HN ASN 92 -25.443 7.276 -25.648 450 HA ASN 92 HA ASN 92 -26.012 7.258 -22.890 451 HB2 ASN 92 HB2 ASN 92 -27.742 7.852 -25.293 452 HB3 ASN 92 HB1 ASN 92 -28.296 8.052 -23.630 453 HD21 ASN 92 HD21 ASN 92 -28.096 10.299 -25.374 454 HD22 ASN 92 HD22 ASN 92 -26.841 11.300 -24.824 455 H LYS 93 HN LYS 93 -27.271 5.266 -25.549 456 HA LYS 93 HA LYS 93 -29.234 3.911 -24.011 457 HB2 LYS 93 HB2 LYS 93 -29.372 2.368 -25.846 458 HB3 LYS 93 HB1 LYS 93 -29.118 3.977 -26.523 459 HG2 LYS 93 HG2 LYS 93 -26.706 3.518 -26.710 460 HG3 LYS 93 HG1 LYS 93 -26.958 1.899 -26.060 461 HD2 LYS 93 HD2 LYS 93 -28.441 1.369 -27.965 462 HD3 LYS 93 HD1 LYS 93 -28.185 2.991 -28.612 463 HE2 LYS 93 HE2 LYS 93 -26.697 1.408 -29.744 464 HE3 LYS 93 HE1 LYS 93 -25.745 2.521 -28.762 465 HZ1 LYS 93 HZ1 LYS 93 -24.873 0.483 -28.195 466 HZ2 LYS 93 HZ2 LYS 93 -26.371 -0.315 -28.278 467 HZ3 LYS 93 HZ3 LYS 93 -26.021 0.708 -26.966 468 H ALA 94 HN ALA 94 -25.799 3.414 -24.503 469 HA ALA 94 HA ALA 94 -25.610 0.757 -23.576 470 HB1 ALA 94 HB1 ALA 94 -23.788 2.954 -24.165 471 HB2 ALA 94 HB2 ALA 94 -23.542 1.216 -24.336 472 HB3 ALA 94 HB3 ALA 94 -23.252 1.999 -22.783 473 H VAL 95 HN VAL 95 -25.584 3.860 -21.914 474 HA VAL 95 HA VAL 95 -26.056 2.446 -19.377 475 HB VAL 95 HB VAL 95 -24.551 4.480 -18.463 476 HG11 VAL 95 HG11 VAL 95 -23.329 2.736 -17.707 477 HG12 VAL 95 HG12 VAL 95 -22.817 2.309 -19.340 478 HG13 VAL 95 HG13 VAL 95 -24.346 1.700 -18.708 479 HG21 VAL 95 HG21 VAL 95 -22.930 3.668 -20.837 480 HG22 VAL 95 HG22 VAL 95 -22.877 5.160 -19.900 481 HG23 VAL 95 HG23 VAL 95 -24.166 4.904 -21.075 482 H LYS 96 HN LYS 96 -27.988 3.659 -20.983 483 HA LYS 96 HA LYS 96 -28.547 6.346 -20.374 484 HB2 LYS 96 HB2 LYS 96 -29.719 5.169 -22.155 485 HB3 LYS 96 HB1 LYS 96 -30.461 4.080 -20.980 486 HG2 LYS 96 HG2 LYS 96 -32.067 5.817 -21.520 487 HG3 LYS 96 HG1 LYS 96 -31.498 6.086 -19.874 488 HD2 LYS 96 HD2 LYS 96 -31.454 8.223 -20.948 489 HD3 LYS 96 HD1 LYS 96 -29.777 7.682 -20.864 490 HE2 LYS 96 HE2 LYS 96 -29.898 6.885 -23.183 491 HE3 LYS 96 HE1 LYS 96 -31.591 7.368 -23.273 492 HZ1 LYS 96 HZ1 LYS 96 -30.082 9.023 -24.236 493 HZ2 LYS 96 HZ2 LYS 96 -29.330 9.213 -22.725 494 HZ3 LYS 96 HZ3 LYS 96 -30.961 9.646 -22.926 495 H GLU 97 HN GLU 97 -29.496 3.347 -18.717 496 HA GLU 97 HA GLU 97 -31.129 4.562 -16.755 497 HB2 GLU 97 HB2 GLU 97 -29.505 2.007 -16.693 498 HB3 GLU 97 HB1 GLU 97 -30.632 2.486 -15.424 499 HG2 GLU 97 HG2 GLU 97 -32.473 2.536 -17.032 500 HG3 GLU 97 HG1 GLU 97 -31.364 2.140 -18.344 501 H GLU 98 HN GLU 98 -27.673 3.884 -16.942 502 HA GLU 98 HA GLU 98 -26.975 4.685 -14.307 503 HB2 GLU 98 HB2 GLU 98 -25.368 4.630 -16.865 504 HB3 GLU 98 HB1 GLU 98 -24.681 4.910 -15.268 505 HG2 GLU 98 HG2 GLU 98 -26.268 2.448 -16.050 506 HG3 GLU 98 HG1 GLU 98 -24.508 2.526 -15.990 507 H LEU 99 HN LEU 99 -27.544 6.381 -17.296 508 HA LEU 99 HA LEU 99 -26.313 8.840 -16.702 509 HB2 LEU 99 HB2 LEU 99 -28.669 8.163 -18.454 510 HB3 LEU 99 HB1 LEU 99 -27.970 9.779 -18.350 511 HG LEU 99 HG LEU 99 -26.358 7.308 -19.032 512 HD11 LEU 99 HD11 LEU 99 -26.643 9.119 -21.228 513 HD12 LEU 99 HD12 LEU 99 -28.253 8.710 -20.637 514 HD13 LEU 99 HD13 LEU 99 -27.145 7.431 -21.133 515 HD21 LEU 99 HD21 LEU 99 -24.618 8.713 -18.771 516 HD22 LEU 99 HD22 LEU 99 -25.717 10.033 -18.372 517 HD23 LEU 99 HD23 LEU 99 -25.277 9.730 -20.052 518 H GLN 100 HN GLN 100 -29.502 7.544 -15.932 519 HA GLN 100 HA GLN 100 -30.713 9.892 -14.981 520 HB2 GLN 100 HB2 GLN 100 -31.903 7.750 -15.405 521 HB3 GLN 100 HB1 GLN 100 -31.121 7.066 -13.980 522 HG2 GLN 100 HG2 GLN 100 -32.168 8.726 -12.545 523 HG3 GLN 100 HG1 GLN 100 -32.857 9.548 -13.943 524 HE21 GLN 100 HE21 GLN 100 -34.587 8.601 -11.924 525 HE22 GLN 100 HE22 GLN 100 -35.474 7.283 -12.522 526 H GLU 101 HN GLU 101 -28.613 7.531 -13.351 527 HA GLU 101 HA GLU 101 -28.893 8.720 -10.757 528 HB2 GLU 101 HB2 GLU 101 -26.823 6.830 -11.892 529 HB3 GLU 101 HB1 GLU 101 -26.883 7.323 -10.201 530 HG2 GLU 101 HG2 GLU 101 -28.140 5.378 -10.102 531 HG3 GLU 101 HG1 GLU 101 -29.415 6.554 -10.421 532 H ILE 102 HN ILE 102 -26.735 9.175 -13.491 533 HA ILE 102 HA ILE 102 -25.053 11.010 -11.939 534 HB ILE 102 HB ILE 102 -23.641 11.046 -13.970 535 HG12 ILE 102 HG12 ILE 102 -25.619 9.018 -15.035 536 HG13 ILE 102 HG11 ILE 102 -25.584 10.706 -15.544 537 HG21 ILE 102 HG21 ILE 102 -23.188 8.495 -13.972 538 HG22 ILE 102 HG22 ILE 102 -24.473 8.410 -12.766 539 HG23 ILE 102 HG23 ILE 102 -23.021 9.357 -12.442 540 HD11 ILE 102 HD1 ILE 102 -24.056 10.109 -17.090 541 HD12 ILE 102 HD2 ILE 102 -23.889 8.501 -16.386 542 HD13 ILE 102 HD3 ILE 102 -22.928 9.841 -15.765 543 H HIS 103 HN HIS 103 -25.298 13.139 -12.005 544 HA HIS 103 HA HIS 103 -26.929 14.305 -14.182 545 HB2 HIS 103 HB2 HIS 103 -27.717 15.970 -12.602 546 HB3 HIS 103 HB1 HIS 103 -28.024 14.361 -11.941 547 HD2 HIS 103 HD2 HIS 103 -26.135 17.574 -10.974 548 HE1 HIS 103 HE1 HIS 103 -24.843 14.570 -8.304 549 HE2 HIS 103 HE2 HIS 103 -24.814 17.065 -8.781 550 H ALA 104 HN ALA 104 -23.945 14.258 -12.542 551 HA ALA 104 HA ALA 104 -23.130 16.813 -13.786 552 HB1 ALA 104 HB1 ALA 104 -22.308 15.416 -11.268 553 HB2 ALA 104 HB2 ALA 104 -22.668 17.122 -11.538 554 HB3 ALA 104 HB3 ALA 104 -21.138 16.444 -12.097 555 H PHE 105 HN PHE 105 -23.280 13.975 -14.877 556 HA PHE 105 HA PHE 105 -20.436 13.516 -15.487 557 HB2 PHE 105 HB2 PHE 105 -22.912 11.812 -15.787 558 HB3 PHE 105 HB1 PHE 105 -21.366 11.374 -16.514 559 HD1 PHE 105 HD1 PHE 105 -21.239 13.281 -13.431 560 HD2 PHE 105 HD2 PHE 105 -21.408 9.309 -15.057 561 HE1 PHE 105 HE1 PHE 105 -20.469 12.361 -11.264 562 HE2 PHE 105 HE2 PHE 105 -20.639 8.390 -12.887 563 HZ PHE 105 HZ PHE 105 -20.169 9.916 -10.991 564 H SER 106 HN SER 106 -19.678 13.449 -17.606 565 HA SER 106 HA SER 106 -21.541 14.346 -19.711 566 HB2 SER 106 HB2 SER 106 -19.770 15.846 -20.573 567 HB3 SER 106 HB1 SER 106 -20.286 16.303 -18.949 568 HG SER 106 HG SER 106 -17.928 16.124 -19.414 569 H CYS 107 HN CYS 107 -21.036 13.709 -21.819 570 HA CYS 107 HA CYS 107 -18.865 11.733 -22.080 571 HB2 CYS 107 HB2 CYS 107 -20.366 10.307 -23.428 572 HB3 CYS 107 HB1 CYS 107 -20.931 10.481 -21.764 573 HG CYS 107 HG CYS 107 -23.036 11.351 -22.719 574 H LYS 108 HN LYS 108 -17.951 13.833 -23.002 575 HA LYS 108 HA LYS 108 -18.954 14.849 -25.461 576 HB2 LYS 108 HB2 LYS 108 -16.197 14.996 -24.222 577 HB3 LYS 108 HB1 LYS 108 -16.697 15.896 -25.654 578 HG2 LYS 108 HG2 LYS 108 -18.524 16.941 -24.341 579 HG3 LYS 108 HG1 LYS 108 -17.957 16.087 -22.905 580 HD2 LYS 108 HD2 LYS 108 -16.237 17.978 -24.533 581 HD3 LYS 108 HD1 LYS 108 -17.108 18.449 -23.073 582 HE2 LYS 108 HE2 LYS 108 -15.059 16.218 -23.214 583 HE3 LYS 108 HE1 LYS 108 -14.737 17.843 -22.606 584 HZ1 LYS 108 HZ1 LYS 108 -16.637 15.853 -21.498 585 HZ2 LYS 108 HZ2 LYS 108 -16.573 17.474 -20.994 586 HZ3 LYS 108 HZ3 LYS 108 -15.233 16.455 -20.761 587 H CYS 109 HN CYS 109 -18.350 14.417 -27.583 588 HA CYS 109 HA CYS 109 -16.769 11.940 -27.966 589 HB2 CYS 109 HB2 CYS 109 -19.007 13.036 -29.680 590 HB3 CYS 109 HB1 CYS 109 -18.132 11.529 -29.956 591 HG CYS 109 HG CYS 109 -19.913 11.984 -27.418 592 H TYR 110 HN TYR 110 -14.880 12.218 -28.973 593 HA TYR 110 HA TYR 110 -14.679 14.262 -31.070 594 HB2 TYR 110 HB2 TYR 110 -12.636 13.901 -28.864 595 HB3 TYR 110 HB1 TYR 110 -12.516 15.014 -30.231 596 HD1 TYR 110 HD1 TYR 110 -13.414 14.777 -26.857 597 HD2 TYR 110 HD2 TYR 110 -14.720 16.549 -30.546 598 HE1 TYR 110 HE1 TYR 110 -14.710 16.467 -25.588 599 HE2 TYR 110 HE2 TYR 110 -16.014 18.241 -29.275 600 HH TYR 110 HH TYR 110 -16.796 18.808 -27.242 601 H THR 111 HN THR 111 -13.109 13.824 -32.657 602 HA THR 111 HA THR 111 -11.566 11.367 -32.451 603 HB THR 111 HB THR 111 -13.795 11.710 -34.460 604 HG1 THR 111 HG1 THR 111 -14.319 10.718 -32.494 605 HG21 THR 111 HG21 THR 111 -11.332 9.976 -34.502 606 HG22 THR 111 HG22 THR 111 -12.028 10.935 -35.808 607 HG23 THR 111 HG23 THR 111 -12.820 9.447 -35.288 608 H GLU 112 HN GLU 112 -12.539 14.198 -34.296 609 HA GLU 112 HA GLU 112 -10.204 15.345 -34.893 610 HB2 GLU 112 HB2 GLU 112 -9.269 13.266 -35.737 611 HB3 GLU 112 HB1 GLU 112 -10.608 13.087 -36.870 612 HG2 GLU 112 HG2 GLU 112 -9.935 15.147 -38.009 613 HG3 GLU 112 HG1 GLU 112 -8.633 15.383 -36.844 614 H GLU 113 HN GLU 113 -13.302 14.341 -35.987 615 HA GLU 113 HA GLU 113 -13.569 15.969 -38.280 616 HB2 GLU 113 HB2 GLU 113 -15.634 14.920 -36.337 617 HB3 GLU 113 HB1 GLU 113 -16.026 15.769 -37.835 618 HG2 GLU 113 HG2 GLU 113 -16.093 13.546 -38.533 619 HG3 GLU 113 HG1 GLU 113 -14.437 13.995 -38.936 620 H GLU 114 HN GLU 114 -14.063 16.586 -34.834 621 HA GLU 114 HA GLU 114 -15.413 19.013 -34.955 622 HB2 GLU 114 HB2 GLU 114 -14.566 19.431 -32.736 623 HB3 GLU 114 HB1 GLU 114 -14.833 17.693 -32.879 624 HG2 GLU 114 HG2 GLU 114 -12.428 17.406 -33.464 625 HG3 GLU 114 HG1 GLU 114 -12.182 19.129 -33.188 626 H TRP 115 HN TRP 115 -12.170 18.231 -35.821 627 HA TRP 115 HA TRP 115 -11.405 21.064 -35.946 628 HB2 TRP 115 HB2 TRP 115 -9.643 19.919 -34.959 629 HB3 TRP 115 HB1 TRP 115 -9.869 18.479 -35.967 630 HD1 TRP 115 HD1 TRP 115 -8.293 18.288 -37.974 631 HE1 TRP 115 HE1 TRP 115 -6.755 19.894 -39.282 632 HE3 TRP 115 HE3 TRP 115 -9.457 22.714 -35.686 633 HZ2 TRP 115 HZ2 TRP 115 -6.102 22.676 -39.353 634 HZ3 TRP 115 HZ3 TRP 115 -8.363 24.822 -36.400 635 HH2 TRP 115 HH2 TRP 115 -6.690 24.809 -38.228 636 H SER 116 HN SER 116 -12.707 18.632 -37.858 637 HA SER 116 HA SER 116 -11.462 19.112 -40.346 638 HB2 SER 116 HB2 SER 116 -14.240 18.103 -39.722 639 HB3 SER 116 HB1 SER 116 -13.493 18.068 -41.317 640 HG SER 116 HG SER 116 -13.184 16.103 -40.196 641 H LYS 117 HN LYS 117 -12.080 20.396 -42.099 642 HA LYS 117 HA LYS 117 -12.759 22.363 -43.087 643 HB2 LYS 117 HB2 LYS 117 -15.249 21.728 -41.491 644 HB3 LYS 117 HB1 LYS 117 -15.159 22.920 -42.788 645 HG2 LYS 117 HG2 LYS 117 -14.453 21.147 -44.368 646 HG3 LYS 117 HG1 LYS 117 -14.583 19.954 -43.076 647 HD2 LYS 117 HD2 LYS 117 -16.983 20.453 -42.838 648 HD3 LYS 117 HD1 LYS 117 -16.861 21.669 -44.111 649 HE2 LYS 117 HE2 LYS 117 -17.721 19.584 -45.057 650 HE3 LYS 117 HE1 LYS 117 -16.106 19.896 -45.691 651 HZ1 LYS 117 HZ1 LYS 117 -16.493 18.249 -43.274 652 HZ2 LYS 117 HZ2 LYS 117 -15.173 18.279 -44.344 653 HZ3 LYS 117 HZ3 LYS 117 -16.640 17.565 -44.820 654 H ILE 118 HN ILE 118 -11.211 22.673 -40.759 655 HA ILE 118 HA ILE 118 -10.841 24.075 -38.927 656 HB ILE 118 HB ILE 118 -11.664 26.020 -41.094 657 HG12 ILE 118 HG12 ILE 118 -9.982 24.386 -41.868 658 HG13 ILE 118 HG11 ILE 118 -9.262 25.988 -41.682 659 HG21 ILE 118 HG21 ILE 118 -10.090 27.527 -39.920 660 HG22 ILE 118 HG22 ILE 118 -9.853 26.295 -38.681 661 HG23 ILE 118 HG23 ILE 118 -11.434 27.049 -38.882 662 HD11 ILE 118 HD1 ILE 118 -8.643 23.507 -40.271 663 HD12 ILE 118 HD2 ILE 118 -8.973 24.839 -39.163 664 HD13 ILE 118 HD3 ILE 118 -7.705 24.998 -40.378 665 H VAL 119 HN VAL 119 -12.925 23.155 -37.941 666 HA VAL 119 HA VAL 119 -15.328 24.636 -37.960 667 HB VAL 119 HB VAL 119 -14.145 22.765 -35.901 668 HG11 VAL 119 HG11 VAL 119 -15.632 23.961 -34.572 669 HG12 VAL 119 HG12 VAL 119 -16.718 22.750 -35.256 670 HG13 VAL 119 HG13 VAL 119 -16.672 24.378 -35.933 671 HG21 VAL 119 HG21 VAL 119 -16.091 22.553 -38.192 672 HG22 VAL 119 HG22 VAL 119 -16.189 21.424 -36.840 673 HG23 VAL 119 HG23 VAL 119 -14.718 21.514 -37.810 674 H VAL 120 HN VAL 120 -12.500 24.751 -35.819 675 HA VAL 120 HA VAL 120 -13.583 26.849 -34.179 676 HB VAL 120 HB VAL 120 -10.732 25.858 -34.457 677 HG11 VAL 120 HG11 VAL 120 -12.109 27.847 -32.690 678 HG12 VAL 120 HG12 VAL 120 -10.475 27.883 -33.353 679 HG13 VAL 120 HG13 VAL 120 -10.847 26.838 -31.982 680 HG21 VAL 120 HG21 VAL 120 -11.390 24.745 -32.230 681 HG22 VAL 120 HG22 VAL 120 -12.064 24.034 -33.697 682 HG23 VAL 120 HG23 VAL 120 -13.059 25.083 -32.687 683 H LEU 121 HN LEU 121 -13.485 27.318 -37.090 684 HA LEU 121 HA LEU 121 -11.434 29.118 -37.797 685 HB2 LEU 121 HB2 LEU 121 -12.943 28.054 -39.435 686 HB3 LEU 121 HB1 LEU 121 -14.290 28.999 -38.799 687 HG LEU 121 HG LEU 121 -11.826 30.470 -39.631 688 HD11 LEU 121 HD11 LEU 121 -13.884 29.918 -41.721 689 HD12 LEU 121 HD12 LEU 121 -12.699 28.654 -41.395 690 HD13 LEU 121 HD13 LEU 121 -12.163 30.256 -41.902 691 HD21 LEU 121 HD21 LEU 121 -13.777 31.976 -40.496 692 HD22 LEU 121 HD22 LEU 121 -13.509 31.863 -38.756 693 HD23 LEU 121 HD23 LEU 121 -14.802 30.932 -39.512 694 H GLU 122 HN GLU 122 -14.619 29.600 -36.331 695 HA GLU 122 HA GLU 122 -14.617 32.419 -36.337 696 HB2 GLU 122 HB2 GLU 122 -15.966 30.440 -34.490 697 HB3 GLU 122 HB1 GLU 122 -16.286 32.175 -34.482 698 HG2 GLU 122 HG2 GLU 122 -16.567 30.429 -36.941 699 HG3 GLU 122 HG1 GLU 122 -17.909 30.837 -35.872 700 H HIS 123 HN HIS 123 -13.335 30.048 -34.044 701 HA HIS 123 HA HIS 123 -11.903 30.280 -32.264 702 HB2 HIS 123 HB2 HIS 123 -11.265 32.906 -33.628 703 HB3 HIS 123 HB1 HIS 123 -10.314 32.169 -32.337 704 HD2 HIS 123 HD2 HIS 123 -10.489 32.060 -36.145 705 HE1 HIS 123 HE1 HIS 123 -8.443 28.554 -34.985 706 HE2 HIS 123 HE2 HIS 123 -9.042 30.042 -36.954 707 H HIS 124 HN HIS 124 -14.391 30.708 -31.501 708 HA HIS 124 HA HIS 124 -15.006 33.251 -30.422 709 HB2 HIS 124 HB2 HIS 124 -15.951 30.466 -29.723 710 HB3 HIS 124 HB1 HIS 124 -16.590 31.919 -28.953 711 HD2 HIS 124 HD2 HIS 124 -18.370 33.407 -30.529 712 HE1 HIS 124 HE1 HIS 124 -18.118 31.001 -33.988 713 HE2 HIS 124 HE2 HIS 124 -19.346 32.941 -32.905 714 H HIS 125 HN HIS 125 -14.785 34.076 -28.351 715 HA HIS 125 HA HIS 125 -13.285 32.566 -26.354 716 HB2 HIS 125 HB2 HIS 125 -11.567 34.294 -26.109 717 HB3 HIS 125 HB1 HIS 125 -11.538 33.633 -27.743 718 HD2 HIS 125 HD2 HIS 125 -12.147 35.482 -29.773 719 HE1 HIS 125 HE1 HIS 125 -12.981 38.754 -27.238 720 HE2 HIS 125 HE2 HIS 125 -12.655 38.041 -29.653 721 H HIS 126 HN HIS 126 -13.138 33.775 -24.285 722 HA HIS 126 HA HIS 126 -15.607 35.309 -23.867 723 HB2 HIS 126 HB2 HIS 126 -13.727 33.972 -21.906 724 HB3 HIS 126 HB1 HIS 126 -15.196 34.843 -21.462 725 HD2 HIS 126 HD2 HIS 126 -14.185 31.305 -22.493 726 HE1 HIS 126 HE1 HIS 126 -18.356 31.544 -23.102 727 HE2 HIS 126 HE2 HIS 126 -16.372 29.964 -22.981 728 H HIS 127 HN HIS 127 -12.557 36.036 -24.666 729 HA HIS 127 HA HIS 127 -11.868 38.027 -22.724 730 HB2 HIS 127 HB2 HIS 127 -10.909 37.564 -25.558 731 HB3 HIS 127 HB1 HIS 127 -10.201 38.733 -24.443 732 HD2 HIS 127 HD2 HIS 127 -9.948 34.975 -25.232 733 HE1 HIS 127 HE1 HIS 127 -8.000 35.554 -21.532 734 HE2 HIS 127 HE2 HIS 127 -8.412 33.900 -23.414 735 H HIS 128 HN HIS 128 -12.166 40.228 -22.785 736 HA HIS 128 HA HIS 128 -14.095 41.204 -24.802 737 HB2 HIS 128 HB2 HIS 128 -15.020 41.245 -22.551 738 HB3 HIS 128 HB1 HIS 128 -13.613 42.130 -21.960 739 HD2 HIS 128 HD2 HIS 128 -13.908 44.876 -22.125 740 HE1 HIS 128 HE1 HIS 128 -17.113 44.961 -24.871 741 HE2 HIS 128 HE2 HIS 128 -15.618 46.387 -23.395 Start of MODEL 12 1 H1 MET 36 HT1 MET 36 -27.405 2.701 -7.284 2 H2 MET 36 HT2 MET 36 -27.578 1.717 -5.910 3 H3 MET 36 HT3 MET 36 -28.280 1.252 -7.385 4 HA MET 36 HA MET 36 -26.024 0.225 -6.572 5 HB2 MET 36 HB2 MET 36 -27.415 0.015 -8.798 6 HB3 MET 36 HB1 MET 36 -26.152 1.059 -9.452 7 HG2 MET 36 HG2 MET 36 -25.559 -1.304 -9.779 8 HG3 MET 36 HG1 MET 36 -24.433 -0.537 -8.661 9 HE1 MET 36 HE1 MET 36 -28.233 -2.018 -7.972 10 HE2 MET 36 HE2 MET 36 -27.622 -3.670 -7.963 11 HE3 MET 36 HE3 MET 36 -27.328 -2.638 -9.360 12 HA PRO 37 HA PRO 37 -23.131 3.626 -6.142 13 HB2 PRO 37 HB2 PRO 37 -21.220 1.387 -5.730 14 HB3 PRO 37 HB1 PRO 37 -21.599 2.757 -4.668 15 HG2 PRO 37 HG2 PRO 37 -22.437 0.302 -4.095 16 HG3 PRO 37 HG1 PRO 37 -23.448 1.721 -3.768 17 HD2 PRO 37 HD2 PRO 37 -23.658 -0.262 -6.020 18 HD3 PRO 37 HD1 PRO 37 -24.952 0.504 -5.069 19 H VAL 38 HN VAL 38 -21.463 4.526 -7.391 20 HA VAL 38 HA VAL 38 -20.620 2.968 -9.757 21 HB VAL 38 HB VAL 38 -22.242 4.551 -10.548 22 HG11 VAL 38 HG11 VAL 38 -22.215 5.996 -8.530 23 HG12 VAL 38 HG12 VAL 38 -22.107 6.939 -10.016 24 HG13 VAL 38 HG13 VAL 38 -20.662 6.657 -9.043 25 HG21 VAL 38 HG21 VAL 38 -19.374 5.429 -10.980 26 HG22 VAL 38 HG22 VAL 38 -20.721 6.172 -11.843 27 HG23 VAL 38 HG23 VAL 38 -20.381 4.454 -12.051 28 H THR 39 HN THR 39 -18.508 2.996 -10.194 29 HA THR 39 HA THR 39 -16.788 4.750 -8.552 30 HB THR 39 HB THR 39 -16.184 1.987 -9.633 31 HG1 THR 39 HG1 THR 39 -17.458 1.715 -7.899 32 HG21 THR 39 HG21 THR 39 -14.147 3.205 -9.562 33 HG22 THR 39 HG22 THR 39 -14.191 2.301 -8.047 34 HG23 THR 39 HG23 THR 39 -14.599 4.017 -8.063 35 H GLU 40 HN GLU 40 -15.288 5.978 -9.561 36 HA GLU 40 HA GLU 40 -15.526 6.564 -12.285 37 HB2 GLU 40 HB2 GLU 40 -14.533 8.102 -10.643 38 HB3 GLU 40 HB1 GLU 40 -13.156 7.016 -10.453 39 HG2 GLU 40 HG2 GLU 40 -12.606 7.296 -12.844 40 HG3 GLU 40 HG1 GLU 40 -13.983 8.379 -13.031 41 H GLN 41 HN GLN 41 -13.133 4.525 -10.591 42 HA GLN 41 HA GLN 41 -11.663 3.853 -12.936 43 HB2 GLN 41 HB2 GLN 41 -11.931 2.510 -10.243 44 HB3 GLN 41 HB1 GLN 41 -10.832 1.947 -11.503 45 HG2 GLN 41 HG2 GLN 41 -9.667 4.076 -11.514 46 HG3 GLN 41 HG1 GLN 41 -10.838 4.762 -10.390 47 HE21 GLN 41 HE21 GLN 41 -7.826 4.241 -10.107 48 HE22 GLN 41 HE22 GLN 41 -7.696 3.351 -8.668 49 H GLY 42 HN GLY 42 -14.323 2.296 -11.209 50 HA2 GLY 42 HA2 GLY 42 -14.497 -0.041 -12.821 51 HA3 GLY 42 HA1 GLY 42 -15.748 0.571 -11.743 52 H LEU 43 HN LEU 43 -15.892 3.160 -13.009 53 HA LEU 43 HA LEU 43 -17.934 2.681 -14.861 54 HB2 LEU 43 HB2 LEU 43 -17.720 4.786 -13.597 55 HB3 LEU 43 HB1 LEU 43 -16.266 5.184 -14.515 56 HG LEU 43 HG LEU 43 -17.559 5.151 -16.599 57 HD11 LEU 43 HD11 LEU 43 -19.925 4.610 -14.790 58 HD12 LEU 43 HD12 LEU 43 -19.204 3.447 -15.904 59 HD13 LEU 43 HD13 LEU 43 -20.001 4.891 -16.530 60 HD21 LEU 43 HD21 LEU 43 -17.633 7.104 -14.663 61 HD22 LEU 43 HD22 LEU 43 -19.348 6.843 -14.981 62 HD23 LEU 43 HD23 LEU 43 -18.266 7.295 -16.299 63 H ARG 44 HN ARG 44 -14.511 3.330 -15.312 64 HA ARG 44 HA ARG 44 -14.499 3.669 -18.092 65 HB2 ARG 44 HB2 ARG 44 -12.554 4.091 -16.605 66 HB3 ARG 44 HB1 ARG 44 -12.397 2.353 -16.351 67 HG2 ARG 44 HG2 ARG 44 -12.046 2.025 -18.768 68 HG3 ARG 44 HG1 ARG 44 -12.205 3.762 -19.027 69 HD2 ARG 44 HD2 ARG 44 -9.841 3.199 -18.927 70 HD3 ARG 44 HD1 ARG 44 -10.269 4.129 -17.497 71 HE ARG 44 HE ARG 44 -9.865 2.233 -16.193 72 HH11 ARG 44 HH11 ARG 44 -9.970 1.482 -19.568 73 HH12 ARG 44 HH12 ARG 44 -9.363 -0.128 -19.371 74 HH21 ARG 44 HH21 ARG 44 -9.054 0.123 -15.927 75 HH22 ARG 44 HH22 ARG 44 -8.843 -0.897 -17.311 76 H GLU 45 HN GLU 45 -14.293 0.753 -16.087 77 HA GLU 45 HA GLU 45 -13.956 -1.102 -18.201 78 HB2 GLU 45 HB2 GLU 45 -15.029 -1.416 -15.390 79 HB3 GLU 45 HB1 GLU 45 -14.775 -2.769 -16.492 80 HG2 GLU 45 HG2 GLU 45 -12.401 -2.224 -16.677 81 HG3 GLU 45 HG1 GLU 45 -12.626 -0.797 -15.664 82 H ARG 46 HN ARG 46 -16.814 0.176 -16.549 83 HA ARG 46 HA ARG 46 -18.718 -1.511 -17.794 84 HB2 ARG 46 HB2 ARG 46 -19.235 -0.263 -15.753 85 HB3 ARG 46 HB1 ARG 46 -19.051 1.260 -16.622 86 HG2 ARG 46 HG2 ARG 46 -21.424 0.677 -16.470 87 HG3 ARG 46 HG1 ARG 46 -20.896 0.580 -18.151 88 HD2 ARG 46 HD2 ARG 46 -20.624 -1.855 -17.935 89 HD3 ARG 46 HD1 ARG 46 -21.113 -1.769 -16.246 90 HE ARG 46 HE ARG 46 -23.172 -0.601 -17.700 91 HH11 ARG 46 HH11 ARG 46 -21.532 -3.645 -17.533 92 HH12 ARG 46 HH12 ARG 46 -22.913 -4.572 -18.015 93 HH21 ARG 46 HH21 ARG 46 -24.988 -1.812 -18.329 94 HH22 ARG 46 HH22 ARG 46 -24.870 -3.535 -18.465 95 H ILE 47 HN ILE 47 -17.462 1.698 -18.554 96 HA ILE 47 HA ILE 47 -19.134 2.201 -20.761 97 HB ILE 47 HB ILE 47 -16.391 3.248 -20.059 98 HG12 ILE 47 HG12 ILE 47 -18.263 3.762 -18.517 99 HG13 ILE 47 HG11 ILE 47 -17.651 5.201 -19.333 100 HG21 ILE 47 HG21 ILE 47 -17.029 3.358 -22.535 101 HG22 ILE 47 HG22 ILE 47 -16.693 4.905 -21.757 102 HG23 ILE 47 HG23 ILE 47 -18.361 4.405 -22.043 103 HD11 ILE 47 HD1 ILE 47 -19.571 4.389 -21.093 104 HD12 ILE 47 HD2 ILE 47 -19.857 5.565 -19.810 105 HD13 ILE 47 HD3 ILE 47 -20.287 3.871 -19.567 106 H GLU 48 HN GLU 48 -15.931 0.746 -20.478 107 HA GLU 48 HA GLU 48 -15.391 0.426 -23.226 108 HB2 GLU 48 HB2 GLU 48 -13.691 0.154 -21.472 109 HB3 GLU 48 HB1 GLU 48 -14.514 -1.295 -20.883 110 HG2 GLU 48 HG2 GLU 48 -14.180 -2.369 -23.101 111 HG3 GLU 48 HG1 GLU 48 -13.370 -0.912 -23.677 112 H SER 49 HN SER 49 -17.073 -1.620 -20.877 113 HA SER 49 HA SER 49 -17.634 -3.641 -22.890 114 HB2 SER 49 HB2 SER 49 -18.758 -4.831 -21.119 115 HB3 SER 49 HB1 SER 49 -17.224 -4.227 -20.498 116 HG SER 49 HG SER 49 -19.849 -3.362 -19.994 117 H ALA 50 HN ALA 50 -18.960 -0.645 -21.971 118 HA ALA 50 HA ALA 50 -21.698 -1.434 -22.702 119 HB1 ALA 50 HB1 ALA 50 -22.340 0.777 -21.983 120 HB2 ALA 50 HB2 ALA 50 -20.653 1.282 -21.891 121 HB3 ALA 50 HB3 ALA 50 -21.275 0.080 -20.760 122 H ILE 51 HN ILE 51 -18.892 -0.232 -24.183 123 HA ILE 51 HA ILE 51 -20.436 0.428 -26.596 124 HB ILE 51 HB ILE 51 -19.554 2.528 -26.895 125 HG12 ILE 51 HG12 ILE 51 -17.249 1.877 -25.013 126 HG13 ILE 51 HG11 ILE 51 -17.156 1.742 -26.773 127 HG21 ILE 51 HG21 ILE 51 -19.235 2.420 -23.896 128 HG22 ILE 51 HG22 ILE 51 -20.818 2.302 -24.666 129 HG23 ILE 51 HG23 ILE 51 -19.835 3.750 -24.886 130 HD11 ILE 51 HD1 ILE 51 -16.331 3.946 -25.704 131 HD12 ILE 51 HD2 ILE 51 -18.039 4.308 -25.452 132 HD13 ILE 51 HD3 ILE 51 -17.420 4.065 -27.085 133 HA PRO 52 HA PRO 52 -17.418 -1.727 -28.915 134 HB2 PRO 52 HB2 PRO 52 -16.703 0.755 -30.398 135 HB3 PRO 52 HB1 PRO 52 -17.292 -0.800 -31.022 136 HG2 PRO 52 HG2 PRO 52 -18.857 1.342 -30.939 137 HG3 PRO 52 HG1 PRO 52 -19.496 -0.279 -30.608 138 HD2 PRO 52 HD2 PRO 52 -18.863 1.934 -28.686 139 HD3 PRO 52 HD1 PRO 52 -20.171 0.728 -28.631 140 H GLN 53 HN GLN 53 -15.281 -2.255 -28.717 141 HA GLN 53 HA GLN 53 -13.651 -1.155 -26.791 142 HB2 GLN 53 HB2 GLN 53 -11.800 -2.134 -28.555 143 HB3 GLN 53 HB1 GLN 53 -12.702 -3.109 -27.391 144 HG2 GLN 53 HG2 GLN 53 -13.994 -2.516 -30.025 145 HG3 GLN 53 HG1 GLN 53 -12.697 -3.710 -29.996 146 HE21 GLN 53 HE21 GLN 53 -15.901 -3.749 -30.086 147 HE22 GLN 53 HE22 GLN 53 -16.255 -5.014 -29.010 148 H VAL 54 HN VAL 54 -13.870 1.120 -27.024 149 HA VAL 54 HA VAL 54 -12.893 2.493 -29.330 150 HB VAL 54 HB VAL 54 -13.122 4.510 -27.945 151 HG11 VAL 54 HG11 VAL 54 -15.461 4.446 -27.861 152 HG12 VAL 54 HG12 VAL 54 -15.496 2.774 -27.299 153 HG13 VAL 54 HG13 VAL 54 -15.107 3.130 -28.982 154 HG21 VAL 54 HG21 VAL 54 -13.000 2.484 -25.816 155 HG22 VAL 54 HG22 VAL 54 -14.303 3.653 -25.599 156 HG23 VAL 54 HG23 VAL 54 -12.636 4.210 -25.747 157 H TYR 55 HN TYR 55 -11.094 3.958 -29.311 158 HA TYR 55 HA TYR 55 -8.761 2.721 -28.016 159 HB2 TYR 55 HB2 TYR 55 -8.931 4.759 -30.249 160 HB3 TYR 55 HB1 TYR 55 -7.433 4.073 -29.614 161 HD1 TYR 55 HD1 TYR 55 -10.414 3.465 -31.649 162 HD2 TYR 55 HD2 TYR 55 -6.913 1.673 -29.923 163 HE1 TYR 55 HE1 TYR 55 -10.686 1.503 -33.138 164 HE2 TYR 55 HE2 TYR 55 -7.185 -0.292 -31.413 165 HH TYR 55 HH TYR 55 -9.483 -0.309 -34.029 166 H HIS 56 HN HIS 56 -10.853 5.290 -27.500 167 HA HIS 56 HA HIS 56 -8.907 6.516 -25.672 168 HB2 HIS 56 HB2 HIS 56 -8.992 7.836 -27.822 169 HB3 HIS 56 HB1 HIS 56 -10.690 8.168 -27.472 170 HD2 HIS 56 HD2 HIS 56 -7.162 9.342 -26.318 171 HE1 HIS 56 HE1 HIS 56 -10.003 11.377 -23.949 172 HE2 HIS 56 HE2 HIS 56 -7.543 11.240 -24.565 173 H ILE 57 HN ILE 57 -9.888 5.930 -23.803 174 HA ILE 57 HA ILE 57 -12.578 7.015 -23.329 175 HB ILE 57 HB ILE 57 -12.941 4.666 -23.847 176 HG12 ILE 57 HG12 ILE 57 -13.054 5.038 -20.847 177 HG13 ILE 57 HG11 ILE 57 -14.198 5.778 -21.969 178 HG21 ILE 57 HG21 ILE 57 -11.666 3.367 -21.667 179 HG22 ILE 57 HG22 ILE 57 -10.448 4.364 -22.461 180 HG23 ILE 57 HG23 ILE 57 -11.343 3.159 -23.388 181 HD11 ILE 57 HD1 ILE 57 -15.176 3.759 -22.526 182 HD12 ILE 57 HD2 ILE 57 -14.693 3.402 -20.867 183 HD13 ILE 57 HD3 ILE 57 -13.703 2.841 -22.214 184 H ILE 58 HN ILE 58 -12.488 8.300 -21.603 185 HA ILE 58 HA ILE 58 -10.760 7.515 -19.349 186 HB ILE 58 HB ILE 58 -10.049 9.850 -19.060 187 HG12 ILE 58 HG12 ILE 58 -11.394 10.345 -21.734 188 HG13 ILE 58 HG11 ILE 58 -12.089 10.823 -20.185 189 HG21 ILE 58 HG21 ILE 58 -9.022 8.050 -20.789 190 HG22 ILE 58 HG22 ILE 58 -8.324 9.653 -20.561 191 HG23 ILE 58 HG23 ILE 58 -9.404 9.347 -21.921 192 HD11 ILE 58 HD1 ILE 58 -9.753 11.968 -19.807 193 HD12 ILE 58 HD2 ILE 58 -10.963 12.771 -20.809 194 HD13 ILE 58 HD3 ILE 58 -9.640 11.882 -21.566 195 H VAL 59 HN VAL 59 -11.538 8.090 -17.307 196 HA VAL 59 HA VAL 59 -14.277 9.215 -17.303 197 HB VAL 59 HB VAL 59 -13.080 7.158 -15.428 198 HG11 VAL 59 HG11 VAL 59 -15.089 7.195 -14.235 199 HG12 VAL 59 HG12 VAL 59 -15.980 7.938 -15.565 200 HG13 VAL 59 HG13 VAL 59 -14.859 8.904 -14.607 201 HG21 VAL 59 HG21 VAL 59 -13.606 5.832 -17.220 202 HG22 VAL 59 HG22 VAL 59 -14.723 7.015 -17.899 203 HG23 VAL 59 HG23 VAL 59 -15.237 5.979 -16.567 204 H THR 60 HN THR 60 -14.496 11.075 -16.226 205 HA THR 60 HA THR 60 -12.513 11.725 -14.129 206 HB THR 60 HB THR 60 -13.753 13.622 -16.136 207 HG1 THR 60 HG1 THR 60 -11.194 13.731 -16.270 208 HG21 THR 60 HG21 THR 60 -13.478 14.875 -14.163 209 HG22 THR 60 HG22 THR 60 -11.981 15.166 -15.048 210 HG23 THR 60 HG23 THR 60 -12.006 14.013 -13.714 211 H ASP 61 HN ASP 61 -13.362 12.225 -12.198 212 HA ASP 61 HA ASP 61 -16.280 12.501 -12.011 213 HB2 ASP 61 HB2 ASP 61 -15.950 12.075 -9.609 214 HB3 ASP 61 HB1 ASP 61 -15.223 10.803 -10.591 215 H LEU 62 HN LEU 62 -17.006 14.529 -12.128 216 HA LEU 62 HA LEU 62 -15.463 16.841 -11.619 217 HB2 LEU 62 HB2 LEU 62 -17.604 18.047 -11.743 218 HB3 LEU 62 HB1 LEU 62 -17.461 16.868 -13.048 219 HG LEU 62 HG LEU 62 -18.620 15.335 -11.120 220 HD11 LEU 62 HD11 LEU 62 -19.715 16.538 -9.560 221 HD12 LEU 62 HD12 LEU 62 -20.433 17.575 -10.792 222 HD13 LEU 62 HD13 LEU 62 -18.843 17.959 -10.132 223 HD21 LEU 62 HD21 LEU 62 -20.624 16.883 -12.585 224 HD22 LEU 62 HD22 LEU 62 -20.210 15.174 -12.722 225 HD23 LEU 62 HD23 LEU 62 -19.283 16.380 -13.615 226 H SER 63 HN SER 63 -17.783 15.045 -9.634 227 HA SER 63 HA SER 63 -17.654 16.863 -7.418 228 HB2 SER 63 HB2 SER 63 -18.964 15.223 -6.235 229 HB3 SER 63 HB1 SER 63 -19.579 15.326 -7.883 230 HG SER 63 HG SER 63 -18.565 13.434 -8.373 231 H TYR 64 HN TYR 64 -16.878 16.177 -5.246 232 HA TYR 64 HA TYR 64 -14.147 15.262 -5.435 233 HB2 TYR 64 HB2 TYR 64 -15.870 16.052 -3.074 234 HB3 TYR 64 HB1 TYR 64 -14.161 15.626 -2.954 235 HD1 TYR 64 HD1 TYR 64 -16.574 18.169 -3.974 236 HD2 TYR 64 HD2 TYR 64 -12.438 17.018 -4.096 237 HE1 TYR 64 HE1 TYR 64 -15.950 20.479 -4.626 238 HE2 TYR 64 HE2 TYR 64 -11.814 19.328 -4.746 239 HH TYR 64 HH TYR 64 -13.793 21.932 -4.398 240 H GLY 65 HN GLY 65 -13.301 13.337 -4.769 241 HA2 GLY 65 HA2 GLY 65 -13.230 11.100 -4.233 242 HA3 GLY 65 HA1 GLY 65 -14.528 11.448 -3.093 243 H CYS 66 HN CYS 66 -16.046 9.937 -3.407 244 HA CYS 66 HA CYS 66 -16.818 9.257 -6.177 245 HB2 CYS 66 HB2 CYS 66 -16.071 7.348 -4.819 246 HB3 CYS 66 HB1 CYS 66 -17.298 7.729 -3.607 247 HG CYS 66 HG CYS 66 -17.880 6.583 -6.440 248 H GLY 67 HN GLY 67 -18.764 9.864 -6.897 249 HA2 GLY 67 HA2 GLY 67 -21.108 10.028 -5.299 250 HA3 GLY 67 HA1 GLY 67 -20.434 11.638 -5.547 251 H GLN 68 HN GLN 68 -22.701 11.704 -6.599 252 HA GLN 68 HA GLN 68 -22.967 10.501 -9.201 253 HB2 GLN 68 HB2 GLN 68 -24.543 12.678 -7.809 254 HB3 GLN 68 HB1 GLN 68 -24.973 11.985 -9.374 255 HG2 GLN 68 HG2 GLN 68 -25.109 9.745 -8.347 256 HG3 GLN 68 HG1 GLN 68 -24.689 10.440 -6.782 257 HE21 GLN 68 HE21 GLN 68 -26.624 10.330 -5.600 258 HE22 GLN 68 HE22 GLN 68 -28.111 10.938 -6.146 259 H SER 69 HN SER 69 -23.124 11.684 -11.201 260 HA SER 69 HA SER 69 -22.683 13.483 -12.641 261 HB2 SER 69 HB2 SER 69 -22.545 14.811 -10.269 262 HB3 SER 69 HB1 SER 69 -20.873 14.915 -10.811 263 HG SER 69 HG SER 69 -22.390 15.361 -12.911 264 H PHE 70 HN PHE 70 -21.499 11.786 -13.687 265 HA PHE 70 HA PHE 70 -18.583 11.930 -13.241 266 HB2 PHE 70 HB2 PHE 70 -20.284 9.707 -14.382 267 HB3 PHE 70 HB1 PHE 70 -18.519 9.704 -14.390 268 HD1 PHE 70 HD1 PHE 70 -21.538 9.455 -12.302 269 HD2 PHE 70 HD2 PHE 70 -17.244 9.521 -12.308 270 HE1 PHE 70 HE1 PHE 70 -21.521 8.594 -9.976 271 HE2 PHE 70 HE2 PHE 70 -17.226 8.661 -9.982 272 HZ PHE 70 HZ PHE 70 -19.364 8.196 -8.816 273 H ASP 71 HN ASP 71 -17.512 13.055 -14.709 274 HA ASP 71 HA ASP 71 -18.671 13.402 -17.394 275 HB2 ASP 71 HB2 ASP 71 -18.035 15.423 -16.035 276 HB3 ASP 71 HB1 ASP 71 -16.356 14.902 -16.159 277 H ILE 72 HN ILE 72 -17.980 11.934 -18.838 278 HA ILE 72 HA ILE 72 -15.100 11.219 -18.810 279 HB ILE 72 HB ILE 72 -15.722 8.997 -19.638 280 HG12 ILE 72 HG12 ILE 72 -18.597 9.874 -19.231 281 HG13 ILE 72 HG11 ILE 72 -17.809 9.833 -20.809 282 HG21 ILE 72 HG21 ILE 72 -17.617 9.066 -17.416 283 HG22 ILE 72 HG22 ILE 72 -16.145 9.970 -17.058 284 HG23 ILE 72 HG23 ILE 72 -16.046 8.271 -17.519 285 HD11 ILE 72 HD1 ILE 72 -17.620 7.496 -20.797 286 HD12 ILE 72 HD2 ILE 72 -19.187 7.750 -20.030 287 HD13 ILE 72 HD3 ILE 72 -17.770 7.396 -19.042 288 H VAL 73 HN VAL 73 -14.072 11.011 -20.762 289 HA VAL 73 HA VAL 73 -15.578 11.961 -23.117 290 HB VAL 73 HB VAL 73 -12.808 12.755 -22.202 291 HG11 VAL 73 HG11 VAL 73 -12.697 14.047 -24.271 292 HG12 VAL 73 HG12 VAL 73 -14.289 13.452 -24.746 293 HG13 VAL 73 HG13 VAL 73 -12.926 12.337 -24.642 294 HG21 VAL 73 HG21 VAL 73 -14.603 14.888 -22.942 295 HG22 VAL 73 HG22 VAL 73 -13.837 14.589 -21.382 296 HG23 VAL 73 HG23 VAL 73 -15.392 13.845 -21.759 297 H VAL 74 HN VAL 74 -15.393 10.718 -24.884 298 HA VAL 74 HA VAL 74 -13.072 8.912 -25.112 299 HB VAL 74 HB VAL 74 -14.584 7.115 -25.905 300 HG11 VAL 74 HG11 VAL 74 -15.892 7.454 -23.384 301 HG12 VAL 74 HG12 VAL 74 -14.254 8.089 -23.237 302 HG13 VAL 74 HG13 VAL 74 -14.511 6.425 -23.763 303 HG21 VAL 74 HG21 VAL 74 -16.547 9.307 -25.536 304 HG22 VAL 74 HG22 VAL 74 -17.068 7.721 -24.966 305 HG23 VAL 74 HG23 VAL 74 -16.585 7.939 -26.648 306 H VAL 75 HN VAL 75 -12.612 8.220 -27.278 307 HA VAL 75 HA VAL 75 -13.851 9.923 -29.354 308 HB VAL 75 HB VAL 75 -10.933 9.196 -29.016 309 HG11 VAL 75 HG11 VAL 75 -12.432 9.645 -31.403 310 HG12 VAL 75 HG12 VAL 75 -10.685 9.467 -31.235 311 HG13 VAL 75 HG13 VAL 75 -11.422 11.066 -31.128 312 HG21 VAL 75 HG21 VAL 75 -11.001 11.129 -27.825 313 HG22 VAL 75 HG22 VAL 75 -12.607 11.541 -28.426 314 HG23 VAL 75 HG23 VAL 75 -11.182 11.922 -29.391 315 H SER 76 HN SER 76 -14.702 8.815 -30.990 316 HA SER 76 HA SER 76 -13.510 6.359 -31.947 317 HB2 SER 76 HB2 SER 76 -15.412 4.923 -31.532 318 HB3 SER 76 HB1 SER 76 -14.872 5.600 -29.997 319 HG SER 76 HG SER 76 -16.690 7.163 -31.325 320 H ASP 77 HN ASP 77 -14.772 5.464 -33.812 321 HA ASP 77 HA ASP 77 -15.400 7.544 -35.647 322 HB2 ASP 77 HB2 ASP 77 -15.721 4.548 -35.774 323 HB3 ASP 77 HB1 ASP 77 -16.142 5.622 -37.105 324 H PHE 78 HN PHE 78 -17.249 5.936 -33.296 325 HA PHE 78 HA PHE 78 -19.802 5.831 -34.453 326 HB2 PHE 78 HB2 PHE 78 -19.127 4.866 -32.226 327 HB3 PHE 78 HB1 PHE 78 -19.188 6.504 -31.568 328 HD1 PHE 78 HD1 PHE 78 -21.149 3.679 -32.862 329 HD2 PHE 78 HD2 PHE 78 -21.336 7.721 -31.428 330 HE1 PHE 78 HE1 PHE 78 -23.608 3.475 -32.604 331 HE2 PHE 78 HE2 PHE 78 -23.792 7.515 -31.165 332 HZ PHE 78 HZ PHE 78 -24.929 5.394 -31.753 333 H PHE 79 HN PHE 79 -17.942 8.490 -33.152 334 HA PHE 79 HA PHE 79 -20.215 10.312 -33.175 335 HB2 PHE 79 HB2 PHE 79 -18.498 10.552 -31.438 336 HB3 PHE 79 HB1 PHE 79 -17.278 10.846 -32.676 337 HD1 PHE 79 HD1 PHE 79 -20.516 12.146 -31.328 338 HD2 PHE 79 HD2 PHE 79 -16.945 13.016 -33.553 339 HE1 PHE 79 HE1 PHE 79 -21.111 14.555 -31.344 340 HE2 PHE 79 HE2 PHE 79 -17.541 15.422 -33.571 341 HZ PHE 79 HZ PHE 79 -19.623 16.192 -32.465 342 H GLN 80 HN GLN 80 -18.375 9.024 -35.556 343 HA GLN 80 HA GLN 80 -17.881 11.435 -37.090 344 HB2 GLN 80 HB2 GLN 80 -16.371 9.512 -37.283 345 HB3 GLN 80 HB1 GLN 80 -17.705 8.514 -37.862 346 HG2 GLN 80 HG2 GLN 80 -16.394 9.316 -39.762 347 HG3 GLN 80 HG1 GLN 80 -17.995 10.053 -39.788 348 HE21 GLN 80 HE21 GLN 80 -17.547 12.087 -40.717 349 HE22 GLN 80 HE22 GLN 80 -16.428 13.190 -40.079 350 H GLY 81 HN GLY 81 -19.829 12.416 -37.476 351 HA2 GLY 81 HA2 GLY 81 -21.538 12.879 -39.004 352 HA3 GLY 81 HA1 GLY 81 -21.468 11.208 -39.559 353 H LYS 82 HN LYS 82 -21.519 10.438 -36.583 354 HA LYS 82 HA LYS 82 -24.289 9.870 -36.438 355 HB2 LYS 82 HB2 LYS 82 -22.468 8.544 -35.327 356 HB3 LYS 82 HB1 LYS 82 -22.313 9.850 -34.153 357 HG2 LYS 82 HG2 LYS 82 -23.778 8.192 -33.194 358 HG3 LYS 82 HG1 LYS 82 -24.770 9.578 -33.646 359 HD2 LYS 82 HD2 LYS 82 -25.469 8.476 -35.699 360 HD3 LYS 82 HD1 LYS 82 -24.375 7.128 -35.391 361 HE2 LYS 82 HE2 LYS 82 -25.634 6.577 -33.337 362 HE3 LYS 82 HE1 LYS 82 -26.733 7.917 -33.653 363 HZ1 LYS 82 HZ1 LYS 82 -26.363 5.451 -35.244 364 HZ2 LYS 82 HZ2 LYS 82 -27.158 6.819 -35.864 365 HZ3 LYS 82 HZ3 LYS 82 -27.779 6.016 -34.502 366 H SER 83 HN SER 83 -22.252 12.328 -34.919 367 HA SER 83 HA SER 83 -22.971 14.508 -34.348 368 HB2 SER 83 HB2 SER 83 -25.197 13.939 -35.494 369 HB3 SER 83 HB1 SER 83 -25.743 13.404 -33.909 370 HG SER 83 HG SER 83 -26.038 15.729 -34.633 371 H LYS 84 HN LYS 84 -23.074 15.440 -32.291 372 HA LYS 84 HA LYS 84 -22.332 13.807 -30.120 373 HB2 LYS 84 HB2 LYS 84 -21.755 16.206 -30.291 374 HB3 LYS 84 HB1 LYS 84 -23.452 16.622 -30.048 375 HG2 LYS 84 HG2 LYS 84 -23.423 15.524 -27.848 376 HG3 LYS 84 HG1 LYS 84 -21.738 15.061 -28.089 377 HD2 LYS 84 HD2 LYS 84 -21.115 17.455 -28.251 378 HD3 LYS 84 HD1 LYS 84 -22.799 17.900 -27.965 379 HE2 LYS 84 HE2 LYS 84 -21.079 16.289 -26.056 380 HE3 LYS 84 HE1 LYS 84 -21.460 18.003 -25.879 381 HZ1 LYS 84 HZ1 LYS 84 -23.001 15.777 -25.123 382 HZ2 LYS 84 HZ2 LYS 84 -23.856 16.655 -26.302 383 HZ3 LYS 84 HZ3 LYS 84 -23.331 17.423 -24.881 384 H LEU 85 HN LEU 85 -25.438 15.329 -30.945 385 HA LEU 85 HA LEU 85 -26.824 14.581 -28.610 386 HB2 LEU 85 HB2 LEU 85 -27.765 15.136 -31.428 387 HB3 LEU 85 HB1 LEU 85 -28.869 14.839 -30.085 388 HG LEU 85 HG LEU 85 -28.586 17.232 -30.304 389 HD11 LEU 85 HD11 LEU 85 -26.766 16.460 -28.024 390 HD12 LEU 85 HD12 LEU 85 -28.487 16.074 -27.991 391 HD13 LEU 85 HD13 LEU 85 -27.963 17.755 -28.084 392 HD21 LEU 85 HD21 LEU 85 -25.637 16.999 -29.794 393 HD22 LEU 85 HD22 LEU 85 -26.533 18.306 -30.569 394 HD23 LEU 85 HD23 LEU 85 -26.242 16.799 -31.438 395 H MET 86 HN MET 86 -26.428 12.938 -31.736 396 HA MET 86 HA MET 86 -28.125 10.740 -31.115 397 HB2 MET 86 HB2 MET 86 -25.869 11.009 -33.118 398 HB3 MET 86 HB1 MET 86 -26.927 9.602 -33.003 399 HG2 MET 86 HG2 MET 86 -28.896 11.065 -33.358 400 HG3 MET 86 HG1 MET 86 -27.817 12.450 -33.508 401 HE1 MET 86 HE1 MET 86 -29.123 9.182 -35.948 402 HE2 MET 86 HE2 MET 86 -28.410 9.009 -34.346 403 HE3 MET 86 HE3 MET 86 -27.440 8.662 -35.776 404 H ARG 87 HN ARG 87 -24.668 11.333 -30.692 405 HA ARG 87 HA ARG 87 -23.922 8.724 -29.961 406 HB2 ARG 87 HB2 ARG 87 -22.754 11.425 -29.332 407 HB3 ARG 87 HB1 ARG 87 -22.044 9.940 -28.695 408 HG2 ARG 87 HG2 ARG 87 -22.494 9.390 -31.403 409 HG3 ARG 87 HG1 ARG 87 -21.881 11.046 -31.380 410 HD2 ARG 87 HD2 ARG 87 -20.059 9.333 -31.495 411 HD3 ARG 87 HD1 ARG 87 -19.945 10.368 -30.071 412 HE ARG 87 HE ARG 87 -21.447 8.171 -29.294 413 HH11 ARG 87 HH11 ARG 87 -18.306 8.776 -30.616 414 HH12 ARG 87 HH12 ARG 87 -17.570 7.413 -29.842 415 HH21 ARG 87 HH21 ARG 87 -20.489 6.389 -28.277 416 HH22 ARG 87 HH22 ARG 87 -18.805 6.060 -28.519 417 H SER 88 HN SER 88 -25.193 11.405 -28.049 418 HA SER 88 HA SER 88 -24.811 10.254 -25.508 419 HB2 SER 88 HB2 SER 88 -26.922 12.180 -26.496 420 HB3 SER 88 HB1 SER 88 -26.654 11.783 -24.801 421 HG SER 88 HG SER 88 -25.027 13.101 -24.819 422 H ARG 89 HN ARG 89 -27.485 9.998 -27.839 423 HA ARG 89 HA ARG 89 -29.218 8.505 -26.171 424 HB2 ARG 89 HB2 ARG 89 -28.977 8.632 -29.184 425 HB3 ARG 89 HB1 ARG 89 -30.289 7.820 -28.330 426 HG2 ARG 89 HG2 ARG 89 -29.569 10.743 -27.969 427 HG3 ARG 89 HG1 ARG 89 -30.870 10.159 -29.007 428 HD2 ARG 89 HD2 ARG 89 -31.907 9.057 -27.040 429 HD3 ARG 89 HD1 ARG 89 -30.641 9.733 -26.019 430 HE ARG 89 HE ARG 89 -31.915 11.805 -27.489 431 HH11 ARG 89 HH11 ARG 89 -32.383 9.587 -24.871 432 HH12 ARG 89 HH12 ARG 89 -33.499 10.608 -24.026 433 HH21 ARG 89 HH21 ARG 89 -33.380 13.143 -26.387 434 HH22 ARG 89 HH22 ARG 89 -34.064 12.618 -24.885 435 H ALA 90 HN ALA 90 -26.738 7.520 -28.530 436 HA ALA 90 HA ALA 90 -27.210 4.729 -28.336 437 HB1 ALA 90 HB1 ALA 90 -25.871 4.984 -30.138 438 HB2 ALA 90 HB2 ALA 90 -24.541 4.944 -28.980 439 HB3 ALA 90 HB3 ALA 90 -25.188 6.490 -29.526 440 H VAL 91 HN VAL 91 -25.001 6.908 -26.630 441 HA VAL 91 HA VAL 91 -23.731 4.854 -25.108 442 HB VAL 91 HB VAL 91 -22.666 7.032 -25.536 443 HG11 VAL 91 HG11 VAL 91 -24.717 8.146 -23.602 444 HG12 VAL 91 HG12 VAL 91 -24.805 8.344 -25.352 445 HG13 VAL 91 HG13 VAL 91 -23.459 9.042 -24.456 446 HG21 VAL 91 HG21 VAL 91 -22.786 5.619 -23.087 447 HG22 VAL 91 HG22 VAL 91 -22.816 7.331 -22.667 448 HG23 VAL 91 HG23 VAL 91 -21.496 6.686 -23.642 449 H ASN 92 HN ASN 92 -26.450 7.033 -24.541 450 HA ASN 92 HA ASN 92 -26.825 6.464 -21.807 451 HB2 ASN 92 HB2 ASN 92 -28.720 7.384 -23.967 452 HB3 ASN 92 HB1 ASN 92 -29.196 7.227 -22.277 453 HD21 ASN 92 HD21 ASN 92 -29.140 9.773 -23.658 454 HD22 ASN 92 HD22 ASN 92 -27.940 10.726 -22.929 455 H LYS 93 HN LYS 93 -28.125 4.918 -24.734 456 HA LYS 93 HA LYS 93 -29.885 3.142 -23.406 457 HB2 LYS 93 HB2 LYS 93 -28.502 2.982 -26.089 458 HB3 LYS 93 HB1 LYS 93 -29.700 1.809 -25.541 459 HG2 LYS 93 HG2 LYS 93 -31.352 3.614 -25.254 460 HG3 LYS 93 HG1 LYS 93 -30.156 4.796 -25.788 461 HD2 LYS 93 HD2 LYS 93 -30.010 3.701 -27.975 462 HD3 LYS 93 HD1 LYS 93 -31.150 2.462 -27.449 463 HE2 LYS 93 HE2 LYS 93 -32.309 4.183 -28.767 464 HE3 LYS 93 HE1 LYS 93 -32.870 4.209 -27.094 465 HZ1 LYS 93 HZ1 LYS 93 -30.664 5.942 -28.026 466 HZ2 LYS 93 HZ2 LYS 93 -31.615 6.102 -26.628 467 HZ3 LYS 93 HZ3 LYS 93 -32.286 6.420 -28.156 468 H ALA 94 HN ALA 94 -26.509 2.825 -24.435 469 HA ALA 94 HA ALA 94 -26.188 0.120 -23.664 470 HB1 ALA 94 HB1 ALA 94 -23.779 0.577 -23.822 471 HB2 ALA 94 HB2 ALA 94 -24.107 2.309 -23.890 472 HB3 ALA 94 HB3 ALA 94 -24.642 1.257 -25.202 473 H VAL 95 HN VAL 95 -25.693 3.177 -21.962 474 HA VAL 95 HA VAL 95 -25.111 1.656 -19.497 475 HB VAL 95 HB VAL 95 -23.988 3.668 -18.686 476 HG11 VAL 95 HG11 VAL 95 -23.132 2.983 -21.512 477 HG12 VAL 95 HG12 VAL 95 -22.737 2.029 -20.082 478 HG13 VAL 95 HG13 VAL 95 -22.108 3.668 -20.250 479 HG21 VAL 95 HG21 VAL 95 -25.574 4.935 -20.656 480 HG22 VAL 95 HG22 VAL 95 -23.898 5.155 -21.159 481 HG23 VAL 95 HG23 VAL 95 -24.418 5.698 -19.564 482 H LYS 96 HN LYS 96 -27.782 1.908 -20.313 483 HA LYS 96 HA LYS 96 -29.139 4.133 -19.233 484 HB2 LYS 96 HB2 LYS 96 -30.026 1.282 -19.688 485 HB3 LYS 96 HB1 LYS 96 -31.113 2.566 -19.155 486 HG2 LYS 96 HG2 LYS 96 -30.467 3.899 -21.146 487 HG3 LYS 96 HG1 LYS 96 -29.475 2.550 -21.698 488 HD2 LYS 96 HD2 LYS 96 -32.445 2.322 -21.134 489 HD3 LYS 96 HD1 LYS 96 -31.778 2.625 -22.738 490 HE2 LYS 96 HE2 LYS 96 -30.438 0.521 -22.526 491 HE3 LYS 96 HE1 LYS 96 -31.251 0.200 -20.995 492 HZ1 LYS 96 HZ1 LYS 96 -32.426 0.308 -23.707 493 HZ2 LYS 96 HZ2 LYS 96 -33.387 0.433 -22.312 494 HZ3 LYS 96 HZ3 LYS 96 -32.468 -0.968 -22.591 495 H GLU 97 HN GLU 97 -28.144 1.055 -17.805 496 HA GLU 97 HA GLU 97 -29.498 1.323 -15.348 497 HB2 GLU 97 HB2 GLU 97 -28.455 -0.784 -16.110 498 HB3 GLU 97 HB1 GLU 97 -26.860 -0.058 -15.910 499 HG2 GLU 97 HG2 GLU 97 -27.301 0.277 -13.512 500 HG3 GLU 97 HG1 GLU 97 -28.907 -0.425 -13.703 501 H GLU 98 HN GLU 98 -26.291 2.387 -16.416 502 HA GLU 98 HA GLU 98 -25.409 3.388 -13.922 503 HB2 GLU 98 HB2 GLU 98 -23.895 2.966 -15.824 504 HB3 GLU 98 HB1 GLU 98 -24.643 4.298 -16.707 505 HG2 GLU 98 HG2 GLU 98 -23.966 5.868 -14.938 506 HG3 GLU 98 HG1 GLU 98 -23.241 4.542 -14.029 507 H LEU 99 HN LEU 99 -27.163 4.902 -16.624 508 HA LEU 99 HA LEU 99 -27.122 7.547 -15.621 509 HB2 LEU 99 HB2 LEU 99 -27.743 6.940 -17.939 510 HB3 LEU 99 HB1 LEU 99 -29.217 6.203 -17.316 511 HG LEU 99 HG LEU 99 -28.650 9.023 -16.528 512 HD11 LEU 99 HD11 LEU 99 -28.905 9.922 -18.592 513 HD12 LEU 99 HD12 LEU 99 -30.197 8.795 -19.006 514 HD13 LEU 99 HD13 LEU 99 -28.512 8.317 -19.209 515 HD21 LEU 99 HD21 LEU 99 -31.305 8.340 -17.491 516 HD22 LEU 99 HD22 LEU 99 -30.813 8.898 -15.892 517 HD23 LEU 99 HD23 LEU 99 -30.755 7.180 -16.282 518 H GLN 100 HN GLN 100 -29.412 4.877 -15.179 519 HA GLN 100 HA GLN 100 -31.348 6.333 -13.717 520 HB2 GLN 100 HB2 GLN 100 -30.670 3.385 -13.771 521 HB3 GLN 100 HB1 GLN 100 -32.053 4.053 -12.905 522 HG2 GLN 100 HG2 GLN 100 -31.526 4.377 -15.874 523 HG3 GLN 100 HG1 GLN 100 -32.695 3.264 -15.164 524 HE21 GLN 100 HE21 GLN 100 -34.262 4.517 -13.503 525 HE22 GLN 100 HE22 GLN 100 -34.874 5.987 -14.092 526 H GLU 101 HN GLU 101 -28.470 4.532 -12.769 527 HA GLU 101 HA GLU 101 -28.914 4.808 -9.948 528 HB2 GLU 101 HB2 GLU 101 -26.383 4.173 -11.486 529 HB3 GLU 101 HB1 GLU 101 -26.592 4.007 -9.741 530 HG2 GLU 101 HG2 GLU 101 -28.275 2.598 -11.820 531 HG3 GLU 101 HG1 GLU 101 -26.930 1.861 -10.953 532 H ILE 102 HN ILE 102 -27.310 6.678 -12.444 533 HA ILE 102 HA ILE 102 -26.328 8.538 -10.362 534 HB ILE 102 HB ILE 102 -25.524 8.265 -13.270 535 HG12 ILE 102 HG12 ILE 102 -23.940 7.616 -10.770 536 HG13 ILE 102 HG11 ILE 102 -24.835 6.398 -11.680 537 HG21 ILE 102 HG21 ILE 102 -25.149 10.331 -11.278 538 HG22 ILE 102 HG22 ILE 102 -24.689 10.330 -12.982 539 HG23 ILE 102 HG23 ILE 102 -23.601 9.646 -11.772 540 HD11 ILE 102 HD1 ILE 102 -22.809 6.211 -12.762 541 HD12 ILE 102 HD2 ILE 102 -22.358 7.882 -12.423 542 HD13 ILE 102 HD3 ILE 102 -23.500 7.523 -13.718 543 H HIS 103 HN HIS 103 -27.413 10.377 -10.076 544 HA HIS 103 HA HIS 103 -29.675 11.111 -11.581 545 HB2 HIS 103 HB2 HIS 103 -29.311 11.854 -9.265 546 HB3 HIS 103 HB1 HIS 103 -27.953 12.849 -9.795 547 HD2 HIS 103 HD2 HIS 103 -31.881 12.886 -9.950 548 HE1 HIS 103 HE1 HIS 103 -30.467 16.517 -11.575 549 HE2 HIS 103 HE2 HIS 103 -32.541 15.251 -10.837 550 H ALA 104 HN ALA 104 -26.353 12.391 -11.619 551 HA ALA 104 HA ALA 104 -26.979 13.638 -14.230 552 HB1 ALA 104 HB1 ALA 104 -25.290 14.615 -11.937 553 HB2 ALA 104 HB2 ALA 104 -26.589 15.453 -12.783 554 HB3 ALA 104 HB3 ALA 104 -25.034 15.207 -13.578 555 H PHE 105 HN PHE 105 -25.891 12.790 -15.880 556 HA PHE 105 HA PHE 105 -23.152 11.822 -15.470 557 HB2 PHE 105 HB2 PHE 105 -24.525 9.825 -15.164 558 HB3 PHE 105 HB1 PHE 105 -25.364 10.141 -16.683 559 HD1 PHE 105 HD1 PHE 105 -21.970 9.515 -15.247 560 HD2 PHE 105 HD2 PHE 105 -24.484 9.357 -18.727 561 HE1 PHE 105 HE1 PHE 105 -20.186 8.313 -16.480 562 HE2 PHE 105 HE2 PHE 105 -22.699 8.155 -19.961 563 HZ PHE 105 HZ PHE 105 -20.550 7.633 -18.836 564 H SER 106 HN SER 106 -21.846 12.173 -17.208 565 HA SER 106 HA SER 106 -23.117 12.982 -19.747 566 HB2 SER 106 HB2 SER 106 -21.417 14.760 -19.995 567 HB3 SER 106 HB1 SER 106 -22.453 15.030 -18.594 568 HG SER 106 HG SER 106 -20.797 14.708 -17.317 569 H CYS 107 HN CYS 107 -21.899 12.577 -21.616 570 HA CYS 107 HA CYS 107 -19.408 11.050 -21.290 571 HB2 CYS 107 HB2 CYS 107 -20.485 9.573 -23.228 572 HB3 CYS 107 HB1 CYS 107 -20.742 9.191 -21.524 573 HG CYS 107 HG CYS 107 -23.135 9.327 -22.314 574 H LYS 108 HN LYS 108 -18.533 13.088 -22.084 575 HA LYS 108 HA LYS 108 -19.242 14.169 -24.603 576 HB2 LYS 108 HB2 LYS 108 -16.693 14.374 -22.988 577 HB3 LYS 108 HB1 LYS 108 -17.011 15.310 -24.449 578 HG2 LYS 108 HG2 LYS 108 -19.028 16.269 -23.400 579 HG3 LYS 108 HG1 LYS 108 -18.713 15.333 -21.938 580 HD2 LYS 108 HD2 LYS 108 -16.550 16.485 -21.660 581 HD3 LYS 108 HD1 LYS 108 -16.861 17.424 -23.122 582 HE2 LYS 108 HE2 LYS 108 -18.876 18.388 -22.082 583 HE3 LYS 108 HE1 LYS 108 -18.578 17.446 -20.621 584 HZ1 LYS 108 HZ1 LYS 108 -16.983 18.839 -19.958 585 HZ2 LYS 108 HZ2 LYS 108 -17.655 19.936 -21.067 586 HZ3 LYS 108 HZ3 LYS 108 -16.314 18.991 -21.509 587 H CYS 109 HN CYS 109 -18.417 13.822 -26.644 588 HA CYS 109 HA CYS 109 -16.420 11.666 -26.950 589 HB2 CYS 109 HB2 CYS 109 -18.673 10.749 -27.372 590 HB3 CYS 109 HB1 CYS 109 -18.939 11.988 -28.599 591 HG CYS 109 HG CYS 109 -17.140 10.900 -30.088 592 H TYR 110 HN TYR 110 -14.797 12.150 -28.292 593 HA TYR 110 HA TYR 110 -15.147 14.447 -30.125 594 HB2 TYR 110 HB2 TYR 110 -12.665 13.620 -28.600 595 HB3 TYR 110 HB1 TYR 110 -12.747 14.932 -29.778 596 HD1 TYR 110 HD1 TYR 110 -13.620 13.849 -26.394 597 HD2 TYR 110 HD2 TYR 110 -14.093 16.960 -29.316 598 HE1 TYR 110 HE1 TYR 110 -14.437 15.384 -24.626 599 HE2 TYR 110 HE2 TYR 110 -14.912 18.496 -27.549 600 HH TYR 110 HH TYR 110 -15.516 17.360 -24.265 601 H THR 111 HN THR 111 -14.324 14.266 -32.185 602 HA THR 111 HA THR 111 -12.743 11.942 -32.938 603 HB THR 111 HB THR 111 -15.466 12.393 -34.178 604 HG1 THR 111 HG1 THR 111 -14.693 11.077 -31.965 605 HG21 THR 111 HG21 THR 111 -14.283 9.818 -34.640 606 HG22 THR 111 HG22 THR 111 -13.129 11.071 -35.096 607 HG23 THR 111 HG23 THR 111 -14.738 11.047 -35.820 608 H GLU 112 HN GLU 112 -12.255 14.771 -32.949 609 HA GLU 112 HA GLU 112 -11.210 16.288 -34.323 610 HB2 GLU 112 HB2 GLU 112 -11.639 14.117 -36.389 611 HB3 GLU 112 HB1 GLU 112 -10.758 15.614 -36.698 612 HG2 GLU 112 HG2 GLU 112 -9.159 15.082 -34.936 613 HG3 GLU 112 HG1 GLU 112 -10.068 13.634 -34.511 614 H GLU 113 HN GLU 113 -14.311 14.960 -35.060 615 HA GLU 113 HA GLU 113 -15.114 16.799 -37.063 616 HB2 GLU 113 HB2 GLU 113 -16.732 15.171 -35.099 617 HB3 GLU 113 HB1 GLU 113 -17.409 16.118 -36.426 618 HG2 GLU 113 HG2 GLU 113 -15.367 13.905 -36.756 619 HG3 GLU 113 HG1 GLU 113 -17.097 13.723 -37.040 620 H GLU 114 HN GLU 114 -15.244 16.833 -33.539 621 HA GLU 114 HA GLU 114 -16.972 18.990 -33.144 622 HB2 GLU 114 HB2 GLU 114 -16.028 19.169 -30.955 623 HB3 GLU 114 HB1 GLU 114 -15.972 17.457 -31.380 624 HG2 GLU 114 HG2 GLU 114 -13.633 19.263 -31.972 625 HG3 GLU 114 HG1 GLU 114 -13.833 18.545 -30.375 626 H TRP 115 HN TRP 115 -13.711 18.867 -34.269 627 HA TRP 115 HA TRP 115 -13.219 21.704 -33.870 628 HB2 TRP 115 HB2 TRP 115 -11.248 20.479 -33.655 629 HB3 TRP 115 HB1 TRP 115 -11.637 19.421 -35.012 630 HD1 TRP 115 HD1 TRP 115 -10.601 23.065 -34.278 631 HE1 TRP 115 HE1 TRP 115 -9.389 23.997 -36.356 632 HE3 TRP 115 HE3 TRP 115 -11.219 19.146 -37.487 633 HZ2 TRP 115 HZ2 TRP 115 -8.766 23.181 -39.031 634 HZ3 TRP 115 HZ3 TRP 115 -10.310 19.245 -39.788 635 HH2 TRP 115 HH2 TRP 115 -9.084 21.256 -40.565 636 H SER 116 HN SER 116 -14.874 19.819 -36.095 637 HA SER 116 HA SER 116 -14.243 21.026 -38.546 638 HB2 SER 116 HB2 SER 116 -16.411 20.190 -39.317 639 HB3 SER 116 HB1 SER 116 -15.573 18.967 -38.364 640 HG SER 116 HG SER 116 -17.587 19.039 -37.528 641 H LYS 117 HN LYS 117 -16.401 22.007 -35.966 642 HA LYS 117 HA LYS 117 -17.800 24.028 -37.339 643 HB2 LYS 117 HB2 LYS 117 -18.473 23.186 -35.129 644 HB3 LYS 117 HB1 LYS 117 -17.039 23.913 -34.410 645 HG2 LYS 117 HG2 LYS 117 -18.933 25.409 -34.087 646 HG3 LYS 117 HG1 LYS 117 -17.809 26.139 -35.233 647 HD2 LYS 117 HD2 LYS 117 -19.191 25.372 -37.111 648 HD3 LYS 117 HD1 LYS 117 -20.298 24.577 -35.990 649 HE2 LYS 117 HE2 LYS 117 -20.814 26.755 -34.951 650 HE3 LYS 117 HE1 LYS 117 -19.707 27.550 -36.069 651 HZ1 LYS 117 HZ1 LYS 117 -21.514 25.925 -37.503 652 HZ2 LYS 117 HZ2 LYS 117 -21.285 27.606 -37.599 653 HZ3 LYS 117 HZ3 LYS 117 -22.385 26.958 -36.477 654 H ILE 118 HN ILE 118 -14.759 24.091 -35.517 655 HA ILE 118 HA ILE 118 -14.360 26.881 -36.386 656 HB ILE 118 HB ILE 118 -12.664 25.436 -34.359 657 HG12 ILE 118 HG12 ILE 118 -14.900 25.115 -33.517 658 HG13 ILE 118 HG11 ILE 118 -14.234 26.506 -32.658 659 HG21 ILE 118 HG21 ILE 118 -12.343 27.724 -33.547 660 HG22 ILE 118 HG22 ILE 118 -13.513 28.322 -34.723 661 HG23 ILE 118 HG23 ILE 118 -11.977 27.650 -35.271 662 HD11 ILE 118 HD1 ILE 118 -15.991 26.669 -35.119 663 HD12 ILE 118 HD2 ILE 118 -15.378 28.035 -34.186 664 HD13 ILE 118 HD3 ILE 118 -16.547 26.926 -33.466 665 H VAL 119 HN VAL 119 -12.892 27.308 -37.925 666 HA VAL 119 HA VAL 119 -11.190 25.126 -38.882 667 HB VAL 119 HB VAL 119 -11.813 27.840 -40.078 668 HG11 VAL 119 HG11 VAL 119 -10.888 25.793 -41.907 669 HG12 VAL 119 HG12 VAL 119 -9.704 26.068 -40.630 670 HG13 VAL 119 HG13 VAL 119 -10.248 27.413 -41.633 671 HG21 VAL 119 HG21 VAL 119 -12.818 25.084 -40.858 672 HG22 VAL 119 HG22 VAL 119 -13.276 26.620 -41.596 673 HG23 VAL 119 HG23 VAL 119 -13.755 26.263 -39.936 674 H VAL 120 HN VAL 120 -9.348 25.038 -37.746 675 HA VAL 120 HA VAL 120 -8.058 27.269 -36.558 676 HB VAL 120 HB VAL 120 -7.780 24.957 -35.745 677 HG11 VAL 120 HG11 VAL 120 -7.545 24.277 -38.357 678 HG12 VAL 120 HG12 VAL 120 -6.951 23.265 -37.039 679 HG13 VAL 120 HG13 VAL 120 -5.841 24.330 -37.900 680 HG21 VAL 120 HG21 VAL 120 -5.826 26.946 -36.033 681 HG22 VAL 120 HG22 VAL 120 -5.010 25.452 -36.494 682 HG23 VAL 120 HG23 VAL 120 -5.776 25.587 -34.911 683 H LEU 121 HN LEU 121 -7.825 25.716 -39.673 684 HA LEU 121 HA LEU 121 -5.345 26.757 -40.515 685 HB2 LEU 121 HB2 LEU 121 -7.791 25.756 -41.947 686 HB3 LEU 121 HB1 LEU 121 -6.458 26.475 -42.850 687 HG LEU 121 HG LEU 121 -6.297 23.973 -42.610 688 HD11 LEU 121 HD11 LEU 121 -4.330 25.876 -42.530 689 HD12 LEU 121 HD12 LEU 121 -4.027 24.142 -42.643 690 HD13 LEU 121 HD13 LEU 121 -3.970 24.948 -41.075 691 HD21 LEU 121 HD21 LEU 121 -5.751 23.032 -40.447 692 HD22 LEU 121 HD22 LEU 121 -7.238 23.964 -40.266 693 HD23 LEU 121 HD23 LEU 121 -5.703 24.634 -39.713 694 H GLU 122 HN GLU 122 -8.655 28.003 -40.740 695 HA GLU 122 HA GLU 122 -7.513 30.606 -41.563 696 HB2 GLU 122 HB2 GLU 122 -10.177 29.359 -42.267 697 HB3 GLU 122 HB1 GLU 122 -9.766 31.043 -42.589 698 HG2 GLU 122 HG2 GLU 122 -7.867 30.345 -43.970 699 HG3 GLU 122 HG1 GLU 122 -8.204 28.653 -43.608 700 H HIS 123 HN HIS 123 -7.471 31.877 -39.842 701 HA HIS 123 HA HIS 123 -9.685 31.759 -37.896 702 HB2 HIS 123 HB2 HIS 123 -7.464 31.442 -36.926 703 HB3 HIS 123 HB1 HIS 123 -6.913 32.955 -37.646 704 HD2 HIS 123 HD2 HIS 123 -7.356 35.161 -36.033 705 HE1 HIS 123 HE1 HIS 123 -10.175 33.418 -33.416 706 HE2 HIS 123 HE2 HIS 123 -8.809 35.506 -33.890 707 H HIS 124 HN HIS 124 -11.182 33.302 -37.992 708 HA HIS 124 HA HIS 124 -10.701 35.696 -39.592 709 HB2 HIS 124 HB2 HIS 124 -12.814 34.551 -39.923 710 HB3 HIS 124 HB1 HIS 124 -13.179 34.655 -38.199 711 HD2 HIS 124 HD2 HIS 124 -14.590 36.937 -37.534 712 HE1 HIS 124 HE1 HIS 124 -13.704 39.208 -40.982 713 HE2 HIS 124 HE2 HIS 124 -15.024 39.172 -38.812 714 H HIS 125 HN HIS 125 -10.022 37.548 -38.728 715 HA HIS 125 HA HIS 125 -10.527 38.018 -35.848 716 HB2 HIS 125 HB2 HIS 125 -8.137 37.659 -36.372 717 HB3 HIS 125 HB1 HIS 125 -8.202 38.997 -37.520 718 HD2 HIS 125 HD2 HIS 125 -7.619 41.431 -36.342 719 HE1 HIS 125 HE1 HIS 125 -8.392 40.345 -32.336 720 HE2 HIS 125 HE2 HIS 125 -7.559 42.205 -33.848 721 H HIS 126 HN HIS 126 -12.002 39.563 -35.550 722 HA HIS 126 HA HIS 126 -12.942 41.305 -37.547 723 HB2 HIS 126 HB2 HIS 126 -14.260 40.722 -35.565 724 HB3 HIS 126 HB1 HIS 126 -13.117 41.588 -34.539 725 HD2 HIS 126 HD2 HIS 126 -13.720 44.269 -34.246 726 HE1 HIS 126 HE1 HIS 126 -16.376 44.639 -37.506 727 HE2 HIS 126 HE2 HIS 126 -15.358 45.852 -35.521 728 H HIS 127 HN HIS 127 -10.708 41.919 -34.834 729 HA HIS 127 HA HIS 127 -8.981 43.619 -36.154 730 HB2 HIS 127 HB2 HIS 127 -10.872 45.105 -36.574 731 HB3 HIS 127 HB1 HIS 127 -11.242 45.152 -34.851 732 HD2 HIS 127 HD2 HIS 127 -9.911 47.169 -33.507 733 HE1 HIS 127 HE1 HIS 127 -6.961 47.970 -36.418 734 HE2 HIS 127 HE2 HIS 127 -7.907 48.702 -34.178 735 H HIS 128 HN HIS 128 -10.817 43.400 -33.113 736 HA HIS 128 HA HIS 128 -8.819 44.413 -31.413 737 HB2 HIS 128 HB2 HIS 128 -11.266 43.952 -30.854 738 HB3 HIS 128 HB1 HIS 128 -10.795 42.267 -30.638 739 HD2 HIS 128 HD2 HIS 128 -10.613 45.619 -28.707 740 HE1 HIS 128 HE1 HIS 128 -8.336 42.814 -26.522 741 HE2 HIS 128 HE2 HIS 128 -9.356 45.138 -26.469 Start of MODEL 13 1 H1 MET 36 HT1 MET 36 -20.338 5.997 -5.250 2 H2 MET 36 HT2 MET 36 -19.277 6.632 -4.084 3 H3 MET 36 HT3 MET 36 -20.949 6.597 -3.785 4 HA MET 36 HA MET 36 -18.973 4.472 -3.581 5 HB2 MET 36 HB2 MET 36 -20.972 5.753 -1.984 6 HB3 MET 36 HB1 MET 36 -21.389 4.044 -2.122 7 HG2 MET 36 HG2 MET 36 -19.914 4.330 -0.211 8 HG3 MET 36 HG1 MET 36 -19.037 3.471 -1.479 9 HE1 MET 36 HE1 MET 36 -16.880 5.550 0.768 10 HE2 MET 36 HE2 MET 36 -16.135 4.716 -0.595 11 HE3 MET 36 HE3 MET 36 -17.483 3.968 0.258 12 HA PRO 37 HA PRO 37 -23.125 2.282 -5.119 13 HB2 PRO 37 HB2 PRO 37 -23.959 4.478 -6.962 14 HB3 PRO 37 HB1 PRO 37 -24.955 3.397 -5.967 15 HG2 PRO 37 HG2 PRO 37 -24.589 5.928 -5.274 16 HG3 PRO 37 HG1 PRO 37 -24.637 4.643 -4.054 17 HD2 PRO 37 HD2 PRO 37 -22.266 6.123 -5.140 18 HD3 PRO 37 HD1 PRO 37 -22.570 5.536 -3.490 19 H VAL 38 HN VAL 38 -21.264 4.532 -7.140 20 HA VAL 38 HA VAL 38 -20.690 2.294 -8.983 21 HB VAL 38 HB VAL 38 -22.246 3.701 -10.157 22 HG11 VAL 38 HG11 VAL 38 -20.791 5.805 -8.724 23 HG12 VAL 38 HG12 VAL 38 -22.436 5.813 -9.362 24 HG13 VAL 38 HG13 VAL 38 -21.077 6.198 -10.420 25 HG21 VAL 38 HG21 VAL 38 -19.373 3.739 -10.902 26 HG22 VAL 38 HG22 VAL 38 -20.387 4.905 -11.751 27 HG23 VAL 38 HG23 VAL 38 -20.765 3.185 -11.831 28 H THR 39 HN THR 39 -18.581 2.019 -9.469 29 HA THR 39 HA THR 39 -16.664 3.874 -8.246 30 HB THR 39 HB THR 39 -15.019 2.078 -8.658 31 HG1 THR 39 HG1 THR 39 -16.935 1.279 -10.343 32 HG21 THR 39 HG21 THR 39 -17.541 0.941 -7.432 33 HG22 THR 39 HG22 THR 39 -16.514 2.118 -6.614 34 HG23 THR 39 HG23 THR 39 -15.873 0.529 -7.032 35 H GLU 40 HN GLU 40 -15.221 5.064 -9.402 36 HA GLU 40 HA GLU 40 -15.805 5.707 -12.087 37 HB2 GLU 40 HB2 GLU 40 -14.675 7.245 -10.512 38 HB3 GLU 40 HB1 GLU 40 -13.250 6.207 -10.544 39 HG2 GLU 40 HG2 GLU 40 -12.893 7.992 -12.118 40 HG3 GLU 40 HG1 GLU 40 -13.173 6.521 -13.041 41 H GLN 41 HN GLN 41 -13.249 3.696 -10.643 42 HA GLN 41 HA GLN 41 -11.893 3.088 -13.044 43 HB2 GLN 41 HB2 GLN 41 -10.917 2.683 -10.828 44 HB3 GLN 41 HB1 GLN 41 -12.134 1.447 -10.509 45 HG2 GLN 41 HG2 GLN 41 -11.313 0.098 -12.360 46 HG3 GLN 41 HG1 GLN 41 -10.171 1.361 -12.817 47 HE21 GLN 41 HE21 GLN 41 -9.257 -1.261 -12.157 48 HE22 GLN 41 HE22 GLN 41 -8.392 -1.178 -10.700 49 H GLY 42 HN GLY 42 -14.503 1.432 -11.321 50 HA2 GLY 42 HA2 GLY 42 -14.743 -0.762 -13.106 51 HA3 GLY 42 HA1 GLY 42 -15.968 -0.228 -11.959 52 H LEU 43 HN LEU 43 -16.037 2.487 -13.075 53 HA LEU 43 HA LEU 43 -18.162 2.192 -14.885 54 HB2 LEU 43 HB2 LEU 43 -17.766 4.236 -13.515 55 HB3 LEU 43 HB1 LEU 43 -16.355 4.592 -14.510 56 HG LEU 43 HG LEU 43 -17.732 4.745 -16.503 57 HD11 LEU 43 HD11 LEU 43 -19.999 4.036 -14.628 58 HD12 LEU 43 HD12 LEU 43 -19.404 3.068 -15.977 59 HD13 LEU 43 HD13 LEU 43 -20.216 4.605 -16.284 60 HD21 LEU 43 HD21 LEU 43 -17.782 6.523 -14.345 61 HD22 LEU 43 HD22 LEU 43 -19.470 6.386 -14.834 62 HD23 LEU 43 HD23 LEU 43 -18.252 6.891 -16.005 63 H ARG 44 HN ARG 44 -14.727 2.846 -15.450 64 HA ARG 44 HA ARG 44 -14.866 3.268 -18.221 65 HB2 ARG 44 HB2 ARG 44 -12.864 3.727 -16.824 66 HB3 ARG 44 HB1 ARG 44 -12.615 1.990 -16.647 67 HG2 ARG 44 HG2 ARG 44 -12.924 3.064 -19.416 68 HG3 ARG 44 HG1 ARG 44 -11.401 3.377 -18.582 69 HD2 ARG 44 HD2 ARG 44 -12.667 0.650 -18.963 70 HD3 ARG 44 HD1 ARG 44 -11.300 1.277 -19.879 71 HE ARG 44 HE ARG 44 -11.249 0.288 -17.148 72 HH11 ARG 44 HH11 ARG 44 -9.732 2.188 -19.609 73 HH12 ARG 44 HH12 ARG 44 -8.153 2.088 -18.907 74 HH21 ARG 44 HH21 ARG 44 -9.180 0.154 -16.219 75 HH22 ARG 44 HH22 ARG 44 -7.839 0.937 -16.988 76 H GLU 45 HN GLU 45 -14.488 0.290 -16.332 77 HA GLU 45 HA GLU 45 -14.157 -1.457 -18.535 78 HB2 GLU 45 HB2 GLU 45 -15.149 -1.932 -15.715 79 HB3 GLU 45 HB1 GLU 45 -14.881 -3.226 -16.883 80 HG2 GLU 45 HG2 GLU 45 -12.530 -2.586 -17.101 81 HG3 GLU 45 HG1 GLU 45 -12.778 -1.224 -16.008 82 H ARG 46 HN ARG 46 -17.007 -0.328 -16.762 83 HA ARG 46 HA ARG 46 -18.885 -2.007 -18.054 84 HB2 ARG 46 HB2 ARG 46 -19.356 -0.827 -15.931 85 HB3 ARG 46 HB1 ARG 46 -19.317 0.715 -16.788 86 HG2 ARG 46 HG2 ARG 46 -21.209 0.064 -18.158 87 HG3 ARG 46 HG1 ARG 46 -21.189 -1.567 -17.484 88 HD2 ARG 46 HD2 ARG 46 -21.637 0.943 -15.847 89 HD3 ARG 46 HD1 ARG 46 -22.933 -0.084 -16.456 90 HE ARG 46 HE ARG 46 -21.139 -1.716 -15.043 91 HH11 ARG 46 HH11 ARG 46 -23.321 0.918 -14.528 92 HH12 ARG 46 HH12 ARG 46 -23.686 0.476 -12.894 93 HH21 ARG 46 HH21 ARG 46 -21.608 -2.296 -12.895 94 HH22 ARG 46 HH22 ARG 46 -22.715 -1.339 -11.969 95 H ILE 47 HN ILE 47 -17.702 1.260 -18.700 96 HA ILE 47 HA ILE 47 -19.399 1.813 -20.879 97 HB ILE 47 HB ILE 47 -16.658 2.871 -20.176 98 HG12 ILE 47 HG12 ILE 47 -18.501 3.326 -18.588 99 HG13 ILE 47 HG11 ILE 47 -17.921 4.794 -19.378 100 HG21 ILE 47 HG21 ILE 47 -18.631 4.169 -22.045 101 HG22 ILE 47 HG22 ILE 47 -17.429 3.026 -22.648 102 HG23 ILE 47 HG23 ILE 47 -16.912 4.509 -21.848 103 HD11 ILE 47 HD1 ILE 47 -20.501 3.311 -19.786 104 HD12 ILE 47 HD2 ILE 47 -19.831 4.258 -21.115 105 HD13 ILE 47 HD3 ILE 47 -20.234 5.042 -19.587 106 H GLU 48 HN GLU 48 -16.169 0.396 -20.672 107 HA GLU 48 HA GLU 48 -15.641 0.160 -23.420 108 HB2 GLU 48 HB2 GLU 48 -13.927 -0.179 -21.698 109 HB3 GLU 48 HB1 GLU 48 -14.753 -1.637 -21.142 110 HG2 GLU 48 HG2 GLU 48 -13.932 -1.334 -24.032 111 HG3 GLU 48 HG1 GLU 48 -12.773 -1.900 -22.828 112 H SER 49 HN SER 49 -17.365 -1.952 -21.165 113 HA SER 49 HA SER 49 -17.806 -4.030 -23.096 114 HB2 SER 49 HB2 SER 49 -19.285 -4.991 -21.419 115 HB3 SER 49 HB1 SER 49 -17.807 -4.433 -20.638 116 HG SER 49 HG SER 49 -19.868 -3.817 -19.627 117 H ALA 50 HN ALA 50 -19.271 -0.978 -22.367 118 HA ALA 50 HA ALA 50 -21.774 -1.724 -23.717 119 HB1 ALA 50 HB1 ALA 50 -22.144 0.858 -23.184 120 HB2 ALA 50 HB2 ALA 50 -20.862 0.545 -22.015 121 HB3 ALA 50 HB3 ALA 50 -22.361 -0.380 -21.947 122 H ILE 51 HN ILE 51 -18.739 -0.639 -24.538 123 HA ILE 51 HA ILE 51 -19.664 0.205 -27.173 124 HB ILE 51 HB ILE 51 -19.586 2.310 -25.906 125 HG12 ILE 51 HG12 ILE 51 -17.185 2.103 -27.751 126 HG13 ILE 51 HG11 ILE 51 -18.854 2.179 -28.323 127 HG21 ILE 51 HG21 ILE 51 -16.745 2.533 -25.559 128 HG22 ILE 51 HG22 ILE 51 -17.315 1.088 -24.722 129 HG23 ILE 51 HG23 ILE 51 -18.017 2.660 -24.344 130 HD11 ILE 51 HD1 ILE 51 -19.096 4.383 -27.754 131 HD12 ILE 51 HD2 ILE 51 -17.345 4.380 -27.966 132 HD13 ILE 51 HD3 ILE 51 -18.037 4.245 -26.349 133 HA PRO 52 HA PRO 52 -16.185 -2.301 -28.231 134 HB2 PRO 52 HB2 PRO 52 -15.840 -1.281 -30.798 135 HB3 PRO 52 HB1 PRO 52 -16.998 -2.552 -30.359 136 HG2 PRO 52 HG2 PRO 52 -17.443 0.365 -30.755 137 HG3 PRO 52 HG1 PRO 52 -18.474 -1.006 -31.199 138 HD2 PRO 52 HD2 PRO 52 -19.019 0.515 -29.040 139 HD3 PRO 52 HD1 PRO 52 -19.336 -1.235 -29.050 140 H GLN 53 HN GLN 53 -13.990 -2.119 -28.125 141 HA GLN 53 HA GLN 53 -12.686 -0.007 -27.060 142 HB2 GLN 53 HB2 GLN 53 -10.607 -0.865 -28.206 143 HB3 GLN 53 HB1 GLN 53 -11.537 -2.094 -27.344 144 HG2 GLN 53 HG2 GLN 53 -12.636 -2.733 -29.472 145 HG3 GLN 53 HG1 GLN 53 -11.658 -1.540 -30.324 146 HE21 GLN 53 HE21 GLN 53 -10.460 -3.093 -31.588 147 HE22 GLN 53 HE22 GLN 53 -9.360 -4.175 -30.881 148 H VAL 54 HN VAL 54 -13.491 1.948 -27.843 149 HA VAL 54 HA VAL 54 -13.268 2.681 -30.615 150 HB VAL 54 HB VAL 54 -14.019 4.873 -29.891 151 HG11 VAL 54 HG11 VAL 54 -15.427 2.522 -29.614 152 HG12 VAL 54 HG12 VAL 54 -16.127 4.136 -29.487 153 HG13 VAL 54 HG13 VAL 54 -15.640 3.268 -28.031 154 HG21 VAL 54 HG21 VAL 54 -13.953 5.623 -27.689 155 HG22 VAL 54 HG22 VAL 54 -12.508 4.613 -27.731 156 HG23 VAL 54 HG23 VAL 54 -14.000 3.990 -27.024 157 H TYR 55 HN TYR 55 -12.275 5.218 -30.589 158 HA TYR 55 HA TYR 55 -9.491 4.795 -30.811 159 HB2 TYR 55 HB2 TYR 55 -11.081 7.362 -30.623 160 HB3 TYR 55 HB1 TYR 55 -9.373 7.278 -31.056 161 HD1 TYR 55 HD1 TYR 55 -12.810 6.517 -32.129 162 HD2 TYR 55 HD2 TYR 55 -8.653 6.316 -33.186 163 HE1 TYR 55 HE1 TYR 55 -13.433 6.022 -34.477 164 HE2 TYR 55 HE2 TYR 55 -9.274 5.821 -35.535 165 HH TYR 55 HH TYR 55 -12.554 6.082 -36.662 166 H HIS 56 HN HIS 56 -11.453 6.354 -28.285 167 HA HIS 56 HA HIS 56 -9.484 5.736 -26.288 168 HB2 HIS 56 HB2 HIS 56 -8.586 7.827 -27.409 169 HB3 HIS 56 HB1 HIS 56 -10.012 8.666 -26.797 170 HD2 HIS 56 HD2 HIS 56 -8.586 6.047 -24.336 171 HE1 HIS 56 HE1 HIS 56 -7.225 9.822 -23.028 172 HE2 HIS 56 HE2 HIS 56 -7.410 7.365 -22.413 173 H ILE 57 HN ILE 57 -10.448 5.567 -24.327 174 HA ILE 57 HA ILE 57 -13.034 6.914 -23.906 175 HB ILE 57 HB ILE 57 -13.733 4.740 -24.572 176 HG12 ILE 57 HG12 ILE 57 -13.538 4.741 -21.551 177 HG13 ILE 57 HG11 ILE 57 -14.758 5.598 -22.494 178 HG21 ILE 57 HG21 ILE 57 -11.702 3.500 -24.559 179 HG22 ILE 57 HG22 ILE 57 -12.732 2.709 -23.365 180 HG23 ILE 57 HG23 ILE 57 -11.444 3.793 -22.839 181 HD11 ILE 57 HD1 ILE 57 -14.328 2.637 -22.866 182 HD12 ILE 57 HD2 ILE 57 -15.751 3.601 -23.263 183 HD13 ILE 57 HD3 ILE 57 -15.369 3.243 -21.578 184 H ILE 58 HN ILE 58 -12.883 8.077 -22.091 185 HA ILE 58 HA ILE 58 -11.578 6.870 -19.753 186 HB ILE 58 HB ILE 58 -10.334 8.939 -19.280 187 HG12 ILE 58 HG12 ILE 58 -11.196 9.812 -22.053 188 HG13 ILE 58 HG11 ILE 58 -11.928 10.419 -20.568 189 HG21 ILE 58 HG21 ILE 58 -8.698 8.744 -21.191 190 HG22 ILE 58 HG22 ILE 58 -9.859 7.692 -22.003 191 HG23 ILE 58 HG23 ILE 58 -9.143 7.197 -20.469 192 HD11 ILE 58 HD1 ILE 58 -9.356 10.840 -19.941 193 HD12 ILE 58 HD2 ILE 58 -10.304 12.029 -20.834 194 HD13 ILE 58 HD3 ILE 58 -9.217 10.940 -21.697 195 H VAL 59 HN VAL 59 -12.569 7.385 -17.846 196 HA VAL 59 HA VAL 59 -14.794 9.329 -18.004 197 HB VAL 59 HB VAL 59 -14.602 6.818 -16.328 198 HG11 VAL 59 HG11 VAL 59 -15.967 9.114 -15.705 199 HG12 VAL 59 HG12 VAL 59 -16.465 7.499 -15.206 200 HG13 VAL 59 HG13 VAL 59 -17.179 8.237 -16.638 201 HG21 VAL 59 HG21 VAL 59 -16.630 6.217 -17.790 202 HG22 VAL 59 HG22 VAL 59 -15.050 6.162 -18.575 203 HG23 VAL 59 HG23 VAL 59 -16.122 7.538 -18.843 204 H THR 60 HN THR 60 -14.672 11.011 -16.684 205 HA THR 60 HA THR 60 -12.995 10.800 -14.265 206 HB THR 60 HB THR 60 -13.136 13.178 -16.140 207 HG1 THR 60 HG1 THR 60 -11.859 11.451 -16.894 208 HG21 THR 60 HG21 THR 60 -11.190 13.884 -14.580 209 HG22 THR 60 HG22 THR 60 -11.860 12.702 -13.454 210 HG23 THR 60 HG23 THR 60 -12.839 14.070 -13.984 211 H ASP 61 HN ASP 61 -13.852 11.622 -12.433 212 HA ASP 61 HA ASP 61 -16.617 12.563 -12.561 213 HB2 ASP 61 HB2 ASP 61 -14.829 11.700 -10.282 214 HB3 ASP 61 HB1 ASP 61 -16.443 12.369 -10.037 215 H LEU 62 HN LEU 62 -17.214 14.621 -12.231 216 HA LEU 62 HA LEU 62 -15.350 16.727 -12.252 217 HB2 LEU 62 HB2 LEU 62 -17.659 16.983 -13.059 218 HB3 LEU 62 HB1 LEU 62 -18.262 16.768 -11.414 219 HG LEU 62 HG LEU 62 -16.994 18.761 -10.695 220 HD11 LEU 62 HD11 LEU 62 -16.346 19.067 -13.642 221 HD12 LEU 62 HD12 LEU 62 -15.192 18.565 -12.407 222 HD13 LEU 62 HD13 LEU 62 -15.894 20.181 -12.352 223 HD21 LEU 62 HD21 LEU 62 -18.324 20.055 -12.905 224 HD22 LEU 62 HD22 LEU 62 -18.835 19.952 -11.221 225 HD23 LEU 62 HD23 LEU 62 -19.287 18.683 -12.359 226 H SER 63 HN SER 63 -17.204 15.249 -9.617 227 HA SER 63 HA SER 63 -16.379 17.047 -7.588 228 HB2 SER 63 HB2 SER 63 -17.313 14.178 -7.414 229 HB3 SER 63 HB1 SER 63 -17.096 15.244 -6.028 230 HG SER 63 HG SER 63 -18.813 16.367 -6.610 231 H TYR 64 HN TYR 64 -14.791 16.811 -5.973 232 HA TYR 64 HA TYR 64 -12.278 15.905 -6.835 233 HB2 TYR 64 HB2 TYR 64 -12.546 17.612 -5.092 234 HB3 TYR 64 HB1 TYR 64 -13.258 16.410 -4.015 235 HD1 TYR 64 HD1 TYR 64 -10.166 17.325 -5.864 236 HD2 TYR 64 HD2 TYR 64 -11.892 14.891 -2.775 237 HE1 TYR 64 HE1 TYR 64 -7.896 16.649 -5.130 238 HE2 TYR 64 HE2 TYR 64 -9.622 14.215 -2.039 239 HH TYR 64 HH TYR 64 -6.768 15.771 -3.227 240 H GLY 65 HN GLY 65 -14.574 14.451 -4.528 241 HA2 GLY 65 HA2 GLY 65 -12.958 12.039 -4.310 242 HA3 GLY 65 HA1 GLY 65 -14.472 12.366 -3.469 243 H CYS 66 HN CYS 66 -14.585 9.967 -4.262 244 HA CYS 66 HA CYS 66 -15.505 9.750 -7.034 245 HB2 CYS 66 HB2 CYS 66 -15.052 7.681 -4.874 246 HB3 CYS 66 HB1 CYS 66 -15.649 7.309 -6.493 247 HG CYS 66 HG CYS 66 -13.179 7.123 -6.919 248 H GLY 67 HN GLY 67 -17.589 9.339 -7.629 249 HA2 GLY 67 HA2 GLY 67 -19.686 8.341 -6.162 250 HA3 GLY 67 HA1 GLY 67 -19.667 10.064 -5.792 251 H GLN 68 HN GLN 68 -21.754 10.196 -6.830 252 HA GLN 68 HA GLN 68 -22.076 9.567 -9.610 253 HB2 GLN 68 HB2 GLN 68 -23.711 11.229 -7.685 254 HB3 GLN 68 HB1 GLN 68 -24.196 10.898 -9.348 255 HG2 GLN 68 HG2 GLN 68 -24.236 8.516 -8.931 256 HG3 GLN 68 HG1 GLN 68 -23.546 8.740 -7.323 257 HE21 GLN 68 HE21 GLN 68 -26.282 7.651 -8.268 258 HE22 GLN 68 HE22 GLN 68 -27.402 8.542 -7.356 259 H SER 69 HN SER 69 -20.354 10.649 -10.654 260 HA SER 69 HA SER 69 -20.795 13.553 -10.948 261 HB2 SER 69 HB2 SER 69 -18.128 12.139 -10.758 262 HB3 SER 69 HB1 SER 69 -18.344 13.830 -11.189 263 HG SER 69 HG SER 69 -18.717 14.286 -9.164 264 H PHE 70 HN PHE 70 -20.224 14.430 -12.997 265 HA PHE 70 HA PHE 70 -19.950 12.413 -15.141 266 HB2 PHE 70 HB2 PHE 70 -21.426 13.811 -16.517 267 HB3 PHE 70 HB1 PHE 70 -22.232 13.261 -15.050 268 HD1 PHE 70 HD1 PHE 70 -20.816 16.139 -16.831 269 HD2 PHE 70 HD2 PHE 70 -22.692 14.817 -13.201 270 HE1 PHE 70 HE1 PHE 70 -21.251 18.498 -16.199 271 HE2 PHE 70 HE2 PHE 70 -23.127 17.176 -12.567 272 HZ PHE 70 HZ PHE 70 -22.405 19.015 -14.066 273 H ASP 71 HN ASP 71 -18.114 12.681 -16.225 274 HA ASP 71 HA ASP 71 -17.360 15.041 -17.503 275 HB2 ASP 71 HB2 ASP 71 -16.870 15.916 -15.281 276 HB3 ASP 71 HB1 ASP 71 -15.844 14.530 -14.926 277 H ILE 72 HN ILE 72 -17.337 13.050 -18.930 278 HA ILE 72 HA ILE 72 -14.668 11.752 -18.790 279 HB ILE 72 HB ILE 72 -15.597 9.730 -19.559 280 HG12 ILE 72 HG12 ILE 72 -18.061 11.340 -20.290 281 HG13 ILE 72 HG11 ILE 72 -16.879 10.669 -21.414 282 HG21 ILE 72 HG21 ILE 72 -16.266 10.147 -17.237 283 HG22 ILE 72 HG22 ILE 72 -17.565 9.308 -18.086 284 HG23 ILE 72 HG23 ILE 72 -17.684 11.041 -17.788 285 HD11 ILE 72 HD1 ILE 72 -17.912 8.651 -19.569 286 HD12 ILE 72 HD2 ILE 72 -17.800 8.611 -21.329 287 HD13 ILE 72 HD3 ILE 72 -19.184 9.380 -20.552 288 H VAL 73 HN VAL 73 -13.684 11.238 -20.813 289 HA VAL 73 HA VAL 73 -14.698 12.845 -23.070 290 HB VAL 73 HB VAL 73 -11.820 12.541 -22.189 291 HG11 VAL 73 HG11 VAL 73 -11.332 14.076 -24.025 292 HG12 VAL 73 HG12 VAL 73 -13.041 14.131 -24.456 293 HG13 VAL 73 HG13 VAL 73 -12.132 12.633 -24.646 294 HG21 VAL 73 HG21 VAL 73 -13.931 14.476 -21.590 295 HG22 VAL 73 HG22 VAL 73 -12.516 15.238 -22.322 296 HG23 VAL 73 HG23 VAL 73 -12.343 14.288 -20.846 297 H VAL 74 HN VAL 74 -14.968 11.729 -24.893 298 HA VAL 74 HA VAL 74 -13.267 9.403 -25.431 299 HB VAL 74 HB VAL 74 -15.173 8.411 -24.323 300 HG11 VAL 74 HG11 VAL 74 -17.006 9.777 -24.375 301 HG12 VAL 74 HG12 VAL 74 -17.408 8.822 -25.802 302 HG13 VAL 74 HG13 VAL 74 -16.628 10.394 -25.985 303 HG21 VAL 74 HG21 VAL 74 -14.345 7.838 -26.941 304 HG22 VAL 74 HG22 VAL 74 -16.107 7.780 -27.004 305 HG23 VAL 74 HG23 VAL 74 -15.232 6.761 -25.861 306 H VAL 75 HN VAL 75 -12.947 8.991 -27.595 307 HA VAL 75 HA VAL 75 -14.325 10.806 -29.486 308 HB VAL 75 HB VAL 75 -11.414 9.979 -29.437 309 HG11 VAL 75 HG11 VAL 75 -11.248 10.484 -31.632 310 HG12 VAL 75 HG12 VAL 75 -12.223 11.942 -31.440 311 HG13 VAL 75 HG13 VAL 75 -13.007 10.383 -31.688 312 HG21 VAL 75 HG21 VAL 75 -12.638 12.747 -29.453 313 HG22 VAL 75 HG22 VAL 75 -10.970 12.303 -29.091 314 HG23 VAL 75 HG23 VAL 75 -12.258 11.891 -27.959 315 H SER 76 HN SER 76 -15.323 9.818 -31.121 316 HA SER 76 HA SER 76 -14.300 7.375 -32.277 317 HB2 SER 76 HB2 SER 76 -16.264 6.014 -31.829 318 HB3 SER 76 HB1 SER 76 -15.560 6.543 -30.303 319 HG SER 76 HG SER 76 -17.832 6.844 -30.369 320 H ASP 77 HN ASP 77 -15.617 6.680 -34.142 321 HA ASP 77 HA ASP 77 -16.430 8.956 -35.692 322 HB2 ASP 77 HB2 ASP 77 -16.442 5.990 -36.238 323 HB3 ASP 77 HB1 ASP 77 -17.005 7.191 -37.397 324 H PHE 78 HN PHE 78 -17.993 7.116 -33.412 325 HA PHE 78 HA PHE 78 -20.555 6.674 -34.456 326 HB2 PHE 78 HB2 PHE 78 -19.713 5.819 -32.260 327 HB3 PHE 78 HB1 PHE 78 -19.883 7.455 -31.608 328 HD1 PHE 78 HD1 PHE 78 -21.896 5.012 -33.648 329 HD2 PHE 78 HD2 PHE 78 -21.874 7.932 -30.496 330 HE1 PHE 78 HE1 PHE 78 -24.307 4.595 -33.247 331 HE2 PHE 78 HE2 PHE 78 -24.286 7.515 -30.098 332 HZ PHE 78 HZ PHE 78 -25.502 5.849 -31.477 333 H PHE 79 HN PHE 79 -19.055 9.554 -33.122 334 HA PHE 79 HA PHE 79 -21.543 11.068 -33.229 335 HB2 PHE 79 HB2 PHE 79 -20.051 11.585 -31.403 336 HB3 PHE 79 HB1 PHE 79 -18.711 11.859 -32.516 337 HD1 PHE 79 HD1 PHE 79 -22.295 12.987 -32.248 338 HD2 PHE 79 HD2 PHE 79 -18.190 14.092 -32.864 339 HE1 PHE 79 HE1 PHE 79 -22.969 15.360 -32.478 340 HE2 PHE 79 HE2 PHE 79 -18.866 16.466 -33.099 341 HZ PHE 79 HZ PHE 79 -21.256 17.101 -32.906 342 H GLN 80 HN GLN 80 -19.450 10.036 -35.509 343 HA GLN 80 HA GLN 80 -19.154 12.469 -37.044 344 HB2 GLN 80 HB2 GLN 80 -17.476 10.676 -37.185 345 HB3 GLN 80 HB1 GLN 80 -18.701 9.575 -37.816 346 HG2 GLN 80 HG2 GLN 80 -19.022 10.989 -39.774 347 HG3 GLN 80 HG1 GLN 80 -17.896 12.183 -39.132 348 HE21 GLN 80 HE21 GLN 80 -17.410 10.966 -41.660 349 HE22 GLN 80 HE22 GLN 80 -16.050 9.959 -41.524 350 H GLY 81 HN GLY 81 -20.719 13.341 -38.225 351 HA2 GLY 81 HA2 GLY 81 -22.413 13.481 -39.807 352 HA3 GLY 81 HA1 GLY 81 -22.444 11.720 -39.888 353 H LYS 82 HN LYS 82 -22.536 12.473 -36.702 354 HA LYS 82 HA LYS 82 -25.477 12.695 -36.606 355 HB2 LYS 82 HB2 LYS 82 -23.704 10.690 -35.257 356 HB3 LYS 82 HB1 LYS 82 -25.227 11.165 -34.504 357 HG2 LYS 82 HG2 LYS 82 -26.434 10.546 -36.582 358 HG3 LYS 82 HG1 LYS 82 -24.903 10.070 -37.319 359 HD2 LYS 82 HD2 LYS 82 -24.596 8.286 -35.753 360 HD3 LYS 82 HD1 LYS 82 -25.916 8.866 -34.736 361 HE2 LYS 82 HE2 LYS 82 -26.664 6.956 -36.081 362 HE3 LYS 82 HE1 LYS 82 -27.513 8.423 -36.570 363 HZ1 LYS 82 HZ1 LYS 82 -26.813 7.989 -38.616 364 HZ2 LYS 82 HZ2 LYS 82 -25.774 6.753 -38.087 365 HZ3 LYS 82 HZ3 LYS 82 -25.240 8.364 -38.104 366 H SER 83 HN SER 83 -26.352 13.773 -34.855 367 HA SER 83 HA SER 83 -24.691 15.800 -33.696 368 HB2 SER 83 HB2 SER 83 -27.567 15.027 -33.166 369 HB3 SER 83 HB1 SER 83 -26.770 16.431 -32.464 370 HG SER 83 HG SER 83 -27.296 17.391 -34.251 371 H LYS 84 HN LYS 84 -24.479 16.181 -31.380 372 HA LYS 84 HA LYS 84 -23.414 13.965 -30.011 373 HB2 LYS 84 HB2 LYS 84 -24.309 16.681 -29.022 374 HB3 LYS 84 HB1 LYS 84 -23.462 15.506 -28.016 375 HG2 LYS 84 HG2 LYS 84 -21.597 15.481 -29.667 376 HG3 LYS 84 HG1 LYS 84 -22.435 16.723 -30.596 377 HD2 LYS 84 HD2 LYS 84 -21.676 17.061 -27.685 378 HD3 LYS 84 HD1 LYS 84 -20.657 17.599 -29.020 379 HE2 LYS 84 HE2 LYS 84 -22.576 18.966 -29.867 380 HE3 LYS 84 HE1 LYS 84 -23.485 18.514 -28.424 381 HZ1 LYS 84 HZ1 LYS 84 -22.467 20.591 -27.996 382 HZ2 LYS 84 HZ2 LYS 84 -20.955 20.056 -28.558 383 HZ3 LYS 84 HZ3 LYS 84 -21.594 19.439 -27.111 384 H LEU 85 HN LEU 85 -26.580 15.546 -29.830 385 HA LEU 85 HA LEU 85 -27.562 14.130 -27.591 386 HB2 LEU 85 HB2 LEU 85 -28.957 15.415 -29.939 387 HB3 LEU 85 HB1 LEU 85 -29.816 14.731 -28.558 388 HG LEU 85 HG LEU 85 -29.519 17.108 -28.166 389 HD11 LEU 85 HD11 LEU 85 -27.427 15.651 -26.530 390 HD12 LEU 85 HD12 LEU 85 -29.161 15.454 -26.273 391 HD13 LEU 85 HD13 LEU 85 -28.408 17.031 -26.034 392 HD21 LEU 85 HD21 LEU 85 -26.532 16.773 -28.246 393 HD22 LEU 85 HD22 LEU 85 -27.488 18.245 -28.425 394 HD23 LEU 85 HD23 LEU 85 -27.417 17.073 -29.742 395 H MET 86 HN MET 86 -27.720 13.451 -31.084 396 HA MET 86 HA MET 86 -29.382 11.171 -30.900 397 HB2 MET 86 HB2 MET 86 -27.321 11.999 -32.951 398 HB3 MET 86 HB1 MET 86 -28.366 10.591 -33.147 399 HG2 MET 86 HG2 MET 86 -30.354 12.045 -32.932 400 HG3 MET 86 HG1 MET 86 -29.298 13.442 -32.740 401 HE1 MET 86 HE1 MET 86 -29.075 10.502 -36.055 402 HE2 MET 86 HE2 MET 86 -30.759 10.996 -35.912 403 HE3 MET 86 HE3 MET 86 -29.906 10.382 -34.499 404 H ARG 87 HN ARG 87 -25.849 11.511 -30.931 405 HA ARG 87 HA ARG 87 -25.309 8.717 -30.809 406 HB2 ARG 87 HB2 ARG 87 -23.026 9.347 -30.336 407 HB3 ARG 87 HB1 ARG 87 -23.664 10.439 -31.564 408 HG2 ARG 87 HG2 ARG 87 -24.107 12.138 -29.880 409 HG3 ARG 87 HG1 ARG 87 -23.574 11.050 -28.597 410 HD2 ARG 87 HD2 ARG 87 -21.330 10.956 -29.642 411 HD3 ARG 87 HD1 ARG 87 -21.878 12.073 -30.885 412 HE ARG 87 HE ARG 87 -21.724 13.817 -29.348 413 HH11 ARG 87 HH11 ARG 87 -21.527 10.740 -27.792 414 HH12 ARG 87 HH12 ARG 87 -21.073 11.390 -26.252 415 HH21 ARG 87 HH21 ARG 87 -21.125 14.684 -27.330 416 HH22 ARG 87 HH22 ARG 87 -20.846 13.621 -25.990 417 H SER 88 HN SER 88 -25.873 11.206 -28.412 418 HA SER 88 HA SER 88 -24.938 9.864 -26.127 419 HB2 SER 88 HB2 SER 88 -27.163 11.890 -26.433 420 HB3 SER 88 HB1 SER 88 -26.511 11.359 -24.886 421 HG SER 88 HG SER 88 -25.323 13.112 -25.392 422 H ARG 89 HN ARG 89 -28.041 9.752 -27.811 423 HA ARG 89 HA ARG 89 -29.463 8.258 -25.894 424 HB2 ARG 89 HB2 ARG 89 -29.736 8.417 -28.901 425 HB3 ARG 89 HB1 ARG 89 -30.894 7.597 -27.854 426 HG2 ARG 89 HG2 ARG 89 -30.103 10.508 -27.565 427 HG3 ARG 89 HG1 ARG 89 -31.551 9.954 -28.405 428 HD2 ARG 89 HD2 ARG 89 -30.916 9.287 -25.522 429 HD3 ARG 89 HD1 ARG 89 -31.950 10.623 -26.015 430 HE ARG 89 HE ARG 89 -32.972 8.375 -27.273 431 HH11 ARG 89 HH11 ARG 89 -32.303 9.436 -24.048 432 HH12 ARG 89 HH12 ARG 89 -33.591 8.525 -23.333 433 HH21 ARG 89 HH21 ARG 89 -34.661 7.174 -26.343 434 HH22 ARG 89 HH22 ARG 89 -34.925 7.244 -24.633 435 H ALA 90 HN ALA 90 -27.409 7.266 -28.615 436 HA ALA 90 HA ALA 90 -27.903 4.484 -28.402 437 HB1 ALA 90 HB1 ALA 90 -25.772 4.251 -29.672 438 HB2 ALA 90 HB2 ALA 90 -25.493 5.980 -29.457 439 HB3 ALA 90 HB3 ALA 90 -26.878 5.421 -30.394 440 H VAL 91 HN VAL 91 -25.411 6.574 -26.981 441 HA VAL 91 HA VAL 91 -24.057 4.443 -25.631 442 HB VAL 91 HB VAL 91 -22.913 6.539 -26.202 443 HG11 VAL 91 HG11 VAL 91 -24.725 7.783 -24.113 444 HG12 VAL 91 HG12 VAL 91 -24.884 8.018 -25.853 445 HG13 VAL 91 HG13 VAL 91 -23.449 8.604 -25.013 446 HG21 VAL 91 HG21 VAL 91 -21.840 5.439 -24.424 447 HG22 VAL 91 HG22 VAL 91 -23.182 5.721 -23.316 448 HG23 VAL 91 HG23 VAL 91 -22.114 7.051 -23.764 449 H ASN 92 HN ASN 92 -26.552 6.776 -24.739 450 HA ASN 92 HA ASN 92 -26.597 6.247 -21.971 451 HB2 ASN 92 HB2 ASN 92 -28.738 7.221 -23.868 452 HB3 ASN 92 HB1 ASN 92 -28.959 7.132 -22.121 453 HD21 ASN 92 HD21 ASN 92 -26.654 8.099 -21.042 454 HD22 ASN 92 HD22 ASN 92 -26.312 9.662 -21.608 455 H LYS 93 HN LYS 93 -28.313 4.761 -24.694 456 HA LYS 93 HA LYS 93 -29.978 3.061 -23.163 457 HB2 LYS 93 HB2 LYS 93 -28.924 2.852 -25.988 458 HB3 LYS 93 HB1 LYS 93 -30.094 1.722 -25.303 459 HG2 LYS 93 HG2 LYS 93 -31.665 3.536 -24.882 460 HG3 LYS 93 HG1 LYS 93 -30.485 4.726 -25.436 461 HD2 LYS 93 HD2 LYS 93 -31.978 4.331 -27.276 462 HD3 LYS 93 HD1 LYS 93 -30.467 3.507 -27.663 463 HE2 LYS 93 HE2 LYS 93 -31.398 1.376 -26.896 464 HE3 LYS 93 HE1 LYS 93 -32.893 2.180 -26.417 465 HZ1 LYS 93 HZ1 LYS 93 -33.636 2.027 -28.481 466 HZ2 LYS 93 HZ2 LYS 93 -32.248 1.146 -28.910 467 HZ3 LYS 93 HZ3 LYS 93 -32.274 2.836 -29.087 468 H ALA 94 HN ALA 94 -26.749 2.616 -24.563 469 HA ALA 94 HA ALA 94 -26.450 -0.112 -23.876 470 HB1 ALA 94 HB1 ALA 94 -24.521 2.106 -24.511 471 HB2 ALA 94 HB2 ALA 94 -24.911 0.670 -25.457 472 HB3 ALA 94 HB3 ALA 94 -23.937 0.524 -23.994 473 H VAL 95 HN VAL 95 -25.684 2.879 -22.160 474 HA VAL 95 HA VAL 95 -24.997 1.276 -19.773 475 HB VAL 95 HB VAL 95 -23.908 3.450 -19.000 476 HG11 VAL 95 HG11 VAL 95 -22.091 3.056 -21.004 477 HG12 VAL 95 HG12 VAL 95 -23.026 1.563 -21.098 478 HG13 VAL 95 HG13 VAL 95 -22.237 2.015 -19.587 479 HG21 VAL 95 HG21 VAL 95 -25.222 4.538 -21.126 480 HG22 VAL 95 HG22 VAL 95 -23.634 4.250 -21.838 481 HG23 VAL 95 HG23 VAL 95 -23.785 5.254 -20.395 482 H LYS 96 HN LYS 96 -27.686 1.703 -20.459 483 HA LYS 96 HA LYS 96 -28.884 3.942 -19.258 484 HB2 LYS 96 HB2 LYS 96 -30.065 2.367 -20.768 485 HB3 LYS 96 HB1 LYS 96 -30.020 1.147 -19.494 486 HG2 LYS 96 HG2 LYS 96 -31.308 2.615 -18.010 487 HG3 LYS 96 HG1 LYS 96 -31.322 3.875 -19.244 488 HD2 LYS 96 HD2 LYS 96 -32.540 2.358 -20.773 489 HD3 LYS 96 HD1 LYS 96 -32.543 1.113 -19.523 490 HE2 LYS 96 HE2 LYS 96 -33.822 2.598 -18.032 491 HE3 LYS 96 HE1 LYS 96 -33.805 3.859 -19.265 492 HZ1 LYS 96 HZ1 LYS 96 -35.411 1.463 -19.098 493 HZ2 LYS 96 HZ2 LYS 96 -34.747 1.755 -20.634 494 HZ3 LYS 96 HZ3 LYS 96 -35.725 2.930 -19.892 495 H GLU 97 HN GLU 97 -27.925 0.810 -17.939 496 HA GLU 97 HA GLU 97 -29.115 1.052 -15.402 497 HB2 GLU 97 HB2 GLU 97 -26.613 -0.408 -16.274 498 HB3 GLU 97 HB1 GLU 97 -27.360 -0.588 -14.687 499 HG2 GLU 97 HG2 GLU 97 -28.770 -1.104 -17.319 500 HG3 GLU 97 HG1 GLU 97 -28.081 -2.357 -16.289 501 H GLU 98 HN GLU 98 -26.034 2.220 -16.671 502 HA GLU 98 HA GLU 98 -24.852 3.003 -14.239 503 HB2 GLU 98 HB2 GLU 98 -24.567 4.091 -17.045 504 HB3 GLU 98 HB1 GLU 98 -23.562 4.613 -15.694 505 HG2 GLU 98 HG2 GLU 98 -22.769 2.334 -15.350 506 HG3 GLU 98 HG1 GLU 98 -23.845 1.740 -16.615 507 H LEU 99 HN LEU 99 -27.090 4.677 -16.413 508 HA LEU 99 HA LEU 99 -27.013 7.200 -15.139 509 HB2 LEU 99 HB2 LEU 99 -29.147 5.842 -16.793 510 HB3 LEU 99 HB1 LEU 99 -29.265 7.509 -16.230 511 HG LEU 99 HG LEU 99 -26.919 6.463 -17.831 512 HD11 LEU 99 HD11 LEU 99 -28.479 8.280 -19.346 513 HD12 LEU 99 HD12 LEU 99 -29.598 7.084 -18.693 514 HD13 LEU 99 HD13 LEU 99 -28.219 6.565 -19.664 515 HD21 LEU 99 HD21 LEU 99 -26.423 8.454 -16.522 516 HD22 LEU 99 HD22 LEU 99 -27.902 9.234 -17.084 517 HD23 LEU 99 HD23 LEU 99 -26.584 8.923 -18.215 518 H GLN 100 HN GLN 100 -29.013 4.321 -14.604 519 HA GLN 100 HA GLN 100 -30.803 5.457 -12.740 520 HB2 GLN 100 HB2 GLN 100 -29.844 2.617 -13.140 521 HB3 GLN 100 HB1 GLN 100 -31.128 3.061 -12.015 522 HG2 GLN 100 HG2 GLN 100 -32.473 3.969 -13.815 523 HG3 GLN 100 HG1 GLN 100 -31.160 3.736 -14.969 524 HE21 GLN 100 HE21 GLN 100 -33.962 2.497 -14.836 525 HE22 GLN 100 HE22 GLN 100 -33.679 0.825 -14.911 526 H GLU 101 HN GLU 101 -27.664 3.869 -12.358 527 HA GLU 101 HA GLU 101 -27.724 4.128 -9.469 528 HB2 GLU 101 HB2 GLU 101 -25.414 3.217 -9.609 529 HB3 GLU 101 HB1 GLU 101 -26.598 2.203 -10.435 530 HG2 GLU 101 HG2 GLU 101 -25.985 3.218 -12.588 531 HG3 GLU 101 HG1 GLU 101 -24.822 4.259 -11.775 532 H ILE 102 HN ILE 102 -26.629 5.951 -12.196 533 HA ILE 102 HA ILE 102 -25.357 7.892 -10.360 534 HB ILE 102 HB ILE 102 -24.591 7.192 -13.202 535 HG12 ILE 102 HG12 ILE 102 -22.941 7.054 -10.667 536 HG13 ILE 102 HG11 ILE 102 -23.858 5.679 -11.276 537 HG21 ILE 102 HG21 ILE 102 -23.854 9.465 -11.384 538 HG22 ILE 102 HG22 ILE 102 -24.195 9.487 -13.115 539 HG23 ILE 102 HG23 ILE 102 -22.664 8.839 -12.525 540 HD11 ILE 102 HD1 ILE 102 -21.311 6.742 -12.194 541 HD12 ILE 102 HD2 ILE 102 -22.479 6.639 -13.512 542 HD13 ILE 102 HD3 ILE 102 -22.076 5.199 -12.575 543 H HIS 103 HN HIS 103 -26.420 9.756 -10.247 544 HA HIS 103 HA HIS 103 -28.435 10.402 -12.254 545 HB2 HIS 103 HB2 HIS 103 -29.163 12.107 -10.731 546 HB3 HIS 103 HB1 HIS 103 -28.830 10.661 -9.775 547 HD2 HIS 103 HD2 HIS 103 -27.620 14.322 -10.038 548 HE1 HIS 103 HE1 HIS 103 -24.988 12.352 -7.392 549 HE2 HIS 103 HE2 HIS 103 -25.685 14.614 -8.309 550 H ALA 104 HN ALA 104 -25.172 11.171 -11.549 551 HA ALA 104 HA ALA 104 -25.295 13.436 -13.447 552 HB1 ALA 104 HB1 ALA 104 -24.254 13.341 -10.763 553 HB2 ALA 104 HB2 ALA 104 -24.358 14.717 -11.862 554 HB3 ALA 104 HB3 ALA 104 -22.944 13.663 -11.899 555 H PHE 105 HN PHE 105 -24.761 12.286 -15.275 556 HA PHE 105 HA PHE 105 -21.998 11.287 -15.343 557 HB2 PHE 105 HB2 PHE 105 -23.361 9.290 -15.036 558 HB3 PHE 105 HB1 PHE 105 -24.401 9.760 -16.379 559 HD1 PHE 105 HD1 PHE 105 -20.850 8.957 -15.526 560 HD2 PHE 105 HD2 PHE 105 -23.853 9.162 -18.590 561 HE1 PHE 105 HE1 PHE 105 -19.302 7.853 -17.116 562 HE2 PHE 105 HE2 PHE 105 -22.305 8.056 -20.181 563 HZ PHE 105 HZ PHE 105 -20.029 7.402 -19.445 564 H SER 106 HN SER 106 -20.930 11.757 -17.200 565 HA SER 106 HA SER 106 -22.487 12.915 -19.434 566 HB2 SER 106 HB2 SER 106 -20.662 14.564 -19.749 567 HB3 SER 106 HB1 SER 106 -21.455 14.749 -18.183 568 HG SER 106 HG SER 106 -19.233 13.048 -18.427 569 H CYS 107 HN CYS 107 -21.624 12.604 -21.500 570 HA CYS 107 HA CYS 107 -19.243 10.908 -21.750 571 HB2 CYS 107 HB2 CYS 107 -20.378 9.299 -23.158 572 HB3 CYS 107 HB1 CYS 107 -21.234 9.405 -21.619 573 HG CYS 107 HG CYS 107 -22.551 11.353 -23.415 574 H LYS 108 HN LYS 108 -18.687 13.223 -22.447 575 HA LYS 108 HA LYS 108 -19.722 14.266 -24.861 576 HB2 LYS 108 HB2 LYS 108 -17.072 14.703 -23.469 577 HB3 LYS 108 HB1 LYS 108 -17.605 15.623 -24.877 578 HG2 LYS 108 HG2 LYS 108 -19.612 16.355 -23.650 579 HG3 LYS 108 HG1 LYS 108 -19.092 15.430 -22.241 580 HD2 LYS 108 HD2 LYS 108 -17.036 16.788 -22.104 581 HD3 LYS 108 HD1 LYS 108 -17.555 17.716 -23.511 582 HE2 LYS 108 HE2 LYS 108 -19.562 18.460 -22.294 583 HE3 LYS 108 HE1 LYS 108 -19.064 17.521 -20.887 584 HZ1 LYS 108 HZ1 LYS 108 -17.622 19.814 -22.099 585 HZ2 LYS 108 HZ2 LYS 108 -16.996 18.842 -20.853 586 HZ3 LYS 108 HZ3 LYS 108 -18.389 19.777 -20.586 587 H CYS 109 HN CYS 109 -19.081 14.031 -26.975 588 HA CYS 109 HA CYS 109 -16.840 12.214 -27.553 589 HB2 CYS 109 HB2 CYS 109 -18.931 10.889 -27.610 590 HB3 CYS 109 HB1 CYS 109 -19.578 11.996 -28.820 591 HG CYS 109 HG CYS 109 -17.111 11.164 -30.054 592 H TYR 110 HN TYR 110 -15.536 12.997 -29.077 593 HA TYR 110 HA TYR 110 -16.622 14.985 -30.974 594 HB2 TYR 110 HB2 TYR 110 -13.950 15.068 -29.554 595 HB3 TYR 110 HB1 TYR 110 -14.440 16.164 -30.847 596 HD1 TYR 110 HD1 TYR 110 -14.871 15.261 -27.322 597 HD2 TYR 110 HD2 TYR 110 -16.295 17.764 -30.509 598 HE1 TYR 110 HE1 TYR 110 -16.047 16.692 -25.672 599 HE2 TYR 110 HE2 TYR 110 -17.471 19.195 -28.861 600 HH TYR 110 HH TYR 110 -18.233 18.335 -25.896 601 H THR 111 HN THR 111 -15.855 14.896 -33.065 602 HA THR 111 HA THR 111 -13.770 12.956 -33.734 603 HB THR 111 HB THR 111 -15.779 11.591 -33.805 604 HG1 THR 111 HG1 THR 111 -15.512 12.133 -36.496 605 HG21 THR 111 HG21 THR 111 -17.034 13.180 -35.968 606 HG22 THR 111 HG22 THR 111 -17.114 13.887 -34.355 607 HG23 THR 111 HG23 THR 111 -17.784 12.282 -34.648 608 H GLU 112 HN GLU 112 -13.026 15.345 -34.030 609 HA GLU 112 HA GLU 112 -12.317 16.971 -35.483 610 HB2 GLU 112 HB2 GLU 112 -13.273 14.988 -37.562 611 HB3 GLU 112 HB1 GLU 112 -12.236 16.380 -37.874 612 HG2 GLU 112 HG2 GLU 112 -11.555 14.127 -35.963 613 HG3 GLU 112 HG1 GLU 112 -10.949 14.254 -37.614 614 H GLU 113 HN GLU 113 -15.446 16.217 -34.980 615 HA GLU 113 HA GLU 113 -16.809 17.669 -37.005 616 HB2 GLU 113 HB2 GLU 113 -17.607 16.979 -34.171 617 HB3 GLU 113 HB1 GLU 113 -18.685 17.691 -35.374 618 HG2 GLU 113 HG2 GLU 113 -17.180 15.102 -35.820 619 HG3 GLU 113 HG1 GLU 113 -18.829 15.167 -35.203 620 H GLU 114 HN GLU 114 -15.493 18.554 -33.846 621 HA GLU 114 HA GLU 114 -16.567 21.155 -33.690 622 HB2 GLU 114 HB2 GLU 114 -14.885 21.566 -32.002 623 HB3 GLU 114 HB1 GLU 114 -15.456 19.908 -31.811 624 HG2 GLU 114 HG2 GLU 114 -13.516 19.103 -33.127 625 HG3 GLU 114 HG1 GLU 114 -12.932 20.762 -33.256 626 H TRP 115 HN TRP 115 -14.090 19.809 -35.645 627 HA TRP 115 HA TRP 115 -13.051 22.481 -36.324 628 HB2 TRP 115 HB2 TRP 115 -11.045 21.473 -36.447 629 HB3 TRP 115 HB1 TRP 115 -11.797 19.943 -35.987 630 HD1 TRP 115 HD1 TRP 115 -12.467 18.258 -37.921 631 HE1 TRP 115 HE1 TRP 115 -11.752 18.076 -40.390 632 HE3 TRP 115 HE3 TRP 115 -10.328 22.850 -38.557 633 HZ2 TRP 115 HZ2 TRP 115 -10.439 19.666 -42.371 634 HZ3 TRP 115 HZ3 TRP 115 -9.356 23.492 -40.744 635 HH2 TRP 115 HH2 TRP 115 -9.409 21.907 -42.650 636 H SER 116 HN SER 116 -15.491 20.574 -37.254 637 HA SER 116 HA SER 116 -15.297 20.116 -39.965 638 HB2 SER 116 HB2 SER 116 -17.698 20.158 -40.035 639 HB3 SER 116 HB1 SER 116 -17.215 19.480 -38.483 640 HG SER 116 HG SER 116 -17.328 22.118 -38.239 641 H LYS 117 HN LYS 117 -17.288 21.601 -41.232 642 HA LYS 117 HA LYS 117 -15.846 23.784 -42.242 643 HB2 LYS 117 HB2 LYS 117 -17.873 24.382 -43.415 644 HB3 LYS 117 HB1 LYS 117 -17.717 22.624 -43.425 645 HG2 LYS 117 HG2 LYS 117 -19.263 22.492 -41.497 646 HG3 LYS 117 HG1 LYS 117 -19.427 24.249 -41.517 647 HD2 LYS 117 HD2 LYS 117 -20.243 24.068 -43.897 648 HD3 LYS 117 HD1 LYS 117 -20.255 22.315 -43.699 649 HE2 LYS 117 HE2 LYS 117 -21.792 24.276 -41.972 650 HE3 LYS 117 HE1 LYS 117 -22.489 23.297 -43.263 651 HZ1 LYS 117 HZ1 LYS 117 -22.755 21.695 -41.776 652 HZ2 LYS 117 HZ2 LYS 117 -21.912 22.571 -40.588 653 HZ3 LYS 117 HZ3 LYS 117 -21.068 21.557 -41.658 654 H ILE 118 HN ILE 118 -17.746 23.487 -39.403 655 HA ILE 118 HA ILE 118 -18.660 26.142 -39.094 656 HB ILE 118 HB ILE 118 -17.908 24.104 -36.983 657 HG12 ILE 118 HG12 ILE 118 -20.631 24.808 -38.117 658 HG13 ILE 118 HG11 ILE 118 -19.669 23.443 -38.688 659 HG21 ILE 118 HG21 ILE 118 -19.785 25.568 -35.811 660 HG22 ILE 118 HG22 ILE 118 -19.206 26.799 -36.933 661 HG23 ILE 118 HG23 ILE 118 -18.096 26.073 -35.770 662 HD11 ILE 118 HD1 ILE 118 -20.857 23.869 -35.945 663 HD12 ILE 118 HD2 ILE 118 -19.557 22.710 -36.224 664 HD13 ILE 118 HD3 ILE 118 -21.106 22.513 -37.044 665 H VAL 119 HN VAL 119 -17.664 27.973 -38.454 666 HA VAL 119 HA VAL 119 -14.771 27.921 -38.143 667 HB VAL 119 HB VAL 119 -16.738 30.222 -38.192 668 HG11 VAL 119 HG11 VAL 119 -13.828 30.031 -37.706 669 HG12 VAL 119 HG12 VAL 119 -14.964 31.306 -37.263 670 HG13 VAL 119 HG13 VAL 119 -14.307 31.238 -38.899 671 HG21 VAL 119 HG21 VAL 119 -16.527 28.856 -40.301 672 HG22 VAL 119 HG22 VAL 119 -14.809 29.252 -40.321 673 HG23 VAL 119 HG23 VAL 119 -16.010 30.533 -40.483 674 H VAL 120 HN VAL 120 -13.788 27.824 -36.246 675 HA VAL 120 HA VAL 120 -15.327 28.342 -33.800 676 HB VAL 120 HB VAL 120 -12.747 26.880 -34.354 677 HG11 VAL 120 HG11 VAL 120 -12.178 27.907 -32.335 678 HG12 VAL 120 HG12 VAL 120 -12.988 26.447 -31.767 679 HG13 VAL 120 HG13 VAL 120 -13.853 27.983 -31.787 680 HG21 VAL 120 HG21 VAL 120 -14.496 25.382 -34.665 681 HG22 VAL 120 HG22 VAL 120 -15.547 26.211 -33.516 682 HG23 VAL 120 HG23 VAL 120 -14.229 25.195 -32.931 683 H LEU 121 HN LEU 121 -12.614 29.526 -35.653 684 HA LEU 121 HA LEU 121 -11.351 31.094 -33.688 685 HB2 LEU 121 HB2 LEU 121 -10.322 30.630 -35.861 686 HB3 LEU 121 HB1 LEU 121 -11.575 31.572 -36.670 687 HG LEU 121 HG LEU 121 -10.873 33.578 -35.399 688 HD11 LEU 121 HD11 LEU 121 -8.660 31.766 -34.387 689 HD12 LEU 121 HD12 LEU 121 -9.992 32.394 -33.416 690 HD13 LEU 121 HD13 LEU 121 -8.790 33.498 -34.085 691 HD21 LEU 121 HD21 LEU 121 -9.192 32.106 -37.311 692 HD22 LEU 121 HD22 LEU 121 -8.303 33.306 -36.373 693 HD23 LEU 121 HD23 LEU 121 -9.700 33.794 -37.330 694 H GLU 122 HN GLU 122 -13.971 31.873 -35.963 695 HA GLU 122 HA GLU 122 -15.410 33.666 -36.068 696 HB2 GLU 122 HB2 GLU 122 -15.074 33.474 -33.065 697 HB3 GLU 122 HB1 GLU 122 -16.360 34.353 -33.892 698 HG2 GLU 122 HG2 GLU 122 -15.826 31.389 -34.236 699 HG3 GLU 122 HG1 GLU 122 -17.052 32.060 -33.160 700 H HIS 123 HN HIS 123 -13.034 34.558 -36.780 701 HA HIS 123 HA HIS 123 -11.899 36.543 -37.070 702 HB2 HIS 123 HB2 HIS 123 -13.863 37.552 -34.996 703 HB3 HIS 123 HB1 HIS 123 -12.705 38.569 -35.851 704 HD2 HIS 123 HD2 HIS 123 -13.563 36.403 -38.626 705 HE1 HIS 123 HE1 HIS 123 -16.867 39.028 -38.516 706 HE2 HIS 123 HE2 HIS 123 -15.635 37.313 -39.927 707 H HIS 124 HN HIS 124 -10.746 38.306 -35.500 708 HA HIS 124 HA HIS 124 -8.985 38.570 -34.048 709 HB2 HIS 124 HB2 HIS 124 -10.963 38.346 -32.467 710 HB3 HIS 124 HB1 HIS 124 -10.485 36.662 -32.250 711 HD2 HIS 124 HD2 HIS 124 -7.371 38.845 -32.601 712 HE1 HIS 124 HE1 HIS 124 -8.043 38.452 -28.451 713 HE2 HIS 124 HE2 HIS 124 -6.379 39.211 -30.213 714 H HIS 125 HN HIS 125 -7.804 37.240 -35.724 715 HA HIS 125 HA HIS 125 -7.280 34.481 -35.255 716 HB2 HIS 125 HB2 HIS 125 -5.819 36.601 -36.837 717 HB3 HIS 125 HB1 HIS 125 -5.316 34.911 -36.798 718 HD2 HIS 125 HD2 HIS 125 -6.789 33.233 -38.469 719 HE1 HIS 125 HE1 HIS 125 -9.767 36.023 -39.554 720 HE2 HIS 125 HE2 HIS 125 -8.858 33.692 -39.995 721 H HIS 126 HN HIS 126 -5.690 33.480 -34.115 722 HA HIS 126 HA HIS 126 -4.083 35.190 -32.328 723 HB2 HIS 126 HB2 HIS 126 -4.909 32.286 -32.106 724 HB3 HIS 126 HB1 HIS 126 -3.832 33.103 -30.972 725 HD2 HIS 126 HD2 HIS 126 -5.121 34.794 -29.132 726 HE1 HIS 126 HE1 HIS 126 -9.033 34.286 -30.638 727 HE2 HIS 126 HE2 HIS 126 -7.659 35.276 -28.745 728 H HIS 127 HN HIS 127 -3.689 33.911 -35.225 729 HA HIS 127 HA HIS 127 -0.884 33.129 -34.708 730 HB2 HIS 127 HB2 HIS 127 -2.767 31.979 -36.782 731 HB3 HIS 127 HB1 HIS 127 -1.054 31.588 -36.636 732 HD2 HIS 127 HD2 HIS 127 -4.394 30.401 -35.186 733 HE1 HIS 127 HE1 HIS 127 -1.401 28.889 -32.620 734 HE2 HIS 127 HE2 HIS 127 -3.865 28.765 -33.220 735 H HIS 128 HN HIS 128 0.652 33.968 -36.059 736 HA HIS 128 HA HIS 128 1.595 35.540 -37.447 737 HB2 HIS 128 HB2 HIS 128 -0.777 34.668 -39.106 738 HB3 HIS 128 HB1 HIS 128 0.507 35.713 -39.713 739 HD2 HIS 128 HD2 HIS 128 2.908 34.388 -40.339 740 HE1 HIS 128 HE1 HIS 128 1.692 30.537 -39.107 741 HE2 HIS 128 HE2 HIS 128 3.520 31.850 -40.283 Start of MODEL 14 1 H1 MET 36 HT1 MET 36 -17.434 3.224 -2.422 2 H2 MET 36 HT2 MET 36 -18.824 2.257 -2.559 3 H3 MET 36 HT3 MET 36 -18.931 3.937 -2.774 4 HA MET 36 HA MET 36 -17.403 3.706 -4.718 5 HB2 MET 36 HB2 MET 36 -18.195 0.798 -4.601 6 HB3 MET 36 HB1 MET 36 -16.949 1.560 -5.591 7 HG2 MET 36 HG2 MET 36 -15.598 2.012 -3.609 8 HG3 MET 36 HG1 MET 36 -16.862 1.362 -2.567 9 HE1 MET 36 HE1 MET 36 -13.997 -0.806 -5.366 10 HE2 MET 36 HE2 MET 36 -14.270 0.921 -5.156 11 HE3 MET 36 HE3 MET 36 -15.406 -0.034 -6.106 12 HA PRO 37 HA PRO 37 -21.874 4.069 -5.718 13 HB2 PRO 37 HB2 PRO 37 -21.519 6.305 -7.282 14 HB3 PRO 37 HB1 PRO 37 -21.777 6.353 -5.526 15 HG2 PRO 37 HG2 PRO 37 -19.251 6.594 -7.077 16 HG3 PRO 37 HG1 PRO 37 -19.763 7.444 -5.611 17 HD2 PRO 37 HD2 PRO 37 -17.996 5.366 -5.564 18 HD3 PRO 37 HD1 PRO 37 -19.096 5.727 -4.214 19 H VAL 38 HN VAL 38 -19.801 5.362 -8.304 20 HA VAL 38 HA VAL 38 -20.853 3.246 -10.089 21 HB VAL 38 HB VAL 38 -20.933 4.760 -11.829 22 HG11 VAL 38 HG11 VAL 38 -21.302 6.347 -9.286 23 HG12 VAL 38 HG12 VAL 38 -22.544 5.554 -10.256 24 HG13 VAL 38 HG13 VAL 38 -21.718 6.985 -10.876 25 HG21 VAL 38 HG21 VAL 38 -19.605 6.995 -11.643 26 HG22 VAL 38 HG22 VAL 38 -18.712 5.521 -12.021 27 HG23 VAL 38 HG23 VAL 38 -18.696 6.167 -10.377 28 H THR 39 HN THR 39 -18.156 4.211 -8.428 29 HA THR 39 HA THR 39 -15.914 3.728 -8.563 30 HB THR 39 HB THR 39 -16.142 1.573 -10.518 31 HG1 THR 39 HG1 THR 39 -17.895 0.696 -9.814 32 HG21 THR 39 HG21 THR 39 -15.006 0.350 -8.819 33 HG22 THR 39 HG22 THR 39 -15.580 1.435 -7.553 34 HG23 THR 39 HG23 THR 39 -14.376 1.994 -8.715 35 H GLU 40 HN GLU 40 -15.056 5.485 -9.614 36 HA GLU 40 HA GLU 40 -15.367 6.067 -12.350 37 HB2 GLU 40 HB2 GLU 40 -14.603 7.719 -10.714 38 HB3 GLU 40 HB1 GLU 40 -13.109 6.814 -10.475 39 HG2 GLU 40 HG2 GLU 40 -12.544 7.132 -12.866 40 HG3 GLU 40 HG1 GLU 40 -14.028 8.057 -13.085 41 H GLN 41 HN GLN 41 -12.777 4.322 -10.623 42 HA GLN 41 HA GLN 41 -11.205 3.817 -12.940 43 HB2 GLN 41 HB2 GLN 41 -10.305 3.655 -10.656 44 HB3 GLN 41 HB1 GLN 41 -11.358 2.276 -10.337 45 HG2 GLN 41 HG2 GLN 41 -10.263 0.988 -12.097 46 HG3 GLN 41 HG1 GLN 41 -9.268 2.377 -12.527 47 HE21 GLN 41 HE21 GLN 41 -8.060 -0.073 -11.721 48 HE22 GLN 41 HE22 GLN 41 -7.312 0.163 -10.216 49 H GLY 42 HN GLY 42 -13.675 1.972 -11.237 50 HA2 GLY 42 HA2 GLY 42 -13.614 -0.364 -12.855 51 HA3 GLY 42 HA1 GLY 42 -14.915 0.116 -11.767 52 H LEU 43 HN LEU 43 -15.258 2.697 -13.073 53 HA LEU 43 HA LEU 43 -17.322 2.063 -14.846 54 HB2 LEU 43 HB2 LEU 43 -17.209 4.192 -13.646 55 HB3 LEU 43 HB1 LEU 43 -15.779 4.651 -14.576 56 HG LEU 43 HG LEU 43 -17.075 4.528 -16.651 57 HD11 LEU 43 HD11 LEU 43 -19.523 4.154 -16.532 58 HD12 LEU 43 HD12 LEU 43 -19.369 3.821 -14.806 59 HD13 LEU 43 HD13 LEU 43 -18.612 2.744 -15.983 60 HD21 LEU 43 HD21 LEU 43 -18.310 6.181 -14.434 61 HD22 LEU 43 HD22 LEU 43 -18.724 6.387 -16.137 62 HD23 LEU 43 HD23 LEU 43 -17.075 6.691 -15.587 63 H ARG 44 HN ARG 44 -13.957 2.913 -15.476 64 HA ARG 44 HA ARG 44 -14.135 3.200 -18.255 65 HB2 ARG 44 HB2 ARG 44 -12.145 3.781 -16.903 66 HB3 ARG 44 HB1 ARG 44 -11.855 2.065 -16.621 67 HG2 ARG 44 HG2 ARG 44 -11.616 1.694 -19.043 68 HG3 ARG 44 HG1 ARG 44 -11.920 3.407 -19.339 69 HD2 ARG 44 HD2 ARG 44 -9.919 4.001 -18.038 70 HD3 ARG 44 HD1 ARG 44 -9.623 2.299 -17.696 71 HE ARG 44 HE ARG 44 -8.851 2.030 -19.892 72 HH11 ARG 44 HH11 ARG 44 -10.313 5.121 -19.380 73 HH12 ARG 44 HH12 ARG 44 -9.757 5.789 -20.877 74 HH21 ARG 44 HH21 ARG 44 -8.116 2.898 -21.864 75 HH22 ARG 44 HH22 ARG 44 -8.513 4.531 -22.283 76 H GLU 45 HN GLU 45 -13.576 0.325 -16.242 77 HA GLU 45 HA GLU 45 -13.261 -1.504 -18.381 78 HB2 GLU 45 HB2 GLU 45 -14.105 -1.941 -15.509 79 HB3 GLU 45 HB1 GLU 45 -13.744 -3.240 -16.647 80 HG2 GLU 45 HG2 GLU 45 -11.801 -1.018 -15.959 81 HG3 GLU 45 HG1 GLU 45 -11.800 -2.600 -15.178 82 H ARG 46 HN ARG 46 -16.051 -0.423 -16.517 83 HA ARG 46 HA ARG 46 -17.927 -2.257 -17.572 84 HB2 ARG 46 HB2 ARG 46 -18.323 -0.948 -15.516 85 HB3 ARG 46 HB1 ARG 46 -18.391 0.528 -16.478 86 HG2 ARG 46 HG2 ARG 46 -20.332 -0.301 -17.698 87 HG3 ARG 46 HG1 ARG 46 -20.225 -1.856 -16.867 88 HD2 ARG 46 HD2 ARG 46 -20.655 0.793 -15.455 89 HD3 ARG 46 HD1 ARG 46 -21.956 -0.307 -15.901 90 HE ARG 46 HE ARG 46 -20.095 -1.792 -14.438 91 HH11 ARG 46 HH11 ARG 46 -22.198 0.926 -14.034 92 HH12 ARG 46 HH12 ARG 46 -22.457 0.650 -12.344 93 HH21 ARG 46 HH21 ARG 46 -20.433 -2.162 -12.222 94 HH22 ARG 46 HH22 ARG 46 -21.458 -1.098 -11.318 95 H ILE 47 HN ILE 47 -16.938 0.994 -18.501 96 HA ILE 47 HA ILE 47 -18.799 1.341 -20.583 97 HB ILE 47 HB ILE 47 -16.069 2.546 -20.139 98 HG12 ILE 47 HG12 ILE 47 -17.844 3.014 -18.458 99 HG13 ILE 47 HG11 ILE 47 -17.350 4.457 -19.352 100 HG21 ILE 47 HG21 ILE 47 -16.505 2.808 -22.465 101 HG22 ILE 47 HG22 ILE 47 -17.045 4.315 -21.723 102 HG23 ILE 47 HG23 ILE 47 -18.224 3.086 -22.184 103 HD11 ILE 47 HD1 ILE 47 -19.315 3.842 -20.953 104 HD12 ILE 47 HD2 ILE 47 -19.703 4.588 -19.402 105 HD13 ILE 47 HD3 ILE 47 -19.889 2.846 -19.616 106 H GLU 48 HN GLU 48 -15.514 0.069 -20.503 107 HA GLU 48 HA GLU 48 -15.163 -0.318 -23.271 108 HB2 GLU 48 HB2 GLU 48 -13.322 -0.439 -21.662 109 HB3 GLU 48 HB1 GLU 48 -14.024 -1.886 -20.930 110 HG2 GLU 48 HG2 GLU 48 -13.426 -1.776 -23.889 111 HG3 GLU 48 HG1 GLU 48 -12.154 -2.171 -22.732 112 H SER 49 HN SER 49 -16.554 -2.362 -20.740 113 HA SER 49 HA SER 49 -17.105 -4.524 -22.573 114 HB2 SER 49 HB2 SER 49 -18.013 -4.014 -19.734 115 HB3 SER 49 HB1 SER 49 -18.359 -5.480 -20.647 116 HG SER 49 HG SER 49 -16.357 -6.105 -20.392 117 H ALA 50 HN ALA 50 -18.637 -1.554 -21.671 118 HA ALA 50 HA ALA 50 -21.274 -2.537 -22.541 119 HB1 ALA 50 HB1 ALA 50 -22.009 -1.053 -21.043 120 HB2 ALA 50 HB2 ALA 50 -21.331 0.248 -22.022 121 HB3 ALA 50 HB3 ALA 50 -20.361 -0.497 -20.754 122 H ILE 51 HN ILE 51 -18.540 -1.298 -23.926 123 HA ILE 51 HA ILE 51 -19.962 -0.617 -26.371 124 HB ILE 51 HB ILE 51 -19.834 1.520 -25.087 125 HG12 ILE 51 HG12 ILE 51 -17.969 1.523 -27.482 126 HG13 ILE 51 HG11 ILE 51 -19.727 1.402 -27.616 127 HG21 ILE 51 HG21 ILE 51 -17.961 2.032 -23.957 128 HG22 ILE 51 HG22 ILE 51 -17.055 2.077 -25.469 129 HG23 ILE 51 HG23 ILE 51 -17.193 0.567 -24.567 130 HD11 ILE 51 HD1 ILE 51 -18.202 3.665 -26.303 131 HD12 ILE 51 HD2 ILE 51 -19.959 3.531 -26.372 132 HD13 ILE 51 HD3 ILE 51 -19.031 3.739 -27.859 133 HA PRO 52 HA PRO 52 -16.448 -2.780 -27.965 134 HB2 PRO 52 HB2 PRO 52 -16.612 -1.823 -30.557 135 HB3 PRO 52 HB1 PRO 52 -17.600 -3.153 -29.916 136 HG2 PRO 52 HG2 PRO 52 -18.292 -0.271 -30.255 137 HG3 PRO 52 HG1 PRO 52 -19.277 -1.714 -30.562 138 HD2 PRO 52 HD2 PRO 52 -19.631 -0.250 -28.330 139 HD3 PRO 52 HD1 PRO 52 -19.789 -2.019 -28.302 140 H GLN 53 HN GLN 53 -14.295 -2.371 -28.327 141 HA GLN 53 HA GLN 53 -13.016 -0.169 -27.454 142 HB2 GLN 53 HB2 GLN 53 -11.193 -0.764 -29.186 143 HB3 GLN 53 HB1 GLN 53 -11.664 -1.999 -28.012 144 HG2 GLN 53 HG2 GLN 53 -13.216 -2.974 -29.678 145 HG3 GLN 53 HG1 GLN 53 -12.721 -1.756 -30.850 146 HE21 GLN 53 HE21 GLN 53 -11.580 -3.043 -32.362 147 HE22 GLN 53 HE22 GLN 53 -10.241 -4.004 -31.957 148 H VAL 54 HN VAL 54 -14.162 1.696 -27.936 149 HA VAL 54 HA VAL 54 -14.620 2.580 -30.622 150 HB VAL 54 HB VAL 54 -15.421 4.611 -29.629 151 HG11 VAL 54 HG11 VAL 54 -16.879 2.669 -29.325 152 HG12 VAL 54 HG12 VAL 54 -16.976 3.713 -27.908 153 HG13 VAL 54 HG13 VAL 54 -16.022 2.232 -27.846 154 HG21 VAL 54 HG21 VAL 54 -13.568 3.802 -27.458 155 HG22 VAL 54 HG22 VAL 54 -15.083 4.536 -26.931 156 HG23 VAL 54 HG23 VAL 54 -14.009 5.416 -28.019 157 H TYR 55 HN TYR 55 -13.837 5.127 -30.802 158 HA TYR 55 HA TYR 55 -11.153 4.954 -31.609 159 HB2 TYR 55 HB2 TYR 55 -12.657 6.619 -32.546 160 HB3 TYR 55 HB1 TYR 55 -12.828 7.391 -30.969 161 HD1 TYR 55 HD1 TYR 55 -10.319 6.507 -33.589 162 HD2 TYR 55 HD2 TYR 55 -11.274 9.011 -30.231 163 HE1 TYR 55 HE1 TYR 55 -8.298 7.876 -34.034 164 HE2 TYR 55 HE2 TYR 55 -9.255 10.378 -30.676 165 HH TYR 55 HH TYR 55 -7.643 10.418 -33.475 166 H HIS 56 HN HIS 56 -12.567 6.513 -28.717 167 HA HIS 56 HA HIS 56 -10.473 5.770 -27.002 168 HB2 HIS 56 HB2 HIS 56 -9.221 7.365 -28.523 169 HB3 HIS 56 HB1 HIS 56 -10.239 8.655 -27.872 170 HD2 HIS 56 HD2 HIS 56 -7.179 6.494 -26.801 171 HE1 HIS 56 HE1 HIS 56 -8.202 8.940 -23.516 172 HE2 HIS 56 HE2 HIS 56 -6.465 7.332 -24.433 173 H ILE 57 HN ILE 57 -11.095 6.111 -24.917 174 HA ILE 57 HA ILE 57 -13.137 8.179 -24.418 175 HB ILE 57 HB ILE 57 -14.400 6.643 -23.005 176 HG12 ILE 57 HG12 ILE 57 -12.449 4.519 -23.955 177 HG13 ILE 57 HG11 ILE 57 -12.430 5.239 -22.344 178 HG21 ILE 57 HG21 ILE 57 -14.023 5.041 -25.493 179 HG22 ILE 57 HG22 ILE 57 -14.490 6.731 -25.681 180 HG23 ILE 57 HG23 ILE 57 -15.510 5.631 -24.753 181 HD11 ILE 57 HD1 ILE 57 -15.091 4.476 -22.729 182 HD12 ILE 57 HD2 ILE 57 -13.900 3.650 -21.724 183 HD13 ILE 57 HD3 ILE 57 -14.149 3.142 -23.394 184 H ILE 58 HN ILE 58 -12.971 9.216 -22.450 185 HA ILE 58 HA ILE 58 -10.829 8.293 -20.639 186 HB ILE 58 HB ILE 58 -10.138 10.631 -20.312 187 HG12 ILE 58 HG12 ILE 58 -12.017 11.259 -22.608 188 HG13 ILE 58 HG11 ILE 58 -12.398 11.582 -20.915 189 HG21 ILE 58 HG21 ILE 58 -8.662 10.251 -21.965 190 HG22 ILE 58 HG22 ILE 58 -9.869 10.706 -23.168 191 HG23 ILE 58 HG23 ILE 58 -9.747 9.031 -22.633 192 HD11 ILE 58 HD1 ILE 58 -9.859 12.663 -21.213 193 HD12 ILE 58 HD2 ILE 58 -11.370 13.574 -21.214 194 HD13 ILE 58 HD3 ILE 58 -10.649 13.058 -22.740 195 H VAL 59 HN VAL 59 -11.146 8.707 -18.445 196 HA VAL 59 HA VAL 59 -13.851 9.692 -17.748 197 HB VAL 59 HB VAL 59 -12.170 7.603 -16.341 198 HG11 VAL 59 HG11 VAL 59 -14.859 8.845 -15.714 199 HG12 VAL 59 HG12 VAL 59 -13.426 8.799 -14.686 200 HG13 VAL 59 HG13 VAL 59 -14.323 7.317 -15.014 201 HG21 VAL 59 HG21 VAL 59 -14.736 6.660 -17.113 202 HG22 VAL 59 HG22 VAL 59 -13.170 6.151 -17.743 203 HG23 VAL 59 HG23 VAL 59 -14.046 7.469 -18.520 204 H THR 60 HN THR 60 -13.865 11.511 -16.614 205 HA THR 60 HA THR 60 -11.544 12.143 -14.897 206 HB THR 60 HB THR 60 -13.103 14.076 -16.631 207 HG1 THR 60 HG1 THR 60 -11.069 14.258 -17.666 208 HG21 THR 60 HG21 THR 60 -11.470 14.423 -14.258 209 HG22 THR 60 HG22 THR 60 -12.404 15.624 -15.151 210 HG23 THR 60 HG23 THR 60 -10.752 15.248 -15.643 211 H ASP 61 HN ASP 61 -12.035 12.672 -12.853 212 HA ASP 61 HA ASP 61 -14.866 12.829 -12.120 213 HB2 ASP 61 HB2 ASP 61 -14.048 12.598 -9.809 214 HB3 ASP 61 HB1 ASP 61 -13.432 11.306 -10.841 215 H LEU 62 HN LEU 62 -15.730 14.801 -12.251 216 HA LEU 62 HA LEU 62 -14.158 17.198 -11.868 217 HB2 LEU 62 HB2 LEU 62 -15.965 18.338 -12.733 218 HB3 LEU 62 HB1 LEU 62 -16.250 16.744 -13.429 219 HG LEU 62 HG LEU 62 -17.609 16.295 -11.251 220 HD11 LEU 62 HD11 LEU 62 -17.707 18.005 -9.792 221 HD12 LEU 62 HD12 LEU 62 -18.570 18.947 -11.009 222 HD13 LEU 62 HD13 LEU 62 -16.812 19.044 -10.901 223 HD21 LEU 62 HD21 LEU 62 -18.750 16.367 -13.342 224 HD22 LEU 62 HD22 LEU 62 -18.465 18.098 -13.523 225 HD23 LEU 62 HD23 LEU 62 -19.607 17.514 -12.312 226 H SER 63 HN SER 63 -16.630 15.412 -10.086 227 HA SER 63 HA SER 63 -16.909 17.343 -7.996 228 HB2 SER 63 HB2 SER 63 -18.208 15.652 -6.870 229 HB3 SER 63 HB1 SER 63 -18.613 15.599 -8.584 230 HG SER 63 HG SER 63 -16.479 14.036 -8.022 231 H TYR 64 HN TYR 64 -16.317 16.954 -5.739 232 HA TYR 64 HA TYR 64 -13.559 16.526 -5.406 233 HB2 TYR 64 HB2 TYR 64 -14.828 17.883 -3.839 234 HB3 TYR 64 HB1 TYR 64 -15.794 16.484 -3.365 235 HD1 TYR 64 HD1 TYR 64 -12.312 17.828 -3.423 236 HD2 TYR 64 HD2 TYR 64 -15.025 14.966 -1.722 237 HE1 TYR 64 HE1 TYR 64 -10.600 17.205 -1.739 238 HE2 TYR 64 HE2 TYR 64 -13.315 14.343 -0.039 239 HH TYR 64 HH TYR 64 -10.379 14.660 -0.200 240 H GLY 65 HN GLY 65 -16.332 14.442 -4.608 241 HA2 GLY 65 HA2 GLY 65 -14.468 12.141 -4.544 242 HA3 GLY 65 HA1 GLY 65 -15.781 12.312 -3.379 243 H CYS 66 HN CYS 66 -15.575 10.044 -4.955 244 HA CYS 66 HA CYS 66 -17.125 10.179 -7.345 245 HB2 CYS 66 HB2 CYS 66 -17.079 7.789 -7.308 246 HB3 CYS 66 HB1 CYS 66 -15.517 8.330 -6.684 247 HG CYS 66 HG CYS 66 -16.039 7.090 -4.614 248 H GLY 67 HN GLY 67 -19.263 9.228 -7.649 249 HA2 GLY 67 HA2 GLY 67 -21.430 8.634 -6.965 250 HA3 GLY 67 HA1 GLY 67 -20.971 8.970 -5.297 251 H GLN 68 HN GLN 68 -19.843 11.545 -6.936 252 HA GLN 68 HA GLN 68 -22.271 13.114 -6.363 253 HB2 GLN 68 HB2 GLN 68 -19.397 13.992 -6.737 254 HB3 GLN 68 HB1 GLN 68 -20.748 15.057 -6.348 255 HG2 GLN 68 HG2 GLN 68 -19.813 12.723 -4.653 256 HG3 GLN 68 HG1 GLN 68 -19.487 14.423 -4.316 257 HE21 GLN 68 HE21 GLN 68 -21.478 11.998 -3.323 258 HE22 GLN 68 HE22 GLN 68 -22.854 12.900 -2.906 259 H SER 69 HN SER 69 -19.567 13.313 -8.692 260 HA SER 69 HA SER 69 -21.462 13.452 -10.907 261 HB2 SER 69 HB2 SER 69 -21.286 15.792 -10.202 262 HB3 SER 69 HB1 SER 69 -19.531 15.700 -10.297 263 HG SER 69 HG SER 69 -21.307 16.174 -12.242 264 H PHE 70 HN PHE 70 -20.624 12.643 -12.775 265 HA PHE 70 HA PHE 70 -17.737 11.994 -12.753 266 HB2 PHE 70 HB2 PHE 70 -20.044 10.430 -13.934 267 HB3 PHE 70 HB1 PHE 70 -18.338 10.023 -14.148 268 HD1 PHE 70 HD1 PHE 70 -21.155 10.118 -11.796 269 HD2 PHE 70 HD2 PHE 70 -16.970 9.261 -12.247 270 HE1 PHE 70 HE1 PHE 70 -21.163 8.933 -9.618 271 HE2 PHE 70 HE2 PHE 70 -16.977 8.076 -10.069 272 HZ PHE 70 HZ PHE 70 -19.074 7.912 -8.754 273 H ASP 71 HN ASP 71 -16.733 13.352 -14.110 274 HA ASP 71 HA ASP 71 -18.104 14.183 -16.582 275 HB2 ASP 71 HB2 ASP 71 -17.173 15.968 -15.158 276 HB3 ASP 71 HB1 ASP 71 -15.572 15.248 -15.313 277 H ILE 72 HN ILE 72 -17.777 12.729 -18.179 278 HA ILE 72 HA ILE 72 -14.987 11.889 -18.708 279 HB ILE 72 HB ILE 72 -15.844 9.717 -19.471 280 HG12 ILE 72 HG12 ILE 72 -18.528 10.666 -18.432 281 HG13 ILE 72 HG11 ILE 72 -18.095 10.642 -20.146 282 HG21 ILE 72 HG21 ILE 72 -17.210 9.772 -16.883 283 HG22 ILE 72 HG22 ILE 72 -15.646 10.586 -16.836 284 HG23 ILE 72 HG23 ILE 72 -15.749 8.904 -17.358 285 HD11 ILE 72 HD1 ILE 72 -18.958 8.454 -18.444 286 HD12 ILE 72 HD2 ILE 72 -17.398 8.099 -19.187 287 HD13 ILE 72 HD3 ILE 72 -18.786 8.499 -20.199 288 H VAL 73 HN VAL 73 -14.478 11.468 -20.888 289 HA VAL 73 HA VAL 73 -16.293 12.790 -22.809 290 HB VAL 73 HB VAL 73 -13.277 12.932 -22.622 291 HG11 VAL 73 HG11 VAL 73 -14.361 14.662 -24.593 292 HG12 VAL 73 HG12 VAL 73 -15.019 13.053 -24.888 293 HG13 VAL 73 HG13 VAL 73 -13.274 13.296 -24.834 294 HG21 VAL 73 HG21 VAL 73 -15.377 15.122 -22.596 295 HG22 VAL 73 HG22 VAL 73 -13.650 15.300 -22.288 296 HG23 VAL 73 HG23 VAL 73 -14.666 14.437 -21.134 297 H VAL 74 HN VAL 74 -16.826 11.602 -24.536 298 HA VAL 74 HA VAL 74 -15.176 9.225 -25.158 299 HB VAL 74 HB VAL 74 -18.186 9.541 -25.238 300 HG11 VAL 74 HG11 VAL 74 -16.615 7.063 -25.950 301 HG12 VAL 74 HG12 VAL 74 -17.088 8.244 -27.172 302 HG13 VAL 74 HG13 VAL 74 -18.322 7.397 -26.239 303 HG21 VAL 74 HG21 VAL 74 -17.543 7.268 -23.820 304 HG22 VAL 74 HG22 VAL 74 -17.910 8.833 -23.096 305 HG23 VAL 74 HG23 VAL 74 -16.234 8.363 -23.375 306 H VAL 75 HN VAL 75 -14.438 9.120 -27.197 307 HA VAL 75 HA VAL 75 -15.733 10.845 -29.223 308 HB VAL 75 HB VAL 75 -12.796 10.176 -28.927 309 HG11 VAL 75 HG11 VAL 75 -12.535 10.803 -31.073 310 HG12 VAL 75 HG12 VAL 75 -13.421 12.300 -30.778 311 HG13 VAL 75 HG13 VAL 75 -14.291 10.836 -31.238 312 HG21 VAL 75 HG21 VAL 75 -13.376 12.972 -28.986 313 HG22 VAL 75 HG22 VAL 75 -12.695 12.034 -27.658 314 HG23 VAL 75 HG23 VAL 75 -14.442 12.227 -27.796 315 H SER 76 HN SER 76 -16.540 9.770 -30.920 316 HA SER 76 HA SER 76 -15.196 7.413 -31.952 317 HB2 SER 76 HB2 SER 76 -18.029 7.211 -30.903 318 HB3 SER 76 HB1 SER 76 -17.163 5.957 -31.787 319 HG SER 76 HG SER 76 -15.532 6.548 -29.926 320 H ASP 77 HN ASP 77 -16.210 6.653 -33.978 321 HA ASP 77 HA ASP 77 -16.900 8.866 -35.652 322 HB2 ASP 77 HB2 ASP 77 -16.853 5.883 -36.113 323 HB3 ASP 77 HB1 ASP 77 -17.281 7.045 -37.367 324 H PHE 78 HN PHE 78 -18.683 6.943 -33.557 325 HA PHE 78 HA PHE 78 -21.122 6.565 -34.890 326 HB2 PHE 78 HB2 PHE 78 -20.413 5.663 -32.604 327 HB3 PHE 78 HB1 PHE 78 -20.870 7.245 -31.957 328 HD1 PHE 78 HD1 PHE 78 -22.069 4.079 -33.343 329 HD2 PHE 78 HD2 PHE 78 -23.239 8.031 -32.145 330 HE1 PHE 78 HE1 PHE 78 -24.447 3.376 -33.340 331 HE2 PHE 78 HE2 PHE 78 -25.618 7.328 -32.136 332 HZ PHE 78 HZ PHE 78 -26.220 4.999 -32.736 333 H PHE 79 HN PHE 79 -19.642 9.402 -33.547 334 HA PHE 79 HA PHE 79 -22.104 10.944 -33.503 335 HB2 PHE 79 HB2 PHE 79 -20.378 11.414 -31.831 336 HB3 PHE 79 HB1 PHE 79 -19.223 11.786 -33.111 337 HD1 PHE 79 HD1 PHE 79 -22.607 12.797 -31.846 338 HD2 PHE 79 HD2 PHE 79 -19.036 13.977 -33.923 339 HE1 PHE 79 HE1 PHE 79 -23.422 15.138 -31.921 340 HE2 PHE 79 HE2 PHE 79 -19.853 16.317 -33.998 341 HZ PHE 79 HZ PHE 79 -22.045 16.898 -32.997 342 H GLN 80 HN GLN 80 -20.219 9.846 -35.935 343 HA GLN 80 HA GLN 80 -20.191 12.304 -37.518 344 HB2 GLN 80 HB2 GLN 80 -19.273 9.482 -38.107 345 HB3 GLN 80 HB1 GLN 80 -19.156 10.816 -39.255 346 HG2 GLN 80 HG2 GLN 80 -17.760 12.076 -37.671 347 HG3 GLN 80 HG1 GLN 80 -17.898 10.768 -36.496 348 HE21 GLN 80 HE21 GLN 80 -15.793 11.988 -38.747 349 HE22 GLN 80 HE22 GLN 80 -14.971 10.564 -39.166 350 H GLY 81 HN GLY 81 -22.079 12.888 -38.397 351 HA2 GLY 81 HA2 GLY 81 -23.855 12.754 -39.894 352 HA3 GLY 81 HA1 GLY 81 -23.489 11.045 -40.132 353 H LYS 82 HN LYS 82 -23.581 11.662 -36.862 354 HA LYS 82 HA LYS 82 -26.447 10.946 -36.688 355 HB2 LYS 82 HB2 LYS 82 -24.135 9.870 -35.060 356 HB3 LYS 82 HB1 LYS 82 -25.833 9.597 -34.670 357 HG2 LYS 82 HG2 LYS 82 -26.173 8.537 -36.873 358 HG3 LYS 82 HG1 LYS 82 -24.474 8.807 -37.264 359 HD2 LYS 82 HD2 LYS 82 -23.789 7.386 -35.388 360 HD3 LYS 82 HD1 LYS 82 -25.474 7.157 -34.922 361 HE2 LYS 82 HE2 LYS 82 -24.695 5.226 -36.217 362 HE3 LYS 82 HE1 LYS 82 -25.919 6.109 -37.130 363 HZ1 LYS 82 HZ1 LYS 82 -23.773 5.429 -38.316 364 HZ2 LYS 82 HZ2 LYS 82 -23.051 6.711 -37.467 365 HZ3 LYS 82 HZ3 LYS 82 -24.337 7.012 -38.536 366 H SER 83 HN SER 83 -27.631 11.863 -35.067 367 HA SER 83 HA SER 83 -26.730 14.365 -34.036 368 HB2 SER 83 HB2 SER 83 -29.084 14.018 -34.587 369 HB3 SER 83 HB1 SER 83 -29.200 12.746 -33.374 370 HG SER 83 HG SER 83 -29.921 14.752 -32.558 371 H LYS 84 HN LYS 84 -26.553 14.976 -31.825 372 HA LYS 84 HA LYS 84 -24.930 13.292 -30.264 373 HB2 LYS 84 HB2 LYS 84 -26.511 15.769 -29.542 374 HB3 LYS 84 HB1 LYS 84 -25.389 14.973 -28.437 375 HG2 LYS 84 HG2 LYS 84 -23.561 15.276 -30.059 376 HG3 LYS 84 HG1 LYS 84 -24.677 16.060 -31.177 377 HD2 LYS 84 HD2 LYS 84 -25.117 17.819 -29.491 378 HD3 LYS 84 HD1 LYS 84 -23.966 17.047 -28.399 379 HE2 LYS 84 HE2 LYS 84 -23.295 18.092 -31.166 380 HE3 LYS 84 HE1 LYS 84 -22.940 18.933 -29.656 381 HZ1 LYS 84 HZ1 LYS 84 -21.764 16.770 -29.018 382 HZ2 LYS 84 HZ2 LYS 84 -20.993 17.796 -30.131 383 HZ3 LYS 84 HZ3 LYS 84 -21.805 16.405 -30.674 384 H LEU 85 HN LEU 85 -28.397 13.913 -30.213 385 HA LEU 85 HA LEU 85 -29.029 12.636 -27.786 386 HB2 LEU 85 HB2 LEU 85 -30.618 13.057 -30.319 387 HB3 LEU 85 HB1 LEU 85 -31.307 12.344 -28.862 388 HG LEU 85 HG LEU 85 -31.739 14.766 -28.935 389 HD11 LEU 85 HD11 LEU 85 -31.148 15.201 -26.701 390 HD12 LEU 85 HD12 LEU 85 -29.618 14.335 -26.841 391 HD13 LEU 85 HD13 LEU 85 -31.136 13.440 -26.777 392 HD21 LEU 85 HD21 LEU 85 -29.588 15.215 -30.263 393 HD22 LEU 85 HD22 LEU 85 -28.748 15.152 -28.713 394 HD23 LEU 85 HD23 LEU 85 -29.983 16.379 -28.997 395 H MET 86 HN MET 86 -28.657 11.401 -31.078 396 HA MET 86 HA MET 86 -29.604 8.783 -30.625 397 HB2 MET 86 HB2 MET 86 -27.567 9.848 -32.595 398 HB3 MET 86 HB1 MET 86 -28.201 8.202 -32.628 399 HG2 MET 86 HG2 MET 86 -29.874 10.725 -32.811 400 HG3 MET 86 HG1 MET 86 -29.452 9.679 -34.170 401 HE1 MET 86 HE1 MET 86 -29.619 6.763 -33.107 402 HE2 MET 86 HE2 MET 86 -30.204 7.451 -34.620 403 HE3 MET 86 HE3 MET 86 -31.272 6.441 -33.648 404 H ARG 87 HN ARG 87 -26.421 10.270 -30.206 405 HA ARG 87 HA ARG 87 -24.948 7.922 -29.689 406 HB2 ARG 87 HB2 ARG 87 -24.545 10.764 -28.758 407 HB3 ARG 87 HB1 ARG 87 -23.397 9.464 -28.438 408 HG2 ARG 87 HG2 ARG 87 -23.158 9.042 -30.827 409 HG3 ARG 87 HG1 ARG 87 -24.357 10.281 -31.192 410 HD2 ARG 87 HD2 ARG 87 -22.109 11.182 -31.489 411 HD3 ARG 87 HD1 ARG 87 -22.893 11.977 -30.126 412 HE ARG 87 HE ARG 87 -21.353 10.954 -28.697 413 HH11 ARG 87 HH11 ARG 87 -21.236 9.605 -31.884 414 HH12 ARG 87 HH12 ARG 87 -19.786 8.703 -31.598 415 HH21 ARG 87 HH21 ARG 87 -19.453 9.766 -28.315 416 HH22 ARG 87 HH22 ARG 87 -18.778 8.793 -29.579 417 H SER 88 HN SER 88 -26.853 10.023 -27.562 418 HA SER 88 HA SER 88 -26.066 8.891 -25.107 419 HB2 SER 88 HB2 SER 88 -28.154 9.848 -24.227 420 HB3 SER 88 HB1 SER 88 -27.330 10.995 -25.279 421 HG SER 88 HG SER 88 -29.780 10.202 -25.498 422 H ARG 89 HN ARG 89 -28.612 7.990 -27.408 423 HA ARG 89 HA ARG 89 -29.785 5.982 -25.785 424 HB2 ARG 89 HB2 ARG 89 -29.741 6.375 -28.779 425 HB3 ARG 89 HB1 ARG 89 -30.656 5.096 -27.980 426 HG2 ARG 89 HG2 ARG 89 -31.910 6.747 -26.690 427 HG3 ARG 89 HG1 ARG 89 -30.951 8.054 -27.390 428 HD2 ARG 89 HD2 ARG 89 -33.064 7.885 -28.591 429 HD3 ARG 89 HD1 ARG 89 -31.749 7.381 -29.648 430 HE ARG 89 HE ARG 89 -32.836 5.133 -28.287 431 HH11 ARG 89 HH11 ARG 89 -33.473 7.431 -30.798 432 HH12 ARG 89 HH12 ARG 89 -34.485 6.362 -31.708 433 HH21 ARG 89 HH21 ARG 89 -34.163 3.728 -29.476 434 HH22 ARG 89 HH22 ARG 89 -34.877 4.266 -30.960 435 H ALA 90 HN ALA 90 -27.183 5.929 -28.187 436 HA ALA 90 HA ALA 90 -26.837 3.134 -28.265 437 HB1 ALA 90 HB1 ALA 90 -25.093 5.484 -28.909 438 HB2 ALA 90 HB2 ALA 90 -25.746 4.253 -29.989 439 HB3 ALA 90 HB3 ALA 90 -24.407 3.859 -28.910 440 H VAL 91 HN VAL 91 -25.292 5.635 -26.272 441 HA VAL 91 HA VAL 91 -23.656 3.765 -24.845 442 HB VAL 91 HB VAL 91 -23.085 6.176 -25.101 443 HG11 VAL 91 HG11 VAL 91 -25.268 6.624 -23.050 444 HG12 VAL 91 HG12 VAL 91 -25.463 6.958 -24.770 445 HG13 VAL 91 HG13 VAL 91 -24.267 7.848 -23.831 446 HG21 VAL 91 HG21 VAL 91 -22.288 6.458 -22.804 447 HG22 VAL 91 HG22 VAL 91 -22.147 4.762 -23.268 448 HG23 VAL 91 HG23 VAL 91 -23.468 5.283 -22.223 449 H ASN 92 HN ASN 92 -26.744 5.379 -24.246 450 HA ASN 92 HA ASN 92 -27.141 4.500 -21.597 451 HB2 ASN 92 HB2 ASN 92 -28.481 6.288 -22.534 452 HB3 ASN 92 HB1 ASN 92 -29.142 5.198 -23.755 453 HD21 ASN 92 HD21 ASN 92 -28.616 4.191 -20.385 454 HD22 ASN 92 HD22 ASN 92 -30.263 4.051 -19.998 455 H LYS 93 HN LYS 93 -28.119 3.058 -24.703 456 HA LYS 93 HA LYS 93 -29.564 0.907 -23.542 457 HB2 LYS 93 HB2 LYS 93 -29.607 -0.042 -25.727 458 HB3 LYS 93 HB1 LYS 93 -29.675 1.708 -25.959 459 HG2 LYS 93 HG2 LYS 93 -27.244 1.750 -26.351 460 HG3 LYS 93 HG1 LYS 93 -27.171 0.003 -26.132 461 HD2 LYS 93 HD2 LYS 93 -28.708 -0.293 -28.047 462 HD3 LYS 93 HD1 LYS 93 -28.755 1.455 -28.274 463 HE2 LYS 93 HE2 LYS 93 -27.138 0.476 -29.825 464 HE3 LYS 93 HE1 LYS 93 -26.285 1.443 -28.623 465 HZ1 LYS 93 HZ1 LYS 93 -26.703 -1.322 -27.894 466 HZ2 LYS 93 HZ2 LYS 93 -25.319 -0.350 -27.732 467 HZ3 LYS 93 HZ3 LYS 93 -25.674 -1.088 -29.221 468 H ALA 94 HN ALA 94 -26.204 1.314 -24.549 469 HA ALA 94 HA ALA 94 -25.373 -1.365 -24.210 470 HB1 ALA 94 HB1 ALA 94 -24.164 1.123 -24.878 471 HB2 ALA 94 HB2 ALA 94 -23.496 -0.500 -25.057 472 HB3 ALA 94 HB3 ALA 94 -23.230 0.402 -23.566 473 H VAL 95 HN VAL 95 -25.518 1.381 -22.008 474 HA VAL 95 HA VAL 95 -25.195 -0.480 -19.752 475 HB VAL 95 HB VAL 95 -23.922 1.942 -19.003 476 HG11 VAL 95 HG11 VAL 95 -23.308 -0.943 -19.281 477 HG12 VAL 95 HG12 VAL 95 -23.053 0.138 -17.910 478 HG13 VAL 95 HG13 VAL 95 -21.910 0.131 -19.253 479 HG21 VAL 95 HG21 VAL 95 -23.445 2.521 -21.278 480 HG22 VAL 95 HG22 VAL 95 -23.037 0.856 -21.687 481 HG23 VAL 95 HG23 VAL 95 -21.968 1.795 -20.643 482 H LYS 96 HN LYS 96 -27.641 0.220 -20.342 483 HA LYS 96 HA LYS 96 -28.524 2.739 -19.362 484 HB2 LYS 96 HB2 LYS 96 -30.747 1.831 -19.533 485 HB3 LYS 96 HB1 LYS 96 -29.815 1.257 -20.918 486 HG2 LYS 96 HG2 LYS 96 -29.391 -0.871 -19.776 487 HG3 LYS 96 HG1 LYS 96 -30.274 -0.301 -18.360 488 HD2 LYS 96 HD2 LYS 96 -31.794 -1.661 -19.639 489 HD3 LYS 96 HD1 LYS 96 -32.283 0.020 -19.864 490 HE2 LYS 96 HE2 LYS 96 -31.132 0.118 -22.007 491 HE3 LYS 96 HE1 LYS 96 -30.496 -1.511 -21.775 492 HZ1 LYS 96 HZ1 LYS 96 -33.380 -0.824 -21.920 493 HZ2 LYS 96 HZ2 LYS 96 -32.718 -2.384 -21.806 494 HZ3 LYS 96 HZ3 LYS 96 -32.472 -1.454 -23.205 495 H GLU 97 HN GLU 97 -27.765 -0.291 -17.832 496 HA GLU 97 HA GLU 97 -29.260 -0.068 -15.469 497 HB2 GLU 97 HB2 GLU 97 -28.075 -2.118 -16.129 498 HB3 GLU 97 HB1 GLU 97 -26.529 -1.309 -15.872 499 HG2 GLU 97 HG2 GLU 97 -27.028 -2.603 -13.890 500 HG3 GLU 97 HG1 GLU 97 -27.219 -0.896 -13.490 501 H GLU 98 HN GLU 98 -26.021 1.175 -16.275 502 HA GLU 98 HA GLU 98 -25.448 2.181 -13.680 503 HB2 GLU 98 HB2 GLU 98 -23.582 3.253 -14.652 504 HB3 GLU 98 HB1 GLU 98 -23.817 1.814 -15.646 505 HG2 GLU 98 HG2 GLU 98 -25.142 3.194 -17.242 506 HG3 GLU 98 HG1 GLU 98 -24.769 4.616 -16.283 507 H LEU 99 HN LEU 99 -27.334 3.370 -16.346 508 HA LEU 99 HA LEU 99 -27.346 6.122 -15.736 509 HB2 LEU 99 HB2 LEU 99 -29.260 4.303 -17.172 510 HB3 LEU 99 HB1 LEU 99 -29.669 5.989 -16.868 511 HG LEU 99 HG LEU 99 -28.477 5.387 -19.101 512 HD11 LEU 99 HD11 LEU 99 -28.825 7.663 -18.535 513 HD12 LEU 99 HD12 LEU 99 -27.099 7.533 -18.873 514 HD13 LEU 99 HD13 LEU 99 -27.670 7.587 -17.206 515 HD21 LEU 99 HD21 LEU 99 -26.069 5.549 -17.265 516 HD22 LEU 99 HD22 LEU 99 -26.064 5.285 -19.008 517 HD23 LEU 99 HD23 LEU 99 -26.687 4.037 -17.929 518 H GLN 100 HN GLN 100 -29.392 3.455 -14.600 519 HA GLN 100 HA GLN 100 -31.220 5.053 -13.145 520 HB2 GLN 100 HB2 GLN 100 -30.364 2.171 -12.836 521 HB3 GLN 100 HB1 GLN 100 -31.670 2.902 -11.904 522 HG2 GLN 100 HG2 GLN 100 -32.864 3.461 -13.971 523 HG3 GLN 100 HG1 GLN 100 -31.543 2.798 -14.931 524 HE21 GLN 100 HE21 GLN 100 -33.717 1.501 -15.603 525 HE22 GLN 100 HE22 GLN 100 -33.921 0.027 -14.785 526 H GLU 101 HN GLU 101 -28.158 3.512 -12.302 527 HA GLU 101 HA GLU 101 -28.260 4.251 -9.535 528 HB2 GLU 101 HB2 GLU 101 -26.932 2.322 -10.371 529 HB3 GLU 101 HB1 GLU 101 -25.856 3.454 -11.192 530 HG2 GLU 101 HG2 GLU 101 -25.296 4.510 -9.049 531 HG3 GLU 101 HG1 GLU 101 -26.405 3.426 -8.210 532 H ILE 102 HN ILE 102 -26.991 5.701 -12.475 533 HA ILE 102 HA ILE 102 -25.874 7.919 -10.869 534 HB ILE 102 HB ILE 102 -25.415 7.171 -13.767 535 HG12 ILE 102 HG12 ILE 102 -23.514 7.012 -11.412 536 HG13 ILE 102 HG11 ILE 102 -24.450 5.634 -11.990 537 HG21 ILE 102 HG21 ILE 102 -24.619 9.483 -12.059 538 HG22 ILE 102 HG22 ILE 102 -24.949 9.425 -13.790 539 HG23 ILE 102 HG23 ILE 102 -23.408 8.838 -13.167 540 HD11 ILE 102 HD1 ILE 102 -23.404 6.429 -14.333 541 HD12 ILE 102 HD2 ILE 102 -22.562 5.309 -13.262 542 HD13 ILE 102 HD3 ILE 102 -22.138 7.022 -13.258 543 H HIS 103 HN HIS 103 -27.063 9.697 -10.714 544 HA HIS 103 HA HIS 103 -29.120 10.219 -12.762 545 HB2 HIS 103 HB2 HIS 103 -30.263 11.534 -11.101 546 HB3 HIS 103 HB1 HIS 103 -29.824 9.992 -10.360 547 HD2 HIS 103 HD2 HIS 103 -27.855 10.167 -8.322 548 HE1 HIS 103 HE1 HIS 103 -27.519 14.375 -8.381 549 HE2 HIS 103 HE2 HIS 103 -26.861 12.267 -7.129 550 H ALA 104 HN ALA 104 -26.102 11.304 -11.588 551 HA ALA 104 HA ALA 104 -26.351 13.765 -13.205 552 HB1 ALA 104 HB1 ALA 104 -24.471 14.184 -11.094 553 HB2 ALA 104 HB2 ALA 104 -25.989 13.629 -10.390 554 HB3 ALA 104 HB3 ALA 104 -25.968 15.058 -11.422 555 H PHE 105 HN PHE 105 -25.246 12.945 -14.926 556 HA PHE 105 HA PHE 105 -22.362 12.630 -14.571 557 HB2 PHE 105 HB2 PHE 105 -22.299 10.580 -15.924 558 HB3 PHE 105 HB1 PHE 105 -23.223 10.337 -14.444 559 HD1 PHE 105 HD1 PHE 105 -25.262 12.394 -16.300 560 HD2 PHE 105 HD2 PHE 105 -23.808 8.357 -16.314 561 HE1 PHE 105 HE1 PHE 105 -27.195 11.713 -17.680 562 HE2 PHE 105 HE2 PHE 105 -25.750 7.667 -17.694 563 HZ PHE 105 HZ PHE 105 -27.439 9.350 -18.378 564 H SER 106 HN SER 106 -21.171 12.729 -16.629 565 HA SER 106 HA SER 106 -22.723 13.962 -18.815 566 HB2 SER 106 HB2 SER 106 -20.895 15.587 -19.167 567 HB3 SER 106 HB1 SER 106 -21.656 15.786 -17.585 568 HG SER 106 HG SER 106 -19.166 15.560 -17.943 569 H CYS 107 HN CYS 107 -21.875 13.651 -20.888 570 HA CYS 107 HA CYS 107 -19.508 11.955 -21.182 571 HB2 CYS 107 HB2 CYS 107 -20.732 10.379 -22.651 572 HB3 CYS 107 HB1 CYS 107 -21.330 10.336 -20.992 573 HG CYS 107 HG CYS 107 -23.404 11.727 -21.735 574 H LYS 108 HN LYS 108 -18.817 14.083 -22.010 575 HA LYS 108 HA LYS 108 -20.000 15.324 -24.238 576 HB2 LYS 108 HB2 LYS 108 -17.128 15.286 -23.290 577 HB3 LYS 108 HB1 LYS 108 -17.730 16.343 -24.568 578 HG2 LYS 108 HG2 LYS 108 -19.367 17.314 -22.998 579 HG3 LYS 108 HG1 LYS 108 -18.763 16.261 -21.718 580 HD2 LYS 108 HD2 LYS 108 -16.539 17.295 -21.891 581 HD3 LYS 108 HD1 LYS 108 -17.112 18.327 -23.203 582 HE2 LYS 108 HE2 LYS 108 -17.165 19.566 -21.088 583 HE3 LYS 108 HE1 LYS 108 -18.808 19.301 -21.671 584 HZ1 LYS 108 HZ1 LYS 108 -18.216 17.087 -20.164 585 HZ2 LYS 108 HZ2 LYS 108 -19.219 18.381 -19.710 586 HZ3 LYS 108 HZ3 LYS 108 -17.577 18.382 -19.273 587 H CYS 109 HN CYS 109 -19.734 15.053 -26.446 588 HA CYS 109 HA CYS 109 -18.091 12.736 -27.286 589 HB2 CYS 109 HB2 CYS 109 -19.752 12.178 -28.926 590 HB3 CYS 109 HB1 CYS 109 -20.587 12.375 -27.384 591 HG CYS 109 HG CYS 109 -20.600 14.553 -29.632 592 H TYR 110 HN TYR 110 -16.623 13.107 -28.833 593 HA TYR 110 HA TYR 110 -16.946 15.442 -30.588 594 HB2 TYR 110 HB2 TYR 110 -14.424 14.809 -29.037 595 HB3 TYR 110 HB1 TYR 110 -14.591 16.077 -30.255 596 HD1 TYR 110 HD1 TYR 110 -15.133 15.158 -26.801 597 HD2 TYR 110 HD2 TYR 110 -16.299 17.925 -29.873 598 HE1 TYR 110 HE1 TYR 110 -16.040 16.692 -25.076 599 HE2 TYR 110 HE2 TYR 110 -17.205 19.459 -28.148 600 HH TYR 110 HH TYR 110 -16.509 19.680 -25.340 601 H THR 111 HN THR 111 -15.737 15.323 -32.555 602 HA THR 111 HA THR 111 -14.116 13.084 -33.224 603 HB THR 111 HB THR 111 -16.127 12.563 -35.057 604 HG1 THR 111 HG1 THR 111 -17.493 13.773 -33.577 605 HG21 THR 111 HG21 THR 111 -14.497 11.171 -33.407 606 HG22 THR 111 HG22 THR 111 -15.838 10.433 -34.284 607 HG23 THR 111 HG23 THR 111 -16.041 10.911 -32.598 608 H GLU 112 HN GLU 112 -14.069 15.953 -33.479 609 HA GLU 112 HA GLU 112 -13.234 17.451 -35.017 610 HB2 GLU 112 HB2 GLU 112 -12.086 15.519 -36.065 611 HB3 GLU 112 HB1 GLU 112 -13.534 15.201 -37.020 612 HG2 GLU 112 HG2 GLU 112 -13.368 17.425 -38.048 613 HG3 GLU 112 HG1 GLU 112 -11.944 17.781 -37.071 614 H GLU 113 HN GLU 113 -16.183 15.788 -35.328 615 HA GLU 113 HA GLU 113 -17.338 17.149 -37.519 616 HB2 GLU 113 HB2 GLU 113 -18.576 15.864 -35.093 617 HB3 GLU 113 HB1 GLU 113 -19.491 16.531 -36.441 618 HG2 GLU 113 HG2 GLU 113 -17.342 14.419 -36.737 619 HG3 GLU 113 HG1 GLU 113 -19.062 14.052 -36.622 620 H GLU 114 HN GLU 114 -17.162 17.884 -34.075 621 HA GLU 114 HA GLU 114 -18.963 20.050 -34.059 622 HB2 GLU 114 HB2 GLU 114 -16.576 19.407 -32.318 623 HB3 GLU 114 HB1 GLU 114 -17.659 20.766 -32.007 624 HG2 GLU 114 HG2 GLU 114 -18.636 19.102 -30.705 625 HG3 GLU 114 HG1 GLU 114 -19.542 18.938 -32.205 626 H TRP 115 HN TRP 115 -15.565 19.749 -34.813 627 HA TRP 115 HA TRP 115 -14.913 22.493 -34.949 628 HB2 TRP 115 HB2 TRP 115 -13.130 20.888 -34.942 629 HB3 TRP 115 HB1 TRP 115 -13.747 20.104 -36.397 630 HD1 TRP 115 HD1 TRP 115 -12.058 23.356 -35.228 631 HE1 TRP 115 HE1 TRP 115 -10.973 24.499 -37.271 632 HE3 TRP 115 HE3 TRP 115 -13.779 20.323 -38.957 633 HZ2 TRP 115 HZ2 TRP 115 -10.851 24.168 -40.112 634 HZ3 TRP 115 HZ3 TRP 115 -13.165 20.757 -41.318 635 HH2 TRP 115 HH2 TRP 115 -11.705 22.673 -41.900 636 H SER 116 HN SER 116 -16.095 20.233 -37.433 637 HA SER 116 HA SER 116 -16.602 20.704 -39.676 638 HB2 SER 116 HB2 SER 116 -18.680 20.904 -38.258 639 HB3 SER 116 HB1 SER 116 -18.430 22.647 -38.252 640 HG SER 116 HG SER 116 -19.804 22.013 -39.953 641 H LYS 117 HN LYS 117 -17.825 23.218 -40.530 642 HA LYS 117 HA LYS 117 -15.358 24.802 -40.862 643 HB2 LYS 117 HB2 LYS 117 -17.828 24.585 -42.595 644 HB3 LYS 117 HB1 LYS 117 -16.504 25.713 -42.890 645 HG2 LYS 117 HG2 LYS 117 -14.924 23.875 -43.117 646 HG3 LYS 117 HG1 LYS 117 -16.174 22.707 -42.684 647 HD2 LYS 117 HD2 LYS 117 -15.954 22.710 -45.095 648 HD3 LYS 117 HD1 LYS 117 -17.489 23.475 -44.683 649 HE2 LYS 117 HE2 LYS 117 -16.467 25.697 -44.920 650 HE3 LYS 117 HE1 LYS 117 -14.911 24.953 -45.290 651 HZ1 LYS 117 HZ1 LYS 117 -16.265 25.666 -47.256 652 HZ2 LYS 117 HZ2 LYS 117 -17.365 24.431 -46.867 653 HZ3 LYS 117 HZ3 LYS 117 -15.761 24.046 -47.277 654 H ILE 118 HN ILE 118 -17.733 24.825 -38.802 655 HA ILE 118 HA ILE 118 -19.098 27.262 -39.049 656 HB ILE 118 HB ILE 118 -19.483 27.092 -36.630 657 HG12 ILE 118 HG12 ILE 118 -17.549 24.757 -36.708 658 HG13 ILE 118 HG11 ILE 118 -17.113 26.364 -36.120 659 HG21 ILE 118 HG21 ILE 118 -20.922 25.698 -37.891 660 HG22 ILE 118 HG22 ILE 118 -20.268 24.631 -36.649 661 HG23 ILE 118 HG23 ILE 118 -19.623 24.574 -38.289 662 HD11 ILE 118 HD1 ILE 118 -18.268 26.102 -34.178 663 HD12 ILE 118 HD2 ILE 118 -18.151 24.382 -34.544 664 HD13 ILE 118 HD3 ILE 118 -19.607 25.277 -34.976 665 H VAL 119 HN VAL 119 -15.798 26.718 -38.595 666 HA VAL 119 HA VAL 119 -14.143 28.384 -38.574 667 HB VAL 119 HB VAL 119 -16.107 30.266 -37.280 668 HG11 VAL 119 HG11 VAL 119 -13.846 30.877 -39.185 669 HG12 VAL 119 HG12 VAL 119 -13.558 30.677 -37.456 670 HG13 VAL 119 HG13 VAL 119 -14.630 31.956 -38.030 671 HG21 VAL 119 HG21 VAL 119 -15.759 30.662 -40.137 672 HG22 VAL 119 HG22 VAL 119 -17.252 30.525 -39.209 673 HG23 VAL 119 HG23 VAL 119 -16.448 29.072 -39.804 674 H VAL 120 HN VAL 120 -12.610 28.271 -37.113 675 HA VAL 120 HA VAL 120 -13.344 28.261 -34.265 676 HB VAL 120 HB VAL 120 -11.701 26.458 -33.884 677 HG11 VAL 120 HG11 VAL 120 -14.166 26.016 -34.375 678 HG12 VAL 120 HG12 VAL 120 -13.077 24.659 -34.658 679 HG13 VAL 120 HG13 VAL 120 -13.671 25.610 -36.019 680 HG21 VAL 120 HG21 VAL 120 -10.674 25.290 -35.723 681 HG22 VAL 120 HG22 VAL 120 -10.364 27.008 -35.970 682 HG23 VAL 120 HG23 VAL 120 -11.622 26.197 -36.902 683 H LEU 121 HN LEU 121 -11.602 28.814 -32.872 684 HA LEU 121 HA LEU 121 -9.964 30.930 -33.943 685 HB2 LEU 121 HB2 LEU 121 -9.604 31.561 -31.736 686 HB3 LEU 121 HB1 LEU 121 -11.189 30.785 -31.652 687 HG LEU 121 HG LEU 121 -9.372 28.679 -31.343 688 HD11 LEU 121 HD11 LEU 121 -8.493 30.360 -29.148 689 HD12 LEU 121 HD12 LEU 121 -8.000 31.048 -30.696 690 HD13 LEU 121 HD13 LEU 121 -7.526 29.403 -30.269 691 HD21 LEU 121 HD21 LEU 121 -11.283 28.548 -30.045 692 HD22 LEU 121 HD22 LEU 121 -11.221 30.254 -29.601 693 HD23 LEU 121 HD23 LEU 121 -10.139 29.100 -28.821 694 H GLU 122 HN GLU 122 -9.268 28.460 -35.069 695 HA GLU 122 HA GLU 122 -7.119 27.151 -33.804 696 HB2 GLU 122 HB2 GLU 122 -8.310 26.240 -35.761 697 HB3 GLU 122 HB1 GLU 122 -7.637 27.526 -36.764 698 HG2 GLU 122 HG2 GLU 122 -5.360 26.746 -36.257 699 HG3 GLU 122 HG1 GLU 122 -6.018 25.469 -35.235 700 H HIS 123 HN HIS 123 -7.184 29.885 -36.081 701 HA HIS 123 HA HIS 123 -4.711 30.905 -34.994 702 HB2 HIS 123 HB2 HIS 123 -3.927 29.174 -36.613 703 HB3 HIS 123 HB1 HIS 123 -4.760 30.049 -37.898 704 HD2 HIS 123 HD2 HIS 123 -1.510 30.357 -35.746 705 HE1 HIS 123 HE1 HIS 123 -1.615 33.642 -38.398 706 HE2 HIS 123 HE2 HIS 123 -0.189 32.395 -36.706 707 H HIS 124 HN HIS 124 -4.963 33.039 -34.925 708 HA HIS 124 HA HIS 124 -6.214 34.426 -37.184 709 HB2 HIS 124 HB2 HIS 124 -7.122 34.745 -34.315 710 HB3 HIS 124 HB1 HIS 124 -7.649 35.745 -35.668 711 HD2 HIS 124 HD2 HIS 124 -8.619 32.423 -34.013 712 HE1 HIS 124 HE1 HIS 124 -10.471 32.436 -37.808 713 HE2 HIS 124 HE2 HIS 124 -10.371 31.257 -35.564 714 H HIS 125 HN HIS 125 -5.658 36.654 -37.328 715 HA HIS 125 HA HIS 125 -3.738 37.694 -35.383 716 HB2 HIS 125 HB2 HIS 125 -2.529 36.372 -37.256 717 HB3 HIS 125 HB1 HIS 125 -2.978 37.724 -38.295 718 HD2 HIS 125 HD2 HIS 125 -0.322 36.864 -35.644 719 HE1 HIS 125 HE1 HIS 125 -0.045 41.024 -36.303 720 HE2 HIS 125 HE2 HIS 125 1.073 39.026 -35.203 721 H HIS 126 HN HIS 126 -3.689 39.931 -35.319 722 HA HIS 126 HA HIS 126 -5.955 41.324 -36.245 723 HB2 HIS 126 HB2 HIS 126 -3.290 42.299 -35.205 724 HB3 HIS 126 HB1 HIS 126 -4.646 43.372 -35.556 725 HD2 HIS 126 HD2 HIS 126 -3.445 41.059 -32.721 726 HE1 HIS 126 HE1 HIS 126 -7.449 42.063 -31.839 727 HE2 HIS 126 HE2 HIS 126 -5.336 40.993 -30.922 728 H HIS 127 HN HIS 127 -2.664 41.100 -37.506 729 HA HIS 127 HA HIS 127 -1.764 41.651 -39.544 730 HB2 HIS 127 HB2 HIS 127 -4.670 41.753 -40.387 731 HB3 HIS 127 HB1 HIS 127 -3.288 41.738 -41.481 732 HD2 HIS 127 HD2 HIS 127 -5.556 39.207 -39.751 733 HE1 HIS 127 HE1 HIS 127 -2.071 37.084 -40.833 734 HE2 HIS 127 HE2 HIS 127 -4.462 36.849 -40.011 735 H HIS 128 HN HIS 128 -2.463 43.697 -37.554 736 HA HIS 128 HA HIS 128 -2.795 46.021 -39.353 737 HB2 HIS 128 HB2 HIS 128 -4.530 45.596 -37.494 738 HB3 HIS 128 HB1 HIS 128 -3.255 46.080 -36.377 739 HD2 HIS 128 HD2 HIS 128 -5.799 47.717 -38.772 740 HE1 HIS 128 HE1 HIS 128 -3.142 50.766 -37.561 741 HE2 HIS 128 HE2 HIS 128 -5.330 50.285 -38.758 Start of MODEL 15 1 H1 MET 36 HT1 MET 36 -29.385 1.874 -8.619 2 H2 MET 36 HT2 MET 36 -29.585 3.081 -7.441 3 H3 MET 36 HT3 MET 36 -30.147 1.505 -7.149 4 HA MET 36 HA MET 36 -28.119 1.869 -5.935 5 HB2 MET 36 HB2 MET 36 -27.971 0.029 -8.331 6 HB3 MET 36 HB1 MET 36 -26.736 0.043 -7.071 7 HG2 MET 36 HG2 MET 36 -29.696 -0.416 -6.598 8 HG3 MET 36 HG1 MET 36 -28.468 -1.682 -6.640 9 HE1 MET 36 HE1 MET 36 -30.408 -0.880 -3.715 10 HE2 MET 36 HE2 MET 36 -29.127 -1.901 -3.066 11 HE3 MET 36 HE3 MET 36 -29.761 -2.214 -4.680 12 HA PRO 37 HA PRO 37 -25.495 4.959 -7.778 13 HB2 PRO 37 HB2 PRO 37 -23.566 4.041 -5.712 14 HB3 PRO 37 HB1 PRO 37 -24.230 5.663 -5.997 15 HG2 PRO 37 HG2 PRO 37 -25.014 4.204 -3.923 16 HG3 PRO 37 HG1 PRO 37 -26.155 5.227 -4.813 17 HD2 PRO 37 HD2 PRO 37 -25.793 2.250 -4.951 18 HD3 PRO 37 HD1 PRO 37 -27.291 3.207 -4.982 19 H VAL 38 HN VAL 38 -23.667 5.048 -9.118 20 HA VAL 38 HA VAL 38 -22.459 2.423 -9.758 21 HB VAL 38 HB VAL 38 -23.730 3.325 -11.623 22 HG11 VAL 38 HG11 VAL 38 -23.806 5.525 -12.141 23 HG12 VAL 38 HG12 VAL 38 -22.050 5.684 -12.072 24 HG13 VAL 38 HG13 VAL 38 -23.005 5.793 -10.593 25 HG21 VAL 38 HG21 VAL 38 -20.812 3.033 -11.676 26 HG22 VAL 38 HG22 VAL 38 -21.419 4.025 -13.003 27 HG23 VAL 38 HG23 VAL 38 -22.023 2.383 -12.782 28 H THR 39 HN THR 39 -20.325 2.173 -9.477 29 HA THR 39 HA THR 39 -18.779 4.363 -8.394 30 HB THR 39 HB THR 39 -17.020 2.692 -8.115 31 HG1 THR 39 HG1 THR 39 -18.646 0.724 -9.241 32 HG21 THR 39 HG21 THR 39 -19.544 2.613 -6.947 33 HG22 THR 39 HG22 THR 39 -18.105 1.783 -6.356 34 HG23 THR 39 HG23 THR 39 -19.243 0.938 -7.406 35 H GLU 40 HN GLU 40 -16.691 5.011 -9.267 36 HA GLU 40 HA GLU 40 -16.824 5.712 -12.004 37 HB2 GLU 40 HB2 GLU 40 -15.602 7.030 -10.347 38 HB3 GLU 40 HB1 GLU 40 -14.454 5.711 -10.126 39 HG2 GLU 40 HG2 GLU 40 -13.811 5.874 -12.508 40 HG3 GLU 40 HG1 GLU 40 -14.965 7.186 -12.726 41 H GLN 41 HN GLN 41 -14.940 3.234 -10.278 42 HA GLN 41 HA GLN 41 -13.500 2.317 -12.536 43 HB2 GLN 41 HB2 GLN 41 -14.245 0.971 -9.935 44 HB3 GLN 41 HB1 GLN 41 -13.192 0.232 -11.142 45 HG2 GLN 41 HG2 GLN 41 -11.616 2.081 -10.966 46 HG3 GLN 41 HG1 GLN 41 -12.698 2.939 -9.870 47 HE21 GLN 41 HE21 GLN 41 -9.908 1.917 -9.351 48 HE22 GLN 41 HE22 GLN 41 -10.055 0.890 -8.007 49 H GLY 42 HN GLY 42 -16.572 1.332 -11.096 50 HA2 GLY 42 HA2 GLY 42 -17.075 -0.904 -12.757 51 HA3 GLY 42 HA1 GLY 42 -18.292 0.010 -11.869 52 H LEU 43 HN LEU 43 -17.651 2.538 -13.121 53 HA LEU 43 HA LEU 43 -19.417 2.445 -15.312 54 HB2 LEU 43 HB2 LEU 43 -19.020 4.489 -13.984 55 HB3 LEU 43 HB1 LEU 43 -17.376 4.568 -14.619 56 HG LEU 43 HG LEU 43 -18.230 4.772 -16.897 57 HD11 LEU 43 HD11 LEU 43 -20.656 5.010 -17.282 58 HD12 LEU 43 HD12 LEU 43 -20.951 4.668 -15.577 59 HD13 LEU 43 HD13 LEU 43 -20.255 3.426 -16.620 60 HD21 LEU 43 HD21 LEU 43 -17.940 6.836 -15.550 61 HD22 LEU 43 HD22 LEU 43 -19.601 6.686 -14.978 62 HD23 LEU 43 HD23 LEU 43 -19.281 7.005 -16.683 63 H ARG 44 HN ARG 44 -15.877 2.514 -15.161 64 HA ARG 44 HA ARG 44 -15.359 2.808 -17.897 65 HB2 ARG 44 HB2 ARG 44 -13.645 2.991 -16.117 66 HB3 ARG 44 HB1 ARG 44 -13.760 1.252 -15.847 67 HG2 ARG 44 HG2 ARG 44 -13.077 0.837 -18.179 68 HG3 ARG 44 HG1 ARG 44 -12.959 2.575 -18.456 69 HD2 ARG 44 HD2 ARG 44 -11.251 2.710 -16.643 70 HD3 ARG 44 HD1 ARG 44 -11.325 0.957 -16.482 71 HE ARG 44 HE ARG 44 -10.063 2.451 -18.638 72 HH11 ARG 44 HH11 ARG 44 -11.347 -0.552 -17.492 73 HH12 ARG 44 HH12 ARG 44 -10.439 -1.522 -18.603 74 HH21 ARG 44 HH21 ARG 44 -8.869 1.185 -20.097 75 HH22 ARG 44 HH22 ARG 44 -9.037 -0.539 -20.077 76 H GLU 45 HN GLU 45 -15.804 -0.120 -15.947 77 HA GLU 45 HA GLU 45 -15.419 -1.945 -18.098 78 HB2 GLU 45 HB2 GLU 45 -16.424 -3.617 -16.569 79 HB3 GLU 45 HB1 GLU 45 -15.158 -2.676 -15.781 80 HG2 GLU 45 HG2 GLU 45 -16.820 -1.238 -14.746 81 HG3 GLU 45 HG1 GLU 45 -18.122 -2.086 -15.578 82 H ARG 46 HN ARG 46 -18.239 -0.348 -16.712 83 HA ARG 46 HA ARG 46 -20.207 -1.802 -18.127 84 HB2 ARG 46 HB2 ARG 46 -20.745 -0.469 -16.142 85 HB3 ARG 46 HB1 ARG 46 -20.306 1.010 -16.998 86 HG2 ARG 46 HG2 ARG 46 -22.728 0.731 -17.072 87 HG3 ARG 46 HG1 ARG 46 -22.069 0.501 -18.691 88 HD2 ARG 46 HD2 ARG 46 -22.156 -1.925 -18.421 89 HD3 ARG 46 HD1 ARG 46 -22.715 -1.747 -16.759 90 HE ARG 46 HE ARG 46 -24.529 -0.359 -18.347 91 HH11 ARG 46 HH11 ARG 46 -23.318 -3.582 -18.000 92 HH12 ARG 46 HH12 ARG 46 -24.783 -4.338 -18.531 93 HH21 ARG 46 HH21 ARG 46 -26.452 -1.342 -19.049 94 HH22 ARG 46 HH22 ARG 46 -26.557 -3.070 -19.125 95 H ILE 47 HN ILE 47 -18.507 1.231 -18.783 96 HA ILE 47 HA ILE 47 -19.881 1.855 -21.157 97 HB ILE 47 HB ILE 47 -17.130 2.621 -20.181 98 HG12 ILE 47 HG12 ILE 47 -19.083 3.402 -18.876 99 HG13 ILE 47 HG11 ILE 47 -18.225 4.733 -19.650 100 HG21 ILE 47 HG21 ILE 47 -17.325 2.743 -22.677 101 HG22 ILE 47 HG22 ILE 47 -17.126 4.324 -21.921 102 HG23 ILE 47 HG23 ILE 47 -18.718 3.806 -22.479 103 HD11 ILE 47 HD1 ILE 47 -20.125 3.888 -21.542 104 HD12 ILE 47 HD2 ILE 47 -20.200 5.351 -20.560 105 HD13 ILE 47 HD3 ILE 47 -20.978 3.872 -19.999 106 H GLU 48 HN GLU 48 -16.881 0.091 -20.533 107 HA GLU 48 HA GLU 48 -16.184 -0.377 -23.228 108 HB2 GLU 48 HB2 GLU 48 -14.629 -0.683 -21.337 109 HB3 GLU 48 HB1 GLU 48 -15.566 -2.078 -20.789 110 HG2 GLU 48 HG2 GLU 48 -15.120 -3.200 -22.993 111 HG3 GLU 48 HG1 GLU 48 -14.185 -1.792 -23.492 112 H SER 49 HN SER 49 -18.174 -2.162 -20.917 113 HA SER 49 HA SER 49 -18.696 -4.337 -22.731 114 HB2 SER 49 HB2 SER 49 -19.980 -3.524 -20.113 115 HB3 SER 49 HB1 SER 49 -20.429 -4.965 -21.021 116 HG SER 49 HG SER 49 -17.846 -5.049 -20.902 117 H ALA 50 HN ALA 50 -19.986 -1.163 -22.162 118 HA ALA 50 HA ALA 50 -22.500 -1.821 -23.532 119 HB1 ALA 50 HB1 ALA 50 -21.474 0.664 -22.161 120 HB2 ALA 50 HB2 ALA 50 -22.787 -0.394 -21.643 121 HB3 ALA 50 HB3 ALA 50 -22.986 0.628 -23.067 122 H ILE 51 HN ILE 51 -19.411 -1.038 -24.374 123 HA ILE 51 HA ILE 51 -20.215 -0.267 -27.055 124 HB ILE 51 HB ILE 51 -20.072 1.900 -25.810 125 HG12 ILE 51 HG12 ILE 51 -17.834 1.544 -27.831 126 HG13 ILE 51 HG11 ILE 51 -19.542 1.667 -28.261 127 HG21 ILE 51 HG21 ILE 51 -17.693 0.673 -24.804 128 HG22 ILE 51 HG22 ILE 51 -18.403 2.225 -24.357 129 HG23 ILE 51 HG23 ILE 51 -17.240 2.136 -25.680 130 HD11 ILE 51 HD1 ILE 51 -19.689 3.885 -27.632 131 HD12 ILE 51 HD2 ILE 51 -18.027 3.825 -28.217 132 HD13 ILE 51 HD3 ILE 51 -18.356 3.761 -26.485 133 HA PRO 52 HA PRO 52 -16.829 -2.943 -27.907 134 HB2 PRO 52 HB2 PRO 52 -16.191 -1.883 -30.410 135 HB3 PRO 52 HB1 PRO 52 -17.440 -3.106 -30.112 136 HG2 PRO 52 HG2 PRO 52 -17.713 -0.160 -30.459 137 HG3 PRO 52 HG1 PRO 52 -18.766 -1.468 -31.031 138 HD2 PRO 52 HD2 PRO 52 -19.443 0.005 -28.893 139 HD3 PRO 52 HD1 PRO 52 -19.792 -1.735 -28.953 140 H GLN 53 HN GLN 53 -14.690 -2.915 -27.494 141 HA GLN 53 HA GLN 53 -13.280 -1.061 -26.257 142 HB2 GLN 53 HB2 GLN 53 -11.203 -1.888 -27.487 143 HB3 GLN 53 HB1 GLN 53 -12.207 -3.122 -26.717 144 HG2 GLN 53 HG2 GLN 53 -12.873 -2.398 -29.533 145 HG3 GLN 53 HG1 GLN 53 -11.399 -3.331 -29.277 146 HE21 GLN 53 HE21 GLN 53 -12.387 -5.262 -30.251 147 HE22 GLN 53 HE22 GLN 53 -13.567 -6.148 -29.413 148 H VAL 54 HN VAL 54 -14.005 1.020 -26.842 149 HA VAL 54 HA VAL 54 -13.776 2.160 -29.401 150 HB VAL 54 HB VAL 54 -14.108 4.271 -28.333 151 HG11 VAL 54 HG11 VAL 54 -15.573 1.893 -27.460 152 HG12 VAL 54 HG12 VAL 54 -16.187 3.469 -27.963 153 HG13 VAL 54 HG13 VAL 54 -15.682 3.213 -26.293 154 HG21 VAL 54 HG21 VAL 54 -12.730 4.671 -26.574 155 HG22 VAL 54 HG22 VAL 54 -12.609 2.959 -26.168 156 HG23 VAL 54 HG23 VAL 54 -13.986 3.905 -25.600 157 H TYR 55 HN TYR 55 -12.306 4.121 -29.791 158 HA TYR 55 HA TYR 55 -9.650 3.207 -30.001 159 HB2 TYR 55 HB2 TYR 55 -10.755 6.018 -30.188 160 HB3 TYR 55 HB1 TYR 55 -9.128 5.543 -30.678 161 HD1 TYR 55 HD1 TYR 55 -12.732 5.190 -31.408 162 HD2 TYR 55 HD2 TYR 55 -8.743 4.237 -32.687 163 HE1 TYR 55 HE1 TYR 55 -13.612 4.459 -33.607 164 HE2 TYR 55 HE2 TYR 55 -9.625 3.505 -34.886 165 HH TYR 55 HH TYR 55 -11.691 4.001 -36.296 166 H HIS 56 HN HIS 56 -11.179 5.447 -27.699 167 HA HIS 56 HA HIS 56 -9.176 4.831 -25.719 168 HB2 HIS 56 HB2 HIS 56 -8.079 6.587 -27.147 169 HB3 HIS 56 HB1 HIS 56 -9.368 7.693 -26.671 170 HD2 HIS 56 HD2 HIS 56 -8.680 9.102 -24.408 171 HE1 HIS 56 HE1 HIS 56 -5.974 6.320 -22.749 172 HE2 HIS 56 HE2 HIS 56 -7.027 8.610 -22.447 173 H ILE 57 HN ILE 57 -9.913 5.218 -23.663 174 HA ILE 57 HA ILE 57 -12.355 6.829 -23.339 175 HB ILE 57 HB ILE 57 -13.092 4.493 -23.575 176 HG12 ILE 57 HG12 ILE 57 -13.231 5.344 -20.674 177 HG13 ILE 57 HG11 ILE 57 -14.171 6.110 -21.956 178 HG21 ILE 57 HG21 ILE 57 -10.713 3.923 -22.262 179 HG22 ILE 57 HG22 ILE 57 -11.997 2.768 -22.618 180 HG23 ILE 57 HG23 ILE 57 -11.945 3.574 -21.049 181 HD11 ILE 57 HD1 ILE 57 -14.227 3.134 -21.402 182 HD12 ILE 57 HD2 ILE 57 -15.292 4.040 -22.477 183 HD13 ILE 57 HD3 ILE 57 -15.397 4.270 -20.731 184 H ILE 58 HN ILE 58 -12.262 8.127 -21.612 185 HA ILE 58 HA ILE 58 -10.288 7.505 -19.498 186 HB ILE 58 HB ILE 58 -10.963 10.234 -20.622 187 HG12 ILE 58 HG12 ILE 58 -9.545 8.859 -22.112 188 HG13 ILE 58 HG11 ILE 58 -8.621 10.189 -21.409 189 HG21 ILE 58 HG21 ILE 58 -10.480 10.531 -18.321 190 HG22 ILE 58 HG22 ILE 58 -8.945 10.833 -19.136 191 HG23 ILE 58 HG23 ILE 58 -9.231 9.286 -18.337 192 HD11 ILE 58 HD1 ILE 58 -8.427 8.079 -19.561 193 HD12 ILE 58 HD2 ILE 58 -7.156 8.672 -20.632 194 HD13 ILE 58 HD3 ILE 58 -8.192 7.340 -21.145 195 H VAL 59 HN VAL 59 -11.070 7.477 -17.469 196 HA VAL 59 HA VAL 59 -13.750 8.649 -17.033 197 HB VAL 59 HB VAL 59 -12.455 6.285 -15.652 198 HG11 VAL 59 HG11 VAL 59 -14.367 6.128 -14.307 199 HG12 VAL 59 HG12 VAL 59 -15.327 7.142 -15.385 200 HG13 VAL 59 HG13 VAL 59 -14.086 7.867 -14.364 201 HG21 VAL 59 HG21 VAL 59 -14.915 5.613 -16.871 202 HG22 VAL 59 HG22 VAL 59 -13.304 5.095 -17.366 203 HG23 VAL 59 HG23 VAL 59 -14.019 6.545 -18.070 204 H THR 60 HN THR 60 -13.725 10.400 -15.785 205 HA THR 60 HA THR 60 -11.723 10.576 -13.617 206 HB THR 60 HB THR 60 -12.624 12.839 -15.420 207 HG1 THR 60 HG1 THR 60 -10.816 12.500 -16.449 208 HG21 THR 60 HG21 THR 60 -10.319 13.385 -13.795 209 HG22 THR 60 HG22 THR 60 -11.642 12.848 -12.758 210 HG23 THR 60 HG23 THR 60 -11.866 14.232 -13.830 211 H ASP 61 HN ASP 61 -12.526 11.113 -11.655 212 HA ASP 61 HA ASP 61 -15.411 11.511 -11.437 213 HB2 ASP 61 HB2 ASP 61 -14.274 9.895 -9.957 214 HB3 ASP 61 HB1 ASP 61 -13.300 11.205 -9.290 215 H LEU 62 HN LEU 62 -16.095 13.549 -11.724 216 HA LEU 62 HA LEU 62 -14.545 15.871 -11.288 217 HB2 LEU 62 HB2 LEU 62 -16.485 15.871 -12.778 218 HB3 LEU 62 HB1 LEU 62 -17.556 15.560 -11.412 219 HG LEU 62 HG LEU 62 -17.336 18.006 -12.177 220 HD11 LEU 62 HD11 LEU 62 -18.151 18.427 -10.122 221 HD12 LEU 62 HD12 LEU 62 -16.560 18.191 -9.398 222 HD13 LEU 62 HD13 LEU 62 -17.634 16.812 -9.637 223 HD21 LEU 62 HD21 LEU 62 -14.883 17.987 -12.471 224 HD22 LEU 62 HD22 LEU 62 -14.676 17.657 -10.752 225 HD23 LEU 62 HD23 LEU 62 -15.359 19.196 -11.280 226 H SER 63 HN SER 63 -16.991 14.246 -9.298 227 HA SER 63 HA SER 63 -16.878 16.171 -7.182 228 HB2 SER 63 HB2 SER 63 -17.987 13.371 -7.358 229 HB3 SER 63 HB1 SER 63 -18.084 14.351 -5.898 230 HG SER 63 HG SER 63 -19.272 15.867 -7.032 231 H TYR 64 HN TYR 64 -15.856 16.031 -5.191 232 HA TYR 64 HA TYR 64 -13.284 14.889 -5.125 233 HB2 TYR 64 HB2 TYR 64 -13.851 16.795 -3.730 234 HB3 TYR 64 HB1 TYR 64 -15.049 15.838 -2.856 235 HD1 TYR 64 HD1 TYR 64 -11.408 16.043 -3.656 236 HD2 TYR 64 HD2 TYR 64 -14.421 14.488 -1.021 237 HE1 TYR 64 HE1 TYR 64 -9.642 15.237 -2.113 238 HE2 TYR 64 HE2 TYR 64 -12.656 13.682 0.522 239 HH TYR 64 HH TYR 64 -10.135 14.441 0.987 240 H GLY 65 HN GLY 65 -16.312 13.869 -3.564 241 HA2 GLY 65 HA2 GLY 65 -15.071 11.348 -2.730 242 HA3 GLY 65 HA1 GLY 65 -16.661 11.936 -2.245 243 H CYS 66 HN CYS 66 -17.006 9.531 -2.847 244 HA CYS 66 HA CYS 66 -17.146 8.865 -5.642 245 HB2 CYS 66 HB2 CYS 66 -18.076 6.793 -4.927 246 HB3 CYS 66 HB1 CYS 66 -16.870 7.227 -3.715 247 HG CYS 66 HG CYS 66 -19.942 7.285 -3.289 248 H GLY 67 HN GLY 67 -19.236 8.154 -6.640 249 HA2 GLY 67 HA2 GLY 67 -21.340 8.648 -7.429 250 HA3 GLY 67 HA1 GLY 67 -21.756 9.043 -5.765 251 H GLN 68 HN GLN 68 -22.783 10.950 -5.850 252 HA GLN 68 HA GLN 68 -23.238 13.158 -6.286 253 HB2 GLN 68 HB2 GLN 68 -20.215 13.222 -6.311 254 HB3 GLN 68 HB1 GLN 68 -21.230 14.665 -6.337 255 HG2 GLN 68 HG2 GLN 68 -22.273 13.992 -4.217 256 HG3 GLN 68 HG1 GLN 68 -21.299 12.523 -4.190 257 HE21 GLN 68 HE21 GLN 68 -20.721 13.776 -1.988 258 HE22 GLN 68 HE22 GLN 68 -19.351 14.772 -2.086 259 H SER 69 HN SER 69 -20.307 13.448 -8.170 260 HA SER 69 HA SER 69 -21.763 13.156 -10.693 261 HB2 SER 69 HB2 SER 69 -22.113 15.514 -10.057 262 HB3 SER 69 HB1 SER 69 -20.373 15.727 -9.907 263 HG SER 69 HG SER 69 -21.971 15.509 -12.159 264 H PHE 70 HN PHE 70 -20.468 12.675 -12.424 265 HA PHE 70 HA PHE 70 -17.554 12.566 -11.946 266 HB2 PHE 70 HB2 PHE 70 -19.313 10.408 -13.107 267 HB3 PHE 70 HB1 PHE 70 -17.552 10.395 -13.211 268 HD1 PHE 70 HD1 PHE 70 -20.442 10.286 -10.893 269 HD2 PHE 70 HD2 PHE 70 -16.188 9.899 -11.297 270 HE1 PHE 70 HE1 PHE 70 -20.313 9.317 -8.618 271 HE2 PHE 70 HE2 PHE 70 -16.056 8.940 -9.015 272 HZ PHE 70 HZ PHE 70 -18.121 8.648 -7.674 273 H ASP 71 HN ASP 71 -16.241 12.803 -13.766 274 HA ASP 71 HA ASP 71 -17.613 13.630 -16.248 275 HB2 ASP 71 HB2 ASP 71 -16.840 15.626 -15.022 276 HB3 ASP 71 HB1 ASP 71 -15.204 14.973 -14.994 277 H ILE 72 HN ILE 72 -17.049 12.228 -17.804 278 HA ILE 72 HA ILE 72 -14.251 11.218 -17.864 279 HB ILE 72 HB ILE 72 -15.128 9.154 -18.856 280 HG12 ILE 72 HG12 ILE 72 -17.890 10.292 -18.340 281 HG13 ILE 72 HG11 ILE 72 -17.117 10.331 -19.928 282 HG21 ILE 72 HG21 ILE 72 -15.705 8.242 -16.840 283 HG22 ILE 72 HG22 ILE 72 -16.977 9.429 -16.552 284 HG23 ILE 72 HG23 ILE 72 -15.294 9.842 -16.225 285 HD11 ILE 72 HD1 ILE 72 -18.515 8.156 -18.665 286 HD12 ILE 72 HD2 ILE 72 -16.840 7.681 -18.945 287 HD13 ILE 72 HD3 ILE 72 -17.838 8.231 -20.291 288 H VAL 73 HN VAL 73 -13.243 11.091 -19.817 289 HA VAL 73 HA VAL 73 -14.635 12.364 -22.089 290 HB VAL 73 HB VAL 73 -11.796 12.802 -21.134 291 HG11 VAL 73 HG11 VAL 73 -13.199 13.729 -23.651 292 HG12 VAL 73 HG12 VAL 73 -11.846 12.600 -23.568 293 HG13 VAL 73 HG13 VAL 73 -11.617 14.288 -23.109 294 HG21 VAL 73 HG21 VAL 73 -13.348 15.157 -21.716 295 HG22 VAL 73 HG22 VAL 73 -12.648 14.657 -20.175 296 HG23 VAL 73 HG23 VAL 73 -14.266 14.117 -20.626 297 H VAL 74 HN VAL 74 -14.537 11.279 -23.974 298 HA VAL 74 HA VAL 74 -12.506 9.144 -24.244 299 HB VAL 74 HB VAL 74 -14.221 7.737 -25.329 300 HG11 VAL 74 HG11 VAL 74 -15.383 8.577 -22.690 301 HG12 VAL 74 HG12 VAL 74 -13.760 7.888 -22.744 302 HG13 VAL 74 HG13 VAL 74 -15.136 6.953 -23.331 303 HG21 VAL 74 HG21 VAL 74 -16.540 9.153 -24.318 304 HG22 VAL 74 HG22 VAL 74 -16.218 8.581 -25.954 305 HG23 VAL 74 HG23 VAL 74 -15.644 10.169 -25.447 306 H VAL 75 HN VAL 75 -11.996 8.570 -26.458 307 HA VAL 75 HA VAL 75 -12.693 10.697 -28.394 308 HB VAL 75 HB VAL 75 -10.018 9.321 -28.047 309 HG11 VAL 75 HG11 VAL 75 -9.568 9.963 -30.153 310 HG12 VAL 75 HG12 VAL 75 -9.953 11.633 -29.732 311 HG13 VAL 75 HG13 VAL 75 -11.221 10.557 -30.321 312 HG21 VAL 75 HG21 VAL 75 -9.815 10.934 -26.450 313 HG22 VAL 75 HG22 VAL 75 -11.191 11.850 -27.065 314 HG23 VAL 75 HG23 VAL 75 -9.608 12.020 -27.824 315 H SER 76 HN SER 76 -13.691 9.929 -30.150 316 HA SER 76 HA SER 76 -12.868 7.408 -31.334 317 HB2 SER 76 HB2 SER 76 -14.517 6.649 -29.686 318 HB3 SER 76 HB1 SER 76 -15.693 7.803 -30.315 319 HG SER 76 HG SER 76 -16.102 5.900 -31.345 320 H ASP 77 HN ASP 77 -13.615 7.152 -33.481 321 HA ASP 77 HA ASP 77 -13.903 9.569 -34.934 322 HB2 ASP 77 HB2 ASP 77 -14.248 6.675 -35.709 323 HB3 ASP 77 HB1 ASP 77 -14.412 8.007 -36.852 324 H PHE 78 HN PHE 78 -16.148 7.644 -33.278 325 HA PHE 78 HA PHE 78 -18.479 7.875 -34.816 326 HB2 PHE 78 HB2 PHE 78 -18.205 6.501 -32.734 327 HB3 PHE 78 HB1 PHE 78 -18.296 7.997 -31.796 328 HD1 PHE 78 HD1 PHE 78 -20.139 6.072 -34.442 329 HD2 PHE 78 HD2 PHE 78 -20.415 8.825 -31.152 330 HE1 PHE 78 HE1 PHE 78 -22.611 5.982 -34.577 331 HE2 PHE 78 HE2 PHE 78 -22.891 8.729 -31.293 332 HZ PHE 78 HZ PHE 78 -23.981 7.317 -33.016 333 H PHE 79 HN PHE 79 -16.812 10.169 -32.766 334 HA PHE 79 HA PHE 79 -18.995 12.097 -32.844 335 HB2 PHE 79 HB2 PHE 79 -17.669 12.013 -30.826 336 HB3 PHE 79 HB1 PHE 79 -16.183 12.262 -31.741 337 HD1 PHE 79 HD1 PHE 79 -19.500 13.854 -31.036 338 HD2 PHE 79 HD2 PHE 79 -15.386 14.438 -32.119 339 HE1 PHE 79 HE1 PHE 79 -19.799 16.309 -30.854 340 HE2 PHE 79 HE2 PHE 79 -15.689 16.893 -31.939 341 HZ PHE 79 HZ PHE 79 -17.896 17.828 -31.308 342 H GLN 80 HN GLN 80 -16.795 11.113 -35.062 343 HA GLN 80 HA GLN 80 -15.990 13.709 -36.077 344 HB2 GLN 80 HB2 GLN 80 -14.565 11.665 -36.313 345 HB3 GLN 80 HB1 GLN 80 -15.781 10.993 -37.399 346 HG2 GLN 80 HG2 GLN 80 -14.024 12.058 -38.716 347 HG3 GLN 80 HG1 GLN 80 -15.517 12.982 -38.874 348 HE21 GLN 80 HE21 GLN 80 -14.916 15.156 -38.955 349 HE22 GLN 80 HE22 GLN 80 -13.817 15.892 -37.891 350 H GLY 81 HN GLY 81 -17.200 14.945 -37.356 351 HA2 GLY 81 HA2 GLY 81 -18.628 15.525 -39.099 352 HA3 GLY 81 HA1 GLY 81 -18.941 13.812 -39.377 353 H LYS 82 HN LYS 82 -19.298 14.219 -36.168 354 HA LYS 82 HA LYS 82 -22.118 15.064 -36.303 355 HB2 LYS 82 HB2 LYS 82 -21.036 12.522 -35.110 356 HB3 LYS 82 HB1 LYS 82 -22.568 13.213 -34.578 357 HG2 LYS 82 HG2 LYS 82 -23.402 13.151 -36.904 358 HG3 LYS 82 HG1 LYS 82 -21.868 12.457 -37.432 359 HD2 LYS 82 HD2 LYS 82 -22.232 10.492 -36.018 360 HD3 LYS 82 HD1 LYS 82 -23.726 11.194 -35.394 361 HE2 LYS 82 HE2 LYS 82 -24.692 11.182 -37.643 362 HE3 LYS 82 HE1 LYS 82 -23.202 10.503 -38.299 363 HZ1 LYS 82 HZ1 LYS 82 -25.346 9.114 -37.272 364 HZ2 LYS 82 HZ2 LYS 82 -24.136 8.985 -36.086 365 HZ3 LYS 82 HZ3 LYS 82 -23.827 8.478 -37.678 366 H SER 83 HN SER 83 -22.943 16.045 -34.485 367 HA SER 83 HA SER 83 -20.995 17.298 -32.763 368 HB2 SER 83 HB2 SER 83 -24.005 17.479 -32.930 369 HB3 SER 83 HB1 SER 83 -23.054 18.350 -31.731 370 HG SER 83 HG SER 83 -23.397 19.617 -33.586 371 H LYS 84 HN LYS 84 -21.475 17.395 -30.354 372 HA LYS 84 HA LYS 84 -21.198 14.828 -29.241 373 HB2 LYS 84 HB2 LYS 84 -20.381 16.902 -28.159 374 HB3 LYS 84 HB1 LYS 84 -22.050 17.378 -27.845 375 HG2 LYS 84 HG2 LYS 84 -22.392 15.381 -26.470 376 HG3 LYS 84 HG1 LYS 84 -20.758 14.826 -26.836 377 HD2 LYS 84 HD2 LYS 84 -19.834 16.857 -25.761 378 HD3 LYS 84 HD1 LYS 84 -21.471 17.385 -25.367 379 HE2 LYS 84 HE2 LYS 84 -20.261 14.763 -24.449 380 HE3 LYS 84 HE1 LYS 84 -20.328 16.223 -23.464 381 HZ1 LYS 84 HZ1 LYS 84 -22.538 14.523 -24.412 382 HZ2 LYS 84 HZ2 LYS 84 -22.821 16.154 -24.031 383 HZ3 LYS 84 HZ3 LYS 84 -22.225 15.093 -22.846 384 H LEU 85 HN LEU 85 -24.025 16.964 -29.521 385 HA LEU 85 HA LEU 85 -25.793 15.412 -27.961 386 HB2 LEU 85 HB2 LEU 85 -26.251 17.320 -30.253 387 HB3 LEU 85 HB1 LEU 85 -27.570 16.575 -29.350 388 HG LEU 85 HG LEU 85 -27.097 18.751 -28.376 389 HD11 LEU 85 HD11 LEU 85 -27.499 16.640 -26.924 390 HD12 LEU 85 HD12 LEU 85 -26.879 18.084 -26.122 391 HD13 LEU 85 HD13 LEU 85 -25.784 16.762 -26.528 392 HD21 LEU 85 HD21 LEU 85 -24.286 17.785 -27.823 393 HD22 LEU 85 HD22 LEU 85 -24.925 19.421 -27.661 394 HD23 LEU 85 HD23 LEU 85 -24.688 18.721 -29.262 395 H MET 86 HN MET 86 -25.063 15.359 -31.456 396 HA MET 86 HA MET 86 -26.993 13.399 -32.136 397 HB2 MET 86 HB2 MET 86 -24.388 14.192 -33.449 398 HB3 MET 86 HB1 MET 86 -25.524 13.044 -34.159 399 HG2 MET 86 HG2 MET 86 -27.297 14.789 -34.071 400 HG3 MET 86 HG1 MET 86 -26.111 15.921 -33.425 401 HE1 MET 86 HE1 MET 86 -27.379 16.776 -36.817 402 HE2 MET 86 HE2 MET 86 -26.083 17.779 -36.173 403 HE3 MET 86 HE3 MET 86 -27.298 17.115 -35.083 404 H ARG 87 HN ARG 87 -23.564 13.161 -31.269 405 HA ARG 87 HA ARG 87 -23.412 10.330 -31.584 406 HB2 ARG 87 HB2 ARG 87 -21.227 10.483 -30.764 407 HB3 ARG 87 HB1 ARG 87 -21.479 12.070 -31.493 408 HG2 ARG 87 HG2 ARG 87 -21.943 13.061 -29.359 409 HG3 ARG 87 HG1 ARG 87 -21.980 11.482 -28.570 410 HD2 ARG 87 HD2 ARG 87 -19.533 11.334 -29.650 411 HD3 ARG 87 HD1 ARG 87 -19.653 13.087 -29.507 412 HE ARG 87 HE ARG 87 -19.670 12.869 -27.167 413 HH11 ARG 87 HH11 ARG 87 -19.841 9.822 -28.803 414 HH12 ARG 87 HH12 ARG 87 -19.515 8.883 -27.384 415 HH21 ARG 87 HH21 ARG 87 -19.234 11.635 -25.302 416 HH22 ARG 87 HH22 ARG 87 -19.175 9.907 -25.405 417 H SER 88 HN SER 88 -24.215 12.492 -28.947 418 HA SER 88 HA SER 88 -24.039 10.702 -26.796 419 HB2 SER 88 HB2 SER 88 -25.860 13.076 -27.221 420 HB3 SER 88 HB1 SER 88 -25.691 12.222 -25.691 421 HG SER 88 HG SER 88 -23.573 12.834 -25.594 422 H ARG 89 HN ARG 89 -26.669 11.368 -29.072 423 HA ARG 89 HA ARG 89 -28.668 9.828 -27.827 424 HB2 ARG 89 HB2 ARG 89 -29.089 11.407 -29.686 425 HB3 ARG 89 HB1 ARG 89 -28.242 10.318 -30.785 426 HG2 ARG 89 HG2 ARG 89 -29.882 8.527 -30.223 427 HG3 ARG 89 HG1 ARG 89 -30.760 9.682 -29.218 428 HD2 ARG 89 HD2 ARG 89 -30.206 10.057 -32.175 429 HD3 ARG 89 HD1 ARG 89 -31.724 9.456 -31.514 430 HE ARG 89 HE ARG 89 -30.761 12.201 -31.431 431 HH11 ARG 89 HH11 ARG 89 -32.916 9.790 -30.199 432 HH12 ARG 89 HH12 ARG 89 -34.067 10.931 -29.590 433 HH21 ARG 89 HH21 ARG 89 -32.263 13.705 -30.629 434 HH22 ARG 89 HH22 ARG 89 -33.697 13.147 -29.833 435 H ALA 90 HN ALA 90 -26.237 8.943 -30.287 436 HA ALA 90 HA ALA 90 -27.093 6.263 -30.611 437 HB1 ALA 90 HB1 ALA 90 -25.508 7.569 -32.103 438 HB2 ALA 90 HB2 ALA 90 -25.029 5.909 -31.747 439 HB3 ALA 90 HB3 ALA 90 -24.255 7.250 -30.902 440 H VAL 91 HN VAL 91 -24.655 7.727 -28.503 441 HA VAL 91 HA VAL 91 -23.853 5.258 -27.286 442 HB VAL 91 HB VAL 91 -22.391 7.258 -27.376 443 HG11 VAL 91 HG11 VAL 91 -24.270 8.346 -25.267 444 HG12 VAL 91 HG12 VAL 91 -24.217 8.900 -26.940 445 HG13 VAL 91 HG13 VAL 91 -22.817 9.129 -25.891 446 HG21 VAL 91 HG21 VAL 91 -23.141 6.002 -24.739 447 HG22 VAL 91 HG22 VAL 91 -21.823 7.170 -24.843 448 HG23 VAL 91 HG23 VAL 91 -21.743 5.665 -25.759 449 H ASN 92 HN ASN 92 -26.215 7.760 -26.548 450 HA ASN 92 HA ASN 92 -26.784 7.046 -23.893 451 HB2 ASN 92 HB2 ASN 92 -28.515 8.298 -26.032 452 HB3 ASN 92 HB1 ASN 92 -29.032 8.104 -24.357 453 HD21 ASN 92 HD21 ASN 92 -26.702 8.758 -22.945 454 HD22 ASN 92 HD22 ASN 92 -26.263 10.363 -23.280 455 H LYS 93 HN LYS 93 -28.105 5.857 -26.966 456 HA LYS 93 HA LYS 93 -30.099 4.183 -25.841 457 HB2 LYS 93 HB2 LYS 93 -28.596 4.062 -28.459 458 HB3 LYS 93 HB1 LYS 93 -29.930 2.980 -28.056 459 HG2 LYS 93 HG2 LYS 93 -30.122 6.001 -28.010 460 HG3 LYS 93 HG1 LYS 93 -30.639 5.003 -29.370 461 HD2 LYS 93 HD2 LYS 93 -32.205 3.802 -27.873 462 HD3 LYS 93 HD1 LYS 93 -31.706 4.839 -26.536 463 HE2 LYS 93 HE2 LYS 93 -32.486 6.823 -27.781 464 HE3 LYS 93 HE1 LYS 93 -32.989 5.786 -29.117 465 HZ1 LYS 93 HZ1 LYS 93 -34.078 4.751 -26.765 466 HZ2 LYS 93 HZ2 LYS 93 -34.897 5.449 -28.080 467 HZ3 LYS 93 HZ3 LYS 93 -34.398 6.417 -26.776 468 H ALA 94 HN ALA 94 -26.708 3.623 -26.701 469 HA ALA 94 HA ALA 94 -26.669 0.844 -26.179 470 HB1 ALA 94 HB1 ALA 94 -24.308 2.683 -25.807 471 HB2 ALA 94 HB2 ALA 94 -24.919 2.257 -27.406 472 HB3 ALA 94 HB3 ALA 94 -24.315 0.998 -26.329 473 H VAL 95 HN VAL 95 -26.070 3.659 -24.130 474 HA VAL 95 HA VAL 95 -25.896 1.856 -21.794 475 HB VAL 95 HB VAL 95 -24.599 3.576 -20.684 476 HG11 VAL 95 HG11 VAL 95 -22.984 2.389 -21.760 477 HG12 VAL 95 HG12 VAL 95 -22.836 3.836 -22.756 478 HG13 VAL 95 HG13 VAL 95 -23.815 2.479 -23.313 479 HG21 VAL 95 HG21 VAL 95 -24.229 5.316 -23.006 480 HG22 VAL 95 HG22 VAL 95 -24.592 5.743 -21.333 481 HG23 VAL 95 HG23 VAL 95 -25.899 5.308 -22.435 482 H LYS 96 HN LYS 96 -28.280 3.153 -23.207 483 HA LYS 96 HA LYS 96 -29.357 5.216 -21.667 484 HB2 LYS 96 HB2 LYS 96 -31.547 4.460 -22.520 485 HB3 LYS 96 HB1 LYS 96 -30.333 4.480 -23.799 486 HG2 LYS 96 HG2 LYS 96 -29.959 2.046 -23.451 487 HG3 LYS 96 HG1 LYS 96 -31.232 2.046 -22.230 488 HD2 LYS 96 HD2 LYS 96 -32.869 2.790 -23.906 489 HD3 LYS 96 HD1 LYS 96 -31.605 2.840 -25.135 490 HE2 LYS 96 HE2 LYS 96 -31.217 0.423 -24.839 491 HE3 LYS 96 HE1 LYS 96 -32.487 0.368 -23.616 492 HZ1 LYS 96 HZ1 LYS 96 -32.697 0.650 -26.512 493 HZ2 LYS 96 HZ2 LYS 96 -33.826 1.503 -25.573 494 HZ3 LYS 96 HZ3 LYS 96 -33.701 -0.187 -25.431 495 H GLU 97 HN GLU 97 -29.409 1.718 -21.147 496 HA GLU 97 HA GLU 97 -31.212 1.735 -18.959 497 HB2 GLU 97 HB2 GLU 97 -29.033 -0.195 -19.774 498 HB3 GLU 97 HB1 GLU 97 -30.135 -0.489 -18.429 499 HG2 GLU 97 HG2 GLU 97 -32.060 -0.329 -19.931 500 HG3 GLU 97 HG1 GLU 97 -30.996 0.055 -21.284 501 H GLU 98 HN GLU 98 -27.692 1.991 -19.174 502 HA GLU 98 HA GLU 98 -27.220 2.005 -16.360 503 HB2 GLU 98 HB2 GLU 98 -25.530 1.526 -18.228 504 HB3 GLU 98 HB1 GLU 98 -25.415 3.277 -18.411 505 HG2 GLU 98 HG2 GLU 98 -23.676 2.531 -16.874 506 HG3 GLU 98 HG1 GLU 98 -24.880 3.451 -15.974 507 H LEU 99 HN LEU 99 -28.138 4.424 -18.680 508 HA LEU 99 HA LEU 99 -27.318 6.740 -17.321 509 HB2 LEU 99 HB2 LEU 99 -29.634 6.241 -19.199 510 HB3 LEU 99 HB1 LEU 99 -29.194 7.842 -18.604 511 HG LEU 99 HG LEU 99 -27.255 6.008 -20.036 512 HD11 LEU 99 HD11 LEU 99 -28.071 6.686 -22.027 513 HD12 LEU 99 HD12 LEU 99 -28.079 8.372 -21.509 514 HD13 LEU 99 HD13 LEU 99 -29.463 7.336 -21.159 515 HD21 LEU 99 HD21 LEU 99 -25.845 7.533 -19.103 516 HD22 LEU 99 HD22 LEU 99 -27.148 8.672 -18.767 517 HD23 LEU 99 HD23 LEU 99 -26.434 8.599 -20.378 518 H GLN 100 HN GLN 100 -30.268 4.788 -17.026 519 HA GLN 100 HA GLN 100 -31.702 6.522 -15.332 520 HB2 GLN 100 HB2 GLN 100 -32.706 4.561 -16.441 521 HB3 GLN 100 HB1 GLN 100 -31.733 3.493 -15.430 522 HG2 GLN 100 HG2 GLN 100 -32.812 4.369 -13.416 523 HG3 GLN 100 HG1 GLN 100 -33.745 5.505 -14.387 524 HE21 GLN 100 HE21 GLN 100 -35.066 3.586 -12.745 525 HE22 GLN 100 HE22 GLN 100 -35.843 2.459 -13.749 526 H GLU 101 HN GLU 101 -29.336 3.969 -14.630 527 HA GLU 101 HA GLU 101 -29.546 4.292 -11.773 528 HB2 GLU 101 HB2 GLU 101 -28.854 2.145 -12.844 529 HB3 GLU 101 HB1 GLU 101 -27.361 2.929 -13.363 530 HG2 GLU 101 HG2 GLU 101 -26.765 3.396 -11.036 531 HG3 GLU 101 HG1 GLU 101 -28.281 2.685 -10.485 532 H ILE 102 HN ILE 102 -27.559 5.565 -14.352 533 HA ILE 102 HA ILE 102 -25.621 6.761 -12.569 534 HB ILE 102 HB ILE 102 -26.114 7.123 -15.530 535 HG12 ILE 102 HG12 ILE 102 -23.912 5.632 -14.079 536 HG13 ILE 102 HG11 ILE 102 -25.355 4.851 -14.729 537 HG21 ILE 102 HG21 ILE 102 -23.636 7.880 -14.002 538 HG22 ILE 102 HG22 ILE 102 -24.963 9.021 -14.227 539 HG23 ILE 102 HG23 ILE 102 -24.118 8.361 -15.628 540 HD11 ILE 102 HD1 ILE 102 -23.951 6.659 -16.599 541 HD12 ILE 102 HD2 ILE 102 -24.658 5.068 -16.889 542 HD13 ILE 102 HD3 ILE 102 -23.061 5.203 -16.152 543 H HIS 103 HN HIS 103 -25.713 8.720 -11.655 544 HA HIS 103 HA HIS 103 -27.642 10.676 -12.733 545 HB2 HIS 103 HB2 HIS 103 -28.575 9.505 -10.716 546 HB3 HIS 103 HB1 HIS 103 -27.222 10.148 -9.783 547 HD2 HIS 103 HD2 HIS 103 -30.619 11.362 -11.254 548 HE1 HIS 103 HE1 HIS 103 -28.754 14.700 -9.466 549 HE2 HIS 103 HE2 HIS 103 -30.906 13.848 -10.510 550 H ALA 104 HN ALA 104 -26.435 12.312 -13.428 551 HA ALA 104 HA ALA 104 -25.153 14.252 -13.128 552 HB1 ALA 104 HB1 ALA 104 -24.469 14.824 -11.053 553 HB2 ALA 104 HB2 ALA 104 -23.595 13.309 -10.832 554 HB3 ALA 104 HB3 ALA 104 -25.330 13.377 -10.529 555 H PHE 105 HN PHE 105 -24.503 12.363 -14.897 556 HA PHE 105 HA PHE 105 -21.560 12.194 -14.682 557 HB2 PHE 105 HB2 PHE 105 -23.508 10.101 -15.656 558 HB3 PHE 105 HB1 PHE 105 -21.782 10.047 -16.017 559 HD1 PHE 105 HD1 PHE 105 -24.115 10.473 -13.106 560 HD2 PHE 105 HD2 PHE 105 -20.344 8.979 -14.519 561 HE1 PHE 105 HE1 PHE 105 -23.682 9.462 -10.884 562 HE2 PHE 105 HE2 PHE 105 -19.909 7.974 -12.293 563 HZ PHE 105 HZ PHE 105 -21.578 8.216 -10.476 564 H SER 106 HN SER 106 -20.409 12.455 -16.620 565 HA SER 106 HA SER 106 -21.996 13.334 -18.956 566 HB2 SER 106 HB2 SER 106 -20.333 15.109 -19.356 567 HB3 SER 106 HB1 SER 106 -21.124 15.318 -17.794 568 HG SER 106 HG SER 106 -18.653 13.969 -18.185 569 H CYS 107 HN CYS 107 -21.050 12.940 -20.985 570 HA CYS 107 HA CYS 107 -18.629 11.244 -20.970 571 HB2 CYS 107 HB2 CYS 107 -19.692 9.843 -22.731 572 HB3 CYS 107 HB1 CYS 107 -20.540 9.753 -21.187 573 HG CYS 107 HG CYS 107 -21.662 10.959 -23.771 574 H LYS 108 HN LYS 108 -17.724 13.432 -21.542 575 HA LYS 108 HA LYS 108 -18.389 14.605 -24.063 576 HB2 LYS 108 HB2 LYS 108 -15.997 14.929 -22.243 577 HB3 LYS 108 HB1 LYS 108 -16.254 15.883 -23.703 578 HG2 LYS 108 HG2 LYS 108 -18.399 16.691 -22.817 579 HG3 LYS 108 HG1 LYS 108 -18.176 15.719 -21.361 580 HD2 LYS 108 HD2 LYS 108 -16.096 16.975 -20.862 581 HD3 LYS 108 HD1 LYS 108 -16.372 17.975 -22.289 582 HE2 LYS 108 HE2 LYS 108 -18.268 17.729 -19.935 583 HE3 LYS 108 HE1 LYS 108 -17.185 19.089 -20.233 584 HZ1 LYS 108 HZ1 LYS 108 -18.493 19.886 -21.848 585 HZ2 LYS 108 HZ2 LYS 108 -19.706 18.952 -21.113 586 HZ3 LYS 108 HZ3 LYS 108 -18.869 18.352 -22.465 587 H CYS 109 HN CYS 109 -17.525 14.264 -26.060 588 HA CYS 109 HA CYS 109 -15.170 12.524 -26.302 589 HB2 CYS 109 HB2 CYS 109 -17.281 11.148 -26.513 590 HB3 CYS 109 HB1 CYS 109 -17.656 12.088 -27.957 591 HG CYS 109 HG CYS 109 -16.184 9.788 -28.371 592 H TYR 110 HN TYR 110 -13.821 13.047 -27.998 593 HA TYR 110 HA TYR 110 -14.807 14.863 -30.072 594 HB2 TYR 110 HB2 TYR 110 -12.914 16.398 -29.750 595 HB3 TYR 110 HB1 TYR 110 -13.921 16.335 -28.303 596 HD1 TYR 110 HD1 TYR 110 -10.708 15.305 -29.800 597 HD2 TYR 110 HD2 TYR 110 -13.137 15.281 -26.258 598 HE1 TYR 110 HE1 TYR 110 -8.747 14.590 -28.462 599 HE2 TYR 110 HE2 TYR 110 -11.176 14.564 -24.919 600 HH TYR 110 HH TYR 110 -8.116 14.857 -25.839 601 H THR 111 HN THR 111 -13.347 15.006 -31.894 602 HA THR 111 HA THR 111 -11.114 13.149 -32.008 603 HB THR 111 HB THR 111 -13.616 12.761 -33.663 604 HG1 THR 111 HG1 THR 111 -12.609 11.656 -31.452 605 HG21 THR 111 HG21 THR 111 -11.790 12.550 -35.189 606 HG22 THR 111 HG22 THR 111 -12.225 10.907 -34.716 607 HG23 THR 111 HG23 THR 111 -10.812 11.684 -34.003 608 H GLU 112 HN GLU 112 -9.957 15.094 -32.381 609 HA GLU 112 HA GLU 112 -8.827 16.520 -33.789 610 HB2 GLU 112 HB2 GLU 112 -10.541 15.182 -35.898 611 HB3 GLU 112 HB1 GLU 112 -9.292 16.377 -36.253 612 HG2 GLU 112 HG2 GLU 112 -7.592 14.961 -35.221 613 HG3 GLU 112 HG1 GLU 112 -8.820 13.784 -34.758 614 H GLU 113 HN GLU 113 -12.314 16.381 -33.832 615 HA GLU 113 HA GLU 113 -12.811 18.891 -35.044 616 HB2 GLU 113 HB2 GLU 113 -14.453 17.273 -33.084 617 HB3 GLU 113 HB1 GLU 113 -15.028 18.714 -33.925 618 HG2 GLU 113 HG2 GLU 113 -13.963 16.241 -35.317 619 HG3 GLU 113 HG1 GLU 113 -15.676 16.573 -35.065 620 H GLU 114 HN GLU 114 -12.154 17.886 -31.725 621 HA GLU 114 HA GLU 114 -12.882 20.172 -30.333 622 HB2 GLU 114 HB2 GLU 114 -11.268 19.489 -28.640 623 HB3 GLU 114 HB1 GLU 114 -12.050 18.053 -29.301 624 HG2 GLU 114 HG2 GLU 114 -10.136 17.692 -30.808 625 HG3 GLU 114 HG1 GLU 114 -9.352 19.133 -30.164 626 H TRP 115 HN TRP 115 -10.360 19.735 -32.627 627 HA TRP 115 HA TRP 115 -8.608 21.819 -31.802 628 HB2 TRP 115 HB2 TRP 115 -7.440 21.374 -33.747 629 HB3 TRP 115 HB1 TRP 115 -8.333 19.860 -33.579 630 HD1 TRP 115 HD1 TRP 115 -11.097 20.472 -34.652 631 HE1 TRP 115 HE1 TRP 115 -11.511 21.159 -37.102 632 HE3 TRP 115 HE3 TRP 115 -6.449 22.194 -35.884 633 HZ2 TRP 115 HZ2 TRP 115 -10.063 22.286 -39.294 634 HZ3 TRP 115 HZ3 TRP 115 -5.996 23.067 -38.159 635 HH2 TRP 115 HH2 TRP 115 -7.795 23.115 -39.863 636 H SER 116 HN SER 116 -11.755 22.010 -32.662 637 HA SER 116 HA SER 116 -11.891 24.059 -34.564 638 HB2 SER 116 HB2 SER 116 -13.776 23.296 -32.333 639 HB3 SER 116 HB1 SER 116 -14.148 24.537 -33.527 640 HG SER 116 HG SER 116 -13.739 21.769 -33.874 641 H LYS 117 HN LYS 117 -11.057 24.109 -31.211 642 HA LYS 117 HA LYS 117 -11.652 26.784 -30.558 643 HB2 LYS 117 HB2 LYS 117 -9.521 24.898 -29.529 644 HB3 LYS 117 HB1 LYS 117 -9.842 26.483 -28.824 645 HG2 LYS 117 HG2 LYS 117 -11.952 24.337 -29.163 646 HG3 LYS 117 HG1 LYS 117 -11.042 24.588 -27.674 647 HD2 LYS 117 HD2 LYS 117 -12.674 26.756 -29.026 648 HD3 LYS 117 HD1 LYS 117 -13.285 25.743 -27.716 649 HE2 LYS 117 HE2 LYS 117 -11.384 26.499 -26.291 650 HE3 LYS 117 HE1 LYS 117 -10.880 27.585 -27.587 651 HZ1 LYS 117 HZ1 LYS 117 -13.083 27.822 -25.732 652 HZ2 LYS 117 HZ2 LYS 117 -13.474 28.196 -27.342 653 HZ3 LYS 117 HZ3 LYS 117 -12.220 29.029 -26.553 654 H ILE 118 HN ILE 118 -8.828 25.299 -32.080 655 HA ILE 118 HA ILE 118 -7.280 27.716 -32.132 656 HB ILE 118 HB ILE 118 -7.007 25.126 -33.675 657 HG12 ILE 118 HG12 ILE 118 -5.401 26.186 -31.334 658 HG13 ILE 118 HG11 ILE 118 -6.769 25.087 -31.146 659 HG21 ILE 118 HG21 ILE 118 -5.960 27.337 -34.613 660 HG22 ILE 118 HG22 ILE 118 -4.955 25.892 -34.499 661 HG23 ILE 118 HG23 ILE 118 -4.824 27.155 -33.276 662 HD11 ILE 118 HD1 ILE 118 -4.317 24.128 -31.359 663 HD12 ILE 118 HD2 ILE 118 -4.595 24.375 -33.083 664 HD13 ILE 118 HD3 ILE 118 -5.661 23.315 -32.162 665 H VAL 119 HN VAL 119 -7.279 29.319 -33.604 666 HA VAL 119 HA VAL 119 -9.341 29.407 -35.590 667 HB VAL 119 HB VAL 119 -6.995 31.249 -35.074 668 HG11 VAL 119 HG11 VAL 119 -8.026 32.818 -36.519 669 HG12 VAL 119 HG12 VAL 119 -9.534 31.905 -36.569 670 HG13 VAL 119 HG13 VAL 119 -8.103 31.292 -37.400 671 HG21 VAL 119 HG21 VAL 119 -8.413 32.480 -33.682 672 HG22 VAL 119 HG22 VAL 119 -8.905 30.827 -33.314 673 HG23 VAL 119 HG23 VAL 119 -9.873 31.811 -34.412 674 H VAL 120 HN VAL 120 -9.033 27.833 -37.142 675 HA VAL 120 HA VAL 120 -6.673 28.214 -38.873 676 HB VAL 120 HB VAL 120 -7.922 25.598 -38.009 677 HG11 VAL 120 HG11 VAL 120 -5.584 25.176 -39.531 678 HG12 VAL 120 HG12 VAL 120 -6.551 26.333 -40.447 679 HG13 VAL 120 HG13 VAL 120 -7.239 24.774 -39.991 680 HG21 VAL 120 HG21 VAL 120 -6.320 26.617 -36.420 681 HG22 VAL 120 HG22 VAL 120 -5.125 26.740 -37.712 682 HG23 VAL 120 HG23 VAL 120 -5.654 25.155 -37.148 683 H LEU 121 HN LEU 121 -7.184 28.606 -40.937 684 HA LEU 121 HA LEU 121 -8.580 29.118 -42.722 685 HB2 LEU 121 HB2 LEU 121 -8.323 26.276 -42.296 686 HB3 LEU 121 HB1 LEU 121 -9.873 26.645 -43.051 687 HG LEU 121 HG LEU 121 -7.916 26.286 -44.655 688 HD11 LEU 121 HD11 LEU 121 -9.450 27.349 -45.928 689 HD12 LEU 121 HD12 LEU 121 -8.550 28.830 -45.600 690 HD13 LEU 121 HD13 LEU 121 -9.933 28.397 -44.595 691 HD21 LEU 121 HD21 LEU 121 -6.683 28.102 -42.921 692 HD22 LEU 121 HD22 LEU 121 -7.020 29.048 -44.371 693 HD23 LEU 121 HD23 LEU 121 -6.064 27.570 -44.484 694 H GLU 122 HN GLU 122 -9.821 29.281 -39.902 695 HA GLU 122 HA GLU 122 -12.551 28.556 -40.113 696 HB2 GLU 122 HB2 GLU 122 -11.133 30.603 -38.397 697 HB3 GLU 122 HB1 GLU 122 -12.847 30.221 -38.238 698 HG2 GLU 122 HG2 GLU 122 -12.302 27.867 -37.796 699 HG3 GLU 122 HG1 GLU 122 -10.586 28.211 -38.008 700 H HIS 123 HN HIS 123 -10.774 31.507 -40.901 701 HA HIS 123 HA HIS 123 -11.489 33.502 -41.843 702 HB2 HIS 123 HB2 HIS 123 -12.775 31.382 -43.572 703 HB3 HIS 123 HB1 HIS 123 -12.710 33.089 -44.009 704 HD2 HIS 123 HD2 HIS 123 -9.440 32.770 -42.414 705 HE1 HIS 123 HE1 HIS 123 -8.738 31.226 -46.280 706 HE2 HIS 123 HE2 HIS 123 -7.627 32.097 -44.168 707 H HIS 124 HN HIS 124 -14.267 33.058 -43.383 708 HA HIS 124 HA HIS 124 -16.229 34.287 -42.917 709 HB2 HIS 124 HB2 HIS 124 -16.286 31.693 -41.376 710 HB3 HIS 124 HB1 HIS 124 -17.705 32.719 -41.574 711 HD2 HIS 124 HD2 HIS 124 -16.204 33.237 -44.856 712 HE1 HIS 124 HE1 HIS 124 -18.126 29.507 -45.318 713 HE2 HIS 124 HE2 HIS 124 -17.061 31.450 -46.557 714 H HIS 125 HN HIS 125 -16.307 32.782 -39.784 715 HA HIS 125 HA HIS 125 -15.567 35.274 -38.434 716 HB2 HIS 125 HB2 HIS 125 -18.052 35.327 -38.956 717 HB3 HIS 125 HB1 HIS 125 -18.221 33.940 -37.880 718 HD2 HIS 125 HD2 HIS 125 -17.672 37.790 -37.652 719 HE1 HIS 125 HE1 HIS 125 -17.626 36.273 -33.715 720 HE2 HIS 125 HE2 HIS 125 -17.664 38.392 -35.112 721 H HIS 126 HN HIS 126 -14.650 34.929 -36.466 722 HA HIS 126 HA HIS 126 -13.756 32.359 -35.753 723 HB2 HIS 126 HB2 HIS 126 -12.605 34.412 -35.052 724 HB3 HIS 126 HB1 HIS 126 -13.977 34.839 -34.030 725 HD2 HIS 126 HD2 HIS 126 -13.803 33.790 -31.476 726 HE1 HIS 126 HE1 HIS 126 -10.885 30.838 -32.251 727 HE2 HIS 126 HE2 HIS 126 -12.281 31.938 -30.438 728 H HIS 127 HN HIS 127 -16.359 34.359 -34.386 729 HA HIS 127 HA HIS 127 -17.295 32.016 -32.858 730 HB2 HIS 127 HB2 HIS 127 -16.917 34.054 -31.541 731 HB3 HIS 127 HB1 HIS 127 -18.017 34.947 -32.591 732 HD2 HIS 127 HD2 HIS 127 -20.685 34.756 -31.843 733 HE1 HIS 127 HE1 HIS 127 -20.286 31.552 -29.122 734 HE2 HIS 127 HE2 HIS 127 -21.901 33.261 -30.081 735 H HIS 128 HN HIS 128 -18.881 30.875 -33.755 736 HA HIS 128 HA HIS 128 -20.485 30.337 -35.370 737 HB2 HIS 128 HB2 HIS 128 -21.674 32.499 -33.632 738 HB3 HIS 128 HB1 HIS 128 -22.628 31.596 -34.807 739 HD2 HIS 128 HD2 HIS 128 -21.371 31.180 -31.211 740 HE1 HIS 128 HE1 HIS 128 -22.591 27.346 -32.483 741 HE2 HIS 128 HE2 HIS 128 -21.894 28.731 -30.474 Start of MODEL 16 1 H1 MET 36 HT1 MET 36 -25.921 -1.183 -10.593 2 H2 MET 36 HT2 MET 36 -26.317 -0.506 -9.087 3 H3 MET 36 HT3 MET 36 -27.056 -1.949 -9.594 4 HA MET 36 HA MET 36 -25.382 -2.459 -7.970 5 HB2 MET 36 HB2 MET 36 -24.323 -3.169 -10.716 6 HB3 MET 36 HB1 MET 36 -24.188 -4.112 -9.232 7 HG2 MET 36 HG2 MET 36 -26.606 -4.461 -9.190 8 HG3 MET 36 HG1 MET 36 -26.801 -3.440 -10.615 9 HE1 MET 36 HE1 MET 36 -25.294 -6.249 -8.944 10 HE2 MET 36 HE2 MET 36 -23.969 -6.566 -10.061 11 HE3 MET 36 HE3 MET 36 -25.375 -7.628 -10.051 12 HA PRO 37 HA PRO 37 -21.641 -0.192 -7.550 13 HB2 PRO 37 HB2 PRO 37 -19.968 -2.622 -7.939 14 HB3 PRO 37 HB1 PRO 37 -20.079 -1.540 -6.536 15 HG2 PRO 37 HG2 PRO 37 -21.142 -3.970 -6.472 16 HG3 PRO 37 HG1 PRO 37 -21.956 -2.592 -5.705 17 HD2 PRO 37 HD2 PRO 37 -22.578 -3.923 -8.328 18 HD3 PRO 37 HD1 PRO 37 -23.694 -3.315 -7.080 19 H VAL 38 HN VAL 38 -20.074 0.903 -8.740 20 HA VAL 38 HA VAL 38 -19.497 -0.098 -11.454 21 HB VAL 38 HB VAL 38 -21.240 1.619 -11.630 22 HG11 VAL 38 HG11 VAL 38 -20.149 4.015 -10.958 23 HG12 VAL 38 HG12 VAL 38 -19.431 2.988 -9.717 24 HG13 VAL 38 HG13 VAL 38 -21.185 3.084 -9.874 25 HG21 VAL 38 HG21 VAL 38 -18.680 1.670 -12.873 26 HG22 VAL 38 HG22 VAL 38 -19.133 3.346 -12.575 27 HG23 VAL 38 HG23 VAL 38 -20.196 2.300 -13.515 28 H THR 39 HN THR 39 -17.444 0.205 -12.154 29 HA THR 39 HA THR 39 -15.572 1.457 -10.241 30 HB THR 39 HB THR 39 -15.057 -0.726 -12.279 31 HG1 THR 39 HG1 THR 39 -16.140 -0.845 -9.920 32 HG21 THR 39 HG21 THR 39 -13.125 0.767 -11.884 33 HG22 THR 39 HG22 THR 39 -12.847 -0.842 -11.217 34 HG23 THR 39 HG23 THR 39 -13.284 0.492 -10.150 35 H GLU 40 HN GLU 40 -14.360 3.132 -10.906 36 HA GLU 40 HA GLU 40 -14.918 4.494 -13.296 37 HB2 GLU 40 HB2 GLU 40 -13.939 5.574 -11.306 38 HB3 GLU 40 HB1 GLU 40 -12.449 4.669 -11.552 39 HG2 GLU 40 HG2 GLU 40 -12.143 5.734 -13.749 40 HG3 GLU 40 HG1 GLU 40 -13.653 6.619 -13.538 41 H GLN 41 HN GLN 41 -12.214 2.327 -12.440 42 HA GLN 41 HA GLN 41 -10.838 2.593 -14.901 43 HB2 GLN 41 HB2 GLN 41 -10.873 0.408 -12.810 44 HB3 GLN 41 HB1 GLN 41 -9.803 0.379 -14.212 45 HG2 GLN 41 HG2 GLN 41 -8.528 1.384 -12.465 46 HG3 GLN 41 HG1 GLN 41 -9.043 2.718 -13.497 47 HE21 GLN 41 HE21 GLN 41 -9.403 4.427 -12.045 48 HE22 GLN 41 HE22 GLN 41 -10.385 4.318 -10.666 49 H GLY 42 HN GLY 42 -13.262 0.285 -13.748 50 HA2 GLY 42 HA2 GLY 42 -13.322 -1.352 -16.067 51 HA3 GLY 42 HA1 GLY 42 -14.573 -1.267 -14.828 52 H LEU 43 HN LEU 43 -15.080 1.513 -15.067 53 HA LEU 43 HA LEU 43 -17.076 1.528 -17.044 54 HB2 LEU 43 HB2 LEU 43 -17.136 2.962 -15.030 55 HB3 LEU 43 HB1 LEU 43 -15.777 3.890 -15.667 56 HG LEU 43 HG LEU 43 -17.091 4.511 -17.636 57 HD11 LEU 43 HD11 LEU 43 -19.490 3.905 -17.738 58 HD12 LEU 43 HD12 LEU 43 -19.286 2.908 -16.296 59 HD13 LEU 43 HD13 LEU 43 -18.451 2.479 -17.793 60 HD21 LEU 43 HD21 LEU 43 -19.026 5.082 -15.452 61 HD22 LEU 43 HD22 LEU 43 -18.229 6.191 -16.565 62 HD23 LEU 43 HD23 LEU 43 -17.355 5.570 -15.166 63 H ARG 44 HN ARG 44 -13.795 2.830 -17.039 64 HA ARG 44 HA ARG 44 -13.930 4.230 -19.465 65 HB2 ARG 44 HB2 ARG 44 -12.052 4.400 -17.853 66 HB3 ARG 44 HB1 ARG 44 -11.557 2.763 -18.281 67 HG2 ARG 44 HG2 ARG 44 -11.197 3.444 -20.604 68 HG3 ARG 44 HG1 ARG 44 -11.761 5.074 -20.232 69 HD2 ARG 44 HD2 ARG 44 -9.318 5.034 -20.230 70 HD3 ARG 44 HD1 ARG 44 -9.908 5.318 -18.596 71 HE ARG 44 HE ARG 44 -9.080 3.223 -17.974 72 HH11 ARG 44 HH11 ARG 44 -9.027 3.664 -21.406 73 HH12 ARG 44 HH12 ARG 44 -8.070 2.252 -21.711 74 HH21 ARG 44 HH21 ARG 44 -7.831 1.372 -18.364 75 HH22 ARG 44 HH22 ARG 44 -7.393 0.953 -19.987 76 H GLU 45 HN GLU 45 -13.159 0.841 -18.771 77 HA GLU 45 HA GLU 45 -12.517 0.096 -21.420 78 HB2 GLU 45 HB2 GLU 45 -13.531 -1.533 -19.073 79 HB3 GLU 45 HB1 GLU 45 -12.989 -2.237 -20.596 80 HG2 GLU 45 HG2 GLU 45 -11.293 -0.430 -18.845 81 HG3 GLU 45 HG1 GLU 45 -11.197 -2.193 -18.850 82 H ARG 46 HN ARG 46 -15.538 0.131 -19.592 83 HA ARG 46 HA ARG 46 -17.121 -1.165 -21.550 84 HB2 ARG 46 HB2 ARG 46 -17.848 0.728 -19.296 85 HB3 ARG 46 HB1 ARG 46 -19.038 -0.118 -20.287 86 HG2 ARG 46 HG2 ARG 46 -16.849 -1.498 -18.699 87 HG3 ARG 46 HG1 ARG 46 -18.514 -1.308 -18.140 88 HD2 ARG 46 HD2 ARG 46 -19.299 -2.521 -20.166 89 HD3 ARG 46 HD1 ARG 46 -17.622 -2.772 -20.642 90 HE ARG 46 HE ARG 46 -17.998 -3.731 -18.005 91 HH11 ARG 46 HH11 ARG 46 -18.849 -4.384 -21.295 92 HH12 ARG 46 HH12 ARG 46 -18.999 -6.094 -21.062 93 HH21 ARG 46 HH21 ARG 46 -18.192 -5.974 -17.692 94 HH22 ARG 46 HH22 ARG 46 -18.627 -6.994 -19.023 95 H ILE 47 HN ILE 47 -16.349 2.200 -20.861 96 HA ILE 47 HA ILE 47 -18.072 3.346 -22.772 97 HB ILE 47 HB ILE 47 -15.512 4.372 -21.541 98 HG12 ILE 47 HG12 ILE 47 -17.425 3.986 -20.024 99 HG13 ILE 47 HG11 ILE 47 -17.055 5.706 -20.189 100 HG21 ILE 47 HG21 ILE 47 -17.605 5.940 -23.054 101 HG22 ILE 47 HG22 ILE 47 -16.091 5.402 -23.782 102 HG23 ILE 47 HG23 ILE 47 -16.069 6.531 -22.427 103 HD11 ILE 47 HD1 ILE 47 -19.489 4.257 -20.905 104 HD12 ILE 47 HD2 ILE 47 -18.867 5.210 -22.254 105 HD13 ILE 47 HD3 ILE 47 -19.237 5.991 -20.715 106 H GLU 48 HN GLU 48 -14.704 2.328 -22.899 107 HA GLU 48 HA GLU 48 -14.107 3.212 -25.500 108 HB2 GLU 48 HB2 GLU 48 -12.391 2.470 -23.907 109 HB3 GLU 48 HB1 GLU 48 -13.006 0.817 -23.986 110 HG2 GLU 48 HG2 GLU 48 -12.190 2.302 -26.490 111 HG3 GLU 48 HG1 GLU 48 -10.984 1.465 -25.512 112 H SER 49 HN SER 49 -15.551 0.221 -24.290 113 HA SER 49 HA SER 49 -15.740 -0.932 -26.936 114 HB2 SER 49 HB2 SER 49 -16.913 -1.782 -24.278 115 HB3 SER 49 HB1 SER 49 -17.047 -2.707 -25.771 116 HG SER 49 HG SER 49 -14.856 -2.247 -24.117 117 H ALA 50 HN ALA 50 -17.579 1.266 -25.018 118 HA ALA 50 HA ALA 50 -20.059 0.657 -26.475 119 HB1 ALA 50 HB1 ALA 50 -19.413 1.802 -23.922 120 HB2 ALA 50 HB2 ALA 50 -20.990 1.321 -24.549 121 HB3 ALA 50 HB3 ALA 50 -20.379 2.949 -24.849 122 H ILE 51 HN ILE 51 -17.324 2.500 -26.891 123 HA ILE 51 HA ILE 51 -18.628 4.108 -28.949 124 HB ILE 51 HB ILE 51 -18.704 5.535 -26.938 125 HG12 ILE 51 HG12 ILE 51 -16.551 6.487 -28.856 126 HG13 ILE 51 HG11 ILE 51 -18.275 6.480 -29.243 127 HG21 ILE 51 HG21 ILE 51 -15.967 6.194 -26.627 128 HG22 ILE 51 HG22 ILE 51 -16.070 4.434 -26.564 129 HG23 ILE 51 HG23 ILE 51 -17.025 5.414 -25.451 130 HD11 ILE 51 HD1 ILE 51 -16.941 8.551 -28.006 131 HD12 ILE 51 HD2 ILE 51 -17.677 7.702 -26.646 132 HD13 ILE 51 HD3 ILE 51 -18.685 8.298 -27.964 133 HA PRO 52 HA PRO 52 -14.934 2.843 -31.033 134 HB2 PRO 52 HB2 PRO 52 -15.069 4.707 -33.077 135 HB3 PRO 52 HB1 PRO 52 -16.010 3.202 -33.034 136 HG2 PRO 52 HG2 PRO 52 -16.829 5.970 -32.274 137 HG3 PRO 52 HG1 PRO 52 -17.731 4.735 -33.173 138 HD2 PRO 52 HD2 PRO 52 -18.239 5.204 -30.571 139 HD3 PRO 52 HD1 PRO 52 -18.307 3.555 -31.241 140 H GLN 53 HN GLN 53 -12.798 3.428 -31.049 141 HA GLN 53 HA GLN 53 -11.767 5.297 -29.345 142 HB2 GLN 53 HB2 GLN 53 -9.695 5.222 -30.813 143 HB3 GLN 53 HB1 GLN 53 -10.311 3.656 -30.271 144 HG2 GLN 53 HG2 GLN 53 -11.536 3.433 -32.434 145 HG3 GLN 53 HG1 GLN 53 -10.808 4.944 -32.973 146 HE21 GLN 53 HE21 GLN 53 -10.451 1.724 -33.413 147 HE22 GLN 53 HE22 GLN 53 -8.769 1.629 -33.619 148 H VAL 54 HN VAL 54 -12.937 7.214 -29.449 149 HA VAL 54 HA VAL 54 -12.930 8.800 -31.881 150 HB VAL 54 HB VAL 54 -14.194 10.428 -30.575 151 HG11 VAL 54 HG11 VAL 54 -16.046 9.173 -30.840 152 HG12 VAL 54 HG12 VAL 54 -15.564 8.078 -29.543 153 HG13 VAL 54 HG13 VAL 54 -14.978 7.812 -31.186 154 HG21 VAL 54 HG21 VAL 54 -12.808 9.244 -28.409 155 HG22 VAL 54 HG22 VAL 54 -14.518 8.901 -28.147 156 HG23 VAL 54 HG23 VAL 54 -13.972 10.567 -28.338 157 H TYR 55 HN TYR 55 -12.673 11.355 -30.643 158 HA TYR 55 HA TYR 55 -9.899 11.778 -30.927 159 HB2 TYR 55 HB2 TYR 55 -12.018 13.500 -29.620 160 HB3 TYR 55 HB1 TYR 55 -10.382 14.044 -30.003 161 HD1 TYR 55 HD1 TYR 55 -13.644 13.055 -31.377 162 HD2 TYR 55 HD2 TYR 55 -9.658 14.340 -32.323 163 HE1 TYR 55 HE1 TYR 55 -14.355 13.543 -33.703 164 HE2 TYR 55 HE2 TYR 55 -10.367 14.827 -34.649 165 HH TYR 55 HH TYR 55 -13.416 13.803 -35.894 166 H HIS 56 HN HIS 56 -11.946 11.512 -28.030 167 HA HIS 56 HA HIS 56 -9.946 10.340 -26.443 168 HB2 HIS 56 HB2 HIS 56 -8.949 12.645 -26.699 169 HB3 HIS 56 HB1 HIS 56 -10.332 13.266 -25.792 170 HD2 HIS 56 HD2 HIS 56 -6.971 11.450 -25.120 171 HE1 HIS 56 HE1 HIS 56 -9.058 11.601 -21.453 172 HE2 HIS 56 HE2 HIS 56 -6.828 11.060 -22.543 173 H ILE 57 HN ILE 57 -11.014 9.300 -24.854 174 HA ILE 57 HA ILE 57 -13.470 10.557 -23.787 175 HB ILE 57 HB ILE 57 -14.586 8.406 -23.773 176 HG12 ILE 57 HG12 ILE 57 -12.038 7.307 -25.008 177 HG13 ILE 57 HG11 ILE 57 -12.553 7.039 -23.340 178 HG21 ILE 57 HG21 ILE 57 -15.121 8.421 -26.000 179 HG22 ILE 57 HG22 ILE 57 -13.435 8.322 -26.510 180 HG23 ILE 57 HG23 ILE 57 -14.113 9.869 -26.002 181 HD11 ILE 57 HD1 ILE 57 -14.559 6.417 -25.434 182 HD12 ILE 57 HD2 ILE 57 -14.195 5.567 -23.932 183 HD13 ILE 57 HD3 ILE 57 -13.167 5.339 -25.348 184 H ILE 58 HN ILE 58 -13.449 10.726 -21.627 185 HA ILE 58 HA ILE 58 -11.953 8.763 -20.039 186 HB ILE 58 HB ILE 58 -10.482 10.784 -20.567 187 HG12 ILE 58 HG12 ILE 58 -9.691 10.924 -18.213 188 HG13 ILE 58 HG11 ILE 58 -11.178 10.134 -17.685 189 HG21 ILE 58 HG21 ILE 58 -12.612 12.045 -18.830 190 HG22 ILE 58 HG22 ILE 58 -12.047 12.582 -20.412 191 HG23 ILE 58 HG23 ILE 58 -11.000 12.738 -19.001 192 HD11 ILE 58 HD1 ILE 58 -9.661 8.759 -19.838 193 HD12 ILE 58 HD2 ILE 58 -10.520 8.080 -18.456 194 HD13 ILE 58 HD3 ILE 58 -8.911 8.769 -18.241 195 H VAL 59 HN VAL 59 -12.860 8.360 -18.055 196 HA VAL 59 HA VAL 59 -15.242 9.973 -17.360 197 HB VAL 59 HB VAL 59 -14.737 7.031 -16.864 198 HG11 VAL 59 HG11 VAL 59 -16.408 8.889 -15.490 199 HG12 VAL 59 HG12 VAL 59 -16.360 7.138 -15.306 200 HG13 VAL 59 HG13 VAL 59 -17.459 7.871 -16.471 201 HG21 VAL 59 HG21 VAL 59 -16.360 8.585 -18.867 202 HG22 VAL 59 HG22 VAL 59 -16.900 6.986 -18.352 203 HG23 VAL 59 HG23 VAL 59 -15.326 7.179 -19.125 204 H THR 60 HN THR 60 -15.178 10.994 -15.485 205 HA THR 60 HA THR 60 -13.315 10.027 -13.407 206 HB THR 60 HB THR 60 -13.911 12.917 -14.096 207 HG1 THR 60 HG1 THR 60 -12.488 11.713 -15.516 208 HG21 THR 60 HG21 THR 60 -13.546 12.737 -11.738 209 HG22 THR 60 HG22 THR 60 -12.027 13.292 -12.439 210 HG23 THR 60 HG23 THR 60 -12.216 11.602 -11.968 211 H ASP 61 HN ASP 61 -14.156 9.737 -11.457 212 HA ASP 61 HA ASP 61 -16.968 10.476 -11.031 213 HB2 ASP 61 HB2 ASP 61 -15.140 8.479 -9.689 214 HB3 ASP 61 HB1 ASP 61 -16.732 8.895 -9.051 215 H LEU 62 HN LEU 62 -17.372 12.268 -9.909 216 HA LEU 62 HA LEU 62 -15.418 13.755 -8.520 217 HB2 LEU 62 HB2 LEU 62 -18.379 13.860 -8.812 218 HB3 LEU 62 HB1 LEU 62 -17.673 14.736 -7.455 219 HG LEU 62 HG LEU 62 -17.935 15.959 -9.755 220 HD11 LEU 62 HD11 LEU 62 -16.772 17.317 -8.356 221 HD12 LEU 62 HD12 LEU 62 -15.355 16.755 -9.245 222 HD13 LEU 62 HD13 LEU 62 -15.804 15.985 -7.724 223 HD21 LEU 62 HD21 LEU 62 -16.205 15.609 -11.350 224 HD22 LEU 62 HD22 LEU 62 -16.743 13.984 -10.919 225 HD23 LEU 62 HD23 LEU 62 -15.258 14.635 -10.227 226 H SER 63 HN SER 63 -14.929 13.951 -6.371 227 HA SER 63 HA SER 63 -14.725 11.837 -4.729 228 HB2 SER 63 HB2 SER 63 -14.592 13.354 -2.842 229 HB3 SER 63 HB1 SER 63 -13.859 14.132 -4.242 230 HG SER 63 HG SER 63 -16.338 14.784 -4.415 231 H TYR 64 HN TYR 64 -16.221 10.352 -4.306 232 HA TYR 64 HA TYR 64 -18.299 10.699 -2.514 233 HB2 TYR 64 HB2 TYR 64 -19.330 12.121 -4.265 234 HB3 TYR 64 HB1 TYR 64 -19.307 10.744 -5.369 235 HD1 TYR 64 HD1 TYR 64 -20.603 11.901 -2.071 236 HD2 TYR 64 HD2 TYR 64 -21.012 9.102 -5.302 237 HE1 TYR 64 HE1 TYR 64 -22.742 11.103 -1.106 238 HE2 TYR 64 HE2 TYR 64 -23.153 8.302 -4.336 239 HH TYR 64 HH TYR 64 -24.178 8.274 -1.917 240 H GLY 65 HN GLY 65 -16.557 8.746 -2.605 241 HA2 GLY 65 HA2 GLY 65 -16.566 6.433 -2.347 242 HA3 GLY 65 HA1 GLY 65 -18.166 6.386 -3.087 243 H CYS 66 HN CYS 66 -16.938 4.427 -4.050 244 HA CYS 66 HA CYS 66 -14.959 4.800 -6.037 245 HB2 CYS 66 HB2 CYS 66 -17.016 2.624 -5.620 246 HB3 CYS 66 HB1 CYS 66 -15.761 2.549 -6.859 247 HG CYS 66 HG CYS 66 -14.071 2.943 -4.680 248 H GLY 67 HN GLY 67 -18.495 4.758 -6.177 249 HA2 GLY 67 HA2 GLY 67 -18.322 5.945 -8.877 250 HA3 GLY 67 HA1 GLY 67 -19.439 4.618 -8.557 251 H GLN 68 HN GLN 68 -21.283 5.823 -9.010 252 HA GLN 68 HA GLN 68 -23.102 7.127 -8.483 253 HB2 GLN 68 HB2 GLN 68 -21.658 7.230 -5.829 254 HB3 GLN 68 HB1 GLN 68 -23.246 7.949 -6.100 255 HG2 GLN 68 HG2 GLN 68 -24.185 5.793 -6.693 256 HG3 GLN 68 HG1 GLN 68 -22.593 5.038 -6.630 257 HE21 GLN 68 HE21 GLN 68 -25.077 4.497 -4.957 258 HE22 GLN 68 HE22 GLN 68 -24.555 4.667 -3.350 259 H SER 69 HN SER 69 -20.460 8.225 -9.487 260 HA SER 69 HA SER 69 -21.072 11.060 -8.935 261 HB2 SER 69 HB2 SER 69 -18.316 9.839 -9.195 262 HB3 SER 69 HB1 SER 69 -18.666 11.556 -9.061 263 HG SER 69 HG SER 69 -19.546 11.173 -7.028 264 H PHE 70 HN PHE 70 -20.629 12.509 -10.676 265 HA PHE 70 HA PHE 70 -20.242 11.201 -13.289 266 HB2 PHE 70 HB2 PHE 70 -21.886 12.758 -14.205 267 HB3 PHE 70 HB1 PHE 70 -22.591 11.774 -12.929 268 HD1 PHE 70 HD1 PHE 70 -21.441 15.127 -13.893 269 HD2 PHE 70 HD2 PHE 70 -23.161 12.758 -10.750 270 HE1 PHE 70 HE1 PHE 70 -22.066 17.195 -12.679 271 HE2 PHE 70 HE2 PHE 70 -23.783 14.828 -9.533 272 HZ PHE 70 HZ PHE 70 -23.234 17.046 -10.496 273 H ASP 71 HN ASP 71 -18.633 12.036 -14.458 274 HA ASP 71 HA ASP 71 -18.154 14.744 -14.877 275 HB2 ASP 71 HB2 ASP 71 -17.520 14.786 -12.508 276 HB3 ASP 71 HB1 ASP 71 -16.308 13.539 -12.803 277 H ILE 72 HN ILE 72 -18.110 13.437 -16.936 278 HA ILE 72 HA ILE 72 -15.356 12.432 -17.424 279 HB ILE 72 HB ILE 72 -16.201 10.683 -18.760 280 HG12 ILE 72 HG12 ILE 72 -18.814 12.211 -18.750 281 HG13 ILE 72 HG11 ILE 72 -17.709 12.022 -20.112 282 HG21 ILE 72 HG21 ILE 72 -16.774 10.541 -16.251 283 HG22 ILE 72 HG22 ILE 72 -17.672 9.478 -17.334 284 HG23 ILE 72 HG23 ILE 72 -18.420 10.954 -16.729 285 HD11 ILE 72 HD1 ILE 72 -19.381 9.883 -18.785 286 HD12 ILE 72 HD2 ILE 72 -18.025 9.499 -19.846 287 HD13 ILE 72 HD3 ILE 72 -19.408 10.396 -20.473 288 H VAL 73 HN VAL 73 -14.488 12.838 -19.478 289 HA VAL 73 HA VAL 73 -15.895 14.935 -21.010 290 HB VAL 73 HB VAL 73 -12.956 14.751 -20.319 291 HG11 VAL 73 HG11 VAL 73 -13.237 17.111 -21.579 292 HG12 VAL 73 HG12 VAL 73 -14.456 16.174 -22.443 293 HG13 VAL 73 HG13 VAL 73 -12.779 15.630 -22.418 294 HG21 VAL 73 HG21 VAL 73 -13.356 16.398 -18.801 295 HG22 VAL 73 HG22 VAL 73 -15.034 15.861 -18.895 296 HG23 VAL 73 HG23 VAL 73 -14.489 17.227 -19.868 297 H VAL 74 HN VAL 74 -16.146 14.506 -23.114 298 HA VAL 74 HA VAL 74 -14.273 12.690 -24.460 299 HB VAL 74 HB VAL 74 -16.116 11.264 -23.673 300 HG11 VAL 74 HG11 VAL 74 -18.372 11.743 -24.896 301 HG12 VAL 74 HG12 VAL 74 -17.747 13.385 -25.054 302 HG13 VAL 74 HG13 VAL 74 -17.978 12.679 -23.454 303 HG21 VAL 74 HG21 VAL 74 -15.094 11.442 -26.241 304 HG22 VAL 74 HG22 VAL 74 -16.835 11.409 -26.516 305 HG23 VAL 74 HG23 VAL 74 -16.059 10.102 -25.621 306 H VAL 75 HN VAL 75 -13.951 13.161 -26.597 307 HA VAL 75 HA VAL 75 -15.596 15.346 -27.731 308 HB VAL 75 HB VAL 75 -12.622 14.877 -28.068 309 HG11 VAL 75 HG11 VAL 75 -14.326 15.951 -29.920 310 HG12 VAL 75 HG12 VAL 75 -12.628 16.399 -29.760 311 HG13 VAL 75 HG13 VAL 75 -13.875 17.385 -28.997 312 HG21 VAL 75 HG21 VAL 75 -14.220 16.399 -26.174 313 HG22 VAL 75 HG22 VAL 75 -13.166 17.460 -27.108 314 HG23 VAL 75 HG23 VAL 75 -12.479 16.122 -26.189 315 H SER 76 HN SER 76 -16.584 14.851 -29.586 316 HA SER 76 HA SER 76 -15.354 13.114 -31.544 317 HB2 SER 76 HB2 SER 76 -16.358 11.460 -30.043 318 HB3 SER 76 HB1 SER 76 -17.915 12.271 -30.174 319 HG SER 76 HG SER 76 -18.112 10.895 -31.780 320 H ASP 77 HN ASP 77 -16.514 13.080 -33.555 321 HA ASP 77 HA ASP 77 -17.776 15.581 -34.141 322 HB2 ASP 77 HB2 ASP 77 -17.321 13.094 -35.788 323 HB3 ASP 77 HB1 ASP 77 -18.111 14.533 -36.418 324 H PHE 78 HN PHE 78 -18.923 12.829 -32.725 325 HA PHE 78 HA PHE 78 -21.388 12.317 -33.933 326 HB2 PHE 78 HB2 PHE 78 -20.361 10.958 -32.102 327 HB3 PHE 78 HB1 PHE 78 -20.783 12.243 -30.963 328 HD1 PHE 78 HD1 PHE 78 -22.118 9.622 -33.210 329 HD2 PHE 78 HD2 PHE 78 -23.093 12.641 -30.320 330 HE1 PHE 78 HE1 PHE 78 -24.417 8.705 -33.028 331 HE2 PHE 78 HE2 PHE 78 -25.394 11.726 -30.143 332 HZ PHE 78 HZ PHE 78 -26.053 9.757 -31.492 333 H PHE 79 HN PHE 79 -20.340 14.923 -31.864 334 HA PHE 79 HA PHE 79 -23.044 15.890 -31.408 335 HB2 PHE 79 HB2 PHE 79 -21.172 16.121 -29.720 336 HB3 PHE 79 HB1 PHE 79 -20.444 17.313 -30.799 337 HD1 PHE 79 HD1 PHE 79 -20.896 18.534 -28.385 338 HD2 PHE 79 HD2 PHE 79 -23.876 17.563 -31.326 339 HE1 PHE 79 HE1 PHE 79 -22.379 20.303 -27.474 340 HE2 PHE 79 HE2 PHE 79 -25.353 19.331 -30.414 341 HZ PHE 79 HZ PHE 79 -24.606 20.701 -28.490 342 H GLN 80 HN GLN 80 -21.436 15.748 -34.118 343 HA GLN 80 HA GLN 80 -21.625 18.552 -34.918 344 HB2 GLN 80 HB2 GLN 80 -19.727 17.140 -35.692 345 HB3 GLN 80 HB1 GLN 80 -20.878 16.105 -36.540 346 HG2 GLN 80 HG2 GLN 80 -21.646 18.066 -37.850 347 HG3 GLN 80 HG1 GLN 80 -20.434 19.057 -37.040 348 HE21 GLN 80 HE21 GLN 80 -18.582 19.303 -38.289 349 HE22 GLN 80 HE22 GLN 80 -17.968 18.140 -39.361 350 H GLY 81 HN GLY 81 -23.710 19.191 -35.186 351 HA2 GLY 81 HA2 GLY 81 -25.679 19.423 -36.408 352 HA3 GLY 81 HA1 GLY 81 -25.258 17.971 -37.313 353 H LYS 82 HN LYS 82 -24.970 17.478 -33.995 354 HA LYS 82 HA LYS 82 -27.689 16.327 -33.825 355 HB2 LYS 82 HB2 LYS 82 -25.067 15.167 -32.878 356 HB3 LYS 82 HB1 LYS 82 -26.633 14.564 -32.340 357 HG2 LYS 82 HG2 LYS 82 -27.265 14.115 -34.686 358 HG3 LYS 82 HG1 LYS 82 -25.699 14.722 -35.223 359 HD2 LYS 82 HD2 LYS 82 -24.556 12.958 -33.951 360 HD3 LYS 82 HD1 LYS 82 -26.107 12.360 -33.363 361 HE2 LYS 82 HE2 LYS 82 -26.806 11.873 -35.663 362 HE3 LYS 82 HE1 LYS 82 -25.272 12.492 -36.275 363 HZ1 LYS 82 HZ1 LYS 82 -24.294 10.763 -34.624 364 HZ2 LYS 82 HZ2 LYS 82 -24.858 10.254 -36.145 365 HZ3 LYS 82 HZ3 LYS 82 -25.820 10.033 -34.761 366 H SER 83 HN SER 83 -28.797 16.588 -31.950 367 HA SER 83 HA SER 83 -27.923 18.696 -30.194 368 HB2 SER 83 HB2 SER 83 -30.087 18.477 -29.155 369 HB3 SER 83 HB1 SER 83 -30.306 18.366 -30.899 370 HG SER 83 HG SER 83 -31.176 16.677 -29.196 371 H LYS 84 HN LYS 84 -28.068 18.414 -27.788 372 HA LYS 84 HA LYS 84 -26.220 16.480 -26.916 373 HB2 LYS 84 HB2 LYS 84 -26.778 17.222 -24.657 374 HB3 LYS 84 HB1 LYS 84 -26.635 18.610 -25.736 375 HG2 LYS 84 HG2 LYS 84 -29.094 18.630 -26.029 376 HG3 LYS 84 HG1 LYS 84 -29.230 17.264 -24.922 377 HD2 LYS 84 HD2 LYS 84 -28.252 18.604 -23.114 378 HD3 LYS 84 HD1 LYS 84 -28.047 19.966 -24.215 379 HE2 LYS 84 HE2 LYS 84 -30.085 20.259 -22.872 380 HE3 LYS 84 HE1 LYS 84 -30.500 20.032 -24.571 381 HZ1 LYS 84 HZ1 LYS 84 -31.047 18.342 -22.300 382 HZ2 LYS 84 HZ2 LYS 84 -30.446 17.506 -23.651 383 HZ3 LYS 84 HZ3 LYS 84 -31.850 18.452 -23.789 384 H LEU 85 HN LEU 85 -29.697 16.423 -27.157 385 HA LEU 85 HA LEU 85 -30.217 14.251 -25.426 386 HB2 LEU 85 HB2 LEU 85 -31.646 15.281 -27.871 387 HB3 LEU 85 HB1 LEU 85 -32.276 13.981 -26.865 388 HG LEU 85 HG LEU 85 -31.495 16.686 -25.751 389 HD11 LEU 85 HD11 LEU 85 -34.312 16.295 -25.714 390 HD12 LEU 85 HD12 LEU 85 -33.774 15.980 -27.364 391 HD13 LEU 85 HD13 LEU 85 -33.411 17.527 -26.599 392 HD21 LEU 85 HD21 LEU 85 -33.468 15.443 -24.221 393 HD22 LEU 85 HD22 LEU 85 -31.746 15.507 -23.840 394 HD23 LEU 85 HD23 LEU 85 -32.407 14.122 -24.713 395 H MET 86 HN MET 86 -29.389 14.409 -28.866 396 HA MET 86 HA MET 86 -29.734 11.652 -29.405 397 HB2 MET 86 HB2 MET 86 -27.983 13.721 -30.757 398 HB3 MET 86 HB1 MET 86 -28.300 12.107 -31.396 399 HG2 MET 86 HG2 MET 86 -30.757 12.630 -31.318 400 HG3 MET 86 HG1 MET 86 -30.338 14.273 -30.850 401 HE1 MET 86 HE1 MET 86 -31.545 15.389 -32.739 402 HE2 MET 86 HE2 MET 86 -32.136 13.826 -33.295 403 HE3 MET 86 HE3 MET 86 -31.421 14.950 -34.449 404 H ARG 87 HN ARG 87 -26.967 13.564 -28.294 405 HA ARG 87 HA ARG 87 -25.004 11.548 -28.526 406 HB2 ARG 87 HB2 ARG 87 -25.179 13.844 -26.566 407 HB3 ARG 87 HB1 ARG 87 -23.730 12.894 -26.904 408 HG2 ARG 87 HG2 ARG 87 -24.125 13.546 -29.374 409 HG3 ARG 87 HG1 ARG 87 -25.209 14.777 -28.734 410 HD2 ARG 87 HD2 ARG 87 -22.278 14.440 -28.073 411 HD3 ARG 87 HD1 ARG 87 -23.002 15.730 -29.026 412 HE ARG 87 HE ARG 87 -23.024 15.500 -26.136 413 HH11 ARG 87 HH11 ARG 87 -24.465 16.859 -28.961 414 HH12 ARG 87 HH12 ARG 87 -25.137 18.219 -28.127 415 HH21 ARG 87 HH21 ARG 87 -23.912 17.258 -25.034 416 HH22 ARG 87 HH22 ARG 87 -24.827 18.444 -25.902 417 H SER 88 HN SER 88 -27.199 12.453 -25.910 418 HA SER 88 HA SER 88 -26.188 10.658 -23.965 419 HB2 SER 88 HB2 SER 88 -28.327 11.011 -22.814 420 HB3 SER 88 HB1 SER 88 -27.685 12.540 -23.408 421 HG SER 88 HG SER 88 -29.555 12.692 -24.347 422 H ARG 89 HN ARG 89 -28.708 10.331 -26.441 423 HA ARG 89 HA ARG 89 -29.641 7.783 -25.635 424 HB2 ARG 89 HB2 ARG 89 -29.659 9.173 -28.321 425 HB3 ARG 89 HB1 ARG 89 -30.498 7.657 -27.995 426 HG2 ARG 89 HG2 ARG 89 -30.942 10.201 -26.411 427 HG3 ARG 89 HG1 ARG 89 -31.957 9.696 -27.762 428 HD2 ARG 89 HD2 ARG 89 -32.412 7.557 -26.569 429 HD3 ARG 89 HD1 ARG 89 -31.482 8.155 -25.199 430 HE ARG 89 HE ARG 89 -33.480 10.046 -25.840 431 HH11 ARG 89 HH11 ARG 89 -33.078 6.844 -24.589 432 HH12 ARG 89 HH12 ARG 89 -34.510 6.896 -23.616 433 HH21 ARG 89 HH21 ARG 89 -35.361 10.120 -24.569 434 HH22 ARG 89 HH22 ARG 89 -35.802 8.751 -23.604 435 H ALA 90 HN ALA 90 -27.151 8.789 -27.969 436 HA ALA 90 HA ALA 90 -26.528 6.177 -28.887 437 HB1 ALA 90 HB1 ALA 90 -25.894 8.184 -30.141 438 HB2 ALA 90 HB2 ALA 90 -24.469 7.214 -29.765 439 HB3 ALA 90 HB3 ALA 90 -24.813 8.672 -28.835 440 H VAL 91 HN VAL 91 -25.094 8.243 -26.383 441 HA VAL 91 HA VAL 91 -23.079 6.353 -25.643 442 HB VAL 91 HB VAL 91 -22.891 8.801 -25.237 443 HG11 VAL 91 HG11 VAL 91 -24.211 9.904 -23.627 444 HG12 VAL 91 HG12 VAL 91 -24.759 8.389 -22.907 445 HG13 VAL 91 HG13 VAL 91 -25.375 8.891 -24.482 446 HG21 VAL 91 HG21 VAL 91 -22.566 6.709 -23.136 447 HG22 VAL 91 HG22 VAL 91 -22.377 8.387 -22.626 448 HG23 VAL 91 HG23 VAL 91 -21.349 7.732 -23.901 449 H ASN 92 HN ASN 92 -26.293 7.177 -24.430 450 HA ASN 92 HA ASN 92 -26.223 5.589 -22.098 451 HB2 ASN 92 HB2 ASN 92 -28.504 6.537 -23.837 452 HB3 ASN 92 HB1 ASN 92 -28.744 5.652 -22.331 453 HD21 ASN 92 HD21 ASN 92 -29.664 8.348 -22.634 454 HD22 ASN 92 HD22 ASN 92 -28.748 9.341 -21.607 455 H LYS 93 HN LYS 93 -27.251 4.862 -25.424 456 HA LYS 93 HA LYS 93 -28.209 2.249 -24.885 457 HB2 LYS 93 HB2 LYS 93 -27.168 3.528 -27.415 458 HB3 LYS 93 HB1 LYS 93 -27.878 1.914 -27.358 459 HG2 LYS 93 HG2 LYS 93 -29.280 4.415 -26.370 460 HG3 LYS 93 HG1 LYS 93 -29.527 3.713 -27.971 461 HD2 LYS 93 HD2 LYS 93 -30.236 1.588 -26.910 462 HD3 LYS 93 HD1 LYS 93 -30.029 2.327 -25.322 463 HE2 LYS 93 HE2 LYS 93 -31.714 4.036 -25.890 464 HE3 LYS 93 HE1 LYS 93 -31.923 3.302 -27.480 465 HZ1 LYS 93 HZ1 LYS 93 -33.181 2.603 -25.097 466 HZ2 LYS 93 HZ2 LYS 93 -32.158 1.313 -25.513 467 HZ3 LYS 93 HZ3 LYS 93 -33.333 1.857 -26.612 468 H ALA 94 HN ALA 94 -25.035 3.485 -25.853 469 HA ALA 94 HA ALA 94 -23.785 0.990 -26.269 470 HB1 ALA 94 HB1 ALA 94 -23.010 3.488 -26.726 471 HB2 ALA 94 HB2 ALA 94 -21.837 2.191 -26.497 472 HB3 ALA 94 HB3 ALA 94 -22.223 3.277 -25.163 473 H VAL 95 HN VAL 95 -24.119 3.006 -23.376 474 HA VAL 95 HA VAL 95 -23.287 0.685 -21.754 475 HB VAL 95 HB VAL 95 -22.360 2.550 -20.162 476 HG11 VAL 95 HG11 VAL 95 -20.293 2.509 -22.016 477 HG12 VAL 95 HG12 VAL 95 -21.223 1.065 -22.415 478 HG13 VAL 95 HG13 VAL 95 -20.590 1.283 -20.783 479 HG21 VAL 95 HG21 VAL 95 -21.455 4.478 -21.391 480 HG22 VAL 95 HG22 VAL 95 -23.210 4.423 -21.563 481 HG23 VAL 95 HG23 VAL 95 -22.176 3.881 -22.886 482 H LYS 96 HN LYS 96 -25.919 1.180 -22.295 483 HA LYS 96 HA LYS 96 -27.257 2.940 -20.557 484 HB2 LYS 96 HB2 LYS 96 -28.305 1.808 -22.508 485 HB3 LYS 96 HB1 LYS 96 -28.256 0.286 -21.617 486 HG2 LYS 96 HG2 LYS 96 -29.662 1.250 -19.851 487 HG3 LYS 96 HG1 LYS 96 -29.685 2.797 -20.697 488 HD2 LYS 96 HD2 LYS 96 -30.770 1.712 -22.640 489 HD3 LYS 96 HD1 LYS 96 -30.775 0.177 -21.770 490 HE2 LYS 96 HE2 LYS 96 -32.164 1.184 -19.996 491 HE3 LYS 96 HE1 LYS 96 -32.155 2.718 -20.868 492 HZ1 LYS 96 HZ1 LYS 96 -33.312 0.148 -21.796 493 HZ2 LYS 96 HZ2 LYS 96 -33.167 1.534 -22.768 494 HZ3 LYS 96 HZ3 LYS 96 -34.157 1.561 -21.389 495 H GLU 97 HN GLU 97 -26.218 -0.413 -20.143 496 HA GLU 97 HA GLU 97 -27.475 -0.925 -17.676 497 HB2 GLU 97 HB2 GLU 97 -26.442 -2.678 -19.082 498 HB3 GLU 97 HB1 GLU 97 -24.847 -2.024 -18.702 499 HG2 GLU 97 HG2 GLU 97 -25.234 -2.441 -16.307 500 HG3 GLU 97 HG1 GLU 97 -26.837 -3.076 -16.671 501 H GLU 98 HN GLU 98 -24.361 0.551 -18.471 502 HA GLU 98 HA GLU 98 -23.308 0.685 -15.859 503 HB2 GLU 98 HB2 GLU 98 -22.853 2.427 -18.287 504 HB3 GLU 98 HB1 GLU 98 -21.928 2.573 -16.792 505 HG2 GLU 98 HG2 GLU 98 -20.584 1.115 -18.012 506 HG3 GLU 98 HG1 GLU 98 -21.578 -0.017 -17.097 507 H LEU 99 HN LEU 99 -25.415 2.892 -17.668 508 HA LEU 99 HA LEU 99 -25.367 5.026 -15.817 509 HB2 LEU 99 HB2 LEU 99 -27.285 4.135 -17.947 510 HB3 LEU 99 HB1 LEU 99 -27.716 5.460 -16.868 511 HG LEU 99 HG LEU 99 -25.570 6.595 -17.486 512 HD11 LEU 99 HD11 LEU 99 -24.387 4.494 -18.175 513 HD12 LEU 99 HD12 LEU 99 -24.292 5.773 -19.385 514 HD13 LEU 99 HD13 LEU 99 -25.418 4.436 -19.605 515 HD21 LEU 99 HD21 LEU 99 -27.885 6.786 -18.725 516 HD22 LEU 99 HD22 LEU 99 -27.031 5.973 -20.037 517 HD23 LEU 99 HD23 LEU 99 -26.452 7.527 -19.437 518 H GLN 100 HN GLN 100 -27.437 2.165 -16.082 519 HA GLN 100 HA GLN 100 -29.237 2.856 -14.009 520 HB2 GLN 100 HB2 GLN 100 -28.438 0.188 -15.179 521 HB3 GLN 100 HB1 GLN 100 -29.722 0.384 -13.986 522 HG2 GLN 100 HG2 GLN 100 -30.926 1.900 -15.479 523 HG3 GLN 100 HG1 GLN 100 -29.620 1.805 -16.661 524 HE21 GLN 100 HE21 GLN 100 -31.813 1.031 -17.867 525 HE22 GLN 100 HE22 GLN 100 -32.023 -0.653 -17.899 526 H GLU 101 HN GLU 101 -26.176 1.104 -14.052 527 HA GLU 101 HA GLU 101 -26.289 0.326 -11.295 528 HB2 GLU 101 HB2 GLU 101 -23.992 0.448 -13.264 529 HB3 GLU 101 HB1 GLU 101 -23.871 -0.225 -11.637 530 HG2 GLU 101 HG2 GLU 101 -25.613 -1.850 -12.148 531 HG3 GLU 101 HG1 GLU 101 -25.815 -1.150 -13.753 532 H ILE 102 HN ILE 102 -25.436 3.198 -12.970 533 HA ILE 102 HA ILE 102 -24.007 4.218 -10.600 534 HB ILE 102 HB ILE 102 -24.124 5.305 -13.423 535 HG12 ILE 102 HG12 ILE 102 -21.830 3.984 -11.945 536 HG13 ILE 102 HG11 ILE 102 -22.868 3.133 -13.091 537 HG21 ILE 102 HG21 ILE 102 -23.736 7.127 -11.980 538 HG22 ILE 102 HG22 ILE 102 -22.123 6.611 -12.474 539 HG23 ILE 102 HG23 ILE 102 -22.747 6.156 -10.889 540 HD11 ILE 102 HD1 ILE 102 -22.044 5.559 -14.336 541 HD12 ILE 102 HD2 ILE 102 -21.610 3.910 -14.785 542 HD13 ILE 102 HD3 ILE 102 -20.606 4.806 -13.646 543 H HIS 103 HN HIS 103 -25.105 5.509 -9.269 544 HA HIS 103 HA HIS 103 -27.758 6.346 -9.710 545 HB2 HIS 103 HB2 HIS 103 -26.737 6.086 -7.469 546 HB3 HIS 103 HB1 HIS 103 -25.733 7.506 -7.780 547 HD2 HIS 103 HD2 HIS 103 -29.440 6.656 -6.866 548 HE1 HIS 103 HE1 HIS 103 -29.097 10.857 -7.075 549 HE2 HIS 103 HE2 HIS 103 -30.626 8.938 -6.420 550 H ALA 104 HN ALA 104 -24.693 8.156 -9.898 551 HA ALA 104 HA ALA 104 -26.091 10.145 -11.577 552 HB1 ALA 104 HB1 ALA 104 -25.439 10.776 -9.075 553 HB2 ALA 104 HB2 ALA 104 -25.263 11.938 -10.390 554 HB3 ALA 104 HB3 ALA 104 -23.859 11.041 -9.811 555 H PHE 105 HN PHE 105 -25.141 10.426 -13.491 556 HA PHE 105 HA PHE 105 -22.238 10.099 -13.730 557 HB2 PHE 105 HB2 PHE 105 -22.464 8.618 -15.675 558 HB3 PHE 105 HB1 PHE 105 -23.182 7.877 -14.245 559 HD1 PHE 105 HD1 PHE 105 -23.874 9.490 -17.488 560 HD2 PHE 105 HD2 PHE 105 -25.598 7.641 -14.015 561 HE1 PHE 105 HE1 PHE 105 -26.052 9.313 -18.663 562 HE2 PHE 105 HE2 PHE 105 -27.774 7.465 -15.189 563 HZ PHE 105 HZ PHE 105 -28.002 8.301 -17.513 564 H SER 106 HN SER 106 -21.356 11.116 -15.583 565 HA SER 106 HA SER 106 -23.216 12.829 -17.118 566 HB2 SER 106 HB2 SER 106 -21.583 14.681 -16.971 567 HB3 SER 106 HB1 SER 106 -22.211 14.229 -15.381 568 HG SER 106 HG SER 106 -20.262 12.767 -15.389 569 H CYS 107 HN CYS 107 -22.541 13.363 -19.213 570 HA CYS 107 HA CYS 107 -20.070 12.141 -20.208 571 HB2 CYS 107 HB2 CYS 107 -21.223 11.040 -22.054 572 HB3 CYS 107 HB1 CYS 107 -21.846 10.445 -20.513 573 HG CYS 107 HG CYS 107 -23.376 12.412 -22.394 574 H LYS 108 HN LYS 108 -19.734 14.578 -20.097 575 HA LYS 108 HA LYS 108 -21.105 16.288 -21.885 576 HB2 LYS 108 HB2 LYS 108 -18.347 16.472 -20.655 577 HB3 LYS 108 HB1 LYS 108 -19.091 17.767 -21.592 578 HG2 LYS 108 HG2 LYS 108 -21.008 17.783 -20.018 579 HG3 LYS 108 HG1 LYS 108 -20.213 16.533 -19.060 580 HD2 LYS 108 HD2 LYS 108 -18.933 19.206 -19.682 581 HD3 LYS 108 HD1 LYS 108 -19.864 18.897 -18.216 582 HE2 LYS 108 HE2 LYS 108 -18.333 16.982 -17.707 583 HE3 LYS 108 HE1 LYS 108 -17.354 17.444 -19.100 584 HZ1 LYS 108 HZ1 LYS 108 -17.229 18.469 -16.522 585 HZ2 LYS 108 HZ2 LYS 108 -17.856 19.709 -17.501 586 HZ3 LYS 108 HZ3 LYS 108 -16.365 18.990 -17.887 587 H CYS 109 HN CYS 109 -20.790 16.733 -24.026 588 HA CYS 109 HA CYS 109 -18.607 15.273 -25.398 589 HB2 CYS 109 HB2 CYS 109 -21.351 15.985 -26.438 590 HB3 CYS 109 HB1 CYS 109 -20.094 15.150 -27.349 591 HG CYS 109 HG CYS 109 -21.707 13.928 -24.989 592 H TYR 110 HN TYR 110 -17.211 16.464 -26.560 593 HA TYR 110 HA TYR 110 -18.000 19.197 -27.340 594 HB2 TYR 110 HB2 TYR 110 -15.344 18.344 -26.157 595 HB3 TYR 110 HB1 TYR 110 -15.700 19.946 -26.811 596 HD1 TYR 110 HD1 TYR 110 -16.297 17.608 -24.037 597 HD2 TYR 110 HD2 TYR 110 -17.278 21.452 -25.685 598 HE1 TYR 110 HE1 TYR 110 -17.287 18.287 -21.866 599 HE2 TYR 110 HE2 TYR 110 -18.268 22.130 -23.515 600 HH TYR 110 HH TYR 110 -17.692 20.621 -20.682 601 H THR 111 HN THR 111 -17.368 19.834 -29.349 602 HA THR 111 HA THR 111 -15.400 18.285 -30.832 603 HB THR 111 HB THR 111 -17.905 17.346 -31.030 604 HG1 THR 111 HG1 THR 111 -16.543 17.595 -33.444 605 HG21 THR 111 HG21 THR 111 -19.141 18.300 -32.807 606 HG22 THR 111 HG22 THR 111 -17.765 19.253 -33.361 607 HG23 THR 111 HG23 THR 111 -18.596 19.690 -31.867 608 H GLU 112 HN GLU 112 -17.745 20.911 -30.741 609 HA GLU 112 HA GLU 112 -16.008 22.914 -31.586 610 HB2 GLU 112 HB2 GLU 112 -16.484 23.236 -33.908 611 HB3 GLU 112 HB1 GLU 112 -16.031 21.542 -33.723 612 HG2 GLU 112 HG2 GLU 112 -18.443 20.938 -33.603 613 HG3 GLU 112 HG1 GLU 112 -18.858 22.627 -33.873 614 H GLU 113 HN GLU 113 -19.280 21.638 -31.624 615 HA GLU 113 HA GLU 113 -20.664 24.074 -31.930 616 HB2 GLU 113 HB2 GLU 113 -21.394 21.468 -30.621 617 HB3 GLU 113 HB1 GLU 113 -22.494 22.841 -30.685 618 HG2 GLU 113 HG2 GLU 113 -21.177 21.603 -33.122 619 HG3 GLU 113 HG1 GLU 113 -22.809 21.217 -32.580 620 H GLU 114 HN GLU 114 -19.441 22.403 -29.065 621 HA GLU 114 HA GLU 114 -20.639 24.056 -27.123 622 HB2 GLU 114 HB2 GLU 114 -18.069 22.452 -27.075 623 HB3 GLU 114 HB1 GLU 114 -18.758 23.240 -25.655 624 HG2 GLU 114 HG2 GLU 114 -20.227 21.214 -27.370 625 HG3 GLU 114 HG1 GLU 114 -19.412 20.830 -25.855 626 H TRP 115 HN TRP 115 -17.689 24.308 -28.994 627 HA TRP 115 HA TRP 115 -16.539 26.500 -27.622 628 HB2 TRP 115 HB2 TRP 115 -15.258 25.125 -29.216 629 HB3 TRP 115 HB1 TRP 115 -16.239 25.750 -30.541 630 HD1 TRP 115 HD1 TRP 115 -15.485 27.961 -31.603 631 HE1 TRP 115 HE1 TRP 115 -13.710 29.744 -31.045 632 HE3 TRP 115 HE3 TRP 115 -13.984 26.322 -27.000 633 HZ2 TRP 115 HZ2 TRP 115 -11.893 30.394 -28.937 634 HZ3 TRP 115 HZ3 TRP 115 -12.230 27.544 -25.743 635 HH2 TRP 115 HH2 TRP 115 -11.185 29.575 -26.704 636 H SER 116 HN SER 116 -18.764 26.317 -30.374 637 HA SER 116 HA SER 116 -20.316 27.859 -31.114 638 HB2 SER 116 HB2 SER 116 -20.506 28.535 -28.702 639 HB3 SER 116 HB1 SER 116 -19.236 29.722 -28.991 640 HG SER 116 HG SER 116 -21.859 29.599 -29.995 641 H LYS 117 HN LYS 117 -19.013 27.893 -33.035 642 HA LYS 117 HA LYS 117 -17.449 28.792 -34.519 643 HB2 LYS 117 HB2 LYS 117 -19.455 30.863 -33.764 644 HB3 LYS 117 HB1 LYS 117 -18.091 31.361 -34.767 645 HG2 LYS 117 HG2 LYS 117 -18.615 29.632 -36.406 646 HG3 LYS 117 HG1 LYS 117 -19.923 29.028 -35.386 647 HD2 LYS 117 HD2 LYS 117 -20.878 30.463 -37.100 648 HD3 LYS 117 HD1 LYS 117 -21.009 31.282 -35.541 649 HE2 LYS 117 HE2 LYS 117 -18.993 32.592 -36.031 650 HE3 LYS 117 HE1 LYS 117 -18.789 31.740 -37.560 651 HZ1 LYS 117 HZ1 LYS 117 -20.845 33.705 -36.795 652 HZ2 LYS 117 HZ2 LYS 117 -21.187 32.555 -37.997 653 HZ3 LYS 117 HZ3 LYS 117 -19.895 33.640 -38.199 654 H ILE 118 HN ILE 118 -17.530 31.962 -33.268 655 HA ILE 118 HA ILE 118 -15.903 33.315 -32.380 656 HB ILE 118 HB ILE 118 -15.318 30.741 -30.905 657 HG12 ILE 118 HG12 ILE 118 -16.518 33.346 -29.927 658 HG13 ILE 118 HG11 ILE 118 -17.499 32.017 -30.541 659 HG21 ILE 118 HG21 ILE 118 -13.328 31.680 -30.376 660 HG22 ILE 118 HG22 ILE 118 -14.263 32.830 -29.421 661 HG23 ILE 118 HG23 ILE 118 -13.790 33.235 -31.071 662 HD11 ILE 118 HD1 ILE 118 -17.485 31.394 -28.333 663 HD12 ILE 118 HD2 ILE 118 -15.964 32.224 -28.004 664 HD13 ILE 118 HD3 ILE 118 -15.955 30.651 -28.801 665 H VAL 119 HN VAL 119 -14.100 30.252 -32.467 666 HA VAL 119 HA VAL 119 -12.583 31.087 -34.791 667 HB VAL 119 HB VAL 119 -11.455 32.322 -32.982 668 HG11 VAL 119 HG11 VAL 119 -10.640 31.300 -31.049 669 HG12 VAL 119 HG12 VAL 119 -10.642 29.694 -31.778 670 HG13 VAL 119 HG13 VAL 119 -12.163 30.446 -31.296 671 HG21 VAL 119 HG21 VAL 119 -9.632 30.030 -33.618 672 HG22 VAL 119 HG22 VAL 119 -9.315 31.763 -33.690 673 HG23 VAL 119 HG23 VAL 119 -10.282 30.990 -34.947 674 H VAL 120 HN VAL 120 -12.251 29.331 -35.952 675 HA VAL 120 HA VAL 120 -11.564 26.815 -34.621 676 HB VAL 120 HB VAL 120 -14.014 26.748 -34.901 677 HG11 VAL 120 HG11 VAL 120 -15.070 27.047 -36.985 678 HG12 VAL 120 HG12 VAL 120 -13.569 26.817 -37.882 679 HG13 VAL 120 HG13 VAL 120 -13.837 28.308 -36.981 680 HG21 VAL 120 HG21 VAL 120 -13.945 24.737 -36.629 681 HG22 VAL 120 HG22 VAL 120 -13.155 24.590 -35.058 682 HG23 VAL 120 HG23 VAL 120 -12.202 24.964 -36.493 683 H LEU 121 HN LEU 121 -10.223 25.526 -35.818 684 HA LEU 121 HA LEU 121 -8.419 25.358 -37.306 685 HB2 LEU 121 HB2 LEU 121 -9.181 24.400 -39.318 686 HB3 LEU 121 HB1 LEU 121 -10.488 24.085 -38.176 687 HG LEU 121 HG LEU 121 -11.006 26.639 -39.262 688 HD11 LEU 121 HD11 LEU 121 -10.384 26.630 -41.424 689 HD12 LEU 121 HD12 LEU 121 -11.061 25.020 -41.667 690 HD13 LEU 121 HD13 LEU 121 -9.410 25.202 -41.073 691 HD21 LEU 121 HD21 LEU 121 -12.952 25.412 -40.285 692 HD22 LEU 121 HD22 LEU 121 -12.721 25.072 -38.570 693 HD23 LEU 121 HD23 LEU 121 -12.199 23.899 -39.779 694 H GLU 122 HN GLU 122 -8.499 27.983 -36.669 695 HA GLU 122 HA GLU 122 -8.943 29.787 -38.788 696 HB2 GLU 122 HB2 GLU 122 -8.659 30.489 -36.442 697 HB3 GLU 122 HB1 GLU 122 -6.966 29.999 -36.504 698 HG2 GLU 122 HG2 GLU 122 -6.544 31.620 -38.299 699 HG3 GLU 122 HG1 GLU 122 -8.243 32.092 -38.288 700 H HIS 123 HN HIS 123 -6.069 27.965 -37.802 701 HA HIS 123 HA HIS 123 -4.310 29.124 -39.713 702 HB2 HIS 123 HB2 HIS 123 -3.631 27.848 -37.640 703 HB3 HIS 123 HB1 HIS 123 -4.086 26.370 -38.488 704 HD2 HIS 123 HD2 HIS 123 -1.151 28.910 -38.400 705 HE1 HIS 123 HE1 HIS 123 -0.370 26.210 -41.551 706 HE2 HIS 123 HE2 HIS 123 0.606 28.089 -40.148 707 H HIS 124 HN HIS 124 -3.812 28.537 -41.778 708 HA HIS 124 HA HIS 124 -5.568 26.515 -43.016 709 HB2 HIS 124 HB2 HIS 124 -4.020 28.800 -44.262 710 HB3 HIS 124 HB1 HIS 124 -5.034 27.660 -45.145 711 HD2 HIS 124 HD2 HIS 124 -5.423 31.006 -43.366 712 HE1 HIS 124 HE1 HIS 124 -9.308 29.364 -43.577 713 HE2 HIS 124 HE2 HIS 124 -7.977 31.468 -43.074 714 H HIS 125 HN HIS 125 -4.723 24.671 -43.734 715 HA HIS 125 HA HIS 125 -1.982 24.531 -44.683 716 HB2 HIS 125 HB2 HIS 125 -1.331 22.742 -43.126 717 HB3 HIS 125 HB1 HIS 125 -1.694 24.234 -42.259 718 HD2 HIS 125 HD2 HIS 125 -3.929 24.095 -40.547 719 HE1 HIS 125 HE1 HIS 125 -4.946 20.086 -41.393 720 HE2 HIS 125 HE2 HIS 125 -5.441 22.071 -39.888 721 H HIS 126 HN HIS 126 -1.477 22.365 -45.570 722 HA HIS 126 HA HIS 126 -3.938 21.050 -46.554 723 HB2 HIS 126 HB2 HIS 126 -2.588 22.183 -48.300 724 HB3 HIS 126 HB1 HIS 126 -1.211 21.170 -47.865 725 HD2 HIS 126 HD2 HIS 126 -4.767 19.523 -48.041 726 HE1 HIS 126 HE1 HIS 126 -2.524 18.136 -51.337 727 HE2 HIS 126 HE2 HIS 126 -4.693 17.853 -50.047 728 H HIS 127 HN HIS 127 -4.285 19.085 -45.762 729 HA HIS 127 HA HIS 127 -2.324 17.673 -44.232 730 HB2 HIS 127 HB2 HIS 127 -4.028 15.947 -44.020 731 HB3 HIS 127 HB1 HIS 127 -4.764 17.533 -43.793 732 HD2 HIS 127 HD2 HIS 127 -6.675 18.236 -45.734 733 HE1 HIS 127 HE1 HIS 127 -6.277 14.765 -48.104 734 HE2 HIS 127 HE2 HIS 127 -7.640 16.878 -47.746 735 H HIS 128 HN HIS 128 -3.036 17.848 -47.558 736 HA HIS 128 HA HIS 128 -2.639 16.325 -49.315 737 HB2 HIS 128 HB2 HIS 128 -0.727 17.849 -49.188 738 HB3 HIS 128 HB1 HIS 128 0.054 16.791 -48.011 739 HD2 HIS 128 HD2 HIS 128 1.642 14.855 -49.186 740 HE1 HIS 128 HE1 HIS 128 0.015 15.040 -53.078 741 HE2 HIS 128 HE2 HIS 128 1.816 13.974 -51.639 Start of MODEL 17 1 H1 MET 36 HT1 MET 36 -21.994 0.514 -3.293 2 H2 MET 36 HT2 MET 36 -21.015 1.840 -2.884 3 H3 MET 36 HT3 MET 36 -20.645 0.896 -4.247 4 HA MET 36 HA MET 36 -23.096 2.541 -3.929 5 HB2 MET 36 HB2 MET 36 -20.416 3.043 -5.185 6 HB3 MET 36 HB1 MET 36 -21.856 3.756 -5.913 7 HG2 MET 36 HG2 MET 36 -21.039 4.066 -3.008 8 HG3 MET 36 HG1 MET 36 -20.816 5.288 -4.261 9 HE1 MET 36 HE1 MET 36 -23.938 4.767 -1.430 10 HE2 MET 36 HE2 MET 36 -22.514 3.773 -1.731 11 HE3 MET 36 HE3 MET 36 -24.080 3.273 -2.367 12 HA PRO 37 HA PRO 37 -24.760 0.155 -7.226 13 HB2 PRO 37 HB2 PRO 37 -25.961 2.113 -8.760 14 HB3 PRO 37 HB1 PRO 37 -26.640 1.472 -7.251 15 HG2 PRO 37 HG2 PRO 37 -25.136 3.994 -7.732 16 HG3 PRO 37 HG1 PRO 37 -26.515 3.684 -6.663 17 HD2 PRO 37 HD2 PRO 37 -23.962 3.875 -5.723 18 HD3 PRO 37 HD1 PRO 37 -25.181 2.831 -4.958 19 H VAL 38 HN VAL 38 -22.600 2.792 -7.944 20 HA VAL 38 HA VAL 38 -21.778 1.403 -10.413 21 HB VAL 38 HB VAL 38 -23.184 3.356 -11.035 22 HG11 VAL 38 HG11 VAL 38 -22.054 4.568 -8.859 23 HG12 VAL 38 HG12 VAL 38 -22.882 5.433 -10.153 24 HG13 VAL 38 HG13 VAL 38 -21.120 5.289 -10.172 25 HG21 VAL 38 HG21 VAL 38 -20.224 3.716 -11.613 26 HG22 VAL 38 HG22 VAL 38 -21.549 4.378 -12.569 27 HG23 VAL 38 HG23 VAL 38 -21.307 2.633 -12.487 28 H THR 39 HN THR 39 -19.566 1.435 -10.812 29 HA THR 39 HA THR 39 -17.911 2.830 -8.795 30 HB THR 39 HB THR 39 -16.380 0.904 -8.801 31 HG1 THR 39 HG1 THR 39 -18.272 -0.670 -10.086 32 HG21 THR 39 HG21 THR 39 -18.419 -0.789 -8.054 33 HG22 THR 39 HG22 THR 39 -19.177 0.797 -7.908 34 HG23 THR 39 HG23 THR 39 -17.696 0.442 -7.017 35 H GLU 40 HN GLU 40 -15.740 3.360 -9.529 36 HA GLU 40 HA GLU 40 -15.700 4.490 -12.113 37 HB2 GLU 40 HB2 GLU 40 -14.318 5.314 -10.240 38 HB3 GLU 40 HB1 GLU 40 -13.354 3.837 -10.319 39 HG2 GLU 40 HG2 GLU 40 -12.714 4.358 -12.637 40 HG3 GLU 40 HG1 GLU 40 -13.690 5.824 -12.584 41 H GLN 41 HN GLN 41 -14.199 1.534 -10.820 42 HA GLN 41 HA GLN 41 -12.933 0.788 -13.261 43 HB2 GLN 41 HB2 GLN 41 -12.543 -1.349 -12.198 44 HB3 GLN 41 HB1 GLN 41 -12.292 -0.079 -11.001 45 HG2 GLN 41 HG2 GLN 41 -14.577 -0.430 -10.142 46 HG3 GLN 41 HG1 GLN 41 -14.832 -1.700 -11.338 47 HE21 GLN 41 HE21 GLN 41 -15.176 -3.122 -9.356 48 HE22 GLN 41 HE22 GLN 41 -13.809 -3.767 -8.586 49 H GLY 42 HN GLY 42 -16.007 -0.109 -11.734 50 HA2 GLY 42 HA2 GLY 42 -16.818 -1.968 -13.722 51 HA3 GLY 42 HA1 GLY 42 -17.877 -1.176 -12.557 52 H LEU 43 HN LEU 43 -17.154 1.519 -13.374 53 HA LEU 43 HA LEU 43 -19.120 1.966 -15.336 54 HB2 LEU 43 HB2 LEU 43 -18.398 3.687 -13.733 55 HB3 LEU 43 HB1 LEU 43 -16.819 3.751 -14.515 56 HG LEU 43 HG LEU 43 -17.867 4.455 -16.620 57 HD11 LEU 43 HD11 LEU 43 -20.003 3.276 -16.352 58 HD12 LEU 43 HD12 LEU 43 -20.284 4.993 -16.655 59 HD13 LEU 43 HD13 LEU 43 -20.440 4.349 -15.020 60 HD21 LEU 43 HD21 LEU 43 -18.260 5.961 -14.076 61 HD22 LEU 43 HD22 LEU 43 -19.073 6.595 -15.508 62 HD23 LEU 43 HD23 LEU 43 -17.320 6.398 -15.504 63 H ARG 44 HN ARG 44 -15.592 1.726 -15.591 64 HA ARG 44 HA ARG 44 -15.309 2.487 -18.270 65 HB2 ARG 44 HB2 ARG 44 -13.416 2.150 -16.704 66 HB3 ARG 44 HB1 ARG 44 -13.695 0.409 -16.769 67 HG2 ARG 44 HG2 ARG 44 -13.285 0.409 -19.189 68 HG3 ARG 44 HG1 ARG 44 -13.062 2.159 -19.165 69 HD2 ARG 44 HD2 ARG 44 -11.135 1.897 -17.651 70 HD3 ARG 44 HD1 ARG 44 -11.362 0.150 -17.657 71 HE ARG 44 HE ARG 44 -11.096 1.030 -20.324 72 HH11 ARG 44 HH11 ARG 44 -9.289 0.769 -17.383 73 HH12 ARG 44 HH12 ARG 44 -7.764 0.557 -18.176 74 HH21 ARG 44 HH21 ARG 44 -9.101 0.735 -21.371 75 HH22 ARG 44 HH22 ARG 44 -7.658 0.536 -20.434 76 H GLU 45 HN GLU 45 -16.004 -0.688 -16.847 77 HA GLU 45 HA GLU 45 -15.937 -2.160 -19.264 78 HB2 GLU 45 HB2 GLU 45 -17.317 -2.678 -16.625 79 HB3 GLU 45 HB1 GLU 45 -17.308 -3.834 -17.959 80 HG2 GLU 45 HG2 GLU 45 -14.879 -3.931 -17.926 81 HG3 GLU 45 HG1 GLU 45 -14.811 -2.666 -16.698 82 H ARG 46 HN ARG 46 -18.546 -0.524 -17.538 83 HA ARG 46 HA ARG 46 -20.665 -1.372 -19.232 84 HB2 ARG 46 HB2 ARG 46 -20.370 0.980 -17.354 85 HB3 ARG 46 HB1 ARG 46 -21.857 0.629 -18.233 86 HG2 ARG 46 HG2 ARG 46 -21.984 -1.587 -17.189 87 HG3 ARG 46 HG1 ARG 46 -20.460 -1.293 -16.351 88 HD2 ARG 46 HD2 ARG 46 -21.471 0.615 -15.164 89 HD3 ARG 46 HD1 ARG 46 -22.990 0.340 -16.011 90 HE ARG 46 HE ARG 46 -22.322 -2.055 -14.741 91 HH11 ARG 46 HH11 ARG 46 -23.064 1.230 -13.933 92 HH12 ARG 46 HH12 ARG 46 -23.763 0.837 -12.397 93 HH21 ARG 46 HH21 ARG 46 -23.237 -2.573 -12.727 94 HH22 ARG 46 HH22 ARG 46 -23.861 -1.313 -11.715 95 H ILE 47 HN ILE 47 -18.559 1.482 -19.179 96 HA ILE 47 HA ILE 47 -19.805 2.829 -21.340 97 HB ILE 47 HB ILE 47 -16.988 3.013 -20.264 98 HG12 ILE 47 HG12 ILE 47 -18.812 3.638 -18.705 99 HG13 ILE 47 HG11 ILE 47 -17.854 5.043 -19.180 100 HG21 ILE 47 HG21 ILE 47 -17.084 3.802 -22.589 101 HG22 ILE 47 HG22 ILE 47 -16.926 5.174 -21.493 102 HG23 ILE 47 HG23 ILE 47 -18.492 4.794 -22.208 103 HD11 ILE 47 HD1 ILE 47 -19.639 5.315 -21.062 104 HD12 ILE 47 HD2 ILE 47 -20.062 5.813 -19.424 105 HD13 ILE 47 HD3 ILE 47 -20.631 4.266 -20.050 106 H GLU 48 HN GLU 48 -17.055 0.613 -21.148 107 HA GLU 48 HA GLU 48 -16.312 0.689 -23.869 108 HB2 GLU 48 HB2 GLU 48 -14.910 -0.299 -22.080 109 HB3 GLU 48 HB1 GLU 48 -16.073 -1.615 -21.911 110 HG2 GLU 48 HG2 GLU 48 -15.691 -2.256 -24.266 111 HG3 GLU 48 HG1 GLU 48 -14.549 -0.925 -24.449 112 H SER 49 HN SER 49 -18.666 -1.266 -22.093 113 HA SER 49 HA SER 49 -19.397 -2.807 -24.438 114 HB2 SER 49 HB2 SER 49 -20.663 -2.602 -21.695 115 HB3 SER 49 HB1 SER 49 -21.167 -3.726 -22.955 116 HG SER 49 HG SER 49 -18.464 -3.604 -22.219 117 H ALA 50 HN ALA 50 -20.099 0.275 -23.209 118 HA ALA 50 HA ALA 50 -22.779 0.371 -24.413 119 HB1 ALA 50 HB1 ALA 50 -21.191 2.123 -22.587 120 HB2 ALA 50 HB2 ALA 50 -22.870 1.604 -22.464 121 HB3 ALA 50 HB3 ALA 50 -22.425 2.877 -23.596 122 H ILE 51 HN ILE 51 -19.562 0.823 -25.292 123 HA ILE 51 HA ILE 51 -20.326 1.956 -27.846 124 HB ILE 51 HB ILE 51 -19.518 4.061 -27.630 125 HG12 ILE 51 HG12 ILE 51 -17.193 3.276 -27.523 126 HG13 ILE 51 HG11 ILE 51 -17.435 4.590 -26.366 127 HG21 ILE 51 HG21 ILE 51 -19.687 3.269 -24.710 128 HG22 ILE 51 HG22 ILE 51 -20.978 3.960 -25.692 129 HG23 ILE 51 HG23 ILE 51 -19.565 4.933 -25.283 130 HD11 ILE 51 HD1 ILE 51 -17.969 1.857 -25.343 131 HD12 ILE 51 HD2 ILE 51 -17.174 3.219 -24.556 132 HD13 ILE 51 HD3 ILE 51 -16.282 2.223 -25.706 133 HA PRO 52 HA PRO 52 -16.824 -0.196 -29.375 134 HB2 PRO 52 HB2 PRO 52 -15.455 1.680 -30.851 135 HB3 PRO 52 HB1 PRO 52 -16.959 0.901 -31.389 136 HG2 PRO 52 HG2 PRO 52 -16.572 3.566 -30.090 137 HG3 PRO 52 HG1 PRO 52 -17.578 3.130 -31.487 138 HD2 PRO 52 HD2 PRO 52 -18.672 3.436 -29.066 139 HD3 PRO 52 HD1 PRO 52 -19.228 2.142 -30.153 140 H GLN 53 HN GLN 53 -14.796 -0.796 -28.713 141 HA GLN 53 HA GLN 53 -13.599 -0.065 -26.445 142 HB2 GLN 53 HB2 GLN 53 -11.379 -0.662 -27.496 143 HB3 GLN 53 HB1 GLN 53 -12.661 -1.858 -27.722 144 HG2 GLN 53 HG2 GLN 53 -13.128 -0.950 -29.960 145 HG3 GLN 53 HG1 GLN 53 -11.881 0.275 -29.736 146 HE21 GLN 53 HE21 GLN 53 -12.028 -2.017 -31.734 147 HE22 GLN 53 HE22 GLN 53 -10.584 -2.878 -31.503 148 H VAL 54 HN VAL 54 -13.909 2.152 -26.018 149 HA VAL 54 HA VAL 54 -12.867 4.240 -27.638 150 HB VAL 54 HB VAL 54 -13.232 5.669 -25.674 151 HG11 VAL 54 HG11 VAL 54 -15.282 5.447 -26.696 152 HG12 VAL 54 HG12 VAL 54 -15.671 4.656 -25.172 153 HG13 VAL 54 HG13 VAL 54 -15.264 3.688 -26.589 154 HG21 VAL 54 HG21 VAL 54 -13.735 3.037 -24.247 155 HG22 VAL 54 HG22 VAL 54 -14.024 4.634 -23.559 156 HG23 VAL 54 HG23 VAL 54 -12.382 4.129 -23.955 157 H TYR 55 HN TYR 55 -10.811 4.726 -27.992 158 HA TYR 55 HA TYR 55 -8.640 3.499 -26.675 159 HB2 TYR 55 HB2 TYR 55 -8.499 4.412 -28.964 160 HB3 TYR 55 HB1 TYR 55 -8.651 6.045 -28.311 161 HD1 TYR 55 HD1 TYR 55 -6.428 3.185 -28.805 162 HD2 TYR 55 HD2 TYR 55 -6.871 6.976 -26.839 163 HE1 TYR 55 HE1 TYR 55 -3.986 3.248 -28.377 164 HE2 TYR 55 HE2 TYR 55 -4.427 7.043 -26.413 165 HH TYR 55 HH TYR 55 -2.462 4.427 -26.589 166 H HIS 56 HN HIS 56 -10.068 6.733 -26.347 167 HA HIS 56 HA HIS 56 -8.356 7.211 -23.994 168 HB2 HIS 56 HB2 HIS 56 -9.919 9.116 -25.749 169 HB3 HIS 56 HB1 HIS 56 -9.031 9.599 -24.305 170 HD2 HIS 56 HD2 HIS 56 -6.171 9.416 -24.557 171 HE1 HIS 56 HE1 HIS 56 -6.197 8.790 -28.732 172 HE2 HIS 56 HE2 HIS 56 -4.726 9.313 -26.729 173 H ILE 57 HN ILE 57 -9.346 6.573 -22.165 174 HA ILE 57 HA ILE 57 -12.059 7.588 -21.659 175 HB ILE 57 HB ILE 57 -12.224 5.198 -22.411 176 HG12 ILE 57 HG12 ILE 57 -12.917 5.564 -19.488 177 HG13 ILE 57 HG11 ILE 57 -13.818 6.330 -20.797 178 HG21 ILE 57 HG21 ILE 57 -9.951 4.745 -21.097 179 HG22 ILE 57 HG22 ILE 57 -11.158 3.475 -21.292 180 HG23 ILE 57 HG23 ILE 57 -11.063 4.377 -19.779 181 HD11 ILE 57 HD1 ILE 57 -14.402 3.857 -19.795 182 HD12 ILE 57 HD2 ILE 57 -13.345 3.432 -21.142 183 HD13 ILE 57 HD3 ILE 57 -14.806 4.375 -21.432 184 H ILE 58 HN ILE 58 -12.128 8.631 -19.768 185 HA ILE 58 HA ILE 58 -10.411 7.730 -17.561 186 HB ILE 58 HB ILE 58 -9.179 9.526 -18.772 187 HG12 ILE 58 HG12 ILE 58 -10.213 10.501 -16.095 188 HG13 ILE 58 HG11 ILE 58 -9.079 9.158 -16.251 189 HG21 ILE 58 HG21 ILE 58 -11.685 10.656 -19.070 190 HG22 ILE 58 HG22 ILE 58 -10.155 11.480 -19.370 191 HG23 ILE 58 HG23 ILE 58 -10.957 11.654 -17.810 192 HD11 ILE 58 HD1 ILE 58 -7.942 11.104 -17.857 193 HD12 ILE 58 HD2 ILE 58 -7.455 10.738 -16.201 194 HD13 ILE 58 HD3 ILE 58 -8.602 12.041 -16.516 195 H VAL 59 HN VAL 59 -11.500 7.682 -15.699 196 HA VAL 59 HA VAL 59 -13.953 9.318 -15.472 197 HB VAL 59 HB VAL 59 -13.411 6.539 -14.406 198 HG11 VAL 59 HG11 VAL 59 -15.875 8.276 -14.083 199 HG12 VAL 59 HG12 VAL 59 -14.682 7.996 -12.815 200 HG13 VAL 59 HG13 VAL 59 -15.641 6.653 -13.435 201 HG21 VAL 59 HG21 VAL 59 -15.322 7.663 -16.476 202 HG22 VAL 59 HG22 VAL 59 -15.428 6.023 -15.834 203 HG23 VAL 59 HG23 VAL 59 -14.008 6.520 -16.755 204 H THR 60 HN THR 60 -13.969 10.731 -13.845 205 HA THR 60 HA THR 60 -12.148 10.270 -11.559 206 HB THR 60 HB THR 60 -12.801 12.921 -12.874 207 HG1 THR 60 HG1 THR 60 -11.332 11.701 -14.065 208 HG21 THR 60 HG21 THR 60 -12.387 12.738 -10.301 209 HG22 THR 60 HG22 THR 60 -11.497 13.951 -11.223 210 HG23 THR 60 HG23 THR 60 -10.711 12.439 -10.765 211 H ASP 61 HN ASP 61 -13.041 10.425 -9.586 212 HA ASP 61 HA ASP 61 -15.881 11.183 -9.430 213 HB2 ASP 61 HB2 ASP 61 -14.102 9.615 -7.552 214 HB3 ASP 61 HB1 ASP 61 -15.782 10.035 -7.210 215 H LEU 62 HN LEU 62 -16.538 12.954 -8.351 216 HA LEU 62 HA LEU 62 -14.594 14.294 -6.574 217 HB2 LEU 62 HB2 LEU 62 -15.522 15.289 -9.031 218 HB3 LEU 62 HB1 LEU 62 -16.369 16.199 -7.810 219 HG LEU 62 HG LEU 62 -14.143 17.182 -8.464 220 HD11 LEU 62 HD11 LEU 62 -13.841 17.971 -6.332 221 HD12 LEU 62 HD12 LEU 62 -13.801 16.353 -5.629 222 HD13 LEU 62 HD13 LEU 62 -15.346 17.099 -6.038 223 HD21 LEU 62 HD21 LEU 62 -12.357 15.816 -8.602 224 HD22 LEU 62 HD22 LEU 62 -13.340 14.463 -8.042 225 HD23 LEU 62 HD23 LEU 62 -12.489 15.477 -6.877 226 H SER 63 HN SER 63 -17.864 13.364 -7.268 227 HA SER 63 HA SER 63 -19.237 14.957 -5.402 228 HB2 SER 63 HB2 SER 63 -20.396 13.622 -7.107 229 HB3 SER 63 HB1 SER 63 -19.855 12.138 -6.330 230 HG SER 63 HG SER 63 -21.906 12.605 -5.594 231 H TYR 64 HN TYR 64 -17.759 11.742 -5.082 232 HA TYR 64 HA TYR 64 -17.308 12.198 -2.250 233 HB2 TYR 64 HB2 TYR 64 -19.085 9.942 -3.206 234 HB3 TYR 64 HB1 TYR 64 -18.441 10.098 -1.570 235 HD1 TYR 64 HD1 TYR 64 -20.801 11.471 -4.039 236 HD2 TYR 64 HD2 TYR 64 -19.227 11.860 -0.060 237 HE1 TYR 64 HE1 TYR 64 -22.668 12.992 -3.449 238 HE2 TYR 64 HE2 TYR 64 -21.096 13.382 0.529 239 HH TYR 64 HH TYR 64 -23.866 13.674 -1.273 240 H GLY 65 HN GLY 65 -16.079 11.348 -5.041 241 HA2 GLY 65 HA2 GLY 65 -14.033 10.340 -5.502 242 HA3 GLY 65 HA1 GLY 65 -14.003 9.714 -3.854 243 H CYS 66 HN CYS 66 -16.987 9.028 -5.120 244 HA CYS 66 HA CYS 66 -16.156 6.501 -6.378 245 HB2 CYS 66 HB2 CYS 66 -16.528 6.042 -3.966 246 HB3 CYS 66 HB1 CYS 66 -18.173 6.663 -4.125 247 HG CYS 66 HG CYS 66 -18.312 4.677 -6.101 248 H GLY 67 HN GLY 67 -17.414 5.932 -8.070 249 HA2 GLY 67 HA2 GLY 67 -19.443 5.745 -9.286 250 HA3 GLY 67 HA1 GLY 67 -20.110 7.066 -8.325 251 H GLN 68 HN GLN 68 -20.170 6.855 -11.191 252 HA GLN 68 HA GLN 68 -18.181 8.391 -12.464 253 HB2 GLN 68 HB2 GLN 68 -19.839 6.997 -13.670 254 HB3 GLN 68 HB1 GLN 68 -21.105 8.132 -13.208 255 HG2 GLN 68 HG2 GLN 68 -20.027 9.926 -14.431 256 HG3 GLN 68 HG1 GLN 68 -18.634 8.904 -14.780 257 HE21 GLN 68 HE21 GLN 68 -22.225 8.666 -15.160 258 HE22 GLN 68 HE22 GLN 68 -22.153 8.029 -16.732 259 H SER 69 HN SER 69 -21.174 9.304 -10.799 260 HA SER 69 HA SER 69 -21.705 11.828 -11.436 261 HB2 SER 69 HB2 SER 69 -21.197 10.930 -8.594 262 HB3 SER 69 HB1 SER 69 -22.125 12.350 -9.068 263 HG SER 69 HG SER 69 -23.744 11.101 -9.582 264 H PHE 70 HN PHE 70 -20.021 12.934 -12.418 265 HA PHE 70 HA PHE 70 -18.639 14.818 -10.965 266 HB2 PHE 70 HB2 PHE 70 -17.366 12.974 -9.957 267 HB3 PHE 70 HB1 PHE 70 -16.885 12.430 -11.564 268 HD1 PHE 70 HD1 PHE 70 -14.608 12.856 -10.093 269 HD2 PHE 70 HD2 PHE 70 -17.127 15.884 -11.799 270 HE1 PHE 70 HE1 PHE 70 -12.712 14.450 -10.062 271 HE2 PHE 70 HE2 PHE 70 -15.231 17.478 -11.768 272 HZ PHE 70 HZ PHE 70 -13.021 16.761 -10.901 273 H ASP 71 HN ASP 71 -16.291 13.499 -12.936 274 HA ASP 71 HA ASP 71 -17.326 14.659 -15.416 275 HB2 ASP 71 HB2 ASP 71 -16.157 16.477 -14.094 276 HB3 ASP 71 HB1 ASP 71 -14.672 15.543 -14.266 277 H ILE 72 HN ILE 72 -16.878 13.293 -17.016 278 HA ILE 72 HA ILE 72 -14.380 11.711 -16.881 279 HB ILE 72 HB ILE 72 -15.582 9.801 -17.842 280 HG12 ILE 72 HG12 ILE 72 -18.101 11.439 -17.441 281 HG13 ILE 72 HG11 ILE 72 -17.307 11.242 -19.007 282 HG21 ILE 72 HG21 ILE 72 -17.301 10.618 -15.528 283 HG22 ILE 72 HG22 ILE 72 -15.564 10.465 -15.266 284 HG23 ILE 72 HG23 ILE 72 -16.495 9.079 -15.833 285 HD11 ILE 72 HD1 ILE 72 -19.246 9.597 -18.287 286 HD12 ILE 72 HD2 ILE 72 -17.952 8.802 -17.390 287 HD13 ILE 72 HD3 ILE 72 -17.831 8.980 -19.139 288 H VAL 73 HN VAL 73 -13.473 11.125 -18.918 289 HA VAL 73 HA VAL 73 -14.469 12.734 -21.195 290 HB VAL 73 HB VAL 73 -11.583 12.205 -20.442 291 HG11 VAL 73 HG11 VAL 73 -10.957 13.157 -22.443 292 HG12 VAL 73 HG12 VAL 73 -12.411 14.148 -22.547 293 HG13 VAL 73 HG13 VAL 73 -12.482 12.435 -22.956 294 HG21 VAL 73 HG21 VAL 73 -12.040 14.944 -20.613 295 HG22 VAL 73 HG22 VAL 73 -11.901 14.015 -19.119 296 HG23 VAL 73 HG23 VAL 73 -13.490 14.336 -19.814 297 H VAL 74 HN VAL 74 -14.998 11.537 -22.904 298 HA VAL 74 HA VAL 74 -13.585 8.975 -23.322 299 HB VAL 74 HB VAL 74 -16.558 9.501 -23.496 300 HG11 VAL 74 HG11 VAL 74 -15.233 6.867 -24.102 301 HG12 VAL 74 HG12 VAL 74 -15.412 8.078 -25.371 302 HG13 VAL 74 HG13 VAL 74 -16.840 7.434 -24.561 303 HG21 VAL 74 HG21 VAL 74 -15.731 8.999 -21.244 304 HG22 VAL 74 HG22 VAL 74 -14.855 7.595 -21.856 305 HG23 VAL 74 HG23 VAL 74 -16.619 7.609 -21.868 306 H VAL 75 HN VAL 75 -12.718 8.802 -25.289 307 HA VAL 75 HA VAL 75 -13.909 10.358 -27.507 308 HB VAL 75 HB VAL 75 -10.958 9.934 -26.980 309 HG11 VAL 75 HG11 VAL 75 -10.626 10.436 -29.145 310 HG12 VAL 75 HG12 VAL 75 -11.577 11.911 -28.971 311 HG13 VAL 75 HG13 VAL 75 -12.370 10.395 -29.399 312 HG21 VAL 75 HG21 VAL 75 -11.403 11.694 -25.574 313 HG22 VAL 75 HG22 VAL 75 -12.880 12.137 -26.430 314 HG23 VAL 75 HG23 VAL 75 -11.310 12.609 -27.078 315 H SER 76 HN SER 76 -14.469 9.136 -29.183 316 HA SER 76 HA SER 76 -12.907 6.836 -29.987 317 HB2 SER 76 HB2 SER 76 -14.692 5.203 -29.757 318 HB3 SER 76 HB1 SER 76 -14.346 5.914 -28.185 319 HG SER 76 HG SER 76 -16.530 6.314 -29.911 320 H ASP 77 HN ASP 77 -13.924 5.775 -31.942 321 HA ASP 77 HA ASP 77 -14.615 7.788 -33.845 322 HB2 ASP 77 HB2 ASP 77 -14.535 4.777 -33.994 323 HB3 ASP 77 HB1 ASP 77 -14.952 5.795 -35.364 324 H PHE 78 HN PHE 78 -16.453 6.093 -31.580 325 HA PHE 78 HA PHE 78 -18.860 5.579 -32.922 326 HB2 PHE 78 HB2 PHE 78 -18.277 4.899 -30.567 327 HB3 PHE 78 HB1 PHE 78 -18.609 6.562 -30.073 328 HD1 PHE 78 HD1 PHE 78 -20.106 3.547 -31.657 329 HD2 PHE 78 HD2 PHE 78 -20.843 7.356 -29.815 330 HE1 PHE 78 HE1 PHE 78 -22.531 3.032 -31.565 331 HE2 PHE 78 HE2 PHE 78 -23.269 6.842 -29.722 332 HZ PHE 78 HZ PHE 78 -24.113 4.681 -30.598 333 H PHE 79 HN PHE 79 -17.487 8.577 -31.723 334 HA PHE 79 HA PHE 79 -19.951 10.069 -32.164 335 HB2 PHE 79 HB2 PHE 79 -18.377 10.622 -30.299 336 HB3 PHE 79 HB1 PHE 79 -17.190 11.115 -31.503 337 HD1 PHE 79 HD1 PHE 79 -20.900 11.586 -31.194 338 HD2 PHE 79 HD2 PHE 79 -17.048 13.441 -31.607 339 HE1 PHE 79 HE1 PHE 79 -21.988 13.809 -31.350 340 HE2 PHE 79 HE2 PHE 79 -18.137 15.666 -31.762 341 HZ PHE 79 HZ PHE 79 -20.607 15.848 -31.633 342 H GLN 80 HN GLN 80 -17.683 8.814 -34.174 343 HA GLN 80 HA GLN 80 -17.334 11.101 -35.931 344 HB2 GLN 80 HB2 GLN 80 -15.540 9.441 -35.730 345 HB3 GLN 80 HB1 GLN 80 -16.626 8.181 -36.317 346 HG2 GLN 80 HG2 GLN 80 -16.873 9.350 -38.452 347 HG3 GLN 80 HG1 GLN 80 -15.860 10.670 -37.870 348 HE21 GLN 80 HE21 GLN 80 -15.061 9.281 -40.185 349 HE22 GLN 80 HE22 GLN 80 -13.695 8.339 -39.831 350 H GLY 81 HN GLY 81 -18.785 11.724 -37.387 351 HA2 GLY 81 HA2 GLY 81 -20.321 11.558 -39.124 352 HA3 GLY 81 HA1 GLY 81 -20.259 9.803 -38.970 353 H LYS 82 HN LYS 82 -20.720 11.151 -35.951 354 HA LYS 82 HA LYS 82 -23.664 11.005 -36.180 355 HB2 LYS 82 HB2 LYS 82 -21.925 9.775 -34.026 356 HB3 LYS 82 HB1 LYS 82 -23.684 9.887 -33.951 357 HG2 LYS 82 HG2 LYS 82 -23.865 8.569 -36.028 358 HG3 LYS 82 HG1 LYS 82 -22.106 8.456 -36.110 359 HD2 LYS 82 HD2 LYS 82 -22.058 7.261 -33.969 360 HD3 LYS 82 HD1 LYS 82 -23.810 7.411 -33.829 361 HE2 LYS 82 HE2 LYS 82 -23.215 5.188 -34.694 362 HE3 LYS 82 HE1 LYS 82 -24.077 6.114 -35.925 363 HZ1 LYS 82 HZ1 LYS 82 -22.352 5.804 -37.254 364 HZ2 LYS 82 HZ2 LYS 82 -21.470 5.034 -36.023 365 HZ3 LYS 82 HZ3 LYS 82 -21.387 6.722 -36.203 366 H SER 83 HN SER 83 -24.821 12.396 -34.883 367 HA SER 83 HA SER 83 -23.455 14.775 -34.042 368 HB2 SER 83 HB2 SER 83 -25.649 15.618 -33.507 369 HB3 SER 83 HB1 SER 83 -25.762 14.729 -35.024 370 HG SER 83 HG SER 83 -27.359 13.843 -33.905 371 H LYS 84 HN LYS 84 -23.749 15.724 -31.860 372 HA LYS 84 HA LYS 84 -22.760 14.011 -29.848 373 HB2 LYS 84 HB2 LYS 84 -22.401 16.458 -29.849 374 HB3 LYS 84 HB1 LYS 84 -24.119 16.699 -29.523 375 HG2 LYS 84 HG2 LYS 84 -23.908 15.432 -27.421 376 HG3 LYS 84 HG1 LYS 84 -22.196 15.168 -27.746 377 HD2 LYS 84 HD2 LYS 84 -21.811 17.609 -27.721 378 HD3 LYS 84 HD1 LYS 84 -23.523 17.872 -27.383 379 HE2 LYS 84 HE2 LYS 84 -23.315 16.611 -25.280 380 HE3 LYS 84 HE1 LYS 84 -21.610 16.313 -25.618 381 HZ1 LYS 84 HZ1 LYS 84 -22.819 18.595 -24.468 382 HZ2 LYS 84 HZ2 LYS 84 -21.997 19.038 -25.887 383 HZ3 LYS 84 HZ3 LYS 84 -21.171 18.234 -24.639 384 H LEU 85 HN LEU 85 -26.000 15.277 -30.498 385 HA LEU 85 HA LEU 85 -27.277 14.252 -28.208 386 HB2 LEU 85 HB2 LEU 85 -28.224 15.049 -30.947 387 HB3 LEU 85 HB1 LEU 85 -29.342 14.324 -29.791 388 HG LEU 85 HG LEU 85 -29.219 16.877 -29.763 389 HD11 LEU 85 HD11 LEU 85 -29.741 16.890 -27.508 390 HD12 LEU 85 HD12 LEU 85 -28.384 15.848 -27.081 391 HD13 LEU 85 HD13 LEU 85 -29.830 15.157 -27.818 392 HD21 LEU 85 HD21 LEU 85 -26.643 16.399 -28.253 393 HD22 LEU 85 HD22 LEU 85 -27.313 17.934 -28.809 394 HD23 LEU 85 HD23 LEU 85 -26.650 16.787 -29.973 395 H MET 86 HN MET 86 -26.742 12.853 -31.430 396 HA MET 86 HA MET 86 -28.219 10.475 -31.011 397 HB2 MET 86 HB2 MET 86 -25.923 11.121 -32.868 398 HB3 MET 86 HB1 MET 86 -26.785 9.582 -32.895 399 HG2 MET 86 HG2 MET 86 -28.040 12.321 -33.279 400 HG3 MET 86 HG1 MET 86 -27.741 11.135 -34.553 401 HE1 MET 86 HE1 MET 86 -30.068 8.256 -33.905 402 HE2 MET 86 HE2 MET 86 -28.464 8.332 -33.180 403 HE3 MET 86 HE3 MET 86 -28.720 8.966 -34.804 404 H ARG 87 HN ARG 87 -24.806 11.283 -30.438 405 HA ARG 87 HA ARG 87 -23.947 8.680 -29.731 406 HB2 ARG 87 HB2 ARG 87 -22.367 10.481 -30.273 407 HB3 ARG 87 HB1 ARG 87 -22.854 11.356 -28.822 408 HG2 ARG 87 HG2 ARG 87 -22.103 9.431 -27.438 409 HG3 ARG 87 HG1 ARG 87 -21.561 8.612 -28.903 410 HD2 ARG 87 HD2 ARG 87 -19.984 10.421 -29.370 411 HD3 ARG 87 HD1 ARG 87 -20.568 11.320 -27.974 412 HE ARG 87 HE ARG 87 -19.479 9.747 -26.556 413 HH11 ARG 87 HH11 ARG 87 -19.115 9.107 -29.938 414 HH12 ARG 87 HH12 ARG 87 -17.795 8.010 -29.728 415 HH21 ARG 87 HH21 ARG 87 -17.751 8.296 -26.275 416 HH22 ARG 87 HH22 ARG 87 -17.023 7.549 -27.657 417 H SER 88 HN SER 88 -25.228 11.361 -27.783 418 HA SER 88 HA SER 88 -24.849 10.201 -25.250 419 HB2 SER 88 HB2 SER 88 -26.967 12.140 -26.199 420 HB3 SER 88 HB1 SER 88 -26.668 11.737 -24.510 421 HG SER 88 HG SER 88 -24.460 12.454 -26.030 422 H ARG 89 HN ARG 89 -27.581 10.005 -27.526 423 HA ARG 89 HA ARG 89 -29.246 8.439 -25.840 424 HB2 ARG 89 HB2 ARG 89 -29.154 8.785 -28.842 425 HB3 ARG 89 HB1 ARG 89 -30.378 7.814 -28.023 426 HG2 ARG 89 HG2 ARG 89 -31.058 9.781 -26.698 427 HG3 ARG 89 HG1 ARG 89 -29.834 10.756 -27.513 428 HD2 ARG 89 HD2 ARG 89 -30.931 10.305 -29.682 429 HD3 ARG 89 HD1 ARG 89 -32.163 9.354 -28.856 430 HE ARG 89 HE ARG 89 -31.938 12.256 -28.886 431 HH11 ARG 89 HH11 ARG 89 -33.246 9.416 -27.401 432 HH12 ARG 89 HH12 ARG 89 -34.571 10.248 -26.658 433 HH21 ARG 89 HH21 ARG 89 -33.668 13.354 -27.906 434 HH22 ARG 89 HH22 ARG 89 -34.809 12.476 -26.944 435 H ALA 90 HN ALA 90 -26.833 7.644 -28.298 436 HA ALA 90 HA ALA 90 -27.211 4.839 -28.306 437 HB1 ALA 90 HB1 ALA 90 -25.693 4.995 -29.947 438 HB2 ALA 90 HB2 ALA 90 -24.461 5.500 -28.792 439 HB3 ALA 90 HB3 ALA 90 -25.488 6.706 -29.570 440 H VAL 91 HN VAL 91 -25.038 6.949 -26.437 441 HA VAL 91 HA VAL 91 -23.782 4.805 -25.012 442 HB VAL 91 HB VAL 91 -22.714 7.021 -25.300 443 HG11 VAL 91 HG11 VAL 91 -23.513 8.918 -23.946 444 HG12 VAL 91 HG12 VAL 91 -24.862 7.945 -23.364 445 HG13 VAL 91 HG13 VAL 91 -24.765 8.387 -25.068 446 HG21 VAL 91 HG21 VAL 91 -23.275 5.985 -22.516 447 HG22 VAL 91 HG22 VAL 91 -22.161 7.325 -22.793 448 HG23 VAL 91 HG23 VAL 91 -21.833 5.744 -23.502 449 H ASN 92 HN ASN 92 -26.435 7.048 -24.292 450 HA ASN 92 HA ASN 92 -26.881 6.232 -21.624 451 HB2 ASN 92 HB2 ASN 92 -27.851 8.284 -22.364 452 HB3 ASN 92 HB1 ASN 92 -28.694 7.483 -23.691 453 HD21 ASN 92 HD21 ASN 92 -28.714 5.578 -20.840 454 HD22 ASN 92 HD22 ASN 92 -30.273 5.978 -20.310 455 H LYS 93 HN LYS 93 -28.386 5.188 -24.675 456 HA LYS 93 HA LYS 93 -30.172 3.323 -23.518 457 HB2 LYS 93 HB2 LYS 93 -28.975 3.509 -26.289 458 HB3 LYS 93 HB1 LYS 93 -30.212 2.333 -25.840 459 HG2 LYS 93 HG2 LYS 93 -31.712 4.173 -25.157 460 HG3 LYS 93 HG1 LYS 93 -30.477 5.346 -25.618 461 HD2 LYS 93 HD2 LYS 93 -30.553 4.515 -27.943 462 HD3 LYS 93 HD1 LYS 93 -31.795 3.350 -27.484 463 HE2 LYS 93 HE2 LYS 93 -33.292 5.193 -26.821 464 HE3 LYS 93 HE1 LYS 93 -32.050 6.365 -27.263 465 HZ1 LYS 93 HZ1 LYS 93 -32.993 6.324 -29.266 466 HZ2 LYS 93 HZ2 LYS 93 -33.867 4.904 -28.939 467 HZ3 LYS 93 HZ3 LYS 93 -32.256 4.811 -29.472 468 H ALA 94 HN ALA 94 -26.870 2.978 -24.797 469 HA ALA 94 HA ALA 94 -26.719 0.167 -24.534 470 HB1 ALA 94 HB1 ALA 94 -25.095 2.063 -25.597 471 HB2 ALA 94 HB2 ALA 94 -24.586 0.407 -25.264 472 HB3 ALA 94 HB3 ALA 94 -24.226 1.691 -24.108 473 H VAL 95 HN VAL 95 -25.924 2.800 -22.294 474 HA VAL 95 HA VAL 95 -25.687 0.775 -20.151 475 HB VAL 95 HB VAL 95 -24.228 2.774 -19.118 476 HG11 VAL 95 HG11 VAL 95 -23.384 0.543 -19.260 477 HG12 VAL 95 HG12 VAL 95 -22.224 1.552 -20.124 478 HG13 VAL 95 HG13 VAL 95 -23.389 0.579 -21.022 479 HG21 VAL 95 HG21 VAL 95 -22.741 3.561 -21.054 480 HG22 VAL 95 HG22 VAL 95 -24.338 4.302 -20.950 481 HG23 VAL 95 HG23 VAL 95 -24.033 3.024 -22.127 482 H LYS 96 HN LYS 96 -28.140 1.889 -20.801 483 HA LYS 96 HA LYS 96 -28.730 4.219 -19.265 484 HB2 LYS 96 HB2 LYS 96 -31.043 3.727 -19.730 485 HB3 LYS 96 HB1 LYS 96 -30.115 3.363 -21.184 486 HG2 LYS 96 HG2 LYS 96 -30.046 0.974 -20.530 487 HG3 LYS 96 HG1 LYS 96 -31.019 1.349 -19.106 488 HD2 LYS 96 HD2 LYS 96 -31.911 1.950 -21.938 489 HD3 LYS 96 HD1 LYS 96 -32.343 0.472 -21.076 490 HE2 LYS 96 HE2 LYS 96 -33.321 1.888 -19.253 491 HE3 LYS 96 HE1 LYS 96 -33.008 3.312 -20.246 492 HZ1 LYS 96 HZ1 LYS 96 -34.614 2.749 -21.732 493 HZ2 LYS 96 HZ2 LYS 96 -35.293 2.051 -20.340 494 HZ3 LYS 96 HZ3 LYS 96 -34.461 1.081 -21.459 495 H GLU 97 HN GLU 97 -28.461 0.823 -18.544 496 HA GLU 97 HA GLU 97 -30.075 0.680 -16.250 497 HB2 GLU 97 HB2 GLU 97 -29.087 -1.301 -17.351 498 HB3 GLU 97 HB1 GLU 97 -27.485 -0.793 -16.814 499 HG2 GLU 97 HG2 GLU 97 -28.205 -0.950 -14.468 500 HG3 GLU 97 HG1 GLU 97 -29.820 -1.431 -14.987 501 H GLU 98 HN GLU 98 -26.627 1.479 -16.604 502 HA GLU 98 HA GLU 98 -26.181 1.932 -13.823 503 HB2 GLU 98 HB2 GLU 98 -24.039 2.803 -14.486 504 HB3 GLU 98 HB1 GLU 98 -24.396 1.417 -15.517 505 HG2 GLU 98 HG2 GLU 98 -25.174 2.909 -17.290 506 HG3 GLU 98 HG1 GLU 98 -24.884 4.313 -16.269 507 H LEU 99 HN LEU 99 -27.214 3.947 -16.504 508 HA LEU 99 HA LEU 99 -26.837 6.473 -15.295 509 HB2 LEU 99 HB2 LEU 99 -28.755 5.527 -17.428 510 HB3 LEU 99 HB1 LEU 99 -28.606 7.215 -16.938 511 HG LEU 99 HG LEU 99 -26.254 5.541 -17.850 512 HD11 LEU 99 HD11 LEU 99 -28.307 7.067 -19.377 513 HD12 LEU 99 HD12 LEU 99 -27.356 5.662 -19.862 514 HD13 LEU 99 HD13 LEU 99 -26.629 7.268 -19.880 515 HD21 LEU 99 HD21 LEU 99 -26.577 8.149 -16.667 516 HD22 LEU 99 HD22 LEU 99 -25.947 8.330 -18.304 517 HD23 LEU 99 HD23 LEU 99 -25.086 7.331 -17.133 518 H GLN 100 HN GLN 100 -29.541 4.181 -15.229 519 HA GLN 100 HA GLN 100 -31.429 5.819 -13.941 520 HB2 GLN 100 HB2 GLN 100 -31.974 3.642 -14.971 521 HB3 GLN 100 HB1 GLN 100 -31.074 2.821 -13.694 522 HG2 GLN 100 HG2 GLN 100 -32.583 3.834 -12.002 523 HG3 GLN 100 HG1 GLN 100 -33.504 4.591 -13.300 524 HE21 GLN 100 HE21 GLN 100 -35.363 3.419 -13.763 525 HE22 GLN 100 HE22 GLN 100 -35.494 1.728 -13.691 526 H GLU 101 HN GLU 101 -28.878 3.732 -12.616 527 HA GLU 101 HA GLU 101 -29.602 4.218 -9.872 528 HB2 GLU 101 HB2 GLU 101 -27.074 3.074 -11.082 529 HB3 GLU 101 HB1 GLU 101 -27.452 3.095 -9.359 530 HG2 GLU 101 HG2 GLU 101 -29.219 1.808 -11.460 531 HG3 GLU 101 HG1 GLU 101 -28.034 0.927 -10.499 532 H ILE 102 HN ILE 102 -27.488 5.700 -12.222 533 HA ILE 102 HA ILE 102 -26.760 7.750 -10.221 534 HB ILE 102 HB ILE 102 -24.826 6.284 -10.668 535 HG12 ILE 102 HG12 ILE 102 -24.485 8.991 -11.983 536 HG13 ILE 102 HG11 ILE 102 -24.592 8.762 -10.238 537 HG21 ILE 102 HG21 ILE 102 -24.195 7.158 -13.320 538 HG22 ILE 102 HG22 ILE 102 -25.811 6.451 -13.338 539 HG23 ILE 102 HG23 ILE 102 -24.444 5.510 -12.744 540 HD11 ILE 102 HD1 ILE 102 -22.427 8.167 -10.139 541 HD12 ILE 102 HD2 ILE 102 -22.286 8.529 -11.858 542 HD13 ILE 102 HD3 ILE 102 -22.691 6.895 -11.332 543 H HIS 103 HN HIS 103 -27.260 9.753 -10.792 544 HA HIS 103 HA HIS 103 -27.393 10.499 -13.630 545 HB2 HIS 103 HB2 HIS 103 -29.690 9.825 -12.928 546 HB3 HIS 103 HB1 HIS 103 -29.631 11.058 -11.667 547 HD2 HIS 103 HD2 HIS 103 -28.149 12.003 -15.159 548 HE1 HIS 103 HE1 HIS 103 -31.846 14.000 -14.761 549 HE2 HIS 103 HE2 HIS 103 -29.758 13.783 -16.189 550 H ALA 104 HN ALA 104 -25.550 11.769 -13.298 551 HA ALA 104 HA ALA 104 -25.820 14.428 -12.763 552 HB1 ALA 104 HB1 ALA 104 -25.973 12.979 -10.311 553 HB2 ALA 104 HB2 ALA 104 -25.998 14.725 -10.555 554 HB3 ALA 104 HB3 ALA 104 -24.463 13.890 -10.316 555 H PHE 105 HN PHE 105 -24.339 13.149 -14.557 556 HA PHE 105 HA PHE 105 -21.604 13.903 -13.811 557 HB2 PHE 105 HB2 PHE 105 -20.637 11.845 -14.614 558 HB3 PHE 105 HB1 PHE 105 -21.858 11.433 -13.409 559 HD1 PHE 105 HD1 PHE 105 -20.994 11.389 -16.978 560 HD2 PHE 105 HD2 PHE 105 -24.010 10.453 -14.066 561 HE1 PHE 105 HE1 PHE 105 -22.188 10.011 -18.659 562 HE2 PHE 105 HE2 PHE 105 -25.204 9.074 -15.747 563 HZ PHE 105 HZ PHE 105 -24.293 8.853 -18.044 564 H SER 106 HN SER 106 -20.202 14.178 -15.695 565 HA SER 106 HA SER 106 -21.769 14.845 -18.114 566 HB2 SER 106 HB2 SER 106 -19.962 16.448 -18.623 567 HB3 SER 106 HB1 SER 106 -20.707 16.781 -17.059 568 HG SER 106 HG SER 106 -18.890 16.301 -16.110 569 H CYS 107 HN CYS 107 -21.140 14.080 -20.096 570 HA CYS 107 HA CYS 107 -18.767 12.314 -20.161 571 HB2 CYS 107 HB2 CYS 107 -20.066 10.892 -21.779 572 HB3 CYS 107 HB1 CYS 107 -20.687 10.871 -20.131 573 HG CYS 107 HG CYS 107 -22.794 11.919 -20.918 574 H LYS 108 HN LYS 108 -17.608 14.137 -21.039 575 HA LYS 108 HA LYS 108 -18.392 15.479 -23.414 576 HB2 LYS 108 HB2 LYS 108 -15.668 15.071 -22.158 577 HB3 LYS 108 HB1 LYS 108 -15.983 16.153 -23.515 578 HG2 LYS 108 HG2 LYS 108 -17.651 17.370 -22.125 579 HG3 LYS 108 HG1 LYS 108 -17.243 16.328 -20.761 580 HD2 LYS 108 HD2 LYS 108 -15.204 18.015 -22.234 581 HD3 LYS 108 HD1 LYS 108 -16.037 18.552 -20.774 582 HE2 LYS 108 HE2 LYS 108 -15.188 16.498 -19.606 583 HE3 LYS 108 HE1 LYS 108 -14.241 16.125 -21.046 584 HZ1 LYS 108 HZ1 LYS 108 -13.086 18.212 -20.817 585 HZ2 LYS 108 HZ2 LYS 108 -12.955 17.330 -19.370 586 HZ3 LYS 108 HZ3 LYS 108 -14.035 18.637 -19.477 587 H CYS 109 HN CYS 109 -18.205 14.929 -25.512 588 HA CYS 109 HA CYS 109 -16.759 12.425 -26.151 589 HB2 CYS 109 HB2 CYS 109 -19.167 13.614 -27.555 590 HB3 CYS 109 HB1 CYS 109 -18.365 12.098 -27.969 591 HG CYS 109 HG CYS 109 -19.136 11.124 -25.654 592 H TYR 110 HN TYR 110 -15.045 12.641 -27.442 593 HA TYR 110 HA TYR 110 -14.970 14.922 -29.317 594 HB2 TYR 110 HB2 TYR 110 -12.663 13.895 -27.644 595 HB3 TYR 110 HB1 TYR 110 -12.567 15.173 -28.857 596 HD1 TYR 110 HD1 TYR 110 -13.291 14.396 -25.423 597 HD2 TYR 110 HD2 TYR 110 -14.077 17.238 -28.547 598 HE1 TYR 110 HE1 TYR 110 -14.004 16.061 -23.729 599 HE2 TYR 110 HE2 TYR 110 -14.787 18.904 -26.854 600 HH TYR 110 HH TYR 110 -14.507 19.377 -24.512 601 H THR 111 HN THR 111 -14.166 14.490 -31.325 602 HA THR 111 HA THR 111 -12.603 12.201 -31.975 603 HB THR 111 HB THR 111 -15.438 12.049 -32.991 604 HG1 THR 111 HG1 THR 111 -14.724 10.183 -31.163 605 HG21 THR 111 HG21 THR 111 -13.448 10.907 -34.144 606 HG22 THR 111 HG22 THR 111 -14.813 9.876 -33.716 607 HG23 THR 111 HG23 THR 111 -13.359 9.875 -32.717 608 H GLU 112 HN GLU 112 -12.516 15.000 -32.471 609 HA GLU 112 HA GLU 112 -11.638 16.168 -34.294 610 HB2 GLU 112 HB2 GLU 112 -11.417 13.975 -35.501 611 HB3 GLU 112 HB1 GLU 112 -13.074 14.184 -36.067 612 HG2 GLU 112 HG2 GLU 112 -12.473 16.289 -37.154 613 HG3 GLU 112 HG1 GLU 112 -10.822 16.146 -36.555 614 H GLU 113 HN GLU 113 -14.948 15.071 -34.074 615 HA GLU 113 HA GLU 113 -16.164 16.996 -35.746 616 HB2 GLU 113 HB2 GLU 113 -17.201 15.467 -33.359 617 HB3 GLU 113 HB1 GLU 113 -18.208 16.529 -34.341 618 HG2 GLU 113 HG2 GLU 113 -17.625 15.211 -36.353 619 HG3 GLU 113 HG1 GLU 113 -16.635 14.143 -35.358 620 H GLU 114 HN GLU 114 -15.242 17.052 -32.335 621 HA GLU 114 HA GLU 114 -16.509 19.381 -31.498 622 HB2 GLU 114 HB2 GLU 114 -14.729 19.569 -29.836 623 HB3 GLU 114 HB1 GLU 114 -15.181 17.875 -30.029 624 HG2 GLU 114 HG2 GLU 114 -13.273 17.526 -31.545 625 HG3 GLU 114 HG1 GLU 114 -12.825 19.223 -31.379 626 H TRP 115 HN TRP 115 -13.679 18.953 -33.531 627 HA TRP 115 HA TRP 115 -12.686 21.597 -33.443 628 HB2 TRP 115 HB2 TRP 115 -11.223 20.033 -34.385 629 HB3 TRP 115 HB1 TRP 115 -12.468 19.356 -35.439 630 HD1 TRP 115 HD1 TRP 115 -10.358 22.557 -34.996 631 HE1 TRP 115 HE1 TRP 115 -10.134 23.703 -37.293 632 HE3 TRP 115 HE3 TRP 115 -13.397 19.548 -37.788 633 HZ2 TRP 115 HZ2 TRP 115 -11.114 23.391 -39.963 634 HZ3 TRP 115 HZ3 TRP 115 -13.733 19.993 -40.203 635 HH2 TRP 115 HH2 TRP 115 -12.596 21.910 -41.294 636 H SER 116 HN SER 116 -14.981 20.029 -35.660 637 HA SER 116 HA SER 116 -16.159 20.994 -37.448 638 HB2 SER 116 HB2 SER 116 -17.387 22.973 -35.718 639 HB3 SER 116 HB1 SER 116 -18.089 21.529 -36.440 640 HG SER 116 HG SER 116 -17.985 20.717 -34.512 641 H LYS 117 HN LYS 117 -17.254 23.662 -37.449 642 HA LYS 117 HA LYS 117 -15.188 25.021 -38.859 643 HB2 LYS 117 HB2 LYS 117 -16.802 26.842 -39.049 644 HB3 LYS 117 HB1 LYS 117 -17.590 25.296 -39.373 645 HG2 LYS 117 HG2 LYS 117 -18.410 25.244 -37.036 646 HG3 LYS 117 HG1 LYS 117 -17.652 26.810 -36.744 647 HD2 LYS 117 HD2 LYS 117 -19.045 27.773 -38.588 648 HD3 LYS 117 HD1 LYS 117 -19.867 26.219 -38.729 649 HE2 LYS 117 HE2 LYS 117 -19.757 27.900 -36.208 650 HE3 LYS 117 HE1 LYS 117 -21.137 27.811 -37.304 651 HZ1 LYS 117 HZ1 LYS 117 -19.956 25.575 -35.749 652 HZ2 LYS 117 HZ2 LYS 117 -21.183 25.393 -36.910 653 HZ3 LYS 117 HZ3 LYS 117 -21.470 26.297 -35.500 654 H ILE 118 HN ILE 118 -16.098 24.930 -35.532 655 HA ILE 118 HA ILE 118 -15.663 27.197 -34.293 656 HB ILE 118 HB ILE 118 -14.034 24.703 -33.761 657 HG12 ILE 118 HG12 ILE 118 -16.504 25.774 -32.366 658 HG13 ILE 118 HG11 ILE 118 -16.569 24.585 -33.670 659 HG21 ILE 118 HG21 ILE 118 -13.608 27.259 -32.722 660 HG22 ILE 118 HG22 ILE 118 -13.045 25.743 -32.022 661 HG23 ILE 118 HG23 ILE 118 -14.572 26.447 -31.490 662 HD11 ILE 118 HD1 ILE 118 -16.439 23.100 -31.931 663 HD12 ILE 118 HD2 ILE 118 -15.661 24.265 -30.860 664 HD13 ILE 118 HD3 ILE 118 -14.711 23.421 -32.082 665 H VAL 119 HN VAL 119 -14.120 28.758 -33.931 666 HA VAL 119 HA VAL 119 -12.479 29.748 -35.746 667 HB VAL 119 HB VAL 119 -11.784 29.445 -32.816 668 HG11 VAL 119 HG11 VAL 119 -10.159 30.365 -34.978 669 HG12 VAL 119 HG12 VAL 119 -9.804 30.420 -33.252 670 HG13 VAL 119 HG13 VAL 119 -10.636 31.770 -34.025 671 HG21 VAL 119 HG21 VAL 119 -12.914 31.795 -34.366 672 HG22 VAL 119 HG22 VAL 119 -12.726 31.668 -32.617 673 HG23 VAL 119 HG23 VAL 119 -13.905 30.657 -33.452 674 H VAL 120 HN VAL 120 -10.887 29.064 -37.005 675 HA VAL 120 HA VAL 120 -8.556 27.782 -36.257 676 HB VAL 120 HB VAL 120 -9.977 25.879 -35.588 677 HG11 VAL 120 HG11 VAL 120 -11.600 24.983 -36.924 678 HG12 VAL 120 HG12 VAL 120 -10.664 25.230 -38.398 679 HG13 VAL 120 HG13 VAL 120 -11.561 26.573 -37.688 680 HG21 VAL 120 HG21 VAL 120 -8.658 24.956 -38.110 681 HG22 VAL 120 HG22 VAL 120 -8.559 24.284 -36.483 682 HG23 VAL 120 HG23 VAL 120 -7.654 25.741 -36.891 683 H LEU 121 HN LEU 121 -10.047 29.549 -38.261 684 HA LEU 121 HA LEU 121 -8.380 29.787 -40.313 685 HB2 LEU 121 HB2 LEU 121 -9.332 28.265 -42.127 686 HB3 LEU 121 HB1 LEU 121 -8.344 27.482 -40.896 687 HG LEU 121 HG LEU 121 -10.753 27.280 -39.702 688 HD11 LEU 121 HD11 LEU 121 -11.399 28.223 -42.271 689 HD12 LEU 121 HD12 LEU 121 -12.512 27.550 -41.080 690 HD13 LEU 121 HD13 LEU 121 -11.780 26.501 -42.294 691 HD21 LEU 121 HD21 LEU 121 -10.860 24.981 -40.679 692 HD22 LEU 121 HD22 LEU 121 -9.239 25.412 -40.133 693 HD23 LEU 121 HD23 LEU 121 -9.630 25.457 -41.851 694 H GLU 122 HN GLU 122 -11.537 29.799 -39.123 695 HA GLU 122 HA GLU 122 -12.940 30.879 -41.354 696 HB2 GLU 122 HB2 GLU 122 -13.515 31.024 -38.386 697 HB3 GLU 122 HB1 GLU 122 -14.645 31.491 -39.658 698 HG2 GLU 122 HG2 GLU 122 -13.404 28.738 -39.398 699 HG3 GLU 122 HG1 GLU 122 -15.017 29.159 -38.827 700 H HIS 123 HN HIS 123 -10.515 32.172 -39.446 701 HA HIS 123 HA HIS 123 -11.301 34.815 -38.977 702 HB2 HIS 123 HB2 HIS 123 -8.554 33.755 -39.692 703 HB3 HIS 123 HB1 HIS 123 -8.885 35.332 -38.975 704 HD2 HIS 123 HD2 HIS 123 -8.243 31.750 -37.806 705 HE1 HIS 123 HE1 HIS 123 -10.028 33.734 -34.535 706 HE2 HIS 123 HE2 HIS 123 -8.806 31.629 -35.259 707 H HIS 124 HN HIS 124 -11.492 36.598 -40.215 708 HA HIS 124 HA HIS 124 -11.170 36.267 -43.113 709 HB2 HIS 124 HB2 HIS 124 -13.333 37.101 -42.388 710 HB3 HIS 124 HB1 HIS 124 -12.564 38.405 -41.483 711 HD2 HIS 124 HD2 HIS 124 -12.153 40.695 -42.987 712 HE1 HIS 124 HE1 HIS 124 -12.643 38.977 -46.813 713 HE2 HIS 124 HE2 HIS 124 -12.267 41.151 -45.557 714 H HIS 125 HN HIS 125 -9.518 37.169 -44.194 715 HA HIS 125 HA HIS 125 -7.479 38.606 -42.804 716 HB2 HIS 125 HB2 HIS 125 -6.351 38.735 -44.925 717 HB3 HIS 125 HB1 HIS 125 -7.107 37.144 -44.829 718 HD2 HIS 125 HD2 HIS 125 -7.241 40.307 -47.054 719 HE1 HIS 125 HE1 HIS 125 -10.384 37.785 -48.314 720 HE2 HIS 125 HE2 HIS 125 -9.058 39.876 -48.880 721 H HIS 126 HN HIS 126 -6.694 40.758 -43.511 722 HA HIS 126 HA HIS 126 -8.976 42.575 -43.992 723 HB2 HIS 126 HB2 HIS 126 -6.373 43.067 -42.526 724 HB3 HIS 126 HB1 HIS 126 -7.622 44.281 -42.807 725 HD2 HIS 126 HD2 HIS 126 -6.801 41.555 -40.244 726 HE1 HIS 126 HE1 HIS 126 -10.859 42.552 -39.638 727 HE2 HIS 126 HE2 HIS 126 -8.870 41.302 -38.670 728 H HIS 127 HN HIS 127 -8.881 44.015 -45.638 729 HA HIS 127 HA HIS 127 -6.345 44.491 -47.015 730 HB2 HIS 127 HB2 HIS 127 -7.422 42.462 -48.067 731 HB3 HIS 127 HB1 HIS 127 -8.770 43.500 -48.529 732 HD2 HIS 127 HD2 HIS 127 -5.135 42.719 -49.674 733 HE1 HIS 127 HE1 HIS 127 -6.547 45.886 -52.082 734 HE2 HIS 127 HE2 HIS 127 -4.666 44.209 -51.766 735 H HIS 128 HN HIS 128 -6.244 46.496 -47.924 736 HA HIS 128 HA HIS 128 -6.824 48.747 -48.008 737 HB2 HIS 128 HB2 HIS 128 -8.455 49.178 -49.726 738 HB3 HIS 128 HB1 HIS 128 -7.565 47.726 -50.186 739 HD2 HIS 128 HD2 HIS 128 -11.202 48.793 -49.429 740 HE1 HIS 128 HE1 HIS 128 -11.198 44.579 -49.682 741 HE2 HIS 128 HE2 HIS 128 -12.675 46.643 -49.560 Start of MODEL 18 1 H1 MET 36 HT1 MET 36 -19.856 0.005 -2.850 2 H2 MET 36 HT2 MET 36 -21.419 0.467 -3.330 3 H3 MET 36 HT3 MET 36 -20.372 1.604 -2.624 4 HA MET 36 HA MET 36 -19.903 2.207 -4.707 5 HB2 MET 36 HB2 MET 36 -18.424 -0.395 -4.332 6 HB3 MET 36 HB1 MET 36 -18.222 0.564 -5.799 7 HG2 MET 36 HG2 MET 36 -16.496 1.201 -4.205 8 HG3 MET 36 HG1 MET 36 -17.638 2.535 -4.370 9 HE1 MET 36 HE1 MET 36 -16.883 3.636 -2.512 10 HE2 MET 36 HE2 MET 36 -15.778 2.541 -1.684 11 HE3 MET 36 HE3 MET 36 -17.135 3.243 -0.806 12 HA PRO 37 HA PRO 37 -23.233 -0.380 -6.674 13 HB2 PRO 37 HB2 PRO 37 -24.550 1.818 -7.694 14 HB3 PRO 37 HB1 PRO 37 -24.881 1.108 -6.100 15 HG2 PRO 37 HG2 PRO 37 -23.235 3.490 -6.810 16 HG3 PRO 37 HG1 PRO 37 -24.345 3.247 -5.448 17 HD2 PRO 37 HD2 PRO 37 -21.656 3.071 -5.145 18 HD3 PRO 37 HD1 PRO 37 -22.778 2.061 -4.200 19 H VAL 38 HN VAL 38 -21.083 2.140 -7.774 20 HA VAL 38 HA VAL 38 -20.980 0.857 -10.421 21 HB VAL 38 HB VAL 38 -22.443 2.737 -10.788 22 HG11 VAL 38 HG11 VAL 38 -22.271 4.292 -9.120 23 HG12 VAL 38 HG12 VAL 38 -21.147 5.056 -10.244 24 HG13 VAL 38 HG13 VAL 38 -20.534 4.051 -8.936 25 HG21 VAL 38 HG21 VAL 38 -20.954 2.529 -12.611 26 HG22 VAL 38 HG22 VAL 38 -19.578 3.098 -11.666 27 HG23 VAL 38 HG23 VAL 38 -20.829 4.234 -12.175 28 H THR 39 HN THR 39 -18.975 -0.017 -9.915 29 HA THR 39 HA THR 39 -16.828 1.439 -8.766 30 HB THR 39 HB THR 39 -16.705 -1.014 -10.532 31 HG1 THR 39 HG1 THR 39 -17.743 -1.814 -8.892 32 HG21 THR 39 HG21 THR 39 -14.487 -0.527 -10.341 33 HG22 THR 39 HG22 THR 39 -14.679 -1.204 -8.724 34 HG23 THR 39 HG23 THR 39 -14.739 0.543 -8.961 35 H GLU 40 HN GLU 40 -15.258 2.679 -9.655 36 HA GLU 40 HA GLU 40 -15.651 3.912 -12.149 37 HB2 GLU 40 HB2 GLU 40 -14.322 4.914 -10.330 38 HB3 GLU 40 HB1 GLU 40 -13.093 3.669 -10.547 39 HG2 GLU 40 HG2 GLU 40 -12.719 4.423 -12.858 40 HG3 GLU 40 HG1 GLU 40 -13.967 5.650 -12.667 41 H GLN 41 HN GLN 41 -13.444 1.288 -11.186 42 HA GLN 41 HA GLN 41 -12.217 0.972 -13.726 43 HB2 GLN 41 HB2 GLN 41 -11.266 0.071 -11.629 44 HB3 GLN 41 HB1 GLN 41 -12.599 -1.082 -11.536 45 HG2 GLN 41 HG2 GLN 41 -10.638 -2.150 -12.546 46 HG3 GLN 41 HG1 GLN 41 -11.931 -2.009 -13.736 47 HE21 GLN 41 HE21 GLN 41 -9.153 -0.006 -12.567 48 HE22 GLN 41 HE22 GLN 41 -8.700 0.514 -14.118 49 H GLY 42 HN GLY 42 -15.016 -0.569 -12.197 50 HA2 GLY 42 HA2 GLY 42 -15.551 -2.424 -14.277 51 HA3 GLY 42 HA1 GLY 42 -16.696 -1.907 -13.038 52 H LEU 43 HN LEU 43 -16.464 0.918 -13.717 53 HA LEU 43 HA LEU 43 -18.557 1.142 -15.580 54 HB2 LEU 43 HB2 LEU 43 -18.065 2.881 -13.914 55 HB3 LEU 43 HB1 LEU 43 -16.543 3.233 -14.731 56 HG LEU 43 HG LEU 43 -17.748 3.863 -16.769 57 HD11 LEU 43 HD11 LEU 43 -20.219 3.227 -15.132 58 HD12 LEU 43 HD12 LEU 43 -19.647 2.340 -16.548 59 HD13 LEU 43 HD13 LEU 43 -20.229 4.001 -16.718 60 HD21 LEU 43 HD21 LEU 43 -17.417 5.453 -14.723 61 HD22 LEU 43 HD22 LEU 43 -19.157 5.270 -14.500 62 HD23 LEU 43 HD23 LEU 43 -18.528 5.958 -15.997 63 H ARG 44 HN ARG 44 -15.056 1.473 -15.961 64 HA ARG 44 HA ARG 44 -15.011 2.413 -18.601 65 HB2 ARG 44 HB2 ARG 44 -13.023 2.311 -17.128 66 HB3 ARG 44 HB1 ARG 44 -13.032 0.552 -17.255 67 HG2 ARG 44 HG2 ARG 44 -12.748 0.719 -19.698 68 HG3 ARG 44 HG1 ARG 44 -12.743 2.479 -19.580 69 HD2 ARG 44 HD2 ARG 44 -10.443 1.684 -19.687 70 HD3 ARG 44 HD1 ARG 44 -10.756 2.335 -18.081 71 HE ARG 44 HE ARG 44 -10.530 0.182 -17.209 72 HH11 ARG 44 HH11 ARG 44 -10.758 0.151 -20.662 73 HH12 ARG 44 HH12 ARG 44 -10.326 -1.519 -20.813 74 HH21 ARG 44 HH21 ARG 44 -9.963 -2.010 -17.400 75 HH22 ARG 44 HH22 ARG 44 -9.876 -2.743 -18.967 76 H GLU 45 HN GLU 45 -15.113 -0.901 -17.338 77 HA GLU 45 HA GLU 45 -14.926 -2.211 -19.842 78 HB2 GLU 45 HB2 GLU 45 -16.082 -3.090 -17.191 79 HB3 GLU 45 HB1 GLU 45 -15.930 -4.155 -18.589 80 HG2 GLU 45 HG2 GLU 45 -13.506 -3.773 -18.643 81 HG3 GLU 45 HG1 GLU 45 -13.639 -2.662 -17.277 82 H ARG 46 HN ARG 46 -17.680 -1.108 -17.901 83 HA ARG 46 HA ARG 46 -19.700 -2.220 -19.555 84 HB2 ARG 46 HB2 ARG 46 -20.133 -1.533 -17.238 85 HB3 ARG 46 HB1 ARG 46 -19.829 0.149 -17.677 86 HG2 ARG 46 HG2 ARG 46 -22.239 -0.273 -17.675 87 HG3 ARG 46 HG1 ARG 46 -21.690 0.024 -19.328 88 HD2 ARG 46 HD2 ARG 46 -21.615 -2.384 -19.763 89 HD3 ARG 46 HD1 ARG 46 -22.082 -2.720 -18.099 90 HE ARG 46 HE ARG 46 -24.059 -1.068 -19.154 91 HH11 ARG 46 HH11 ARG 46 -22.657 -4.171 -19.768 92 HH12 ARG 46 HH12 ARG 46 -24.110 -4.852 -20.421 93 HH21 ARG 46 HH21 ARG 46 -25.968 -1.954 -20.009 94 HH22 ARG 46 HH22 ARG 46 -25.984 -3.597 -20.557 95 H ILE 47 HN ILE 47 -18.177 0.981 -19.397 96 HA ILE 47 HA ILE 47 -19.732 2.192 -21.410 97 HB ILE 47 HB ILE 47 -16.947 2.797 -20.421 98 HG12 ILE 47 HG12 ILE 47 -18.846 3.020 -18.814 99 HG13 ILE 47 HG11 ILE 47 -18.069 4.565 -19.171 100 HG21 ILE 47 HG21 ILE 47 -16.838 3.998 -22.362 101 HG22 ILE 47 HG22 ILE 47 -17.875 5.122 -21.486 102 HG23 ILE 47 HG23 ILE 47 -18.585 3.955 -22.601 103 HD11 ILE 47 HD1 ILE 47 -20.655 3.508 -20.345 104 HD12 ILE 47 HD2 ILE 47 -19.841 4.967 -20.909 105 HD13 ILE 47 HD3 ILE 47 -20.471 4.889 -19.264 106 H GLU 48 HN GLU 48 -16.630 0.482 -21.494 107 HA GLU 48 HA GLU 48 -16.015 0.884 -24.206 108 HB2 GLU 48 HB2 GLU 48 -14.424 -0.035 -22.554 109 HB3 GLU 48 HB1 GLU 48 -15.375 -1.520 -22.468 110 HG2 GLU 48 HG2 GLU 48 -14.986 -1.907 -24.882 111 HG3 GLU 48 HG1 GLU 48 -14.079 -0.399 -24.986 112 H SER 49 HN SER 49 -18.009 -1.555 -22.591 113 HA SER 49 HA SER 49 -18.589 -2.906 -25.109 114 HB2 SER 49 HB2 SER 49 -19.620 -3.352 -22.301 115 HB3 SER 49 HB1 SER 49 -20.029 -4.354 -23.691 116 HG SER 49 HG SER 49 -18.290 -5.376 -23.019 117 H ALA 50 HN ALA 50 -19.745 -0.219 -23.387 118 HA ALA 50 HA ALA 50 -22.501 -0.505 -24.372 119 HB1 ALA 50 HB1 ALA 50 -22.929 1.538 -23.084 120 HB2 ALA 50 HB2 ALA 50 -21.207 1.692 -22.735 121 HB3 ALA 50 HB3 ALA 50 -22.122 0.334 -22.079 122 H ILE 51 HN ILE 51 -19.551 0.694 -25.446 123 HA ILE 51 HA ILE 51 -20.791 1.973 -27.717 124 HB ILE 51 HB ILE 51 -19.712 4.156 -27.403 125 HG12 ILE 51 HG12 ILE 51 -19.034 3.230 -24.621 126 HG13 ILE 51 HG11 ILE 51 -17.865 3.185 -25.943 127 HG21 ILE 51 HG21 ILE 51 -21.164 4.983 -25.626 128 HG22 ILE 51 HG22 ILE 51 -21.366 3.346 -25.002 129 HG23 ILE 51 HG23 ILE 51 -22.027 3.776 -26.580 130 HD11 ILE 51 HD1 ILE 51 -18.049 5.581 -26.249 131 HD12 ILE 51 HD2 ILE 51 -17.738 5.270 -24.539 132 HD13 ILE 51 HD3 ILE 51 -19.367 5.673 -25.081 133 HA PRO 52 HA PRO 52 -17.232 0.681 -29.882 134 HB2 PRO 52 HB2 PRO 52 -16.468 3.008 -31.213 135 HB3 PRO 52 HB1 PRO 52 -17.723 1.882 -31.768 136 HG2 PRO 52 HG2 PRO 52 -17.999 4.447 -30.273 137 HG3 PRO 52 HG1 PRO 52 -19.004 3.785 -31.577 138 HD2 PRO 52 HD2 PRO 52 -19.831 3.681 -29.034 139 HD3 PRO 52 HD1 PRO 52 -20.144 2.324 -30.136 140 H GLN 53 HN GLN 53 -15.069 0.435 -29.541 141 HA GLN 53 HA GLN 53 -13.795 1.278 -27.304 142 HB2 GLN 53 HB2 GLN 53 -11.624 1.023 -28.658 143 HB3 GLN 53 HB1 GLN 53 -12.708 -0.375 -28.591 144 HG2 GLN 53 HG2 GLN 53 -13.678 0.290 -30.769 145 HG3 GLN 53 HG1 GLN 53 -12.583 1.669 -30.835 146 HE21 GLN 53 HE21 GLN 53 -12.862 -1.094 -32.381 147 HE22 GLN 53 HE22 GLN 53 -11.250 -1.622 -32.455 148 H VAL 54 HN VAL 54 -14.291 3.430 -26.801 149 HA VAL 54 HA VAL 54 -13.749 5.637 -28.494 150 HB VAL 54 HB VAL 54 -14.017 6.998 -26.485 151 HG11 VAL 54 HG11 VAL 54 -16.102 5.340 -25.640 152 HG12 VAL 54 HG12 VAL 54 -15.857 4.907 -27.332 153 HG13 VAL 54 HG13 VAL 54 -16.195 6.582 -26.888 154 HG21 VAL 54 HG21 VAL 54 -13.367 6.234 -24.474 155 HG22 VAL 54 HG22 VAL 54 -12.926 4.700 -25.224 156 HG23 VAL 54 HG23 VAL 54 -14.547 4.927 -24.568 157 H TYR 55 HN TYR 55 -11.763 3.713 -26.401 158 HA TYR 55 HA TYR 55 -9.447 3.608 -26.313 159 HB2 TYR 55 HB2 TYR 55 -9.455 4.582 -28.621 160 HB3 TYR 55 HB1 TYR 55 -9.451 6.190 -27.895 161 HD1 TYR 55 HD1 TYR 55 -7.519 3.055 -28.277 162 HD2 TYR 55 HD2 TYR 55 -7.486 7.115 -26.876 163 HE1 TYR 55 HE1 TYR 55 -5.057 2.941 -28.007 164 HE2 TYR 55 HE2 TYR 55 -5.023 7.001 -26.606 165 HH TYR 55 HH TYR 55 -3.162 4.336 -27.832 166 H HIS 56 HN HIS 56 -10.768 6.906 -26.016 167 HA HIS 56 HA HIS 56 -9.078 7.288 -23.625 168 HB2 HIS 56 HB2 HIS 56 -8.774 8.966 -25.396 169 HB3 HIS 56 HB1 HIS 56 -10.503 9.329 -25.354 170 HD2 HIS 56 HD2 HIS 56 -11.125 11.336 -23.562 171 HE1 HIS 56 HE1 HIS 56 -7.646 11.112 -21.180 172 HE2 HIS 56 HE2 HIS 56 -9.816 12.376 -21.557 173 H ILE 57 HN ILE 57 -10.149 6.705 -21.840 174 HA ILE 57 HA ILE 57 -12.879 7.769 -21.472 175 HB ILE 57 HB ILE 57 -11.880 5.038 -20.637 176 HG12 ILE 57 HG12 ILE 57 -14.103 5.802 -22.551 177 HG13 ILE 57 HG11 ILE 57 -12.472 5.379 -23.074 178 HG21 ILE 57 HG21 ILE 57 -14.737 5.602 -20.421 179 HG22 ILE 57 HG22 ILE 57 -13.770 6.652 -19.384 180 HG23 ILE 57 HG23 ILE 57 -13.641 4.899 -19.231 181 HD11 ILE 57 HD1 ILE 57 -12.710 3.156 -22.494 182 HD12 ILE 57 HD2 ILE 57 -14.386 3.531 -22.893 183 HD13 ILE 57 HD3 ILE 57 -13.865 3.507 -21.208 184 H ILE 58 HN ILE 58 -13.051 9.020 -19.727 185 HA ILE 58 HA ILE 58 -11.143 8.600 -17.507 186 HB ILE 58 HB ILE 58 -12.136 11.235 -18.614 187 HG12 ILE 58 HG12 ILE 58 -9.324 10.117 -18.443 188 HG13 ILE 58 HG11 ILE 58 -10.321 10.034 -19.896 189 HG21 ILE 58 HG21 ILE 58 -11.921 11.187 -16.128 190 HG22 ILE 58 HG22 ILE 58 -10.753 12.265 -16.892 191 HG23 ILE 58 HG23 ILE 58 -10.243 10.679 -16.313 192 HD11 ILE 58 HD1 ILE 58 -10.475 12.467 -19.979 193 HD12 ILE 58 HD2 ILE 58 -8.776 11.998 -19.900 194 HD13 ILE 58 HD3 ILE 58 -9.593 12.603 -18.459 195 H VAL 59 HN VAL 59 -12.130 8.130 -15.658 196 HA VAL 59 HA VAL 59 -14.892 9.104 -15.248 197 HB VAL 59 HB VAL 59 -13.649 6.514 -14.299 198 HG11 VAL 59 HG11 VAL 59 -15.920 6.046 -13.427 199 HG12 VAL 59 HG12 VAL 59 -16.428 7.667 -13.902 200 HG13 VAL 59 HG13 VAL 59 -15.208 7.457 -12.645 201 HG21 VAL 59 HG21 VAL 59 -15.853 7.118 -16.298 202 HG22 VAL 59 HG22 VAL 59 -15.375 5.504 -15.774 203 HG23 VAL 59 HG23 VAL 59 -14.246 6.505 -16.686 204 H THR 60 HN THR 60 -15.155 10.415 -13.559 205 HA THR 60 HA THR 60 -13.204 10.270 -11.344 206 HB THR 60 HB THR 60 -14.388 12.791 -12.541 207 HG1 THR 60 HG1 THR 60 -12.782 12.386 -13.859 208 HG21 THR 60 HG21 THR 60 -12.311 12.416 -10.362 209 HG22 THR 60 HG22 THR 60 -13.997 12.847 -10.075 210 HG23 THR 60 HG23 THR 60 -12.942 13.951 -10.959 211 H ASP 61 HN ASP 61 -14.061 10.221 -9.346 212 HA ASP 61 HA ASP 61 -16.987 10.391 -9.125 213 HB2 ASP 61 HB2 ASP 61 -15.932 8.310 -8.353 214 HB3 ASP 61 HB1 ASP 61 -14.951 9.233 -7.211 215 H LEU 62 HN LEU 62 -17.654 12.385 -8.608 216 HA LEU 62 HA LEU 62 -16.214 13.848 -6.505 217 HB2 LEU 62 HB2 LEU 62 -17.401 14.738 -9.042 218 HB3 LEU 62 HB1 LEU 62 -17.705 15.779 -7.693 219 HG LEU 62 HG LEU 62 -15.536 16.158 -9.082 220 HD11 LEU 62 HD11 LEU 62 -14.798 15.862 -6.225 221 HD12 LEU 62 HD12 LEU 62 -16.265 16.789 -6.537 222 HD13 LEU 62 HD13 LEU 62 -14.736 17.287 -7.261 223 HD21 LEU 62 HD21 LEU 62 -14.334 14.146 -7.220 224 HD22 LEU 62 HD22 LEU 62 -13.756 14.701 -8.791 225 HD23 LEU 62 HD23 LEU 62 -15.087 13.552 -8.697 226 H SER 63 HN SER 63 -18.937 12.082 -7.136 227 HA SER 63 HA SER 63 -21.018 13.549 -5.948 228 HB2 SER 63 HB2 SER 63 -21.441 11.514 -7.198 229 HB3 SER 63 HB1 SER 63 -20.563 10.564 -6.005 230 HG SER 63 HG SER 63 -22.195 11.690 -4.521 231 H TYR 64 HN TYR 64 -18.681 11.264 -4.535 232 HA TYR 64 HA TYR 64 -18.837 12.607 -1.978 233 HB2 TYR 64 HB2 TYR 64 -20.770 11.174 -1.736 234 HB3 TYR 64 HB1 TYR 64 -19.849 9.772 -2.292 235 HD1 TYR 64 HD1 TYR 64 -19.952 12.380 0.386 236 HD2 TYR 64 HD2 TYR 64 -18.617 8.463 -0.768 237 HE1 TYR 64 HE1 TYR 64 -19.196 11.953 2.710 238 HE2 TYR 64 HE2 TYR 64 -17.860 8.037 1.555 239 HH TYR 64 HH TYR 64 -18.499 10.358 4.151 240 H GLY 65 HN GLY 65 -17.960 9.355 -3.166 241 HA2 GLY 65 HA2 GLY 65 -15.144 9.946 -2.513 242 HA3 GLY 65 HA1 GLY 65 -15.901 8.480 -1.888 243 H CYS 66 HN CYS 66 -15.839 6.694 -3.116 244 HA CYS 66 HA CYS 66 -15.108 7.000 -5.968 245 HB2 CYS 66 HB2 CYS 66 -14.287 4.823 -4.030 246 HB3 CYS 66 HB1 CYS 66 -13.915 4.841 -5.756 247 HG CYS 66 HG CYS 66 -11.929 6.169 -5.096 248 H GLY 67 HN GLY 67 -16.056 5.568 -7.448 249 HA2 GLY 67 HA2 GLY 67 -17.626 4.116 -8.292 250 HA3 GLY 67 HA1 GLY 67 -17.846 3.481 -6.662 251 H GLN 68 HN GLN 68 -18.178 6.886 -7.325 252 HA GLN 68 HA GLN 68 -21.101 6.640 -6.944 253 HB2 GLN 68 HB2 GLN 68 -19.299 8.905 -6.072 254 HB3 GLN 68 HB1 GLN 68 -21.038 8.797 -5.810 255 HG2 GLN 68 HG2 GLN 68 -18.965 6.872 -4.727 256 HG3 GLN 68 HG1 GLN 68 -19.818 8.099 -3.792 257 HE21 GLN 68 HE21 GLN 68 -19.857 4.869 -4.212 258 HE22 GLN 68 HE22 GLN 68 -21.519 4.557 -4.066 259 H SER 69 HN SER 69 -22.211 8.768 -7.701 260 HA SER 69 HA SER 69 -21.776 8.980 -10.512 261 HB2 SER 69 HB2 SER 69 -23.627 10.513 -10.498 262 HB3 SER 69 HB1 SER 69 -23.987 9.248 -9.331 263 HG SER 69 HG SER 69 -22.933 11.820 -8.795 264 H PHE 70 HN PHE 70 -21.478 11.074 -11.638 265 HA PHE 70 HA PHE 70 -20.476 13.395 -10.546 266 HB2 PHE 70 HB2 PHE 70 -18.686 12.076 -9.580 267 HB3 PHE 70 HB1 PHE 70 -18.268 11.435 -11.159 268 HD1 PHE 70 HD1 PHE 70 -15.989 12.566 -10.150 269 HD2 PHE 70 HD2 PHE 70 -19.382 14.705 -11.671 270 HE1 PHE 70 HE1 PHE 70 -14.559 14.537 -10.580 271 HE2 PHE 70 HE2 PHE 70 -17.951 16.673 -12.098 272 HZ PHE 70 HZ PHE 70 -15.535 16.589 -11.553 273 H ASP 71 HN ASP 71 -18.112 12.426 -12.723 274 HA ASP 71 HA ASP 71 -19.692 13.071 -15.109 275 HB2 ASP 71 HB2 ASP 71 -18.626 15.177 -13.921 276 HB3 ASP 71 HB1 ASP 71 -17.138 14.580 -14.657 277 H ILE 72 HN ILE 72 -18.789 12.314 -17.015 278 HA ILE 72 HA ILE 72 -16.211 10.881 -16.811 279 HB ILE 72 HB ILE 72 -17.155 9.009 -18.078 280 HG12 ILE 72 HG12 ILE 72 -19.830 10.401 -17.733 281 HG13 ILE 72 HG11 ILE 72 -18.899 10.421 -19.238 282 HG21 ILE 72 HG21 ILE 72 -18.055 9.822 -15.412 283 HG22 ILE 72 HG22 ILE 72 -17.464 8.255 -15.966 284 HG23 ILE 72 HG23 ILE 72 -19.161 8.686 -16.186 285 HD11 ILE 72 HD1 ILE 72 -20.035 8.520 -19.735 286 HD12 ILE 72 HD2 ILE 72 -20.508 8.255 -18.056 287 HD13 ILE 72 HD3 ILE 72 -18.916 7.742 -18.615 288 H VAL 73 HN VAL 73 -15.105 10.588 -18.802 289 HA VAL 73 HA VAL 73 -16.043 12.388 -20.960 290 HB VAL 73 HB VAL 73 -13.224 11.991 -19.927 291 HG11 VAL 73 HG11 VAL 73 -14.109 12.578 -22.544 292 HG12 VAL 73 HG12 VAL 73 -12.467 12.704 -21.915 293 HG13 VAL 73 HG13 VAL 73 -13.543 14.099 -21.858 294 HG21 VAL 73 HG21 VAL 73 -15.346 14.022 -19.572 295 HG22 VAL 73 HG22 VAL 73 -13.754 14.674 -19.960 296 HG23 VAL 73 HG23 VAL 73 -13.964 13.648 -18.542 297 H VAL 74 HN VAL 74 -16.289 11.407 -22.855 298 HA VAL 74 HA VAL 74 -14.683 8.995 -23.427 299 HB VAL 74 HB VAL 74 -17.637 9.402 -23.928 300 HG11 VAL 74 HG11 VAL 74 -16.143 8.260 -25.762 301 HG12 VAL 74 HG12 VAL 74 -17.646 7.485 -25.261 302 HG13 VAL 74 HG13 VAL 74 -16.104 6.913 -24.624 303 HG21 VAL 74 HG21 VAL 74 -16.741 8.640 -21.632 304 HG22 VAL 74 HG22 VAL 74 -16.245 7.160 -22.453 305 HG23 VAL 74 HG23 VAL 74 -17.949 7.608 -22.398 306 H VAL 75 HN VAL 75 -13.670 9.027 -25.345 307 HA VAL 75 HA VAL 75 -14.562 11.026 -27.341 308 HB VAL 75 HB VAL 75 -11.730 10.152 -26.711 309 HG11 VAL 75 HG11 VAL 75 -12.692 12.306 -28.608 310 HG12 VAL 75 HG12 VAL 75 -12.269 10.677 -29.134 311 HG13 VAL 75 HG13 VAL 75 -11.043 11.715 -28.405 312 HG21 VAL 75 HG21 VAL 75 -13.463 12.360 -25.800 313 HG22 VAL 75 HG22 VAL 75 -11.885 12.877 -26.394 314 HG23 VAL 75 HG23 VAL 75 -11.992 11.712 -25.074 315 H SER 76 HN SER 76 -15.143 10.180 -29.232 316 HA SER 76 HA SER 76 -13.770 7.880 -30.345 317 HB2 SER 76 HB2 SER 76 -15.756 6.492 -30.558 318 HB3 SER 76 HB1 SER 76 -15.468 6.850 -28.857 319 HG SER 76 HG SER 76 -17.566 7.326 -29.125 320 H ASP 77 HN ASP 77 -14.683 7.333 -32.537 321 HA ASP 77 HA ASP 77 -15.023 9.757 -34.040 322 HB2 ASP 77 HB2 ASP 77 -15.097 8.266 -35.991 323 HB3 ASP 77 HB1 ASP 77 -13.765 7.883 -34.924 324 H PHE 78 HN PHE 78 -17.156 7.875 -32.313 325 HA PHE 78 HA PHE 78 -19.428 7.690 -33.955 326 HB2 PHE 78 HB2 PHE 78 -19.112 6.650 -31.669 327 HB3 PHE 78 HB1 PHE 78 -19.458 8.241 -30.984 328 HD1 PHE 78 HD1 PHE 78 -20.835 5.499 -33.079 329 HD2 PHE 78 HD2 PHE 78 -21.689 9.114 -30.922 330 HE1 PHE 78 HE1 PHE 78 -23.266 5.076 -33.334 331 HE2 PHE 78 HE2 PHE 78 -24.120 8.690 -31.177 332 HZ PHE 78 HZ PHE 78 -24.908 6.672 -32.382 333 H PHE 79 HN PHE 79 -17.860 10.407 -32.564 334 HA PHE 79 HA PHE 79 -20.247 12.113 -32.776 335 HB2 PHE 79 HB2 PHE 79 -18.443 12.220 -30.898 336 HB3 PHE 79 HB1 PHE 79 -17.498 13.103 -32.091 337 HD1 PHE 79 HD1 PHE 79 -18.084 14.634 -29.787 338 HD2 PHE 79 HD2 PHE 79 -20.660 13.804 -33.123 339 HE1 PHE 79 HE1 PHE 79 -19.381 16.690 -29.300 340 HE2 PHE 79 HE2 PHE 79 -21.956 15.857 -32.635 341 HZ PHE 79 HZ PHE 79 -21.316 17.300 -30.723 342 H GLN 80 HN GLN 80 -17.991 10.926 -34.857 343 HA GLN 80 HA GLN 80 -17.614 13.399 -36.382 344 HB2 GLN 80 HB2 GLN 80 -16.611 10.570 -36.756 345 HB3 GLN 80 HB1 GLN 80 -16.293 11.873 -37.902 346 HG2 GLN 80 HG2 GLN 80 -15.176 13.176 -36.168 347 HG3 GLN 80 HG1 GLN 80 -15.578 11.961 -34.957 348 HE21 GLN 80 HE21 GLN 80 -12.881 12.932 -36.144 349 HE22 GLN 80 HE22 GLN 80 -12.100 11.490 -36.581 350 H GLY 81 HN GLY 81 -19.016 14.010 -37.888 351 HA2 GLY 81 HA2 GLY 81 -20.414 13.856 -39.735 352 HA3 GLY 81 HA1 GLY 81 -20.219 12.103 -39.698 353 H LYS 82 HN LYS 82 -21.002 13.194 -36.644 354 HA LYS 82 HA LYS 82 -23.897 12.824 -37.101 355 HB2 LYS 82 HB2 LYS 82 -22.185 11.603 -34.927 356 HB3 LYS 82 HB1 LYS 82 -23.949 11.605 -34.905 357 HG2 LYS 82 HG2 LYS 82 -23.975 10.405 -37.067 358 HG3 LYS 82 HG1 LYS 82 -22.211 10.393 -37.076 359 HD2 LYS 82 HD2 LYS 82 -22.194 9.093 -34.987 360 HD3 LYS 82 HD1 LYS 82 -23.958 9.118 -34.950 361 HE2 LYS 82 HE2 LYS 82 -24.027 7.913 -37.097 362 HE3 LYS 82 HE1 LYS 82 -22.264 7.891 -37.147 363 HZ1 LYS 82 HZ1 LYS 82 -22.149 6.448 -35.357 364 HZ2 LYS 82 HZ2 LYS 82 -23.485 5.856 -36.224 365 HZ3 LYS 82 HZ3 LYS 82 -23.723 6.797 -34.829 366 H SER 83 HN SER 83 -25.269 14.023 -35.807 367 HA SER 83 HA SER 83 -24.271 16.496 -34.819 368 HB2 SER 83 HB2 SER 83 -26.519 16.368 -35.703 369 HB3 SER 83 HB1 SER 83 -26.968 15.165 -34.497 370 HG SER 83 HG SER 83 -26.603 17.913 -34.261 371 H LYS 84 HN LYS 84 -24.159 17.273 -32.692 372 HA LYS 84 HA LYS 84 -23.086 15.547 -30.771 373 HB2 LYS 84 HB2 LYS 84 -23.256 17.404 -29.229 374 HB3 LYS 84 HB1 LYS 84 -22.844 18.048 -30.818 375 HG2 LYS 84 HG2 LYS 84 -25.221 18.576 -31.225 376 HG3 LYS 84 HG1 LYS 84 -25.630 17.950 -29.627 377 HD2 LYS 84 HD2 LYS 84 -24.173 19.646 -28.584 378 HD3 LYS 84 HD1 LYS 84 -23.760 20.274 -30.180 379 HE2 LYS 84 HE2 LYS 84 -26.131 20.817 -30.586 380 HE3 LYS 84 HE1 LYS 84 -26.551 20.183 -28.995 381 HZ1 LYS 84 HZ1 LYS 84 -26.248 22.642 -29.106 382 HZ2 LYS 84 HZ2 LYS 84 -24.599 22.376 -29.415 383 HZ3 LYS 84 HZ3 LYS 84 -25.284 21.866 -27.946 384 H LEU 85 HN LEU 85 -26.410 16.645 -31.273 385 HA LEU 85 HA LEU 85 -27.511 15.639 -28.872 386 HB2 LEU 85 HB2 LEU 85 -28.726 16.146 -31.593 387 HB3 LEU 85 HB1 LEU 85 -29.671 15.662 -30.184 388 HG LEU 85 HG LEU 85 -27.837 18.071 -30.195 389 HD11 LEU 85 HD11 LEU 85 -30.328 19.124 -30.150 390 HD12 LEU 85 HD12 LEU 85 -30.626 17.710 -31.160 391 HD13 LEU 85 HD13 LEU 85 -29.414 18.896 -31.641 392 HD21 LEU 85 HD21 LEU 85 -29.129 16.640 -28.144 393 HD22 LEU 85 HD22 LEU 85 -30.115 18.082 -28.392 394 HD23 LEU 85 HD23 LEU 85 -28.399 18.241 -28.014 395 H MET 86 HN MET 86 -27.030 14.182 -32.067 396 HA MET 86 HA MET 86 -28.395 11.758 -31.540 397 HB2 MET 86 HB2 MET 86 -26.168 12.412 -33.480 398 HB3 MET 86 HB1 MET 86 -27.047 10.883 -33.466 399 HG2 MET 86 HG2 MET 86 -28.269 13.633 -33.857 400 HG3 MET 86 HG1 MET 86 -28.037 12.410 -35.112 401 HE1 MET 86 HE1 MET 86 -28.797 10.250 -35.120 402 HE2 MET 86 HE2 MET 86 -30.389 9.706 -34.597 403 HE3 MET 86 HE3 MET 86 -29.013 9.556 -33.507 404 H ARG 87 HN ARG 87 -25.023 12.754 -31.125 405 HA ARG 87 HA ARG 87 -23.962 10.237 -30.438 406 HB2 ARG 87 HB2 ARG 87 -22.564 12.187 -30.990 407 HB3 ARG 87 HB1 ARG 87 -23.082 12.978 -29.501 408 HG2 ARG 87 HG2 ARG 87 -22.112 11.152 -28.174 409 HG3 ARG 87 HG1 ARG 87 -21.620 10.323 -29.651 410 HD2 ARG 87 HD2 ARG 87 -20.178 12.214 -30.252 411 HD3 ARG 87 HD1 ARG 87 -20.697 13.085 -28.810 412 HE ARG 87 HE ARG 87 -19.333 11.678 -27.515 413 HH11 ARG 87 HH11 ARG 87 -19.562 10.632 -30.806 414 HH12 ARG 87 HH12 ARG 87 -18.270 9.485 -30.675 415 HH21 ARG 87 HH21 ARG 87 -17.639 10.176 -27.337 416 HH22 ARG 87 HH22 ARG 87 -17.182 9.227 -28.712 417 H SER 88 HN SER 88 -25.306 12.828 -28.410 418 HA SER 88 HA SER 88 -24.855 11.569 -25.924 419 HB2 SER 88 HB2 SER 88 -25.414 13.955 -26.131 420 HB3 SER 88 HB1 SER 88 -27.024 13.531 -26.708 421 HG SER 88 HG SER 88 -27.599 13.059 -24.731 422 H ARG 89 HN ARG 89 -27.667 11.555 -28.102 423 HA ARG 89 HA ARG 89 -29.347 9.987 -26.458 424 HB2 ARG 89 HB2 ARG 89 -30.142 11.302 -28.406 425 HB3 ARG 89 HB1 ARG 89 -29.321 10.168 -29.480 426 HG2 ARG 89 HG2 ARG 89 -30.690 8.322 -28.603 427 HG3 ARG 89 HG1 ARG 89 -31.499 9.436 -27.500 428 HD2 ARG 89 HD2 ARG 89 -32.341 10.733 -29.419 429 HD3 ARG 89 HD1 ARG 89 -31.529 9.629 -30.525 430 HE ARG 89 HE ARG 89 -33.213 8.125 -28.839 431 HH11 ARG 89 HH11 ARG 89 -33.336 10.506 -31.347 432 HH12 ARG 89 HH12 ARG 89 -34.871 9.985 -31.956 433 HH21 ARG 89 HH21 ARG 89 -35.227 7.436 -29.632 434 HH22 ARG 89 HH22 ARG 89 -35.942 8.247 -30.985 435 H ALA 90 HN ALA 90 -27.109 9.104 -29.078 436 HA ALA 90 HA ALA 90 -27.652 6.327 -29.040 437 HB1 ALA 90 HB1 ALA 90 -24.937 7.389 -29.738 438 HB2 ALA 90 HB2 ALA 90 -26.317 7.807 -30.754 439 HB3 ALA 90 HB3 ALA 90 -25.875 6.116 -30.520 440 H VAL 91 HN VAL 91 -25.217 8.301 -27.375 441 HA VAL 91 HA VAL 91 -23.951 6.090 -26.082 442 HB VAL 91 HB VAL 91 -22.825 8.267 -26.469 443 HG11 VAL 91 HG11 VAL 91 -24.839 9.663 -25.970 444 HG12 VAL 91 HG12 VAL 91 -23.405 10.189 -25.092 445 HG13 VAL 91 HG13 VAL 91 -24.655 9.260 -24.263 446 HG21 VAL 91 HG21 VAL 91 -21.579 7.305 -24.826 447 HG22 VAL 91 HG22 VAL 91 -23.003 6.848 -23.891 448 HG23 VAL 91 HG23 VAL 91 -22.351 8.482 -23.764 449 H ASN 92 HN ASN 92 -26.509 8.359 -25.198 450 HA ASN 92 HA ASN 92 -26.705 7.679 -22.470 451 HB2 ASN 92 HB2 ASN 92 -28.736 8.746 -24.439 452 HB3 ASN 92 HB1 ASN 92 -29.075 8.543 -22.720 453 HD21 ASN 92 HD21 ASN 92 -29.079 11.136 -23.954 454 HD22 ASN 92 HD22 ASN 92 -27.778 12.023 -23.321 455 H LYS 93 HN LYS 93 -28.278 6.333 -25.352 456 HA LYS 93 HA LYS 93 -29.986 4.532 -23.989 457 HB2 LYS 93 HB2 LYS 93 -28.829 4.496 -26.780 458 HB3 LYS 93 HB1 LYS 93 -30.013 3.321 -26.206 459 HG2 LYS 93 HG2 LYS 93 -31.581 5.154 -25.683 460 HG3 LYS 93 HG1 LYS 93 -30.399 6.330 -26.258 461 HD2 LYS 93 HD2 LYS 93 -30.446 5.257 -28.497 462 HD3 LYS 93 HD1 LYS 93 -31.676 4.135 -27.915 463 HE2 LYS 93 HE2 LYS 93 -31.981 7.151 -27.914 464 HE3 LYS 93 HE1 LYS 93 -32.643 6.084 -29.152 465 HZ1 LYS 93 HZ1 LYS 93 -33.607 4.881 -27.045 466 HZ2 LYS 93 HZ2 LYS 93 -34.407 6.204 -27.748 467 HZ3 LYS 93 HZ3 LYS 93 -33.451 6.425 -26.361 468 H ALA 94 HN ALA 94 -26.702 4.203 -25.278 469 HA ALA 94 HA ALA 94 -26.396 1.442 -24.753 470 HB1 ALA 94 HB1 ALA 94 -24.727 3.650 -25.613 471 HB2 ALA 94 HB2 ALA 94 -24.564 1.926 -25.952 472 HB3 ALA 94 HB3 ALA 94 -23.867 2.606 -24.482 473 H VAL 95 HN VAL 95 -25.753 4.327 -22.810 474 HA VAL 95 HA VAL 95 -24.922 2.646 -20.551 475 HB VAL 95 HB VAL 95 -24.291 4.807 -19.496 476 HG11 VAL 95 HG11 VAL 95 -23.224 4.277 -22.286 477 HG12 VAL 95 HG12 VAL 95 -22.615 3.593 -20.779 478 HG13 VAL 95 HG13 VAL 95 -22.435 5.318 -21.100 479 HG21 VAL 95 HG21 VAL 95 -25.986 5.828 -21.542 480 HG22 VAL 95 HG22 VAL 95 -24.360 6.429 -21.867 481 HG23 VAL 95 HG23 VAL 95 -25.119 6.739 -20.306 482 H LYS 96 HN LYS 96 -27.707 2.774 -21.501 483 HA LYS 96 HA LYS 96 -29.317 4.420 -19.891 484 HB2 LYS 96 HB2 LYS 96 -30.159 3.151 -21.839 485 HB3 LYS 96 HB1 LYS 96 -29.940 1.648 -20.941 486 HG2 LYS 96 HG2 LYS 96 -32.259 2.309 -20.730 487 HG3 LYS 96 HG1 LYS 96 -31.475 2.565 -19.171 488 HD2 LYS 96 HD2 LYS 96 -31.200 4.947 -19.663 489 HD3 LYS 96 HD1 LYS 96 -31.898 4.716 -21.266 490 HE2 LYS 96 HE2 LYS 96 -33.342 4.138 -18.664 491 HE3 LYS 96 HE1 LYS 96 -33.553 5.603 -19.624 492 HZ1 LYS 96 HZ1 LYS 96 -34.194 4.163 -21.507 493 HZ2 LYS 96 HZ2 LYS 96 -35.263 4.056 -20.190 494 HZ3 LYS 96 HZ3 LYS 96 -34.134 2.819 -20.474 495 H GLU 97 HN GLU 97 -28.047 1.151 -19.335 496 HA GLU 97 HA GLU 97 -29.335 0.714 -16.849 497 HB2 GLU 97 HB2 GLU 97 -26.807 -0.447 -18.033 498 HB3 GLU 97 HB1 GLU 97 -27.529 -1.006 -16.523 499 HG2 GLU 97 HG2 GLU 97 -29.609 -1.561 -17.686 500 HG3 GLU 97 HG1 GLU 97 -28.954 -0.933 -19.197 501 H GLU 98 HN GLU 98 -26.271 2.212 -17.744 502 HA GLU 98 HA GLU 98 -25.120 2.409 -15.191 503 HB2 GLU 98 HB2 GLU 98 -23.898 2.868 -17.293 504 HB3 GLU 98 HB1 GLU 98 -24.848 4.338 -17.507 505 HG2 GLU 98 HG2 GLU 98 -23.981 5.251 -15.416 506 HG3 GLU 98 HG1 GLU 98 -23.096 3.759 -15.103 507 H LEU 99 HN LEU 99 -27.459 4.452 -16.863 508 HA LEU 99 HA LEU 99 -27.431 6.640 -15.088 509 HB2 LEU 99 HB2 LEU 99 -29.602 5.523 -16.873 510 HB3 LEU 99 HB1 LEU 99 -29.771 7.028 -15.970 511 HG LEU 99 HG LEU 99 -27.461 6.501 -17.852 512 HD11 LEU 99 HD11 LEU 99 -29.254 6.492 -19.352 513 HD12 LEU 99 HD12 LEU 99 -28.859 8.210 -19.280 514 HD13 LEU 99 HD13 LEU 99 -30.223 7.578 -18.356 515 HD21 LEU 99 HD21 LEU 99 -28.592 9.165 -17.012 516 HD22 LEU 99 HD22 LEU 99 -26.963 8.780 -17.567 517 HD23 LEU 99 HD23 LEU 99 -27.479 8.302 -15.950 518 H GLN 100 HN GLN 100 -29.256 3.604 -15.056 519 HA GLN 100 HA GLN 100 -30.940 4.237 -12.867 520 HB2 GLN 100 HB2 GLN 100 -29.951 1.583 -13.937 521 HB3 GLN 100 HB1 GLN 100 -31.176 1.742 -12.678 522 HG2 GLN 100 HG2 GLN 100 -31.371 2.955 -15.448 523 HG3 GLN 100 HG1 GLN 100 -32.190 1.482 -14.932 524 HE21 GLN 100 HE21 GLN 100 -32.967 4.554 -15.549 525 HE22 GLN 100 HE22 GLN 100 -34.110 4.853 -14.330 526 H GLU 101 HN GLU 101 -27.733 2.749 -13.079 527 HA GLU 101 HA GLU 101 -27.581 2.334 -10.212 528 HB2 GLU 101 HB2 GLU 101 -25.376 1.436 -10.653 529 HB3 GLU 101 HB1 GLU 101 -26.507 0.780 -11.840 530 HG2 GLU 101 HG2 GLU 101 -25.793 2.546 -13.445 531 HG3 GLU 101 HG1 GLU 101 -24.611 3.098 -12.261 532 H ILE 102 HN ILE 102 -26.988 4.878 -12.383 533 HA ILE 102 HA ILE 102 -25.217 6.229 -10.439 534 HB ILE 102 HB ILE 102 -25.629 6.827 -13.378 535 HG12 ILE 102 HG12 ILE 102 -24.412 4.715 -12.968 536 HG13 ILE 102 HG11 ILE 102 -23.337 5.941 -13.619 537 HG21 ILE 102 HG21 ILE 102 -23.499 8.205 -12.902 538 HG22 ILE 102 HG22 ILE 102 -23.929 8.046 -11.199 539 HG23 ILE 102 HG23 ILE 102 -25.028 8.859 -12.314 540 HD11 ILE 102 HD1 ILE 102 -23.106 4.512 -11.152 541 HD12 ILE 102 HD2 ILE 102 -23.353 6.220 -10.782 542 HD13 ILE 102 HD3 ILE 102 -22.014 5.726 -11.820 543 H HIS 103 HN HIS 103 -25.965 7.964 -9.387 544 HA HIS 103 HA HIS 103 -28.678 8.723 -9.505 545 HB2 HIS 103 HB2 HIS 103 -26.247 10.051 -8.300 546 HB3 HIS 103 HB1 HIS 103 -27.877 10.710 -8.130 547 HD2 HIS 103 HD2 HIS 103 -28.643 7.132 -7.977 548 HE1 HIS 103 HE1 HIS 103 -27.381 7.976 -4.037 549 HE2 HIS 103 HE2 HIS 103 -28.575 6.285 -5.508 550 H ALA 104 HN ALA 104 -25.759 10.174 -10.899 551 HA ALA 104 HA ALA 104 -27.107 11.282 -13.110 552 HB1 ALA 104 HB1 ALA 104 -28.002 13.146 -12.237 553 HB2 ALA 104 HB2 ALA 104 -26.356 13.724 -11.977 554 HB3 ALA 104 HB3 ALA 104 -27.206 12.873 -10.687 555 H PHE 105 HN PHE 105 -25.586 11.395 -14.625 556 HA PHE 105 HA PHE 105 -22.938 12.451 -13.962 557 HB2 PHE 105 HB2 PHE 105 -21.761 10.573 -14.925 558 HB3 PHE 105 HB1 PHE 105 -22.825 9.977 -13.651 559 HD1 PHE 105 HD1 PHE 105 -22.209 10.100 -17.265 560 HD2 PHE 105 HD2 PHE 105 -24.896 8.761 -14.194 561 HE1 PHE 105 HE1 PHE 105 -23.338 8.617 -18.900 562 HE2 PHE 105 HE2 PHE 105 -26.022 7.278 -15.829 563 HZ PHE 105 HZ PHE 105 -25.246 7.205 -18.181 564 H SER 106 HN SER 106 -21.660 12.945 -15.898 565 HA SER 106 HA SER 106 -23.358 13.340 -18.289 566 HB2 SER 106 HB2 SER 106 -22.110 15.442 -18.686 567 HB3 SER 106 HB1 SER 106 -22.990 15.477 -17.155 568 HG SER 106 HG SER 106 -21.129 15.816 -16.258 569 H CYS 107 HN CYS 107 -22.332 13.169 -20.307 570 HA CYS 107 HA CYS 107 -19.638 11.938 -20.243 571 HB2 CYS 107 HB2 CYS 107 -20.631 10.854 -22.469 572 HB3 CYS 107 HB1 CYS 107 -20.866 10.108 -20.886 573 HG CYS 107 HG CYS 107 -23.038 11.926 -22.225 574 H LYS 108 HN LYS 108 -18.350 13.556 -20.933 575 HA LYS 108 HA LYS 108 -19.145 15.518 -22.848 576 HB2 LYS 108 HB2 LYS 108 -16.376 14.732 -21.899 577 HB3 LYS 108 HB1 LYS 108 -16.773 16.194 -22.804 578 HG2 LYS 108 HG2 LYS 108 -17.939 15.462 -20.101 579 HG3 LYS 108 HG1 LYS 108 -16.632 16.619 -20.357 580 HD2 LYS 108 HD2 LYS 108 -18.103 18.006 -21.749 581 HD3 LYS 108 HD1 LYS 108 -19.413 16.842 -21.545 582 HE2 LYS 108 HE2 LYS 108 -19.745 18.657 -19.965 583 HE3 LYS 108 HE1 LYS 108 -19.278 17.211 -19.069 584 HZ1 LYS 108 HZ1 LYS 108 -17.918 19.709 -19.311 585 HZ2 LYS 108 HZ2 LYS 108 -16.911 18.404 -19.719 586 HZ3 LYS 108 HZ3 LYS 108 -17.672 18.451 -18.201 587 H CYS 109 HN CYS 109 -18.759 15.641 -25.025 588 HA CYS 109 HA CYS 109 -17.696 13.192 -26.297 589 HB2 CYS 109 HB2 CYS 109 -19.651 15.232 -27.393 590 HB3 CYS 109 HB1 CYS 109 -19.085 13.789 -28.235 591 HG CYS 109 HG CYS 109 -20.901 12.577 -27.073 592 H TYR 110 HN TYR 110 -15.865 13.366 -27.421 593 HA TYR 110 HA TYR 110 -15.121 15.985 -28.539 594 HB2 TYR 110 HB2 TYR 110 -13.283 14.150 -26.983 595 HB3 TYR 110 HB1 TYR 110 -12.789 15.622 -27.827 596 HD1 TYR 110 HD1 TYR 110 -14.239 14.247 -24.813 597 HD2 TYR 110 HD2 TYR 110 -13.823 17.838 -27.133 598 HE1 TYR 110 HE1 TYR 110 -14.879 15.599 -22.835 599 HE2 TYR 110 HE2 TYR 110 -14.463 19.190 -25.155 600 HH TYR 110 HH TYR 110 -16.000 18.083 -22.593 601 H THR 111 HN THR 111 -14.025 15.911 -30.478 602 HA THR 111 HA THR 111 -12.889 13.526 -31.556 603 HB THR 111 HB THR 111 -15.384 13.083 -31.736 604 HG1 THR 111 HG1 THR 111 -13.972 12.001 -33.073 605 HG21 THR 111 HG21 THR 111 -16.695 14.670 -32.632 606 HG22 THR 111 HG22 THR 111 -15.778 14.586 -34.134 607 HG23 THR 111 HG23 THR 111 -15.284 15.699 -32.860 608 H GLU 112 HN GLU 112 -11.980 16.149 -31.207 609 HA GLU 112 HA GLU 112 -10.695 17.658 -32.382 610 HB2 GLU 112 HB2 GLU 112 -11.617 16.110 -34.818 611 HB3 GLU 112 HB1 GLU 112 -10.328 17.308 -34.784 612 HG2 GLU 112 HG2 GLU 112 -10.346 14.779 -33.117 613 HG3 GLU 112 HG1 GLU 112 -9.483 14.957 -34.643 614 H GLU 113 HN GLU 113 -14.010 17.126 -32.886 615 HA GLU 113 HA GLU 113 -14.634 19.246 -34.658 616 HB2 GLU 113 HB2 GLU 113 -16.264 17.837 -32.542 617 HB3 GLU 113 HB1 GLU 113 -16.925 19.060 -33.635 618 HG2 GLU 113 HG2 GLU 113 -16.293 17.711 -35.574 619 HG3 GLU 113 HG1 GLU 113 -15.528 16.518 -34.528 620 H GLU 114 HN GLU 114 -14.270 19.055 -31.153 621 HA GLU 114 HA GLU 114 -15.315 21.539 -30.428 622 HB2 GLU 114 HB2 GLU 114 -13.951 21.359 -28.425 623 HB3 GLU 114 HB1 GLU 114 -14.581 19.763 -28.835 624 HG2 GLU 114 HG2 GLU 114 -12.454 19.196 -29.939 625 HG3 GLU 114 HG1 GLU 114 -11.820 20.794 -29.552 626 H TRP 115 HN TRP 115 -12.486 20.778 -32.221 627 HA TRP 115 HA TRP 115 -11.072 23.233 -31.647 628 HB2 TRP 115 HB2 TRP 115 -9.353 22.263 -32.756 629 HB3 TRP 115 HB1 TRP 115 -10.332 20.790 -32.673 630 HD1 TRP 115 HD1 TRP 115 -8.348 22.217 -35.106 631 HE1 TRP 115 HE1 TRP 115 -9.303 22.059 -37.495 632 HE3 TRP 115 HE3 TRP 115 -13.246 21.253 -34.040 633 HZ2 TRP 115 HZ2 TRP 115 -11.814 21.591 -38.783 634 HZ3 TRP 115 HZ3 TRP 115 -14.900 20.958 -35.862 635 HH2 TRP 115 HH2 TRP 115 -14.189 21.126 -38.232 636 H SER 116 HN SER 116 -13.908 22.910 -33.025 637 HA SER 116 HA SER 116 -13.744 23.980 -35.602 638 HB2 SER 116 HB2 SER 116 -15.919 24.266 -33.520 639 HB3 SER 116 HB1 SER 116 -16.099 24.721 -35.212 640 HG SER 116 HG SER 116 -16.498 22.700 -35.579 641 H LYS 117 HN LYS 117 -13.912 25.569 -32.438 642 HA LYS 117 HA LYS 117 -13.523 28.182 -33.765 643 HB2 LYS 117 HB2 LYS 117 -14.472 27.468 -30.981 644 HB3 LYS 117 HB1 LYS 117 -14.157 29.117 -31.525 645 HG2 LYS 117 HG2 LYS 117 -15.835 28.900 -33.283 646 HG3 LYS 117 HG1 LYS 117 -16.104 27.210 -32.854 647 HD2 LYS 117 HD2 LYS 117 -17.861 28.503 -31.823 648 HD3 LYS 117 HD1 LYS 117 -16.760 27.991 -30.543 649 HE2 LYS 117 HE2 LYS 117 -15.643 30.175 -30.600 650 HE3 LYS 117 HE1 LYS 117 -16.691 30.692 -31.921 651 HZ1 LYS 117 HZ1 LYS 117 -17.769 29.771 -29.325 652 HZ2 LYS 117 HZ2 LYS 117 -18.563 30.651 -30.542 653 HZ3 LYS 117 HZ3 LYS 117 -17.357 31.392 -29.602 654 H ILE 118 HN ILE 118 -11.312 28.141 -34.125 655 HA ILE 118 HA ILE 118 -9.656 28.379 -31.708 656 HB ILE 118 HB ILE 118 -9.576 26.009 -32.742 657 HG12 ILE 118 HG12 ILE 118 -6.934 27.479 -32.596 658 HG13 ILE 118 HG11 ILE 118 -7.894 27.122 -31.160 659 HG21 ILE 118 HG21 ILE 118 -7.997 27.606 -34.784 660 HG22 ILE 118 HG22 ILE 118 -9.470 26.687 -35.090 661 HG23 ILE 118 HG23 ILE 118 -7.981 25.847 -34.658 662 HD11 ILE 118 HD1 ILE 118 -6.119 25.383 -32.589 663 HD12 ILE 118 HD2 ILE 118 -7.758 24.734 -32.707 664 HD13 ILE 118 HD3 ILE 118 -7.040 25.045 -31.123 665 H VAL 119 HN VAL 119 -7.940 29.783 -31.915 666 HA VAL 119 HA VAL 119 -8.066 31.613 -34.160 667 HB VAL 119 HB VAL 119 -6.389 32.902 -32.889 668 HG11 VAL 119 HG11 VAL 119 -7.901 32.776 -30.627 669 HG12 VAL 119 HG12 VAL 119 -8.976 31.983 -31.778 670 HG13 VAL 119 HG13 VAL 119 -8.404 33.621 -32.092 671 HG21 VAL 119 HG21 VAL 119 -5.147 31.990 -31.223 672 HG22 VAL 119 HG22 VAL 119 -5.699 30.432 -31.839 673 HG23 VAL 119 HG23 VAL 119 -6.550 31.202 -30.500 674 H VAL 120 HN VAL 120 -6.529 28.730 -33.618 675 HA VAL 120 HA VAL 120 -3.916 29.166 -34.565 676 HB VAL 120 HB VAL 120 -5.695 26.719 -34.652 677 HG11 VAL 120 HG11 VAL 120 -3.208 27.258 -36.020 678 HG12 VAL 120 HG12 VAL 120 -4.185 25.790 -36.042 679 HG13 VAL 120 HG13 VAL 120 -2.957 26.013 -34.796 680 HG21 VAL 120 HG21 VAL 120 -5.050 27.494 -32.406 681 HG22 VAL 120 HG22 VAL 120 -3.356 27.536 -32.894 682 HG23 VAL 120 HG23 VAL 120 -4.209 25.995 -32.800 683 H LEU 121 HN LEU 121 -6.915 28.301 -36.259 684 HA LEU 121 HA LEU 121 -5.525 28.616 -38.833 685 HB2 LEU 121 HB2 LEU 121 -6.923 26.604 -38.516 686 HB3 LEU 121 HB1 LEU 121 -8.327 27.631 -38.221 687 HG LEU 121 HG LEU 121 -8.075 28.615 -40.475 688 HD11 LEU 121 HD11 LEU 121 -6.388 26.787 -41.768 689 HD12 LEU 121 HD12 LEU 121 -5.524 27.233 -40.297 690 HD13 LEU 121 HD13 LEU 121 -6.038 28.482 -41.431 691 HD21 LEU 121 HD21 LEU 121 -8.179 26.072 -41.587 692 HD22 LEU 121 HD22 LEU 121 -9.547 26.942 -40.893 693 HD23 LEU 121 HD23 LEU 121 -8.639 25.795 -39.908 694 H GLU 122 HN GLU 122 -5.366 30.754 -39.254 695 HA GLU 122 HA GLU 122 -7.277 32.727 -38.587 696 HB2 GLU 122 HB2 GLU 122 -4.931 33.249 -39.148 697 HB3 GLU 122 HB1 GLU 122 -5.230 32.765 -40.818 698 HG2 GLU 122 HG2 GLU 122 -6.942 34.515 -41.035 699 HG3 GLU 122 HG1 GLU 122 -6.683 34.989 -39.357 700 H HIS 123 HN HIS 123 -6.750 30.851 -41.555 701 HA HIS 123 HA HIS 123 -8.011 30.675 -43.481 702 HB2 HIS 123 HB2 HIS 123 -9.354 29.307 -42.020 703 HB3 HIS 123 HB1 HIS 123 -10.147 30.729 -41.341 704 HD2 HIS 123 HD2 HIS 123 -12.428 31.484 -42.715 705 HE1 HIS 123 HE1 HIS 123 -11.762 29.247 -46.232 706 HE2 HIS 123 HE2 HIS 123 -13.405 30.761 -45.026 707 H HIS 124 HN HIS 124 -7.482 32.689 -44.425 708 HA HIS 124 HA HIS 124 -8.922 35.087 -43.838 709 HB2 HIS 124 HB2 HIS 124 -7.206 34.266 -46.191 710 HB3 HIS 124 HB1 HIS 124 -7.893 35.879 -46.000 711 HD2 HIS 124 HD2 HIS 124 -6.599 37.497 -44.090 712 HE1 HIS 124 HE1 HIS 124 -3.747 34.633 -42.870 713 HE2 HIS 124 HE2 HIS 124 -4.447 37.067 -42.676 714 H HIS 125 HN HIS 125 -10.726 35.928 -44.755 715 HA HIS 125 HA HIS 125 -11.893 34.664 -47.120 716 HB2 HIS 125 HB2 HIS 125 -14.037 34.264 -46.066 717 HB3 HIS 125 HB1 HIS 125 -12.790 33.418 -45.150 718 HD2 HIS 125 HD2 HIS 125 -15.458 36.157 -44.591 719 HE1 HIS 125 HE1 HIS 125 -13.033 36.092 -41.136 720 HE2 HIS 125 HE2 HIS 125 -15.180 37.007 -42.138 721 H HIS 126 HN HIS 126 -10.763 37.323 -46.122 722 HA HIS 126 HA HIS 126 -12.844 39.220 -45.961 723 HB2 HIS 126 HB2 HIS 126 -9.976 39.472 -46.884 724 HB3 HIS 126 HB1 HIS 126 -11.059 40.848 -46.676 725 HD2 HIS 126 HD2 HIS 126 -8.775 38.623 -44.527 726 HE1 HIS 126 HE1 HIS 126 -11.203 40.791 -41.838 727 HE2 HIS 126 HE2 HIS 126 -9.167 39.285 -42.031 728 H HIS 127 HN HIS 127 -11.082 37.863 -48.711 729 HA HIS 127 HA HIS 127 -12.269 39.574 -50.669 730 HB2 HIS 127 HB2 HIS 127 -10.144 38.428 -51.088 731 HB3 HIS 127 HB1 HIS 127 -10.953 36.865 -50.975 732 HD2 HIS 127 HD2 HIS 127 -11.971 35.987 -53.393 733 HE1 HIS 127 HE1 HIS 127 -11.906 39.681 -55.436 734 HE2 HIS 127 HE2 HIS 127 -12.384 37.198 -55.670 735 H HIS 128 HN HIS 128 -14.176 39.418 -51.682 736 HA HIS 128 HA HIS 128 -15.643 36.868 -51.603 737 HB2 HIS 128 HB2 HIS 128 -16.530 38.120 -49.726 738 HB3 HIS 128 HB1 HIS 128 -16.748 39.550 -50.736 739 HD2 HIS 128 HD2 HIS 128 -19.198 39.637 -52.033 740 HE1 HIS 128 HE1 HIS 128 -20.331 35.620 -51.394 741 HE2 HIS 128 HE2 HIS 128 -21.092 37.861 -52.316 Start of MODEL 19 1 H1 MET 36 HT1 MET 36 -28.868 0.615 -6.166 2 H2 MET 36 HT2 MET 36 -29.175 -0.173 -7.639 3 H3 MET 36 HT3 MET 36 -28.276 1.269 -7.614 4 HA MET 36 HA MET 36 -27.248 -0.912 -5.993 5 HB2 MET 36 HB2 MET 36 -28.107 -1.736 -8.374 6 HB3 MET 36 HB1 MET 36 -26.606 -0.982 -8.914 7 HG2 MET 36 HG2 MET 36 -25.364 -2.317 -7.210 8 HG3 MET 36 HG1 MET 36 -26.872 -3.128 -6.787 9 HE1 MET 36 HE1 MET 36 -28.457 -3.658 -8.625 10 HE2 MET 36 HE2 MET 36 -27.880 -5.316 -8.468 11 HE3 MET 36 HE3 MET 36 -28.050 -4.598 -10.068 12 HA PRO 37 HA PRO 37 -24.092 2.193 -5.776 13 HB2 PRO 37 HB2 PRO 37 -22.280 -0.127 -5.308 14 HB3 PRO 37 HB1 PRO 37 -22.574 1.297 -4.290 15 HG2 PRO 37 HG2 PRO 37 -23.551 -1.061 -3.605 16 HG3 PRO 37 HG1 PRO 37 -24.511 0.416 -3.389 17 HD2 PRO 37 HD2 PRO 37 -24.742 -1.672 -5.542 18 HD3 PRO 37 HD1 PRO 37 -26.028 -0.824 -4.647 19 H VAL 38 HN VAL 38 -22.506 3.072 -7.110 20 HA VAL 38 HA VAL 38 -21.459 1.377 -9.288 21 HB VAL 38 HB VAL 38 -23.454 2.736 -10.042 22 HG11 VAL 38 HG11 VAL 38 -21.674 5.131 -10.093 23 HG12 VAL 38 HG12 VAL 38 -22.430 4.722 -8.552 24 HG13 VAL 38 HG13 VAL 38 -23.433 5.038 -9.967 25 HG21 VAL 38 HG21 VAL 38 -22.068 2.031 -11.801 26 HG22 VAL 38 HG22 VAL 38 -20.692 2.968 -11.223 27 HG23 VAL 38 HG23 VAL 38 -22.045 3.784 -12.003 28 H THR 39 HN THR 39 -19.394 1.820 -9.931 29 HA THR 39 HA THR 39 -18.021 4.018 -8.501 30 HB THR 39 HB THR 39 -15.983 2.603 -8.628 31 HG1 THR 39 HG1 THR 39 -16.484 0.329 -9.115 32 HG21 THR 39 HG21 THR 39 -16.530 1.703 -6.633 33 HG22 THR 39 HG22 THR 39 -17.811 0.717 -7.339 34 HG23 THR 39 HG23 THR 39 -18.132 2.393 -6.894 35 H GLU 40 HN GLU 40 -16.789 5.398 -9.662 36 HA GLU 40 HA GLU 40 -17.151 5.598 -12.463 37 HB2 GLU 40 HB2 GLU 40 -15.228 6.922 -10.552 38 HB3 GLU 40 HB1 GLU 40 -15.313 7.338 -12.263 39 HG2 GLU 40 HG2 GLU 40 -16.783 8.890 -11.355 40 HG3 GLU 40 HG1 GLU 40 -17.890 7.581 -11.755 41 H GLN 41 HN GLN 41 -14.469 4.387 -10.466 42 HA GLN 41 HA GLN 41 -12.658 3.933 -12.601 43 HB2 GLN 41 HB2 GLN 41 -12.936 2.649 -9.870 44 HB3 GLN 41 HB1 GLN 41 -11.600 2.312 -10.972 45 HG2 GLN 41 HG2 GLN 41 -10.921 4.642 -10.953 46 HG3 GLN 41 HG1 GLN 41 -12.343 5.089 -10.012 47 HE21 GLN 41 HE21 GLN 41 -9.430 5.353 -9.274 48 HE22 GLN 41 HE22 GLN 41 -9.263 4.497 -7.818 49 H GLY 42 HN GLY 42 -15.064 1.918 -10.987 50 HA2 GLY 42 HA2 GLY 42 -14.624 -0.418 -12.590 51 HA3 GLY 42 HA1 GLY 42 -15.993 -0.132 -11.512 52 H LEU 43 HN LEU 43 -16.617 2.417 -12.763 53 HA LEU 43 HA LEU 43 -18.547 1.596 -14.626 54 HB2 LEU 43 HB2 LEU 43 -18.712 3.687 -13.326 55 HB3 LEU 43 HB1 LEU 43 -17.365 4.356 -14.247 56 HG LEU 43 HG LEU 43 -18.640 4.135 -16.322 57 HD11 LEU 43 HD11 LEU 43 -19.918 2.139 -15.781 58 HD12 LEU 43 HD12 LEU 43 -21.034 3.443 -16.192 59 HD13 LEU 43 HD13 LEU 43 -20.778 3.001 -14.504 60 HD21 LEU 43 HD21 LEU 43 -19.414 6.192 -15.816 61 HD22 LEU 43 HD22 LEU 43 -19.358 5.811 -14.095 62 HD23 LEU 43 HD23 LEU 43 -20.805 5.442 -15.033 63 H ARG 44 HN ARG 44 -15.274 2.834 -15.063 64 HA ARG 44 HA ARG 44 -15.335 3.297 -17.816 65 HB2 ARG 44 HB2 ARG 44 -13.439 3.886 -16.324 66 HB3 ARG 44 HB1 ARG 44 -13.048 2.174 -16.176 67 HG2 ARG 44 HG2 ARG 44 -12.691 2.031 -18.607 68 HG3 ARG 44 HG1 ARG 44 -13.096 3.740 -18.773 69 HD2 ARG 44 HD2 ARG 44 -11.192 4.323 -17.299 70 HD3 ARG 44 HD1 ARG 44 -10.781 2.616 -17.166 71 HE ARG 44 HE ARG 44 -10.310 4.340 -19.459 72 HH11 ARG 44 HH11 ARG 44 -10.611 1.127 -18.213 73 HH12 ARG 44 HH12 ARG 44 -9.688 0.398 -19.484 74 HH21 ARG 44 HH21 ARG 44 -9.097 3.393 -21.130 75 HH22 ARG 44 HH22 ARG 44 -8.830 1.682 -21.136 76 H GLU 45 HN GLU 45 -14.686 0.290 -16.025 77 HA GLU 45 HA GLU 45 -14.125 -1.309 -18.290 78 HB2 GLU 45 HB2 GLU 45 -15.107 -2.012 -15.515 79 HB3 GLU 45 HB1 GLU 45 -14.670 -3.219 -16.723 80 HG2 GLU 45 HG2 GLU 45 -12.405 -2.288 -16.867 81 HG3 GLU 45 HG1 GLU 45 -12.833 -1.026 -15.711 82 H ARG 46 HN ARG 46 -17.108 -0.596 -16.529 83 HA ARG 46 HA ARG 46 -18.774 -2.400 -17.933 84 HB2 ARG 46 HB2 ARG 46 -19.406 -1.388 -15.767 85 HB3 ARG 46 HB1 ARG 46 -19.518 0.192 -16.542 86 HG2 ARG 46 HG2 ARG 46 -21.274 -0.666 -18.047 87 HG3 ARG 46 HG1 ARG 46 -21.158 -2.253 -17.281 88 HD2 ARG 46 HD2 ARG 46 -21.828 -1.279 -15.127 89 HD3 ARG 46 HD1 ARG 46 -21.904 0.321 -15.861 90 HE ARG 46 HE ARG 46 -23.920 -0.286 -16.890 91 HH11 ARG 46 HH11 ARG 46 -22.355 -2.981 -15.386 92 HH12 ARG 46 HH12 ARG 46 -23.725 -4.031 -15.526 93 HH21 ARG 46 HH21 ARG 46 -25.722 -1.657 -17.074 94 HH22 ARG 46 HH22 ARG 46 -25.630 -3.282 -16.483 95 H ILE 47 HN ILE 47 -17.963 1.002 -18.392 96 HA ILE 47 HA ILE 47 -19.697 1.486 -20.551 97 HB ILE 47 HB ILE 47 -17.099 2.805 -19.764 98 HG12 ILE 47 HG12 ILE 47 -18.979 2.955 -18.170 99 HG13 ILE 47 HG11 ILE 47 -18.548 4.518 -18.864 100 HG21 ILE 47 HG21 ILE 47 -17.945 3.009 -22.233 101 HG22 ILE 47 HG22 ILE 47 -17.488 4.467 -21.357 102 HG23 ILE 47 HG23 ILE 47 -19.189 4.039 -21.528 103 HD11 ILE 47 HD1 ILE 47 -20.669 4.767 -19.577 104 HD12 ILE 47 HD2 ILE 47 -21.086 3.178 -18.936 105 HD13 ILE 47 HD3 ILE 47 -20.484 3.330 -20.587 106 H GLU 48 HN GLU 48 -16.331 0.434 -20.389 107 HA GLU 48 HA GLU 48 -15.776 0.430 -23.141 108 HB2 GLU 48 HB2 GLU 48 -14.030 0.201 -21.444 109 HB3 GLU 48 HB1 GLU 48 -14.680 -1.367 -20.954 110 HG2 GLU 48 HG2 GLU 48 -14.247 -2.262 -23.210 111 HG3 GLU 48 HG1 GLU 48 -13.660 -0.685 -23.740 112 H SER 49 HN SER 49 -17.196 -2.034 -21.036 113 HA SER 49 HA SER 49 -17.476 -3.906 -23.231 114 HB2 SER 49 HB2 SER 49 -18.503 -5.369 -21.601 115 HB3 SER 49 HB1 SER 49 -17.072 -4.644 -20.873 116 HG SER 49 HG SER 49 -19.781 -3.859 -20.547 117 H ALA 50 HN ALA 50 -19.178 -1.195 -22.066 118 HA ALA 50 HA ALA 50 -21.774 -2.193 -23.014 119 HB1 ALA 50 HB1 ALA 50 -22.511 0.132 -22.235 120 HB2 ALA 50 HB2 ALA 50 -20.889 0.297 -21.565 121 HB3 ALA 50 HB3 ALA 50 -21.955 -0.984 -20.987 122 H ILE 51 HN ILE 51 -19.068 -0.585 -24.189 123 HA ILE 51 HA ILE 51 -20.551 0.262 -26.581 124 HB ILE 51 HB ILE 51 -20.284 2.313 -25.335 125 HG12 ILE 51 HG12 ILE 51 -18.054 2.220 -27.391 126 HG13 ILE 51 HG11 ILE 51 -19.768 2.260 -27.828 127 HG21 ILE 51 HG21 ILE 51 -17.517 2.716 -25.176 128 HG22 ILE 51 HG22 ILE 51 -17.767 1.068 -24.599 129 HG23 ILE 51 HG23 ILE 51 -18.616 2.409 -23.833 130 HD11 ILE 51 HD1 ILE 51 -19.978 4.454 -27.277 131 HD12 ILE 51 HD2 ILE 51 -18.220 4.486 -27.415 132 HD13 ILE 51 HD3 ILE 51 -18.976 4.283 -25.834 133 HA PRO 52 HA PRO 52 -17.696 -2.199 -28.831 134 HB2 PRO 52 HB2 PRO 52 -17.444 0.237 -30.518 135 HB3 PRO 52 HB1 PRO 52 -17.888 -1.414 -30.994 136 HG2 PRO 52 HG2 PRO 52 -19.616 0.753 -30.563 137 HG3 PRO 52 HG1 PRO 52 -20.074 -0.943 -30.794 138 HD2 PRO 52 HD2 PRO 52 -20.416 0.584 -28.429 139 HD3 PRO 52 HD1 PRO 52 -20.591 -1.182 -28.581 140 H GLN 53 HN GLN 53 -15.747 -2.480 -27.881 141 HA GLN 53 HA GLN 53 -14.036 -1.110 -26.511 142 HB2 GLN 53 HB2 GLN 53 -12.094 -1.983 -27.951 143 HB3 GLN 53 HB1 GLN 53 -13.232 -3.180 -27.322 144 HG2 GLN 53 HG2 GLN 53 -14.469 -3.098 -29.476 145 HG3 GLN 53 HG1 GLN 53 -13.271 -1.966 -30.101 146 HE21 GLN 53 HE21 GLN 53 -13.983 -4.931 -30.776 147 HE22 GLN 53 HE22 GLN 53 -12.469 -5.698 -30.776 148 H VAL 54 HN VAL 54 -14.511 1.116 -26.750 149 HA VAL 54 HA VAL 54 -13.943 2.554 -29.144 150 HB VAL 54 HB VAL 54 -14.149 4.558 -27.700 151 HG11 VAL 54 HG11 VAL 54 -16.293 4.059 -28.318 152 HG12 VAL 54 HG12 VAL 54 -16.470 3.586 -26.629 153 HG13 VAL 54 HG13 VAL 54 -16.139 2.365 -27.856 154 HG21 VAL 54 HG21 VAL 54 -14.945 3.838 -25.267 155 HG22 VAL 54 HG22 VAL 54 -13.234 4.064 -25.628 156 HG23 VAL 54 HG23 VAL 54 -13.920 2.440 -25.595 157 H TYR 55 HN TYR 55 -12.271 4.118 -29.448 158 HA TYR 55 HA TYR 55 -9.682 3.100 -29.026 159 HB2 TYR 55 HB2 TYR 55 -10.154 4.616 -30.869 160 HB3 TYR 55 HB1 TYR 55 -10.548 5.910 -29.735 161 HD1 TYR 55 HD1 TYR 55 -7.796 3.614 -30.778 162 HD2 TYR 55 HD2 TYR 55 -8.848 7.306 -28.849 163 HE1 TYR 55 HE1 TYR 55 -5.399 4.239 -30.668 164 HE2 TYR 55 HE2 TYR 55 -6.449 7.931 -28.739 165 HH TYR 55 HH TYR 55 -4.203 6.908 -30.459 166 H HIS 56 HN HIS 56 -11.372 5.804 -27.414 167 HA HIS 56 HA HIS 56 -9.516 5.481 -25.143 168 HB2 HIS 56 HB2 HIS 56 -8.844 7.423 -26.563 169 HB3 HIS 56 HB1 HIS 56 -10.429 8.137 -26.259 170 HD2 HIS 56 HD2 HIS 56 -7.029 7.639 -24.421 171 HE1 HIS 56 HE1 HIS 56 -9.649 9.598 -21.753 172 HE2 HIS 56 HE2 HIS 56 -7.245 8.871 -22.129 173 H ILE 57 HN ILE 57 -10.607 5.145 -23.313 174 HA ILE 57 HA ILE 57 -13.168 6.529 -22.863 175 HB ILE 57 HB ILE 57 -13.755 4.302 -23.727 176 HG12 ILE 57 HG12 ILE 57 -14.185 4.434 -20.747 177 HG13 ILE 57 HG11 ILE 57 -15.062 5.423 -21.920 178 HG21 ILE 57 HG21 ILE 57 -12.681 2.894 -21.365 179 HG22 ILE 57 HG22 ILE 57 -11.467 3.448 -22.519 180 HG23 ILE 57 HG23 ILE 57 -12.760 2.375 -23.049 181 HD11 ILE 57 HD1 ILE 57 -16.262 3.648 -22.740 182 HD12 ILE 57 HD2 ILE 57 -15.961 3.013 -21.126 183 HD13 ILE 57 HD3 ILE 57 -14.948 2.503 -22.470 184 H ILE 58 HN ILE 58 -12.921 7.620 -21.049 185 HA ILE 58 HA ILE 58 -11.713 6.267 -18.747 186 HB ILE 58 HB ILE 58 -10.856 8.999 -19.725 187 HG12 ILE 58 HG12 ILE 58 -9.258 6.458 -19.282 188 HG13 ILE 58 HG11 ILE 58 -9.869 6.970 -20.856 189 HG21 ILE 58 HG21 ILE 58 -9.264 8.046 -17.579 190 HG22 ILE 58 HG22 ILE 58 -10.946 7.863 -17.081 191 HG23 ILE 58 HG23 ILE 58 -10.341 9.442 -17.580 192 HD11 ILE 58 HD1 ILE 58 -8.673 9.212 -20.367 193 HD12 ILE 58 HD2 ILE 58 -7.672 7.827 -20.808 194 HD13 ILE 58 HD3 ILE 58 -7.809 8.317 -19.120 195 H VAL 59 HN VAL 59 -12.858 6.584 -16.922 196 HA VAL 59 HA VAL 59 -14.898 8.729 -16.967 197 HB VAL 59 HB VAL 59 -14.893 6.122 -15.440 198 HG11 VAL 59 HG11 VAL 59 -16.361 8.591 -15.088 199 HG12 VAL 59 HG12 VAL 59 -16.391 7.129 -14.102 200 HG13 VAL 59 HG13 VAL 59 -17.458 7.272 -15.495 201 HG21 VAL 59 HG21 VAL 59 -15.322 6.243 -18.039 202 HG22 VAL 59 HG22 VAL 59 -16.889 6.876 -17.543 203 HG23 VAL 59 HG23 VAL 59 -16.379 5.275 -17.013 204 H THR 60 HN THR 60 -14.731 10.297 -15.521 205 HA THR 60 HA THR 60 -13.004 9.877 -13.160 206 HB THR 60 HB THR 60 -13.232 12.389 -14.837 207 HG1 THR 60 HG1 THR 60 -11.659 10.206 -14.956 208 HG21 THR 60 HG21 THR 60 -12.361 13.490 -13.082 209 HG22 THR 60 HG22 THR 60 -11.039 12.326 -12.980 210 HG23 THR 60 HG23 THR 60 -12.545 12.029 -12.110 211 H ASP 61 HN ASP 61 -13.760 10.599 -11.224 212 HA ASP 61 HA ASP 61 -16.521 11.594 -11.219 213 HB2 ASP 61 HB2 ASP 61 -16.518 10.970 -8.835 214 HB3 ASP 61 HB1 ASP 61 -16.066 9.607 -9.854 215 H LEU 62 HN LEU 62 -16.602 13.793 -11.309 216 HA LEU 62 HA LEU 62 -14.571 15.532 -10.400 217 HB2 LEU 62 HB2 LEU 62 -17.509 15.976 -10.963 218 HB3 LEU 62 HB1 LEU 62 -16.391 17.282 -10.560 219 HG LEU 62 HG LEU 62 -15.922 15.336 -12.831 220 HD11 LEU 62 HD11 LEU 62 -16.579 17.348 -14.257 221 HD12 LEU 62 HD12 LEU 62 -17.258 18.052 -12.790 222 HD13 LEU 62 HD13 LEU 62 -17.907 16.539 -13.424 223 HD21 LEU 62 HD21 LEU 62 -14.549 17.557 -13.457 224 HD22 LEU 62 HD22 LEU 62 -13.858 16.289 -12.445 225 HD23 LEU 62 HD23 LEU 62 -14.549 17.732 -11.702 226 H SER 63 HN SER 63 -17.553 14.357 -8.898 227 HA SER 63 HA SER 63 -17.221 15.925 -6.514 228 HB2 SER 63 HB2 SER 63 -19.015 13.558 -7.084 229 HB3 SER 63 HB1 SER 63 -19.080 14.544 -5.629 230 HG SER 63 HG SER 63 -20.306 15.813 -6.756 231 H TYR 64 HN TYR 64 -16.837 15.064 -4.384 232 HA TYR 64 HA TYR 64 -14.542 13.456 -4.204 233 HB2 TYR 64 HB2 TYR 64 -15.135 15.007 -2.427 234 HB3 TYR 64 HB1 TYR 64 -16.622 14.112 -2.101 235 HD1 TYR 64 HD1 TYR 64 -12.902 13.791 -2.144 236 HD2 TYR 64 HD2 TYR 64 -16.621 12.233 -0.668 237 HE1 TYR 64 HE1 TYR 64 -11.662 12.274 -0.623 238 HE2 TYR 64 HE2 TYR 64 -15.383 10.716 0.854 239 HH TYR 64 HH TYR 64 -11.885 10.397 0.680 240 H GLY 65 HN GLY 65 -17.962 12.675 -3.589 241 HA2 GLY 65 HA2 GLY 65 -17.412 9.907 -3.016 242 HA3 GLY 65 HA1 GLY 65 -19.003 10.638 -3.222 243 H CYS 66 HN CYS 66 -18.895 8.271 -4.301 244 HA CYS 66 HA CYS 66 -18.335 8.671 -7.182 245 HB2 CYS 66 HB2 CYS 66 -18.077 6.235 -7.334 246 HB3 CYS 66 HB1 CYS 66 -16.956 6.904 -6.144 247 HG CYS 66 HG CYS 66 -18.198 5.762 -4.293 248 H GLY 67 HN GLY 67 -19.822 7.636 -8.664 249 HA2 GLY 67 HA2 GLY 67 -21.898 6.854 -9.370 250 HA3 GLY 67 HA1 GLY 67 -22.390 6.714 -7.682 251 H GLN 68 HN GLN 68 -21.051 9.700 -8.013 252 HA GLN 68 HA GLN 68 -23.547 10.997 -8.894 253 HB2 GLN 68 HB2 GLN 68 -23.513 12.504 -6.994 254 HB3 GLN 68 HB1 GLN 68 -23.536 10.842 -6.403 255 HG2 GLN 68 HG2 GLN 68 -21.078 10.919 -6.119 256 HG3 GLN 68 HG1 GLN 68 -21.076 12.594 -6.670 257 HE21 GLN 68 HE21 GLN 68 -20.604 11.126 -3.899 258 HE22 GLN 68 HE22 GLN 68 -21.491 12.097 -2.826 259 H SER 69 HN SER 69 -20.778 10.581 -9.987 260 HA SER 69 HA SER 69 -20.145 13.430 -10.430 261 HB2 SER 69 HB2 SER 69 -18.182 11.142 -10.187 262 HB3 SER 69 HB1 SER 69 -17.770 12.794 -10.612 263 HG SER 69 HG SER 69 -17.921 11.798 -8.229 264 H PHE 70 HN PHE 70 -19.336 13.973 -12.488 265 HA PHE 70 HA PHE 70 -19.606 11.920 -14.565 266 HB2 PHE 70 HB2 PHE 70 -20.887 13.498 -15.936 267 HB3 PHE 70 HB1 PHE 70 -21.722 13.116 -14.435 268 HD1 PHE 70 HD1 PHE 70 -19.984 15.702 -16.365 269 HD2 PHE 70 HD2 PHE 70 -21.836 14.761 -12.607 270 HE1 PHE 70 HE1 PHE 70 -20.038 18.112 -15.792 271 HE2 PHE 70 HE2 PHE 70 -21.891 17.171 -12.031 272 HZ PHE 70 HZ PHE 70 -20.989 18.847 -13.621 273 H ASP 71 HN ASP 71 -17.599 11.831 -15.414 274 HA ASP 71 HA ASP 71 -16.591 14.141 -16.797 275 HB2 ASP 71 HB2 ASP 71 -15.768 14.560 -14.487 276 HB3 ASP 71 HB1 ASP 71 -14.925 13.020 -14.537 277 H ILE 72 HN ILE 72 -17.313 12.066 -18.131 278 HA ILE 72 HA ILE 72 -14.970 10.290 -18.434 279 HB ILE 72 HB ILE 72 -17.629 9.750 -19.709 280 HG12 ILE 72 HG12 ILE 72 -16.872 9.032 -16.872 281 HG13 ILE 72 HG11 ILE 72 -18.026 10.285 -17.290 282 HG21 ILE 72 HG21 ILE 72 -16.884 7.420 -19.337 283 HG22 ILE 72 HG22 ILE 72 -15.410 8.035 -18.595 284 HG23 ILE 72 HG23 ILE 72 -15.732 8.344 -20.299 285 HD11 ILE 72 HD1 ILE 72 -19.664 8.778 -17.620 286 HD12 ILE 72 HD2 ILE 72 -18.589 7.567 -16.925 287 HD13 ILE 72 HD3 ILE 72 -18.634 7.802 -18.671 288 H VAL 73 HN VAL 73 -13.744 10.541 -20.225 289 HA VAL 73 HA VAL 73 -14.950 11.972 -22.523 290 HB VAL 73 HB VAL 73 -13.109 13.157 -21.125 291 HG11 VAL 73 HG11 VAL 73 -10.829 12.522 -21.649 292 HG12 VAL 73 HG12 VAL 73 -11.388 11.270 -22.757 293 HG13 VAL 73 HG13 VAL 73 -11.667 11.102 -21.024 294 HG21 VAL 73 HG21 VAL 73 -12.081 14.056 -23.222 295 HG22 VAL 73 HG22 VAL 73 -13.843 13.981 -23.292 296 HG23 VAL 73 HG23 VAL 73 -12.874 12.762 -24.122 297 H VAL 74 HN VAL 74 -14.982 10.842 -24.368 298 HA VAL 74 HA VAL 74 -12.977 8.716 -24.743 299 HB VAL 74 HB VAL 74 -14.722 7.244 -25.662 300 HG11 VAL 74 HG11 VAL 74 -14.350 7.965 -22.947 301 HG12 VAL 74 HG12 VAL 74 -14.958 6.434 -23.578 302 HG13 VAL 74 HG13 VAL 74 -16.083 7.729 -23.171 303 HG21 VAL 74 HG21 VAL 74 -16.186 9.414 -26.143 304 HG22 VAL 74 HG22 VAL 74 -16.844 9.044 -24.548 305 HG23 VAL 74 HG23 VAL 74 -16.955 7.854 -25.846 306 H VAL 75 HN VAL 75 -12.383 8.323 -26.893 307 HA VAL 75 HA VAL 75 -13.546 10.145 -28.906 308 HB VAL 75 HB VAL 75 -10.600 9.566 -28.509 309 HG11 VAL 75 HG11 VAL 75 -10.737 9.882 -30.795 310 HG12 VAL 75 HG12 VAL 75 -10.649 11.565 -30.276 311 HG13 VAL 75 HG13 VAL 75 -12.209 10.845 -30.681 312 HG21 VAL 75 HG21 VAL 75 -11.965 11.233 -26.974 313 HG22 VAL 75 HG22 VAL 75 -11.877 12.281 -28.390 314 HG23 VAL 75 HG23 VAL 75 -10.396 11.711 -27.621 315 H SER 76 HN SER 76 -14.268 9.050 -30.625 316 HA SER 76 HA SER 76 -12.762 6.877 -31.764 317 HB2 SER 76 HB2 SER 76 -14.430 5.145 -31.499 318 HB3 SER 76 HB1 SER 76 -13.973 5.742 -29.906 319 HG SER 76 HG SER 76 -16.127 5.820 -29.838 320 H ASP 77 HN ASP 77 -13.904 5.981 -33.711 321 HA ASP 77 HA ASP 77 -14.818 8.100 -35.355 322 HB2 ASP 77 HB2 ASP 77 -14.851 5.105 -35.690 323 HB3 ASP 77 HB1 ASP 77 -15.407 6.214 -36.936 324 H PHE 78 HN PHE 78 -16.407 6.044 -33.134 325 HA PHE 78 HA PHE 78 -18.988 5.848 -34.218 326 HB2 PHE 78 HB2 PHE 78 -17.977 4.807 -32.044 327 HB3 PHE 78 HB1 PHE 78 -18.543 6.305 -31.284 328 HD1 PHE 78 HD1 PHE 78 -19.845 3.857 -33.836 329 HD2 PHE 78 HD2 PHE 78 -20.654 6.161 -30.300 330 HE1 PHE 78 HE1 PHE 78 -22.151 2.944 -33.769 331 HE2 PHE 78 HE2 PHE 78 -22.959 5.247 -30.237 332 HZ PHE 78 HZ PHE 78 -23.708 3.640 -31.970 333 H PHE 79 HN PHE 79 -17.290 8.475 -32.679 334 HA PHE 79 HA PHE 79 -19.752 10.090 -32.649 335 HB2 PHE 79 HB2 PHE 79 -17.131 11.075 -31.595 336 HB3 PHE 79 HB1 PHE 79 -18.746 11.460 -31.054 337 HD1 PHE 79 HD1 PHE 79 -16.195 10.382 -29.499 338 HD2 PHE 79 HD2 PHE 79 -19.796 8.582 -30.989 339 HE1 PHE 79 HE1 PHE 79 -16.014 8.601 -27.782 340 HE2 PHE 79 HE2 PHE 79 -19.620 6.805 -29.270 341 HZ PHE 79 HZ PHE 79 -17.729 6.814 -27.669 342 H GLN 80 HN GLN 80 -17.708 9.272 -34.877 343 HA GLN 80 HA GLN 80 -16.870 11.874 -35.862 344 HB2 GLN 80 HB2 GLN 80 -15.442 9.885 -36.161 345 HB3 GLN 80 HB1 GLN 80 -16.708 9.129 -37.127 346 HG2 GLN 80 HG2 GLN 80 -16.573 10.943 -38.765 347 HG3 GLN 80 HG1 GLN 80 -15.352 11.754 -37.788 348 HE21 GLN 80 HE21 GLN 80 -14.693 11.050 -40.425 349 HE22 GLN 80 HE22 GLN 80 -13.582 9.767 -40.408 350 H GLY 81 HN GLY 81 -18.110 13.144 -37.086 351 HA2 GLY 81 HA2 GLY 81 -19.619 13.793 -38.718 352 HA3 GLY 81 HA1 GLY 81 -19.816 12.096 -39.154 353 H LYS 82 HN LYS 82 -20.223 12.944 -35.834 354 HA LYS 82 HA LYS 82 -23.160 12.928 -36.148 355 HB2 LYS 82 HB2 LYS 82 -21.527 11.369 -34.135 356 HB3 LYS 82 HB1 LYS 82 -23.280 11.559 -34.061 357 HG2 LYS 82 HG2 LYS 82 -23.482 10.529 -36.301 358 HG3 LYS 82 HG1 LYS 82 -21.730 10.322 -36.358 359 HD2 LYS 82 HD2 LYS 82 -21.834 8.900 -34.345 360 HD3 LYS 82 HD1 LYS 82 -23.582 9.100 -34.294 361 HE2 LYS 82 HE2 LYS 82 -23.784 8.047 -36.505 362 HE3 LYS 82 HE1 LYS 82 -22.032 7.854 -36.582 363 HZ1 LYS 82 HZ1 LYS 82 -23.808 6.663 -34.520 364 HZ2 LYS 82 HZ2 LYS 82 -22.125 6.453 -34.627 365 HZ3 LYS 82 HZ3 LYS 82 -23.141 5.831 -35.839 366 H SER 83 HN SER 83 -24.334 14.045 -34.568 367 HA SER 83 HA SER 83 -23.084 16.396 -33.560 368 HB2 SER 83 HB2 SER 83 -25.429 16.425 -34.213 369 HB3 SER 83 HB1 SER 83 -25.814 15.221 -32.986 370 HG SER 83 HG SER 83 -24.880 17.876 -32.626 371 H LYS 84 HN LYS 84 -22.886 17.067 -31.364 372 HA LYS 84 HA LYS 84 -21.662 15.186 -29.663 373 HB2 LYS 84 HB2 LYS 84 -22.787 17.940 -29.117 374 HB3 LYS 84 HB1 LYS 84 -21.868 17.009 -27.933 375 HG2 LYS 84 HG2 LYS 84 -19.963 16.894 -29.489 376 HG3 LYS 84 HG1 LYS 84 -20.878 17.816 -30.684 377 HD2 LYS 84 HD2 LYS 84 -21.034 19.710 -29.108 378 HD3 LYS 84 HD1 LYS 84 -20.112 18.791 -27.917 379 HE2 LYS 84 HE2 LYS 84 -18.208 18.669 -29.473 380 HE3 LYS 84 HE1 LYS 84 -19.123 19.578 -30.673 381 HZ1 LYS 84 HZ1 LYS 84 -17.580 20.579 -28.579 382 HZ2 LYS 84 HZ2 LYS 84 -19.198 20.961 -28.232 383 HZ3 LYS 84 HZ3 LYS 84 -18.503 21.450 -29.704 384 H LEU 85 HN LEU 85 -24.942 16.496 -29.750 385 HA LEU 85 HA LEU 85 -25.877 15.411 -27.320 386 HB2 LEU 85 HB2 LEU 85 -27.317 16.131 -29.878 387 HB3 LEU 85 HB1 LEU 85 -28.146 15.629 -28.404 388 HG LEU 85 HG LEU 85 -26.187 17.936 -28.520 389 HD11 LEU 85 HD11 LEU 85 -29.148 18.291 -28.221 390 HD12 LEU 85 HD12 LEU 85 -28.480 18.062 -29.837 391 HD13 LEU 85 HD13 LEU 85 -27.944 19.419 -28.846 392 HD21 LEU 85 HD21 LEU 85 -27.430 16.466 -26.397 393 HD22 LEU 85 HD22 LEU 85 -28.110 18.092 -26.415 394 HD23 LEU 85 HD23 LEU 85 -26.367 17.867 -26.275 395 H MET 86 HN MET 86 -25.699 14.097 -30.586 396 HA MET 86 HA MET 86 -27.200 11.750 -30.178 397 HB2 MET 86 HB2 MET 86 -24.909 12.353 -32.057 398 HB3 MET 86 HB1 MET 86 -25.855 10.865 -32.114 399 HG2 MET 86 HG2 MET 86 -26.981 13.669 -32.380 400 HG3 MET 86 HG1 MET 86 -26.728 12.537 -33.712 401 HE1 MET 86 HE1 MET 86 -28.411 9.472 -32.385 402 HE2 MET 86 HE2 MET 86 -27.185 10.226 -33.403 403 HE3 MET 86 HE3 MET 86 -28.855 10.145 -33.960 404 H ARG 87 HN ARG 87 -23.806 12.527 -29.574 405 HA ARG 87 HA ARG 87 -22.864 9.924 -29.067 406 HB2 ARG 87 HB2 ARG 87 -22.008 12.613 -27.978 407 HB3 ARG 87 HB1 ARG 87 -21.141 11.113 -27.645 408 HG2 ARG 87 HG2 ARG 87 -21.562 12.472 -30.307 409 HG3 ARG 87 HG1 ARG 87 -20.040 12.023 -29.534 410 HD2 ARG 87 HD2 ARG 87 -20.272 10.286 -31.045 411 HD3 ARG 87 HD1 ARG 87 -21.063 9.595 -29.646 412 HE ARG 87 HE ARG 87 -22.828 11.057 -31.426 413 HH11 ARG 87 HH11 ARG 87 -21.336 8.040 -30.623 414 HH12 ARG 87 HH12 ARG 87 -22.548 7.079 -31.402 415 HH21 ARG 87 HH21 ARG 87 -24.425 9.800 -32.438 416 HH22 ARG 87 HH22 ARG 87 -24.294 8.072 -32.428 417 H SER 88 HN SER 88 -24.399 12.319 -26.930 418 HA SER 88 HA SER 88 -24.094 10.879 -24.519 419 HB2 SER 88 HB2 SER 88 -26.203 12.872 -25.374 420 HB3 SER 88 HB1 SER 88 -26.000 12.286 -23.726 421 HG SER 88 HG SER 88 -24.813 14.311 -24.713 422 H ARG 89 HN ARG 89 -26.711 10.929 -26.928 423 HA ARG 89 HA ARG 89 -28.452 9.173 -25.552 424 HB2 ARG 89 HB2 ARG 89 -29.173 10.609 -27.429 425 HB3 ARG 89 HB1 ARG 89 -28.206 9.631 -28.534 426 HG2 ARG 89 HG2 ARG 89 -29.526 7.633 -27.918 427 HG3 ARG 89 HG1 ARG 89 -30.500 8.619 -26.827 428 HD2 ARG 89 HD2 ARG 89 -31.248 10.000 -28.715 429 HD3 ARG 89 HD1 ARG 89 -30.246 9.059 -29.815 430 HE ARG 89 HE ARG 89 -31.810 7.318 -29.693 431 HH11 ARG 89 HH11 ARG 89 -32.459 9.834 -27.409 432 HH12 ARG 89 HH12 ARG 89 -34.035 9.246 -26.999 433 HH21 ARG 89 HH21 ARG 89 -33.873 6.533 -29.153 434 HH22 ARG 89 HH22 ARG 89 -34.836 7.377 -27.986 435 H ALA 90 HN ALA 90 -25.967 8.604 -28.031 436 HA ALA 90 HA ALA 90 -26.408 5.835 -28.336 437 HB1 ALA 90 HB1 ALA 90 -23.810 5.997 -28.940 438 HB2 ALA 90 HB2 ALA 90 -24.178 7.722 -28.944 439 HB3 ALA 90 HB3 ALA 90 -25.053 6.633 -30.019 440 H VAL 91 HN VAL 91 -24.240 7.652 -26.192 441 HA VAL 91 HA VAL 91 -23.089 5.327 -24.986 442 HB VAL 91 HB VAL 91 -21.960 7.529 -25.006 443 HG11 VAL 91 HG11 VAL 91 -23.854 9.004 -24.697 444 HG12 VAL 91 HG12 VAL 91 -22.774 9.220 -23.320 445 HG13 VAL 91 HG13 VAL 91 -24.243 8.258 -23.149 446 HG21 VAL 91 HG21 VAL 91 -20.964 7.220 -22.923 447 HG22 VAL 91 HG22 VAL 91 -21.765 5.663 -23.138 448 HG23 VAL 91 HG23 VAL 91 -22.502 6.902 -22.121 449 H ASN 92 HN ASN 92 -25.778 7.467 -24.213 450 HA ASN 92 HA ASN 92 -26.300 6.518 -21.614 451 HB2 ASN 92 HB2 ASN 92 -28.077 7.786 -23.699 452 HB3 ASN 92 HB1 ASN 92 -28.626 7.410 -22.066 453 HD21 ASN 92 HD21 ASN 92 -28.436 10.117 -23.107 454 HD22 ASN 92 HD22 ASN 92 -27.260 10.930 -22.192 455 H LYS 93 HN LYS 93 -27.442 5.456 -24.785 456 HA LYS 93 HA LYS 93 -29.340 3.568 -23.886 457 HB2 LYS 93 HB2 LYS 93 -27.721 3.714 -26.434 458 HB3 LYS 93 HB1 LYS 93 -29.022 2.555 -26.162 459 HG2 LYS 93 HG2 LYS 93 -29.369 5.555 -25.914 460 HG3 LYS 93 HG1 LYS 93 -29.751 4.642 -27.376 461 HD2 LYS 93 HD2 LYS 93 -31.320 3.235 -26.046 462 HD3 LYS 93 HD1 LYS 93 -30.985 4.238 -24.635 463 HE2 LYS 93 HE2 LYS 93 -32.101 5.268 -27.259 464 HE3 LYS 93 HE1 LYS 93 -33.061 4.942 -25.815 465 HZ1 LYS 93 HZ1 LYS 93 -31.428 7.195 -26.427 466 HZ2 LYS 93 HZ2 LYS 93 -30.986 6.497 -24.942 467 HZ3 LYS 93 HZ3 LYS 93 -32.585 7.006 -25.203 468 H ALA 94 HN ALA 94 -25.869 3.319 -24.549 469 HA ALA 94 HA ALA 94 -25.626 0.524 -24.334 470 HB1 ALA 94 HB1 ALA 94 -23.239 1.008 -23.805 471 HB2 ALA 94 HB2 ALA 94 -23.649 2.718 -23.678 472 HB3 ALA 94 HB3 ALA 94 -23.821 1.883 -25.222 473 H VAL 95 HN VAL 95 -25.473 3.080 -21.885 474 HA VAL 95 HA VAL 95 -25.828 1.007 -19.821 475 HB VAL 95 HB VAL 95 -24.310 2.307 -18.337 476 HG11 VAL 95 HG11 VAL 95 -22.350 1.823 -20.328 477 HG12 VAL 95 HG12 VAL 95 -23.636 0.642 -20.576 478 HG13 VAL 95 HG13 VAL 95 -22.833 0.757 -19.010 479 HG21 VAL 95 HG21 VAL 95 -22.701 3.749 -19.986 480 HG22 VAL 95 HG22 VAL 95 -24.026 4.455 -19.062 481 HG23 VAL 95 HG23 VAL 95 -24.265 4.017 -20.755 482 H LYS 96 HN LYS 96 -27.952 2.344 -20.860 483 HA LYS 96 HA LYS 96 -28.602 4.795 -19.613 484 HB2 LYS 96 HB2 LYS 96 -29.796 3.887 -21.575 485 HB3 LYS 96 HB1 LYS 96 -30.490 2.635 -20.544 486 HG2 LYS 96 HG2 LYS 96 -32.093 4.457 -20.742 487 HG3 LYS 96 HG1 LYS 96 -31.460 4.434 -19.095 488 HD2 LYS 96 HD2 LYS 96 -29.903 6.236 -19.619 489 HD3 LYS 96 HD1 LYS 96 -30.401 6.213 -21.312 490 HE2 LYS 96 HE2 LYS 96 -32.688 6.848 -20.657 491 HE3 LYS 96 HE1 LYS 96 -32.206 6.859 -18.960 492 HZ1 LYS 96 HZ1 LYS 96 -31.710 8.988 -19.306 493 HZ2 LYS 96 HZ2 LYS 96 -31.778 8.833 -20.996 494 HZ3 LYS 96 HZ3 LYS 96 -30.352 8.436 -20.161 495 H GLU 97 HN GLU 97 -29.071 1.441 -18.613 496 HA GLU 97 HA GLU 97 -30.810 1.851 -16.456 497 HB2 GLU 97 HB2 GLU 97 -30.218 -0.367 -17.361 498 HB3 GLU 97 HB1 GLU 97 -28.592 -0.191 -16.699 499 HG2 GLU 97 HG2 GLU 97 -29.530 0.003 -14.427 500 HG3 GLU 97 HG1 GLU 97 -31.156 -0.170 -15.084 501 H GLU 98 HN GLU 98 -27.230 1.824 -16.495 502 HA GLU 98 HA GLU 98 -26.962 2.335 -13.697 503 HB2 GLU 98 HB2 GLU 98 -24.638 2.631 -14.125 504 HB3 GLU 98 HB1 GLU 98 -25.184 1.372 -15.233 505 HG2 GLU 98 HG2 GLU 98 -25.382 2.984 -17.029 506 HG3 GLU 98 HG1 GLU 98 -24.941 4.304 -15.955 507 H LEU 99 HN LEU 99 -27.481 4.350 -16.489 508 HA LEU 99 HA LEU 99 -26.543 6.798 -15.450 509 HB2 LEU 99 HB2 LEU 99 -28.715 6.184 -17.459 510 HB3 LEU 99 HB1 LEU 99 -28.149 7.815 -17.094 511 HG LEU 99 HG LEU 99 -26.340 5.564 -17.995 512 HD11 LEU 99 HD11 LEU 99 -28.103 7.344 -19.498 513 HD12 LEU 99 HD12 LEU 99 -27.217 5.920 -20.045 514 HD13 LEU 99 HD13 LEU 99 -26.416 7.487 -19.992 515 HD21 LEU 99 HD21 LEU 99 -25.977 8.371 -17.158 516 HD22 LEU 99 HD22 LEU 99 -25.089 7.891 -18.600 517 HD23 LEU 99 HD23 LEU 99 -24.849 7.023 -17.083 518 H GLN 100 HN GLN 100 -29.692 5.191 -15.210 519 HA GLN 100 HA GLN 100 -31.083 7.303 -13.956 520 HB2 GLN 100 HB2 GLN 100 -32.197 5.339 -14.952 521 HB3 GLN 100 HB1 GLN 100 -31.522 4.319 -13.680 522 HG2 GLN 100 HG2 GLN 100 -32.712 5.594 -11.974 523 HG3 GLN 100 HG1 GLN 100 -33.321 6.710 -13.194 524 HE21 GLN 100 HE21 GLN 100 -35.145 5.260 -11.575 525 HE22 GLN 100 HE22 GLN 100 -35.949 4.119 -12.541 526 H GLU 101 HN GLU 101 -29.133 4.652 -12.684 527 HA GLU 101 HA GLU 101 -29.667 5.240 -9.933 528 HB2 GLU 101 HB2 GLU 101 -28.959 2.993 -10.682 529 HB3 GLU 101 HB1 GLU 101 -27.392 3.657 -11.153 530 HG2 GLU 101 HG2 GLU 101 -27.158 2.688 -8.948 531 HG3 GLU 101 HG1 GLU 101 -27.089 4.441 -8.782 532 H ILE 102 HN ILE 102 -27.280 6.258 -12.293 533 HA ILE 102 HA ILE 102 -25.591 7.522 -10.298 534 HB ILE 102 HB ILE 102 -25.557 7.642 -13.324 535 HG12 ILE 102 HG12 ILE 102 -23.755 6.117 -11.429 536 HG13 ILE 102 HG11 ILE 102 -25.161 5.390 -12.204 537 HG21 ILE 102 HG21 ILE 102 -23.847 8.801 -11.162 538 HG22 ILE 102 HG22 ILE 102 -24.311 9.498 -12.714 539 HG23 ILE 102 HG23 ILE 102 -23.072 8.243 -12.643 540 HD11 ILE 102 HD1 ILE 102 -23.153 4.916 -13.524 541 HD12 ILE 102 HD2 ILE 102 -22.783 6.637 -13.616 542 HD13 ILE 102 HD3 ILE 102 -24.213 5.998 -14.426 543 H HIS 103 HN HIS 103 -25.951 9.487 -9.477 544 HA HIS 103 HA HIS 103 -28.095 11.145 -10.243 545 HB2 HIS 103 HB2 HIS 103 -27.094 11.220 -8.007 546 HB3 HIS 103 HB1 HIS 103 -25.593 11.852 -8.691 547 HD2 HIS 103 HD2 HIS 103 -25.560 14.609 -8.900 548 HE1 HIS 103 HE1 HIS 103 -29.705 15.285 -8.474 549 HE2 HIS 103 HE2 HIS 103 -27.440 16.410 -8.700 550 H ALA 104 HN ALA 104 -24.595 11.449 -10.872 551 HA ALA 104 HA ALA 104 -25.260 13.129 -13.201 552 HB1 ALA 104 HB1 ALA 104 -22.907 13.720 -11.409 553 HB2 ALA 104 HB2 ALA 104 -24.479 14.481 -11.169 554 HB3 ALA 104 HB3 ALA 104 -23.597 14.736 -12.675 555 H PHE 105 HN PHE 105 -24.238 12.518 -15.003 556 HA PHE 105 HA PHE 105 -21.697 11.076 -14.805 557 HB2 PHE 105 HB2 PHE 105 -22.510 9.295 -16.317 558 HB3 PHE 105 HB1 PHE 105 -23.407 9.313 -14.798 559 HD1 PHE 105 HD1 PHE 105 -23.565 9.990 -18.414 560 HD2 PHE 105 HD2 PHE 105 -25.708 10.159 -14.692 561 HE1 PHE 105 HE1 PHE 105 -25.692 10.314 -19.652 562 HE2 PHE 105 HE2 PHE 105 -27.834 10.480 -15.931 563 HZ PHE 105 HZ PHE 105 -27.825 10.556 -18.410 564 H SER 106 HN SER 106 -20.435 11.195 -16.680 565 HA SER 106 HA SER 106 -21.501 12.843 -18.890 566 HB2 SER 106 HB2 SER 106 -19.404 14.092 -19.008 567 HB3 SER 106 HB1 SER 106 -20.133 14.287 -17.416 568 HG SER 106 HG SER 106 -18.734 12.261 -17.024 569 H CYS 107 HN CYS 107 -20.513 12.499 -20.908 570 HA CYS 107 HA CYS 107 -18.917 10.025 -21.108 571 HB2 CYS 107 HB2 CYS 107 -20.113 9.370 -23.037 572 HB3 CYS 107 HB1 CYS 107 -21.357 9.922 -21.911 573 HG CYS 107 HG CYS 107 -22.015 11.482 -23.720 574 H LYS 108 HN LYS 108 -19.213 13.347 -21.889 575 HA LYS 108 HA LYS 108 -18.164 14.624 -23.589 576 HB2 LYS 108 HB2 LYS 108 -15.944 13.408 -21.927 577 HB3 LYS 108 HB1 LYS 108 -15.786 14.844 -22.932 578 HG2 LYS 108 HG2 LYS 108 -17.459 16.016 -21.619 579 HG3 LYS 108 HG1 LYS 108 -17.780 14.563 -20.672 580 HD2 LYS 108 HD2 LYS 108 -16.305 15.982 -19.378 581 HD3 LYS 108 HD1 LYS 108 -15.372 14.594 -19.939 582 HE2 LYS 108 HE2 LYS 108 -14.462 15.916 -21.787 583 HE3 LYS 108 HE1 LYS 108 -15.442 17.301 -21.302 584 HZ1 LYS 108 HZ1 LYS 108 -13.654 17.858 -20.110 585 HZ2 LYS 108 HZ2 LYS 108 -12.983 16.300 -20.179 586 HZ3 LYS 108 HZ3 LYS 108 -14.170 16.666 -19.018 587 H CYS 109 HN CYS 109 -18.496 13.701 -25.611 588 HA CYS 109 HA CYS 109 -16.512 11.689 -26.479 589 HB2 CYS 109 HB2 CYS 109 -19.242 12.386 -27.582 590 HB3 CYS 109 HB1 CYS 109 -18.135 11.233 -28.322 591 HG CYS 109 HG CYS 109 -19.964 10.564 -26.084 592 H TYR 110 HN TYR 110 -15.030 12.246 -27.940 593 HA TYR 110 HA TYR 110 -15.513 14.626 -29.612 594 HB2 TYR 110 HB2 TYR 110 -12.935 13.976 -28.152 595 HB3 TYR 110 HB1 TYR 110 -13.177 15.327 -29.263 596 HD1 TYR 110 HD1 TYR 110 -13.726 14.053 -25.900 597 HD2 TYR 110 HD2 TYR 110 -14.795 17.152 -28.674 598 HE1 TYR 110 HE1 TYR 110 -14.624 15.414 -24.034 599 HE2 TYR 110 HE2 TYR 110 -15.695 18.513 -26.803 600 HH TYR 110 HH TYR 110 -16.629 18.039 -24.478 601 H THR 111 HN THR 111 -14.494 14.605 -31.645 602 HA THR 111 HA THR 111 -12.847 12.341 -32.408 603 HB THR 111 HB THR 111 -15.537 12.755 -33.728 604 HG1 THR 111 HG1 THR 111 -14.777 10.441 -32.361 605 HG21 THR 111 HG21 THR 111 -13.135 11.542 -34.625 606 HG22 THR 111 HG22 THR 111 -14.722 11.487 -35.392 607 HG23 THR 111 HG23 THR 111 -14.255 10.236 -34.240 608 H GLU 112 HN GLU 112 -12.452 15.191 -32.319 609 HA GLU 112 HA GLU 112 -11.447 16.799 -33.600 610 HB2 GLU 112 HB2 GLU 112 -10.215 15.007 -34.686 611 HB3 GLU 112 HB1 GLU 112 -11.591 14.657 -35.734 612 HG2 GLU 112 HG2 GLU 112 -9.978 16.022 -36.948 613 HG3 GLU 112 HG1 GLU 112 -11.434 16.965 -36.653 614 H GLU 113 HN GLU 113 -14.487 15.554 -34.102 615 HA GLU 113 HA GLU 113 -15.376 16.907 -36.401 616 HB2 GLU 113 HB2 GLU 113 -16.824 16.032 -33.906 617 HB3 GLU 113 HB1 GLU 113 -17.637 16.755 -35.296 618 HG2 GLU 113 HG2 GLU 113 -15.879 14.284 -35.431 619 HG3 GLU 113 HG1 GLU 113 -17.641 14.251 -35.364 620 H GLU 114 HN GLU 114 -15.063 17.937 -33.047 621 HA GLU 114 HA GLU 114 -16.492 20.345 -33.193 622 HB2 GLU 114 HB2 GLU 114 -14.091 19.557 -31.528 623 HB3 GLU 114 HB1 GLU 114 -14.996 21.054 -31.291 624 HG2 GLU 114 HG2 GLU 114 -17.042 19.786 -30.870 625 HG3 GLU 114 HG1 GLU 114 -16.197 18.272 -31.191 626 H TRP 115 HN TRP 115 -13.440 19.423 -34.508 627 HA TRP 115 HA TRP 115 -12.386 22.087 -34.795 628 HB2 TRP 115 HB2 TRP 115 -10.497 21.040 -35.480 629 HB3 TRP 115 HB1 TRP 115 -11.300 19.555 -34.942 630 HD1 TRP 115 HD1 TRP 115 -13.280 18.881 -37.106 631 HE1 TRP 115 HE1 TRP 115 -12.588 18.388 -39.539 632 HE3 TRP 115 HE3 TRP 115 -8.736 21.205 -37.219 633 HZ2 TRP 115 HZ2 TRP 115 -10.400 18.913 -41.302 634 HZ3 TRP 115 HZ3 TRP 115 -7.374 21.201 -39.288 635 HH2 TRP 115 HH2 TRP 115 -8.199 20.058 -41.328 636 H SER 116 HN SER 116 -15.118 21.175 -35.946 637 HA SER 116 HA SER 116 -15.113 21.117 -38.710 638 HB2 SER 116 HB2 SER 116 -17.150 20.803 -37.427 639 HB3 SER 116 HB1 SER 116 -17.087 22.469 -36.859 640 HG SER 116 HG SER 116 -18.473 22.296 -38.637 641 H LYS 117 HN LYS 117 -15.275 22.705 -40.340 642 HA LYS 117 HA LYS 117 -13.545 24.750 -40.449 643 HB2 LYS 117 HB2 LYS 117 -15.022 24.059 -42.324 644 HB3 LYS 117 HB1 LYS 117 -16.357 24.921 -41.559 645 HG2 LYS 117 HG2 LYS 117 -15.121 27.030 -41.714 646 HG3 LYS 117 HG1 LYS 117 -13.741 26.188 -42.423 647 HD2 LYS 117 HD2 LYS 117 -15.161 25.488 -44.330 648 HD3 LYS 117 HD1 LYS 117 -16.519 26.370 -43.629 649 HE2 LYS 117 HE2 LYS 117 -13.868 27.627 -44.388 650 HE3 LYS 117 HE1 LYS 117 -15.321 27.681 -45.387 651 HZ1 LYS 117 HZ1 LYS 117 -16.476 28.802 -43.595 652 HZ2 LYS 117 HZ2 LYS 117 -15.087 29.673 -44.036 653 HZ3 LYS 117 HZ3 LYS 117 -15.090 28.735 -42.620 654 H ILE 118 HN ILE 118 -13.174 26.026 -38.719 655 HA ILE 118 HA ILE 118 -15.366 27.815 -37.869 656 HB ILE 118 HB ILE 118 -14.369 27.828 -35.611 657 HG12 ILE 118 HG12 ILE 118 -12.633 25.571 -36.656 658 HG13 ILE 118 HG11 ILE 118 -12.058 27.220 -36.397 659 HG21 ILE 118 HG21 ILE 118 -14.676 24.990 -35.713 660 HG22 ILE 118 HG22 ILE 118 -15.785 25.699 -36.886 661 HG23 ILE 118 HG23 ILE 118 -15.854 26.195 -35.196 662 HD11 ILE 118 HD1 ILE 118 -12.905 26.995 -33.999 663 HD12 ILE 118 HD2 ILE 118 -11.497 26.017 -34.411 664 HD13 ILE 118 HD3 ILE 118 -13.094 25.273 -34.327 665 H VAL 119 HN VAL 119 -13.034 27.980 -39.842 666 HA VAL 119 HA VAL 119 -11.481 29.544 -40.510 667 HB VAL 119 HB VAL 119 -12.274 31.795 -38.934 668 HG11 VAL 119 HG11 VAL 119 -11.750 31.126 -41.587 669 HG12 VAL 119 HG12 VAL 119 -12.233 32.714 -40.993 670 HG13 VAL 119 HG13 VAL 119 -13.452 31.590 -41.596 671 HG21 VAL 119 HG21 VAL 119 -14.321 30.760 -38.304 672 HG22 VAL 119 HG22 VAL 119 -14.514 29.998 -39.882 673 HG23 VAL 119 HG23 VAL 119 -14.733 31.739 -39.710 674 H VAL 120 HN VAL 120 -10.916 27.940 -38.107 675 HA VAL 120 HA VAL 120 -9.654 29.519 -36.122 676 HB VAL 120 HB VAL 120 -10.279 27.104 -35.850 677 HG11 VAL 120 HG11 VAL 120 -8.808 25.403 -36.782 678 HG12 VAL 120 HG12 VAL 120 -7.797 26.642 -37.527 679 HG13 VAL 120 HG13 VAL 120 -9.448 26.394 -38.094 680 HG21 VAL 120 HG21 VAL 120 -7.565 26.736 -35.150 681 HG22 VAL 120 HG22 VAL 120 -8.861 27.335 -34.113 682 HG23 VAL 120 HG23 VAL 120 -7.866 28.470 -35.026 683 H LEU 121 HN LEU 121 -8.686 28.334 -39.244 684 HA LEU 121 HA LEU 121 -5.895 29.079 -38.864 685 HB2 LEU 121 HB2 LEU 121 -7.388 28.017 -41.273 686 HB3 LEU 121 HB1 LEU 121 -5.652 28.301 -41.206 687 HG LEU 121 HG LEU 121 -7.155 26.450 -39.336 688 HD11 LEU 121 HD11 LEU 121 -7.175 25.509 -41.574 689 HD12 LEU 121 HD12 LEU 121 -5.954 24.657 -40.628 690 HD13 LEU 121 HD13 LEU 121 -5.466 25.888 -41.791 691 HD21 LEU 121 HD21 LEU 121 -5.119 27.384 -38.352 692 HD22 LEU 121 HD22 LEU 121 -4.201 26.974 -39.801 693 HD23 LEU 121 HD23 LEU 121 -4.842 25.694 -38.771 694 H GLU 122 HN GLU 122 -8.680 30.723 -39.439 695 HA GLU 122 HA GLU 122 -8.099 32.414 -41.611 696 HB2 GLU 122 HB2 GLU 122 -10.321 32.257 -40.529 697 HB3 GLU 122 HB1 GLU 122 -9.665 33.052 -39.098 698 HG2 GLU 122 HG2 GLU 122 -9.091 35.029 -40.452 699 HG3 GLU 122 HG1 GLU 122 -9.742 34.236 -41.886 700 H HIS 123 HN HIS 123 -7.388 32.738 -38.142 701 HA HIS 123 HA HIS 123 -5.993 34.166 -36.997 702 HB2 HIS 123 HB2 HIS 123 -4.477 33.923 -39.606 703 HB3 HIS 123 HB1 HIS 123 -3.817 34.629 -38.130 704 HD2 HIS 123 HD2 HIS 123 -3.013 32.765 -36.189 705 HE1 HIS 123 HE1 HIS 123 -4.274 29.306 -38.256 706 HE2 HIS 123 HE2 HIS 123 -2.998 30.154 -36.231 707 H HIS 124 HN HIS 124 -8.197 35.413 -38.255 708 HA HIS 124 HA HIS 124 -7.037 38.074 -38.807 709 HB2 HIS 124 HB2 HIS 124 -9.447 36.837 -40.163 710 HB3 HIS 124 HB1 HIS 124 -8.907 38.503 -40.373 711 HD2 HIS 124 HD2 HIS 124 -8.443 35.297 -42.220 712 HE1 HIS 124 HE1 HIS 124 -4.816 37.370 -42.822 713 HE2 HIS 124 HE2 HIS 124 -6.237 35.419 -43.611 714 H HIS 125 HN HIS 125 -7.986 39.781 -37.796 715 HA HIS 125 HA HIS 125 -9.544 39.283 -35.480 716 HB2 HIS 125 HB2 HIS 125 -8.927 41.850 -36.958 717 HB3 HIS 125 HB1 HIS 125 -9.743 41.781 -35.396 718 HD2 HIS 125 HD2 HIS 125 -6.164 41.813 -36.756 719 HE1 HIS 125 HE1 HIS 125 -5.889 40.450 -32.769 720 HE2 HIS 125 HE2 HIS 125 -4.558 41.276 -34.768 721 H HIS 126 HN HIS 126 -10.345 40.480 -38.711 722 HA HIS 126 HA HIS 126 -13.035 39.551 -38.533 723 HB2 HIS 126 HB2 HIS 126 -14.074 41.851 -38.772 724 HB3 HIS 126 HB1 HIS 126 -13.456 41.463 -37.167 725 HD2 HIS 126 HD2 HIS 126 -11.362 43.104 -36.289 726 HE1 HIS 126 HE1 HIS 126 -10.921 45.331 -39.848 727 HE2 HIS 126 HE2 HIS 126 -10.188 45.141 -37.424 728 H HIS 127 HN HIS 127 -12.433 38.578 -40.494 729 HA HIS 127 HA HIS 127 -11.339 39.916 -42.713 730 HB2 HIS 127 HB2 HIS 127 -11.399 37.467 -42.532 731 HB3 HIS 127 HB1 HIS 127 -13.158 37.495 -42.661 732 HD2 HIS 127 HD2 HIS 127 -14.063 37.410 -45.278 733 HE1 HIS 127 HE1 HIS 127 -10.450 38.488 -47.179 734 HE2 HIS 127 HE2 HIS 127 -12.850 37.751 -47.566 735 H HIS 128 HN HIS 128 -14.718 39.249 -41.828 736 HA HIS 128 HA HIS 128 -15.846 40.489 -44.133 737 HB2 HIS 128 HB2 HIS 128 -17.131 38.874 -42.855 738 HB3 HIS 128 HB1 HIS 128 -17.036 39.887 -41.415 739 HD2 HIS 128 HD2 HIS 128 -19.084 41.746 -41.228 740 HE1 HIS 128 HE1 HIS 128 -20.457 41.500 -45.212 741 HE2 HIS 128 HE2 HIS 128 -20.896 42.533 -42.935 Start of MODEL 20 1 H1 MET 36 HT1 MET 36 -28.979 2.414 -9.826 2 H2 MET 36 HT2 MET 36 -30.323 2.818 -8.867 3 H3 MET 36 HT3 MET 36 -30.196 1.266 -9.547 4 HA MET 36 HA MET 36 -29.475 1.903 -7.034 5 HB2 MET 36 HB2 MET 36 -28.794 -0.323 -6.928 6 HB3 MET 36 HB1 MET 36 -29.753 -0.345 -8.406 7 HG2 MET 36 HG2 MET 36 -26.742 0.005 -8.275 8 HG3 MET 36 HG1 MET 36 -27.583 -1.469 -8.756 9 HE1 MET 36 HE1 MET 36 -29.519 -0.440 -11.915 10 HE2 MET 36 HE2 MET 36 -30.029 -0.522 -10.230 11 HE3 MET 36 HE3 MET 36 -28.981 -1.777 -10.888 12 HA PRO 37 HA PRO 37 -25.314 3.325 -6.633 13 HB2 PRO 37 HB2 PRO 37 -24.199 0.672 -5.888 14 HB3 PRO 37 HB1 PRO 37 -24.216 2.190 -4.966 15 HG2 PRO 37 HG2 PRO 37 -25.796 0.162 -4.300 16 HG3 PRO 37 HG1 PRO 37 -26.351 1.841 -4.176 17 HD2 PRO 37 HD2 PRO 37 -26.995 -0.206 -6.278 18 HD3 PRO 37 HD1 PRO 37 -28.055 1.006 -5.522 19 H VAL 38 HN VAL 38 -23.369 3.585 -7.781 20 HA VAL 38 HA VAL 38 -22.853 1.629 -9.932 21 HB VAL 38 HB VAL 38 -23.905 3.530 -10.976 22 HG11 VAL 38 HG11 VAL 38 -22.229 5.709 -10.514 23 HG12 VAL 38 HG12 VAL 38 -22.405 4.970 -8.923 24 HG13 VAL 38 HG13 VAL 38 -23.835 5.474 -9.823 25 HG21 VAL 38 HG21 VAL 38 -22.310 3.871 -12.615 26 HG22 VAL 38 HG22 VAL 38 -21.512 2.562 -11.744 27 HG23 VAL 38 HG23 VAL 38 -21.040 4.234 -11.447 28 H THR 39 HN THR 39 -20.771 1.065 -10.220 29 HA THR 39 HA THR 39 -18.799 2.239 -8.374 30 HB THR 39 HB THR 39 -18.730 -0.387 -9.884 31 HG1 THR 39 HG1 THR 39 -18.896 -0.071 -7.104 32 HG21 THR 39 HG21 THR 39 -16.920 -0.627 -7.917 33 HG22 THR 39 HG22 THR 39 -16.811 1.114 -8.182 34 HG23 THR 39 HG23 THR 39 -16.498 -0.003 -9.512 35 H GLU 40 HN GLU 40 -17.021 3.277 -9.108 36 HA GLU 40 HA GLU 40 -16.918 4.285 -11.718 37 HB2 GLU 40 HB2 GLU 40 -15.768 5.311 -9.773 38 HB3 GLU 40 HB1 GLU 40 -14.636 3.961 -9.756 39 HG2 GLU 40 HG2 GLU 40 -13.898 4.527 -12.031 40 HG3 GLU 40 HG1 GLU 40 -15.050 5.859 -12.080 41 H GLN 41 HN GLN 41 -15.143 1.569 -10.228 42 HA GLN 41 HA GLN 41 -13.605 0.939 -12.531 43 HB2 GLN 41 HB2 GLN 41 -14.457 -0.745 -10.169 44 HB3 GLN 41 HB1 GLN 41 -13.297 -1.271 -11.390 45 HG2 GLN 41 HG2 GLN 41 -13.022 1.186 -9.635 46 HG3 GLN 41 HG1 GLN 41 -12.137 -0.325 -9.431 47 HE21 GLN 41 HE21 GLN 41 -11.546 2.677 -10.466 48 HE22 GLN 41 HE22 GLN 41 -10.491 2.373 -11.761 49 H GLY 42 HN GLY 42 -16.711 -0.224 -11.304 50 HA2 GLY 42 HA2 GLY 42 -17.154 -2.224 -13.266 51 HA3 GLY 42 HA1 GLY 42 -18.393 -1.474 -12.260 52 H LEU 43 HN LEU 43 -17.837 1.216 -13.127 53 HA LEU 43 HA LEU 43 -19.607 1.414 -15.299 54 HB2 LEU 43 HB2 LEU 43 -19.215 3.247 -13.686 55 HB3 LEU 43 HB1 LEU 43 -17.583 3.448 -14.328 56 HG LEU 43 HG LEU 43 -18.484 3.969 -16.537 57 HD11 LEU 43 HD11 LEU 43 -20.926 4.222 -16.836 58 HD12 LEU 43 HD12 LEU 43 -21.176 3.615 -15.199 59 HD13 LEU 43 HD13 LEU 43 -20.485 2.562 -16.435 60 HD21 LEU 43 HD21 LEU 43 -18.481 6.087 -15.750 61 HD22 LEU 43 HD22 LEU 43 -18.944 5.528 -14.143 62 HD23 LEU 43 HD23 LEU 43 -20.185 5.882 -15.345 63 H ARG 44 HN ARG 44 -16.075 1.481 -15.177 64 HA ARG 44 HA ARG 44 -15.600 2.168 -17.853 65 HB2 ARG 44 HB2 ARG 44 -13.855 2.107 -16.092 66 HB3 ARG 44 HB1 ARG 44 -13.961 0.346 -16.068 67 HG2 ARG 44 HG2 ARG 44 -13.312 0.261 -18.440 68 HG3 ARG 44 HG1 ARG 44 -13.221 2.022 -18.486 69 HD2 ARG 44 HD2 ARG 44 -10.980 1.128 -18.178 70 HD3 ARG 44 HD1 ARG 44 -11.482 1.936 -16.696 71 HE ARG 44 HE ARG 44 -11.515 -0.139 -15.623 72 HH11 ARG 44 HH11 ARG 44 -11.196 -0.463 -19.053 73 HH12 ARG 44 HH12 ARG 44 -10.825 -2.154 -18.999 74 HH21 ARG 44 HH21 ARG 44 -11.027 -2.358 -15.543 75 HH22 ARG 44 HH22 ARG 44 -10.729 -3.227 -17.012 76 H GLU 45 HN GLU 45 -16.095 -0.986 -16.310 77 HA GLU 45 HA GLU 45 -15.670 -2.547 -18.634 78 HB2 GLU 45 HB2 GLU 45 -17.210 -3.105 -16.089 79 HB3 GLU 45 HB1 GLU 45 -16.938 -4.308 -17.351 80 HG2 GLU 45 HG2 GLU 45 -14.769 -2.808 -15.853 81 HG3 GLU 45 HG1 GLU 45 -15.232 -4.487 -15.576 82 H ARG 46 HN ARG 46 -18.556 -1.095 -17.198 83 HA ARG 46 HA ARG 46 -20.444 -2.280 -18.938 84 HB2 ARG 46 HB2 ARG 46 -21.099 -1.243 -16.812 85 HB3 ARG 46 HB1 ARG 46 -20.594 0.337 -17.410 86 HG2 ARG 46 HG2 ARG 46 -22.994 0.157 -17.703 87 HG3 ARG 46 HG1 ARG 46 -22.240 0.065 -19.297 88 HD2 ARG 46 HD2 ARG 46 -23.935 -1.673 -19.125 89 HD3 ARG 46 HD1 ARG 46 -22.343 -2.426 -19.155 90 HE ARG 46 HE ARG 46 -23.204 -1.938 -16.472 91 HH11 ARG 46 HH11 ARG 46 -23.629 -3.986 -19.228 92 HH12 ARG 46 HH12 ARG 46 -24.114 -5.365 -18.302 93 HH21 ARG 46 HH21 ARG 46 -23.839 -3.743 -15.250 94 HH22 ARG 46 HH22 ARG 46 -24.233 -5.229 -16.048 95 H ILE 47 HN ILE 47 -18.679 0.787 -19.013 96 HA ILE 47 HA ILE 47 -19.889 1.793 -21.346 97 HB ILE 47 HB ILE 47 -17.187 2.338 -20.104 98 HG12 ILE 47 HG12 ILE 47 -19.205 2.938 -18.798 99 HG13 ILE 47 HG11 ILE 47 -18.284 4.356 -19.301 100 HG21 ILE 47 HG21 ILE 47 -18.625 3.628 -22.432 101 HG22 ILE 47 HG22 ILE 47 -16.988 2.973 -22.404 102 HG23 ILE 47 HG23 ILE 47 -17.361 4.454 -21.520 103 HD11 ILE 47 HD1 ILE 47 -20.089 3.858 -21.403 104 HD12 ILE 47 HD2 ILE 47 -20.183 5.162 -20.219 105 HD13 ILE 47 HD3 ILE 47 -21.026 3.641 -19.924 106 H GLU 48 HN GLU 48 -16.956 -0.104 -20.814 107 HA GLU 48 HA GLU 48 -16.086 -0.173 -23.497 108 HB2 GLU 48 HB2 GLU 48 -14.660 -0.782 -21.573 109 HB3 GLU 48 HB1 GLU 48 -15.640 -2.229 -21.310 110 HG2 GLU 48 HG2 GLU 48 -15.050 -3.027 -23.599 111 HG3 GLU 48 HG1 GLU 48 -14.099 -1.567 -23.852 112 H SER 49 HN SER 49 -18.236 -2.248 -21.610 113 HA SER 49 HA SER 49 -18.680 -4.047 -23.845 114 HB2 SER 49 HB2 SER 49 -19.968 -3.878 -21.110 115 HB3 SER 49 HB1 SER 49 -20.308 -5.130 -22.301 116 HG SER 49 HG SER 49 -18.068 -4.706 -20.715 117 H ALA 50 HN ALA 50 -19.904 -1.048 -22.751 118 HA ALA 50 HA ALA 50 -22.536 -1.479 -23.977 119 HB1 ALA 50 HB1 ALA 50 -22.929 0.889 -23.195 120 HB2 ALA 50 HB2 ALA 50 -21.316 0.853 -22.481 121 HB3 ALA 50 HB3 ALA 50 -22.561 -0.254 -21.901 122 H ILE 51 HN ILE 51 -19.444 -0.517 -24.885 123 HA ILE 51 HA ILE 51 -20.404 0.392 -27.468 124 HB ILE 51 HB ILE 51 -19.888 2.604 -27.341 125 HG12 ILE 51 HG12 ILE 51 -17.627 1.993 -25.392 126 HG13 ILE 51 HG11 ILE 51 -17.432 2.059 -27.147 127 HG21 ILE 51 HG21 ILE 51 -19.867 2.010 -24.369 128 HG22 ILE 51 HG22 ILE 51 -21.312 2.238 -25.353 129 HG23 ILE 51 HG23 ILE 51 -20.190 3.577 -25.113 130 HD11 ILE 51 HD1 ILE 51 -17.135 4.199 -25.464 131 HD12 ILE 51 HD2 ILE 51 -18.804 4.396 -26.003 132 HD13 ILE 51 HD3 ILE 51 -17.498 4.315 -27.186 133 HA PRO 52 HA PRO 52 -16.640 -1.300 -28.966 134 HB2 PRO 52 HB2 PRO 52 -15.589 0.725 -30.549 135 HB3 PRO 52 HB1 PRO 52 -16.899 -0.361 -31.048 136 HG2 PRO 52 HG2 PRO 52 -17.042 2.423 -30.002 137 HG3 PRO 52 HG1 PRO 52 -17.994 1.642 -31.277 138 HD2 PRO 52 HD2 PRO 52 -18.992 2.035 -28.801 139 HD3 PRO 52 HD1 PRO 52 -19.423 0.608 -29.770 140 H GLN 53 HN GLN 53 -14.438 -1.437 -28.513 141 HA GLN 53 HA GLN 53 -13.409 -0.352 -26.219 142 HB2 GLN 53 HB2 GLN 53 -11.180 -0.963 -27.075 143 HB3 GLN 53 HB1 GLN 53 -12.369 -2.228 -27.403 144 HG2 GLN 53 HG2 GLN 53 -12.671 -1.309 -29.699 145 HG3 GLN 53 HG1 GLN 53 -11.428 -0.107 -29.361 146 HE21 GLN 53 HE21 GLN 53 -9.390 -0.708 -30.090 147 HE22 GLN 53 HE22 GLN 53 -8.851 -2.310 -30.262 148 H VAL 54 HN VAL 54 -14.025 1.305 -29.101 149 HA VAL 54 HA VAL 54 -13.404 3.362 -29.921 150 HB VAL 54 HB VAL 54 -13.495 5.139 -28.232 151 HG11 VAL 54 HG11 VAL 54 -15.492 3.309 -28.831 152 HG12 VAL 54 HG12 VAL 54 -15.728 4.852 -28.013 153 HG13 VAL 54 HG13 VAL 54 -15.525 3.377 -27.069 154 HG21 VAL 54 HG21 VAL 54 -12.105 3.923 -26.535 155 HG22 VAL 54 HG22 VAL 54 -13.486 2.876 -26.210 156 HG23 VAL 54 HG23 VAL 54 -13.586 4.600 -25.856 157 H TYR 55 HN TYR 55 -11.805 5.276 -29.435 158 HA TYR 55 HA TYR 55 -9.197 4.238 -29.888 159 HB2 TYR 55 HB2 TYR 55 -10.211 7.022 -29.312 160 HB3 TYR 55 HB1 TYR 55 -8.498 6.678 -29.561 161 HD1 TYR 55 HD1 TYR 55 -10.052 4.235 -31.413 162 HD2 TYR 55 HD2 TYR 55 -9.429 8.485 -31.470 163 HE1 TYR 55 HE1 TYR 55 -10.411 4.252 -33.863 164 HE2 TYR 55 HE2 TYR 55 -9.786 8.500 -33.924 165 HH TYR 55 HH TYR 55 -9.668 5.802 -35.813 166 H HIS 56 HN HIS 56 -10.704 5.730 -27.051 167 HA HIS 56 HA HIS 56 -9.094 4.262 -25.235 168 HB2 HIS 56 HB2 HIS 56 -7.348 5.818 -25.964 169 HB3 HIS 56 HB1 HIS 56 -8.387 7.187 -25.562 170 HD2 HIS 56 HD2 HIS 56 -8.143 8.010 -22.932 171 HE1 HIS 56 HE1 HIS 56 -6.241 4.562 -21.410 172 HE2 HIS 56 HE2 HIS 56 -7.028 6.908 -20.843 173 H ILE 57 HN ILE 57 -9.952 4.331 -23.190 174 HA ILE 57 HA ILE 57 -12.003 6.387 -22.652 175 HB ILE 57 HB ILE 57 -13.127 4.287 -23.338 176 HG12 ILE 57 HG12 ILE 57 -13.393 4.715 -20.355 177 HG13 ILE 57 HG11 ILE 57 -14.030 5.847 -21.550 178 HG21 ILE 57 HG21 ILE 57 -12.506 2.255 -22.558 179 HG22 ILE 57 HG22 ILE 57 -12.375 2.838 -20.898 180 HG23 ILE 57 HG23 ILE 57 -11.034 3.063 -22.021 181 HD11 ILE 57 HD1 ILE 57 -15.588 3.945 -20.639 182 HD12 ILE 57 HD2 ILE 57 -14.696 2.926 -21.768 183 HD13 ILE 57 HD3 ILE 57 -15.598 4.319 -22.362 184 H ILE 58 HN ILE 58 -11.820 7.315 -20.700 185 HA ILE 58 HA ILE 58 -10.289 5.920 -18.600 186 HB ILE 58 HB ILE 58 -8.959 7.710 -19.944 187 HG12 ILE 58 HG12 ILE 58 -8.285 6.672 -17.768 188 HG13 ILE 58 HG11 ILE 58 -7.772 8.354 -17.910 189 HG21 ILE 58 HG21 ILE 58 -10.817 9.386 -19.855 190 HG22 ILE 58 HG22 ILE 58 -9.306 10.000 -19.182 191 HG23 ILE 58 HG23 ILE 58 -10.602 9.478 -18.106 192 HD11 ILE 58 HD1 ILE 58 -8.788 8.664 -15.912 193 HD12 ILE 58 HD2 ILE 58 -9.658 7.135 -16.026 194 HD13 ILE 58 HD3 ILE 58 -10.301 8.578 -16.812 195 H VAL 59 HN VAL 59 -11.061 6.195 -16.554 196 HA VAL 59 HA VAL 59 -13.402 7.979 -16.252 197 HB VAL 59 HB VAL 59 -12.842 5.331 -14.894 198 HG11 VAL 59 HG11 VAL 59 -15.168 5.671 -13.999 199 HG12 VAL 59 HG12 VAL 59 -15.116 7.317 -14.629 200 HG13 VAL 59 HG13 VAL 59 -13.991 6.820 -13.366 201 HG21 VAL 59 HG21 VAL 59 -14.378 6.173 -17.281 202 HG22 VAL 59 HG22 VAL 59 -15.247 5.113 -16.170 203 HG23 VAL 59 HG23 VAL 59 -13.715 4.591 -16.870 204 H THR 60 HN THR 60 -13.238 9.524 -14.759 205 HA THR 60 HA THR 60 -11.165 9.246 -12.667 206 HB THR 60 HB THR 60 -11.988 11.770 -14.125 207 HG1 THR 60 HG1 THR 60 -10.642 10.392 -15.331 208 HG21 THR 60 HG21 THR 60 -10.143 12.793 -12.826 209 HG22 THR 60 HG22 THR 60 -9.923 11.271 -11.961 210 HG23 THR 60 HG23 THR 60 -11.420 12.184 -11.773 211 H ASP 61 HN ASP 61 -11.860 9.476 -10.635 212 HA ASP 61 HA ASP 61 -14.670 10.063 -10.159 213 HB2 ASP 61 HB2 ASP 61 -13.562 8.193 -8.982 214 HB3 ASP 61 HB1 ASP 61 -12.461 9.340 -8.218 215 H LEU 62 HN LEU 62 -15.296 12.112 -9.994 216 HA LEU 62 HA LEU 62 -13.483 14.045 -8.680 217 HB2 LEU 62 HB2 LEU 62 -14.234 15.715 -10.105 218 HB3 LEU 62 HB1 LEU 62 -14.265 14.313 -11.175 219 HG LEU 62 HG LEU 62 -16.745 14.241 -9.893 220 HD11 LEU 62 HD11 LEU 62 -15.831 17.061 -10.424 221 HD12 LEU 62 HD12 LEU 62 -16.702 16.426 -9.029 222 HD13 LEU 62 HD13 LEU 62 -17.535 16.629 -10.570 223 HD21 LEU 62 HD21 LEU 62 -15.880 13.972 -12.383 224 HD22 LEU 62 HD22 LEU 62 -16.417 15.647 -12.520 225 HD23 LEU 62 HD23 LEU 62 -17.563 14.386 -12.061 226 H SER 63 HN SER 63 -14.649 15.851 -7.562 227 HA SER 63 HA SER 63 -16.211 16.655 -6.069 228 HB2 SER 63 HB2 SER 63 -17.921 15.915 -7.724 229 HB3 SER 63 HB1 SER 63 -17.942 14.333 -6.954 230 HG SER 63 HG SER 63 -19.362 16.386 -6.287 231 H TYR 64 HN TYR 64 -17.693 13.651 -5.432 232 HA TYR 64 HA TYR 64 -15.966 13.263 -3.063 233 HB2 TYR 64 HB2 TYR 64 -18.942 12.764 -3.323 234 HB3 TYR 64 HB1 TYR 64 -17.966 12.440 -1.890 235 HD1 TYR 64 HD1 TYR 64 -19.536 15.026 -3.957 236 HD2 TYR 64 HD2 TYR 64 -16.977 14.289 -0.587 237 HE1 TYR 64 HE1 TYR 64 -19.810 17.383 -3.235 238 HE2 TYR 64 HE2 TYR 64 -17.251 16.646 0.136 239 HH TYR 64 HH TYR 64 -19.609 18.595 -0.810 240 H GLY 65 HN GLY 65 -17.460 10.860 -2.348 241 HA2 GLY 65 HA2 GLY 65 -15.923 8.955 -3.842 242 HA3 GLY 65 HA1 GLY 65 -17.088 8.592 -2.570 243 H CYS 66 HN CYS 66 -17.520 6.785 -4.176 244 HA CYS 66 HA CYS 66 -18.672 7.177 -6.681 245 HB2 CYS 66 HB2 CYS 66 -19.561 4.945 -6.468 246 HB3 CYS 66 HB1 CYS 66 -17.976 4.974 -5.692 247 HG CYS 66 HG CYS 66 -19.585 3.859 -3.984 248 H GLY 67 HN GLY 67 -20.922 6.994 -7.338 249 HA2 GLY 67 HA2 GLY 67 -23.217 7.350 -7.122 250 HA3 GLY 67 HA1 GLY 67 -22.995 7.557 -5.386 251 H GLN 68 HN GLN 68 -20.724 9.411 -6.939 252 HA GLN 68 HA GLN 68 -22.451 11.811 -6.822 253 HB2 GLN 68 HB2 GLN 68 -19.707 11.277 -5.816 254 HB3 GLN 68 HB1 GLN 68 -20.007 12.870 -6.513 255 HG2 GLN 68 HG2 GLN 68 -20.536 13.076 -4.196 256 HG3 GLN 68 HG1 GLN 68 -22.084 12.976 -5.032 257 HE21 GLN 68 HE21 GLN 68 -23.464 11.724 -3.770 258 HE22 GLN 68 HE22 GLN 68 -23.031 10.270 -3.008 259 H SER 69 HN SER 69 -20.644 13.612 -7.929 260 HA SER 69 HA SER 69 -21.080 13.224 -10.697 261 HB2 SER 69 HB2 SER 69 -20.875 15.459 -9.748 262 HB3 SER 69 HB1 SER 69 -19.221 15.122 -9.247 263 HG SER 69 HG SER 69 -20.266 15.293 -11.878 264 H PHE 70 HN PHE 70 -19.776 12.499 -12.319 265 HA PHE 70 HA PHE 70 -17.076 11.555 -11.576 266 HB2 PHE 70 HB2 PHE 70 -19.113 10.117 -13.293 267 HB3 PHE 70 HB1 PHE 70 -17.436 9.610 -13.078 268 HD1 PHE 70 HD1 PHE 70 -20.771 9.590 -11.675 269 HD2 PHE 70 HD2 PHE 70 -16.611 9.078 -10.734 270 HE1 PHE 70 HE1 PHE 70 -21.388 8.423 -9.576 271 HE2 PHE 70 HE2 PHE 70 -17.230 7.912 -8.635 272 HZ PHE 70 HZ PHE 70 -19.619 7.583 -8.058 273 H ASP 71 HN ASP 71 -15.479 11.901 -13.054 274 HA ASP 71 HA ASP 71 -16.257 13.324 -15.528 275 HB2 ASP 71 HB2 ASP 71 -15.087 14.780 -13.924 276 HB3 ASP 71 HB1 ASP 71 -13.731 13.653 -13.887 277 H ILE 72 HN ILE 72 -16.065 11.939 -17.187 278 HA ILE 72 HA ILE 72 -13.590 10.318 -17.361 279 HB ILE 72 HB ILE 72 -14.904 8.551 -18.451 280 HG12 ILE 72 HG12 ILE 72 -17.334 10.228 -17.747 281 HG13 ILE 72 HG11 ILE 72 -16.635 10.158 -19.367 282 HG21 ILE 72 HG21 ILE 72 -16.616 8.925 -16.099 283 HG22 ILE 72 HG22 ILE 72 -14.906 9.180 -15.748 284 HG23 ILE 72 HG23 ILE 72 -15.447 7.651 -16.441 285 HD11 ILE 72 HD1 ILE 72 -16.866 7.482 -18.648 286 HD12 ILE 72 HD2 ILE 72 -17.965 8.362 -19.711 287 HD13 ILE 72 HD3 ILE 72 -18.332 8.211 -17.993 288 H VAL 73 HN VAL 73 -12.730 9.999 -19.410 289 HA VAL 73 HA VAL 73 -13.839 11.737 -21.525 290 HB VAL 73 HB VAL 73 -10.939 11.383 -20.734 291 HG11 VAL 73 HG11 VAL 73 -11.016 11.439 -23.117 292 HG12 VAL 73 HG12 VAL 73 -10.611 13.076 -22.601 293 HG13 VAL 73 HG13 VAL 73 -12.255 12.693 -23.113 294 HG21 VAL 73 HG21 VAL 73 -11.407 13.183 -19.449 295 HG22 VAL 73 HG22 VAL 73 -13.020 13.336 -20.144 296 HG23 VAL 73 HG23 VAL 73 -11.639 14.086 -20.946 297 H VAL 74 HN VAL 74 -14.108 10.781 -23.448 298 HA VAL 74 HA VAL 74 -12.606 8.316 -24.041 299 HB VAL 74 HB VAL 74 -14.791 7.616 -23.177 300 HG11 VAL 74 HG11 VAL 74 -15.663 9.846 -24.871 301 HG12 VAL 74 HG12 VAL 74 -16.480 9.090 -23.503 302 HG13 VAL 74 HG13 VAL 74 -16.618 8.384 -25.114 303 HG21 VAL 74 HG21 VAL 74 -15.242 7.203 -26.067 304 HG22 VAL 74 HG22 VAL 74 -15.004 6.014 -24.787 305 HG23 VAL 74 HG23 VAL 74 -13.612 6.810 -25.520 306 H VAL 75 HN VAL 75 -12.060 8.041 -26.169 307 HA VAL 75 HA VAL 75 -12.974 10.140 -28.045 308 HB VAL 75 HB VAL 75 -10.230 8.902 -27.746 309 HG11 VAL 75 HG11 VAL 75 -9.812 9.385 -29.905 310 HG12 VAL 75 HG12 VAL 75 -10.400 11.033 -29.683 311 HG13 VAL 75 HG13 VAL 75 -11.525 9.746 -30.118 312 HG21 VAL 75 HG21 VAL 75 -11.483 11.571 -27.206 313 HG22 VAL 75 HG22 VAL 75 -9.799 11.525 -27.731 314 HG23 VAL 75 HG23 VAL 75 -10.288 10.687 -26.258 315 H SER 76 HN SER 76 -13.987 9.393 -29.806 316 HA SER 76 HA SER 76 -13.167 6.905 -31.047 317 HB2 SER 76 HB2 SER 76 -15.317 5.797 -30.865 318 HB3 SER 76 HB1 SER 76 -14.723 6.160 -29.246 319 HG SER 76 HG SER 76 -16.686 6.991 -29.137 320 H ASP 77 HN ASP 77 -14.652 6.455 -32.980 321 HA ASP 77 HA ASP 77 -14.640 8.695 -34.674 322 HB2 ASP 77 HB2 ASP 77 -16.011 6.020 -34.878 323 HB3 ASP 77 HB1 ASP 77 -16.108 7.243 -36.143 324 H PHE 78 HN PHE 78 -16.657 8.096 -32.140 325 HA PHE 78 HA PHE 78 -19.227 8.736 -33.042 326 HB2 PHE 78 HB2 PHE 78 -17.769 8.925 -30.448 327 HB3 PHE 78 HB1 PHE 78 -19.297 9.788 -30.593 328 HD1 PHE 78 HD1 PHE 78 -17.683 6.457 -30.937 329 HD2 PHE 78 HD2 PHE 78 -21.388 8.608 -30.606 330 HE1 PHE 78 HE1 PHE 78 -18.900 4.317 -30.634 331 HE2 PHE 78 HE2 PHE 78 -22.604 6.468 -30.303 332 HZ PHE 78 HZ PHE 78 -21.360 4.322 -30.318 333 H PHE 79 HN PHE 79 -16.470 10.764 -32.287 334 HA PHE 79 HA PHE 79 -18.023 13.210 -32.633 335 HB2 PHE 79 HB2 PHE 79 -16.161 12.935 -30.931 336 HB3 PHE 79 HB1 PHE 79 -15.034 13.009 -32.288 337 HD1 PHE 79 HD1 PHE 79 -14.592 15.075 -30.426 338 HD2 PHE 79 HD2 PHE 79 -17.649 14.895 -33.441 339 HE1 PHE 79 HE1 PHE 79 -14.737 17.552 -30.434 340 HE2 PHE 79 HE2 PHE 79 -17.794 17.366 -33.444 341 HZ PHE 79 HZ PHE 79 -16.340 18.696 -31.942 342 H GLN 80 HN GLN 80 -17.406 11.163 -34.827 343 HA GLN 80 HA GLN 80 -15.959 12.893 -36.711 344 HB2 GLN 80 HB2 GLN 80 -16.910 10.029 -36.964 345 HB3 GLN 80 HB1 GLN 80 -15.988 10.904 -38.186 346 HG2 GLN 80 HG2 GLN 80 -15.066 10.376 -35.347 347 HG3 GLN 80 HG1 GLN 80 -14.518 9.495 -36.774 348 HE21 GLN 80 HE21 GLN 80 -13.568 11.937 -34.745 349 HE22 GLN 80 HE22 GLN 80 -12.613 12.840 -35.819 350 H GLY 81 HN GLY 81 -17.423 14.461 -37.285 351 HA2 GLY 81 HA2 GLY 81 -19.043 15.321 -38.708 352 HA3 GLY 81 HA1 GLY 81 -19.496 13.673 -39.136 353 H LYS 82 HN LYS 82 -19.325 14.218 -35.785 354 HA LYS 82 HA LYS 82 -22.258 14.591 -35.643 355 HB2 LYS 82 HB2 LYS 82 -20.501 12.887 -33.864 356 HB3 LYS 82 HB1 LYS 82 -22.227 13.160 -33.630 357 HG2 LYS 82 HG2 LYS 82 -21.027 11.960 -36.141 358 HG3 LYS 82 HG1 LYS 82 -21.708 11.009 -34.820 359 HD2 LYS 82 HD2 LYS 82 -23.876 12.163 -35.113 360 HD3 LYS 82 HD1 LYS 82 -23.194 13.090 -36.451 361 HE2 LYS 82 HE2 LYS 82 -24.439 11.184 -37.335 362 HE3 LYS 82 HE1 LYS 82 -22.718 10.957 -37.646 363 HZ1 LYS 82 HZ1 LYS 82 -23.246 9.892 -35.138 364 HZ2 LYS 82 HZ2 LYS 82 -22.846 9.050 -36.558 365 HZ3 LYS 82 HZ3 LYS 82 -24.475 9.329 -36.162 366 H SER 83 HN SER 83 -23.040 15.976 -34.108 367 HA SER 83 HA SER 83 -21.144 17.866 -32.983 368 HB2 SER 83 HB2 SER 83 -24.168 17.772 -32.886 369 HB3 SER 83 HB1 SER 83 -23.176 19.088 -32.262 370 HG SER 83 HG SER 83 -24.006 18.686 -34.746 371 H LYS 84 HN LYS 84 -21.612 18.632 -30.664 372 HA LYS 84 HA LYS 84 -20.970 16.585 -28.867 373 HB2 LYS 84 HB2 LYS 84 -21.352 18.229 -27.114 374 HB3 LYS 84 HB1 LYS 84 -20.593 19.032 -28.490 375 HG2 LYS 84 HG2 LYS 84 -22.809 19.806 -29.264 376 HG3 LYS 84 HG1 LYS 84 -23.567 19.015 -27.882 377 HD2 LYS 84 HD2 LYS 84 -22.258 20.438 -26.346 378 HD3 LYS 84 HD1 LYS 84 -21.504 21.234 -27.727 379 HE2 LYS 84 HE2 LYS 84 -23.715 22.013 -28.493 380 HE3 LYS 84 HE1 LYS 84 -24.477 21.210 -27.120 381 HZ1 LYS 84 HZ1 LYS 84 -22.291 23.000 -26.468 382 HZ2 LYS 84 HZ2 LYS 84 -23.792 22.788 -25.701 383 HZ3 LYS 84 HZ3 LYS 84 -23.676 23.752 -27.096 384 H LEU 85 HN LEU 85 -24.054 17.888 -29.839 385 HA LEU 85 HA LEU 85 -25.622 16.608 -27.821 386 HB2 LEU 85 HB2 LEU 85 -27.303 16.893 -29.994 387 HB3 LEU 85 HB1 LEU 85 -27.054 18.097 -28.730 388 HG LEU 85 HG LEU 85 -25.182 17.955 -31.081 389 HD11 LEU 85 HD11 LEU 85 -26.559 19.214 -32.454 390 HD12 LEU 85 HD12 LEU 85 -27.545 19.798 -31.113 391 HD13 LEU 85 HD13 LEU 85 -27.733 18.143 -31.692 392 HD21 LEU 85 HD21 LEU 85 -24.429 19.962 -30.301 393 HD22 LEU 85 HD22 LEU 85 -25.154 19.423 -28.787 394 HD23 LEU 85 HD23 LEU 85 -26.047 20.509 -29.854 395 H MET 86 HN MET 86 -24.706 15.767 -31.136 396 HA MET 86 HA MET 86 -26.228 13.383 -31.317 397 HB2 MET 86 HB2 MET 86 -23.720 14.280 -32.755 398 HB3 MET 86 HB1 MET 86 -24.609 12.812 -33.162 399 HG2 MET 86 HG2 MET 86 -25.756 15.619 -33.166 400 HG3 MET 86 HG1 MET 86 -25.308 14.693 -34.601 401 HE1 MET 86 HE1 MET 86 -27.670 11.680 -34.575 402 HE2 MET 86 HE2 MET 86 -26.009 11.848 -34.012 403 HE3 MET 86 HE3 MET 86 -26.511 12.640 -35.504 404 H ARG 87 HN ARG 87 -22.941 14.074 -30.205 405 HA ARG 87 HA ARG 87 -22.063 11.396 -29.942 406 HB2 ARG 87 HB2 ARG 87 -21.270 13.910 -28.470 407 HB3 ARG 87 HB1 ARG 87 -20.443 12.364 -28.275 408 HG2 ARG 87 HG2 ARG 87 -20.142 12.333 -30.796 409 HG3 ARG 87 HG1 ARG 87 -20.713 14.001 -30.804 410 HD2 ARG 87 HD2 ARG 87 -18.338 12.976 -29.231 411 HD3 ARG 87 HD1 ARG 87 -18.251 13.871 -30.743 412 HE ARG 87 HE ARG 87 -18.901 14.961 -28.122 413 HH11 ARG 87 HH11 ARG 87 -18.872 15.333 -31.560 414 HH12 ARG 87 HH12 ARG 87 -18.945 17.063 -31.512 415 HH21 ARG 87 HH21 ARG 87 -18.987 17.228 -28.050 416 HH22 ARG 87 HH22 ARG 87 -19.014 18.136 -29.525 417 H SER 88 HN SER 88 -23.606 13.607 -27.636 418 HA SER 88 HA SER 88 -23.622 11.811 -25.433 419 HB2 SER 88 HB2 SER 88 -25.403 14.179 -26.048 420 HB3 SER 88 HB1 SER 88 -25.384 13.317 -24.512 421 HG SER 88 HG SER 88 -23.761 15.242 -25.349 422 H ARG 89 HN ARG 89 -25.989 12.516 -27.976 423 HA ARG 89 HA ARG 89 -28.087 10.920 -26.983 424 HB2 ARG 89 HB2 ARG 89 -28.359 12.590 -28.787 425 HB3 ARG 89 HB1 ARG 89 -27.416 11.560 -29.865 426 HG2 ARG 89 HG2 ARG 89 -29.072 9.761 -29.624 427 HG3 ARG 89 HG1 ARG 89 -30.009 10.759 -28.511 428 HD2 ARG 89 HD2 ARG 89 -30.343 12.435 -30.283 429 HD3 ARG 89 HD1 ARG 89 -29.391 11.457 -31.396 430 HE ARG 89 HE ARG 89 -31.474 9.856 -30.400 431 HH11 ARG 89 HH11 ARG 89 -30.960 12.680 -32.331 432 HH12 ARG 89 HH12 ARG 89 -32.377 12.445 -33.300 433 HH21 ARG 89 HH21 ARG 89 -33.334 9.540 -31.665 434 HH22 ARG 89 HH22 ARG 89 -33.720 10.667 -32.923 435 H ALA 90 HN ALA 90 -25.454 10.171 -29.258 436 HA ALA 90 HA ALA 90 -26.244 7.509 -29.791 437 HB1 ALA 90 HB1 ALA 90 -24.120 7.245 -30.809 438 HB2 ALA 90 HB2 ALA 90 -23.393 8.493 -29.797 439 HB3 ALA 90 HB3 ALA 90 -24.543 8.939 -31.058 440 H VAL 91 HN VAL 91 -24.070 8.910 -27.373 441 HA VAL 91 HA VAL 91 -23.203 6.448 -26.259 442 HB VAL 91 HB VAL 91 -23.271 9.262 -25.152 443 HG11 VAL 91 HG11 VAL 91 -22.609 6.649 -23.895 444 HG12 VAL 91 HG12 VAL 91 -23.125 8.157 -23.142 445 HG13 VAL 91 HG13 VAL 91 -21.446 7.948 -23.636 446 HG21 VAL 91 HG21 VAL 91 -21.262 7.459 -26.482 447 HG22 VAL 91 HG22 VAL 91 -20.724 8.764 -25.423 448 HG23 VAL 91 HG23 VAL 91 -21.667 9.133 -26.868 449 H ASN 92 HN ASN 92 -25.804 8.702 -25.409 450 HA ASN 92 HA ASN 92 -26.653 7.403 -23.064 451 HB2 ASN 92 HB2 ASN 92 -28.118 9.127 -25.068 452 HB3 ASN 92 HB1 ASN 92 -28.858 8.550 -23.577 453 HD21 ASN 92 HD21 ASN 92 -28.449 11.351 -24.069 454 HD22 ASN 92 HD22 ASN 92 -27.293 11.917 -22.962 455 H LYS 93 HN LYS 93 -27.591 6.965 -26.464 456 HA LYS 93 HA LYS 93 -29.628 5.052 -25.978 457 HB2 LYS 93 HB2 LYS 93 -27.892 5.591 -28.396 458 HB3 LYS 93 HB1 LYS 93 -29.235 4.446 -28.394 459 HG2 LYS 93 HG2 LYS 93 -29.536 7.345 -27.575 460 HG3 LYS 93 HG1 LYS 93 -29.825 6.773 -29.219 461 HD2 LYS 93 HD2 LYS 93 -31.520 5.189 -28.356 462 HD3 LYS 93 HD1 LYS 93 -31.244 5.800 -26.723 463 HE2 LYS 93 HE2 LYS 93 -32.134 7.519 -29.056 464 HE3 LYS 93 HE1 LYS 93 -33.227 6.847 -27.845 465 HZ1 LYS 93 HZ1 LYS 93 -32.717 8.498 -26.485 466 HZ2 LYS 93 HZ2 LYS 93 -31.725 9.185 -27.681 467 HZ3 LYS 93 HZ3 LYS 93 -31.070 8.099 -26.551 468 H ALA 94 HN ALA 94 -26.154 4.760 -26.671 469 HA ALA 94 HA ALA 94 -26.103 1.922 -26.741 470 HB1 ALA 94 HB1 ALA 94 -24.029 4.066 -26.406 471 HB2 ALA 94 HB2 ALA 94 -24.224 2.896 -27.711 472 HB3 ALA 94 HB3 ALA 94 -23.595 2.376 -26.148 473 H VAL 95 HN VAL 95 -25.584 4.301 -24.177 474 HA VAL 95 HA VAL 95 -25.712 2.088 -22.210 475 HB VAL 95 HB VAL 95 -24.416 4.580 -21.326 476 HG11 VAL 95 HG11 VAL 95 -24.631 2.162 -20.272 477 HG12 VAL 95 HG12 VAL 95 -23.165 3.115 -20.041 478 HG13 VAL 95 HG13 VAL 95 -23.206 1.842 -21.261 479 HG21 VAL 95 HG21 VAL 95 -23.304 4.732 -23.365 480 HG22 VAL 95 HG22 VAL 95 -23.406 2.998 -23.666 481 HG23 VAL 95 HG23 VAL 95 -22.241 3.623 -22.499 482 H LYS 96 HN LYS 96 -28.041 3.167 -23.065 483 HA LYS 96 HA LYS 96 -28.943 5.460 -21.693 484 HB2 LYS 96 HB2 LYS 96 -30.099 4.415 -23.643 485 HB3 LYS 96 HB1 LYS 96 -30.604 3.093 -22.587 486 HG2 LYS 96 HG2 LYS 96 -31.800 4.661 -21.141 487 HG3 LYS 96 HG1 LYS 96 -31.245 6.022 -22.118 488 HD2 LYS 96 HD2 LYS 96 -32.423 5.080 -24.082 489 HD3 LYS 96 HD1 LYS 96 -33.006 3.747 -23.082 490 HE2 LYS 96 HE2 LYS 96 -34.167 5.357 -21.613 491 HE3 LYS 96 HE1 LYS 96 -33.580 6.684 -22.616 492 HZ1 LYS 96 HZ1 LYS 96 -35.907 5.789 -23.073 493 HZ2 LYS 96 HZ2 LYS 96 -35.127 4.457 -23.785 494 HZ3 LYS 96 HZ3 LYS 96 -34.879 6.021 -24.402 495 H GLU 97 HN GLU 97 -28.899 2.041 -20.819 496 HA GLU 97 HA GLU 97 -30.503 2.159 -18.519 497 HB2 GLU 97 HB2 GLU 97 -29.772 0.051 -19.580 498 HB3 GLU 97 HB1 GLU 97 -28.121 0.365 -19.047 499 HG2 GLU 97 HG2 GLU 97 -28.842 0.337 -16.706 500 HG3 GLU 97 HG1 GLU 97 -30.515 0.094 -17.208 501 H GLU 98 HN GLU 98 -27.047 2.752 -18.971 502 HA GLU 98 HA GLU 98 -26.349 3.013 -16.247 503 HB2 GLU 98 HB2 GLU 98 -25.130 4.188 -18.753 504 HB3 GLU 98 HB1 GLU 98 -24.412 4.359 -17.150 505 HG2 GLU 98 HG2 GLU 98 -25.056 1.723 -18.506 506 HG3 GLU 98 HG1 GLU 98 -23.448 2.430 -18.365 507 H LEU 99 HN LEU 99 -27.797 5.228 -18.545 508 HA LEU 99 HA LEU 99 -27.371 7.637 -17.149 509 HB2 LEU 99 HB2 LEU 99 -29.402 6.707 -19.153 510 HB3 LEU 99 HB1 LEU 99 -29.571 8.280 -18.379 511 HG LEU 99 HG LEU 99 -28.222 8.062 -20.640 512 HD11 LEU 99 HD11 LEU 99 -28.490 10.100 -19.220 513 HD12 LEU 99 HD12 LEU 99 -26.901 9.999 -19.977 514 HD13 LEU 99 HD13 LEU 99 -27.095 9.584 -18.274 515 HD21 LEU 99 HD21 LEU 99 -26.024 7.524 -18.626 516 HD22 LEU 99 HD22 LEU 99 -25.893 7.553 -20.385 517 HD23 LEU 99 HD23 LEU 99 -26.758 6.241 -19.584 518 H GLN 100 HN GLN 100 -29.951 5.219 -16.930 519 HA GLN 100 HA GLN 100 -31.613 6.653 -15.151 520 HB2 GLN 100 HB2 GLN 100 -32.354 4.655 -16.397 521 HB3 GLN 100 HB1 GLN 100 -31.265 3.659 -15.431 522 HG2 GLN 100 HG2 GLN 100 -32.457 4.299 -13.386 523 HG3 GLN 100 HG1 GLN 100 -33.522 5.350 -14.318 524 HE21 GLN 100 HE21 GLN 100 -34.651 3.250 -12.806 525 HE22 GLN 100 HE22 GLN 100 -35.244 2.060 -13.862 526 H GLU 101 HN GLU 101 -28.920 4.410 -14.623 527 HA GLU 101 HA GLU 101 -29.168 4.416 -11.764 528 HB2 GLU 101 HB2 GLU 101 -26.917 3.574 -13.601 529 HB3 GLU 101 HB1 GLU 101 -26.899 3.353 -11.851 530 HG2 GLU 101 HG2 GLU 101 -28.927 2.005 -11.974 531 HG3 GLU 101 HG1 GLU 101 -29.017 2.270 -13.713 532 H ILE 102 HN ILE 102 -27.386 6.282 -14.151 533 HA ILE 102 HA ILE 102 -26.377 7.988 -11.953 534 HB ILE 102 HB ILE 102 -24.976 7.287 -14.543 535 HG12 ILE 102 HG12 ILE 102 -24.190 6.689 -11.677 536 HG13 ILE 102 HG11 ILE 102 -25.014 5.529 -12.720 537 HG21 ILE 102 HG21 ILE 102 -23.613 8.701 -12.331 538 HG22 ILE 102 HG22 ILE 102 -24.798 9.644 -13.237 539 HG23 ILE 102 HG23 ILE 102 -23.438 8.896 -14.074 540 HD11 ILE 102 HD1 ILE 102 -23.119 5.055 -13.860 541 HD12 ILE 102 HD2 ILE 102 -22.266 5.876 -12.554 542 HD13 ILE 102 HD3 ILE 102 -22.696 6.759 -14.018 543 H HIS 103 HN HIS 103 -26.979 10.061 -12.072 544 HA HIS 103 HA HIS 103 -27.965 11.069 -14.675 545 HB2 HIS 103 HB2 HIS 103 -28.900 11.810 -11.894 546 HB3 HIS 103 HB1 HIS 103 -29.500 12.507 -13.400 547 HD2 HIS 103 HD2 HIS 103 -30.267 9.529 -11.133 548 HE1 HIS 103 HE1 HIS 103 -32.050 8.636 -14.854 549 HE2 HIS 103 HE2 HIS 103 -31.911 7.954 -12.412 550 H ALA 104 HN ALA 104 -25.718 11.449 -12.141 551 HA ALA 104 HA ALA 104 -25.096 14.202 -13.025 552 HB1 ALA 104 HB1 ALA 104 -23.712 13.894 -10.693 553 HB2 ALA 104 HB2 ALA 104 -25.138 12.905 -10.381 554 HB3 ALA 104 HB3 ALA 104 -25.322 14.605 -10.808 555 H PHE 105 HN PHE 105 -23.990 13.017 -14.842 556 HA PHE 105 HA PHE 105 -21.187 12.599 -14.102 557 HB2 PHE 105 HB2 PHE 105 -20.991 10.530 -15.324 558 HB3 PHE 105 HB1 PHE 105 -22.283 10.348 -14.137 559 HD1 PHE 105 HD1 PHE 105 -21.456 10.619 -17.694 560 HD2 PHE 105 HD2 PHE 105 -24.656 10.359 -14.838 561 HE1 PHE 105 HE1 PHE 105 -23.039 10.079 -19.519 562 HE2 PHE 105 HE2 PHE 105 -26.240 9.817 -16.670 563 HZ PHE 105 HZ PHE 105 -25.425 9.676 -19.009 564 H SER 106 HN SER 106 -19.747 12.684 -15.975 565 HA SER 106 HA SER 106 -20.951 14.093 -18.281 566 HB2 SER 106 HB2 SER 106 -18.890 15.459 -18.402 567 HB3 SER 106 HB1 SER 106 -19.755 15.710 -16.886 568 HG SER 106 HG SER 106 -18.107 13.649 -16.583 569 H CYS 107 HN CYS 107 -19.981 13.732 -20.299 570 HA CYS 107 HA CYS 107 -17.928 11.624 -20.432 571 HB2 CYS 107 HB2 CYS 107 -19.197 10.459 -22.184 572 HB3 CYS 107 HB1 CYS 107 -20.116 10.518 -20.678 573 HG CYS 107 HG CYS 107 -20.697 12.411 -23.105 574 H LYS 108 HN LYS 108 -16.591 13.507 -20.944 575 HA LYS 108 HA LYS 108 -17.090 15.166 -23.176 576 HB2 LYS 108 HB2 LYS 108 -14.446 14.405 -21.904 577 HB3 LYS 108 HB1 LYS 108 -14.712 15.766 -22.996 578 HG2 LYS 108 HG2 LYS 108 -16.103 15.381 -20.330 579 HG3 LYS 108 HG1 LYS 108 -14.749 16.474 -20.619 580 HD2 LYS 108 HD2 LYS 108 -16.083 17.697 -22.293 581 HD3 LYS 108 HD1 LYS 108 -17.441 16.609 -22.007 582 HE2 LYS 108 HE2 LYS 108 -17.522 17.320 -19.647 583 HE3 LYS 108 HE1 LYS 108 -16.165 18.412 -19.929 584 HZ1 LYS 108 HZ1 LYS 108 -17.525 19.925 -20.771 585 HZ2 LYS 108 HZ2 LYS 108 -18.839 18.960 -20.290 586 HZ3 LYS 108 HZ3 LYS 108 -18.203 18.814 -21.858 587 H CYS 109 HN CYS 109 -16.630 14.937 -25.316 588 HA CYS 109 HA CYS 109 -15.398 12.380 -26.158 589 HB2 CYS 109 HB2 CYS 109 -17.478 14.054 -27.582 590 HB3 CYS 109 HB1 CYS 109 -16.764 12.563 -28.199 591 HG CYS 109 HG CYS 109 -18.523 11.388 -26.919 592 H TYR 110 HN TYR 110 -13.578 12.502 -27.303 593 HA TYR 110 HA TYR 110 -12.991 14.970 -28.797 594 HB2 TYR 110 HB2 TYR 110 -11.036 13.556 -26.965 595 HB3 TYR 110 HB1 TYR 110 -10.677 14.947 -27.993 596 HD1 TYR 110 HD1 TYR 110 -12.007 13.844 -24.831 597 HD2 TYR 110 HD2 TYR 110 -11.991 17.113 -27.616 598 HE1 TYR 110 HE1 TYR 110 -12.830 15.364 -23.054 599 HE2 TYR 110 HE2 TYR 110 -12.812 18.633 -25.839 600 HH TYR 110 HH TYR 110 -13.746 18.698 -23.765 601 H THR 111 HN THR 111 -11.500 14.694 -30.538 602 HA THR 111 HA THR 111 -10.328 12.215 -31.220 603 HB THR 111 HB THR 111 -13.020 12.811 -32.442 604 HG1 THR 111 HG1 THR 111 -13.493 11.240 -31.157 605 HG21 THR 111 HG21 THR 111 -11.588 12.391 -34.321 606 HG22 THR 111 HG22 THR 111 -12.435 10.880 -33.985 607 HG23 THR 111 HG23 THR 111 -10.760 11.084 -33.475 608 H GLU 112 HN GLU 112 -11.318 15.441 -31.946 609 HA GLU 112 HA GLU 112 -9.163 16.423 -33.147 610 HB2 GLU 112 HB2 GLU 112 -10.408 14.463 -34.950 611 HB3 GLU 112 HB1 GLU 112 -10.086 16.031 -35.694 612 HG2 GLU 112 HG2 GLU 112 -7.757 15.933 -35.038 613 HG3 GLU 112 HG1 GLU 112 -8.035 14.461 -34.108 614 H GLU 113 HN GLU 113 -12.598 15.997 -33.945 615 HA GLU 113 HA GLU 113 -13.037 18.547 -35.042 616 HB2 GLU 113 HB2 GLU 113 -14.911 16.650 -33.612 617 HB3 GLU 113 HB1 GLU 113 -15.443 18.136 -34.402 618 HG2 GLU 113 HG2 GLU 113 -15.724 16.606 -36.133 619 HG3 GLU 113 HG1 GLU 113 -14.084 17.169 -36.451 620 H GLU 114 HN GLU 114 -12.958 17.411 -31.727 621 HA GLU 114 HA GLU 114 -14.189 19.499 -30.386 622 HB2 GLU 114 HB2 GLU 114 -12.874 18.867 -28.461 623 HB3 GLU 114 HB1 GLU 114 -13.270 17.396 -29.353 624 HG2 GLU 114 HG2 GLU 114 -10.985 17.099 -28.991 625 HG3 GLU 114 HG1 GLU 114 -10.985 17.872 -30.576 626 H TRP 115 HN TRP 115 -11.456 19.626 -32.374 627 HA TRP 115 HA TRP 115 -9.804 21.515 -31.183 628 HB2 TRP 115 HB2 TRP 115 -8.831 21.772 -33.277 629 HB3 TRP 115 HB1 TRP 115 -9.658 20.223 -33.487 630 HD1 TRP 115 HD1 TRP 115 -10.531 23.977 -33.946 631 HE1 TRP 115 HE1 TRP 115 -11.961 24.225 -36.071 632 HE3 TRP 115 HE3 TRP 115 -10.829 19.094 -35.381 633 HZ2 TRP 115 HZ2 TRP 115 -13.075 22.570 -38.113 634 HZ3 TRP 115 HZ3 TRP 115 -12.075 18.455 -37.412 635 HH2 TRP 115 HH2 TRP 115 -13.198 20.184 -38.785 636 H SER 116 HN SER 116 -12.855 21.915 -32.894 637 HA SER 116 HA SER 116 -13.866 23.944 -33.602 638 HB2 SER 116 HB2 SER 116 -14.191 23.157 -30.859 639 HB3 SER 116 HB1 SER 116 -14.297 24.911 -30.984 640 HG SER 116 HG SER 116 -15.787 24.527 -32.751 641 H LYS 117 HN LYS 117 -12.570 25.197 -30.585 642 HA LYS 117 HA LYS 117 -11.997 27.743 -31.405 643 HB2 LYS 117 HB2 LYS 117 -9.998 27.427 -29.638 644 HB3 LYS 117 HB1 LYS 117 -11.686 27.564 -29.145 645 HG2 LYS 117 HG2 LYS 117 -11.911 25.157 -29.007 646 HG3 LYS 117 HG1 LYS 117 -10.308 24.919 -29.705 647 HD2 LYS 117 HD2 LYS 117 -9.955 24.656 -27.387 648 HD3 LYS 117 HD1 LYS 117 -9.455 26.319 -27.697 649 HE2 LYS 117 HE2 LYS 117 -10.876 26.300 -25.728 650 HE3 LYS 117 HE1 LYS 117 -11.760 27.070 -27.047 651 HZ1 LYS 117 HZ1 LYS 117 -12.922 25.027 -27.463 652 HZ2 LYS 117 HZ2 LYS 117 -13.095 25.431 -25.822 653 HZ3 LYS 117 HZ3 LYS 117 -12.011 24.209 -26.289 654 H ILE 118 HN ILE 118 -9.205 25.675 -30.743 655 HA ILE 118 HA ILE 118 -7.085 25.811 -31.694 656 HB ILE 118 HB ILE 118 -8.409 24.019 -32.919 657 HG12 ILE 118 HG12 ILE 118 -6.325 25.390 -34.636 658 HG13 ILE 118 HG11 ILE 118 -5.908 24.522 -33.157 659 HG21 ILE 118 HG21 ILE 118 -9.910 25.571 -34.130 660 HG22 ILE 118 HG22 ILE 118 -9.025 24.535 -35.251 661 HG23 ILE 118 HG23 ILE 118 -8.527 26.211 -35.016 662 HD11 ILE 118 HD1 ILE 118 -6.169 23.387 -35.680 663 HD12 ILE 118 HD2 ILE 118 -7.693 22.983 -34.891 664 HD13 ILE 118 HD3 ILE 118 -6.164 22.508 -34.152 665 H VAL 119 HN VAL 119 -8.712 28.356 -31.756 666 HA VAL 119 HA VAL 119 -8.347 30.504 -32.499 667 HB VAL 119 HB VAL 119 -6.177 29.747 -34.374 668 HG11 VAL 119 HG11 VAL 119 -6.187 31.682 -32.051 669 HG12 VAL 119 HG12 VAL 119 -6.880 32.091 -33.619 670 HG13 VAL 119 HG13 VAL 119 -5.163 31.714 -33.486 671 HG21 VAL 119 HG21 VAL 119 -4.699 29.619 -32.182 672 HG22 VAL 119 HG22 VAL 119 -5.486 28.168 -32.806 673 HG23 VAL 119 HG23 VAL 119 -6.200 29.047 -31.455 674 H VAL 120 HN VAL 120 -9.141 27.897 -34.429 675 HA VAL 120 HA VAL 120 -9.903 29.681 -36.664 676 HB VAL 120 HB VAL 120 -9.259 26.721 -36.731 677 HG11 VAL 120 HG11 VAL 120 -11.030 28.052 -38.345 678 HG12 VAL 120 HG12 VAL 120 -10.094 26.644 -38.848 679 HG13 VAL 120 HG13 VAL 120 -9.522 28.266 -39.234 680 HG21 VAL 120 HG21 VAL 120 -7.603 28.050 -38.497 681 HG22 VAL 120 HG22 VAL 120 -7.144 27.536 -36.874 682 HG23 VAL 120 HG23 VAL 120 -7.705 29.184 -37.150 683 H LEU 121 HN LEU 121 -12.020 29.931 -36.960 684 HA LEU 121 HA LEU 121 -13.978 27.976 -36.956 685 HB2 LEU 121 HB2 LEU 121 -13.483 27.660 -34.570 686 HB3 LEU 121 HB1 LEU 121 -13.804 29.368 -34.271 687 HG LEU 121 HG LEU 121 -16.119 29.076 -35.073 688 HD11 LEU 121 HD11 LEU 121 -15.141 26.257 -35.527 689 HD12 LEU 121 HD12 LEU 121 -15.981 27.322 -36.654 690 HD13 LEU 121 HD13 LEU 121 -16.855 26.606 -35.300 691 HD21 LEU 121 HD21 LEU 121 -16.288 26.911 -33.218 692 HD22 LEU 121 HD22 LEU 121 -16.584 28.623 -32.916 693 HD23 LEU 121 HD23 LEU 121 -14.965 27.956 -32.702 694 H GLU 122 HN GLU 122 -13.360 31.290 -35.822 695 HA GLU 122 HA GLU 122 -15.906 32.336 -36.468 696 HB2 GLU 122 HB2 GLU 122 -14.291 33.486 -34.995 697 HB3 GLU 122 HB1 GLU 122 -13.242 33.771 -36.383 698 HG2 GLU 122 HG2 GLU 122 -15.009 35.074 -37.478 699 HG3 GLU 122 HG1 GLU 122 -16.097 34.760 -36.128 700 H HIS 123 HN HIS 123 -13.443 34.074 -38.069 701 HA HIS 123 HA HIS 123 -13.067 34.603 -40.273 702 HB2 HIS 123 HB2 HIS 123 -14.181 31.821 -40.704 703 HB3 HIS 123 HB1 HIS 123 -13.407 32.799 -41.951 704 HD2 HIS 123 HD2 HIS 123 -10.597 32.900 -41.800 705 HE1 HIS 123 HE1 HIS 123 -10.203 30.508 -38.343 706 HE2 HIS 123 HE2 HIS 123 -8.933 31.649 -40.223 707 H HIS 124 HN HIS 124 -15.907 34.598 -38.863 708 HA HIS 124 HA HIS 124 -17.996 35.406 -39.365 709 HB2 HIS 124 HB2 HIS 124 -16.500 36.464 -41.775 710 HB3 HIS 124 HB1 HIS 124 -18.138 36.938 -41.326 711 HD2 HIS 124 HD2 HIS 124 -18.299 38.744 -39.168 712 HE1 HIS 124 HE1 HIS 124 -14.151 38.996 -38.428 713 HE2 HIS 124 HE2 HIS 124 -16.419 39.973 -37.838 714 H HIS 125 HN HIS 125 -16.860 32.794 -40.597 715 HA HIS 125 HA HIS 125 -17.667 31.076 -41.893 716 HB2 HIS 125 HB2 HIS 125 -20.220 32.703 -41.795 717 HB3 HIS 125 HB1 HIS 125 -20.092 31.009 -42.269 718 HD2 HIS 125 HD2 HIS 125 -20.578 33.048 -39.074 719 HE1 HIS 125 HE1 HIS 125 -19.328 29.213 -37.824 720 HE2 HIS 125 HE2 HIS 125 -20.298 31.428 -37.045 721 H HIS 126 HN HIS 126 -16.484 33.507 -43.127 722 HA HIS 126 HA HIS 126 -17.491 33.043 -45.856 723 HB2 HIS 126 HB2 HIS 126 -16.870 35.756 -44.665 724 HB3 HIS 126 HB1 HIS 126 -17.251 35.449 -46.359 725 HD2 HIS 126 HD2 HIS 126 -19.134 36.362 -43.212 726 HE1 HIS 126 HE1 HIS 126 -21.974 34.447 -45.679 727 HE2 HIS 126 HE2 HIS 126 -21.668 35.861 -43.593 728 H HIS 127 HN HIS 127 -15.945 33.261 -47.498 729 HA HIS 127 HA HIS 127 -13.314 32.494 -46.827 730 HB2 HIS 127 HB2 HIS 127 -14.521 33.570 -49.378 731 HB3 HIS 127 HB1 HIS 127 -12.842 33.045 -49.260 732 HD2 HIS 127 HD2 HIS 127 -14.314 30.549 -47.066 733 HE1 HIS 127 HE1 HIS 127 -15.198 28.998 -50.891 734 HE2 HIS 127 HE2 HIS 127 -15.074 28.447 -48.415 735 H HIS 128 HN HIS 128 -14.732 35.622 -47.675 736 HA HIS 128 HA HIS 128 -12.158 36.902 -46.973 737 HB2 HIS 128 HB2 HIS 128 -14.332 37.766 -48.886 738 HB3 HIS 128 HB1 HIS 128 -13.035 38.835 -48.349 739 HD2 HIS 128 HD2 HIS 128 -10.576 38.415 -49.621 740 HE1 HIS 128 HE1 HIS 128 -11.694 34.976 -51.802 741 HE2 HIS 128 HE2 HIS 128 -9.860 36.697 -51.454
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