NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
634977 | 6f8e | 34216 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 11 HT1 SER 11 23.835 3.489 3.229 2 H2 SER 11 HT2 SER 11 23.754 5.171 3.100 3 H3 SER 11 HT3 SER 11 25.251 4.388 3.046 4 HA SER 11 HA SER 11 24.545 5.090 0.860 5 HB2 SER 11 HB2 SER 11 24.499 2.089 1.241 6 HB3 SER 11 HB1 SER 11 24.972 2.962 -0.212 7 HG SER 11 HG SER 11 26.795 3.665 0.766 8 H ALA 12 HN ALA 12 22.940 5.267 -0.654 9 HA ALA 12 HA ALA 12 20.388 5.538 0.343 10 HB1 ALA 12 HB1 ALA 12 21.123 5.219 -2.559 11 HB2 ALA 12 HB2 ALA 12 21.269 6.710 -1.627 12 HB3 ALA 12 HB3 ALA 12 19.680 6.002 -1.916 13 H SER 13 HN SER 13 21.417 2.977 -1.951 14 HA SER 13 HA SER 13 18.871 1.771 -1.979 15 HB2 SER 13 HB2 SER 13 21.553 0.641 -2.789 16 HB3 SER 13 HB1 SER 13 19.978 0.058 -3.290 17 HG SER 13 HG SER 13 19.784 1.659 -4.664 18 H ASP 14 HN ASP 14 21.860 1.093 -0.222 19 HA ASP 14 HA ASP 14 21.031 -1.391 0.846 20 HB2 ASP 14 HB2 ASP 14 23.183 0.551 1.647 21 HB3 ASP 14 HB1 ASP 14 22.887 -0.929 2.553 22 H ILE 15 HN ILE 15 20.991 1.903 2.204 23 HA ILE 15 HA ILE 15 19.849 1.108 4.668 24 HB ILE 15 HB ILE 15 20.985 3.307 4.359 25 HG12 ILE 15 HG12 ILE 15 19.191 4.624 5.635 26 HG13 ILE 15 HG11 ILE 15 18.179 3.188 5.444 27 HG21 ILE 15 HG21 ILE 15 18.446 4.089 2.940 28 HG22 ILE 15 HG22 ILE 15 20.041 3.942 2.202 29 HG23 ILE 15 HG23 ILE 15 19.743 5.184 3.417 30 HD11 ILE 15 HD11 ILE 15 19.255 3.186 7.602 31 HD12 ILE 15 HD12 ILE 15 20.840 3.322 6.840 32 HD13 ILE 15 HD13 ILE 15 19.875 1.865 6.611 33 H ARG 16 HN ARG 16 18.501 2.067 1.575 34 HA ARG 16 HA ARG 16 15.857 2.488 2.372 35 HB2 ARG 16 HB2 ARG 16 16.571 3.205 0.210 36 HB3 ARG 16 HB1 ARG 16 17.130 1.597 -0.217 37 HG2 ARG 16 HG2 ARG 16 14.725 0.860 -0.140 38 HG3 ARG 16 HG1 ARG 16 14.300 2.574 -0.018 39 HD2 ARG 16 HD2 ARG 16 15.957 1.332 -2.202 40 HD3 ARG 16 HD1 ARG 16 14.244 1.734 -2.340 41 HE ARG 16 HE ARG 16 15.751 4.015 -1.564 42 HH11 ARG 16 HH11 ARG 16 15.070 1.978 -4.325 43 HH12 ARG 16 HH12 ARG 16 15.340 3.240 -5.486 44 HH21 ARG 16 HH21 ARG 16 16.123 5.680 -3.090 45 HH22 ARG 16 HH22 ARG 16 15.930 5.350 -4.784 46 H MET 17 HN MET 17 17.505 -0.478 1.324 47 HA MET 17 HA MET 17 15.225 -2.079 1.166 48 HB2 MET 17 HB2 MET 17 18.104 -2.741 1.721 49 HB3 MET 17 HB1 MET 17 16.864 -3.983 1.630 50 HG2 MET 17 HG2 MET 17 16.314 -3.239 -0.649 51 HG3 MET 17 HG1 MET 17 17.605 -2.043 -0.552 52 HE1 MET 17 HE1 MET 17 20.180 -2.637 -0.496 53 HE2 MET 17 HE2 MET 17 20.800 -4.283 -0.364 54 HE3 MET 17 HE3 MET 17 19.895 -3.572 0.971 55 H LYS 18 HN LYS 18 17.308 -1.388 3.965 56 HA LYS 18 HA LYS 18 15.671 -2.998 5.698 57 HB2 LYS 18 HB2 LYS 18 17.000 -2.200 7.515 58 HB3 LYS 18 HB1 LYS 18 18.087 -2.511 6.174 59 HG2 LYS 18 HG2 LYS 18 18.427 -0.219 5.775 60 HG3 LYS 18 HG1 LYS 18 17.028 0.240 6.748 61 HD2 LYS 18 HD2 LYS 18 19.055 0.710 7.971 62 HD3 LYS 18 HD1 LYS 18 18.181 -0.606 8.754 63 HE2 LYS 18 HE2 LYS 18 19.668 -2.236 7.761 64 HE3 LYS 18 HE1 LYS 18 20.490 -0.973 6.850 65 HZ1 LYS 18 HZ1 LYS 18 21.753 -1.603 8.800 66 HZ2 LYS 18 HZ2 LYS 18 20.448 -1.228 9.805 67 HZ3 LYS 18 HZ3 LYS 18 21.226 -0.001 8.941 68 H LYS 19 HN LYS 19 15.737 0.334 4.687 69 HA LYS 19 HA LYS 19 14.184 1.341 6.870 70 HB2 LYS 19 HB2 LYS 19 15.836 2.463 5.015 71 HB3 LYS 19 HB1 LYS 19 14.257 2.957 4.422 72 HG2 LYS 19 HG2 LYS 19 15.299 3.422 7.209 73 HG3 LYS 19 HG1 LYS 19 15.297 4.615 5.912 74 HD2 LYS 19 HD2 LYS 19 12.876 4.553 5.824 75 HD3 LYS 19 HD1 LYS 19 12.839 3.285 7.050 76 HE2 LYS 19 HE2 LYS 19 12.332 5.489 7.997 77 HE3 LYS 19 HE1 LYS 19 13.805 4.803 8.680 78 HZ1 LYS 19 HZ1 LYS 19 13.700 6.845 6.529 79 HZ2 LYS 19 HZ2 LYS 19 15.105 6.208 7.215 80 HZ3 LYS 19 HZ3 LYS 19 14.060 7.151 8.152 81 H VAL 20 HN VAL 20 13.491 0.272 3.608 82 HA VAL 20 HA VAL 20 10.784 1.043 3.598 83 HB VAL 20 HB VAL 20 10.422 -0.643 1.879 84 HG11 VAL 20 HG11 VAL 20 13.034 0.819 1.513 85 HG12 VAL 20 HG12 VAL 20 11.429 1.509 1.272 86 HG13 VAL 20 HG13 VAL 20 11.996 0.208 0.224 87 HG21 VAL 20 HG21 VAL 20 11.771 -2.447 2.794 88 HG22 VAL 20 HG22 VAL 20 13.242 -1.526 2.477 89 HG23 VAL 20 HG23 VAL 20 12.251 -2.094 1.134 90 H MET 21 HN MET 21 12.510 -1.618 5.041 91 HA MET 21 HA MET 21 10.395 -3.271 5.784 92 HB2 MET 21 HB2 MET 21 12.961 -2.619 7.238 93 HB3 MET 21 HB1 MET 21 11.876 -3.932 7.699 94 HG2 MET 21 HG2 MET 21 12.236 -4.938 5.470 95 HG3 MET 21 HG1 MET 21 13.380 -3.651 5.108 96 HE1 MET 21 HE1 MET 21 15.690 -6.767 5.578 97 HE2 MET 21 HE2 MET 21 15.223 -5.443 4.512 98 HE3 MET 21 HE3 MET 21 14.078 -6.736 4.863 99 H GLN 22 HN GLN 22 11.734 -0.393 7.503 100 HA GLN 22 HA GLN 22 9.991 -0.224 9.599 101 HB2 GLN 22 HB2 GLN 22 11.240 1.833 7.809 102 HB3 GLN 22 HB1 GLN 22 10.312 2.273 9.232 103 HG2 GLN 22 HG2 GLN 22 12.739 2.229 9.514 104 HG3 GLN 22 HG1 GLN 22 11.870 1.247 10.665 105 HE21 GLN 22 HE21 GLN 22 14.325 1.454 8.354 106 HE22 GLN 22 HE22 GLN 22 14.772 -0.220 8.345 107 H TYR 23 HN TYR 23 9.619 1.086 6.337 108 HA TYR 23 HA TYR 23 7.028 2.160 6.748 109 HB2 TYR 23 HB2 TYR 23 8.665 1.553 4.297 110 HB3 TYR 23 HB1 TYR 23 7.038 2.227 4.186 111 HD1 TYR 23 HD1 TYR 23 10.475 2.987 4.423 112 HD2 TYR 23 HD2 TYR 23 6.639 4.399 5.592 113 HE1 TYR 23 HE1 TYR 23 11.398 5.248 4.709 114 HE2 TYR 23 HE2 TYR 23 7.554 6.660 5.886 115 HH TYR 23 HH TYR 23 10.646 7.555 4.751 116 H ARG 24 HN ARG 24 8.198 -0.956 5.803 117 HA ARG 24 HA ARG 24 5.919 -1.895 4.446 118 HB2 ARG 24 HB2 ARG 24 8.257 -2.867 4.397 119 HB3 ARG 24 HB1 ARG 24 7.909 -3.581 5.965 120 HG2 ARG 24 HG2 ARG 24 6.220 -4.967 5.063 121 HG3 ARG 24 HG1 ARG 24 6.219 -4.087 3.533 122 HD2 ARG 24 HD2 ARG 24 8.576 -4.829 3.190 123 HD3 ARG 24 HD1 ARG 24 8.419 -5.838 4.625 124 HE ARG 24 HE ARG 24 6.571 -6.181 2.363 125 HH11 ARG 24 HH11 ARG 24 9.038 -7.459 4.503 126 HH12 ARG 24 HH12 ARG 24 8.898 -9.081 3.899 127 HH21 ARG 24 HH21 ARG 24 6.385 -8.313 1.571 128 HH22 ARG 24 HH22 ARG 24 7.393 -9.566 2.225 129 H ARG 25 HN ARG 25 6.870 -1.965 7.832 130 HA ARG 25 HA ARG 25 4.715 -3.609 8.699 131 HB2 ARG 25 HB2 ARG 25 6.290 -1.565 10.271 132 HB3 ARG 25 HB1 ARG 25 5.288 -2.845 10.944 133 HG2 ARG 25 HG2 ARG 25 6.780 -4.490 9.787 134 HG3 ARG 25 HG1 ARG 25 7.841 -3.137 9.390 135 HD2 ARG 25 HD2 ARG 25 8.001 -2.629 11.811 136 HD3 ARG 25 HD1 ARG 25 7.061 -4.085 12.135 137 HE ARG 25 HE ARG 25 9.585 -4.265 10.646 138 HH11 ARG 25 HH11 ARG 25 7.682 -5.048 13.482 139 HH12 ARG 25 HH12 ARG 25 8.801 -6.244 14.050 140 HH21 ARG 25 HH21 ARG 25 11.052 -5.840 11.394 141 HH22 ARG 25 HH22 ARG 25 10.717 -6.689 12.870 142 H ALA 26 HN ALA 26 5.113 -0.201 8.112 143 HA ALA 26 HA ALA 26 2.601 0.538 9.319 144 HB1 ALA 26 HB1 ALA 26 3.097 2.761 8.473 145 HB2 ALA 26 HB2 ALA 26 4.446 2.120 7.538 146 HB3 ALA 26 HB3 ALA 26 4.498 2.084 9.301 147 H LEU 27 HN LEU 27 3.671 -0.627 6.296 148 HA LEU 27 HA LEU 27 1.236 0.245 4.940 149 HB2 LEU 27 HB2 LEU 27 3.905 -0.701 4.092 150 HB3 LEU 27 HB1 LEU 27 2.563 -1.162 3.066 151 HG LEU 27 HG LEU 27 2.119 1.037 2.429 152 HD11 LEU 27 HD11 LEU 27 1.981 2.068 4.618 153 HD12 LEU 27 HD12 LEU 27 3.026 3.022 3.566 154 HD13 LEU 27 HD13 LEU 27 3.734 1.976 4.797 155 HD21 LEU 27 HD21 LEU 27 5.092 0.907 2.891 156 HD22 LEU 27 HD22 LEU 27 4.272 1.995 1.771 157 HD23 LEU 27 HD23 LEU 27 4.223 0.253 1.503 158 H THR 28 HN THR 28 2.486 -2.467 6.589 159 HA THR 28 HA THR 28 0.743 -4.359 5.260 160 HB THR 28 HB THR 28 2.422 -4.663 7.763 161 HG1 THR 28 HG1 THR 28 3.714 -4.429 5.934 162 HG21 THR 28 HG21 THR 28 1.008 -6.770 6.123 163 HG22 THR 28 HG22 THR 28 0.534 -6.229 7.734 164 HG23 THR 28 HG23 THR 28 2.069 -7.064 7.500 165 H LYS 29 HN LYS 29 -1.343 -4.089 5.580 166 HA LYS 29 HA LYS 29 -2.439 -3.927 8.284 167 HB2 LYS 29 HB2 LYS 29 -2.594 -1.753 6.255 168 HB3 LYS 29 HB1 LYS 29 -4.074 -2.132 7.112 169 HG2 LYS 29 HG2 LYS 29 -3.125 -0.370 8.302 170 HG3 LYS 29 HG1 LYS 29 -2.730 -1.802 9.249 171 HD2 LYS 29 HD2 LYS 29 -0.496 -1.810 8.443 172 HD3 LYS 29 HD1 LYS 29 -0.857 -0.570 7.246 173 HE2 LYS 29 HE2 LYS 29 -0.982 -0.194 10.225 174 HE3 LYS 29 HE1 LYS 29 0.350 0.311 9.202 175 HZ1 LYS 29 HZ1 LYS 29 -2.429 1.339 9.199 176 HZ2 LYS 29 HZ2 LYS 29 -1.288 1.715 7.998 177 HZ3 LYS 29 HZ3 LYS 29 -1.010 2.180 9.602 178 H VAL 30 HN VAL 30 -4.806 -4.258 8.245 179 HA VAL 30 HA VAL 30 -5.708 -5.633 5.816 180 HB VAL 30 HB VAL 30 -7.651 -6.394 7.193 181 HG11 VAL 30 HG11 VAL 30 -5.751 -7.858 6.842 182 HG12 VAL 30 HG12 VAL 30 -6.391 -8.077 8.471 183 HG13 VAL 30 HG13 VAL 30 -4.916 -7.142 8.221 184 HG21 VAL 30 HG21 VAL 30 -7.522 -6.234 9.628 185 HG22 VAL 30 HG22 VAL 30 -7.615 -4.634 8.889 186 HG23 VAL 30 HG23 VAL 30 -6.073 -5.240 9.490 187 H VAL 31 HN VAL 31 -7.170 -4.698 4.528 188 HA VAL 31 HA VAL 31 -8.735 -2.441 5.462 189 HB VAL 31 HB VAL 31 -6.216 -2.079 4.129 190 HG11 VAL 31 HG11 VAL 31 -7.477 -2.205 2.043 191 HG12 VAL 31 HG12 VAL 31 -6.857 -0.580 2.336 192 HG13 VAL 31 HG13 VAL 31 -8.561 -0.938 2.622 193 HG21 VAL 31 HG21 VAL 31 -8.315 -0.113 5.026 194 HG22 VAL 31 HG22 VAL 31 -6.638 0.272 4.642 195 HG23 VAL 31 HG23 VAL 31 -7.012 -0.772 6.014 196 H LYS 32 HN LYS 32 -10.426 -1.883 4.008 197 HA LYS 32 HA LYS 32 -11.031 -4.087 2.178 198 HB2 LYS 32 HB2 LYS 32 -12.538 -3.472 4.156 199 HB3 LYS 32 HB1 LYS 32 -12.965 -2.037 3.238 200 HG2 LYS 32 HG2 LYS 32 -13.217 -4.648 1.865 201 HG3 LYS 32 HG1 LYS 32 -14.395 -4.262 3.127 202 HD2 LYS 32 HD2 LYS 32 -14.817 -2.096 1.950 203 HD3 LYS 32 HD1 LYS 32 -13.779 -2.669 0.643 204 HE2 LYS 32 HE2 LYS 32 -16.108 -3.051 0.098 205 HE3 LYS 32 HE1 LYS 32 -15.272 -4.588 0.316 206 HZ1 LYS 32 HZ1 LYS 32 -16.950 -3.269 2.383 207 HZ2 LYS 32 HZ2 LYS 32 -16.232 -4.799 2.492 208 HZ3 LYS 32 HZ3 LYS 32 -17.469 -4.525 1.374 209 H LEU 33 HN LEU 33 -10.936 -3.767 0.082 210 HA LEU 33 HA LEU 33 -10.562 -1.067 -0.934 211 HB2 LEU 33 HB2 LEU 33 -10.191 -3.805 -2.077 212 HB3 LEU 33 HB1 LEU 33 -10.327 -2.423 -3.151 213 HG LEU 33 HG LEU 33 -8.259 -2.701 -0.970 214 HD11 LEU 33 HD11 LEU 33 -6.677 -3.061 -2.798 215 HD12 LEU 33 HD12 LEU 33 -8.007 -3.042 -3.957 216 HD13 LEU 33 HD13 LEU 33 -7.901 -4.329 -2.757 217 HD21 LEU 33 HD21 LEU 33 -8.608 -0.686 -3.187 218 HD22 LEU 33 HD22 LEU 33 -7.235 -0.768 -2.082 219 HD23 LEU 33 HD23 LEU 33 -8.843 -0.391 -1.466 220 H LYS 34 HN LYS 34 -11.879 -0.017 -2.321 221 HA LYS 34 HA LYS 34 -14.322 -1.346 -3.254 222 HB2 LYS 34 HB2 LYS 34 -14.493 1.362 -1.942 223 HB3 LYS 34 HB1 LYS 34 -15.808 0.288 -2.399 224 HG2 LYS 34 HG2 LYS 34 -15.032 -1.299 -0.652 225 HG3 LYS 34 HG1 LYS 34 -13.863 -0.082 -0.141 226 HD2 LYS 34 HD2 LYS 34 -16.870 0.190 -0.142 227 HD3 LYS 34 HD1 LYS 34 -15.828 0.009 1.270 228 HE2 LYS 34 HE2 LYS 34 -14.760 2.153 0.745 229 HE3 LYS 34 HE1 LYS 34 -15.822 2.334 -0.652 230 HZ1 LYS 34 HZ1 LYS 34 -16.611 3.573 1.285 231 HZ2 LYS 34 HZ2 LYS 34 -16.737 2.136 2.167 232 HZ3 LYS 34 HZ3 LYS 34 -17.718 2.385 0.815 233 H THR 35 HN THR 35 -14.024 -1.095 -5.397 234 HA THR 35 HA THR 35 -14.220 1.481 -6.545 235 HB THR 35 HB THR 35 -11.916 1.746 -5.948 236 HG1 THR 35 HG1 THR 35 -11.148 2.321 -7.897 237 HG21 THR 35 HG21 THR 35 -10.148 0.212 -6.741 238 HG22 THR 35 HG22 THR 35 -11.398 -0.885 -7.319 239 HG23 THR 35 HG23 THR 35 -11.257 -0.542 -5.599 240 H HIS 36 HN HIS 36 -13.163 0.961 -9.099 241 HA HIS 36 HA HIS 36 -15.179 -0.684 -10.221 242 HB2 HIS 36 HB2 HIS 36 -13.971 1.230 -11.360 243 HB3 HIS 36 HB1 HIS 36 -12.592 0.158 -11.551 244 HD1 HIS 36 HD1 HIS 36 -15.784 1.094 -13.079 245 HD2 HIS 36 HD2 HIS 36 -13.098 -2.064 -13.342 246 HE1 HIS 36 HE1 HIS 36 -16.369 -0.114 -15.201 247 HE2 HIS 36 HE2 HIS 36 -14.867 -2.132 -15.226 248 H LEU 37 HN LEU 37 -12.084 -1.322 -8.955 249 HA LEU 37 HA LEU 37 -11.453 -3.795 -10.123 250 HB2 LEU 37 HB2 LEU 37 -9.943 -2.397 -8.714 251 HB3 LEU 37 HB1 LEU 37 -10.908 -2.807 -7.314 252 HG LEU 37 HG LEU 37 -10.277 -5.216 -7.713 253 HD11 LEU 37 HD11 LEU 37 -9.598 -5.039 -10.036 254 HD12 LEU 37 HD12 LEU 37 -8.262 -5.621 -9.044 255 HD13 LEU 37 HD13 LEU 37 -8.290 -3.944 -9.589 256 HD21 LEU 37 HD21 LEU 37 -9.268 -3.940 -5.940 257 HD22 LEU 37 HD22 LEU 37 -8.149 -3.179 -7.067 258 HD23 LEU 37 HD23 LEU 37 -8.016 -4.905 -6.724 259 H PHE 38 HN PHE 38 -12.746 -3.232 -6.860 260 HA PHE 38 HA PHE 38 -15.040 -4.788 -7.081 261 HB2 PHE 38 HB2 PHE 38 -14.366 -6.757 -5.676 262 HB3 PHE 38 HB1 PHE 38 -13.658 -6.754 -7.284 263 HD1 PHE 38 HD1 PHE 38 -11.432 -7.222 -7.493 264 HD2 PHE 38 HD2 PHE 38 -12.851 -5.653 -3.804 265 HE1 PHE 38 HE1 PHE 38 -9.199 -7.512 -6.513 266 HE2 PHE 38 HE2 PHE 38 -10.618 -5.934 -2.817 267 HZ PHE 38 HZ PHE 38 -8.786 -6.866 -4.172 268 H SER 39 HN SER 39 -15.631 -5.593 -4.674 269 HA SER 39 HA SER 39 -14.546 -3.671 -2.736 270 HB2 SER 39 HB2 SER 39 -16.882 -3.706 -1.690 271 HB3 SER 39 HB1 SER 39 -16.711 -2.807 -3.195 272 HG SER 39 HG SER 39 -17.411 -4.897 -4.194 273 H GLU 40 HN GLU 40 -13.249 -5.001 -1.621 274 HA GLU 40 HA GLU 40 -14.390 -7.229 -0.149 275 HB2 GLU 40 HB2 GLU 40 -12.109 -7.611 -2.104 276 HB3 GLU 40 HB1 GLU 40 -12.547 -8.772 -0.862 277 HG2 GLU 40 HG2 GLU 40 -14.757 -9.029 -1.913 278 HG3 GLU 40 HG1 GLU 40 -14.262 -7.909 -3.179 279 H THR 41 HN THR 41 -12.907 -8.000 1.515 280 HA THR 41 HA THR 41 -11.219 -5.850 2.480 281 HB THR 41 HB THR 41 -11.822 -8.484 3.813 282 HG1 THR 41 HG1 THR 41 -13.310 -6.994 5.035 283 HG21 THR 41 HG21 THR 41 -10.824 -5.854 4.914 284 HG22 THR 41 HG22 THR 41 -9.865 -7.320 4.712 285 HG23 THR 41 HG23 THR 41 -11.197 -7.290 5.866 286 H VAL 42 HN VAL 42 -9.094 -5.798 2.251 287 HA VAL 42 HA VAL 42 -7.722 -8.274 1.428 288 HB VAL 42 HB VAL 42 -6.494 -7.113 -0.245 289 HG11 VAL 42 HG11 VAL 42 -9.355 -6.155 -0.362 290 HG12 VAL 42 HG12 VAL 42 -8.737 -7.701 -0.951 291 HG13 VAL 42 HG13 VAL 42 -8.230 -6.199 -1.723 292 HG21 VAL 42 HG21 VAL 42 -6.646 -4.696 -0.623 293 HG22 VAL 42 HG22 VAL 42 -6.026 -5.060 0.987 294 HG23 VAL 42 HG23 VAL 42 -7.700 -4.542 0.782 295 H LYS 43 HN LYS 43 -5.432 -8.304 1.947 296 HA LYS 43 HA LYS 43 -4.724 -6.469 4.125 297 HB2 LYS 43 HB2 LYS 43 -4.527 -8.858 4.661 298 HB3 LYS 43 HB1 LYS 43 -3.448 -9.080 3.292 299 HG2 LYS 43 HG2 LYS 43 -1.768 -7.704 4.316 300 HG3 LYS 43 HG1 LYS 43 -2.861 -7.288 5.637 301 HD2 LYS 43 HD2 LYS 43 -1.313 -8.972 6.384 302 HD3 LYS 43 HD1 LYS 43 -2.928 -9.673 6.281 303 HE2 LYS 43 HE2 LYS 43 -2.314 -10.591 4.049 304 HE3 LYS 43 HE1 LYS 43 -0.672 -10.002 4.307 305 HZ1 LYS 43 HZ1 LYS 43 -2.105 -12.005 5.960 306 HZ2 LYS 43 HZ2 LYS 43 -0.567 -11.396 6.309 307 HZ3 LYS 43 HZ3 LYS 43 -0.816 -12.311 4.907 308 H VAL 44 HN VAL 44 -3.329 -4.878 3.714 309 HA VAL 44 HA VAL 44 -2.080 -4.870 1.055 310 HB VAL 44 HB VAL 44 -1.780 -2.358 2.401 311 HG11 VAL 44 HG11 VAL 44 -2.996 -1.520 0.451 312 HG12 VAL 44 HG12 VAL 44 -3.437 -3.171 0.018 313 HG13 VAL 44 HG13 VAL 44 -1.744 -2.675 -0.007 314 HG21 VAL 44 HG21 VAL 44 -4.617 -3.383 2.315 315 HG22 VAL 44 HG22 VAL 44 -4.147 -1.706 2.596 316 HG23 VAL 44 HG23 VAL 44 -3.696 -2.952 3.759 317 H THR 45 HN THR 45 0.074 -4.051 0.843 318 HA THR 45 HA THR 45 1.816 -3.642 3.025 319 HB THR 45 HB THR 45 1.355 -6.097 3.318 320 HG1 THR 45 HG1 THR 45 3.285 -5.703 4.158 321 HG21 THR 45 HG21 THR 45 1.063 -6.695 0.958 322 HG22 THR 45 HG22 THR 45 2.326 -7.674 1.709 323 HG23 THR 45 HG23 THR 45 2.764 -6.332 0.653 324 H CYS 46 HN CYS 46 4.206 -4.046 2.117 325 HA CYS 46 HA CYS 46 4.210 -3.467 -0.758 326 HB2 CYS 46 HB2 CYS 46 6.241 -2.055 -0.379 327 HB3 CYS 46 HB1 CYS 46 4.768 -1.396 0.319 328 HG CYS 46 HG CYS 46 7.108 -0.979 1.936 329 H SER 47 HN SER 47 6.510 -3.900 -1.675 330 HA SER 47 HA SER 47 7.045 -6.635 -1.111 331 HB2 SER 47 HB2 SER 47 8.816 -6.404 -2.842 332 HB3 SER 47 HB1 SER 47 7.244 -5.824 -3.378 333 HG SER 47 HG SER 47 9.228 -4.483 -3.772 334 H LYS 48 HN LYS 48 9.671 -7.124 -1.120 335 HA LYS 48 HA LYS 48 10.347 -6.489 1.584 336 HB2 LYS 48 HB2 LYS 48 12.009 -7.835 -0.560 337 HB3 LYS 48 HB1 LYS 48 12.397 -7.796 1.154 338 HG2 LYS 48 HG2 LYS 48 10.377 -9.060 1.652 339 HG3 LYS 48 HG1 LYS 48 9.966 -9.082 -0.063 340 HD2 LYS 48 HD2 LYS 48 12.084 -10.285 -0.509 341 HD3 LYS 48 HD1 LYS 48 12.382 -10.340 1.229 342 HE2 LYS 48 HE2 LYS 48 10.344 -11.619 1.557 343 HE3 LYS 48 HE1 LYS 48 9.982 -11.517 -0.165 344 HZ1 LYS 48 HZ1 LYS 48 12.029 -12.760 -0.601 345 HZ2 LYS 48 HZ2 LYS 48 10.949 -13.638 0.356 346 HZ3 LYS 48 HZ3 LYS 48 12.299 -12.908 1.062 347 H ASP 49 HN ASP 49 11.227 -5.250 -1.540 348 HA ASP 49 HA ASP 49 13.262 -3.489 -0.394 349 HB2 ASP 49 HB2 ASP 49 12.290 -3.702 -3.253 350 HB3 ASP 49 HB1 ASP 49 13.661 -2.749 -2.689 351 H GLY 50 HN GLY 50 10.001 -3.502 -0.529 352 HA2 GLY 50 HA2 GLY 50 8.465 -1.821 -0.096 353 HA3 GLY 50 HA1 GLY 50 9.801 -0.686 -0.073 354 H GLU 51 HN GLU 51 9.993 -2.371 -2.903 355 HA GLU 51 HA GLU 51 9.430 0.038 -4.341 356 HB2 GLU 51 HB2 GLU 51 10.410 -2.676 -5.214 357 HB3 GLU 51 HB1 GLU 51 10.236 -1.303 -6.308 358 HG2 GLU 51 HG2 GLU 51 11.791 -0.031 -4.822 359 HG3 GLU 51 HG1 GLU 51 12.056 -1.524 -3.923 360 H GLU 52 HN GLU 52 7.616 -2.759 -3.630 361 HA GLU 52 HA GLU 52 5.621 -1.943 -5.639 362 HB2 GLU 52 HB2 GLU 52 6.697 -4.610 -5.007 363 HB3 GLU 52 HB1 GLU 52 4.955 -4.532 -5.179 364 HG2 GLU 52 HG2 GLU 52 5.233 -3.549 -7.406 365 HG3 GLU 52 HG1 GLU 52 6.984 -3.645 -7.223 366 H VAL 53 HN VAL 53 3.534 -1.820 -4.985 367 HA VAL 53 HA VAL 53 2.976 -2.362 -2.143 368 HB VAL 53 HB VAL 53 1.337 -0.723 -4.091 369 HG11 VAL 53 HG11 VAL 53 1.067 -1.060 -1.105 370 HG12 VAL 53 HG12 VAL 53 0.005 -1.767 -2.324 371 HG13 VAL 53 HG13 VAL 53 0.078 -0.016 -2.126 372 HG21 VAL 53 HG21 VAL 53 3.429 0.399 -3.606 373 HG22 VAL 53 HG22 VAL 53 3.167 0.185 -1.875 374 HG23 VAL 53 HG23 VAL 53 2.092 1.229 -2.808 375 H GLN 54 HN GLN 54 2.102 -4.319 -1.866 376 HA GLN 54 HA GLN 54 0.311 -5.321 -3.973 377 HB2 GLN 54 HB2 GLN 54 1.499 -7.503 -2.547 378 HB3 GLN 54 HB1 GLN 54 1.569 -7.140 -4.264 379 HG2 GLN 54 HG2 GLN 54 3.445 -5.521 -3.670 380 HG3 GLN 54 HG1 GLN 54 3.476 -6.326 -2.102 381 HE21 GLN 54 HE21 GLN 54 5.482 -7.195 -2.357 382 HE22 GLN 54 HE22 GLN 54 5.847 -8.449 -3.483 383 H TRP 55 HN TRP 55 -1.206 -6.988 -3.200 384 HA TRP 55 HA TRP 55 -1.875 -6.711 -0.382 385 HB2 TRP 55 HB2 TRP 55 -4.329 -6.362 -1.135 386 HB3 TRP 55 HB1 TRP 55 -3.236 -4.985 -1.126 387 HD1 TRP 55 HD1 TRP 55 -4.966 -7.393 -3.600 388 HE1 TRP 55 HE1 TRP 55 -5.049 -6.237 -5.906 389 HE3 TRP 55 HE3 TRP 55 -2.194 -3.244 -2.522 390 HZ2 TRP 55 HZ2 TRP 55 -4.066 -3.872 -7.096 391 HZ3 TRP 55 HZ3 TRP 55 -1.813 -1.585 -4.291 392 HH2 TRP 55 HH2 TRP 55 -2.726 -1.886 -6.533 393 H PHE 56 HN PHE 56 -2.889 -8.358 0.512 394 HA PHE 56 HA PHE 56 -3.385 -10.730 -1.148 395 HB2 PHE 56 HB2 PHE 56 -3.089 -10.467 1.858 396 HB3 PHE 56 HB1 PHE 56 -3.332 -11.974 0.989 397 HD1 PHE 56 HD1 PHE 56 -1.523 -13.133 0.040 398 HD2 PHE 56 HD2 PHE 56 -0.961 -9.188 1.530 399 HE1 PHE 56 HE1 PHE 56 0.913 -13.405 -0.168 400 HE2 PHE 56 HE2 PHE 56 1.475 -9.452 1.320 401 HZ PHE 56 HZ PHE 56 2.417 -11.563 0.471 402 H LYS 57 HN LYS 57 -5.412 -10.516 -1.889 403 HA LYS 57 HA LYS 57 -7.549 -9.288 -0.519 404 HB2 LYS 57 HB2 LYS 57 -7.684 -11.369 -2.712 405 HB3 LYS 57 HB1 LYS 57 -8.959 -10.243 -2.265 406 HG2 LYS 57 HG2 LYS 57 -7.742 -8.390 -3.083 407 HG3 LYS 57 HG1 LYS 57 -6.270 -9.348 -3.259 408 HD2 LYS 57 HD2 LYS 57 -7.473 -10.737 -4.955 409 HD3 LYS 57 HD1 LYS 57 -8.814 -9.595 -4.857 410 HE2 LYS 57 HE2 LYS 57 -7.387 -7.797 -5.614 411 HE3 LYS 57 HE1 LYS 57 -5.983 -8.861 -5.590 412 HZ1 LYS 57 HZ1 LYS 57 -6.940 -10.162 -7.349 413 HZ2 LYS 57 HZ2 LYS 57 -6.899 -8.541 -7.826 414 HZ3 LYS 57 HZ3 LYS 57 -8.357 -9.240 -7.330 415 H GLY 58 HN GLY 58 -9.576 -10.476 0.125 416 HA2 GLY 58 HA2 GLY 58 -8.852 -12.293 2.190 417 HA3 GLY 58 HA1 GLY 58 -10.479 -11.766 1.795 418 H LYS 59 HN LYS 59 -8.332 -13.328 -0.460 419 HA LYS 59 HA LYS 59 -9.749 -15.876 -0.203 420 HB2 LYS 59 HB2 LYS 59 -9.273 -14.371 -2.789 421 HB3 LYS 59 HB1 LYS 59 -9.867 -16.023 -2.689 422 HG2 LYS 59 HG2 LYS 59 -11.912 -15.352 -1.768 423 HG3 LYS 59 HG1 LYS 59 -11.297 -13.756 -1.345 424 HD2 LYS 59 HD2 LYS 59 -11.733 -14.777 -4.152 425 HD3 LYS 59 HD1 LYS 59 -12.820 -13.695 -3.278 426 HE2 LYS 59 HE2 LYS 59 -10.790 -12.156 -3.036 427 HE3 LYS 59 HE1 LYS 59 -10.037 -13.158 -4.274 428 HZ1 LYS 59 HZ1 LYS 59 -12.458 -11.472 -4.508 429 HZ2 LYS 59 HZ2 LYS 59 -12.087 -12.674 -5.641 430 HZ3 LYS 59 HZ3 LYS 59 -11.026 -11.381 -5.405 431 H SER 60 HN SER 60 -7.008 -14.297 0.058 432 HA SER 60 HA SER 60 -5.381 -16.649 -0.279 433 HB2 SER 60 HB2 SER 60 -4.739 -14.117 -1.824 434 HB3 SER 60 HB1 SER 60 -3.655 -15.496 -1.650 435 HG SER 60 HG SER 60 -6.143 -16.206 -2.533 436 H THR 61 HN THR 61 -4.304 -16.746 1.587 437 HA THR 61 HA THR 61 -4.019 -14.350 3.204 438 HB THR 61 HB THR 61 -3.214 -17.169 3.934 439 HG1 THR 61 HG1 THR 61 -5.713 -15.852 4.357 440 HG21 THR 61 HG21 THR 61 -3.950 -14.776 5.624 441 HG22 THR 61 HG22 THR 61 -2.322 -15.410 5.389 442 HG23 THR 61 HG23 THR 61 -3.532 -16.378 6.231 443 H ALA 62 HN ALA 62 -1.905 -16.914 1.909 444 HA ALA 62 HA ALA 62 0.311 -15.145 1.614 445 HB1 ALA 62 HB1 ALA 62 0.370 -15.458 4.050 446 HB2 ALA 62 HB2 ALA 62 1.792 -16.129 3.254 447 HB3 ALA 62 HB3 ALA 62 0.505 -17.201 3.811 448 H GLY 63 HN GLY 63 1.580 -15.905 0.049 449 HA2 GLY 63 HA2 GLY 63 1.124 -18.456 -1.119 450 HA3 GLY 63 HA1 GLY 63 2.354 -17.302 -1.593 451 H ALA 64 HN ALA 64 1.742 -20.242 -0.216 452 HA ALA 64 HA ALA 64 3.002 -21.874 0.722 453 HB1 ALA 64 HB1 ALA 64 5.294 -22.058 -0.053 454 HB2 ALA 64 HB2 ALA 64 5.271 -20.374 -0.574 455 HB3 ALA 64 HB3 ALA 64 4.233 -21.557 -1.369 456 H GLN 65 HN GLN 65 2.330 -20.049 2.560 457 HA GLN 65 HA GLN 65 2.712 -19.617 4.744 458 HB2 GLN 65 HB2 GLN 65 5.336 -21.047 4.320 459 HB3 GLN 65 HB1 GLN 65 4.694 -20.555 5.881 460 HG2 GLN 65 HG2 GLN 65 3.461 -22.543 3.987 461 HG3 GLN 65 HG1 GLN 65 4.291 -22.906 5.499 462 HE21 GLN 65 HE21 GLN 65 1.390 -21.711 4.034 463 HE22 GLN 65 HE22 GLN 65 0.425 -21.692 5.469 464 H ASP 66 HN ASP 66 5.624 -19.041 2.795 465 HA ASP 66 HA ASP 66 6.448 -16.858 4.495 466 HB2 ASP 66 HB2 ASP 66 7.558 -17.924 1.899 467 HB3 ASP 66 HB1 ASP 66 8.278 -16.591 2.794 468 H ARG 67 HN ARG 67 3.996 -16.973 2.581 469 HA ARG 67 HA ARG 67 2.666 -15.528 1.489 470 HB2 ARG 67 HB2 ARG 67 4.087 -13.103 2.392 471 HB3 ARG 67 HB1 ARG 67 2.379 -13.513 2.453 472 HG2 ARG 67 HG2 ARG 67 2.704 -14.834 4.426 473 HG3 ARG 67 HG1 ARG 67 4.453 -14.617 4.332 474 HD2 ARG 67 HD2 ARG 67 4.165 -12.206 4.624 475 HD3 ARG 67 HD1 ARG 67 2.419 -12.427 4.721 476 HE ARG 67 HE ARG 67 3.862 -13.970 6.660 477 HH11 ARG 67 HH11 ARG 67 2.536 -10.818 5.945 478 HH12 ARG 67 HH12 ARG 67 2.317 -10.386 7.609 479 HH21 ARG 67 HH21 ARG 67 3.589 -13.394 8.867 480 HH22 ARG 67 HH22 ARG 67 2.920 -11.845 9.267 481 H LYS 68 HN LYS 68 4.257 -16.438 -0.371 482 HA LYS 68 HA LYS 68 5.395 -14.083 -1.718 483 HB2 LYS 68 HB2 LYS 68 5.700 -17.003 -2.402 484 HB3 LYS 68 HB1 LYS 68 6.410 -15.681 -3.310 485 HG2 LYS 68 HG2 LYS 68 8.197 -16.191 -2.045 486 HG3 LYS 68 HG1 LYS 68 7.397 -15.114 -0.900 487 HD2 LYS 68 HD2 LYS 68 8.082 -17.118 0.241 488 HD3 LYS 68 HD1 LYS 68 6.321 -17.079 0.136 489 HE2 LYS 68 HE2 LYS 68 7.215 -19.314 -0.339 490 HE3 LYS 68 HE1 LYS 68 6.377 -18.640 -1.731 491 HZ1 LYS 68 HZ1 LYS 68 8.546 -18.018 -2.653 492 HZ2 LYS 68 HZ2 LYS 68 8.417 -19.684 -2.414 493 HZ3 LYS 68 HZ3 LYS 68 9.319 -18.746 -1.336 494 H LYS 69 HN LYS 69 2.502 -14.791 -1.465 495 HA LYS 69 HA LYS 69 1.894 -14.744 -4.323 496 HB2 LYS 69 HB2 LYS 69 1.526 -17.025 -3.577 497 HB3 LYS 69 HB1 LYS 69 0.510 -16.471 -2.264 498 HG2 LYS 69 HG2 LYS 69 -0.726 -17.426 -4.205 499 HG3 LYS 69 HG1 LYS 69 -1.207 -15.787 -3.768 500 HD2 LYS 69 HD2 LYS 69 -1.044 -16.026 -6.181 501 HD3 LYS 69 HD1 LYS 69 0.172 -14.901 -5.584 502 HE2 LYS 69 HE2 LYS 69 1.859 -16.674 -5.697 503 HE3 LYS 69 HE1 LYS 69 0.638 -17.792 -6.303 504 HZ1 LYS 69 HZ1 LYS 69 1.448 -15.283 -7.665 505 HZ2 LYS 69 HZ2 LYS 69 0.382 -16.450 -8.260 506 HZ3 LYS 69 HZ3 LYS 69 2.019 -16.820 -8.069 507 HA PRO 70 HA PRO 70 -0.604 -11.385 -2.421 508 HB2 PRO 70 HB2 PRO 70 0.571 -9.762 -4.534 509 HB3 PRO 70 HB1 PRO 70 0.554 -9.469 -2.793 510 HG2 PRO 70 HG2 PRO 70 2.808 -10.092 -4.167 511 HG3 PRO 70 HG1 PRO 70 2.568 -10.518 -2.465 512 HD2 PRO 70 HD2 PRO 70 2.294 -12.231 -4.910 513 HD3 PRO 70 HD1 PRO 70 2.981 -12.637 -3.321 514 H SER 71 HN SER 71 -2.535 -10.787 -3.407 515 HA SER 71 HA SER 71 -3.077 -12.213 -5.894 516 HB2 SER 71 HB2 SER 71 -4.545 -12.527 -3.895 517 HB3 SER 71 HB1 SER 71 -5.018 -10.836 -4.027 518 HG SER 71 HG SER 71 -5.273 -12.291 -6.359 519 H GLY 72 HN GLY 72 -1.818 -9.398 -5.287 520 HA2 GLY 72 HA2 GLY 72 -2.238 -8.262 -7.758 521 HA3 GLY 72 HA1 GLY 72 -3.448 -7.546 -6.698 522 H GLY 73 HN GLY 73 -1.573 -5.934 -7.834 523 HA2 GLY 73 HA2 GLY 73 -0.570 -4.469 -5.746 524 HA3 GLY 73 HA1 GLY 73 0.718 -5.592 -6.161 525 H PHE 74 HN PHE 74 1.232 -2.968 -6.377 526 HA PHE 74 HA PHE 74 1.821 -2.776 -9.189 527 HB2 PHE 74 HB2 PHE 74 0.820 -0.634 -9.596 528 HB3 PHE 74 HB1 PHE 74 -0.428 -1.709 -9.002 529 HD1 PHE 74 HD1 PHE 74 -0.288 -1.577 -6.138 530 HD2 PHE 74 HD2 PHE 74 0.402 1.494 -8.993 531 HE1 PHE 74 HE1 PHE 74 -0.927 0.120 -4.472 532 HE2 PHE 74 HE2 PHE 74 -0.232 3.185 -7.345 533 HZ PHE 74 HZ PHE 74 -0.899 2.505 -5.073 534 HA PRO 75 HA PRO 75 5.524 -1.041 -7.678 535 HB2 PRO 75 HB2 PRO 75 5.664 0.865 -9.884 536 HB3 PRO 75 HB1 PRO 75 6.679 -0.538 -9.556 537 HG2 PRO 75 HG2 PRO 75 4.923 -0.462 -11.608 538 HG3 PRO 75 HG1 PRO 75 5.328 -1.959 -10.752 539 HD2 PRO 75 HD2 PRO 75 2.906 -0.222 -10.495 540 HD3 PRO 75 HD1 PRO 75 3.044 -1.990 -10.463 541 H VAL 76 HN VAL 76 6.219 0.484 -6.359 542 HA VAL 76 HA VAL 76 4.500 2.512 -5.424 543 HB VAL 76 HB VAL 76 7.410 1.910 -4.915 544 HG11 VAL 76 HG11 VAL 76 5.705 3.944 -3.486 545 HG12 VAL 76 HG12 VAL 76 7.030 4.316 -4.586 546 HG13 VAL 76 HG13 VAL 76 7.353 3.481 -3.066 547 HG21 VAL 76 HG21 VAL 76 4.959 1.600 -3.194 548 HG22 VAL 76 HG22 VAL 76 6.599 1.096 -2.789 549 HG23 VAL 76 HG23 VAL 76 5.734 0.306 -4.106 550 H ASP 77 HN ASP 77 7.275 2.558 -7.585 551 HA ASP 77 HA ASP 77 7.541 5.380 -7.701 552 HB2 ASP 77 HB2 ASP 77 9.390 3.961 -8.341 553 HB3 ASP 77 HB1 ASP 77 8.426 3.191 -9.593 554 H LYS 78 HN LYS 78 5.303 3.200 -9.083 555 HA LYS 78 HA LYS 78 4.725 4.939 -11.349 556 HB2 LYS 78 HB2 LYS 78 4.020 2.119 -10.649 557 HB3 LYS 78 HB1 LYS 78 3.039 2.988 -11.819 558 HG2 LYS 78 HG2 LYS 78 4.708 1.672 -12.952 559 HG3 LYS 78 HG1 LYS 78 5.044 3.386 -13.185 560 HD2 LYS 78 HD2 LYS 78 6.647 3.139 -11.194 561 HD3 LYS 78 HD1 LYS 78 6.485 1.402 -11.451 562 HE2 LYS 78 HE2 LYS 78 8.409 2.044 -12.640 563 HE3 LYS 78 HE1 LYS 78 7.147 1.825 -13.851 564 HZ1 LYS 78 HZ1 LYS 78 8.379 3.827 -14.294 565 HZ2 LYS 78 HZ2 LYS 78 8.087 4.413 -12.732 566 HZ3 LYS 78 HZ3 LYS 78 6.806 4.241 -13.828 567 H ILE 79 HN ILE 79 3.657 4.576 -8.191 568 HA ILE 79 HA ILE 79 0.897 5.105 -8.482 569 HB ILE 79 HB ILE 79 2.564 6.176 -6.215 570 HG12 ILE 79 HG12 ILE 79 1.531 3.354 -6.569 571 HG13 ILE 79 HG11 ILE 79 3.219 3.843 -6.512 572 HG21 ILE 79 HG21 ILE 79 0.251 6.878 -6.265 573 HG22 ILE 79 HG22 ILE 79 0.500 5.747 -4.934 574 HG23 ILE 79 HG23 ILE 79 -0.283 5.205 -6.419 575 HD11 ILE 79 HD11 ILE 79 2.852 4.624 -4.189 576 HD12 ILE 79 HD12 ILE 79 2.617 2.889 -4.408 577 HD13 ILE 79 HD13 ILE 79 1.221 3.958 -4.269 578 H THR 80 HN THR 80 -0.015 6.864 -9.394 579 HA THR 80 HA THR 80 1.661 9.117 -10.009 580 HB THR 80 HB THR 80 0.096 8.309 -11.699 581 HG1 THR 80 HG1 THR 80 -0.140 10.950 -10.727 582 HG21 THR 80 HG21 THR 80 -2.304 8.758 -11.510 583 HG22 THR 80 HG22 THR 80 -2.066 9.284 -9.843 584 HG23 THR 80 HG23 THR 80 -1.754 7.605 -10.294 585 H SER 81 HN SER 81 -1.027 8.433 -7.830 586 HA SER 81 HA SER 81 -0.393 10.800 -6.314 587 HB2 SER 81 HB2 SER 81 -3.112 10.560 -7.622 588 HB3 SER 81 HB1 SER 81 -2.651 11.778 -6.434 589 HG SER 81 HG SER 81 -0.820 11.900 -8.290 590 H VAL 82 HN VAL 82 -0.812 10.533 -4.241 591 HA VAL 82 HA VAL 82 -2.764 8.488 -3.420 592 HB VAL 82 HB VAL 82 -0.126 9.211 -2.119 593 HG11 VAL 82 HG11 VAL 82 -0.711 7.696 -0.303 594 HG12 VAL 82 HG12 VAL 82 -2.309 7.452 -1.006 595 HG13 VAL 82 HG13 VAL 82 -1.850 9.039 -0.389 596 HG21 VAL 82 HG21 VAL 82 -1.228 6.589 -3.111 597 HG22 VAL 82 HG22 VAL 82 0.351 6.834 -2.362 598 HG23 VAL 82 HG23 VAL 82 -0.010 7.573 -3.923 599 H LYS 83 HN LYS 83 -4.508 9.608 -2.795 600 HA LYS 83 HA LYS 83 -4.079 11.929 -1.050 601 HB2 LYS 83 HB2 LYS 83 -6.450 11.962 -2.831 602 HB3 LYS 83 HB1 LYS 83 -5.493 13.296 -2.218 603 HG2 LYS 83 HG2 LYS 83 -4.914 13.417 -4.398 604 HG3 LYS 83 HG1 LYS 83 -3.690 12.269 -3.868 605 HD2 LYS 83 HD2 LYS 83 -4.683 11.467 -5.910 606 HD3 LYS 83 HD1 LYS 83 -5.188 10.422 -4.580 607 HE2 LYS 83 HE2 LYS 83 -7.050 10.928 -6.087 608 HE3 LYS 83 HE1 LYS 83 -7.335 11.566 -4.473 609 HZ1 LYS 83 HZ1 LYS 83 -6.289 13.182 -6.727 610 HZ2 LYS 83 HZ2 LYS 83 -6.789 13.748 -5.215 611 HZ3 LYS 83 HZ3 LYS 83 -7.921 13.112 -6.295 612 H SER 84 HN SER 84 -5.961 12.474 0.243 613 HA SER 84 HA SER 84 -7.727 10.185 0.725 614 HB2 SER 84 HB2 SER 84 -8.183 11.361 2.920 615 HB3 SER 84 HB1 SER 84 -6.538 10.767 2.721 616 HG SER 84 HG SER 84 -5.920 12.734 3.051 617 H GLN 85 HN GLN 85 -9.999 10.656 1.032 618 HA GLN 85 HA GLN 85 -11.056 12.344 -0.954 619 HB2 GLN 85 HB2 GLN 85 -12.030 10.411 0.916 620 HB3 GLN 85 HB1 GLN 85 -13.082 11.818 0.944 621 HG2 GLN 85 HG2 GLN 85 -13.968 10.311 -0.641 622 HG3 GLN 85 HG1 GLN 85 -13.237 11.635 -1.543 623 HE21 GLN 85 HE21 GLN 85 -11.428 9.070 -0.003 624 HE22 GLN 85 HE22 GLN 85 -10.877 8.326 -1.459 625 H ALA 86 HN ALA 86 -13.052 13.855 -0.220 626 HA ALA 86 HA ALA 86 -11.879 16.220 0.661 627 HB1 ALA 86 HB1 ALA 86 -13.925 16.131 -0.681 628 HB2 ALA 86 HB2 ALA 86 -14.138 17.131 0.757 629 HB3 ALA 86 HB3 ALA 86 -14.807 15.500 0.710 630 H ASP 87 HN ASP 87 -13.977 13.989 2.452 631 HA ASP 87 HA ASP 87 -12.921 15.154 4.951 632 HB2 ASP 87 HB2 ASP 87 -15.339 15.487 4.814 633 HB3 ASP 87 HB1 ASP 87 -15.579 13.775 4.484 634 H ASN 88 HN ASN 88 -13.447 12.392 2.998 635 HA ASN 88 HA ASN 88 -12.780 10.227 3.117 636 HB2 ASN 88 HB2 ASN 88 -10.384 9.955 3.585 637 HB3 ASN 88 HB1 ASN 88 -10.714 11.317 2.529 638 HD21 ASN 88 HD21 ASN 88 -9.617 10.339 5.674 639 HD22 ASN 88 HD22 ASN 88 -8.971 11.869 6.149 640 H THR 89 HN THR 89 -14.471 10.499 5.171 641 HA THR 89 HA THR 89 -13.664 10.089 7.756 642 HB THR 89 HB THR 89 -15.920 8.549 6.470 643 HG1 THR 89 HG1 THR 89 -15.629 11.277 7.030 644 HG21 THR 89 HG21 THR 89 -15.463 9.527 9.289 645 HG22 THR 89 HG22 THR 89 -15.443 7.849 8.735 646 HG23 THR 89 HG23 THR 89 -16.948 8.771 8.710 647 H LYS 90 HN LYS 90 -14.648 7.348 5.689 648 HA LYS 90 HA LYS 90 -12.360 5.897 6.800 649 HB2 LYS 90 HB2 LYS 90 -13.637 3.815 6.261 650 HB3 LYS 90 HB1 LYS 90 -14.316 4.823 7.532 651 HG2 LYS 90 HG2 LYS 90 -15.998 5.664 6.043 652 HG3 LYS 90 HG1 LYS 90 -15.269 4.816 4.678 653 HD2 LYS 90 HD2 LYS 90 -17.259 3.663 5.628 654 HD3 LYS 90 HD1 LYS 90 -15.793 2.683 5.647 655 HE2 LYS 90 HE2 LYS 90 -16.924 2.409 7.743 656 HE3 LYS 90 HE1 LYS 90 -15.450 3.337 8.014 657 HZ1 LYS 90 HZ1 LYS 90 -16.805 5.364 8.002 658 HZ2 LYS 90 HZ2 LYS 90 -17.274 4.300 9.227 659 HZ3 LYS 90 HZ3 LYS 90 -18.201 4.432 7.822 660 H VAL 91 HN VAL 91 -12.847 7.612 4.198 661 HA VAL 91 HA VAL 91 -12.372 5.505 2.194 662 HB VAL 91 HB VAL 91 -13.303 8.301 1.602 663 HG11 VAL 91 HG11 VAL 91 -14.181 7.260 -0.438 664 HG12 VAL 91 HG12 VAL 91 -13.553 5.699 0.090 665 HG13 VAL 91 HG13 VAL 91 -12.441 7.018 -0.279 666 HG21 VAL 91 HG21 VAL 91 -15.602 7.433 1.571 667 HG22 VAL 91 HG22 VAL 91 -14.886 7.343 3.179 668 HG23 VAL 91 HG23 VAL 91 -15.021 5.888 2.192 669 H LEU 92 HN LEU 92 -10.424 5.381 1.307 670 HA LEU 92 HA LEU 92 -8.787 7.819 1.039 671 HB2 LEU 92 HB2 LEU 92 -8.096 4.950 1.451 672 HB3 LEU 92 HB1 LEU 92 -7.001 5.937 0.507 673 HG LEU 92 HG LEU 92 -6.623 7.415 2.376 674 HD11 LEU 92 HD11 LEU 92 -7.603 6.990 4.577 675 HD12 LEU 92 HD12 LEU 92 -8.600 5.710 3.884 676 HD13 LEU 92 HD13 LEU 92 -8.839 7.384 3.382 677 HD21 LEU 92 HD21 LEU 92 -5.240 5.441 2.231 678 HD22 LEU 92 HD22 LEU 92 -6.434 4.505 3.133 679 HD23 LEU 92 HD23 LEU 92 -5.565 5.820 3.923 680 H VAL 93 HN VAL 93 -7.678 8.157 -0.991 681 HA VAL 93 HA VAL 93 -8.715 6.574 -3.227 682 HB VAL 93 HB VAL 93 -10.156 8.423 -3.319 683 HG11 VAL 93 HG11 VAL 93 -7.757 10.157 -2.779 684 HG12 VAL 93 HG12 VAL 93 -9.160 9.897 -1.736 685 HG13 VAL 93 HG13 VAL 93 -9.337 10.779 -3.254 686 HG21 VAL 93 HG21 VAL 93 -7.864 9.012 -5.186 687 HG22 VAL 93 HG22 VAL 93 -9.499 9.654 -5.345 688 HG23 VAL 93 HG23 VAL 93 -9.215 7.918 -5.489 689 H ILE 94 HN ILE 94 -7.034 5.672 -4.158 690 HA ILE 94 HA ILE 94 -4.563 7.245 -4.529 691 HB ILE 94 HB ILE 94 -4.889 4.364 -3.702 692 HG12 ILE 94 HG12 ILE 94 -3.049 5.103 -2.067 693 HG13 ILE 94 HG11 ILE 94 -3.428 6.744 -2.569 694 HG21 ILE 94 HG21 ILE 94 -2.384 5.622 -4.810 695 HG22 ILE 94 HG22 ILE 94 -3.348 4.361 -5.577 696 HG23 ILE 94 HG23 ILE 94 -2.493 4.024 -4.072 697 HD11 ILE 94 HD11 ILE 94 -5.385 4.822 -1.341 698 HD12 ILE 94 HD12 ILE 94 -5.686 6.509 -1.755 699 HD13 ILE 94 HD13 ILE 94 -4.534 6.105 -0.481 700 H THR 95 HN THR 95 -3.769 7.299 -6.575 701 HA THR 95 HA THR 95 -4.975 5.473 -8.562 702 HB THR 95 HB THR 95 -4.222 8.359 -9.076 703 HG1 THR 95 HG1 THR 95 -6.810 7.206 -8.665 704 HG21 THR 95 HG21 THR 95 -5.816 6.369 -10.704 705 HG22 THR 95 HG22 THR 95 -4.181 6.928 -11.062 706 HG23 THR 95 HG23 THR 95 -5.534 8.057 -11.132 707 H VAL 96 HN VAL 96 -3.612 4.754 -10.239 708 HA VAL 96 HA VAL 96 -0.756 5.327 -9.871 709 HB VAL 96 HB VAL 96 -0.997 3.137 -9.119 710 HG11 VAL 96 HG11 VAL 96 -2.293 1.405 -10.220 711 HG12 VAL 96 HG12 VAL 96 -2.746 2.540 -11.494 712 HG13 VAL 96 HG13 VAL 96 -3.304 2.801 -9.842 713 HG21 VAL 96 HG21 VAL 96 -0.254 3.017 -12.028 714 HG22 VAL 96 HG22 VAL 96 -0.004 1.692 -10.892 715 HG23 VAL 96 HG23 VAL 96 0.830 3.229 -10.653 716 H ASN 97 HN ASN 97 0.555 5.518 -11.702 717 HA ASN 97 HA ASN 97 -0.844 5.546 -14.297 718 HB2 ASN 97 HB2 ASN 97 0.449 7.358 -15.050 719 HB3 ASN 97 HB1 ASN 97 0.018 7.801 -13.409 720 HD21 ASN 97 HD21 ASN 97 1.642 7.794 -11.810 721 HD22 ASN 97 HD22 ASN 97 3.317 7.784 -12.213 722 H ASN 98 HN ASN 98 0.305 4.773 -16.087 723 HA ASN 98 HA ASN 98 1.927 3.722 -17.286 724 HB2 ASN 98 HB2 ASN 98 3.731 4.436 -15.813 725 HB3 ASN 98 HB1 ASN 98 3.373 3.129 -14.702 726 HD21 ASN 98 HD21 ASN 98 3.888 0.990 -15.314 727 HD22 ASN 98 HD22 ASN 98 4.997 0.667 -16.599 728 HA PRO 99 HA PRO 99 0.597 -0.697 -15.708 729 HB2 PRO 99 HB2 PRO 99 -0.557 0.069 -13.069 730 HB3 PRO 99 HB1 PRO 99 0.250 -1.428 -13.550 731 HG2 PRO 99 HG2 PRO 99 1.495 0.349 -12.026 732 HG3 PRO 99 HG1 PRO 99 2.363 -0.513 -13.310 733 HD2 PRO 99 HD2 PRO 99 1.327 2.289 -13.267 734 HD3 PRO 99 HD1 PRO 99 2.840 1.647 -13.937 735 H GLN 100 HN GLN 100 -1.744 -1.440 -15.471 736 HA GLN 100 HA GLN 100 -3.391 0.249 -16.987 737 HB2 GLN 100 HB2 GLN 100 -4.226 -2.077 -15.241 738 HB3 GLN 100 HB1 GLN 100 -5.166 -1.382 -16.556 739 HG2 GLN 100 HG2 GLN 100 -3.463 -2.066 -18.152 740 HG3 GLN 100 HG1 GLN 100 -2.494 -2.736 -16.844 741 HE21 GLN 100 HE21 GLN 100 -4.875 -3.760 -15.445 742 HE22 GLN 100 HE22 GLN 100 -5.373 -5.155 -16.337 743 HA PRO 101 HA PRO 101 -4.246 3.289 -13.927 744 HB2 PRO 101 HB2 PRO 101 -6.616 4.178 -15.150 745 HB3 PRO 101 HB1 PRO 101 -4.991 4.817 -15.396 746 HG2 PRO 101 HG2 PRO 101 -6.539 2.891 -17.045 747 HG3 PRO 101 HG1 PRO 101 -5.352 4.106 -17.550 748 HD2 PRO 101 HD2 PRO 101 -4.758 1.493 -17.490 749 HD3 PRO 101 HD1 PRO 101 -3.553 2.729 -17.068 750 H THR 102 HN THR 102 -4.999 2.876 -12.039 751 HA THR 102 HA THR 102 -7.749 1.988 -11.690 752 HB THR 102 HB THR 102 -5.482 0.583 -10.260 753 HG1 THR 102 HG1 THR 102 -5.464 0.089 -12.536 754 HG21 THR 102 HG21 THR 102 -8.384 -0.161 -10.599 755 HG22 THR 102 HG22 THR 102 -7.705 0.600 -9.162 756 HG23 THR 102 HG23 THR 102 -7.185 -1.018 -9.634 757 H THR 103 HN THR 103 -8.659 2.756 -9.808 758 HA THR 103 HA THR 103 -6.895 4.339 -8.062 759 HB THR 103 HB THR 103 -9.774 4.931 -8.754 760 HG1 THR 103 HG1 THR 103 -8.709 5.637 -10.480 761 HG21 THR 103 HG21 THR 103 -9.392 7.040 -7.554 762 HG22 THR 103 HG22 THR 103 -7.777 6.487 -7.111 763 HG23 THR 103 HG23 THR 103 -9.198 5.646 -6.492 764 H TYR 104 HN TYR 104 -6.668 3.331 -6.224 765 HA TYR 104 HA TYR 104 -8.667 1.396 -5.363 766 HB2 TYR 104 HB2 TYR 104 -5.913 1.965 -4.253 767 HB3 TYR 104 HB1 TYR 104 -6.935 0.588 -3.852 768 HD1 TYR 104 HD1 TYR 104 -7.452 -1.108 -5.626 769 HD2 TYR 104 HD2 TYR 104 -4.513 1.928 -6.163 770 HE1 TYR 104 HE1 TYR 104 -6.459 -2.388 -7.488 771 HE2 TYR 104 HE2 TYR 104 -3.524 0.661 -8.023 772 HH TYR 104 HH TYR 104 -5.080 -1.939 -9.505 773 H ASN 105 HN ASN 105 -10.082 1.820 -3.806 774 HA ASN 105 HA ASN 105 -9.554 4.101 -2.041 775 HB2 ASN 105 HB2 ASN 105 -12.154 2.615 -2.508 776 HB3 ASN 105 HB1 ASN 105 -11.935 3.946 -1.379 777 HD21 ASN 105 HD21 ASN 105 -10.672 3.624 -4.661 778 HD22 ASN 105 HD22 ASN 105 -11.505 4.999 -5.300 779 H PHE 106 HN PHE 106 -8.431 3.463 -0.337 780 HA PHE 106 HA PHE 106 -8.846 0.839 0.816 781 HB2 PHE 106 HB2 PHE 106 -7.061 3.108 1.732 782 HB3 PHE 106 HB1 PHE 106 -7.050 1.474 2.379 783 HD1 PHE 106 HD1 PHE 106 -6.756 -0.384 0.466 784 HD2 PHE 106 HD2 PHE 106 -5.401 3.639 0.231 785 HE1 PHE 106 HE1 PHE 106 -5.087 -1.046 -1.217 786 HE2 PHE 106 HE2 PHE 106 -3.737 2.988 -1.454 787 HZ PHE 106 HZ PHE 106 -3.551 0.673 -2.169 788 H THR 107 HN THR 107 -10.532 0.535 2.075 789 HA THR 107 HA THR 107 -11.362 2.709 3.884 790 HB THR 107 HB THR 107 -13.132 0.595 2.628 791 HG1 THR 107 HG1 THR 107 -12.157 2.527 1.367 792 HG21 THR 107 HG21 THR 107 -13.953 1.355 4.788 793 HG22 THR 107 HG22 THR 107 -14.965 1.999 3.495 794 HG23 THR 107 HG23 THR 107 -13.776 3.035 4.286 795 H PHE 108 HN PHE 108 -11.642 2.195 6.022 796 HA PHE 108 HA PHE 108 -11.727 -0.625 6.762 797 HB2 PHE 108 HB2 PHE 108 -9.317 0.321 6.891 798 HB3 PHE 108 HB1 PHE 108 -9.905 1.270 8.246 799 HD1 PHE 108 HD1 PHE 108 -9.339 0.424 10.289 800 HD2 PHE 108 HD2 PHE 108 -10.224 -2.277 7.126 801 HE1 PHE 108 HE1 PHE 108 -8.959 -1.471 11.809 802 HE2 PHE 108 HE2 PHE 108 -9.845 -4.178 8.639 803 HZ PHE 108 HZ PHE 108 -9.213 -3.776 10.984 804 H LYS 109 HN LYS 109 -12.132 -0.741 9.232 805 HA LYS 109 HA LYS 109 -14.491 0.670 9.891 806 HB2 LYS 109 HB2 LYS 109 -13.574 -1.595 10.776 807 HB3 LYS 109 HB1 LYS 109 -12.598 -0.602 11.862 808 HG2 LYS 109 HG2 LYS 109 -15.599 -0.401 11.749 809 HG3 LYS 109 HG1 LYS 109 -14.757 -1.547 12.790 810 HD2 LYS 109 HD2 LYS 109 -13.548 0.343 13.828 811 HD3 LYS 109 HD1 LYS 109 -14.487 1.456 12.836 812 HE2 LYS 109 HE2 LYS 109 -15.585 -0.465 14.885 813 HE3 LYS 109 HE1 LYS 109 -15.418 1.278 15.082 814 HZ1 LYS 109 HZ1 LYS 109 -17.188 -0.130 13.162 815 HZ2 LYS 109 HZ2 LYS 109 -16.950 1.543 13.183 816 HZ3 LYS 109 HZ3 LYS 109 -17.661 0.778 14.507 817 H SER 110 HN SER 110 -11.186 0.816 10.990 818 HA SER 110 HA SER 110 -11.657 2.806 12.965 819 HB2 SER 110 HB2 SER 110 -9.064 1.706 11.878 820 HB3 SER 110 HB1 SER 110 -9.303 2.503 13.418 821 HG SER 110 HG SER 110 -9.636 0.577 14.147 822 HA PRO 111 HA PRO 111 -11.277 6.104 9.896 823 HB2 PRO 111 HB2 PRO 111 -11.771 7.864 12.183 824 HB3 PRO 111 HB1 PRO 111 -12.717 7.649 10.712 825 HG2 PRO 111 HG2 PRO 111 -13.568 6.767 13.112 826 HG3 PRO 111 HG1 PRO 111 -13.951 5.928 11.598 827 HD2 PRO 111 HD2 PRO 111 -11.899 5.260 13.669 828 HD3 PRO 111 HD1 PRO 111 -12.968 4.183 12.746 829 H GLY 112 HN GLY 112 -9.209 5.292 12.348 830 HA2 GLY 112 HA2 GLY 112 -7.398 7.507 11.648 831 HA3 GLY 112 HA1 GLY 112 -7.214 6.455 13.045 832 H GLU 113 HN GLU 113 -7.874 4.066 11.420 833 HA GLU 113 HA GLU 113 -5.226 3.218 11.110 834 HB2 GLU 113 HB2 GLU 113 -7.127 1.738 11.642 835 HB3 GLU 113 HB1 GLU 113 -7.760 1.984 10.025 836 HG2 GLU 113 HG2 GLU 113 -6.617 -0.155 10.292 837 HG3 GLU 113 HG1 GLU 113 -5.877 0.860 9.055 838 H ARG 114 HN ARG 114 -7.682 3.849 8.602 839 HA ARG 114 HA ARG 114 -6.075 3.186 6.419 840 HB2 ARG 114 HB2 ARG 114 -8.097 5.376 6.140 841 HB3 ARG 114 HB1 ARG 114 -7.683 4.098 5.015 842 HG2 ARG 114 HG2 ARG 114 -9.728 3.387 5.676 843 HG3 ARG 114 HG1 ARG 114 -8.738 2.577 6.891 844 HD2 ARG 114 HD2 ARG 114 -10.771 3.754 7.761 845 HD3 ARG 114 HD1 ARG 114 -9.252 4.211 8.526 846 HE ARG 114 HE ARG 114 -10.834 5.841 6.681 847 HH11 ARG 114 HH11 ARG 114 -8.110 5.570 8.844 848 HH12 ARG 114 HH12 ARG 114 -7.930 7.284 9.039 849 HH21 ARG 114 HH21 ARG 114 -10.593 8.118 6.941 850 HH22 ARG 114 HH22 ARG 114 -9.321 8.727 7.962 851 H GLU 115 HN GLU 115 -6.516 6.272 8.077 852 HA GLU 115 HA GLU 115 -5.017 7.796 6.231 853 HB2 GLU 115 HB2 GLU 115 -5.955 8.275 9.031 854 HB3 GLU 115 HB1 GLU 115 -4.891 9.421 8.225 855 HG2 GLU 115 HG2 GLU 115 -6.506 9.670 6.424 856 HG3 GLU 115 HG1 GLU 115 -7.566 8.500 7.205 857 H SER 116 HN SER 116 -4.140 6.117 9.218 858 HA SER 116 HA SER 116 -1.473 6.906 9.371 859 HB2 SER 116 HB2 SER 116 -2.551 4.125 9.934 860 HB3 SER 116 HB1 SER 116 -1.071 4.837 10.582 861 HG SER 116 HG SER 116 -2.531 6.510 11.471 862 H TRP 117 HN TRP 117 -3.073 4.594 7.293 863 HA TRP 117 HA TRP 117 -0.696 3.564 6.080 864 HB2 TRP 117 HB2 TRP 117 -3.219 2.690 6.143 865 HB3 TRP 117 HB1 TRP 117 -3.314 3.602 4.642 866 HD1 TRP 117 HD1 TRP 117 -1.916 0.432 6.134 867 HE1 TRP 117 HE1 TRP 117 -0.908 -1.016 4.252 868 HE3 TRP 117 HE3 TRP 117 -2.105 3.815 2.304 869 HZ2 TRP 117 HZ2 TRP 117 -0.271 -0.753 1.525 870 HZ3 TRP 117 HZ3 TRP 117 -1.272 3.136 0.090 871 HH2 TRP 117 HH2 TRP 117 -0.372 0.900 -0.288 872 H GLN 118 HN GLN 118 -3.141 5.938 5.218 873 HA GLN 118 HA GLN 118 -2.367 6.744 2.710 874 HB2 GLN 118 HB2 GLN 118 -4.422 7.479 3.707 875 HB3 GLN 118 HB1 GLN 118 -3.565 8.300 4.998 876 HG2 GLN 118 HG2 GLN 118 -4.421 9.918 3.475 877 HG3 GLN 118 HG1 GLN 118 -2.666 9.890 3.353 878 HE21 GLN 118 HE21 GLN 118 -4.639 7.411 1.907 879 HE22 GLN 118 HE22 GLN 118 -4.376 7.893 0.269 880 H GLU 119 HN GLU 119 -1.269 8.149 5.802 881 HA GLU 119 HA GLU 119 0.434 10.035 4.507 882 HB2 GLU 119 HB2 GLU 119 1.251 10.509 6.786 883 HB3 GLU 119 HB1 GLU 119 -0.505 10.491 6.702 884 HG2 GLU 119 HG2 GLU 119 -0.500 8.203 7.595 885 HG3 GLU 119 HG1 GLU 119 1.252 8.285 7.744 886 H GLN 120 HN GLN 120 0.863 6.811 5.769 887 HA GLN 120 HA GLN 120 3.701 6.951 5.969 888 HB2 GLN 120 HB2 GLN 120 1.645 4.811 6.236 889 HB3 GLN 120 HB1 GLN 120 3.336 4.354 6.077 890 HG2 GLN 120 HG2 GLN 120 2.270 6.255 8.150 891 HG3 GLN 120 HG1 GLN 120 2.565 4.540 8.423 892 HE21 GLN 120 HE21 GLN 120 4.911 4.678 6.588 893 HE22 GLN 120 HE22 GLN 120 6.176 5.362 7.559 894 H ILE 121 HN ILE 121 1.460 5.640 3.573 895 HA ILE 121 HA ILE 121 3.406 4.398 1.969 896 HB ILE 121 HB ILE 121 1.042 3.897 1.722 897 HG12 ILE 121 HG12 ILE 121 0.889 3.964 -0.759 898 HG13 ILE 121 HG11 ILE 121 2.250 5.077 -0.792 899 HG21 ILE 121 HG21 ILE 121 0.058 6.051 2.117 900 HG22 ILE 121 HG22 ILE 121 -0.455 5.478 0.528 901 HG23 ILE 121 HG23 ILE 121 0.806 6.708 0.659 902 HD11 ILE 121 HD11 ILE 121 3.684 3.363 0.169 903 HD12 ILE 121 HD12 ILE 121 2.930 2.804 -1.323 904 HD13 ILE 121 HD13 ILE 121 2.318 2.250 0.235 905 H GLN 122 HN GLN 122 2.177 7.700 2.069 906 HA GLN 122 HA GLN 122 3.344 8.591 -0.348 907 HB2 GLN 122 HB2 GLN 122 2.589 10.077 2.171 908 HB3 GLN 122 HB1 GLN 122 3.130 10.868 0.700 909 HG2 GLN 122 HG2 GLN 122 1.232 10.063 -0.509 910 HG3 GLN 122 HG1 GLN 122 0.724 9.081 0.866 911 HE21 GLN 122 HE21 GLN 122 -0.201 10.058 2.633 912 HE22 GLN 122 HE22 GLN 122 -0.774 11.687 2.605 913 H SER 123 HN SER 123 4.507 8.528 2.986 914 HA SER 123 HA SER 123 6.951 9.838 2.571 915 HB2 SER 123 HB2 SER 123 6.311 7.663 4.576 916 HB3 SER 123 HB1 SER 123 7.642 8.815 4.683 917 HG SER 123 HG SER 123 5.818 10.442 4.543 918 H LEU 124 HN LEU 124 6.047 6.420 2.341 919 HA LEU 124 HA LEU 124 8.646 5.414 1.855 920 HB2 LEU 124 HB2 LEU 124 6.698 4.062 2.608 921 HB3 LEU 124 HB1 LEU 124 5.968 4.267 1.033 922 HG LEU 124 HG LEU 124 7.147 2.031 1.582 923 HD11 LEU 124 HD11 LEU 124 6.340 2.628 -0.641 924 HD12 LEU 124 HD12 LEU 124 7.861 1.736 -0.717 925 HD13 LEU 124 HD13 LEU 124 7.848 3.486 -0.959 926 HD21 LEU 124 HD21 LEU 124 9.558 3.697 0.882 927 HD22 LEU 124 HD22 LEU 124 9.516 1.946 1.099 928 HD23 LEU 124 HD23 LEU 124 9.206 3.012 2.470 929 H MET 125 HN MET 125 6.002 6.354 -0.314 930 HA MET 125 HA MET 125 7.135 5.656 -2.762 931 HB2 MET 125 HB2 MET 125 5.333 7.977 -2.055 932 HB3 MET 125 HB1 MET 125 5.691 7.472 -3.699 933 HG2 MET 125 HG2 MET 125 4.472 5.527 -3.508 934 HG3 MET 125 HG1 MET 125 4.551 5.527 -1.747 935 HE1 MET 125 HE1 MET 125 2.045 8.635 -4.055 936 HE2 MET 125 HE2 MET 125 3.151 7.511 -4.846 937 HE3 MET 125 HE3 MET 125 3.784 8.770 -3.785 938 H LYS 126 HN LYS 126 7.287 8.765 -1.064 939 HA LYS 126 HA LYS 126 8.896 9.964 -3.089 940 HB2 LYS 126 HB2 LYS 126 8.290 10.904 -0.288 941 HB3 LYS 126 HB1 LYS 126 9.012 11.880 -1.562 942 HG2 LYS 126 HG2 LYS 126 6.240 10.703 -1.540 943 HG3 LYS 126 HG1 LYS 126 6.675 12.402 -1.383 944 HD2 LYS 126 HD2 LYS 126 7.671 12.302 -3.658 945 HD3 LYS 126 HD1 LYS 126 7.071 10.649 -3.802 946 HE2 LYS 126 HE2 LYS 126 5.501 12.063 -4.892 947 HE3 LYS 126 HE1 LYS 126 4.770 11.545 -3.376 948 HZ1 LYS 126 HZ1 LYS 126 5.398 13.671 -2.401 949 HZ2 LYS 126 HZ2 LYS 126 4.417 13.892 -3.757 950 HZ3 LYS 126 HZ3 LYS 126 6.082 14.165 -3.869 951 H PHE 127 HN PHE 127 9.594 8.005 -0.406 952 HA PHE 127 HA PHE 127 12.211 8.960 0.166 953 HB2 PHE 127 HB2 PHE 127 10.899 7.623 1.759 954 HB3 PHE 127 HB1 PHE 127 10.952 6.253 0.655 955 HD1 PHE 127 HD1 PHE 127 12.446 4.598 1.182 956 HD2 PHE 127 HD2 PHE 127 13.368 8.608 2.268 957 HE1 PHE 127 HE1 PHE 127 14.527 3.830 2.249 958 HE2 PHE 127 HE2 PHE 127 15.450 7.842 3.333 959 HZ PHE 127 HZ PHE 127 16.030 5.451 3.322 960 H MET 128 HN MET 128 10.957 6.316 -1.840 961 HA MET 128 HA MET 128 13.677 5.782 -2.783 962 HB2 MET 128 HB2 MET 128 12.698 3.745 -3.806 963 HB3 MET 128 HB1 MET 128 12.495 3.821 -2.062 964 HG2 MET 128 HG2 MET 128 10.203 4.385 -2.264 965 HG3 MET 128 HG1 MET 128 10.353 4.635 -4.005 966 HE1 MET 128 HE1 MET 128 10.810 0.533 -1.978 967 HE2 MET 128 HE2 MET 128 10.556 2.041 -1.099 968 HE3 MET 128 HE3 MET 128 12.063 1.773 -1.974 969 H SER 129 HN SER 129 10.527 6.810 -3.931 970 HA SER 129 HA SER 129 11.456 6.860 -6.688 971 HB2 SER 129 HB2 SER 129 9.183 6.007 -6.109 972 HB3 SER 129 HB1 SER 129 8.758 7.618 -5.539 973 HG SER 129 HG SER 129 9.448 6.841 -8.196 974 H MET 130 HN MET 130 12.683 8.596 -4.747 975 HA MET 130 HA MET 130 11.654 11.239 -5.213 976 HB2 MET 130 HB2 MET 130 13.551 12.012 -3.875 977 HB3 MET 130 HB1 MET 130 12.647 10.745 -3.053 978 HG2 MET 130 HG2 MET 130 14.306 9.122 -3.611 979 HG3 MET 130 HG1 MET 130 15.151 10.293 -4.616 980 HE1 MET 130 HE1 MET 130 17.421 9.688 -3.340 981 HE2 MET 130 HE2 MET 130 16.550 8.533 -2.332 982 HE3 MET 130 HE3 MET 130 17.598 9.741 -1.587 983 H LYS 131 HN LYS 131 12.151 12.533 -6.814 984 HA LYS 131 HA LYS 131 14.589 11.984 -8.365 985 HB2 LYS 131 HB2 LYS 131 11.911 12.988 -9.351 986 HB3 LYS 131 HB1 LYS 131 13.371 12.964 -10.326 987 HG2 LYS 131 HG2 LYS 131 11.943 10.573 -9.175 988 HG3 LYS 131 HG1 LYS 131 11.970 11.072 -10.866 989 HD2 LYS 131 HD2 LYS 131 14.333 10.148 -9.230 990 HD3 LYS 131 HD1 LYS 131 13.518 9.234 -10.497 991 HE2 LYS 131 HE2 LYS 131 14.207 10.850 -12.160 992 HE3 LYS 131 HE1 LYS 131 14.923 11.870 -10.915 993 HZ1 LYS 131 HZ1 LYS 131 16.601 10.574 -12.057 994 HZ2 LYS 131 HZ2 LYS 131 15.823 9.135 -11.634 995 HZ3 LYS 131 HZ3 LYS 131 16.506 10.112 -10.433 Start of MODEL 2 1 H1 SER 11 HT1 SER 11 24.765 3.361 3.754 2 H2 SER 11 HT2 SER 11 25.810 2.053 3.973 3 H3 SER 11 HT3 SER 11 24.154 1.870 4.269 4 HA SER 11 HA SER 11 25.363 2.456 1.632 5 HB2 SER 11 HB2 SER 11 25.924 0.202 2.219 6 HB3 SER 11 HB1 SER 11 24.321 -0.095 2.881 7 HG SER 11 HG SER 11 25.079 0.211 0.164 8 H ALA 12 HN ALA 12 23.978 3.234 0.208 9 HA ALA 12 HA ALA 12 21.438 4.161 0.897 10 HB1 ALA 12 HB1 ALA 12 22.524 3.646 -1.867 11 HB2 ALA 12 HB2 ALA 12 22.815 5.100 -0.910 12 HB3 ALA 12 HB3 ALA 12 21.181 4.713 -1.453 13 H SER 13 HN SER 13 22.394 1.316 -0.980 14 HA SER 13 HA SER 13 19.793 0.445 -1.575 15 HB2 SER 13 HB2 SER 13 22.461 -0.957 -1.444 16 HB3 SER 13 HB1 SER 13 20.999 -1.689 -2.083 17 HG SER 13 HG SER 13 20.969 -0.226 -3.729 18 H ASP 14 HN ASP 14 22.090 -0.400 0.995 19 HA ASP 14 HA ASP 14 20.482 -2.440 2.136 20 HB2 ASP 14 HB2 ASP 14 22.901 -2.328 2.533 21 HB3 ASP 14 HB1 ASP 14 22.689 -0.812 3.400 22 H ILE 15 HN ILE 15 20.988 0.977 2.983 23 HA ILE 15 HA ILE 15 19.341 0.938 5.265 24 HB ILE 15 HB ILE 15 20.981 2.779 4.691 25 HG12 ILE 15 HG12 ILE 15 19.404 4.562 5.647 26 HG13 ILE 15 HG11 ILE 15 18.157 3.314 5.595 27 HG21 ILE 15 HG21 ILE 15 20.180 4.663 3.387 28 HG22 ILE 15 HG22 ILE 15 18.685 3.798 3.028 29 HG23 ILE 15 HG23 ILE 15 20.219 3.204 2.394 30 HD11 ILE 15 HD11 ILE 15 19.463 1.923 7.078 31 HD12 ILE 15 HD12 ILE 15 19.179 3.507 7.797 32 HD13 ILE 15 HD13 ILE 15 20.753 3.123 7.101 33 H ARG 16 HN ARG 16 18.649 1.472 1.850 34 HA ARG 16 HA ARG 16 16.005 2.319 2.140 35 HB2 ARG 16 HB2 ARG 16 16.983 2.522 -0.013 36 HB3 ARG 16 HB1 ARG 16 17.467 0.833 -0.040 37 HG2 ARG 16 HG2 ARG 16 15.027 0.239 -0.117 38 HG3 ARG 16 HG1 ARG 16 14.697 1.957 -0.358 39 HD2 ARG 16 HD2 ARG 16 16.560 0.368 -2.095 40 HD3 ARG 16 HD1 ARG 16 14.843 0.566 -2.452 41 HE ARG 16 HE ARG 16 16.085 3.088 -2.045 42 HH11 ARG 16 HH11 ARG 16 15.780 0.497 -4.377 43 HH12 ARG 16 HH12 ARG 16 16.104 1.512 -5.744 44 HH21 ARG 16 HH21 ARG 16 16.515 4.435 -3.846 45 HH22 ARG 16 HH22 ARG 16 16.508 3.756 -5.443 46 H MET 17 HN MET 17 17.294 -0.973 1.661 47 HA MET 17 HA MET 17 14.881 -2.361 1.843 48 HB2 MET 17 HB2 MET 17 17.571 -3.242 2.918 49 HB3 MET 17 HB1 MET 17 16.223 -4.293 2.506 50 HG2 MET 17 HG2 MET 17 16.442 -3.768 0.183 51 HG3 MET 17 HG1 MET 17 17.658 -2.540 0.532 52 HE1 MET 17 HE1 MET 17 19.853 -5.174 -1.252 53 HE2 MET 17 HE2 MET 17 19.455 -3.463 -1.103 54 HE3 MET 17 HE3 MET 17 18.235 -4.607 -1.660 55 H LYS 18 HN LYS 18 17.000 -1.094 4.278 56 HA LYS 18 HA LYS 18 15.695 -2.195 6.551 57 HB2 LYS 18 HB2 LYS 18 17.844 -1.652 7.074 58 HB3 LYS 18 HB1 LYS 18 17.910 -0.351 5.907 59 HG2 LYS 18 HG2 LYS 18 18.237 0.606 8.028 60 HG3 LYS 18 HG1 LYS 18 16.604 1.044 7.524 61 HD2 LYS 18 HD2 LYS 18 15.700 -0.777 8.910 62 HD3 LYS 18 HD1 LYS 18 17.338 -1.199 9.414 63 HE2 LYS 18 HE2 LYS 18 17.591 1.023 10.412 64 HE3 LYS 18 HE1 LYS 18 15.948 1.428 9.922 65 HZ1 LYS 18 HZ1 LYS 18 15.988 0.767 12.217 66 HZ2 LYS 18 HZ2 LYS 18 16.737 -0.696 11.835 67 HZ3 LYS 18 HZ3 LYS 18 15.157 -0.402 11.325 68 H LYS 19 HN LYS 19 15.445 0.897 4.839 69 HA LYS 19 HA LYS 19 13.612 1.999 6.743 70 HB2 LYS 19 HB2 LYS 19 15.152 2.991 4.660 71 HB3 LYS 19 HB1 LYS 19 13.494 3.228 4.125 72 HG2 LYS 19 HG2 LYS 19 14.729 4.230 6.682 73 HG3 LYS 19 HG1 LYS 19 14.269 5.192 5.277 74 HD2 LYS 19 HD2 LYS 19 11.930 4.620 5.633 75 HD3 LYS 19 HD1 LYS 19 12.369 3.600 6.999 76 HE2 LYS 19 HE2 LYS 19 11.539 5.750 7.768 77 HE3 LYS 19 HE1 LYS 19 13.243 5.563 8.177 78 HZ1 LYS 19 HZ1 LYS 19 12.781 7.767 7.322 79 HZ2 LYS 19 HZ2 LYS 19 12.176 7.120 5.884 80 HZ3 LYS 19 HZ3 LYS 19 13.810 6.936 6.271 81 H VAL 20 HN VAL 20 13.319 0.435 3.591 82 HA VAL 20 HA VAL 20 10.542 0.883 3.334 83 HB VAL 20 HB VAL 20 10.519 -0.770 1.572 84 HG11 VAL 20 HG11 VAL 20 13.057 0.849 1.440 85 HG12 VAL 20 HG12 VAL 20 11.439 1.459 1.088 86 HG13 VAL 20 HG13 VAL 20 12.150 0.202 0.072 87 HG21 VAL 20 HG21 VAL 20 12.556 -2.037 0.993 88 HG22 VAL 20 HG22 VAL 20 11.865 -2.502 2.549 89 HG23 VAL 20 HG23 VAL 20 13.294 -1.471 2.493 90 H MET 21 HN MET 21 12.409 -1.619 4.982 91 HA MET 21 HA MET 21 10.226 -3.378 5.371 92 HB2 MET 21 HB2 MET 21 11.566 -4.516 6.955 93 HB3 MET 21 HB1 MET 21 12.643 -3.993 5.668 94 HG2 MET 21 HG2 MET 21 13.446 -2.203 6.977 95 HG3 MET 21 HG1 MET 21 12.239 -2.509 8.211 96 HE1 MET 21 HE1 MET 21 13.483 -5.969 9.653 97 HE2 MET 21 HE2 MET 21 12.405 -5.803 8.268 98 HE3 MET 21 HE3 MET 21 12.199 -4.760 9.676 99 H GLN 22 HN GLN 22 11.408 -0.571 7.046 100 HA GLN 22 HA GLN 22 9.705 -0.685 9.307 101 HB2 GLN 22 HB2 GLN 22 10.532 1.902 8.004 102 HB3 GLN 22 HB1 GLN 22 10.292 1.565 9.711 103 HG2 GLN 22 HG2 GLN 22 12.316 0.232 9.755 104 HG3 GLN 22 HG1 GLN 22 12.547 0.498 8.027 105 HE21 GLN 22 HE21 GLN 22 14.449 1.590 8.084 106 HE22 GLN 22 HE22 GLN 22 14.659 3.122 8.868 107 H TYR 23 HN TYR 23 9.449 0.971 6.184 108 HA TYR 23 HA TYR 23 6.849 1.973 6.547 109 HB2 TYR 23 HB2 TYR 23 8.489 1.406 4.092 110 HB3 TYR 23 HB1 TYR 23 6.850 2.035 3.982 111 HD1 TYR 23 HD1 TYR 23 10.133 2.971 3.865 112 HD2 TYR 23 HD2 TYR 23 6.501 4.112 5.758 113 HE1 TYR 23 HE1 TYR 23 11.014 5.241 4.173 114 HE2 TYR 23 HE2 TYR 23 7.379 6.386 6.078 115 HH TYR 23 HH TYR 23 10.263 7.470 4.538 116 H ARG 24 HN ARG 24 8.059 -1.064 5.288 117 HA ARG 24 HA ARG 24 5.743 -2.076 4.132 118 HB2 ARG 24 HB2 ARG 24 8.089 -3.057 4.062 119 HB3 ARG 24 HB1 ARG 24 7.761 -3.731 5.651 120 HG2 ARG 24 HG2 ARG 24 5.980 -5.074 4.782 121 HG3 ARG 24 HG1 ARG 24 6.103 -4.292 3.204 122 HD2 ARG 24 HD2 ARG 24 8.422 -5.168 3.018 123 HD3 ARG 24 HD1 ARG 24 8.168 -6.051 4.522 124 HE ARG 24 HE ARG 24 6.353 -6.506 2.259 125 HH11 ARG 24 HH11 ARG 24 8.903 -7.678 4.349 126 HH12 ARG 24 HH12 ARG 24 8.645 -9.344 3.951 127 HH21 ARG 24 HH21 ARG 24 6.027 -8.698 1.694 128 HH22 ARG 24 HH22 ARG 24 7.008 -9.930 2.428 129 H ARG 25 HN ARG 25 6.892 -2.269 7.465 130 HA ARG 25 HA ARG 25 4.760 -3.797 8.488 131 HB2 ARG 25 HB2 ARG 25 6.547 -1.791 9.849 132 HB3 ARG 25 HB1 ARG 25 5.477 -2.916 10.681 133 HG2 ARG 25 HG2 ARG 25 6.700 -4.798 9.809 134 HG3 ARG 25 HG1 ARG 25 7.713 -3.728 8.836 135 HD2 ARG 25 HD2 ARG 25 8.601 -2.713 10.842 136 HD3 ARG 25 HD1 ARG 25 7.548 -3.720 11.837 137 HE ARG 25 HE ARG 25 9.231 -5.257 10.108 138 HH11 ARG 25 HH11 ARG 25 9.120 -3.578 13.180 139 HH12 ARG 25 HH12 ARG 25 10.408 -4.506 13.876 140 HH21 ARG 25 HH21 ARG 25 10.922 -6.481 11.021 141 HH22 ARG 25 HH22 ARG 25 11.445 -6.151 12.644 142 H ALA 26 HN ALA 26 5.221 -0.343 8.043 143 HA ALA 26 HA ALA 26 2.823 0.409 9.428 144 HB1 ALA 26 HB1 ALA 26 4.531 2.021 7.541 145 HB2 ALA 26 HB2 ALA 26 4.785 1.884 9.281 146 HB3 ALA 26 HB3 ALA 26 3.323 2.648 8.661 147 H LEU 27 HN LEU 27 3.558 -0.680 6.285 148 HA LEU 27 HA LEU 27 1.058 0.345 5.179 149 HB2 LEU 27 HB2 LEU 27 3.585 -0.731 4.089 150 HB3 LEU 27 HB1 LEU 27 2.137 -1.111 3.180 151 HG LEU 27 HG LEU 27 1.775 1.104 2.571 152 HD11 LEU 27 HD11 LEU 27 1.842 2.106 4.795 153 HD12 LEU 27 HD12 LEU 27 2.804 3.043 3.653 154 HD13 LEU 27 HD13 LEU 27 3.601 1.976 4.809 155 HD21 LEU 27 HD21 LEU 27 4.763 0.832 2.848 156 HD22 LEU 27 HD22 LEU 27 3.927 1.966 1.787 157 HD23 LEU 27 HD23 LEU 27 3.780 0.231 1.512 158 H THR 28 HN THR 28 2.362 -2.480 6.601 159 HA THR 28 HA THR 28 0.567 -4.349 5.380 160 HB THR 28 HB THR 28 2.171 -4.626 7.933 161 HG1 THR 28 HG1 THR 28 3.472 -4.328 6.053 162 HG21 THR 28 HG21 THR 28 0.865 -6.734 6.211 163 HG22 THR 28 HG22 THR 28 0.302 -6.212 7.797 164 HG23 THR 28 HG23 THR 28 1.857 -7.026 7.640 165 H LYS 29 HN LYS 29 -1.523 -4.109 5.674 166 HA LYS 29 HA LYS 29 -2.638 -3.811 8.356 167 HB2 LYS 29 HB2 LYS 29 -2.793 -1.765 6.199 168 HB3 LYS 29 HB1 LYS 29 -4.273 -2.099 7.071 169 HG2 LYS 29 HG2 LYS 29 -3.303 -0.250 8.126 170 HG3 LYS 29 HG1 LYS 29 -2.988 -1.622 9.186 171 HD2 LYS 29 HD2 LYS 29 -0.731 -1.758 8.467 172 HD3 LYS 29 HD1 LYS 29 -1.012 -0.602 7.163 173 HE2 LYS 29 HE2 LYS 29 0.143 0.424 9.060 174 HE3 LYS 29 HE1 LYS 29 -1.432 1.147 8.770 175 HZ1 LYS 29 HZ1 LYS 29 -2.349 0.005 10.612 176 HZ2 LYS 29 HZ2 LYS 29 -0.890 0.680 11.149 177 HZ3 LYS 29 HZ3 LYS 29 -0.972 -0.971 10.789 178 H VAL 30 HN VAL 30 -5.000 -4.177 8.313 179 HA VAL 30 HA VAL 30 -5.818 -5.721 5.961 180 HB VAL 30 HB VAL 30 -7.703 -6.553 7.372 181 HG11 VAL 30 HG11 VAL 30 -6.331 -8.097 8.707 182 HG12 VAL 30 HG12 VAL 30 -4.923 -7.070 8.436 183 HG13 VAL 30 HG13 VAL 30 -5.691 -7.890 7.077 184 HG21 VAL 30 HG21 VAL 30 -6.208 -5.216 9.627 185 HG22 VAL 30 HG22 VAL 30 -7.613 -6.269 9.788 186 HG23 VAL 30 HG23 VAL 30 -7.769 -4.706 8.987 187 H VAL 31 HN VAL 31 -7.453 -4.994 4.701 188 HA VAL 31 HA VAL 31 -8.814 -2.515 5.407 189 HB VAL 31 HB VAL 31 -6.504 -2.711 3.544 190 HG11 VAL 31 HG11 VAL 31 -7.255 -0.718 2.307 191 HG12 VAL 31 HG12 VAL 31 -8.845 -0.901 3.046 192 HG13 VAL 31 HG13 VAL 31 -8.216 -2.160 1.977 193 HG21 VAL 31 HG21 VAL 31 -7.555 -0.481 5.260 194 HG22 VAL 31 HG22 VAL 31 -6.036 -0.471 4.361 195 HG23 VAL 31 HG23 VAL 31 -6.265 -1.604 5.693 196 H LYS 32 HN LYS 32 -10.584 -2.071 4.050 197 HA LYS 32 HA LYS 32 -11.234 -4.220 2.172 198 HB2 LYS 32 HB2 LYS 32 -12.771 -3.553 4.125 199 HB3 LYS 32 HB1 LYS 32 -13.122 -2.110 3.187 200 HG2 LYS 32 HG2 LYS 32 -13.408 -4.715 1.813 201 HG3 LYS 32 HG1 LYS 32 -14.615 -4.294 3.037 202 HD2 LYS 32 HD2 LYS 32 -14.962 -2.131 1.854 203 HD3 LYS 32 HD1 LYS 32 -13.868 -2.697 0.590 204 HE2 LYS 32 HE2 LYS 32 -16.201 -3.036 -0.041 205 HE3 LYS 32 HE1 LYS 32 -15.353 -4.574 0.128 206 HZ1 LYS 32 HZ1 LYS 32 -16.368 -4.906 2.255 207 HZ2 LYS 32 HZ2 LYS 32 -17.587 -4.561 1.134 208 HZ3 LYS 32 HZ3 LYS 32 -17.080 -3.371 2.221 209 H LEU 33 HN LEU 33 -10.887 -3.841 0.114 210 HA LEU 33 HA LEU 33 -10.467 -1.120 -0.832 211 HB2 LEU 33 HB2 LEU 33 -10.019 -3.833 -2.007 212 HB3 LEU 33 HB1 LEU 33 -10.090 -2.426 -3.056 213 HG LEU 33 HG LEU 33 -8.155 -2.771 -0.763 214 HD11 LEU 33 HD11 LEU 33 -6.468 -3.060 -2.509 215 HD12 LEU 33 HD12 LEU 33 -7.726 -2.995 -3.743 216 HD13 LEU 33 HD13 LEU 33 -7.690 -4.329 -2.589 217 HD21 LEU 33 HD21 LEU 33 -7.065 -0.800 -1.773 218 HD22 LEU 33 HD22 LEU 33 -8.687 -0.445 -1.181 219 HD23 LEU 33 HD23 LEU 33 -8.409 -0.664 -2.907 220 H LYS 34 HN LYS 34 -11.666 -0.070 -2.344 221 HA LYS 34 HA LYS 34 -14.107 -1.366 -3.320 222 HB2 LYS 34 HB2 LYS 34 -14.244 1.355 -2.023 223 HB3 LYS 34 HB1 LYS 34 -15.577 0.327 -2.529 224 HG2 LYS 34 HG2 LYS 34 -14.936 -1.289 -0.766 225 HG3 LYS 34 HG1 LYS 34 -13.713 -0.145 -0.218 226 HD2 LYS 34 HD2 LYS 34 -16.695 0.304 -0.292 227 HD3 LYS 34 HD1 LYS 34 -15.706 0.035 1.146 228 HE2 LYS 34 HE2 LYS 34 -14.507 2.114 0.723 229 HE3 LYS 34 HE1 LYS 34 -15.462 2.382 -0.733 230 HZ1 LYS 34 HZ1 LYS 34 -17.443 2.532 0.613 231 HZ2 LYS 34 HZ2 LYS 34 -16.297 3.649 1.155 232 HZ3 LYS 34 HZ3 LYS 34 -16.557 2.222 2.021 233 H THR 35 HN THR 35 -13.717 -1.191 -5.440 234 HA THR 35 HA THR 35 -13.902 1.345 -6.682 235 HB THR 35 HB THR 35 -11.604 1.644 -6.091 236 HG1 THR 35 HG1 THR 35 -11.448 2.433 -8.032 237 HG21 THR 35 HG21 THR 35 -9.837 0.061 -6.750 238 HG22 THR 35 HG22 THR 35 -11.077 -1.056 -7.311 239 HG23 THR 35 HG23 THR 35 -10.981 -0.638 -5.603 240 H HIS 36 HN HIS 36 -13.090 0.872 -9.219 241 HA HIS 36 HA HIS 36 -14.906 -1.104 -10.130 242 HB2 HIS 36 HB2 HIS 36 -14.024 -0.642 -12.391 243 HB3 HIS 36 HB1 HIS 36 -14.455 0.821 -11.521 244 HD1 HIS 36 HD1 HIS 36 -11.686 -0.816 -13.280 245 HD2 HIS 36 HD2 HIS 36 -12.168 2.356 -10.643 246 HE1 HIS 36 HE1 HIS 36 -9.581 0.540 -13.466 247 HE2 HIS 36 HE2 HIS 36 -10.009 2.574 -12.048 248 H LEU 37 HN LEU 37 -11.763 -1.353 -8.986 249 HA LEU 37 HA LEU 37 -10.917 -3.749 -10.230 250 HB2 LEU 37 HB2 LEU 37 -9.492 -2.299 -8.779 251 HB3 LEU 37 HB1 LEU 37 -10.447 -2.791 -7.397 252 HG LEU 37 HG LEU 37 -9.703 -5.171 -7.912 253 HD11 LEU 37 HD11 LEU 37 -7.606 -5.392 -9.143 254 HD12 LEU 37 HD12 LEU 37 -7.675 -3.681 -9.569 255 HD13 LEU 37 HD13 LEU 37 -8.902 -4.793 -10.177 256 HD21 LEU 37 HD21 LEU 37 -7.773 -3.049 -6.986 257 HD22 LEU 37 HD22 LEU 37 -7.497 -4.781 -6.793 258 HD23 LEU 37 HD23 LEU 37 -8.870 -4.013 -5.995 259 H PHE 38 HN PHE 38 -12.376 -3.226 -7.039 260 HA PHE 38 HA PHE 38 -14.564 -4.894 -7.313 261 HB2 PHE 38 HB2 PHE 38 -13.908 -6.824 -5.891 262 HB3 PHE 38 HB1 PHE 38 -13.033 -6.791 -7.414 263 HD1 PHE 38 HD1 PHE 38 -10.733 -6.979 -7.418 264 HD2 PHE 38 HD2 PHE 38 -12.700 -5.800 -3.837 265 HE1 PHE 38 HE1 PHE 38 -8.604 -7.126 -6.200 266 HE2 PHE 38 HE2 PHE 38 -10.574 -5.945 -2.614 267 HZ PHE 38 HZ PHE 38 -8.521 -6.607 -3.797 268 H SER 39 HN SER 39 -15.407 -5.536 -5.022 269 HA SER 39 HA SER 39 -14.408 -3.651 -3.001 270 HB2 SER 39 HB2 SER 39 -16.843 -3.686 -2.147 271 HB3 SER 39 HB1 SER 39 -16.503 -2.729 -3.590 272 HG SER 39 HG SER 39 -17.606 -4.103 -4.790 273 H GLU 40 HN GLU 40 -13.260 -4.956 -1.727 274 HA GLU 40 HA GLU 40 -14.532 -7.170 -0.361 275 HB2 GLU 40 HB2 GLU 40 -12.346 -7.559 -2.368 276 HB3 GLU 40 HB1 GLU 40 -12.437 -8.603 -0.964 277 HG2 GLU 40 HG2 GLU 40 -14.681 -8.215 -2.925 278 HG3 GLU 40 HG1 GLU 40 -13.506 -9.529 -2.999 279 H THR 41 HN THR 41 -13.131 -8.062 1.321 280 HA THR 41 HA THR 41 -11.448 -6.000 2.471 281 HB THR 41 HB THR 41 -12.123 -8.697 3.622 282 HG1 THR 41 HG1 THR 41 -13.942 -7.174 3.094 283 HG21 THR 41 HG21 THR 41 -11.617 -7.599 5.769 284 HG22 THR 41 HG22 THR 41 -11.170 -6.131 4.898 285 HG23 THR 41 HG23 THR 41 -10.222 -7.603 4.689 286 H VAL 42 HN VAL 42 -9.335 -5.962 2.270 287 HA VAL 42 HA VAL 42 -7.927 -8.404 1.406 288 HB VAL 42 HB VAL 42 -6.651 -7.166 -0.174 289 HG11 VAL 42 HG11 VAL 42 -9.513 -6.211 -0.326 290 HG12 VAL 42 HG12 VAL 42 -8.864 -7.713 -0.991 291 HG13 VAL 42 HG13 VAL 42 -8.349 -6.163 -1.654 292 HG21 VAL 42 HG21 VAL 42 -6.203 -5.179 1.158 293 HG22 VAL 42 HG22 VAL 42 -7.873 -4.645 0.965 294 HG23 VAL 42 HG23 VAL 42 -6.803 -4.721 -0.436 295 H LYS 43 HN LYS 43 -5.464 -8.048 1.733 296 HA LYS 43 HA LYS 43 -4.996 -6.431 4.147 297 HB2 LYS 43 HB2 LYS 43 -4.849 -8.962 4.385 298 HB3 LYS 43 HB1 LYS 43 -3.434 -8.883 3.343 299 HG2 LYS 43 HG2 LYS 43 -2.334 -7.414 4.959 300 HG3 LYS 43 HG1 LYS 43 -3.749 -7.523 6.009 301 HD2 LYS 43 HD2 LYS 43 -1.876 -9.735 5.206 302 HD3 LYS 43 HD1 LYS 43 -2.124 -9.057 6.818 303 HE2 LYS 43 HE2 LYS 43 -4.429 -9.899 6.805 304 HE3 LYS 43 HE1 LYS 43 -4.158 -10.588 5.204 305 HZ1 LYS 43 HZ1 LYS 43 -2.588 -11.344 7.602 306 HZ2 LYS 43 HZ2 LYS 43 -2.577 -12.099 6.088 307 HZ3 LYS 43 HZ3 LYS 43 -3.952 -12.186 7.071 308 H VAL 44 HN VAL 44 -3.467 -4.873 3.936 309 HA VAL 44 HA VAL 44 -2.229 -4.677 1.283 310 HB VAL 44 HB VAL 44 -1.986 -2.319 2.994 311 HG11 VAL 44 HG11 VAL 44 -2.864 -1.232 0.964 312 HG12 VAL 44 HG12 VAL 44 -3.154 -2.822 0.258 313 HG13 VAL 44 HG13 VAL 44 -1.507 -2.305 0.623 314 HG21 VAL 44 HG21 VAL 44 -4.332 -1.644 2.874 315 HG22 VAL 44 HG22 VAL 44 -4.121 -3.081 3.873 316 HG23 VAL 44 HG23 VAL 44 -4.763 -3.232 2.235 317 H THR 45 HN THR 45 -0.095 -3.801 1.128 318 HA THR 45 HA THR 45 1.709 -3.430 3.207 319 HB THR 45 HB THR 45 1.237 -5.847 3.665 320 HG1 THR 45 HG1 THR 45 3.201 -5.471 4.402 321 HG21 THR 45 HG21 THR 45 2.542 -6.302 0.982 322 HG22 THR 45 HG22 THR 45 0.837 -6.571 1.350 323 HG23 THR 45 HG23 THR 45 2.077 -7.552 2.135 324 H CYS 46 HN CYS 46 4.079 -4.209 2.111 325 HA CYS 46 HA CYS 46 3.927 -3.610 -0.748 326 HB2 CYS 46 HB2 CYS 46 5.824 -2.052 -0.596 327 HB3 CYS 46 HB1 CYS 46 4.447 -1.474 0.336 328 HG CYS 46 HG CYS 46 7.453 -2.592 1.434 329 H SER 47 HN SER 47 6.109 -4.068 -1.817 330 HA SER 47 HA SER 47 6.870 -6.714 -1.077 331 HB2 SER 47 HB2 SER 47 6.801 -5.833 -3.431 332 HB3 SER 47 HB1 SER 47 8.253 -4.904 -3.067 333 HG SER 47 HG SER 47 9.042 -6.739 -3.890 334 H LYS 48 HN LYS 48 9.415 -7.191 -1.049 335 HA LYS 48 HA LYS 48 10.151 -6.262 1.512 336 HB2 LYS 48 HB2 LYS 48 11.551 -7.929 -0.544 337 HB3 LYS 48 HB1 LYS 48 12.407 -7.391 0.895 338 HG2 LYS 48 HG2 LYS 48 10.534 -8.419 2.238 339 HG3 LYS 48 HG1 LYS 48 9.990 -9.162 0.732 340 HD2 LYS 48 HD2 LYS 48 12.031 -10.363 0.497 341 HD3 LYS 48 HD1 LYS 48 12.784 -9.455 1.808 342 HE2 LYS 48 HE2 LYS 48 11.117 -10.425 3.365 343 HE3 LYS 48 HE1 LYS 48 10.508 -11.413 2.039 344 HZ1 LYS 48 HZ1 LYS 48 12.670 -12.464 1.866 345 HZ2 LYS 48 HZ2 LYS 48 12.069 -12.624 3.444 346 HZ3 LYS 48 HZ3 LYS 48 13.277 -11.486 3.106 347 H ASP 49 HN ASP 49 11.217 -5.307 -1.707 348 HA ASP 49 HA ASP 49 13.239 -3.547 -0.565 349 HB2 ASP 49 HB2 ASP 49 12.496 -4.161 -3.428 350 HB3 ASP 49 HB1 ASP 49 13.746 -3.011 -2.967 351 H GLY 50 HN GLY 50 10.062 -3.288 -0.759 352 HA2 GLY 50 HA2 GLY 50 8.602 -1.510 -0.718 353 HA3 GLY 50 HA1 GLY 50 10.010 -0.469 -0.594 354 H GLU 51 HN GLU 51 9.820 -2.594 -3.287 355 HA GLU 51 HA GLU 51 9.689 -0.353 -5.097 356 HB2 GLU 51 HB2 GLU 51 9.872 -3.314 -5.661 357 HB3 GLU 51 HB1 GLU 51 10.081 -2.032 -6.847 358 HG2 GLU 51 HG2 GLU 51 12.053 -1.242 -5.673 359 HG3 GLU 51 HG1 GLU 51 11.831 -2.486 -4.443 360 H GLU 52 HN GLU 52 7.625 -2.966 -4.061 361 HA GLU 52 HA GLU 52 5.492 -1.957 -5.822 362 HB2 GLU 52 HB2 GLU 52 6.208 -4.752 -5.016 363 HB3 GLU 52 HB1 GLU 52 4.550 -4.355 -5.428 364 HG2 GLU 52 HG2 GLU 52 5.516 -5.232 -7.377 365 HG3 GLU 52 HG1 GLU 52 5.449 -3.490 -7.628 366 H VAL 53 HN VAL 53 3.475 -1.667 -4.956 367 HA VAL 53 HA VAL 53 3.115 -2.269 -2.102 368 HB VAL 53 HB VAL 53 1.269 -0.720 -3.939 369 HG11 VAL 53 HG11 VAL 53 0.164 -0.007 -1.877 370 HG12 VAL 53 HG12 VAL 53 1.268 -1.008 -0.935 371 HG13 VAL 53 HG13 VAL 53 0.126 -1.762 -2.048 372 HG21 VAL 53 HG21 VAL 53 2.063 1.290 -2.756 373 HG22 VAL 53 HG22 VAL 53 3.342 0.496 -3.673 374 HG23 VAL 53 HG23 VAL 53 3.264 0.303 -1.922 375 H GLN 54 HN GLN 54 2.021 -4.079 -1.587 376 HA GLN 54 HA GLN 54 0.490 -5.395 -3.731 377 HB2 GLN 54 HB2 GLN 54 1.474 -7.557 -2.965 378 HB3 GLN 54 HB1 GLN 54 2.647 -6.459 -3.677 379 HG2 GLN 54 HG2 GLN 54 3.292 -5.766 -1.374 380 HG3 GLN 54 HG1 GLN 54 2.227 -7.023 -0.757 381 HE21 GLN 54 HE21 GLN 54 4.124 -7.427 -3.665 382 HE22 GLN 54 HE22 GLN 54 5.221 -8.588 -3.007 383 H TRP 55 HN TRP 55 -1.095 -6.946 -2.972 384 HA TRP 55 HA TRP 55 -1.780 -6.729 -0.150 385 HB2 TRP 55 HB2 TRP 55 -4.221 -6.332 -0.850 386 HB3 TRP 55 HB1 TRP 55 -3.116 -4.968 -0.878 387 HD1 TRP 55 HD1 TRP 55 -5.035 -7.303 -3.259 388 HE1 TRP 55 HE1 TRP 55 -5.167 -6.155 -5.562 389 HE3 TRP 55 HE3 TRP 55 -1.992 -3.317 -2.341 390 HZ2 TRP 55 HZ2 TRP 55 -4.107 -3.852 -6.821 391 HZ3 TRP 55 HZ3 TRP 55 -1.602 -1.690 -4.131 392 HH2 TRP 55 HH2 TRP 55 -2.631 -1.939 -6.327 393 H PHE 56 HN PHE 56 -3.079 -8.302 0.663 394 HA PHE 56 HA PHE 56 -3.327 -10.717 -1.003 395 HB2 PHE 56 HB2 PHE 56 -3.279 -10.515 2.019 396 HB3 PHE 56 HB1 PHE 56 -3.210 -11.990 1.064 397 HD1 PHE 56 HD1 PHE 56 -1.193 -12.366 -0.412 398 HD2 PHE 56 HD2 PHE 56 -1.329 -9.374 2.609 399 HE1 PHE 56 HE1 PHE 56 1.263 -12.267 -0.403 400 HE2 PHE 56 HE2 PHE 56 1.129 -9.273 2.624 401 HZ PHE 56 HZ PHE 56 2.425 -10.666 1.087 402 H LYS 57 HN LYS 57 -5.353 -10.712 -1.816 403 HA LYS 57 HA LYS 57 -7.543 -9.408 -0.567 404 HB2 LYS 57 HB2 LYS 57 -7.560 -11.433 -2.808 405 HB3 LYS 57 HB1 LYS 57 -8.897 -10.383 -2.366 406 HG2 LYS 57 HG2 LYS 57 -7.599 -8.429 -2.979 407 HG3 LYS 57 HG1 LYS 57 -6.222 -9.459 -3.387 408 HD2 LYS 57 HD2 LYS 57 -8.928 -9.459 -4.727 409 HD3 LYS 57 HD1 LYS 57 -7.426 -8.831 -5.403 410 HE2 LYS 57 HE2 LYS 57 -6.467 -11.092 -5.343 411 HE3 LYS 57 HE1 LYS 57 -7.982 -11.709 -4.685 412 HZ1 LYS 57 HZ1 LYS 57 -7.685 -10.398 -7.328 413 HZ2 LYS 57 HZ2 LYS 57 -9.104 -11.066 -6.701 414 HZ3 LYS 57 HZ3 LYS 57 -7.793 -12.064 -7.075 415 H GLY 58 HN GLY 58 -8.806 -10.108 1.001 416 HA2 GLY 58 HA2 GLY 58 -10.002 -11.472 2.386 417 HA3 GLY 58 HA1 GLY 58 -10.057 -12.603 1.046 418 H LYS 59 HN LYS 59 -8.790 -14.375 1.061 419 HA LYS 59 HA LYS 59 -7.202 -14.792 3.505 420 HB2 LYS 59 HB2 LYS 59 -8.881 -16.810 2.003 421 HB3 LYS 59 HB1 LYS 59 -7.913 -17.144 3.431 422 HG2 LYS 59 HG2 LYS 59 -10.273 -15.280 3.311 423 HG3 LYS 59 HG1 LYS 59 -10.277 -16.914 3.976 424 HD2 LYS 59 HD2 LYS 59 -8.592 -16.220 5.631 425 HD3 LYS 59 HD1 LYS 59 -8.655 -14.580 4.984 426 HE2 LYS 59 HE2 LYS 59 -10.990 -14.397 5.601 427 HE3 LYS 59 HE1 LYS 59 -10.992 -16.065 6.171 428 HZ1 LYS 59 HZ1 LYS 59 -9.406 -13.833 7.311 429 HZ2 LYS 59 HZ2 LYS 59 -9.350 -15.436 7.844 430 HZ3 LYS 59 HZ3 LYS 59 -10.776 -14.539 8.008 431 H SER 60 HN SER 60 -6.289 -13.845 0.903 432 HA SER 60 HA SER 60 -4.976 -15.880 -0.527 433 HB2 SER 60 HB2 SER 60 -4.231 -12.968 -0.170 434 HB3 SER 60 HB1 SER 60 -3.517 -14.045 -1.365 435 HG SER 60 HG SER 60 -6.314 -13.636 -1.221 436 H THR 61 HN THR 61 -3.042 -16.883 -0.256 437 HA THR 61 HA THR 61 -1.968 -17.042 2.351 438 HB THR 61 HB THR 61 -1.868 -18.976 0.915 439 HG1 THR 61 HG1 THR 61 -0.193 -19.175 2.251 440 HG21 THR 61 HG21 THR 61 -0.390 -19.076 -1.049 441 HG22 THR 61 HG22 THR 61 -0.042 -17.358 -0.863 442 HG23 THR 61 HG23 THR 61 -1.677 -17.889 -1.254 443 H ALA 62 HN ALA 62 -0.368 -15.978 3.314 444 HA ALA 62 HA ALA 62 0.857 -13.754 1.943 445 HB1 ALA 62 HB1 ALA 62 1.271 -14.611 4.800 446 HB2 ALA 62 HB2 ALA 62 -0.090 -13.628 4.266 447 HB3 ALA 62 HB3 ALA 62 1.554 -13.020 4.092 448 H GLY 63 HN GLY 63 1.924 -15.409 0.520 449 HA2 GLY 63 HA2 GLY 63 3.729 -16.632 -0.190 450 HA3 GLY 63 HA1 GLY 63 4.629 -15.425 0.708 451 H ALA 64 HN ALA 64 6.236 -16.826 1.294 452 HA ALA 64 HA ALA 64 5.550 -19.064 3.037 453 HB1 ALA 64 HB1 ALA 64 7.167 -19.545 1.304 454 HB2 ALA 64 HB2 ALA 64 7.962 -19.608 2.877 455 HB3 ALA 64 HB3 ALA 64 8.177 -18.201 1.838 456 H GLN 65 HN GLN 65 4.756 -17.068 4.373 457 HA GLN 65 HA GLN 65 4.889 -15.948 6.341 458 HB2 GLN 65 HB2 GLN 65 7.680 -17.087 6.596 459 HB3 GLN 65 HB1 GLN 65 6.783 -16.273 7.868 460 HG2 GLN 65 HG2 GLN 65 6.044 -18.883 6.565 461 HG3 GLN 65 HG1 GLN 65 6.747 -18.679 8.168 462 HE21 GLN 65 HE21 GLN 65 3.884 -18.400 6.234 463 HE22 GLN 65 HE22 GLN 65 2.779 -18.150 7.540 464 H ASP 66 HN ASP 66 7.558 -15.703 4.108 465 HA ASP 66 HA ASP 66 8.213 -12.995 4.900 466 HB2 ASP 66 HB2 ASP 66 9.152 -14.797 2.679 467 HB3 ASP 66 HB1 ASP 66 9.603 -13.098 2.734 468 H ARG 67 HN ARG 67 5.939 -14.517 2.992 469 HA ARG 67 HA ARG 67 4.120 -13.804 1.862 470 HB2 ARG 67 HB2 ARG 67 4.696 -11.005 2.804 471 HB3 ARG 67 HB1 ARG 67 3.144 -11.780 2.509 472 HG2 ARG 67 HG2 ARG 67 3.456 -13.187 4.472 473 HG3 ARG 67 HG1 ARG 67 5.020 -12.425 4.772 474 HD2 ARG 67 HD2 ARG 67 3.985 -10.296 5.115 475 HD3 ARG 67 HD1 ARG 67 2.414 -10.926 4.629 476 HE ARG 67 HE ARG 67 3.426 -12.364 6.853 477 HH11 ARG 67 HH11 ARG 67 2.066 -9.263 5.982 478 HH12 ARG 67 HH12 ARG 67 1.297 -9.025 7.521 479 HH21 ARG 67 HH21 ARG 67 2.427 -12.037 8.898 480 HH22 ARG 67 HH22 ARG 67 1.508 -10.591 9.173 481 H LYS 68 HN LYS 68 6.186 -14.053 0.109 482 HA LYS 68 HA LYS 68 6.101 -11.609 -1.509 483 HB2 LYS 68 HB2 LYS 68 7.712 -14.133 -1.898 484 HB3 LYS 68 HB1 LYS 68 7.727 -12.768 -2.999 485 HG2 LYS 68 HG2 LYS 68 9.585 -12.297 -1.791 486 HG3 LYS 68 HG1 LYS 68 8.386 -11.454 -0.809 487 HD2 LYS 68 HD2 LYS 68 9.814 -12.718 0.645 488 HD3 LYS 68 HD1 LYS 68 8.222 -13.477 0.623 489 HE2 LYS 68 HE2 LYS 68 9.930 -15.180 0.505 490 HE3 LYS 68 HE1 LYS 68 9.063 -15.116 -1.022 491 HZ1 LYS 68 HZ1 LYS 68 11.723 -13.915 -0.482 492 HZ2 LYS 68 HZ2 LYS 68 10.884 -13.807 -1.948 493 HZ3 LYS 68 HZ3 LYS 68 11.425 -15.308 -1.392 494 H LYS 69 HN LYS 69 3.765 -13.301 -1.121 495 HA LYS 69 HA LYS 69 3.256 -13.936 -3.934 496 HB2 LYS 69 HB2 LYS 69 3.742 -16.035 -2.660 497 HB3 LYS 69 HB1 LYS 69 2.364 -15.681 -1.631 498 HG2 LYS 69 HG2 LYS 69 1.813 -17.329 -3.335 499 HG3 LYS 69 HG1 LYS 69 0.872 -15.849 -3.546 500 HD2 LYS 69 HD2 LYS 69 2.408 -15.119 -5.301 501 HD3 LYS 69 HD1 LYS 69 3.365 -16.585 -5.081 502 HE2 LYS 69 HE2 LYS 69 1.526 -17.951 -5.796 503 HE3 LYS 69 HE1 LYS 69 0.457 -16.551 -5.863 504 HZ1 LYS 69 HZ1 LYS 69 1.803 -15.640 -7.638 505 HZ2 LYS 69 HZ2 LYS 69 1.256 -17.184 -8.057 506 HZ3 LYS 69 HZ3 LYS 69 2.855 -16.960 -7.562 507 HA PRO 70 HA PRO 70 -0.160 -11.428 -2.136 508 HB2 PRO 70 HB2 PRO 70 0.068 -9.266 -3.728 509 HB3 PRO 70 HB1 PRO 70 1.019 -9.468 -2.255 510 HG2 PRO 70 HG2 PRO 70 1.846 -9.713 -5.078 511 HG3 PRO 70 HG1 PRO 70 2.805 -9.281 -3.657 512 HD2 PRO 70 HD2 PRO 70 2.692 -11.804 -4.947 513 HD3 PRO 70 HD1 PRO 70 3.506 -11.414 -3.421 514 H SER 71 HN SER 71 -2.123 -10.602 -3.229 515 HA SER 71 HA SER 71 -2.613 -12.119 -5.707 516 HB2 SER 71 HB2 SER 71 -3.898 -12.659 -3.526 517 HB3 SER 71 HB1 SER 71 -4.759 -11.151 -3.825 518 HG SER 71 HG SER 71 -4.536 -13.147 -5.812 519 H GLY 72 HN GLY 72 -1.511 -9.385 -5.228 520 HA2 GLY 72 HA2 GLY 72 -2.365 -8.105 -7.487 521 HA3 GLY 72 HA1 GLY 72 -3.425 -7.507 -6.214 522 H GLY 73 HN GLY 73 -1.464 -5.978 -7.709 523 HA2 GLY 73 HA2 GLY 73 -0.374 -4.451 -5.670 524 HA3 GLY 73 HA1 GLY 73 0.867 -5.601 -6.138 525 H PHE 74 HN PHE 74 1.284 -2.911 -6.362 526 HA PHE 74 HA PHE 74 1.801 -2.704 -9.202 527 HB2 PHE 74 HB2 PHE 74 0.820 -0.511 -9.492 528 HB3 PHE 74 HB1 PHE 74 -0.421 -1.623 -8.949 529 HD1 PHE 74 HD1 PHE 74 -0.172 -1.643 -6.058 530 HD2 PHE 74 HD2 PHE 74 0.325 1.581 -8.782 531 HE1 PHE 74 HE1 PHE 74 -0.777 -0.042 -4.285 532 HE2 PHE 74 HE2 PHE 74 -0.281 3.173 -7.021 533 HZ PHE 74 HZ PHE 74 -0.831 2.364 -4.764 534 HA PRO 75 HA PRO 75 5.568 -0.979 -7.757 535 HB2 PRO 75 HB2 PRO 75 5.688 0.866 -10.021 536 HB3 PRO 75 HB1 PRO 75 6.699 -0.535 -9.669 537 HG2 PRO 75 HG2 PRO 75 4.907 -0.495 -11.694 538 HG3 PRO 75 HG1 PRO 75 5.333 -1.975 -10.818 539 HD2 PRO 75 HD2 PRO 75 2.909 -0.242 -10.555 540 HD3 PRO 75 HD1 PRO 75 3.053 -2.009 -10.481 541 H VAL 76 HN VAL 76 6.226 0.559 -6.440 542 HA VAL 76 HA VAL 76 4.470 2.576 -5.542 543 HB VAL 76 HB VAL 76 7.420 2.202 -4.999 544 HG11 VAL 76 HG11 VAL 76 5.384 3.814 -3.472 545 HG12 VAL 76 HG12 VAL 76 6.659 4.474 -4.496 546 HG13 VAL 76 HG13 VAL 76 7.075 3.579 -3.034 547 HG21 VAL 76 HG21 VAL 76 6.733 1.068 -2.985 548 HG22 VAL 76 HG22 VAL 76 5.990 0.283 -4.379 549 HG23 VAL 76 HG23 VAL 76 5.037 1.360 -3.359 550 H ASP 77 HN ASP 77 7.323 2.649 -7.598 551 HA ASP 77 HA ASP 77 7.524 5.481 -7.750 552 HB2 ASP 77 HB2 ASP 77 9.429 4.048 -8.219 553 HB3 ASP 77 HB1 ASP 77 8.569 3.284 -9.546 554 H LYS 78 HN LYS 78 5.302 3.322 -9.019 555 HA LYS 78 HA LYS 78 4.792 4.911 -11.425 556 HB2 LYS 78 HB2 LYS 78 4.180 2.105 -10.614 557 HB3 LYS 78 HB1 LYS 78 3.142 2.883 -11.797 558 HG2 LYS 78 HG2 LYS 78 4.959 1.526 -12.792 559 HG3 LYS 78 HG1 LYS 78 4.975 3.213 -13.299 560 HD2 LYS 78 HD2 LYS 78 6.706 3.603 -11.497 561 HD3 LYS 78 HD1 LYS 78 6.803 1.850 -11.333 562 HE2 LYS 78 HE2 LYS 78 7.514 1.613 -13.609 563 HE3 LYS 78 HE1 LYS 78 7.226 3.323 -13.926 564 HZ1 LYS 78 HZ1 LYS 78 9.546 3.006 -13.613 565 HZ2 LYS 78 HZ2 LYS 78 9.313 2.157 -12.172 566 HZ3 LYS 78 HZ3 LYS 78 8.967 3.815 -12.238 567 H ILE 79 HN ILE 79 3.697 4.678 -8.277 568 HA ILE 79 HA ILE 79 0.924 5.128 -8.584 569 HB ILE 79 HB ILE 79 2.613 6.327 -6.389 570 HG12 ILE 79 HG12 ILE 79 1.540 3.504 -6.584 571 HG13 ILE 79 HG11 ILE 79 3.234 3.975 -6.566 572 HG21 ILE 79 HG21 ILE 79 0.311 7.060 -6.437 573 HG22 ILE 79 HG22 ILE 79 0.563 5.987 -5.059 574 HG23 ILE 79 HG23 ILE 79 -0.250 5.389 -6.505 575 HD11 ILE 79 HD11 ILE 79 1.258 4.244 -4.315 576 HD12 ILE 79 HD12 ILE 79 2.904 4.879 -4.284 577 HD13 ILE 79 HD13 ILE 79 2.630 3.138 -4.408 578 H THR 80 HN THR 80 -0.151 6.901 -9.305 579 HA THR 80 HA THR 80 1.475 9.141 -10.146 580 HB THR 80 HB THR 80 -0.142 8.204 -11.740 581 HG1 THR 80 HG1 THR 80 0.421 10.651 -11.384 582 HG21 THR 80 HG21 THR 80 -1.945 7.605 -10.210 583 HG22 THR 80 HG22 THR 80 -2.533 8.669 -11.490 584 HG23 THR 80 HG23 THR 80 -2.237 9.312 -9.873 585 H SER 81 HN SER 81 -1.108 8.451 -7.840 586 HA SER 81 HA SER 81 -0.414 10.811 -6.347 587 HB2 SER 81 HB2 SER 81 -3.139 10.600 -7.638 588 HB3 SER 81 HB1 SER 81 -2.751 11.730 -6.344 589 HG SER 81 HG SER 81 -0.929 11.892 -8.333 590 H VAL 82 HN VAL 82 -0.600 10.377 -4.265 591 HA VAL 82 HA VAL 82 -2.615 8.428 -3.372 592 HB VAL 82 HB VAL 82 -0.017 9.274 -2.064 593 HG11 VAL 82 HG11 VAL 82 -2.168 7.495 -0.914 594 HG12 VAL 82 HG12 VAL 82 -1.778 9.123 -0.361 595 HG13 VAL 82 HG13 VAL 82 -0.596 7.828 -0.188 596 HG21 VAL 82 HG21 VAL 82 0.259 7.585 -3.755 597 HG22 VAL 82 HG22 VAL 82 -1.044 6.622 -3.057 598 HG23 VAL 82 HG23 VAL 82 0.460 6.850 -2.164 599 H LYS 83 HN LYS 83 -4.367 9.477 -2.799 600 HA LYS 83 HA LYS 83 -4.109 12.023 -1.357 601 HB2 LYS 83 HB2 LYS 83 -6.436 12.021 -3.029 602 HB3 LYS 83 HB1 LYS 83 -5.066 13.124 -3.058 603 HG2 LYS 83 HG2 LYS 83 -4.175 12.166 -4.870 604 HG3 LYS 83 HG1 LYS 83 -4.516 10.534 -4.298 605 HD2 LYS 83 HD2 LYS 83 -6.964 11.128 -4.858 606 HD3 LYS 83 HD1 LYS 83 -6.246 12.399 -5.853 607 HE2 LYS 83 HE2 LYS 83 -4.907 10.683 -7.001 608 HE3 LYS 83 HE1 LYS 83 -5.722 9.441 -6.055 609 HZ1 LYS 83 HZ1 LYS 83 -6.907 11.240 -8.085 610 HZ2 LYS 83 HZ2 LYS 83 -7.842 10.316 -7.025 611 HZ3 LYS 83 HZ3 LYS 83 -6.809 9.550 -8.128 612 H SER 84 HN SER 84 -6.172 12.638 -0.294 613 HA SER 84 HA SER 84 -7.744 10.272 0.450 614 HB2 SER 84 HB2 SER 84 -8.233 11.472 2.573 615 HB3 SER 84 HB1 SER 84 -6.519 11.133 2.360 616 HG SER 84 HG SER 84 -7.830 13.545 2.489 617 H GLN 85 HN GLN 85 -10.023 10.614 0.760 618 HA GLN 85 HA GLN 85 -11.244 12.056 -1.318 619 HB2 GLN 85 HB2 GLN 85 -12.030 10.256 0.768 620 HB3 GLN 85 HB1 GLN 85 -13.190 11.571 0.653 621 HG2 GLN 85 HG2 GLN 85 -13.946 9.807 -0.723 622 HG3 GLN 85 HG1 GLN 85 -13.376 11.095 -1.781 623 HE21 GLN 85 HE21 GLN 85 -11.322 8.866 -0.034 624 HE22 GLN 85 HE22 GLN 85 -10.724 8.027 -1.418 625 H ALA 86 HN ALA 86 -13.418 13.377 -0.500 626 HA ALA 86 HA ALA 86 -12.351 15.896 0.269 627 HB1 ALA 86 HB1 ALA 86 -14.264 15.661 -1.249 628 HB2 ALA 86 HB2 ALA 86 -14.627 16.709 0.122 629 HB3 ALA 86 HB3 ALA 86 -15.239 15.056 0.089 630 H ASP 87 HN ASP 87 -14.444 13.547 1.929 631 HA ASP 87 HA ASP 87 -13.917 14.993 4.450 632 HB2 ASP 87 HB2 ASP 87 -16.258 14.728 4.199 633 HB3 ASP 87 HB1 ASP 87 -16.091 13.075 3.622 634 H ASN 88 HN ASN 88 -13.570 12.045 2.732 635 HA ASN 88 HA ASN 88 -12.435 10.105 3.128 636 HB2 ASN 88 HB2 ASN 88 -10.054 10.540 3.323 637 HB3 ASN 88 HB1 ASN 88 -10.823 11.668 2.221 638 HD21 ASN 88 HD21 ASN 88 -9.094 11.317 5.187 639 HD22 ASN 88 HD22 ASN 88 -8.919 13.004 5.533 640 H THR 89 HN THR 89 -13.958 10.405 5.497 641 HA THR 89 HA THR 89 -12.447 10.340 7.842 642 HB THR 89 HB THR 89 -14.985 8.800 7.271 643 HG1 THR 89 HG1 THR 89 -15.164 11.121 7.080 644 HG21 THR 89 HG21 THR 89 -13.829 7.893 9.211 645 HG22 THR 89 HG22 THR 89 -15.271 8.776 9.713 646 HG23 THR 89 HG23 THR 89 -13.679 9.511 9.894 647 H LYS 90 HN LYS 90 -13.784 7.455 6.214 648 HA LYS 90 HA LYS 90 -11.261 6.092 6.856 649 HB2 LYS 90 HB2 LYS 90 -12.533 3.973 6.697 650 HB3 LYS 90 HB1 LYS 90 -13.099 5.038 7.978 651 HG2 LYS 90 HG2 LYS 90 -14.928 5.802 6.518 652 HG3 LYS 90 HG1 LYS 90 -14.396 4.658 5.288 653 HD2 LYS 90 HD2 LYS 90 -16.292 3.836 6.671 654 HD3 LYS 90 HD1 LYS 90 -14.866 2.799 6.736 655 HE2 LYS 90 HE2 LYS 90 -14.244 3.668 8.874 656 HE3 LYS 90 HE1 LYS 90 -15.499 4.908 8.793 657 HZ1 LYS 90 HZ1 LYS 90 -16.187 3.100 10.210 658 HZ2 LYS 90 HZ2 LYS 90 -15.946 1.980 8.969 659 HZ3 LYS 90 HZ3 LYS 90 -17.166 3.137 8.833 660 H VAL 91 HN VAL 91 -12.204 7.767 4.432 661 HA VAL 91 HA VAL 91 -12.088 5.677 2.362 662 HB VAL 91 HB VAL 91 -13.084 8.473 1.902 663 HG11 VAL 91 HG11 VAL 91 -14.321 7.398 0.073 664 HG12 VAL 91 HG12 VAL 91 -13.636 5.838 0.528 665 HG13 VAL 91 HG13 VAL 91 -12.585 7.124 -0.068 666 HG21 VAL 91 HG21 VAL 91 -14.716 6.109 2.832 667 HG22 VAL 91 HG22 VAL 91 -15.366 7.656 2.290 668 HG23 VAL 91 HG23 VAL 91 -14.385 7.577 3.753 669 H LEU 92 HN LEU 92 -10.028 5.502 1.733 670 HA LEU 92 HA LEU 92 -8.479 7.910 1.101 671 HB2 LEU 92 HB2 LEU 92 -7.819 5.058 1.612 672 HB3 LEU 92 HB1 LEU 92 -6.783 5.946 0.516 673 HG LEU 92 HG LEU 92 -6.076 7.430 2.194 674 HD11 LEU 92 HD11 LEU 92 -8.149 7.983 3.247 675 HD12 LEU 92 HD12 LEU 92 -7.036 7.401 4.485 676 HD13 LEU 92 HD13 LEU 92 -8.319 6.347 3.880 677 HD21 LEU 92 HD21 LEU 92 -5.254 5.908 3.963 678 HD22 LEU 92 HD22 LEU 92 -5.019 5.276 2.334 679 HD23 LEU 92 HD23 LEU 92 -6.329 4.653 3.338 680 H VAL 93 HN VAL 93 -7.539 8.203 -0.978 681 HA VAL 93 HA VAL 93 -8.596 6.476 -3.088 682 HB VAL 93 HB VAL 93 -10.075 8.292 -3.245 683 HG11 VAL 93 HG11 VAL 93 -9.333 10.653 -3.303 684 HG12 VAL 93 HG12 VAL 93 -7.706 10.109 -2.891 685 HG13 VAL 93 HG13 VAL 93 -9.037 9.851 -1.760 686 HG21 VAL 93 HG21 VAL 93 -7.851 8.891 -5.181 687 HG22 VAL 93 HG22 VAL 93 -9.539 9.376 -5.346 688 HG23 VAL 93 HG23 VAL 93 -9.104 7.671 -5.390 689 H ILE 94 HN ILE 94 -6.890 5.546 -3.932 690 HA ILE 94 HA ILE 94 -4.469 7.163 -4.408 691 HB ILE 94 HB ILE 94 -4.750 4.308 -3.502 692 HG12 ILE 94 HG12 ILE 94 -2.884 5.066 -1.943 693 HG13 ILE 94 HG11 ILE 94 -3.178 6.695 -2.532 694 HG21 ILE 94 HG21 ILE 94 -3.291 4.248 -5.450 695 HG22 ILE 94 HG22 ILE 94 -2.384 3.930 -3.970 696 HG23 ILE 94 HG23 ILE 94 -2.281 5.511 -4.743 697 HD11 ILE 94 HD11 ILE 94 -5.447 6.611 -1.678 698 HD12 ILE 94 HD12 ILE 94 -4.276 6.280 -0.400 699 HD13 ILE 94 HD13 ILE 94 -5.187 4.957 -1.128 700 H THR 95 HN THR 95 -3.880 7.340 -6.475 701 HA THR 95 HA THR 95 -5.018 5.412 -8.396 702 HB THR 95 HB THR 95 -4.343 8.304 -8.972 703 HG1 THR 95 HG1 THR 95 -6.946 7.177 -8.651 704 HG21 THR 95 HG21 THR 95 -5.667 7.948 -11.002 705 HG22 THR 95 HG22 THR 95 -5.943 6.270 -10.537 706 HG23 THR 95 HG23 THR 95 -4.314 6.819 -10.931 707 H VAL 96 HN VAL 96 -3.673 4.633 -9.991 708 HA VAL 96 HA VAL 96 -0.834 5.341 -9.763 709 HB VAL 96 HB VAL 96 -1.005 3.147 -8.939 710 HG11 VAL 96 HG11 VAL 96 -2.737 2.450 -11.301 711 HG12 VAL 96 HG12 VAL 96 -3.308 2.730 -9.656 712 HG13 VAL 96 HG13 VAL 96 -2.252 1.359 -10.002 713 HG21 VAL 96 HG21 VAL 96 0.044 1.734 -10.705 714 HG22 VAL 96 HG22 VAL 96 0.805 3.311 -10.493 715 HG23 VAL 96 HG23 VAL 96 -0.282 3.030 -11.854 716 H ASN 97 HN ASN 97 0.356 5.611 -11.686 717 HA ASN 97 HA ASN 97 -1.191 5.360 -14.162 718 HB2 ASN 97 HB2 ASN 97 -1.166 7.736 -13.404 719 HB3 ASN 97 HB1 ASN 97 0.586 7.715 -13.570 720 HD21 ASN 97 HD21 ASN 97 -2.454 7.688 -15.241 721 HD22 ASN 97 HD22 ASN 97 -1.821 8.012 -16.819 722 H ASN 98 HN ASN 98 -0.163 3.593 -14.755 723 HA ASN 98 HA ASN 98 1.770 3.759 -16.620 724 HB2 ASN 98 HB2 ASN 98 3.430 4.282 -14.860 725 HB3 ASN 98 HB1 ASN 98 3.075 2.749 -14.081 726 HD21 ASN 98 HD21 ASN 98 3.853 0.844 -14.982 727 HD22 ASN 98 HD22 ASN 98 5.033 0.837 -16.246 728 HA PRO 99 HA PRO 99 0.137 -0.744 -15.566 729 HB2 PRO 99 HB2 PRO 99 -1.169 -0.052 -12.995 730 HB3 PRO 99 HB1 PRO 99 -0.406 -1.567 -13.492 731 HG2 PRO 99 HG2 PRO 99 0.755 0.081 -11.735 732 HG3 PRO 99 HG1 PRO 99 1.698 -0.852 -12.908 733 HD2 PRO 99 HD2 PRO 99 1.010 2.047 -12.906 734 HD3 PRO 99 HD1 PRO 99 2.472 1.222 -13.478 735 H GLN 100 HN GLN 100 -2.306 -1.201 -15.509 736 HA GLN 100 HA GLN 100 -3.645 0.803 -16.954 737 HB2 GLN 100 HB2 GLN 100 -5.620 -0.591 -16.787 738 HB3 GLN 100 HB1 GLN 100 -4.219 -1.616 -17.064 739 HG2 GLN 100 HG2 GLN 100 -4.178 -2.289 -14.774 740 HG3 GLN 100 HG1 GLN 100 -5.421 -1.110 -14.359 741 HE21 GLN 100 HE21 GLN 100 -5.498 -3.066 -17.260 742 HE22 GLN 100 HE22 GLN 100 -6.850 -4.036 -16.791 743 HA PRO 101 HA PRO 101 -4.523 3.714 -13.812 744 HB2 PRO 101 HB2 PRO 101 -7.007 4.251 -15.361 745 HB3 PRO 101 HB1 PRO 101 -5.740 5.367 -14.841 746 HG2 PRO 101 HG2 PRO 101 -5.901 4.592 -17.382 747 HG3 PRO 101 HG1 PRO 101 -4.328 4.787 -16.589 748 HD2 PRO 101 HD2 PRO 101 -5.829 2.282 -17.231 749 HD3 PRO 101 HD1 PRO 101 -4.084 2.603 -17.289 750 H THR 102 HN THR 102 -5.104 2.924 -11.937 751 HA THR 102 HA THR 102 -7.899 2.166 -11.532 752 HB THR 102 HB THR 102 -5.591 0.614 -10.338 753 HG1 THR 102 HG1 THR 102 -5.695 0.220 -12.587 754 HG21 THR 102 HG21 THR 102 -8.562 0.061 -10.447 755 HG22 THR 102 HG22 THR 102 -7.657 0.575 -9.022 756 HG23 THR 102 HG23 THR 102 -7.341 -1.004 -9.745 757 H THR 103 HN THR 103 -8.727 2.854 -9.613 758 HA THR 103 HA THR 103 -6.905 4.358 -7.865 759 HB THR 103 HB THR 103 -9.798 4.891 -8.537 760 HG1 THR 103 HG1 THR 103 -8.314 5.623 -10.102 761 HG21 THR 103 HG21 THR 103 -9.622 6.846 -7.092 762 HG22 THR 103 HG22 THR 103 -7.989 6.365 -6.632 763 HG23 THR 103 HG23 THR 103 -9.366 5.361 -6.175 764 H TYR 104 HN TYR 104 -6.556 3.285 -6.077 765 HA TYR 104 HA TYR 104 -8.480 1.309 -5.143 766 HB2 TYR 104 HB2 TYR 104 -5.713 1.938 -4.093 767 HB3 TYR 104 HB1 TYR 104 -6.676 0.502 -3.747 768 HD1 TYR 104 HD1 TYR 104 -7.118 -1.149 -5.570 769 HD2 TYR 104 HD2 TYR 104 -4.379 2.078 -6.039 770 HE1 TYR 104 HE1 TYR 104 -6.095 -2.315 -7.478 771 HE2 TYR 104 HE2 TYR 104 -3.358 0.920 -7.965 772 HH TYR 104 HH TYR 104 -3.135 -1.344 -8.859 773 H ASN 105 HN ASN 105 -9.889 1.765 -3.601 774 HA ASN 105 HA ASN 105 -9.340 4.040 -1.832 775 HB2 ASN 105 HB2 ASN 105 -11.953 2.613 -2.386 776 HB3 ASN 105 HB1 ASN 105 -11.749 3.916 -1.226 777 HD21 ASN 105 HD21 ASN 105 -10.342 3.663 -4.457 778 HD22 ASN 105 HD22 ASN 105 -11.149 5.049 -5.100 779 H PHE 106 HN PHE 106 -8.266 3.378 -0.094 780 HA PHE 106 HA PHE 106 -8.717 0.727 0.987 781 HB2 PHE 106 HB2 PHE 106 -6.927 2.944 2.015 782 HB3 PHE 106 HB1 PHE 106 -6.900 1.266 2.540 783 HD1 PHE 106 HD1 PHE 106 -6.310 -0.504 0.754 784 HD2 PHE 106 HD2 PHE 106 -5.583 3.658 0.280 785 HE1 PHE 106 HE1 PHE 106 -4.641 -1.001 -0.978 786 HE2 PHE 106 HE2 PHE 106 -3.914 3.169 -1.461 787 HZ PHE 106 HZ PHE 106 -3.441 0.838 -2.090 788 H THR 107 HN THR 107 -10.430 0.422 2.214 789 HA THR 107 HA THR 107 -11.280 2.574 4.041 790 HB THR 107 HB THR 107 -13.112 0.536 2.759 791 HG1 THR 107 HG1 THR 107 -12.042 1.989 1.226 792 HG21 THR 107 HG21 THR 107 -13.649 3.194 4.093 793 HG22 THR 107 HG22 THR 107 -13.940 1.609 4.810 794 HG23 THR 107 HG23 THR 107 -14.861 2.121 3.395 795 H PHE 108 HN PHE 108 -11.605 2.026 6.151 796 HA PHE 108 HA PHE 108 -11.960 -0.785 6.842 797 HB2 PHE 108 HB2 PHE 108 -9.483 0.037 7.075 798 HB3 PHE 108 HB1 PHE 108 -10.093 0.836 8.518 799 HD1 PHE 108 HD1 PHE 108 -9.904 -0.274 10.497 800 HD2 PHE 108 HD2 PHE 108 -10.304 -2.524 6.906 801 HE1 PHE 108 HE1 PHE 108 -9.718 -2.359 11.789 802 HE2 PHE 108 HE2 PHE 108 -10.121 -4.614 8.194 803 HZ PHE 108 HZ PHE 108 -9.827 -4.533 10.637 804 H LYS 109 HN LYS 109 -12.567 -0.946 9.264 805 HA LYS 109 HA LYS 109 -14.691 0.823 9.858 806 HB2 LYS 109 HB2 LYS 109 -14.616 -1.487 10.670 807 HB3 LYS 109 HB1 LYS 109 -13.179 -1.126 11.610 808 HG2 LYS 109 HG2 LYS 109 -15.678 0.396 12.148 809 HG3 LYS 109 HG1 LYS 109 -15.516 -1.253 12.750 810 HD2 LYS 109 HD2 LYS 109 -13.506 0.932 13.248 811 HD3 LYS 109 HD1 LYS 109 -14.807 0.527 14.368 812 HE2 LYS 109 HE2 LYS 109 -12.575 -1.294 13.464 813 HE3 LYS 109 HE1 LYS 109 -12.715 -0.522 15.041 814 HZ1 LYS 109 HZ1 LYS 109 -13.442 -2.790 15.175 815 HZ2 LYS 109 HZ2 LYS 109 -14.544 -2.569 13.915 816 HZ3 LYS 109 HZ3 LYS 109 -14.779 -1.777 15.390 817 H SER 110 HN SER 110 -11.313 0.850 10.502 818 HA SER 110 HA SER 110 -11.540 2.849 12.617 819 HB2 SER 110 HB2 SER 110 -10.059 0.875 12.953 820 HB3 SER 110 HB1 SER 110 -9.136 1.376 11.543 821 HG SER 110 HG SER 110 -9.413 2.759 14.001 822 HA PRO 111 HA PRO 111 -10.775 5.913 9.367 823 HB2 PRO 111 HB2 PRO 111 -10.735 7.694 11.729 824 HB3 PRO 111 HB1 PRO 111 -11.705 7.803 10.258 825 HG2 PRO 111 HG2 PRO 111 -12.795 7.069 12.587 826 HG3 PRO 111 HG1 PRO 111 -13.315 6.344 11.054 827 HD2 PRO 111 HD2 PRO 111 -11.511 5.228 13.166 828 HD3 PRO 111 HD1 PRO 111 -12.762 4.414 12.202 829 H GLY 112 HN GLY 112 -9.113 5.572 12.465 830 HA2 GLY 112 HA2 GLY 112 -6.910 7.261 11.770 831 HA3 GLY 112 HA1 GLY 112 -6.989 6.164 13.143 832 H GLU 113 HN GLU 113 -7.690 3.945 11.271 833 HA GLU 113 HA GLU 113 -5.113 2.879 10.908 834 HB2 GLU 113 HB2 GLU 113 -7.463 1.712 11.025 835 HB3 GLU 113 HB1 GLU 113 -7.479 1.976 9.293 836 HG2 GLU 113 HG2 GLU 113 -6.683 -0.264 9.969 837 HG3 GLU 113 HG1 GLU 113 -5.525 0.647 8.998 838 H ARG 114 HN ARG 114 -7.461 4.151 8.589 839 HA ARG 114 HA ARG 114 -5.711 3.912 6.372 840 HB2 ARG 114 HB2 ARG 114 -7.484 5.667 5.411 841 HB3 ARG 114 HB1 ARG 114 -7.756 3.932 5.476 842 HG2 ARG 114 HG2 ARG 114 -8.615 5.349 7.883 843 HG3 ARG 114 HG1 ARG 114 -9.458 5.817 6.407 844 HD2 ARG 114 HD2 ARG 114 -10.508 3.905 7.600 845 HD3 ARG 114 HD1 ARG 114 -10.038 3.542 5.938 846 HE ARG 114 HE ARG 114 -8.874 2.523 8.379 847 HH11 ARG 114 HH11 ARG 114 -8.801 2.644 4.865 848 HH12 ARG 114 HH12 ARG 114 -7.666 1.342 4.712 849 HH21 ARG 114 HH21 ARG 114 -7.357 0.784 8.158 850 HH22 ARG 114 HH22 ARG 114 -6.842 0.290 6.585 851 H GLU 115 HN GLU 115 -6.527 6.543 8.556 852 HA GLU 115 HA GLU 115 -5.298 8.606 7.115 853 HB2 GLU 115 HB2 GLU 115 -5.632 8.263 10.093 854 HB3 GLU 115 HB1 GLU 115 -5.022 9.733 9.347 855 HG2 GLU 115 HG2 GLU 115 -7.148 9.839 8.033 856 HG3 GLU 115 HG1 GLU 115 -7.743 8.504 9.017 857 H SER 116 HN SER 116 -3.951 6.403 9.523 858 HA SER 116 HA SER 116 -1.317 7.416 9.409 859 HB2 SER 116 HB2 SER 116 -2.242 4.629 10.139 860 HB3 SER 116 HB1 SER 116 -0.676 5.340 10.534 861 HG SER 116 HG SER 116 -3.233 5.979 11.546 862 H TRP 117 HN TRP 117 -3.051 5.036 7.497 863 HA TRP 117 HA TRP 117 -0.779 3.906 6.209 864 HB2 TRP 117 HB2 TRP 117 -3.310 3.117 6.367 865 HB3 TRP 117 HB1 TRP 117 -3.452 4.015 4.860 866 HD1 TRP 117 HD1 TRP 117 -2.207 0.781 6.286 867 HE1 TRP 117 HE1 TRP 117 -1.275 -0.711 4.410 868 HE3 TRP 117 HE3 TRP 117 -2.164 4.195 2.483 869 HZ2 TRP 117 HZ2 TRP 117 -0.591 -0.470 1.702 870 HZ3 TRP 117 HZ3 TRP 117 -1.349 3.477 0.275 871 HH2 TRP 117 HH2 TRP 117 -0.582 1.193 -0.106 872 H GLN 118 HN GLN 118 -3.099 6.409 5.359 873 HA GLN 118 HA GLN 118 -2.361 7.018 2.772 874 HB2 GLN 118 HB2 GLN 118 -4.366 7.891 3.722 875 HB3 GLN 118 HB1 GLN 118 -3.485 8.711 4.998 876 HG2 GLN 118 HG2 GLN 118 -4.310 10.291 3.381 877 HG3 GLN 118 HG1 GLN 118 -2.549 10.257 3.360 878 HE21 GLN 118 HE21 GLN 118 -4.481 7.771 1.865 879 HE22 GLN 118 HE22 GLN 118 -4.109 8.200 0.237 880 H GLU 119 HN GLU 119 -1.084 8.443 5.773 881 HA GLU 119 HA GLU 119 0.745 10.133 4.377 882 HB2 GLU 119 HB2 GLU 119 1.649 10.568 6.663 883 HB3 GLU 119 HB1 GLU 119 -0.083 10.832 6.508 884 HG2 GLU 119 HG2 GLU 119 -0.478 8.613 7.484 885 HG3 GLU 119 HG1 GLU 119 1.260 8.436 7.723 886 H GLN 120 HN GLN 120 0.965 6.967 5.918 887 HA GLN 120 HA GLN 120 3.770 6.802 6.051 888 HB2 GLN 120 HB2 GLN 120 1.554 4.794 6.072 889 HB3 GLN 120 HB1 GLN 120 3.223 4.251 5.984 890 HG2 GLN 120 HG2 GLN 120 2.069 6.002 8.140 891 HG3 GLN 120 HG1 GLN 120 2.367 4.270 8.274 892 HE21 GLN 120 HE21 GLN 120 4.830 4.589 6.621 893 HE22 GLN 120 HE22 GLN 120 6.017 5.218 7.716 894 H ILE 121 HN ILE 121 1.486 5.640 3.615 895 HA ILE 121 HA ILE 121 3.342 4.347 1.974 896 HB ILE 121 HB ILE 121 0.947 3.993 1.769 897 HG12 ILE 121 HG12 ILE 121 0.749 4.135 -0.724 898 HG13 ILE 121 HG11 ILE 121 2.239 5.073 -0.742 899 HG21 ILE 121 HG21 ILE 121 -0.467 5.663 0.598 900 HG22 ILE 121 HG22 ILE 121 0.865 6.816 0.725 901 HG23 ILE 121 HG23 ILE 121 0.096 6.191 2.185 902 HD11 ILE 121 HD11 ILE 121 3.459 3.201 0.168 903 HD12 ILE 121 HD12 ILE 121 2.595 2.715 -1.289 904 HD13 ILE 121 HD13 ILE 121 1.970 2.265 0.298 905 H GLN 122 HN GLN 122 2.312 7.711 2.086 906 HA GLN 122 HA GLN 122 3.481 8.505 -0.362 907 HB2 GLN 122 HB2 GLN 122 2.699 10.051 2.103 908 HB3 GLN 122 HB1 GLN 122 3.360 10.822 0.669 909 HG2 GLN 122 HG2 GLN 122 1.507 9.993 -0.657 910 HG3 GLN 122 HG1 GLN 122 0.852 9.169 0.757 911 HE21 GLN 122 HE21 GLN 122 -0.141 10.350 2.354 912 HE22 GLN 122 HE22 GLN 122 -0.609 12.003 2.141 913 H SER 123 HN SER 123 4.674 8.393 2.943 914 HA SER 123 HA SER 123 7.141 9.677 2.471 915 HB2 SER 123 HB2 SER 123 6.512 7.577 4.556 916 HB3 SER 123 HB1 SER 123 7.800 8.781 4.624 917 HG SER 123 HG SER 123 5.503 9.079 5.662 918 H LEU 124 HN LEU 124 6.098 6.314 2.247 919 HA LEU 124 HA LEU 124 8.648 5.187 1.739 920 HB2 LEU 124 HB2 LEU 124 6.649 3.903 2.460 921 HB3 LEU 124 HB1 LEU 124 5.908 4.207 0.906 922 HG LEU 124 HG LEU 124 6.976 1.897 1.344 923 HD11 LEU 124 HD11 LEU 124 7.690 3.433 -1.141 924 HD12 LEU 124 HD12 LEU 124 6.163 2.606 -0.832 925 HD13 LEU 124 HD13 LEU 124 7.655 1.678 -0.983 926 HD21 LEU 124 HD21 LEU 124 9.099 2.704 2.232 927 HD22 LEU 124 HD22 LEU 124 9.460 3.472 0.688 928 HD23 LEU 124 HD23 LEU 124 9.337 1.716 0.791 929 H MET 125 HN MET 125 6.071 6.402 -0.345 930 HA MET 125 HA MET 125 7.188 5.792 -2.836 931 HB2 MET 125 HB2 MET 125 5.463 8.135 -2.023 932 HB3 MET 125 HB1 MET 125 5.784 7.651 -3.682 933 HG2 MET 125 HG2 MET 125 4.502 5.746 -3.514 934 HG3 MET 125 HG1 MET 125 4.600 5.712 -1.753 935 HE1 MET 125 HE1 MET 125 2.173 8.918 -4.000 936 HE2 MET 125 HE2 MET 125 3.274 7.795 -4.798 937 HE3 MET 125 HE3 MET 125 3.913 9.037 -3.711 938 H LYS 126 HN LYS 126 7.420 8.761 -0.912 939 HA LYS 126 HA LYS 126 9.093 10.108 -2.770 940 HB2 LYS 126 HB2 LYS 126 8.527 10.626 0.149 941 HB3 LYS 126 HB1 LYS 126 9.431 11.720 -0.891 942 HG2 LYS 126 HG2 LYS 126 6.593 10.846 -1.414 943 HG3 LYS 126 HG1 LYS 126 7.045 12.345 -0.592 944 HD2 LYS 126 HD2 LYS 126 8.275 13.059 -2.592 945 HD3 LYS 126 HD1 LYS 126 7.812 11.563 -3.404 946 HE2 LYS 126 HE2 LYS 126 5.919 13.675 -2.389 947 HE3 LYS 126 HE1 LYS 126 6.388 13.440 -4.069 948 HZ1 LYS 126 HZ1 LYS 126 5.413 11.207 -3.956 949 HZ2 LYS 126 HZ2 LYS 126 4.270 12.416 -3.661 950 HZ3 LYS 126 HZ3 LYS 126 4.893 11.516 -2.375 951 H PHE 127 HN PHE 127 9.701 7.773 -0.365 952 HA PHE 127 HA PHE 127 12.428 8.380 0.150 953 HB2 PHE 127 HB2 PHE 127 11.040 6.977 1.639 954 HB3 PHE 127 HB1 PHE 127 10.972 5.739 0.380 955 HD1 PHE 127 HD1 PHE 127 12.494 4.037 0.423 956 HD2 PHE 127 HD2 PHE 127 13.468 7.700 2.351 957 HE1 PHE 127 HE1 PHE 127 14.577 3.045 1.252 958 HE2 PHE 127 HE2 PHE 127 15.561 6.709 3.190 959 HZ PHE 127 HZ PHE 127 16.117 4.377 2.635 960 H MET 128 HN MET 128 10.839 6.028 -2.001 961 HA MET 128 HA MET 128 13.477 5.349 -3.081 962 HB2 MET 128 HB2 MET 128 12.349 3.327 -3.981 963 HB3 MET 128 HB1 MET 128 12.287 3.455 -2.231 964 HG2 MET 128 HG2 MET 128 10.154 2.781 -2.740 965 HG3 MET 128 HG1 MET 128 9.971 4.527 -2.635 966 HE1 MET 128 HE1 MET 128 11.653 2.578 -5.674 967 HE2 MET 128 HE2 MET 128 10.212 2.204 -6.618 968 HE3 MET 128 HE3 MET 128 10.433 1.487 -5.023 969 H SER 129 HN SER 129 10.494 6.840 -3.956 970 HA SER 129 HA SER 129 11.313 6.910 -6.771 971 HB2 SER 129 HB2 SER 129 8.959 6.229 -6.172 972 HB3 SER 129 HB1 SER 129 8.705 7.858 -5.553 973 HG SER 129 HG SER 129 9.302 7.089 -8.231 974 H MET 130 HN MET 130 12.554 8.359 -4.523 975 HA MET 130 HA MET 130 11.897 11.082 -4.568 976 HB2 MET 130 HB2 MET 130 14.138 11.451 -3.617 977 HB3 MET 130 HB1 MET 130 13.262 10.168 -2.796 978 HG2 MET 130 HG2 MET 130 14.564 8.497 -3.782 979 HG3 MET 130 HG1 MET 130 15.185 9.604 -4.999 980 HE1 MET 130 HE1 MET 130 15.220 8.660 -1.180 981 HE2 MET 130 HE2 MET 130 14.828 10.379 -1.159 982 HE3 MET 130 HE3 MET 130 16.383 9.822 -0.542 983 H LYS 131 HN LYS 131 12.438 12.729 -5.861 984 HA LYS 131 HA LYS 131 14.164 12.123 -8.169 985 HB2 LYS 131 HB2 LYS 131 11.804 14.012 -8.029 986 HB3 LYS 131 HB1 LYS 131 12.819 13.752 -9.441 987 HG2 LYS 131 HG2 LYS 131 12.069 11.461 -9.605 988 HG3 LYS 131 HG1 LYS 131 11.129 11.637 -8.122 989 HD2 LYS 131 HD2 LYS 131 10.682 13.189 -10.672 990 HD3 LYS 131 HD1 LYS 131 9.727 11.807 -10.137 991 HE2 LYS 131 HE2 LYS 131 9.130 13.075 -8.092 992 HE3 LYS 131 HE1 LYS 131 9.997 14.465 -8.738 993 HZ1 LYS 131 HZ1 LYS 131 8.474 14.472 -10.626 994 HZ2 LYS 131 HZ2 LYS 131 7.643 14.651 -9.165 995 HZ3 LYS 131 HZ3 LYS 131 7.631 13.162 -9.967 Start of MODEL 3 1 H1 SER 11 HT1 SER 11 24.603 1.717 4.487 2 H2 SER 11 HT2 SER 11 25.218 3.231 4.056 3 H3 SER 11 HT3 SER 11 26.251 1.900 4.147 4 HA SER 11 HA SER 11 25.774 2.413 1.866 5 HB2 SER 11 HB2 SER 11 26.162 0.107 2.247 6 HB3 SER 11 HB1 SER 11 24.596 -0.109 3.018 7 HG SER 11 HG SER 11 24.389 -0.931 0.990 8 H ALA 12 HN ALA 12 24.448 3.409 0.519 9 HA ALA 12 HA ALA 12 21.977 4.448 1.325 10 HB1 ALA 12 HB1 ALA 12 23.031 4.142 -1.480 11 HB2 ALA 12 HB2 ALA 12 23.411 5.468 -0.381 12 HB3 ALA 12 HB3 ALA 12 21.759 5.245 -0.957 13 H SER 13 HN SER 13 22.766 1.537 -0.460 14 HA SER 13 HA SER 13 20.081 0.992 -1.235 15 HB2 SER 13 HB2 SER 13 22.507 -0.808 -1.130 16 HB3 SER 13 HB1 SER 13 21.029 -1.092 -2.033 17 HG SER 13 HG SER 13 21.578 1.055 -3.037 18 H ASP 14 HN ASP 14 22.277 -0.106 1.316 19 HA ASP 14 HA ASP 14 20.494 -2.107 2.295 20 HB2 ASP 14 HB2 ASP 14 22.988 -0.877 3.449 21 HB3 ASP 14 HB1 ASP 14 22.073 -2.122 4.283 22 H ILE 15 HN ILE 15 21.185 1.248 3.212 23 HA ILE 15 HA ILE 15 19.652 1.236 5.572 24 HB ILE 15 HB ILE 15 21.190 3.103 4.981 25 HG12 ILE 15 HG12 ILE 15 19.480 4.930 5.665 26 HG13 ILE 15 HG11 ILE 15 18.324 3.594 5.711 27 HG21 ILE 15 HG21 ILE 15 20.468 4.871 3.498 28 HG22 ILE 15 HG22 ILE 15 18.986 3.988 3.131 29 HG23 ILE 15 HG23 ILE 15 20.546 3.345 2.615 30 HD11 ILE 15 HD11 ILE 15 19.765 2.443 7.330 31 HD12 ILE 15 HD12 ILE 15 19.189 4.005 7.912 32 HD13 ILE 15 HD13 ILE 15 20.844 3.836 7.329 33 H ARG 16 HN ARG 16 18.806 1.755 2.202 34 HA ARG 16 HA ARG 16 16.115 2.464 2.606 35 HB2 ARG 16 HB2 ARG 16 17.042 2.855 0.454 36 HB3 ARG 16 HB1 ARG 16 17.607 1.196 0.310 37 HG2 ARG 16 HG2 ARG 16 15.196 0.487 0.265 38 HG3 ARG 16 HG1 ARG 16 14.781 2.198 0.130 39 HD2 ARG 16 HD2 ARG 16 15.969 2.392 -1.931 40 HD3 ARG 16 HD1 ARG 16 16.648 0.774 -1.745 41 HE ARG 16 HE ARG 16 13.941 0.394 -1.734 42 HH11 ARG 16 HH11 ARG 16 16.223 1.855 -3.945 43 HH12 ARG 16 HH12 ARG 16 15.313 1.434 -5.360 44 HH21 ARG 16 HH21 ARG 16 12.745 -0.155 -3.585 45 HH22 ARG 16 HH22 ARG 16 13.340 0.284 -5.157 46 H MET 17 HN MET 17 17.682 -0.672 2.087 47 HA MET 17 HA MET 17 15.391 -2.237 1.959 48 HB2 MET 17 HB2 MET 17 18.127 -2.917 3.051 49 HB3 MET 17 HB1 MET 17 16.868 -4.107 2.751 50 HG2 MET 17 HG2 MET 17 16.910 -3.651 0.404 51 HG3 MET 17 HG1 MET 17 18.014 -2.296 0.639 52 HE1 MET 17 HE1 MET 17 19.169 -6.718 1.332 53 HE2 MET 17 HE2 MET 17 17.573 -6.191 0.803 54 HE3 MET 17 HE3 MET 17 18.129 -5.815 2.433 55 H LYS 18 HN LYS 18 17.236 -1.192 4.814 56 HA LYS 18 HA LYS 18 15.511 -2.590 6.623 57 HB2 LYS 18 HB2 LYS 18 16.692 -1.521 8.400 58 HB3 LYS 18 HB1 LYS 18 17.876 -1.936 7.174 59 HG2 LYS 18 HG2 LYS 18 18.133 0.313 6.509 60 HG3 LYS 18 HG1 LYS 18 16.665 0.808 7.353 61 HD2 LYS 18 HD2 LYS 18 18.585 1.521 8.615 62 HD3 LYS 18 HD1 LYS 18 17.750 0.245 9.496 63 HE2 LYS 18 HE2 LYS 18 19.379 -1.391 8.647 64 HE3 LYS 18 HE1 LYS 18 20.225 -0.096 7.805 65 HZ1 LYS 18 HZ1 LYS 18 19.865 -0.298 10.744 66 HZ2 LYS 18 HZ2 LYS 18 20.677 0.944 9.940 67 HZ3 LYS 18 HZ3 LYS 18 21.290 -0.628 9.901 68 H LYS 19 HN LYS 19 15.605 0.587 5.196 69 HA LYS 19 HA LYS 19 13.807 1.785 7.055 70 HB2 LYS 19 HB2 LYS 19 15.547 2.679 5.080 71 HB3 LYS 19 HB1 LYS 19 13.953 3.135 4.494 72 HG2 LYS 19 HG2 LYS 19 15.068 3.823 7.206 73 HG3 LYS 19 HG1 LYS 19 15.031 4.904 5.811 74 HD2 LYS 19 HD2 LYS 19 12.631 4.876 5.787 75 HD3 LYS 19 HD1 LYS 19 12.587 3.651 7.055 76 HE2 LYS 19 HE2 LYS 19 12.104 5.875 7.942 77 HE3 LYS 19 HE1 LYS 19 13.592 5.219 8.621 78 HZ1 LYS 19 HZ1 LYS 19 13.416 7.209 6.427 79 HZ2 LYS 19 HZ2 LYS 19 14.849 6.576 7.054 80 HZ3 LYS 19 HZ3 LYS 19 13.852 7.534 8.024 81 H VAL 20 HN VAL 20 13.474 0.364 3.834 82 HA VAL 20 HA VAL 20 10.763 1.096 3.485 83 HB VAL 20 HB VAL 20 10.640 -0.582 1.723 84 HG11 VAL 20 HG11 VAL 20 12.296 0.323 0.256 85 HG12 VAL 20 HG12 VAL 20 13.303 0.812 1.617 86 HG13 VAL 20 HG13 VAL 20 11.750 1.609 1.335 87 HG21 VAL 20 HG21 VAL 20 12.530 -2.017 1.192 88 HG22 VAL 20 HG22 VAL 20 11.910 -2.366 2.807 89 HG23 VAL 20 HG23 VAL 20 13.393 -1.429 2.614 90 H MET 21 HN MET 21 12.341 -1.592 5.084 91 HA MET 21 HA MET 21 10.037 -3.160 5.526 92 HB2 MET 21 HB2 MET 21 12.658 -2.932 6.994 93 HB3 MET 21 HB1 MET 21 11.392 -4.034 7.515 94 HG2 MET 21 HG2 MET 21 12.646 -4.048 4.782 95 HG3 MET 21 HG1 MET 21 13.133 -5.094 6.114 96 HE1 MET 21 HE1 MET 21 10.378 -5.837 7.492 97 HE2 MET 21 HE2 MET 21 11.647 -7.006 7.125 98 HE3 MET 21 HE3 MET 21 9.981 -7.327 6.640 99 H GLN 22 HN GLN 22 11.375 -0.376 7.172 100 HA GLN 22 HA GLN 22 9.682 -0.427 9.447 101 HB2 GLN 22 HB2 GLN 22 10.723 2.088 8.145 102 HB3 GLN 22 HB1 GLN 22 10.378 1.811 9.845 103 HG2 GLN 22 HG2 GLN 22 12.263 0.283 9.989 104 HG3 GLN 22 HG1 GLN 22 12.606 0.534 8.279 105 HE21 GLN 22 HE21 GLN 22 14.598 1.433 8.475 106 HE22 GLN 22 HE22 GLN 22 14.903 2.938 9.271 107 H TYR 23 HN TYR 23 9.483 1.206 6.315 108 HA TYR 23 HA TYR 23 6.925 2.347 6.681 109 HB2 TYR 23 HB2 TYR 23 8.513 1.640 4.209 110 HB3 TYR 23 HB1 TYR 23 6.932 2.413 4.127 111 HD1 TYR 23 HD1 TYR 23 10.345 2.989 4.115 112 HD2 TYR 23 HD2 TYR 23 6.752 4.586 5.716 113 HE1 TYR 23 HE1 TYR 23 11.442 5.174 4.378 114 HE2 TYR 23 HE2 TYR 23 7.837 6.775 5.990 115 HH TYR 23 HH TYR 23 10.020 7.750 6.160 116 H ARG 24 HN ARG 24 8.047 -0.726 5.504 117 HA ARG 24 HA ARG 24 5.780 -1.709 4.249 118 HB2 ARG 24 HB2 ARG 24 8.120 -2.665 4.266 119 HB3 ARG 24 HB1 ARG 24 7.754 -3.343 5.844 120 HG2 ARG 24 HG2 ARG 24 6.065 -4.753 4.927 121 HG3 ARG 24 HG1 ARG 24 6.176 -3.951 3.357 122 HD2 ARG 24 HD2 ARG 24 8.541 -4.702 3.208 123 HD3 ARG 24 HD1 ARG 24 8.305 -5.616 4.696 124 HE ARG 24 HE ARG 24 6.565 -6.150 2.394 125 HH11 ARG 24 HH11 ARG 24 9.134 -7.177 4.537 126 HH12 ARG 24 HH12 ARG 24 9.055 -8.840 4.052 127 HH21 ARG 24 HH21 ARG 24 6.474 -8.327 1.719 128 HH22 ARG 24 HH22 ARG 24 7.526 -9.499 2.448 129 H ARG 25 HN ARG 25 6.699 -1.804 7.652 130 HA ARG 25 HA ARG 25 4.628 -3.522 8.512 131 HB2 ARG 25 HB2 ARG 25 6.193 -1.435 10.024 132 HB3 ARG 25 HB1 ARG 25 5.162 -2.658 10.763 133 HG2 ARG 25 HG2 ARG 25 6.550 -4.420 9.906 134 HG3 ARG 25 HG1 ARG 25 7.526 -3.257 9.007 135 HD2 ARG 25 HD2 ARG 25 8.168 -2.213 11.142 136 HD3 ARG 25 HD1 ARG 25 7.270 -3.469 11.991 137 HE ARG 25 HE ARG 25 8.903 -4.950 10.523 138 HH11 ARG 25 HH11 ARG 25 9.589 -2.120 12.468 139 HH12 ARG 25 HH12 ARG 25 11.240 -2.568 12.751 140 HH21 ARG 25 HH21 ARG 25 11.062 -5.542 10.901 141 HH22 ARG 25 HH22 ARG 25 12.081 -4.508 11.855 142 H ALA 26 HN ALA 26 4.826 -0.032 8.115 143 HA ALA 26 HA ALA 26 2.241 0.461 9.294 144 HB1 ALA 26 HB1 ALA 26 3.996 2.249 7.619 145 HB2 ALA 26 HB2 ALA 26 3.990 2.160 9.381 146 HB3 ALA 26 HB3 ALA 26 2.568 2.753 8.522 147 H LEU 27 HN LEU 27 3.394 -0.590 6.314 148 HA LEU 27 HA LEU 27 0.995 0.241 4.868 149 HB2 LEU 27 HB2 LEU 27 3.722 -0.647 4.135 150 HB3 LEU 27 HB1 LEU 27 2.436 -1.113 3.039 151 HG LEU 27 HG LEU 27 2.009 1.089 2.399 152 HD11 LEU 27 HD11 LEU 27 1.749 2.078 4.611 153 HD12 LEU 27 HD12 LEU 27 2.797 3.072 3.602 154 HD13 LEU 27 HD13 LEU 27 3.496 2.036 4.847 155 HD21 LEU 27 HD21 LEU 27 4.181 0.336 1.596 156 HD22 LEU 27 HD22 LEU 27 4.952 0.999 3.038 157 HD23 LEU 27 HD23 LEU 27 4.182 2.078 1.874 158 H THR 28 HN THR 28 2.162 -2.394 6.629 159 HA THR 28 HA THR 28 0.597 -4.356 5.140 160 HB THR 28 HB THR 28 2.403 -4.740 7.535 161 HG1 THR 28 HG1 THR 28 3.574 -4.144 5.684 162 HG21 THR 28 HG21 THR 28 1.181 -6.790 5.684 163 HG22 THR 28 HG22 THR 28 0.691 -6.489 7.351 164 HG23 THR 28 HG23 THR 28 2.303 -7.115 7.006 165 H LYS 29 HN LYS 29 -1.476 -4.266 5.546 166 HA LYS 29 HA LYS 29 -2.416 -4.671 8.201 167 HB2 LYS 29 HB2 LYS 29 -4.099 -2.707 7.753 168 HB3 LYS 29 HB1 LYS 29 -2.572 -2.550 8.570 169 HG2 LYS 29 HG2 LYS 29 -2.473 -2.159 5.719 170 HG3 LYS 29 HG1 LYS 29 -3.331 -0.957 6.671 171 HD2 LYS 29 HD2 LYS 29 -0.601 -1.961 7.372 172 HD3 LYS 29 HD1 LYS 29 -0.851 -0.523 6.376 173 HE2 LYS 29 HE2 LYS 29 -1.807 -0.927 9.216 174 HE3 LYS 29 HE1 LYS 29 -0.450 0.074 8.711 175 HZ1 LYS 29 HZ1 LYS 29 -1.879 1.586 7.667 176 HZ2 LYS 29 HZ2 LYS 29 -2.617 1.243 9.156 177 HZ3 LYS 29 HZ3 LYS 29 -3.200 0.536 7.741 178 H VAL 30 HN VAL 30 -4.848 -4.717 8.269 179 HA VAL 30 HA VAL 30 -5.902 -5.958 5.845 180 HB VAL 30 HB VAL 30 -7.834 -6.621 7.281 181 HG11 VAL 30 HG11 VAL 30 -6.030 -8.184 6.913 182 HG12 VAL 30 HG12 VAL 30 -6.604 -8.329 8.574 183 HG13 VAL 30 HG13 VAL 30 -5.102 -7.472 8.233 184 HG21 VAL 30 HG21 VAL 30 -7.661 -4.831 8.955 185 HG22 VAL 30 HG22 VAL 30 -6.151 -5.529 9.540 186 HG23 VAL 30 HG23 VAL 30 -7.659 -6.426 9.706 187 H VAL 31 HN VAL 31 -7.233 -4.863 4.567 188 HA VAL 31 HA VAL 31 -8.690 -2.549 5.561 189 HB VAL 31 HB VAL 31 -6.173 -2.347 4.129 190 HG11 VAL 31 HG11 VAL 31 -7.486 -2.195 2.126 191 HG12 VAL 31 HG12 VAL 31 -6.841 -0.607 2.544 192 HG13 VAL 31 HG13 VAL 31 -8.532 -0.980 2.865 193 HG21 VAL 31 HG21 VAL 31 -6.675 -1.114 6.148 194 HG22 VAL 31 HG22 VAL 31 -8.008 -0.288 5.338 195 HG23 VAL 31 HG23 VAL 31 -6.348 -0.001 4.819 196 H LYS 32 HN LYS 32 -10.385 -1.906 4.108 197 HA LYS 32 HA LYS 32 -11.034 -4.060 2.231 198 HB2 LYS 32 HB2 LYS 32 -12.532 -3.442 4.231 199 HB3 LYS 32 HB1 LYS 32 -12.963 -2.016 3.299 200 HG2 LYS 32 HG2 LYS 32 -13.192 -4.597 1.899 201 HG3 LYS 32 HG1 LYS 32 -14.328 -4.319 3.224 202 HD2 LYS 32 HD2 LYS 32 -14.888 -2.120 2.148 203 HD3 LYS 32 HD1 LYS 32 -13.913 -2.627 0.765 204 HE2 LYS 32 HE2 LYS 32 -16.261 -3.092 0.362 205 HE3 LYS 32 HE1 LYS 32 -15.350 -4.596 0.489 206 HZ1 LYS 32 HZ1 LYS 32 -17.030 -3.381 2.618 207 HZ2 LYS 32 HZ2 LYS 32 -16.115 -4.790 2.793 208 HZ3 LYS 32 HZ3 LYS 32 -17.409 -4.756 1.708 209 H LEU 33 HN LEU 33 -10.809 -3.691 0.168 210 HA LEU 33 HA LEU 33 -10.480 -0.970 -0.793 211 HB2 LEU 33 HB2 LEU 33 -10.080 -3.671 -2.020 212 HB3 LEU 33 HB1 LEU 33 -10.188 -2.241 -3.035 213 HG LEU 33 HG LEU 33 -8.164 -2.622 -0.828 214 HD11 LEU 33 HD11 LEU 33 -6.551 -2.916 -2.644 215 HD12 LEU 33 HD12 LEU 33 -7.860 -2.845 -3.823 216 HD13 LEU 33 HD13 LEU 33 -7.782 -4.180 -2.673 217 HD21 LEU 33 HD21 LEU 33 -8.711 -0.293 -1.228 218 HD22 LEU 33 HD22 LEU 33 -8.484 -0.515 -2.960 219 HD23 LEU 33 HD23 LEU 33 -7.107 -0.654 -1.866 220 H LYS 34 HN LYS 34 -11.758 0.065 -2.218 221 HA LYS 34 HA LYS 34 -14.230 -1.238 -3.109 222 HB2 LYS 34 HB2 LYS 34 -14.304 1.444 -1.731 223 HB3 LYS 34 HB1 LYS 34 -15.668 0.468 -2.252 224 HG2 LYS 34 HG2 LYS 34 -15.073 -1.220 -0.565 225 HG3 LYS 34 HG1 LYS 34 -13.762 -0.176 -0.016 226 HD2 LYS 34 HD2 LYS 34 -16.721 0.409 0.065 227 HD3 LYS 34 HD1 LYS 34 -15.657 0.110 1.441 228 HE2 LYS 34 HE2 LYS 34 -14.431 2.150 0.965 229 HE3 LYS 34 HE1 LYS 34 -15.424 2.434 -0.462 230 HZ1 LYS 34 HZ1 LYS 34 -17.359 2.630 0.972 231 HZ2 LYS 34 HZ2 LYS 34 -16.177 3.761 1.391 232 HZ3 LYS 34 HZ3 LYS 34 -16.397 2.381 2.341 233 H THR 35 HN THR 35 -13.952 -0.989 -5.251 234 HA THR 35 HA THR 35 -14.179 1.593 -6.390 235 HB THR 35 HB THR 35 -11.866 1.887 -5.905 236 HG1 THR 35 HG1 THR 35 -11.224 2.436 -7.872 237 HG21 THR 35 HG21 THR 35 -10.119 0.308 -6.617 238 HG22 THR 35 HG22 THR 35 -11.373 -0.807 -7.151 239 HG23 THR 35 HG23 THR 35 -11.232 -0.398 -5.444 240 H HIS 36 HN HIS 36 -13.259 1.077 -8.985 241 HA HIS 36 HA HIS 36 -15.250 -0.729 -9.947 242 HB2 HIS 36 HB2 HIS 36 -12.931 0.604 -11.365 243 HB3 HIS 36 HB1 HIS 36 -14.177 -0.334 -12.181 244 HD1 HIS 36 HD1 HIS 36 -13.421 2.934 -12.135 245 HD2 HIS 36 HD2 HIS 36 -16.824 0.953 -10.796 246 HE1 HIS 36 HE1 HIS 36 -15.246 4.660 -12.115 247 HE2 HIS 36 HE2 HIS 36 -17.319 3.413 -11.420 248 H LEU 37 HN LEU 37 -12.119 -1.121 -8.799 249 HA LEU 37 HA LEU 37 -11.308 -3.524 -10.029 250 HB2 LEU 37 HB2 LEU 37 -9.931 -2.012 -8.555 251 HB3 LEU 37 HB1 LEU 37 -10.843 -2.604 -7.185 252 HG LEU 37 HG LEU 37 -9.980 -4.924 -7.821 253 HD11 LEU 37 HD11 LEU 37 -9.196 -4.379 -10.058 254 HD12 LEU 37 HD12 LEU 37 -7.865 -4.942 -9.049 255 HD13 LEU 37 HD13 LEU 37 -8.047 -3.222 -9.388 256 HD21 LEU 37 HD21 LEU 37 -9.231 -3.755 -5.850 257 HD22 LEU 37 HD22 LEU 37 -8.139 -2.758 -6.810 258 HD23 LEU 37 HD23 LEU 37 -7.836 -4.489 -6.644 259 H PHE 38 HN PHE 38 -12.781 -2.975 -6.850 260 HA PHE 38 HA PHE 38 -14.948 -4.649 -7.030 261 HB2 PHE 38 HB2 PHE 38 -14.234 -6.610 -5.659 262 HB3 PHE 38 HB1 PHE 38 -13.480 -6.569 -7.246 263 HD1 PHE 38 HD1 PHE 38 -11.175 -6.836 -7.416 264 HD2 PHE 38 HD2 PHE 38 -12.858 -5.608 -3.708 265 HE1 PHE 38 HE1 PHE 38 -8.965 -7.017 -6.358 266 HE2 PHE 38 HE2 PHE 38 -10.654 -5.792 -2.644 267 HZ PHE 38 HZ PHE 38 -8.697 -6.568 -3.993 268 H SER 39 HN SER 39 -15.600 -5.388 -4.646 269 HA SER 39 HA SER 39 -14.476 -3.496 -2.698 270 HB2 SER 39 HB2 SER 39 -16.802 -3.362 -1.703 271 HB3 SER 39 HB1 SER 39 -16.623 -2.579 -3.273 272 HG SER 39 HG SER 39 -17.679 -5.178 -2.805 273 H GLU 40 HN GLU 40 -13.269 -4.862 -1.527 274 HA GLU 40 HA GLU 40 -14.518 -7.001 -0.023 275 HB2 GLU 40 HB2 GLU 40 -12.349 -7.541 -2.054 276 HB3 GLU 40 HB1 GLU 40 -12.696 -8.629 -0.724 277 HG2 GLU 40 HG2 GLU 40 -14.726 -7.836 -2.793 278 HG3 GLU 40 HG1 GLU 40 -13.701 -9.265 -2.917 279 H THR 41 HN THR 41 -13.078 -7.816 1.653 280 HA THR 41 HA THR 41 -11.237 -5.792 2.577 281 HB THR 41 HB THR 41 -11.991 -8.425 3.833 282 HG1 THR 41 HG1 THR 41 -13.740 -6.943 3.706 283 HG21 THR 41 HG21 THR 41 -9.817 -7.610 4.620 284 HG22 THR 41 HG22 THR 41 -11.034 -7.491 5.890 285 HG23 THR 41 HG23 THR 41 -10.540 -6.048 5.005 286 H VAL 42 HN VAL 42 -9.131 -5.801 2.266 287 HA VAL 42 HA VAL 42 -7.855 -8.293 1.351 288 HB VAL 42 HB VAL 42 -6.596 -7.100 -0.293 289 HG11 VAL 42 HG11 VAL 42 -9.472 -6.177 -0.389 290 HG12 VAL 42 HG12 VAL 42 -8.834 -7.703 -1.009 291 HG13 VAL 42 HG13 VAL 42 -8.353 -6.180 -1.755 292 HG21 VAL 42 HG21 VAL 42 -6.146 -5.062 0.971 293 HG22 VAL 42 HG22 VAL 42 -7.823 -4.552 0.776 294 HG23 VAL 42 HG23 VAL 42 -6.768 -4.675 -0.633 295 H LYS 43 HN LYS 43 -5.594 -8.453 1.878 296 HA LYS 43 HA LYS 43 -4.808 -6.695 4.084 297 HB2 LYS 43 HB2 LYS 43 -4.664 -9.067 4.589 298 HB3 LYS 43 HB1 LYS 43 -3.654 -9.334 3.172 299 HG2 LYS 43 HG2 LYS 43 -1.832 -8.204 4.119 300 HG3 LYS 43 HG1 LYS 43 -2.832 -7.476 5.377 301 HD2 LYS 43 HD2 LYS 43 -1.497 -9.261 6.301 302 HD3 LYS 43 HD1 LYS 43 -3.204 -9.695 6.341 303 HE2 LYS 43 HE2 LYS 43 -2.904 -11.050 4.328 304 HE3 LYS 43 HE1 LYS 43 -1.194 -10.620 4.295 305 HZ1 LYS 43 HZ1 LYS 43 -0.902 -11.712 6.417 306 HZ2 LYS 43 HZ2 LYS 43 -1.574 -12.792 5.305 307 HZ3 LYS 43 HZ3 LYS 43 -2.548 -12.090 6.491 308 H VAL 44 HN VAL 44 -3.349 -5.170 3.780 309 HA VAL 44 HA VAL 44 -2.097 -5.027 1.132 310 HB VAL 44 HB VAL 44 -1.656 -2.581 2.370 311 HG11 VAL 44 HG11 VAL 44 -2.241 -2.945 0.034 312 HG12 VAL 44 HG12 VAL 44 -3.306 -1.746 0.765 313 HG13 VAL 44 HG13 VAL 44 -3.883 -3.392 0.500 314 HG21 VAL 44 HG21 VAL 44 -3.913 -1.873 3.114 315 HG22 VAL 44 HG22 VAL 44 -3.191 -3.081 4.190 316 HG23 VAL 44 HG23 VAL 44 -4.438 -3.554 3.021 317 H THR 45 HN THR 45 0.039 -4.171 0.962 318 HA THR 45 HA THR 45 1.826 -3.875 3.110 319 HB THR 45 HB THR 45 1.396 -6.332 3.329 320 HG1 THR 45 HG1 THR 45 3.363 -5.744 4.098 321 HG21 THR 45 HG21 THR 45 2.705 -6.469 0.612 322 HG22 THR 45 HG22 THR 45 1.030 -6.879 0.983 323 HG23 THR 45 HG23 THR 45 2.345 -7.853 1.644 324 H CYS 46 HN CYS 46 4.213 -4.513 1.968 325 HA CYS 46 HA CYS 46 4.098 -3.714 -0.827 326 HB2 CYS 46 HB2 CYS 46 5.806 -1.957 -0.516 327 HB3 CYS 46 HB1 CYS 46 4.311 -1.584 0.335 328 HG CYS 46 HG CYS 46 7.352 -2.373 1.608 329 H SER 47 HN SER 47 6.283 -3.843 -1.854 330 HA SER 47 HA SER 47 7.478 -6.334 -1.485 331 HB2 SER 47 HB2 SER 47 7.725 -5.257 -3.588 332 HB3 SER 47 HB1 SER 47 8.411 -3.812 -2.853 333 HG SER 47 HG SER 47 9.738 -5.783 -3.872 334 H LYS 48 HN LYS 48 9.661 -6.855 -0.850 335 HA LYS 48 HA LYS 48 10.345 -5.913 1.725 336 HB2 LYS 48 HB2 LYS 48 12.010 -7.505 -0.232 337 HB3 LYS 48 HB1 LYS 48 12.396 -7.271 1.463 338 HG2 LYS 48 HG2 LYS 48 10.212 -8.407 1.996 339 HG3 LYS 48 HG1 LYS 48 10.123 -8.837 0.283 340 HD2 LYS 48 HD2 LYS 48 12.344 -9.911 0.483 341 HD3 LYS 48 HD1 LYS 48 12.331 -9.557 2.209 342 HE2 LYS 48 HE2 LYS 48 11.639 -11.799 1.994 343 HE3 LYS 48 HE1 LYS 48 10.183 -10.871 2.338 344 HZ1 LYS 48 HZ1 LYS 48 9.621 -10.934 -0.004 345 HZ2 LYS 48 HZ2 LYS 48 9.838 -12.504 0.585 346 HZ3 LYS 48 HZ3 LYS 48 11.042 -11.780 -0.356 347 H ASP 49 HN ASP 49 11.175 -4.823 -1.442 348 HA ASP 49 HA ASP 49 13.317 -3.135 -0.324 349 HB2 ASP 49 HB2 ASP 49 12.733 -3.890 -3.193 350 HB3 ASP 49 HB1 ASP 49 13.968 -2.734 -2.704 351 H GLY 50 HN GLY 50 10.195 -2.940 -0.588 352 HA2 GLY 50 HA2 GLY 50 8.681 -1.223 -0.729 353 HA3 GLY 50 HA1 GLY 50 10.051 -0.130 -0.645 354 H GLU 51 HN GLU 51 9.945 -2.453 -3.206 355 HA GLU 51 HA GLU 51 9.787 -0.320 -5.144 356 HB2 GLU 51 HB2 GLU 51 10.083 -3.299 -5.495 357 HB3 GLU 51 HB1 GLU 51 10.109 -2.140 -6.814 358 HG2 GLU 51 HG2 GLU 51 12.044 -1.036 -5.607 359 HG3 GLU 51 HG1 GLU 51 12.095 -2.480 -4.597 360 H GLU 52 HN GLU 52 7.640 -2.669 -3.825 361 HA GLU 52 HA GLU 52 5.566 -1.874 -5.745 362 HB2 GLU 52 HB2 GLU 52 6.336 -4.648 -4.896 363 HB3 GLU 52 HB1 GLU 52 4.716 -4.291 -5.459 364 HG2 GLU 52 HG2 GLU 52 5.676 -3.488 -7.586 365 HG3 GLU 52 HG1 GLU 52 7.276 -3.956 -7.006 366 H VAL 53 HN VAL 53 3.448 -1.950 -4.978 367 HA VAL 53 HA VAL 53 3.104 -2.429 -2.088 368 HB VAL 53 HB VAL 53 1.347 -0.862 -3.995 369 HG11 VAL 53 HG11 VAL 53 0.101 -2.060 -2.217 370 HG12 VAL 53 HG12 VAL 53 -0.019 -0.306 -2.101 371 HG13 VAL 53 HG13 VAL 53 1.052 -1.188 -1.013 372 HG21 VAL 53 HG21 VAL 53 3.362 0.356 -3.474 373 HG22 VAL 53 HG22 VAL 53 3.129 0.068 -1.750 374 HG23 VAL 53 HG23 VAL 53 1.995 1.089 -2.635 375 H GLN 54 HN GLN 54 1.974 -4.230 -1.558 376 HA GLN 54 HA GLN 54 0.594 -5.625 -3.765 377 HB2 GLN 54 HB2 GLN 54 1.701 -7.179 -1.481 378 HB3 GLN 54 HB1 GLN 54 1.524 -7.630 -3.167 379 HG2 GLN 54 HG2 GLN 54 3.567 -5.624 -2.308 380 HG3 GLN 54 HG1 GLN 54 3.878 -7.356 -2.215 381 HE21 GLN 54 HE21 GLN 54 5.495 -7.325 -3.721 382 HE22 GLN 54 HE22 GLN 54 5.220 -7.037 -5.404 383 H TRP 55 HN TRP 55 -1.175 -7.051 -3.088 384 HA TRP 55 HA TRP 55 -2.019 -6.851 -0.323 385 HB2 TRP 55 HB2 TRP 55 -4.430 -6.401 -1.102 386 HB3 TRP 55 HB1 TRP 55 -3.319 -5.039 -1.011 387 HD1 TRP 55 HD1 TRP 55 -5.025 -7.335 -3.616 388 HE1 TRP 55 HE1 TRP 55 -5.095 -6.073 -5.865 389 HE3 TRP 55 HE3 TRP 55 -2.283 -3.229 -2.323 390 HZ2 TRP 55 HZ2 TRP 55 -4.115 -3.651 -6.936 391 HZ3 TRP 55 HZ3 TRP 55 -1.900 -1.486 -4.005 392 HH2 TRP 55 HH2 TRP 55 -2.792 -1.687 -6.269 393 H PHE 56 HN PHE 56 -3.392 -8.433 0.375 394 HA PHE 56 HA PHE 56 -3.726 -10.732 -1.442 395 HB2 PHE 56 HB2 PHE 56 -3.450 -10.764 1.579 396 HB3 PHE 56 HB1 PHE 56 -3.536 -12.170 0.519 397 HD1 PHE 56 HD1 PHE 56 -1.657 -12.618 -1.067 398 HD2 PHE 56 HD2 PHE 56 -1.414 -9.654 1.976 399 HE1 PHE 56 HE1 PHE 56 0.792 -12.592 -1.292 400 HE2 PHE 56 HE2 PHE 56 1.036 -9.624 1.755 401 HZ PHE 56 HZ PHE 56 2.140 -11.091 0.116 402 H LYS 57 HN LYS 57 -5.777 -11.059 -1.987 403 HA LYS 57 HA LYS 57 -7.835 -9.525 -0.666 404 HB2 LYS 57 HB2 LYS 57 -8.034 -11.365 -3.055 405 HB3 LYS 57 HB1 LYS 57 -9.230 -10.180 -2.550 406 HG2 LYS 57 HG2 LYS 57 -7.861 -8.374 -3.154 407 HG3 LYS 57 HG1 LYS 57 -6.430 -9.401 -3.292 408 HD2 LYS 57 HD2 LYS 57 -7.597 -10.595 -5.173 409 HD3 LYS 57 HD1 LYS 57 -8.837 -9.341 -5.105 410 HE2 LYS 57 HE2 LYS 57 -7.175 -7.638 -5.583 411 HE3 LYS 57 HE1 LYS 57 -5.896 -8.850 -5.561 412 HZ1 LYS 57 HZ1 LYS 57 -7.002 -9.926 -7.465 413 HZ2 LYS 57 HZ2 LYS 57 -6.477 -8.362 -7.811 414 HZ3 LYS 57 HZ3 LYS 57 -8.116 -8.655 -7.524 415 H GLY 58 HN GLY 58 -9.276 -10.269 0.753 416 HA2 GLY 58 HA2 GLY 58 -10.867 -11.761 1.583 417 HA3 GLY 58 HA1 GLY 58 -10.138 -13.041 0.629 418 H LYS 59 HN LYS 59 -9.228 -14.574 1.790 419 HA LYS 59 HA LYS 59 -8.682 -14.142 4.590 420 HB2 LYS 59 HB2 LYS 59 -8.375 -16.606 2.869 421 HB3 LYS 59 HB1 LYS 59 -8.157 -16.562 4.611 422 HG2 LYS 59 HG2 LYS 59 -10.480 -15.943 4.916 423 HG3 LYS 59 HG1 LYS 59 -10.712 -15.898 3.169 424 HD2 LYS 59 HD2 LYS 59 -11.572 -17.975 3.837 425 HD3 LYS 59 HD1 LYS 59 -9.983 -18.339 3.172 426 HE2 LYS 59 HE2 LYS 59 -10.502 -17.957 6.114 427 HE3 LYS 59 HE1 LYS 59 -10.585 -19.522 5.316 428 HZ1 LYS 59 HZ1 LYS 59 -8.447 -19.369 6.230 429 HZ2 LYS 59 HZ2 LYS 59 -8.214 -17.790 5.687 430 HZ3 LYS 59 HZ3 LYS 59 -8.226 -19.069 4.580 431 H SER 60 HN SER 60 -6.715 -15.792 2.131 432 HA SER 60 HA SER 60 -4.431 -14.151 2.559 433 HB2 SER 60 HB2 SER 60 -4.396 -15.461 4.668 434 HB3 SER 60 HB1 SER 60 -4.355 -16.948 3.724 435 HG SER 60 HG SER 60 -2.264 -16.495 4.227 436 H THR 61 HN THR 61 -3.372 -14.190 0.700 437 HA THR 61 HA THR 61 -3.531 -16.621 -0.962 438 HB THR 61 HB THR 61 -3.024 -13.906 -2.142 439 HG1 THR 61 HG1 THR 61 -5.415 -14.850 -1.026 440 HG21 THR 61 HG21 THR 61 -2.799 -15.897 -3.555 441 HG22 THR 61 HG22 THR 61 -4.157 -14.900 -4.077 442 HG23 THR 61 HG23 THR 61 -4.446 -16.374 -3.152 443 H ALA 62 HN ALA 62 -1.569 -15.407 1.105 444 HA ALA 62 HA ALA 62 0.733 -14.451 -0.132 445 HB1 ALA 62 HB1 ALA 62 0.316 -14.219 2.241 446 HB2 ALA 62 HB2 ALA 62 1.874 -14.982 1.949 447 HB3 ALA 62 HB3 ALA 62 0.497 -15.959 2.460 448 H GLY 63 HN GLY 63 2.183 -15.334 -1.359 449 HA2 GLY 63 HA2 GLY 63 2.239 -18.008 -2.141 450 HA3 GLY 63 HA1 GLY 63 3.529 -16.853 -2.405 451 H ALA 64 HN ALA 64 2.724 -19.699 -1.017 452 HA ALA 64 HA ALA 64 3.706 -21.147 0.425 453 HB1 ALA 64 HB1 ALA 64 6.169 -19.531 -0.205 454 HB2 ALA 64 HB2 ALA 64 5.526 -20.849 -1.183 455 HB3 ALA 64 HB3 ALA 64 6.132 -21.172 0.441 456 H GLN 65 HN GLN 65 2.483 -18.876 1.627 457 HA GLN 65 HA GLN 65 2.070 -18.166 3.734 458 HB2 GLN 65 HB2 GLN 65 4.443 -19.776 4.669 459 HB3 GLN 65 HB1 GLN 65 3.092 -19.203 5.637 460 HG2 GLN 65 HG2 GLN 65 3.017 -21.304 3.485 461 HG3 GLN 65 HG1 GLN 65 2.832 -21.548 5.220 462 HE21 GLN 65 HE21 GLN 65 1.078 -22.108 2.894 463 HE22 GLN 65 HE22 GLN 65 -0.435 -21.369 3.291 464 H ASP 66 HN ASP 66 5.486 -18.087 2.816 465 HA ASP 66 HA ASP 66 6.098 -15.864 4.531 466 HB2 ASP 66 HB2 ASP 66 7.617 -17.102 2.235 467 HB3 ASP 66 HB1 ASP 66 8.235 -15.774 3.206 468 H ARG 67 HN ARG 67 4.278 -16.075 1.868 469 HA ARG 67 HA ARG 67 3.152 -14.542 0.669 470 HB2 ARG 67 HB2 ARG 67 4.616 -12.260 1.951 471 HB3 ARG 67 HB1 ARG 67 2.947 -12.363 1.410 472 HG2 ARG 67 HG2 ARG 67 2.333 -13.686 3.298 473 HG3 ARG 67 HG1 ARG 67 4.014 -13.827 3.808 474 HD2 ARG 67 HD2 ARG 67 2.479 -11.237 3.619 475 HD3 ARG 67 HD1 ARG 67 2.708 -12.159 5.104 476 HE ARG 67 HE ARG 67 5.212 -11.624 3.915 477 HH11 ARG 67 HH11 ARG 67 2.631 -10.030 5.665 478 HH12 ARG 67 HH12 ARG 67 3.669 -8.811 6.330 479 HH21 ARG 67 HH21 ARG 67 6.575 -10.022 4.805 480 HH22 ARG 67 HH22 ARG 67 5.905 -8.808 5.849 481 H LYS 68 HN LYS 68 4.920 -15.626 -0.855 482 HA LYS 68 HA LYS 68 6.376 -13.400 -2.138 483 HB2 LYS 68 HB2 LYS 68 6.775 -16.381 -2.420 484 HB3 LYS 68 HB1 LYS 68 7.597 -15.186 -3.408 485 HG2 LYS 68 HG2 LYS 68 9.167 -15.659 -1.800 486 HG3 LYS 68 HG1 LYS 68 8.393 -14.218 -1.142 487 HD2 LYS 68 HD2 LYS 68 8.612 -15.761 0.649 488 HD3 LYS 68 HD1 LYS 68 6.909 -15.755 0.186 489 HE2 LYS 68 HE2 LYS 68 7.536 -18.023 0.514 490 HE3 LYS 68 HE1 LYS 68 7.383 -17.775 -1.222 491 HZ1 LYS 68 HZ1 LYS 68 9.360 -19.044 -0.679 492 HZ2 LYS 68 HZ2 LYS 68 9.931 -17.793 0.301 493 HZ3 LYS 68 HZ3 LYS 68 9.786 -17.559 -1.365 494 H LYS 69 HN LYS 69 3.481 -14.239 -2.292 495 HA LYS 69 HA LYS 69 3.234 -13.967 -5.167 496 HB2 LYS 69 HB2 LYS 69 3.251 -16.423 -4.709 497 HB3 LYS 69 HB1 LYS 69 1.852 -16.205 -3.674 498 HG2 LYS 69 HG2 LYS 69 0.550 -15.404 -5.575 499 HG3 LYS 69 HG1 LYS 69 1.950 -15.614 -6.624 500 HD2 LYS 69 HD2 LYS 69 0.440 -17.499 -6.857 501 HD3 LYS 69 HD1 LYS 69 1.952 -18.021 -6.116 502 HE2 LYS 69 HE2 LYS 69 0.054 -19.045 -4.998 503 HE3 LYS 69 HE1 LYS 69 0.890 -17.943 -3.908 504 HZ1 LYS 69 HZ1 LYS 69 -0.811 -16.275 -4.386 505 HZ2 LYS 69 HZ2 LYS 69 -1.483 -17.677 -3.728 506 HZ3 LYS 69 HZ3 LYS 69 -1.623 -17.374 -5.383 507 HA PRO 70 HA PRO 70 0.099 -11.461 -2.939 508 HB2 PRO 70 HB2 PRO 70 0.531 -9.578 -5.123 509 HB3 PRO 70 HB1 PRO 70 0.737 -9.341 -3.388 510 HG2 PRO 70 HG2 PRO 70 2.827 -9.425 -5.094 511 HG3 PRO 70 HG1 PRO 70 2.938 -10.000 -3.422 512 HD2 PRO 70 HD2 PRO 70 2.584 -11.581 -5.948 513 HD3 PRO 70 HD1 PRO 70 3.624 -11.917 -4.545 514 H SER 71 HN SER 71 -2.017 -10.874 -3.581 515 HA SER 71 HA SER 71 -2.956 -12.270 -5.972 516 HB2 SER 71 HB2 SER 71 -4.087 -12.642 -3.764 517 HB3 SER 71 HB1 SER 71 -4.568 -10.947 -3.770 518 HG SER 71 HG SER 71 -5.303 -11.914 -6.094 519 H GLY 72 HN GLY 72 -1.722 -9.411 -5.304 520 HA2 GLY 72 HA2 GLY 72 -2.459 -8.129 -7.643 521 HA3 GLY 72 HA1 GLY 72 -3.518 -7.520 -6.373 522 H GLY 73 HN GLY 73 -1.669 -5.881 -7.701 523 HA2 GLY 73 HA2 GLY 73 -0.447 -4.506 -5.694 524 HA3 GLY 73 HA1 GLY 73 0.742 -5.711 -6.163 525 H PHE 74 HN PHE 74 1.401 -3.143 -6.374 526 HA PHE 74 HA PHE 74 1.888 -2.863 -9.193 527 HB2 PHE 74 HB2 PHE 74 0.906 -0.682 -9.516 528 HB3 PHE 74 HB1 PHE 74 -0.346 -1.781 -8.969 529 HD1 PHE 74 HD1 PHE 74 0.010 -1.793 -6.087 530 HD2 PHE 74 HD2 PHE 74 0.279 1.452 -8.824 531 HE1 PHE 74 HE1 PHE 74 -0.563 -0.232 -4.285 532 HE2 PHE 74 HE2 PHE 74 -0.304 3.018 -7.017 533 HZ PHE 74 HZ PHE 74 -0.781 2.255 -4.835 534 HA PRO 75 HA PRO 75 5.613 -1.142 -7.672 535 HB2 PRO 75 HB2 PRO 75 5.734 0.769 -9.880 536 HB3 PRO 75 HB1 PRO 75 6.765 -0.623 -9.552 537 HG2 PRO 75 HG2 PRO 75 5.013 -0.572 -11.603 538 HG3 PRO 75 HG1 PRO 75 5.426 -2.062 -10.739 539 HD2 PRO 75 HD2 PRO 75 2.997 -0.334 -10.485 540 HD3 PRO 75 HD1 PRO 75 3.137 -2.101 -10.459 541 H VAL 76 HN VAL 76 6.265 0.386 -6.331 542 HA VAL 76 HA VAL 76 4.500 2.385 -5.412 543 HB VAL 76 HB VAL 76 7.446 1.960 -4.893 544 HG11 VAL 76 HG11 VAL 76 5.512 3.717 -3.392 545 HG12 VAL 76 HG12 VAL 76 6.799 4.283 -4.457 546 HG13 VAL 76 HG13 VAL 76 7.199 3.418 -2.973 547 HG21 VAL 76 HG21 VAL 76 5.954 0.131 -4.186 548 HG22 VAL 76 HG22 VAL 76 5.042 1.282 -3.209 549 HG23 VAL 76 HG23 VAL 76 6.727 0.940 -2.824 550 H ASP 77 HN ASP 77 7.301 2.448 -7.526 551 HA ASP 77 HA ASP 77 7.552 5.268 -7.662 552 HB2 ASP 77 HB2 ASP 77 9.381 3.742 -8.233 553 HB3 ASP 77 HB1 ASP 77 8.449 3.115 -9.584 554 H LYS 78 HN LYS 78 5.408 3.026 -9.117 555 HA LYS 78 HA LYS 78 4.823 4.694 -11.420 556 HB2 LYS 78 HB2 LYS 78 4.125 1.938 -10.561 557 HB3 LYS 78 HB1 LYS 78 2.994 2.755 -11.626 558 HG2 LYS 78 HG2 LYS 78 4.557 1.365 -12.867 559 HG3 LYS 78 HG1 LYS 78 4.736 3.067 -13.285 560 HD2 LYS 78 HD2 LYS 78 6.688 3.203 -11.789 561 HD3 LYS 78 HD1 LYS 78 6.518 1.484 -11.436 562 HE2 LYS 78 HE2 LYS 78 7.029 2.678 -14.156 563 HE3 LYS 78 HE1 LYS 78 8.235 1.900 -13.136 564 HZ1 LYS 78 HZ1 LYS 78 7.041 -0.167 -13.316 565 HZ2 LYS 78 HZ2 LYS 78 7.361 0.423 -14.867 566 HZ3 LYS 78 HZ3 LYS 78 5.811 0.565 -14.213 567 H ILE 79 HN ILE 79 3.766 4.534 -8.234 568 HA ILE 79 HA ILE 79 1.013 5.078 -8.502 569 HB ILE 79 HB ILE 79 2.794 6.180 -6.328 570 HG12 ILE 79 HG12 ILE 79 1.459 3.465 -6.474 571 HG13 ILE 79 HG11 ILE 79 3.192 3.767 -6.544 572 HG21 ILE 79 HG21 ILE 79 0.748 6.047 -4.976 573 HG22 ILE 79 HG22 ILE 79 -0.136 5.468 -6.389 574 HG23 ILE 79 HG23 ILE 79 0.544 7.096 -6.381 575 HD11 ILE 79 HD11 ILE 79 2.635 3.021 -4.350 576 HD12 ILE 79 HD12 ILE 79 1.358 4.229 -4.210 577 HD13 ILE 79 HD13 ILE 79 3.048 4.736 -4.261 578 H THR 80 HN THR 80 -0.001 6.840 -9.274 579 HA THR 80 HA THR 80 1.669 9.056 -10.094 580 HB THR 80 HB THR 80 0.079 8.100 -11.712 581 HG1 THR 80 HG1 THR 80 0.731 10.285 -11.934 582 HG21 THR 80 HG21 THR 80 -2.311 8.608 -11.525 583 HG22 THR 80 HG22 THR 80 -2.039 9.277 -9.915 584 HG23 THR 80 HG23 THR 80 -1.767 7.559 -10.215 585 H SER 81 HN SER 81 -0.921 8.373 -7.806 586 HA SER 81 HA SER 81 -0.392 10.841 -6.414 587 HB2 SER 81 HB2 SER 81 -3.145 10.399 -7.597 588 HB3 SER 81 HB1 SER 81 -2.658 11.738 -6.559 589 HG SER 81 HG SER 81 -0.954 11.688 -8.563 590 H VAL 82 HN VAL 82 -0.738 10.598 -4.299 591 HA VAL 82 HA VAL 82 -2.632 8.545 -3.382 592 HB VAL 82 HB VAL 82 -0.096 9.486 -2.016 593 HG11 VAL 82 HG11 VAL 82 -0.680 7.980 -0.180 594 HG12 VAL 82 HG12 VAL 82 -2.213 7.606 -0.966 595 HG13 VAL 82 HG13 VAL 82 -1.901 9.237 -0.375 596 HG21 VAL 82 HG21 VAL 82 0.309 7.824 -3.719 597 HG22 VAL 82 HG22 VAL 82 -0.960 6.794 -3.057 598 HG23 VAL 82 HG23 VAL 82 0.506 7.095 -2.125 599 H LYS 83 HN LYS 83 -4.396 9.561 -2.842 600 HA LYS 83 HA LYS 83 -4.228 12.111 -1.412 601 HB2 LYS 83 HB2 LYS 83 -6.288 12.717 -2.818 602 HB3 LYS 83 HB1 LYS 83 -4.717 12.773 -3.602 603 HG2 LYS 83 HG2 LYS 83 -5.321 10.277 -4.204 604 HG3 LYS 83 HG1 LYS 83 -6.968 10.877 -3.988 605 HD2 LYS 83 HD2 LYS 83 -6.263 12.752 -5.568 606 HD3 LYS 83 HD1 LYS 83 -4.878 11.718 -5.928 607 HE2 LYS 83 HE2 LYS 83 -6.322 9.944 -6.661 608 HE3 LYS 83 HE1 LYS 83 -7.750 10.858 -6.180 609 HZ1 LYS 83 HZ1 LYS 83 -5.842 11.664 -8.310 610 HZ2 LYS 83 HZ2 LYS 83 -7.235 12.504 -7.859 611 HZ3 LYS 83 HZ3 LYS 83 -7.366 10.978 -8.570 612 H SER 84 HN SER 84 -6.345 12.696 -0.436 613 HA SER 84 HA SER 84 -7.887 10.311 0.296 614 HB2 SER 84 HB2 SER 84 -8.256 11.374 2.531 615 HB3 SER 84 HB1 SER 84 -6.577 10.942 2.219 616 HG SER 84 HG SER 84 -6.024 12.997 2.119 617 H GLN 85 HN GLN 85 -10.136 10.736 0.796 618 HA GLN 85 HA GLN 85 -11.374 12.162 -1.268 619 HB2 GLN 85 HB2 GLN 85 -12.135 10.438 0.898 620 HB3 GLN 85 HB1 GLN 85 -13.296 11.742 0.715 621 HG2 GLN 85 HG2 GLN 85 -14.014 9.869 -0.573 622 HG3 GLN 85 HG1 GLN 85 -13.516 11.152 -1.671 623 HE21 GLN 85 HE21 GLN 85 -11.318 9.067 0.087 624 HE22 GLN 85 HE22 GLN 85 -10.711 8.230 -1.295 625 H ALA 86 HN ALA 86 -13.501 13.543 -0.492 626 HA ALA 86 HA ALA 86 -12.448 16.087 0.087 627 HB1 ALA 86 HB1 ALA 86 -15.317 15.174 0.239 628 HB2 ALA 86 HB2 ALA 86 -14.497 15.766 -1.205 629 HB3 ALA 86 HB3 ALA 86 -14.765 16.846 0.164 630 H ASP 87 HN ASP 87 -14.338 13.853 2.107 631 HA ASP 87 HA ASP 87 -13.423 15.388 4.463 632 HB2 ASP 87 HB2 ASP 87 -15.900 15.249 4.216 633 HB3 ASP 87 HB1 ASP 87 -15.782 13.493 4.269 634 H ASN 88 HN ASN 88 -13.565 12.390 2.818 635 HA ASN 88 HA ASN 88 -12.711 10.312 3.202 636 HB2 ASN 88 HB2 ASN 88 -10.273 10.354 3.456 637 HB3 ASN 88 HB1 ASN 88 -10.845 11.516 2.271 638 HD21 ASN 88 HD21 ASN 88 -9.235 11.095 5.294 639 HD22 ASN 88 HD22 ASN 88 -8.789 12.747 5.520 640 H THR 89 HN THR 89 -14.264 10.662 5.327 641 HA THR 89 HA THR 89 -13.157 10.553 7.859 642 HB THR 89 HB THR 89 -15.481 8.891 6.861 643 HG1 THR 89 HG1 THR 89 -15.230 11.558 7.183 644 HG21 THR 89 HG21 THR 89 -16.190 8.816 9.181 645 HG22 THR 89 HG22 THR 89 -14.802 9.785 9.663 646 HG23 THR 89 HG23 THR 89 -14.562 8.156 9.034 647 H LYS 90 HN LYS 90 -14.176 7.661 6.040 648 HA LYS 90 HA LYS 90 -11.760 6.330 7.039 649 HB2 LYS 90 HB2 LYS 90 -13.027 4.191 6.696 650 HB3 LYS 90 HB1 LYS 90 -13.598 5.231 7.989 651 HG2 LYS 90 HG2 LYS 90 -15.389 6.047 6.526 652 HG3 LYS 90 HG1 LYS 90 -14.834 4.947 5.261 653 HD2 LYS 90 HD2 LYS 90 -16.748 4.063 6.581 654 HD3 LYS 90 HD1 LYS 90 -15.311 3.037 6.638 655 HE2 LYS 90 HE2 LYS 90 -14.737 3.846 8.813 656 HE3 LYS 90 HE1 LYS 90 -16.001 5.073 8.748 657 HZ1 LYS 90 HZ1 LYS 90 -16.639 3.173 10.108 658 HZ2 LYS 90 HZ2 LYS 90 -16.461 2.140 8.780 659 HZ3 LYS 90 HZ3 LYS 90 -17.659 3.334 8.768 660 H VAL 91 HN VAL 91 -12.740 7.788 4.340 661 HA VAL 91 HA VAL 91 -12.151 5.579 2.505 662 HB VAL 91 HB VAL 91 -13.184 8.311 1.771 663 HG11 VAL 91 HG11 VAL 91 -12.246 7.010 -0.065 664 HG12 VAL 91 HG12 VAL 91 -13.996 7.143 -0.231 665 HG13 VAL 91 HG13 VAL 91 -13.279 5.644 0.356 666 HG21 VAL 91 HG21 VAL 91 -15.430 7.323 1.766 667 HG22 VAL 91 HG22 VAL 91 -14.716 7.295 3.379 668 HG23 VAL 91 HG23 VAL 91 -14.771 5.822 2.414 669 H LEU 92 HN LEU 92 -10.226 5.402 1.602 670 HA LEU 92 HA LEU 92 -8.554 7.790 1.177 671 HB2 LEU 92 HB2 LEU 92 -7.960 4.897 1.560 672 HB3 LEU 92 HB1 LEU 92 -6.890 5.823 0.530 673 HG LEU 92 HG LEU 92 -6.309 7.292 2.351 674 HD11 LEU 92 HD11 LEU 92 -8.329 5.733 3.946 675 HD12 LEU 92 HD12 LEU 92 -8.390 7.446 3.523 676 HD13 LEU 92 HD13 LEU 92 -7.154 6.855 4.632 677 HD21 LEU 92 HD21 LEU 92 -5.046 5.234 2.141 678 HD22 LEU 92 HD22 LEU 92 -6.215 4.388 3.154 679 HD23 LEU 92 HD23 LEU 92 -5.219 5.672 3.840 680 H VAL 93 HN VAL 93 -7.593 8.127 -0.908 681 HA VAL 93 HA VAL 93 -8.656 6.470 -3.068 682 HB VAL 93 HB VAL 93 -10.127 8.285 -3.195 683 HG11 VAL 93 HG11 VAL 93 -9.316 9.872 -1.722 684 HG12 VAL 93 HG12 VAL 93 -9.204 10.677 -3.289 685 HG13 VAL 93 HG13 VAL 93 -7.762 9.985 -2.545 686 HG21 VAL 93 HG21 VAL 93 -9.201 7.753 -5.360 687 HG22 VAL 93 HG22 VAL 93 -7.868 8.876 -5.096 688 HG23 VAL 93 HG23 VAL 93 -9.515 9.485 -5.251 689 H ILE 94 HN ILE 94 -6.977 5.612 -4.052 690 HA ILE 94 HA ILE 94 -4.516 7.191 -4.376 691 HB ILE 94 HB ILE 94 -4.837 4.325 -3.524 692 HG12 ILE 94 HG12 ILE 94 -2.933 4.988 -1.995 693 HG13 ILE 94 HG11 ILE 94 -3.128 6.633 -2.584 694 HG21 ILE 94 HG21 ILE 94 -2.376 5.462 -4.841 695 HG22 ILE 94 HG22 ILE 94 -3.427 4.202 -5.490 696 HG23 ILE 94 HG23 ILE 94 -2.478 3.896 -4.034 697 HD11 ILE 94 HD11 ILE 94 -4.214 6.233 -0.416 698 HD12 ILE 94 HD12 ILE 94 -5.266 5.049 -1.191 699 HD13 ILE 94 HD13 ILE 94 -5.348 6.741 -1.668 700 H THR 95 HN THR 95 -3.715 7.280 -6.406 701 HA THR 95 HA THR 95 -4.957 5.514 -8.411 702 HB THR 95 HB THR 95 -4.158 8.389 -8.890 703 HG1 THR 95 HG1 THR 95 -6.798 7.353 -8.555 704 HG21 THR 95 HG21 THR 95 -4.187 6.965 -10.884 705 HG22 THR 95 HG22 THR 95 -5.497 8.144 -10.927 706 HG23 THR 95 HG23 THR 95 -5.835 6.465 -10.507 707 H VAL 96 HN VAL 96 -3.621 4.705 -9.985 708 HA VAL 96 HA VAL 96 -0.769 5.361 -9.786 709 HB VAL 96 HB VAL 96 -0.996 3.150 -8.983 710 HG11 VAL 96 HG11 VAL 96 -2.705 2.541 -11.384 711 HG12 VAL 96 HG12 VAL 96 -3.281 2.756 -9.731 712 HG13 VAL 96 HG13 VAL 96 -2.229 1.397 -10.127 713 HG21 VAL 96 HG21 VAL 96 -0.207 3.123 -11.878 714 HG22 VAL 96 HG22 VAL 96 0.045 1.762 -10.789 715 HG23 VAL 96 HG23 VAL 96 0.846 3.303 -10.477 716 H ASN 97 HN ASN 97 0.405 5.587 -11.753 717 HA ASN 97 HA ASN 97 -1.233 5.452 -14.179 718 HB2 ASN 97 HB2 ASN 97 -1.030 7.818 -13.337 719 HB3 ASN 97 HB1 ASN 97 0.690 7.702 -13.690 720 HD21 ASN 97 HD21 ASN 97 -1.262 9.492 -14.839 721 HD22 ASN 97 HD22 ASN 97 -1.272 9.186 -16.541 722 H ASN 98 HN ASN 98 -0.310 3.661 -14.882 723 HA ASN 98 HA ASN 98 1.489 3.754 -16.839 724 HB2 ASN 98 HB2 ASN 98 3.312 4.331 -15.311 725 HB3 ASN 98 HB1 ASN 98 3.017 2.879 -14.375 726 HD21 ASN 98 HD21 ASN 98 3.621 0.875 -15.227 727 HD22 ASN 98 HD22 ASN 98 4.695 0.743 -16.577 728 HA PRO 99 HA PRO 99 0.235 -0.832 -15.562 729 HB2 PRO 99 HB2 PRO 99 -1.053 -0.108 -12.982 730 HB3 PRO 99 HB1 PRO 99 -0.214 -1.596 -13.438 731 HG2 PRO 99 HG2 PRO 99 0.927 0.175 -11.811 732 HG3 PRO 99 HG1 PRO 99 1.875 -0.697 -13.027 733 HD2 PRO 99 HD2 PRO 99 0.909 2.125 -13.048 734 HD3 PRO 99 HD1 PRO 99 2.426 1.434 -13.649 735 H GLN 100 HN GLN 100 -2.129 -1.535 -15.456 736 HA GLN 100 HA GLN 100 -3.665 0.240 -17.008 737 HB2 GLN 100 HB2 GLN 100 -4.537 -2.204 -15.452 738 HB3 GLN 100 HB1 GLN 100 -5.517 -1.376 -16.654 739 HG2 GLN 100 HG2 GLN 100 -3.862 -1.888 -18.368 740 HG3 GLN 100 HG1 GLN 100 -2.871 -2.709 -17.166 741 HE21 GLN 100 HE21 GLN 100 -6.354 -2.883 -17.237 742 HE22 GLN 100 HE22 GLN 100 -6.454 -4.546 -17.698 743 HA PRO 101 HA PRO 101 -4.667 3.292 -14.003 744 HB2 PRO 101 HB2 PRO 101 -7.102 3.418 -15.742 745 HB3 PRO 101 HB1 PRO 101 -6.113 4.734 -15.101 746 HG2 PRO 101 HG2 PRO 101 -5.820 3.934 -17.616 747 HG3 PRO 101 HG1 PRO 101 -4.413 4.386 -16.637 748 HD2 PRO 101 HD2 PRO 101 -5.320 1.703 -17.515 749 HD3 PRO 101 HD1 PRO 101 -3.684 2.278 -17.142 750 H THR 102 HN THR 102 -5.266 2.685 -12.062 751 HA THR 102 HA THR 102 -8.051 1.983 -11.618 752 HB THR 102 HB THR 102 -5.849 0.380 -10.300 753 HG1 THR 102 HG1 THR 102 -6.218 0.073 -12.702 754 HG21 THR 102 HG21 THR 102 -7.966 0.556 -9.062 755 HG22 THR 102 HG22 THR 102 -7.685 -1.089 -9.634 756 HG23 THR 102 HG23 THR 102 -8.837 -0.048 -10.473 757 H THR 103 HN THR 103 -8.843 2.966 -9.831 758 HA THR 103 HA THR 103 -6.906 4.320 -8.082 759 HB THR 103 HB THR 103 -9.744 5.102 -8.761 760 HG1 THR 103 HG1 THR 103 -8.003 5.564 -10.307 761 HG21 THR 103 HG21 THR 103 -9.256 5.617 -6.424 762 HG22 THR 103 HG22 THR 103 -9.343 7.093 -7.386 763 HG23 THR 103 HG23 THR 103 -7.774 6.444 -6.909 764 H TYR 104 HN TYR 104 -6.707 3.424 -6.184 765 HA TYR 104 HA TYR 104 -8.696 1.472 -5.312 766 HB2 TYR 104 HB2 TYR 104 -5.934 2.022 -4.212 767 HB3 TYR 104 HB1 TYR 104 -6.949 0.626 -3.860 768 HD1 TYR 104 HD1 TYR 104 -7.391 -1.052 -5.632 769 HD2 TYR 104 HD2 TYR 104 -4.591 2.108 -6.168 770 HE1 TYR 104 HE1 TYR 104 -6.378 -2.264 -7.527 771 HE2 TYR 104 HE2 TYR 104 -3.579 0.911 -8.062 772 HH TYR 104 HH TYR 104 -3.406 -1.269 -8.982 773 H ASN 105 HN ASN 105 -10.085 1.901 -3.729 774 HA ASN 105 HA ASN 105 -9.499 4.136 -1.921 775 HB2 ASN 105 HB2 ASN 105 -12.093 2.625 -2.356 776 HB3 ASN 105 HB1 ASN 105 -11.865 3.910 -1.177 777 HD21 ASN 105 HD21 ASN 105 -10.576 3.852 -4.444 778 HD22 ASN 105 HD22 ASN 105 -11.494 5.200 -5.022 779 H PHE 106 HN PHE 106 -8.232 3.388 -0.315 780 HA PHE 106 HA PHE 106 -8.733 0.777 0.845 781 HB2 PHE 106 HB2 PHE 106 -6.792 2.950 1.683 782 HB3 PHE 106 HB1 PHE 106 -6.825 1.313 2.321 783 HD1 PHE 106 HD1 PHE 106 -6.107 -0.567 0.926 784 HD2 PHE 106 HD2 PHE 106 -5.787 3.442 -0.440 785 HE1 PHE 106 HE1 PHE 106 -4.563 -1.297 -0.846 786 HE2 PHE 106 HE2 PHE 106 -4.250 2.730 -2.210 787 HZ PHE 106 HZ PHE 106 -3.583 0.390 -2.390 788 H THR 107 HN THR 107 -10.449 0.616 2.132 789 HA THR 107 HA THR 107 -10.931 2.787 4.063 790 HB THR 107 HB THR 107 -13.057 1.042 2.801 791 HG1 THR 107 HG1 THR 107 -11.927 2.699 1.440 792 HG21 THR 107 HG21 THR 107 -14.568 2.777 3.783 793 HG22 THR 107 HG22 THR 107 -13.167 3.449 4.626 794 HG23 THR 107 HG23 THR 107 -13.714 1.809 4.983 795 H PHE 108 HN PHE 108 -11.238 2.205 6.161 796 HA PHE 108 HA PHE 108 -11.775 -0.600 6.749 797 HB2 PHE 108 HB2 PHE 108 -9.267 -0.079 6.939 798 HB3 PHE 108 HB1 PHE 108 -9.695 0.915 8.326 799 HD1 PHE 108 HD1 PHE 108 -9.568 -0.045 10.394 800 HD2 PHE 108 HD2 PHE 108 -10.322 -2.531 7.027 801 HE1 PHE 108 HE1 PHE 108 -9.501 -2.027 11.848 802 HE2 PHE 108 HE2 PHE 108 -10.256 -4.518 8.475 803 HZ PHE 108 HZ PHE 108 -9.861 -4.284 10.867 804 H LYS 109 HN LYS 109 -12.395 -0.819 9.142 805 HA LYS 109 HA LYS 109 -14.473 1.021 9.689 806 HB2 LYS 109 HB2 LYS 109 -14.410 -1.409 10.375 807 HB3 LYS 109 HB1 LYS 109 -13.214 -0.974 11.584 808 HG2 LYS 109 HG2 LYS 109 -15.886 0.366 11.542 809 HG3 LYS 109 HG1 LYS 109 -15.671 -1.215 12.296 810 HD2 LYS 109 HD2 LYS 109 -13.965 1.163 12.955 811 HD3 LYS 109 HD1 LYS 109 -15.453 0.785 13.829 812 HE2 LYS 109 HE2 LYS 109 -14.519 -1.397 14.440 813 HE3 LYS 109 HE1 LYS 109 -13.041 -1.008 13.560 814 HZ1 LYS 109 HZ1 LYS 109 -14.086 0.416 15.944 815 HZ2 LYS 109 HZ2 LYS 109 -12.707 0.863 15.077 816 HZ3 LYS 109 HZ3 LYS 109 -12.744 -0.612 15.900 817 H SER 110 HN SER 110 -11.251 0.497 10.979 818 HA SER 110 HA SER 110 -11.408 2.653 12.874 819 HB2 SER 110 HB2 SER 110 -10.020 0.537 13.141 820 HB3 SER 110 HB1 SER 110 -8.953 1.190 11.907 821 HG SER 110 HG SER 110 -8.489 1.597 14.261 822 HA PRO 111 HA PRO 111 -10.370 5.727 9.676 823 HB2 PRO 111 HB2 PRO 111 -10.085 7.711 11.626 824 HB3 PRO 111 HB1 PRO 111 -11.536 7.387 10.676 825 HG2 PRO 111 HG2 PRO 111 -10.863 6.561 13.450 826 HG3 PRO 111 HG1 PRO 111 -12.436 6.974 12.745 827 HD2 PRO 111 HD2 PRO 111 -11.728 4.432 13.256 828 HD3 PRO 111 HD1 PRO 111 -12.733 4.861 11.856 829 H GLY 112 HN GLY 112 -8.749 5.305 12.816 830 HA2 GLY 112 HA2 GLY 112 -6.376 6.663 12.119 831 HA3 GLY 112 HA1 GLY 112 -6.548 5.494 13.418 832 H GLU 113 HN GLU 113 -7.486 3.434 11.483 833 HA GLU 113 HA GLU 113 -4.966 2.221 11.061 834 HB2 GLU 113 HB2 GLU 113 -7.109 1.009 11.464 835 HB3 GLU 113 HB1 GLU 113 -7.643 1.484 9.862 836 HG2 GLU 113 HG2 GLU 113 -6.842 -0.803 9.913 837 HG3 GLU 113 HG1 GLU 113 -5.848 0.207 8.858 838 H ARG 114 HN ARG 114 -7.381 3.482 8.754 839 HA ARG 114 HA ARG 114 -5.578 3.139 6.556 840 HB2 ARG 114 HB2 ARG 114 -7.645 4.942 5.801 841 HB3 ARG 114 HB1 ARG 114 -7.390 3.280 5.299 842 HG2 ARG 114 HG2 ARG 114 -9.503 3.172 6.143 843 HG3 ARG 114 HG1 ARG 114 -8.568 2.734 7.571 844 HD2 ARG 114 HD2 ARG 114 -10.286 4.373 8.108 845 HD3 ARG 114 HD1 ARG 114 -8.670 5.060 8.338 846 HE ARG 114 HE ARG 114 -10.251 5.513 5.915 847 HH11 ARG 114 HH11 ARG 114 -8.379 6.820 8.554 848 HH12 ARG 114 HH12 ARG 114 -8.337 8.424 7.879 849 HH21 ARG 114 HH21 ARG 114 -10.203 7.624 5.058 850 HH22 ARG 114 HH22 ARG 114 -9.381 8.876 5.926 851 H GLU 115 HN GLU 115 -6.423 5.814 8.679 852 HA GLU 115 HA GLU 115 -5.178 7.923 7.413 853 HB2 GLU 115 HB2 GLU 115 -5.358 7.165 10.292 854 HB3 GLU 115 HB1 GLU 115 -4.406 8.560 9.804 855 HG2 GLU 115 HG2 GLU 115 -7.337 8.115 9.360 856 HG3 GLU 115 HG1 GLU 115 -6.572 9.276 10.424 857 H SER 116 HN SER 116 -3.677 5.479 9.509 858 HA SER 116 HA SER 116 -1.048 6.380 9.337 859 HB2 SER 116 HB2 SER 116 -2.007 3.515 9.591 860 HB3 SER 116 HB1 SER 116 -0.398 4.110 10.005 861 HG SER 116 HG SER 116 -1.702 5.632 11.424 862 H TRP 117 HN TRP 117 -2.951 4.525 7.058 863 HA TRP 117 HA TRP 117 -0.715 3.585 5.539 864 HB2 TRP 117 HB2 TRP 117 -3.376 2.925 5.642 865 HB3 TRP 117 HB1 TRP 117 -3.286 3.817 4.124 866 HD1 TRP 117 HD1 TRP 117 -2.247 0.581 5.757 867 HE1 TRP 117 HE1 TRP 117 -1.206 -0.985 4.001 868 HE3 TRP 117 HE3 TRP 117 -1.945 3.847 1.849 869 HZ2 TRP 117 HZ2 TRP 117 -0.373 -0.864 1.336 870 HZ3 TRP 117 HZ3 TRP 117 -1.014 3.043 -0.279 871 HH2 TRP 117 HH2 TRP 117 -0.248 0.737 -0.532 872 H GLN 118 HN GLN 118 -3.152 6.098 5.046 873 HA GLN 118 HA GLN 118 -2.433 7.021 2.552 874 HB2 GLN 118 HB2 GLN 118 -4.477 7.701 3.609 875 HB3 GLN 118 HB1 GLN 118 -3.610 8.468 4.924 876 HG2 GLN 118 HG2 GLN 118 -4.494 10.142 3.467 877 HG3 GLN 118 HG1 GLN 118 -2.736 10.133 3.339 878 HE21 GLN 118 HE21 GLN 118 -4.706 7.702 1.822 879 HE22 GLN 118 HE22 GLN 118 -4.453 8.233 0.199 880 H GLU 119 HN GLU 119 -1.247 8.213 5.689 881 HA GLU 119 HA GLU 119 0.463 10.164 4.499 882 HB2 GLU 119 HB2 GLU 119 1.321 10.417 6.830 883 HB3 GLU 119 HB1 GLU 119 -0.429 10.554 6.693 884 HG2 GLU 119 HG2 GLU 119 -0.616 8.187 7.376 885 HG3 GLU 119 HG1 GLU 119 1.124 8.167 7.647 886 H GLN 120 HN GLN 120 0.912 6.887 5.719 887 HA GLN 120 HA GLN 120 3.756 7.070 5.825 888 HB2 GLN 120 HB2 GLN 120 1.752 4.905 6.219 889 HB3 GLN 120 HB1 GLN 120 3.434 4.458 5.965 890 HG2 GLN 120 HG2 GLN 120 2.452 6.347 8.091 891 HG3 GLN 120 HG1 GLN 120 2.843 4.647 8.343 892 HE21 GLN 120 HE21 GLN 120 5.040 4.797 6.402 893 HE22 GLN 120 HE22 GLN 120 6.335 5.593 7.240 894 H ILE 121 HN ILE 121 1.472 5.772 3.480 895 HA ILE 121 HA ILE 121 3.350 4.417 1.896 896 HB ILE 121 HB ILE 121 0.947 4.063 1.668 897 HG12 ILE 121 HG12 ILE 121 0.839 4.051 -0.826 898 HG13 ILE 121 HG11 ILE 121 2.303 5.026 -0.861 899 HG21 ILE 121 HG21 ILE 121 0.137 6.328 1.943 900 HG22 ILE 121 HG22 ILE 121 -0.447 5.664 0.417 901 HG23 ILE 121 HG23 ILE 121 0.894 6.810 0.424 902 HD11 ILE 121 HD11 ILE 121 2.075 2.265 0.311 903 HD12 ILE 121 HD12 ILE 121 3.543 3.237 0.194 904 HD13 ILE 121 HD13 ILE 121 2.748 2.662 -1.270 905 H GLN 122 HN GLN 122 2.281 7.769 1.922 906 HA GLN 122 HA GLN 122 3.550 8.585 -0.466 907 HB2 GLN 122 HB2 GLN 122 2.771 10.119 2.012 908 HB3 GLN 122 HB1 GLN 122 3.394 10.884 0.559 909 HG2 GLN 122 HG2 GLN 122 1.508 10.056 -0.714 910 HG3 GLN 122 HG1 GLN 122 0.897 9.215 0.710 911 HE21 GLN 122 HE21 GLN 122 -0.048 10.381 2.357 912 HE22 GLN 122 HE22 GLN 122 -0.530 12.033 2.172 913 H SER 123 HN SER 123 4.601 8.544 2.903 914 HA SER 123 HA SER 123 7.101 9.765 2.533 915 HB2 SER 123 HB2 SER 123 6.321 7.702 4.607 916 HB3 SER 123 HB1 SER 123 7.656 8.851 4.723 917 HG SER 123 HG SER 123 6.035 10.532 4.596 918 H LEU 124 HN LEU 124 6.035 6.422 2.227 919 HA LEU 124 HA LEU 124 8.632 5.301 1.877 920 HB2 LEU 124 HB2 LEU 124 6.648 4.010 2.595 921 HB3 LEU 124 HB1 LEU 124 5.926 4.257 1.021 922 HG LEU 124 HG LEU 124 7.038 1.980 1.569 923 HD11 LEU 124 HD11 LEU 124 6.191 2.574 -0.630 924 HD12 LEU 124 HD12 LEU 124 7.704 1.674 -0.755 925 HD13 LEU 124 HD13 LEU 124 7.696 3.422 -0.989 926 HD21 LEU 124 HD21 LEU 124 9.151 2.889 2.401 927 HD22 LEU 124 HD22 LEU 124 9.482 3.575 0.811 928 HD23 LEU 124 HD23 LEU 124 9.399 1.825 1.018 929 H MET 125 HN MET 125 6.090 6.386 -0.329 930 HA MET 125 HA MET 125 7.236 5.640 -2.759 931 HB2 MET 125 HB2 MET 125 5.526 8.037 -2.084 932 HB3 MET 125 HB1 MET 125 5.897 7.512 -3.720 933 HG2 MET 125 HG2 MET 125 4.612 5.602 -3.540 934 HG3 MET 125 HG1 MET 125 4.624 5.641 -1.777 935 HE1 MET 125 HE1 MET 125 3.510 7.638 -4.942 936 HE2 MET 125 HE2 MET 125 4.059 8.912 -3.844 937 HE3 MET 125 HE3 MET 125 2.346 8.774 -4.258 938 H LYS 126 HN LYS 126 7.502 8.718 -1.022 939 HA LYS 126 HA LYS 126 9.227 9.889 -2.965 940 HB2 LYS 126 HB2 LYS 126 8.770 10.712 -0.093 941 HB3 LYS 126 HB1 LYS 126 9.457 11.712 -1.365 942 HG2 LYS 126 HG2 LYS 126 6.654 10.602 -1.375 943 HG3 LYS 126 HG1 LYS 126 7.099 12.239 -0.884 944 HD2 LYS 126 HD2 LYS 126 7.976 12.672 -3.125 945 HD3 LYS 126 HD1 LYS 126 7.551 11.028 -3.609 946 HE2 LYS 126 HE2 LYS 126 5.863 12.595 -4.373 947 HE3 LYS 126 HE1 LYS 126 5.193 11.509 -3.156 948 HZ1 LYS 126 HZ1 LYS 126 6.123 14.286 -2.652 949 HZ2 LYS 126 HZ2 LYS 126 5.439 13.248 -1.508 950 HZ3 LYS 126 HZ3 LYS 126 4.510 13.807 -2.802 951 H PHE 127 HN PHE 127 9.724 7.787 -0.310 952 HA PHE 127 HA PHE 127 12.462 8.392 0.168 953 HB2 PHE 127 HB2 PHE 127 11.101 7.233 1.838 954 HB3 PHE 127 HB1 PHE 127 10.888 5.876 0.733 955 HD1 PHE 127 HD1 PHE 127 12.153 4.033 1.198 956 HD2 PHE 127 HD2 PHE 127 13.736 7.882 2.091 957 HE1 PHE 127 HE1 PHE 127 14.198 2.989 2.079 958 HE2 PHE 127 HE2 PHE 127 15.784 6.839 2.973 959 HZ PHE 127 HZ PHE 127 16.016 4.394 2.967 960 H MET 128 HN MET 128 10.876 5.724 -1.609 961 HA MET 128 HA MET 128 13.476 4.864 -2.565 962 HB2 MET 128 HB2 MET 128 12.261 2.976 -3.579 963 HB3 MET 128 HB1 MET 128 11.945 3.136 -1.861 964 HG2 MET 128 HG2 MET 128 9.878 2.631 -2.770 965 HG3 MET 128 HG1 MET 128 9.823 4.376 -2.549 966 HE1 MET 128 HE1 MET 128 10.465 1.486 -5.091 967 HE2 MET 128 HE2 MET 128 11.807 2.556 -5.495 968 HE3 MET 128 HE3 MET 128 10.485 2.326 -6.639 969 H SER 129 HN SER 129 10.758 6.646 -3.741 970 HA SER 129 HA SER 129 11.762 6.477 -6.485 971 HB2 SER 129 HB2 SER 129 9.339 6.034 -6.029 972 HB3 SER 129 HB1 SER 129 9.178 7.703 -5.493 973 HG SER 129 HG SER 129 9.807 6.734 -8.091 974 H MET 130 HN MET 130 12.760 8.148 -4.072 975 HA MET 130 HA MET 130 12.496 10.850 -4.803 976 HB2 MET 130 HB2 MET 130 14.512 11.251 -3.465 977 HB3 MET 130 HB1 MET 130 13.363 10.226 -2.614 978 HG2 MET 130 HG2 MET 130 14.643 8.278 -3.091 979 HG3 MET 130 HG1 MET 130 15.698 9.193 -4.158 980 HE1 MET 130 HE1 MET 130 14.508 8.679 -0.463 981 HE2 MET 130 HE2 MET 130 14.320 10.420 -0.668 982 HE3 MET 130 HE3 MET 130 15.555 9.789 0.420 983 H LYS 131 HN LYS 131 13.586 12.114 -6.238 984 HA LYS 131 HA LYS 131 15.150 10.641 -8.222 985 HB2 LYS 131 HB2 LYS 131 14.156 13.481 -8.452 986 HB3 LYS 131 HB1 LYS 131 14.671 12.412 -9.746 987 HG2 LYS 131 HG2 LYS 131 12.192 12.089 -8.067 988 HG3 LYS 131 HG1 LYS 131 12.255 12.679 -9.726 989 HD2 LYS 131 HD2 LYS 131 13.117 10.514 -10.466 990 HD3 LYS 131 HD1 LYS 131 13.084 9.926 -8.802 991 HE2 LYS 131 HE2 LYS 131 10.637 10.326 -8.759 992 HE3 LYS 131 HE1 LYS 131 10.711 10.786 -10.458 993 HZ1 LYS 131 HZ1 LYS 131 11.510 8.567 -10.986 994 HZ2 LYS 131 HZ2 LYS 131 10.022 8.487 -10.191 995 HZ3 LYS 131 HZ3 LYS 131 11.447 8.127 -9.356 Start of MODEL 4 1 H1 SER 11 HT1 SER 11 24.730 3.977 4.390 2 H2 SER 11 HT2 SER 11 25.881 2.791 4.743 3 H3 SER 11 HT3 SER 11 24.242 2.487 5.023 4 HA SER 11 HA SER 11 25.477 2.929 2.371 5 HB2 SER 11 HB2 SER 11 26.122 0.765 3.287 6 HB3 SER 11 HB1 SER 11 24.455 0.419 3.733 7 HG SER 11 HG SER 11 25.571 -0.305 1.554 8 H ALA 12 HN ALA 12 24.087 3.479 0.835 9 HA ALA 12 HA ALA 12 21.471 4.285 1.420 10 HB1 ALA 12 HB1 ALA 12 22.660 3.706 -1.289 11 HB2 ALA 12 HB2 ALA 12 22.818 5.224 -0.407 12 HB3 ALA 12 HB3 ALA 12 21.232 4.686 -0.960 13 H SER 13 HN SER 13 22.720 1.341 -0.054 14 HA SER 13 HA SER 13 20.187 0.266 -0.750 15 HB2 SER 13 HB2 SER 13 22.253 -0.517 -1.813 16 HB3 SER 13 HB1 SER 13 22.840 -1.118 -0.264 17 HG SER 13 HG SER 13 20.613 -2.042 -1.762 18 H ASP 14 HN ASP 14 22.388 -0.273 1.984 19 HA ASP 14 HA ASP 14 20.811 -2.225 3.265 20 HB2 ASP 14 HB2 ASP 14 23.187 -1.919 3.782 21 HB3 ASP 14 HB1 ASP 14 22.842 -0.332 4.453 22 H ILE 15 HN ILE 15 21.102 1.280 3.806 23 HA ILE 15 HA ILE 15 19.323 1.350 5.981 24 HB ILE 15 HB ILE 15 20.937 3.198 5.353 25 HG12 ILE 15 HG12 ILE 15 19.151 4.999 5.990 26 HG13 ILE 15 HG11 ILE 15 18.073 3.605 6.116 27 HG21 ILE 15 HG21 ILE 15 18.710 4.007 3.495 28 HG22 ILE 15 HG22 ILE 15 20.288 3.401 2.987 29 HG23 ILE 15 HG23 ILE 15 20.166 4.934 3.851 30 HD11 ILE 15 HD11 ILE 15 18.941 4.119 8.283 31 HD12 ILE 15 HD12 ILE 15 20.596 4.088 7.678 32 HD13 ILE 15 HD13 ILE 15 19.653 2.601 7.735 33 H ARG 16 HN ARG 16 18.814 1.611 2.501 34 HA ARG 16 HA ARG 16 16.097 2.363 2.653 35 HB2 ARG 16 HB2 ARG 16 17.154 2.725 0.579 36 HB3 ARG 16 HB1 ARG 16 17.813 1.098 0.530 37 HG2 ARG 16 HG2 ARG 16 15.476 0.249 0.247 38 HG3 ARG 16 HG1 ARG 16 14.957 1.930 0.080 39 HD2 ARG 16 HD2 ARG 16 17.072 0.637 -1.622 40 HD3 ARG 16 HD1 ARG 16 15.369 0.735 -2.079 41 HE ARG 16 HE ARG 16 16.694 3.245 -1.427 42 HH11 ARG 16 HH11 ARG 16 15.648 1.022 -3.923 43 HH12 ARG 16 HH12 ARG 16 15.661 2.221 -5.176 44 HH21 ARG 16 HH21 ARG 16 16.714 4.828 -3.066 45 HH22 ARG 16 HH22 ARG 16 16.270 4.393 -4.686 46 H MET 17 HN MET 17 17.672 -0.797 2.204 47 HA MET 17 HA MET 17 15.336 -2.300 1.989 48 HB2 MET 17 HB2 MET 17 18.039 -3.061 3.098 49 HB3 MET 17 HB1 MET 17 16.742 -4.216 2.834 50 HG2 MET 17 HG2 MET 17 16.743 -3.645 0.446 51 HG3 MET 17 HG1 MET 17 18.086 -2.540 0.728 52 HE1 MET 17 HE1 MET 17 19.395 -3.856 -1.231 53 HE2 MET 17 HE2 MET 17 18.044 -4.976 -1.405 54 HE3 MET 17 HE3 MET 17 19.682 -5.596 -1.202 55 H LYS 18 HN LYS 18 17.111 -1.263 4.873 56 HA LYS 18 HA LYS 18 15.369 -2.676 6.643 57 HB2 LYS 18 HB2 LYS 18 16.503 -1.602 8.432 58 HB3 LYS 18 HB1 LYS 18 17.713 -1.981 7.217 59 HG2 LYS 18 HG2 LYS 18 17.887 0.278 6.549 60 HG3 LYS 18 HG1 LYS 18 16.434 0.729 7.439 61 HD2 LYS 18 HD2 LYS 18 18.370 1.470 8.655 62 HD3 LYS 18 HD1 LYS 18 17.586 0.164 9.541 63 HE2 LYS 18 HE2 LYS 18 19.233 -1.424 8.653 64 HE3 LYS 18 HE1 LYS 18 20.018 -0.113 7.773 65 HZ1 LYS 18 HZ1 LYS 18 19.740 -0.231 10.726 66 HZ2 LYS 18 HZ2 LYS 18 20.591 0.933 9.840 67 HZ3 LYS 18 HZ3 LYS 18 21.133 -0.666 9.871 68 H LYS 19 HN LYS 19 15.489 0.589 5.325 69 HA LYS 19 HA LYS 19 13.567 1.685 7.098 70 HB2 LYS 19 HB2 LYS 19 15.290 2.701 5.190 71 HB3 LYS 19 HB1 LYS 19 13.705 2.983 4.484 72 HG2 LYS 19 HG2 LYS 19 14.686 3.943 7.166 73 HG3 LYS 19 HG1 LYS 19 14.392 4.921 5.729 74 HD2 LYS 19 HD2 LYS 19 12.001 4.320 5.845 75 HD3 LYS 19 HD1 LYS 19 12.321 3.408 7.319 76 HE2 LYS 19 HE2 LYS 19 11.462 5.527 7.971 77 HE3 LYS 19 HE1 LYS 19 13.183 5.529 8.339 78 HZ1 LYS 19 HZ1 LYS 19 11.851 6.844 6.030 79 HZ2 LYS 19 HZ2 LYS 19 13.531 6.728 6.216 80 HZ3 LYS 19 HZ3 LYS 19 12.617 7.598 7.337 81 H VAL 20 HN VAL 20 13.386 0.288 3.850 82 HA VAL 20 HA VAL 20 10.644 0.833 3.452 83 HB VAL 20 HB VAL 20 10.666 -0.790 1.657 84 HG11 VAL 20 HG11 VAL 20 13.234 0.784 1.710 85 HG12 VAL 20 HG12 VAL 20 11.649 1.427 1.267 86 HG13 VAL 20 HG13 VAL 20 12.408 0.180 0.275 87 HG21 VAL 20 HG21 VAL 20 13.407 -1.562 2.642 88 HG22 VAL 20 HG22 VAL 20 12.648 -2.126 1.153 89 HG23 VAL 20 HG23 VAL 20 11.954 -2.559 2.717 90 H MET 21 HN MET 21 12.339 -1.781 5.071 91 HA MET 21 HA MET 21 10.089 -3.441 5.485 92 HB2 MET 21 HB2 MET 21 12.633 -3.097 7.072 93 HB3 MET 21 HB1 MET 21 11.412 -4.298 7.464 94 HG2 MET 21 HG2 MET 21 12.921 -4.117 4.869 95 HG3 MET 21 HG1 MET 21 13.263 -5.242 6.183 96 HE1 MET 21 HE1 MET 21 13.139 -7.312 4.578 97 HE2 MET 21 HE2 MET 21 12.868 -6.214 3.226 98 HE3 MET 21 HE3 MET 21 11.812 -7.609 3.454 99 H GLN 22 HN GLN 22 11.361 -0.643 7.190 100 HA GLN 22 HA GLN 22 9.609 -0.709 9.410 101 HB2 GLN 22 HB2 GLN 22 10.645 1.819 8.126 102 HB3 GLN 22 HB1 GLN 22 10.252 1.548 9.816 103 HG2 GLN 22 HG2 GLN 22 12.172 0.105 10.069 104 HG3 GLN 22 HG1 GLN 22 12.541 0.253 8.352 105 HE21 GLN 22 HE21 GLN 22 14.509 1.211 8.499 106 HE22 GLN 22 HE22 GLN 22 14.775 2.772 9.195 107 H TYR 23 HN TYR 23 9.452 0.918 6.266 108 HA TYR 23 HA TYR 23 6.885 2.045 6.573 109 HB2 TYR 23 HB2 TYR 23 8.445 1.264 4.105 110 HB3 TYR 23 HB1 TYR 23 6.886 2.074 4.035 111 HD1 TYR 23 HD1 TYR 23 10.259 2.625 3.779 112 HD2 TYR 23 HD2 TYR 23 6.839 4.217 5.722 113 HE1 TYR 23 HE1 TYR 23 11.383 4.797 3.947 114 HE2 TYR 23 HE2 TYR 23 7.952 6.400 5.905 115 HH TYR 23 HH TYR 23 10.599 7.264 4.162 116 H ARG 24 HN ARG 24 8.017 -1.049 5.402 117 HA ARG 24 HA ARG 24 5.710 -1.989 4.179 118 HB2 ARG 24 HB2 ARG 24 8.065 -2.979 4.174 119 HB3 ARG 24 HB1 ARG 24 7.634 -3.735 5.702 120 HG2 ARG 24 HG2 ARG 24 5.898 -5.001 4.666 121 HG3 ARG 24 HG1 ARG 24 6.093 -4.117 3.151 122 HD2 ARG 24 HD2 ARG 24 8.416 -4.997 3.014 123 HD3 ARG 24 HD1 ARG 24 8.080 -5.989 4.429 124 HE ARG 24 HE ARG 24 6.389 -6.236 2.042 125 HH11 ARG 24 HH11 ARG 24 8.698 -7.647 4.271 126 HH12 ARG 24 HH12 ARG 24 8.496 -9.252 3.651 127 HH21 ARG 24 HH21 ARG 24 6.140 -8.341 1.219 128 HH22 ARG 24 HH22 ARG 24 7.056 -9.645 1.906 129 H ARG 25 HN ARG 25 6.703 -2.164 7.564 130 HA ARG 25 HA ARG 25 4.561 -3.814 8.418 131 HB2 ARG 25 HB2 ARG 25 6.271 -1.876 9.968 132 HB3 ARG 25 HB1 ARG 25 5.171 -3.045 10.686 133 HG2 ARG 25 HG2 ARG 25 6.455 -4.857 9.599 134 HG3 ARG 25 HG1 ARG 25 7.602 -3.645 9.022 135 HD2 ARG 25 HD2 ARG 25 8.095 -3.011 11.316 136 HD3 ARG 25 HD1 ARG 25 6.923 -4.191 11.900 137 HE ARG 25 HE ARG 25 8.829 -5.470 10.263 138 HH11 ARG 25 HH11 ARG 25 8.517 -3.989 13.413 139 HH12 ARG 25 HH12 ARG 25 9.745 -4.975 14.143 140 HH21 ARG 25 HH21 ARG 25 10.450 -6.772 11.212 141 HH22 ARG 25 HH22 ARG 25 10.857 -6.550 12.884 142 H ALA 26 HN ALA 26 4.959 -0.354 8.070 143 HA ALA 26 HA ALA 26 2.455 0.286 9.347 144 HB1 ALA 26 HB1 ALA 26 4.237 2.005 7.629 145 HB2 ALA 26 HB2 ALA 26 4.367 1.835 9.380 146 HB3 ALA 26 HB3 ALA 26 2.928 2.562 8.670 147 H LEU 27 HN LEU 27 3.451 -0.775 6.301 148 HA LEU 27 HA LEU 27 1.002 0.135 4.992 149 HB2 LEU 27 HB2 LEU 27 3.636 -0.892 4.086 150 HB3 LEU 27 HB1 LEU 27 2.253 -1.264 3.078 151 HG LEU 27 HG LEU 27 1.953 0.938 2.432 152 HD11 LEU 27 HD11 LEU 27 2.833 2.893 3.621 153 HD12 LEU 27 HD12 LEU 27 3.489 1.830 4.869 154 HD13 LEU 27 HD13 LEU 27 1.744 1.944 4.631 155 HD21 LEU 27 HD21 LEU 27 4.902 0.743 3.021 156 HD22 LEU 27 HD22 LEU 27 4.150 1.863 1.886 157 HD23 LEU 27 HD23 LEU 27 4.080 0.128 1.586 158 H THR 28 HN THR 28 2.206 -2.555 6.667 159 HA THR 28 HA THR 28 0.465 -4.454 5.321 160 HB THR 28 HB THR 28 2.285 -4.899 7.694 161 HG1 THR 28 HG1 THR 28 3.418 -4.384 5.755 162 HG21 THR 28 HG21 THR 28 0.469 -6.536 7.572 163 HG22 THR 28 HG22 THR 28 2.018 -7.280 7.183 164 HG23 THR 28 HG23 THR 28 0.883 -6.881 5.893 165 H LYS 29 HN LYS 29 -1.562 -4.237 5.752 166 HA LYS 29 HA LYS 29 -2.491 -4.629 8.407 167 HB2 LYS 29 HB2 LYS 29 -4.129 -2.627 8.025 168 HB3 LYS 29 HB1 LYS 29 -2.563 -2.478 8.766 169 HG2 LYS 29 HG2 LYS 29 -2.674 -2.062 5.899 170 HG3 LYS 29 HG1 LYS 29 -3.370 -0.851 6.962 171 HD2 LYS 29 HD2 LYS 29 -0.655 -1.997 7.425 172 HD3 LYS 29 HD1 LYS 29 -0.886 -0.593 6.381 173 HE2 LYS 29 HE2 LYS 29 -1.743 -0.745 9.272 174 HE3 LYS 29 HE1 LYS 29 -0.229 -0.041 8.722 175 HZ1 LYS 29 HZ1 LYS 29 -2.982 0.928 8.303 176 HZ2 LYS 29 HZ2 LYS 29 -1.717 1.430 7.295 177 HZ3 LYS 29 HZ3 LYS 29 -1.650 1.745 8.954 178 H VAL 30 HN VAL 30 -4.970 -4.664 8.422 179 HA VAL 30 HA VAL 30 -5.894 -5.868 5.924 180 HB VAL 30 HB VAL 30 -7.876 -6.642 7.208 181 HG11 VAL 30 HG11 VAL 30 -5.200 -7.481 8.315 182 HG12 VAL 30 HG12 VAL 30 -5.991 -8.128 6.877 183 HG13 VAL 30 HG13 VAL 30 -6.699 -8.395 8.469 184 HG21 VAL 30 HG21 VAL 30 -6.378 -5.656 9.634 185 HG22 VAL 30 HG22 VAL 30 -7.892 -6.558 9.632 186 HG23 VAL 30 HG23 VAL 30 -7.839 -4.922 8.974 187 H VAL 31 HN VAL 31 -7.185 -4.794 4.641 188 HA VAL 31 HA VAL 31 -8.666 -2.478 5.599 189 HB VAL 31 HB VAL 31 -6.129 -2.321 4.179 190 HG11 VAL 31 HG11 VAL 31 -6.765 -0.563 2.608 191 HG12 VAL 31 HG12 VAL 31 -8.465 -0.895 2.937 192 HG13 VAL 31 HG13 VAL 31 -7.451 -2.133 2.185 193 HG21 VAL 31 HG21 VAL 31 -7.921 -0.242 5.410 194 HG22 VAL 31 HG22 VAL 31 -6.257 0.019 4.889 195 HG23 VAL 31 HG23 VAL 31 -6.602 -1.099 6.211 196 H LYS 32 HN LYS 32 -10.304 -1.822 4.107 197 HA LYS 32 HA LYS 32 -11.000 -4.005 2.281 198 HB2 LYS 32 HB2 LYS 32 -12.493 -3.336 4.259 199 HB3 LYS 32 HB1 LYS 32 -12.877 -1.901 3.321 200 HG2 LYS 32 HG2 LYS 32 -13.166 -4.363 1.798 201 HG3 LYS 32 HG1 LYS 32 -14.207 -4.294 3.225 202 HD2 LYS 32 HD2 LYS 32 -14.947 -2.025 2.459 203 HD3 LYS 32 HD1 LYS 32 -14.051 -2.313 0.964 204 HE2 LYS 32 HE2 LYS 32 -15.441 -4.144 0.383 205 HE3 LYS 32 HE1 LYS 32 -16.170 -4.186 1.985 206 HZ1 LYS 32 HZ1 LYS 32 -16.512 -2.025 -0.025 207 HZ2 LYS 32 HZ2 LYS 32 -17.175 -2.025 1.529 208 HZ3 LYS 32 HZ3 LYS 32 -17.669 -3.184 0.404 209 H LEU 33 HN LEU 33 -10.758 -3.688 0.225 210 HA LEU 33 HA LEU 33 -10.373 -0.991 -0.791 211 HB2 LEU 33 HB2 LEU 33 -10.001 -3.727 -1.945 212 HB3 LEU 33 HB1 LEU 33 -10.078 -2.326 -3.001 213 HG LEU 33 HG LEU 33 -8.093 -2.643 -0.750 214 HD11 LEU 33 HD11 LEU 33 -7.711 -4.308 -2.499 215 HD12 LEU 33 HD12 LEU 33 -6.449 -3.075 -2.501 216 HD13 LEU 33 HD13 LEU 33 -7.726 -3.034 -3.719 217 HD21 LEU 33 HD21 LEU 33 -6.986 -0.746 -1.818 218 HD22 LEU 33 HD22 LEU 33 -8.628 -0.325 -1.331 219 HD23 LEU 33 HD23 LEU 33 -8.272 -0.667 -3.022 220 H LYS 34 HN LYS 34 -11.615 0.019 -2.295 221 HA LYS 34 HA LYS 34 -14.084 -1.287 -3.192 222 HB2 LYS 34 HB2 LYS 34 -14.232 1.481 -2.033 223 HB3 LYS 34 HB1 LYS 34 -15.546 0.380 -2.408 224 HG2 LYS 34 HG2 LYS 34 -14.872 -1.050 -0.544 225 HG3 LYS 34 HG1 LYS 34 -13.575 0.083 -0.159 226 HD2 LYS 34 HD2 LYS 34 -16.541 0.641 -0.109 227 HD3 LYS 34 HD1 LYS 34 -15.475 0.488 1.287 228 HE2 LYS 34 HE2 LYS 34 -14.254 2.472 0.599 229 HE3 LYS 34 HE1 LYS 34 -15.256 2.607 -0.846 230 HZ1 LYS 34 HZ1 LYS 34 -16.047 4.112 0.818 231 HZ2 LYS 34 HZ2 LYS 34 -16.173 2.874 1.962 232 HZ3 LYS 34 HZ3 LYS 34 -17.190 2.885 0.613 233 H THR 35 HN THR 35 -13.741 -1.117 -5.345 234 HA THR 35 HA THR 35 -13.991 1.426 -6.546 235 HB THR 35 HB THR 35 -11.685 1.751 -5.996 236 HG1 THR 35 HG1 THR 35 -11.156 2.458 -7.916 237 HG21 THR 35 HG21 THR 35 -9.903 0.244 -6.754 238 HG22 THR 35 HG22 THR 35 -11.121 -0.881 -7.339 239 HG23 THR 35 HG23 THR 35 -11.001 -0.538 -5.618 240 H HIS 36 HN HIS 36 -12.950 0.886 -9.087 241 HA HIS 36 HA HIS 36 -14.952 -0.789 -10.181 242 HB2 HIS 36 HB2 HIS 36 -12.376 0.201 -11.428 243 HB3 HIS 36 HB1 HIS 36 -13.704 -0.539 -12.312 244 HD1 HIS 36 HD1 HIS 36 -15.600 0.961 -13.015 245 HD2 HIS 36 HD2 HIS 36 -13.014 2.795 -10.325 246 HE1 HIS 36 HE1 HIS 36 -16.285 3.377 -12.955 247 HE2 HIS 36 HE2 HIS 36 -14.797 4.436 -11.225 248 H LEU 37 HN LEU 37 -11.885 -1.389 -8.890 249 HA LEU 37 HA LEU 37 -11.203 -3.872 -10.017 250 HB2 LEU 37 HB2 LEU 37 -9.696 -2.463 -8.668 251 HB3 LEU 37 HB1 LEU 37 -10.704 -2.727 -7.263 252 HG LEU 37 HG LEU 37 -10.119 -5.174 -7.436 253 HD11 LEU 37 HD11 LEU 37 -8.083 -5.738 -8.655 254 HD12 LEU 37 HD12 LEU 37 -8.027 -4.108 -9.326 255 HD13 LEU 37 HD13 LEU 37 -9.355 -5.190 -9.747 256 HD21 LEU 37 HD21 LEU 37 -7.989 -3.111 -6.887 257 HD22 LEU 37 HD22 LEU 37 -7.883 -4.803 -6.399 258 HD23 LEU 37 HD23 LEU 37 -9.154 -3.773 -5.740 259 H PHE 38 HN PHE 38 -12.536 -3.237 -6.790 260 HA PHE 38 HA PHE 38 -14.811 -4.818 -6.956 261 HB2 PHE 38 HB2 PHE 38 -14.149 -6.749 -5.526 262 HB3 PHE 38 HB1 PHE 38 -13.373 -6.774 -7.102 263 HD1 PHE 38 HD1 PHE 38 -11.083 -7.148 -7.216 264 HD2 PHE 38 HD2 PHE 38 -12.770 -5.660 -3.609 265 HE1 PHE 38 HE1 PHE 38 -8.893 -7.338 -6.121 266 HE2 PHE 38 HE2 PHE 38 -10.585 -5.849 -2.508 267 HZ PHE 38 HZ PHE 38 -8.635 -6.773 -3.790 268 H SER 39 HN SER 39 -15.333 -5.556 -4.468 269 HA SER 39 HA SER 39 -14.201 -3.555 -2.652 270 HB2 SER 39 HB2 SER 39 -16.561 -3.364 -1.664 271 HB3 SER 39 HB1 SER 39 -16.272 -2.550 -3.203 272 HG SER 39 HG SER 39 -17.331 -5.173 -3.012 273 H GLU 40 HN GLU 40 -13.042 -4.918 -1.430 274 HA GLU 40 HA GLU 40 -14.392 -6.954 0.135 275 HB2 GLU 40 HB2 GLU 40 -12.138 -7.612 -1.766 276 HB3 GLU 40 HB1 GLU 40 -12.637 -8.661 -0.454 277 HG2 GLU 40 HG2 GLU 40 -14.423 -7.813 -2.721 278 HG3 GLU 40 HG1 GLU 40 -13.514 -9.322 -2.672 279 H THR 41 HN THR 41 -13.076 -7.679 1.913 280 HA THR 41 HA THR 41 -11.194 -5.688 2.806 281 HB THR 41 HB THR 41 -12.042 -8.246 4.144 282 HG1 THR 41 HG1 THR 41 -13.766 -6.720 3.791 283 HG21 THR 41 HG21 THR 41 -9.930 -7.395 5.025 284 HG22 THR 41 HG22 THR 41 -11.223 -7.178 6.203 285 HG23 THR 41 HG23 THR 41 -10.656 -5.804 5.253 286 H VAL 42 HN VAL 42 -9.129 -5.732 2.322 287 HA VAL 42 HA VAL 42 -7.894 -8.313 1.604 288 HB VAL 42 HB VAL 42 -6.578 -7.215 -0.051 289 HG11 VAL 42 HG11 VAL 42 -9.385 -6.118 -0.201 290 HG12 VAL 42 HG12 VAL 42 -8.843 -7.698 -0.773 291 HG13 VAL 42 HG13 VAL 42 -8.251 -6.230 -1.550 292 HG21 VAL 42 HG21 VAL 42 -6.000 -5.193 1.159 293 HG22 VAL 42 HG22 VAL 42 -7.652 -4.593 1.001 294 HG23 VAL 42 HG23 VAL 42 -6.639 -4.780 -0.432 295 H LYS 43 HN LYS 43 -5.576 -8.448 2.072 296 HA LYS 43 HA LYS 43 -4.789 -6.713 4.300 297 HB2 LYS 43 HB2 LYS 43 -4.629 -9.084 4.802 298 HB3 LYS 43 HB1 LYS 43 -3.655 -9.355 3.362 299 HG2 LYS 43 HG2 LYS 43 -1.812 -8.206 4.264 300 HG3 LYS 43 HG1 LYS 43 -2.780 -7.518 5.566 301 HD2 LYS 43 HD2 LYS 43 -1.392 -9.290 6.429 302 HD3 LYS 43 HD1 LYS 43 -3.085 -9.770 6.495 303 HE2 LYS 43 HE2 LYS 43 -1.437 -10.542 4.136 304 HE3 LYS 43 HE1 LYS 43 -1.259 -11.438 5.641 305 HZ1 LYS 43 HZ1 LYS 43 -3.839 -11.023 4.227 306 HZ2 LYS 43 HZ2 LYS 43 -3.583 -11.983 5.595 307 HZ3 LYS 43 HZ3 LYS 43 -2.897 -12.419 4.117 308 H VAL 44 HN VAL 44 -3.351 -5.169 3.962 309 HA VAL 44 HA VAL 44 -2.149 -5.017 1.287 310 HB VAL 44 HB VAL 44 -1.699 -2.570 2.507 311 HG11 VAL 44 HG11 VAL 44 -2.397 -2.954 0.196 312 HG12 VAL 44 HG12 VAL 44 -3.414 -1.745 0.981 313 HG13 VAL 44 HG13 VAL 44 -4.013 -3.389 0.755 314 HG21 VAL 44 HG21 VAL 44 -3.916 -1.876 3.342 315 HG22 VAL 44 HG22 VAL 44 -3.161 -3.092 4.386 316 HG23 VAL 44 HG23 VAL 44 -4.449 -3.554 3.259 317 H THR 45 HN THR 45 -0.022 -4.139 1.087 318 HA THR 45 HA THR 45 1.804 -3.825 3.192 319 HB THR 45 HB THR 45 1.404 -6.313 3.388 320 HG1 THR 45 HG1 THR 45 3.340 -5.877 4.197 321 HG21 THR 45 HG21 THR 45 2.340 -7.799 1.706 322 HG22 THR 45 HG22 THR 45 2.800 -6.416 0.714 323 HG23 THR 45 HG23 THR 45 1.094 -6.779 0.983 324 H CYS 46 HN CYS 46 4.164 -4.477 1.945 325 HA CYS 46 HA CYS 46 3.918 -3.599 -0.824 326 HB2 CYS 46 HB2 CYS 46 5.637 -1.894 -0.595 327 HB3 CYS 46 HB1 CYS 46 4.298 -1.544 0.489 328 HG CYS 46 HG CYS 46 7.381 -2.749 1.337 329 H SER 47 HN SER 47 6.171 -3.652 -1.867 330 HA SER 47 HA SER 47 7.263 -6.226 -1.669 331 HB2 SER 47 HB2 SER 47 7.577 -5.202 -3.735 332 HB3 SER 47 HB1 SER 47 8.072 -3.670 -3.020 333 HG SER 47 HG SER 47 9.565 -5.909 -3.658 334 H LYS 48 HN LYS 48 9.575 -6.692 -1.232 335 HA LYS 48 HA LYS 48 10.199 -5.940 1.463 336 HB2 LYS 48 HB2 LYS 48 11.721 -7.602 -0.554 337 HB3 LYS 48 HB1 LYS 48 12.173 -7.423 1.134 338 HG2 LYS 48 HG2 LYS 48 10.244 -8.582 1.866 339 HG3 LYS 48 HG1 LYS 48 9.519 -8.521 0.257 340 HD2 LYS 48 HD2 LYS 48 10.436 -10.739 0.735 341 HD3 LYS 48 HD1 LYS 48 11.282 -9.966 -0.604 342 HE2 LYS 48 HE2 LYS 48 13.068 -9.286 0.962 343 HE3 LYS 48 HE1 LYS 48 12.234 -10.153 2.252 344 HZ1 LYS 48 HZ1 LYS 48 13.318 -11.363 -0.234 345 HZ2 LYS 48 HZ2 LYS 48 12.513 -12.202 0.992 346 HZ3 LYS 48 HZ3 LYS 48 14.007 -11.480 1.305 347 H ASP 49 HN ASP 49 10.978 -4.756 -1.634 348 HA ASP 49 HA ASP 49 13.255 -3.218 -0.578 349 HB2 ASP 49 HB2 ASP 49 12.300 -3.460 -3.441 350 HB3 ASP 49 HB1 ASP 49 13.751 -2.627 -2.893 351 H GLY 50 HN GLY 50 10.039 -3.014 -0.726 352 HA2 GLY 50 HA2 GLY 50 8.575 -1.269 -0.432 353 HA3 GLY 50 HA1 GLY 50 9.964 -0.197 -0.353 354 H GLU 51 HN GLU 51 10.040 -2.013 -3.174 355 HA GLU 51 HA GLU 51 9.570 0.374 -4.717 356 HB2 GLU 51 HB2 GLU 51 10.491 -2.399 -5.442 357 HB3 GLU 51 HB1 GLU 51 10.260 -1.124 -6.637 358 HG2 GLU 51 HG2 GLU 51 11.903 0.259 -5.440 359 HG3 GLU 51 HG1 GLU 51 12.159 -1.064 -4.304 360 H GLU 52 HN GLU 52 7.566 -2.037 -3.646 361 HA GLU 52 HA GLU 52 5.600 -1.453 -5.724 362 HB2 GLU 52 HB2 GLU 52 6.650 -4.169 -5.028 363 HB3 GLU 52 HB1 GLU 52 4.991 -3.983 -5.561 364 HG2 GLU 52 HG2 GLU 52 5.681 -3.138 -7.668 365 HG3 GLU 52 HG1 GLU 52 7.358 -3.000 -7.131 366 H VAL 53 HN VAL 53 3.500 -1.511 -5.019 367 HA VAL 53 HA VAL 53 3.048 -2.207 -2.200 368 HB VAL 53 HB VAL 53 1.146 -0.874 -4.149 369 HG11 VAL 53 HG11 VAL 53 0.955 -1.177 -1.152 370 HG12 VAL 53 HG12 VAL 53 0.049 -2.125 -2.330 371 HG13 VAL 53 HG13 VAL 53 -0.220 -0.386 -2.204 372 HG21 VAL 53 HG21 VAL 53 1.584 1.192 -2.884 373 HG22 VAL 53 HG22 VAL 53 3.024 0.591 -3.703 374 HG23 VAL 53 HG23 VAL 53 2.833 0.348 -1.967 375 H GLN 54 HN GLN 54 1.700 -3.916 -1.673 376 HA GLN 54 HA GLN 54 0.362 -5.338 -3.821 377 HB2 GLN 54 HB2 GLN 54 1.500 -7.486 -3.216 378 HB3 GLN 54 HB1 GLN 54 2.546 -6.309 -3.992 379 HG2 GLN 54 HG2 GLN 54 3.316 -5.651 -1.686 380 HG3 GLN 54 HG1 GLN 54 2.450 -7.063 -1.090 381 HE21 GLN 54 HE21 GLN 54 4.124 -6.992 -4.168 382 HE22 GLN 54 HE22 GLN 54 5.381 -8.087 -3.717 383 H TRP 55 HN TRP 55 -1.195 -6.848 -3.067 384 HA TRP 55 HA TRP 55 -1.656 -6.877 -0.191 385 HB2 TRP 55 HB2 TRP 55 -4.130 -6.373 -0.665 386 HB3 TRP 55 HB1 TRP 55 -3.005 -5.021 -0.666 387 HD1 TRP 55 HD1 TRP 55 -5.009 -7.232 -3.117 388 HE1 TRP 55 HE1 TRP 55 -5.334 -5.906 -5.303 389 HE3 TRP 55 HE3 TRP 55 -2.131 -3.166 -2.027 390 HZ2 TRP 55 HZ2 TRP 55 -4.483 -3.449 -6.406 391 HZ3 TRP 55 HZ3 TRP 55 -1.940 -1.370 -3.682 392 HH2 TRP 55 HH2 TRP 55 -3.088 -1.502 -5.841 393 H PHE 56 HN PHE 56 -3.343 -8.334 0.457 394 HA PHE 56 HA PHE 56 -3.605 -10.650 -1.358 395 HB2 PHE 56 HB2 PHE 56 -3.489 -10.712 1.676 396 HB3 PHE 56 HB1 PHE 56 -3.412 -12.087 0.575 397 HD1 PHE 56 HD1 PHE 56 -1.400 -12.291 -0.941 398 HD2 PHE 56 HD2 PHE 56 -1.546 -9.605 2.352 399 HE1 PHE 56 HE1 PHE 56 1.052 -12.154 -0.952 400 HE2 PHE 56 HE2 PHE 56 0.913 -9.460 2.344 401 HZ PHE 56 HZ PHE 56 2.211 -10.695 0.708 402 H LYS 57 HN LYS 57 -5.667 -11.297 -1.739 403 HA LYS 57 HA LYS 57 -7.723 -9.561 -0.626 404 HB2 LYS 57 HB2 LYS 57 -7.871 -11.555 -2.877 405 HB3 LYS 57 HB1 LYS 57 -9.133 -10.414 -2.440 406 HG2 LYS 57 HG2 LYS 57 -7.867 -8.568 -3.122 407 HG3 LYS 57 HG1 LYS 57 -6.379 -9.514 -3.202 408 HD2 LYS 57 HD2 LYS 57 -7.474 -10.860 -5.036 409 HD3 LYS 57 HD1 LYS 57 -8.761 -9.653 -5.038 410 HE2 LYS 57 HE2 LYS 57 -7.116 -7.906 -5.535 411 HE3 LYS 57 HE1 LYS 57 -5.832 -9.113 -5.526 412 HZ1 LYS 57 HZ1 LYS 57 -6.544 -8.579 -7.772 413 HZ2 LYS 57 HZ2 LYS 57 -8.122 -9.062 -7.411 414 HZ3 LYS 57 HZ3 LYS 57 -6.873 -10.198 -7.408 415 H GLY 58 HN GLY 58 -8.491 -10.214 1.230 416 HA2 GLY 58 HA2 GLY 58 -9.882 -11.388 2.634 417 HA3 GLY 58 HA1 GLY 58 -10.164 -12.522 1.324 418 H LYS 59 HN LYS 59 -8.799 -14.299 1.080 419 HA LYS 59 HA LYS 59 -8.082 -15.494 3.528 420 HB2 LYS 59 HB2 LYS 59 -7.263 -17.361 2.131 421 HB3 LYS 59 HB1 LYS 59 -8.873 -16.827 1.672 422 HG2 LYS 59 HG2 LYS 59 -7.952 -15.604 -0.212 423 HG3 LYS 59 HG1 LYS 59 -6.321 -16.076 0.260 424 HD2 LYS 59 HD2 LYS 59 -7.085 -17.497 -1.539 425 HD3 LYS 59 HD1 LYS 59 -6.950 -18.443 -0.057 426 HE2 LYS 59 HE2 LYS 59 -8.988 -19.011 -1.253 427 HE3 LYS 59 HE1 LYS 59 -9.366 -18.242 0.286 428 HZ1 LYS 59 HZ1 LYS 59 -9.382 -16.898 -2.363 429 HZ2 LYS 59 HZ2 LYS 59 -9.760 -16.168 -0.885 430 HZ3 LYS 59 HZ3 LYS 59 -10.749 -17.391 -1.499 431 H SER 60 HN SER 60 -5.982 -16.499 3.989 432 HA SER 60 HA SER 60 -3.921 -14.500 3.921 433 HB2 SER 60 HB2 SER 60 -3.925 -17.285 5.108 434 HB3 SER 60 HB1 SER 60 -2.713 -16.041 5.409 435 HG SER 60 HG SER 60 -5.078 -14.961 5.893 436 H THR 61 HN THR 61 -4.029 -14.879 1.410 437 HA THR 61 HA THR 61 -2.572 -17.046 0.322 438 HB THR 61 HB THR 61 -2.923 -14.271 -0.835 439 HG1 THR 61 HG1 THR 61 -4.609 -16.540 -0.710 440 HG21 THR 61 HG21 THR 61 -2.434 -16.935 -2.176 441 HG22 THR 61 HG22 THR 61 -1.245 -15.645 -1.996 442 HG23 THR 61 HG23 THR 61 -2.677 -15.393 -2.995 443 H ALA 62 HN ALA 62 -0.451 -17.449 0.546 444 HA ALA 62 HA ALA 62 1.435 -15.237 0.656 445 HB1 ALA 62 HB1 ALA 62 0.965 -17.177 2.900 446 HB2 ALA 62 HB2 ALA 62 1.020 -15.412 2.956 447 HB3 ALA 62 HB3 ALA 62 2.500 -16.335 2.698 448 H GLY 63 HN GLY 63 3.573 -15.864 0.206 449 HA2 GLY 63 HA2 GLY 63 3.859 -18.195 -1.423 450 HA3 GLY 63 HA1 GLY 63 5.127 -17.058 -1.004 451 H ALA 64 HN ALA 64 6.747 -18.202 -0.178 452 HA ALA 64 HA ALA 64 6.322 -20.547 1.415 453 HB1 ALA 64 HB1 ALA 64 8.858 -19.003 0.886 454 HB2 ALA 64 HB2 ALA 64 8.256 -20.354 -0.075 455 HB3 ALA 64 HB3 ALA 64 8.755 -20.613 1.597 456 H GLN 65 HN GLN 65 4.889 -19.197 2.874 457 HA GLN 65 HA GLN 65 4.482 -18.623 5.026 458 HB2 GLN 65 HB2 GLN 65 7.444 -19.051 5.415 459 HB3 GLN 65 HB1 GLN 65 6.320 -18.691 6.716 460 HG2 GLN 65 HG2 GLN 65 6.333 -21.126 4.952 461 HG3 GLN 65 HG1 GLN 65 6.734 -21.046 6.666 462 HE21 GLN 65 HE21 GLN 65 4.209 -21.107 4.312 463 HE22 GLN 65 HE22 GLN 65 2.893 -21.290 5.419 464 H ASP 66 HN ASP 66 7.350 -17.012 3.696 465 HA ASP 66 HA ASP 66 6.939 -14.639 5.262 466 HB2 ASP 66 HB2 ASP 66 8.811 -15.405 3.061 467 HB3 ASP 66 HB1 ASP 66 8.648 -13.712 3.506 468 H ARG 67 HN ARG 67 5.156 -15.826 2.893 469 HA ARG 67 HA ARG 67 3.443 -15.037 1.665 470 HB2 ARG 67 HB2 ARG 67 3.827 -12.305 2.848 471 HB3 ARG 67 HB1 ARG 67 2.342 -13.080 2.305 472 HG2 ARG 67 HG2 ARG 67 2.425 -14.603 4.196 473 HG3 ARG 67 HG1 ARG 67 3.932 -13.861 4.737 474 HD2 ARG 67 HD2 ARG 67 2.736 -11.697 4.919 475 HD3 ARG 67 HD1 ARG 67 1.236 -12.533 4.514 476 HE ARG 67 HE ARG 67 2.035 -13.951 6.607 477 HH11 ARG 67 HH11 ARG 67 1.927 -10.483 6.140 478 HH12 ARG 67 HH12 ARG 67 1.730 -10.137 7.831 479 HH21 ARG 67 HH21 ARG 67 1.755 -13.499 8.827 480 HH22 ARG 67 HH22 ARG 67 1.627 -11.851 9.355 481 H LYS 68 HN LYS 68 5.597 -15.200 0.116 482 HA LYS 68 HA LYS 68 5.675 -12.657 -1.344 483 HB2 LYS 68 HB2 LYS 68 7.434 -15.091 -1.486 484 HB3 LYS 68 HB1 LYS 68 7.441 -13.878 -2.754 485 HG2 LYS 68 HG2 LYS 68 9.160 -13.121 -1.474 486 HG3 LYS 68 HG1 LYS 68 7.825 -12.243 -0.731 487 HD2 LYS 68 HD2 LYS 68 9.138 -13.148 1.030 488 HD3 LYS 68 HD1 LYS 68 7.661 -14.107 0.942 489 HE2 LYS 68 HE2 LYS 68 9.588 -15.553 1.245 490 HE3 LYS 68 HE1 LYS 68 8.863 -15.822 -0.336 491 HZ1 LYS 68 HZ1 LYS 68 11.249 -15.745 -0.511 492 HZ2 LYS 68 HZ2 LYS 68 11.300 -14.222 0.221 493 HZ3 LYS 68 HZ3 LYS 68 10.590 -14.403 -1.304 494 H LYS 69 HN LYS 69 3.281 -13.650 -1.526 495 HA LYS 69 HA LYS 69 3.069 -14.300 -4.332 496 HB2 LYS 69 HB2 LYS 69 3.165 -16.496 -3.080 497 HB3 LYS 69 HB1 LYS 69 1.668 -16.028 -2.291 498 HG2 LYS 69 HG2 LYS 69 0.522 -15.971 -4.428 499 HG3 LYS 69 HG1 LYS 69 2.026 -16.361 -5.264 500 HD2 LYS 69 HD2 LYS 69 0.701 -18.362 -5.058 501 HD3 LYS 69 HD1 LYS 69 2.112 -18.501 -4.008 502 HE2 LYS 69 HE2 LYS 69 0.754 -17.890 -2.080 503 HE3 LYS 69 HE1 LYS 69 -0.654 -17.686 -3.120 504 HZ1 LYS 69 HZ1 LYS 69 -0.564 -20.029 -3.658 505 HZ2 LYS 69 HZ2 LYS 69 -0.663 -19.824 -1.985 506 HZ3 LYS 69 HZ3 LYS 69 0.812 -20.234 -2.698 507 HA PRO 70 HA PRO 70 0.069 -11.256 -2.531 508 HB2 PRO 70 HB2 PRO 70 0.702 -9.676 -4.906 509 HB3 PRO 70 HB1 PRO 70 0.855 -9.249 -3.200 510 HG2 PRO 70 HG2 PRO 70 3.003 -9.671 -4.771 511 HG3 PRO 70 HG1 PRO 70 2.997 -10.077 -3.046 512 HD2 PRO 70 HD2 PRO 70 2.620 -11.877 -5.414 513 HD3 PRO 70 HD1 PRO 70 3.581 -12.141 -3.941 514 H SER 71 HN SER 71 -1.950 -10.574 -3.235 515 HA SER 71 HA SER 71 -3.085 -12.156 -5.404 516 HB2 SER 71 HB2 SER 71 -4.458 -10.325 -3.423 517 HB3 SER 71 HB1 SER 71 -5.224 -11.535 -4.443 518 HG SER 71 HG SER 71 -3.505 -12.921 -3.197 519 H GLY 72 HN GLY 72 -1.795 -9.110 -4.932 520 HA2 GLY 72 HA2 GLY 72 -2.309 -8.173 -7.515 521 HA3 GLY 72 HA1 GLY 72 -3.490 -7.443 -6.433 522 H GLY 73 HN GLY 73 -2.001 -5.610 -7.534 523 HA2 GLY 73 HA2 GLY 73 -0.916 -4.028 -5.726 524 HA3 GLY 73 HA1 GLY 73 0.392 -5.185 -5.914 525 H PHE 74 HN PHE 74 1.370 -2.969 -6.451 526 HA PHE 74 HA PHE 74 1.780 -2.779 -9.253 527 HB2 PHE 74 HB2 PHE 74 0.840 -0.579 -9.669 528 HB3 PHE 74 HB1 PHE 74 -0.427 -1.662 -9.119 529 HD1 PHE 74 HD1 PHE 74 -0.575 -1.589 -6.344 530 HD2 PHE 74 HD2 PHE 74 0.648 1.547 -8.938 531 HE1 PHE 74 HE1 PHE 74 -1.228 0.074 -4.650 532 HE2 PHE 74 HE2 PHE 74 -0.005 3.203 -7.259 533 HZ PHE 74 HZ PHE 74 -0.940 2.472 -5.103 534 HA PRO 75 HA PRO 75 5.539 -0.992 -7.865 535 HB2 PRO 75 HB2 PRO 75 5.609 0.867 -10.131 536 HB3 PRO 75 HB1 PRO 75 6.660 -0.505 -9.776 537 HG2 PRO 75 HG2 PRO 75 4.882 -0.550 -11.796 538 HG3 PRO 75 HG1 PRO 75 5.296 -2.003 -10.866 539 HD2 PRO 75 HD2 PRO 75 2.890 -0.234 -10.648 540 HD3 PRO 75 HD1 PRO 75 2.999 -2.003 -10.578 541 H VAL 76 HN VAL 76 6.213 0.543 -6.540 542 HA VAL 76 HA VAL 76 4.444 2.568 -5.664 543 HB VAL 76 HB VAL 76 7.334 1.992 -5.020 544 HG11 VAL 76 HG11 VAL 76 5.518 3.969 -3.651 545 HG12 VAL 76 HG12 VAL 76 6.869 4.391 -4.702 546 HG13 VAL 76 HG13 VAL 76 7.164 3.552 -3.178 547 HG21 VAL 76 HG21 VAL 76 6.423 1.164 -2.924 548 HG22 VAL 76 HG22 VAL 76 5.674 0.338 -4.292 549 HG23 VAL 76 HG23 VAL 76 4.796 1.607 -3.440 550 H ASP 77 HN ASP 77 7.267 2.594 -7.751 551 HA ASP 77 HA ASP 77 7.556 5.414 -7.859 552 HB2 ASP 77 HB2 ASP 77 9.430 4.084 -8.477 553 HB3 ASP 77 HB1 ASP 77 8.489 3.162 -9.641 554 H LYS 78 HN LYS 78 5.282 3.282 -9.208 555 HA LYS 78 HA LYS 78 4.666 5.023 -11.469 556 HB2 LYS 78 HB2 LYS 78 4.015 2.203 -10.759 557 HB3 LYS 78 HB1 LYS 78 2.903 3.070 -11.808 558 HG2 LYS 78 HG2 LYS 78 4.549 1.751 -13.060 559 HG3 LYS 78 HG1 LYS 78 4.665 3.476 -13.411 560 HD2 LYS 78 HD2 LYS 78 6.535 3.592 -11.743 561 HD3 LYS 78 HD1 LYS 78 6.478 1.832 -11.656 562 HE2 LYS 78 HE2 LYS 78 6.963 1.682 -14.036 563 HE3 LYS 78 HE1 LYS 78 6.970 3.441 -14.158 564 HZ1 LYS 78 HZ1 LYS 78 8.838 3.452 -12.561 565 HZ2 LYS 78 HZ2 LYS 78 9.205 2.662 -14.012 566 HZ3 LYS 78 HZ3 LYS 78 8.874 1.759 -12.624 567 H ILE 79 HN ILE 79 3.711 4.721 -8.275 568 HA ILE 79 HA ILE 79 0.946 5.252 -8.469 569 HB ILE 79 HB ILE 79 2.716 6.385 -6.307 570 HG12 ILE 79 HG12 ILE 79 1.615 3.573 -6.519 571 HG13 ILE 79 HG11 ILE 79 3.310 4.033 -6.523 572 HG21 ILE 79 HG21 ILE 79 0.425 7.145 -6.290 573 HG22 ILE 79 HG22 ILE 79 0.692 6.051 -4.932 574 HG23 ILE 79 HG23 ILE 79 -0.161 5.484 -6.368 575 HD11 ILE 79 HD11 ILE 79 1.374 4.265 -4.235 576 HD12 ILE 79 HD12 ILE 79 3.014 4.909 -4.223 577 HD13 ILE 79 HD13 ILE 79 2.752 3.171 -4.369 578 H THR 80 HN THR 80 0.008 6.968 -9.410 579 HA THR 80 HA THR 80 1.650 9.240 -10.081 580 HB THR 80 HB THR 80 0.161 8.384 -11.786 581 HG1 THR 80 HG1 THR 80 0.466 10.869 -11.182 582 HG21 THR 80 HG21 THR 80 -1.661 7.554 -10.396 583 HG22 THR 80 HG22 THR 80 -2.267 8.652 -11.639 584 HG23 THR 80 HG23 THR 80 -2.101 9.210 -9.973 585 H SER 81 HN SER 81 -0.981 8.494 -7.868 586 HA SER 81 HA SER 81 -0.396 10.871 -6.358 587 HB2 SER 81 HB2 SER 81 -3.108 10.591 -7.678 588 HB3 SER 81 HB1 SER 81 -2.702 11.779 -6.441 589 HG SER 81 HG SER 81 -0.864 11.935 -8.349 590 H VAL 82 HN VAL 82 -0.659 10.449 -4.274 591 HA VAL 82 HA VAL 82 -2.584 8.384 -3.461 592 HB VAL 82 HB VAL 82 -0.128 9.395 -2.006 593 HG11 VAL 82 HG11 VAL 82 -1.978 9.012 -0.436 594 HG12 VAL 82 HG12 VAL 82 -0.684 7.832 -0.231 595 HG13 VAL 82 HG13 VAL 82 -2.166 7.377 -1.071 596 HG21 VAL 82 HG21 VAL 82 0.401 7.811 -3.739 597 HG22 VAL 82 HG22 VAL 82 -0.849 6.708 -3.160 598 HG23 VAL 82 HG23 VAL 82 0.573 7.030 -2.166 599 H LYS 83 HN LYS 83 -4.407 9.281 -2.904 600 HA LYS 83 HA LYS 83 -4.384 11.907 -1.569 601 HB2 LYS 83 HB2 LYS 83 -6.438 10.964 -3.559 602 HB3 LYS 83 HB1 LYS 83 -6.249 12.581 -2.904 603 HG2 LYS 83 HG2 LYS 83 -4.613 13.115 -4.355 604 HG3 LYS 83 HG1 LYS 83 -3.940 11.484 -4.374 605 HD2 LYS 83 HD2 LYS 83 -4.943 12.116 -6.536 606 HD3 LYS 83 HD1 LYS 83 -5.742 10.726 -5.799 607 HE2 LYS 83 HE2 LYS 83 -7.381 12.261 -6.723 608 HE3 LYS 83 HE1 LYS 83 -7.516 12.191 -4.966 609 HZ1 LYS 83 HZ1 LYS 83 -6.284 14.257 -4.819 610 HZ2 LYS 83 HZ2 LYS 83 -7.651 14.464 -5.788 611 HZ3 LYS 83 HZ3 LYS 83 -6.125 14.322 -6.501 612 H SER 84 HN SER 84 -6.378 12.384 -0.410 613 HA SER 84 HA SER 84 -7.927 10.004 0.338 614 HB2 SER 84 HB2 SER 84 -8.434 11.271 2.472 615 HB3 SER 84 HB1 SER 84 -6.764 10.736 2.299 616 HG SER 84 HG SER 84 -6.460 12.780 2.806 617 H GLN 85 HN GLN 85 -10.226 10.425 0.701 618 HA GLN 85 HA GLN 85 -11.366 11.774 -1.469 619 HB2 GLN 85 HB2 GLN 85 -12.244 10.118 0.667 620 HB3 GLN 85 HB1 GLN 85 -13.324 11.498 0.561 621 HG2 GLN 85 HG2 GLN 85 -14.196 9.723 -0.779 622 HG3 GLN 85 HG1 GLN 85 -13.642 11.015 -1.839 623 HE21 GLN 85 HE21 GLN 85 -11.535 8.768 -0.207 624 HE22 GLN 85 HE22 GLN 85 -11.003 7.933 -1.617 625 H ALA 86 HN ALA 86 -13.367 13.336 -1.014 626 HA ALA 86 HA ALA 86 -12.232 15.822 -0.414 627 HB1 ALA 86 HB1 ALA 86 -14.469 16.729 -0.644 628 HB2 ALA 86 HB2 ALA 86 -15.159 15.115 -0.497 629 HB3 ALA 86 HB3 ALA 86 -14.164 15.523 -1.892 630 H ASP 87 HN ASP 87 -14.464 13.824 1.524 631 HA ASP 87 HA ASP 87 -13.637 15.411 3.874 632 HB2 ASP 87 HB2 ASP 87 -16.062 15.439 3.522 633 HB3 ASP 87 HB1 ASP 87 -16.097 13.681 3.508 634 H ASN 88 HN ASN 88 -13.775 12.329 2.389 635 HA ASN 88 HA ASN 88 -12.929 10.287 2.913 636 HB2 ASN 88 HB2 ASN 88 -10.532 10.325 3.235 637 HB3 ASN 88 HB1 ASN 88 -11.017 11.550 2.078 638 HD21 ASN 88 HD21 ASN 88 -10.829 13.745 2.641 639 HD22 ASN 88 HD22 ASN 88 -9.851 14.259 3.971 640 H THR 89 HN THR 89 -14.614 10.561 4.901 641 HA THR 89 HA THR 89 -13.596 10.594 7.498 642 HB THR 89 HB THR 89 -15.874 8.871 6.504 643 HG1 THR 89 HG1 THR 89 -15.611 11.574 6.711 644 HG21 THR 89 HG21 THR 89 -15.321 10.006 9.245 645 HG22 THR 89 HG22 THR 89 -15.030 8.334 8.771 646 HG23 THR 89 HG23 THR 89 -16.675 8.972 8.788 647 H LYS 90 HN LYS 90 -14.532 7.632 5.743 648 HA LYS 90 HA LYS 90 -12.161 6.352 6.907 649 HB2 LYS 90 HB2 LYS 90 -13.377 4.204 6.645 650 HB3 LYS 90 HB1 LYS 90 -14.123 5.321 7.778 651 HG2 LYS 90 HG2 LYS 90 -15.692 5.992 5.945 652 HG3 LYS 90 HG1 LYS 90 -15.025 4.668 4.986 653 HD2 LYS 90 HD2 LYS 90 -16.394 4.430 7.663 654 HD3 LYS 90 HD1 LYS 90 -17.064 3.958 6.101 655 HE2 LYS 90 HE2 LYS 90 -15.359 2.260 5.847 656 HE3 LYS 90 HE1 LYS 90 -14.583 2.773 7.343 657 HZ1 LYS 90 HZ1 LYS 90 -17.308 1.624 7.123 658 HZ2 LYS 90 HZ2 LYS 90 -16.555 2.106 8.556 659 HZ3 LYS 90 HZ3 LYS 90 -15.935 0.807 7.669 660 H VAL 91 HN VAL 91 -12.905 7.758 4.135 661 HA VAL 91 HA VAL 91 -12.253 5.494 2.377 662 HB VAL 91 HB VAL 91 -13.237 8.168 1.431 663 HG11 VAL 91 HG11 VAL 91 -13.495 5.372 0.314 664 HG12 VAL 91 HG12 VAL 91 -12.366 6.609 -0.239 665 HG13 VAL 91 HG13 VAL 91 -14.103 6.847 -0.438 666 HG21 VAL 91 HG21 VAL 91 -14.964 5.857 2.328 667 HG22 VAL 91 HG22 VAL 91 -15.529 7.332 1.543 668 HG23 VAL 91 HG23 VAL 91 -14.807 7.409 3.150 669 H LEU 92 HN LEU 92 -10.441 5.414 1.216 670 HA LEU 92 HA LEU 92 -8.734 7.813 0.986 671 HB2 LEU 92 HB2 LEU 92 -8.118 4.943 1.422 672 HB3 LEU 92 HB1 LEU 92 -7.056 5.811 0.336 673 HG LEU 92 HG LEU 92 -6.476 7.382 2.093 674 HD11 LEU 92 HD11 LEU 92 -8.365 5.785 3.810 675 HD12 LEU 92 HD12 LEU 92 -8.565 7.464 3.304 676 HD13 LEU 92 HD13 LEU 92 -7.252 7.021 4.395 677 HD21 LEU 92 HD21 LEU 92 -5.171 5.343 1.888 678 HD22 LEU 92 HD22 LEU 92 -6.282 4.506 2.973 679 HD23 LEU 92 HD23 LEU 92 -5.291 5.833 3.579 680 H VAL 93 HN VAL 93 -7.705 8.176 -1.090 681 HA VAL 93 HA VAL 93 -8.737 6.523 -3.279 682 HB VAL 93 HB VAL 93 -10.209 8.329 -3.447 683 HG11 VAL 93 HG11 VAL 93 -9.365 9.852 -1.870 684 HG12 VAL 93 HG12 VAL 93 -9.406 10.717 -3.410 685 HG13 VAL 93 HG13 VAL 93 -7.881 10.091 -2.785 686 HG21 VAL 93 HG21 VAL 93 -9.575 9.551 -5.463 687 HG22 VAL 93 HG22 VAL 93 -9.147 7.846 -5.589 688 HG23 VAL 93 HG23 VAL 93 -7.899 9.046 -5.249 689 H ILE 94 HN ILE 94 -7.014 5.613 -4.144 690 HA ILE 94 HA ILE 94 -4.575 7.235 -4.505 691 HB ILE 94 HB ILE 94 -4.883 4.360 -3.676 692 HG12 ILE 94 HG12 ILE 94 -3.059 5.051 -2.057 693 HG13 ILE 94 HG11 ILE 94 -3.292 6.699 -2.621 694 HG21 ILE 94 HG21 ILE 94 -3.382 4.312 -5.582 695 HG22 ILE 94 HG22 ILE 94 -2.496 3.994 -4.089 696 HG23 ILE 94 HG23 ILE 94 -2.391 5.579 -4.856 697 HD11 ILE 94 HD11 ILE 94 -5.543 6.713 -1.795 698 HD12 ILE 94 HD12 ILE 94 -4.452 6.202 -0.505 699 HD13 ILE 94 HD13 ILE 94 -5.432 5.010 -1.360 700 H THR 95 HN THR 95 -3.934 7.473 -6.558 701 HA THR 95 HA THR 95 -5.047 5.623 -8.570 702 HB THR 95 HB THR 95 -4.150 8.453 -9.118 703 HG1 THR 95 HG1 THR 95 -6.829 7.574 -8.677 704 HG21 THR 95 HG21 THR 95 -5.954 6.553 -10.628 705 HG22 THR 95 HG22 THR 95 -4.297 6.973 -11.062 706 HG23 THR 95 HG23 THR 95 -5.561 8.202 -11.115 707 H VAL 96 HN VAL 96 -3.678 4.772 -10.109 708 HA VAL 96 HA VAL 96 -0.827 5.395 -9.810 709 HB VAL 96 HB VAL 96 -0.974 3.241 -8.962 710 HG11 VAL 96 HG11 VAL 96 -2.307 1.444 -9.876 711 HG12 VAL 96 HG12 VAL 96 -2.839 2.486 -11.199 712 HG13 VAL 96 HG13 VAL 96 -3.319 2.850 -9.541 713 HG21 VAL 96 HG21 VAL 96 -0.399 2.994 -11.899 714 HG22 VAL 96 HG22 VAL 96 -0.065 1.729 -10.720 715 HG23 VAL 96 HG23 VAL 96 0.757 3.284 -10.599 716 H ASN 97 HN ASN 97 0.427 5.561 -11.662 717 HA ASN 97 HA ASN 97 -1.073 5.636 -14.193 718 HB2 ASN 97 HB2 ASN 97 -0.483 7.892 -13.441 719 HB3 ASN 97 HB1 ASN 97 1.212 7.424 -13.346 720 HD21 ASN 97 HD21 ASN 97 -1.426 8.265 -15.416 721 HD22 ASN 97 HD22 ASN 97 -0.505 8.419 -16.872 722 H ASN 98 HN ASN 98 -0.156 4.765 -15.965 723 HA ASN 98 HA ASN 98 1.431 3.839 -17.342 724 HB2 ASN 98 HB2 ASN 98 3.383 4.535 -16.120 725 HB3 ASN 98 HB1 ASN 98 3.105 3.316 -14.886 726 HD21 ASN 98 HD21 ASN 98 3.662 1.196 -15.294 727 HD22 ASN 98 HD22 ASN 98 4.587 0.719 -16.671 728 HA PRO 99 HA PRO 99 0.260 -0.580 -15.594 729 HB2 PRO 99 HB2 PRO 99 -0.944 0.344 -13.029 730 HB3 PRO 99 HB1 PRO 99 -0.131 -1.180 -13.403 731 HG2 PRO 99 HG2 PRO 99 1.112 0.669 -11.978 732 HG3 PRO 99 HG1 PRO 99 1.988 -0.243 -13.220 733 HD2 PRO 99 HD2 PRO 99 0.922 2.551 -13.318 734 HD3 PRO 99 HD1 PRO 99 2.449 1.901 -13.946 735 H GLN 100 HN GLN 100 -2.058 -1.361 -15.390 736 HA GLN 100 HA GLN 100 -3.741 0.205 -17.002 737 HB2 GLN 100 HB2 GLN 100 -4.512 -2.068 -15.157 738 HB3 GLN 100 HB1 GLN 100 -5.471 -1.460 -16.498 739 HG2 GLN 100 HG2 GLN 100 -3.860 -2.235 -18.085 740 HG3 GLN 100 HG1 GLN 100 -2.740 -2.680 -16.799 741 HE21 GLN 100 HE21 GLN 100 -3.859 -4.345 -18.894 742 HE22 GLN 100 HE22 GLN 100 -4.702 -5.624 -18.097 743 HA PRO 101 HA PRO 101 -4.730 3.370 -14.081 744 HB2 PRO 101 HB2 PRO 101 -7.185 3.510 -15.779 745 HB3 PRO 101 HB1 PRO 101 -6.120 4.811 -15.232 746 HG2 PRO 101 HG2 PRO 101 -5.971 3.887 -17.722 747 HG3 PRO 101 HG1 PRO 101 -4.513 4.347 -16.831 748 HD2 PRO 101 HD2 PRO 101 -5.539 1.644 -17.514 749 HD3 PRO 101 HD1 PRO 101 -3.868 2.198 -17.295 750 H THR 102 HN THR 102 -5.294 2.713 -12.146 751 HA THR 102 HA THR 102 -8.072 1.981 -11.679 752 HB THR 102 HB THR 102 -5.821 0.416 -10.393 753 HG1 THR 102 HG1 THR 102 -6.007 -0.031 -12.684 754 HG21 THR 102 HG21 THR 102 -7.611 -1.089 -9.693 755 HG22 THR 102 HG22 THR 102 -8.799 -0.079 -10.517 756 HG23 THR 102 HG23 THR 102 -7.923 0.551 -9.120 757 H THR 103 HN THR 103 -8.834 2.799 -9.761 758 HA THR 103 HA THR 103 -6.885 4.283 -8.129 759 HB THR 103 HB THR 103 -9.773 4.985 -8.697 760 HG1 THR 103 HG1 THR 103 -8.039 5.415 -10.320 761 HG21 THR 103 HG21 THR 103 -9.338 7.021 -7.408 762 HG22 THR 103 HG22 THR 103 -7.726 6.426 -7.007 763 HG23 THR 103 HG23 THR 103 -9.154 5.581 -6.407 764 H TYR 104 HN TYR 104 -6.561 3.279 -6.298 765 HA TYR 104 HA TYR 104 -8.509 1.336 -5.354 766 HB2 TYR 104 HB2 TYR 104 -5.704 1.911 -4.379 767 HB3 TYR 104 HB1 TYR 104 -6.696 0.523 -3.939 768 HD1 TYR 104 HD1 TYR 104 -7.304 -1.151 -5.717 769 HD2 TYR 104 HD2 TYR 104 -4.395 1.894 -6.346 770 HE1 TYR 104 HE1 TYR 104 -6.399 -2.406 -7.638 771 HE2 TYR 104 HE2 TYR 104 -3.493 0.651 -8.267 772 HH TYR 104 HH TYR 104 -5.101 -1.883 -9.739 773 H ASN 105 HN ASN 105 -9.886 1.770 -3.781 774 HA ASN 105 HA ASN 105 -9.349 4.049 -2.017 775 HB2 ASN 105 HB2 ASN 105 -11.910 2.486 -2.451 776 HB3 ASN 105 HB1 ASN 105 -11.725 3.817 -1.318 777 HD21 ASN 105 HD21 ASN 105 -10.329 3.701 -4.541 778 HD22 ASN 105 HD22 ASN 105 -11.282 4.984 -5.197 779 H PHE 106 HN PHE 106 -8.102 3.361 -0.360 780 HA PHE 106 HA PHE 106 -8.592 0.774 0.855 781 HB2 PHE 106 HB2 PHE 106 -6.675 2.981 1.656 782 HB3 PHE 106 HB1 PHE 106 -6.715 1.366 2.353 783 HD1 PHE 106 HD1 PHE 106 -6.037 -0.583 0.972 784 HD2 PHE 106 HD2 PHE 106 -5.595 3.411 -0.403 785 HE1 PHE 106 HE1 PHE 106 -4.451 -1.358 -0.722 786 HE2 PHE 106 HE2 PHE 106 -4.009 2.647 -2.121 787 HZ PHE 106 HZ PHE 106 -3.434 0.257 -2.285 788 H THR 107 HN THR 107 -10.279 0.587 2.146 789 HA THR 107 HA THR 107 -10.928 2.821 3.956 790 HB THR 107 HB THR 107 -12.880 0.876 2.710 791 HG1 THR 107 HG1 THR 107 -11.869 2.465 1.257 792 HG21 THR 107 HG21 THR 107 -14.567 2.486 3.546 793 HG22 THR 107 HG22 THR 107 -13.273 3.374 4.358 794 HG23 THR 107 HG23 THR 107 -13.647 1.720 4.841 795 H PHE 108 HN PHE 108 -11.226 2.305 6.095 796 HA PHE 108 HA PHE 108 -11.659 -0.494 6.778 797 HB2 PHE 108 HB2 PHE 108 -9.170 0.063 6.927 798 HB3 PHE 108 HB1 PHE 108 -9.589 1.122 8.267 799 HD1 PHE 108 HD1 PHE 108 -9.296 0.253 10.360 800 HD2 PHE 108 HD2 PHE 108 -10.322 -2.380 7.182 801 HE1 PHE 108 HE1 PHE 108 -9.185 -1.655 11.908 802 HE2 PHE 108 HE2 PHE 108 -10.216 -4.292 8.724 803 HZ PHE 108 HZ PHE 108 -9.662 -3.946 11.074 804 H LYS 109 HN LYS 109 -12.281 -0.715 9.103 805 HA LYS 109 HA LYS 109 -14.413 1.041 9.687 806 HB2 LYS 109 HB2 LYS 109 -14.385 -1.343 10.302 807 HB3 LYS 109 HB1 LYS 109 -13.069 -1.047 11.422 808 HG2 LYS 109 HG2 LYS 109 -15.554 0.516 11.812 809 HG3 LYS 109 HG1 LYS 109 -15.605 -1.207 12.189 810 HD2 LYS 109 HD2 LYS 109 -13.741 -0.962 13.715 811 HD3 LYS 109 HD1 LYS 109 -13.577 0.740 13.282 812 HE2 LYS 109 HE2 LYS 109 -14.736 0.497 15.408 813 HE3 LYS 109 HE1 LYS 109 -15.802 1.188 14.187 814 HZ1 LYS 109 HZ1 LYS 109 -16.927 -0.499 15.490 815 HZ2 LYS 109 HZ2 LYS 109 -15.775 -1.654 15.051 816 HZ3 LYS 109 HZ3 LYS 109 -16.797 -0.994 13.879 817 H SER 110 HN SER 110 -11.088 0.974 10.584 818 HA SER 110 HA SER 110 -11.451 3.035 12.621 819 HB2 SER 110 HB2 SER 110 -9.964 1.054 13.062 820 HB3 SER 110 HB1 SER 110 -8.931 1.619 11.756 821 HG SER 110 HG SER 110 -9.419 2.809 14.269 822 HA PRO 111 HA PRO 111 -10.545 6.088 9.324 823 HB2 PRO 111 HB2 PRO 111 -10.394 8.080 11.312 824 HB3 PRO 111 HB1 PRO 111 -11.781 7.729 10.274 825 HG2 PRO 111 HG2 PRO 111 -11.235 6.867 13.070 826 HG3 PRO 111 HG1 PRO 111 -12.780 7.249 12.287 827 HD2 PRO 111 HD2 PRO 111 -12.076 4.725 12.780 828 HD3 PRO 111 HD1 PRO 111 -12.931 5.157 11.285 829 H GLY 112 HN GLY 112 -8.956 5.755 12.492 830 HA2 GLY 112 HA2 GLY 112 -6.604 7.161 11.788 831 HA3 GLY 112 HA1 GLY 112 -6.758 6.019 13.114 832 H GLU 113 HN GLU 113 -7.594 3.844 11.334 833 HA GLU 113 HA GLU 113 -5.070 2.685 10.914 834 HB2 GLU 113 HB2 GLU 113 -7.058 1.356 11.355 835 HB3 GLU 113 HB1 GLU 113 -7.799 1.919 9.866 836 HG2 GLU 113 HG2 GLU 113 -6.987 -0.331 9.619 837 HG3 GLU 113 HG1 GLU 113 -6.079 0.764 8.576 838 H ARG 114 HN ARG 114 -7.461 3.893 8.560 839 HA ARG 114 HA ARG 114 -5.747 3.276 6.359 840 HB2 ARG 114 HB2 ARG 114 -7.746 5.235 5.660 841 HB3 ARG 114 HB1 ARG 114 -7.521 3.600 5.062 842 HG2 ARG 114 HG2 ARG 114 -9.570 3.335 5.953 843 HG3 ARG 114 HG1 ARG 114 -8.646 3.043 7.428 844 HD2 ARG 114 HD2 ARG 114 -10.488 4.633 7.777 845 HD3 ARG 114 HD1 ARG 114 -8.908 5.376 8.072 846 HE ARG 114 HE ARG 114 -10.188 5.660 5.459 847 HH11 ARG 114 HH11 ARG 114 -9.032 7.203 8.386 848 HH12 ARG 114 HH12 ARG 114 -9.215 8.804 7.745 849 HH21 ARG 114 HH21 ARG 114 -10.356 7.773 4.621 850 HH22 ARG 114 HH22 ARG 114 -9.941 9.126 5.621 851 H GLU 115 HN GLU 115 -6.487 6.220 8.176 852 HA GLU 115 HA GLU 115 -5.035 8.013 6.613 853 HB2 GLU 115 HB2 GLU 115 -5.565 7.943 9.570 854 HB3 GLU 115 HB1 GLU 115 -4.588 9.214 8.846 855 HG2 GLU 115 HG2 GLU 115 -6.595 9.543 7.268 856 HG3 GLU 115 HG1 GLU 115 -7.493 8.624 8.474 857 H SER 116 HN SER 116 -3.920 5.835 9.183 858 HA SER 116 HA SER 116 -1.234 6.602 9.197 859 HB2 SER 116 HB2 SER 116 -2.364 3.819 9.641 860 HB3 SER 116 HB1 SER 116 -0.762 4.381 10.127 861 HG SER 116 HG SER 116 -3.265 5.362 11.060 862 H TRP 117 HN TRP 117 -3.025 4.528 7.012 863 HA TRP 117 HA TRP 117 -0.744 3.518 5.620 864 HB2 TRP 117 HB2 TRP 117 -3.378 2.836 5.664 865 HB3 TRP 117 HB1 TRP 117 -3.301 3.731 4.149 866 HD1 TRP 117 HD1 TRP 117 -2.249 0.505 5.771 867 HE1 TRP 117 HE1 TRP 117 -1.184 -1.049 4.020 868 HE3 TRP 117 HE3 TRP 117 -1.943 3.780 1.865 869 HZ2 TRP 117 HZ2 TRP 117 -0.337 -0.917 1.360 870 HZ3 TRP 117 HZ3 TRP 117 -0.997 2.981 -0.261 871 HH2 TRP 117 HH2 TRP 117 -0.215 0.678 -0.508 872 H GLN 118 HN GLN 118 -3.118 6.038 5.011 873 HA GLN 118 HA GLN 118 -2.382 6.941 2.522 874 HB2 GLN 118 HB2 GLN 118 -4.401 7.662 3.627 875 HB3 GLN 118 HB1 GLN 118 -3.483 8.439 4.903 876 HG2 GLN 118 HG2 GLN 118 -4.388 10.090 3.421 877 HG3 GLN 118 HG1 GLN 118 -2.632 10.065 3.281 878 HE21 GLN 118 HE21 GLN 118 -4.657 7.640 1.814 879 HE22 GLN 118 HE22 GLN 118 -4.409 8.148 0.182 880 H GLU 119 HN GLU 119 -1.157 8.146 5.655 881 HA GLU 119 HA GLU 119 0.603 10.015 4.404 882 HB2 GLU 119 HB2 GLU 119 1.467 10.360 6.700 883 HB3 GLU 119 HB1 GLU 119 -0.285 10.471 6.598 884 HG2 GLU 119 HG2 GLU 119 -0.481 8.194 7.451 885 HG3 GLU 119 HG1 GLU 119 1.271 8.085 7.561 886 H GLN 120 HN GLN 120 1.001 6.793 5.792 887 HA GLN 120 HA GLN 120 3.830 6.861 5.863 888 HB2 GLN 120 HB2 GLN 120 1.737 4.781 6.221 889 HB3 GLN 120 HB1 GLN 120 3.392 4.251 5.947 890 HG2 GLN 120 HG2 GLN 120 2.553 6.174 8.102 891 HG3 GLN 120 HG1 GLN 120 2.783 4.442 8.337 892 HE21 GLN 120 HE21 GLN 120 5.016 4.454 6.390 893 HE22 GLN 120 HE22 GLN 120 6.367 5.089 7.269 894 H ILE 121 HN ILE 121 1.522 5.647 3.484 895 HA ILE 121 HA ILE 121 3.396 4.291 1.890 896 HB ILE 121 HB ILE 121 0.978 3.959 1.655 897 HG12 ILE 121 HG12 ILE 121 0.897 3.939 -0.835 898 HG13 ILE 121 HG11 ILE 121 2.371 4.900 -0.860 899 HG21 ILE 121 HG21 ILE 121 0.966 6.698 0.394 900 HG22 ILE 121 HG22 ILE 121 0.199 6.242 1.917 901 HG23 ILE 121 HG23 ILE 121 -0.388 5.568 0.396 902 HD11 ILE 121 HD11 ILE 121 2.108 2.148 0.326 903 HD12 ILE 121 HD12 ILE 121 3.586 3.106 0.215 904 HD13 ILE 121 HD13 ILE 121 2.798 2.529 -1.253 905 H GLN 122 HN GLN 122 2.377 7.656 1.983 906 HA GLN 122 HA GLN 122 3.668 8.432 -0.430 907 HB2 GLN 122 HB2 GLN 122 2.768 10.022 1.971 908 HB3 GLN 122 HB1 GLN 122 3.432 10.753 0.516 909 HG2 GLN 122 HG2 GLN 122 1.620 9.888 -0.804 910 HG3 GLN 122 HG1 GLN 122 0.987 9.007 0.587 911 HE21 GLN 122 HE21 GLN 122 -0.028 10.124 2.228 912 HE22 GLN 122 HE22 GLN 122 -0.595 11.745 2.025 913 H SER 123 HN SER 123 4.615 8.398 2.953 914 HA SER 123 HA SER 123 7.114 9.646 2.690 915 HB2 SER 123 HB2 SER 123 5.976 9.208 4.857 916 HB3 SER 123 HB1 SER 123 6.295 7.485 4.652 917 HG SER 123 HG SER 123 8.503 9.121 4.405 918 H LEU 124 HN LEU 124 6.073 6.306 2.296 919 HA LEU 124 HA LEU 124 8.649 5.191 1.894 920 HB2 LEU 124 HB2 LEU 124 6.714 3.854 2.550 921 HB3 LEU 124 HB1 LEU 124 5.906 4.242 1.049 922 HG LEU 124 HG LEU 124 6.987 1.909 1.347 923 HD11 LEU 124 HD11 LEU 124 7.521 3.545 -1.123 924 HD12 LEU 124 HD12 LEU 124 6.023 2.698 -0.734 925 HD13 LEU 124 HD13 LEU 124 7.501 1.783 -1.032 926 HD21 LEU 124 HD21 LEU 124 9.313 1.770 0.592 927 HD22 LEU 124 HD22 LEU 124 9.167 2.642 2.115 928 HD23 LEU 124 HD23 LEU 124 9.423 3.531 0.614 929 H MET 125 HN MET 125 6.115 6.287 -0.345 930 HA MET 125 HA MET 125 7.273 5.622 -2.778 931 HB2 MET 125 HB2 MET 125 5.638 8.056 -2.047 932 HB3 MET 125 HB1 MET 125 5.983 7.547 -3.693 933 HG2 MET 125 HG2 MET 125 4.610 5.711 -3.556 934 HG3 MET 125 HG1 MET 125 4.678 5.659 -1.794 935 HE1 MET 125 HE1 MET 125 2.390 8.942 -4.081 936 HE2 MET 125 HE2 MET 125 3.449 7.763 -4.860 937 HE3 MET 125 HE3 MET 125 4.132 8.992 -3.791 938 H LYS 126 HN LYS 126 7.609 8.670 -0.982 939 HA LYS 126 HA LYS 126 9.392 9.776 -2.940 940 HB2 LYS 126 HB2 LYS 126 8.878 10.722 -0.109 941 HB3 LYS 126 HB1 LYS 126 9.551 11.669 -1.429 942 HG2 LYS 126 HG2 LYS 126 6.752 10.545 -1.352 943 HG3 LYS 126 HG1 LYS 126 7.197 12.211 -0.974 944 HD2 LYS 126 HD2 LYS 126 8.042 12.500 -3.254 945 HD3 LYS 126 HD1 LYS 126 7.606 10.830 -3.627 946 HE2 LYS 126 HE2 LYS 126 5.256 11.338 -3.209 947 HE3 LYS 126 HE1 LYS 126 5.680 12.998 -2.789 948 HZ1 LYS 126 HZ1 LYS 126 6.104 11.735 -5.442 949 HZ2 LYS 126 HZ2 LYS 126 6.471 13.335 -5.037 950 HZ3 LYS 126 HZ3 LYS 126 4.862 12.818 -5.057 951 H PHE 127 HN PHE 127 9.801 7.929 -0.015 952 HA PHE 127 HA PHE 127 12.466 8.580 0.539 953 HB2 PHE 127 HB2 PHE 127 11.130 7.273 2.098 954 HB3 PHE 127 HB1 PHE 127 11.001 5.960 0.933 955 HD1 PHE 127 HD1 PHE 127 12.509 4.223 0.988 956 HD2 PHE 127 HD2 PHE 127 13.533 7.915 2.836 957 HE1 PHE 127 HE1 PHE 127 14.561 3.206 1.865 958 HE2 PHE 127 HE2 PHE 127 15.593 6.903 3.725 959 HZ PHE 127 HZ PHE 127 16.110 4.544 3.237 960 H MET 128 HN MET 128 11.085 6.152 -1.644 961 HA MET 128 HA MET 128 13.753 5.551 -2.643 962 HB2 MET 128 HB2 MET 128 12.508 3.934 -4.147 963 HB3 MET 128 HB1 MET 128 12.463 3.594 -2.425 964 HG2 MET 128 HG2 MET 128 10.236 4.234 -2.233 965 HG3 MET 128 HG1 MET 128 10.253 5.104 -3.768 966 HE1 MET 128 HE1 MET 128 10.263 2.207 -6.376 967 HE2 MET 128 HE2 MET 128 11.693 3.001 -5.721 968 HE3 MET 128 HE3 MET 128 10.262 3.951 -6.120 969 H SER 129 HN SER 129 11.045 7.524 -3.448 970 HA SER 129 HA SER 129 11.609 7.752 -6.205 971 HB2 SER 129 HB2 SER 129 9.392 8.277 -5.195 972 HB3 SER 129 HB1 SER 129 10.119 9.752 -4.563 973 HG SER 129 HG SER 129 10.205 9.096 -7.311 974 H MET 130 HN MET 130 12.404 9.639 -3.406 975 HA MET 130 HA MET 130 13.809 11.646 -4.875 976 HB2 MET 130 HB2 MET 130 13.721 11.056 -1.914 977 HB3 MET 130 HB1 MET 130 14.523 12.449 -2.624 978 HG2 MET 130 HG2 MET 130 11.575 11.855 -2.780 979 HG3 MET 130 HG1 MET 130 12.333 13.000 -1.681 980 HE1 MET 130 HE1 MET 130 10.496 12.569 -4.910 981 HE2 MET 130 HE2 MET 130 12.072 12.135 -5.570 982 HE3 MET 130 HE3 MET 130 11.282 13.628 -6.080 983 H LYS 131 HN LYS 131 15.760 11.368 -5.704 984 HA LYS 131 HA LYS 131 17.407 9.154 -4.787 985 HB2 LYS 131 HB2 LYS 131 17.912 11.076 -7.067 986 HB3 LYS 131 HB1 LYS 131 18.740 9.553 -6.772 987 HG2 LYS 131 HG2 LYS 131 15.837 9.885 -7.497 988 HG3 LYS 131 HG1 LYS 131 17.124 9.330 -8.565 989 HD2 LYS 131 HD2 LYS 131 17.482 7.385 -7.120 990 HD3 LYS 131 HD1 LYS 131 16.192 7.941 -6.051 991 HE2 LYS 131 HE2 LYS 131 15.361 6.216 -7.538 992 HE3 LYS 131 HE1 LYS 131 14.598 7.760 -7.910 993 HZ1 LYS 131 HZ1 LYS 131 16.891 6.593 -9.390 994 HZ2 LYS 131 HZ2 LYS 131 16.092 8.035 -9.765 995 HZ3 LYS 131 HZ3 LYS 131 15.281 6.559 -9.908 Start of MODEL 5 1 H1 SER 11 HT1 SER 11 25.940 2.517 1.728 2 H2 SER 11 HT2 SER 11 24.396 2.320 2.389 3 H3 SER 11 HT3 SER 11 24.808 3.767 1.614 4 HA SER 11 HA SER 11 25.023 2.624 -0.482 5 HB2 SER 11 HB2 SER 11 25.695 0.442 0.173 6 HB3 SER 11 HB1 SER 11 24.316 0.250 1.244 7 HG SER 11 HG SER 11 23.931 -0.922 -0.624 8 H ALA 12 HN ALA 12 23.418 3.416 -1.614 9 HA ALA 12 HA ALA 12 21.049 4.371 -0.479 10 HB1 ALA 12 HB1 ALA 12 22.106 5.280 -2.516 11 HB2 ALA 12 HB2 ALA 12 20.388 4.943 -2.732 12 HB3 ALA 12 HB3 ALA 12 21.595 3.838 -3.395 13 H SER 13 HN SER 13 21.664 1.482 -2.431 14 HA SER 13 HA SER 13 18.981 0.649 -2.564 15 HB2 SER 13 HB2 SER 13 21.571 -0.882 -2.851 16 HB3 SER 13 HB1 SER 13 19.988 -1.461 -3.339 17 HG SER 13 HG SER 13 20.026 0.701 -4.574 18 H ASP 14 HN ASP 14 21.687 -0.231 -0.434 19 HA ASP 14 HA ASP 14 20.289 -2.245 0.979 20 HB2 ASP 14 HB2 ASP 14 22.789 -0.692 1.516 21 HB3 ASP 14 HB1 ASP 14 22.146 -1.778 2.734 22 H ILE 15 HN ILE 15 20.930 1.175 1.752 23 HA ILE 15 HA ILE 15 19.677 1.100 4.269 24 HB ILE 15 HB ILE 15 21.187 2.962 3.454 25 HG12 ILE 15 HG12 ILE 15 19.761 4.736 4.654 26 HG13 ILE 15 HG11 ILE 15 18.549 3.463 4.807 27 HG21 ILE 15 HG21 ILE 15 20.074 3.401 1.310 28 HG22 ILE 15 HG22 ILE 15 20.171 4.850 2.310 29 HG23 ILE 15 HG23 ILE 15 18.649 3.970 2.181 30 HD11 ILE 15 HD11 ILE 15 21.350 3.392 5.904 31 HD12 ILE 15 HD12 ILE 15 20.170 2.087 6.020 32 HD13 ILE 15 HD13 ILE 15 19.863 3.625 6.823 33 H ARG 16 HN ARG 16 18.429 1.657 1.027 34 HA ARG 16 HA ARG 16 15.840 2.437 1.796 35 HB2 ARG 16 HB2 ARG 16 16.456 2.833 -0.460 36 HB3 ARG 16 HB1 ARG 16 17.001 1.179 -0.688 37 HG2 ARG 16 HG2 ARG 16 14.602 0.465 -0.448 38 HG3 ARG 16 HG1 ARG 16 14.171 2.176 -0.516 39 HD2 ARG 16 HD2 ARG 16 15.769 0.730 -2.612 40 HD3 ARG 16 HD1 ARG 16 14.027 0.996 -2.705 41 HE ARG 16 HE ARG 16 15.688 3.363 -2.374 42 HH11 ARG 16 HH11 ARG 16 13.832 1.311 -4.549 43 HH12 ARG 16 HH12 ARG 16 13.827 2.488 -5.826 44 HH21 ARG 16 HH21 ARG 16 15.648 4.901 -4.072 45 HH22 ARG 16 HH22 ARG 16 14.842 4.515 -5.561 46 H MET 17 HN MET 17 17.206 -0.748 0.996 47 HA MET 17 HA MET 17 14.855 -2.210 1.217 48 HB2 MET 17 HB2 MET 17 17.695 -3.030 1.834 49 HB3 MET 17 HB1 MET 17 16.347 -4.155 1.753 50 HG2 MET 17 HG2 MET 17 15.977 -3.561 -0.577 51 HG3 MET 17 HG1 MET 17 17.308 -2.407 -0.500 52 HE1 MET 17 HE1 MET 17 17.798 -6.983 -0.160 53 HE2 MET 17 HE2 MET 17 16.257 -6.170 -0.431 54 HE3 MET 17 HE3 MET 17 17.081 -6.006 1.119 55 H LYS 18 HN LYS 18 17.119 -1.210 3.764 56 HA LYS 18 HA LYS 18 15.657 -2.628 5.787 57 HB2 LYS 18 HB2 LYS 18 17.106 -1.617 7.396 58 HB3 LYS 18 HB1 LYS 18 18.088 -2.070 6.014 59 HG2 LYS 18 HG2 LYS 18 18.615 0.073 5.515 60 HG3 LYS 18 HG1 LYS 18 17.047 0.697 6.032 61 HD2 LYS 18 HD2 LYS 18 18.748 1.489 7.541 62 HD3 LYS 18 HD1 LYS 18 17.724 0.324 8.382 63 HE2 LYS 18 HE2 LYS 18 19.434 -1.423 7.865 64 HE3 LYS 18 HE1 LYS 18 20.476 -0.139 7.252 65 HZ1 LYS 18 HZ1 LYS 18 19.436 -0.380 10.023 66 HZ2 LYS 18 HZ2 LYS 18 20.376 0.905 9.449 67 HZ3 LYS 18 HZ3 LYS 18 21.028 -0.653 9.522 68 H LYS 19 HN LYS 19 15.590 0.615 4.452 69 HA LYS 19 HA LYS 19 13.956 1.667 6.554 70 HB2 LYS 19 HB2 LYS 19 15.450 2.731 4.471 71 HB3 LYS 19 HB1 LYS 19 13.785 3.136 4.063 72 HG2 LYS 19 HG2 LYS 19 15.182 3.775 6.657 73 HG3 LYS 19 HG1 LYS 19 14.822 4.912 5.356 74 HD2 LYS 19 HD2 LYS 19 12.454 4.620 5.697 75 HD3 LYS 19 HD1 LYS 19 12.739 3.354 6.890 76 HE2 LYS 19 HE2 LYS 19 12.175 5.498 7.943 77 HE3 LYS 19 HE1 LYS 19 13.797 4.962 8.373 78 HZ1 LYS 19 HZ1 LYS 19 14.702 6.489 6.746 79 HZ2 LYS 19 HZ2 LYS 19 13.738 7.320 7.854 80 HZ3 LYS 19 HZ3 LYS 19 13.149 6.994 6.306 81 H VAL 20 HN VAL 20 13.356 0.390 3.323 82 HA VAL 20 HA VAL 20 10.609 1.022 3.248 83 HB VAL 20 HB VAL 20 10.388 -0.608 1.453 84 HG11 VAL 20 HG11 VAL 20 11.303 1.603 0.940 85 HG12 VAL 20 HG12 VAL 20 11.969 0.362 -0.122 86 HG13 VAL 20 HG13 VAL 20 12.934 0.987 1.215 87 HG21 VAL 20 HG21 VAL 20 11.771 -2.391 2.323 88 HG22 VAL 20 HG22 VAL 20 13.214 -1.394 2.137 89 HG23 VAL 20 HG23 VAL 20 12.324 -1.930 0.712 90 H MET 21 HN MET 21 12.377 -1.676 4.666 91 HA MET 21 HA MET 21 10.066 -3.268 5.097 92 HB2 MET 21 HB2 MET 21 11.411 -4.691 6.409 93 HB3 MET 21 HB1 MET 21 12.408 -4.154 5.066 94 HG2 MET 21 HG2 MET 21 13.562 -2.636 6.437 95 HG3 MET 21 HG1 MET 21 12.442 -2.903 7.760 96 HE1 MET 21 HE1 MET 21 14.413 -3.352 9.471 97 HE2 MET 21 HE2 MET 21 15.578 -3.029 8.188 98 HE3 MET 21 HE3 MET 21 15.731 -4.485 9.171 99 H GLN 22 HN GLN 22 11.645 -0.723 6.832 100 HA GLN 22 HA GLN 22 10.147 -0.867 9.235 101 HB2 GLN 22 HB2 GLN 22 11.067 1.725 8.002 102 HB3 GLN 22 HB1 GLN 22 10.923 1.317 9.706 103 HG2 GLN 22 HG2 GLN 22 12.801 -0.221 9.490 104 HG3 GLN 22 HG1 GLN 22 12.952 0.203 7.788 105 HE21 GLN 22 HE21 GLN 22 14.934 1.126 7.797 106 HE22 GLN 22 HE22 GLN 22 15.349 2.529 8.729 107 H TYR 23 HN TYR 23 9.735 1.041 6.267 108 HA TYR 23 HA TYR 23 7.209 2.106 6.861 109 HB2 TYR 23 HB2 TYR 23 8.593 1.518 4.249 110 HB3 TYR 23 HB1 TYR 23 6.981 2.221 4.308 111 HD1 TYR 23 HD1 TYR 23 10.363 2.955 4.034 112 HD2 TYR 23 HD2 TYR 23 6.832 4.350 5.947 113 HE1 TYR 23 HE1 TYR 23 11.377 5.182 4.273 114 HE2 TYR 23 HE2 TYR 23 7.835 6.580 6.189 115 HH TYR 23 HH TYR 23 10.563 7.557 4.515 116 H ARG 24 HN ARG 24 8.230 -0.976 5.647 117 HA ARG 24 HA ARG 24 5.856 -1.874 4.495 118 HB2 ARG 24 HB2 ARG 24 8.158 -2.911 4.310 119 HB3 ARG 24 HB1 ARG 24 7.877 -3.621 5.893 120 HG2 ARG 24 HG2 ARG 24 6.072 -4.932 5.074 121 HG3 ARG 24 HG1 ARG 24 6.073 -4.072 3.532 122 HD2 ARG 24 HD2 ARG 24 8.398 -4.920 3.161 123 HD3 ARG 24 HD1 ARG 24 8.200 -5.921 4.597 124 HE ARG 24 HE ARG 24 6.334 -6.158 2.333 125 HH11 ARG 24 HH11 ARG 24 8.719 -7.592 4.471 126 HH12 ARG 24 HH12 ARG 24 8.426 -9.207 3.919 127 HH21 ARG 24 HH21 ARG 24 5.955 -8.279 1.604 128 HH22 ARG 24 HH22 ARG 24 6.845 -9.600 2.291 129 H ARG 25 HN ARG 25 6.997 -2.033 7.839 130 HA ARG 25 HA ARG 25 4.862 -3.615 8.815 131 HB2 ARG 25 HB2 ARG 25 6.671 -1.609 10.161 132 HB3 ARG 25 HB1 ARG 25 5.429 -2.500 11.034 133 HG2 ARG 25 HG2 ARG 25 6.849 -4.168 11.311 134 HG3 ARG 25 HG1 ARG 25 6.923 -4.389 9.563 135 HD2 ARG 25 HD2 ARG 25 9.146 -4.080 10.547 136 HD3 ARG 25 HD1 ARG 25 8.743 -2.793 9.413 137 HE ARG 25 HE ARG 25 7.996 -1.845 11.881 138 HH11 ARG 25 HH11 ARG 25 10.973 -3.044 10.481 139 HH12 ARG 25 HH12 ARG 25 11.988 -2.008 11.435 140 HH21 ARG 25 HH21 ARG 25 9.329 -0.479 13.134 141 HH22 ARG 25 HH22 ARG 25 11.052 -0.556 12.951 142 H ALA 26 HN ALA 26 5.211 -0.206 8.166 143 HA ALA 26 HA ALA 26 2.720 0.503 9.452 144 HB1 ALA 26 HB1 ALA 26 4.545 2.137 7.700 145 HB2 ALA 26 HB2 ALA 26 4.611 2.052 9.463 146 HB3 ALA 26 HB3 ALA 26 3.203 2.748 8.663 147 H LEU 27 HN LEU 27 3.731 -0.618 6.413 148 HA LEU 27 HA LEU 27 1.287 0.307 5.102 149 HB2 LEU 27 HB2 LEU 27 3.942 -0.617 4.189 150 HB3 LEU 27 HB1 LEU 27 2.586 -1.080 3.183 151 HG LEU 27 HG LEU 27 2.125 1.110 2.551 152 HD11 LEU 27 HD11 LEU 27 3.707 2.061 4.936 153 HD12 LEU 27 HD12 LEU 27 1.954 2.120 4.744 154 HD13 LEU 27 HD13 LEU 27 2.985 3.102 3.708 155 HD21 LEU 27 HD21 LEU 27 5.100 1.016 3.019 156 HD22 LEU 27 HD22 LEU 27 4.271 2.135 1.938 157 HD23 LEU 27 HD23 LEU 27 4.235 0.405 1.607 158 H THR 28 HN THR 28 2.551 -2.408 6.700 159 HA THR 28 HA THR 28 0.820 -4.317 5.394 160 HB THR 28 HB THR 28 2.443 -4.567 7.945 161 HG1 THR 28 HG1 THR 28 3.735 -4.318 6.077 162 HG21 THR 28 HG21 THR 28 2.126 -6.974 7.689 163 HG22 THR 28 HG22 THR 28 1.100 -6.703 6.282 164 HG23 THR 28 HG23 THR 28 0.576 -6.157 7.874 165 H LYS 29 HN LYS 29 -1.278 -4.061 5.678 166 HA LYS 29 HA LYS 29 -2.388 -3.772 8.359 167 HB2 LYS 29 HB2 LYS 29 -2.466 -1.659 6.279 168 HB3 LYS 29 HB1 LYS 29 -3.984 -1.994 7.086 169 HG2 LYS 29 HG2 LYS 29 -3.090 -0.251 8.312 170 HG3 LYS 29 HG1 LYS 29 -2.664 -1.669 9.264 171 HD2 LYS 29 HD2 LYS 29 -0.422 -1.622 8.454 172 HD3 LYS 29 HD1 LYS 29 -0.812 -0.371 7.278 173 HE2 LYS 29 HE2 LYS 29 -0.821 -0.102 10.268 174 HE3 LYS 29 HE1 LYS 29 0.334 0.611 9.160 175 HZ1 LYS 29 HZ1 LYS 29 -1.596 1.842 8.187 176 HZ2 LYS 29 HZ2 LYS 29 -1.183 2.294 9.764 177 HZ3 LYS 29 HZ3 LYS 29 -2.533 1.299 9.497 178 H VAL 30 HN VAL 30 -4.727 -4.076 8.349 179 HA VAL 30 HA VAL 30 -5.661 -5.590 6.018 180 HB VAL 30 HB VAL 30 -7.545 -6.313 7.527 181 HG11 VAL 30 HG11 VAL 30 -5.651 -7.772 7.103 182 HG12 VAL 30 HG12 VAL 30 -6.175 -7.937 8.779 183 HG13 VAL 30 HG13 VAL 30 -4.733 -6.995 8.395 184 HG21 VAL 30 HG21 VAL 30 -7.412 -4.483 9.149 185 HG22 VAL 30 HG22 VAL 30 -5.828 -5.059 9.672 186 HG23 VAL 30 HG23 VAL 30 -7.260 -6.051 9.943 187 H VAL 31 HN VAL 31 -7.195 -4.741 4.726 188 HA VAL 31 HA VAL 31 -8.753 -2.453 5.589 189 HB VAL 31 HB VAL 31 -6.244 -2.121 4.245 190 HG11 VAL 31 HG11 VAL 31 -8.592 -1.094 2.657 191 HG12 VAL 31 HG12 VAL 31 -7.437 -2.322 2.138 192 HG13 VAL 31 HG13 VAL 31 -6.902 -0.662 2.403 193 HG21 VAL 31 HG21 VAL 31 -8.370 -0.154 5.066 194 HG22 VAL 31 HG22 VAL 31 -6.704 0.252 4.650 195 HG23 VAL 31 HG23 VAL 31 -7.041 -0.748 6.065 196 H LYS 32 HN LYS 32 -10.302 -1.780 3.866 197 HA LYS 32 HA LYS 32 -10.931 -4.094 2.167 198 HB2 LYS 32 HB2 LYS 32 -12.479 -3.544 4.114 199 HB3 LYS 32 HB1 LYS 32 -12.910 -2.085 3.235 200 HG2 LYS 32 HG2 LYS 32 -13.139 -4.701 1.843 201 HG3 LYS 32 HG1 LYS 32 -14.350 -4.268 3.056 202 HD2 LYS 32 HD2 LYS 32 -14.687 -2.117 1.822 203 HD3 LYS 32 HD1 LYS 32 -13.629 -2.748 0.558 204 HE2 LYS 32 HE2 LYS 32 -15.968 -3.096 -0.014 205 HE3 LYS 32 HE1 LYS 32 -15.143 -4.635 0.229 206 HZ1 LYS 32 HZ1 LYS 32 -16.093 -4.721 2.468 207 HZ2 LYS 32 HZ2 LYS 32 -17.293 -4.660 1.283 208 HZ3 LYS 32 HZ3 LYS 32 -16.923 -3.275 2.179 209 H LEU 33 HN LEU 33 -10.936 -3.786 0.060 210 HA LEU 33 HA LEU 33 -10.512 -1.078 -0.938 211 HB2 LEU 33 HB2 LEU 33 -10.129 -3.809 -2.097 212 HB3 LEU 33 HB1 LEU 33 -10.235 -2.413 -3.156 213 HG LEU 33 HG LEU 33 -8.216 -2.713 -0.932 214 HD11 LEU 33 HD11 LEU 33 -7.897 -3.073 -3.912 215 HD12 LEU 33 HD12 LEU 33 -7.829 -4.353 -2.701 216 HD13 LEU 33 HD13 LEU 33 -6.595 -3.094 -2.723 217 HD21 LEU 33 HD21 LEU 33 -7.150 -0.795 -2.020 218 HD22 LEU 33 HD22 LEU 33 -8.776 -0.399 -1.461 219 HD23 LEU 33 HD23 LEU 33 -8.483 -0.710 -3.172 220 H LYS 34 HN LYS 34 -11.777 -0.043 -2.386 221 HA LYS 34 HA LYS 34 -14.202 -1.366 -3.376 222 HB2 LYS 34 HB2 LYS 34 -14.418 1.363 -2.133 223 HB3 LYS 34 HB1 LYS 34 -15.711 0.274 -2.605 224 HG2 LYS 34 HG2 LYS 34 -15.070 -1.231 -0.764 225 HG3 LYS 34 HG1 LYS 34 -13.852 -0.054 -0.267 226 HD2 LYS 34 HD2 LYS 34 -16.841 0.362 -0.370 227 HD3 LYS 34 HD1 LYS 34 -15.844 0.226 1.079 228 HE2 LYS 34 HE2 LYS 34 -14.675 2.286 0.478 229 HE3 LYS 34 HE1 LYS 34 -15.642 2.417 -0.990 230 HZ1 LYS 34 HZ1 LYS 34 -16.500 3.842 0.750 231 HZ2 LYS 34 HZ2 LYS 34 -16.687 2.522 1.788 232 HZ3 LYS 34 HZ3 LYS 34 -17.622 2.630 0.385 233 H THR 35 HN THR 35 -13.821 -1.120 -5.516 234 HA THR 35 HA THR 35 -14.026 1.454 -6.657 235 HB THR 35 HB THR 35 -11.753 1.790 -6.027 236 HG1 THR 35 HG1 THR 35 -10.929 2.318 -7.971 237 HG21 THR 35 HG21 THR 35 -11.049 -0.465 -5.593 238 HG22 THR 35 HG22 THR 35 -9.933 0.269 -6.745 239 HG23 THR 35 HG23 THR 35 -11.154 -0.869 -7.303 240 H HIS 36 HN HIS 36 -12.914 1.005 -9.177 241 HA HIS 36 HA HIS 36 -14.822 -0.757 -10.345 242 HB2 HIS 36 HB2 HIS 36 -12.348 0.510 -11.539 243 HB3 HIS 36 HB1 HIS 36 -13.593 -0.319 -12.464 244 HD1 HIS 36 HD1 HIS 36 -12.587 2.958 -11.758 245 HD2 HIS 36 HD2 HIS 36 -16.275 1.040 -11.730 246 HE1 HIS 36 HE1 HIS 36 -14.298 4.783 -11.956 247 HE2 HIS 36 HE2 HIS 36 -16.504 3.583 -12.125 248 H LEU 37 HN LEU 37 -11.774 -1.207 -8.982 249 HA LEU 37 HA LEU 37 -10.934 -3.610 -10.199 250 HB2 LEU 37 HB2 LEU 37 -9.577 -2.157 -8.677 251 HB3 LEU 37 HB1 LEU 37 -10.574 -2.686 -7.341 252 HG LEU 37 HG LEU 37 -9.774 -5.040 -7.849 253 HD11 LEU 37 HD11 LEU 37 -8.933 -4.645 -10.095 254 HD12 LEU 37 HD12 LEU 37 -7.644 -5.217 -9.036 255 HD13 LEU 37 HD13 LEU 37 -7.741 -3.509 -9.464 256 HD21 LEU 37 HD21 LEU 37 -7.598 -4.622 -6.684 257 HD22 LEU 37 HD22 LEU 37 -8.996 -3.869 -5.917 258 HD23 LEU 37 HD23 LEU 37 -7.893 -2.893 -6.884 259 H PHE 38 HN PHE 38 -12.435 -3.146 -7.015 260 HA PHE 38 HA PHE 38 -14.646 -4.785 -7.328 261 HB2 PHE 38 HB2 PHE 38 -13.983 -6.772 -5.982 262 HB3 PHE 38 HB1 PHE 38 -13.144 -6.691 -7.524 263 HD1 PHE 38 HD1 PHE 38 -10.835 -6.939 -7.575 264 HD2 PHE 38 HD2 PHE 38 -12.726 -5.803 -3.943 265 HE1 PHE 38 HE1 PHE 38 -8.683 -7.130 -6.401 266 HE2 PHE 38 HE2 PHE 38 -10.582 -5.994 -2.762 267 HZ PHE 38 HZ PHE 38 -8.545 -6.728 -4.021 268 H SER 39 HN SER 39 -15.311 -5.610 -4.940 269 HA SER 39 HA SER 39 -14.316 -3.682 -2.955 270 HB2 SER 39 HB2 SER 39 -16.684 -3.710 -2.006 271 HB3 SER 39 HB1 SER 39 -16.468 -2.831 -3.519 272 HG SER 39 HG SER 39 -17.096 -5.509 -3.799 273 H GLU 40 HN GLU 40 -13.081 -5.014 -1.752 274 HA GLU 40 HA GLU 40 -14.334 -7.199 -0.308 275 HB2 GLU 40 HB2 GLU 40 -12.003 -7.638 -2.181 276 HB3 GLU 40 HB1 GLU 40 -12.409 -8.744 -0.883 277 HG2 GLU 40 HG2 GLU 40 -14.541 -9.219 -1.895 278 HG3 GLU 40 HG1 GLU 40 -14.240 -8.020 -3.154 279 H THR 41 HN THR 41 -12.995 -7.950 1.453 280 HA THR 41 HA THR 41 -11.256 -5.890 2.493 281 HB THR 41 HB THR 41 -11.896 -8.575 3.707 282 HG1 THR 41 HG1 THR 41 -13.533 -7.482 4.830 283 HG21 THR 41 HG21 THR 41 -11.265 -7.498 5.816 284 HG22 THR 41 HG22 THR 41 -10.889 -6.011 4.947 285 HG23 THR 41 HG23 THR 41 -9.932 -7.465 4.662 286 H VAL 42 HN VAL 42 -9.124 -5.877 2.322 287 HA VAL 42 HA VAL 42 -7.749 -8.331 1.452 288 HB VAL 42 HB VAL 42 -6.506 -7.141 -0.207 289 HG11 VAL 42 HG11 VAL 42 -8.253 -6.310 -1.725 290 HG12 VAL 42 HG12 VAL 42 -9.399 -6.300 -0.381 291 HG13 VAL 42 HG13 VAL 42 -8.712 -7.825 -0.946 292 HG21 VAL 42 HG21 VAL 42 -6.746 -4.738 -0.617 293 HG22 VAL 42 HG22 VAL 42 -6.145 -5.057 1.010 294 HG23 VAL 42 HG23 VAL 42 -7.833 -4.611 0.765 295 H LYS 43 HN LYS 43 -5.523 -8.437 2.107 296 HA LYS 43 HA LYS 43 -4.857 -6.530 4.227 297 HB2 LYS 43 HB2 LYS 43 -4.712 -9.049 4.599 298 HB3 LYS 43 HB1 LYS 43 -3.318 -9.024 3.525 299 HG2 LYS 43 HG2 LYS 43 -2.221 -7.413 5.024 300 HG3 LYS 43 HG1 LYS 43 -3.605 -7.511 6.110 301 HD2 LYS 43 HD2 LYS 43 -1.610 -9.646 5.434 302 HD3 LYS 43 HD1 LYS 43 -1.970 -8.936 7.009 303 HE2 LYS 43 HE2 LYS 43 -4.283 -9.916 6.785 304 HE3 LYS 43 HE1 LYS 43 -3.680 -10.801 5.380 305 HZ1 LYS 43 HZ1 LYS 43 -3.567 -12.160 7.361 306 HZ2 LYS 43 HZ2 LYS 43 -2.629 -11.002 8.152 307 HZ3 LYS 43 HZ3 LYS 43 -2.004 -11.822 6.814 308 H VAL 44 HN VAL 44 -3.514 -4.917 3.789 309 HA VAL 44 HA VAL 44 -2.123 -4.992 1.205 310 HB VAL 44 HB VAL 44 -1.888 -2.396 2.051 311 HG11 VAL 44 HG11 VAL 44 -2.523 -3.175 -0.175 312 HG12 VAL 44 HG12 VAL 44 -3.603 -1.901 0.394 313 HG13 VAL 44 HG13 VAL 44 -4.135 -3.582 0.425 314 HG21 VAL 44 HG21 VAL 44 -4.130 -1.697 2.777 315 HG22 VAL 44 HG22 VAL 44 -3.345 -2.740 3.965 316 HG23 VAL 44 HG23 VAL 44 -4.602 -3.390 2.909 317 H THR 45 HN THR 45 -0.056 -4.056 1.029 318 HA THR 45 HA THR 45 1.635 -3.463 3.206 319 HB THR 45 HB THR 45 1.316 -5.896 3.668 320 HG1 THR 45 HG1 THR 45 3.262 -5.540 4.418 321 HG21 THR 45 HG21 THR 45 2.651 -6.285 0.986 322 HG22 THR 45 HG22 THR 45 0.969 -6.660 1.363 323 HG23 THR 45 HG23 THR 45 2.270 -7.558 2.147 324 H CYS 46 HN CYS 46 4.084 -4.089 2.193 325 HA CYS 46 HA CYS 46 3.952 -3.294 -0.628 326 HB2 CYS 46 HB2 CYS 46 5.832 -1.771 -0.331 327 HB3 CYS 46 HB1 CYS 46 4.493 -1.306 0.708 328 HG CYS 46 HG CYS 46 7.500 -2.623 1.587 329 H SER 47 HN SER 47 6.132 -3.606 -1.710 330 HA SER 47 HA SER 47 6.920 -6.291 -1.466 331 HB2 SER 47 HB2 SER 47 7.115 -4.942 -3.546 332 HB3 SER 47 HB1 SER 47 8.413 -4.016 -2.802 333 HG SER 47 HG SER 47 8.385 -6.755 -3.520 334 H LYS 48 HN LYS 48 9.224 -6.984 -1.118 335 HA LYS 48 HA LYS 48 10.055 -6.256 1.500 336 HB2 LYS 48 HB2 LYS 48 11.549 -7.845 -0.597 337 HB3 LYS 48 HB1 LYS 48 11.887 -7.828 1.130 338 HG2 LYS 48 HG2 LYS 48 9.864 -8.938 1.633 339 HG3 LYS 48 HG1 LYS 48 9.252 -8.708 -0.005 340 HD2 LYS 48 HD2 LYS 48 11.146 -10.132 -0.818 341 HD3 LYS 48 HD1 LYS 48 11.523 -10.482 0.871 342 HE2 LYS 48 HE2 LYS 48 10.156 -12.250 -0.111 343 HE3 LYS 48 HE1 LYS 48 9.292 -11.418 1.181 344 HZ1 LYS 48 HZ1 LYS 48 7.866 -11.786 -0.727 345 HZ2 LYS 48 HZ2 LYS 48 8.930 -10.944 -1.730 346 HZ3 LYS 48 HZ3 LYS 48 8.107 -10.131 -0.497 347 H ASP 49 HN ASP 49 11.013 -5.310 -1.718 348 HA ASP 49 HA ASP 49 13.191 -3.661 -0.678 349 HB2 ASP 49 HB2 ASP 49 12.234 -4.178 -3.500 350 HB3 ASP 49 HB1 ASP 49 13.533 -3.059 -3.095 351 H GLY 50 HN GLY 50 9.956 -3.423 -0.866 352 HA2 GLY 50 HA2 GLY 50 8.533 -1.629 -0.578 353 HA3 GLY 50 HA1 GLY 50 9.940 -0.575 -0.602 354 H GLU 51 HN GLU 51 9.993 -2.508 -3.303 355 HA GLU 51 HA GLU 51 9.571 -0.279 -5.023 356 HB2 GLU 51 HB2 GLU 51 9.874 -3.196 -5.743 357 HB3 GLU 51 HB1 GLU 51 10.087 -1.831 -6.827 358 HG2 GLU 51 HG2 GLU 51 11.783 -2.297 -4.392 359 HG3 GLU 51 HG1 GLU 51 12.188 -2.904 -5.994 360 H GLU 52 HN GLU 52 7.257 -1.987 -3.494 361 HA GLU 52 HA GLU 52 5.304 -1.676 -5.616 362 HB2 GLU 52 HB2 GLU 52 6.488 -3.988 -5.792 363 HB3 GLU 52 HB1 GLU 52 5.535 -4.391 -4.381 364 HG2 GLU 52 HG2 GLU 52 3.497 -3.800 -5.635 365 HG3 GLU 52 HG1 GLU 52 4.494 -3.571 -7.071 366 H VAL 53 HN VAL 53 3.201 -1.622 -4.887 367 HA VAL 53 HA VAL 53 2.738 -2.068 -2.005 368 HB VAL 53 HB VAL 53 0.955 -0.631 -3.990 369 HG11 VAL 53 HG11 VAL 53 -0.258 -1.718 -2.158 370 HG12 VAL 53 HG12 VAL 53 -0.345 0.039 -2.047 371 HG13 VAL 53 HG13 VAL 53 0.745 -0.858 -0.989 372 HG21 VAL 53 HG21 VAL 53 1.575 1.421 -2.780 373 HG22 VAL 53 HG22 VAL 53 2.946 0.674 -3.595 374 HG23 VAL 53 HG23 VAL 53 2.755 0.496 -1.852 375 H GLN 54 HN GLN 54 1.809 -3.978 -1.551 376 HA GLN 54 HA GLN 54 0.313 -5.314 -3.706 377 HB2 GLN 54 HB2 GLN 54 1.401 -7.442 -3.002 378 HB3 GLN 54 HB1 GLN 54 2.516 -6.271 -3.687 379 HG2 GLN 54 HG2 GLN 54 3.024 -5.596 -1.288 380 HG3 GLN 54 HG1 GLN 54 2.178 -7.066 -0.818 381 HE21 GLN 54 HE21 GLN 54 4.132 -6.780 -3.716 382 HE22 GLN 54 HE22 GLN 54 5.397 -7.836 -3.185 383 H TRP 55 HN TRP 55 -1.067 -7.126 -2.883 384 HA TRP 55 HA TRP 55 -1.893 -6.823 -0.119 385 HB2 TRP 55 HB2 TRP 55 -4.331 -6.549 -0.951 386 HB3 TRP 55 HB1 TRP 55 -3.286 -5.135 -0.893 387 HD1 TRP 55 HD1 TRP 55 -4.725 -7.646 -3.474 388 HE1 TRP 55 HE1 TRP 55 -4.838 -6.451 -5.761 389 HE3 TRP 55 HE3 TRP 55 -2.432 -3.267 -2.218 390 HZ2 TRP 55 HZ2 TRP 55 -4.063 -3.976 -6.869 391 HZ3 TRP 55 HZ3 TRP 55 -2.161 -1.538 -3.932 392 HH2 TRP 55 HH2 TRP 55 -2.955 -1.875 -6.219 393 H PHE 56 HN PHE 56 -3.379 -8.359 0.619 394 HA PHE 56 HA PHE 56 -3.535 -10.818 -0.999 395 HB2 PHE 56 HB2 PHE 56 -3.542 -10.576 2.018 396 HB3 PHE 56 HB1 PHE 56 -3.494 -12.068 1.086 397 HD1 PHE 56 HD1 PHE 56 -1.463 -12.592 -0.271 398 HD2 PHE 56 HD2 PHE 56 -1.575 -9.377 2.512 399 HE1 PHE 56 HE1 PHE 56 0.995 -12.507 -0.271 400 HE2 PHE 56 HE2 PHE 56 0.881 -9.288 2.516 401 HZ PHE 56 HZ PHE 56 2.170 -10.853 1.122 402 H LYS 57 HN LYS 57 -5.557 -11.172 -1.717 403 HA LYS 57 HA LYS 57 -7.708 -9.568 -0.608 404 HB2 LYS 57 HB2 LYS 57 -7.718 -11.402 -3.003 405 HB3 LYS 57 HB1 LYS 57 -8.964 -10.240 -2.577 406 HG2 LYS 57 HG2 LYS 57 -7.562 -8.409 -3.074 407 HG3 LYS 57 HG1 LYS 57 -6.134 -9.444 -3.181 408 HD2 LYS 57 HD2 LYS 57 -7.198 -10.603 -5.111 409 HD3 LYS 57 HD1 LYS 57 -8.505 -9.420 -5.045 410 HE2 LYS 57 HE2 LYS 57 -6.928 -7.625 -5.476 411 HE3 LYS 57 HE1 LYS 57 -5.592 -8.777 -5.472 412 HZ1 LYS 57 HZ1 LYS 57 -6.535 -9.848 -7.402 413 HZ2 LYS 57 HZ2 LYS 57 -6.304 -8.207 -7.719 414 HZ3 LYS 57 HZ3 LYS 57 -7.853 -8.794 -7.398 415 H GLY 58 HN GLY 58 -9.662 -10.338 0.137 416 HA2 GLY 58 HA2 GLY 58 -11.293 -11.979 0.548 417 HA3 GLY 58 HA1 GLY 58 -10.091 -13.224 0.246 418 H LYS 59 HN LYS 59 -8.562 -13.706 1.876 419 HA LYS 59 HA LYS 59 -9.063 -12.564 4.514 420 HB2 LYS 59 HB2 LYS 59 -10.491 -14.622 4.243 421 HB3 LYS 59 HB1 LYS 59 -9.011 -15.552 4.063 422 HG2 LYS 59 HG2 LYS 59 -9.838 -15.732 6.322 423 HG3 LYS 59 HG1 LYS 59 -8.312 -14.849 6.310 424 HD2 LYS 59 HD2 LYS 59 -9.507 -12.738 6.483 425 HD3 LYS 59 HD1 LYS 59 -11.051 -13.587 6.415 426 HE2 LYS 59 HE2 LYS 59 -10.507 -14.739 8.501 427 HE3 LYS 59 HE1 LYS 59 -8.959 -13.898 8.565 428 HZ1 LYS 59 HZ1 LYS 59 -10.580 -12.834 9.984 429 HZ2 LYS 59 HZ2 LYS 59 -11.641 -12.626 8.686 430 HZ3 LYS 59 HZ3 LYS 59 -10.167 -11.799 8.714 431 H SER 60 HN SER 60 -7.190 -15.063 2.787 432 HA SER 60 HA SER 60 -4.726 -13.756 3.376 433 HB2 SER 60 HB2 SER 60 -5.190 -14.845 5.570 434 HB3 SER 60 HB1 SER 60 -5.219 -16.407 4.755 435 HG SER 60 HG SER 60 -3.112 -16.401 4.638 436 H THR 61 HN THR 61 -4.111 -13.920 1.300 437 HA THR 61 HA THR 61 -3.808 -16.621 0.178 438 HB THR 61 HB THR 61 -3.458 -15.427 -2.004 439 HG1 THR 61 HG1 THR 61 -2.926 -13.379 -1.473 440 HG21 THR 61 HG21 THR 61 -6.086 -14.878 -0.619 441 HG22 THR 61 HG22 THR 61 -5.642 -16.372 -1.446 442 HG23 THR 61 HG23 THR 61 -5.821 -14.877 -2.363 443 H ALA 62 HN ALA 62 -2.118 -15.543 2.206 444 HA ALA 62 HA ALA 62 0.161 -14.226 1.203 445 HB1 ALA 62 HB1 ALA 62 -0.155 -15.821 3.735 446 HB2 ALA 62 HB2 ALA 62 -0.546 -14.112 3.534 447 HB3 ALA 62 HB3 ALA 62 1.121 -14.658 3.383 448 H GLY 63 HN GLY 63 1.386 -15.113 -0.301 449 HA2 GLY 63 HA2 GLY 63 1.823 -17.732 -0.918 450 HA3 GLY 63 HA1 GLY 63 2.985 -16.469 -1.226 451 H ALA 64 HN ALA 64 2.905 -19.369 -0.243 452 HA ALA 64 HA ALA 64 3.979 -20.750 1.216 453 HB1 ALA 64 HB1 ALA 64 6.344 -20.296 1.463 454 HB2 ALA 64 HB2 ALA 64 6.090 -18.616 0.993 455 HB3 ALA 64 HB3 ALA 64 5.809 -19.910 -0.173 456 H GLN 65 HN GLN 65 2.269 -18.775 2.530 457 HA GLN 65 HA GLN 65 1.611 -18.386 4.671 458 HB2 GLN 65 HB2 GLN 65 4.143 -19.790 5.530 459 HB3 GLN 65 HB1 GLN 65 2.764 -19.417 6.553 460 HG2 GLN 65 HG2 GLN 65 2.767 -21.294 4.201 461 HG3 GLN 65 HG1 GLN 65 2.783 -21.756 5.902 462 HE21 GLN 65 HE21 GLN 65 0.887 -20.556 3.275 463 HE22 GLN 65 HE22 GLN 65 -0.652 -20.670 4.059 464 H ASP 66 HN ASP 66 5.032 -17.753 4.071 465 HA ASP 66 HA ASP 66 5.167 -15.646 6.024 466 HB2 ASP 66 HB2 ASP 66 7.086 -16.407 3.814 467 HB3 ASP 66 HB1 ASP 66 7.418 -15.221 5.072 468 H ARG 67 HN ARG 67 3.398 -15.708 3.473 469 HA ARG 67 HA ARG 67 2.394 -14.198 2.133 470 HB2 ARG 67 HB2 ARG 67 3.732 -11.898 3.496 471 HB3 ARG 67 HB1 ARG 67 2.071 -12.073 2.940 472 HG2 ARG 67 HG2 ARG 67 1.536 -13.493 4.811 473 HG3 ARG 67 HG1 ARG 67 3.215 -13.472 5.346 474 HD2 ARG 67 HD2 ARG 67 1.414 -11.063 5.151 475 HD3 ARG 67 HD1 ARG 67 1.788 -11.936 6.635 476 HE ARG 67 HE ARG 67 4.140 -11.032 5.276 477 HH11 ARG 67 HH11 ARG 67 1.570 -10.058 7.430 478 HH12 ARG 67 HH12 ARG 67 2.492 -8.795 8.177 479 HH21 ARG 67 HH21 ARG 67 5.367 -9.360 6.243 480 HH22 ARG 67 HH22 ARG 67 4.658 -8.390 7.497 481 H LYS 68 HN LYS 68 4.290 -15.315 0.868 482 HA LYS 68 HA LYS 68 6.292 -13.403 -0.070 483 HB2 LYS 68 HB2 LYS 68 6.735 -15.862 0.531 484 HB3 LYS 68 HB1 LYS 68 5.895 -16.263 -0.956 485 HG2 LYS 68 HG2 LYS 68 8.098 -16.292 -1.607 486 HG3 LYS 68 HG1 LYS 68 7.592 -14.667 -2.065 487 HD2 LYS 68 HD2 LYS 68 9.725 -14.502 -0.993 488 HD3 LYS 68 HD1 LYS 68 8.509 -13.848 0.105 489 HE2 LYS 68 HE2 LYS 68 10.079 -15.238 1.327 490 HE3 LYS 68 HE1 LYS 68 8.483 -15.980 1.327 491 HZ1 LYS 68 HZ1 LYS 68 10.775 -16.745 -0.398 492 HZ2 LYS 68 HZ2 LYS 68 9.234 -17.431 -0.487 493 HZ3 LYS 68 HZ3 LYS 68 10.165 -17.628 0.910 494 H LYS 69 HN LYS 69 3.279 -14.731 -0.936 495 HA LYS 69 HA LYS 69 3.534 -13.757 -3.694 496 HB2 LYS 69 HB2 LYS 69 3.412 -16.315 -3.361 497 HB3 LYS 69 HB1 LYS 69 1.757 -16.040 -2.849 498 HG2 LYS 69 HG2 LYS 69 1.475 -16.580 -5.058 499 HG3 LYS 69 HG1 LYS 69 1.495 -14.820 -5.117 500 HD2 LYS 69 HD2 LYS 69 3.922 -16.537 -5.622 501 HD3 LYS 69 HD1 LYS 69 2.842 -15.982 -6.898 502 HE2 LYS 69 HE2 LYS 69 3.316 -13.634 -6.128 503 HE3 LYS 69 HE1 LYS 69 4.557 -14.310 -5.075 504 HZ1 LYS 69 HZ1 LYS 69 5.455 -13.511 -7.185 505 HZ2 LYS 69 HZ2 LYS 69 4.492 -14.620 -8.023 506 HZ3 LYS 69 HZ3 LYS 69 5.706 -15.172 -6.983 507 HA PRO 70 HA PRO 70 0.045 -11.356 -2.073 508 HB2 PRO 70 HB2 PRO 70 0.595 -9.621 -4.347 509 HB3 PRO 70 HB1 PRO 70 0.674 -9.254 -2.623 510 HG2 PRO 70 HG2 PRO 70 2.878 -9.405 -4.185 511 HG3 PRO 70 HG1 PRO 70 2.892 -9.832 -2.466 512 HD2 PRO 70 HD2 PRO 70 2.758 -11.626 -4.864 513 HD3 PRO 70 HD1 PRO 70 3.705 -11.806 -3.369 514 H SER 71 HN SER 71 -1.963 -10.626 -3.120 515 HA SER 71 HA SER 71 -2.677 -12.406 -5.342 516 HB2 SER 71 HB2 SER 71 -3.992 -12.464 -3.182 517 HB3 SER 71 HB1 SER 71 -4.526 -10.824 -3.539 518 HG SER 71 HG SER 71 -4.892 -12.984 -5.335 519 H GLY 72 HN GLY 72 -1.483 -9.476 -4.985 520 HA2 GLY 72 HA2 GLY 72 -1.967 -8.523 -7.520 521 HA3 GLY 72 HA1 GLY 72 -3.212 -7.805 -6.502 522 H GLY 73 HN GLY 73 -1.646 -5.987 -7.573 523 HA2 GLY 73 HA2 GLY 73 -0.693 -4.391 -5.680 524 HA3 GLY 73 HA1 GLY 73 0.643 -5.519 -5.840 525 H PHE 74 HN PHE 74 0.799 -2.762 -6.294 526 HA PHE 74 HA PHE 74 1.616 -2.765 -9.099 527 HB2 PHE 74 HB2 PHE 74 0.687 -0.560 -9.506 528 HB3 PHE 74 HB1 PHE 74 -0.594 -1.648 -9.009 529 HD1 PHE 74 HD1 PHE 74 -0.608 -1.651 -6.190 530 HD2 PHE 74 HD2 PHE 74 0.272 1.601 -8.784 531 HE1 PHE 74 HE1 PHE 74 -1.256 -0.075 -4.429 532 HE2 PHE 74 HE2 PHE 74 -0.389 3.181 -7.020 533 HZ PHE 74 HZ PHE 74 -1.196 2.430 -4.934 534 HA PRO 75 HA PRO 75 5.363 -1.117 -7.553 535 HB2 PRO 75 HB2 PRO 75 5.480 0.711 -9.844 536 HB3 PRO 75 HB1 PRO 75 6.577 -0.594 -9.400 537 HG2 PRO 75 HG2 PRO 75 4.940 -0.813 -11.497 538 HG3 PRO 75 HG1 PRO 75 5.298 -2.205 -10.456 539 HD2 PRO 75 HD2 PRO 75 2.872 -0.447 -10.501 540 HD3 PRO 75 HD1 PRO 75 2.982 -2.211 -10.325 541 H VAL 76 HN VAL 76 6.170 0.528 -6.390 542 HA VAL 76 HA VAL 76 4.321 2.473 -5.451 543 HB VAL 76 HB VAL 76 7.219 1.934 -4.819 544 HG11 VAL 76 HG11 VAL 76 6.703 4.326 -4.485 545 HG12 VAL 76 HG12 VAL 76 7.047 3.480 -2.977 546 HG13 VAL 76 HG13 VAL 76 5.383 3.863 -3.412 547 HG21 VAL 76 HG21 VAL 76 4.705 1.518 -3.211 548 HG22 VAL 76 HG22 VAL 76 6.341 1.054 -2.745 549 HG23 VAL 76 HG23 VAL 76 5.554 0.261 -4.109 550 H ASP 77 HN ASP 77 7.206 2.608 -7.478 551 HA ASP 77 HA ASP 77 7.298 5.465 -7.530 552 HB2 ASP 77 HB2 ASP 77 9.307 4.106 -7.895 553 HB3 ASP 77 HB1 ASP 77 8.591 3.418 -9.346 554 H LYS 78 HN LYS 78 5.366 3.153 -9.042 555 HA LYS 78 HA LYS 78 4.841 4.776 -11.403 556 HB2 LYS 78 HB2 LYS 78 4.123 1.993 -10.577 557 HB3 LYS 78 HB1 LYS 78 3.159 2.799 -11.802 558 HG2 LYS 78 HG2 LYS 78 4.818 1.444 -12.873 559 HG3 LYS 78 HG1 LYS 78 5.207 3.142 -13.144 560 HD2 LYS 78 HD2 LYS 78 6.868 3.019 -11.325 561 HD3 LYS 78 HD1 LYS 78 6.494 1.310 -11.126 562 HE2 LYS 78 HE2 LYS 78 7.524 2.542 -13.667 563 HE3 LYS 78 HE1 LYS 78 8.527 1.727 -12.471 564 HZ1 LYS 78 HZ1 LYS 78 7.317 -0.304 -12.858 565 HZ2 LYS 78 HZ2 LYS 78 7.930 0.277 -14.321 566 HZ3 LYS 78 HZ3 LYS 78 6.291 0.466 -13.959 567 H ILE 79 HN ILE 79 3.711 4.590 -8.265 568 HA ILE 79 HA ILE 79 0.952 5.094 -8.617 569 HB ILE 79 HB ILE 79 2.684 6.195 -6.397 570 HG12 ILE 79 HG12 ILE 79 1.364 3.484 -6.641 571 HG13 ILE 79 HG11 ILE 79 3.089 3.807 -6.555 572 HG21 ILE 79 HG21 ILE 79 0.608 6.084 -5.084 573 HG22 ILE 79 HG22 ILE 79 -0.255 5.524 -6.516 574 HG23 ILE 79 HG23 ILE 79 0.449 7.141 -6.487 575 HD11 ILE 79 HD11 ILE 79 2.738 4.719 -4.274 576 HD12 ILE 79 HD12 ILE 79 2.355 3.004 -4.436 577 HD13 ILE 79 HD13 ILE 79 1.057 4.197 -4.376 578 H THR 80 HN THR 80 -0.063 6.882 -9.378 579 HA THR 80 HA THR 80 1.647 9.056 -10.241 580 HB THR 80 HB THR 80 0.002 8.094 -11.816 581 HG1 THR 80 HG1 THR 80 -0.021 10.835 -11.127 582 HG21 THR 80 HG21 THR 80 -2.044 9.409 -10.034 583 HG22 THR 80 HG22 THR 80 -1.844 7.673 -10.284 584 HG23 THR 80 HG23 THR 80 -2.361 8.704 -11.620 585 H SER 81 HN SER 81 -0.861 8.447 -7.870 586 HA SER 81 HA SER 81 -0.275 10.962 -6.587 587 HB2 SER 81 HB2 SER 81 -3.079 10.456 -7.618 588 HB3 SER 81 HB1 SER 81 -2.573 11.817 -6.619 589 HG SER 81 HG SER 81 -0.951 11.778 -8.686 590 H VAL 82 HN VAL 82 -0.540 10.818 -4.455 591 HA VAL 82 HA VAL 82 -2.238 8.685 -3.375 592 HB VAL 82 HB VAL 82 0.047 8.179 -2.788 593 HG11 VAL 82 HG11 VAL 82 1.489 9.712 -1.577 594 HG12 VAL 82 HG12 VAL 82 0.241 10.957 -1.640 595 HG13 VAL 82 HG13 VAL 82 1.009 10.404 -3.127 596 HG21 VAL 82 HG21 VAL 82 -1.416 9.390 -0.442 597 HG22 VAL 82 HG22 VAL 82 -0.068 8.262 -0.327 598 HG23 VAL 82 HG23 VAL 82 -1.587 7.745 -1.055 599 H LYS 83 HN LYS 83 -4.044 9.595 -2.777 600 HA LYS 83 HA LYS 83 -3.987 12.173 -1.397 601 HB2 LYS 83 HB2 LYS 83 -6.077 12.676 -2.786 602 HB3 LYS 83 HB1 LYS 83 -4.525 12.773 -3.599 603 HG2 LYS 83 HG2 LYS 83 -5.061 10.237 -4.120 604 HG3 LYS 83 HG1 LYS 83 -6.717 10.803 -3.913 605 HD2 LYS 83 HD2 LYS 83 -6.143 12.609 -5.578 606 HD3 LYS 83 HD1 LYS 83 -4.657 11.702 -5.873 607 HE2 LYS 83 HE2 LYS 83 -5.937 9.748 -6.510 608 HE3 LYS 83 HE1 LYS 83 -7.442 10.592 -6.151 609 HZ1 LYS 83 HZ1 LYS 83 -6.964 10.560 -8.521 610 HZ2 LYS 83 HZ2 LYS 83 -5.502 11.367 -8.263 611 HZ3 LYS 83 HZ3 LYS 83 -6.965 12.143 -7.930 612 H SER 84 HN SER 84 -6.075 12.669 -0.380 613 HA SER 84 HA SER 84 -7.658 10.283 0.259 614 HB2 SER 84 HB2 SER 84 -7.934 11.150 2.562 615 HB3 SER 84 HB1 SER 84 -6.249 10.796 2.190 616 HG SER 84 HG SER 84 -5.919 12.764 2.834 617 H GLN 85 HN GLN 85 -9.877 10.730 0.720 618 HA GLN 85 HA GLN 85 -11.051 12.577 -1.031 619 HB2 GLN 85 HB2 GLN 85 -11.938 10.615 0.928 620 HB3 GLN 85 HB1 GLN 85 -13.021 11.993 0.812 621 HG2 GLN 85 HG2 GLN 85 -13.826 10.365 -0.684 622 HG3 GLN 85 HG1 GLN 85 -13.065 11.614 -1.666 623 HE21 GLN 85 HE21 GLN 85 -11.302 9.196 0.158 624 HE22 GLN 85 HE22 GLN 85 -10.694 8.339 -1.213 625 H ALA 86 HN ALA 86 -12.749 14.234 -0.271 626 HA ALA 86 HA ALA 86 -11.383 16.393 0.789 627 HB1 ALA 86 HB1 ALA 86 -13.402 16.580 -0.577 628 HB2 ALA 86 HB2 ALA 86 -13.531 17.526 0.906 629 HB3 ALA 86 HB3 ALA 86 -14.367 15.979 0.771 630 H ASP 87 HN ASP 87 -13.729 14.311 2.463 631 HA ASP 87 HA ASP 87 -12.632 15.299 5.014 632 HB2 ASP 87 HB2 ASP 87 -14.999 15.723 4.920 633 HB3 ASP 87 HB1 ASP 87 -15.327 14.086 4.370 634 H ASN 88 HN ASN 88 -13.124 12.626 2.941 635 HA ASN 88 HA ASN 88 -12.648 10.398 3.067 636 HB2 ASN 88 HB2 ASN 88 -10.277 9.967 3.469 637 HB3 ASN 88 HB1 ASN 88 -10.511 11.409 2.496 638 HD21 ASN 88 HD21 ASN 88 -9.999 13.426 3.373 639 HD22 ASN 88 HD22 ASN 88 -9.020 13.589 4.791 640 H THR 89 HN THR 89 -14.349 10.622 5.049 641 HA THR 89 HA THR 89 -13.623 10.199 7.653 642 HB THR 89 HB THR 89 -15.901 8.929 6.133 643 HG1 THR 89 HG1 THR 89 -15.469 11.408 6.980 644 HG21 THR 89 HG21 THR 89 -15.265 8.911 9.075 645 HG22 THR 89 HG22 THR 89 -15.615 7.539 8.017 646 HG23 THR 89 HG23 THR 89 -16.898 8.668 8.453 647 H LYS 90 HN LYS 90 -14.614 7.395 5.670 648 HA LYS 90 HA LYS 90 -12.237 6.018 6.711 649 HB2 LYS 90 HB2 LYS 90 -14.892 4.857 5.906 650 HB3 LYS 90 HB1 LYS 90 -13.476 3.905 6.335 651 HG2 LYS 90 HG2 LYS 90 -13.526 4.657 8.566 652 HG3 LYS 90 HG1 LYS 90 -14.687 5.927 8.191 653 HD2 LYS 90 HD2 LYS 90 -16.367 4.204 7.670 654 HD3 LYS 90 HD1 LYS 90 -15.197 2.958 8.112 655 HE2 LYS 90 HE2 LYS 90 -15.096 3.826 10.377 656 HE3 LYS 90 HE1 LYS 90 -16.205 5.129 9.948 657 HZ1 LYS 90 HZ1 LYS 90 -17.309 3.297 11.098 658 HZ2 LYS 90 HZ2 LYS 90 -16.867 2.236 9.861 659 HZ3 LYS 90 HZ3 LYS 90 -17.925 3.515 9.540 660 H VAL 91 HN VAL 91 -12.949 7.663 4.132 661 HA VAL 91 HA VAL 91 -12.439 5.586 2.121 662 HB VAL 91 HB VAL 91 -13.167 8.428 1.483 663 HG11 VAL 91 HG11 VAL 91 -14.129 7.400 -0.524 664 HG12 VAL 91 HG12 VAL 91 -13.631 5.809 0.052 665 HG13 VAL 91 HG13 VAL 91 -12.416 7.021 -0.355 666 HG21 VAL 91 HG21 VAL 91 -14.843 7.679 3.071 667 HG22 VAL 91 HG22 VAL 91 -15.086 6.194 2.153 668 HG23 VAL 91 HG23 VAL 91 -15.535 7.748 1.450 669 H LEU 92 HN LEU 92 -10.411 5.326 1.462 670 HA LEU 92 HA LEU 92 -8.659 7.677 1.164 671 HB2 LEU 92 HB2 LEU 92 -8.192 4.864 1.806 672 HB3 LEU 92 HB1 LEU 92 -7.140 5.467 0.543 673 HG LEU 92 HG LEU 92 -6.281 7.192 2.003 674 HD11 LEU 92 HD11 LEU 92 -8.286 7.678 3.279 675 HD12 LEU 92 HD12 LEU 92 -6.941 7.306 4.357 676 HD13 LEU 92 HD13 LEU 92 -8.193 6.099 4.060 677 HD21 LEU 92 HD21 LEU 92 -6.327 4.475 3.307 678 HD22 LEU 92 HD22 LEU 92 -5.183 5.765 3.678 679 HD23 LEU 92 HD23 LEU 92 -5.193 5.029 2.075 680 H VAL 93 HN VAL 93 -7.516 7.962 -0.861 681 HA VAL 93 HA VAL 93 -8.596 6.452 -3.114 682 HB VAL 93 HB VAL 93 -10.041 8.314 -3.125 683 HG11 VAL 93 HG11 VAL 93 -9.138 9.848 -1.644 684 HG12 VAL 93 HG12 VAL 93 -9.046 10.677 -3.201 685 HG13 VAL 93 HG13 VAL 93 -7.606 9.930 -2.511 686 HG21 VAL 93 HG21 VAL 93 -9.191 7.790 -5.323 687 HG22 VAL 93 HG22 VAL 93 -7.810 8.858 -5.076 688 HG23 VAL 93 HG23 VAL 93 -9.437 9.531 -5.178 689 H ILE 94 HN ILE 94 -6.922 5.631 -4.150 690 HA ILE 94 HA ILE 94 -4.478 7.241 -4.451 691 HB ILE 94 HB ILE 94 -4.721 4.362 -3.608 692 HG12 ILE 94 HG12 ILE 94 -2.815 5.154 -2.064 693 HG13 ILE 94 HG11 ILE 94 -3.258 6.781 -2.562 694 HG21 ILE 94 HG21 ILE 94 -2.341 4.033 -4.066 695 HG22 ILE 94 HG22 ILE 94 -2.269 5.621 -4.828 696 HG23 ILE 94 HG23 ILE 94 -3.254 4.344 -5.546 697 HD11 ILE 94 HD11 ILE 94 -5.094 4.810 -1.223 698 HD12 ILE 94 HD12 ILE 94 -5.482 6.475 -1.658 699 HD13 ILE 94 HD13 ILE 94 -4.263 6.147 -0.427 700 H THR 95 HN THR 95 -3.731 7.366 -6.499 701 HA THR 95 HA THR 95 -4.959 5.567 -8.493 702 HB THR 95 HB THR 95 -4.072 8.403 -9.029 703 HG1 THR 95 HG1 THR 95 -6.786 7.645 -8.748 704 HG21 THR 95 HG21 THR 95 -5.486 8.186 -11.014 705 HG22 THR 95 HG22 THR 95 -5.911 6.541 -10.541 706 HG23 THR 95 HG23 THR 95 -4.250 6.928 -10.988 707 H VAL 96 HN VAL 96 -3.637 4.705 -10.059 708 HA VAL 96 HA VAL 96 -0.772 5.311 -9.854 709 HB VAL 96 HB VAL 96 -0.961 3.136 -9.029 710 HG11 VAL 96 HG11 VAL 96 -2.301 1.370 -10.004 711 HG12 VAL 96 HG12 VAL 96 -2.814 2.453 -11.301 712 HG13 VAL 96 HG13 VAL 96 -3.304 2.774 -9.638 713 HG21 VAL 96 HG21 VAL 96 -0.381 2.929 -11.970 714 HG22 VAL 96 HG22 VAL 96 -0.022 1.669 -10.792 715 HG23 VAL 96 HG23 VAL 96 0.777 3.238 -10.678 716 H ASN 97 HN ASN 97 0.405 5.582 -11.767 717 HA ASN 97 HA ASN 97 -1.108 5.337 -14.263 718 HB2 ASN 97 HB2 ASN 97 -1.178 7.704 -13.450 719 HB3 ASN 97 HB1 ASN 97 0.571 7.747 -13.626 720 HD21 ASN 97 HD21 ASN 97 -2.472 7.726 -15.261 721 HD22 ASN 97 HD22 ASN 97 -1.859 8.088 -16.838 722 H ASN 98 HN ASN 98 0.009 3.637 -14.908 723 HA ASN 98 HA ASN 98 1.941 3.884 -16.737 724 HB2 ASN 98 HB2 ASN 98 3.578 4.555 -15.011 725 HB3 ASN 98 HB1 ASN 98 3.336 3.028 -14.184 726 HD21 ASN 98 HD21 ASN 98 4.158 1.126 -15.107 727 HD22 ASN 98 HD22 ASN 98 5.354 1.168 -16.358 728 HA PRO 99 HA PRO 99 0.607 -0.676 -15.651 729 HB2 PRO 99 HB2 PRO 99 -0.725 -0.154 -13.061 730 HB3 PRO 99 HB1 PRO 99 0.203 -1.565 -13.578 731 HG2 PRO 99 HG2 PRO 99 1.180 0.183 -11.805 732 HG3 PRO 99 HG1 PRO 99 2.218 -0.618 -12.997 733 HD2 PRO 99 HD2 PRO 99 1.154 2.172 -12.980 734 HD3 PRO 99 HD1 PRO 99 2.732 1.558 -13.504 735 H GLN 100 HN GLN 100 -1.814 -1.301 -15.574 736 HA GLN 100 HA GLN 100 -3.257 0.612 -17.046 737 HB2 GLN 100 HB2 GLN 100 -4.272 -1.829 -15.574 738 HB3 GLN 100 HB1 GLN 100 -5.170 -0.933 -16.791 739 HG2 GLN 100 HG2 GLN 100 -3.487 -1.499 -18.459 740 HG3 GLN 100 HG1 GLN 100 -2.576 -2.389 -17.242 741 HE21 GLN 100 HE21 GLN 100 -3.772 -3.283 -19.755 742 HE22 GLN 100 HE22 GLN 100 -4.843 -4.575 -19.336 743 HA PRO 101 HA PRO 101 -4.056 3.515 -13.808 744 HB2 PRO 101 HB2 PRO 101 -6.349 4.090 -15.645 745 HB3 PRO 101 HB1 PRO 101 -5.242 5.213 -14.844 746 HG2 PRO 101 HG2 PRO 101 -4.906 4.609 -17.404 747 HG3 PRO 101 HG1 PRO 101 -3.509 4.766 -16.324 748 HD2 PRO 101 HD2 PRO 101 -4.750 2.319 -17.468 749 HD3 PRO 101 HD1 PRO 101 -3.058 2.633 -17.038 750 H THR 102 HN THR 102 -4.828 2.803 -11.978 751 HA THR 102 HA THR 102 -7.687 2.203 -11.787 752 HB THR 102 HB THR 102 -5.592 0.589 -10.313 753 HG1 THR 102 HG1 THR 102 -5.681 0.292 -12.709 754 HG21 THR 102 HG21 THR 102 -7.816 0.711 -9.261 755 HG22 THR 102 HG22 THR 102 -7.450 -0.916 -9.834 756 HG23 THR 102 HG23 THR 102 -8.544 0.117 -10.754 757 H THR 103 HN THR 103 -8.612 2.875 -9.835 758 HA THR 103 HA THR 103 -6.823 4.400 -8.058 759 HB THR 103 HB THR 103 -9.725 4.972 -8.693 760 HG1 THR 103 HG1 THR 103 -7.974 5.485 -10.306 761 HG21 THR 103 HG21 THR 103 -9.382 7.028 -7.406 762 HG22 THR 103 HG22 THR 103 -7.748 6.502 -7.003 763 HG23 THR 103 HG23 THR 103 -9.139 5.597 -6.405 764 H TYR 104 HN TYR 104 -6.573 3.370 -6.213 765 HA TYR 104 HA TYR 104 -8.551 1.394 -5.382 766 HB2 TYR 104 HB2 TYR 104 -5.814 1.977 -4.234 767 HB3 TYR 104 HB1 TYR 104 -6.820 0.572 -3.890 768 HD1 TYR 104 HD1 TYR 104 -7.298 -1.059 -5.751 769 HD2 TYR 104 HD2 TYR 104 -4.371 2.012 -6.083 770 HE1 TYR 104 HE1 TYR 104 -6.246 -2.283 -7.606 771 HE2 TYR 104 HE2 TYR 104 -3.314 0.794 -7.955 772 HH TYR 104 HH TYR 104 -3.172 -1.461 -8.845 773 H ASN 105 HN ASN 105 -9.975 1.780 -3.821 774 HA ASN 105 HA ASN 105 -9.494 4.069 -2.051 775 HB2 ASN 105 HB2 ASN 105 -12.074 2.585 -2.609 776 HB3 ASN 105 HB1 ASN 105 -11.900 3.895 -1.448 777 HD21 ASN 105 HD21 ASN 105 -10.519 3.635 -4.693 778 HD22 ASN 105 HD22 ASN 105 -11.339 5.016 -5.337 779 H PHE 106 HN PHE 106 -8.411 3.429 -0.312 780 HA PHE 106 HA PHE 106 -8.881 0.814 0.844 781 HB2 PHE 106 HB2 PHE 106 -7.109 3.069 1.816 782 HB3 PHE 106 HB1 PHE 106 -7.124 1.428 2.446 783 HD1 PHE 106 HD1 PHE 106 -6.715 -0.431 0.574 784 HD2 PHE 106 HD2 PHE 106 -5.477 3.627 0.320 785 HE1 PHE 106 HE1 PHE 106 -4.972 -1.072 -1.033 786 HE2 PHE 106 HE2 PHE 106 -3.738 2.998 -1.302 787 HZ PHE 106 HZ PHE 106 -3.482 0.646 -1.980 788 H THR 107 HN THR 107 -10.605 0.530 2.054 789 HA THR 107 HA THR 107 -11.469 2.706 3.851 790 HB THR 107 HB THR 107 -13.246 0.591 2.615 791 HG1 THR 107 HG1 THR 107 -12.208 2.251 1.167 792 HG21 THR 107 HG21 THR 107 -13.888 3.190 4.023 793 HG22 THR 107 HG22 THR 107 -14.092 1.573 4.700 794 HG23 THR 107 HG23 THR 107 -15.062 2.079 3.317 795 H PHE 108 HN PHE 108 -11.841 2.156 5.983 796 HA PHE 108 HA PHE 108 -11.869 -0.681 6.674 797 HB2 PHE 108 HB2 PHE 108 -9.484 0.359 6.893 798 HB3 PHE 108 HB1 PHE 108 -10.152 1.192 8.290 799 HD1 PHE 108 HD1 PHE 108 -9.482 0.235 10.256 800 HD2 PHE 108 HD2 PHE 108 -10.445 -2.288 6.973 801 HE1 PHE 108 HE1 PHE 108 -9.045 -1.742 11.653 802 HE2 PHE 108 HE2 PHE 108 -10.013 -4.269 8.361 803 HZ PHE 108 HZ PHE 108 -9.379 -3.997 10.727 804 H LYS 109 HN LYS 109 -12.256 -0.810 9.203 805 HA LYS 109 HA LYS 109 -14.622 0.676 9.798 806 HB2 LYS 109 HB2 LYS 109 -14.319 -1.616 10.603 807 HB3 LYS 109 HB1 LYS 109 -12.900 -1.133 11.515 808 HG2 LYS 109 HG2 LYS 109 -15.540 0.141 12.093 809 HG3 LYS 109 HG1 LYS 109 -15.177 -1.467 12.718 810 HD2 LYS 109 HD2 LYS 109 -13.192 -0.601 13.838 811 HD3 LYS 109 HD1 LYS 109 -13.502 1.003 13.174 812 HE2 LYS 109 HE2 LYS 109 -14.273 0.967 15.439 813 HE3 LYS 109 HE1 LYS 109 -15.678 1.012 14.377 814 HZ1 LYS 109 HZ1 LYS 109 -14.595 -1.379 15.761 815 HZ2 LYS 109 HZ2 LYS 109 -15.887 -1.401 14.673 816 HZ3 LYS 109 HZ3 LYS 109 -16.028 -0.564 16.135 817 H SER 110 HN SER 110 -11.255 0.807 10.718 818 HA SER 110 HA SER 110 -11.638 2.918 12.648 819 HB2 SER 110 HB2 SER 110 -9.920 1.201 13.013 820 HB3 SER 110 HB1 SER 110 -9.136 1.676 11.505 821 HG SER 110 HG SER 110 -9.182 2.967 13.980 822 HA PRO 111 HA PRO 111 -11.020 6.146 9.549 823 HB2 PRO 111 HB2 PRO 111 -11.003 7.898 11.909 824 HB3 PRO 111 HB1 PRO 111 -12.095 7.906 10.519 825 HG2 PRO 111 HG2 PRO 111 -12.896 7.118 12.970 826 HG3 PRO 111 HG1 PRO 111 -13.546 6.404 11.484 827 HD2 PRO 111 HD2 PRO 111 -11.480 5.325 13.360 828 HD3 PRO 111 HD1 PRO 111 -12.801 4.478 12.526 829 H GLY 112 HN GLY 112 -9.232 5.413 12.451 830 HA2 GLY 112 HA2 GLY 112 -7.042 7.198 11.817 831 HA3 GLY 112 HA1 GLY 112 -7.115 6.066 13.158 832 H GLU 113 HN GLU 113 -7.692 3.730 11.605 833 HA GLU 113 HA GLU 113 -5.108 2.800 11.163 834 HB2 GLU 113 HB2 GLU 113 -7.118 1.376 11.562 835 HB3 GLU 113 HB1 GLU 113 -7.653 1.732 9.928 836 HG2 GLU 113 HG2 GLU 113 -6.602 -0.447 10.053 837 HG3 GLU 113 HG1 GLU 113 -5.678 0.647 9.023 838 H ARG 114 HN ARG 114 -7.503 3.961 8.854 839 HA ARG 114 HA ARG 114 -5.995 3.276 6.540 840 HB2 ARG 114 HB2 ARG 114 -8.139 5.378 6.636 841 HB3 ARG 114 HB1 ARG 114 -7.691 4.330 5.298 842 HG2 ARG 114 HG2 ARG 114 -8.943 2.614 6.045 843 HG3 ARG 114 HG1 ARG 114 -8.685 3.017 7.747 844 HD2 ARG 114 HD2 ARG 114 -10.591 4.273 5.792 845 HD3 ARG 114 HD1 ARG 114 -10.938 3.520 7.354 846 HE ARG 114 HE ARG 114 -10.148 5.431 8.442 847 HH11 ARG 114 HH11 ARG 114 -10.113 5.812 4.970 848 HH12 ARG 114 HH12 ARG 114 -9.847 7.525 5.031 849 HH21 ARG 114 HH21 ARG 114 -9.733 7.710 8.514 850 HH22 ARG 114 HH22 ARG 114 -9.650 8.596 7.026 851 H GLU 115 HN GLU 115 -6.443 6.267 8.404 852 HA GLU 115 HA GLU 115 -4.978 7.913 6.626 853 HB2 GLU 115 HB2 GLU 115 -5.783 8.197 9.499 854 HB3 GLU 115 HB1 GLU 115 -4.695 9.360 8.754 855 HG2 GLU 115 HG2 GLU 115 -6.495 9.577 6.940 856 HG3 GLU 115 HG1 GLU 115 -7.555 8.778 8.104 857 H SER 116 HN SER 116 -4.087 5.971 9.414 858 HA SER 116 HA SER 116 -1.403 6.647 9.641 859 HB2 SER 116 HB2 SER 116 -2.400 5.152 11.249 860 HB3 SER 116 HB1 SER 116 -2.803 3.981 9.993 861 HG SER 116 HG SER 116 -0.179 4.732 10.794 862 H TRP 117 HN TRP 117 -3.058 4.530 7.394 863 HA TRP 117 HA TRP 117 -0.707 3.555 6.105 864 HB2 TRP 117 HB2 TRP 117 -3.280 2.760 6.146 865 HB3 TRP 117 HB1 TRP 117 -3.289 3.667 4.636 866 HD1 TRP 117 HD1 TRP 117 -1.985 0.488 6.215 867 HE1 TRP 117 HE1 TRP 117 -0.967 -1.011 4.376 868 HE3 TRP 117 HE3 TRP 117 -2.074 3.796 2.324 869 HZ2 TRP 117 HZ2 TRP 117 -0.300 -0.811 1.652 870 HZ3 TRP 117 HZ3 TRP 117 -1.228 3.060 0.133 871 HH2 TRP 117 HH2 TRP 117 -0.360 0.805 -0.191 872 H GLN 118 HN GLN 118 -3.106 6.049 5.387 873 HA GLN 118 HA GLN 118 -2.243 6.862 2.880 874 HB2 GLN 118 HB2 GLN 118 -4.359 7.587 3.747 875 HB3 GLN 118 HB1 GLN 118 -3.593 8.393 5.103 876 HG2 GLN 118 HG2 GLN 118 -4.361 10.014 3.513 877 HG3 GLN 118 HG1 GLN 118 -2.601 10.018 3.562 878 HE21 GLN 118 HE21 GLN 118 -4.460 7.566 1.896 879 HE22 GLN 118 HE22 GLN 118 -4.014 8.051 0.300 880 H GLU 119 HN GLU 119 -1.269 8.194 6.054 881 HA GLU 119 HA GLU 119 0.471 10.132 4.894 882 HB2 GLU 119 HB2 GLU 119 1.268 10.469 7.209 883 HB3 GLU 119 HB1 GLU 119 -0.486 10.485 7.095 884 HG2 GLU 119 HG2 GLU 119 -0.525 8.146 7.856 885 HG3 GLU 119 HG1 GLU 119 1.224 8.208 8.056 886 H GLN 120 HN GLN 120 0.863 6.842 5.963 887 HA GLN 120 HA GLN 120 3.714 6.943 6.129 888 HB2 GLN 120 HB2 GLN 120 1.640 4.811 6.348 889 HB3 GLN 120 HB1 GLN 120 3.328 4.353 6.154 890 HG2 GLN 120 HG2 GLN 120 2.290 6.181 8.304 891 HG3 GLN 120 HG1 GLN 120 2.586 4.457 8.511 892 HE21 GLN 120 HE21 GLN 120 4.911 4.655 6.661 893 HE22 GLN 120 HE22 GLN 120 6.184 5.315 7.634 894 H ILE 121 HN ILE 121 1.405 5.688 3.756 895 HA ILE 121 HA ILE 121 3.319 4.526 2.056 896 HB ILE 121 HB ILE 121 0.911 4.051 1.896 897 HG12 ILE 121 HG12 ILE 121 0.749 4.073 -0.589 898 HG13 ILE 121 HG11 ILE 121 2.149 5.138 -0.644 899 HG21 ILE 121 HG21 ILE 121 -0.558 5.630 0.675 900 HG22 ILE 121 HG22 ILE 121 0.733 6.833 0.750 901 HG23 ILE 121 HG23 ILE 121 -0.012 6.245 2.236 902 HD11 ILE 121 HD11 ILE 121 2.128 2.346 0.472 903 HD12 ILE 121 HD12 ILE 121 3.529 3.408 0.335 904 HD13 ILE 121 HD13 ILE 121 2.727 2.815 -1.118 905 H GLN 122 HN GLN 122 2.069 7.795 2.324 906 HA GLN 122 HA GLN 122 3.156 8.944 0.016 907 HB2 GLN 122 HB2 GLN 122 2.613 10.029 2.781 908 HB3 GLN 122 HB1 GLN 122 3.294 11.044 1.520 909 HG2 GLN 122 HG2 GLN 122 1.351 10.766 0.163 910 HG3 GLN 122 HG1 GLN 122 0.692 9.563 1.268 911 HE21 GLN 122 HE21 GLN 122 -0.277 10.216 3.139 912 HE22 GLN 122 HE22 GLN 122 -0.675 11.869 3.474 913 H SER 123 HN SER 123 4.554 8.437 3.220 914 HA SER 123 HA SER 123 7.026 9.687 2.674 915 HB2 SER 123 HB2 SER 123 6.354 7.607 4.763 916 HB3 SER 123 HB1 SER 123 7.765 8.666 4.769 917 HG SER 123 HG SER 123 6.069 10.415 4.650 918 H LEU 124 HN LEU 124 5.966 6.293 2.529 919 HA LEU 124 HA LEU 124 8.512 5.228 1.895 920 HB2 LEU 124 HB2 LEU 124 6.624 3.873 2.736 921 HB3 LEU 124 HB1 LEU 124 5.767 4.139 1.235 922 HG LEU 124 HG LEU 124 6.967 1.871 1.607 923 HD11 LEU 124 HD11 LEU 124 5.967 2.526 -0.513 924 HD12 LEU 124 HD12 LEU 124 7.485 1.663 -0.763 925 HD13 LEU 124 HD13 LEU 124 7.429 3.417 -0.936 926 HD21 LEU 124 HD21 LEU 124 9.318 3.548 0.744 927 HD22 LEU 124 HD22 LEU 124 9.284 1.792 0.905 928 HD23 LEU 124 HD23 LEU 124 9.108 2.811 2.333 929 H MET 125 HN MET 125 5.773 6.234 -0.128 930 HA MET 125 HA MET 125 6.758 5.516 -2.622 931 HB2 MET 125 HB2 MET 125 5.026 7.840 -1.783 932 HB3 MET 125 HB1 MET 125 5.369 7.460 -3.465 933 HG2 MET 125 HG2 MET 125 4.228 5.413 -3.343 934 HG3 MET 125 HG1 MET 125 4.159 5.465 -1.583 935 HE1 MET 125 HE1 MET 125 1.934 8.613 -4.080 936 HE2 MET 125 HE2 MET 125 3.258 7.624 -4.701 937 HE3 MET 125 HE3 MET 125 3.562 8.818 -3.433 938 H LYS 126 HN LYS 126 7.125 8.625 -0.947 939 HA LYS 126 HA LYS 126 8.719 9.738 -3.041 940 HB2 LYS 126 HB2 LYS 126 8.421 10.674 -0.180 941 HB3 LYS 126 HB1 LYS 126 9.038 11.620 -1.530 942 HG2 LYS 126 HG2 LYS 126 6.233 10.558 -1.236 943 HG3 LYS 126 HG1 LYS 126 6.749 12.234 -1.039 944 HD2 LYS 126 HD2 LYS 126 7.350 12.375 -3.366 945 HD3 LYS 126 HD1 LYS 126 7.039 10.654 -3.591 946 HE2 LYS 126 HE2 LYS 126 4.681 11.000 -3.089 947 HE3 LYS 126 HE1 LYS 126 4.979 12.719 -2.824 948 HZ1 LYS 126 HZ1 LYS 126 5.699 12.883 -5.146 949 HZ2 LYS 126 HZ2 LYS 126 4.095 12.370 -5.015 950 HZ3 LYS 126 HZ3 LYS 126 5.312 11.255 -5.386 951 H PHE 127 HN PHE 127 9.433 8.016 -0.071 952 HA PHE 127 HA PHE 127 12.106 8.675 0.248 953 HB2 PHE 127 HB2 PHE 127 10.905 7.320 1.874 954 HB3 PHE 127 HB1 PHE 127 10.730 6.019 0.699 955 HD1 PHE 127 HD1 PHE 127 12.478 4.463 0.320 956 HD2 PHE 127 HD2 PHE 127 13.126 7.858 2.796 957 HE1 PHE 127 HE1 PHE 127 14.583 3.473 1.118 958 HE2 PHE 127 HE2 PHE 127 15.224 6.880 3.597 959 HZ PHE 127 HZ PHE 127 16.003 4.694 2.666 960 H MET 128 HN MET 128 10.664 6.225 -1.874 961 HA MET 128 HA MET 128 13.319 5.672 -2.966 962 HB2 MET 128 HB2 MET 128 12.174 3.818 -4.179 963 HB3 MET 128 HB1 MET 128 12.103 3.690 -2.432 964 HG2 MET 128 HG2 MET 128 9.839 4.272 -2.373 965 HG3 MET 128 HG1 MET 128 9.863 4.873 -4.032 966 HE1 MET 128 HE1 MET 128 10.122 3.326 -6.142 967 HE2 MET 128 HE2 MET 128 10.149 1.564 -6.097 968 HE3 MET 128 HE3 MET 128 11.531 2.481 -5.500 969 H SER 129 HN SER 129 10.406 7.344 -3.759 970 HA SER 129 HA SER 129 11.045 7.345 -6.602 971 HB2 SER 129 HB2 SER 129 8.704 6.923 -5.765 972 HB3 SER 129 HB1 SER 129 8.656 8.612 -5.264 973 HG SER 129 HG SER 129 9.054 7.629 -7.912 974 H MET 130 HN MET 130 11.884 9.215 -3.985 975 HA MET 130 HA MET 130 11.694 11.796 -5.114 976 HB2 MET 130 HB2 MET 130 13.111 10.595 -2.795 977 HB3 MET 130 HB1 MET 130 13.731 12.127 -3.407 978 HG2 MET 130 HG2 MET 130 11.437 13.052 -3.176 979 HG3 MET 130 HG1 MET 130 10.960 11.547 -2.404 980 HE1 MET 130 HE1 MET 130 11.084 14.125 0.566 981 HE2 MET 130 HE2 MET 130 10.087 12.949 -0.287 982 HE3 MET 130 HE3 MET 130 10.584 14.435 -1.095 983 H LYS 131 HN LYS 131 14.090 12.966 -5.013 984 HA LYS 131 HA LYS 131 15.329 12.515 -7.414 985 HB2 LYS 131 HB2 LYS 131 17.282 13.760 -6.443 986 HB3 LYS 131 HB1 LYS 131 15.728 14.564 -6.286 987 HG2 LYS 131 HG2 LYS 131 15.582 14.003 -3.980 988 HG3 LYS 131 HG1 LYS 131 16.981 12.933 -4.094 989 HD2 LYS 131 HD2 LYS 131 17.680 14.991 -3.070 990 HD3 LYS 131 HD1 LYS 131 18.371 14.909 -4.690 991 HE2 LYS 131 HE2 LYS 131 17.564 17.134 -4.332 992 HE3 LYS 131 HE1 LYS 131 16.497 16.343 -5.491 993 HZ1 LYS 131 HZ1 LYS 131 15.235 17.576 -3.855 994 HZ2 LYS 131 HZ2 LYS 131 15.951 16.707 -2.594 995 HZ3 LYS 131 HZ3 LYS 131 14.931 15.923 -3.687 Start of MODEL 6 1 H1 SER 11 HT1 SER 11 23.777 3.274 4.292 2 H2 SER 11 HT2 SER 11 23.786 4.961 4.209 3 H3 SER 11 HT3 SER 11 25.243 4.110 4.334 4 HA SER 11 HA SER 11 24.912 4.889 2.102 5 HB2 SER 11 HB2 SER 11 24.585 1.895 2.385 6 HB3 SER 11 HB1 SER 11 25.271 2.743 1.005 7 HG SER 11 HG SER 11 27.095 2.984 2.039 8 H ALA 12 HN ALA 12 23.599 5.148 0.316 9 HA ALA 12 HA ALA 12 20.987 5.744 0.922 10 HB1 ALA 12 HB1 ALA 12 22.057 5.228 -1.837 11 HB2 ALA 12 HB2 ALA 12 22.288 6.717 -0.921 12 HB3 ALA 12 HB3 ALA 12 20.666 6.221 -1.405 13 H SER 13 HN SER 13 22.091 2.870 -0.894 14 HA SER 13 HA SER 13 19.376 1.977 -1.259 15 HB2 SER 13 HB2 SER 13 21.110 1.528 -2.961 16 HB3 SER 13 HB1 SER 13 21.977 0.521 -1.804 17 HG SER 13 HG SER 13 19.426 0.071 -2.957 18 H ASP 14 HN ASP 14 22.105 1.118 0.800 19 HA ASP 14 HA ASP 14 20.997 -1.210 1.938 20 HB2 ASP 14 HB2 ASP 14 23.109 0.710 2.892 21 HB3 ASP 14 HB1 ASP 14 22.625 -0.685 3.848 22 H ILE 15 HN ILE 15 21.030 2.158 3.095 23 HA ILE 15 HA ILE 15 19.557 1.710 5.437 24 HB ILE 15 HB ILE 15 20.769 3.842 4.930 25 HG12 ILE 15 HG12 ILE 15 18.757 5.300 5.770 26 HG13 ILE 15 HG11 ILE 15 17.939 3.741 5.874 27 HG21 ILE 15 HG21 ILE 15 18.355 4.448 3.241 28 HG22 ILE 15 HG22 ILE 15 19.989 4.179 2.635 29 HG23 ILE 15 HG23 ILE 15 19.643 5.577 3.653 30 HD11 ILE 15 HD11 ILE 15 18.864 4.259 8.005 31 HD12 ILE 15 HD12 ILE 15 20.442 4.594 7.297 32 HD13 ILE 15 HD13 ILE 15 19.813 2.948 7.302 33 H ARG 16 HN ARG 16 18.569 2.281 2.116 34 HA ARG 16 HA ARG 16 15.842 2.724 2.576 35 HB2 ARG 16 HB2 ARG 16 16.769 3.281 0.444 36 HB3 ARG 16 HB1 ARG 16 17.388 1.654 0.212 37 HG2 ARG 16 HG2 ARG 16 15.001 0.870 0.135 38 HG3 ARG 16 HG1 ARG 16 14.531 2.573 0.082 39 HD2 ARG 16 HD2 ARG 16 16.387 1.219 -1.859 40 HD3 ARG 16 HD1 ARG 16 14.677 1.537 -2.156 41 HE ARG 16 HE ARG 16 16.271 3.857 -1.480 42 HH11 ARG 16 HH11 ARG 16 14.981 1.850 -4.044 43 HH12 ARG 16 HH12 ARG 16 15.160 3.075 -5.260 44 HH21 ARG 16 HH21 ARG 16 16.508 5.465 -3.075 45 HH22 ARG 16 HH22 ARG 16 16.021 5.130 -4.708 46 H MET 17 HN MET 17 17.649 -0.247 1.889 47 HA MET 17 HA MET 17 15.458 -1.943 1.631 48 HB2 MET 17 HB2 MET 17 18.233 -2.544 2.671 49 HB3 MET 17 HB1 MET 17 17.046 -3.774 2.262 50 HG2 MET 17 HG2 MET 17 17.055 -3.087 -0.042 51 HG3 MET 17 HG1 MET 17 18.125 -1.735 0.331 52 HE1 MET 17 HE1 MET 17 18.693 -3.832 -1.985 53 HE2 MET 17 HE2 MET 17 20.417 -4.126 -1.758 54 HE3 MET 17 HE3 MET 17 19.774 -2.491 -1.607 55 H LYS 18 HN LYS 18 17.228 -0.970 4.559 56 HA LYS 18 HA LYS 18 15.558 -2.576 6.244 57 HB2 LYS 18 HB2 LYS 18 16.795 -1.822 8.030 58 HB3 LYS 18 HB1 LYS 18 17.951 -1.632 6.725 59 HG2 LYS 18 HG2 LYS 18 17.839 0.671 6.775 60 HG3 LYS 18 HG1 LYS 18 16.215 0.672 7.476 61 HD2 LYS 18 HD2 LYS 18 17.121 -0.167 9.580 62 HD3 LYS 18 HD1 LYS 18 18.747 -0.146 8.894 63 HE2 LYS 18 HE2 LYS 18 18.450 2.305 8.522 64 HE3 LYS 18 HE1 LYS 18 16.939 2.202 9.416 65 HZ1 LYS 18 HZ1 LYS 18 19.637 1.549 10.464 66 HZ2 LYS 18 HZ2 LYS 18 18.196 1.381 11.330 67 HZ3 LYS 18 HZ3 LYS 18 18.722 2.916 10.852 68 H LYS 19 HN LYS 19 15.542 0.731 5.086 69 HA LYS 19 HA LYS 19 13.703 1.692 7.028 70 HB2 LYS 19 HB2 LYS 19 15.396 2.857 5.203 71 HB3 LYS 19 HB1 LYS 19 13.816 3.174 4.495 72 HG2 LYS 19 HG2 LYS 19 14.640 3.885 7.307 73 HG3 LYS 19 HG1 LYS 19 14.588 5.001 5.943 74 HD2 LYS 19 HD2 LYS 19 12.221 4.765 5.748 75 HD3 LYS 19 HD1 LYS 19 12.200 3.449 6.924 76 HE2 LYS 19 HE2 LYS 19 11.430 5.491 7.965 77 HE3 LYS 19 HE1 LYS 19 12.977 5.014 8.657 78 HZ1 LYS 19 HZ1 LYS 19 12.645 7.058 6.535 79 HZ2 LYS 19 HZ2 LYS 19 14.081 6.662 7.333 80 HZ3 LYS 19 HZ3 LYS 19 12.819 7.401 8.177 81 H VAL 20 HN VAL 20 13.416 0.469 3.736 82 HA VAL 20 HA VAL 20 10.669 1.046 3.416 83 HB VAL 20 HB VAL 20 10.659 -0.578 1.595 84 HG11 VAL 20 HG11 VAL 20 11.584 1.680 1.228 85 HG12 VAL 20 HG12 VAL 20 12.309 0.463 0.175 86 HG13 VAL 20 HG13 VAL 20 13.195 1.048 1.584 87 HG21 VAL 20 HG21 VAL 20 12.635 -1.869 1.027 88 HG22 VAL 20 HG22 VAL 20 12.054 -2.299 2.636 89 HG23 VAL 20 HG23 VAL 20 13.465 -1.256 2.458 90 H MET 21 HN MET 21 12.403 -1.595 4.930 91 HA MET 21 HA MET 21 10.182 -3.306 5.320 92 HB2 MET 21 HB2 MET 21 12.811 -3.010 6.753 93 HB3 MET 21 HB1 MET 21 11.603 -4.172 7.274 94 HG2 MET 21 HG2 MET 21 12.853 -4.072 4.541 95 HG3 MET 21 HG1 MET 21 13.326 -5.165 5.839 96 HE1 MET 21 HE1 MET 21 10.130 -7.384 6.247 97 HE2 MET 21 HE2 MET 21 10.441 -5.877 7.106 98 HE3 MET 21 HE3 MET 21 11.751 -7.028 6.840 99 H GLN 22 HN GLN 22 11.420 -0.535 7.061 100 HA GLN 22 HA GLN 22 9.730 -0.732 9.329 101 HB2 GLN 22 HB2 GLN 22 10.700 1.853 8.109 102 HB3 GLN 22 HB1 GLN 22 10.337 1.524 9.797 103 HG2 GLN 22 HG2 GLN 22 12.269 0.058 9.942 104 HG3 GLN 22 HG1 GLN 22 12.626 0.341 8.240 105 HE21 GLN 22 HE21 GLN 22 14.583 1.313 8.466 106 HE22 GLN 22 HE22 GLN 22 14.824 2.818 9.292 107 H TYR 23 HN TYR 23 9.475 1.034 6.264 108 HA TYR 23 HA TYR 23 6.852 1.995 6.617 109 HB2 TYR 23 HB2 TYR 23 8.504 1.414 4.168 110 HB3 TYR 23 HB1 TYR 23 6.850 1.989 4.043 111 HD1 TYR 23 HD1 TYR 23 10.227 2.938 4.244 112 HD2 TYR 23 HD2 TYR 23 6.329 4.209 5.364 113 HE1 TYR 23 HE1 TYR 23 11.056 5.235 4.491 114 HE2 TYR 23 HE2 TYR 23 7.150 6.514 5.615 115 HH TYR 23 HH TYR 23 9.308 7.667 6.043 116 H ARG 24 HN ARG 24 8.139 -1.046 5.520 117 HA ARG 24 HA ARG 24 5.901 -2.078 4.210 118 HB2 ARG 24 HB2 ARG 24 8.298 -2.954 4.225 119 HB3 ARG 24 HB1 ARG 24 7.896 -3.733 5.749 120 HG2 ARG 24 HG2 ARG 24 6.216 -5.070 4.688 121 HG3 ARG 24 HG1 ARG 24 6.416 -4.192 3.171 122 HD2 ARG 24 HD2 ARG 24 8.758 -4.987 3.075 123 HD3 ARG 24 HD1 ARG 24 8.458 -5.954 4.518 124 HE ARG 24 HE ARG 24 6.730 -6.371 2.199 125 HH11 ARG 24 HH11 ARG 24 9.377 -7.505 4.193 126 HH12 ARG 24 HH12 ARG 24 9.285 -9.136 3.607 127 HH21 ARG 24 HH21 ARG 24 6.624 -8.501 1.409 128 HH22 ARG 24 HH22 ARG 24 7.719 -9.700 2.014 129 H ARG 25 HN ARG 25 6.876 -2.258 7.608 130 HA ARG 25 HA ARG 25 4.728 -3.933 8.410 131 HB2 ARG 25 HB2 ARG 25 6.341 -1.983 10.058 132 HB3 ARG 25 HB1 ARG 25 5.289 -3.240 10.698 133 HG2 ARG 25 HG2 ARG 25 6.739 -4.891 9.435 134 HG3 ARG 25 HG1 ARG 25 7.868 -3.557 9.200 135 HD2 ARG 25 HD2 ARG 25 7.982 -3.256 11.637 136 HD3 ARG 25 HD1 ARG 25 6.897 -4.631 11.838 137 HE ARG 25 HE ARG 25 9.523 -4.904 10.525 138 HH11 ARG 25 HH11 ARG 25 7.182 -5.944 12.925 139 HH12 ARG 25 HH12 ARG 25 8.124 -7.313 13.419 140 HH21 ARG 25 HH21 ARG 25 10.748 -6.698 11.186 141 HH22 ARG 25 HH22 ARG 25 10.153 -7.736 12.443 142 H ALA 26 HN ALA 26 5.114 -0.501 7.993 143 HA ALA 26 HA ALA 26 2.663 0.208 9.312 144 HB1 ALA 26 HB1 ALA 26 4.364 1.841 7.433 145 HB2 ALA 26 HB2 ALA 26 4.592 1.738 9.179 146 HB3 ALA 26 HB3 ALA 26 3.117 2.445 8.524 147 H LEU 27 HN LEU 27 3.623 -0.729 6.126 148 HA LEU 27 HA LEU 27 1.096 0.102 4.962 149 HB2 LEU 27 HB2 LEU 27 3.704 -0.861 3.946 150 HB3 LEU 27 HB1 LEU 27 2.297 -1.290 2.995 151 HG LEU 27 HG LEU 27 1.853 0.914 2.399 152 HD11 LEU 27 HD11 LEU 27 2.801 2.882 3.523 153 HD12 LEU 27 HD12 LEU 27 3.562 1.823 4.711 154 HD13 LEU 27 HD13 LEU 27 1.803 1.912 4.603 155 HD21 LEU 27 HD21 LEU 27 4.019 1.912 1.731 156 HD22 LEU 27 HD22 LEU 27 3.879 0.203 1.327 157 HD23 LEU 27 HD23 LEU 27 4.842 0.703 2.718 158 H THR 28 HN THR 28 2.526 -2.670 6.392 159 HA THR 28 HA THR 28 0.693 -4.564 5.268 160 HB THR 28 HB THR 28 2.333 -4.757 7.810 161 HG1 THR 28 HG1 THR 28 3.549 -4.530 5.826 162 HG21 THR 28 HG21 THR 28 0.969 -6.915 6.192 163 HG22 THR 28 HG22 THR 28 0.443 -6.326 7.769 164 HG23 THR 28 HG23 THR 28 1.985 -7.167 7.612 165 H LYS 29 HN LYS 29 -1.411 -4.283 5.605 166 HA LYS 29 HA LYS 29 -2.413 -3.995 8.311 167 HB2 LYS 29 HB2 LYS 29 -2.032 -1.700 6.804 168 HB3 LYS 29 HB1 LYS 29 -3.726 -2.077 6.546 169 HG2 LYS 29 HG2 LYS 29 -3.744 -0.665 8.388 170 HG3 LYS 29 HG1 LYS 29 -3.873 -2.277 9.095 171 HD2 LYS 29 HD2 LYS 29 -2.273 -1.171 10.415 172 HD3 LYS 29 HD1 LYS 29 -1.328 -2.189 9.325 173 HE2 LYS 29 HE2 LYS 29 -0.363 0.054 9.519 174 HE3 LYS 29 HE1 LYS 29 -0.910 -0.286 7.882 175 HZ1 LYS 29 HZ1 LYS 29 -2.563 1.196 9.840 176 HZ2 LYS 29 HZ2 LYS 29 -2.773 1.096 8.162 177 HZ3 LYS 29 HZ3 LYS 29 -1.469 1.963 8.798 178 H VAL 30 HN VAL 30 -4.829 -4.048 8.290 179 HA VAL 30 HA VAL 30 -5.825 -5.611 6.012 180 HB VAL 30 HB VAL 30 -7.701 -6.278 7.559 181 HG11 VAL 30 HG11 VAL 30 -6.374 -7.948 8.763 182 HG12 VAL 30 HG12 VAL 30 -4.906 -7.035 8.411 183 HG13 VAL 30 HG13 VAL 30 -5.825 -7.767 7.096 184 HG21 VAL 30 HG21 VAL 30 -7.357 -6.031 9.970 185 HG22 VAL 30 HG22 VAL 30 -7.500 -4.460 9.183 186 HG23 VAL 30 HG23 VAL 30 -5.914 -5.061 9.670 187 H VAL 31 HN VAL 31 -7.317 -4.717 4.726 188 HA VAL 31 HA VAL 31 -8.843 -2.409 5.604 189 HB VAL 31 HB VAL 31 -6.356 -2.149 4.138 190 HG11 VAL 31 HG11 VAL 31 -7.729 -2.172 2.139 191 HG12 VAL 31 HG12 VAL 31 -7.101 -0.552 2.445 192 HG13 VAL 31 HG13 VAL 31 -8.779 -0.931 2.825 193 HG21 VAL 31 HG21 VAL 31 -6.932 -0.838 6.093 194 HG22 VAL 31 HG22 VAL 31 -8.301 -0.126 5.237 195 HG23 VAL 31 HG23 VAL 31 -6.654 0.217 4.708 196 H LYS 32 HN LYS 32 -10.568 -1.898 4.200 197 HA LYS 32 HA LYS 32 -11.219 -4.063 2.343 198 HB2 LYS 32 HB2 LYS 32 -12.736 -3.365 4.294 199 HB3 LYS 32 HB1 LYS 32 -13.098 -1.938 3.334 200 HG2 LYS 32 HG2 LYS 32 -13.370 -4.371 1.789 201 HG3 LYS 32 HG1 LYS 32 -14.401 -4.368 3.226 202 HD2 LYS 32 HD2 LYS 32 -15.229 -2.122 2.549 203 HD3 LYS 32 HD1 LYS 32 -14.291 -2.276 1.062 204 HE2 LYS 32 HE2 LYS 32 -15.595 -4.101 0.316 205 HE3 LYS 32 HE1 LYS 32 -16.335 -4.316 1.900 206 HZ1 LYS 32 HZ1 LYS 32 -17.503 -2.240 1.621 207 HZ2 LYS 32 HZ2 LYS 32 -17.839 -3.260 0.318 208 HZ3 LYS 32 HZ3 LYS 32 -16.763 -1.971 0.125 209 H LEU 33 HN LEU 33 -10.936 -3.743 0.271 210 HA LEU 33 HA LEU 33 -10.507 -1.044 -0.713 211 HB2 LEU 33 HB2 LEU 33 -10.115 -3.769 -1.884 212 HB3 LEU 33 HB1 LEU 33 -10.182 -2.364 -2.934 213 HG LEU 33 HG LEU 33 -8.216 -2.721 -0.671 214 HD11 LEU 33 HD11 LEU 33 -7.792 -4.307 -2.477 215 HD12 LEU 33 HD12 LEU 33 -6.561 -3.045 -2.447 216 HD13 LEU 33 HD13 LEU 33 -7.845 -2.995 -3.654 217 HD21 LEU 33 HD21 LEU 33 -7.115 -0.778 -1.687 218 HD22 LEU 33 HD22 LEU 33 -8.741 -0.391 -1.127 219 HD23 LEU 33 HD23 LEU 33 -8.438 -0.643 -2.844 220 H LYS 34 HN LYS 34 -11.689 -0.015 -2.253 221 HA LYS 34 HA LYS 34 -14.151 -1.276 -3.217 222 HB2 LYS 34 HB2 LYS 34 -14.255 1.503 -2.066 223 HB3 LYS 34 HB1 LYS 34 -15.592 0.442 -2.485 224 HG2 LYS 34 HG2 LYS 34 -14.928 -1.041 -0.611 225 HG3 LYS 34 HG1 LYS 34 -13.716 0.157 -0.153 226 HD2 LYS 34 HD2 LYS 34 -16.701 0.570 -0.273 227 HD3 LYS 34 HD1 LYS 34 -15.722 0.433 1.184 228 HE2 LYS 34 HE2 LYS 34 -14.610 2.496 0.706 229 HE3 LYS 34 HE1 LYS 34 -15.363 2.594 -0.884 230 HZ1 LYS 34 HZ1 LYS 34 -16.820 2.704 1.700 231 HZ2 LYS 34 HZ2 LYS 34 -17.506 2.850 0.162 232 HZ3 LYS 34 HZ3 LYS 34 -16.448 4.038 0.731 233 H THR 35 HN THR 35 -13.762 -1.144 -5.349 234 HA THR 35 HA THR 35 -13.725 1.377 -6.636 235 HB THR 35 HB THR 35 -11.441 1.539 -5.979 236 HG1 THR 35 HG1 THR 35 -10.759 2.073 -7.893 237 HG21 THR 35 HG21 THR 35 -9.763 -0.183 -6.485 238 HG22 THR 35 HG22 THR 35 -11.048 -1.235 -7.068 239 HG23 THR 35 HG23 THR 35 -11.006 -0.759 -5.375 240 H HIS 36 HN HIS 36 -12.726 0.738 -9.116 241 HA HIS 36 HA HIS 36 -14.691 -0.986 -10.201 242 HB2 HIS 36 HB2 HIS 36 -12.131 0.092 -11.392 243 HB3 HIS 36 HB1 HIS 36 -13.327 -0.816 -12.308 244 HD1 HIS 36 HD1 HIS 36 -12.356 2.511 -11.784 245 HD2 HIS 36 HD2 HIS 36 -16.037 0.585 -11.876 246 HE1 HIS 36 HE1 HIS 36 -14.050 4.311 -12.243 247 HE2 HIS 36 HE2 HIS 36 -16.283 3.146 -12.124 248 H LEU 37 HN LEU 37 -11.692 -1.575 -8.758 249 HA LEU 37 HA LEU 37 -11.023 -4.083 -9.848 250 HB2 LEU 37 HB2 LEU 37 -9.549 -2.705 -8.404 251 HB3 LEU 37 HB1 LEU 37 -10.610 -3.025 -7.050 252 HG LEU 37 HG LEU 37 -10.047 -5.439 -7.230 253 HD11 LEU 37 HD11 LEU 37 -9.392 -5.495 -9.578 254 HD12 LEU 37 HD12 LEU 37 -8.093 -6.087 -8.544 255 HD13 LEU 37 HD13 LEU 37 -8.006 -4.462 -9.224 256 HD21 LEU 37 HD21 LEU 37 -7.734 -5.145 -6.331 257 HD22 LEU 37 HD22 LEU 37 -8.943 -4.096 -5.591 258 HD23 LEU 37 HD23 LEU 37 -7.832 -3.446 -6.796 259 H PHE 38 HN PHE 38 -12.702 -3.244 -6.842 260 HA PHE 38 HA PHE 38 -14.953 -4.759 -7.066 261 HB2 PHE 38 HB2 PHE 38 -14.568 -6.818 -5.878 262 HB3 PHE 38 HB1 PHE 38 -13.401 -6.737 -7.187 263 HD1 PHE 38 HD1 PHE 38 -11.794 -4.591 -5.416 264 HD2 PHE 38 HD2 PHE 38 -13.111 -8.597 -4.871 265 HE1 PHE 38 HE1 PHE 38 -9.964 -4.975 -3.823 266 HE2 PHE 38 HE2 PHE 38 -11.280 -8.987 -3.282 267 HZ PHE 38 HZ PHE 38 -9.767 -7.296 -2.720 268 H SER 39 HN SER 39 -15.533 -5.565 -4.539 269 HA SER 39 HA SER 39 -14.442 -3.554 -2.712 270 HB2 SER 39 HB2 SER 39 -16.819 -3.310 -1.789 271 HB3 SER 39 HB1 SER 39 -16.486 -2.535 -3.338 272 HG SER 39 HG SER 39 -17.466 -5.167 -3.310 273 H GLU 40 HN GLU 40 -13.337 -4.882 -1.402 274 HA GLU 40 HA GLU 40 -14.710 -6.839 0.215 275 HB2 GLU 40 HB2 GLU 40 -12.722 -7.660 -1.887 276 HB3 GLU 40 HB1 GLU 40 -12.931 -8.602 -0.422 277 HG2 GLU 40 HG2 GLU 40 -15.142 -7.974 -2.360 278 HG3 GLU 40 HG1 GLU 40 -14.195 -9.461 -2.365 279 H THR 41 HN THR 41 -13.227 -7.797 1.835 280 HA THR 41 HA THR 41 -11.356 -5.802 2.762 281 HB THR 41 HB THR 41 -12.097 -8.444 4.003 282 HG1 THR 41 HG1 THR 41 -13.875 -6.973 3.811 283 HG21 THR 41 HG21 THR 41 -10.734 -6.023 5.185 284 HG22 THR 41 HG22 THR 41 -9.966 -7.572 4.832 285 HG23 THR 41 HG23 THR 41 -11.213 -7.468 6.074 286 H VAL 42 HN VAL 42 -9.265 -5.809 2.388 287 HA VAL 42 HA VAL 42 -7.979 -8.319 1.508 288 HB VAL 42 HB VAL 42 -6.699 -7.137 -0.102 289 HG11 VAL 42 HG11 VAL 42 -8.375 -6.128 -1.563 290 HG12 VAL 42 HG12 VAL 42 -9.499 -6.011 -0.205 291 HG13 VAL 42 HG13 VAL 42 -8.997 -7.592 -0.803 292 HG21 VAL 42 HG21 VAL 42 -7.795 -4.570 1.048 293 HG22 VAL 42 HG22 VAL 42 -6.758 -4.695 -0.373 294 HG23 VAL 42 HG23 VAL 42 -6.142 -5.165 1.211 295 H LYS 43 HN LYS 43 -5.610 -8.333 1.928 296 HA LYS 43 HA LYS 43 -4.900 -6.583 4.186 297 HB2 LYS 43 HB2 LYS 43 -4.759 -9.062 4.598 298 HB3 LYS 43 HB1 LYS 43 -3.501 -9.137 3.369 299 HG2 LYS 43 HG2 LYS 43 -2.115 -7.616 4.687 300 HG3 LYS 43 HG1 LYS 43 -3.379 -7.516 5.909 301 HD2 LYS 43 HD2 LYS 43 -1.858 -9.062 6.769 302 HD3 LYS 43 HD1 LYS 43 -3.148 -10.056 6.090 303 HE2 LYS 43 HE2 LYS 43 -1.045 -11.017 5.470 304 HE3 LYS 43 HE1 LYS 43 -1.777 -10.312 4.030 305 HZ1 LYS 43 HZ1 LYS 43 -0.350 -8.363 4.331 306 HZ2 LYS 43 HZ2 LYS 43 0.561 -9.773 4.140 307 HZ3 LYS 43 HZ3 LYS 43 0.375 -9.090 5.674 308 H VAL 44 HN VAL 44 -3.499 -5.011 3.788 309 HA VAL 44 HA VAL 44 -2.198 -5.007 1.152 310 HB VAL 44 HB VAL 44 -1.853 -2.478 2.325 311 HG11 VAL 44 HG11 VAL 44 -2.192 -2.950 -0.042 312 HG12 VAL 44 HG12 VAL 44 -3.336 -1.737 0.530 313 HG13 VAL 44 HG13 VAL 44 -3.868 -3.400 0.278 314 HG21 VAL 44 HG21 VAL 44 -4.147 -1.778 2.853 315 HG22 VAL 44 HG22 VAL 44 -3.566 -3.002 3.983 316 HG23 VAL 44 HG23 VAL 44 -4.688 -3.449 2.695 317 H THR 45 HN THR 45 -0.071 -4.027 1.012 318 HA THR 45 HA THR 45 1.672 -3.648 3.163 319 HB THR 45 HB THR 45 1.257 -6.085 3.533 320 HG1 THR 45 HG1 THR 45 3.216 -5.856 4.294 321 HG21 THR 45 HG21 THR 45 2.606 -6.427 0.854 322 HG22 THR 45 HG22 THR 45 0.903 -6.739 1.187 323 HG23 THR 45 HG23 THR 45 2.150 -7.722 1.959 324 H CYS 46 HN CYS 46 4.084 -4.301 2.134 325 HA CYS 46 HA CYS 46 4.012 -3.567 -0.700 326 HB2 CYS 46 HB2 CYS 46 5.700 -1.891 -0.458 327 HB3 CYS 46 HB1 CYS 46 4.455 -1.538 0.736 328 HG CYS 46 HG CYS 46 7.581 -2.780 1.276 329 H SER 47 HN SER 47 6.157 -3.994 -1.764 330 HA SER 47 HA SER 47 6.985 -6.636 -1.064 331 HB2 SER 47 HB2 SER 47 6.814 -5.778 -3.409 332 HB3 SER 47 HB1 SER 47 8.231 -4.775 -3.099 333 HG SER 47 HG SER 47 9.070 -6.572 -3.956 334 H LYS 48 HN LYS 48 9.545 -7.022 -1.164 335 HA LYS 48 HA LYS 48 10.310 -6.249 1.418 336 HB2 LYS 48 HB2 LYS 48 11.850 -7.553 -0.810 337 HB3 LYS 48 HB1 LYS 48 12.563 -7.238 0.766 338 HG2 LYS 48 HG2 LYS 48 10.769 -8.589 1.801 339 HG3 LYS 48 HG1 LYS 48 10.174 -8.973 0.184 340 HD2 LYS 48 HD2 LYS 48 12.233 -10.079 -0.370 341 HD3 LYS 48 HD1 LYS 48 12.971 -9.557 1.144 342 HE2 LYS 48 HE2 LYS 48 11.362 -10.900 2.396 343 HE3 LYS 48 HE1 LYS 48 10.602 -11.406 0.890 344 HZ1 LYS 48 HZ1 LYS 48 12.608 -12.527 0.253 345 HZ2 LYS 48 HZ2 LYS 48 12.165 -13.056 1.795 346 HZ3 LYS 48 HZ3 LYS 48 13.427 -11.949 1.615 347 H ASP 49 HN ASP 49 11.487 -5.072 -1.734 348 HA ASP 49 HA ASP 49 13.328 -3.251 -0.404 349 HB2 ASP 49 HB2 ASP 49 12.699 -3.489 -3.354 350 HB3 ASP 49 HB1 ASP 49 14.034 -2.591 -2.636 351 H GLY 50 HN GLY 50 10.136 -3.173 -0.795 352 HA2 GLY 50 HA2 GLY 50 8.630 -1.443 -0.537 353 HA3 GLY 50 HA1 GLY 50 9.979 -0.322 -0.543 354 H GLU 51 HN GLU 51 10.403 -2.088 -3.247 355 HA GLU 51 HA GLU 51 9.808 0.022 -4.990 356 HB2 GLU 51 HB2 GLU 51 10.365 -2.899 -5.475 357 HB3 GLU 51 HB1 GLU 51 10.126 -1.755 -6.789 358 HG2 GLU 51 HG2 GLU 51 12.245 -1.489 -4.669 359 HG3 GLU 51 HG1 GLU 51 12.501 -2.214 -6.254 360 H GLU 52 HN GLU 52 7.841 -2.613 -3.879 361 HA GLU 52 HA GLU 52 5.715 -1.782 -5.736 362 HB2 GLU 52 HB2 GLU 52 6.587 -4.540 -4.949 363 HB3 GLU 52 HB1 GLU 52 4.950 -4.233 -5.498 364 HG2 GLU 52 HG2 GLU 52 5.816 -3.407 -7.624 365 HG3 GLU 52 HG1 GLU 52 7.466 -3.675 -7.059 366 H VAL 53 HN VAL 53 3.645 -1.739 -4.958 367 HA VAL 53 HA VAL 53 3.251 -2.415 -2.121 368 HB VAL 53 HB VAL 53 1.416 -0.849 -3.952 369 HG11 VAL 53 HG11 VAL 53 0.226 -2.009 -2.161 370 HG12 VAL 53 HG12 VAL 53 0.210 -0.264 -1.904 371 HG13 VAL 53 HG13 VAL 53 1.302 -1.283 -0.966 372 HG21 VAL 53 HG21 VAL 53 3.473 0.383 -3.511 373 HG22 VAL 53 HG22 VAL 53 3.245 0.156 -1.777 374 HG23 VAL 53 HG23 VAL 53 2.098 1.129 -2.698 375 H GLN 54 HN GLN 54 1.969 -4.142 -1.622 376 HA GLN 54 HA GLN 54 0.517 -5.424 -3.821 377 HB2 GLN 54 HB2 GLN 54 1.451 -7.632 -3.125 378 HB3 GLN 54 HB1 GLN 54 2.639 -6.542 -3.821 379 HG2 GLN 54 HG2 GLN 54 3.331 -5.934 -1.503 380 HG3 GLN 54 HG1 GLN 54 2.250 -7.195 -0.915 381 HE21 GLN 54 HE21 GLN 54 4.093 -7.497 -3.868 382 HE22 GLN 54 HE22 GLN 54 5.175 -8.716 -3.291 383 H TRP 55 HN TRP 55 -1.115 -6.918 -3.126 384 HA TRP 55 HA TRP 55 -1.829 -6.781 -0.308 385 HB2 TRP 55 HB2 TRP 55 -4.215 -6.177 -0.988 386 HB3 TRP 55 HB1 TRP 55 -3.022 -4.884 -1.024 387 HD1 TRP 55 HD1 TRP 55 -5.161 -7.050 -3.348 388 HE1 TRP 55 HE1 TRP 55 -5.194 -5.959 -5.682 389 HE3 TRP 55 HE3 TRP 55 -1.710 -3.382 -2.559 390 HZ2 TRP 55 HZ2 TRP 55 -3.916 -3.816 -7.003 391 HZ3 TRP 55 HZ3 TRP 55 -1.172 -1.854 -4.399 392 HH2 TRP 55 HH2 TRP 55 -2.250 -2.058 -6.579 393 H PHE 56 HN PHE 56 -3.409 -8.232 0.343 394 HA PHE 56 HA PHE 56 -3.673 -10.573 -1.424 395 HB2 PHE 56 HB2 PHE 56 -3.726 -10.454 1.603 396 HB3 PHE 56 HB1 PHE 56 -3.772 -11.912 0.620 397 HD1 PHE 56 HD1 PHE 56 -1.777 -12.726 -0.491 398 HD2 PHE 56 HD2 PHE 56 -1.686 -9.217 1.909 399 HE1 PHE 56 HE1 PHE 56 0.680 -12.811 -0.463 400 HE2 PHE 56 HE2 PHE 56 0.769 -9.296 1.942 401 HZ PHE 56 HZ PHE 56 1.957 -11.093 0.752 402 H LYS 57 HN LYS 57 -5.635 -10.397 -2.341 403 HA LYS 57 HA LYS 57 -7.818 -9.156 -0.936 404 HB2 LYS 57 HB2 LYS 57 -7.838 -10.505 -3.636 405 HB3 LYS 57 HB1 LYS 57 -9.067 -9.427 -2.989 406 HG2 LYS 57 HG2 LYS 57 -7.396 -7.606 -2.944 407 HG3 LYS 57 HG1 LYS 57 -6.239 -8.696 -3.708 408 HD2 LYS 57 HD2 LYS 57 -8.873 -7.794 -4.870 409 HD3 LYS 57 HD1 LYS 57 -7.278 -7.221 -5.351 410 HE2 LYS 57 HE2 LYS 57 -6.707 -9.535 -6.036 411 HE3 LYS 57 HE1 LYS 57 -8.356 -10.022 -5.649 412 HZ1 LYS 57 HZ1 LYS 57 -8.160 -9.596 -7.992 413 HZ2 LYS 57 HZ2 LYS 57 -7.540 -8.051 -7.712 414 HZ3 LYS 57 HZ3 LYS 57 -9.142 -8.405 -7.304 415 H GLY 58 HN GLY 58 -8.971 -10.222 0.477 416 HA2 GLY 58 HA2 GLY 58 -10.275 -11.859 1.416 417 HA3 GLY 58 HA1 GLY 58 -10.276 -12.665 -0.145 418 H LYS 59 HN LYS 59 -9.724 -14.691 0.200 419 HA LYS 59 HA LYS 59 -7.667 -15.328 2.171 420 HB2 LYS 59 HB2 LYS 59 -8.444 -17.691 1.791 421 HB3 LYS 59 HB1 LYS 59 -9.659 -16.606 2.451 422 HG2 LYS 59 HG2 LYS 59 -10.594 -16.337 0.175 423 HG3 LYS 59 HG1 LYS 59 -9.430 -17.530 -0.405 424 HD2 LYS 59 HD2 LYS 59 -10.375 -19.183 1.147 425 HD3 LYS 59 HD1 LYS 59 -11.555 -17.988 1.686 426 HE2 LYS 59 HE2 LYS 59 -12.569 -19.469 0.066 427 HE3 LYS 59 HE1 LYS 59 -12.429 -17.849 -0.612 428 HZ1 LYS 59 HZ1 LYS 59 -11.783 -19.517 -2.215 429 HZ2 LYS 59 HZ2 LYS 59 -10.609 -20.129 -1.163 430 HZ3 LYS 59 HZ3 LYS 59 -10.443 -18.572 -1.801 431 H SER 60 HN SER 60 -6.448 -14.117 0.247 432 HA SER 60 HA SER 60 -5.643 -15.551 -2.023 433 HB2 SER 60 HB2 SER 60 -5.246 -13.103 -1.595 434 HB3 SER 60 HB1 SER 60 -3.993 -13.559 -0.445 435 HG SER 60 HG SER 60 -2.683 -14.080 -2.042 436 H THR 61 HN THR 61 -3.966 -16.962 -2.397 437 HA THR 61 HA THR 61 -3.215 -18.744 -0.392 438 HB THR 61 HB THR 61 -1.687 -18.214 -2.950 439 HG1 THR 61 HG1 THR 61 -4.168 -19.439 -2.445 440 HG21 THR 61 HG21 THR 61 -0.548 -19.711 -1.390 441 HG22 THR 61 HG22 THR 61 -1.133 -20.607 -2.792 442 HG23 THR 61 HG23 THR 61 -2.002 -20.701 -1.261 443 H ALA 62 HN ALA 62 -1.863 -18.490 1.253 444 HA ALA 62 HA ALA 62 -0.249 -16.115 1.412 445 HB1 ALA 62 HB1 ALA 62 0.147 -16.807 3.715 446 HB2 ALA 62 HB2 ALA 62 -0.691 -18.323 3.406 447 HB3 ALA 62 HB3 ALA 62 -1.564 -16.793 3.314 448 H GLY 63 HN GLY 63 0.769 -17.477 -0.552 449 HA2 GLY 63 HA2 GLY 63 2.479 -18.948 -1.298 450 HA3 GLY 63 HA1 GLY 63 3.289 -17.493 -0.768 451 H ALA 64 HN ALA 64 5.065 -17.921 0.260 452 HA ALA 64 HA ALA 64 5.463 -20.460 1.601 453 HB1 ALA 64 HB1 ALA 64 7.209 -19.505 0.145 454 HB2 ALA 64 HB2 ALA 64 7.781 -19.780 1.790 455 HB3 ALA 64 HB3 ALA 64 7.373 -18.146 1.260 456 H GLN 65 HN GLN 65 3.618 -19.556 3.070 457 HA GLN 65 HA GLN 65 3.043 -19.326 5.248 458 HB2 GLN 65 HB2 GLN 65 5.972 -18.970 5.887 459 HB3 GLN 65 HB1 GLN 65 4.688 -19.427 6.998 460 HG2 GLN 65 HG2 GLN 65 5.766 -21.060 4.714 461 HG3 GLN 65 HG1 GLN 65 5.985 -21.365 6.436 462 HE21 GLN 65 HE21 GLN 65 4.787 -22.971 4.257 463 HE22 GLN 65 HE22 GLN 65 3.212 -23.401 4.829 464 H ASP 66 HN ASP 66 5.680 -17.055 4.498 465 HA ASP 66 HA ASP 66 4.426 -14.929 5.984 466 HB2 ASP 66 HB2 ASP 66 6.842 -15.074 4.200 467 HB3 ASP 66 HB1 ASP 66 6.238 -13.533 4.796 468 H ARG 67 HN ARG 67 3.262 -16.331 3.529 469 HA ARG 67 HA ARG 67 1.913 -15.904 1.779 470 HB2 ARG 67 HB2 ARG 67 1.441 -13.072 2.506 471 HB3 ARG 67 HB1 ARG 67 0.299 -14.366 2.165 472 HG2 ARG 67 HG2 ARG 67 0.921 -15.303 4.447 473 HG3 ARG 67 HG1 ARG 67 1.688 -13.750 4.742 474 HD2 ARG 67 HD2 ARG 67 -0.426 -12.612 4.304 475 HD3 ARG 67 HD1 ARG 67 -1.201 -14.166 4.001 476 HE ARG 67 HE ARG 67 0.047 -13.678 6.610 477 HH11 ARG 67 HH11 ARG 67 -2.850 -14.146 4.694 478 HH12 ARG 67 HH12 ARG 67 -3.859 -14.463 6.067 479 HH21 ARG 67 HH21 ARG 67 -1.290 -14.077 8.419 480 HH22 ARG 67 HH22 ARG 67 -2.977 -14.404 8.188 481 H LYS 68 HN LYS 68 3.733 -16.089 0.422 482 HA LYS 68 HA LYS 68 4.919 -13.626 -0.575 483 HB2 LYS 68 HB2 LYS 68 5.518 -16.507 -1.231 484 HB3 LYS 68 HB1 LYS 68 6.408 -15.124 -1.848 485 HG2 LYS 68 HG2 LYS 68 6.147 -15.834 1.053 486 HG3 LYS 68 HG1 LYS 68 7.523 -16.263 0.034 487 HD2 LYS 68 HD2 LYS 68 7.782 -13.797 -0.427 488 HD3 LYS 68 HD1 LYS 68 6.590 -13.519 0.844 489 HE2 LYS 68 HE2 LYS 68 8.774 -13.299 1.802 490 HE3 LYS 68 HE1 LYS 68 8.046 -14.790 2.403 491 HZ1 LYS 68 HZ1 LYS 68 9.353 -16.054 0.866 492 HZ2 LYS 68 HZ2 LYS 68 10.387 -15.053 1.747 493 HZ3 LYS 68 HZ3 LYS 68 9.981 -14.657 0.155 494 H LYS 69 HN LYS 69 2.088 -14.705 -1.095 495 HA LYS 69 HA LYS 69 2.198 -14.471 -4.013 496 HB2 LYS 69 HB2 LYS 69 1.927 -16.839 -3.445 497 HB3 LYS 69 HB1 LYS 69 0.530 -16.453 -2.455 498 HG2 LYS 69 HG2 LYS 69 -0.100 -17.395 -4.626 499 HG3 LYS 69 HG1 LYS 69 -0.719 -15.759 -4.403 500 HD2 LYS 69 HD2 LYS 69 0.143 -16.060 -6.661 501 HD3 LYS 69 HD1 LYS 69 1.111 -14.881 -5.776 502 HE2 LYS 69 HE2 LYS 69 2.525 -16.384 -7.066 503 HE3 LYS 69 HE1 LYS 69 2.800 -16.590 -5.339 504 HZ1 LYS 69 HZ1 LYS 69 2.668 -18.702 -6.546 505 HZ2 LYS 69 HZ2 LYS 69 1.078 -18.351 -6.997 506 HZ3 LYS 69 HZ3 LYS 69 1.465 -18.571 -5.366 507 HA PRO 70 HA PRO 70 -0.821 -11.393 -2.438 508 HB2 PRO 70 HB2 PRO 70 0.246 -9.769 -4.616 509 HB3 PRO 70 HB1 PRO 70 0.198 -9.419 -2.886 510 HG2 PRO 70 HG2 PRO 70 2.501 -9.940 -4.198 511 HG3 PRO 70 HG1 PRO 70 2.249 -10.378 -2.499 512 HD2 PRO 70 HD2 PRO 70 2.086 -12.105 -4.945 513 HD3 PRO 70 HD1 PRO 70 2.810 -12.460 -3.361 514 H SER 71 HN SER 71 -2.605 -10.402 -3.582 515 HA SER 71 HA SER 71 -3.309 -11.913 -6.007 516 HB2 SER 71 HB2 SER 71 -4.748 -12.201 -3.957 517 HB3 SER 71 HB1 SER 71 -5.179 -10.499 -4.090 518 HG SER 71 HG SER 71 -5.518 -11.787 -6.448 519 H GLY 72 HN GLY 72 -1.842 -9.257 -5.415 520 HA2 GLY 72 HA2 GLY 72 -2.360 -7.946 -7.787 521 HA3 GLY 72 HA1 GLY 72 -3.390 -7.186 -6.580 522 H GLY 73 HN GLY 73 -1.226 -5.924 -7.974 523 HA2 GLY 73 HA2 GLY 73 0.011 -4.596 -5.847 524 HA3 GLY 73 HA1 GLY 73 1.126 -5.818 -6.439 525 H PHE 74 HN PHE 74 1.635 -3.062 -6.504 526 HA PHE 74 HA PHE 74 2.222 -2.767 -9.306 527 HB2 PHE 74 HB2 PHE 74 1.133 -0.655 -9.662 528 HB3 PHE 74 HB1 PHE 74 -0.071 -1.800 -9.109 529 HD1 PHE 74 HD1 PHE 74 0.241 -1.768 -6.245 530 HD2 PHE 74 HD2 PHE 74 0.422 1.466 -8.995 531 HE1 PHE 74 HE1 PHE 74 -0.411 -0.227 -4.459 532 HE2 PHE 74 HE2 PHE 74 -0.244 3.022 -7.203 533 HZ PHE 74 HZ PHE 74 -0.733 2.279 -5.056 534 HA PRO 75 HA PRO 75 5.787 -0.832 -7.666 535 HB2 PRO 75 HB2 PRO 75 6.014 1.043 -9.858 536 HB3 PRO 75 HB1 PRO 75 6.973 -0.397 -9.532 537 HG2 PRO 75 HG2 PRO 75 5.232 -0.176 -11.619 538 HG3 PRO 75 HG1 PRO 75 5.674 -1.716 -10.863 539 HD2 PRO 75 HD2 PRO 75 3.200 -0.078 -10.520 540 HD3 PRO 75 HD1 PRO 75 3.398 -1.837 -10.554 541 H VAL 76 HN VAL 76 6.389 0.749 -6.388 542 HA VAL 76 HA VAL 76 4.542 2.655 -5.474 543 HB VAL 76 HB VAL 76 7.389 2.000 -4.909 544 HG11 VAL 76 HG11 VAL 76 6.053 4.490 -3.864 545 HG12 VAL 76 HG12 VAL 76 7.414 4.444 -4.985 546 HG13 VAL 76 HG13 VAL 76 7.606 3.845 -3.334 547 HG21 VAL 76 HG21 VAL 76 4.920 2.293 -3.208 548 HG22 VAL 76 HG22 VAL 76 6.499 1.745 -2.642 549 HG23 VAL 76 HG23 VAL 76 5.601 0.784 -3.816 550 H ASP 77 HN ASP 77 7.369 2.983 -7.583 551 HA ASP 77 HA ASP 77 7.250 5.821 -7.650 552 HB2 ASP 77 HB2 ASP 77 8.739 3.721 -9.170 553 HB3 ASP 77 HB1 ASP 77 8.716 5.367 -9.760 554 H LYS 78 HN LYS 78 5.329 3.462 -9.062 555 HA LYS 78 HA LYS 78 4.730 5.049 -11.439 556 HB2 LYS 78 HB2 LYS 78 4.193 2.227 -10.624 557 HB3 LYS 78 HB1 LYS 78 3.122 2.981 -11.796 558 HG2 LYS 78 HG2 LYS 78 4.921 1.666 -12.836 559 HG3 LYS 78 HG1 LYS 78 4.952 3.364 -13.309 560 HD2 LYS 78 HD2 LYS 78 6.731 3.750 -11.624 561 HD3 LYS 78 HD1 LYS 78 6.735 2.023 -11.277 562 HE2 LYS 78 HE2 LYS 78 7.291 3.223 -13.981 563 HE3 LYS 78 HE1 LYS 78 8.533 2.743 -12.830 564 HZ1 LYS 78 HZ1 LYS 78 7.748 0.475 -12.967 565 HZ2 LYS 78 HZ2 LYS 78 8.140 1.046 -14.509 566 HZ3 LYS 78 HZ3 LYS 78 6.522 0.926 -14.040 567 H ILE 79 HN ILE 79 3.643 4.739 -8.288 568 HA ILE 79 HA ILE 79 0.875 5.158 -8.587 569 HB ILE 79 HB ILE 79 2.587 6.295 -6.372 570 HG12 ILE 79 HG12 ILE 79 1.375 3.531 -6.611 571 HG13 ILE 79 HG11 ILE 79 3.090 3.912 -6.623 572 HG21 ILE 79 HG21 ILE 79 0.524 6.040 -5.046 573 HG22 ILE 79 HG22 ILE 79 -0.316 5.482 -6.494 574 HG23 ILE 79 HG23 ILE 79 0.311 7.128 -6.417 575 HD11 ILE 79 HD11 ILE 79 2.920 4.711 -4.321 576 HD12 ILE 79 HD12 ILE 79 2.407 3.030 -4.477 577 HD13 ILE 79 HD13 ILE 79 1.204 4.309 -4.315 578 H THR 80 HN THR 80 -0.058 6.797 -9.635 579 HA THR 80 HA THR 80 1.503 9.094 -10.355 580 HB THR 80 HB THR 80 -0.006 8.042 -11.978 581 HG1 THR 80 HG1 THR 80 0.098 10.689 -11.391 582 HG21 THR 80 HG21 THR 80 -2.232 9.127 -10.261 583 HG22 THR 80 HG22 THR 80 -1.836 7.422 -10.482 584 HG23 THR 80 HG23 THR 80 -2.419 8.378 -11.846 585 H SER 81 HN SER 81 -1.020 8.358 -8.050 586 HA SER 81 HA SER 81 -0.562 10.882 -6.739 587 HB2 SER 81 HB2 SER 81 -3.252 10.259 -7.964 588 HB3 SER 81 HB1 SER 81 -3.021 11.477 -6.709 589 HG SER 81 HG SER 81 -1.249 11.765 -8.762 590 H VAL 82 HN VAL 82 -0.674 10.622 -4.629 591 HA VAL 82 HA VAL 82 -2.341 8.465 -3.533 592 HB VAL 82 HB VAL 82 -0.025 7.930 -3.115 593 HG11 VAL 82 HG11 VAL 82 0.281 10.635 -1.822 594 HG12 VAL 82 HG12 VAL 82 0.873 10.212 -3.428 595 HG13 VAL 82 HG13 VAL 82 1.527 9.398 -2.007 596 HG21 VAL 82 HG21 VAL 82 -1.259 9.069 -0.607 597 HG22 VAL 82 HG22 VAL 82 0.015 7.851 -0.678 598 HG23 VAL 82 HG23 VAL 82 -1.594 7.480 -1.292 599 H LYS 83 HN LYS 83 -4.129 9.384 -2.770 600 HA LYS 83 HA LYS 83 -3.921 11.931 -1.333 601 HB2 LYS 83 HB2 LYS 83 -6.271 11.965 -2.948 602 HB3 LYS 83 HB1 LYS 83 -4.892 13.055 -3.008 603 HG2 LYS 83 HG2 LYS 83 -4.132 12.151 -4.897 604 HG3 LYS 83 HG1 LYS 83 -4.333 10.509 -4.285 605 HD2 LYS 83 HD2 LYS 83 -6.838 10.905 -4.718 606 HD3 LYS 83 HD1 LYS 83 -6.288 12.239 -5.736 607 HE2 LYS 83 HE2 LYS 83 -4.863 10.642 -6.970 608 HE3 LYS 83 HE1 LYS 83 -5.549 9.334 -6.012 609 HZ1 LYS 83 HZ1 LYS 83 -7.750 9.976 -6.895 610 HZ2 LYS 83 HZ2 LYS 83 -6.678 9.455 -8.094 611 HZ3 LYS 83 HZ3 LYS 83 -6.994 11.105 -7.903 612 H SER 84 HN SER 84 -5.902 12.478 -0.179 613 HA SER 84 HA SER 84 -7.531 10.128 0.483 614 HB2 SER 84 HB2 SER 84 -8.122 11.380 2.562 615 HB3 SER 84 HB1 SER 84 -6.401 11.023 2.435 616 HG SER 84 HG SER 84 -5.967 13.084 2.296 617 H GLN 85 HN GLN 85 -9.846 10.501 0.701 618 HA GLN 85 HA GLN 85 -10.991 11.792 -1.492 619 HB2 GLN 85 HB2 GLN 85 -11.878 10.239 0.719 620 HB3 GLN 85 HB1 GLN 85 -12.919 11.642 0.586 621 HG2 GLN 85 HG2 GLN 85 -13.895 9.879 -0.627 622 HG3 GLN 85 HG1 GLN 85 -13.306 11.080 -1.776 623 HE21 GLN 85 HE21 GLN 85 -11.211 8.877 -0.081 624 HE22 GLN 85 HE22 GLN 85 -10.771 7.919 -1.444 625 H ALA 86 HN ALA 86 -12.975 13.393 -1.091 626 HA ALA 86 HA ALA 86 -11.887 15.862 -0.226 627 HB1 ALA 86 HB1 ALA 86 -14.095 16.786 -0.635 628 HB2 ALA 86 HB2 ALA 86 -14.782 15.166 -0.711 629 HB3 ALA 86 HB3 ALA 86 -13.639 15.697 -1.945 630 H ASP 87 HN ASP 87 -14.315 13.681 1.211 631 HA ASP 87 HA ASP 87 -14.095 15.144 3.743 632 HB2 ASP 87 HB2 ASP 87 -16.023 13.920 4.445 633 HB3 ASP 87 HB1 ASP 87 -16.349 14.449 2.808 634 H ASN 88 HN ASN 88 -13.270 12.272 2.159 635 HA ASN 88 HA ASN 88 -12.405 10.251 2.781 636 HB2 ASN 88 HB2 ASN 88 -10.063 10.502 3.334 637 HB3 ASN 88 HB1 ASN 88 -10.559 11.639 2.096 638 HD21 ASN 88 HD21 ASN 88 -9.445 11.302 5.364 639 HD22 ASN 88 HD22 ASN 88 -9.118 12.975 5.638 640 H THR 89 HN THR 89 -14.277 10.726 4.755 641 HA THR 89 HA THR 89 -13.389 10.737 7.372 642 HB THR 89 HB THR 89 -15.690 9.068 6.343 643 HG1 THR 89 HG1 THR 89 -15.953 11.203 5.629 644 HG21 THR 89 HG21 THR 89 -16.620 9.399 8.570 645 HG22 THR 89 HG22 THR 89 -15.218 10.364 9.030 646 HG23 THR 89 HG23 THR 89 -15.027 8.645 8.682 647 H LYS 90 HN LYS 90 -14.434 7.731 5.767 648 HA LYS 90 HA LYS 90 -12.089 6.424 6.955 649 HB2 LYS 90 HB2 LYS 90 -13.355 4.293 6.731 650 HB3 LYS 90 HB1 LYS 90 -14.078 5.445 7.845 651 HG2 LYS 90 HG2 LYS 90 -15.787 5.994 6.303 652 HG3 LYS 90 HG1 LYS 90 -14.985 5.117 5.000 653 HD2 LYS 90 HD2 LYS 90 -16.902 3.879 5.966 654 HD3 LYS 90 HD1 LYS 90 -15.373 3.012 6.115 655 HE2 LYS 90 HE2 LYS 90 -16.591 2.810 8.179 656 HE3 LYS 90 HE1 LYS 90 -15.184 3.839 8.444 657 HZ1 LYS 90 HZ1 LYS 90 -16.587 5.773 8.337 658 HZ2 LYS 90 HZ2 LYS 90 -17.204 4.704 9.491 659 HZ3 LYS 90 HZ3 LYS 90 -17.944 4.830 7.978 660 H VAL 91 HN VAL 91 -12.523 7.899 4.302 661 HA VAL 91 HA VAL 91 -12.118 5.649 2.438 662 HB VAL 91 HB VAL 91 -12.938 8.387 1.557 663 HG11 VAL 91 HG11 VAL 91 -12.300 6.763 -0.143 664 HG12 VAL 91 HG12 VAL 91 -14.026 7.112 -0.249 665 HG13 VAL 91 HG13 VAL 91 -13.474 5.608 0.488 666 HG21 VAL 91 HG21 VAL 91 -15.300 7.729 1.760 667 HG22 VAL 91 HG22 VAL 91 -14.506 7.825 3.331 668 HG23 VAL 91 HG23 VAL 91 -14.812 6.253 2.593 669 H LEU 92 HN LEU 92 -10.221 5.462 1.459 670 HA LEU 92 HA LEU 92 -8.491 7.831 1.113 671 HB2 LEU 92 HB2 LEU 92 -7.924 4.952 1.595 672 HB3 LEU 92 HB1 LEU 92 -6.834 5.817 0.533 673 HG LEU 92 HG LEU 92 -6.259 7.368 2.300 674 HD11 LEU 92 HD11 LEU 92 -8.209 5.826 4.001 675 HD12 LEU 92 HD12 LEU 92 -8.390 7.493 3.454 676 HD13 LEU 92 HD13 LEU 92 -7.099 7.068 4.579 677 HD21 LEU 92 HD21 LEU 92 -5.183 5.778 3.849 678 HD22 LEU 92 HD22 LEU 92 -4.976 5.333 2.156 679 HD23 LEU 92 HD23 LEU 92 -6.154 4.481 3.155 680 H VAL 93 HN VAL 93 -7.446 8.106 -0.969 681 HA VAL 93 HA VAL 93 -8.483 6.406 -3.110 682 HB VAL 93 HB VAL 93 -10.002 8.214 -3.231 683 HG11 VAL 93 HG11 VAL 93 -9.255 10.581 -3.387 684 HG12 VAL 93 HG12 VAL 93 -7.628 10.040 -2.971 685 HG13 VAL 93 HG13 VAL 93 -8.951 9.825 -1.823 686 HG21 VAL 93 HG21 VAL 93 -9.145 7.552 -5.395 687 HG22 VAL 93 HG22 VAL 93 -7.823 8.710 -5.248 688 HG23 VAL 93 HG23 VAL 93 -9.487 9.282 -5.376 689 H ILE 94 HN ILE 94 -6.745 5.514 -3.938 690 HA ILE 94 HA ILE 94 -4.376 7.194 -4.478 691 HB ILE 94 HB ILE 94 -4.576 4.330 -3.571 692 HG12 ILE 94 HG12 ILE 94 -2.709 5.067 -2.034 693 HG13 ILE 94 HG11 ILE 94 -2.965 6.712 -2.599 694 HG21 ILE 94 HG21 ILE 94 -2.173 5.580 -4.891 695 HG22 ILE 94 HG22 ILE 94 -3.176 4.285 -5.548 696 HG23 ILE 94 HG23 ILE 94 -2.208 4.004 -4.097 697 HD11 ILE 94 HD11 ILE 94 -5.195 6.712 -1.699 698 HD12 ILE 94 HD12 ILE 94 -4.051 6.224 -0.447 699 HD13 ILE 94 HD13 ILE 94 -5.049 5.014 -1.252 700 H THR 95 HN THR 95 -3.669 7.233 -6.568 701 HA THR 95 HA THR 95 -4.934 5.342 -8.449 702 HB THR 95 HB THR 95 -4.283 8.235 -9.051 703 HG1 THR 95 HG1 THR 95 -6.899 7.163 -8.801 704 HG21 THR 95 HG21 THR 95 -5.645 7.862 -11.056 705 HG22 THR 95 HG22 THR 95 -5.869 6.176 -10.591 706 HG23 THR 95 HG23 THR 95 -4.262 6.768 -11.012 707 H VAL 96 HN VAL 96 -3.643 4.575 -10.122 708 HA VAL 96 HA VAL 96 -0.787 5.215 -9.923 709 HB VAL 96 HB VAL 96 -1.001 3.024 -9.109 710 HG11 VAL 96 HG11 VAL 96 -2.777 2.403 -11.456 711 HG12 VAL 96 HG12 VAL 96 -3.299 2.628 -9.787 712 HG13 VAL 96 HG13 VAL 96 -2.267 1.263 -10.210 713 HG21 VAL 96 HG21 VAL 96 -0.277 2.928 -12.023 714 HG22 VAL 96 HG22 VAL 96 -0.013 1.591 -10.908 715 HG23 VAL 96 HG23 VAL 96 0.811 3.130 -10.650 716 H ASN 97 HN ASN 97 0.421 5.366 -11.825 717 HA ASN 97 HA ASN 97 -1.122 5.315 -14.333 718 HB2 ASN 97 HB2 ASN 97 -0.650 7.641 -13.676 719 HB3 ASN 97 HB1 ASN 97 1.071 7.273 -13.613 720 HD21 ASN 97 HD21 ASN 97 -1.665 7.883 -15.628 721 HD22 ASN 97 HD22 ASN 97 -0.799 8.024 -17.118 722 H ASN 98 HN ASN 98 -0.212 4.345 -16.029 723 HA ASN 98 HA ASN 98 1.430 3.509 -17.410 724 HB2 ASN 98 HB2 ASN 98 3.307 4.466 -16.127 725 HB3 ASN 98 HB1 ASN 98 3.229 3.114 -15.015 726 HD21 ASN 98 HD21 ASN 98 3.986 1.100 -15.666 727 HD22 ASN 98 HD22 ASN 98 4.915 0.887 -17.108 728 HA PRO 99 HA PRO 99 0.636 -0.887 -15.407 729 HB2 PRO 99 HB2 PRO 99 -0.477 0.076 -12.816 730 HB3 PRO 99 HB1 PRO 99 0.406 -1.414 -13.175 731 HG2 PRO 99 HG2 PRO 99 1.610 0.568 -11.900 732 HG3 PRO 99 HG1 PRO 99 2.470 -0.348 -13.154 733 HD2 PRO 99 HD2 PRO 99 1.234 2.373 -13.303 734 HD3 PRO 99 HD1 PRO 99 2.760 1.782 -13.987 735 H GLN 100 HN GLN 100 -1.641 -1.768 -14.962 736 HA GLN 100 HA GLN 100 -3.449 -0.440 -16.636 737 HB2 GLN 100 HB2 GLN 100 -4.094 -2.512 -14.531 738 HB3 GLN 100 HB1 GLN 100 -5.081 -2.103 -15.927 739 HG2 GLN 100 HG2 GLN 100 -3.342 -2.945 -17.412 740 HG3 GLN 100 HG1 GLN 100 -2.338 -3.338 -16.018 741 HE21 GLN 100 HE21 GLN 100 -4.664 -4.208 -14.447 742 HE22 GLN 100 HE22 GLN 100 -5.098 -5.759 -15.070 743 HA PRO 101 HA PRO 101 -4.445 2.948 -13.960 744 HB2 PRO 101 HB2 PRO 101 -6.853 2.998 -15.724 745 HB3 PRO 101 HB1 PRO 101 -5.766 4.314 -15.265 746 HG2 PRO 101 HG2 PRO 101 -5.590 3.200 -17.670 747 HG3 PRO 101 HG1 PRO 101 -4.131 3.669 -16.778 748 HD2 PRO 101 HD2 PRO 101 -5.283 0.962 -17.240 749 HD3 PRO 101 HD1 PRO 101 -3.585 1.463 -17.107 750 H THR 102 HN THR 102 -5.075 2.435 -12.001 751 HA THR 102 HA THR 102 -7.873 1.759 -11.571 752 HB THR 102 HB THR 102 -5.696 0.257 -10.106 753 HG1 THR 102 HG1 THR 102 -5.732 -0.291 -12.385 754 HG21 THR 102 HG21 THR 102 -7.854 0.417 -8.962 755 HG22 THR 102 HG22 THR 102 -7.546 -1.237 -9.491 756 HG23 THR 102 HG23 THR 102 -8.668 -0.216 -10.391 757 H THR 103 HN THR 103 -8.661 2.524 -9.610 758 HA THR 103 HA THR 103 -6.786 4.170 -8.037 759 HB THR 103 HB THR 103 -9.696 4.740 -8.650 760 HG1 THR 103 HG1 THR 103 -8.944 5.942 -10.212 761 HG21 THR 103 HG21 THR 103 -9.080 5.449 -6.388 762 HG22 THR 103 HG22 THR 103 -9.360 6.834 -7.443 763 HG23 THR 103 HG23 THR 103 -7.712 6.348 -7.043 764 H TYR 104 HN TYR 104 -6.477 3.206 -6.159 765 HA TYR 104 HA TYR 104 -8.443 1.289 -5.197 766 HB2 TYR 104 HB2 TYR 104 -5.659 1.885 -4.177 767 HB3 TYR 104 HB1 TYR 104 -6.665 0.507 -3.729 768 HD1 TYR 104 HD1 TYR 104 -7.240 -1.201 -5.481 769 HD2 TYR 104 HD2 TYR 104 -4.321 1.829 -6.128 770 HE1 TYR 104 HE1 TYR 104 -6.322 -2.484 -7.376 771 HE2 TYR 104 HE2 TYR 104 -3.401 0.556 -8.019 772 HH TYR 104 HH TYR 104 -5.014 -2.047 -9.443 773 H ASN 105 HN ASN 105 -9.861 1.782 -3.690 774 HA ASN 105 HA ASN 105 -9.339 4.094 -1.965 775 HB2 ASN 105 HB2 ASN 105 -11.944 2.636 -2.486 776 HB3 ASN 105 HB1 ASN 105 -11.748 3.987 -1.379 777 HD21 ASN 105 HD21 ASN 105 -10.300 3.636 -4.576 778 HD22 ASN 105 HD22 ASN 105 -11.128 4.976 -5.289 779 H PHE 106 HN PHE 106 -8.268 3.469 -0.217 780 HA PHE 106 HA PHE 106 -8.750 0.869 0.960 781 HB2 PHE 106 HB2 PHE 106 -6.952 3.109 1.919 782 HB3 PHE 106 HB1 PHE 106 -6.940 1.451 2.500 783 HD1 PHE 106 HD1 PHE 106 -6.389 -0.383 0.755 784 HD2 PHE 106 HD2 PHE 106 -5.568 3.749 0.191 785 HE1 PHE 106 HE1 PHE 106 -4.723 -0.957 -0.955 786 HE2 PHE 106 HE2 PHE 106 -3.900 3.185 -1.527 787 HZ PHE 106 HZ PHE 106 -3.476 0.829 -2.102 788 H THR 107 HN THR 107 -10.459 0.608 2.193 789 HA THR 107 HA THR 107 -11.314 2.818 3.950 790 HB THR 107 HB THR 107 -13.102 0.718 2.704 791 HG1 THR 107 HG1 THR 107 -12.053 2.304 1.229 792 HG21 THR 107 HG21 THR 107 -13.988 1.696 4.755 793 HG22 THR 107 HG22 THR 107 -14.904 2.260 3.357 794 HG23 THR 107 HG23 THR 107 -13.715 3.318 4.116 795 H PHE 108 HN PHE 108 -11.636 2.308 6.090 796 HA PHE 108 HA PHE 108 -11.832 -0.508 6.819 797 HB2 PHE 108 HB2 PHE 108 -9.384 0.357 6.975 798 HB3 PHE 108 HB1 PHE 108 -9.952 1.264 8.367 799 HD1 PHE 108 HD1 PHE 108 -9.336 0.308 10.346 800 HD2 PHE 108 HD2 PHE 108 -10.483 -2.207 7.115 801 HE1 PHE 108 HE1 PHE 108 -9.010 -1.668 11.775 802 HE2 PHE 108 HE2 PHE 108 -10.162 -4.187 8.535 803 HZ PHE 108 HZ PHE 108 -9.442 -3.918 10.875 804 H LYS 109 HN LYS 109 -12.268 -0.659 9.271 805 HA LYS 109 HA LYS 109 -14.579 0.882 9.856 806 HB2 LYS 109 HB2 LYS 109 -14.156 -1.481 10.592 807 HB3 LYS 109 HB1 LYS 109 -12.952 -0.872 11.713 808 HG2 LYS 109 HG2 LYS 109 -15.781 0.096 11.834 809 HG3 LYS 109 HG1 LYS 109 -15.308 -1.429 12.579 810 HD2 LYS 109 HD2 LYS 109 -13.598 -0.220 13.887 811 HD3 LYS 109 HD1 LYS 109 -14.162 1.295 13.180 812 HE2 LYS 109 HE2 LYS 109 -16.393 0.876 14.143 813 HE3 LYS 109 HE1 LYS 109 -15.770 -0.590 14.898 814 HZ1 LYS 109 HZ1 LYS 109 -14.859 2.183 15.430 815 HZ2 LYS 109 HZ2 LYS 109 -14.167 0.797 16.104 816 HZ3 LYS 109 HZ3 LYS 109 -15.765 1.206 16.473 817 H SER 110 HN SER 110 -11.250 0.899 10.989 818 HA SER 110 HA SER 110 -11.610 2.889 12.987 819 HB2 SER 110 HB2 SER 110 -9.765 1.300 13.114 820 HB3 SER 110 HB1 SER 110 -9.126 1.895 11.584 821 HG SER 110 HG SER 110 -8.659 2.813 14.039 822 HA PRO 111 HA PRO 111 -11.362 6.422 10.181 823 HB2 PRO 111 HB2 PRO 111 -11.436 7.990 12.653 824 HB3 PRO 111 HB1 PRO 111 -12.575 7.980 11.303 825 HG2 PRO 111 HG2 PRO 111 -13.197 6.955 13.719 826 HG3 PRO 111 HG1 PRO 111 -13.837 6.286 12.206 827 HD2 PRO 111 HD2 PRO 111 -11.583 5.290 13.919 828 HD3 PRO 111 HD1 PRO 111 -12.868 4.372 13.100 829 H GLY 112 HN GLY 112 -9.192 5.129 12.326 830 HA2 GLY 112 HA2 GLY 112 -7.239 7.283 11.834 831 HA3 GLY 112 HA1 GLY 112 -7.129 6.115 13.140 832 H GLU 113 HN GLU 113 -7.685 3.775 11.705 833 HA GLU 113 HA GLU 113 -5.123 2.945 11.164 834 HB2 GLU 113 HB2 GLU 113 -7.122 1.501 11.617 835 HB3 GLU 113 HB1 GLU 113 -7.615 1.754 9.949 836 HG2 GLU 113 HG2 GLU 113 -6.508 -0.369 10.163 837 HG3 GLU 113 HG1 GLU 113 -5.524 0.722 9.190 838 H ARG 114 HN ARG 114 -7.535 4.050 8.839 839 HA ARG 114 HA ARG 114 -6.085 3.202 6.540 840 HB2 ARG 114 HB2 ARG 114 -8.135 5.387 6.485 841 HB3 ARG 114 HB1 ARG 114 -7.782 4.175 5.263 842 HG2 ARG 114 HG2 ARG 114 -9.214 2.714 6.137 843 HG3 ARG 114 HG1 ARG 114 -8.703 3.050 7.791 844 HD2 ARG 114 HD2 ARG 114 -10.612 4.667 6.112 845 HD3 ARG 114 HD1 ARG 114 -11.001 3.700 7.534 846 HE ARG 114 HE ARG 114 -10.030 5.326 8.903 847 HH11 ARG 114 HH11 ARG 114 -9.912 6.248 5.520 848 HH12 ARG 114 HH12 ARG 114 -9.553 7.912 5.852 849 HH21 ARG 114 HH21 ARG 114 -9.519 7.544 9.324 850 HH22 ARG 114 HH22 ARG 114 -9.330 8.649 7.997 851 H GLU 115 HN GLU 115 -6.556 6.358 8.101 852 HA GLU 115 HA GLU 115 -5.054 7.759 6.144 853 HB2 GLU 115 HB2 GLU 115 -6.138 8.471 8.840 854 HB3 GLU 115 HB1 GLU 115 -5.067 9.571 7.981 855 HG2 GLU 115 HG2 GLU 115 -6.601 9.550 6.067 856 HG3 GLU 115 HG1 GLU 115 -7.676 8.474 6.954 857 H SER 116 HN SER 116 -4.264 6.319 9.247 858 HA SER 116 HA SER 116 -1.606 7.142 9.455 859 HB2 SER 116 HB2 SER 116 -2.677 4.386 10.126 860 HB3 SER 116 HB1 SER 116 -1.248 5.161 10.810 861 HG SER 116 HG SER 116 -3.223 6.842 11.189 862 H TRP 117 HN TRP 117 -3.121 4.683 7.473 863 HA TRP 117 HA TRP 117 -0.719 3.597 6.370 864 HB2 TRP 117 HB2 TRP 117 -3.157 2.638 6.437 865 HB3 TRP 117 HB1 TRP 117 -3.385 3.584 4.973 866 HD1 TRP 117 HD1 TRP 117 -1.787 0.436 6.283 867 HE1 TRP 117 HE1 TRP 117 -0.893 -0.961 4.320 868 HE3 TRP 117 HE3 TRP 117 -2.362 3.853 2.527 869 HZ2 TRP 117 HZ2 TRP 117 -0.478 -0.663 1.566 870 HZ3 TRP 117 HZ3 TRP 117 -1.689 3.211 0.248 871 HH2 TRP 117 HH2 TRP 117 -0.766 0.999 -0.221 872 H GLN 118 HN GLN 118 -3.108 5.984 5.355 873 HA GLN 118 HA GLN 118 -2.271 6.634 2.815 874 HB2 GLN 118 HB2 GLN 118 -4.322 7.511 3.640 875 HB3 GLN 118 HB1 GLN 118 -3.526 8.310 4.983 876 HG2 GLN 118 HG2 GLN 118 -4.227 9.923 3.340 877 HG3 GLN 118 HG1 GLN 118 -2.468 9.869 3.428 878 HE21 GLN 118 HE21 GLN 118 -4.413 7.465 1.781 879 HE22 GLN 118 HE22 GLN 118 -3.903 7.881 0.185 880 H GLU 119 HN GLU 119 -1.185 8.156 5.851 881 HA GLU 119 HA GLU 119 0.605 9.941 4.530 882 HB2 GLU 119 HB2 GLU 119 1.434 10.419 6.800 883 HB3 GLU 119 HB1 GLU 119 -0.324 10.457 6.725 884 HG2 GLU 119 HG2 GLU 119 -0.429 8.228 7.665 885 HG3 GLU 119 HG1 GLU 119 1.326 8.143 7.699 886 H GLN 120 HN GLN 120 0.857 6.698 5.748 887 HA GLN 120 HA GLN 120 3.708 6.696 5.948 888 HB2 GLN 120 HB2 GLN 120 1.553 4.659 6.228 889 HB3 GLN 120 HB1 GLN 120 3.209 4.110 6.006 890 HG2 GLN 120 HG2 GLN 120 2.271 5.985 8.164 891 HG3 GLN 120 HG1 GLN 120 2.577 4.262 8.371 892 HE21 GLN 120 HE21 GLN 120 4.852 4.461 6.460 893 HE22 GLN 120 HE22 GLN 120 6.152 5.127 7.393 894 H ILE 121 HN ILE 121 1.377 5.393 3.615 895 HA ILE 121 HA ILE 121 3.243 4.137 1.947 896 HB ILE 121 HB ILE 121 0.884 3.676 1.713 897 HG12 ILE 121 HG12 ILE 121 0.645 3.881 -0.757 898 HG13 ILE 121 HG11 ILE 121 2.031 4.966 -0.774 899 HG21 ILE 121 HG21 ILE 121 -0.087 5.794 2.244 900 HG22 ILE 121 HG22 ILE 121 -0.630 5.329 0.631 901 HG23 ILE 121 HG23 ILE 121 0.640 6.543 0.821 902 HD11 ILE 121 HD11 ILE 121 3.452 3.180 0.052 903 HD12 ILE 121 HD12 ILE 121 2.635 2.706 -1.437 904 HD13 ILE 121 HD13 ILE 121 2.065 2.093 0.116 905 H GLN 122 HN GLN 122 2.017 7.456 1.961 906 HA GLN 122 HA GLN 122 3.263 8.135 -0.518 907 HB2 GLN 122 HB2 GLN 122 2.759 10.505 0.197 908 HB3 GLN 122 HB1 GLN 122 1.384 9.427 0.071 909 HG2 GLN 122 HG2 GLN 122 1.255 9.185 2.419 910 HG3 GLN 122 HG1 GLN 122 2.766 10.069 2.652 911 HE21 GLN 122 HE21 GLN 122 -0.601 10.289 1.863 912 HE22 GLN 122 HE22 GLN 122 -0.747 12.000 2.064 913 H SER 123 HN SER 123 4.245 8.272 2.830 914 HA SER 123 HA SER 123 6.578 9.836 2.381 915 HB2 SER 123 HB2 SER 123 5.918 7.922 4.632 916 HB3 SER 123 HB1 SER 123 7.244 9.088 4.638 917 HG SER 123 HG SER 123 4.480 9.502 4.860 918 H LEU 124 HN LEU 124 5.860 6.382 2.359 919 HA LEU 124 HA LEU 124 8.518 5.488 1.957 920 HB2 LEU 124 HB2 LEU 124 6.696 3.984 2.642 921 HB3 LEU 124 HB1 LEU 124 5.893 4.241 1.108 922 HG LEU 124 HG LEU 124 7.200 2.040 1.486 923 HD11 LEU 124 HD11 LEU 124 7.687 3.672 -0.998 924 HD12 LEU 124 HD12 LEU 124 6.268 2.679 -0.664 925 HD13 LEU 124 HD13 LEU 124 7.848 1.921 -0.863 926 HD21 LEU 124 HD21 LEU 124 9.260 3.041 2.329 927 HD22 LEU 124 HD22 LEU 124 9.494 3.869 0.789 928 HD23 LEU 124 HD23 LEU 124 9.553 2.109 0.861 929 H MET 125 HN MET 125 5.881 6.348 -0.235 930 HA MET 125 HA MET 125 7.060 5.737 -2.668 931 HB2 MET 125 HB2 MET 125 5.224 8.027 -1.948 932 HB3 MET 125 HB1 MET 125 5.628 7.566 -3.593 933 HG2 MET 125 HG2 MET 125 4.504 5.515 -3.410 934 HG3 MET 125 HG1 MET 125 4.379 5.651 -1.657 935 HE1 MET 125 HE1 MET 125 3.836 8.826 -3.822 936 HE2 MET 125 HE2 MET 125 2.186 8.611 -4.410 937 HE3 MET 125 HE3 MET 125 3.468 7.536 -4.969 938 H LYS 126 HN LYS 126 7.159 8.837 -0.932 939 HA LYS 126 HA LYS 126 8.865 10.047 -2.884 940 HB2 LYS 126 HB2 LYS 126 8.313 10.919 -0.038 941 HB3 LYS 126 HB1 LYS 126 8.968 11.916 -1.330 942 HG2 LYS 126 HG2 LYS 126 6.228 10.668 -1.345 943 HG3 LYS 126 HG1 LYS 126 6.579 12.340 -0.901 944 HD2 LYS 126 HD2 LYS 126 7.369 12.815 -3.122 945 HD3 LYS 126 HD1 LYS 126 7.242 11.114 -3.576 946 HE2 LYS 126 HE2 LYS 126 4.833 11.194 -3.297 947 HE3 LYS 126 HE1 LYS 126 4.930 12.871 -2.762 948 HZ1 LYS 126 HZ1 LYS 126 5.730 11.886 -5.448 949 HZ2 LYS 126 HZ2 LYS 126 5.750 13.495 -4.932 950 HZ3 LYS 126 HZ3 LYS 126 4.280 12.681 -5.093 951 H PHE 127 HN PHE 127 9.433 8.245 0.048 952 HA PHE 127 HA PHE 127 12.047 8.993 0.603 953 HB2 PHE 127 HB2 PHE 127 10.770 7.539 2.061 954 HB3 PHE 127 HB1 PHE 127 10.718 6.292 0.819 955 HD1 PHE 127 HD1 PHE 127 12.189 4.546 0.995 956 HD2 PHE 127 HD2 PHE 127 13.235 8.292 2.724 957 HE1 PHE 127 HE1 PHE 127 14.246 3.552 1.898 958 HE2 PHE 127 HE2 PHE 127 15.301 7.301 3.626 959 HZ PHE 127 HZ PHE 127 15.807 4.929 3.213 960 H MET 128 HN MET 128 10.833 6.665 -1.769 961 HA MET 128 HA MET 128 13.570 6.348 -2.777 962 HB2 MET 128 HB2 MET 128 12.536 4.457 -4.127 963 HB3 MET 128 HB1 MET 128 12.657 4.223 -2.392 964 HG2 MET 128 HG2 MET 128 10.350 4.580 -2.086 965 HG3 MET 128 HG1 MET 128 10.154 5.193 -3.733 966 HE1 MET 128 HE1 MET 128 11.242 0.804 -2.828 967 HE2 MET 128 HE2 MET 128 11.144 2.057 -1.591 968 HE3 MET 128 HE3 MET 128 12.410 2.126 -2.819 969 H SER 129 HN SER 129 10.534 7.779 -3.539 970 HA SER 129 HA SER 129 11.075 8.031 -6.338 971 HB2 SER 129 HB2 SER 129 8.928 9.118 -4.569 972 HB3 SER 129 HB1 SER 129 9.069 9.581 -6.267 973 HG SER 129 HG SER 129 9.212 7.062 -6.439 974 H MET 130 HN MET 130 11.798 9.856 -3.532 975 HA MET 130 HA MET 130 12.317 12.320 -4.826 976 HB2 MET 130 HB2 MET 130 13.172 11.136 -2.198 977 HB3 MET 130 HB1 MET 130 13.874 12.649 -2.762 978 HG2 MET 130 HG2 MET 130 11.683 13.670 -2.834 979 HG3 MET 130 HG1 MET 130 10.931 12.147 -2.375 980 HE1 MET 130 HE1 MET 130 10.476 14.986 -0.844 981 HE2 MET 130 HE2 MET 130 10.454 14.398 0.817 982 HE3 MET 130 HE3 MET 130 9.645 13.484 -0.451 983 H LYS 131 HN LYS 131 13.599 12.194 -6.585 984 HA LYS 131 HA LYS 131 15.766 10.360 -6.787 985 HB2 LYS 131 HB2 LYS 131 15.188 12.715 -8.585 986 HB3 LYS 131 HB1 LYS 131 16.129 11.286 -8.978 987 HG2 LYS 131 HG2 LYS 131 13.167 11.367 -8.441 988 HG3 LYS 131 HG1 LYS 131 13.938 11.207 -10.017 989 HD2 LYS 131 HD2 LYS 131 14.254 9.236 -7.754 990 HD3 LYS 131 HD1 LYS 131 13.104 9.059 -9.078 991 HE2 LYS 131 HE2 LYS 131 14.981 9.096 -10.675 992 HE3 LYS 131 HE1 LYS 131 16.107 9.194 -9.321 993 HZ1 LYS 131 HZ1 LYS 131 14.191 6.974 -9.774 994 HZ2 LYS 131 HZ2 LYS 131 15.356 7.056 -8.552 995 HZ3 LYS 131 HZ3 LYS 131 15.835 6.927 -10.166 Start of MODEL 7 1 H1 SER 11 HT1 SER 11 25.861 3.459 4.503 2 H2 SER 11 HT2 SER 11 24.232 3.063 4.715 3 H3 SER 11 HT3 SER 11 24.664 4.617 4.206 4 HA SER 11 HA SER 11 25.508 3.759 2.148 5 HB2 SER 11 HB2 SER 11 24.410 1.080 2.992 6 HB3 SER 11 HB1 SER 11 25.491 1.452 1.655 7 HG SER 11 HG SER 11 27.166 1.614 3.001 8 H ALA 12 HN ALA 12 24.104 4.297 0.597 9 HA ALA 12 HA ALA 12 21.509 5.076 1.296 10 HB1 ALA 12 HB1 ALA 12 21.244 5.698 -1.025 11 HB2 ALA 12 HB2 ALA 12 22.646 4.727 -1.468 12 HB3 ALA 12 HB3 ALA 12 22.848 6.151 -0.451 13 H SER 13 HN SER 13 22.663 2.142 -0.261 14 HA SER 13 HA SER 13 20.004 1.309 -0.990 15 HB2 SER 13 HB2 SER 13 22.135 0.655 -2.228 16 HB3 SER 13 HB1 SER 13 22.471 -0.435 -0.885 17 HG SER 13 HG SER 13 21.373 -1.689 -2.256 18 H ASP 14 HN ASP 14 22.411 0.390 1.451 19 HA ASP 14 HA ASP 14 20.926 -1.591 2.746 20 HB2 ASP 14 HB2 ASP 14 23.312 -1.263 3.177 21 HB3 ASP 14 HB1 ASP 14 22.976 0.298 3.916 22 H ILE 15 HN ILE 15 21.135 1.903 3.421 23 HA ILE 15 HA ILE 15 19.421 1.819 5.652 24 HB ILE 15 HB ILE 15 20.920 3.758 5.138 25 HG12 ILE 15 HG12 ILE 15 19.039 5.482 5.720 26 HG13 ILE 15 HG11 ILE 15 18.010 4.049 5.775 27 HG21 ILE 15 HG21 ILE 15 20.369 3.985 2.750 28 HG22 ILE 15 HG22 ILE 15 20.155 5.495 3.635 29 HG23 ILE 15 HG23 ILE 15 18.749 4.526 3.197 30 HD11 ILE 15 HD11 ILE 15 19.378 3.089 7.505 31 HD12 ILE 15 HD12 ILE 15 18.852 4.702 7.981 32 HD13 ILE 15 HD13 ILE 15 20.502 4.444 7.414 33 H ARG 16 HN ARG 16 18.792 2.214 2.202 34 HA ARG 16 HA ARG 16 16.065 2.878 2.494 35 HB2 ARG 16 HB2 ARG 16 17.109 3.367 0.409 36 HB3 ARG 16 HB1 ARG 16 17.677 1.714 0.226 37 HG2 ARG 16 HG2 ARG 16 15.310 0.989 -0.021 38 HG3 ARG 16 HG1 ARG 16 14.841 2.693 -0.003 39 HD2 ARG 16 HD2 ARG 16 16.856 1.561 -1.913 40 HD3 ARG 16 HD1 ARG 16 15.132 1.628 -2.275 41 HE ARG 16 HE ARG 16 16.491 4.116 -1.554 42 HH11 ARG 16 HH11 ARG 16 14.992 2.109 -3.999 43 HH12 ARG 16 HH12 ARG 16 14.887 3.384 -5.169 44 HH21 ARG 16 HH21 ARG 16 16.337 5.815 -3.099 45 HH22 ARG 16 HH22 ARG 16 15.649 5.495 -4.658 46 H MET 17 HN MET 17 17.722 -0.205 1.865 47 HA MET 17 HA MET 17 15.375 -1.728 1.653 48 HB2 MET 17 HB2 MET 17 18.177 -2.529 2.435 49 HB3 MET 17 HB1 MET 17 16.874 -3.685 2.192 50 HG2 MET 17 HG2 MET 17 16.621 -2.868 -0.119 51 HG3 MET 17 HG1 MET 17 17.993 -1.791 0.138 52 HE1 MET 17 HE1 MET 17 19.196 -2.789 -1.990 53 HE2 MET 17 HE2 MET 17 17.835 -3.877 -2.269 54 HE3 MET 17 HE3 MET 17 19.481 -4.510 -2.244 55 H LYS 18 HN LYS 18 17.289 -0.804 4.485 56 HA LYS 18 HA LYS 18 15.680 -2.379 6.261 57 HB2 LYS 18 HB2 LYS 18 16.879 -1.431 8.040 58 HB3 LYS 18 HB1 LYS 18 18.040 -1.527 6.730 59 HG2 LYS 18 HG2 LYS 18 17.906 0.814 6.322 60 HG3 LYS 18 HG1 LYS 18 16.497 0.970 7.369 61 HD2 LYS 18 HD2 LYS 18 18.192 1.751 8.716 62 HD3 LYS 18 HD1 LYS 18 18.067 0.067 9.214 63 HE2 LYS 18 HE2 LYS 18 20.100 1.209 7.297 64 HE3 LYS 18 HE1 LYS 18 20.398 0.745 8.963 65 HZ1 LYS 18 HZ1 LYS 18 19.591 -1.098 6.783 66 HZ2 LYS 18 HZ2 LYS 18 19.907 -1.541 8.383 67 HZ3 LYS 18 HZ3 LYS 18 21.152 -0.936 7.407 68 H LYS 19 HN LYS 19 15.581 0.895 5.016 69 HA LYS 19 HA LYS 19 13.733 1.876 6.946 70 HB2 LYS 19 HB2 LYS 19 15.358 2.997 5.008 71 HB3 LYS 19 HB1 LYS 19 13.736 3.303 4.403 72 HG2 LYS 19 HG2 LYS 19 14.841 4.113 7.085 73 HG3 LYS 19 HG1 LYS 19 14.501 5.173 5.716 74 HD2 LYS 19 HD2 LYS 19 12.115 4.568 5.884 75 HD3 LYS 19 HD1 LYS 19 12.483 3.584 7.299 76 HE2 LYS 19 HE2 LYS 19 12.910 6.561 7.051 77 HE3 LYS 19 HE1 LYS 19 11.603 5.773 7.932 78 HZ1 LYS 19 HZ1 LYS 19 14.495 5.510 8.557 79 HZ2 LYS 19 HZ2 LYS 19 13.225 4.792 9.418 80 HZ3 LYS 19 HZ3 LYS 19 13.393 6.475 9.400 81 H VAL 20 HN VAL 20 13.466 0.616 3.659 82 HA VAL 20 HA VAL 20 10.701 1.061 3.358 83 HB VAL 20 HB VAL 20 10.743 -0.651 1.595 84 HG11 VAL 20 HG11 VAL 20 11.457 1.655 1.127 85 HG12 VAL 20 HG12 VAL 20 12.270 0.475 0.099 86 HG13 VAL 20 HG13 VAL 20 13.126 1.188 1.467 87 HG21 VAL 20 HG21 VAL 20 13.591 -1.092 2.472 88 HG22 VAL 20 HG22 VAL 20 12.857 -1.752 1.010 89 HG23 VAL 20 HG23 VAL 20 12.264 -2.246 2.594 90 H MET 21 HN MET 21 12.539 -1.499 4.900 91 HA MET 21 HA MET 21 10.386 -3.268 5.363 92 HB2 MET 21 HB2 MET 21 12.972 -2.818 6.851 93 HB3 MET 21 HB1 MET 21 11.836 -4.085 7.273 94 HG2 MET 21 HG2 MET 21 13.242 -3.783 4.634 95 HG3 MET 21 HG1 MET 21 13.651 -4.935 5.904 96 HE1 MET 21 HE1 MET 21 13.572 -6.824 4.015 97 HE2 MET 21 HE2 MET 21 13.072 -5.644 2.806 98 HE3 MET 21 HE3 MET 21 12.161 -7.141 3.006 99 H GLN 22 HN GLN 22 11.579 -0.441 7.053 100 HA GLN 22 HA GLN 22 9.929 -0.633 9.347 101 HB2 GLN 22 HB2 GLN 22 10.855 1.950 8.079 102 HB3 GLN 22 HB1 GLN 22 10.519 1.639 9.778 103 HG2 GLN 22 HG2 GLN 22 12.452 0.229 9.955 104 HG3 GLN 22 HG1 GLN 22 12.758 0.369 8.226 105 HE21 GLN 22 HE21 GLN 22 14.737 1.316 8.300 106 HE22 GLN 22 HE22 GLN 22 15.044 2.868 9.002 107 H TYR 23 HN TYR 23 9.576 1.058 6.253 108 HA TYR 23 HA TYR 23 6.949 2.004 6.722 109 HB2 TYR 23 HB2 TYR 23 8.485 1.505 4.171 110 HB3 TYR 23 HB1 TYR 23 6.870 2.199 4.196 111 HD1 TYR 23 HD1 TYR 23 10.228 3.001 3.977 112 HD2 TYR 23 HD2 TYR 23 6.677 4.239 5.955 113 HE1 TYR 23 HE1 TYR 23 11.183 5.247 4.270 114 HE2 TYR 23 HE2 TYR 23 7.625 6.485 6.263 115 HH TYR 23 HH TYR 23 9.762 7.594 6.328 116 H ARG 24 HN ARG 24 8.265 -0.982 5.560 117 HA ARG 24 HA ARG 24 6.057 -2.049 4.229 118 HB2 ARG 24 HB2 ARG 24 8.455 -2.880 4.235 119 HB3 ARG 24 HB1 ARG 24 8.103 -3.635 5.781 120 HG2 ARG 24 HG2 ARG 24 6.595 -5.147 4.824 121 HG3 ARG 24 HG1 ARG 24 6.475 -4.214 3.331 122 HD2 ARG 24 HD2 ARG 24 8.868 -4.704 2.894 123 HD3 ARG 24 HD1 ARG 24 8.883 -5.742 4.315 124 HE ARG 24 HE ARG 24 7.013 -6.277 2.111 125 HH11 ARG 24 HH11 ARG 24 9.689 -7.251 4.145 126 HH12 ARG 24 HH12 ARG 24 9.722 -8.880 3.548 127 HH21 ARG 24 HH21 ARG 24 7.055 -8.417 1.310 128 HH22 ARG 24 HH22 ARG 24 8.222 -9.540 1.928 129 H ARG 25 HN ARG 25 7.018 -2.231 7.625 130 HA ARG 25 HA ARG 25 4.905 -3.933 8.437 131 HB2 ARG 25 HB2 ARG 25 6.509 -1.919 10.016 132 HB3 ARG 25 HB1 ARG 25 5.415 -3.106 10.722 133 HG2 ARG 25 HG2 ARG 25 6.824 -4.871 9.573 134 HG3 ARG 25 HG1 ARG 25 7.993 -3.588 9.259 135 HD2 ARG 25 HD2 ARG 25 8.178 -3.153 11.641 136 HD3 ARG 25 HD1 ARG 25 6.964 -4.389 11.973 137 HE ARG 25 HE ARG 25 9.441 -5.145 10.594 138 HH11 ARG 25 HH11 ARG 25 7.380 -5.325 13.419 139 HH12 ARG 25 HH12 ARG 25 8.251 -6.645 14.125 140 HH21 ARG 25 HH21 ARG 25 10.587 -6.893 11.529 141 HH22 ARG 25 HH22 ARG 25 10.081 -7.523 13.064 142 H ALA 26 HN ALA 26 5.207 -0.468 8.068 143 HA ALA 26 HA ALA 26 2.705 0.123 9.355 144 HB1 ALA 26 HB1 ALA 26 4.444 1.883 7.636 145 HB2 ALA 26 HB2 ALA 26 4.595 1.694 9.383 146 HB3 ALA 26 HB3 ALA 26 3.139 2.412 8.696 147 H LEU 27 HN LEU 27 3.703 -0.812 6.230 148 HA LEU 27 HA LEU 27 1.223 0.097 4.992 149 HB2 LEU 27 HB2 LEU 27 3.861 -0.845 4.020 150 HB3 LEU 27 HB1 LEU 27 2.476 -1.228 3.018 151 HG LEU 27 HG LEU 27 2.094 0.988 2.449 152 HD11 LEU 27 HD11 LEU 27 2.962 2.927 3.680 153 HD12 LEU 27 HD12 LEU 27 3.669 1.841 4.878 154 HD13 LEU 27 HD13 LEU 27 1.919 1.923 4.684 155 HD21 LEU 27 HD21 LEU 27 4.255 1.980 1.879 156 HD22 LEU 27 HD22 LEU 27 4.220 0.252 1.532 157 HD23 LEU 27 HD23 LEU 27 5.061 0.847 2.964 158 H THR 28 HN THR 28 2.670 -2.720 6.352 159 HA THR 28 HA THR 28 0.833 -4.581 5.171 160 HB THR 28 HB THR 28 2.521 -4.864 7.672 161 HG1 THR 28 HG1 THR 28 3.847 -4.628 5.876 162 HG21 THR 28 HG21 THR 28 2.191 -7.276 7.367 163 HG22 THR 28 HG22 THR 28 1.113 -6.956 6.009 164 HG23 THR 28 HG23 THR 28 0.658 -6.448 7.635 165 H LYS 29 HN LYS 29 -1.269 -4.426 5.562 166 HA LYS 29 HA LYS 29 -2.261 -3.998 8.259 167 HB2 LYS 29 HB2 LYS 29 -1.835 -1.776 6.694 168 HB3 LYS 29 HB1 LYS 29 -3.515 -2.152 6.354 169 HG2 LYS 29 HG2 LYS 29 -3.613 -0.663 8.133 170 HG3 LYS 29 HG1 LYS 29 -3.817 -2.246 8.887 171 HD2 LYS 29 HD2 LYS 29 -2.269 -1.166 10.266 172 HD3 LYS 29 HD1 LYS 29 -1.270 -2.186 9.227 173 HE2 LYS 29 HE2 LYS 29 -0.295 0.037 9.434 174 HE3 LYS 29 HE1 LYS 29 -0.821 -0.269 7.780 175 HZ1 LYS 29 HZ1 LYS 29 -1.390 1.966 8.696 176 HZ2 LYS 29 HZ2 LYS 29 -2.476 1.201 9.752 177 HZ3 LYS 29 HZ3 LYS 29 -2.702 1.098 8.078 178 H VAL 30 HN VAL 30 -4.708 -3.978 8.220 179 HA VAL 30 HA VAL 30 -5.729 -5.570 5.969 180 HB VAL 30 HB VAL 30 -7.625 -6.192 7.512 181 HG11 VAL 30 HG11 VAL 30 -5.806 -7.737 7.034 182 HG12 VAL 30 HG12 VAL 30 -6.338 -7.902 8.707 183 HG13 VAL 30 HG13 VAL 30 -4.849 -7.034 8.337 184 HG21 VAL 30 HG21 VAL 30 -7.377 -4.398 9.147 185 HG22 VAL 30 HG22 VAL 30 -5.799 -5.033 9.617 186 HG23 VAL 30 HG23 VAL 30 -7.256 -5.977 9.926 187 H VAL 31 HN VAL 31 -7.225 -4.684 4.699 188 HA VAL 31 HA VAL 31 -8.732 -2.356 5.542 189 HB VAL 31 HB VAL 31 -6.238 -2.140 4.050 190 HG11 VAL 31 HG11 VAL 31 -8.667 -0.837 2.835 191 HG12 VAL 31 HG12 VAL 31 -7.662 -2.084 2.091 192 HG13 VAL 31 HG13 VAL 31 -6.991 -0.484 2.418 193 HG21 VAL 31 HG21 VAL 31 -8.095 -0.083 5.234 194 HG22 VAL 31 HG22 VAL 31 -6.447 0.214 4.682 195 HG23 VAL 31 HG23 VAL 31 -6.738 -0.857 6.052 196 H LYS 32 HN LYS 32 -10.449 -1.861 4.099 197 HA LYS 32 HA LYS 32 -11.028 -4.056 2.247 198 HB2 LYS 32 HB2 LYS 32 -12.576 -3.497 4.197 199 HB3 LYS 32 HB1 LYS 32 -12.970 -2.021 3.332 200 HG2 LYS 32 HG2 LYS 32 -13.239 -4.570 1.852 201 HG3 LYS 32 HG1 LYS 32 -14.424 -4.226 3.117 202 HD2 LYS 32 HD2 LYS 32 -14.835 -2.019 2.034 203 HD3 LYS 32 HD1 LYS 32 -13.768 -2.518 0.718 204 HE2 LYS 32 HE2 LYS 32 -16.095 -2.885 0.120 205 HE3 LYS 32 HE1 LYS 32 -15.238 -4.420 0.255 206 HZ1 LYS 32 HZ1 LYS 32 -17.419 -4.507 1.300 207 HZ2 LYS 32 HZ2 LYS 32 -16.995 -3.246 2.344 208 HZ3 LYS 32 HZ3 LYS 32 -16.196 -4.729 2.443 209 H LEU 33 HN LEU 33 -10.858 -3.708 0.161 210 HA LEU 33 HA LEU 33 -10.501 -0.984 -0.807 211 HB2 LEU 33 HB2 LEU 33 -10.089 -3.695 -2.003 212 HB3 LEU 33 HB1 LEU 33 -10.221 -2.289 -3.048 213 HG LEU 33 HG LEU 33 -8.185 -2.562 -0.836 214 HD11 LEU 33 HD11 LEU 33 -7.810 -4.226 -2.601 215 HD12 LEU 33 HD12 LEU 33 -6.568 -2.976 -2.611 216 HD13 LEU 33 HD13 LEU 33 -7.858 -2.945 -3.812 217 HD21 LEU 33 HD21 LEU 33 -8.771 -0.262 -1.402 218 HD22 LEU 33 HD22 LEU 33 -8.478 -0.599 -3.107 219 HD23 LEU 33 HD23 LEU 33 -7.142 -0.651 -1.956 220 H LYS 34 HN LYS 34 -11.754 0.012 -2.361 221 HA LYS 34 HA LYS 34 -14.199 -1.319 -3.265 222 HB2 LYS 34 HB2 LYS 34 -14.389 1.431 -2.050 223 HB3 LYS 34 HB1 LYS 34 -15.694 0.344 -2.496 224 HG2 LYS 34 HG2 LYS 34 -15.004 -1.162 -0.663 225 HG3 LYS 34 HG1 LYS 34 -13.800 0.032 -0.185 226 HD2 LYS 34 HD2 LYS 34 -16.796 0.393 -0.226 227 HD3 LYS 34 HD1 LYS 34 -15.770 0.252 1.200 228 HE2 LYS 34 HE2 LYS 34 -15.981 2.520 1.128 229 HE3 LYS 34 HE1 LYS 34 -14.571 2.339 0.089 230 HZ1 LYS 34 HZ1 LYS 34 -16.010 2.466 -1.840 231 HZ2 LYS 34 HZ2 LYS 34 -16.222 3.830 -0.868 232 HZ3 LYS 34 HZ3 LYS 34 -17.375 2.596 -0.854 233 H THR 35 HN THR 35 -13.845 -1.124 -5.408 234 HA THR 35 HA THR 35 -14.010 1.423 -6.618 235 HB THR 35 HB THR 35 -11.731 1.728 -5.972 236 HG1 THR 35 HG1 THR 35 -10.818 2.122 -7.943 237 HG21 THR 35 HG21 THR 35 -11.187 -0.968 -7.191 238 HG22 THR 35 HG22 THR 35 -11.058 -0.520 -5.494 239 HG23 THR 35 HG23 THR 35 -9.938 0.161 -6.675 240 H HIS 36 HN HIS 36 -12.958 0.919 -9.129 241 HA HIS 36 HA HIS 36 -14.838 -0.898 -10.235 242 HB2 HIS 36 HB2 HIS 36 -12.404 0.415 -11.454 243 HB3 HIS 36 HB1 HIS 36 -13.571 -0.531 -12.370 244 HD1 HIS 36 HD1 HIS 36 -12.842 2.857 -11.402 245 HD2 HIS 36 HD2 HIS 36 -16.303 0.667 -12.129 246 HE1 HIS 36 HE1 HIS 36 -14.644 4.554 -11.820 247 HE2 HIS 36 HE2 HIS 36 -16.704 3.210 -12.362 248 H LEU 37 HN LEU 37 -11.743 -1.274 -8.914 249 HA LEU 37 HA LEU 37 -10.903 -3.685 -10.108 250 HB2 LEU 37 HB2 LEU 37 -9.518 -2.195 -8.650 251 HB3 LEU 37 HB1 LEU 37 -10.474 -2.709 -7.278 252 HG LEU 37 HG LEU 37 -9.676 -5.065 -7.766 253 HD11 LEU 37 HD11 LEU 37 -7.707 -3.556 -9.475 254 HD12 LEU 37 HD12 LEU 37 -8.908 -4.716 -10.041 255 HD13 LEU 37 HD13 LEU 37 -7.580 -5.254 -9.013 256 HD21 LEU 37 HD21 LEU 37 -7.777 -2.893 -6.894 257 HD22 LEU 37 HD22 LEU 37 -7.463 -4.617 -6.684 258 HD23 LEU 37 HD23 LEU 37 -8.841 -3.869 -5.879 259 H PHE 38 HN PHE 38 -12.385 -3.145 -6.933 260 HA PHE 38 HA PHE 38 -14.554 -4.840 -7.174 261 HB2 PHE 38 HB2 PHE 38 -13.843 -6.762 -5.747 262 HB3 PHE 38 HB1 PHE 38 -13.032 -6.731 -7.306 263 HD1 PHE 38 HD1 PHE 38 -10.742 -6.933 -7.403 264 HD2 PHE 38 HD2 PHE 38 -12.547 -5.712 -3.752 265 HE1 PHE 38 HE1 PHE 38 -8.561 -7.076 -6.281 266 HE2 PHE 38 HE2 PHE 38 -10.369 -5.848 -2.624 267 HZ PHE 38 HZ PHE 38 -8.371 -6.530 -3.888 268 H SER 39 HN SER 39 -15.274 -5.533 -4.801 269 HA SER 39 HA SER 39 -14.245 -3.592 -2.846 270 HB2 SER 39 HB2 SER 39 -16.625 -3.539 -1.928 271 HB3 SER 39 HB1 SER 39 -16.373 -2.703 -3.460 272 HG SER 39 HG SER 39 -17.434 -5.319 -3.111 273 H GLU 40 HN GLU 40 -13.053 -4.941 -1.623 274 HA GLU 40 HA GLU 40 -14.357 -7.100 -0.176 275 HB2 GLU 40 HB2 GLU 40 -11.984 -7.575 -1.989 276 HB3 GLU 40 HB1 GLU 40 -12.481 -8.689 -0.730 277 HG2 GLU 40 HG2 GLU 40 -14.224 -7.870 -3.039 278 HG3 GLU 40 HG1 GLU 40 -13.208 -9.310 -3.024 279 H THR 41 HN THR 41 -13.071 -7.814 1.629 280 HA THR 41 HA THR 41 -11.336 -5.755 2.664 281 HB THR 41 HB THR 41 -12.103 -8.386 3.913 282 HG1 THR 41 HG1 THR 41 -13.989 -7.324 3.872 283 HG21 THR 41 HG21 THR 41 -11.440 -7.313 6.019 284 HG22 THR 41 HG22 THR 41 -10.941 -5.878 5.125 285 HG23 THR 41 HG23 THR 41 -10.089 -7.404 4.890 286 H VAL 42 HN VAL 42 -9.234 -5.722 2.283 287 HA VAL 42 HA VAL 42 -7.928 -8.249 1.513 288 HB VAL 42 HB VAL 42 -6.618 -7.086 -0.106 289 HG11 VAL 42 HG11 VAL 42 -9.463 -6.095 -0.276 290 HG12 VAL 42 HG12 VAL 42 -8.856 -7.646 -0.859 291 HG13 VAL 42 HG13 VAL 42 -8.312 -6.149 -1.614 292 HG21 VAL 42 HG21 VAL 42 -6.724 -4.665 -0.457 293 HG22 VAL 42 HG22 VAL 42 -6.164 -5.052 1.170 294 HG23 VAL 42 HG23 VAL 42 -7.822 -4.512 0.915 295 H LYS 43 HN LYS 43 -5.659 -8.395 2.027 296 HA LYS 43 HA LYS 43 -4.857 -6.650 4.248 297 HB2 LYS 43 HB2 LYS 43 -4.745 -9.050 4.720 298 HB3 LYS 43 HB1 LYS 43 -3.709 -9.291 3.320 299 HG2 LYS 43 HG2 LYS 43 -1.945 -8.018 4.335 300 HG3 LYS 43 HG1 LYS 43 -2.988 -7.578 5.688 301 HD2 LYS 43 HD2 LYS 43 -1.482 -9.351 6.345 302 HD3 LYS 43 HD1 LYS 43 -3.141 -9.950 6.312 303 HE2 LYS 43 HE2 LYS 43 -2.746 -10.993 4.152 304 HE3 LYS 43 HE1 LYS 43 -1.112 -10.335 4.109 305 HZ1 LYS 43 HZ1 LYS 43 -0.568 -11.661 6.052 306 HZ2 LYS 43 HZ2 LYS 43 -1.120 -12.648 4.797 307 HZ3 LYS 43 HZ3 LYS 43 -2.138 -12.291 6.099 308 H VAL 44 HN VAL 44 -3.399 -5.110 3.882 309 HA VAL 44 HA VAL 44 -2.179 -5.059 1.211 310 HB VAL 44 HB VAL 44 -1.786 -2.580 2.565 311 HG11 VAL 44 HG11 VAL 44 -3.059 -1.690 0.680 312 HG12 VAL 44 HG12 VAL 44 -3.598 -3.318 0.271 313 HG13 VAL 44 HG13 VAL 44 -1.890 -2.899 0.150 314 HG21 VAL 44 HG21 VAL 44 -4.644 -3.549 2.635 315 HG22 VAL 44 HG22 VAL 44 -4.144 -1.873 2.852 316 HG23 VAL 44 HG23 VAL 44 -3.643 -3.098 4.019 317 H THR 45 HN THR 45 -0.025 -4.167 1.023 318 HA THR 45 HA THR 45 1.767 -3.922 3.183 319 HB THR 45 HB THR 45 1.315 -6.371 3.368 320 HG1 THR 45 HG1 THR 45 3.302 -5.942 4.118 321 HG21 THR 45 HG21 THR 45 2.190 -7.883 1.635 322 HG22 THR 45 HG22 THR 45 2.553 -6.492 0.615 323 HG23 THR 45 HG23 THR 45 0.880 -6.872 1.025 324 H CYS 46 HN CYS 46 4.147 -4.564 2.030 325 HA CYS 46 HA CYS 46 4.041 -3.624 -0.735 326 HB2 CYS 46 HB2 CYS 46 5.680 -1.912 -0.408 327 HB3 CYS 46 HB1 CYS 46 4.429 -1.659 0.808 328 HG CYS 46 HG CYS 46 7.545 -2.975 1.317 329 H SER 47 HN SER 47 6.093 -4.016 -1.899 330 HA SER 47 HA SER 47 7.109 -6.591 -1.352 331 HB2 SER 47 HB2 SER 47 7.985 -4.439 -3.276 332 HB3 SER 47 HB1 SER 47 8.756 -6.023 -3.199 333 HG SER 47 HG SER 47 7.061 -5.886 -4.778 334 H LYS 48 HN LYS 48 9.791 -6.657 -1.669 335 HA LYS 48 HA LYS 48 10.506 -6.265 1.065 336 HB2 LYS 48 HB2 LYS 48 12.174 -7.150 -1.302 337 HB3 LYS 48 HB1 LYS 48 12.694 -7.221 0.376 338 HG2 LYS 48 HG2 LYS 48 10.995 -8.825 0.901 339 HG3 LYS 48 HG1 LYS 48 10.286 -8.662 -0.707 340 HD2 LYS 48 HD2 LYS 48 12.308 -9.564 -1.713 341 HD3 LYS 48 HD1 LYS 48 13.066 -9.676 -0.125 342 HE2 LYS 48 HE2 LYS 48 10.547 -11.131 -0.918 343 HE3 LYS 48 HE1 LYS 48 12.162 -11.836 -0.973 344 HZ1 LYS 48 HZ1 LYS 48 10.938 -12.406 1.061 345 HZ2 LYS 48 HZ2 LYS 48 10.874 -10.765 1.475 346 HZ3 LYS 48 HZ3 LYS 48 12.365 -11.553 1.385 347 H ASP 49 HN ASP 49 11.756 -4.909 -1.974 348 HA ASP 49 HA ASP 49 13.402 -2.974 -0.611 349 HB2 ASP 49 HB2 ASP 49 12.697 -3.458 -3.501 350 HB3 ASP 49 HB1 ASP 49 13.610 -2.041 -3.001 351 H GLY 50 HN GLY 50 10.299 -3.089 -0.471 352 HA2 GLY 50 HA2 GLY 50 8.557 -1.602 -0.311 353 HA3 GLY 50 HA1 GLY 50 9.773 -0.337 -0.240 354 H GLU 51 HN GLU 51 9.965 -2.321 -2.962 355 HA GLU 51 HA GLU 51 9.678 -0.094 -4.681 356 HB2 GLU 51 HB2 GLU 51 10.217 -1.708 -6.461 357 HB3 GLU 51 HB1 GLU 51 11.320 -1.820 -5.094 358 HG2 GLU 51 HG2 GLU 51 10.139 -3.755 -4.268 359 HG3 GLU 51 HG1 GLU 51 9.006 -3.654 -5.614 360 H GLU 52 HN GLU 52 7.399 -2.286 -3.481 361 HA GLU 52 HA GLU 52 5.453 -1.513 -5.522 362 HB2 GLU 52 HB2 GLU 52 6.196 -4.330 -4.785 363 HB3 GLU 52 HB1 GLU 52 4.651 -3.929 -5.507 364 HG2 GLU 52 HG2 GLU 52 5.680 -3.225 -7.520 365 HG3 GLU 52 HG1 GLU 52 7.282 -3.236 -6.781 366 H VAL 53 HN VAL 53 3.309 -1.638 -4.852 367 HA VAL 53 HA VAL 53 2.878 -2.236 -2.007 368 HB VAL 53 HB VAL 53 1.055 -0.763 -3.924 369 HG11 VAL 53 HG11 VAL 53 0.848 -1.102 -0.934 370 HG12 VAL 53 HG12 VAL 53 -0.138 -1.940 -2.133 371 HG13 VAL 53 HG13 VAL 53 -0.257 -0.189 -1.959 372 HG21 VAL 53 HG21 VAL 53 3.026 0.558 -3.474 373 HG22 VAL 53 HG22 VAL 53 2.834 0.306 -1.739 374 HG23 VAL 53 HG23 VAL 53 1.639 1.250 -2.631 375 H GLN 54 HN GLN 54 1.642 -3.976 -1.472 376 HA GLN 54 HA GLN 54 0.395 -5.455 -3.701 377 HB2 GLN 54 HB2 GLN 54 1.819 -6.827 -1.429 378 HB3 GLN 54 HB1 GLN 54 1.350 -7.488 -2.988 379 HG2 GLN 54 HG2 GLN 54 3.402 -5.324 -2.758 380 HG3 GLN 54 HG1 GLN 54 3.820 -7.026 -2.579 381 HE21 GLN 54 HE21 GLN 54 5.140 -6.919 -4.378 382 HE22 GLN 54 HE22 GLN 54 4.508 -6.867 -5.981 383 H TRP 55 HN TRP 55 -1.352 -6.868 -3.059 384 HA TRP 55 HA TRP 55 -2.198 -6.690 -0.281 385 HB2 TRP 55 HB2 TRP 55 -4.592 -6.261 -1.053 386 HB3 TRP 55 HB1 TRP 55 -3.484 -4.897 -1.076 387 HD1 TRP 55 HD1 TRP 55 -5.305 -7.298 -3.479 388 HE1 TRP 55 HE1 TRP 55 -5.389 -6.177 -5.800 389 HE3 TRP 55 HE3 TRP 55 -2.390 -3.229 -2.504 390 HZ2 TRP 55 HZ2 TRP 55 -4.346 -3.856 -7.044 391 HZ3 TRP 55 HZ3 TRP 55 -1.982 -1.609 -4.298 392 HH2 TRP 55 HH2 TRP 55 -2.935 -1.907 -6.519 393 H PHE 56 HN PHE 56 -3.730 -8.218 0.352 394 HA PHE 56 HA PHE 56 -3.940 -10.565 -1.419 395 HB2 PHE 56 HB2 PHE 56 -3.698 -10.508 1.601 396 HB3 PHE 56 HB1 PHE 56 -3.846 -11.952 0.606 397 HD1 PHE 56 HD1 PHE 56 -1.982 -12.642 -0.856 398 HD2 PHE 56 HD2 PHE 56 -1.619 -9.386 1.860 399 HE1 PHE 56 HE1 PHE 56 0.469 -12.752 -1.054 400 HE2 PHE 56 HE2 PHE 56 0.830 -9.490 1.663 401 HZ PHE 56 HZ PHE 56 1.875 -11.173 0.205 402 H LYS 57 HN LYS 57 -5.988 -11.055 -1.933 403 HA LYS 57 HA LYS 57 -8.108 -9.515 -0.704 404 HB2 LYS 57 HB2 LYS 57 -8.361 -11.591 -2.874 405 HB3 LYS 57 HB1 LYS 57 -9.525 -10.345 -2.458 406 HG2 LYS 57 HG2 LYS 57 -8.036 -8.628 -3.218 407 HG3 LYS 57 HG1 LYS 57 -6.778 -9.818 -3.547 408 HD2 LYS 57 HD2 LYS 57 -9.463 -9.642 -4.919 409 HD3 LYS 57 HD1 LYS 57 -7.921 -9.132 -5.601 410 HE2 LYS 57 HE2 LYS 57 -8.075 -11.195 -6.552 411 HE3 LYS 57 HE1 LYS 57 -7.269 -11.641 -5.053 412 HZ1 LYS 57 HZ1 LYS 57 -9.109 -13.118 -5.519 413 HZ2 LYS 57 HZ2 LYS 57 -10.186 -11.816 -5.574 414 HZ3 LYS 57 HZ3 LYS 57 -9.432 -12.226 -4.118 415 H GLY 58 HN GLY 58 -8.851 -10.192 1.156 416 HA2 GLY 58 HA2 GLY 58 -9.824 -11.507 2.759 417 HA3 GLY 58 HA1 GLY 58 -10.329 -12.561 1.448 418 H LYS 59 HN LYS 59 -9.599 -14.554 1.529 419 HA LYS 59 HA LYS 59 -7.241 -15.148 3.152 420 HB2 LYS 59 HB2 LYS 59 -9.258 -16.487 3.582 421 HB3 LYS 59 HB1 LYS 59 -9.276 -17.010 1.903 422 HG2 LYS 59 HG2 LYS 59 -7.258 -18.241 2.183 423 HG3 LYS 59 HG1 LYS 59 -6.999 -17.557 3.786 424 HD2 LYS 59 HD2 LYS 59 -9.089 -18.662 4.540 425 HD3 LYS 59 HD1 LYS 59 -9.213 -19.427 2.954 426 HE2 LYS 59 HE2 LYS 59 -8.208 -20.927 4.613 427 HE3 LYS 59 HE1 LYS 59 -7.088 -20.550 3.305 428 HZ1 LYS 59 HZ1 LYS 59 -5.987 -18.958 4.724 429 HZ2 LYS 59 HZ2 LYS 59 -6.029 -20.461 5.493 430 HZ3 LYS 59 HZ3 LYS 59 -7.092 -19.240 5.969 431 H SER 60 HN SER 60 -5.351 -15.572 2.245 432 HA SER 60 HA SER 60 -5.272 -16.015 -0.660 433 HB2 SER 60 HB2 SER 60 -3.273 -14.488 -0.678 434 HB3 SER 60 HB1 SER 60 -4.799 -13.686 -0.298 435 HG SER 60 HG SER 60 -4.134 -14.140 1.993 436 H THR 61 HN THR 61 -2.837 -16.447 -1.252 437 HA THR 61 HA THR 61 -1.733 -18.364 0.688 438 HB THR 61 HB THR 61 -0.794 -19.533 -1.388 439 HG1 THR 61 HG1 THR 61 -1.615 -17.551 -2.675 440 HG21 THR 61 HG21 THR 61 -3.783 -19.520 -0.949 441 HG22 THR 61 HG22 THR 61 -2.606 -20.503 -0.080 442 HG23 THR 61 HG23 THR 61 -2.883 -20.775 -1.799 443 H ALA 62 HN ALA 62 -0.462 -16.591 1.504 444 HA ALA 62 HA ALA 62 1.267 -14.972 0.107 445 HB1 ALA 62 HB1 ALA 62 0.770 -14.812 2.525 446 HB2 ALA 62 HB2 ALA 62 2.489 -14.725 2.162 447 HB3 ALA 62 HB3 ALA 62 1.802 -16.214 2.799 448 H GLY 63 HN GLY 63 2.608 -15.596 -1.399 449 HA2 GLY 63 HA2 GLY 63 3.495 -18.018 -2.116 450 HA3 GLY 63 HA1 GLY 63 4.417 -16.566 -2.432 451 H ALA 64 HN ALA 64 4.364 -19.543 -0.970 452 HA ALA 64 HA ALA 64 5.877 -20.762 0.191 453 HB1 ALA 64 HB1 ALA 64 8.224 -20.197 -0.048 454 HB2 ALA 64 HB2 ALA 64 7.797 -18.574 -0.586 455 HB3 ALA 64 HB3 ALA 64 7.377 -19.970 -1.579 456 H GLN 65 HN GLN 65 4.332 -18.708 1.590 457 HA GLN 65 HA GLN 65 4.041 -18.036 3.738 458 HB2 GLN 65 HB2 GLN 65 6.705 -19.347 4.306 459 HB3 GLN 65 HB1 GLN 65 5.574 -18.762 5.517 460 HG2 GLN 65 HG2 GLN 65 5.174 -21.045 3.601 461 HG3 GLN 65 HG1 GLN 65 5.371 -21.134 5.350 462 HE21 GLN 65 HE21 GLN 65 3.218 -20.473 2.741 463 HE22 GLN 65 HE22 GLN 65 1.772 -20.346 3.686 464 H ASP 66 HN ASP 66 6.729 -17.173 1.886 465 HA ASP 66 HA ASP 66 7.568 -15.003 3.643 466 HB2 ASP 66 HB2 ASP 66 9.127 -16.543 2.240 467 HB3 ASP 66 HB1 ASP 66 8.642 -15.537 0.881 468 H ARG 67 HN ARG 67 5.115 -15.504 1.738 469 HA ARG 67 HA ARG 67 3.555 -14.285 0.673 470 HB2 ARG 67 HB2 ARG 67 4.680 -11.701 1.643 471 HB3 ARG 67 HB1 ARG 67 3.008 -12.246 1.546 472 HG2 ARG 67 HG2 ARG 67 3.418 -13.737 3.472 473 HG3 ARG 67 HG1 ARG 67 5.047 -13.077 3.598 474 HD2 ARG 67 HD2 ARG 67 2.480 -11.517 3.828 475 HD3 ARG 67 HD1 ARG 67 3.516 -12.006 5.166 476 HE ARG 67 HE ARG 67 4.551 -10.254 3.042 477 HH11 ARG 67 HH11 ARG 67 3.786 -10.840 6.405 478 HH12 ARG 67 HH12 ARG 67 4.594 -9.414 6.968 479 HH21 ARG 67 HH21 ARG 67 5.610 -8.379 3.772 480 HH22 ARG 67 HH22 ARG 67 5.647 -8.011 5.466 481 H LYS 68 HN LYS 68 5.474 -15.002 -1.000 482 HA LYS 68 HA LYS 68 6.278 -12.651 -2.541 483 HB2 LYS 68 HB2 LYS 68 6.860 -15.580 -2.975 484 HB3 LYS 68 HB1 LYS 68 7.544 -14.246 -3.899 485 HG2 LYS 68 HG2 LYS 68 8.135 -13.523 -1.337 486 HG3 LYS 68 HG1 LYS 68 8.280 -15.283 -1.275 487 HD2 LYS 68 HD2 LYS 68 9.592 -13.520 -3.323 488 HD3 LYS 68 HD1 LYS 68 10.390 -14.133 -1.875 489 HE2 LYS 68 HE2 LYS 68 10.072 -16.414 -2.623 490 HE3 LYS 68 HE1 LYS 68 9.159 -15.854 -4.023 491 HZ1 LYS 68 HZ1 LYS 68 11.118 -14.803 -4.884 492 HZ2 LYS 68 HZ2 LYS 68 11.477 -16.420 -4.541 493 HZ3 LYS 68 HZ3 LYS 68 12.007 -15.200 -3.500 494 H LYS 69 HN LYS 69 3.494 -14.024 -2.254 495 HA LYS 69 HA LYS 69 2.845 -13.981 -5.113 496 HB2 LYS 69 HB2 LYS 69 3.057 -16.325 -4.448 497 HB3 LYS 69 HB1 LYS 69 1.952 -16.069 -3.111 498 HG2 LYS 69 HG2 LYS 69 0.195 -15.502 -4.806 499 HG3 LYS 69 HG1 LYS 69 1.327 -16.040 -6.049 500 HD2 LYS 69 HD2 LYS 69 1.438 -18.244 -5.023 501 HD3 LYS 69 HD1 LYS 69 0.365 -17.712 -3.726 502 HE2 LYS 69 HE2 LYS 69 -1.351 -17.221 -5.492 503 HE3 LYS 69 HE1 LYS 69 -0.286 -18.020 -6.646 504 HZ1 LYS 69 HZ1 LYS 69 -1.965 -19.534 -5.809 505 HZ2 LYS 69 HZ2 LYS 69 -1.455 -19.269 -4.217 506 HZ3 LYS 69 HZ3 LYS 69 -0.426 -20.038 -5.319 507 HA PRO 70 HA PRO 70 -0.099 -11.378 -2.694 508 HB2 PRO 70 HB2 PRO 70 0.285 -9.354 -4.718 509 HB3 PRO 70 HB1 PRO 70 0.674 -9.288 -2.998 510 HG2 PRO 70 HG2 PRO 70 2.553 -9.329 -4.972 511 HG3 PRO 70 HG1 PRO 70 2.842 -9.932 -3.334 512 HD2 PRO 70 HD2 PRO 70 2.206 -11.460 -5.833 513 HD3 PRO 70 HD1 PRO 70 3.351 -11.854 -4.529 514 H SER 71 HN SER 71 -2.200 -10.787 -3.199 515 HA SER 71 HA SER 71 -3.383 -12.172 -5.429 516 HB2 SER 71 HB2 SER 71 -4.783 -10.268 -3.557 517 HB3 SER 71 HB1 SER 71 -5.450 -11.665 -4.398 518 HG SER 71 HG SER 71 -3.902 -12.915 -3.073 519 H GLY 72 HN GLY 72 -1.989 -9.196 -4.975 520 HA2 GLY 72 HA2 GLY 72 -2.376 -8.261 -7.550 521 HA3 GLY 72 HA1 GLY 72 -3.611 -7.499 -6.550 522 H GLY 73 HN GLY 73 -1.734 -5.902 -7.743 523 HA2 GLY 73 HA2 GLY 73 -0.832 -4.327 -5.689 524 HA3 GLY 73 HA1 GLY 73 0.488 -5.442 -6.001 525 H PHE 74 HN PHE 74 1.382 -3.155 -6.363 526 HA PHE 74 HA PHE 74 1.837 -2.836 -9.147 527 HB2 PHE 74 HB2 PHE 74 0.871 -0.651 -9.509 528 HB3 PHE 74 HB1 PHE 74 -0.391 -1.752 -8.997 529 HD1 PHE 74 HD1 PHE 74 -0.244 -1.721 -6.091 530 HD2 PHE 74 HD2 PHE 74 0.334 1.441 -8.867 531 HE1 PHE 74 HE1 PHE 74 -0.929 -0.086 -4.380 532 HE2 PHE 74 HE2 PHE 74 -0.353 3.069 -7.175 533 HZ PHE 74 HZ PHE 74 -0.984 2.310 -4.919 534 HA PRO 75 HA PRO 75 5.523 -1.069 -7.571 535 HB2 PRO 75 HB2 PRO 75 5.667 0.839 -9.777 536 HB3 PRO 75 HB1 PRO 75 6.708 -0.538 -9.426 537 HG2 PRO 75 HG2 PRO 75 5.008 -0.525 -11.514 538 HG3 PRO 75 HG1 PRO 75 5.396 -2.005 -10.618 539 HD2 PRO 75 HD2 PRO 75 2.970 -0.259 -10.431 540 HD3 PRO 75 HD1 PRO 75 3.095 -2.027 -10.412 541 H VAL 76 HN VAL 76 6.192 0.490 -6.265 542 HA VAL 76 HA VAL 76 4.356 2.446 -5.354 543 HB VAL 76 HB VAL 76 7.241 1.861 -4.711 544 HG11 VAL 76 HG11 VAL 76 5.497 3.896 -3.336 545 HG12 VAL 76 HG12 VAL 76 6.814 4.287 -4.441 546 HG13 VAL 76 HG13 VAL 76 7.154 3.462 -2.920 547 HG21 VAL 76 HG21 VAL 76 4.711 1.588 -3.098 548 HG22 VAL 76 HG22 VAL 76 6.328 1.076 -2.614 549 HG23 VAL 76 HG23 VAL 76 5.516 0.277 -3.961 550 H ASP 77 HN ASP 77 7.211 2.572 -7.394 551 HA ASP 77 HA ASP 77 7.427 5.401 -7.484 552 HB2 ASP 77 HB2 ASP 77 9.287 3.916 -8.082 553 HB3 ASP 77 HB1 ASP 77 8.368 3.302 -9.449 554 H LYS 78 HN LYS 78 5.315 3.157 -8.950 555 HA LYS 78 HA LYS 78 4.757 4.848 -11.247 556 HB2 LYS 78 HB2 LYS 78 4.076 2.029 -10.508 557 HB3 LYS 78 HB1 LYS 78 3.151 2.854 -11.754 558 HG2 LYS 78 HG2 LYS 78 4.921 1.520 -12.729 559 HG3 LYS 78 HG1 LYS 78 5.200 3.235 -13.033 560 HD2 LYS 78 HD2 LYS 78 6.658 3.072 -10.862 561 HD3 LYS 78 HD1 LYS 78 6.673 1.350 -11.243 562 HE2 LYS 78 HE2 LYS 78 8.602 2.250 -12.247 563 HE3 LYS 78 HE1 LYS 78 7.448 1.995 -13.553 564 HZ1 LYS 78 HZ1 LYS 78 8.071 4.578 -12.221 565 HZ2 LYS 78 HZ2 LYS 78 6.868 4.368 -13.396 566 HZ3 LYS 78 HZ3 LYS 78 8.491 4.123 -13.798 567 H ILE 79 HN ILE 79 3.583 4.496 -8.121 568 HA ILE 79 HA ILE 79 0.849 5.023 -8.473 569 HB ILE 79 HB ILE 79 2.541 6.188 -6.260 570 HG12 ILE 79 HG12 ILE 79 1.380 3.403 -6.495 571 HG13 ILE 79 HG11 ILE 79 3.084 3.825 -6.422 572 HG21 ILE 79 HG21 ILE 79 0.469 5.962 -4.955 573 HG22 ILE 79 HG22 ILE 79 -0.353 5.351 -6.393 574 HG23 ILE 79 HG23 ILE 79 0.259 7.004 -6.363 575 HD11 ILE 79 HD11 ILE 79 2.714 4.702 -4.138 576 HD12 ILE 79 HD12 ILE 79 2.391 2.974 -4.301 577 HD13 ILE 79 HD13 ILE 79 1.051 4.119 -4.227 578 H THR 80 HN THR 80 -0.036 6.701 -9.554 579 HA THR 80 HA THR 80 1.657 8.901 -10.291 580 HB THR 80 HB THR 80 0.121 7.927 -11.945 581 HG1 THR 80 HG1 THR 80 0.605 10.461 -11.530 582 HG21 THR 80 HG21 THR 80 -2.066 9.151 -10.275 583 HG22 THR 80 HG22 THR 80 -1.781 7.426 -10.519 584 HG23 THR 80 HG23 THR 80 -2.263 8.442 -11.878 585 H SER 81 HN SER 81 -0.929 8.332 -8.021 586 HA SER 81 HA SER 81 -0.386 10.863 -6.756 587 HB2 SER 81 HB2 SER 81 -3.117 10.327 -7.944 588 HB3 SER 81 HB1 SER 81 -2.747 11.636 -6.824 589 HG SER 81 HG SER 81 -0.985 11.662 -8.844 590 H VAL 82 HN VAL 82 -0.782 10.807 -4.639 591 HA VAL 82 HA VAL 82 -2.393 8.615 -3.548 592 HB VAL 82 HB VAL 82 -0.059 8.115 -3.078 593 HG11 VAL 82 HG11 VAL 82 0.108 10.800 -1.722 594 HG12 VAL 82 HG12 VAL 82 0.839 10.392 -3.273 595 HG13 VAL 82 HG13 VAL 82 1.383 9.583 -1.804 596 HG21 VAL 82 HG21 VAL 82 -1.667 7.532 -1.366 597 HG22 VAL 82 HG22 VAL 82 -1.499 9.127 -0.633 598 HG23 VAL 82 HG23 VAL 82 -0.137 8.007 -0.628 599 H LYS 83 HN LYS 83 -4.181 9.513 -2.810 600 HA LYS 83 HA LYS 83 -4.036 12.078 -1.415 601 HB2 LYS 83 HB2 LYS 83 -6.136 12.667 -2.762 602 HB3 LYS 83 HB1 LYS 83 -4.587 12.760 -3.581 603 HG2 LYS 83 HG2 LYS 83 -5.274 10.200 -4.093 604 HG3 LYS 83 HG1 LYS 83 -6.864 10.962 -4.035 605 HD2 LYS 83 HD2 LYS 83 -6.049 12.619 -5.687 606 HD3 LYS 83 HD1 LYS 83 -4.541 11.702 -5.775 607 HE2 LYS 83 HE2 LYS 83 -5.728 9.748 -6.552 608 HE3 LYS 83 HE1 LYS 83 -7.270 10.580 -6.376 609 HZ1 LYS 83 HZ1 LYS 83 -6.465 10.514 -8.680 610 HZ2 LYS 83 HZ2 LYS 83 -5.110 11.422 -8.232 611 HZ3 LYS 83 HZ3 LYS 83 -6.653 12.093 -8.110 612 H SER 84 HN SER 84 -6.084 12.627 -0.351 613 HA SER 84 HA SER 84 -7.628 10.243 0.409 614 HB2 SER 84 HB2 SER 84 -8.098 11.392 2.548 615 HB3 SER 84 HB1 SER 84 -6.370 11.145 2.307 616 HG SER 84 HG SER 84 -6.339 13.213 2.779 617 H GLN 85 HN GLN 85 -9.925 10.602 0.714 618 HA GLN 85 HA GLN 85 -11.090 12.073 -1.373 619 HB2 GLN 85 HB2 GLN 85 -11.980 10.286 0.684 620 HB3 GLN 85 HB1 GLN 85 -13.071 11.663 0.602 621 HG2 GLN 85 HG2 GLN 85 -13.935 10.000 -0.832 622 HG3 GLN 85 HG1 GLN 85 -13.254 11.263 -1.856 623 HE21 GLN 85 HE21 GLN 85 -11.366 8.883 -0.127 624 HE22 GLN 85 HE22 GLN 85 -10.813 8.025 -1.518 625 H ALA 86 HN ALA 86 -13.067 13.618 -0.818 626 HA ALA 86 HA ALA 86 -11.912 16.010 0.114 627 HB1 ALA 86 HB1 ALA 86 -14.117 16.981 -0.167 628 HB2 ALA 86 HB2 ALA 86 -14.836 15.374 -0.248 629 HB3 ALA 86 HB3 ALA 86 -13.744 15.915 -1.520 630 H ASP 87 HN ASP 87 -14.292 13.830 1.608 631 HA ASP 87 HA ASP 87 -13.826 15.172 4.188 632 HB2 ASP 87 HB2 ASP 87 -16.153 15.055 3.645 633 HB3 ASP 87 HB1 ASP 87 -16.025 13.365 3.178 634 H ASN 88 HN ASN 88 -13.548 12.213 2.448 635 HA ASN 88 HA ASN 88 -12.679 10.159 2.922 636 HB2 ASN 88 HB2 ASN 88 -10.298 10.288 3.313 637 HB3 ASN 88 HB1 ASN 88 -10.811 11.541 2.197 638 HD21 ASN 88 HD21 ASN 88 -9.406 10.860 5.271 639 HD22 ASN 88 HD22 ASN 88 -9.006 12.489 5.687 640 H THR 89 HN THR 89 -14.382 10.684 5.121 641 HA THR 89 HA THR 89 -13.206 10.488 7.613 642 HB THR 89 HB THR 89 -15.807 9.266 6.684 643 HG1 THR 89 HG1 THR 89 -15.838 11.526 6.665 644 HG21 THR 89 HG21 THR 89 -15.036 8.052 8.648 645 HG22 THR 89 HG22 THR 89 -16.387 9.102 9.075 646 HG23 THR 89 HG23 THR 89 -14.739 9.572 9.493 647 H LYS 90 HN LYS 90 -14.483 7.645 5.808 648 HA LYS 90 HA LYS 90 -12.198 6.182 6.930 649 HB2 LYS 90 HB2 LYS 90 -13.504 4.119 6.735 650 HB3 LYS 90 HB1 LYS 90 -14.247 5.292 7.806 651 HG2 LYS 90 HG2 LYS 90 -15.763 5.933 5.929 652 HG3 LYS 90 HG1 LYS 90 -15.096 4.582 5.010 653 HD2 LYS 90 HD2 LYS 90 -16.568 4.433 7.642 654 HD3 LYS 90 HD1 LYS 90 -17.162 3.899 6.069 655 HE2 LYS 90 HE2 LYS 90 -15.384 2.220 5.977 656 HE3 LYS 90 HE1 LYS 90 -14.794 2.756 7.548 657 HZ1 LYS 90 HZ1 LYS 90 -17.447 1.542 6.996 658 HZ2 LYS 90 HZ2 LYS 90 -16.933 2.103 8.504 659 HZ3 LYS 90 HZ3 LYS 90 -16.148 0.792 7.778 660 H VAL 91 HN VAL 91 -12.613 7.725 4.261 661 HA VAL 91 HA VAL 91 -12.107 5.462 2.436 662 HB VAL 91 HB VAL 91 -13.083 8.174 1.572 663 HG11 VAL 91 HG11 VAL 91 -13.217 5.443 0.280 664 HG12 VAL 91 HG12 VAL 91 -12.110 6.744 -0.156 665 HG13 VAL 91 HG13 VAL 91 -13.845 6.942 -0.406 666 HG21 VAL 91 HG21 VAL 91 -14.768 5.762 2.261 667 HG22 VAL 91 HG22 VAL 91 -15.352 7.262 1.538 668 HG23 VAL 91 HG23 VAL 91 -14.693 7.268 3.172 669 H LEU 92 HN LEU 92 -10.307 5.394 1.263 670 HA LEU 92 HA LEU 92 -8.584 7.785 1.070 671 HB2 LEU 92 HB2 LEU 92 -7.961 4.917 1.525 672 HB3 LEU 92 HB1 LEU 92 -6.874 5.815 0.488 673 HG LEU 92 HG LEU 92 -6.347 7.350 2.274 674 HD11 LEU 92 HD11 LEU 92 -7.213 6.975 4.553 675 HD12 LEU 92 HD12 LEU 92 -8.347 5.791 3.901 676 HD13 LEU 92 HD13 LEU 92 -8.463 7.483 3.417 677 HD21 LEU 92 HD21 LEU 92 -6.227 4.465 3.122 678 HD22 LEU 92 HD22 LEU 92 -5.271 5.769 3.820 679 HD23 LEU 92 HD23 LEU 92 -5.049 5.321 2.128 680 H VAL 93 HN VAL 93 -7.482 8.081 -0.989 681 HA VAL 93 HA VAL 93 -8.546 6.462 -3.184 682 HB VAL 93 HB VAL 93 -9.995 8.295 -3.318 683 HG11 VAL 93 HG11 VAL 93 -9.138 9.829 -1.781 684 HG12 VAL 93 HG12 VAL 93 -9.085 10.674 -3.330 685 HG13 VAL 93 HG13 VAL 93 -7.614 9.979 -2.648 686 HG21 VAL 93 HG21 VAL 93 -9.308 9.534 -5.338 687 HG22 VAL 93 HG22 VAL 93 -9.047 7.797 -5.474 688 HG23 VAL 93 HG23 VAL 93 -7.684 8.872 -5.162 689 H ILE 94 HN ILE 94 -6.921 5.658 -4.313 690 HA ILE 94 HA ILE 94 -4.451 7.226 -4.640 691 HB ILE 94 HB ILE 94 -4.708 4.346 -3.792 692 HG12 ILE 94 HG12 ILE 94 -2.798 5.135 -2.242 693 HG13 ILE 94 HG11 ILE 94 -3.266 6.762 -2.717 694 HG21 ILE 94 HG21 ILE 94 -2.258 5.621 -4.996 695 HG22 ILE 94 HG22 ILE 94 -3.235 4.341 -5.718 696 HG23 ILE 94 HG23 ILE 94 -2.323 4.029 -4.239 697 HD11 ILE 94 HD11 ILE 94 -5.083 4.753 -1.417 698 HD12 ILE 94 HD12 ILE 94 -5.473 6.428 -1.805 699 HD13 ILE 94 HD13 ILE 94 -4.250 6.066 -0.585 700 H THR 95 HN THR 95 -3.739 7.321 -6.709 701 HA THR 95 HA THR 95 -4.979 5.478 -8.658 702 HB THR 95 HB THR 95 -4.108 8.311 -9.262 703 HG1 THR 95 HG1 THR 95 -6.799 7.473 -8.865 704 HG21 THR 95 HG21 THR 95 -5.573 8.027 -11.218 705 HG22 THR 95 HG22 THR 95 -5.921 6.374 -10.713 706 HG23 THR 95 HG23 THR 95 -4.285 6.823 -11.194 707 H VAL 96 HN VAL 96 -3.624 4.688 -10.328 708 HA VAL 96 HA VAL 96 -0.758 5.172 -9.923 709 HB VAL 96 HB VAL 96 -1.130 3.027 -9.050 710 HG11 VAL 96 HG11 VAL 96 -3.385 2.686 -9.868 711 HG12 VAL 96 HG12 VAL 96 -2.383 1.275 -10.206 712 HG13 VAL 96 HG13 VAL 96 -2.769 2.416 -11.496 713 HG21 VAL 96 HG21 VAL 96 -0.197 2.803 -11.892 714 HG22 VAL 96 HG22 VAL 96 -0.089 1.483 -10.732 715 HG23 VAL 96 HG23 VAL 96 0.792 2.985 -10.444 716 H ASN 97 HN ASN 97 0.582 5.232 -11.718 717 HA ASN 97 HA ASN 97 -0.733 5.017 -14.344 718 HB2 ASN 97 HB2 ASN 97 0.672 6.682 -15.243 719 HB3 ASN 97 HB1 ASN 97 0.178 7.318 -13.683 720 HD21 ASN 97 HD21 ASN 97 1.715 7.586 -12.078 721 HD22 ASN 97 HD22 ASN 97 3.405 7.431 -12.361 722 H ASN 98 HN ASN 98 0.525 4.091 -16.034 723 HA ASN 98 HA ASN 98 2.159 2.850 -17.022 724 HB2 ASN 98 HB2 ASN 98 3.878 3.502 -15.402 725 HB3 ASN 98 HB1 ASN 98 3.324 2.254 -14.301 726 HD21 ASN 98 HD21 ASN 98 3.834 0.104 -14.727 727 HD22 ASN 98 HD22 ASN 98 4.980 -0.349 -15.939 728 HA PRO 99 HA PRO 99 0.162 -1.273 -15.365 729 HB2 PRO 99 HB2 PRO 99 -1.048 -0.230 -12.856 730 HB3 PRO 99 HB1 PRO 99 -0.408 -1.840 -13.207 731 HG2 PRO 99 HG2 PRO 99 0.939 -0.148 -11.661 732 HG3 PRO 99 HG1 PRO 99 1.776 -1.203 -12.810 733 HD2 PRO 99 HD2 PRO 99 1.178 1.716 -13.004 734 HD3 PRO 99 HD1 PRO 99 2.615 0.814 -13.527 735 H GLN 100 HN GLN 100 -2.278 -1.634 -15.348 736 HA GLN 100 HA GLN 100 -3.562 0.349 -16.876 737 HB2 GLN 100 HB2 GLN 100 -4.721 -1.968 -15.319 738 HB3 GLN 100 HB1 GLN 100 -5.650 -0.964 -16.423 739 HG2 GLN 100 HG2 GLN 100 -4.109 -1.637 -18.244 740 HG3 GLN 100 HG1 GLN 100 -3.326 -2.741 -17.114 741 HE21 GLN 100 HE21 GLN 100 -3.871 -4.537 -18.330 742 HE22 GLN 100 HE22 GLN 100 -5.488 -5.148 -18.408 743 HA PRO 101 HA PRO 101 -4.042 3.359 -13.663 744 HB2 PRO 101 HB2 PRO 101 -6.239 4.212 -15.505 745 HB3 PRO 101 HB1 PRO 101 -4.985 5.185 -14.724 746 HG2 PRO 101 HG2 PRO 101 -4.756 4.532 -17.284 747 HG3 PRO 101 HG1 PRO 101 -3.339 4.500 -16.218 748 HD2 PRO 101 HD2 PRO 101 -4.940 2.236 -17.308 749 HD3 PRO 101 HD1 PRO 101 -3.202 2.328 -16.958 750 H THR 102 HN THR 102 -4.902 2.616 -11.878 751 HA THR 102 HA THR 102 -7.807 2.252 -11.752 752 HB THR 102 HB THR 102 -5.824 0.492 -10.286 753 HG1 THR 102 HG1 THR 102 -5.789 0.028 -12.539 754 HG21 THR 102 HG21 THR 102 -8.017 0.777 -9.194 755 HG22 THR 102 HG22 THR 102 -7.773 -0.873 -9.764 756 HG23 THR 102 HG23 THR 102 -8.810 0.226 -10.672 757 H THR 103 HN THR 103 -8.726 2.934 -9.809 758 HA THR 103 HA THR 103 -6.903 4.433 -8.056 759 HB THR 103 HB THR 103 -9.793 5.036 -8.702 760 HG1 THR 103 HG1 THR 103 -8.031 5.501 -10.309 761 HG21 THR 103 HG21 THR 103 -9.418 7.109 -7.441 762 HG22 THR 103 HG22 THR 103 -7.806 6.540 -7.006 763 HG23 THR 103 HG23 THR 103 -9.231 5.681 -6.421 764 H TYR 104 HN TYR 104 -6.630 3.404 -6.227 765 HA TYR 104 HA TYR 104 -8.599 1.448 -5.341 766 HB2 TYR 104 HB2 TYR 104 -5.865 2.049 -4.198 767 HB3 TYR 104 HB1 TYR 104 -6.852 0.623 -3.889 768 HD1 TYR 104 HD1 TYR 104 -7.407 -0.873 -5.908 769 HD2 TYR 104 HD2 TYR 104 -4.295 2.032 -5.914 770 HE1 TYR 104 HE1 TYR 104 -6.325 -2.023 -7.810 771 HE2 TYR 104 HE2 TYR 104 -3.215 0.894 -7.806 772 HH TYR 104 HH TYR 104 -4.776 -1.579 -9.599 773 H ASN 105 HN ASN 105 -10.013 1.865 -3.780 774 HA ASN 105 HA ASN 105 -9.490 4.143 -2.009 775 HB2 ASN 105 HB2 ASN 105 -12.077 2.656 -2.529 776 HB3 ASN 105 HB1 ASN 105 -11.884 3.947 -1.350 777 HD21 ASN 105 HD21 ASN 105 -10.535 3.777 -4.605 778 HD22 ASN 105 HD22 ASN 105 -11.379 5.162 -5.213 779 H PHE 106 HN PHE 106 -8.361 3.498 -0.299 780 HA PHE 106 HA PHE 106 -8.788 0.877 0.856 781 HB2 PHE 106 HB2 PHE 106 -7.001 3.147 1.765 782 HB3 PHE 106 HB1 PHE 106 -7.005 1.526 2.440 783 HD1 PHE 106 HD1 PHE 106 -6.603 -0.387 0.673 784 HD2 PHE 106 HD2 PHE 106 -5.422 3.664 0.161 785 HE1 PHE 106 HE1 PHE 106 -4.925 -1.087 -0.987 786 HE2 PHE 106 HE2 PHE 106 -3.753 2.977 -1.502 787 HZ PHE 106 HZ PHE 106 -3.463 0.626 -2.052 788 H THR 107 HN THR 107 -10.475 0.573 2.102 789 HA THR 107 HA THR 107 -11.361 2.747 3.888 790 HB THR 107 HB THR 107 -13.093 0.617 2.612 791 HG1 THR 107 HG1 THR 107 -12.135 2.252 1.161 792 HG21 THR 107 HG21 THR 107 -13.983 1.501 4.708 793 HG22 THR 107 HG22 THR 107 -14.948 2.050 3.338 794 HG23 THR 107 HG23 THR 107 -13.799 3.147 4.103 795 H PHE 108 HN PHE 108 -11.592 2.213 6.038 796 HA PHE 108 HA PHE 108 -11.724 -0.617 6.738 797 HB2 PHE 108 HB2 PHE 108 -9.287 0.241 6.843 798 HB3 PHE 108 HB1 PHE 108 -9.819 1.198 8.216 799 HD1 PHE 108 HD1 PHE 108 -9.045 0.304 10.175 800 HD2 PHE 108 HD2 PHE 108 -10.483 -2.310 7.144 801 HE1 PHE 108 HE1 PHE 108 -8.681 -1.619 11.665 802 HE2 PHE 108 HE2 PHE 108 -10.125 -4.237 8.627 803 HZ PHE 108 HZ PHE 108 -9.234 -3.884 10.904 804 H LYS 109 HN LYS 109 -12.158 -0.843 9.147 805 HA LYS 109 HA LYS 109 -14.462 0.647 9.813 806 HB2 LYS 109 HB2 LYS 109 -14.096 -1.676 10.522 807 HB3 LYS 109 HB1 LYS 109 -12.721 -1.178 11.491 808 HG2 LYS 109 HG2 LYS 109 -15.402 0.000 12.044 809 HG3 LYS 109 HG1 LYS 109 -15.036 -1.636 12.593 810 HD2 LYS 109 HD2 LYS 109 -13.077 -0.784 13.796 811 HD3 LYS 109 HD1 LYS 109 -13.456 0.851 13.253 812 HE2 LYS 109 HE2 LYS 109 -14.245 0.520 15.521 813 HE3 LYS 109 HE1 LYS 109 -15.610 0.722 14.425 814 HZ1 LYS 109 HZ1 LYS 109 -14.599 -1.874 15.452 815 HZ2 LYS 109 HZ2 LYS 109 -15.925 -1.667 14.421 816 HZ3 LYS 109 HZ3 LYS 109 -15.982 -1.069 16.001 817 H SER 110 HN SER 110 -11.128 0.696 10.941 818 HA SER 110 HA SER 110 -11.500 2.625 12.981 819 HB2 SER 110 HB2 SER 110 -9.614 1.084 13.027 820 HB3 SER 110 HB1 SER 110 -9.021 1.743 11.502 821 HG SER 110 HG SER 110 -8.116 2.523 13.651 822 HA PRO 111 HA PRO 111 -11.595 6.227 10.268 823 HB2 PRO 111 HB2 PRO 111 -11.589 7.689 12.816 824 HB3 PRO 111 HB1 PRO 111 -12.789 7.701 11.522 825 HG2 PRO 111 HG2 PRO 111 -13.276 6.531 13.889 826 HG3 PRO 111 HG1 PRO 111 -13.919 5.877 12.370 827 HD2 PRO 111 HD2 PRO 111 -11.552 4.971 13.973 828 HD3 PRO 111 HD1 PRO 111 -12.808 4.004 13.168 829 H GLY 112 HN GLY 112 -9.174 5.032 12.189 830 HA2 GLY 112 HA2 GLY 112 -7.424 7.318 11.528 831 HA3 GLY 112 HA1 GLY 112 -7.173 6.275 12.918 832 H GLU 113 HN GLU 113 -7.715 3.805 11.521 833 HA GLU 113 HA GLU 113 -5.119 3.027 11.051 834 HB2 GLU 113 HB2 GLU 113 -7.106 1.544 11.467 835 HB3 GLU 113 HB1 GLU 113 -7.544 1.758 9.780 836 HG2 GLU 113 HG2 GLU 113 -6.393 -0.330 10.064 837 HG3 GLU 113 HG1 GLU 113 -5.399 0.775 9.115 838 H ARG 114 HN ARG 114 -7.529 3.993 8.669 839 HA ARG 114 HA ARG 114 -5.984 3.217 6.413 840 HB2 ARG 114 HB2 ARG 114 -8.154 5.288 6.311 841 HB3 ARG 114 HB1 ARG 114 -7.711 4.093 5.101 842 HG2 ARG 114 HG2 ARG 114 -9.106 2.582 5.935 843 HG3 ARG 114 HG1 ARG 114 -8.585 2.886 7.593 844 HD2 ARG 114 HD2 ARG 114 -10.588 4.478 5.998 845 HD3 ARG 114 HD1 ARG 114 -10.915 3.434 7.383 846 HE ARG 114 HE ARG 114 -10.004 5.039 8.808 847 HH11 ARG 114 HH11 ARG 114 -10.005 6.111 5.470 848 HH12 ARG 114 HH12 ARG 114 -9.700 7.772 5.867 849 HH21 ARG 114 HH21 ARG 114 -9.550 7.246 9.319 850 HH22 ARG 114 HH22 ARG 114 -9.436 8.416 8.045 851 H GLU 115 HN GLU 115 -6.551 6.285 8.079 852 HA GLU 115 HA GLU 115 -5.137 7.852 6.191 853 HB2 GLU 115 HB2 GLU 115 -6.159 8.325 8.961 854 HB3 GLU 115 HB1 GLU 115 -5.132 9.513 8.171 855 HG2 GLU 115 HG2 GLU 115 -6.701 9.666 6.322 856 HG3 GLU 115 HG1 GLU 115 -7.718 8.439 7.070 857 H SER 116 HN SER 116 -4.214 6.236 9.183 858 HA SER 116 HA SER 116 -1.564 7.092 9.340 859 HB2 SER 116 HB2 SER 116 -2.539 4.267 9.864 860 HB3 SER 116 HB1 SER 116 -1.126 5.056 10.567 861 HG SER 116 HG SER 116 -2.561 6.540 11.578 862 H TRP 117 HN TRP 117 -3.062 4.558 7.395 863 HA TRP 117 HA TRP 117 -0.701 3.610 6.141 864 HB2 TRP 117 HB2 TRP 117 -3.186 2.673 6.254 865 HB3 TRP 117 HB1 TRP 117 -3.346 3.559 4.743 866 HD1 TRP 117 HD1 TRP 117 -1.921 0.414 6.216 867 HE1 TRP 117 HE1 TRP 117 -0.908 -1.043 4.354 868 HE3 TRP 117 HE3 TRP 117 -2.082 3.783 2.374 869 HZ2 TRP 117 HZ2 TRP 117 -0.263 -0.802 1.633 870 HZ3 TRP 117 HZ3 TRP 117 -1.241 3.084 0.170 871 HH2 TRP 117 HH2 TRP 117 -0.352 0.842 -0.191 872 H GLN 118 HN GLN 118 -3.134 6.005 5.282 873 HA GLN 118 HA GLN 118 -2.339 6.704 2.735 874 HB2 GLN 118 HB2 GLN 118 -4.397 7.539 3.616 875 HB3 GLN 118 HB1 GLN 118 -3.577 8.353 4.936 876 HG2 GLN 118 HG2 GLN 118 -4.340 9.944 3.292 877 HG3 GLN 118 HG1 GLN 118 -2.580 9.920 3.358 878 HE21 GLN 118 HE21 GLN 118 -4.487 7.466 1.738 879 HE22 GLN 118 HE22 GLN 118 -4.010 7.892 0.135 880 H GLU 119 HN GLU 119 -1.212 8.163 5.803 881 HA GLU 119 HA GLU 119 0.595 9.898 4.420 882 HB2 GLU 119 HB2 GLU 119 1.397 10.506 6.658 883 HB3 GLU 119 HB1 GLU 119 -0.356 10.568 6.540 884 HG2 GLU 119 HG2 GLU 119 -0.541 8.453 7.687 885 HG3 GLU 119 HG1 GLU 119 1.214 8.303 7.741 886 H GLN 120 HN GLN 120 0.840 6.732 5.886 887 HA GLN 120 HA GLN 120 3.667 6.690 6.101 888 HB2 GLN 120 HB2 GLN 120 1.489 4.670 6.289 889 HB3 GLN 120 HB1 GLN 120 3.139 4.099 6.083 890 HG2 GLN 120 HG2 GLN 120 2.224 5.962 8.261 891 HG3 GLN 120 HG1 GLN 120 2.429 4.221 8.440 892 HE21 GLN 120 HE21 GLN 120 4.761 4.270 6.622 893 HE22 GLN 120 HE22 GLN 120 6.068 4.859 7.594 894 H ILE 121 HN ILE 121 1.407 5.526 3.649 895 HA ILE 121 HA ILE 121 3.328 4.301 2.000 896 HB ILE 121 HB ILE 121 0.898 3.929 1.762 897 HG12 ILE 121 HG12 ILE 121 0.833 3.940 -0.714 898 HG13 ILE 121 HG11 ILE 121 2.256 4.974 -0.732 899 HG21 ILE 121 HG21 ILE 121 0.919 6.758 0.724 900 HG22 ILE 121 HG22 ILE 121 -0.009 6.095 2.076 901 HG23 ILE 121 HG23 ILE 121 -0.398 5.620 0.420 902 HD11 ILE 121 HD11 ILE 121 2.151 2.190 0.402 903 HD12 ILE 121 HD12 ILE 121 3.576 3.221 0.273 904 HD13 ILE 121 HD13 ILE 121 2.783 2.629 -1.185 905 H GLN 122 HN GLN 122 2.196 7.616 2.270 906 HA GLN 122 HA GLN 122 3.324 8.663 -0.088 907 HB2 GLN 122 HB2 GLN 122 2.939 10.019 2.591 908 HB3 GLN 122 HB1 GLN 122 3.242 10.834 1.071 909 HG2 GLN 122 HG2 GLN 122 1.128 10.123 0.204 910 HG3 GLN 122 HG1 GLN 122 0.831 9.150 1.644 911 HE21 GLN 122 HE21 GLN 122 -1.006 10.222 2.234 912 HE22 GLN 122 HE22 GLN 122 -1.019 11.854 2.807 913 H SER 123 HN SER 123 4.572 8.412 3.209 914 HA SER 123 HA SER 123 7.057 9.620 2.792 915 HB2 SER 123 HB2 SER 123 6.372 7.417 4.752 916 HB3 SER 123 HB1 SER 123 7.700 8.571 4.891 917 HG SER 123 HG SER 123 5.732 9.060 6.113 918 H LEU 124 HN LEU 124 6.022 6.252 2.504 919 HA LEU 124 HA LEU 124 8.574 5.179 1.890 920 HB2 LEU 124 HB2 LEU 124 6.644 3.861 2.707 921 HB3 LEU 124 HB1 LEU 124 5.815 4.151 1.196 922 HG LEU 124 HG LEU 124 6.950 1.864 1.586 923 HD11 LEU 124 HD11 LEU 124 7.509 1.658 -0.784 924 HD12 LEU 124 HD12 LEU 124 7.452 3.414 -0.942 925 HD13 LEU 124 HD13 LEU 124 5.990 2.518 -0.534 926 HD21 LEU 124 HD21 LEU 124 9.354 3.485 0.765 927 HD22 LEU 124 HD22 LEU 124 9.278 1.728 0.896 928 HD23 LEU 124 HD23 LEU 124 9.105 2.728 2.337 929 H MET 125 HN MET 125 5.861 6.266 -0.113 930 HA MET 125 HA MET 125 6.895 5.632 -2.625 931 HB2 MET 125 HB2 MET 125 5.069 7.858 -1.730 932 HB3 MET 125 HB1 MET 125 5.438 7.547 -3.418 933 HG2 MET 125 HG2 MET 125 4.362 5.455 -3.368 934 HG3 MET 125 HG1 MET 125 4.261 5.465 -1.608 935 HE1 MET 125 HE1 MET 125 3.297 7.571 -4.752 936 HE2 MET 125 HE2 MET 125 3.625 8.792 -3.515 937 HE3 MET 125 HE3 MET 125 1.984 8.568 -4.125 938 H LYS 126 HN LYS 126 7.116 8.680 -0.820 939 HA LYS 126 HA LYS 126 8.675 9.945 -2.850 940 HB2 LYS 126 HB2 LYS 126 8.252 10.781 0.023 941 HB3 LYS 126 HB1 LYS 126 8.862 11.800 -1.276 942 HG2 LYS 126 HG2 LYS 126 6.112 10.574 -1.135 943 HG3 LYS 126 HG1 LYS 126 6.517 12.263 -0.825 944 HD2 LYS 126 HD2 LYS 126 7.162 12.595 -3.106 945 HD3 LYS 126 HD1 LYS 126 7.039 10.869 -3.448 946 HE2 LYS 126 HE2 LYS 126 4.642 10.943 -3.054 947 HE3 LYS 126 HE1 LYS 126 4.746 12.654 -2.648 948 HZ1 LYS 126 HZ1 LYS 126 3.985 12.257 -4.929 949 HZ2 LYS 126 HZ2 LYS 126 5.456 11.501 -5.289 950 HZ3 LYS 126 HZ3 LYS 126 5.424 13.141 -4.884 951 H PHE 127 HN PHE 127 9.418 7.854 -0.275 952 HA PHE 127 HA PHE 127 12.088 8.694 0.209 953 HB2 PHE 127 HB2 PHE 127 10.806 7.330 1.801 954 HB3 PHE 127 HB1 PHE 127 10.771 6.006 0.641 955 HD1 PHE 127 HD1 PHE 127 12.248 4.308 0.991 956 HD2 PHE 127 HD2 PHE 127 13.302 8.229 2.255 957 HE1 PHE 127 HE1 PHE 127 14.351 3.440 1.910 958 HE2 PHE 127 HE2 PHE 127 15.414 7.368 3.177 959 HZ PHE 127 HZ PHE 127 15.942 4.971 3.005 960 H MET 128 HN MET 128 10.717 6.048 -1.760 961 HA MET 128 HA MET 128 13.364 5.571 -2.898 962 HB2 MET 128 HB2 MET 128 12.339 3.606 -3.964 963 HB3 MET 128 HB1 MET 128 12.123 3.604 -2.222 964 HG2 MET 128 HG2 MET 128 9.856 4.072 -2.374 965 HG3 MET 128 HG1 MET 128 9.995 4.680 -4.025 966 HE1 MET 128 HE1 MET 128 10.295 3.191 -6.135 967 HE2 MET 128 HE2 MET 128 10.436 1.434 -6.112 968 HE3 MET 128 HE3 MET 128 11.740 2.431 -5.470 969 H SER 129 HN SER 129 10.327 6.990 -3.739 970 HA SER 129 HA SER 129 11.159 7.227 -6.548 971 HB2 SER 129 HB2 SER 129 8.934 6.157 -6.016 972 HB3 SER 129 HB1 SER 129 8.406 7.715 -5.391 973 HG SER 129 HG SER 129 9.253 7.144 -8.052 974 H MET 130 HN MET 130 12.244 8.792 -4.394 975 HA MET 130 HA MET 130 11.197 11.359 -4.203 976 HB2 MET 130 HB2 MET 130 13.585 12.044 -3.714 977 HB3 MET 130 HB1 MET 130 12.911 10.781 -2.691 978 HG2 MET 130 HG2 MET 130 14.018 9.113 -4.128 979 HG3 MET 130 HG1 MET 130 14.799 10.428 -5.001 980 HE1 MET 130 HE1 MET 130 17.682 8.818 -2.846 981 HE2 MET 130 HE2 MET 130 17.164 9.250 -4.473 982 HE3 MET 130 HE3 MET 130 16.317 7.984 -3.586 983 H LYS 131 HN LYS 131 11.171 13.089 -5.496 984 HA LYS 131 HA LYS 131 12.168 12.704 -8.217 985 HB2 LYS 131 HB2 LYS 131 10.243 14.785 -7.171 986 HB3 LYS 131 HB1 LYS 131 10.595 14.441 -8.858 987 HG2 LYS 131 HG2 LYS 131 9.271 12.554 -6.917 988 HG3 LYS 131 HG1 LYS 131 8.454 13.498 -8.165 989 HD2 LYS 131 HD2 LYS 131 10.584 11.426 -8.696 990 HD3 LYS 131 HD1 LYS 131 8.850 11.131 -8.808 991 HE2 LYS 131 HE2 LYS 131 10.411 13.134 -10.434 992 HE3 LYS 131 HE1 LYS 131 9.832 11.571 -11.003 993 HZ1 LYS 131 HZ1 LYS 131 8.362 13.353 -11.686 994 HZ2 LYS 131 HZ2 LYS 131 8.121 13.813 -10.078 995 HZ3 LYS 131 HZ3 LYS 131 7.564 12.312 -10.619 Start of MODEL 8 1 H1 SER 11 HT1 SER 11 26.232 2.183 3.296 2 H2 SER 11 HT2 SER 11 24.628 1.949 3.771 3 H3 SER 11 HT3 SER 11 25.093 3.412 3.061 4 HA SER 11 HA SER 11 25.538 2.328 0.995 5 HB2 SER 11 HB2 SER 11 24.628 -0.156 2.464 6 HB3 SER 11 HB1 SER 11 25.047 -0.065 0.758 7 HG SER 11 HG SER 11 26.805 -0.824 2.004 8 H ALA 12 HN ALA 12 23.985 2.891 -0.344 9 HA ALA 12 HA ALA 12 21.523 3.823 0.593 10 HB1 ALA 12 HB1 ALA 12 20.999 4.284 -1.725 11 HB2 ALA 12 HB2 ALA 12 22.310 3.231 -2.251 12 HB3 ALA 12 HB3 ALA 12 22.673 4.717 -1.376 13 H SER 13 HN SER 13 22.322 0.863 -1.190 14 HA SER 13 HA SER 13 19.658 0.003 -1.539 15 HB2 SER 13 HB2 SER 13 21.580 -0.914 -2.818 16 HB3 SER 13 HB1 SER 13 22.164 -1.692 -1.348 17 HG SER 13 HG SER 13 20.993 -3.228 -2.368 18 H ASP 14 HN ASP 14 22.087 -0.724 0.933 19 HA ASP 14 HA ASP 14 20.528 -2.562 2.385 20 HB2 ASP 14 HB2 ASP 14 22.940 -0.913 3.080 21 HB3 ASP 14 HB1 ASP 14 22.161 -1.931 4.283 22 H ILE 15 HN ILE 15 21.105 0.921 2.890 23 HA ILE 15 HA ILE 15 19.535 1.045 5.230 24 HB ILE 15 HB ILE 15 21.204 2.800 4.581 25 HG12 ILE 15 HG12 ILE 15 19.635 4.709 5.345 26 HG13 ILE 15 HG11 ILE 15 18.386 3.460 5.386 27 HG21 ILE 15 HG21 ILE 15 18.995 3.800 2.792 28 HG22 ILE 15 HG22 ILE 15 20.507 3.081 2.236 29 HG23 ILE 15 HG23 ILE 15 20.529 4.608 3.119 30 HD11 ILE 15 HD11 ILE 15 20.948 3.468 6.959 31 HD12 ILE 15 HD12 ILE 15 19.752 2.175 6.960 32 HD13 ILE 15 HD13 ILE 15 19.327 3.770 7.580 33 H ARG 16 HN ARG 16 18.766 1.502 1.818 34 HA ARG 16 HA ARG 16 16.104 2.333 2.151 35 HB2 ARG 16 HB2 ARG 16 17.167 2.495 -0.012 36 HB3 ARG 16 HB1 ARG 16 17.460 0.764 -0.054 37 HG2 ARG 16 HG2 ARG 16 14.976 0.435 -0.082 38 HG3 ARG 16 HG1 ARG 16 14.819 2.183 -0.290 39 HD2 ARG 16 HD2 ARG 16 16.212 2.037 -2.314 40 HD3 ARG 16 HD1 ARG 16 16.287 0.289 -2.114 41 HE ARG 16 HE ARG 16 13.614 0.859 -2.177 42 HH11 ARG 16 HH11 ARG 16 16.337 1.359 -4.297 43 HH12 ARG 16 HH12 ARG 16 15.380 1.403 -5.741 44 HH21 ARG 16 HH21 ARG 16 12.329 0.926 -4.083 45 HH22 ARG 16 HH22 ARG 16 13.098 1.163 -5.619 46 H MET 17 HN MET 17 17.521 -0.906 1.760 47 HA MET 17 HA MET 17 15.127 -2.327 1.757 48 HB2 MET 17 HB2 MET 17 17.904 -3.111 2.623 49 HB3 MET 17 HB1 MET 17 16.566 -4.249 2.640 50 HG2 MET 17 HG2 MET 17 16.256 -3.923 0.239 51 HG3 MET 17 HG1 MET 17 17.600 -2.782 0.223 52 HE1 MET 17 HE1 MET 17 18.731 -4.232 -1.752 53 HE2 MET 17 HE2 MET 17 17.361 -5.340 -1.683 54 HE3 MET 17 HE3 MET 17 19.007 -5.970 -1.629 55 H LYS 18 HN LYS 18 17.123 -1.286 4.523 56 HA LYS 18 HA LYS 18 15.387 -2.577 6.398 57 HB2 LYS 18 HB2 LYS 18 16.614 -1.492 8.141 58 HB3 LYS 18 HB1 LYS 18 17.751 -2.066 6.936 59 HG2 LYS 18 HG2 LYS 18 18.454 0.015 6.412 60 HG3 LYS 18 HG1 LYS 18 16.856 0.732 6.631 61 HD2 LYS 18 HD2 LYS 18 18.447 1.521 8.325 62 HD3 LYS 18 HD1 LYS 18 17.116 0.619 9.048 63 HE2 LYS 18 HE2 LYS 18 19.175 -0.041 10.100 64 HE3 LYS 18 HE1 LYS 18 18.570 -1.381 9.128 65 HZ1 LYS 18 HZ1 LYS 18 20.934 -1.101 8.834 66 HZ2 LYS 18 HZ2 LYS 18 20.727 0.500 8.344 67 HZ3 LYS 18 HZ3 LYS 18 20.137 -0.761 7.385 68 H LYS 19 HN LYS 19 15.540 0.617 4.960 69 HA LYS 19 HA LYS 19 13.704 1.822 6.785 70 HB2 LYS 19 HB2 LYS 19 15.424 2.760 4.834 71 HB3 LYS 19 HB1 LYS 19 13.828 3.080 4.166 72 HG2 LYS 19 HG2 LYS 19 14.934 4.041 6.791 73 HG3 LYS 19 HG1 LYS 19 14.531 5.009 5.373 74 HD2 LYS 19 HD2 LYS 19 12.167 4.367 5.644 75 HD3 LYS 19 HD1 LYS 19 12.593 3.469 7.104 76 HE2 LYS 19 HE2 LYS 19 12.973 6.434 6.685 77 HE3 LYS 19 HE1 LYS 19 11.683 5.684 7.622 78 HZ1 LYS 19 HZ1 LYS 19 13.383 4.758 9.102 79 HZ2 LYS 19 HZ2 LYS 19 13.436 6.444 9.068 80 HZ3 LYS 19 HZ3 LYS 19 14.590 5.550 8.220 81 H VAL 20 HN VAL 20 13.406 0.373 3.588 82 HA VAL 20 HA VAL 20 10.664 0.985 3.287 83 HB VAL 20 HB VAL 20 10.607 -0.704 1.529 84 HG11 VAL 20 HG11 VAL 20 11.618 1.555 1.154 85 HG12 VAL 20 HG12 VAL 20 12.175 0.301 0.047 86 HG13 VAL 20 HG13 VAL 20 13.204 0.809 1.386 87 HG21 VAL 20 HG21 VAL 20 12.608 -2.013 0.991 88 HG22 VAL 20 HG22 VAL 20 11.958 -2.424 2.578 89 HG23 VAL 20 HG23 VAL 20 13.389 -1.401 2.449 90 H MET 21 HN MET 21 12.394 -1.651 4.844 91 HA MET 21 HA MET 21 10.119 -3.235 5.433 92 HB2 MET 21 HB2 MET 21 12.838 -3.000 6.708 93 HB3 MET 21 HB1 MET 21 11.608 -4.081 7.344 94 HG2 MET 21 HG2 MET 21 12.654 -4.160 4.529 95 HG3 MET 21 HG1 MET 21 13.242 -5.173 5.846 96 HE1 MET 21 HE1 MET 21 11.889 -7.078 6.981 97 HE2 MET 21 HE2 MET 21 10.198 -7.442 6.643 98 HE3 MET 21 HE3 MET 21 10.630 -5.935 7.447 99 H GLN 22 HN GLN 22 11.733 -0.580 7.122 100 HA GLN 22 HA GLN 22 10.118 -0.439 9.383 101 HB2 GLN 22 HB2 GLN 22 11.432 1.783 7.798 102 HB3 GLN 22 HB1 GLN 22 10.725 1.987 9.396 103 HG2 GLN 22 HG2 GLN 22 12.306 0.386 10.308 104 HG3 GLN 22 HG1 GLN 22 13.007 0.148 8.719 105 HE21 GLN 22 HE21 GLN 22 14.548 1.528 8.012 106 HE22 GLN 22 HE22 GLN 22 15.114 2.895 8.907 107 H TYR 23 HN TYR 23 9.683 1.026 6.174 108 HA TYR 23 HA TYR 23 7.128 2.137 6.773 109 HB2 TYR 23 HB2 TYR 23 8.621 1.628 4.213 110 HB3 TYR 23 HB1 TYR 23 6.957 2.198 4.193 111 HD1 TYR 23 HD1 TYR 23 10.318 3.210 4.169 112 HD2 TYR 23 HD2 TYR 23 6.509 4.303 5.719 113 HE1 TYR 23 HE1 TYR 23 11.091 5.533 4.424 114 HE2 TYR 23 HE2 TYR 23 7.275 6.624 5.982 115 HH TYR 23 HH TYR 23 9.412 7.833 6.253 116 H ARG 24 HN ARG 24 8.241 -0.950 5.673 117 HA ARG 24 HA ARG 24 5.937 -1.892 4.395 118 HB2 ARG 24 HB2 ARG 24 8.232 -2.899 4.274 119 HB3 ARG 24 HB1 ARG 24 7.978 -3.547 5.888 120 HG2 ARG 24 HG2 ARG 24 6.245 -4.978 5.135 121 HG3 ARG 24 HG1 ARG 24 6.176 -4.173 3.565 122 HD2 ARG 24 HD2 ARG 24 8.428 -4.962 3.053 123 HD3 ARG 24 HD1 ARG 24 8.525 -5.747 4.626 124 HE ARG 24 HE ARG 24 6.415 -6.525 2.739 125 HH11 ARG 24 HH11 ARG 24 9.348 -7.319 4.484 126 HH12 ARG 24 HH12 ARG 24 9.199 -9.026 4.220 127 HH21 ARG 24 HH21 ARG 24 6.220 -8.771 2.374 128 HH22 ARG 24 HH22 ARG 24 7.413 -9.856 3.011 129 H ARG 25 HN ARG 25 6.969 -2.095 7.768 130 HA ARG 25 HA ARG 25 4.854 -3.659 8.744 131 HB2 ARG 25 HB2 ARG 25 6.288 -1.410 10.155 132 HB3 ARG 25 HB1 ARG 25 5.344 -2.678 10.922 133 HG2 ARG 25 HG2 ARG 25 6.945 -4.345 10.057 134 HG3 ARG 25 HG1 ARG 25 7.916 -3.023 9.399 135 HD2 ARG 25 HD2 ARG 25 8.084 -2.086 11.677 136 HD3 ARG 25 HD1 ARG 25 7.227 -3.497 12.285 137 HE ARG 25 HE ARG 25 9.198 -4.760 11.204 138 HH11 ARG 25 HH11 ARG 25 9.412 -1.600 12.703 139 HH12 ARG 25 HH12 ARG 25 11.051 -1.816 13.227 140 HH21 ARG 25 HH21 ARG 25 11.356 -5.054 11.902 141 HH22 ARG 25 HH22 ARG 25 12.158 -3.788 12.777 142 H ALA 26 HN ALA 26 5.126 -0.241 8.060 143 HA ALA 26 HA ALA 26 2.628 0.434 9.324 144 HB1 ALA 26 HB1 ALA 26 3.117 2.678 8.657 145 HB2 ALA 26 HB2 ALA 26 4.362 2.122 7.541 146 HB3 ALA 26 HB3 ALA 26 4.593 1.944 9.280 147 H LEU 27 HN LEU 27 3.600 -0.701 6.282 148 HA LEU 27 HA LEU 27 1.125 0.212 5.014 149 HB2 LEU 27 HB2 LEU 27 3.748 -0.760 4.048 150 HB3 LEU 27 HB1 LEU 27 2.357 -1.203 3.083 151 HG LEU 27 HG LEU 27 1.945 0.981 2.413 152 HD11 LEU 27 HD11 LEU 27 3.551 1.965 4.774 153 HD12 LEU 27 HD12 LEU 27 1.795 2.011 4.615 154 HD13 LEU 27 HD13 LEU 27 2.802 2.983 3.542 155 HD21 LEU 27 HD21 LEU 27 4.085 1.956 1.763 156 HD22 LEU 27 HD22 LEU 27 4.075 0.209 1.519 157 HD23 LEU 27 HD23 LEU 27 4.918 0.902 2.906 158 H THR 28 HN THR 28 2.469 -2.507 6.573 159 HA THR 28 HA THR 28 0.765 -4.457 5.307 160 HB THR 28 HB THR 28 2.440 -4.661 7.819 161 HG1 THR 28 HG1 THR 28 3.795 -4.399 6.087 162 HG21 THR 28 HG21 THR 28 1.163 -6.837 6.159 163 HG22 THR 28 HG22 THR 28 0.648 -6.333 7.770 164 HG23 THR 28 HG23 THR 28 2.231 -7.077 7.541 165 H LYS 29 HN LYS 29 -1.338 -4.390 5.648 166 HA LYS 29 HA LYS 29 -2.451 -4.013 8.321 167 HB2 LYS 29 HB2 LYS 29 -2.600 -2.012 6.128 168 HB3 LYS 29 HB1 LYS 29 -4.100 -2.351 6.967 169 HG2 LYS 29 HG2 LYS 29 -3.203 -0.477 8.026 170 HG3 LYS 29 HG1 LYS 29 -2.851 -1.820 9.107 171 HD2 LYS 29 HD2 LYS 29 -0.581 -1.879 8.432 172 HD3 LYS 29 HD1 LYS 29 -0.887 -0.779 7.086 173 HE2 LYS 29 HE2 LYS 29 0.210 0.347 8.966 174 HE3 LYS 29 HE1 LYS 29 -1.376 1.014 8.620 175 HZ1 LYS 29 HZ1 LYS 29 -2.295 0.007 10.499 176 HZ2 LYS 29 HZ2 LYS 29 -0.804 0.604 11.034 177 HZ3 LYS 29 HZ3 LYS 29 -0.979 -1.044 10.703 178 H VAL 30 HN VAL 30 -4.824 -4.352 8.288 179 HA VAL 30 HA VAL 30 -5.754 -5.746 5.877 180 HB VAL 30 HB VAL 30 -7.698 -6.493 7.265 181 HG11 VAL 30 HG11 VAL 30 -5.808 -7.970 6.873 182 HG12 VAL 30 HG12 VAL 30 -6.464 -8.220 8.491 183 HG13 VAL 30 HG13 VAL 30 -4.974 -7.300 8.276 184 HG21 VAL 30 HG21 VAL 30 -7.593 -4.738 8.981 185 HG22 VAL 30 HG22 VAL 30 -6.081 -5.425 9.577 186 HG23 VAL 30 HG23 VAL 30 -7.576 -6.354 9.689 187 H VAL 31 HN VAL 31 -7.196 -4.760 4.603 188 HA VAL 31 HA VAL 31 -8.712 -2.481 5.568 189 HB VAL 31 HB VAL 31 -6.191 -2.143 4.228 190 HG11 VAL 31 HG11 VAL 31 -7.435 -2.200 2.141 191 HG12 VAL 31 HG12 VAL 31 -6.832 -0.577 2.481 192 HG13 VAL 31 HG13 VAL 31 -8.531 -0.959 2.750 193 HG21 VAL 31 HG21 VAL 31 -8.240 -0.147 5.163 194 HG22 VAL 31 HG22 VAL 31 -6.548 0.195 4.799 195 HG23 VAL 31 HG23 VAL 31 -6.965 -0.865 6.147 196 H LYS 32 HN LYS 32 -10.262 -1.731 3.943 197 HA LYS 32 HA LYS 32 -11.025 -4.001 2.243 198 HB2 LYS 32 HB2 LYS 32 -12.490 -3.246 4.216 199 HB3 LYS 32 HB1 LYS 32 -12.864 -1.833 3.239 200 HG2 LYS 32 HG2 LYS 32 -13.245 -4.530 2.046 201 HG3 LYS 32 HG1 LYS 32 -14.420 -3.942 3.231 202 HD2 LYS 32 HD2 LYS 32 -14.626 -1.864 1.828 203 HD3 LYS 32 HD1 LYS 32 -13.650 -2.681 0.606 204 HE2 LYS 32 HE2 LYS 32 -16.010 -2.908 0.092 205 HE3 LYS 32 HE1 LYS 32 -15.315 -4.477 0.492 206 HZ1 LYS 32 HZ1 LYS 32 -17.479 -4.121 1.534 207 HZ2 LYS 32 HZ2 LYS 32 -16.876 -2.777 2.361 208 HZ3 LYS 32 HZ3 LYS 32 -16.263 -4.319 2.689 209 H LEU 33 HN LEU 33 -10.883 -3.740 0.147 210 HA LEU 33 HA LEU 33 -10.420 -1.076 -0.929 211 HB2 LEU 33 HB2 LEU 33 -10.031 -3.849 -1.954 212 HB3 LEU 33 HB1 LEU 33 -10.179 -2.534 -3.105 213 HG LEU 33 HG LEU 33 -8.103 -2.720 -0.918 214 HD11 LEU 33 HD11 LEU 33 -7.856 -3.049 -3.907 215 HD12 LEU 33 HD12 LEU 33 -7.735 -4.339 -2.712 216 HD13 LEU 33 HD13 LEU 33 -6.525 -3.058 -2.751 217 HD21 LEU 33 HD21 LEU 33 -8.677 -0.417 -1.372 218 HD22 LEU 33 HD22 LEU 33 -8.538 -0.691 -3.107 219 HD23 LEU 33 HD23 LEU 33 -7.105 -0.779 -2.083 220 H LYS 34 HN LYS 34 -11.715 -0.002 -2.294 221 HA LYS 34 HA LYS 34 -14.152 -1.312 -3.291 222 HB2 LYS 34 HB2 LYS 34 -14.305 1.457 -2.127 223 HB3 LYS 34 HB1 LYS 34 -15.618 0.356 -2.509 224 HG2 LYS 34 HG2 LYS 34 -14.909 -1.081 -0.637 225 HG3 LYS 34 HG1 LYS 34 -13.671 0.108 -0.231 226 HD2 LYS 34 HD2 LYS 34 -16.661 0.520 -0.227 227 HD3 LYS 34 HD1 LYS 34 -15.604 0.443 1.182 228 HE2 LYS 34 HE2 LYS 34 -14.473 2.483 0.448 229 HE3 LYS 34 HE1 LYS 34 -15.510 2.552 -0.975 230 HZ1 LYS 34 HZ1 LYS 34 -16.326 4.035 0.720 231 HZ2 LYS 34 HZ2 LYS 34 -16.400 2.777 1.849 232 HZ3 LYS 34 HZ3 LYS 34 -17.427 2.771 0.507 233 H THR 35 HN THR 35 -13.805 -1.125 -5.453 234 HA THR 35 HA THR 35 -13.833 1.443 -6.650 235 HB THR 35 HB THR 35 -11.543 1.606 -5.986 236 HG1 THR 35 HG1 THR 35 -10.864 2.270 -7.874 237 HG21 THR 35 HG21 THR 35 -9.829 -0.023 -6.642 238 HG22 THR 35 HG22 THR 35 -11.084 -1.054 -7.321 239 HG23 THR 35 HG23 THR 35 -11.050 -0.739 -5.589 240 H HIS 36 HN HIS 36 -12.803 0.940 -9.150 241 HA HIS 36 HA HIS 36 -14.732 -0.634 -10.429 242 HB2 HIS 36 HB2 HIS 36 -13.527 1.079 -11.635 243 HB3 HIS 36 HB1 HIS 36 -11.993 0.273 -11.343 244 HD1 HIS 36 HD1 HIS 36 -11.157 -0.895 -13.335 245 HD2 HIS 36 HD2 HIS 36 -15.310 -0.816 -13.243 246 HE1 HIS 36 HE1 HIS 36 -11.900 -2.092 -15.414 247 HE2 HIS 36 HE2 HIS 36 -14.411 -2.172 -15.255 248 H LEU 37 HN LEU 37 -11.738 -1.459 -8.977 249 HA LEU 37 HA LEU 37 -11.239 -3.964 -10.147 250 HB2 LEU 37 HB2 LEU 37 -9.597 -2.747 -8.820 251 HB3 LEU 37 HB1 LEU 37 -10.615 -2.870 -7.403 252 HG LEU 37 HG LEU 37 -10.288 -5.341 -7.445 253 HD11 LEU 37 HD11 LEU 37 -9.727 -5.593 -9.810 254 HD12 LEU 37 HD12 LEU 37 -8.456 -6.248 -8.777 255 HD13 LEU 37 HD13 LEU 37 -8.239 -4.682 -9.557 256 HD21 LEU 37 HD21 LEU 37 -9.004 -3.940 -5.954 257 HD22 LEU 37 HD22 LEU 37 -7.855 -3.578 -7.239 258 HD23 LEU 37 HD23 LEU 37 -7.964 -5.215 -6.595 259 H PHE 38 HN PHE 38 -12.716 -3.193 -6.993 260 HA PHE 38 HA PHE 38 -14.962 -4.775 -7.176 261 HB2 PHE 38 HB2 PHE 38 -14.448 -6.819 -6.059 262 HB3 PHE 38 HB1 PHE 38 -13.250 -6.644 -7.329 263 HD1 PHE 38 HD1 PHE 38 -11.655 -4.514 -5.717 264 HD2 PHE 38 HD2 PHE 38 -13.099 -8.405 -4.794 265 HE1 PHE 38 HE1 PHE 38 -9.843 -4.796 -4.086 266 HE2 PHE 38 HE2 PHE 38 -11.284 -8.695 -3.163 267 HZ PHE 38 HZ PHE 38 -9.738 -6.983 -2.741 268 H SER 39 HN SER 39 -15.477 -5.581 -4.647 269 HA SER 39 HA SER 39 -14.367 -3.590 -2.818 270 HB2 SER 39 HB2 SER 39 -16.749 -3.298 -1.898 271 HB3 SER 39 HB1 SER 39 -16.372 -2.491 -3.421 272 HG SER 39 HG SER 39 -17.512 -5.079 -3.355 273 H GLU 40 HN GLU 40 -13.282 -5.025 -1.601 274 HA GLU 40 HA GLU 40 -14.761 -6.785 0.141 275 HB2 GLU 40 HB2 GLU 40 -12.650 -7.949 -1.696 276 HB3 GLU 40 HB1 GLU 40 -13.413 -8.795 -0.359 277 HG2 GLU 40 HG2 GLU 40 -15.608 -8.417 -1.567 278 HG3 GLU 40 HG1 GLU 40 -14.642 -7.923 -2.951 279 H THR 41 HN THR 41 -13.190 -7.836 1.726 280 HA THR 41 HA THR 41 -11.361 -5.788 2.618 281 HB THR 41 HB THR 41 -11.855 -8.469 3.891 282 HG1 THR 41 HG1 THR 41 -13.216 -6.346 4.962 283 HG21 THR 41 HG21 THR 41 -10.975 -5.814 5.033 284 HG22 THR 41 HG22 THR 41 -9.939 -7.214 4.763 285 HG23 THR 41 HG23 THR 41 -11.236 -7.295 5.954 286 H VAL 42 HN VAL 42 -9.213 -5.786 2.367 287 HA VAL 42 HA VAL 42 -7.931 -8.247 1.369 288 HB VAL 42 HB VAL 42 -6.674 -7.033 -0.229 289 HG11 VAL 42 HG11 VAL 42 -8.983 -7.464 -0.904 290 HG12 VAL 42 HG12 VAL 42 -8.367 -5.987 -1.641 291 HG13 VAL 42 HG13 VAL 42 -9.471 -5.894 -0.265 292 HG21 VAL 42 HG21 VAL 42 -6.729 -4.588 -0.452 293 HG22 VAL 42 HG22 VAL 42 -6.095 -5.090 1.116 294 HG23 VAL 42 HG23 VAL 42 -7.746 -4.486 0.986 295 H LYS 43 HN LYS 43 -5.648 -8.408 1.859 296 HA LYS 43 HA LYS 43 -4.849 -6.767 4.155 297 HB2 LYS 43 HB2 LYS 43 -4.701 -9.195 4.478 298 HB3 LYS 43 HB1 LYS 43 -3.643 -9.325 3.080 299 HG2 LYS 43 HG2 LYS 43 -1.862 -8.304 4.178 300 HG3 LYS 43 HG1 LYS 43 -2.907 -7.598 5.412 301 HD2 LYS 43 HD2 LYS 43 -1.688 -9.408 6.390 302 HD3 LYS 43 HD1 LYS 43 -3.378 -9.886 6.242 303 HE2 LYS 43 HE2 LYS 43 -2.121 -11.761 5.561 304 HE3 LYS 43 HE1 LYS 43 -2.722 -11.026 4.078 305 HZ1 LYS 43 HZ1 LYS 43 -0.543 -9.919 3.857 306 HZ2 LYS 43 HZ2 LYS 43 -0.441 -11.604 3.798 307 HZ3 LYS 43 HZ3 LYS 43 0.006 -10.783 5.203 308 H VAL 44 HN VAL 44 -3.480 -5.151 3.852 309 HA VAL 44 HA VAL 44 -2.232 -4.905 1.198 310 HB VAL 44 HB VAL 44 -2.014 -2.483 2.729 311 HG11 VAL 44 HG11 VAL 44 -2.012 -2.637 0.291 312 HG12 VAL 44 HG12 VAL 44 -3.289 -1.558 0.856 313 HG13 VAL 44 HG13 VAL 44 -3.688 -3.188 0.318 314 HG21 VAL 44 HG21 VAL 44 -3.906 -3.264 4.035 315 HG22 VAL 44 HG22 VAL 44 -4.815 -3.592 2.556 316 HG23 VAL 44 HG23 VAL 44 -4.389 -1.934 2.981 317 H THR 45 HN THR 45 -0.088 -4.119 1.025 318 HA THR 45 HA THR 45 1.675 -3.711 3.171 319 HB THR 45 HB THR 45 1.209 -6.141 3.560 320 HG1 THR 45 HG1 THR 45 3.177 -5.615 4.318 321 HG21 THR 45 HG21 THR 45 2.024 -7.806 2.005 322 HG22 THR 45 HG22 THR 45 2.610 -6.550 0.920 323 HG23 THR 45 HG23 THR 45 0.876 -6.752 1.175 324 H CYS 46 HN CYS 46 4.075 -4.429 2.143 325 HA CYS 46 HA CYS 46 4.047 -3.767 -0.705 326 HB2 CYS 46 HB2 CYS 46 5.896 -2.158 -0.414 327 HB3 CYS 46 HB1 CYS 46 4.431 -1.635 0.410 328 HG CYS 46 HG CYS 46 7.417 -2.533 1.703 329 H SER 47 HN SER 47 6.301 -4.101 -1.672 330 HA SER 47 HA SER 47 7.121 -6.738 -0.989 331 HB2 SER 47 HB2 SER 47 8.831 -6.400 -2.774 332 HB3 SER 47 HB1 SER 47 7.185 -6.046 -3.292 333 HG SER 47 HG SER 47 8.906 -4.490 -3.860 334 H LYS 48 HN LYS 48 9.717 -7.069 -1.031 335 HA LYS 48 HA LYS 48 10.481 -6.244 1.587 336 HB2 LYS 48 HB2 LYS 48 12.034 -7.653 -0.584 337 HB3 LYS 48 HB1 LYS 48 12.640 -7.387 1.044 338 HG2 LYS 48 HG2 LYS 48 10.919 -8.761 1.973 339 HG3 LYS 48 HG1 LYS 48 10.134 -8.914 0.397 340 HD2 LYS 48 HD2 LYS 48 12.091 -10.073 -0.476 341 HD3 LYS 48 HD1 LYS 48 12.903 -9.893 1.080 342 HE2 LYS 48 HE2 LYS 48 11.902 -12.128 0.734 343 HE3 LYS 48 HE1 LYS 48 11.281 -11.290 2.152 344 HZ1 LYS 48 HZ1 LYS 48 9.305 -10.714 0.939 345 HZ2 LYS 48 HZ2 LYS 48 9.540 -12.388 0.841 346 HZ3 LYS 48 HZ3 LYS 48 9.916 -11.397 -0.480 347 H ASP 49 HN ASP 49 11.341 -5.185 -1.645 348 HA ASP 49 HA ASP 49 13.349 -3.346 -0.609 349 HB2 ASP 49 HB2 ASP 49 12.394 -3.928 -3.413 350 HB3 ASP 49 HB1 ASP 49 13.575 -2.681 -3.032 351 H GLY 50 HN GLY 50 10.110 -3.356 -0.730 352 HA2 GLY 50 HA2 GLY 50 8.541 -1.695 -0.468 353 HA3 GLY 50 HA1 GLY 50 9.865 -0.545 -0.383 354 H GLU 51 HN GLU 51 10.023 -2.427 -3.168 355 HA GLU 51 HA GLU 51 9.624 -0.136 -4.820 356 HB2 GLU 51 HB2 GLU 51 9.999 -3.039 -5.551 357 HB3 GLU 51 HB1 GLU 51 10.055 -1.698 -6.685 358 HG2 GLU 51 HG2 GLU 51 12.017 -0.812 -5.583 359 HG3 GLU 51 HG1 GLU 51 11.936 -2.091 -4.372 360 H GLU 52 HN GLU 52 7.690 -2.842 -3.845 361 HA GLU 52 HA GLU 52 5.566 -1.999 -5.704 362 HB2 GLU 52 HB2 GLU 52 6.463 -4.726 -4.862 363 HB3 GLU 52 HB1 GLU 52 4.791 -4.463 -5.317 364 HG2 GLU 52 HG2 GLU 52 5.906 -5.272 -7.231 365 HG3 GLU 52 HG1 GLU 52 5.646 -3.551 -7.501 366 H VAL 53 HN VAL 53 3.536 -1.796 -4.921 367 HA VAL 53 HA VAL 53 3.088 -2.414 -2.081 368 HB VAL 53 HB VAL 53 1.308 -0.833 -3.951 369 HG11 VAL 53 HG11 VAL 53 1.215 -1.159 -0.952 370 HG12 VAL 53 HG12 VAL 53 0.111 -1.905 -2.108 371 HG13 VAL 53 HG13 VAL 53 0.137 -0.152 -1.919 372 HG21 VAL 53 HG21 VAL 53 3.417 0.331 -3.571 373 HG22 VAL 53 HG22 VAL 53 3.190 0.181 -1.827 374 HG23 VAL 53 HG23 VAL 53 2.075 1.158 -2.783 375 H GLN 54 HN GLN 54 1.990 -4.232 -1.635 376 HA GLN 54 HA GLN 54 0.432 -5.439 -3.815 377 HB2 GLN 54 HB2 GLN 54 1.289 -7.662 -3.076 378 HB3 GLN 54 HB1 GLN 54 2.518 -6.620 -3.776 379 HG2 GLN 54 HG2 GLN 54 3.299 -6.039 -1.538 380 HG3 GLN 54 HG1 GLN 54 2.062 -7.083 -0.842 381 HE21 GLN 54 HE21 GLN 54 5.035 -6.977 -2.640 382 HE22 GLN 54 HE22 GLN 54 5.470 -8.632 -2.406 383 H TRP 55 HN TRP 55 -1.113 -7.074 -3.074 384 HA TRP 55 HA TRP 55 -1.916 -6.860 -0.293 385 HB2 TRP 55 HB2 TRP 55 -4.318 -6.400 -1.072 386 HB3 TRP 55 HB1 TRP 55 -3.194 -5.047 -1.064 387 HD1 TRP 55 HD1 TRP 55 -5.009 -7.404 -3.508 388 HE1 TRP 55 HE1 TRP 55 -5.029 -6.289 -5.833 389 HE3 TRP 55 HE3 TRP 55 -2.034 -3.389 -2.491 390 HZ2 TRP 55 HZ2 TRP 55 -3.918 -3.995 -7.063 391 HZ3 TRP 55 HZ3 TRP 55 -1.561 -1.785 -4.283 392 HH2 TRP 55 HH2 TRP 55 -2.479 -2.072 -6.523 393 H PHE 56 HN PHE 56 -3.552 -8.349 0.306 394 HA PHE 56 HA PHE 56 -3.824 -10.635 -1.530 395 HB2 PHE 56 HB2 PHE 56 -3.659 -10.661 1.500 396 HB3 PHE 56 HB1 PHE 56 -3.917 -12.076 0.482 397 HD1 PHE 56 HD1 PHE 56 -2.117 -13.004 -0.843 398 HD2 PHE 56 HD2 PHE 56 -1.496 -9.594 1.626 399 HE1 PHE 56 HE1 PHE 56 0.315 -13.320 -1.026 400 HE2 PHE 56 HE2 PHE 56 0.938 -9.903 1.443 401 HZ PHE 56 HZ PHE 56 1.844 -11.698 0.032 402 H LYS 57 HN LYS 57 -5.806 -10.422 -2.360 403 HA LYS 57 HA LYS 57 -7.898 -9.061 -0.978 404 HB2 LYS 57 HB2 LYS 57 -8.074 -10.671 -3.530 405 HB3 LYS 57 HB1 LYS 57 -9.231 -9.474 -2.964 406 HG2 LYS 57 HG2 LYS 57 -7.398 -7.767 -3.116 407 HG3 LYS 57 HG1 LYS 57 -6.418 -8.997 -3.920 408 HD2 LYS 57 HD2 LYS 57 -9.042 -7.847 -4.866 409 HD3 LYS 57 HD1 LYS 57 -7.453 -7.586 -5.579 410 HE2 LYS 57 HE2 LYS 57 -8.812 -10.269 -5.409 411 HE3 LYS 57 HE1 LYS 57 -8.901 -9.205 -6.807 412 HZ1 LYS 57 HZ1 LYS 57 -6.458 -10.474 -5.695 413 HZ2 LYS 57 HZ2 LYS 57 -6.455 -9.329 -6.940 414 HZ3 LYS 57 HZ3 LYS 57 -7.210 -10.822 -7.172 415 H GLY 58 HN GLY 58 -9.540 -9.854 0.177 416 HA2 GLY 58 HA2 GLY 58 -10.923 -11.357 1.220 417 HA3 GLY 58 HA1 GLY 58 -10.511 -12.520 -0.033 418 H LYS 59 HN LYS 59 -9.098 -14.108 0.406 419 HA LYS 59 HA LYS 59 -7.361 -13.893 2.735 420 HB2 LYS 59 HB2 LYS 59 -9.559 -14.999 3.405 421 HB3 LYS 59 HB1 LYS 59 -9.111 -16.326 2.344 422 HG2 LYS 59 HG2 LYS 59 -7.155 -16.790 3.671 423 HG3 LYS 59 HG1 LYS 59 -7.466 -15.379 4.682 424 HD2 LYS 59 HD2 LYS 59 -9.324 -17.740 4.409 425 HD3 LYS 59 HD1 LYS 59 -8.172 -17.516 5.727 426 HE2 LYS 59 HE2 LYS 59 -9.298 -15.418 6.333 427 HE3 LYS 59 HE1 LYS 59 -10.460 -15.673 5.033 428 HZ1 LYS 59 HZ1 LYS 59 -11.190 -17.693 6.126 429 HZ2 LYS 59 HZ2 LYS 59 -11.344 -16.369 7.164 430 HZ3 LYS 59 HZ3 LYS 59 -10.069 -17.460 7.371 431 H SER 60 HN SER 60 -6.495 -13.578 0.302 432 HA SER 60 HA SER 60 -5.955 -15.876 -1.234 433 HB2 SER 60 HB2 SER 60 -5.955 -13.481 -2.030 434 HB3 SER 60 HB1 SER 60 -4.395 -13.288 -1.235 435 HG SER 60 HG SER 60 -4.966 -15.225 -3.231 436 H THR 61 HN THR 61 -4.307 -17.266 -1.255 437 HA THR 61 HA THR 61 -2.770 -17.674 1.063 438 HB THR 61 HB THR 61 -1.584 -19.392 -0.423 439 HG1 THR 61 HG1 THR 61 -2.816 -17.992 -2.297 440 HG21 THR 61 HG21 THR 61 -3.549 -20.881 -0.437 441 HG22 THR 61 HG22 THR 61 -4.587 -19.493 -0.108 442 HG23 THR 61 HG23 THR 61 -3.392 -20.003 1.085 443 H ALA 62 HN ALA 62 -0.741 -17.177 1.601 444 HA ALA 62 HA ALA 62 0.785 -15.325 0.043 445 HB1 ALA 62 HB1 ALA 62 1.416 -16.808 2.585 446 HB2 ALA 62 HB2 ALA 62 0.793 -15.163 2.443 447 HB3 ALA 62 HB3 ALA 62 2.415 -15.545 1.873 448 H GLY 63 HN GLY 63 1.987 -15.888 -1.621 449 HA2 GLY 63 HA2 GLY 63 2.688 -18.402 -2.458 450 HA3 GLY 63 HA1 GLY 63 3.552 -16.951 -2.905 451 H ALA 64 HN ALA 64 4.008 -19.888 -1.876 452 HA ALA 64 HA ALA 64 5.671 -21.040 -0.824 453 HB1 ALA 64 HB1 ALA 64 6.883 -19.943 -2.658 454 HB2 ALA 64 HB2 ALA 64 7.905 -20.240 -1.253 455 HB3 ALA 64 HB3 ALA 64 7.292 -18.617 -1.570 456 H GLN 65 HN GLN 65 4.085 -19.440 0.957 457 HA GLN 65 HA GLN 65 3.977 -19.047 3.192 458 HB2 GLN 65 HB2 GLN 65 6.861 -19.948 3.298 459 HB3 GLN 65 HB1 GLN 65 5.790 -19.748 4.675 460 HG2 GLN 65 HG2 GLN 65 5.497 -21.760 2.457 461 HG3 GLN 65 HG1 GLN 65 6.014 -22.082 4.110 462 HE21 GLN 65 HE21 GLN 65 3.346 -21.462 2.011 463 HE22 GLN 65 HE22 GLN 65 2.096 -21.769 3.168 464 H ASP 66 HN ASP 66 6.955 -17.859 1.706 465 HA ASP 66 HA ASP 66 7.228 -15.678 3.571 466 HB2 ASP 66 HB2 ASP 66 9.175 -16.754 2.486 467 HB3 ASP 66 HB1 ASP 66 8.617 -16.167 0.925 468 H ARG 67 HN ARG 67 4.952 -16.168 1.483 469 HA ARG 67 HA ARG 67 3.456 -14.995 0.294 470 HB2 ARG 67 HB2 ARG 67 4.429 -12.352 1.266 471 HB3 ARG 67 HB1 ARG 67 2.791 -12.964 1.087 472 HG2 ARG 67 HG2 ARG 67 3.081 -14.327 3.108 473 HG3 ARG 67 HG1 ARG 67 4.706 -13.672 3.296 474 HD2 ARG 67 HD2 ARG 67 3.772 -11.415 3.475 475 HD3 ARG 67 HD1 ARG 67 2.147 -12.074 3.294 476 HE ARG 67 HE ARG 67 2.620 -13.318 5.411 477 HH11 ARG 67 HH11 ARG 67 4.319 -10.336 4.688 478 HH12 ARG 67 HH12 ARG 67 4.569 -9.936 6.357 479 HH21 ARG 67 HH21 ARG 67 2.957 -12.790 7.593 480 HH22 ARG 67 HH22 ARG 67 3.816 -11.337 8.005 481 H LYS 68 HN LYS 68 5.262 -15.765 -1.295 482 HA LYS 68 HA LYS 68 6.608 -13.604 -2.684 483 HB2 LYS 68 HB2 LYS 68 6.267 -16.492 -3.498 484 HB3 LYS 68 HB1 LYS 68 7.375 -15.334 -4.218 485 HG2 LYS 68 HG2 LYS 68 7.488 -16.205 -1.357 486 HG3 LYS 68 HG1 LYS 68 8.418 -16.962 -2.650 487 HD2 LYS 68 HD2 LYS 68 9.309 -14.601 -3.112 488 HD3 LYS 68 HD1 LYS 68 8.645 -14.185 -1.529 489 HE2 LYS 68 HE2 LYS 68 9.950 -16.198 -0.653 490 HE3 LYS 68 HE1 LYS 68 10.803 -16.164 -2.193 491 HZ1 LYS 68 HZ1 LYS 68 11.378 -13.811 -1.677 492 HZ2 LYS 68 HZ2 LYS 68 12.070 -14.942 -0.630 493 HZ3 LYS 68 HZ3 LYS 68 10.729 -14.042 -0.127 494 H LYS 69 HN LYS 69 3.588 -15.007 -2.604 495 HA LYS 69 HA LYS 69 2.920 -14.133 -5.321 496 HB2 LYS 69 HB2 LYS 69 2.851 -16.534 -5.255 497 HB3 LYS 69 HB1 LYS 69 1.912 -16.533 -3.773 498 HG2 LYS 69 HG2 LYS 69 0.556 -17.087 -5.719 499 HG3 LYS 69 HG1 LYS 69 0.021 -15.585 -4.966 500 HD2 LYS 69 HD2 LYS 69 1.244 -14.307 -6.658 501 HD3 LYS 69 HD1 LYS 69 1.762 -15.814 -7.416 502 HE2 LYS 69 HE2 LYS 69 -0.141 -14.852 -8.584 503 HE3 LYS 69 HE1 LYS 69 -0.557 -16.399 -7.852 504 HZ1 LYS 69 HZ1 LYS 69 -1.179 -13.748 -6.663 505 HZ2 LYS 69 HZ2 LYS 69 -1.659 -15.259 -6.067 506 HZ3 LYS 69 HZ3 LYS 69 -2.275 -14.697 -7.536 507 HA PRO 70 HA PRO 70 0.080 -11.693 -2.733 508 HB2 PRO 70 HB2 PRO 70 0.439 -9.592 -4.661 509 HB3 PRO 70 HB1 PRO 70 0.956 -9.628 -2.975 510 HG2 PRO 70 HG2 PRO 70 2.672 -9.645 -5.109 511 HG3 PRO 70 HG1 PRO 70 3.072 -10.287 -3.509 512 HD2 PRO 70 HD2 PRO 70 2.212 -11.741 -5.981 513 HD3 PRO 70 HD1 PRO 70 3.439 -12.192 -4.774 514 H SER 71 HN SER 71 -1.943 -10.627 -3.383 515 HA SER 71 HA SER 71 -3.186 -12.081 -5.587 516 HB2 SER 71 HB2 SER 71 -4.199 -12.060 -3.298 517 HB3 SER 71 HB1 SER 71 -4.434 -10.322 -3.461 518 HG SER 71 HG SER 71 -5.744 -12.441 -4.752 519 H GLY 72 HN GLY 72 -1.508 -9.381 -5.335 520 HA2 GLY 72 HA2 GLY 72 -2.057 -8.237 -7.736 521 HA3 GLY 72 HA1 GLY 72 -3.192 -7.460 -6.634 522 H GLY 73 HN GLY 73 -1.265 -5.934 -7.886 523 HA2 GLY 73 HA2 GLY 73 -0.083 -4.556 -5.811 524 HA3 GLY 73 HA1 GLY 73 1.111 -5.738 -6.325 525 H PHE 74 HN PHE 74 1.366 -2.919 -6.424 526 HA PHE 74 HA PHE 74 1.986 -2.647 -9.247 527 HB2 PHE 74 HB2 PHE 74 0.966 -0.466 -9.484 528 HB3 PHE 74 HB1 PHE 74 -0.257 -1.622 -9.005 529 HD1 PHE 74 HD1 PHE 74 0.029 -1.708 -6.075 530 HD2 PHE 74 HD2 PHE 74 0.288 1.572 -8.763 531 HE1 PHE 74 HE1 PHE 74 -0.671 -0.174 -4.278 532 HE2 PHE 74 HE2 PHE 74 -0.413 3.100 -6.978 533 HZ PHE 74 HZ PHE 74 -0.891 2.230 -4.730 534 HA PRO 75 HA PRO 75 5.649 -0.921 -7.639 535 HB2 PRO 75 HB2 PRO 75 5.929 0.933 -9.848 536 HB3 PRO 75 HB1 PRO 75 6.837 -0.542 -9.519 537 HG2 PRO 75 HG2 PRO 75 5.094 -0.294 -11.594 538 HG3 PRO 75 HG1 PRO 75 5.446 -1.836 -10.794 539 HD2 PRO 75 HD2 PRO 75 3.093 -0.023 -10.466 540 HD3 PRO 75 HD1 PRO 75 3.164 -1.793 -10.500 541 H VAL 76 HN VAL 76 6.342 0.643 -6.381 542 HA VAL 76 HA VAL 76 4.533 2.581 -5.433 543 HB VAL 76 HB VAL 76 7.453 2.058 -4.891 544 HG11 VAL 76 HG11 VAL 76 6.933 4.452 -4.509 545 HG12 VAL 76 HG12 VAL 76 7.355 3.578 -3.037 546 HG13 VAL 76 HG13 VAL 76 5.669 3.957 -3.382 547 HG21 VAL 76 HG21 VAL 76 4.971 1.611 -3.240 548 HG22 VAL 76 HG22 VAL 76 6.618 1.162 -2.798 549 HG23 VAL 76 HG23 VAL 76 5.825 0.372 -4.160 550 H ASP 77 HN ASP 77 7.334 2.796 -7.562 551 HA ASP 77 HA ASP 77 7.375 5.657 -7.607 552 HB2 ASP 77 HB2 ASP 77 9.408 4.449 -8.093 553 HB3 ASP 77 HB1 ASP 77 8.631 3.587 -9.417 554 H LYS 78 HN LYS 78 5.419 3.310 -9.071 555 HA LYS 78 HA LYS 78 4.862 4.923 -11.430 556 HB2 LYS 78 HB2 LYS 78 4.200 2.125 -10.607 557 HB3 LYS 78 HB1 LYS 78 3.249 2.907 -11.862 558 HG2 LYS 78 HG2 LYS 78 4.987 1.581 -12.859 559 HG3 LYS 78 HG1 LYS 78 5.307 3.289 -13.157 560 HD2 LYS 78 HD2 LYS 78 6.772 3.070 -10.990 561 HD3 LYS 78 HD1 LYS 78 6.745 1.355 -11.399 562 HE2 LYS 78 HE2 LYS 78 8.690 2.216 -12.405 563 HE3 LYS 78 HE1 LYS 78 7.519 2.021 -13.709 564 HZ1 LYS 78 HZ1 LYS 78 7.006 4.406 -13.492 565 HZ2 LYS 78 HZ2 LYS 78 8.613 4.124 -13.923 566 HZ3 LYS 78 HZ3 LYS 78 8.234 4.559 -12.331 567 H ILE 79 HN ILE 79 3.719 4.674 -8.303 568 HA ILE 79 HA ILE 79 0.949 5.111 -8.663 569 HB ILE 79 HB ILE 79 2.613 6.244 -6.413 570 HG12 ILE 79 HG12 ILE 79 1.475 3.453 -6.694 571 HG13 ILE 79 HG11 ILE 79 3.180 3.880 -6.657 572 HG21 ILE 79 HG21 ILE 79 -0.267 5.367 -6.579 573 HG22 ILE 79 HG22 ILE 79 0.320 7.028 -6.493 574 HG23 ILE 79 HG23 ILE 79 0.541 5.941 -5.122 575 HD11 ILE 79 HD11 ILE 79 2.899 4.693 -4.353 576 HD12 ILE 79 HD12 ILE 79 2.503 2.982 -4.530 577 HD13 ILE 79 HD13 ILE 79 1.212 4.176 -4.402 578 H THR 80 HN THR 80 -0.108 6.892 -9.388 579 HA THR 80 HA THR 80 1.554 9.086 -10.256 580 HB THR 80 HB THR 80 -0.080 8.194 -11.835 581 HG1 THR 80 HG1 THR 80 0.521 10.403 -11.990 582 HG21 THR 80 HG21 THR 80 -1.865 7.579 -10.271 583 HG22 THR 80 HG22 THR 80 -2.467 8.614 -11.565 584 HG23 THR 80 HG23 THR 80 -2.178 9.287 -9.961 585 H SER 81 HN SER 81 -1.092 8.535 -7.963 586 HA SER 81 HA SER 81 -0.358 10.898 -6.499 587 HB2 SER 81 HB2 SER 81 -3.044 10.793 -7.891 588 HB3 SER 81 HB1 SER 81 -2.603 11.968 -6.654 589 HG SER 81 HG SER 81 -0.689 11.958 -8.507 590 H VAL 82 HN VAL 82 -0.872 10.723 -4.406 591 HA VAL 82 HA VAL 82 -2.752 8.605 -3.581 592 HB VAL 82 HB VAL 82 -0.170 9.502 -2.285 593 HG11 VAL 82 HG11 VAL 82 -1.862 9.259 -0.539 594 HG12 VAL 82 HG12 VAL 82 -0.652 7.981 -0.446 595 HG13 VAL 82 HG13 VAL 82 -2.241 7.641 -1.127 596 HG21 VAL 82 HG21 VAL 82 0.085 7.858 -4.041 597 HG22 VAL 82 HG22 VAL 82 -1.126 6.825 -3.283 598 HG23 VAL 82 HG23 VAL 82 0.412 7.122 -2.472 599 H LYS 83 HN LYS 83 -4.577 9.646 -3.026 600 HA LYS 83 HA LYS 83 -4.340 12.093 -1.403 601 HB2 LYS 83 HB2 LYS 83 -6.675 11.519 -3.175 602 HB3 LYS 83 HB1 LYS 83 -6.072 13.065 -2.606 603 HG2 LYS 83 HG2 LYS 83 -4.771 13.323 -4.384 604 HG3 LYS 83 HG1 LYS 83 -4.155 11.671 -4.283 605 HD2 LYS 83 HD2 LYS 83 -6.943 11.958 -5.140 606 HD3 LYS 83 HD1 LYS 83 -5.740 12.564 -6.272 607 HE2 LYS 83 HE2 LYS 83 -4.641 10.374 -6.229 608 HE3 LYS 83 HE1 LYS 83 -5.866 9.792 -5.100 609 HZ1 LYS 83 HZ1 LYS 83 -6.353 9.148 -7.399 610 HZ2 LYS 83 HZ2 LYS 83 -6.411 10.778 -7.849 611 HZ3 LYS 83 HZ3 LYS 83 -7.556 10.161 -6.773 612 H SER 84 HN SER 84 -6.243 12.546 -0.063 613 HA SER 84 HA SER 84 -7.765 10.144 0.676 614 HB2 SER 84 HB2 SER 84 -8.335 11.405 2.753 615 HB3 SER 84 HB1 SER 84 -6.604 11.130 2.570 616 HG SER 84 HG SER 84 -6.589 13.214 2.964 617 H GLN 85 HN GLN 85 -10.095 10.417 0.958 618 HA GLN 85 HA GLN 85 -11.296 11.756 -1.207 619 HB2 GLN 85 HB2 GLN 85 -12.113 9.943 0.827 620 HB3 GLN 85 HB1 GLN 85 -13.241 11.289 0.830 621 HG2 GLN 85 HG2 GLN 85 -14.130 9.661 -0.622 622 HG3 GLN 85 HG1 GLN 85 -13.499 10.952 -1.640 623 HE21 GLN 85 HE21 GLN 85 -11.501 8.595 -0.024 624 HE22 GLN 85 HE22 GLN 85 -10.993 7.758 -1.445 625 H ALA 86 HN ALA 86 -13.301 13.268 -0.790 626 HA ALA 86 HA ALA 86 -12.277 15.730 0.058 627 HB1 ALA 86 HB1 ALA 86 -14.536 16.589 -0.215 628 HB2 ALA 86 HB2 ALA 86 -15.170 14.944 -0.256 629 HB3 ALA 86 HB3 ALA 86 -14.111 15.513 -1.545 630 H ASP 87 HN ASP 87 -14.545 13.532 1.682 631 HA ASP 87 HA ASP 87 -14.068 15.002 4.192 632 HB2 ASP 87 HB2 ASP 87 -16.408 14.899 3.633 633 HB3 ASP 87 HB1 ASP 87 -16.313 13.171 3.321 634 H ASN 88 HN ASN 88 -13.817 11.998 2.556 635 HA ASN 88 HA ASN 88 -13.005 9.936 3.109 636 HB2 ASN 88 HB2 ASN 88 -10.635 10.011 3.487 637 HB3 ASN 88 HB1 ASN 88 -11.097 11.293 2.381 638 HD21 ASN 88 HD21 ASN 88 -10.997 13.454 3.100 639 HD22 ASN 88 HD22 ASN 88 -10.068 13.908 4.486 640 H THR 89 HN THR 89 -14.756 10.431 5.225 641 HA THR 89 HA THR 89 -13.671 10.382 7.764 642 HB THR 89 HB THR 89 -16.146 8.950 6.784 643 HG1 THR 89 HG1 THR 89 -16.097 11.323 6.771 644 HG21 THR 89 HG21 THR 89 -15.210 9.415 9.614 645 HG22 THR 89 HG22 THR 89 -15.334 7.854 8.804 646 HG23 THR 89 HG23 THR 89 -16.790 8.787 9.150 647 H LYS 90 HN LYS 90 -14.588 7.438 5.899 648 HA LYS 90 HA LYS 90 -12.263 6.194 7.182 649 HB2 LYS 90 HB2 LYS 90 -13.417 3.986 6.690 650 HB3 LYS 90 HB1 LYS 90 -14.040 4.977 7.998 651 HG2 LYS 90 HG2 LYS 90 -15.886 5.698 6.646 652 HG3 LYS 90 HG1 LYS 90 -15.219 4.885 5.229 653 HD2 LYS 90 HD2 LYS 90 -17.037 3.592 6.281 654 HD3 LYS 90 HD1 LYS 90 -15.503 2.723 6.292 655 HE2 LYS 90 HE2 LYS 90 -16.597 2.446 8.420 656 HE3 LYS 90 HE1 LYS 90 -15.153 3.429 8.628 657 HZ1 LYS 90 HZ1 LYS 90 -16.954 4.361 9.879 658 HZ2 LYS 90 HZ2 LYS 90 -17.950 4.408 8.515 659 HZ3 LYS 90 HZ3 LYS 90 -16.593 5.408 8.600 660 H VAL 91 HN VAL 91 -12.799 7.583 4.344 661 HA VAL 91 HA VAL 91 -11.971 5.281 2.695 662 HB VAL 91 HB VAL 91 -13.233 7.811 1.662 663 HG11 VAL 91 HG11 VAL 91 -12.065 6.455 0.008 664 HG12 VAL 91 HG12 VAL 91 -13.808 6.385 -0.258 665 HG13 VAL 91 HG13 VAL 91 -12.977 5.029 0.504 666 HG21 VAL 91 HG21 VAL 91 -14.626 5.233 2.399 667 HG22 VAL 91 HG22 VAL 91 -15.370 6.656 1.667 668 HG23 VAL 91 HG23 VAL 91 -14.724 6.740 3.305 669 H LEU 92 HN LEU 92 -10.149 5.304 1.558 670 HA LEU 92 HA LEU 92 -8.625 7.818 1.246 671 HB2 LEU 92 HB2 LEU 92 -7.838 4.978 1.647 672 HB3 LEU 92 HB1 LEU 92 -6.820 5.959 0.616 673 HG LEU 92 HG LEU 92 -6.321 7.461 2.421 674 HD11 LEU 92 HD11 LEU 92 -8.460 7.507 3.557 675 HD12 LEU 92 HD12 LEU 92 -7.179 7.084 4.691 676 HD13 LEU 92 HD13 LEU 92 -8.251 5.832 4.065 677 HD21 LEU 92 HD21 LEU 92 -6.123 4.566 3.227 678 HD22 LEU 92 HD22 LEU 92 -5.206 5.883 3.958 679 HD23 LEU 92 HD23 LEU 92 -4.966 5.478 2.258 680 H VAL 93 HN VAL 93 -7.637 8.217 -0.857 681 HA VAL 93 HA VAL 93 -8.622 6.486 -3.012 682 HB VAL 93 HB VAL 93 -10.150 8.256 -3.172 683 HG11 VAL 93 HG11 VAL 93 -9.223 9.829 -1.649 684 HG12 VAL 93 HG12 VAL 93 -9.438 10.651 -3.196 685 HG13 VAL 93 HG13 VAL 93 -7.835 10.110 -2.698 686 HG21 VAL 93 HG21 VAL 93 -9.605 9.412 -5.246 687 HG22 VAL 93 HG22 VAL 93 -9.123 7.716 -5.324 688 HG23 VAL 93 HG23 VAL 93 -7.909 8.968 -5.058 689 H ILE 94 HN ILE 94 -6.905 5.626 -3.916 690 HA ILE 94 HA ILE 94 -4.501 7.280 -4.366 691 HB ILE 94 HB ILE 94 -4.743 4.398 -3.520 692 HG12 ILE 94 HG12 ILE 94 -2.887 5.112 -1.943 693 HG13 ILE 94 HG11 ILE 94 -3.171 6.763 -2.479 694 HG21 ILE 94 HG21 ILE 94 -2.364 4.074 -3.999 695 HG22 ILE 94 HG22 ILE 94 -2.307 5.662 -4.763 696 HG23 ILE 94 HG23 ILE 94 -3.297 4.382 -5.464 697 HD11 ILE 94 HD11 ILE 94 -5.243 5.002 -1.200 698 HD12 ILE 94 HD12 ILE 94 -5.402 6.711 -1.602 699 HD13 ILE 94 HD13 ILE 94 -4.272 6.202 -0.347 700 H THR 95 HN THR 95 -3.753 7.335 -6.454 701 HA THR 95 HA THR 95 -4.970 5.432 -8.350 702 HB THR 95 HB THR 95 -4.354 8.331 -8.956 703 HG1 THR 95 HG1 THR 95 -6.963 7.239 -8.761 704 HG21 THR 95 HG21 THR 95 -5.876 6.225 -10.504 705 HG22 THR 95 HG22 THR 95 -4.286 6.867 -10.914 706 HG23 THR 95 HG23 THR 95 -5.702 7.917 -10.973 707 H VAL 96 HN VAL 96 -3.658 4.671 -9.987 708 HA VAL 96 HA VAL 96 -0.812 5.369 -9.799 709 HB VAL 96 HB VAL 96 -1.020 3.188 -8.915 710 HG11 VAL 96 HG11 VAL 96 -2.694 2.471 -11.314 711 HG12 VAL 96 HG12 VAL 96 -3.292 2.731 -9.676 712 HG13 VAL 96 HG13 VAL 96 -2.215 1.375 -10.016 713 HG21 VAL 96 HG21 VAL 96 -0.181 3.105 -11.792 714 HG22 VAL 96 HG22 VAL 96 0.041 1.751 -10.689 715 HG23 VAL 96 HG23 VAL 96 0.842 3.290 -10.369 716 H ASN 97 HN ASN 97 0.369 5.538 -11.748 717 HA ASN 97 HA ASN 97 -1.189 5.238 -14.209 718 HB2 ASN 97 HB2 ASN 97 -1.089 7.642 -13.536 719 HB3 ASN 97 HB1 ASN 97 0.657 7.561 -13.721 720 HD21 ASN 97 HD21 ASN 97 -1.257 9.217 -15.141 721 HD22 ASN 97 HD22 ASN 97 -1.088 8.830 -16.818 722 H ASN 98 HN ASN 98 -0.205 3.425 -14.782 723 HA ASN 98 HA ASN 98 1.709 3.477 -16.646 724 HB2 ASN 98 HB2 ASN 98 3.450 4.096 -15.074 725 HB3 ASN 98 HB1 ASN 98 3.068 2.731 -14.043 726 HD21 ASN 98 HD21 ASN 98 3.787 0.684 -14.620 727 HD22 ASN 98 HD22 ASN 98 4.921 0.421 -15.897 728 HA PRO 99 HA PRO 99 0.328 -1.068 -15.315 729 HB2 PRO 99 HB2 PRO 99 -1.017 -0.228 -12.793 730 HB3 PRO 99 HB1 PRO 99 -0.225 -1.759 -13.184 731 HG2 PRO 99 HG2 PRO 99 0.952 -0.014 -11.578 732 HG3 PRO 99 HG1 PRO 99 1.896 -0.914 -12.780 733 HD2 PRO 99 HD2 PRO 99 0.960 1.924 -12.841 734 HD3 PRO 99 HD1 PRO 99 2.496 1.222 -13.384 735 H GLN 100 HN GLN 100 -2.087 -1.726 -15.233 736 HA GLN 100 HA GLN 100 -3.565 0.018 -16.847 737 HB2 GLN 100 HB2 GLN 100 -5.459 -1.480 -16.471 738 HB3 GLN 100 HB1 GLN 100 -3.991 -2.401 -16.760 739 HG2 GLN 100 HG2 GLN 100 -3.768 -2.800 -14.367 740 HG3 GLN 100 HG1 GLN 100 -5.232 -1.862 -14.079 741 HE21 GLN 100 HE21 GLN 100 -6.286 -3.606 -13.133 742 HE22 GLN 100 HE22 GLN 100 -6.866 -4.941 -14.061 743 HA PRO 101 HA PRO 101 -4.552 3.238 -14.083 744 HB2 PRO 101 HB2 PRO 101 -7.055 3.441 -15.682 745 HB3 PRO 101 HB1 PRO 101 -5.861 4.685 -15.292 746 HG2 PRO 101 HG2 PRO 101 -5.950 3.596 -17.720 747 HG3 PRO 101 HG1 PRO 101 -4.401 3.991 -16.951 748 HD2 PRO 101 HD2 PRO 101 -5.712 1.333 -17.318 749 HD3 PRO 101 HD1 PRO 101 -3.991 1.763 -17.353 750 H THR 102 HN THR 102 -5.099 2.672 -12.108 751 HA THR 102 HA THR 102 -7.876 1.940 -11.588 752 HB THR 102 HB THR 102 -5.597 0.510 -10.211 753 HG1 THR 102 HG1 THR 102 -5.661 -0.049 -12.464 754 HG21 THR 102 HG21 THR 102 -7.721 0.585 -8.990 755 HG22 THR 102 HG22 THR 102 -7.363 -1.054 -9.534 756 HG23 THR 102 HG23 THR 102 -8.557 -0.081 -10.393 757 H THR 103 HN THR 103 -8.641 2.645 -9.621 758 HA THR 103 HA THR 103 -6.806 4.310 -8.032 759 HB THR 103 HB THR 103 -9.719 4.841 -8.668 760 HG1 THR 103 HG1 THR 103 -8.895 6.021 -10.204 761 HG21 THR 103 HG21 THR 103 -9.203 5.449 -6.351 762 HG22 THR 103 HG22 THR 103 -9.469 6.882 -7.343 763 HG23 THR 103 HG23 THR 103 -7.829 6.404 -6.906 764 H TYR 104 HN TYR 104 -6.461 3.296 -6.206 765 HA TYR 104 HA TYR 104 -8.383 1.343 -5.245 766 HB2 TYR 104 HB2 TYR 104 -5.580 1.985 -4.304 767 HB3 TYR 104 HB1 TYR 104 -6.565 0.630 -3.752 768 HD1 TYR 104 HD1 TYR 104 -7.147 -1.199 -5.345 769 HD2 TYR 104 HD2 TYR 104 -4.381 1.877 -6.341 770 HE1 TYR 104 HE1 TYR 104 -6.263 -2.599 -7.165 771 HE2 TYR 104 HE2 TYR 104 -3.503 0.488 -8.174 772 HH TYR 104 HH TYR 104 -5.030 -2.463 -9.164 773 H ASN 105 HN ASN 105 -9.783 1.801 -3.741 774 HA ASN 105 HA ASN 105 -9.283 4.108 -2.014 775 HB2 ASN 105 HB2 ASN 105 -11.877 2.740 -2.748 776 HB3 ASN 105 HB1 ASN 105 -11.736 4.027 -1.547 777 HD21 ASN 105 HD21 ASN 105 -11.396 3.228 -4.921 778 HD22 ASN 105 HD22 ASN 105 -11.457 4.844 -5.507 779 H PHE 106 HN PHE 106 -8.288 3.492 -0.311 780 HA PHE 106 HA PHE 106 -8.751 0.883 0.873 781 HB2 PHE 106 HB2 PHE 106 -6.921 3.121 1.777 782 HB3 PHE 106 HB1 PHE 106 -6.942 1.490 2.432 783 HD1 PHE 106 HD1 PHE 106 -6.529 -0.411 0.694 784 HD2 PHE 106 HD2 PHE 106 -5.407 3.647 0.112 785 HE1 PHE 106 HE1 PHE 106 -4.870 -1.114 -0.982 786 HE2 PHE 106 HE2 PHE 106 -3.759 2.959 -1.573 787 HZ PHE 106 HZ PHE 106 -3.459 0.599 -2.107 788 H THR 107 HN THR 107 -10.442 0.626 2.132 789 HA THR 107 HA THR 107 -11.188 2.827 3.945 790 HB THR 107 HB THR 107 -13.047 0.733 2.798 791 HG1 THR 107 HG1 THR 107 -12.073 2.422 1.324 792 HG21 THR 107 HG21 THR 107 -13.784 1.673 4.928 793 HG22 THR 107 HG22 THR 107 -14.811 2.243 3.610 794 HG23 THR 107 HG23 THR 107 -13.577 3.305 4.293 795 H PHE 108 HN PHE 108 -11.385 2.340 6.077 796 HA PHE 108 HA PHE 108 -11.647 -0.460 6.845 797 HB2 PHE 108 HB2 PHE 108 -9.184 0.310 6.987 798 HB3 PHE 108 HB1 PHE 108 -9.716 1.315 8.328 799 HD1 PHE 108 HD1 PHE 108 -9.432 0.464 10.423 800 HD2 PHE 108 HD2 PHE 108 -10.088 -2.225 7.197 801 HE1 PHE 108 HE1 PHE 108 -9.181 -1.437 11.964 802 HE2 PHE 108 HE2 PHE 108 -9.842 -4.132 8.729 803 HZ PHE 108 HZ PHE 108 -9.435 -3.752 11.108 804 H LYS 109 HN LYS 109 -12.233 -0.590 9.230 805 HA LYS 109 HA LYS 109 -14.432 1.104 9.759 806 HB2 LYS 109 HB2 LYS 109 -14.322 -1.163 10.637 807 HB3 LYS 109 HB1 LYS 109 -12.874 -0.762 11.554 808 HG2 LYS 109 HG2 LYS 109 -14.591 1.097 12.502 809 HG3 LYS 109 HG1 LYS 109 -15.699 -0.232 12.154 810 HD2 LYS 109 HD2 LYS 109 -14.339 -1.736 13.501 811 HD3 LYS 109 HD1 LYS 109 -13.191 -0.432 13.815 812 HE2 LYS 109 HE2 LYS 109 -14.994 0.844 14.913 813 HE3 LYS 109 HE1 LYS 109 -16.084 -0.515 14.658 814 HZ1 LYS 109 HZ1 LYS 109 -15.189 -0.548 16.880 815 HZ2 LYS 109 HZ2 LYS 109 -13.605 -0.545 16.290 816 HZ3 LYS 109 HZ3 LYS 109 -14.605 -1.880 16.018 817 H SER 110 HN SER 110 -11.148 0.940 11.014 818 HA SER 110 HA SER 110 -11.508 2.874 13.063 819 HB2 SER 110 HB2 SER 110 -9.814 1.080 13.189 820 HB3 SER 110 HB1 SER 110 -8.975 1.797 11.817 821 HG SER 110 HG SER 110 -8.306 2.321 14.124 822 HA PRO 111 HA PRO 111 -11.093 6.461 10.294 823 HB2 PRO 111 HB2 PRO 111 -11.338 7.850 12.888 824 HB3 PRO 111 HB1 PRO 111 -12.283 8.052 11.409 825 HG2 PRO 111 HG2 PRO 111 -13.306 6.839 13.565 826 HG3 PRO 111 HG1 PRO 111 -13.709 6.315 11.921 827 HD2 PRO 111 HD2 PRO 111 -11.835 5.085 13.895 828 HD3 PRO 111 HD1 PRO 111 -12.941 4.308 12.746 829 H GLY 112 HN GLY 112 -9.022 5.128 12.516 830 HA2 GLY 112 HA2 GLY 112 -7.047 7.277 12.088 831 HA3 GLY 112 HA1 GLY 112 -6.938 6.048 13.341 832 H GLU 113 HN GLU 113 -7.636 3.835 11.665 833 HA GLU 113 HA GLU 113 -5.077 2.953 11.090 834 HB2 GLU 113 HB2 GLU 113 -7.046 1.508 11.517 835 HB3 GLU 113 HB1 GLU 113 -7.675 1.931 9.937 836 HG2 GLU 113 HG2 GLU 113 -6.659 -0.241 9.876 837 HG3 GLU 113 HG1 GLU 113 -5.732 0.885 8.885 838 H ARG 114 HN ARG 114 -7.563 4.010 8.754 839 HA ARG 114 HA ARG 114 -5.956 3.369 6.510 840 HB2 ARG 114 HB2 ARG 114 -8.129 5.397 6.259 841 HB3 ARG 114 HB1 ARG 114 -7.663 4.115 5.156 842 HG2 ARG 114 HG2 ARG 114 -9.606 3.240 5.895 843 HG3 ARG 114 HG1 ARG 114 -8.550 2.612 7.163 844 HD2 ARG 114 HD2 ARG 114 -10.670 3.691 7.961 845 HD3 ARG 114 HD1 ARG 114 -9.186 4.334 8.663 846 HE ARG 114 HE ARG 114 -10.805 5.638 6.591 847 HH11 ARG 114 HH11 ARG 114 -8.469 5.826 9.174 848 HH12 ARG 114 HH12 ARG 114 -8.413 7.561 9.170 849 HH21 ARG 114 HH21 ARG 114 -10.687 7.941 6.557 850 HH22 ARG 114 HH22 ARG 114 -9.652 8.750 7.695 851 H GLU 115 HN GLU 115 -6.696 6.459 8.110 852 HA GLU 115 HA GLU 115 -5.286 8.090 6.325 853 HB2 GLU 115 HB2 GLU 115 -6.186 8.405 9.160 854 HB3 GLU 115 HB1 GLU 115 -5.188 9.638 8.401 855 HG2 GLU 115 HG2 GLU 115 -6.813 10.039 6.724 856 HG3 GLU 115 HG1 GLU 115 -7.740 8.620 7.196 857 H SER 116 HN SER 116 -4.218 6.328 9.183 858 HA SER 116 HA SER 116 -1.579 7.288 9.233 859 HB2 SER 116 HB2 SER 116 -2.617 4.537 9.970 860 HB3 SER 116 HB1 SER 116 -1.039 5.187 10.417 861 HG SER 116 HG SER 116 -3.188 6.804 11.066 862 H TRP 117 HN TRP 117 -3.127 4.715 7.375 863 HA TRP 117 HA TRP 117 -0.800 3.713 6.107 864 HB2 TRP 117 HB2 TRP 117 -3.320 2.845 6.234 865 HB3 TRP 117 HB1 TRP 117 -3.450 3.715 4.713 866 HD1 TRP 117 HD1 TRP 117 -2.126 0.547 6.231 867 HE1 TRP 117 HE1 TRP 117 -1.182 -0.978 4.388 868 HE3 TRP 117 HE3 TRP 117 -2.198 3.849 2.332 869 HZ2 TRP 117 HZ2 TRP 117 -0.542 -0.804 1.658 870 HZ3 TRP 117 HZ3 TRP 117 -1.395 3.081 0.137 871 HH2 TRP 117 HH2 TRP 117 -0.588 0.806 -0.192 872 H GLN 118 HN GLN 118 -3.146 6.195 5.324 873 HA GLN 118 HA GLN 118 -2.490 6.868 2.731 874 HB2 GLN 118 HB2 GLN 118 -4.446 7.755 3.782 875 HB3 GLN 118 HB1 GLN 118 -3.496 8.540 5.029 876 HG2 GLN 118 HG2 GLN 118 -4.356 10.153 3.448 877 HG3 GLN 118 HG1 GLN 118 -2.596 10.090 3.385 878 HE21 GLN 118 HE21 GLN 118 -4.548 7.611 1.930 879 HE22 GLN 118 HE22 GLN 118 -4.237 8.058 0.290 880 H GLU 119 HN GLU 119 -1.175 8.347 5.705 881 HA GLU 119 HA GLU 119 0.642 9.996 4.235 882 HB2 GLU 119 HB2 GLU 119 1.540 10.591 6.442 883 HB3 GLU 119 HB1 GLU 119 -0.217 10.688 6.409 884 HG2 GLU 119 HG2 GLU 119 -0.348 8.497 7.481 885 HG3 GLU 119 HG1 GLU 119 1.409 8.433 7.548 886 H GLN 120 HN GLN 120 0.785 6.841 5.703 887 HA GLN 120 HA GLN 120 3.606 6.668 5.880 888 HB2 GLN 120 HB2 GLN 120 1.353 4.717 6.059 889 HB3 GLN 120 HB1 GLN 120 3.004 4.125 5.941 890 HG2 GLN 120 HG2 GLN 120 1.956 6.004 8.042 891 HG3 GLN 120 HG1 GLN 120 2.264 4.283 8.256 892 HE21 GLN 120 HE21 GLN 120 4.644 4.553 6.448 893 HE22 GLN 120 HE22 GLN 120 5.879 5.214 7.469 894 H ILE 121 HN ILE 121 1.262 5.497 3.492 895 HA ILE 121 HA ILE 121 3.118 4.122 1.903 896 HB ILE 121 HB ILE 121 0.738 3.745 1.653 897 HG12 ILE 121 HG12 ILE 121 0.584 3.841 -0.836 898 HG13 ILE 121 HG11 ILE 121 2.040 4.832 -0.850 899 HG21 ILE 121 HG21 ILE 121 -0.123 5.968 2.035 900 HG22 ILE 121 HG22 ILE 121 -0.709 5.357 0.488 901 HG23 ILE 121 HG23 ILE 121 0.602 6.536 0.530 902 HD11 ILE 121 HD11 ILE 121 1.847 2.024 0.211 903 HD12 ILE 121 HD12 ILE 121 3.306 3.014 0.131 904 HD13 ILE 121 HD13 ILE 121 2.510 2.496 -1.354 905 H GLN 122 HN GLN 122 2.002 7.484 1.800 906 HA GLN 122 HA GLN 122 3.377 8.034 -0.642 907 HB2 GLN 122 HB2 GLN 122 2.923 10.453 -0.045 908 HB3 GLN 122 HB1 GLN 122 1.520 9.410 -0.221 909 HG2 GLN 122 HG2 GLN 122 1.202 9.290 2.111 910 HG3 GLN 122 HG1 GLN 122 2.757 10.061 2.433 911 HE21 GLN 122 HE21 GLN 122 -0.530 10.525 1.441 912 HE22 GLN 122 HE22 GLN 122 -0.539 12.248 1.574 913 H SER 123 HN SER 123 4.242 8.147 2.720 914 HA SER 123 HA SER 123 6.621 9.665 2.424 915 HB2 SER 123 HB2 SER 123 5.897 7.587 4.505 916 HB3 SER 123 HB1 SER 123 7.245 8.719 4.619 917 HG SER 123 HG SER 123 4.462 9.303 4.592 918 H LEU 124 HN LEU 124 5.910 6.192 2.333 919 HA LEU 124 HA LEU 124 8.556 5.305 1.911 920 HB2 LEU 124 HB2 LEU 124 6.684 3.836 2.587 921 HB3 LEU 124 HB1 LEU 124 5.946 4.059 1.018 922 HG LEU 124 HG LEU 124 7.219 1.863 1.492 923 HD11 LEU 124 HD11 LEU 124 7.958 1.686 -0.818 924 HD12 LEU 124 HD12 LEU 124 7.858 3.437 -0.994 925 HD13 LEU 124 HD13 LEU 124 6.394 2.495 -0.714 926 HD21 LEU 124 HD21 LEU 124 9.232 2.918 2.421 927 HD22 LEU 124 HD22 LEU 124 9.564 3.646 0.848 928 HD23 LEU 124 HD23 LEU 124 9.594 1.892 1.033 929 H MET 125 HN MET 125 5.956 6.235 -0.294 930 HA MET 125 HA MET 125 7.140 5.644 -2.733 931 HB2 MET 125 HB2 MET 125 5.334 7.942 -1.976 932 HB3 MET 125 HB1 MET 125 5.737 7.512 -3.629 933 HG2 MET 125 HG2 MET 125 4.546 5.515 -3.523 934 HG3 MET 125 HG1 MET 125 4.472 5.549 -1.761 935 HE1 MET 125 HE1 MET 125 3.936 8.802 -3.841 936 HE2 MET 125 HE2 MET 125 2.243 8.654 -4.327 937 HE3 MET 125 HE3 MET 125 3.448 7.541 -4.978 938 H LYS 126 HN LYS 126 7.244 8.680 -0.923 939 HA LYS 126 HA LYS 126 8.887 10.043 -2.787 940 HB2 LYS 126 HB2 LYS 126 8.365 10.557 0.150 941 HB3 LYS 126 HB1 LYS 126 9.179 11.679 -0.932 942 HG2 LYS 126 HG2 LYS 126 6.380 10.669 -1.397 943 HG3 LYS 126 HG1 LYS 126 6.753 12.154 -0.515 944 HD2 LYS 126 HD2 LYS 126 7.899 13.032 -2.500 945 HD3 LYS 126 HD1 LYS 126 7.511 11.548 -3.373 946 HE2 LYS 126 HE2 LYS 126 5.492 13.461 -2.209 947 HE3 LYS 126 HE1 LYS 126 5.969 13.397 -3.904 948 HZ1 LYS 126 HZ1 LYS 126 4.671 11.201 -2.389 949 HZ2 LYS 126 HZ2 LYS 126 5.138 11.130 -4.012 950 HZ3 LYS 126 HZ3 LYS 126 3.918 12.195 -3.530 951 H PHE 127 HN PHE 127 9.626 8.149 0.105 952 HA PHE 127 HA PHE 127 12.247 8.923 0.527 953 HB2 PHE 127 HB2 PHE 127 11.106 7.493 2.094 954 HB3 PHE 127 HB1 PHE 127 10.915 6.234 0.876 955 HD1 PHE 127 HD1 PHE 127 12.452 4.503 0.767 956 HD2 PHE 127 HD2 PHE 127 13.528 8.121 2.733 957 HE1 PHE 127 HE1 PHE 127 14.553 3.465 1.522 958 HE2 PHE 127 HE2 PHE 127 15.626 7.091 3.490 959 HZ PHE 127 HZ PHE 127 16.134 4.733 2.876 960 H MET 128 HN MET 128 11.016 6.568 -1.798 961 HA MET 128 HA MET 128 13.770 6.124 -2.723 962 HB2 MET 128 HB2 MET 128 12.815 4.133 -3.892 963 HB3 MET 128 HB1 MET 128 12.710 4.071 -2.141 964 HG2 MET 128 HG2 MET 128 10.384 4.618 -2.201 965 HG3 MET 128 HG1 MET 128 10.447 4.897 -3.944 966 HE1 MET 128 HE1 MET 128 12.123 2.065 -1.786 967 HE2 MET 128 HE2 MET 128 10.883 0.815 -1.875 968 HE3 MET 128 HE3 MET 128 10.544 2.337 -1.050 969 H SER 129 HN SER 129 10.732 7.482 -3.670 970 HA SER 129 HA SER 129 11.493 7.476 -6.480 971 HB2 SER 129 HB2 SER 129 9.179 6.855 -5.851 972 HB3 SER 129 HB1 SER 129 8.945 8.472 -5.191 973 HG SER 129 HG SER 129 9.343 7.702 -7.898 974 H MET 130 HN MET 130 11.819 9.509 -3.806 975 HA MET 130 HA MET 130 11.659 11.998 -5.136 976 HB2 MET 130 HB2 MET 130 12.815 11.099 -2.533 977 HB3 MET 130 HB1 MET 130 13.339 12.652 -3.194 978 HG2 MET 130 HG2 MET 130 10.917 13.269 -3.385 979 HG3 MET 130 HG1 MET 130 10.547 11.805 -2.484 980 HE1 MET 130 HE1 MET 130 12.212 12.511 0.984 981 HE2 MET 130 HE2 MET 130 12.870 11.606 -0.380 982 HE3 MET 130 HE3 MET 130 11.176 11.418 0.068 983 H LYS 131 HN LYS 131 12.766 11.975 -7.016 984 HA LYS 131 HA LYS 131 15.568 11.194 -7.027 985 HB2 LYS 131 HB2 LYS 131 15.284 11.628 -9.548 986 HB3 LYS 131 HB1 LYS 131 14.453 10.245 -8.852 987 HG2 LYS 131 HG2 LYS 131 12.404 11.684 -8.687 988 HG3 LYS 131 HG1 LYS 131 13.272 12.896 -9.630 989 HD2 LYS 131 HD2 LYS 131 13.520 11.321 -11.465 990 HD3 LYS 131 HD1 LYS 131 12.719 10.066 -10.516 991 HE2 LYS 131 HE2 LYS 131 10.692 11.461 -10.424 992 HE3 LYS 131 HE1 LYS 131 11.494 12.667 -11.426 993 HZ1 LYS 131 HZ1 LYS 131 10.088 11.293 -12.777 994 HZ2 LYS 131 HZ2 LYS 131 10.828 9.885 -12.209 995 HZ3 LYS 131 HZ3 LYS 131 11.701 10.967 -13.171 Start of MODEL 9 1 H1 SER 11 HT1 SER 11 24.038 5.324 4.127 2 H2 SER 11 HT2 SER 11 25.443 4.414 4.366 3 H3 SER 11 HT3 SER 11 23.930 3.667 4.441 4 HA SER 11 HA SER 11 25.095 4.918 2.037 5 HB2 SER 11 HB2 SER 11 24.666 1.983 2.621 6 HB3 SER 11 HB1 SER 11 25.519 2.695 1.257 7 HG SER 11 HG SER 11 27.200 3.207 2.535 8 H ALA 12 HN ALA 12 23.715 5.008 0.275 9 HA ALA 12 HA ALA 12 21.081 5.571 0.876 10 HB1 ALA 12 HB1 ALA 12 22.152 4.833 -1.838 11 HB2 ALA 12 HB2 ALA 12 22.296 6.421 -1.083 12 HB3 ALA 12 HB3 ALA 12 20.706 5.780 -1.497 13 H SER 13 HN SER 13 22.174 2.701 -0.986 14 HA SER 13 HA SER 13 19.589 1.603 -1.131 15 HB2 SER 13 HB2 SER 13 22.288 0.288 -1.476 16 HB3 SER 13 HB1 SER 13 20.749 -0.344 -2.028 17 HG SER 13 HG SER 13 20.557 1.396 -3.438 18 H ASP 14 HN ASP 14 22.314 1.079 1.060 19 HA ASP 14 HA ASP 14 21.305 -1.200 2.371 20 HB2 ASP 14 HB2 ASP 14 23.650 -0.521 2.571 21 HB3 ASP 14 HB1 ASP 14 23.166 0.940 3.426 22 H ILE 15 HN ILE 15 21.118 2.251 3.240 23 HA ILE 15 HA ILE 15 19.615 1.801 5.591 24 HB ILE 15 HB ILE 15 20.885 3.921 5.118 25 HG12 ILE 15 HG12 ILE 15 19.009 5.410 6.062 26 HG13 ILE 15 HG11 ILE 15 18.009 3.957 5.988 27 HG21 ILE 15 HG21 ILE 15 19.799 5.695 3.859 28 HG22 ILE 15 HG22 ILE 15 18.490 4.597 3.423 29 HG23 ILE 15 HG23 ILE 15 20.122 4.302 2.824 30 HD11 ILE 15 HD11 ILE 15 19.601 2.807 7.446 31 HD12 ILE 15 HD12 ILE 15 18.919 4.247 8.201 32 HD13 ILE 15 HD13 ILE 15 20.557 4.284 7.550 33 H ARG 16 HN ARG 16 18.752 2.379 2.243 34 HA ARG 16 HA ARG 16 16.015 2.806 2.576 35 HB2 ARG 16 HB2 ARG 16 16.998 3.297 0.471 36 HB3 ARG 16 HB1 ARG 16 17.677 1.684 0.326 37 HG2 ARG 16 HG2 ARG 16 15.333 0.811 0.133 38 HG3 ARG 16 HG1 ARG 16 14.795 2.493 0.043 39 HD2 ARG 16 HD2 ARG 16 16.809 1.227 -1.798 40 HD3 ARG 16 HD1 ARG 16 15.097 1.418 -2.167 41 HE ARG 16 HE ARG 16 16.609 3.830 -1.513 42 HH11 ARG 16 HH11 ARG 16 15.154 1.790 -3.955 43 HH12 ARG 16 HH12 ARG 16 15.148 3.030 -5.168 44 HH21 ARG 16 HH21 ARG 16 16.620 5.462 -3.118 45 HH22 ARG 16 HH22 ARG 16 15.983 5.119 -4.697 46 H MET 17 HN MET 17 17.821 -0.215 2.062 47 HA MET 17 HA MET 17 15.580 -1.882 1.853 48 HB2 MET 17 HB2 MET 17 18.384 -2.481 2.794 49 HB3 MET 17 HB1 MET 17 17.163 -3.720 2.540 50 HG2 MET 17 HG2 MET 17 16.974 -3.012 0.186 51 HG3 MET 17 HG1 MET 17 18.269 -1.849 0.457 52 HE1 MET 17 HE1 MET 17 21.331 -4.175 1.177 53 HE2 MET 17 HE2 MET 17 20.261 -3.389 2.336 54 HE3 MET 17 HE3 MET 17 20.801 -2.517 0.902 55 H LYS 18 HN LYS 18 17.375 -0.801 4.711 56 HA LYS 18 HA LYS 18 15.797 -2.410 6.485 57 HB2 LYS 18 HB2 LYS 18 16.980 -1.433 8.263 58 HB3 LYS 18 HB1 LYS 18 18.146 -1.507 6.951 59 HG2 LYS 18 HG2 LYS 18 18.014 0.811 6.559 60 HG3 LYS 18 HG1 LYS 18 16.548 0.968 7.525 61 HD2 LYS 18 HD2 LYS 18 18.385 1.834 8.786 62 HD3 LYS 18 HD1 LYS 18 17.862 0.322 9.524 63 HE2 LYS 18 HE2 LYS 18 19.694 -0.866 8.483 64 HE3 LYS 18 HE1 LYS 18 20.186 0.588 7.617 65 HZ1 LYS 18 HZ1 LYS 18 21.572 0.230 9.545 66 HZ2 LYS 18 HZ2 LYS 18 20.223 0.219 10.564 67 HZ3 LYS 18 HZ3 LYS 18 20.657 1.634 9.755 68 H LYS 19 HN LYS 19 15.635 0.819 5.170 69 HA LYS 19 HA LYS 19 13.765 1.817 7.070 70 HB2 LYS 19 HB2 LYS 19 15.382 2.915 5.097 71 HB3 LYS 19 HB1 LYS 19 13.748 3.212 4.521 72 HG2 LYS 19 HG2 LYS 19 14.873 4.026 7.194 73 HG3 LYS 19 HG1 LYS 19 14.545 5.087 5.824 74 HD2 LYS 19 HD2 LYS 19 12.175 4.639 5.995 75 HD3 LYS 19 HD1 LYS 19 12.458 3.463 7.279 76 HE2 LYS 19 HE2 LYS 19 11.709 5.510 8.276 77 HE3 LYS 19 HE1 LYS 19 13.413 5.291 8.664 78 HZ1 LYS 19 HZ1 LYS 19 13.925 6.814 6.794 79 HZ2 LYS 19 HZ2 LYS 19 13.066 7.546 8.050 80 HZ3 LYS 19 HZ3 LYS 19 12.270 7.118 6.622 81 H VAL 20 HN VAL 20 13.514 0.463 3.806 82 HA VAL 20 HA VAL 20 10.756 0.952 3.481 83 HB VAL 20 HB VAL 20 10.752 -0.739 1.725 84 HG11 VAL 20 HG11 VAL 20 12.387 0.273 0.254 85 HG12 VAL 20 HG12 VAL 20 13.255 0.938 1.637 86 HG13 VAL 20 HG13 VAL 20 11.628 1.510 1.257 87 HG21 VAL 20 HG21 VAL 20 12.176 -2.404 2.806 88 HG22 VAL 20 HG22 VAL 20 13.573 -1.351 2.588 89 HG23 VAL 20 HG23 VAL 20 12.741 -2.017 1.182 90 H MET 21 HN MET 21 12.527 -1.609 5.090 91 HA MET 21 HA MET 21 10.358 -3.326 5.616 92 HB2 MET 21 HB2 MET 21 12.900 -2.781 7.150 93 HB3 MET 21 HB1 MET 21 11.741 -4.012 7.632 94 HG2 MET 21 HG2 MET 21 13.156 -3.922 4.981 95 HG3 MET 21 HG1 MET 21 13.646 -4.904 6.359 96 HE1 MET 21 HE1 MET 21 13.207 -6.181 3.532 97 HE2 MET 21 HE2 MET 21 12.281 -7.621 3.952 98 HE3 MET 21 HE3 MET 21 13.623 -7.107 4.975 99 H GLN 22 HN GLN 22 11.560 -0.450 7.251 100 HA GLN 22 HA GLN 22 9.840 -0.553 9.501 101 HB2 GLN 22 HB2 GLN 22 10.835 2.011 8.272 102 HB3 GLN 22 HB1 GLN 22 10.531 1.658 9.966 103 HG2 GLN 22 HG2 GLN 22 12.454 0.156 9.998 104 HG3 GLN 22 HG1 GLN 22 12.760 0.515 8.299 105 HE21 GLN 22 HE21 GLN 22 14.704 1.513 8.455 106 HE22 GLN 22 HE22 GLN 22 14.976 2.978 9.340 107 H TYR 23 HN TYR 23 9.602 0.945 6.316 108 HA TYR 23 HA TYR 23 7.020 2.080 6.711 109 HB2 TYR 23 HB2 TYR 23 8.552 1.369 4.206 110 HB3 TYR 23 HB1 TYR 23 6.970 2.134 4.177 111 HD1 TYR 23 HD1 TYR 23 10.383 2.749 3.984 112 HD2 TYR 23 HD2 TYR 23 6.846 4.316 5.739 113 HE1 TYR 23 HE1 TYR 23 11.444 4.958 4.123 114 HE2 TYR 23 HE2 TYR 23 7.901 6.534 5.894 115 HH TYR 23 HH TYR 23 10.780 7.317 4.272 116 H ARG 24 HN ARG 24 8.227 -0.992 5.579 117 HA ARG 24 HA ARG 24 5.951 -2.003 4.339 118 HB2 ARG 24 HB2 ARG 24 8.334 -2.926 4.348 119 HB3 ARG 24 HB1 ARG 24 7.927 -3.675 5.883 120 HG2 ARG 24 HG2 ARG 24 6.216 -5.002 4.846 121 HG3 ARG 24 HG1 ARG 24 6.440 -4.158 3.311 122 HD2 ARG 24 HD2 ARG 24 8.769 -4.987 3.244 123 HD3 ARG 24 HD1 ARG 24 8.461 -5.909 4.709 124 HE ARG 24 HE ARG 24 7.032 -6.362 2.161 125 HH11 ARG 24 HH11 ARG 24 8.455 -7.564 5.129 126 HH12 ARG 24 HH12 ARG 24 8.269 -9.232 4.696 127 HH21 ARG 24 HH21 ARG 24 6.787 -8.562 1.583 128 HH22 ARG 24 HH22 ARG 24 7.321 -9.804 2.671 129 H ARG 25 HN ARG 25 6.964 -2.183 7.734 130 HA ARG 25 HA ARG 25 4.821 -3.818 8.591 131 HB2 ARG 25 HB2 ARG 25 6.477 -1.818 10.138 132 HB3 ARG 25 HB1 ARG 25 5.368 -2.974 10.867 133 HG2 ARG 25 HG2 ARG 25 6.745 -4.773 9.701 134 HG3 ARG 25 HG1 ARG 25 7.938 -3.505 9.418 135 HD2 ARG 25 HD2 ARG 25 8.054 -3.087 11.826 136 HD3 ARG 25 HD1 ARG 25 6.871 -4.362 12.103 137 HE ARG 25 HE ARG 25 9.644 -4.723 11.211 138 HH11 ARG 25 HH11 ARG 25 6.605 -6.105 12.274 139 HH12 ARG 25 HH12 ARG 25 7.276 -7.678 12.559 140 HH21 ARG 25 HH21 ARG 25 10.529 -6.798 11.593 141 HH22 ARG 25 HH22 ARG 25 9.509 -8.071 12.171 142 H ALA 26 HN ALA 26 5.146 -0.368 8.121 143 HA ALA 26 HA ALA 26 2.646 0.273 9.410 144 HB1 ALA 26 HB1 ALA 26 4.408 1.981 7.658 145 HB2 ALA 26 HB2 ALA 26 4.527 1.851 9.413 146 HB3 ALA 26 HB3 ALA 26 3.083 2.545 8.677 147 H LEU 27 HN LEU 27 3.662 -0.744 6.322 148 HA LEU 27 HA LEU 27 1.197 0.157 5.043 149 HB2 LEU 27 HB2 LEU 27 3.845 -0.781 4.117 150 HB3 LEU 27 HB1 LEU 27 2.482 -1.232 3.115 151 HG LEU 27 HG LEU 27 2.045 0.961 2.475 152 HD11 LEU 27 HD11 LEU 27 3.622 1.919 4.865 153 HD12 LEU 27 HD12 LEU 27 1.868 1.970 4.680 154 HD13 LEU 27 HD13 LEU 27 2.892 2.952 3.635 155 HD21 LEU 27 HD21 LEU 27 4.178 1.948 1.834 156 HD22 LEU 27 HD22 LEU 27 4.197 0.200 1.598 157 HD23 LEU 27 HD23 LEU 27 5.015 0.912 2.989 158 H THR 28 HN THR 28 2.449 -2.562 6.641 159 HA THR 28 HA THR 28 0.752 -4.468 5.275 160 HB THR 28 HB THR 28 2.399 -4.793 7.793 161 HG1 THR 28 HG1 THR 28 3.675 -4.380 5.942 162 HG21 THR 28 HG21 THR 28 0.604 -6.446 7.653 163 HG22 THR 28 HG22 THR 28 2.174 -7.200 7.378 164 HG23 THR 28 HG23 THR 28 1.106 -6.865 6.015 165 H LYS 29 HN LYS 29 -1.334 -4.324 5.598 166 HA LYS 29 HA LYS 29 -2.485 -4.170 8.270 167 HB2 LYS 29 HB2 LYS 29 -2.592 -1.959 6.273 168 HB3 LYS 29 HB1 LYS 29 -4.091 -2.351 7.089 169 HG2 LYS 29 HG2 LYS 29 -3.218 -0.637 8.363 170 HG3 LYS 29 HG1 LYS 29 -2.738 -2.078 9.254 171 HD2 LYS 29 HD2 LYS 29 -0.516 -1.932 8.479 172 HD3 LYS 29 HD1 LYS 29 -0.941 -0.733 7.261 173 HE2 LYS 29 HE2 LYS 29 -1.056 -0.319 10.243 174 HE3 LYS 29 HE1 LYS 29 0.210 0.271 9.178 175 HZ1 LYS 29 HZ1 LYS 29 -1.252 2.049 9.551 176 HZ2 LYS 29 HZ2 LYS 29 -2.629 1.101 9.277 177 HZ3 LYS 29 HZ3 LYS 29 -1.601 1.504 7.987 178 H VAL 30 HN VAL 30 -4.926 -4.432 8.099 179 HA VAL 30 HA VAL 30 -5.694 -5.659 5.549 180 HB VAL 30 HB VAL 30 -6.270 -6.447 8.261 181 HG11 VAL 30 HG11 VAL 30 -8.665 -6.884 8.055 182 HG12 VAL 30 HG12 VAL 30 -8.692 -5.923 6.577 183 HG13 VAL 30 HG13 VAL 30 -8.286 -5.162 8.116 184 HG21 VAL 30 HG21 VAL 30 -7.081 -8.480 7.158 185 HG22 VAL 30 HG22 VAL 30 -5.514 -7.960 6.534 186 HG23 VAL 30 HG23 VAL 30 -6.981 -7.653 5.604 187 H VAL 31 HN VAL 31 -7.160 -4.658 4.340 188 HA VAL 31 HA VAL 31 -8.713 -2.448 5.428 189 HB VAL 31 HB VAL 31 -6.229 -2.081 4.000 190 HG11 VAL 31 HG11 VAL 31 -8.636 -0.824 2.699 191 HG12 VAL 31 HG12 VAL 31 -7.557 -2.021 1.976 192 HG13 VAL 31 HG13 VAL 31 -6.953 -0.412 2.376 193 HG21 VAL 31 HG21 VAL 31 -6.869 -0.877 6.009 194 HG22 VAL 31 HG22 VAL 31 -8.207 -0.119 5.144 195 HG23 VAL 31 HG23 VAL 31 -6.543 0.242 4.684 196 H LYS 32 HN LYS 32 -10.464 -1.855 4.034 197 HA LYS 32 HA LYS 32 -11.072 -3.984 2.122 198 HB2 LYS 32 HB2 LYS 32 -12.579 -3.416 4.121 199 HB3 LYS 32 HB1 LYS 32 -13.034 -1.989 3.198 200 HG2 LYS 32 HG2 LYS 32 -13.187 -4.369 1.580 201 HG3 LYS 32 HG1 LYS 32 -14.164 -4.516 3.047 202 HD2 LYS 32 HD2 LYS 32 -15.171 -2.299 2.503 203 HD3 LYS 32 HD1 LYS 32 -14.298 -2.346 0.969 204 HE2 LYS 32 HE2 LYS 32 -15.535 -4.157 0.180 205 HE3 LYS 32 HE1 LYS 32 -16.077 -4.609 1.796 206 HZ1 LYS 32 HZ1 LYS 32 -16.953 -2.218 0.264 207 HZ2 LYS 32 HZ2 LYS 32 -17.432 -2.588 1.841 208 HZ3 LYS 32 HZ3 LYS 32 -17.869 -3.609 0.566 209 H LEU 33 HN LEU 33 -10.870 -3.609 0.072 210 HA LEU 33 HA LEU 33 -10.580 -0.878 -0.883 211 HB2 LEU 33 HB2 LEU 33 -10.149 -3.578 -2.096 212 HB3 LEU 33 HB1 LEU 33 -10.305 -2.170 -3.134 213 HG LEU 33 HG LEU 33 -8.240 -2.458 -0.950 214 HD11 LEU 33 HD11 LEU 33 -6.644 -2.786 -2.763 215 HD12 LEU 33 HD12 LEU 33 -7.954 -2.739 -3.941 216 HD13 LEU 33 HD13 LEU 33 -7.867 -4.057 -2.773 217 HD21 LEU 33 HD21 LEU 33 -8.842 -0.152 -1.410 218 HD22 LEU 33 HD22 LEU 33 -8.631 -0.420 -3.139 219 HD23 LEU 33 HD23 LEU 33 -7.239 -0.500 -2.058 220 H LYS 34 HN LYS 34 -11.869 0.121 -2.381 221 HA LYS 34 HA LYS 34 -14.298 -1.238 -3.286 222 HB2 LYS 34 HB2 LYS 34 -14.495 1.469 -1.972 223 HB3 LYS 34 HB1 LYS 34 -15.807 0.419 -2.486 224 HG2 LYS 34 HG2 LYS 34 -15.157 -1.188 -0.728 225 HG3 LYS 34 HG1 LYS 34 -13.933 -0.042 -0.181 226 HD2 LYS 34 HD2 LYS 34 -16.918 0.371 -0.230 227 HD3 LYS 34 HD1 LYS 34 -15.901 0.176 1.196 228 HE2 LYS 34 HE2 LYS 34 -14.736 2.263 0.627 229 HE3 LYS 34 HE1 LYS 34 -15.793 2.459 -0.769 230 HZ1 LYS 34 HZ1 LYS 34 -17.685 2.565 0.731 231 HZ2 LYS 34 HZ2 LYS 34 -16.562 3.774 1.092 232 HZ3 LYS 34 HZ3 LYS 34 -16.663 2.397 2.066 233 H THR 35 HN THR 35 -14.003 -1.001 -5.423 234 HA THR 35 HA THR 35 -14.227 1.563 -6.599 235 HB THR 35 HB THR 35 -11.930 1.878 -6.043 236 HG1 THR 35 HG1 THR 35 -11.201 2.401 -8.001 237 HG21 THR 35 HG21 THR 35 -10.151 0.326 -6.740 238 HG22 THR 35 HG22 THR 35 -11.382 -0.800 -7.303 239 HG23 THR 35 HG23 THR 35 -11.274 -0.402 -5.591 240 H HIS 36 HN HIS 36 -13.270 1.082 -9.155 241 HA HIS 36 HA HIS 36 -15.185 -0.666 -10.253 242 HB2 HIS 36 HB2 HIS 36 -12.645 0.467 -11.439 243 HB3 HIS 36 HB1 HIS 36 -13.819 -0.460 -12.367 244 HD1 HIS 36 HD1 HIS 36 -13.037 2.924 -11.301 245 HD2 HIS 36 HD2 HIS 36 -16.445 0.841 -12.450 246 HE1 HIS 36 HE1 HIS 36 -14.740 4.679 -11.873 247 HE2 HIS 36 HE2 HIS 36 -16.732 3.396 -12.729 248 H LEU 37 HN LEU 37 -12.095 -1.197 -8.947 249 HA LEU 37 HA LEU 37 -11.372 -3.648 -10.120 250 HB2 LEU 37 HB2 LEU 37 -9.916 -2.150 -8.755 251 HB3 LEU 37 HB1 LEU 37 -10.828 -2.608 -7.335 252 HG LEU 37 HG LEU 37 -10.068 -4.977 -7.738 253 HD11 LEU 37 HD11 LEU 37 -8.168 -3.600 -9.631 254 HD12 LEU 37 HD12 LEU 37 -9.431 -4.749 -10.079 255 HD13 LEU 37 HD13 LEU 37 -8.064 -5.277 -9.099 256 HD21 LEU 37 HD21 LEU 37 -7.793 -4.497 -6.813 257 HD22 LEU 37 HD22 LEU 37 -9.114 -3.676 -5.980 258 HD23 LEU 37 HD23 LEU 37 -8.099 -2.785 -7.115 259 H PHE 38 HN PHE 38 -12.728 -3.053 -6.879 260 HA PHE 38 HA PHE 38 -14.915 -4.747 -7.010 261 HB2 PHE 38 HB2 PHE 38 -14.149 -6.669 -5.622 262 HB3 PHE 38 HB1 PHE 38 -13.385 -6.633 -7.205 263 HD1 PHE 38 HD1 PHE 38 -11.073 -6.824 -7.361 264 HD2 PHE 38 HD2 PHE 38 -12.819 -5.601 -3.685 265 HE1 PHE 38 HE1 PHE 38 -8.868 -6.938 -6.282 266 HE2 PHE 38 HE2 PHE 38 -10.620 -5.716 -2.597 267 HZ PHE 38 HZ PHE 38 -8.624 -6.401 -3.933 268 H SER 39 HN SER 39 -15.430 -5.508 -4.553 269 HA SER 39 HA SER 39 -14.361 -3.506 -2.690 270 HB2 SER 39 HB2 SER 39 -16.653 -3.364 -1.665 271 HB3 SER 39 HB1 SER 39 -16.557 -2.694 -3.294 272 HG SER 39 HG SER 39 -17.238 -5.391 -3.036 273 H GLU 40 HN GLU 40 -13.085 -4.843 -1.507 274 HA GLU 40 HA GLU 40 -14.289 -6.997 0.030 275 HB2 GLU 40 HB2 GLU 40 -12.025 -7.500 -1.918 276 HB3 GLU 40 HB1 GLU 40 -12.498 -8.616 -0.652 277 HG2 GLU 40 HG2 GLU 40 -14.260 -7.746 -2.928 278 HG3 GLU 40 HG1 GLU 40 -13.335 -9.245 -2.874 279 H THR 41 HN THR 41 -12.868 -7.717 1.760 280 HA THR 41 HA THR 41 -10.993 -5.698 2.614 281 HB THR 41 HB THR 41 -11.670 -8.337 3.897 282 HG1 THR 41 HG1 THR 41 -13.414 -6.798 3.801 283 HG21 THR 41 HG21 THR 41 -10.639 -7.365 5.930 284 HG22 THR 41 HG22 THR 41 -10.154 -5.954 4.992 285 HG23 THR 41 HG23 THR 41 -9.470 -7.535 4.621 286 H VAL 42 HN VAL 42 -8.968 -5.656 2.070 287 HA VAL 42 HA VAL 42 -7.668 -8.160 1.223 288 HB VAL 42 HB VAL 42 -6.410 -6.950 -0.404 289 HG11 VAL 42 HG11 VAL 42 -8.668 -7.495 -1.113 290 HG12 VAL 42 HG12 VAL 42 -8.144 -5.980 -1.844 291 HG13 VAL 42 HG13 VAL 42 -9.261 -5.960 -0.476 292 HG21 VAL 42 HG21 VAL 42 -5.916 -4.944 0.887 293 HG22 VAL 42 HG22 VAL 42 -7.590 -4.410 0.735 294 HG23 VAL 42 HG23 VAL 42 -6.561 -4.512 -0.696 295 H LYS 43 HN LYS 43 -5.478 -8.409 1.872 296 HA LYS 43 HA LYS 43 -4.689 -6.647 4.071 297 HB2 LYS 43 HB2 LYS 43 -4.571 -9.082 4.484 298 HB3 LYS 43 HB1 LYS 43 -3.429 -9.240 3.155 299 HG2 LYS 43 HG2 LYS 43 -1.830 -7.840 4.334 300 HG3 LYS 43 HG1 LYS 43 -2.979 -7.612 5.650 301 HD2 LYS 43 HD2 LYS 43 -1.355 -9.276 6.275 302 HD3 LYS 43 HD1 LYS 43 -2.933 -10.042 6.068 303 HE2 LYS 43 HE2 LYS 43 -2.289 -10.845 3.875 304 HE3 LYS 43 HE1 LYS 43 -0.748 -9.998 3.988 305 HZ1 LYS 43 HZ1 LYS 43 -1.607 -12.188 5.798 306 HZ2 LYS 43 HZ2 LYS 43 -0.098 -11.428 5.786 307 HZ3 LYS 43 HZ3 LYS 43 -0.574 -12.380 4.473 308 H VAL 44 HN VAL 44 -3.304 -5.062 3.717 309 HA VAL 44 HA VAL 44 -2.014 -4.986 1.082 310 HB VAL 44 HB VAL 44 -1.736 -2.503 2.479 311 HG11 VAL 44 HG11 VAL 44 -3.404 -3.272 0.089 312 HG12 VAL 44 HG12 VAL 44 -1.711 -2.775 0.063 313 HG13 VAL 44 HG13 VAL 44 -2.961 -1.629 0.551 314 HG21 VAL 44 HG21 VAL 44 -3.648 -3.132 3.832 315 HG22 VAL 44 HG22 VAL 44 -4.572 -3.535 2.383 316 HG23 VAL 44 HG23 VAL 44 -4.108 -1.863 2.696 317 H THR 45 HN THR 45 0.141 -4.248 0.903 318 HA THR 45 HA THR 45 1.878 -3.886 3.112 319 HB THR 45 HB THR 45 1.357 -6.358 3.305 320 HG1 THR 45 HG1 THR 45 3.268 -5.711 4.220 321 HG21 THR 45 HG21 THR 45 2.412 -7.881 1.699 322 HG22 THR 45 HG22 THR 45 2.904 -6.504 0.714 323 HG23 THR 45 HG23 THR 45 1.192 -6.873 0.920 324 H CYS 46 HN CYS 46 4.292 -4.605 2.006 325 HA CYS 46 HA CYS 46 4.234 -3.786 -0.787 326 HB2 CYS 46 HB2 CYS 46 5.949 -2.043 -0.436 327 HB3 CYS 46 HB1 CYS 46 4.437 -1.663 0.380 328 HG CYS 46 HG CYS 46 7.453 -2.438 1.709 329 H SER 47 HN SER 47 6.371 -3.974 -1.833 330 HA SER 47 HA SER 47 7.592 -6.450 -1.371 331 HB2 SER 47 HB2 SER 47 7.614 -5.307 -3.540 332 HB3 SER 47 HB1 SER 47 8.621 -4.026 -2.872 333 HG SER 47 HG SER 47 9.357 -6.393 -3.897 334 H LYS 48 HN LYS 48 9.879 -6.836 -0.868 335 HA LYS 48 HA LYS 48 10.502 -5.774 1.697 336 HB2 LYS 48 HB2 LYS 48 11.963 -7.631 -0.162 337 HB3 LYS 48 HB1 LYS 48 12.645 -7.123 1.375 338 HG2 LYS 48 HG2 LYS 48 10.662 -8.057 2.514 339 HG3 LYS 48 HG1 LYS 48 10.096 -8.659 0.951 340 HD2 LYS 48 HD2 LYS 48 12.051 -10.033 0.712 341 HD3 LYS 48 HD1 LYS 48 12.770 -9.335 2.163 342 HE2 LYS 48 HE2 LYS 48 10.987 -10.292 3.516 343 HE3 LYS 48 HE1 LYS 48 10.241 -10.969 2.069 344 HZ1 LYS 48 HZ1 LYS 48 12.244 -12.284 1.712 345 HZ2 LYS 48 HZ2 LYS 48 11.543 -12.633 3.214 346 HZ3 LYS 48 HZ3 LYS 48 12.925 -11.657 3.128 347 H ASP 49 HN ASP 49 11.288 -4.724 -1.452 348 HA ASP 49 HA ASP 49 13.417 -3.020 -0.337 349 HB2 ASP 49 HB2 ASP 49 12.827 -3.733 -3.215 350 HB3 ASP 49 HB1 ASP 49 14.025 -2.542 -2.710 351 H GLY 50 HN GLY 50 10.292 -2.952 -0.583 352 HA2 GLY 50 HA2 GLY 50 8.692 -1.325 -0.678 353 HA3 GLY 50 HA1 GLY 50 9.999 -0.164 -0.488 354 H GLU 51 HN GLU 51 10.068 -2.323 -3.165 355 HA GLU 51 HA GLU 51 9.826 -0.112 -5.007 356 HB2 GLU 51 HB2 GLU 51 10.258 -3.059 -5.530 357 HB3 GLU 51 HB1 GLU 51 10.390 -1.778 -6.728 358 HG2 GLU 51 HG2 GLU 51 12.246 -0.803 -5.461 359 HG3 GLU 51 HG1 GLU 51 12.124 -2.117 -4.293 360 H GLU 52 HN GLU 52 7.628 -2.204 -3.579 361 HA GLU 52 HA GLU 52 5.653 -1.756 -5.661 362 HB2 GLU 52 HB2 GLU 52 7.088 -3.947 -5.957 363 HB3 GLU 52 HB1 GLU 52 5.997 -4.569 -4.742 364 HG2 GLU 52 HG2 GLU 52 4.145 -4.389 -6.113 365 HG3 GLU 52 HG1 GLU 52 4.929 -3.241 -7.195 366 H VAL 53 HN VAL 53 3.552 -1.927 -4.952 367 HA VAL 53 HA VAL 53 3.167 -2.419 -2.066 368 HB VAL 53 HB VAL 53 1.348 -0.911 -3.959 369 HG11 VAL 53 HG11 VAL 53 0.159 -1.943 -2.102 370 HG12 VAL 53 HG12 VAL 53 0.190 -0.188 -1.929 371 HG13 VAL 53 HG13 VAL 53 1.269 -1.189 -0.957 372 HG21 VAL 53 HG21 VAL 53 3.412 0.317 -3.642 373 HG22 VAL 53 HG22 VAL 53 3.266 0.155 -1.892 374 HG23 VAL 53 HG23 VAL 53 2.090 1.115 -2.790 375 H GLN 54 HN GLN 54 1.938 -4.145 -1.500 376 HA GLN 54 HA GLN 54 0.638 -5.615 -3.708 377 HB2 GLN 54 HB2 GLN 54 1.776 -7.017 -1.319 378 HB3 GLN 54 HB1 GLN 54 1.480 -7.634 -2.936 379 HG2 GLN 54 HG2 GLN 54 3.613 -5.616 -2.332 380 HG3 GLN 54 HG1 GLN 54 3.885 -7.355 -2.264 381 HE21 GLN 54 HE21 GLN 54 5.384 -7.298 -3.893 382 HE22 GLN 54 HE22 GLN 54 4.969 -7.012 -5.552 383 H TRP 55 HN TRP 55 -1.158 -6.976 -3.076 384 HA TRP 55 HA TRP 55 -2.103 -6.719 -0.350 385 HB2 TRP 55 HB2 TRP 55 -4.460 -6.237 -1.176 386 HB3 TRP 55 HB1 TRP 55 -3.322 -4.900 -1.197 387 HD1 TRP 55 HD1 TRP 55 -4.977 -7.397 -3.659 388 HE1 TRP 55 HE1 TRP 55 -5.086 -6.256 -5.971 389 HE3 TRP 55 HE3 TRP 55 -2.428 -3.115 -2.555 390 HZ2 TRP 55 HZ2 TRP 55 -4.203 -3.843 -7.156 391 HZ3 TRP 55 HZ3 TRP 55 -2.107 -1.443 -4.322 392 HH2 TRP 55 HH2 TRP 55 -2.970 -1.793 -6.572 393 H PHE 56 HN PHE 56 -3.559 -8.270 0.298 394 HA PHE 56 HA PHE 56 -3.815 -10.584 -1.509 395 HB2 PHE 56 HB2 PHE 56 -3.673 -10.614 1.515 396 HB3 PHE 56 HB1 PHE 56 -3.703 -12.015 0.451 397 HD1 PHE 56 HD1 PHE 56 -1.740 -12.674 -0.801 398 HD2 PHE 56 HD2 PHE 56 -1.661 -9.297 1.784 399 HE1 PHE 56 HE1 PHE 56 0.716 -12.667 -0.894 400 HE2 PHE 56 HE2 PHE 56 0.797 -9.282 1.690 401 HZ PHE 56 HZ PHE 56 1.989 -10.958 0.371 402 H LYS 57 HN LYS 57 -5.851 -10.838 -2.154 403 HA LYS 57 HA LYS 57 -7.962 -9.349 -0.899 404 HB2 LYS 57 HB2 LYS 57 -8.093 -11.281 -3.215 405 HB3 LYS 57 HB1 LYS 57 -9.326 -10.114 -2.759 406 HG2 LYS 57 HG2 LYS 57 -7.901 -8.282 -3.340 407 HG3 LYS 57 HG1 LYS 57 -6.545 -9.374 -3.634 408 HD2 LYS 57 HD2 LYS 57 -9.134 -9.306 -5.188 409 HD3 LYS 57 HD1 LYS 57 -7.586 -8.656 -5.732 410 HE2 LYS 57 HE2 LYS 57 -6.630 -10.937 -5.573 411 HE3 LYS 57 HE1 LYS 57 -8.231 -11.546 -5.156 412 HZ1 LYS 57 HZ1 LYS 57 -7.536 -10.160 -7.686 413 HZ2 LYS 57 HZ2 LYS 57 -9.047 -10.797 -7.288 414 HZ3 LYS 57 HZ3 LYS 57 -7.727 -11.829 -7.506 415 H GLY 58 HN GLY 58 -9.307 -10.061 0.607 416 HA2 GLY 58 HA2 GLY 58 -10.804 -11.470 1.655 417 HA3 GLY 58 HA1 GLY 58 -10.383 -12.725 0.499 418 H LYS 59 HN LYS 59 -8.368 -13.881 0.847 419 HA LYS 59 HA LYS 59 -8.061 -14.471 3.666 420 HB2 LYS 59 HB2 LYS 59 -8.287 -16.273 1.946 421 HB3 LYS 59 HB1 LYS 59 -6.737 -15.783 1.284 422 HG2 LYS 59 HG2 LYS 59 -6.543 -17.748 2.725 423 HG3 LYS 59 HG1 LYS 59 -5.624 -16.379 3.351 424 HD2 LYS 59 HD2 LYS 59 -6.807 -17.525 5.149 425 HD3 LYS 59 HD1 LYS 59 -7.433 -15.892 4.934 426 HE2 LYS 59 HE2 LYS 59 -9.301 -16.820 3.612 427 HE3 LYS 59 HE1 LYS 59 -8.686 -18.443 3.919 428 HZ1 LYS 59 HZ1 LYS 59 -10.477 -17.830 5.437 429 HZ2 LYS 59 HZ2 LYS 59 -9.567 -16.525 6.007 430 HZ3 LYS 59 HZ3 LYS 59 -9.031 -18.106 6.272 431 H SER 60 HN SER 60 -6.191 -14.241 4.837 432 HA SER 60 HA SER 60 -4.469 -12.108 3.983 433 HB2 SER 60 HB2 SER 60 -4.337 -13.750 6.521 434 HB3 SER 60 HB1 SER 60 -3.628 -12.158 6.245 435 HG SER 60 HG SER 60 -5.546 -11.863 7.329 436 H THR 61 HN THR 61 -3.986 -13.953 2.211 437 HA THR 61 HA THR 61 -2.131 -15.967 2.685 438 HB THR 61 HB THR 61 -2.372 -14.279 0.186 439 HG1 THR 61 HG1 THR 61 -4.079 -15.594 -0.374 440 HG21 THR 61 HG21 THR 61 -1.722 -16.325 -0.984 441 HG22 THR 61 HG22 THR 61 -1.576 -17.166 0.559 442 HG23 THR 61 HG23 THR 61 -0.479 -15.840 0.171 443 H ALA 62 HN ALA 62 0.148 -16.059 2.260 444 HA ALA 62 HA ALA 62 1.620 -13.664 1.686 445 HB1 ALA 62 HB1 ALA 62 3.033 -13.724 3.661 446 HB2 ALA 62 HB2 ALA 62 2.051 -15.023 4.343 447 HB3 ALA 62 HB3 ALA 62 1.353 -13.420 4.098 448 H GLY 63 HN GLY 63 2.527 -14.600 -0.026 449 HA2 GLY 63 HA2 GLY 63 3.246 -17.186 -0.486 450 HA3 GLY 63 HA1 GLY 63 4.042 -15.820 -1.230 451 H ALA 64 HN ALA 64 4.547 -18.546 0.364 452 HA ALA 64 HA ALA 64 6.193 -19.490 1.638 453 HB1 ALA 64 HB1 ALA 64 7.336 -19.031 -0.481 454 HB2 ALA 64 HB2 ALA 64 8.436 -18.971 0.896 455 HB3 ALA 64 HB3 ALA 64 7.870 -17.475 0.154 456 H GLN 65 HN GLN 65 4.819 -17.399 3.030 457 HA GLN 65 HA GLN 65 4.916 -16.434 5.085 458 HB2 GLN 65 HB2 GLN 65 7.729 -17.520 5.119 459 HB3 GLN 65 HB1 GLN 65 6.957 -16.729 6.488 460 HG2 GLN 65 HG2 GLN 65 5.350 -18.450 6.693 461 HG3 GLN 65 HG1 GLN 65 5.810 -19.155 5.144 462 HE21 GLN 65 HE21 GLN 65 7.665 -20.362 4.991 463 HE22 GLN 65 HE22 GLN 65 8.499 -20.968 6.383 464 H ASP 66 HN ASP 66 7.494 -15.720 2.853 465 HA ASP 66 HA ASP 66 8.150 -13.170 4.003 466 HB2 ASP 66 HB2 ASP 66 8.797 -14.374 1.303 467 HB3 ASP 66 HB1 ASP 66 9.445 -12.849 1.894 468 H ARG 67 HN ARG 67 5.497 -14.242 2.552 469 HA ARG 67 HA ARG 67 3.702 -13.390 1.486 470 HB2 ARG 67 HB2 ARG 67 4.522 -10.552 1.750 471 HB3 ARG 67 HB1 ARG 67 2.989 -11.338 2.121 472 HG2 ARG 67 HG2 ARG 67 3.753 -12.068 4.227 473 HG3 ARG 67 HG1 ARG 67 5.422 -11.650 3.848 474 HD2 ARG 67 HD2 ARG 67 4.738 -9.273 3.725 475 HD3 ARG 67 HD1 ARG 67 3.119 -9.749 4.239 476 HE ARG 67 HE ARG 67 4.680 -10.792 6.170 477 HH11 ARG 67 HH11 ARG 67 4.455 -7.596 4.778 478 HH12 ARG 67 HH12 ARG 67 4.979 -6.792 6.220 479 HH21 ARG 67 HH21 ARG 67 5.367 -9.750 8.073 480 HH22 ARG 67 HH22 ARG 67 5.496 -8.023 8.099 481 H LYS 68 HN LYS 68 5.675 -14.242 -0.072 482 HA LYS 68 HA LYS 68 6.515 -12.239 -1.986 483 HB2 LYS 68 HB2 LYS 68 7.946 -14.092 -1.058 484 HB3 LYS 68 HB1 LYS 68 6.974 -15.218 -1.991 485 HG2 LYS 68 HG2 LYS 68 8.085 -14.775 -3.859 486 HG3 LYS 68 HG1 LYS 68 7.998 -13.031 -3.596 487 HD2 LYS 68 HD2 LYS 68 10.313 -13.775 -3.584 488 HD3 LYS 68 HD1 LYS 68 9.824 -13.187 -1.993 489 HE2 LYS 68 HE2 LYS 68 9.467 -15.495 -1.252 490 HE3 LYS 68 HE1 LYS 68 9.981 -16.077 -2.835 491 HZ1 LYS 68 HZ1 LYS 68 12.158 -15.161 -2.456 492 HZ2 LYS 68 HZ2 LYS 68 11.753 -16.176 -1.167 493 HZ3 LYS 68 HZ3 LYS 68 11.678 -14.498 -0.976 494 H LYS 69 HN LYS 69 3.784 -14.032 -1.571 495 HA LYS 69 HA LYS 69 3.257 -14.134 -4.460 496 HB2 LYS 69 HB2 LYS 69 3.582 -16.401 -3.259 497 HB3 LYS 69 HB1 LYS 69 2.045 -16.056 -2.485 498 HG2 LYS 69 HG2 LYS 69 1.842 -17.524 -4.460 499 HG3 LYS 69 HG1 LYS 69 0.894 -16.045 -4.577 500 HD2 LYS 69 HD2 LYS 69 2.031 -16.595 -6.689 501 HD3 LYS 69 HD1 LYS 69 2.566 -15.052 -6.031 502 HE2 LYS 69 HE2 LYS 69 4.562 -16.153 -5.114 503 HE3 LYS 69 HE1 LYS 69 4.026 -17.684 -5.803 504 HZ1 LYS 69 HZ1 LYS 69 4.682 -15.236 -7.353 505 HZ2 LYS 69 HZ2 LYS 69 4.199 -16.718 -8.005 506 HZ3 LYS 69 HZ3 LYS 69 5.676 -16.593 -7.195 507 HA PRO 70 HA PRO 70 0.119 -11.443 -2.410 508 HB2 PRO 70 HB2 PRO 70 0.455 -9.746 -4.756 509 HB3 PRO 70 HB1 PRO 70 0.696 -9.358 -3.051 510 HG2 PRO 70 HG2 PRO 70 2.749 -9.540 -4.793 511 HG3 PRO 70 HG1 PRO 70 2.911 -9.980 -3.085 512 HD2 PRO 70 HD2 PRO 70 2.503 -11.764 -5.464 513 HD3 PRO 70 HD1 PRO 70 3.612 -11.963 -4.088 514 H SER 71 HN SER 71 -1.950 -10.690 -3.197 515 HA SER 71 HA SER 71 -2.970 -12.365 -5.385 516 HB2 SER 71 HB2 SER 71 -3.947 -12.511 -3.014 517 HB3 SER 71 HB1 SER 71 -4.602 -10.902 -3.306 518 HG SER 71 HG SER 71 -5.090 -12.810 -5.264 519 H GLY 72 HN GLY 72 -1.547 -9.676 -5.307 520 HA2 GLY 72 HA2 GLY 72 -2.320 -8.435 -7.524 521 HA3 GLY 72 HA1 GLY 72 -3.522 -7.845 -6.381 522 H GLY 73 HN GLY 73 -1.695 -6.137 -7.669 523 HA2 GLY 73 HA2 GLY 73 -0.888 -4.523 -5.603 524 HA3 GLY 73 HA1 GLY 73 0.493 -5.560 -5.926 525 H PHE 74 HN PHE 74 1.314 -3.276 -6.296 526 HA PHE 74 HA PHE 74 1.697 -2.950 -9.097 527 HB2 PHE 74 HB2 PHE 74 0.777 -0.735 -9.415 528 HB3 PHE 74 HB1 PHE 74 -0.498 -1.819 -8.898 529 HD1 PHE 74 HD1 PHE 74 -0.013 -1.790 -5.925 530 HD2 PHE 74 HD2 PHE 74 -0.007 1.336 -8.807 531 HE1 PHE 74 HE1 PHE 74 -0.643 -0.175 -4.178 532 HE2 PHE 74 HE2 PHE 74 -0.633 2.948 -7.068 533 HZ PHE 74 HZ PHE 74 -0.953 2.197 -4.748 534 HA PRO 75 HA PRO 75 5.500 -1.337 -7.635 535 HB2 PRO 75 HB2 PRO 75 5.635 0.461 -9.948 536 HB3 PRO 75 HB1 PRO 75 6.667 -0.909 -9.535 537 HG2 PRO 75 HG2 PRO 75 4.929 -1.008 -11.581 538 HG3 PRO 75 HG1 PRO 75 5.289 -2.432 -10.585 539 HD2 PRO 75 HD2 PRO 75 2.921 -0.598 -10.488 540 HD3 PRO 75 HD1 PRO 75 2.984 -2.366 -10.351 541 H VAL 76 HN VAL 76 6.219 0.220 -6.365 542 HA VAL 76 HA VAL 76 4.510 2.253 -5.443 543 HB VAL 76 HB VAL 76 7.468 1.801 -5.022 544 HG11 VAL 76 HG11 VAL 76 5.656 3.675 -3.510 545 HG12 VAL 76 HG12 VAL 76 6.900 4.166 -4.659 546 HG13 VAL 76 HG13 VAL 76 7.353 3.348 -3.164 547 HG21 VAL 76 HG21 VAL 76 5.952 0.058 -4.172 548 HG22 VAL 76 HG22 VAL 76 5.108 1.281 -3.222 549 HG23 VAL 76 HG23 VAL 76 6.795 0.909 -2.878 550 H ASP 77 HN ASP 77 7.250 2.307 -7.639 551 HA ASP 77 HA ASP 77 7.464 5.132 -7.795 552 HB2 ASP 77 HB2 ASP 77 9.361 3.760 -8.341 553 HB3 ASP 77 HB1 ASP 77 8.455 2.912 -9.586 554 H LYS 78 HN LYS 78 5.260 2.925 -9.120 555 HA LYS 78 HA LYS 78 4.736 4.576 -11.468 556 HB2 LYS 78 HB2 LYS 78 4.065 1.772 -10.696 557 HB3 LYS 78 HB1 LYS 78 3.066 2.590 -11.887 558 HG2 LYS 78 HG2 LYS 78 4.824 1.247 -12.932 559 HG3 LYS 78 HG1 LYS 78 4.997 2.960 -13.306 560 HD2 LYS 78 HD2 LYS 78 6.676 3.084 -11.432 561 HD3 LYS 78 HD1 LYS 78 6.606 1.323 -11.357 562 HE2 LYS 78 HE2 LYS 78 7.384 1.144 -13.626 563 HE3 LYS 78 HE1 LYS 78 7.309 2.893 -13.831 564 HZ1 LYS 78 HZ1 LYS 78 9.112 1.439 -11.972 565 HZ2 LYS 78 HZ2 LYS 78 9.032 3.124 -12.145 566 HZ3 LYS 78 HZ3 LYS 78 9.567 2.162 -13.434 567 H ILE 79 HN ILE 79 3.655 4.330 -8.325 568 HA ILE 79 HA ILE 79 0.902 4.920 -8.623 569 HB ILE 79 HB ILE 79 2.693 5.957 -6.421 570 HG12 ILE 79 HG12 ILE 79 1.314 3.268 -6.595 571 HG13 ILE 79 HG11 ILE 79 3.052 3.538 -6.669 572 HG21 ILE 79 HG21 ILE 79 0.641 5.840 -5.075 573 HG22 ILE 79 HG22 ILE 79 -0.248 5.298 -6.498 574 HG23 ILE 79 HG23 ILE 79 0.462 6.912 -6.465 575 HD11 ILE 79 HD11 ILE 79 1.244 4.032 -4.318 576 HD12 ILE 79 HD12 ILE 79 2.952 4.464 -4.375 577 HD13 ILE 79 HD13 ILE 79 2.465 2.769 -4.480 578 H THR 80 HN THR 80 -0.090 6.814 -9.212 579 HA THR 80 HA THR 80 1.711 8.925 -10.057 580 HB THR 80 HB THR 80 0.097 8.193 -11.711 581 HG1 THR 80 HG1 THR 80 0.768 10.494 -11.457 582 HG21 THR 80 HG21 THR 80 -2.020 9.202 -9.815 583 HG22 THR 80 HG22 THR 80 -1.742 7.518 -10.260 584 HG23 THR 80 HG23 THR 80 -2.291 8.673 -11.475 585 H SER 81 HN SER 81 -1.034 8.463 -7.849 586 HA SER 81 HA SER 81 -0.185 10.745 -6.307 587 HB2 SER 81 HB2 SER 81 -2.907 10.829 -7.636 588 HB3 SER 81 HB1 SER 81 -2.272 12.012 -6.496 589 HG SER 81 HG SER 81 -0.467 11.816 -8.387 590 H VAL 82 HN VAL 82 -0.793 10.584 -4.213 591 HA VAL 82 HA VAL 82 -2.758 8.511 -3.488 592 HB VAL 82 HB VAL 82 -0.216 9.302 -2.045 593 HG11 VAL 82 HG11 VAL 82 -2.045 8.977 -0.433 594 HG12 VAL 82 HG12 VAL 82 -0.810 7.728 -0.304 595 HG13 VAL 82 HG13 VAL 82 -2.337 7.375 -1.108 596 HG21 VAL 82 HG21 VAL 82 0.082 7.741 -3.895 597 HG22 VAL 82 HG22 VAL 82 -1.125 6.667 -3.185 598 HG23 VAL 82 HG23 VAL 82 0.396 6.967 -2.342 599 H LYS 83 HN LYS 83 -4.557 9.544 -2.890 600 HA LYS 83 HA LYS 83 -4.298 11.962 -1.237 601 HB2 LYS 83 HB2 LYS 83 -6.521 11.576 -3.221 602 HB3 LYS 83 HB1 LYS 83 -6.004 13.057 -2.434 603 HG2 LYS 83 HG2 LYS 83 -5.135 13.408 -4.487 604 HG3 LYS 83 HG1 LYS 83 -3.776 12.557 -3.767 605 HD2 LYS 83 HD2 LYS 83 -4.178 11.636 -5.942 606 HD3 LYS 83 HD1 LYS 83 -4.677 10.447 -4.739 607 HE2 LYS 83 HE2 LYS 83 -6.287 10.617 -6.578 608 HE3 LYS 83 HE1 LYS 83 -7.002 11.089 -5.040 609 HZ1 LYS 83 HZ1 LYS 83 -7.607 12.592 -6.846 610 HZ2 LYS 83 HZ2 LYS 83 -5.980 12.973 -7.095 611 HZ3 LYS 83 HZ3 LYS 83 -6.736 13.399 -5.643 612 H SER 84 HN SER 84 -6.273 12.491 -0.041 613 HA SER 84 HA SER 84 -7.860 10.126 0.657 614 HB2 SER 84 HB2 SER 84 -8.350 11.320 2.786 615 HB3 SER 84 HB1 SER 84 -6.631 11.001 2.569 616 HG SER 84 HG SER 84 -6.887 13.124 3.237 617 H GLN 85 HN GLN 85 -10.167 10.523 1.015 618 HA GLN 85 HA GLN 85 -11.343 11.930 -1.115 619 HB2 GLN 85 HB2 GLN 85 -12.173 10.139 0.912 620 HB3 GLN 85 HB1 GLN 85 -13.261 11.518 0.946 621 HG2 GLN 85 HG2 GLN 85 -14.217 9.926 -0.497 622 HG3 GLN 85 HG1 GLN 85 -13.574 11.211 -1.519 623 HE21 GLN 85 HE21 GLN 85 -11.641 8.753 0.042 624 HE22 GLN 85 HE22 GLN 85 -11.168 7.929 -1.397 625 H ALA 86 HN ALA 86 -13.500 13.325 -0.320 626 HA ALA 86 HA ALA 86 -12.330 15.821 0.449 627 HB1 ALA 86 HB1 ALA 86 -15.235 15.114 0.068 628 HB2 ALA 86 HB2 ALA 86 -14.147 15.700 -1.188 629 HB3 ALA 86 HB3 ALA 86 -14.566 16.740 0.173 630 H ASP 87 HN ASP 87 -14.626 13.576 1.970 631 HA ASP 87 HA ASP 87 -14.188 14.982 4.525 632 HB2 ASP 87 HB2 ASP 87 -16.520 14.743 4.077 633 HB3 ASP 87 HB1 ASP 87 -16.328 13.063 3.594 634 H ASN 88 HN ASN 88 -13.804 12.031 2.815 635 HA ASN 88 HA ASN 88 -12.752 10.063 3.257 636 HB2 ASN 88 HB2 ASN 88 -10.366 10.411 3.757 637 HB3 ASN 88 HB1 ASN 88 -10.980 11.480 2.509 638 HD21 ASN 88 HD21 ASN 88 -9.800 11.273 5.778 639 HD22 ASN 88 HD22 ASN 88 -9.533 12.967 5.999 640 H THR 89 HN THR 89 -14.464 10.484 5.499 641 HA THR 89 HA THR 89 -13.146 10.302 7.950 642 HB THR 89 HB THR 89 -15.803 9.111 7.150 643 HG1 THR 89 HG1 THR 89 -15.962 11.321 7.141 644 HG21 THR 89 HG21 THR 89 -16.244 8.951 9.575 645 HG22 THR 89 HG22 THR 89 -14.569 9.410 9.892 646 HG23 THR 89 HG23 THR 89 -14.926 7.895 9.064 647 H LYS 90 HN LYS 90 -14.520 7.541 6.105 648 HA LYS 90 HA LYS 90 -12.141 6.066 6.985 649 HB2 LYS 90 HB2 LYS 90 -13.410 3.979 6.612 650 HB3 LYS 90 HB1 LYS 90 -14.057 4.988 7.892 651 HG2 LYS 90 HG2 LYS 90 -15.888 5.672 6.562 652 HG3 LYS 90 HG1 LYS 90 -15.170 4.986 5.104 653 HD2 LYS 90 HD2 LYS 90 -17.005 3.607 6.089 654 HD3 LYS 90 HD1 LYS 90 -15.469 2.758 5.916 655 HE2 LYS 90 HE2 LYS 90 -16.456 2.227 8.058 656 HE3 LYS 90 HE1 LYS 90 -14.993 3.184 8.298 657 HZ1 LYS 90 HZ1 LYS 90 -17.769 4.241 8.373 658 HZ2 LYS 90 HZ2 LYS 90 -16.360 5.132 8.649 659 HZ3 LYS 90 HZ3 LYS 90 -16.807 3.912 9.724 660 H VAL 91 HN VAL 91 -12.719 7.811 4.482 661 HA VAL 91 HA VAL 91 -12.441 5.703 2.439 662 HB VAL 91 HB VAL 91 -13.152 8.462 1.617 663 HG11 VAL 91 HG11 VAL 91 -14.129 5.728 0.799 664 HG12 VAL 91 HG12 VAL 91 -12.900 6.687 -0.026 665 HG13 VAL 91 HG13 VAL 91 -14.570 7.251 0.029 666 HG21 VAL 91 HG21 VAL 91 -14.541 8.202 3.590 667 HG22 VAL 91 HG22 VAL 91 -15.121 6.644 3.002 668 HG23 VAL 91 HG23 VAL 91 -15.525 8.123 2.128 669 H LEU 92 HN LEU 92 -10.623 5.558 1.312 670 HA LEU 92 HA LEU 92 -8.828 7.897 1.106 671 HB2 LEU 92 HB2 LEU 92 -8.293 5.019 1.572 672 HB3 LEU 92 HB1 LEU 92 -7.217 5.834 0.457 673 HG LEU 92 HG LEU 92 -6.546 7.407 2.173 674 HD11 LEU 92 HD11 LEU 92 -8.635 7.593 3.391 675 HD12 LEU 92 HD12 LEU 92 -7.313 7.171 4.479 676 HD13 LEU 92 HD13 LEU 92 -8.464 5.935 3.967 677 HD21 LEU 92 HD21 LEU 92 -5.332 5.310 2.019 678 HD22 LEU 92 HD22 LEU 92 -6.471 4.550 3.131 679 HD23 LEU 92 HD23 LEU 92 -5.424 5.849 3.696 680 H VAL 93 HN VAL 93 -7.775 8.216 -0.958 681 HA VAL 93 HA VAL 93 -8.845 6.626 -3.167 682 HB VAL 93 HB VAL 93 -10.328 8.449 -3.244 683 HG11 VAL 93 HG11 VAL 93 -9.307 9.955 -1.705 684 HG12 VAL 93 HG12 VAL 93 -9.561 10.815 -3.227 685 HG13 VAL 93 HG13 VAL 93 -7.952 10.234 -2.799 686 HG21 VAL 93 HG21 VAL 93 -9.737 9.653 -5.304 687 HG22 VAL 93 HG22 VAL 93 -9.416 7.925 -5.425 688 HG23 VAL 93 HG23 VAL 93 -8.085 9.052 -5.168 689 H ILE 94 HN ILE 94 -7.142 5.747 -4.082 690 HA ILE 94 HA ILE 94 -4.701 7.365 -4.457 691 HB ILE 94 HB ILE 94 -4.994 4.481 -3.639 692 HG12 ILE 94 HG12 ILE 94 -3.164 5.218 -2.009 693 HG13 ILE 94 HG11 ILE 94 -3.512 6.859 -2.530 694 HG21 ILE 94 HG21 ILE 94 -2.503 5.749 -4.767 695 HG22 ILE 94 HG22 ILE 94 -3.474 4.491 -5.534 696 HG23 ILE 94 HG23 ILE 94 -2.604 4.146 -4.037 697 HD11 ILE 94 HD11 ILE 94 -5.736 6.727 -1.685 698 HD12 ILE 94 HD12 ILE 94 -4.624 6.197 -0.421 699 HD13 ILE 94 HD13 ILE 94 -5.552 5.009 -1.341 700 H THR 95 HN THR 95 -3.896 7.433 -6.505 701 HA THR 95 HA THR 95 -5.086 5.583 -8.471 702 HB THR 95 HB THR 95 -4.251 8.439 -9.018 703 HG1 THR 95 HG1 THR 95 -6.873 7.338 -8.680 704 HG21 THR 95 HG21 THR 95 -5.841 6.472 -10.676 705 HG22 THR 95 HG22 THR 95 -4.166 6.940 -10.966 706 HG23 THR 95 HG23 THR 95 -5.454 8.134 -11.124 707 H VAL 96 HN VAL 96 -3.740 4.754 -10.041 708 HA VAL 96 HA VAL 96 -0.872 5.312 -9.755 709 HB VAL 96 HB VAL 96 -1.176 3.120 -8.951 710 HG11 VAL 96 HG11 VAL 96 -2.469 1.404 -10.123 711 HG12 VAL 96 HG12 VAL 96 -2.919 2.591 -11.348 712 HG13 VAL 96 HG13 VAL 96 -3.466 2.792 -9.683 713 HG21 VAL 96 HG21 VAL 96 0.677 3.196 -10.457 714 HG22 VAL 96 HG22 VAL 96 -0.389 2.999 -11.847 715 HG23 VAL 96 HG23 VAL 96 -0.168 1.667 -10.715 716 H ASN 97 HN ASN 97 0.337 5.599 -11.663 717 HA ASN 97 HA ASN 97 -1.182 5.399 -14.160 718 HB2 ASN 97 HB2 ASN 97 -1.153 7.762 -13.382 719 HB3 ASN 97 HB1 ASN 97 0.602 7.729 -13.516 720 HD21 ASN 97 HD21 ASN 97 -2.405 7.700 -15.252 721 HD22 ASN 97 HD22 ASN 97 -1.740 8.052 -16.812 722 H ASN 98 HN ASN 98 -0.163 3.638 -14.785 723 HA ASN 98 HA ASN 98 1.717 3.818 -16.675 724 HB2 ASN 98 HB2 ASN 98 3.458 4.398 -15.056 725 HB3 ASN 98 HB1 ASN 98 3.144 2.926 -14.157 726 HD21 ASN 98 HD21 ASN 98 3.848 0.948 -14.995 727 HD22 ASN 98 HD22 ASN 98 4.972 0.853 -16.305 728 HA PRO 99 HA PRO 99 0.366 -0.763 -15.543 729 HB2 PRO 99 HB2 PRO 99 -0.929 -0.133 -12.946 730 HB3 PRO 99 HB1 PRO 99 -0.079 -1.598 -13.449 731 HG2 PRO 99 HG2 PRO 99 1.029 0.118 -11.738 732 HG3 PRO 99 HG1 PRO 99 1.998 -0.721 -12.962 733 HD2 PRO 99 HD2 PRO 99 1.030 2.104 -12.919 734 HD3 PRO 99 HD1 PRO 99 2.566 1.433 -13.501 735 H GLN 100 HN GLN 100 -2.070 -1.377 -15.401 736 HA GLN 100 HA GLN 100 -3.470 0.470 -16.991 737 HB2 GLN 100 HB2 GLN 100 -4.572 -1.830 -15.367 738 HB3 GLN 100 HB1 GLN 100 -5.418 -0.999 -16.665 739 HG2 GLN 100 HG2 GLN 100 -3.701 -1.751 -18.248 740 HG3 GLN 100 HG1 GLN 100 -2.893 -2.613 -16.938 741 HE21 GLN 100 HE21 GLN 100 -3.145 -4.604 -17.919 742 HE22 GLN 100 HE22 GLN 100 -4.679 -5.398 -18.022 743 HA PRO 101 HA PRO 101 -4.276 3.592 -13.975 744 HB2 PRO 101 HB2 PRO 101 -6.579 4.023 -15.842 745 HB3 PRO 101 HB1 PRO 101 -5.467 5.205 -15.138 746 HG2 PRO 101 HG2 PRO 101 -5.151 4.405 -17.647 747 HG3 PRO 101 HG1 PRO 101 -3.746 4.651 -16.594 748 HD2 PRO 101 HD2 PRO 101 -4.984 2.119 -17.536 749 HD3 PRO 101 HD1 PRO 101 -3.291 2.474 -17.140 750 H THR 102 HN THR 102 -5.060 3.020 -12.088 751 HA THR 102 HA THR 102 -7.898 2.376 -11.842 752 HB THR 102 HB THR 102 -5.740 0.760 -10.456 753 HG1 THR 102 HG1 THR 102 -5.898 0.312 -12.742 754 HG21 THR 102 HG21 THR 102 -8.731 0.360 -10.615 755 HG22 THR 102 HG22 THR 102 -7.845 0.938 -9.204 756 HG23 THR 102 HG23 THR 102 -7.587 -0.702 -9.796 757 H THR 103 HN THR 103 -8.800 3.086 -9.918 758 HA THR 103 HA THR 103 -6.995 4.544 -8.100 759 HB THR 103 HB THR 103 -9.863 5.192 -8.803 760 HG1 THR 103 HG1 THR 103 -8.459 5.882 -10.410 761 HG21 THR 103 HG21 THR 103 -7.964 6.600 -6.928 762 HG22 THR 103 HG22 THR 103 -9.400 5.689 -6.457 763 HG23 THR 103 HG23 THR 103 -9.565 7.175 -7.394 764 H TYR 104 HN TYR 104 -6.821 3.604 -6.220 765 HA TYR 104 HA TYR 104 -8.790 1.595 -5.423 766 HB2 TYR 104 HB2 TYR 104 -6.057 2.168 -4.260 767 HB3 TYR 104 HB1 TYR 104 -7.064 0.758 -3.940 768 HD1 TYR 104 HD1 TYR 104 -7.455 -0.909 -5.742 769 HD2 TYR 104 HD2 TYR 104 -4.663 2.274 -6.178 770 HE1 TYR 104 HE1 TYR 104 -6.390 -2.093 -7.627 771 HE2 TYR 104 HE2 TYR 104 -3.602 1.103 -8.062 772 HH TYR 104 HH TYR 104 -3.385 -1.188 -8.913 773 H ASN 105 HN ASN 105 -10.169 1.933 -3.800 774 HA ASN 105 HA ASN 105 -9.677 4.227 -2.034 775 HB2 ASN 105 HB2 ASN 105 -12.242 2.681 -2.504 776 HB3 ASN 105 HB1 ASN 105 -12.055 3.994 -1.349 777 HD21 ASN 105 HD21 ASN 105 -10.719 3.847 -4.605 778 HD22 ASN 105 HD22 ASN 105 -11.632 5.175 -5.230 779 H PHE 106 HN PHE 106 -8.492 3.564 -0.350 780 HA PHE 106 HA PHE 106 -8.909 0.934 0.792 781 HB2 PHE 106 HB2 PHE 106 -7.132 3.201 1.739 782 HB3 PHE 106 HB1 PHE 106 -7.122 1.564 2.373 783 HD1 PHE 106 HD1 PHE 106 -6.670 -0.302 0.592 784 HD2 PHE 106 HD2 PHE 106 -5.580 3.779 0.113 785 HE1 PHE 106 HE1 PHE 106 -4.981 -0.949 -1.077 786 HE2 PHE 106 HE2 PHE 106 -3.899 3.143 -1.559 787 HZ PHE 106 HZ PHE 106 -3.553 0.826 -2.134 788 H THR 107 HN THR 107 -10.604 0.627 2.033 789 HA THR 107 HA THR 107 -11.477 2.798 3.826 790 HB THR 107 HB THR 107 -13.216 0.698 2.510 791 HG1 THR 107 HG1 THR 107 -12.226 2.462 1.167 792 HG21 THR 107 HG21 THR 107 -14.109 1.505 4.637 793 HG22 THR 107 HG22 THR 107 -15.075 2.100 3.287 794 HG23 THR 107 HG23 THR 107 -13.928 3.172 4.091 795 H PHE 108 HN PHE 108 -11.702 2.266 5.956 796 HA PHE 108 HA PHE 108 -11.915 -0.552 6.659 797 HB2 PHE 108 HB2 PHE 108 -9.449 0.371 6.752 798 HB3 PHE 108 HB1 PHE 108 -10.005 1.141 8.231 799 HD1 PHE 108 HD1 PHE 108 -9.221 0.032 10.066 800 HD2 PHE 108 HD2 PHE 108 -10.600 -2.222 6.737 801 HE1 PHE 108 HE1 PHE 108 -8.817 -2.047 11.313 802 HE2 PHE 108 HE2 PHE 108 -10.204 -4.309 7.978 803 HZ PHE 108 HZ PHE 108 -9.355 -4.227 10.275 804 H LYS 109 HN LYS 109 -12.371 -0.748 9.078 805 HA LYS 109 HA LYS 109 -14.568 0.895 9.805 806 HB2 LYS 109 HB2 LYS 109 -13.929 -1.519 10.562 807 HB3 LYS 109 HB1 LYS 109 -12.880 -0.707 11.728 808 HG2 LYS 109 HG2 LYS 109 -15.819 -0.108 11.558 809 HG3 LYS 109 HG1 LYS 109 -15.194 -1.453 12.511 810 HD2 LYS 109 HD2 LYS 109 -13.800 0.107 13.787 811 HD3 LYS 109 HD1 LYS 109 -14.437 1.449 12.833 812 HE2 LYS 109 HE2 LYS 109 -16.677 1.001 13.659 813 HE3 LYS 109 HE1 LYS 109 -16.085 -0.394 14.558 814 HZ1 LYS 109 HZ1 LYS 109 -16.350 1.522 15.989 815 HZ2 LYS 109 HZ2 LYS 109 -15.293 2.428 15.030 816 HZ3 LYS 109 HZ3 LYS 109 -14.718 1.089 15.887 817 H SER 110 HN SER 110 -11.267 0.592 10.797 818 HA SER 110 HA SER 110 -11.345 2.512 12.879 819 HB2 SER 110 HB2 SER 110 -8.928 1.398 11.501 820 HB3 SER 110 HB1 SER 110 -9.114 1.841 13.192 821 HG SER 110 HG SER 110 -9.401 -0.264 13.339 822 HA PRO 111 HA PRO 111 -10.780 6.040 10.121 823 HB2 PRO 111 HB2 PRO 111 -10.398 7.459 12.683 824 HB3 PRO 111 HB1 PRO 111 -11.559 7.770 11.387 825 HG2 PRO 111 HG2 PRO 111 -12.315 6.708 13.733 826 HG3 PRO 111 HG1 PRO 111 -13.083 6.247 12.203 827 HD2 PRO 111 HD2 PRO 111 -11.060 4.770 13.832 828 HD3 PRO 111 HD1 PRO 111 -12.451 4.147 12.921 829 H GLY 112 HN GLY 112 -8.733 5.335 12.941 830 HA2 GLY 112 HA2 GLY 112 -6.574 6.973 12.014 831 HA3 GLY 112 HA1 GLY 112 -6.520 5.836 13.351 832 H GLU 113 HN GLU 113 -7.512 3.672 11.473 833 HA GLU 113 HA GLU 113 -4.967 2.550 11.024 834 HB2 GLU 113 HB2 GLU 113 -7.100 1.280 11.416 835 HB3 GLU 113 HB1 GLU 113 -7.591 1.702 9.786 836 HG2 GLU 113 HG2 GLU 113 -6.711 -0.551 9.913 837 HG3 GLU 113 HG1 GLU 113 -5.717 0.471 8.873 838 H ARG 114 HN ARG 114 -7.392 3.823 8.788 839 HA ARG 114 HA ARG 114 -5.856 3.277 6.449 840 HB2 ARG 114 HB2 ARG 114 -8.054 5.313 6.560 841 HB3 ARG 114 HB1 ARG 114 -7.600 4.254 5.235 842 HG2 ARG 114 HG2 ARG 114 -8.900 2.589 5.953 843 HG3 ARG 114 HG1 ARG 114 -8.493 2.856 7.648 844 HD2 ARG 114 HD2 ARG 114 -10.533 4.299 5.973 845 HD3 ARG 114 HD1 ARG 114 -10.787 3.354 7.444 846 HE ARG 114 HE ARG 114 -9.961 5.124 8.721 847 HH11 ARG 114 HH11 ARG 114 -10.108 5.925 5.319 848 HH12 ARG 114 HH12 ARG 114 -9.825 7.617 5.570 849 HH21 ARG 114 HH21 ARG 114 -9.492 7.373 9.032 850 HH22 ARG 114 HH22 ARG 114 -9.501 8.436 7.664 851 H GLU 115 HN GLU 115 -6.357 6.105 8.498 852 HA GLU 115 HA GLU 115 -5.132 7.989 6.797 853 HB2 GLU 115 HB2 GLU 115 -5.688 7.937 9.746 854 HB3 GLU 115 HB1 GLU 115 -4.796 9.265 9.014 855 HG2 GLU 115 HG2 GLU 115 -6.672 9.718 7.529 856 HG3 GLU 115 HG1 GLU 115 -7.568 8.382 8.253 857 H SER 116 HN SER 116 -3.843 6.029 9.463 858 HA SER 116 HA SER 116 -1.221 7.002 9.363 859 HB2 SER 116 HB2 SER 116 -2.086 4.172 10.041 860 HB3 SER 116 HB1 SER 116 -0.590 4.970 10.531 861 HG SER 116 HG SER 116 -3.217 5.400 11.434 862 H TRP 117 HN TRP 117 -2.903 4.635 7.412 863 HA TRP 117 HA TRP 117 -0.616 3.642 6.032 864 HB2 TRP 117 HB2 TRP 117 -3.152 2.793 6.245 865 HB3 TRP 117 HB1 TRP 117 -3.291 3.660 4.721 866 HD1 TRP 117 HD1 TRP 117 -1.910 0.506 6.247 867 HE1 TRP 117 HE1 TRP 117 -0.970 -1.012 4.389 868 HE3 TRP 117 HE3 TRP 117 -2.114 3.789 2.333 869 HZ2 TRP 117 HZ2 TRP 117 -0.386 -0.838 1.647 870 HZ3 TRP 117 HZ3 TRP 117 -1.340 3.030 0.125 871 HH2 TRP 117 HH2 TRP 117 -0.497 0.767 -0.210 872 H GLN 118 HN GLN 118 -3.074 6.067 5.326 873 HA GLN 118 HA GLN 118 -2.452 6.787 2.742 874 HB2 GLN 118 HB2 GLN 118 -4.438 7.589 3.804 875 HB3 GLN 118 HB1 GLN 118 -3.517 8.418 5.046 876 HG2 GLN 118 HG2 GLN 118 -4.434 10.007 3.497 877 HG3 GLN 118 HG1 GLN 118 -2.679 9.985 3.362 878 HE21 GLN 118 HE21 GLN 118 -4.680 7.490 1.967 879 HE22 GLN 118 HE22 GLN 118 -4.421 7.941 0.323 880 H GLU 119 HN GLU 119 -1.106 8.218 5.721 881 HA GLU 119 HA GLU 119 0.602 9.993 4.275 882 HB2 GLU 119 HB2 GLU 119 1.590 10.441 6.511 883 HB3 GLU 119 HB1 GLU 119 -0.159 10.610 6.466 884 HG2 GLU 119 HG2 GLU 119 -0.385 8.374 7.439 885 HG3 GLU 119 HG1 GLU 119 1.369 8.256 7.537 886 H GLN 120 HN GLN 120 1.011 6.851 5.817 887 HA GLN 120 HA GLN 120 3.829 6.840 5.804 888 HB2 GLN 120 HB2 GLN 120 1.704 4.793 6.206 889 HB3 GLN 120 HB1 GLN 120 3.359 4.252 5.956 890 HG2 GLN 120 HG2 GLN 120 2.463 6.183 8.085 891 HG3 GLN 120 HG1 GLN 120 2.785 4.467 8.330 892 HE21 GLN 120 HE21 GLN 120 5.004 4.579 6.381 893 HE22 GLN 120 HE22 GLN 120 6.323 5.288 7.253 894 H ILE 121 HN ILE 121 1.452 5.587 3.511 895 HA ILE 121 HA ILE 121 3.282 4.201 1.891 896 HB ILE 121 HB ILE 121 0.873 3.853 1.725 897 HG12 ILE 121 HG12 ILE 121 0.684 3.840 -0.760 898 HG13 ILE 121 HG11 ILE 121 2.144 4.818 -0.844 899 HG21 ILE 121 HG21 ILE 121 0.799 6.613 0.519 900 HG22 ILE 121 HG22 ILE 121 0.054 6.095 2.033 901 HG23 ILE 121 HG23 ILE 121 -0.542 5.467 0.496 902 HD11 ILE 121 HD11 ILE 121 3.421 3.029 0.176 903 HD12 ILE 121 HD12 ILE 121 2.587 2.461 -1.270 904 HD13 ILE 121 HD13 ILE 121 1.958 2.055 0.327 905 H GLN 122 HN GLN 122 2.226 7.557 1.916 906 HA GLN 122 HA GLN 122 3.501 8.327 -0.497 907 HB2 GLN 122 HB2 GLN 122 2.646 9.903 1.930 908 HB3 GLN 122 HB1 GLN 122 3.327 10.646 0.492 909 HG2 GLN 122 HG2 GLN 122 1.493 9.864 -0.843 910 HG3 GLN 122 HG1 GLN 122 0.838 8.965 0.526 911 HE21 GLN 122 HE21 GLN 122 -0.192 10.052 2.167 912 HE22 GLN 122 HE22 GLN 122 -0.690 11.703 2.026 913 H SER 123 HN SER 123 4.495 8.319 2.888 914 HA SER 123 HA SER 123 6.985 9.567 2.571 915 HB2 SER 123 HB2 SER 123 6.217 7.447 4.593 916 HB3 SER 123 HB1 SER 123 7.542 8.600 4.738 917 HG SER 123 HG SER 123 5.730 9.324 5.886 918 H LEU 124 HN LEU 124 5.960 6.227 2.190 919 HA LEU 124 HA LEU 124 8.571 5.149 1.832 920 HB2 LEU 124 HB2 LEU 124 6.617 3.813 2.523 921 HB3 LEU 124 HB1 LEU 124 5.875 4.090 0.965 922 HG LEU 124 HG LEU 124 7.010 1.814 1.432 923 HD11 LEU 124 HD11 LEU 124 6.161 2.446 -0.745 924 HD12 LEU 124 HD12 LEU 124 7.701 1.599 -0.904 925 HD13 LEU 124 HD13 LEU 124 7.636 3.353 -1.077 926 HD21 LEU 124 HD21 LEU 124 9.437 3.467 0.750 927 HD22 LEU 124 HD22 LEU 124 9.377 1.707 0.857 928 HD23 LEU 124 HD23 LEU 124 9.112 2.688 2.298 929 H MET 125 HN MET 125 6.010 6.194 -0.387 930 HA MET 125 HA MET 125 7.227 5.524 -2.813 931 HB2 MET 125 HB2 MET 125 5.392 7.836 -2.152 932 HB3 MET 125 HB1 MET 125 5.798 7.320 -3.780 933 HG2 MET 125 HG2 MET 125 4.577 5.371 -3.612 934 HG3 MET 125 HG1 MET 125 4.588 5.397 -1.848 935 HE1 MET 125 HE1 MET 125 3.380 7.384 -5.005 936 HE2 MET 125 HE2 MET 125 3.914 8.652 -3.898 937 HE3 MET 125 HE3 MET 125 2.201 8.486 -4.293 938 H LYS 126 HN LYS 126 7.287 8.601 -1.050 939 HA LYS 126 HA LYS 126 8.973 9.853 -2.983 940 HB2 LYS 126 HB2 LYS 126 8.321 10.727 -0.168 941 HB3 LYS 126 HB1 LYS 126 9.023 11.734 -1.429 942 HG2 LYS 126 HG2 LYS 126 6.267 10.517 -1.413 943 HG3 LYS 126 HG1 LYS 126 6.680 12.224 -1.244 944 HD2 LYS 126 HD2 LYS 126 7.580 12.235 -3.516 945 HD3 LYS 126 HD1 LYS 126 7.199 10.520 -3.680 946 HE2 LYS 126 HE2 LYS 126 5.491 11.840 -4.764 947 HE3 LYS 126 HE1 LYS 126 4.817 11.041 -3.343 948 HZ1 LYS 126 HZ1 LYS 126 4.086 13.329 -3.471 949 HZ2 LYS 126 HZ2 LYS 126 5.685 13.879 -3.500 950 HZ3 LYS 126 HZ3 LYS 126 5.076 13.120 -2.118 951 H PHE 127 HN PHE 127 9.551 7.828 -0.319 952 HA PHE 127 HA PHE 127 12.177 8.708 0.325 953 HB2 PHE 127 HB2 PHE 127 10.857 7.395 1.895 954 HB3 PHE 127 HB1 PHE 127 10.800 6.054 0.753 955 HD1 PHE 127 HD1 PHE 127 12.292 4.329 1.026 956 HD2 PHE 127 HD2 PHE 127 13.286 8.181 2.529 957 HE1 PHE 127 HE1 PHE 127 14.348 3.406 2.015 958 HE2 PHE 127 HE2 PHE 127 15.340 7.272 3.516 959 HZ PHE 127 HZ PHE 127 15.878 4.855 3.234 960 H MET 128 HN MET 128 11.017 5.856 -1.484 961 HA MET 128 HA MET 128 13.760 5.439 -2.392 962 HB2 MET 128 HB2 MET 128 13.006 3.194 -3.047 963 HB3 MET 128 HB1 MET 128 12.716 3.532 -1.352 964 HG2 MET 128 HG2 MET 128 10.784 2.465 -1.976 965 HG3 MET 128 HG1 MET 128 10.331 4.158 -2.133 966 HE1 MET 128 HE1 MET 128 11.513 0.952 -4.012 967 HE2 MET 128 HE2 MET 128 12.642 2.144 -4.657 968 HE3 MET 128 HE3 MET 128 11.410 1.441 -5.703 969 H SER 129 HN SER 129 10.645 6.334 -3.602 970 HA SER 129 HA SER 129 11.671 6.291 -6.349 971 HB2 SER 129 HB2 SER 129 8.870 6.589 -5.254 972 HB3 SER 129 HB1 SER 129 9.274 6.780 -6.963 973 HG SER 129 HG SER 129 9.629 4.456 -5.361 974 H MET 130 HN MET 130 12.576 8.147 -4.365 975 HA MET 130 HA MET 130 11.408 10.648 -4.471 976 HB2 MET 130 HB2 MET 130 13.776 11.486 -4.008 977 HB3 MET 130 HB1 MET 130 13.065 10.365 -2.854 978 HG2 MET 130 HG2 MET 130 15.222 9.579 -3.113 979 HG3 MET 130 HG1 MET 130 14.266 8.550 -4.175 980 HE1 MET 130 HE1 MET 130 17.650 8.803 -6.100 981 HE2 MET 130 HE2 MET 130 16.398 7.711 -5.507 982 HE3 MET 130 HE3 MET 130 17.369 8.642 -4.367 983 H LYS 131 HN LYS 131 11.655 12.448 -5.739 984 HA LYS 131 HA LYS 131 12.800 11.948 -8.402 985 HB2 LYS 131 HB2 LYS 131 10.489 13.737 -7.632 986 HB3 LYS 131 HB1 LYS 131 11.144 13.571 -9.256 987 HG2 LYS 131 HG2 LYS 131 10.535 11.187 -9.232 988 HG3 LYS 131 HG1 LYS 131 9.818 11.407 -7.634 989 HD2 LYS 131 HD2 LYS 131 8.254 13.040 -8.566 990 HD3 LYS 131 HD1 LYS 131 8.978 12.825 -10.159 991 HE2 LYS 131 HE2 LYS 131 8.321 10.465 -10.131 992 HE3 LYS 131 HE1 LYS 131 7.585 10.691 -8.545 993 HZ1 LYS 131 HZ1 LYS 131 6.754 12.058 -11.047 994 HZ2 LYS 131 HZ2 LYS 131 6.041 12.269 -9.528 995 HZ3 LYS 131 HZ3 LYS 131 5.940 10.773 -10.310 Start of MODEL 10 1 H1 SER 11 HT1 SER 11 26.510 1.755 3.478 2 H2 SER 11 HT2 SER 11 24.925 1.686 4.061 3 H3 SER 11 HT3 SER 11 25.514 3.117 3.377 4 HA SER 11 HA SER 11 25.736 2.034 1.239 5 HB2 SER 11 HB2 SER 11 26.110 -0.226 1.876 6 HB3 SER 11 HB1 SER 11 24.622 -0.287 2.812 7 HG SER 11 HG SER 11 24.138 -1.306 0.947 8 H ALA 12 HN ALA 12 24.277 2.918 -0.024 9 HA ALA 12 HA ALA 12 21.908 4.059 1.005 10 HB1 ALA 12 HB1 ALA 12 23.177 5.039 -0.843 11 HB2 ALA 12 HB2 ALA 12 21.489 4.777 -1.278 12 HB3 ALA 12 HB3 ALA 12 22.733 3.675 -1.868 13 H SER 13 HN SER 13 22.588 1.090 -0.701 14 HA SER 13 HA SER 13 19.849 0.501 -1.287 15 HB2 SER 13 HB2 SER 13 21.796 -0.439 -2.560 16 HB3 SER 13 HB1 SER 13 22.189 -1.416 -1.147 17 HG SER 13 HG SER 13 19.876 -1.537 -2.781 18 H ASP 14 HN ASP 14 22.165 -0.472 1.196 19 HA ASP 14 HA ASP 14 20.481 -2.325 2.502 20 HB2 ASP 14 HB2 ASP 14 22.936 -0.824 3.378 21 HB3 ASP 14 HB1 ASP 14 22.102 -1.938 4.450 22 H ILE 15 HN ILE 15 21.206 1.100 3.183 23 HA ILE 15 HA ILE 15 19.605 1.283 5.482 24 HB ILE 15 HB ILE 15 21.269 3.026 4.769 25 HG12 ILE 15 HG12 ILE 15 19.653 4.937 5.471 26 HG13 ILE 15 HG11 ILE 15 18.464 3.641 5.620 27 HG21 ILE 15 HG21 ILE 15 20.514 3.236 2.420 28 HG22 ILE 15 HG22 ILE 15 20.589 4.782 3.265 29 HG23 ILE 15 HG23 ILE 15 19.032 3.997 3.001 30 HD11 ILE 15 HD11 ILE 15 19.381 3.974 7.765 31 HD12 ILE 15 HD12 ILE 15 21.028 3.982 7.138 32 HD13 ILE 15 HD13 ILE 15 20.096 2.487 7.142 33 H ARG 16 HN ARG 16 18.871 1.627 2.088 34 HA ARG 16 HA ARG 16 16.203 2.496 2.349 35 HB2 ARG 16 HB2 ARG 16 17.446 2.714 0.268 36 HB3 ARG 16 HB1 ARG 16 17.670 0.980 0.175 37 HG2 ARG 16 HG2 ARG 16 15.241 0.714 -0.199 38 HG3 ARG 16 HG1 ARG 16 15.083 2.481 -0.199 39 HD2 ARG 16 HD2 ARG 16 16.800 2.544 -2.009 40 HD3 ARG 16 HD1 ARG 16 16.728 0.788 -2.064 41 HE ARG 16 HE ARG 16 14.333 1.095 -2.712 42 HH11 ARG 16 HH11 ARG 16 16.628 3.689 -3.245 43 HH12 ARG 16 HH12 ARG 16 15.857 4.248 -4.692 44 HH21 ARG 16 HH21 ARG 16 13.342 1.790 -4.663 45 HH22 ARG 16 HH22 ARG 16 13.991 3.182 -5.495 46 H MET 17 HN MET 17 17.637 -0.725 1.945 47 HA MET 17 HA MET 17 15.235 -2.153 1.892 48 HB2 MET 17 HB2 MET 17 18.012 -2.934 2.754 49 HB3 MET 17 HB1 MET 17 16.675 -4.076 2.716 50 HG2 MET 17 HG2 MET 17 16.398 -3.756 0.353 51 HG3 MET 17 HG1 MET 17 17.620 -2.481 0.343 52 HE1 MET 17 HE1 MET 17 17.866 -5.816 2.457 53 HE2 MET 17 HE2 MET 17 18.575 -6.909 1.268 54 HE3 MET 17 HE3 MET 17 16.944 -6.286 1.029 55 H LYS 18 HN LYS 18 17.241 -1.149 4.656 56 HA LYS 18 HA LYS 18 15.502 -2.443 6.516 57 HB2 LYS 18 HB2 LYS 18 16.693 -1.254 8.277 58 HB3 LYS 18 HB1 LYS 18 17.804 -2.028 7.164 59 HG2 LYS 18 HG2 LYS 18 18.619 -0.045 6.383 60 HG3 LYS 18 HG1 LYS 18 17.134 0.843 6.728 61 HD2 LYS 18 HD2 LYS 18 18.949 1.483 8.246 62 HD3 LYS 18 HD1 LYS 18 17.604 0.741 9.109 63 HE2 LYS 18 HE2 LYS 18 19.729 -0.088 9.956 64 HE3 LYS 18 HE1 LYS 18 18.822 -1.381 9.177 65 HZ1 LYS 18 HZ1 LYS 18 21.093 0.121 7.997 66 HZ2 LYS 18 HZ2 LYS 18 20.197 -1.064 7.192 67 HZ3 LYS 18 HZ3 LYS 18 21.126 -1.478 8.541 68 H LYS 19 HN LYS 19 15.612 0.760 5.072 69 HA LYS 19 HA LYS 19 13.730 1.857 6.926 70 HB2 LYS 19 HB2 LYS 19 15.409 2.921 5.000 71 HB3 LYS 19 HB1 LYS 19 13.802 3.195 4.341 72 HG2 LYS 19 HG2 LYS 19 14.834 4.105 7.022 73 HG3 LYS 19 HG1 LYS 19 14.474 5.115 5.620 74 HD2 LYS 19 HD2 LYS 19 12.121 4.568 5.788 75 HD3 LYS 19 HD1 LYS 19 12.443 3.448 7.108 76 HE2 LYS 19 HE2 LYS 19 11.598 5.461 8.061 77 HE3 LYS 19 HE1 LYS 19 13.318 5.381 8.429 78 HZ1 LYS 19 HZ1 LYS 19 12.702 7.588 7.741 79 HZ2 LYS 19 HZ2 LYS 19 12.060 7.012 6.286 80 HZ3 LYS 19 HZ3 LYS 19 13.725 6.907 6.580 81 H VAL 20 HN VAL 20 13.515 0.382 3.724 82 HA VAL 20 HA VAL 20 10.775 0.971 3.343 83 HB VAL 20 HB VAL 20 10.744 -0.720 1.591 84 HG11 VAL 20 HG11 VAL 20 11.645 1.505 1.111 85 HG12 VAL 20 HG12 VAL 20 12.401 0.255 0.121 86 HG13 VAL 20 HG13 VAL 20 13.267 0.925 1.505 87 HG21 VAL 20 HG21 VAL 20 13.526 -1.402 2.517 88 HG22 VAL 20 HG22 VAL 20 12.758 -2.005 1.047 89 HG23 VAL 20 HG23 VAL 20 12.101 -2.434 2.626 90 H MET 21 HN MET 21 12.431 -1.652 5.012 91 HA MET 21 HA MET 21 10.110 -3.261 5.270 92 HB2 MET 21 HB2 MET 21 11.309 -4.592 6.810 93 HB3 MET 21 HB1 MET 21 12.443 -4.115 5.556 94 HG2 MET 21 HG2 MET 21 13.448 -2.530 6.954 95 HG3 MET 21 HG1 MET 21 12.165 -2.680 8.143 96 HE1 MET 21 HE1 MET 21 15.245 -6.020 7.292 97 HE2 MET 21 HE2 MET 21 15.218 -4.479 6.436 98 HE3 MET 21 HE3 MET 21 13.909 -5.638 6.207 99 H GLN 22 HN GLN 22 11.473 -0.636 7.102 100 HA GLN 22 HA GLN 22 9.732 -0.699 9.319 101 HB2 GLN 22 HB2 GLN 22 10.676 1.860 8.032 102 HB3 GLN 22 HB1 GLN 22 10.350 1.555 9.730 103 HG2 GLN 22 HG2 GLN 22 12.322 0.148 9.876 104 HG3 GLN 22 HG1 GLN 22 12.635 0.388 8.157 105 HE21 GLN 22 HE21 GLN 22 14.569 1.425 8.283 106 HE22 GLN 22 HE22 GLN 22 14.791 2.958 9.064 107 H TYR 23 HN TYR 23 9.537 1.037 6.227 108 HA TYR 23 HA TYR 23 6.944 2.068 6.568 109 HB2 TYR 23 HB2 TYR 23 8.521 1.438 4.068 110 HB3 TYR 23 HB1 TYR 23 6.943 2.218 4.037 111 HD1 TYR 23 HD1 TYR 23 10.274 2.880 3.740 112 HD2 TYR 23 HD2 TYR 23 6.888 4.245 5.913 113 HE1 TYR 23 HE1 TYR 23 11.358 5.061 4.036 114 HE2 TYR 23 HE2 TYR 23 7.966 6.435 6.225 115 HH TYR 23 HH TYR 23 10.527 7.495 4.472 116 H ARG 24 HN ARG 24 8.142 -0.973 5.345 117 HA ARG 24 HA ARG 24 5.842 -1.988 4.159 118 HB2 ARG 24 HB2 ARG 24 8.209 -2.932 4.130 119 HB3 ARG 24 HB1 ARG 24 7.843 -3.641 5.694 120 HG2 ARG 24 HG2 ARG 24 6.102 -4.988 4.741 121 HG3 ARG 24 HG1 ARG 24 6.280 -4.182 3.179 122 HD2 ARG 24 HD2 ARG 24 8.622 -5.010 3.090 123 HD3 ARG 24 HD1 ARG 24 8.316 -5.920 4.564 124 HE ARG 24 HE ARG 24 6.606 -6.398 2.233 125 HH11 ARG 24 HH11 ARG 24 9.123 -7.506 4.402 126 HH12 ARG 24 HH12 ARG 24 9.049 -9.151 3.860 127 HH21 ARG 24 HH21 ARG 24 6.517 -8.573 1.504 128 HH22 ARG 24 HH22 ARG 24 7.566 -9.756 2.217 129 H ARG 25 HN ARG 25 6.901 -2.054 7.524 130 HA ARG 25 HA ARG 25 4.796 -3.682 8.496 131 HB2 ARG 25 HB2 ARG 25 6.423 -1.601 9.945 132 HB3 ARG 25 HB1 ARG 25 5.435 -2.846 10.700 133 HG2 ARG 25 HG2 ARG 25 6.843 -4.576 9.768 134 HG3 ARG 25 HG1 ARG 25 7.803 -3.364 8.918 135 HD2 ARG 25 HD2 ARG 25 8.370 -2.366 11.106 136 HD3 ARG 25 HD1 ARG 25 7.520 -3.696 11.888 137 HE ARG 25 HE ARG 25 9.232 -5.069 10.440 138 HH11 ARG 25 HH11 ARG 25 9.812 -2.138 12.261 139 HH12 ARG 25 HH12 ARG 25 11.470 -2.525 12.592 140 HH21 ARG 25 HH21 ARG 25 11.411 -5.570 10.853 141 HH22 ARG 25 HH22 ARG 25 12.387 -4.470 11.780 142 H ALA 26 HN ALA 26 5.193 -0.228 8.059 143 HA ALA 26 HA ALA 26 2.719 0.461 9.342 144 HB1 ALA 26 HB1 ALA 26 4.478 2.129 7.560 145 HB2 ALA 26 HB2 ALA 26 4.681 1.955 9.303 146 HB3 ALA 26 HB3 ALA 26 3.230 2.714 8.657 147 H LEU 27 HN LEU 27 3.606 -0.654 6.277 148 HA LEU 27 HA LEU 27 1.139 0.314 5.045 149 HB2 LEU 27 HB2 LEU 27 3.722 -0.741 4.052 150 HB3 LEU 27 HB1 LEU 27 2.306 -1.130 3.097 151 HG LEU 27 HG LEU 27 1.993 1.048 2.411 152 HD11 LEU 27 HD11 LEU 27 2.874 3.031 3.582 153 HD12 LEU 27 HD12 LEU 27 3.498 1.978 4.851 154 HD13 LEU 27 HD13 LEU 27 1.759 2.095 4.573 155 HD21 LEU 27 HD21 LEU 27 4.160 0.240 1.601 156 HD22 LEU 27 HD22 LEU 27 4.951 0.980 2.995 157 HD23 LEU 27 HD23 LEU 27 4.142 1.991 1.798 158 H THR 28 HN THR 28 2.494 -2.492 6.505 159 HA THR 28 HA THR 28 0.710 -4.378 5.278 160 HB THR 28 HB THR 28 2.388 -4.632 7.787 161 HG1 THR 28 HG1 THR 28 3.610 -4.364 5.859 162 HG21 THR 28 HG21 THR 28 0.981 -6.762 6.168 163 HG22 THR 28 HG22 THR 28 0.528 -6.223 7.786 164 HG23 THR 28 HG23 THR 28 2.066 -7.048 7.530 165 H LYS 29 HN LYS 29 -1.374 -4.167 5.606 166 HA LYS 29 HA LYS 29 -2.455 -3.986 8.300 167 HB2 LYS 29 HB2 LYS 29 -2.666 -1.814 6.260 168 HB3 LYS 29 HB1 LYS 29 -4.100 -2.187 7.195 169 HG2 LYS 29 HG2 LYS 29 -3.125 -0.440 8.355 170 HG3 LYS 29 HG1 LYS 29 -2.601 -1.863 9.252 171 HD2 LYS 29 HD2 LYS 29 -0.443 -1.787 8.229 172 HD3 LYS 29 HD1 LYS 29 -0.955 -0.510 7.127 173 HE2 LYS 29 HE2 LYS 29 -0.856 -0.240 10.122 174 HE3 LYS 29 HE1 LYS 29 0.414 0.293 9.035 175 HZ1 LYS 29 HZ1 LYS 29 -1.278 1.730 7.965 176 HZ2 LYS 29 HZ2 LYS 29 -0.925 2.143 9.565 177 HZ3 LYS 29 HZ3 LYS 29 -2.364 1.314 9.205 178 H VAL 30 HN VAL 30 -4.811 -4.338 8.266 179 HA VAL 30 HA VAL 30 -5.697 -5.740 5.854 180 HB VAL 30 HB VAL 30 -7.619 -6.524 7.297 181 HG11 VAL 30 HG11 VAL 30 -5.716 -7.967 6.792 182 HG12 VAL 30 HG12 VAL 30 -6.297 -8.253 8.432 183 HG13 VAL 30 HG13 VAL 30 -4.834 -7.304 8.168 184 HG21 VAL 30 HG21 VAL 30 -7.338 -6.430 9.729 185 HG22 VAL 30 HG22 VAL 30 -7.482 -4.813 9.039 186 HG23 VAL 30 HG23 VAL 30 -5.902 -5.427 9.526 187 H VAL 31 HN VAL 31 -7.175 -4.821 4.584 188 HA VAL 31 HA VAL 31 -8.661 -2.491 5.498 189 HB VAL 31 HB VAL 31 -6.223 -2.358 3.863 190 HG11 VAL 31 HG11 VAL 31 -8.612 -0.756 2.997 191 HG12 VAL 31 HG12 VAL 31 -7.861 -2.067 2.083 192 HG13 VAL 31 HG13 VAL 31 -6.960 -0.582 2.405 193 HG21 VAL 31 HG21 VAL 31 -6.193 -0.063 4.688 194 HG22 VAL 31 HG22 VAL 31 -6.448 -1.221 5.995 195 HG23 VAL 31 HG23 VAL 31 -7.806 -0.288 5.365 196 H LYS 32 HN LYS 32 -10.366 -1.912 4.063 197 HA LYS 32 HA LYS 32 -11.061 -4.115 2.262 198 HB2 LYS 32 HB2 LYS 32 -12.531 -3.314 4.267 199 HB3 LYS 32 HB1 LYS 32 -12.990 -2.017 3.173 200 HG2 LYS 32 HG2 LYS 32 -13.133 -4.626 1.912 201 HG3 LYS 32 HG1 LYS 32 -14.174 -4.493 3.335 202 HD2 LYS 32 HD2 LYS 32 -15.111 -2.395 2.381 203 HD3 LYS 32 HD1 LYS 32 -14.143 -2.673 0.928 204 HE2 LYS 32 HE2 LYS 32 -15.333 -4.644 0.391 205 HE3 LYS 32 HE1 LYS 32 -16.074 -4.724 1.988 206 HZ1 LYS 32 HZ1 LYS 32 -17.614 -3.947 0.275 207 HZ2 LYS 32 HZ2 LYS 32 -16.623 -2.612 -0.030 208 HZ3 LYS 32 HZ3 LYS 32 -17.374 -2.780 1.474 209 H LEU 33 HN LEU 33 -10.913 -3.811 0.174 210 HA LEU 33 HA LEU 33 -10.510 -1.127 -0.871 211 HB2 LEU 33 HB2 LEU 33 -10.221 -3.883 -1.981 212 HB3 LEU 33 HB1 LEU 33 -10.396 -2.536 -3.088 213 HG LEU 33 HG LEU 33 -8.224 -2.803 -1.008 214 HD11 LEU 33 HD11 LEU 33 -8.120 -3.106 -4.008 215 HD12 LEU 33 HD12 LEU 33 -7.981 -4.415 -2.834 216 HD13 LEU 33 HD13 LEU 33 -6.741 -3.163 -2.910 217 HD21 LEU 33 HD21 LEU 33 -8.783 -0.485 -1.436 218 HD22 LEU 33 HD22 LEU 33 -8.689 -0.758 -3.175 219 HD23 LEU 33 HD23 LEU 33 -7.235 -0.878 -2.183 220 H LYS 34 HN LYS 34 -11.819 -0.079 -2.316 221 HA LYS 34 HA LYS 34 -14.314 -1.358 -3.148 222 HB2 LYS 34 HB2 LYS 34 -14.454 1.381 -1.924 223 HB3 LYS 34 HB1 LYS 34 -15.766 0.272 -2.280 224 HG2 LYS 34 HG2 LYS 34 -14.941 -1.197 -0.458 225 HG3 LYS 34 HG1 LYS 34 -13.757 0.049 -0.056 226 HD2 LYS 34 HD2 LYS 34 -16.762 0.290 0.021 227 HD3 LYS 34 HD1 LYS 34 -15.662 0.295 1.397 228 HE2 LYS 34 HE2 LYS 34 -14.738 2.406 0.719 229 HE3 LYS 34 HE1 LYS 34 -15.649 2.371 -0.790 230 HZ1 LYS 34 HZ1 LYS 34 -16.687 3.823 0.821 231 HZ2 LYS 34 HZ2 LYS 34 -16.818 2.556 1.931 232 HZ3 LYS 34 HZ3 LYS 34 -17.693 2.508 0.485 233 H THR 35 HN THR 35 -14.032 -1.136 -5.301 234 HA THR 35 HA THR 35 -14.256 1.434 -6.462 235 HB THR 35 HB THR 35 -11.940 1.713 -5.939 236 HG1 THR 35 HG1 THR 35 -11.093 2.043 -7.990 237 HG21 THR 35 HG21 THR 35 -11.436 -0.924 -7.294 238 HG22 THR 35 HG22 THR 35 -11.331 -0.608 -5.565 239 HG23 THR 35 HG23 THR 35 -10.196 0.163 -6.676 240 H HIS 36 HN HIS 36 -13.443 1.005 -9.040 241 HA HIS 36 HA HIS 36 -15.358 -0.773 -10.081 242 HB2 HIS 36 HB2 HIS 36 -14.572 1.067 -11.417 243 HB3 HIS 36 HB1 HIS 36 -12.916 0.484 -11.345 244 HD1 HIS 36 HD1 HIS 36 -12.192 -1.167 -13.108 245 HD2 HIS 36 HD2 HIS 36 -16.293 -0.475 -13.128 246 HE1 HIS 36 HE1 HIS 36 -13.058 -2.291 -15.182 247 HE2 HIS 36 HE2 HIS 36 -15.559 -2.009 -15.080 248 H LEU 37 HN LEU 37 -12.204 -1.284 -8.919 249 HA LEU 37 HA LEU 37 -11.518 -3.722 -10.129 250 HB2 LEU 37 HB2 LEU 37 -10.002 -2.327 -8.757 251 HB3 LEU 37 HB1 LEU 37 -10.959 -2.691 -7.340 252 HG LEU 37 HG LEU 37 -10.328 -5.120 -7.690 253 HD11 LEU 37 HD11 LEU 37 -9.593 -4.939 -10.006 254 HD12 LEU 37 HD12 LEU 37 -8.297 -5.538 -8.971 255 HD13 LEU 37 HD13 LEU 37 -8.287 -3.862 -9.515 256 HD21 LEU 37 HD21 LEU 37 -8.255 -3.036 -7.015 257 HD22 LEU 37 HD22 LEU 37 -8.086 -4.755 -6.659 258 HD23 LEU 37 HD23 LEU 37 -9.380 -3.821 -5.908 259 H PHE 38 HN PHE 38 -12.727 -3.249 -6.828 260 HA PHE 38 HA PHE 38 -15.018 -4.817 -7.014 261 HB2 PHE 38 HB2 PHE 38 -14.265 -6.784 -5.622 262 HB3 PHE 38 HB1 PHE 38 -13.661 -6.780 -7.271 263 HD1 PHE 38 HD1 PHE 38 -11.486 -7.388 -7.566 264 HD2 PHE 38 HD2 PHE 38 -12.595 -5.527 -3.905 265 HE1 PHE 38 HE1 PHE 38 -9.193 -7.664 -6.734 266 HE2 PHE 38 HE2 PHE 38 -10.298 -5.797 -3.068 267 HZ PHE 38 HZ PHE 38 -8.594 -6.866 -4.483 268 H SER 39 HN SER 39 -15.537 -5.632 -4.586 269 HA SER 39 HA SER 39 -14.421 -3.668 -2.702 270 HB2 SER 39 HB2 SER 39 -16.739 -3.749 -1.610 271 HB3 SER 39 HB1 SER 39 -16.608 -2.852 -3.123 272 HG SER 39 HG SER 39 -17.403 -5.571 -2.985 273 H GLU 40 HN GLU 40 -13.083 -4.969 -1.581 274 HA GLU 40 HA GLU 40 -14.159 -7.330 -0.248 275 HB2 GLU 40 HB2 GLU 40 -11.740 -7.413 -2.062 276 HB3 GLU 40 HB1 GLU 40 -12.199 -8.696 -0.961 277 HG2 GLU 40 HG2 GLU 40 -13.897 -7.726 -3.243 278 HG3 GLU 40 HG1 GLU 40 -12.814 -9.114 -3.316 279 H THR 41 HN THR 41 -12.837 -8.044 1.496 280 HA THR 41 HA THR 41 -11.192 -5.977 2.672 281 HB THR 41 HB THR 41 -11.686 -8.763 3.707 282 HG1 THR 41 HG1 THR 41 -13.127 -6.648 4.784 283 HG21 THR 41 HG21 THR 41 -9.840 -7.578 4.778 284 HG22 THR 41 HG22 THR 41 -11.198 -7.749 5.892 285 HG23 THR 41 HG23 THR 41 -10.898 -6.203 5.099 286 H VAL 42 HN VAL 42 -9.087 -5.822 2.247 287 HA VAL 42 HA VAL 42 -7.672 -8.244 1.335 288 HB VAL 42 HB VAL 42 -6.444 -6.943 -0.255 289 HG11 VAL 42 HG11 VAL 42 -8.664 -7.637 -0.985 290 HG12 VAL 42 HG12 VAL 42 -8.211 -6.104 -1.727 291 HG13 VAL 42 HG13 VAL 42 -9.351 -6.130 -0.377 292 HG21 VAL 42 HG21 VAL 42 -6.109 -4.919 1.057 293 HG22 VAL 42 HG22 VAL 42 -7.811 -4.494 0.873 294 HG23 VAL 42 HG23 VAL 42 -6.750 -4.522 -0.536 295 H LYS 43 HN LYS 43 -5.467 -8.410 1.962 296 HA LYS 43 HA LYS 43 -4.699 -6.610 4.143 297 HB2 LYS 43 HB2 LYS 43 -4.488 -9.071 4.528 298 HB3 LYS 43 HB1 LYS 43 -3.305 -9.135 3.227 299 HG2 LYS 43 HG2 LYS 43 -1.843 -7.625 4.472 300 HG3 LYS 43 HG1 LYS 43 -3.033 -7.537 5.769 301 HD2 LYS 43 HD2 LYS 43 -1.507 -9.099 6.546 302 HD3 LYS 43 HD1 LYS 43 -2.793 -10.100 5.872 303 HE2 LYS 43 HE2 LYS 43 -0.738 -11.042 5.152 304 HE3 LYS 43 HE1 LYS 43 -1.440 -10.226 3.757 305 HZ1 LYS 43 HZ1 LYS 43 0.685 -9.106 5.506 306 HZ2 LYS 43 HZ2 LYS 43 0.039 -8.364 4.132 307 HZ3 LYS 43 HZ3 LYS 43 0.938 -9.789 3.980 308 H VAL 44 HN VAL 44 -3.470 -4.939 3.661 309 HA VAL 44 HA VAL 44 -2.121 -4.951 1.061 310 HB VAL 44 HB VAL 44 -1.925 -2.362 1.947 311 HG11 VAL 44 HG11 VAL 44 -3.698 -1.881 0.340 312 HG12 VAL 44 HG12 VAL 44 -4.160 -3.585 0.335 313 HG13 VAL 44 HG13 VAL 44 -2.577 -3.094 -0.281 314 HG21 VAL 44 HG21 VAL 44 -4.603 -3.429 2.828 315 HG22 VAL 44 HG22 VAL 44 -4.169 -1.723 2.718 316 HG23 VAL 44 HG23 VAL 44 -3.347 -2.769 3.877 317 H THR 45 HN THR 45 -0.065 -3.866 0.903 318 HA THR 45 HA THR 45 1.677 -3.444 3.058 319 HB THR 45 HB THR 45 1.244 -5.887 3.440 320 HG1 THR 45 HG1 THR 45 3.182 -5.557 4.245 321 HG21 THR 45 HG21 THR 45 2.621 -6.226 0.770 322 HG22 THR 45 HG22 THR 45 0.924 -6.570 1.110 323 HG23 THR 45 HG23 THR 45 2.191 -7.527 1.882 324 H CYS 46 HN CYS 46 4.080 -4.200 2.022 325 HA CYS 46 HA CYS 46 4.031 -3.553 -0.827 326 HB2 CYS 46 HB2 CYS 46 5.959 -2.024 -0.554 327 HB3 CYS 46 HB1 CYS 46 4.513 -1.434 0.254 328 HG CYS 46 HG CYS 46 7.477 -2.325 1.542 329 H SER 47 HN SER 47 6.109 -4.088 -1.890 330 HA SER 47 HA SER 47 6.920 -6.700 -1.208 331 HB2 SER 47 HB2 SER 47 6.936 -5.781 -3.515 332 HB3 SER 47 HB1 SER 47 8.290 -4.745 -3.072 333 HG SER 47 HG SER 47 8.288 -7.347 -3.809 334 H LYS 48 HN LYS 48 9.409 -7.212 -1.088 335 HA LYS 48 HA LYS 48 10.162 -6.472 1.500 336 HB2 LYS 48 HB2 LYS 48 11.712 -7.781 -0.725 337 HB3 LYS 48 HB1 LYS 48 12.410 -7.496 0.863 338 HG2 LYS 48 HG2 LYS 48 10.567 -8.826 1.854 339 HG3 LYS 48 HG1 LYS 48 10.018 -9.202 0.217 340 HD2 LYS 48 HD2 LYS 48 12.131 -10.282 -0.277 341 HD3 LYS 48 HD1 LYS 48 12.761 -9.830 1.308 342 HE2 LYS 48 HE2 LYS 48 10.972 -11.180 2.353 343 HE3 LYS 48 HE1 LYS 48 10.454 -11.691 0.749 344 HZ1 LYS 48 HZ1 LYS 48 12.585 -12.735 0.411 345 HZ2 LYS 48 HZ2 LYS 48 11.895 -13.321 1.840 346 HZ3 LYS 48 HZ3 LYS 48 13.142 -12.184 1.908 347 H ASP 49 HN ASP 49 11.460 -5.366 -1.622 348 HA ASP 49 HA ASP 49 13.305 -3.571 -0.280 349 HB2 ASP 49 HB2 ASP 49 12.788 -3.646 -3.249 350 HB3 ASP 49 HB1 ASP 49 14.235 -3.115 -2.404 351 H GLY 50 HN GLY 50 10.156 -3.421 -0.649 352 HA2 GLY 50 HA2 GLY 50 8.659 -1.693 -0.437 353 HA3 GLY 50 HA1 GLY 50 10.022 -0.591 -0.392 354 H GLU 51 HN GLU 51 10.160 -2.501 -3.153 355 HA GLU 51 HA GLU 51 9.846 -0.220 -4.805 356 HB2 GLU 51 HB2 GLU 51 10.189 -3.141 -5.457 357 HB3 GLU 51 HB1 GLU 51 10.152 -1.874 -6.676 358 HG2 GLU 51 HG2 GLU 51 12.141 -2.112 -4.432 359 HG3 GLU 51 HG1 GLU 51 12.429 -2.508 -6.125 360 H GLU 52 HN GLU 52 7.611 -2.664 -3.800 361 HA GLU 52 HA GLU 52 5.623 -1.549 -5.651 362 HB2 GLU 52 HB2 GLU 52 6.474 -4.375 -5.390 363 HB3 GLU 52 HB1 GLU 52 4.748 -4.072 -5.551 364 HG2 GLU 52 HG2 GLU 52 5.140 -2.865 -7.625 365 HG3 GLU 52 HG1 GLU 52 6.877 -3.112 -7.457 366 H VAL 53 HN VAL 53 3.523 -1.519 -4.949 367 HA VAL 53 HA VAL 53 3.050 -2.191 -2.141 368 HB VAL 53 HB VAL 53 1.181 -0.833 -4.104 369 HG11 VAL 53 HG11 VAL 53 0.030 -1.901 -2.239 370 HG12 VAL 53 HG12 VAL 53 -0.065 -0.145 -2.116 371 HG13 VAL 53 HG13 VAL 53 1.061 -1.042 -1.096 372 HG21 VAL 53 HG21 VAL 53 3.007 0.390 -2.039 373 HG22 VAL 53 HG22 VAL 53 1.756 1.261 -2.926 374 HG23 VAL 53 HG23 VAL 53 3.125 0.560 -3.791 375 H GLN 54 HN GLN 54 1.629 -3.838 -1.557 376 HA GLN 54 HA GLN 54 0.466 -5.399 -3.762 377 HB2 GLN 54 HB2 GLN 54 1.861 -6.847 -1.548 378 HB3 GLN 54 HB1 GLN 54 1.534 -7.372 -3.192 379 HG2 GLN 54 HG2 GLN 54 3.235 -5.722 -3.975 380 HG3 GLN 54 HG1 GLN 54 3.638 -5.424 -2.287 381 HE21 GLN 54 HE21 GLN 54 3.839 -7.614 -4.933 382 HE22 GLN 54 HE22 GLN 54 4.967 -8.708 -4.217 383 H TRP 55 HN TRP 55 -1.178 -6.926 -3.060 384 HA TRP 55 HA TRP 55 -2.073 -6.703 -0.311 385 HB2 TRP 55 HB2 TRP 55 -4.470 -6.311 -1.142 386 HB3 TRP 55 HB1 TRP 55 -3.380 -4.933 -1.077 387 HD1 TRP 55 HD1 TRP 55 -5.015 -7.315 -3.648 388 HE1 TRP 55 HE1 TRP 55 -5.070 -6.099 -5.924 389 HE3 TRP 55 HE3 TRP 55 -2.355 -3.147 -2.394 390 HZ2 TRP 55 HZ2 TRP 55 -4.106 -3.683 -7.026 391 HZ3 TRP 55 HZ3 TRP 55 -1.967 -1.433 -4.101 392 HH2 TRP 55 HH2 TRP 55 -2.820 -1.688 -6.376 393 H PHE 56 HN PHE 56 -3.484 -8.272 0.368 394 HA PHE 56 HA PHE 56 -3.695 -10.639 -1.382 395 HB2 PHE 56 HB2 PHE 56 -3.629 -10.503 1.647 396 HB3 PHE 56 HB1 PHE 56 -3.732 -11.967 0.684 397 HD1 PHE 56 HD1 PHE 56 -1.790 -13.131 0.191 398 HD2 PHE 56 HD2 PHE 56 -1.539 -9.004 1.203 399 HE1 PHE 56 HE1 PHE 56 0.666 -13.272 0.148 400 HE2 PHE 56 HE2 PHE 56 0.916 -9.143 1.162 401 HZ PHE 56 HZ PHE 56 2.020 -11.319 0.696 402 H LYS 57 HN LYS 57 -5.735 -11.051 -2.027 403 HA LYS 57 HA LYS 57 -7.889 -9.478 -0.918 404 HB2 LYS 57 HB2 LYS 57 -7.979 -11.543 -3.121 405 HB3 LYS 57 HB1 LYS 57 -9.218 -10.354 -2.747 406 HG2 LYS 57 HG2 LYS 57 -7.877 -8.567 -3.491 407 HG3 LYS 57 HG1 LYS 57 -6.434 -9.582 -3.558 408 HD2 LYS 57 HD2 LYS 57 -7.602 -10.951 -5.313 409 HD3 LYS 57 HD1 LYS 57 -8.866 -9.720 -5.332 410 HE2 LYS 57 HE2 LYS 57 -7.231 -8.034 -5.982 411 HE3 LYS 57 HE1 LYS 57 -5.943 -9.237 -5.911 412 HZ1 LYS 57 HZ1 LYS 57 -6.739 -8.825 -8.180 413 HZ2 LYS 57 HZ2 LYS 57 -8.278 -9.366 -7.742 414 HZ3 LYS 57 HZ3 LYS 57 -6.969 -10.432 -7.708 415 H GLY 58 HN GLY 58 -9.167 -10.117 0.682 416 HA2 GLY 58 HA2 GLY 58 -10.539 -11.492 1.934 417 HA3 GLY 58 HA1 GLY 58 -10.174 -12.811 0.828 418 H LYS 59 HN LYS 59 -8.766 -14.330 1.434 419 HA LYS 59 HA LYS 59 -7.449 -14.044 4.016 420 HB2 LYS 59 HB2 LYS 59 -7.741 -16.390 2.133 421 HB3 LYS 59 HB1 LYS 59 -6.825 -16.452 3.632 422 HG2 LYS 59 HG2 LYS 59 -8.814 -16.018 4.918 423 HG3 LYS 59 HG1 LYS 59 -9.756 -15.795 3.443 424 HD2 LYS 59 HD2 LYS 59 -10.138 -18.009 4.388 425 HD3 LYS 59 HD1 LYS 59 -9.334 -18.123 2.823 426 HE2 LYS 59 HE2 LYS 59 -7.184 -18.437 3.953 427 HE3 LYS 59 HE1 LYS 59 -7.990 -18.326 5.516 428 HZ1 LYS 59 HZ1 LYS 59 -7.589 -20.622 4.846 429 HZ2 LYS 59 HZ2 LYS 59 -8.524 -20.397 3.458 430 HZ3 LYS 59 HZ3 LYS 59 -9.245 -20.307 4.984 431 H SER 60 HN SER 60 -5.209 -14.272 4.284 432 HA SER 60 HA SER 60 -3.698 -13.090 2.165 433 HB2 SER 60 HB2 SER 60 -2.814 -14.136 4.860 434 HB3 SER 60 HB1 SER 60 -1.836 -13.146 3.774 435 HG SER 60 HG SER 60 -4.257 -12.016 4.210 436 H THR 61 HN THR 61 -3.385 -14.418 0.458 437 HA THR 61 HA THR 61 -2.772 -17.154 0.557 438 HB THR 61 HB THR 61 -1.912 -15.191 -1.585 439 HG1 THR 61 HG1 THR 61 -4.398 -16.343 -0.933 440 HG21 THR 61 HG21 THR 61 -2.061 -17.131 -3.070 441 HG22 THR 61 HG22 THR 61 -2.519 -18.151 -1.706 442 HG23 THR 61 HG23 THR 61 -0.911 -17.430 -1.767 443 H ALA 62 HN ALA 62 -1.130 -17.857 1.782 444 HA ALA 62 HA ALA 62 1.180 -16.170 2.160 445 HB1 ALA 62 HB1 ALA 62 0.103 -18.591 3.516 446 HB2 ALA 62 HB2 ALA 62 0.495 -16.995 4.175 447 HB3 ALA 62 HB3 ALA 62 1.785 -18.124 3.756 448 H GLY 63 HN GLY 63 2.165 -16.288 0.167 449 HA2 GLY 63 HA2 GLY 63 2.946 -18.612 -1.175 450 HA3 GLY 63 HA1 GLY 63 3.701 -17.041 -1.341 451 H ALA 64 HN ALA 64 4.424 -20.056 -0.857 452 HA ALA 64 HA ALA 64 6.169 -21.227 -0.011 453 HB1 ALA 64 HB1 ALA 64 7.428 -19.540 -1.257 454 HB2 ALA 64 HB2 ALA 64 8.294 -20.079 0.182 455 HB3 ALA 64 HB3 ALA 64 7.471 -18.519 0.180 456 H GLN 65 HN GLN 65 4.148 -20.140 1.857 457 HA GLN 65 HA GLN 65 3.685 -20.504 4.046 458 HB2 GLN 65 HB2 GLN 65 6.568 -21.372 4.276 459 HB3 GLN 65 HB1 GLN 65 5.328 -21.605 5.503 460 HG2 GLN 65 HG2 GLN 65 4.105 -23.088 4.089 461 HG3 GLN 65 HG1 GLN 65 5.156 -22.725 2.719 462 HE21 GLN 65 HE21 GLN 65 7.196 -23.617 2.629 463 HE22 GLN 65 HE22 GLN 65 7.674 -24.940 3.634 464 H ASP 66 HN ASP 66 6.718 -18.776 3.448 465 HA ASP 66 HA ASP 66 6.493 -17.172 5.824 466 HB2 ASP 66 HB2 ASP 66 8.240 -16.939 3.372 467 HB3 ASP 66 HB1 ASP 66 8.310 -15.801 4.711 468 H ARG 67 HN ARG 67 4.790 -17.275 3.079 469 HA ARG 67 HA ARG 67 3.003 -16.120 2.393 470 HB2 ARG 67 HB2 ARG 67 3.404 -13.944 4.413 471 HB3 ARG 67 HB1 ARG 67 1.910 -14.626 3.780 472 HG2 ARG 67 HG2 ARG 67 2.498 -16.745 5.023 473 HG3 ARG 67 HG1 ARG 67 3.754 -15.811 5.829 474 HD2 ARG 67 HD2 ARG 67 0.827 -15.099 5.818 475 HD3 ARG 67 HD1 ARG 67 1.639 -15.968 7.116 476 HE ARG 67 HE ARG 67 3.114 -13.721 6.885 477 HH11 ARG 67 HH11 ARG 67 -0.333 -14.266 7.188 478 HH12 ARG 67 HH12 ARG 67 -0.614 -12.798 8.069 479 HH21 ARG 67 HH21 ARG 67 2.745 -11.796 8.043 480 HH22 ARG 67 HH22 ARG 67 1.134 -11.393 8.552 481 H LYS 68 HN LYS 68 4.740 -15.783 0.635 482 HA LYS 68 HA LYS 68 4.852 -12.872 0.133 483 HB2 LYS 68 HB2 LYS 68 6.836 -14.893 -0.910 484 HB3 LYS 68 HB1 LYS 68 6.876 -13.160 -1.170 485 HG2 LYS 68 HG2 LYS 68 8.448 -13.385 0.466 486 HG3 LYS 68 HG1 LYS 68 7.011 -13.074 1.440 487 HD2 LYS 68 HD2 LYS 68 8.254 -14.908 2.402 488 HD3 LYS 68 HD1 LYS 68 6.731 -15.509 1.747 489 HE2 LYS 68 HE2 LYS 68 8.578 -17.014 1.219 490 HE3 LYS 68 HE1 LYS 68 7.889 -16.316 -0.241 491 HZ1 LYS 68 HZ1 LYS 68 9.724 -14.786 -0.373 492 HZ2 LYS 68 HZ2 LYS 68 10.325 -16.359 -0.261 493 HZ3 LYS 68 HZ3 LYS 68 10.361 -15.346 1.092 494 H LYS 69 HN LYS 69 2.597 -14.099 -0.647 495 HA LYS 69 HA LYS 69 2.898 -14.056 -3.546 496 HB2 LYS 69 HB2 LYS 69 2.892 -16.411 -2.936 497 HB3 LYS 69 HB1 LYS 69 1.392 -16.210 -2.052 498 HG2 LYS 69 HG2 LYS 69 0.217 -15.719 -4.111 499 HG3 LYS 69 HG1 LYS 69 1.729 -15.812 -5.019 500 HD2 LYS 69 HD2 LYS 69 0.554 -18.087 -3.423 501 HD3 LYS 69 HD1 LYS 69 0.336 -17.875 -5.162 502 HE2 LYS 69 HE2 LYS 69 2.785 -17.969 -5.446 503 HE3 LYS 69 HE1 LYS 69 2.953 -18.256 -3.716 504 HZ1 LYS 69 HZ1 LYS 69 1.535 -20.017 -5.635 505 HZ2 LYS 69 HZ2 LYS 69 1.671 -20.291 -3.972 506 HZ3 LYS 69 HZ3 LYS 69 3.050 -20.316 -4.947 507 HA PRO 70 HA PRO 70 -0.543 -11.342 -2.062 508 HB2 PRO 70 HB2 PRO 70 0.609 -9.540 -4.083 509 HB3 PRO 70 HB1 PRO 70 0.249 -9.232 -2.381 510 HG2 PRO 70 HG2 PRO 70 2.771 -9.444 -3.251 511 HG3 PRO 70 HG1 PRO 70 2.285 -10.061 -1.662 512 HD2 PRO 70 HD2 PRO 70 2.696 -11.560 -4.226 513 HD3 PRO 70 HD1 PRO 70 3.235 -11.976 -2.583 514 H SER 71 HN SER 71 -2.391 -10.691 -3.219 515 HA SER 71 HA SER 71 -2.806 -12.288 -5.624 516 HB2 SER 71 HB2 SER 71 -4.349 -12.513 -3.686 517 HB3 SER 71 HB1 SER 71 -4.808 -10.826 -3.885 518 HG SER 71 HG SER 71 -5.033 -12.582 -6.064 519 H GLY 72 HN GLY 72 -1.822 -9.253 -4.961 520 HA2 GLY 72 HA2 GLY 72 -2.092 -8.319 -7.579 521 HA3 GLY 72 HA1 GLY 72 -3.389 -7.614 -6.623 522 H GLY 73 HN GLY 73 -1.688 -5.881 -7.707 523 HA2 GLY 73 HA2 GLY 73 -0.877 -4.214 -5.753 524 HA3 GLY 73 HA1 GLY 73 0.498 -5.295 -5.918 525 H PHE 74 HN PHE 74 1.316 -2.969 -6.394 526 HA PHE 74 HA PHE 74 1.819 -2.810 -9.208 527 HB2 PHE 74 HB2 PHE 74 0.877 -0.630 -9.649 528 HB3 PHE 74 HB1 PHE 74 -0.400 -1.686 -9.075 529 HD1 PHE 74 HD1 PHE 74 -0.393 -1.567 -6.247 530 HD2 PHE 74 HD2 PHE 74 0.578 1.518 -9.006 531 HE1 PHE 74 HE1 PHE 74 -1.011 0.129 -4.572 532 HE2 PHE 74 HE2 PHE 74 -0.038 3.209 -7.344 533 HZ PHE 74 HZ PHE 74 -0.831 2.518 -5.118 534 HA PRO 75 HA PRO 75 5.540 -0.997 -7.771 535 HB2 PRO 75 HB2 PRO 75 5.644 0.869 -10.021 536 HB3 PRO 75 HB1 PRO 75 6.675 -0.518 -9.675 537 HG2 PRO 75 HG2 PRO 75 4.914 -0.526 -11.710 538 HG3 PRO 75 HG1 PRO 75 5.294 -1.992 -10.786 539 HD2 PRO 75 HD2 PRO 75 2.929 -0.163 -10.554 540 HD3 PRO 75 HD1 PRO 75 2.987 -1.936 -10.534 541 H VAL 76 HN VAL 76 6.157 0.502 -6.399 542 HA VAL 76 HA VAL 76 4.422 2.551 -5.545 543 HB VAL 76 HB VAL 76 7.338 2.041 -4.950 544 HG11 VAL 76 HG11 VAL 76 5.443 3.894 -3.519 545 HG12 VAL 76 HG12 VAL 76 6.759 4.400 -4.579 546 HG13 VAL 76 HG13 VAL 76 7.115 3.551 -3.075 547 HG21 VAL 76 HG21 VAL 76 4.858 1.485 -3.331 548 HG22 VAL 76 HG22 VAL 76 6.518 1.098 -2.876 549 HG23 VAL 76 HG23 VAL 76 5.767 0.286 -4.250 550 H ASP 77 HN ASP 77 7.226 2.517 -7.630 551 HA ASP 77 HA ASP 77 7.628 5.315 -7.789 552 HB2 ASP 77 HB2 ASP 77 9.334 3.653 -8.385 553 HB3 ASP 77 HB1 ASP 77 8.342 3.112 -9.729 554 H LYS 78 HN LYS 78 5.171 3.354 -8.972 555 HA LYS 78 HA LYS 78 4.645 5.070 -11.288 556 HB2 LYS 78 HB2 LYS 78 3.989 2.240 -10.622 557 HB3 LYS 78 HB1 LYS 78 2.903 3.117 -11.688 558 HG2 LYS 78 HG2 LYS 78 4.576 1.802 -12.908 559 HG3 LYS 78 HG1 LYS 78 4.693 3.528 -13.251 560 HD2 LYS 78 HD2 LYS 78 6.520 3.612 -11.503 561 HD3 LYS 78 HD1 LYS 78 6.492 1.847 -11.527 562 HE2 LYS 78 HE2 LYS 78 7.066 1.818 -13.863 563 HE3 LYS 78 HE1 LYS 78 6.932 3.573 -13.960 564 HZ1 LYS 78 HZ1 LYS 78 9.225 2.953 -13.813 565 HZ2 LYS 78 HZ2 LYS 78 8.951 2.034 -12.425 566 HZ3 LYS 78 HZ3 LYS 78 8.790 3.722 -12.364 567 H ILE 79 HN ILE 79 3.643 4.692 -8.110 568 HA ILE 79 HA ILE 79 0.875 5.204 -8.330 569 HB ILE 79 HB ILE 79 2.575 6.311 -6.108 570 HG12 ILE 79 HG12 ILE 79 1.573 3.467 -6.388 571 HG13 ILE 79 HG11 ILE 79 3.256 3.977 -6.409 572 HG21 ILE 79 HG21 ILE 79 0.546 5.870 -4.785 573 HG22 ILE 79 HG22 ILE 79 -0.253 5.279 -6.242 574 HG23 ILE 79 HG23 ILE 79 0.245 6.966 -6.133 575 HD11 ILE 79 HD11 ILE 79 1.346 4.121 -4.094 576 HD12 ILE 79 HD12 ILE 79 2.968 4.814 -4.094 577 HD13 ILE 79 HD13 ILE 79 2.754 3.069 -4.260 578 H THR 80 HN THR 80 -0.041 6.935 -9.269 579 HA THR 80 HA THR 80 1.595 9.230 -9.848 580 HB THR 80 HB THR 80 0.113 8.367 -11.579 581 HG1 THR 80 HG1 THR 80 0.502 10.483 -11.909 582 HG21 THR 80 HG21 THR 80 -2.308 8.710 -11.455 583 HG22 THR 80 HG22 THR 80 -2.143 9.264 -9.789 584 HG23 THR 80 HG23 THR 80 -1.750 7.595 -10.208 585 H SER 81 HN SER 81 -1.151 8.469 -7.755 586 HA SER 81 HA SER 81 -0.605 10.888 -6.251 587 HB2 SER 81 HB2 SER 81 -3.278 10.412 -7.580 588 HB3 SER 81 HB1 SER 81 -3.000 11.623 -6.329 589 HG SER 81 HG SER 81 -1.186 11.777 -8.367 590 H VAL 82 HN VAL 82 -0.810 10.517 -4.152 591 HA VAL 82 HA VAL 82 -2.712 8.454 -3.254 592 HB VAL 82 HB VAL 82 -0.163 9.397 -1.915 593 HG11 VAL 82 HG11 VAL 82 -2.276 7.532 -0.836 594 HG12 VAL 82 HG12 VAL 82 -1.917 9.151 -0.236 595 HG13 VAL 82 HG13 VAL 82 -0.717 7.870 -0.082 596 HG21 VAL 82 HG21 VAL 82 0.441 7.011 -2.042 597 HG22 VAL 82 HG22 VAL 82 0.206 7.740 -3.631 598 HG23 VAL 82 HG23 VAL 82 -1.046 6.705 -2.941 599 H LYS 83 HN LYS 83 -4.501 9.453 -2.705 600 HA LYS 83 HA LYS 83 -4.333 12.003 -1.263 601 HB2 LYS 83 HB2 LYS 83 -6.581 12.055 -3.007 602 HB3 LYS 83 HB1 LYS 83 -5.167 13.100 -3.031 603 HG2 LYS 83 HG2 LYS 83 -4.329 12.110 -4.842 604 HG3 LYS 83 HG1 LYS 83 -4.656 10.494 -4.217 605 HD2 LYS 83 HD2 LYS 83 -7.100 10.998 -4.790 606 HD3 LYS 83 HD1 LYS 83 -6.445 12.309 -5.775 607 HE2 LYS 83 HE2 LYS 83 -5.045 10.668 -6.959 608 HE3 LYS 83 HE1 LYS 83 -5.801 9.380 -6.024 609 HZ1 LYS 83 HZ1 LYS 83 -7.956 10.123 -6.972 610 HZ2 LYS 83 HZ2 LYS 83 -6.875 9.514 -8.123 611 HZ3 LYS 83 HZ3 LYS 83 -7.109 11.182 -7.981 612 H SER 84 HN SER 84 -6.442 12.588 -0.295 613 HA SER 84 HA SER 84 -8.019 10.205 0.362 614 HB2 SER 84 HB2 SER 84 -8.576 11.347 2.489 615 HB3 SER 84 HB1 SER 84 -6.844 11.082 2.314 616 HG SER 84 HG SER 84 -8.015 13.356 2.816 617 H GLN 85 HN GLN 85 -10.290 10.534 0.593 618 HA GLN 85 HA GLN 85 -11.468 11.960 -1.505 619 HB2 GLN 85 HB2 GLN 85 -12.268 10.216 0.628 620 HB3 GLN 85 HB1 GLN 85 -13.450 11.500 0.414 621 HG2 GLN 85 HG2 GLN 85 -14.123 9.664 -0.904 622 HG3 GLN 85 HG1 GLN 85 -13.531 10.910 -1.999 623 HE21 GLN 85 HE21 GLN 85 -11.502 8.806 -0.066 624 HE22 GLN 85 HE22 GLN 85 -10.839 7.917 -1.390 625 H ALA 86 HN ALA 86 -13.564 13.385 -0.911 626 HA ALA 86 HA ALA 86 -12.541 15.865 -0.033 627 HB1 ALA 86 HB1 ALA 86 -15.428 15.053 -0.346 628 HB2 ALA 86 HB2 ALA 86 -14.391 15.655 -1.638 629 HB3 ALA 86 HB3 ALA 86 -14.807 16.702 -0.279 630 H ASP 87 HN ASP 87 -14.750 13.550 1.519 631 HA ASP 87 HA ASP 87 -14.392 14.985 4.065 632 HB2 ASP 87 HB2 ASP 87 -16.691 14.579 3.625 633 HB3 ASP 87 HB1 ASP 87 -16.381 12.934 3.086 634 H ASN 88 HN ASN 88 -13.773 12.049 2.391 635 HA ASN 88 HA ASN 88 -12.711 10.098 2.921 636 HB2 ASN 88 HB2 ASN 88 -10.356 10.460 3.113 637 HB3 ASN 88 HB1 ASN 88 -11.045 11.681 2.056 638 HD21 ASN 88 HD21 ASN 88 -11.138 13.836 2.776 639 HD22 ASN 88 HD22 ASN 88 -10.169 14.395 4.097 640 H THR 89 HN THR 89 -14.336 10.533 5.207 641 HA THR 89 HA THR 89 -12.991 10.520 7.630 642 HB THR 89 HB THR 89 -15.500 9.016 6.866 643 HG1 THR 89 HG1 THR 89 -15.694 11.285 6.763 644 HG21 THR 89 HG21 THR 89 -15.959 8.849 9.268 645 HG22 THR 89 HG22 THR 89 -14.385 9.559 9.621 646 HG23 THR 89 HG23 THR 89 -14.485 7.980 8.841 647 H LYS 90 HN LYS 90 -14.160 7.516 6.043 648 HA LYS 90 HA LYS 90 -11.627 6.320 6.907 649 HB2 LYS 90 HB2 LYS 90 -12.748 4.117 6.799 650 HB3 LYS 90 HB1 LYS 90 -13.417 5.206 8.008 651 HG2 LYS 90 HG2 LYS 90 -15.330 5.665 6.664 652 HG3 LYS 90 HG1 LYS 90 -14.635 4.808 5.286 653 HD2 LYS 90 HD2 LYS 90 -16.363 3.502 6.510 654 HD3 LYS 90 HD1 LYS 90 -14.789 2.708 6.441 655 HE2 LYS 90 HE2 LYS 90 -15.715 2.472 8.655 656 HE3 LYS 90 HE1 LYS 90 -14.303 3.530 8.717 657 HZ1 LYS 90 HZ1 LYS 90 -16.110 4.400 10.049 658 HZ2 LYS 90 HZ2 LYS 90 -17.143 4.406 8.711 659 HZ3 LYS 90 HZ3 LYS 90 -15.804 5.435 8.750 660 H VAL 91 HN VAL 91 -12.466 7.770 4.318 661 HA VAL 91 HA VAL 91 -12.120 5.538 2.428 662 HB VAL 91 HB VAL 91 -13.214 8.243 1.711 663 HG11 VAL 91 HG11 VAL 91 -14.231 7.010 -0.143 664 HG12 VAL 91 HG12 VAL 91 -13.513 5.514 0.453 665 HG13 VAL 91 HG13 VAL 91 -12.478 6.819 -0.130 666 HG21 VAL 91 HG21 VAL 91 -14.595 7.354 3.517 667 HG22 VAL 91 HG22 VAL 91 -14.785 5.836 2.638 668 HG23 VAL 91 HG23 VAL 91 -15.468 7.326 1.985 669 H LEU 92 HN LEU 92 -10.100 5.380 1.741 670 HA LEU 92 HA LEU 92 -8.527 7.786 1.140 671 HB2 LEU 92 HB2 LEU 92 -7.879 4.898 1.571 672 HB3 LEU 92 HB1 LEU 92 -6.796 5.875 0.603 673 HG LEU 92 HG LEU 92 -6.302 7.305 2.450 674 HD11 LEU 92 HD11 LEU 92 -7.274 6.949 4.676 675 HD12 LEU 92 HD12 LEU 92 -8.390 5.772 3.982 676 HD13 LEU 92 HD13 LEU 92 -8.471 7.465 3.489 677 HD21 LEU 92 HD21 LEU 92 -6.270 4.408 3.274 678 HD22 LEU 92 HD22 LEU 92 -5.326 5.692 4.032 679 HD23 LEU 92 HD23 LEU 92 -5.031 5.259 2.349 680 H VAL 93 HN VAL 93 -7.608 8.094 -0.966 681 HA VAL 93 HA VAL 93 -8.647 6.327 -3.057 682 HB VAL 93 HB VAL 93 -10.168 8.122 -3.184 683 HG11 VAL 93 HG11 VAL 93 -7.806 9.953 -2.933 684 HG12 VAL 93 HG12 VAL 93 -9.176 9.778 -1.828 685 HG13 VAL 93 HG13 VAL 93 -9.410 10.494 -3.424 686 HG21 VAL 93 HG21 VAL 93 -9.710 9.146 -5.355 687 HG22 VAL 93 HG22 VAL 93 -9.322 7.427 -5.352 688 HG23 VAL 93 HG23 VAL 93 -8.030 8.623 -5.245 689 H ILE 94 HN ILE 94 -6.962 5.438 -3.975 690 HA ILE 94 HA ILE 94 -4.556 7.079 -4.456 691 HB ILE 94 HB ILE 94 -4.824 4.181 -3.687 692 HG12 ILE 94 HG12 ILE 94 -2.933 4.854 -2.126 693 HG13 ILE 94 HG11 ILE 94 -3.227 6.513 -2.628 694 HG21 ILE 94 HG21 ILE 94 -2.468 3.826 -4.215 695 HG22 ILE 94 HG22 ILE 94 -2.377 5.444 -4.912 696 HG23 ILE 94 HG23 ILE 94 -3.401 4.216 -5.662 697 HD11 ILE 94 HD11 ILE 94 -4.290 5.927 -0.489 698 HD12 ILE 94 HD12 ILE 94 -5.276 4.735 -1.338 699 HD13 ILE 94 HD13 ILE 94 -5.443 6.448 -1.716 700 H THR 95 HN THR 95 -3.869 7.244 -6.513 701 HA THR 95 HA THR 95 -5.032 5.399 -8.500 702 HB THR 95 HB THR 95 -4.372 8.310 -8.992 703 HG1 THR 95 HG1 THR 95 -6.992 7.210 -8.835 704 HG21 THR 95 HG21 THR 95 -5.669 7.970 -11.054 705 HG22 THR 95 HG22 THR 95 -5.890 6.273 -10.635 706 HG23 THR 95 HG23 THR 95 -4.277 6.892 -10.986 707 H VAL 96 HN VAL 96 -3.656 4.714 -10.154 708 HA VAL 96 HA VAL 96 -0.825 5.389 -9.788 709 HB VAL 96 HB VAL 96 -1.008 3.172 -9.078 710 HG11 VAL 96 HG11 VAL 96 -2.701 2.571 -11.493 711 HG12 VAL 96 HG12 VAL 96 -3.295 2.783 -9.847 712 HG13 VAL 96 HG13 VAL 96 -2.233 1.429 -10.230 713 HG21 VAL 96 HG21 VAL 96 0.830 3.377 -10.590 714 HG22 VAL 96 HG22 VAL 96 -0.231 3.154 -11.980 715 HG23 VAL 96 HG23 VAL 96 0.060 1.813 -10.872 716 H ASN 97 HN ASN 97 0.469 5.665 -11.604 717 HA ASN 97 HA ASN 97 -0.941 5.775 -14.188 718 HB2 ASN 97 HB2 ASN 97 -0.502 8.043 -13.292 719 HB3 ASN 97 HB1 ASN 97 1.219 7.671 -13.246 720 HD21 ASN 97 HD21 ASN 97 -1.501 8.435 -15.228 721 HD22 ASN 97 HD22 ASN 97 -0.621 8.716 -16.691 722 H ASN 98 HN ASN 98 0.149 5.079 -15.964 723 HA ASN 98 HA ASN 98 1.871 4.292 -17.265 724 HB2 ASN 98 HB2 ASN 98 3.697 5.023 -15.880 725 HB3 ASN 98 HB1 ASN 98 3.398 3.742 -14.722 726 HD21 ASN 98 HD21 ASN 98 3.987 1.617 -15.250 727 HD22 ASN 98 HD22 ASN 98 5.059 1.263 -16.559 728 HA PRO 99 HA PRO 99 0.876 -0.258 -15.841 729 HB2 PRO 99 HB2 PRO 99 -0.418 0.302 -13.227 730 HB3 PRO 99 HB1 PRO 99 0.584 -1.071 -13.712 731 HG2 PRO 99 HG2 PRO 99 1.548 0.808 -12.099 732 HG3 PRO 99 HG1 PRO 99 2.561 0.079 -13.359 733 HD2 PRO 99 HD2 PRO 99 1.194 2.740 -13.330 734 HD3 PRO 99 HD1 PRO 99 2.806 2.299 -13.922 735 H GLN 100 HN GLN 100 -1.401 -1.205 -15.635 736 HA GLN 100 HA GLN 100 -3.175 0.352 -17.156 737 HB2 GLN 100 HB2 GLN 100 -3.753 -2.091 -15.465 738 HB3 GLN 100 HB1 GLN 100 -4.822 -1.435 -16.695 739 HG2 GLN 100 HG2 GLN 100 -3.224 -1.926 -18.422 740 HG3 GLN 100 HG1 GLN 100 -2.043 -2.453 -17.226 741 HE21 GLN 100 HE21 GLN 100 -3.184 -3.901 -19.473 742 HE22 GLN 100 HE22 GLN 100 -3.931 -5.317 -18.810 743 HA PRO 101 HA PRO 101 -4.170 3.299 -14.000 744 HB2 PRO 101 HB2 PRO 101 -6.525 3.656 -15.804 745 HB3 PRO 101 HB1 PRO 101 -5.455 4.872 -15.095 746 HG2 PRO 101 HG2 PRO 101 -5.186 4.164 -17.642 747 HG3 PRO 101 HG1 PRO 101 -3.762 4.470 -16.630 748 HD2 PRO 101 HD2 PRO 101 -4.884 1.887 -17.588 749 HD3 PRO 101 HD1 PRO 101 -3.199 2.343 -17.272 750 H THR 102 HN THR 102 -4.880 2.568 -12.142 751 HA THR 102 HA THR 102 -7.702 1.847 -11.912 752 HB THR 102 HB THR 102 -5.550 0.313 -10.442 753 HG1 THR 102 HG1 THR 102 -5.553 -0.040 -12.794 754 HG21 THR 102 HG21 THR 102 -8.489 -0.223 -10.884 755 HG22 THR 102 HG22 THR 102 -7.763 0.366 -9.389 756 HG23 THR 102 HG23 THR 102 -7.377 -1.252 -9.982 757 H THR 103 HN THR 103 -8.654 2.697 -10.101 758 HA THR 103 HA THR 103 -6.884 4.148 -8.251 759 HB THR 103 HB THR 103 -9.789 4.674 -8.903 760 HG1 THR 103 HG1 THR 103 -8.284 5.305 -10.548 761 HG21 THR 103 HG21 THR 103 -9.281 5.250 -6.589 762 HG22 THR 103 HG22 THR 103 -9.512 6.708 -7.553 763 HG23 THR 103 HG23 THR 103 -7.885 6.187 -7.118 764 H TYR 104 HN TYR 104 -6.723 3.355 -6.288 765 HA TYR 104 HA TYR 104 -8.636 1.290 -5.451 766 HB2 TYR 104 HB2 TYR 104 -5.842 1.841 -4.429 767 HB3 TYR 104 HB1 TYR 104 -6.862 0.472 -3.994 768 HD1 TYR 104 HD1 TYR 104 -7.486 -1.187 -5.789 769 HD2 TYR 104 HD2 TYR 104 -4.471 1.766 -6.340 770 HE1 TYR 104 HE1 TYR 104 -6.565 -2.472 -7.687 771 HE2 TYR 104 HE2 TYR 104 -3.550 0.494 -8.231 772 HH TYR 104 HH TYR 104 -5.214 -2.033 -9.723 773 H ASN 105 HN ASN 105 -9.996 1.729 -3.859 774 HA ASN 105 HA ASN 105 -9.392 3.999 -2.110 775 HB2 ASN 105 HB2 ASN 105 -12.037 2.673 -2.739 776 HB3 ASN 105 HB1 ASN 105 -11.817 3.921 -1.509 777 HD21 ASN 105 HD21 ASN 105 -11.615 3.239 -4.927 778 HD22 ASN 105 HD22 ASN 105 -11.719 4.876 -5.448 779 H PHE 106 HN PHE 106 -8.383 3.391 -0.419 780 HA PHE 106 HA PHE 106 -8.813 0.774 0.767 781 HB2 PHE 106 HB2 PHE 106 -6.992 3.037 1.636 782 HB3 PHE 106 HB1 PHE 106 -7.012 1.424 2.338 783 HD1 PHE 106 HD1 PHE 106 -6.718 -0.510 0.500 784 HD2 PHE 106 HD2 PHE 106 -5.361 3.497 0.118 785 HE1 PHE 106 HE1 PHE 106 -5.040 -1.242 -1.136 786 HE2 PHE 106 HE2 PHE 106 -3.683 2.778 -1.532 787 HZ PHE 106 HZ PHE 106 -3.521 0.402 -2.161 788 H THR 107 HN THR 107 -10.471 0.499 2.081 789 HA THR 107 HA THR 107 -11.272 2.734 3.834 790 HB THR 107 HB THR 107 -13.089 0.563 2.778 791 HG1 THR 107 HG1 THR 107 -12.141 2.055 1.151 792 HG21 THR 107 HG21 THR 107 -14.873 2.107 3.449 793 HG22 THR 107 HG22 THR 107 -13.666 3.244 4.048 794 HG23 THR 107 HG23 THR 107 -13.856 1.673 4.824 795 H PHE 108 HN PHE 108 -11.403 2.308 5.997 796 HA PHE 108 HA PHE 108 -11.688 -0.463 6.874 797 HB2 PHE 108 HB2 PHE 108 -9.187 0.509 6.956 798 HB3 PHE 108 HB1 PHE 108 -9.799 1.227 8.438 799 HD1 PHE 108 HD1 PHE 108 -8.928 0.072 10.219 800 HD2 PHE 108 HD2 PHE 108 -10.466 -2.092 6.897 801 HE1 PHE 108 HE1 PHE 108 -8.542 -2.038 11.421 802 HE2 PHE 108 HE2 PHE 108 -10.091 -4.206 8.097 803 HZ PHE 108 HZ PHE 108 -9.223 -4.181 10.392 804 H LYS 109 HN LYS 109 -12.422 -0.599 9.133 805 HA LYS 109 HA LYS 109 -14.435 1.311 9.690 806 HB2 LYS 109 HB2 LYS 109 -14.501 -1.116 10.308 807 HB3 LYS 109 HB1 LYS 109 -13.302 -0.789 11.546 808 HG2 LYS 109 HG2 LYS 109 -15.756 0.854 11.613 809 HG3 LYS 109 HG1 LYS 109 -15.925 -0.853 12.027 810 HD2 LYS 109 HD2 LYS 109 -14.167 -0.603 13.721 811 HD3 LYS 109 HD1 LYS 109 -14.018 1.106 13.308 812 HE2 LYS 109 HE2 LYS 109 -16.266 1.535 14.042 813 HE3 LYS 109 HE1 LYS 109 -16.560 -0.185 14.286 814 HZ1 LYS 109 HZ1 LYS 109 -16.109 0.983 16.367 815 HZ2 LYS 109 HZ2 LYS 109 -14.582 1.436 15.796 816 HZ3 LYS 109 HZ3 LYS 109 -14.939 -0.195 16.054 817 H SER 110 HN SER 110 -11.191 0.797 10.895 818 HA SER 110 HA SER 110 -11.336 2.731 12.996 819 HB2 SER 110 HB2 SER 110 -9.761 0.855 13.095 820 HB3 SER 110 HB1 SER 110 -8.982 1.432 11.626 821 HG SER 110 HG SER 110 -8.728 2.314 14.224 822 HA PRO 111 HA PRO 111 -10.760 6.233 10.199 823 HB2 PRO 111 HB2 PRO 111 -10.749 8.128 12.154 824 HB3 PRO 111 HB1 PRO 111 -12.227 7.415 11.502 825 HG2 PRO 111 HG2 PRO 111 -10.753 6.750 14.020 826 HG3 PRO 111 HG1 PRO 111 -12.498 6.911 13.754 827 HD2 PRO 111 HD2 PRO 111 -11.269 4.512 13.876 828 HD3 PRO 111 HD1 PRO 111 -12.681 4.798 12.842 829 H GLY 112 HN GLY 112 -8.849 5.409 13.021 830 HA2 GLY 112 HA2 GLY 112 -6.700 7.217 12.415 831 HA3 GLY 112 HA1 GLY 112 -6.664 5.906 13.587 832 H GLU 113 HN GLU 113 -7.511 3.900 11.668 833 HA GLU 113 HA GLU 113 -5.024 3.024 10.718 834 HB2 GLU 113 HB2 GLU 113 -7.192 1.683 11.134 835 HB3 GLU 113 HB1 GLU 113 -7.659 2.193 9.518 836 HG2 GLU 113 HG2 GLU 113 -6.658 -0.039 9.561 837 HG3 GLU 113 HG1 GLU 113 -5.732 1.095 8.573 838 H ARG 114 HN ARG 114 -7.695 4.661 9.148 839 HA ARG 114 HA ARG 114 -6.808 4.713 6.514 840 HB2 ARG 114 HB2 ARG 114 -7.990 7.267 7.362 841 HB3 ARG 114 HB1 ARG 114 -8.500 6.160 6.105 842 HG2 ARG 114 HG2 ARG 114 -9.093 5.674 9.007 843 HG3 ARG 114 HG1 ARG 114 -10.132 6.625 7.964 844 HD2 ARG 114 HD2 ARG 114 -10.836 4.262 8.184 845 HD3 ARG 114 HD1 ARG 114 -10.514 4.753 6.520 846 HE ARG 114 HE ARG 114 -8.822 3.057 8.185 847 HH11 ARG 114 HH11 ARG 114 -9.775 4.300 5.081 848 HH12 ARG 114 HH12 ARG 114 -8.721 3.266 4.174 849 HH21 ARG 114 HH21 ARG 114 -7.379 1.678 7.006 850 HH22 ARG 114 HH22 ARG 114 -7.351 1.767 5.277 851 H GLU 115 HN GLU 115 -6.265 6.961 9.128 852 HA GLU 115 HA GLU 115 -4.763 8.816 7.616 853 HB2 GLU 115 HB2 GLU 115 -4.966 8.364 10.586 854 HB3 GLU 115 HB1 GLU 115 -4.081 9.703 9.868 855 HG2 GLU 115 HG2 GLU 115 -6.145 10.482 8.805 856 HG3 GLU 115 HG1 GLU 115 -7.024 9.154 9.565 857 H SER 116 HN SER 116 -3.783 6.239 9.839 858 HA SER 116 HA SER 116 -1.037 6.717 9.777 859 HB2 SER 116 HB2 SER 116 -2.384 4.010 9.987 860 HB3 SER 116 HB1 SER 116 -0.761 4.425 10.536 861 HG SER 116 HG SER 116 -2.595 6.114 11.590 862 H TRP 117 HN TRP 117 -3.074 4.841 7.564 863 HA TRP 117 HA TRP 117 -0.854 3.766 6.118 864 HB2 TRP 117 HB2 TRP 117 -3.447 3.056 6.302 865 HB3 TRP 117 HB1 TRP 117 -3.494 3.944 4.783 866 HD1 TRP 117 HD1 TRP 117 -2.234 0.732 6.335 867 HE1 TRP 117 HE1 TRP 117 -1.307 -0.807 4.490 868 HE3 TRP 117 HE3 TRP 117 -2.324 4.015 2.414 869 HZ2 TRP 117 HZ2 TRP 117 -0.698 -0.650 1.750 870 HZ3 TRP 117 HZ3 TRP 117 -1.548 3.237 0.212 871 HH2 TRP 117 HH2 TRP 117 -0.751 0.950 -0.109 872 H GLN 118 HN GLN 118 -3.088 6.453 5.600 873 HA GLN 118 HA GLN 118 -2.516 7.062 2.954 874 HB2 GLN 118 HB2 GLN 118 -4.364 8.001 4.417 875 HB3 GLN 118 HB1 GLN 118 -3.169 9.094 5.099 876 HG2 GLN 118 HG2 GLN 118 -4.134 10.418 3.504 877 HG3 GLN 118 HG1 GLN 118 -2.767 9.754 2.609 878 HE21 GLN 118 HE21 GLN 118 -3.160 8.119 1.076 879 HE22 GLN 118 HE22 GLN 118 -4.727 7.906 0.383 880 H GLU 119 HN GLU 119 -1.001 8.400 5.876 881 HA GLU 119 HA GLU 119 0.761 10.103 4.409 882 HB2 GLU 119 HB2 GLU 119 1.797 10.477 6.648 883 HB3 GLU 119 HB1 GLU 119 0.057 10.742 6.613 884 HG2 GLU 119 HG2 GLU 119 -0.277 8.489 7.535 885 HG3 GLU 119 HG1 GLU 119 1.470 8.304 7.654 886 H GLN 120 HN GLN 120 1.028 6.920 5.874 887 HA GLN 120 HA GLN 120 3.844 6.800 5.929 888 HB2 GLN 120 HB2 GLN 120 1.636 4.813 6.191 889 HB3 GLN 120 HB1 GLN 120 3.291 4.242 6.023 890 HG2 GLN 120 HG2 GLN 120 2.340 6.175 8.124 891 HG3 GLN 120 HG1 GLN 120 2.560 4.444 8.368 892 HE21 GLN 120 HE21 GLN 120 4.905 4.486 6.544 893 HE22 GLN 120 HE22 GLN 120 6.202 5.113 7.509 894 H ILE 121 HN ILE 121 1.475 5.645 3.574 895 HA ILE 121 HA ILE 121 3.304 4.278 1.940 896 HB ILE 121 HB ILE 121 0.922 3.915 1.734 897 HG12 ILE 121 HG12 ILE 121 0.705 4.024 -0.743 898 HG13 ILE 121 HG11 ILE 121 2.137 5.046 -0.795 899 HG21 ILE 121 HG21 ILE 121 -0.510 5.590 0.562 900 HG22 ILE 121 HG22 ILE 121 0.804 6.755 0.738 901 HG23 ILE 121 HG23 ILE 121 0.019 6.087 2.171 902 HD11 ILE 121 HD11 ILE 121 2.049 2.217 0.224 903 HD12 ILE 121 HD12 ILE 121 3.480 3.240 0.105 904 HD13 ILE 121 HD13 ILE 121 2.639 2.728 -1.357 905 H GLN 122 HN GLN 122 2.326 7.647 2.066 906 HA GLN 122 HA GLN 122 3.562 8.441 -0.367 907 HB2 GLN 122 HB2 GLN 122 2.709 9.981 2.082 908 HB3 GLN 122 HB1 GLN 122 3.386 10.754 0.656 909 HG2 GLN 122 HG2 GLN 122 1.560 9.922 -0.695 910 HG3 GLN 122 HG1 GLN 122 0.899 9.065 0.697 911 HE21 GLN 122 HE21 GLN 122 -0.106 10.216 2.323 912 HE22 GLN 122 HE22 GLN 122 -0.603 11.861 2.122 913 H SER 123 HN SER 123 4.610 8.276 2.975 914 HA SER 123 HA SER 123 7.080 9.594 2.654 915 HB2 SER 123 HB2 SER 123 5.901 9.070 4.835 916 HB3 SER 123 HB1 SER 123 6.465 7.409 4.652 917 HG SER 123 HG SER 123 8.028 9.757 4.920 918 H LEU 124 HN LEU 124 6.082 6.230 2.327 919 HA LEU 124 HA LEU 124 8.655 5.151 1.836 920 HB2 LEU 124 HB2 LEU 124 6.699 3.804 2.505 921 HB3 LEU 124 HB1 LEU 124 5.926 4.160 0.978 922 HG LEU 124 HG LEU 124 7.029 1.848 1.314 923 HD11 LEU 124 HD11 LEU 124 6.159 2.595 -0.815 924 HD12 LEU 124 HD12 LEU 124 7.683 1.735 -1.041 925 HD13 LEU 124 HD13 LEU 124 7.642 3.497 -1.126 926 HD21 LEU 124 HD21 LEU 124 9.477 3.485 0.673 927 HD22 LEU 124 HD22 LEU 124 9.384 1.725 0.691 928 HD23 LEU 124 HD23 LEU 124 9.161 2.634 2.184 929 H MET 125 HN MET 125 6.075 6.328 -0.290 930 HA MET 125 HA MET 125 7.212 5.726 -2.761 931 HB2 MET 125 HB2 MET 125 5.468 8.054 -1.946 932 HB3 MET 125 HB1 MET 125 5.834 7.633 -3.612 933 HG2 MET 125 HG2 MET 125 4.575 5.708 -3.541 934 HG3 MET 125 HG1 MET 125 4.622 5.616 -1.781 935 HE1 MET 125 HE1 MET 125 2.210 8.842 -4.012 936 HE2 MET 125 HE2 MET 125 3.307 7.718 -4.814 937 HE3 MET 125 HE3 MET 125 3.949 8.945 -3.717 938 H LYS 126 HN LYS 126 7.442 8.726 -0.887 939 HA LYS 126 HA LYS 126 9.207 9.975 -2.759 940 HB2 LYS 126 HB2 LYS 126 8.441 10.652 0.086 941 HB3 LYS 126 HB1 LYS 126 9.453 11.676 -0.927 942 HG2 LYS 126 HG2 LYS 126 6.667 10.820 -1.682 943 HG3 LYS 126 HG1 LYS 126 7.044 12.333 -0.849 944 HD2 LYS 126 HD2 LYS 126 8.458 13.023 -2.713 945 HD3 LYS 126 HD1 LYS 126 8.143 11.495 -3.535 946 HE2 LYS 126 HE2 LYS 126 6.022 13.505 -2.802 947 HE3 LYS 126 HE1 LYS 126 6.795 13.406 -4.382 948 HZ1 LYS 126 HZ1 LYS 126 4.714 12.251 -4.420 949 HZ2 LYS 126 HZ2 LYS 126 5.151 11.304 -3.092 950 HZ3 LYS 126 HZ3 LYS 126 5.963 11.119 -4.562 951 H PHE 127 HN PHE 127 9.691 7.796 -0.148 952 HA PHE 127 HA PHE 127 12.437 8.452 0.243 953 HB2 PHE 127 HB2 PHE 127 11.161 7.223 1.940 954 HB3 PHE 127 HB1 PHE 127 10.947 5.884 0.817 955 HD1 PHE 127 HD1 PHE 127 12.365 4.088 1.010 956 HD2 PHE 127 HD2 PHE 127 13.694 7.913 2.313 957 HE1 PHE 127 HE1 PHE 127 14.461 3.079 1.816 958 HE2 PHE 127 HE2 PHE 127 15.787 6.914 3.121 959 HZ PHE 127 HZ PHE 127 16.178 4.483 2.850 960 H MET 128 HN MET 128 10.844 5.790 -1.509 961 HA MET 128 HA MET 128 13.417 4.986 -2.580 962 HB2 MET 128 HB2 MET 128 12.214 3.064 -3.501 963 HB3 MET 128 HB1 MET 128 11.899 3.260 -1.784 964 HG2 MET 128 HG2 MET 128 9.712 3.573 -2.097 965 HG3 MET 128 HG1 MET 128 9.965 4.624 -3.489 966 HE1 MET 128 HE1 MET 128 11.607 2.866 -5.497 967 HE2 MET 128 HE2 MET 128 10.182 3.793 -5.966 968 HE3 MET 128 HE3 MET 128 10.318 2.097 -6.422 969 H SER 129 HN SER 129 10.474 6.512 -3.754 970 HA SER 129 HA SER 129 11.229 6.020 -6.507 971 HB2 SER 129 HB2 SER 129 8.897 5.685 -5.833 972 HB3 SER 129 HB1 SER 129 8.788 7.373 -5.345 973 HG SER 129 HG SER 129 9.460 6.582 -7.990 974 H MET 130 HN MET 130 11.659 8.490 -4.217 975 HA MET 130 HA MET 130 11.595 10.731 -5.889 976 HB2 MET 130 HB2 MET 130 12.683 10.110 -3.224 977 HB3 MET 130 HB1 MET 130 13.487 11.426 -4.089 978 HG2 MET 130 HG2 MET 130 10.523 11.243 -3.642 979 HG3 MET 130 HG1 MET 130 11.634 12.152 -2.631 980 HE1 MET 130 HE1 MET 130 12.985 14.274 -3.447 981 HE2 MET 130 HE2 MET 130 12.910 14.921 -5.085 982 HE3 MET 130 HE3 MET 130 13.673 13.360 -4.790 983 H LYS 131 HN LYS 131 12.911 11.409 -7.436 984 HA LYS 131 HA LYS 131 15.388 9.932 -7.919 985 HB2 LYS 131 HB2 LYS 131 13.843 11.830 -9.694 986 HB3 LYS 131 HB1 LYS 131 15.304 10.971 -10.162 987 HG2 LYS 131 HG2 LYS 131 14.159 8.841 -9.873 988 HG3 LYS 131 HG1 LYS 131 12.695 9.691 -9.378 989 HD2 LYS 131 HD2 LYS 131 14.044 10.000 -12.056 990 HD3 LYS 131 HD1 LYS 131 12.657 8.957 -11.745 991 HE2 LYS 131 HE2 LYS 131 12.736 11.953 -11.403 992 HE3 LYS 131 HE1 LYS 131 11.969 11.084 -12.730 993 HZ1 LYS 131 HZ1 LYS 131 10.343 11.728 -11.092 994 HZ2 LYS 131 HZ2 LYS 131 11.195 10.935 -9.869 995 HZ3 LYS 131 HZ3 LYS 131 10.482 10.042 -11.112
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