NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
145497 | 2kep | 16164 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 39 HT1 MET 39 3.693 5.675 -0.059 2 H2 MET 39 HT2 MET 39 3.874 6.106 -1.656 3 H3 MET 39 HT3 MET 39 4.603 7.042 -0.469 4 HA MET 39 HA MET 39 6.212 5.667 -1.627 5 HB2 MET 39 HB2 MET 39 5.795 4.381 1.089 6 HB3 MET 39 HB1 MET 39 7.290 4.631 0.215 7 HG2 MET 39 HG2 MET 39 7.321 6.107 2.044 8 HG3 MET 39 HG1 MET 39 7.002 7.094 0.624 9 HE1 MET 39 HE1 MET 39 6.329 8.991 2.417 10 HE2 MET 39 HE2 MET 39 6.499 7.878 3.776 11 HE3 MET 39 HE3 MET 39 5.016 8.816 3.581 12 H SER 40 HN SER 40 5.619 4.258 -3.232 13 HA SER 40 HA SER 40 4.287 1.831 -2.336 14 HB2 SER 40 HB2 SER 40 4.366 2.991 -5.127 15 HB3 SER 40 HB1 SER 40 3.451 1.572 -4.612 16 HG SER 40 HG SER 40 2.090 2.818 -3.473 17 H ARG 41 HN ARG 41 6.207 0.924 -1.608 18 HA ARG 41 HA ARG 41 7.514 -0.737 -3.570 19 HB2 ARG 41 HB2 ARG 41 9.109 1.012 -1.652 20 HB3 ARG 41 HB1 ARG 41 9.771 -0.330 -2.547 21 HG2 ARG 41 HG2 ARG 41 9.348 0.910 -4.642 22 HG3 ARG 41 HG1 ARG 41 8.772 2.277 -3.675 23 HD2 ARG 41 HD2 ARG 41 10.948 2.294 -2.487 24 HD3 ARG 41 HD1 ARG 41 11.500 1.015 -3.561 25 HE ARG 41 HE ARG 41 10.596 3.290 -4.999 26 HH11 ARG 41 HH11 ARG 41 13.353 2.068 -3.116 27 HH12 ARG 41 HH12 ARG 41 14.498 3.062 -3.900 28 HH21 ARG 41 HH21 ARG 41 12.178 4.654 -6.040 29 HH22 ARG 41 HH22 ARG 41 13.825 4.547 -5.582 30 HA PRO 42 HA PRO 42 7.109 -3.679 -0.178 31 HB2 PRO 42 HB2 PRO 42 10.046 -4.142 -0.501 32 HB3 PRO 42 HB1 PRO 42 8.732 -5.322 -0.400 33 HG2 PRO 42 HG2 PRO 42 9.829 -4.781 -2.738 34 HG3 PRO 42 HG1 PRO 42 8.070 -4.967 -2.598 35 HD2 PRO 42 HD2 PRO 42 9.696 -2.484 -2.901 36 HD3 PRO 42 HD1 PRO 42 8.102 -2.879 -3.570 37 H ASP 43 HN ASP 43 7.252 -3.513 1.988 38 HA ASP 43 HA ASP 43 7.637 -2.798 4.016 39 HB2 ASP 43 HB2 ASP 43 10.418 -2.417 3.006 40 HB3 ASP 43 HB1 ASP 43 9.983 -1.755 4.579 41 H GLN 44 HN GLN 44 8.435 -0.452 1.609 42 HA GLN 44 HA GLN 44 7.827 1.776 3.331 43 HB2 GLN 44 HB2 GLN 44 7.549 1.742 0.336 44 HB3 GLN 44 HB1 GLN 44 7.764 3.122 1.394 45 HG2 GLN 44 HG2 GLN 44 10.044 2.305 1.937 46 HG3 GLN 44 HG1 GLN 44 9.818 1.008 0.763 47 HE21 GLN 44 HE21 GLN 44 11.834 2.993 0.646 48 HE22 GLN 44 HE22 GLN 44 11.546 3.928 -0.777 49 H ALA 45 HN ALA 45 6.116 -0.442 1.374 50 HA ALA 45 HA ALA 45 3.613 0.824 1.309 51 HB1 ALA 45 HB1 ALA 45 4.212 -1.048 -0.161 52 HB2 ALA 45 HB2 ALA 45 2.738 -1.392 0.753 53 HB3 ALA 45 HB3 ALA 45 4.275 -2.102 1.254 54 H LYS 46 HN LYS 46 5.372 -0.746 3.796 55 HA LYS 46 HA LYS 46 3.069 -1.285 5.482 56 HB2 LYS 46 HB2 LYS 46 6.041 -1.239 6.045 57 HB3 LYS 46 HB1 LYS 46 4.824 -1.799 7.165 58 HG2 LYS 46 HG2 LYS 46 5.333 -3.073 4.491 59 HG3 LYS 46 HG1 LYS 46 6.136 -3.593 5.978 60 HD2 LYS 46 HD2 LYS 46 3.803 -3.895 6.925 61 HD3 LYS 46 HD1 LYS 46 3.202 -3.729 5.270 62 HE2 LYS 46 HE2 LYS 46 5.105 -5.809 6.360 63 HE3 LYS 46 HE1 LYS 46 3.439 -6.061 5.867 64 HZ1 LYS 46 HZ1 LYS 46 5.689 -5.340 4.048 65 HZ2 LYS 46 HZ2 LYS 46 4.083 -5.564 3.588 66 HZ3 LYS 46 HZ3 LYS 46 4.959 -6.842 4.217 67 H VAL 47 HN VAL 47 5.345 1.227 4.756 68 HA VAL 47 HA VAL 47 5.151 2.704 7.189 69 HB VAL 47 HB VAL 47 6.174 3.512 4.443 70 HG11 VAL 47 HG11 VAL 47 7.333 5.374 5.590 71 HG12 VAL 47 HG12 VAL 47 6.414 4.997 7.055 72 HG13 VAL 47 HG13 VAL 47 5.578 5.525 5.600 73 HG21 VAL 47 HG21 VAL 47 7.481 1.737 5.471 74 HG22 VAL 47 HG22 VAL 47 7.685 2.718 6.928 75 HG23 VAL 47 HG23 VAL 47 8.389 3.247 5.397 76 H THR 48 HN THR 48 3.824 2.908 3.953 77 HA THR 48 HA THR 48 2.443 5.322 4.300 78 HB THR 48 HB THR 48 3.097 4.466 2.085 79 HG1 THR 48 HG1 THR 48 1.402 5.382 1.136 80 HG21 THR 48 HG21 THR 48 2.662 2.110 2.485 81 HG22 THR 48 HG22 THR 48 1.871 2.654 1.007 82 HG23 THR 48 HG23 THR 48 0.926 2.408 2.481 83 H VAL 49 HN VAL 49 1.581 2.060 5.143 84 HA VAL 49 HA VAL 49 -1.223 2.555 5.532 85 HB VAL 49 HB VAL 49 0.575 0.391 6.696 86 HG11 VAL 49 HG11 VAL 49 -2.447 0.572 6.718 87 HG12 VAL 49 HG12 VAL 49 -1.394 0.706 8.128 88 HG13 VAL 49 HG13 VAL 49 -1.503 -0.816 7.252 89 HG21 VAL 49 HG21 VAL 49 -1.383 0.312 4.402 90 HG22 VAL 49 HG22 VAL 49 -0.495 -1.073 5.038 91 HG23 VAL 49 HG23 VAL 49 0.375 0.261 4.275 92 H ALA 50 HN ALA 50 1.613 2.383 7.618 93 HA ALA 50 HA ALA 50 0.243 2.923 9.998 94 HB1 ALA 50 HB1 ALA 50 2.365 3.260 10.994 95 HB2 ALA 50 HB2 ALA 50 3.088 3.513 9.410 96 HB3 ALA 50 HB3 ALA 50 2.494 1.898 9.860 97 H LYS 51 HN LYS 51 1.416 5.041 7.495 98 HA LYS 51 HA LYS 51 1.593 7.356 9.053 99 HB2 LYS 51 HB2 LYS 51 0.949 7.067 6.118 100 HB3 LYS 51 HB1 LYS 51 1.267 8.615 6.884 101 HG2 LYS 51 HG2 LYS 51 3.204 6.313 6.793 102 HG3 LYS 51 HG1 LYS 51 3.196 7.652 5.649 103 HD2 LYS 51 HD2 LYS 51 3.586 7.924 8.637 104 HD3 LYS 51 HD1 LYS 51 4.886 7.900 7.452 105 HE2 LYS 51 HE2 LYS 51 3.832 9.899 6.365 106 HE3 LYS 51 HE1 LYS 51 2.685 9.956 7.698 107 HZ1 LYS 51 HZ1 LYS 51 4.541 11.472 8.009 108 HZ2 LYS 51 HZ2 LYS 51 5.636 10.196 7.992 109 HZ3 LYS 51 HZ3 LYS 51 4.514 10.338 9.230 110 H GLY 52 HN GLY 52 -1.093 5.666 7.686 111 HA2 GLY 52 HA2 GLY 52 -2.978 7.822 8.158 112 HA3 GLY 52 HA1 GLY 52 -3.353 6.213 7.536 113 H ASP 53 HN ASP 53 -1.725 5.013 9.665 114 HA ASP 53 HA ASP 53 -3.882 4.794 11.540 115 HB2 ASP 53 HB2 ASP 53 -1.160 3.492 11.623 116 HB3 ASP 53 HB1 ASP 53 -2.522 3.094 12.661 117 H ILE 54 HN ILE 54 -0.647 6.144 11.556 118 HA ILE 54 HA ILE 54 -0.685 6.822 14.289 119 HB ILE 54 HB ILE 54 1.133 8.458 13.750 120 HG12 ILE 54 HG12 ILE 54 0.687 7.466 10.931 121 HG13 ILE 54 HG11 ILE 54 0.426 9.099 11.513 122 HG21 ILE 54 HG21 ILE 54 1.444 5.646 12.731 123 HG22 ILE 54 HG22 ILE 54 1.765 6.250 14.372 124 HG23 ILE 54 HG23 ILE 54 2.767 6.770 13.012 125 HD11 ILE 54 HD11 ILE 54 2.457 8.962 10.242 126 HD12 ILE 54 HD12 ILE 54 3.052 7.673 11.288 127 HD13 ILE 54 HD13 ILE 54 2.836 9.307 11.936 128 H LYS 55 HN LYS 55 -1.742 8.663 11.395 129 HA LYS 55 HA LYS 55 -2.377 10.930 12.832 130 HB2 LYS 55 HB2 LYS 55 -2.170 10.468 10.247 131 HB3 LYS 55 HB1 LYS 55 -3.891 10.138 10.386 132 HG2 LYS 55 HG2 LYS 55 -3.511 12.444 9.716 133 HG3 LYS 55 HG1 LYS 55 -4.236 12.378 11.328 134 HD2 LYS 55 HD2 LYS 55 -2.057 12.648 12.354 135 HD3 LYS 55 HD1 LYS 55 -1.305 12.603 10.776 136 HE2 LYS 55 HE2 LYS 55 -2.425 14.705 10.182 137 HE3 LYS 55 HE1 LYS 55 -3.272 14.706 11.724 138 HZ1 LYS 55 HZ1 LYS 55 -0.323 14.881 11.405 139 HZ2 LYS 55 HZ2 LYS 55 -1.166 14.980 12.867 140 HZ3 LYS 55 HZ3 LYS 55 -1.333 16.182 11.714 141 H ALA 56 HN ALA 56 -4.012 7.942 12.310 142 HA ALA 56 HA ALA 56 -6.589 8.616 13.215 143 HB1 ALA 56 HB1 ALA 56 -6.050 6.521 12.054 144 HB2 ALA 56 HB2 ALA 56 -6.801 6.198 13.629 145 HB3 ALA 56 HB3 ALA 56 -5.059 6.044 13.433 146 H ILE 57 HN ILE 57 -3.709 7.397 14.876 147 HA ILE 57 HA ILE 57 -4.819 7.167 17.471 148 HB ILE 57 HB ILE 57 -1.900 7.761 16.870 149 HG12 ILE 57 HG12 ILE 57 -3.237 5.071 16.994 150 HG13 ILE 57 HG11 ILE 57 -2.855 5.890 15.485 151 HG21 ILE 57 HG21 ILE 57 -1.524 6.463 18.925 152 HG22 ILE 57 HG22 ILE 57 -3.261 6.211 19.093 153 HG23 ILE 57 HG23 ILE 57 -2.591 7.835 19.238 154 HD11 ILE 57 HD11 ILE 57 -0.894 4.930 17.557 155 HD12 ILE 57 HD12 ILE 57 -0.494 5.859 16.111 156 HD13 ILE 57 HD13 ILE 57 -1.222 4.257 15.950 157 H ALA 58 HN ALA 58 -3.054 9.725 15.840 158 HA ALA 58 HA ALA 58 -2.826 11.548 17.949 159 HB1 ALA 58 HB1 ALA 58 -3.153 12.165 15.012 160 HB2 ALA 58 HB2 ALA 58 -1.631 11.785 15.818 161 HB3 ALA 58 HB3 ALA 58 -2.506 13.259 16.236 162 H ALA 59 HN ALA 59 -5.529 10.740 15.983 163 HA ALA 59 HA ALA 59 -7.084 13.076 16.677 164 HB1 ALA 59 HB1 ALA 59 -8.846 12.022 15.377 165 HB2 ALA 59 HB2 ALA 59 -7.900 10.538 15.270 166 HB3 ALA 59 HB3 ALA 59 -7.325 12.007 14.483 167 H ALA 60 HN ALA 60 -6.656 9.794 17.706 168 HA ALA 60 HA ALA 60 -8.992 9.816 19.376 169 HB1 ALA 60 HB1 ALA 60 -8.264 7.576 20.044 170 HB2 ALA 60 HB2 ALA 60 -6.753 7.816 19.182 171 HB3 ALA 60 HB3 ALA 60 -8.273 7.744 18.289 172 H LEU 61 HN LEU 61 -5.551 10.389 19.698 173 HA LEU 61 HA LEU 61 -5.428 10.500 22.534 174 HB2 LEU 61 HB2 LEU 61 -3.575 10.439 20.693 175 HB3 LEU 61 HB1 LEU 61 -3.825 12.164 20.593 176 HG LEU 61 HG LEU 61 -1.850 11.409 21.933 177 HD11 LEU 61 HD11 LEU 61 -3.915 13.019 23.405 178 HD12 LEU 61 HD12 LEU 61 -2.740 13.638 22.241 179 HD13 LEU 61 HD13 LEU 61 -2.195 12.974 23.782 180 HD21 LEU 61 HD21 LEU 61 -2.892 9.484 23.016 181 HD22 LEU 61 HD22 LEU 61 -3.930 10.607 23.925 182 HD23 LEU 61 HD23 LEU 61 -2.191 10.620 24.176 183 H ASP 62 HN ASP 62 -6.458 12.705 20.067 184 HA ASP 62 HA ASP 62 -6.938 14.949 21.769 185 HB2 ASP 62 HB2 ASP 62 -6.736 15.255 19.347 186 HB3 ASP 62 HB1 ASP 62 -8.106 14.194 19.068 187 H MET 63 HN MET 63 -8.576 12.029 21.128 188 HA MET 63 HA MET 63 -11.083 12.925 22.239 189 HB2 MET 63 HB2 MET 63 -10.201 10.199 21.272 190 HB3 MET 63 HB1 MET 63 -11.797 10.527 21.941 191 HG2 MET 63 HG2 MET 63 -12.214 12.162 20.173 192 HG3 MET 63 HG1 MET 63 -10.612 11.860 19.527 193 HE1 MET 63 HE1 MET 63 -13.255 10.411 16.959 194 HE2 MET 63 HE2 MET 63 -12.054 11.675 17.250 195 HE3 MET 63 HE3 MET 63 -13.594 11.709 18.104 196 H TYR 64 HN TYR 64 -8.251 11.170 23.311 197 HA TYR 64 HA TYR 64 -9.277 10.566 25.943 198 HB2 TYR 64 HB2 TYR 64 -7.187 9.510 25.085 199 HB3 TYR 64 HB1 TYR 64 -6.406 11.093 25.117 200 HD1 TYR 64 HD2 TYR 64 -7.758 8.358 27.261 201 HD2 TYR 64 HD1 TYR 64 -5.763 12.140 27.244 202 HE1 TYR 64 HE2 TYR 64 -7.186 8.056 29.468 203 HE2 TYR 64 HE1 TYR 64 -5.210 11.827 29.537 204 HH TYR 64 HH TYR 64 -6.250 10.573 31.337 205 H LYS 65 HN LYS 65 -7.606 13.245 24.416 206 HA LYS 65 HA LYS 65 -7.248 15.014 26.466 207 HB2 LYS 65 HB2 LYS 65 -6.457 15.515 24.323 208 HB3 LYS 65 HB1 LYS 65 -8.029 15.274 23.599 209 HG2 LYS 65 HG2 LYS 65 -8.774 17.381 24.690 210 HG3 LYS 65 HG1 LYS 65 -7.102 17.618 25.233 211 HD2 LYS 65 HD2 LYS 65 -6.289 17.633 22.997 212 HD3 LYS 65 HD1 LYS 65 -7.840 17.129 22.358 213 HE2 LYS 65 HE2 LYS 65 -8.792 19.290 23.091 214 HE3 LYS 65 HE1 LYS 65 -7.184 19.779 23.629 215 HZ1 LYS 65 HZ1 LYS 65 -6.368 19.625 21.417 216 HZ2 LYS 65 HZ2 LYS 65 -7.773 20.563 21.363 217 HZ3 LYS 65 HZ3 LYS 65 -7.804 18.934 20.868 218 H LEU 66 HN LEU 66 -10.151 14.220 24.641 219 HA LEU 66 HA LEU 66 -11.843 16.056 26.018 220 HB2 LEU 66 HB2 LEU 66 -12.345 15.259 23.762 221 HB3 LEU 66 HB1 LEU 66 -12.499 13.621 24.359 222 HG LEU 66 HG LEU 66 -14.459 14.300 25.672 223 HD11 LEU 66 HD11 LEU 66 -15.517 16.472 25.183 224 HD12 LEU 66 HD12 LEU 66 -14.094 16.941 24.255 225 HD13 LEU 66 HD13 LEU 66 -13.964 16.660 25.993 226 HD21 LEU 66 HD21 LEU 66 -15.982 14.618 23.761 227 HD22 LEU 66 HD22 LEU 66 -14.805 13.334 23.524 228 HD23 LEU 66 HD23 LEU 66 -14.580 14.896 22.723 229 H ASP 67 HN ASP 67 -10.977 12.653 26.500 230 HA ASP 67 HA ASP 67 -13.098 12.005 28.343 231 HB2 ASP 67 HB2 ASP 67 -11.975 10.246 27.054 232 HB3 ASP 67 HB1 ASP 67 -10.445 10.638 27.808 233 H ASN 68 HN ASN 68 -9.957 13.422 28.731 234 HA ASN 68 HA ASN 68 -10.337 13.482 31.728 235 HB2 ASN 68 HB2 ASN 68 -8.313 12.184 30.339 236 HB3 ASN 68 HB1 ASN 68 -7.915 13.925 30.608 237 HD21 ASN 68 HD21 ASN 68 -9.744 12.574 33.150 238 HD22 ASN 68 HD22 ASN 68 -8.441 12.469 34.259 239 H PHE 69 HN PHE 69 -10.935 15.218 29.371 240 HA PHE 69 HA PHE 69 -10.713 17.398 28.688 241 HB2 PHE 69 HB2 PHE 69 -11.002 18.972 30.666 242 HB3 PHE 69 HB1 PHE 69 -12.222 17.731 30.435 243 HD1 PHE 69 HD2 PHE 69 -9.253 18.579 32.372 244 HD2 PHE 69 HD1 PHE 69 -12.598 16.173 32.037 245 HE1 PHE 69 HE2 PHE 69 -8.960 17.970 34.727 246 HE2 PHE 69 HE1 PHE 69 -12.413 15.473 34.358 247 HZ PHE 69 HZ PHE 69 -10.557 16.376 35.765 248 H ALA 70 HN ALA 70 -8.167 16.217 28.743 249 HA ALA 70 HA ALA 70 -6.371 18.372 28.777 250 HB1 ALA 70 HB1 ALA 70 -6.298 16.536 31.164 251 HB2 ALA 70 HB2 ALA 70 -6.756 18.221 31.209 252 HB3 ALA 70 HB3 ALA 70 -5.087 17.772 30.792 253 H TYR 71 HN TYR 71 -4.281 17.601 28.208 254 HA TYR 71 HA TYR 71 -4.253 15.003 27.075 255 HB2 TYR 71 HB2 TYR 71 -2.217 17.199 27.233 256 HB3 TYR 71 HB1 TYR 71 -1.778 15.601 26.647 257 HD1 TYR 71 HD2 TYR 71 -3.901 14.710 24.984 258 HD2 TYR 71 HD1 TYR 71 -2.437 18.681 25.505 259 HE1 TYR 71 HE2 TYR 71 -4.716 15.245 22.838 260 HE2 TYR 71 HE1 TYR 71 -3.263 19.265 23.284 261 HH TYR 71 HH TYR 71 -3.790 18.125 21.198 262 HA PRO 72 HA PRO 72 -2.541 12.602 30.341 263 HB2 PRO 72 HB2 PRO 72 -0.909 10.975 28.808 264 HB3 PRO 72 HB1 PRO 72 -2.661 10.760 28.944 265 HG2 PRO 72 HG2 PRO 72 -1.033 12.061 26.809 266 HG3 PRO 72 HG1 PRO 72 -2.431 10.987 26.661 267 HD2 PRO 72 HD2 PRO 72 -2.627 13.626 26.369 268 HD3 PRO 72 HD1 PRO 72 -3.924 12.664 27.100 269 H SER 73 HN SER 73 -0.381 12.200 31.478 270 HA SER 73 HA SER 73 1.657 14.069 30.539 271 HB2 SER 73 HB2 SER 73 2.658 13.695 32.796 272 HB3 SER 73 HB1 SER 73 1.004 14.285 32.905 273 HG SER 73 HG SER 73 0.874 12.706 34.170 274 H THR 74 HN THR 74 3.927 13.138 30.457 275 HA THR 74 HA THR 74 3.670 10.707 29.014 276 HB THR 74 HB THR 74 5.418 12.621 28.657 277 HG1 THR 74 HG1 THR 74 6.384 11.257 27.328 278 HG21 THR 74 HG21 THR 74 6.930 10.791 30.550 279 HG22 THR 74 HG22 THR 74 6.452 12.435 30.904 280 HG23 THR 74 HG23 THR 74 7.649 12.124 29.635 281 H GLN 75 HN GLN 75 4.041 11.248 32.317 282 HA GLN 75 HA GLN 75 4.904 8.488 32.724 283 HB2 GLN 75 HB2 GLN 75 4.576 10.798 34.608 284 HB3 GLN 75 HB1 GLN 75 4.990 9.167 35.161 285 HG2 GLN 75 HG2 GLN 75 6.598 10.930 33.317 286 HG3 GLN 75 HG1 GLN 75 6.928 10.648 35.022 287 HE21 GLN 75 HE21 GLN 75 6.306 7.779 34.837 288 HE22 GLN 75 HE22 GLN 75 7.634 7.075 34.002 289 H GLN 76 HN GLN 76 2.321 10.665 34.086 290 HA GLN 76 HA GLN 76 0.806 8.374 35.043 291 HB2 GLN 76 HB2 GLN 76 0.184 11.325 34.962 292 HB3 GLN 76 HB1 GLN 76 -0.875 10.113 35.644 293 HG2 GLN 76 HG2 GLN 76 1.927 10.514 36.633 294 HG3 GLN 76 HG1 GLN 76 0.549 11.408 37.281 295 HE21 GLN 76 HE21 GLN 76 -0.941 10.359 38.496 296 HE22 GLN 76 HE22 GLN 76 -0.716 8.778 39.140 297 H GLY 77 HN GLY 77 0.598 10.662 32.435 298 HA2 GLY 77 HA2 GLY 77 -1.918 9.608 31.626 299 HA3 GLY 77 HA1 GLY 77 -0.918 10.690 30.689 300 H LEU 78 HN LEU 78 1.380 8.660 30.988 301 HA LEU 78 HA LEU 78 0.754 7.172 28.620 302 HB2 LEU 78 HB2 LEU 78 3.116 7.839 29.379 303 HB3 LEU 78 HB1 LEU 78 3.006 6.568 30.570 304 HG LEU 78 HG LEU 78 2.850 6.043 27.596 305 HD11 LEU 78 HD11 LEU 78 5.236 5.882 29.416 306 HD12 LEU 78 HD12 LEU 78 4.984 7.081 28.144 307 HD13 LEU 78 HD13 LEU 78 5.189 5.380 27.729 308 HD21 LEU 78 HD21 LEU 78 1.963 4.242 29.018 309 HD22 LEU 78 HD22 LEU 78 3.478 4.206 29.917 310 HD23 LEU 78 HD23 LEU 78 3.454 3.749 28.212 311 H GLU 79 HN GLU 79 1.132 6.365 32.027 312 HA GLU 79 HA GLU 79 0.135 3.767 31.840 313 HB2 GLU 79 HB2 GLU 79 0.250 5.730 34.095 314 HB3 GLU 79 HB1 GLU 79 -0.611 4.210 34.274 315 HG2 GLU 79 HG2 GLU 79 1.328 2.975 33.805 316 HG3 GLU 79 HG1 GLU 79 2.280 4.439 33.490 317 H ALA 80 HN ALA 80 -1.457 6.845 31.978 318 HA ALA 80 HA ALA 80 -4.067 5.753 32.412 319 HB1 ALA 80 HB1 ALA 80 -4.839 7.978 32.200 320 HB2 ALA 80 HB2 ALA 80 -3.425 8.430 31.287 321 HB3 ALA 80 HB3 ALA 80 -3.256 8.082 33.015 322 H LEU 81 HN LEU 81 -2.080 5.907 29.744 323 HA LEU 81 HA LEU 81 -4.267 5.757 27.830 324 HB2 LEU 81 HB2 LEU 81 -1.402 6.277 27.746 325 HB3 LEU 81 HB1 LEU 81 -1.927 5.193 26.483 326 HG LEU 81 HG LEU 81 -3.419 6.880 25.579 327 HD11 LEU 81 HD11 LEU 81 -3.585 9.113 26.522 328 HD12 LEU 81 HD12 LEU 81 -2.586 8.619 27.892 329 HD13 LEU 81 HD13 LEU 81 -4.180 7.904 27.658 330 HD21 LEU 81 HD21 LEU 81 -1.093 6.984 24.879 331 HD22 LEU 81 HD22 LEU 81 -0.716 8.038 26.239 332 HD23 LEU 81 HD23 LEU 81 -1.791 8.599 24.960 333 H VAL 82 HN VAL 82 -2.245 3.753 29.673 334 HA VAL 82 HA VAL 82 -2.988 1.395 28.058 335 HB VAL 82 HB VAL 82 -0.971 1.555 30.321 336 HG11 VAL 82 HG11 VAL 82 -1.503 -0.633 28.311 337 HG12 VAL 82 HG12 VAL 82 -1.869 -0.699 30.035 338 HG13 VAL 82 HG13 VAL 82 -0.192 -0.622 29.489 339 HG21 VAL 82 HG21 VAL 82 -0.526 1.455 27.349 340 HG22 VAL 82 HG22 VAL 82 0.741 1.518 28.577 341 HG23 VAL 82 HG23 VAL 82 -0.348 2.891 28.338 342 H LYS 83 HN LYS 83 -3.400 2.772 31.224 343 HA LYS 83 HA LYS 83 -5.237 0.647 32.058 344 HB2 LYS 83 HB2 LYS 83 -4.234 0.585 34.217 345 HB3 LYS 83 HB1 LYS 83 -2.824 0.922 33.230 346 HG2 LYS 83 HG2 LYS 83 -3.084 3.312 33.703 347 HG3 LYS 83 HG1 LYS 83 -4.411 2.921 34.794 348 HD2 LYS 83 HD2 LYS 83 -2.862 1.509 36.099 349 HD3 LYS 83 HD1 LYS 83 -1.548 2.027 35.036 350 HE2 LYS 83 HE2 LYS 83 -2.085 4.387 35.647 351 HE3 LYS 83 HE1 LYS 83 -3.240 3.762 36.812 352 HZ1 LYS 83 HZ1 LYS 83 -0.317 3.238 36.838 353 HZ2 LYS 83 HZ2 LYS 83 -1.452 2.633 37.946 354 HZ3 LYS 83 HZ3 LYS 83 -1.171 4.284 37.845 355 H LYS 84 HN LYS 84 -7.023 1.616 33.389 356 HA LYS 84 HA LYS 84 -7.979 4.004 32.241 357 HB2 LYS 84 HB2 LYS 84 -8.877 2.699 34.823 358 HB3 LYS 84 HB1 LYS 84 -9.658 4.105 34.142 359 HG2 LYS 84 HG2 LYS 84 -11.022 2.349 33.445 360 HG3 LYS 84 HG1 LYS 84 -10.011 2.653 32.040 361 HD2 LYS 84 HD2 LYS 84 -10.173 0.285 32.353 362 HD3 LYS 84 HD1 LYS 84 -8.540 0.773 32.797 363 HE2 LYS 84 HE2 LYS 84 -9.205 0.761 35.182 364 HE3 LYS 84 HE1 LYS 84 -10.821 0.251 34.703 365 HZ1 LYS 84 HZ1 LYS 84 -9.885 -1.783 33.829 366 HZ2 LYS 84 HZ2 LYS 84 -9.422 -1.579 35.448 367 HZ3 LYS 84 HZ3 LYS 84 -8.326 -1.268 34.220 368 HA PRO 85 HA PRO 85 -5.713 7.259 34.002 369 HB2 PRO 85 HB2 PRO 85 -7.626 9.203 33.837 370 HB3 PRO 85 HB1 PRO 85 -6.630 8.691 32.477 371 HG2 PRO 85 HG2 PRO 85 -9.413 7.902 33.168 372 HG3 PRO 85 HG1 PRO 85 -8.702 8.244 31.579 373 HD2 PRO 85 HD2 PRO 85 -9.139 5.752 32.410 374 HD3 PRO 85 HD1 PRO 85 -7.704 6.165 31.448 375 H THR 86 HN THR 86 -5.298 7.592 36.031 376 HA THR 86 HA THR 86 -7.452 7.525 37.945 377 HB THR 86 HB THR 86 -5.233 6.403 38.476 378 HG1 THR 86 HG1 THR 86 -6.266 6.707 40.281 379 HG21 THR 86 HG21 THR 86 -3.348 7.784 39.234 380 HG22 THR 86 HG22 THR 86 -4.245 9.244 38.820 381 HG23 THR 86 HG23 THR 86 -3.730 8.141 37.546 382 H GLY 87 HN GLY 87 -8.145 9.273 39.124 383 HA2 GLY 87 HA2 GLY 87 -7.793 11.659 39.653 384 HA3 GLY 87 HA1 GLY 87 -7.399 11.855 37.940 385 H ASN 88 HN ASN 88 -9.092 12.931 37.044 386 HA ASN 88 HA ASN 88 -11.722 11.701 37.470 387 HB2 ASN 88 HB2 ASN 88 -11.054 14.621 37.586 388 HB3 ASN 88 HB1 ASN 88 -12.607 14.136 36.939 389 HD21 ASN 88 HD21 ASN 88 -10.992 12.455 39.583 390 HD22 ASN 88 HD22 ASN 88 -12.102 12.929 40.797 391 HA PRO 89 HA PRO 89 -11.599 12.110 33.030 392 HB2 PRO 89 HB2 PRO 89 -12.289 9.573 32.359 393 HB3 PRO 89 HB1 PRO 89 -10.639 9.992 32.701 394 HG2 PRO 89 HG2 PRO 89 -12.527 8.449 34.371 395 HG3 PRO 89 HG1 PRO 89 -10.764 8.499 34.454 396 HD2 PRO 89 HD2 PRO 89 -12.672 9.888 36.121 397 HD3 PRO 89 HD1 PRO 89 -10.902 9.891 36.244 398 H GLN 90 HN GLN 90 -13.391 12.285 31.681 399 HA GLN 90 HA GLN 90 -15.921 12.751 33.038 400 HB2 GLN 90 HB2 GLN 90 -15.263 13.001 30.094 401 HB3 GLN 90 HB1 GLN 90 -16.621 13.722 30.934 402 HG2 GLN 90 HG2 GLN 90 -14.982 15.069 32.255 403 HG3 GLN 90 HG1 GLN 90 -13.720 14.433 31.205 404 HE21 GLN 90 HE21 GLN 90 -14.590 17.149 31.593 405 HE22 GLN 90 HE22 GLN 90 -15.045 17.759 30.056 406 HA PRO 91 HA PRO 91 -17.757 8.885 31.711 407 HB2 PRO 91 HB2 PRO 91 -20.147 10.226 30.656 408 HB3 PRO 91 HB1 PRO 91 -20.025 9.072 31.988 409 HG2 PRO 91 HG2 PRO 91 -20.549 11.707 32.359 410 HG3 PRO 91 HG1 PRO 91 -19.689 10.713 33.545 411 HD2 PRO 91 HD2 PRO 91 -18.626 12.746 31.643 412 HD3 PRO 91 HD1 PRO 91 -18.064 12.307 33.268 413 H LYS 92 HN LYS 92 -16.457 8.399 30.011 414 HA LYS 92 HA LYS 92 -17.390 8.811 27.332 415 HB2 LYS 92 HB2 LYS 92 -15.891 10.777 28.163 416 HB3 LYS 92 HB1 LYS 92 -14.593 9.616 28.207 417 HG2 LYS 92 HG2 LYS 92 -16.114 10.292 25.699 418 HG3 LYS 92 HG1 LYS 92 -14.698 11.178 26.231 419 HD2 LYS 92 HD2 LYS 92 -13.424 9.034 26.159 420 HD3 LYS 92 HD1 LYS 92 -14.855 8.270 25.472 421 HE2 LYS 92 HE2 LYS 92 -13.467 10.664 24.294 422 HE3 LYS 92 HE1 LYS 92 -13.199 8.999 23.754 423 HZ1 LYS 92 HZ1 LYS 92 -15.800 10.464 23.652 424 HZ2 LYS 92 HZ2 LYS 92 -15.525 8.892 23.121 425 HZ3 LYS 92 HZ3 LYS 92 -14.772 10.180 22.356 426 H ASN 93 HN ASN 93 -16.450 7.002 26.041 427 HA ASN 93 HA ASN 93 -15.634 4.860 27.785 428 HB2 ASN 93 HB2 ASN 93 -17.244 4.369 25.977 429 HB3 ASN 93 HB1 ASN 93 -16.018 4.790 24.783 430 HD21 ASN 93 HD21 ASN 93 -15.538 2.967 27.770 431 HD22 ASN 93 HD22 ASN 93 -15.041 1.501 27.004 432 H TRP 94 HN TRP 94 -13.614 5.408 28.500 433 HA TRP 94 HA TRP 94 -11.417 6.147 27.099 434 HB2 TRP 94 HB2 TRP 94 -11.523 6.170 29.492 435 HB3 TRP 94 HB1 TRP 94 -11.733 4.423 29.555 436 HD1 TRP 94 HD1 TRP 94 -9.062 7.119 29.091 437 HE1 TRP 94 HE1 TRP 94 -6.750 5.977 29.286 438 HE3 TRP 94 HE3 TRP 94 -10.526 2.222 29.287 439 HZ2 TRP 94 HZ2 TRP 94 -5.709 3.412 29.487 440 HZ3 TRP 94 HZ3 TRP 94 -8.805 0.489 29.496 441 HH2 TRP 94 HH2 TRP 94 -6.446 1.075 29.595 442 H ASN 95 HN ASN 95 -9.736 5.080 26.141 443 HA ASN 95 HA ASN 95 -10.154 2.300 25.437 444 HB2 ASN 95 HB2 ASN 95 -10.695 3.669 23.469 445 HB3 ASN 95 HB1 ASN 95 -9.184 4.549 23.694 446 HD21 ASN 95 HD21 ASN 95 -9.427 0.989 23.864 447 HD22 ASN 95 HD22 ASN 95 -8.410 0.792 22.474 448 H LYS 96 HN LYS 96 -8.225 1.074 25.638 449 HA LYS 96 HA LYS 96 -5.912 2.414 26.736 450 HB2 LYS 96 HB2 LYS 96 -5.057 0.257 27.241 451 HB3 LYS 96 HB1 LYS 96 -6.783 0.125 27.517 452 HG2 LYS 96 HG2 LYS 96 -7.016 -0.980 25.296 453 HG3 LYS 96 HG1 LYS 96 -5.261 -0.788 25.125 454 HD2 LYS 96 HD2 LYS 96 -4.896 -2.170 27.107 455 HD3 LYS 96 HD1 LYS 96 -6.637 -2.406 27.265 456 HE2 LYS 96 HE2 LYS 96 -6.727 -3.564 25.150 457 HE3 LYS 96 HE1 LYS 96 -5.030 -3.206 24.840 458 HZ1 LYS 96 HZ1 LYS 96 -4.441 -4.565 26.746 459 HZ2 LYS 96 HZ2 LYS 96 -5.301 -5.458 25.616 460 HZ3 LYS 96 HZ3 LYS 96 -6.060 -4.937 27.029 461 H ASP 97 HN ASP 97 -3.797 1.089 25.747 462 HA ASP 97 HA ASP 97 -2.336 0.676 24.132 463 HB2 ASP 97 HB2 ASP 97 -4.577 -0.438 23.118 464 HB3 ASP 97 HB1 ASP 97 -4.285 0.805 21.910 465 H GLY 98 HN GLY 98 -3.726 3.316 24.729 466 HA2 GLY 98 HA2 GLY 98 -2.438 5.270 24.575 467 HA3 GLY 98 HA1 GLY 98 -1.884 4.768 22.996 468 H TYR 99 HN TYR 99 -5.192 4.303 23.591 469 HA TYR 99 HA TYR 99 -7.023 5.067 22.697 470 HB2 TYR 99 HB2 TYR 99 -5.808 7.454 23.687 471 HB3 TYR 99 HB1 TYR 99 -6.520 7.866 22.116 472 HD1 TYR 99 HD1 TYR 99 -7.024 6.741 25.514 473 HD2 TYR 99 HD2 TYR 99 -8.920 7.811 21.881 474 HE1 TYR 99 HE1 TYR 99 -9.156 6.913 26.678 475 HE2 TYR 99 HE2 TYR 99 -11.057 7.988 23.032 476 HH TYR 99 HH TYR 99 -11.220 7.815 26.472 477 H LEU 100 HN LEU 100 -7.138 3.968 21.006 478 HA LEU 100 HA LEU 100 -5.852 4.849 18.521 479 HB2 LEU 100 HB2 LEU 100 -4.717 2.939 19.553 480 HB3 LEU 100 HB1 LEU 100 -6.231 2.088 19.690 481 HG LEU 100 HG LEU 100 -6.319 1.962 17.201 482 HD11 LEU 100 HD11 LEU 100 -4.287 2.388 15.933 483 HD12 LEU 100 HD12 LEU 100 -3.532 3.057 17.377 484 HD13 LEU 100 HD13 LEU 100 -4.934 3.861 16.655 485 HD21 LEU 100 HD21 LEU 100 -5.505 0.111 18.522 486 HD22 LEU 100 HD22 LEU 100 -3.881 0.799 18.518 487 HD23 LEU 100 HD23 LEU 100 -4.608 0.239 17.012 488 H LYS 101 HN LYS 101 -7.008 3.768 16.660 489 HA LYS 101 HA LYS 101 -9.912 3.881 16.989 490 HB2 LYS 101 HB2 LYS 101 -8.165 3.662 14.518 491 HB3 LYS 101 HB1 LYS 101 -9.906 3.857 14.488 492 HG2 LYS 101 HG2 LYS 101 -7.930 5.870 15.578 493 HG3 LYS 101 HG1 LYS 101 -8.721 5.930 14.000 494 HD2 LYS 101 HD2 LYS 101 -10.888 6.128 15.066 495 HD3 LYS 101 HD1 LYS 101 -10.137 6.013 16.661 496 HE2 LYS 101 HE2 LYS 101 -8.971 8.078 16.322 497 HE3 LYS 101 HE1 LYS 101 -9.483 8.151 14.641 498 HZ1 LYS 101 HZ1 LYS 101 -11.312 8.344 16.997 499 HZ2 LYS 101 HZ2 LYS 101 -11.750 8.367 15.376 500 HZ3 LYS 101 HZ3 LYS 101 -10.829 9.613 15.980 501 H LYS 102 HN LYS 102 -10.752 2.070 15.100 502 HA LYS 102 HA LYS 102 -9.971 -0.430 16.293 503 HB2 LYS 102 HB2 LYS 102 -11.653 -1.597 14.961 504 HB3 LYS 102 HB1 LYS 102 -12.367 -0.149 15.624 505 HG2 LYS 102 HG2 LYS 102 -11.358 -0.385 12.800 506 HG3 LYS 102 HG1 LYS 102 -13.014 -0.760 13.257 507 HD2 LYS 102 HD2 LYS 102 -11.671 1.938 13.576 508 HD3 LYS 102 HD1 LYS 102 -12.729 1.478 12.257 509 HE2 LYS 102 HE2 LYS 102 -13.555 1.508 15.163 510 HE3 LYS 102 HE1 LYS 102 -13.898 2.779 13.996 511 HZ1 LYS 102 HZ1 LYS 102 -14.854 -0.026 13.807 512 HZ2 LYS 102 HZ2 LYS 102 -15.163 1.200 12.694 513 HZ3 LYS 102 HZ3 LYS 102 -15.769 1.310 14.250 514 H LEU 103 HN LEU 103 -7.801 -0.251 15.837 515 HA LEU 103 HA LEU 103 -7.018 -1.151 13.144 516 HB2 LEU 103 HB2 LEU 103 -5.635 0.883 14.878 517 HB3 LEU 103 HB1 LEU 103 -5.019 0.263 13.360 518 HG LEU 103 HG LEU 103 -7.557 1.861 13.659 519 HD11 LEU 103 HD11 LEU 103 -6.284 3.685 12.658 520 HD12 LEU 103 HD12 LEU 103 -4.829 2.690 12.683 521 HD13 LEU 103 HD13 LEU 103 -5.582 3.190 14.196 522 HD21 LEU 103 HD21 LEU 103 -7.581 0.369 11.734 523 HD22 LEU 103 HD22 LEU 103 -6.006 0.981 11.228 524 HD23 LEU 103 HD23 LEU 103 -7.408 2.046 11.216 525 HA PRO 104 HA PRO 104 -4.568 -4.083 15.504 526 HB2 PRO 104 HB2 PRO 104 -2.858 -4.860 13.543 527 HB3 PRO 104 HB1 PRO 104 -4.545 -5.386 13.571 528 HG2 PRO 104 HG2 PRO 104 -3.264 -3.203 11.977 529 HG3 PRO 104 HG1 PRO 104 -4.459 -4.403 11.461 530 HD2 PRO 104 HD2 PRO 104 -5.119 -1.846 12.110 531 HD3 PRO 104 HD1 PRO 104 -6.220 -3.214 12.339 532 H VAL 105 HN VAL 105 -1.884 -4.491 15.327 533 HA VAL 105 HA VAL 105 -0.856 -1.946 16.231 534 HB VAL 105 HB VAL 105 -0.548 -4.256 17.337 535 HG11 VAL 105 HG11 VAL 105 1.663 -4.494 15.330 536 HG12 VAL 105 HG12 VAL 105 0.210 -5.483 15.432 537 HG13 VAL 105 HG13 VAL 105 1.403 -5.541 16.727 538 HG21 VAL 105 HG21 VAL 105 0.535 -2.210 18.126 539 HG22 VAL 105 HG22 VAL 105 1.872 -2.504 17.015 540 HG23 VAL 105 HG23 VAL 105 1.518 -3.657 18.321 541 H ASP 106 HN ASP 106 1.713 -1.592 15.439 542 HA ASP 106 HA ASP 106 1.315 -1.159 12.679 543 HB2 ASP 106 HB2 ASP 106 3.683 -0.104 12.823 544 HB3 ASP 106 HB1 ASP 106 2.394 0.659 13.738 545 HA PRO 107 HA PRO 107 3.186 -4.452 10.684 546 HB2 PRO 107 HB2 PRO 107 4.954 -3.300 8.978 547 HB3 PRO 107 HB1 PRO 107 3.204 -3.410 8.705 548 HG2 PRO 107 HG2 PRO 107 4.785 -1.104 9.795 549 HG3 PRO 107 HG1 PRO 107 3.486 -1.085 8.583 550 HD2 PRO 107 HD2 PRO 107 2.967 -0.414 11.071 551 HD3 PRO 107 HD1 PRO 107 1.835 -1.432 10.166 552 H TRP 108 HN TRP 108 5.235 -5.451 10.091 553 HA TRP 108 HA TRP 108 7.258 -6.320 10.500 554 HB2 TRP 108 HB2 TRP 108 8.060 -3.821 12.011 555 HB3 TRP 108 HB1 TRP 108 9.113 -4.976 11.212 556 HD1 TRP 108 HD1 TRP 108 8.653 -5.043 8.415 557 HE1 TRP 108 HE1 TRP 108 8.473 -3.036 6.854 558 HE3 TRP 108 HE3 TRP 108 7.419 -1.606 11.899 559 HZ2 TRP 108 HZ2 TRP 108 7.809 -0.197 7.129 560 HZ3 TRP 108 HZ3 TRP 108 7.022 0.750 11.195 561 HH2 TRP 108 HH2 TRP 108 7.199 1.403 8.900 562 H GLY 109 HN GLY 109 5.016 -6.039 12.491 563 HA2 GLY 109 HA2 GLY 109 4.427 -7.067 14.457 564 HA3 GLY 109 HA1 GLY 109 6.027 -7.801 14.490 565 H ASN 110 HN ASN 110 6.102 -4.326 14.374 566 HA ASN 110 HA ASN 110 6.960 -4.272 17.066 567 HB2 ASN 110 HB2 ASN 110 8.226 -3.043 15.416 568 HB3 ASN 110 HB1 ASN 110 6.789 -2.182 14.885 569 HD21 ASN 110 HD21 ASN 110 6.128 -0.469 15.976 570 HD22 ASN 110 HD22 ASN 110 6.926 0.256 17.336 571 HA PRO 111 HA PRO 111 3.093 -2.575 18.621 572 HB2 PRO 111 HB2 PRO 111 3.853 -2.060 21.135 573 HB3 PRO 111 HB1 PRO 111 3.624 -3.719 20.574 574 HG2 PRO 111 HG2 PRO 111 6.145 -2.194 20.999 575 HG3 PRO 111 HG1 PRO 111 5.807 -3.908 21.283 576 HD2 PRO 111 HD2 PRO 111 7.115 -2.869 19.050 577 HD3 PRO 111 HD1 PRO 111 6.367 -4.474 19.149 578 H TYR 112 HN TYR 112 2.227 -0.540 18.948 579 HA TYR 112 HA TYR 112 3.718 1.654 18.019 580 HB2 TYR 112 HB2 TYR 112 1.007 1.470 19.339 581 HB3 TYR 112 HB1 TYR 112 1.717 3.017 18.920 582 HD1 TYR 112 HD1 TYR 112 2.184 3.513 16.522 583 HD2 TYR 112 HD2 TYR 112 -0.115 0.138 17.699 584 HE1 TYR 112 HE1 TYR 112 1.290 3.361 14.259 585 HE2 TYR 112 HE2 TYR 112 -1.025 -0.030 15.407 586 HH TYR 112 HH TYR 112 -1.360 1.483 13.355 587 H GLN 113 HN GLN 113 4.624 3.296 19.013 588 HA GLN 113 HA GLN 113 4.838 3.101 21.921 589 HB2 GLN 113 HB2 GLN 113 6.613 5.108 20.883 590 HB3 GLN 113 HB1 GLN 113 7.069 3.651 21.764 591 HG2 GLN 113 HG2 GLN 113 6.813 4.082 18.785 592 HG3 GLN 113 HG1 GLN 113 8.309 3.979 19.694 593 HE21 GLN 113 HE21 GLN 113 7.271 1.650 21.253 594 HE22 GLN 113 HE22 GLN 113 7.259 0.347 20.115 595 H TYR 114 HN TYR 114 3.516 4.322 22.919 596 HA TYR 114 HA TYR 114 2.843 6.913 21.817 597 HB2 TYR 114 HB2 TYR 114 0.660 6.548 23.231 598 HB3 TYR 114 HB1 TYR 114 0.802 5.776 21.665 599 HD1 TYR 114 HD2 TYR 114 1.475 3.285 21.624 600 HD2 TYR 114 HD1 TYR 114 0.175 5.220 25.202 601 HE1 TYR 114 HE2 TYR 114 0.963 1.098 22.638 602 HE2 TYR 114 HE1 TYR 114 -0.324 3.028 26.183 603 HH TYR 114 HH TYR 114 0.803 0.156 24.839 604 H LEU 115 HN LEU 115 3.547 8.523 22.906 605 HA LEU 115 HA LEU 115 4.083 8.297 25.766 606 HB2 LEU 115 HB2 LEU 115 5.692 9.777 23.682 607 HB3 LEU 115 HB1 LEU 115 6.054 9.697 25.395 608 HG LEU 115 HG LEU 115 6.224 7.415 23.420 609 HD11 LEU 115 HD11 LEU 115 7.948 9.087 23.078 610 HD12 LEU 115 HD12 LEU 115 8.634 7.609 23.749 611 HD13 LEU 115 HD13 LEU 115 8.382 9.015 24.786 612 HD21 LEU 115 HD21 LEU 115 5.651 6.623 25.656 613 HD22 LEU 115 HD22 LEU 115 6.995 7.541 26.332 614 HD23 LEU 115 HD23 LEU 115 7.309 6.190 25.240 615 H ALA 116 HN ALA 116 3.884 10.455 26.809 616 HA ALA 116 HA ALA 116 2.045 12.039 25.268 617 HB1 ALA 116 HB1 ALA 116 2.242 11.937 28.277 618 HB2 ALA 116 HB2 ALA 116 1.266 10.827 27.308 619 HB3 ALA 116 HB3 ALA 116 0.914 12.545 27.259 620 HA PRO 117 HA PRO 117 4.166 15.756 25.004 621 HB2 PRO 117 HB2 PRO 117 3.936 17.530 27.056 622 HB3 PRO 117 HB1 PRO 117 2.794 17.330 25.753 623 HG2 PRO 117 HG2 PRO 117 2.657 16.169 28.505 624 HG3 PRO 117 HG1 PRO 117 1.355 16.868 27.520 625 HD2 PRO 117 HD2 PRO 117 1.698 14.207 27.758 626 HD3 PRO 117 HD1 PRO 117 1.136 14.916 26.220 627 H GLY 118 HN GLY 118 6.045 15.456 24.793 628 HA2 GLY 118 HA2 GLY 118 7.754 14.921 27.046 629 HA3 GLY 118 HA1 GLY 118 8.169 14.913 25.324 630 H THR 119 HN THR 119 8.809 16.658 24.355 631 HA THR 119 HA THR 119 9.416 18.883 26.161 632 HB THR 119 HB THR 119 10.927 18.371 23.617 633 HG1 THR 119 HG1 THR 119 10.746 16.570 25.392 634 HG21 THR 119 HG21 THR 119 11.650 19.605 26.287 635 HG22 THR 119 HG22 THR 119 11.256 20.492 24.817 636 HG23 THR 119 HG23 THR 119 12.715 19.501 24.886 637 H LYS 120 HN LYS 120 7.905 20.290 25.818 638 HA LYS 120 HA LYS 120 6.801 21.999 24.925 639 HB2 LYS 120 HB2 LYS 120 8.185 21.374 22.315 640 HB3 LYS 120 HB1 LYS 120 7.233 22.812 22.642 641 HG2 LYS 120 HG2 LYS 120 9.785 22.019 24.019 642 HG3 LYS 120 HG1 LYS 120 9.611 23.270 22.784 643 HD2 LYS 120 HD2 LYS 120 8.109 24.517 24.241 644 HD3 LYS 120 HD1 LYS 120 8.257 23.261 25.469 645 HE2 LYS 120 HE2 LYS 120 10.635 23.708 25.677 646 HE3 LYS 120 HE1 LYS 120 10.533 24.941 24.423 647 HZ1 LYS 120 HZ1 LYS 120 9.111 25.019 27.026 648 HZ2 LYS 120 HZ2 LYS 120 9.074 26.226 25.853 649 HZ3 LYS 120 HZ3 LYS 120 10.514 25.867 26.663 650 H GLY 121 HN GLY 121 6.544 18.914 23.314 651 HA2 GLY 121 HA2 GLY 121 4.110 19.926 22.088 652 HA3 GLY 121 HA1 GLY 121 5.013 18.511 21.535 653 HA PRO 122 HA PRO 122 1.177 18.176 24.821 654 HB2 PRO 122 HB2 PRO 122 0.002 17.916 22.088 655 HB3 PRO 122 HB1 PRO 122 -0.798 18.317 23.616 656 HG2 PRO 122 HG2 PRO 122 -0.116 20.269 22.034 657 HG3 PRO 122 HG1 PRO 122 0.274 20.399 23.760 658 HD2 PRO 122 HD2 PRO 122 2.040 19.765 21.459 659 HD3 PRO 122 HD1 PRO 122 2.413 20.711 22.931 660 H PHE 123 HN PHE 123 2.463 16.319 22.072 661 HA PHE 123 HA PHE 123 2.521 14.088 23.761 662 HB2 PHE 123 HB2 PHE 123 1.083 12.469 22.529 663 HB3 PHE 123 HB1 PHE 123 0.193 13.748 23.302 664 HD1 PHE 123 HD1 PHE 123 -0.932 15.496 21.985 665 HD2 PHE 123 HD2 PHE 123 1.087 12.241 20.129 666 HE1 PHE 123 HE1 PHE 123 -2.120 15.962 19.891 667 HE2 PHE 123 HE2 PHE 123 -0.106 12.705 18.022 668 HZ PHE 123 HZ PHE 123 -1.709 14.569 17.906 669 H ASP 124 HN ASP 124 3.265 12.028 22.645 670 HA ASP 124 HA ASP 124 4.912 12.535 20.252 671 HB2 ASP 124 HB2 ASP 124 5.836 11.550 22.933 672 HB3 ASP 124 HB1 ASP 124 6.648 11.037 21.463 673 H LEU 125 HN LEU 125 3.903 10.969 18.876 674 HA LEU 125 HA LEU 125 4.155 8.338 20.015 675 HB2 LEU 125 HB2 LEU 125 1.965 7.536 19.261 676 HB3 LEU 125 HB1 LEU 125 1.858 8.781 20.476 677 HG LEU 125 HG LEU 125 1.475 10.333 18.392 678 HD11 LEU 125 HD11 LEU 125 0.588 7.646 17.372 679 HD12 LEU 125 HD12 LEU 125 1.891 8.632 16.711 680 HD13 LEU 125 HD13 LEU 125 0.219 9.203 16.622 681 HD21 LEU 125 HD21 LEU 125 -0.073 10.034 20.196 682 HD22 LEU 125 HD22 LEU 125 -0.511 8.448 19.591 683 HD23 LEU 125 HD23 LEU 125 -0.960 9.894 18.666 684 H TYR 126 HN TYR 126 4.500 6.631 18.696 685 HA TYR 126 HA TYR 126 4.797 6.911 15.912 686 HB2 TYR 126 HB2 TYR 126 7.253 7.013 15.724 687 HB3 TYR 126 HB1 TYR 126 6.614 8.457 16.483 688 HD1 TYR 126 HD2 TYR 126 6.798 8.609 19.066 689 HD2 TYR 126 HD1 TYR 126 8.993 5.814 16.726 690 HE1 TYR 126 HE2 TYR 126 8.421 8.388 20.882 691 HE2 TYR 126 HE1 TYR 126 10.643 5.579 18.530 692 HH TYR 126 HH TYR 126 10.090 6.544 21.638 693 H SER 127 HN SER 127 6.111 5.203 14.995 694 HA SER 127 HA SER 127 6.177 2.783 16.632 695 HB2 SER 127 HB2 SER 127 5.681 2.972 13.649 696 HB3 SER 127 HB1 SER 127 5.521 1.562 14.707 697 HG SER 127 HG SER 127 3.692 2.139 15.257 698 H LEU 128 HN LEU 128 7.980 1.480 16.189 699 HA LEU 128 HA LEU 128 10.330 2.811 15.239 700 HB2 LEU 128 HB2 LEU 128 9.850 -0.055 16.000 701 HB3 LEU 128 HB1 LEU 128 11.427 0.600 15.614 702 HG LEU 128 HG LEU 128 9.686 1.366 17.964 703 HD11 LEU 128 HD11 LEU 128 10.762 -0.779 18.196 704 HD12 LEU 128 HD12 LEU 128 11.484 0.405 19.288 705 HD13 LEU 128 HD13 LEU 128 12.323 -0.060 17.808 706 HD21 LEU 128 HD21 LEU 128 11.591 2.750 18.682 707 HD22 LEU 128 HD22 LEU 128 10.877 3.335 17.186 708 HD23 LEU 128 HD23 LEU 128 12.394 2.434 17.144 709 H GLY 129 HN GLY 129 11.719 2.049 13.528 710 HA2 GLY 129 HA2 GLY 129 10.236 1.509 11.130 711 HA3 GLY 129 HA1 GLY 129 11.974 1.708 11.251 712 H ALA 130 HN ALA 130 11.394 -0.064 9.578 713 HA ALA 130 HA ALA 130 10.657 -2.644 10.301 714 HB1 ALA 130 HB1 ALA 130 11.649 -3.343 8.210 715 HB2 ALA 130 HB2 ALA 130 12.536 -1.822 8.100 716 HB3 ALA 130 HB3 ALA 130 10.776 -1.826 8.005 717 H ASP 131 HN ASP 131 13.672 -1.050 10.764 718 HA ASP 131 HA ASP 131 15.059 -3.581 11.207 719 HB2 ASP 131 HB2 ASP 131 16.068 -1.686 9.858 720 HB3 ASP 131 HB1 ASP 131 16.215 -0.792 11.363 721 H GLY 132 HN GLY 132 13.077 -1.769 13.017 722 HA2 GLY 132 HA2 GLY 132 12.619 -1.788 15.270 723 HA3 GLY 132 HA1 GLY 132 13.994 -2.862 15.491 724 H LYS 133 HN LYS 133 14.066 0.318 14.065 725 HA LYS 133 HA LYS 133 15.420 1.359 16.409 726 HB2 LYS 133 HB2 LYS 133 17.222 0.505 15.008 727 HB3 LYS 133 HB1 LYS 133 16.592 1.376 13.622 728 HG2 LYS 133 HG2 LYS 133 17.110 3.501 14.664 729 HG3 LYS 133 HG1 LYS 133 17.638 2.683 16.126 730 HD2 LYS 133 HD2 LYS 133 18.919 2.290 13.428 731 HD3 LYS 133 HD1 LYS 133 19.476 3.465 14.616 732 HE2 LYS 133 HE2 LYS 133 19.809 1.612 16.231 733 HE3 LYS 133 HE1 LYS 133 19.335 0.472 14.978 734 HZ1 LYS 133 HZ1 LYS 133 21.749 0.708 15.177 735 HZ2 LYS 133 HZ2 LYS 133 21.618 2.341 14.757 736 HZ3 LYS 133 HZ3 LYS 133 21.178 1.149 13.657 737 H GLU 134 HN GLU 134 15.276 3.596 16.632 738 HA GLU 134 HA GLU 134 13.470 4.852 14.791 739 HB2 GLU 134 HB2 GLU 134 13.695 6.779 16.621 740 HB3 GLU 134 HB1 GLU 134 12.591 5.437 16.816 741 HG2 GLU 134 HG2 GLU 134 13.732 5.901 18.894 742 HG3 GLU 134 HG1 GLU 134 14.200 4.323 18.275 743 H GLY 135 HN GLY 135 14.317 5.710 13.124 744 HA2 GLY 135 HA2 GLY 135 16.580 7.517 13.344 745 HA3 GLY 135 HA1 GLY 135 16.810 6.091 12.338 746 H GLY 136 HN GLY 136 17.143 8.015 10.785 747 HA2 GLY 136 HA2 GLY 136 14.529 8.718 9.621 748 HA3 GLY 136 HA1 GLY 136 16.004 9.671 9.405 749 H SER 137 HN SER 137 14.096 7.855 7.696 750 HA SER 137 HA SER 137 15.731 6.942 5.687 751 HB2 SER 137 HB2 SER 137 15.007 4.875 7.787 752 HB3 SER 137 HB1 SER 137 15.455 4.424 6.131 753 HG SER 137 HG SER 137 17.179 6.093 7.491 754 H ASP 138 HN ASP 138 14.219 5.073 4.504 755 HA ASP 138 HA ASP 138 11.551 6.257 4.455 756 HB2 ASP 138 HB2 ASP 138 12.771 3.982 2.861 757 HB3 ASP 138 HB1 ASP 138 11.117 4.548 2.662 758 H ASN 139 HN ASN 139 12.503 2.855 4.646 759 HA ASN 139 HA ASN 139 10.151 2.486 6.359 760 HB2 ASN 139 HB2 ASN 139 10.356 0.075 5.878 761 HB3 ASN 139 HB1 ASN 139 10.190 1.028 4.411 762 HD21 ASN 139 HD21 ASN 139 12.274 -1.019 6.271 763 HD22 ASN 139 HD22 ASN 139 13.487 -1.197 5.054 764 H ASP 140 HN ASP 140 13.378 2.907 6.658 765 HA ASP 140 HA ASP 140 13.563 1.278 9.109 766 HB2 ASP 140 HB2 ASP 140 15.724 2.812 7.639 767 HB3 ASP 140 HB1 ASP 140 15.977 1.908 9.120 768 H ALA 141 HN ALA 141 12.319 4.052 8.419 769 HA ALA 141 HA ALA 141 13.557 5.729 10.441 770 HB1 ALA 141 HB1 ALA 141 11.997 7.416 9.717 771 HB2 ALA 141 HB2 ALA 141 11.169 6.241 8.697 772 HB3 ALA 141 HB3 ALA 141 12.825 6.714 8.327 773 H ASP 142 HN ASP 142 12.344 6.616 12.177 774 HA ASP 142 HA ASP 142 10.321 4.810 13.173 775 HB2 ASP 142 HB2 ASP 142 10.353 6.026 15.217 776 HB3 ASP 142 HB1 ASP 142 12.005 6.185 14.668 777 H ILE 143 HN ILE 143 8.236 5.126 12.904 778 HA ILE 143 HA ILE 143 7.546 7.507 11.388 779 HB ILE 143 HB ILE 143 5.776 6.164 10.261 780 HG12 ILE 143 HG12 ILE 143 7.241 3.813 11.503 781 HG13 ILE 143 HG11 ILE 143 5.592 4.312 11.870 782 HG21 ILE 143 HG21 ILE 143 8.650 5.352 9.909 783 HG22 ILE 143 HG22 ILE 143 7.796 6.655 9.065 784 HG23 ILE 143 HG23 ILE 143 7.375 4.960 8.770 785 HD11 ILE 143 HD11 ILE 143 6.619 3.313 9.246 786 HD12 ILE 143 HD12 ILE 143 4.991 3.889 9.545 787 HD13 ILE 143 HD13 ILE 143 5.570 2.426 10.365 788 H GLY 144 HN GLY 144 6.374 8.834 12.435 789 HA2 GLY 144 HA2 GLY 144 4.026 8.013 13.806 790 HA3 GLY 144 HA1 GLY 144 5.337 8.473 14.884 791 H ASN 145 HN ASN 145 3.407 9.967 15.248 792 HA ASN 145 HA ASN 145 4.245 12.420 14.149 793 HB2 ASN 145 HB2 ASN 145 2.028 13.179 13.335 794 HB3 ASN 145 HB1 ASN 145 2.673 11.821 12.432 795 HD21 ASN 145 HD21 ASN 145 1.091 11.195 15.530 796 HD22 ASN 145 HD22 ASN 145 -0.319 10.509 14.802 797 H TRP 146 HN TRP 146 3.379 14.174 15.241 798 HA TRP 146 HA TRP 146 1.753 13.702 17.503 799 HB2 TRP 146 HB2 TRP 146 3.406 14.680 19.099 800 HB3 TRP 146 HB1 TRP 146 3.782 13.065 18.532 801 HD1 TRP 146 HD1 TRP 146 4.873 16.722 17.719 802 HE1 TRP 146 HE1 TRP 146 7.373 16.649 17.105 803 HE3 TRP 146 HE3 TRP 146 5.595 11.725 18.018 804 HZ2 TRP 146 HZ2 TRP 146 9.396 14.710 16.809 805 HZ3 TRP 146 HZ3 TRP 146 7.857 10.805 17.573 806 HH2 TRP 146 HH2 TRP 146 9.712 12.288 16.977 807 H ASP 147 HN ASP 147 1.811 15.859 18.770 808 HA ASP 147 HA ASP 147 1.940 17.992 16.833 809 HB2 ASP 147 HB2 ASP 147 -0.489 17.345 18.499 810 HB3 ASP 147 HB1 ASP 147 -0.201 18.970 17.887 811 H ASN 148 HN ASN 148 2.568 19.814 17.462 812 HA ASN 148 HA ASN 148 3.175 20.436 20.244 813 HB2 ASN 148 HB2 ASN 148 5.256 19.469 19.334 814 HB3 ASN 148 HB1 ASN 148 5.134 20.515 17.923 815 HD21 ASN 148 HD21 ASN 148 7.176 21.423 18.381 816 HD22 ASN 148 HD22 ASN 148 7.374 22.563 19.660 Start of MODEL 2 1 H1 MET 39 HT1 MET 39 3.231 5.095 0.098 2 H2 MET 39 HT2 MET 39 3.088 5.418 -1.534 3 H3 MET 39 HT3 MET 39 4.069 6.392 -0.584 4 HA MET 39 HA MET 39 5.308 4.885 -1.981 5 HB2 MET 39 HB2 MET 39 5.551 4.503 1.005 6 HB3 MET 39 HB1 MET 39 6.626 3.698 -0.116 7 HG2 MET 39 HG2 MET 39 6.237 6.664 0.089 8 HG3 MET 39 HG1 MET 39 7.606 5.745 0.728 9 HE1 MET 39 HE1 MET 39 7.948 8.240 -1.223 10 HE2 MET 39 HE2 MET 39 9.196 7.627 -2.310 11 HE3 MET 39 HE3 MET 39 9.294 7.301 -0.580 12 H SER 40 HN SER 40 4.423 3.422 -3.264 13 HA SER 40 HA SER 40 3.505 0.962 -2.012 14 HB2 SER 40 HB2 SER 40 2.034 2.146 -3.742 15 HB3 SER 40 HB1 SER 40 3.260 1.728 -4.934 16 HG SER 40 HG SER 40 1.352 0.208 -3.736 17 H ARG 41 HN ARG 41 5.563 0.354 -1.457 18 HA ARG 41 HA ARG 41 7.082 -0.971 -3.537 19 HB2 ARG 41 HB2 ARG 41 8.239 1.060 -1.593 20 HB3 ARG 41 HB1 ARG 41 9.221 -0.122 -2.433 21 HG2 ARG 41 HG2 ARG 41 7.542 1.971 -3.789 22 HG3 ARG 41 HG1 ARG 41 9.259 2.160 -3.414 23 HD2 ARG 41 HD2 ARG 41 9.734 0.180 -4.804 24 HD3 ARG 41 HD1 ARG 41 8.024 0.070 -5.220 25 HE ARG 41 HE ARG 41 8.989 2.635 -5.812 26 HH11 ARG 41 HH11 ARG 41 9.391 -0.672 -6.986 27 HH12 ARG 41 HH12 ARG 41 9.613 -0.228 -8.616 28 HH21 ARG 41 HH21 ARG 41 9.359 3.259 -8.076 29 HH22 ARG 41 HH22 ARG 41 9.606 2.044 -9.241 30 HA PRO 42 HA PRO 42 7.314 -4.255 -0.543 31 HB2 PRO 42 HB2 PRO 42 10.282 -4.071 -0.813 32 HB3 PRO 42 HB1 PRO 42 9.237 -5.493 -0.914 33 HG2 PRO 42 HG2 PRO 42 10.234 -4.409 -3.115 34 HG3 PRO 42 HG1 PRO 42 8.566 -5.010 -3.082 35 HD2 PRO 42 HD2 PRO 42 9.560 -2.195 -3.022 36 HD3 PRO 42 HD1 PRO 42 8.089 -2.860 -3.753 37 H ASP 43 HN ASP 43 6.993 -3.971 1.477 38 HA ASP 43 HA ASP 43 7.145 -3.588 3.663 39 HB2 ASP 43 HB2 ASP 43 9.682 -4.097 3.301 40 HB3 ASP 43 HB1 ASP 43 9.864 -2.348 3.468 41 H GLN 44 HN GLN 44 8.116 -1.036 1.558 42 HA GLN 44 HA GLN 44 7.452 1.087 3.354 43 HB2 GLN 44 HB2 GLN 44 7.692 1.062 0.365 44 HB3 GLN 44 HB1 GLN 44 7.401 2.508 1.328 45 HG2 GLN 44 HG2 GLN 44 9.493 2.211 2.490 46 HG3 GLN 44 HG1 GLN 44 9.788 0.709 1.611 47 HE21 GLN 44 HE21 GLN 44 9.695 4.179 1.418 48 HE22 GLN 44 HE22 GLN 44 10.499 4.314 -0.099 49 H ALA 45 HN ALA 45 5.643 -1.040 1.567 50 HA ALA 45 HA ALA 45 3.242 0.367 1.360 51 HB1 ALA 45 HB1 ALA 45 3.661 -2.585 1.865 52 HB2 ALA 45 HB2 ALA 45 3.580 -1.801 0.288 53 HB3 ALA 45 HB3 ALA 45 2.151 -1.851 1.324 54 H LYS 46 HN LYS 46 4.909 -1.104 4.058 55 HA LYS 46 HA LYS 46 2.681 -1.019 5.917 56 HB2 LYS 46 HB2 LYS 46 5.649 -1.308 6.389 57 HB3 LYS 46 HB1 LYS 46 4.365 -1.699 7.521 58 HG2 LYS 46 HG2 LYS 46 3.687 -3.571 6.258 59 HG3 LYS 46 HG1 LYS 46 4.646 -3.069 4.864 60 HD2 LYS 46 HD2 LYS 46 6.697 -3.385 6.219 61 HD3 LYS 46 HD1 LYS 46 5.693 -3.996 7.536 62 HE2 LYS 46 HE2 LYS 46 4.984 -5.830 6.260 63 HE3 LYS 46 HE1 LYS 46 5.703 -5.194 4.774 64 HZ1 LYS 46 HZ1 LYS 46 7.133 -6.876 5.617 65 HZ2 LYS 46 HZ2 LYS 46 7.097 -6.251 7.173 66 HZ3 LYS 46 HZ3 LYS 46 7.901 -5.414 5.958 67 H VAL 47 HN VAL 47 5.295 0.962 4.775 68 HA VAL 47 HA VAL 47 5.335 2.860 6.933 69 HB VAL 47 HB VAL 47 6.331 3.143 4.081 70 HG11 VAL 47 HG11 VAL 47 6.923 4.840 6.500 71 HG12 VAL 47 HG12 VAL 47 5.997 5.307 5.069 72 HG13 VAL 47 HG13 VAL 47 7.724 4.977 4.931 73 HG21 VAL 47 HG21 VAL 47 7.457 1.337 5.347 74 HG22 VAL 47 HG22 VAL 47 7.946 2.554 6.551 75 HG23 VAL 47 HG23 VAL 47 8.485 2.687 4.877 76 H THR 48 HN THR 48 3.940 2.687 3.724 77 HA THR 48 HA THR 48 2.983 5.308 3.695 78 HB THR 48 HB THR 48 3.477 3.891 1.665 79 HG1 THR 48 HG1 THR 48 0.845 4.936 1.514 80 HG21 THR 48 HG21 THR 48 0.758 2.704 2.215 81 HG22 THR 48 HG22 THR 48 2.307 1.872 2.343 82 HG23 THR 48 HG23 THR 48 1.739 2.432 0.766 83 H VAL 49 HN VAL 49 1.430 2.255 4.699 84 HA VAL 49 HA VAL 49 -1.053 3.625 5.104 85 HB VAL 49 HB VAL 49 -1.941 1.600 6.068 86 HG11 VAL 49 HG11 VAL 49 -1.586 -0.008 4.266 87 HG12 VAL 49 HG12 VAL 49 -0.238 0.972 3.685 88 HG13 VAL 49 HG13 VAL 49 -1.874 1.633 3.694 89 HG21 VAL 49 HG21 VAL 49 -0.122 0.910 7.467 90 HG22 VAL 49 HG22 VAL 49 0.881 0.526 6.069 91 HG23 VAL 49 HG23 VAL 49 -0.568 -0.431 6.414 92 H ALA 50 HN ALA 50 1.762 2.891 6.987 93 HA ALA 50 HA ALA 50 0.803 3.172 9.562 94 HB1 ALA 50 HB1 ALA 50 3.057 3.602 10.194 95 HB2 ALA 50 HB2 ALA 50 3.479 4.039 8.542 96 HB3 ALA 50 HB3 ALA 50 3.062 2.372 8.928 97 H LYS 51 HN LYS 51 1.884 5.594 7.250 98 HA LYS 51 HA LYS 51 1.831 7.721 9.078 99 HB2 LYS 51 HB2 LYS 51 1.581 7.754 6.076 100 HB3 LYS 51 HB1 LYS 51 1.854 9.181 7.072 101 HG2 LYS 51 HG2 LYS 51 3.961 8.239 7.864 102 HG3 LYS 51 HG1 LYS 51 3.668 6.791 6.897 103 HD2 LYS 51 HD2 LYS 51 3.714 8.102 4.876 104 HD3 LYS 51 HD1 LYS 51 3.960 9.584 5.805 105 HE2 LYS 51 HE2 LYS 51 5.839 7.221 5.739 106 HE3 LYS 51 HE1 LYS 51 6.051 8.708 4.820 107 HZ1 LYS 51 HZ1 LYS 51 6.080 8.463 7.794 108 HZ2 LYS 51 HZ2 LYS 51 6.233 9.908 6.938 109 HZ3 LYS 51 HZ3 LYS 51 7.395 8.720 6.780 110 H GLY 52 HN GLY 52 -0.659 6.150 7.305 111 HA2 GLY 52 HA2 GLY 52 -2.609 8.236 7.742 112 HA3 GLY 52 HA1 GLY 52 -2.921 6.622 7.101 113 H ASP 53 HN ASP 53 -1.543 5.272 9.233 114 HA ASP 53 HA ASP 53 -3.758 5.217 11.050 115 HB2 ASP 53 HB2 ASP 53 -1.427 3.387 10.679 116 HB3 ASP 53 HB1 ASP 53 -2.457 3.271 12.107 117 H ILE 54 HN ILE 54 -0.492 6.312 11.253 118 HA ILE 54 HA ILE 54 -0.667 6.809 14.036 119 HB ILE 54 HB ILE 54 1.262 8.367 13.732 120 HG12 ILE 54 HG12 ILE 54 0.843 7.664 10.827 121 HG13 ILE 54 HG11 ILE 54 0.758 9.260 11.548 122 HG21 ILE 54 HG21 ILE 54 1.527 5.660 12.446 123 HG22 ILE 54 HG22 ILE 54 1.647 6.025 14.169 124 HG23 ILE 54 HG23 ILE 54 2.865 6.638 13.049 125 HD11 ILE 54 HD11 ILE 54 2.797 9.029 10.306 126 HD12 ILE 54 HD12 ILE 54 3.199 7.562 11.192 127 HD13 ILE 54 HD13 ILE 54 3.181 9.119 12.030 128 H LYS 55 HN LYS 55 -1.629 8.728 11.246 129 HA LYS 55 HA LYS 55 -2.229 11.072 12.792 130 HB2 LYS 55 HB2 LYS 55 -2.921 10.198 10.011 131 HB3 LYS 55 HB1 LYS 55 -3.858 11.486 10.735 132 HG2 LYS 55 HG2 LYS 55 -2.068 12.352 9.286 133 HG3 LYS 55 HG1 LYS 55 -1.865 12.865 10.955 134 HD2 LYS 55 HD2 LYS 55 -0.095 11.310 11.289 135 HD3 LYS 55 HD1 LYS 55 -0.416 10.519 9.743 136 HE2 LYS 55 HE2 LYS 55 1.556 11.961 9.607 137 HE3 LYS 55 HE1 LYS 55 0.271 12.544 8.558 138 HZ1 LYS 55 HZ1 LYS 55 0.867 13.668 11.256 139 HZ2 LYS 55 HZ2 LYS 55 -0.224 14.282 10.126 140 HZ3 LYS 55 HZ3 LYS 55 1.420 14.306 9.811 141 H ALA 56 HN ALA 56 -3.890 8.171 11.971 142 HA ALA 56 HA ALA 56 -6.516 8.783 12.759 143 HB1 ALA 56 HB1 ALA 56 -6.793 6.380 12.928 144 HB2 ALA 56 HB2 ALA 56 -5.044 6.178 12.975 145 HB3 ALA 56 HB3 ALA 56 -5.820 6.764 11.498 146 H ILE 57 HN ILE 57 -3.761 7.448 14.485 147 HA ILE 57 HA ILE 57 -5.001 6.989 16.946 148 HB ILE 57 HB ILE 57 -2.096 7.669 16.425 149 HG12 ILE 57 HG12 ILE 57 -3.440 4.987 16.696 150 HG13 ILE 57 HG11 ILE 57 -3.063 5.744 15.155 151 HG21 ILE 57 HG21 ILE 57 -3.448 6.312 18.776 152 HG22 ILE 57 HG22 ILE 57 -2.682 7.900 18.796 153 HG23 ILE 57 HG23 ILE 57 -1.706 6.450 18.550 154 HD11 ILE 57 HD11 ILE 57 -1.037 4.982 17.247 155 HD12 ILE 57 HD12 ILE 57 -0.729 5.663 15.647 156 HD13 ILE 57 HD13 ILE 57 -1.458 4.072 15.792 157 H ALA 58 HN ALA 58 -3.395 9.822 15.632 158 HA ALA 58 HA ALA 58 -3.388 11.420 17.922 159 HB1 ALA 58 HB1 ALA 58 -3.268 13.330 16.437 160 HB2 ALA 58 HB2 ALA 58 -3.798 12.322 15.087 161 HB3 ALA 58 HB3 ALA 58 -2.243 12.013 15.864 162 H ALA 59 HN ALA 59 -6.006 10.728 15.673 163 HA ALA 59 HA ALA 59 -7.727 12.757 16.690 164 HB1 ALA 59 HB1 ALA 59 -9.495 11.616 15.416 165 HB2 ALA 59 HB2 ALA 59 -8.384 10.278 15.095 166 HB3 ALA 59 HB3 ALA 59 -8.050 11.884 14.448 167 H ALA 60 HN ALA 60 -7.121 9.396 17.424 168 HA ALA 60 HA ALA 60 -9.307 9.234 19.308 169 HB1 ALA 60 HB1 ALA 60 -8.522 7.195 18.193 170 HB2 ALA 60 HB2 ALA 60 -8.324 7.068 19.953 171 HB3 ALA 60 HB3 ALA 60 -6.936 7.409 18.937 172 H LEU 61 HN LEU 61 -5.939 10.015 19.396 173 HA LEU 61 HA LEU 61 -5.587 10.042 22.209 174 HB2 LEU 61 HB2 LEU 61 -3.913 10.040 20.163 175 HB3 LEU 61 HB1 LEU 61 -4.113 11.768 20.229 176 HG LEU 61 HG LEU 61 -2.040 10.856 21.312 177 HD11 LEU 61 HD11 LEU 61 -3.893 12.362 23.122 178 HD12 LEU 61 HD12 LEU 61 -2.847 13.062 21.887 179 HD13 LEU 61 HD13 LEU 61 -2.142 12.260 23.289 180 HD21 LEU 61 HD21 LEU 61 -3.042 8.864 22.311 181 HD22 LEU 61 HD22 LEU 61 -3.947 9.918 23.419 182 HD23 LEU 61 HD23 LEU 61 -2.192 9.864 23.495 183 H ASP 62 HN ASP 62 -6.820 12.272 19.837 184 HA ASP 62 HA ASP 62 -7.164 14.479 21.576 185 HB2 ASP 62 HB2 ASP 62 -8.502 13.744 18.996 186 HB3 ASP 62 HB1 ASP 62 -9.040 15.125 19.937 187 H MET 63 HN MET 63 -8.914 11.550 21.152 188 HA MET 63 HA MET 63 -11.206 12.677 22.444 189 HB2 MET 63 HB2 MET 63 -10.603 9.812 21.725 190 HB3 MET 63 HB1 MET 63 -12.098 10.304 22.519 191 HG2 MET 63 HG2 MET 63 -12.527 11.791 20.551 192 HG3 MET 63 HG1 MET 63 -11.133 11.050 19.768 193 HE1 MET 63 HE1 MET 63 -11.382 8.029 20.796 194 HE2 MET 63 HE2 MET 63 -11.061 8.389 19.090 195 HE3 MET 63 HE3 MET 63 -12.359 7.294 19.527 196 H TYR 64 HN TYR 64 -8.465 10.735 23.353 197 HA TYR 64 HA TYR 64 -9.139 10.416 26.112 198 HB2 TYR 64 HB2 TYR 64 -7.224 9.297 25.090 199 HB3 TYR 64 HB1 TYR 64 -6.451 10.860 24.819 200 HD1 TYR 64 HD2 TYR 64 -7.624 8.519 27.524 201 HD2 TYR 64 HD1 TYR 64 -5.282 11.972 26.573 202 HE1 TYR 64 HE2 TYR 64 -6.628 8.369 29.554 203 HE2 TYR 64 HE1 TYR 64 -4.267 11.823 28.741 204 HH TYR 64 HH TYR 64 -4.844 9.049 30.659 205 H LYS 65 HN LYS 65 -7.605 12.968 24.176 206 HA LYS 65 HA LYS 65 -6.939 14.780 26.097 207 HB2 LYS 65 HB2 LYS 65 -6.366 15.132 23.789 208 HB3 LYS 65 HB1 LYS 65 -8.064 15.236 23.349 209 HG2 LYS 65 HG2 LYS 65 -8.310 17.226 24.572 210 HG3 LYS 65 HG1 LYS 65 -6.605 17.216 25.090 211 HD2 LYS 65 HD2 LYS 65 -6.709 18.719 23.236 212 HD3 LYS 65 HD1 LYS 65 -6.073 17.216 22.576 213 HE2 LYS 65 HE2 LYS 65 -8.360 16.611 21.833 214 HE3 LYS 65 HE1 LYS 65 -8.941 18.161 22.435 215 HZ1 LYS 65 HZ1 LYS 65 -7.040 17.667 20.233 216 HZ2 LYS 65 HZ2 LYS 65 -7.367 19.222 20.854 217 HZ3 LYS 65 HZ3 LYS 65 -8.592 18.328 20.126 218 H LEU 66 HN LEU 66 -10.103 14.160 24.662 219 HA LEU 66 HA LEU 66 -11.222 16.166 26.387 220 HB2 LEU 66 HB2 LEU 66 -12.429 14.491 24.242 221 HB3 LEU 66 HB1 LEU 66 -13.458 15.247 25.438 222 HG LEU 66 HG LEU 66 -13.480 16.625 23.550 223 HD11 LEU 66 HD11 LEU 66 -11.630 17.926 25.522 224 HD12 LEU 66 HD12 LEU 66 -13.382 17.824 25.633 225 HD13 LEU 66 HD13 LEU 66 -12.635 18.744 24.327 226 HD21 LEU 66 HD21 LEU 66 -11.478 17.603 22.509 227 HD22 LEU 66 HD22 LEU 66 -11.514 15.846 22.374 228 HD23 LEU 66 HD23 LEU 66 -10.469 16.618 23.567 229 H ASP 67 HN ASP 67 -10.841 12.679 26.457 230 HA ASP 67 HA ASP 67 -12.911 12.298 28.396 231 HB2 ASP 67 HB2 ASP 67 -12.273 10.477 27.005 232 HB3 ASP 67 HB1 ASP 67 -10.608 10.513 27.599 233 H ASN 68 HN ASN 68 -9.481 13.065 28.566 234 HA ASN 68 HA ASN 68 -9.828 13.325 31.504 235 HB2 ASN 68 HB2 ASN 68 -7.293 12.664 30.008 236 HB3 ASN 68 HB1 ASN 68 -7.402 13.341 31.635 237 HD21 ASN 68 HD21 ASN 68 -9.626 10.842 30.459 238 HD22 ASN 68 HD22 ASN 68 -9.019 9.630 31.479 239 H PHE 69 HN PHE 69 -10.361 15.046 29.238 240 HA PHE 69 HA PHE 69 -10.163 17.264 28.643 241 HB2 PHE 69 HB2 PHE 69 -10.291 18.762 30.733 242 HB3 PHE 69 HB1 PHE 69 -11.564 17.574 30.492 243 HD1 PHE 69 HD2 PHE 69 -8.522 18.273 32.341 244 HD2 PHE 69 HD1 PHE 69 -11.900 15.869 32.031 245 HE1 PHE 69 HE2 PHE 69 -8.051 17.406 34.589 246 HE2 PHE 69 HE1 PHE 69 -11.513 14.931 34.247 247 HZ PHE 69 HZ PHE 69 -9.554 15.696 35.566 248 H ALA 70 HN ALA 70 -7.655 15.996 28.486 249 HA ALA 70 HA ALA 70 -5.783 18.062 28.329 250 HB1 ALA 70 HB1 ALA 70 -4.389 17.423 30.270 251 HB2 ALA 70 HB2 ALA 70 -5.681 16.297 30.757 252 HB3 ALA 70 HB3 ALA 70 -5.988 18.016 30.785 253 H TYR 71 HN TYR 71 -3.861 17.202 27.520 254 HA TYR 71 HA TYR 71 -3.970 14.540 26.562 255 HB2 TYR 71 HB2 TYR 71 -1.921 16.732 26.501 256 HB3 TYR 71 HB1 TYR 71 -1.495 15.111 25.981 257 HD1 TYR 71 HD1 TYR 71 -3.812 14.208 24.506 258 HD2 TYR 71 HD2 TYR 71 -2.054 18.068 24.666 259 HE1 TYR 71 HE1 TYR 71 -4.633 14.600 22.324 260 HE2 TYR 71 HE2 TYR 71 -2.863 18.535 22.403 261 HH TYR 71 HH TYR 71 -5.088 16.459 20.680 262 HA PRO 72 HA PRO 72 -2.293 12.318 29.929 263 HB2 PRO 72 HB2 PRO 72 -0.430 10.711 28.715 264 HB3 PRO 72 HB1 PRO 72 -2.172 10.438 28.606 265 HG2 PRO 72 HG2 PRO 72 -0.334 11.777 26.659 266 HG3 PRO 72 HG1 PRO 72 -1.609 10.585 26.354 267 HD2 PRO 72 HD2 PRO 72 -2.025 13.164 25.916 268 HD3 PRO 72 HD1 PRO 72 -3.294 12.130 26.596 269 H SER 73 HN SER 73 -0.425 12.258 31.434 270 HA SER 73 HA SER 73 1.764 13.958 30.590 271 HB2 SER 73 HB2 SER 73 2.463 13.710 32.990 272 HB3 SER 73 HB1 SER 73 0.823 14.324 32.840 273 HG SER 73 HG SER 73 0.426 12.803 34.145 274 H THR 74 HN THR 74 4.007 12.950 30.803 275 HA THR 74 HA THR 74 3.760 10.424 29.515 276 HB THR 74 HB THR 74 5.542 12.334 29.107 277 HG1 THR 74 HG1 THR 74 6.478 9.663 28.993 278 HG21 THR 74 HG21 THR 74 7.730 11.825 30.133 279 HG22 THR 74 HG22 THR 74 6.979 10.523 31.063 280 HG23 THR 74 HG23 THR 74 6.526 12.185 31.381 281 H GLN 75 HN GLN 75 3.886 11.275 32.706 282 HA GLN 75 HA GLN 75 4.720 8.599 33.464 283 HB2 GLN 75 HB2 GLN 75 4.329 11.143 34.982 284 HB3 GLN 75 HB1 GLN 75 4.545 9.604 35.830 285 HG2 GLN 75 HG2 GLN 75 6.729 9.368 34.791 286 HG3 GLN 75 HG1 GLN 75 6.472 10.843 33.867 287 HE21 GLN 75 HE21 GLN 75 6.654 12.780 34.864 288 HE22 GLN 75 HE22 GLN 75 7.326 13.001 36.441 289 H GLN 76 HN GLN 76 1.981 10.849 34.427 290 HA GLN 76 HA GLN 76 0.497 8.474 35.198 291 HB2 GLN 76 HB2 GLN 76 -0.142 11.382 35.450 292 HB3 GLN 76 HB1 GLN 76 -1.318 10.135 35.715 293 HG2 GLN 76 HG2 GLN 76 1.270 10.226 37.226 294 HG3 GLN 76 HG1 GLN 76 -0.245 10.903 37.828 295 HE21 GLN 76 HE21 GLN 76 1.511 7.983 37.140 296 HE22 GLN 76 HE22 GLN 76 0.418 6.907 37.917 297 H GLY 77 HN GLY 77 0.396 10.804 32.632 298 HA2 GLY 77 HA2 GLY 77 -2.094 9.763 31.718 299 HA3 GLY 77 HA1 GLY 77 -0.993 10.724 30.756 300 H LEU 78 HN LEU 78 1.216 8.745 31.419 301 HA LEU 78 HA LEU 78 0.792 7.020 29.164 302 HB2 LEU 78 HB2 LEU 78 3.027 7.908 30.227 303 HB3 LEU 78 HB1 LEU 78 2.858 6.554 31.312 304 HG LEU 78 HG LEU 78 3.196 6.378 28.313 305 HD11 LEU 78 HD11 LEU 78 5.171 7.131 29.409 306 HD12 LEU 78 HD12 LEU 78 5.393 5.467 28.864 307 HD13 LEU 78 HD13 LEU 78 5.075 5.808 30.566 308 HD21 LEU 78 HD21 LEU 78 1.892 4.483 29.157 309 HD22 LEU 78 HD22 LEU 78 3.124 4.182 30.381 310 HD23 LEU 78 HD23 LEU 78 3.509 3.961 28.677 311 H GLU 79 HN GLU 79 0.873 6.694 32.652 312 HA GLU 79 HA GLU 79 0.045 4.034 32.856 313 HB2 GLU 79 HB2 GLU 79 0.393 6.284 34.628 314 HB3 GLU 79 HB1 GLU 79 -1.063 5.386 35.037 315 HG2 GLU 79 HG2 GLU 79 1.706 4.232 34.772 316 HG3 GLU 79 HG1 GLU 79 0.856 4.575 36.284 317 H ALA 80 HN ALA 80 -1.717 6.987 32.459 318 HA ALA 80 HA ALA 80 -4.280 5.724 32.733 319 HB1 ALA 80 HB1 ALA 80 -5.158 7.953 32.386 320 HB2 ALA 80 HB2 ALA 80 -3.548 8.495 31.894 321 HB3 ALA 80 HB3 ALA 80 -3.811 8.011 33.548 322 H LEU 81 HN LEU 81 -2.114 5.896 30.220 323 HA LEU 81 HA LEU 81 -4.181 5.758 28.162 324 HB2 LEU 81 HB2 LEU 81 -1.180 5.586 28.052 325 HB3 LEU 81 HB1 LEU 81 -2.174 5.225 26.667 326 HG LEU 81 HG LEU 81 -1.963 7.897 28.070 327 HD11 LEU 81 HD11 LEU 81 -0.935 6.977 25.388 328 HD12 LEU 81 HD12 LEU 81 0.043 7.317 26.812 329 HD13 LEU 81 HD13 LEU 81 -0.837 8.618 26.018 330 HD21 LEU 81 HD21 LEU 81 -4.198 7.580 27.130 331 HD22 LEU 81 HD22 LEU 81 -3.496 7.117 25.581 332 HD23 LEU 81 HD23 LEU 81 -3.289 8.759 26.187 333 H VAL 82 HN VAL 82 -2.183 3.770 30.082 334 HA VAL 82 HA VAL 82 -2.899 1.419 28.484 335 HB VAL 82 HB VAL 82 -0.849 1.620 30.699 336 HG11 VAL 82 HG11 VAL 82 0.017 -0.481 29.789 337 HG12 VAL 82 HG12 VAL 82 -1.291 -0.509 28.607 338 HG13 VAL 82 HG13 VAL 82 -1.655 -0.661 30.325 339 HG21 VAL 82 HG21 VAL 82 -0.242 3.077 28.857 340 HG22 VAL 82 HG22 VAL 82 -0.510 1.794 27.704 341 HG23 VAL 82 HG23 VAL 82 0.820 1.668 28.866 342 H LYS 83 HN LYS 83 -3.146 2.741 31.728 343 HA LYS 83 HA LYS 83 -4.988 0.581 32.484 344 HB2 LYS 83 HB2 LYS 83 -2.781 0.725 33.753 345 HB3 LYS 83 HB1 LYS 83 -3.248 2.320 34.274 346 HG2 LYS 83 HG2 LYS 83 -5.217 1.358 35.410 347 HG3 LYS 83 HG1 LYS 83 -4.685 -0.246 34.923 348 HD2 LYS 83 HD2 LYS 83 -3.048 1.632 36.641 349 HD3 LYS 83 HD1 LYS 83 -4.113 0.401 37.292 350 HE2 LYS 83 HE2 LYS 83 -1.881 -0.465 37.363 351 HE3 LYS 83 HE1 LYS 83 -2.724 -1.313 36.082 352 HZ1 LYS 83 HZ1 LYS 83 -0.933 1.015 35.570 353 HZ2 LYS 83 HZ2 LYS 83 -1.481 -0.151 34.447 354 HZ3 LYS 83 HZ3 LYS 83 -0.395 -0.567 35.636 355 H LYS 84 HN LYS 84 -6.884 1.376 33.569 356 HA LYS 84 HA LYS 84 -7.989 3.731 32.541 357 HB2 LYS 84 HB2 LYS 84 -8.770 2.243 35.059 358 HB3 LYS 84 HB1 LYS 84 -9.771 3.427 34.222 359 HG2 LYS 84 HG2 LYS 84 -9.867 2.008 32.264 360 HG3 LYS 84 HG1 LYS 84 -8.794 0.842 33.024 361 HD2 LYS 84 HD2 LYS 84 -11.039 0.036 33.186 362 HD3 LYS 84 HD1 LYS 84 -10.512 0.521 34.798 363 HE2 LYS 84 HE2 LYS 84 -11.722 2.628 34.549 364 HE3 LYS 84 HE1 LYS 84 -12.224 2.146 32.928 365 HZ1 LYS 84 HZ1 LYS 84 -12.957 0.811 35.471 366 HZ2 LYS 84 HZ2 LYS 84 -13.326 0.222 33.942 367 HZ3 LYS 84 HZ3 LYS 84 -13.979 1.693 34.448 368 HA PRO 85 HA PRO 85 -5.996 7.046 34.534 369 HB2 PRO 85 HB2 PRO 85 -8.027 8.892 34.296 370 HB3 PRO 85 HB1 PRO 85 -6.990 8.403 32.953 371 HG2 PRO 85 HG2 PRO 85 -9.680 7.379 33.695 372 HG3 PRO 85 HG1 PRO 85 -9.063 7.898 32.113 373 HD2 PRO 85 HD2 PRO 85 -9.197 5.346 32.688 374 HD3 PRO 85 HD1 PRO 85 -7.756 5.989 31.871 375 H THR 86 HN THR 86 -5.926 8.250 36.396 376 HA THR 86 HA THR 86 -7.643 7.338 38.524 377 HB THR 86 HB THR 86 -5.952 8.619 39.957 378 HG1 THR 86 HG1 THR 86 -3.877 8.778 38.627 379 HG21 THR 86 HG21 THR 86 -4.898 6.424 38.165 380 HG22 THR 86 HG22 THR 86 -5.832 6.186 39.639 381 HG23 THR 86 HG23 THR 86 -4.218 6.890 39.723 382 H GLY 87 HN GLY 87 -9.043 8.647 39.645 383 HA2 GLY 87 HA2 GLY 87 -9.929 10.747 40.295 384 HA3 GLY 87 HA1 GLY 87 -9.214 11.461 38.850 385 H ASN 88 HN ASN 88 -11.535 12.358 38.432 386 HA ASN 88 HA ASN 88 -13.135 10.284 37.338 387 HB2 ASN 88 HB2 ASN 88 -14.322 11.325 39.063 388 HB3 ASN 88 HB1 ASN 88 -13.638 12.902 38.710 389 HD21 ASN 88 HD21 ASN 88 -14.496 14.118 37.185 390 HD22 ASN 88 HD22 ASN 88 -15.978 13.771 36.418 391 HA PRO 89 HA PRO 89 -11.856 12.601 33.669 392 HB2 PRO 89 HB2 PRO 89 -12.122 10.225 32.070 393 HB3 PRO 89 HB1 PRO 89 -10.640 10.876 32.665 394 HG2 PRO 89 HG2 PRO 89 -11.770 8.482 33.517 395 HG3 PRO 89 HG1 PRO 89 -10.509 9.386 34.371 396 HD2 PRO 89 HD2 PRO 89 -13.447 9.278 34.870 397 HD3 PRO 89 HD1 PRO 89 -12.082 9.365 36.013 398 H GLN 90 HN GLN 90 -13.020 12.969 31.606 399 HA GLN 90 HA GLN 90 -15.885 12.867 32.071 400 HB2 GLN 90 HB2 GLN 90 -14.215 14.560 30.217 401 HB3 GLN 90 HB1 GLN 90 -15.970 14.498 30.112 402 HG2 GLN 90 HG2 GLN 90 -14.384 15.360 32.518 403 HG3 GLN 90 HG1 GLN 90 -15.226 16.429 31.392 404 HE21 GLN 90 HE21 GLN 90 -15.622 16.051 34.253 405 HE22 GLN 90 HE22 GLN 90 -17.265 15.583 34.463 406 HA PRO 91 HA PRO 91 -15.870 9.134 29.909 407 HB2 PRO 91 HB2 PRO 91 -18.560 9.088 29.276 408 HB3 PRO 91 HB1 PRO 91 -17.818 8.510 30.765 409 HG2 PRO 91 HG2 PRO 91 -19.166 11.104 30.202 410 HG3 PRO 91 HG1 PRO 91 -19.193 10.121 31.674 411 HD2 PRO 91 HD2 PRO 91 -17.726 12.334 31.487 412 HD3 PRO 91 HD1 PRO 91 -17.141 10.921 32.393 413 H LYS 92 HN LYS 92 -14.669 9.480 28.071 414 HA LYS 92 HA LYS 92 -16.395 9.196 25.751 415 HB2 LYS 92 HB2 LYS 92 -13.816 10.782 25.800 416 HB3 LYS 92 HB1 LYS 92 -14.505 10.134 24.322 417 HG2 LYS 92 HG2 LYS 92 -16.542 11.440 24.753 418 HG3 LYS 92 HG1 LYS 92 -15.727 12.085 26.190 419 HD2 LYS 92 HD2 LYS 92 -14.079 13.162 24.885 420 HD3 LYS 92 HD1 LYS 92 -14.602 12.341 23.415 421 HE2 LYS 92 HE2 LYS 92 -16.294 14.281 24.986 422 HE3 LYS 92 HE1 LYS 92 -15.348 14.707 23.562 423 HZ1 LYS 92 HZ1 LYS 92 -17.531 12.684 23.611 424 HZ2 LYS 92 HZ2 LYS 92 -16.670 13.203 22.247 425 HZ3 LYS 92 HZ3 LYS 92 -17.687 14.263 23.053 426 H ASN 93 HN ASN 93 -16.354 7.143 26.168 427 HA ASN 93 HA ASN 93 -15.447 5.065 26.724 428 HB2 ASN 93 HB2 ASN 93 -16.522 5.329 24.438 429 HB3 ASN 93 HB1 ASN 93 -14.897 5.292 23.788 430 HD21 ASN 93 HD21 ASN 93 -17.180 3.524 23.548 431 HD22 ASN 93 HD22 ASN 93 -16.608 1.941 23.972 432 H TRP 94 HN TRP 94 -13.567 5.413 28.043 433 HA TRP 94 HA TRP 94 -11.060 5.891 27.108 434 HB2 TRP 94 HB2 TRP 94 -11.646 5.922 29.465 435 HB3 TRP 94 HB1 TRP 94 -11.850 4.172 29.465 436 HD1 TRP 94 HD1 TRP 94 -9.074 6.866 29.311 437 HE1 TRP 94 HE1 TRP 94 -6.811 5.709 29.748 438 HE3 TRP 94 HE3 TRP 94 -10.617 1.981 29.412 439 HZ2 TRP 94 HZ2 TRP 94 -5.828 3.122 30.095 440 HZ3 TRP 94 HZ3 TRP 94 -8.942 0.230 29.815 441 HH2 TRP 94 HH2 TRP 94 -6.597 0.794 30.148 442 H ASN 95 HN ASN 95 -9.454 4.739 26.348 443 HA ASN 95 HA ASN 95 -9.999 1.996 25.840 444 HB2 ASN 95 HB2 ASN 95 -10.558 3.047 23.784 445 HB3 ASN 95 HB1 ASN 95 -9.115 4.038 23.832 446 HD21 ASN 95 HD21 ASN 95 -9.153 0.518 24.459 447 HD22 ASN 95 HD22 ASN 95 -8.153 0.176 23.093 448 H LYS 96 HN LYS 96 -8.159 0.732 26.357 449 HA LYS 96 HA LYS 96 -5.816 2.001 27.367 450 HB2 LYS 96 HB2 LYS 96 -4.905 -0.150 27.734 451 HB3 LYS 96 HB1 LYS 96 -6.606 -0.222 28.200 452 HG2 LYS 96 HG2 LYS 96 -7.140 -1.401 26.159 453 HG3 LYS 96 HG1 LYS 96 -5.500 -1.101 25.568 454 HD2 LYS 96 HD2 LYS 96 -6.088 -2.665 28.036 455 HD3 LYS 96 HD1 LYS 96 -5.919 -3.438 26.449 456 HE2 LYS 96 HE2 LYS 96 -3.635 -2.175 26.397 457 HE3 LYS 96 HE1 LYS 96 -3.875 -2.012 28.132 458 HZ1 LYS 96 HZ1 LYS 96 -3.808 -4.565 26.640 459 HZ2 LYS 96 HZ2 LYS 96 -4.013 -4.425 28.303 460 HZ3 LYS 96 HZ3 LYS 96 -2.555 -3.966 27.591 461 H ASP 97 HN ASP 97 -3.712 1.216 26.676 462 HA ASP 97 HA ASP 97 -1.998 0.936 25.331 463 HB2 ASP 97 HB2 ASP 97 -3.429 -1.093 24.571 464 HB3 ASP 97 HB1 ASP 97 -3.773 -0.127 23.143 465 H GLY 98 HN GLY 98 -3.730 3.234 25.309 466 HA2 GLY 98 HA2 GLY 98 -2.568 5.260 24.798 467 HA3 GLY 98 HA1 GLY 98 -2.003 4.512 23.332 468 H TYR 99 HN TYR 99 -5.328 4.070 24.005 469 HA TYR 99 HA TYR 99 -7.176 4.715 22.952 470 HB2 TYR 99 HB2 TYR 99 -5.853 7.265 23.539 471 HB3 TYR 99 HB1 TYR 99 -6.915 7.391 22.126 472 HD1 TYR 99 HD1 TYR 99 -6.676 6.308 25.629 473 HD2 TYR 99 HD2 TYR 99 -9.128 7.716 22.478 474 HE1 TYR 99 HE1 TYR 99 -8.489 6.709 27.216 475 HE2 TYR 99 HE2 TYR 99 -10.948 8.118 24.056 476 HH TYR 99 HH TYR 99 -11.631 7.509 26.166 477 H LEU 100 HN LEU 100 -7.171 3.409 21.325 478 HA LEU 100 HA LEU 100 -6.024 4.339 18.805 479 HB2 LEU 100 HB2 LEU 100 -6.311 1.557 19.868 480 HB3 LEU 100 HB1 LEU 100 -6.038 1.907 18.184 481 HG LEU 100 HG LEU 100 -4.154 2.474 20.466 482 HD11 LEU 100 HD11 LEU 100 -4.304 0.142 19.738 483 HD12 LEU 100 HD12 LEU 100 -2.750 0.850 19.275 484 HD13 LEU 100 HD13 LEU 100 -4.036 0.649 18.076 485 HD21 LEU 100 HD21 LEU 100 -4.013 3.115 17.542 486 HD22 LEU 100 HD22 LEU 100 -2.630 3.195 18.639 487 HD23 LEU 100 HD23 LEU 100 -4.018 4.267 18.873 488 H LYS 101 HN LYS 101 -6.959 3.269 17.025 489 HA LYS 101 HA LYS 101 -9.861 3.430 16.996 490 HB2 LYS 101 HB2 LYS 101 -7.834 3.053 14.771 491 HB3 LYS 101 HB1 LYS 101 -9.539 3.344 14.560 492 HG2 LYS 101 HG2 LYS 101 -7.730 5.308 15.914 493 HG3 LYS 101 HG1 LYS 101 -7.967 5.280 14.170 494 HD2 LYS 101 HD2 LYS 101 -10.460 5.484 14.620 495 HD3 LYS 101 HD1 LYS 101 -10.034 5.804 16.306 496 HE2 LYS 101 HE2 LYS 101 -8.809 7.765 15.700 497 HE3 LYS 101 HE1 LYS 101 -8.952 7.385 13.989 498 HZ1 LYS 101 HZ1 LYS 101 -11.166 8.252 15.804 499 HZ2 LYS 101 HZ2 LYS 101 -11.378 7.693 14.237 500 HZ3 LYS 101 HZ3 LYS 101 -10.516 9.090 14.488 501 H LYS 102 HN LYS 102 -10.257 1.693 14.944 502 HA LYS 102 HA LYS 102 -10.363 -0.891 16.188 503 HB2 LYS 102 HB2 LYS 102 -11.753 -1.577 14.396 504 HB3 LYS 102 HB1 LYS 102 -12.168 0.079 14.764 505 HG2 LYS 102 HG2 LYS 102 -10.497 -0.825 12.415 506 HG3 LYS 102 HG1 LYS 102 -12.215 -0.455 12.334 507 HD2 LYS 102 HD2 LYS 102 -11.415 1.565 11.606 508 HD3 LYS 102 HD1 LYS 102 -11.275 1.857 13.340 509 HE2 LYS 102 HE2 LYS 102 -9.226 2.544 12.280 510 HE3 LYS 102 HE1 LYS 102 -8.924 1.095 13.234 511 HZ1 LYS 102 HZ1 LYS 102 -7.838 0.985 11.041 512 HZ2 LYS 102 HZ2 LYS 102 -9.337 1.164 10.300 513 HZ3 LYS 102 HZ3 LYS 102 -9.012 -0.214 11.182 514 H LEU 103 HN LEU 103 -7.642 -0.088 15.562 515 HA LEU 103 HA LEU 103 -6.986 -1.912 13.368 516 HB2 LEU 103 HB2 LEU 103 -5.063 -0.682 12.812 517 HB3 LEU 103 HB1 LEU 103 -6.326 0.500 13.049 518 HG LEU 103 HG LEU 103 -4.159 -0.119 15.074 519 HD11 LEU 103 HD11 LEU 103 -4.385 2.145 13.118 520 HD12 LEU 103 HD12 LEU 103 -3.227 0.818 13.057 521 HD13 LEU 103 HD13 LEU 103 -3.165 1.982 14.380 522 HD21 LEU 103 HD21 LEU 103 -6.173 0.850 16.084 523 HD22 LEU 103 HD22 LEU 103 -6.104 2.171 14.911 524 HD23 LEU 103 HD23 LEU 103 -4.823 1.983 16.098 525 HA PRO 104 HA PRO 104 -4.576 -4.394 16.259 526 HB2 PRO 104 HB2 PRO 104 -2.894 -5.104 13.945 527 HB3 PRO 104 HB1 PRO 104 -3.916 -6.156 14.925 528 HG2 PRO 104 HG2 PRO 104 -4.554 -5.554 12.397 529 HG3 PRO 104 HG1 PRO 104 -5.791 -5.747 13.651 530 HD2 PRO 104 HD2 PRO 104 -4.635 -3.231 12.512 531 HD3 PRO 104 HD1 PRO 104 -6.325 -3.649 12.875 532 H VAL 105 HN VAL 105 -1.914 -4.862 16.169 533 HA VAL 105 HA VAL 105 -0.829 -2.242 16.620 534 HB VAL 105 HB VAL 105 -0.394 -4.391 17.964 535 HG11 VAL 105 HG11 VAL 105 1.633 -4.903 15.816 536 HG12 VAL 105 HG12 VAL 105 0.233 -5.900 16.211 537 HG13 VAL 105 HG13 VAL 105 1.553 -5.730 17.369 538 HG21 VAL 105 HG21 VAL 105 0.748 -2.291 18.433 539 HG22 VAL 105 HG22 VAL 105 1.973 -2.683 17.235 540 HG23 VAL 105 HG23 VAL 105 1.754 -3.716 18.663 541 H ASP 106 HN ASP 106 1.592 -1.861 15.584 542 HA ASP 106 HA ASP 106 0.880 -1.742 12.785 543 HB2 ASP 106 HB2 ASP 106 2.084 0.138 14.335 544 HB3 ASP 106 HB1 ASP 106 3.527 -0.678 13.735 545 HA PRO 107 HA PRO 107 3.294 -5.073 10.995 546 HB2 PRO 107 HB2 PRO 107 4.535 -2.826 9.496 547 HB3 PRO 107 HB1 PRO 107 4.009 -4.406 8.925 548 HG2 PRO 107 HG2 PRO 107 2.461 -2.273 8.534 549 HG3 PRO 107 HG1 PRO 107 1.754 -3.836 8.984 550 HD2 PRO 107 HD2 PRO 107 2.115 -1.389 10.636 551 HD3 PRO 107 HD1 PRO 107 0.881 -2.663 10.745 552 H TRP 108 HN TRP 108 5.534 -5.574 10.444 553 HA TRP 108 HA TRP 108 7.605 -5.988 10.935 554 HB2 TRP 108 HB2 TRP 108 7.866 -3.407 12.517 555 HB3 TRP 108 HB1 TRP 108 9.156 -4.328 11.766 556 HD1 TRP 108 HD1 TRP 108 8.847 -4.397 8.939 557 HE1 TRP 108 HE1 TRP 108 8.374 -2.363 7.404 558 HE3 TRP 108 HE3 TRP 108 6.851 -1.295 12.404 559 HZ2 TRP 108 HZ2 TRP 108 7.227 0.246 7.688 560 HZ3 TRP 108 HZ3 TRP 108 6.078 0.943 11.731 561 HH2 TRP 108 HH2 TRP 108 6.238 1.692 9.472 562 H GLY 109 HN GLY 109 5.243 -6.158 12.785 563 HA2 GLY 109 HA2 GLY 109 4.621 -7.023 14.844 564 HA3 GLY 109 HA1 GLY 109 6.265 -7.645 14.966 565 H ASN 110 HN ASN 110 5.763 -4.236 14.621 566 HA ASN 110 HA ASN 110 6.914 -3.847 17.222 567 HB2 ASN 110 HB2 ASN 110 6.653 -1.981 14.871 568 HB3 ASN 110 HB1 ASN 110 7.287 -1.492 16.436 569 HD21 ASN 110 HD21 ASN 110 8.614 -1.495 13.883 570 HD22 ASN 110 HD22 ASN 110 9.975 -2.543 14.008 571 HA PRO 111 HA PRO 111 3.069 -2.428 19.056 572 HB2 PRO 111 HB2 PRO 111 5.131 -1.632 21.031 573 HB3 PRO 111 HB1 PRO 111 3.602 -2.479 21.288 574 HG2 PRO 111 HG2 PRO 111 5.897 -3.802 21.417 575 HG3 PRO 111 HG1 PRO 111 4.482 -4.529 20.630 576 HD2 PRO 111 HD2 PRO 111 6.912 -3.314 19.404 577 HD3 PRO 111 HD1 PRO 111 5.955 -4.715 18.895 578 H TYR 112 HN TYR 112 2.199 -0.411 19.096 579 HA TYR 112 HA TYR 112 3.729 1.739 18.038 580 HB2 TYR 112 HB2 TYR 112 0.963 1.584 19.264 581 HB3 TYR 112 HB1 TYR 112 1.703 3.126 18.910 582 HD1 TYR 112 HD1 TYR 112 2.309 3.597 16.432 583 HD2 TYR 112 HD2 TYR 112 -0.292 0.436 17.618 584 HE1 TYR 112 HE1 TYR 112 1.277 3.621 14.191 585 HE2 TYR 112 HE2 TYR 112 -1.326 0.444 15.378 586 HH TYR 112 HH TYR 112 -0.138 2.160 12.619 587 H GLN 113 HN GLN 113 4.525 3.441 19.131 588 HA GLN 113 HA GLN 113 5.004 2.956 21.995 589 HB2 GLN 113 HB2 GLN 113 6.459 5.210 20.771 590 HB3 GLN 113 HB1 GLN 113 7.055 3.962 21.831 591 HG2 GLN 113 HG2 GLN 113 6.675 3.723 18.858 592 HG3 GLN 113 HG1 GLN 113 8.186 4.080 19.661 593 HE21 GLN 113 HE21 GLN 113 7.738 2.097 21.778 594 HE22 GLN 113 HE22 GLN 113 7.953 0.562 21.024 595 H TYR 114 HN TYR 114 3.836 4.190 23.322 596 HA TYR 114 HA TYR 114 2.848 6.734 22.296 597 HB2 TYR 114 HB2 TYR 114 1.143 6.379 24.303 598 HB3 TYR 114 HB1 TYR 114 0.861 5.673 22.725 599 HD1 TYR 114 HD1 TYR 114 2.880 4.565 25.732 600 HD2 TYR 114 HD2 TYR 114 -0.180 3.620 22.939 601 HE1 TYR 114 HE1 TYR 114 2.603 2.332 26.765 602 HE2 TYR 114 HE2 TYR 114 -0.445 1.417 23.975 603 HH TYR 114 HH TYR 114 0.531 -0.069 25.266 604 H LEU 115 HN LEU 115 3.783 8.451 23.071 605 HA LEU 115 HA LEU 115 4.626 8.465 25.854 606 HB2 LEU 115 HB2 LEU 115 6.117 9.625 23.504 607 HB3 LEU 115 HB1 LEU 115 6.563 9.874 25.183 608 HG LEU 115 HG LEU 115 6.626 7.261 23.667 609 HD11 LEU 115 HD11 LEU 115 8.846 8.996 24.715 610 HD12 LEU 115 HD12 LEU 115 8.385 8.808 23.027 611 HD13 LEU 115 HD13 LEU 115 9.029 7.430 23.925 612 HD21 LEU 115 HD21 LEU 115 6.072 6.865 26.013 613 HD22 LEU 115 HD22 LEU 115 7.428 7.864 26.516 614 HD23 LEU 115 HD23 LEU 115 7.720 6.345 25.670 615 H ALA 116 HN ALA 116 4.631 10.673 26.795 616 HA ALA 116 HA ALA 116 2.603 12.211 25.448 617 HB1 ALA 116 HB1 ALA 116 2.029 10.836 27.494 618 HB2 ALA 116 HB2 ALA 116 1.574 12.514 27.493 619 HB3 ALA 116 HB3 ALA 116 3.008 12.000 28.411 620 HA PRO 117 HA PRO 117 4.920 15.847 25.484 621 HB2 PRO 117 HB2 PRO 117 4.140 17.710 27.261 622 HB3 PRO 117 HB1 PRO 117 3.306 17.321 25.777 623 HG2 PRO 117 HG2 PRO 117 2.678 16.379 28.545 624 HG3 PRO 117 HG1 PRO 117 1.564 16.892 27.263 625 HD2 PRO 117 HD2 PRO 117 2.099 14.280 27.833 626 HD3 PRO 117 HD1 PRO 117 1.669 14.810 26.188 627 H GLY 118 HN GLY 118 6.841 16.053 25.865 628 HA2 GLY 118 HA2 GLY 118 7.736 16.180 28.639 629 HA3 GLY 118 HA1 GLY 118 8.573 15.155 27.465 630 H THR 119 HN THR 119 9.410 16.283 25.551 631 HA THR 119 HA THR 119 10.695 18.703 26.528 632 HB THR 119 HB THR 119 11.320 17.253 23.986 633 HG1 THR 119 HG1 THR 119 11.415 15.741 25.692 634 HG21 THR 119 HG21 THR 119 13.588 18.160 24.412 635 HG22 THR 119 HG22 THR 119 12.987 18.917 25.888 636 HG23 THR 119 HG23 THR 119 12.372 19.436 24.319 637 H LYS 120 HN LYS 120 9.190 20.183 26.215 638 HA LYS 120 HA LYS 120 7.722 21.581 25.321 639 HB2 LYS 120 HB2 LYS 120 8.636 22.937 23.424 640 HB3 LYS 120 HB1 LYS 120 9.657 22.776 24.833 641 HG2 LYS 120 HG2 LYS 120 11.132 22.629 22.988 642 HG3 LYS 120 HG1 LYS 120 10.916 20.978 23.536 643 HD2 LYS 120 HD2 LYS 120 10.865 21.057 21.117 644 HD3 LYS 120 HD1 LYS 120 9.275 20.615 21.738 645 HE2 LYS 120 HE2 LYS 120 9.108 22.206 19.891 646 HE3 LYS 120 HE1 LYS 120 8.490 22.897 21.382 647 HZ1 LYS 120 HZ1 LYS 120 11.184 23.403 20.238 648 HZ2 LYS 120 HZ2 LYS 120 10.527 24.176 21.604 649 HZ3 LYS 120 HZ3 LYS 120 9.867 24.422 20.088 650 H GLY 121 HN GLY 121 7.109 18.889 24.463 651 HA2 GLY 121 HA2 GLY 121 5.415 19.699 22.219 652 HA3 GLY 121 HA1 GLY 121 6.359 18.203 22.100 653 HA PRO 122 HA PRO 122 1.953 18.426 24.646 654 HB2 PRO 122 HB2 PRO 122 1.100 17.987 21.820 655 HB3 PRO 122 HB1 PRO 122 0.178 18.642 23.181 656 HG2 PRO 122 HG2 PRO 122 1.264 20.298 21.455 657 HG3 PRO 122 HG1 PRO 122 1.385 20.642 23.189 658 HD2 PRO 122 HD2 PRO 122 3.447 19.670 21.299 659 HD3 PRO 122 HD1 PRO 122 3.634 20.697 22.737 660 H PHE 123 HN PHE 123 3.387 16.243 22.233 661 HA PHE 123 HA PHE 123 3.299 14.069 23.878 662 HB2 PHE 123 HB2 PHE 123 1.605 12.541 22.888 663 HB3 PHE 123 HB1 PHE 123 0.849 13.935 23.626 664 HD1 PHE 123 HD1 PHE 123 1.580 12.194 20.496 665 HD2 PHE 123 HD2 PHE 123 -0.428 15.537 22.246 666 HE1 PHE 123 HE1 PHE 123 0.287 12.509 18.429 667 HE2 PHE 123 HE2 PHE 123 -1.691 15.851 20.184 668 HZ PHE 123 HZ PHE 123 -1.344 14.339 18.270 669 H ASP 124 HN ASP 124 3.756 11.960 22.662 670 HA ASP 124 HA ASP 124 4.981 12.454 20.061 671 HB2 ASP 124 HB2 ASP 124 6.374 11.251 22.463 672 HB3 ASP 124 HB1 ASP 124 6.892 10.878 20.829 673 H LEU 125 HN LEU 125 3.860 11.105 18.769 674 HA LEU 125 HA LEU 125 3.291 8.433 19.819 675 HB2 LEU 125 HB2 LEU 125 1.293 9.910 19.579 676 HB3 LEU 125 HB1 LEU 125 1.662 10.102 17.887 677 HG LEU 125 HG LEU 125 -0.237 8.606 18.367 678 HD11 LEU 125 HD11 LEU 125 0.385 6.779 16.861 679 HD12 LEU 125 HD12 LEU 125 2.074 7.285 16.968 680 HD13 LEU 125 HD13 LEU 125 0.875 8.361 16.253 681 HD21 LEU 125 HD21 LEU 125 0.521 7.582 20.425 682 HD22 LEU 125 HD22 LEU 125 1.867 6.815 19.580 683 HD23 LEU 125 HD23 LEU 125 0.220 6.318 19.228 684 H TYR 126 HN TYR 126 4.184 6.783 18.634 685 HA TYR 126 HA TYR 126 4.643 6.933 15.860 686 HB2 TYR 126 HB2 TYR 126 7.110 6.949 15.827 687 HB3 TYR 126 HB1 TYR 126 6.465 8.443 16.476 688 HD1 TYR 126 HD2 TYR 126 6.543 8.771 19.021 689 HD2 TYR 126 HD1 TYR 126 8.670 5.672 17.030 690 HE1 TYR 126 HE2 TYR 126 8.004 8.529 20.972 691 HE2 TYR 126 HE1 TYR 126 10.143 5.423 18.970 692 HH TYR 126 HH TYR 126 10.886 6.693 20.875 693 H SER 127 HN SER 127 5.709 4.997 15.058 694 HA SER 127 HA SER 127 5.989 2.879 17.067 695 HB2 SER 127 HB2 SER 127 3.918 2.546 15.627 696 HB3 SER 127 HB1 SER 127 4.990 2.489 14.230 697 HG SER 127 HG SER 127 5.098 0.455 14.653 698 H LEU 128 HN LEU 128 7.816 1.598 16.771 699 HA LEU 128 HA LEU 128 10.018 2.709 15.426 700 HB2 LEU 128 HB2 LEU 128 9.554 -0.108 16.402 701 HB3 LEU 128 HB1 LEU 128 11.099 0.478 15.818 702 HG LEU 128 HG LEU 128 9.632 1.457 18.268 703 HD11 LEU 128 HD11 LEU 128 12.144 -0.174 17.982 704 HD12 LEU 128 HD12 LEU 128 10.580 -0.756 18.548 705 HD13 LEU 128 HD13 LEU 128 11.472 0.435 19.496 706 HD21 LEU 128 HD21 LEU 128 10.889 3.280 17.248 707 HD22 LEU 128 HD22 LEU 128 12.321 2.259 17.150 708 HD23 LEU 128 HD23 LEU 128 11.691 2.739 18.724 709 H GLY 129 HN GLY 129 10.891 2.381 13.436 710 HA2 GLY 129 HA2 GLY 129 9.094 1.467 11.402 711 HA3 GLY 129 HA1 GLY 129 10.705 2.115 11.155 712 H ALA 130 HN ALA 130 10.767 0.476 9.469 713 HA ALA 130 HA ALA 130 10.459 -2.248 9.793 714 HB1 ALA 130 HB1 ALA 130 11.723 -2.519 7.762 715 HB2 ALA 130 HB2 ALA 130 12.372 -0.887 7.922 716 HB3 ALA 130 HB3 ALA 130 10.647 -1.127 7.635 717 H ASP 131 HN ASP 131 13.249 -0.313 10.513 718 HA ASP 131 HA ASP 131 14.875 -2.721 10.948 719 HB2 ASP 131 HB2 ASP 131 15.701 -0.555 9.779 720 HB3 ASP 131 HB1 ASP 131 15.792 0.120 11.400 721 H GLY 132 HN GLY 132 12.655 -1.033 12.649 722 HA2 GLY 132 HA2 GLY 132 12.107 -1.030 14.865 723 HA3 GLY 132 HA1 GLY 132 13.560 -1.968 15.184 724 H LYS 133 HN LYS 133 13.969 0.853 13.388 725 HA LYS 133 HA LYS 133 15.419 2.017 15.628 726 HB2 LYS 133 HB2 LYS 133 15.625 2.426 12.667 727 HB3 LYS 133 HB1 LYS 133 16.420 3.467 13.831 728 HG2 LYS 133 HG2 LYS 133 17.645 1.531 14.698 729 HG3 LYS 133 HG1 LYS 133 16.866 0.519 13.478 730 HD2 LYS 133 HD2 LYS 133 17.911 1.681 11.705 731 HD3 LYS 133 HD1 LYS 133 18.458 2.974 12.767 732 HE2 LYS 133 HE2 LYS 133 19.387 0.104 12.829 733 HE3 LYS 133 HE1 LYS 133 20.284 1.479 12.188 734 HZ1 LYS 133 HZ1 LYS 133 20.265 2.455 14.446 735 HZ2 LYS 133 HZ2 LYS 133 21.050 0.992 14.399 736 HZ3 LYS 133 HZ3 LYS 133 19.511 1.075 15.042 737 H GLU 134 HN GLU 134 15.061 4.001 16.357 738 HA GLU 134 HA GLU 134 12.916 5.548 15.127 739 HB2 GLU 134 HB2 GLU 134 12.858 4.961 17.577 740 HB3 GLU 134 HB1 GLU 134 14.398 5.758 17.789 741 HG2 GLU 134 HG2 GLU 134 12.025 7.285 16.811 742 HG3 GLU 134 HG1 GLU 134 12.181 6.894 18.519 743 H GLY 135 HN GLY 135 13.795 6.610 13.516 744 HA2 GLY 135 HA2 GLY 135 16.234 8.130 13.744 745 HA3 GLY 135 HA1 GLY 135 16.336 6.743 12.663 746 H GLY 136 HN GLY 136 16.774 8.736 11.202 747 HA2 GLY 136 HA2 GLY 136 14.173 9.612 10.150 748 HA3 GLY 136 HA1 GLY 136 15.709 10.459 9.891 749 H SER 137 HN SER 137 13.598 8.758 8.276 750 HA SER 137 HA SER 137 15.053 7.927 6.101 751 HB2 SER 137 HB2 SER 137 14.476 5.753 8.151 752 HB3 SER 137 HB1 SER 137 14.682 5.370 6.436 753 HG SER 137 HG SER 137 16.619 6.864 7.763 754 H ASP 138 HN ASP 138 13.406 6.304 4.833 755 HA ASP 138 HA ASP 138 10.673 7.183 5.510 756 HB2 ASP 138 HB2 ASP 138 11.392 7.366 3.112 757 HB3 ASP 138 HB1 ASP 138 11.633 5.623 3.088 758 H ASN 139 HN ASN 139 12.340 4.205 4.692 759 HA ASN 139 HA ASN 139 10.178 2.640 5.831 760 HB2 ASN 139 HB2 ASN 139 11.229 2.029 3.668 761 HB3 ASN 139 HB1 ASN 139 12.747 1.783 4.507 762 HD21 ASN 139 HD21 ASN 139 9.634 0.832 5.812 763 HD22 ASN 139 HD22 ASN 139 9.896 -0.862 5.696 764 H ASP 140 HN ASP 140 13.520 3.393 6.496 765 HA ASP 140 HA ASP 140 13.610 1.416 8.657 766 HB2 ASP 140 HB2 ASP 140 15.812 3.289 7.771 767 HB3 ASP 140 HB1 ASP 140 15.981 1.946 8.890 768 H ALA 141 HN ALA 141 12.290 4.209 8.536 769 HA ALA 141 HA ALA 141 13.355 5.284 11.039 770 HB1 ALA 141 HB1 ALA 141 12.111 7.281 10.492 771 HB2 ALA 141 HB2 ALA 141 11.569 6.534 8.985 772 HB3 ALA 141 HB3 ALA 141 13.277 6.886 9.240 773 H ASP 142 HN ASP 142 11.840 5.979 12.576 774 HA ASP 142 HA ASP 142 9.662 4.182 12.933 775 HB2 ASP 142 HB2 ASP 142 9.364 5.423 15.037 776 HB3 ASP 142 HB1 ASP 142 11.042 4.935 14.851 777 H ILE 143 HN ILE 143 7.589 4.724 12.672 778 HA ILE 143 HA ILE 143 7.195 7.182 11.222 779 HB ILE 143 HB ILE 143 4.891 6.100 10.634 780 HG12 ILE 143 HG12 ILE 143 5.185 3.536 10.386 781 HG13 ILE 143 HG11 ILE 143 6.416 3.682 11.624 782 HG21 ILE 143 HG21 ILE 143 7.453 5.058 9.477 783 HG22 ILE 143 HG22 ILE 143 6.573 6.512 8.990 784 HG23 ILE 143 HG23 ILE 143 5.869 4.918 8.723 785 HD11 ILE 143 HD11 ILE 143 3.544 4.495 11.961 786 HD12 ILE 143 HD12 ILE 143 4.787 4.439 13.214 787 HD13 ILE 143 HD13 ILE 143 4.222 2.948 12.448 788 H GLY 144 HN GLY 144 6.274 8.827 12.055 789 HA2 GLY 144 HA2 GLY 144 4.720 8.426 14.484 790 HA3 GLY 144 HA1 GLY 144 6.194 9.371 14.591 791 H ASN 145 HN ASN 145 3.726 10.170 15.295 792 HA ASN 145 HA ASN 145 3.328 12.527 13.667 793 HB2 ASN 145 HB2 ASN 145 1.703 11.079 12.671 794 HB3 ASN 145 HB1 ASN 145 1.233 10.427 14.235 795 HD21 ASN 145 HD21 ASN 145 -0.127 11.570 15.520 796 HD22 ASN 145 HD22 ASN 145 -1.037 12.923 14.971 797 H TRP 146 HN TRP 146 3.069 14.193 15.078 798 HA TRP 146 HA TRP 146 1.757 13.810 17.556 799 HB2 TRP 146 HB2 TRP 146 3.728 14.576 18.926 800 HB3 TRP 146 HB1 TRP 146 3.799 12.926 18.327 801 HD1 TRP 146 HD1 TRP 146 5.232 16.412 17.286 802 HE1 TRP 146 HE1 TRP 146 7.598 16.003 16.326 803 HE3 TRP 146 HE3 TRP 146 5.351 11.354 17.605 804 HZ2 TRP 146 HZ2 TRP 146 9.282 13.817 15.793 805 HZ3 TRP 146 HZ3 TRP 146 7.387 10.157 16.855 806 HH2 TRP 146 HH2 TRP 146 9.289 11.363 15.976 807 H ASP 147 HN ASP 147 2.144 15.804 18.905 808 HA ASP 147 HA ASP 147 2.238 18.135 17.162 809 HB2 ASP 147 HB2 ASP 147 0.467 17.633 19.551 810 HB3 ASP 147 HB1 ASP 147 0.851 19.267 19.023 811 H ASN 148 HN ASN 148 3.508 19.695 17.709 812 HA ASN 148 HA ASN 148 5.003 19.515 20.196 813 HB2 ASN 148 HB2 ASN 148 6.240 18.227 18.439 814 HB3 ASN 148 HB1 ASN 148 6.272 19.684 17.455 815 HD21 ASN 148 HD21 ASN 148 7.461 18.129 20.303 816 HD22 ASN 148 HD22 ASN 148 8.792 19.184 20.574 Start of MODEL 3 1 H1 MET 39 HT1 MET 39 2.192 4.578 0.177 2 H2 MET 39 HT2 MET 39 2.056 5.143 -1.396 3 H3 MET 39 HT3 MET 39 2.838 6.071 -0.238 4 HA MET 39 HA MET 39 4.365 5.067 -1.773 5 HB2 MET 39 HB2 MET 39 4.696 3.786 0.987 6 HB3 MET 39 HB1 MET 39 5.934 4.113 -0.187 7 HG2 MET 39 HG2 MET 39 6.107 5.690 1.593 8 HG3 MET 39 HG1 MET 39 5.602 6.532 0.135 9 HE1 MET 39 HE1 MET 39 4.937 8.637 1.618 10 HE2 MET 39 HE2 MET 39 5.433 7.770 3.072 11 HE3 MET 39 HE3 MET 39 3.853 8.551 3.008 12 H SER 40 HN SER 40 3.642 3.617 -3.318 13 HA SER 40 HA SER 40 2.960 0.933 -2.402 14 HB2 SER 40 HB2 SER 40 2.653 2.167 -5.143 15 HB3 SER 40 HB1 SER 40 2.058 0.581 -4.650 16 HG SER 40 HG SER 40 0.481 1.458 -3.590 17 H ARG 41 HN ARG 41 5.178 0.583 -1.849 18 HA ARG 41 HA ARG 41 6.709 -0.573 -4.006 19 HB2 ARG 41 HB2 ARG 41 7.738 1.689 -2.258 20 HB3 ARG 41 HB1 ARG 41 8.819 0.587 -3.097 21 HG2 ARG 41 HG2 ARG 41 7.973 1.304 -5.229 22 HG3 ARG 41 HG1 ARG 41 6.744 2.289 -4.449 23 HD2 ARG 41 HD2 ARG 41 8.454 3.727 -3.524 24 HD3 ARG 41 HD1 ARG 41 9.717 2.698 -4.206 25 HE ARG 41 HE ARG 41 8.647 3.244 -6.405 26 HH11 ARG 41 HH11 ARG 41 8.594 5.576 -3.712 27 HH12 ARG 41 HH12 ARG 41 8.534 6.927 -4.751 28 HH21 ARG 41 HH21 ARG 41 8.568 5.152 -7.781 29 HH22 ARG 41 HH22 ARG 41 8.514 6.689 -7.047 30 HA PRO 42 HA PRO 42 7.590 -3.831 -1.134 31 HB2 PRO 42 HB2 PRO 42 10.495 -3.252 -1.489 32 HB3 PRO 42 HB1 PRO 42 9.628 -4.788 -1.615 33 HG2 PRO 42 HG2 PRO 42 10.392 -3.523 -3.802 34 HG3 PRO 42 HG1 PRO 42 8.806 -4.305 -3.728 35 HD2 PRO 42 HD2 PRO 42 9.499 -1.415 -3.568 36 HD3 PRO 42 HD1 PRO 42 8.093 -2.198 -4.313 37 H ASP 43 HN ASP 43 7.233 -3.589 0.925 38 HA ASP 43 HA ASP 43 7.531 -3.317 3.165 39 HB2 ASP 43 HB2 ASP 43 10.066 -3.587 2.564 40 HB3 ASP 43 HB1 ASP 43 10.121 -1.841 2.770 41 H GLN 44 HN GLN 44 7.979 -0.733 1.022 42 HA GLN 44 HA GLN 44 7.380 1.419 2.808 43 HB2 GLN 44 HB2 GLN 44 6.951 1.337 -0.186 44 HB3 GLN 44 HB1 GLN 44 7.139 2.763 0.827 45 HG2 GLN 44 HG2 GLN 44 9.261 0.711 0.241 46 HG3 GLN 44 HG1 GLN 44 9.164 2.338 -0.425 47 HE21 GLN 44 HE21 GLN 44 11.211 0.985 1.207 48 HE22 GLN 44 HE22 GLN 44 11.465 1.988 2.570 49 H ALA 45 HN ALA 45 5.609 -1.007 1.263 50 HA ALA 45 HA ALA 45 3.041 0.099 1.320 51 HB1 ALA 45 HB1 ALA 45 2.240 -2.218 1.313 52 HB2 ALA 45 HB2 ALA 45 3.865 -2.780 1.706 53 HB3 ALA 45 HB3 ALA 45 3.552 -1.991 0.157 54 H LYS 46 HN LYS 46 5.131 -1.156 3.854 55 HA LYS 46 HA LYS 46 2.971 -1.304 5.786 56 HB2 LYS 46 HB2 LYS 46 5.950 -1.303 6.273 57 HB3 LYS 46 HB1 LYS 46 4.706 -1.804 7.395 58 HG2 LYS 46 HG2 LYS 46 4.182 -3.702 5.871 59 HG3 LYS 46 HG1 LYS 46 5.559 -3.218 4.872 60 HD2 LYS 46 HD2 LYS 46 6.997 -3.394 6.894 61 HD3 LYS 46 HD1 LYS 46 5.631 -4.052 7.772 62 HE2 LYS 46 HE2 LYS 46 7.024 -5.850 7.070 63 HE3 LYS 46 HE1 LYS 46 5.549 -5.893 6.110 64 HZ1 LYS 46 HZ1 LYS 46 7.999 -4.550 5.186 65 HZ2 LYS 46 HZ2 LYS 46 6.674 -5.061 4.239 66 HZ3 LYS 46 HZ3 LYS 46 7.731 -6.185 4.898 67 H VAL 47 HN VAL 47 5.311 0.937 4.583 68 HA VAL 47 HA VAL 47 5.250 2.765 6.800 69 HB VAL 47 HB VAL 47 6.104 3.301 3.931 70 HG11 VAL 47 HG11 VAL 47 6.744 4.809 6.465 71 HG12 VAL 47 HG12 VAL 47 5.745 5.383 5.128 72 HG13 VAL 47 HG13 VAL 47 7.476 5.118 4.895 73 HG21 VAL 47 HG21 VAL 47 7.386 1.467 4.870 74 HG22 VAL 47 HG22 VAL 47 7.767 2.450 6.286 75 HG23 VAL 47 HG23 VAL 47 8.381 2.915 4.699 76 H THR 48 HN THR 48 3.734 2.518 3.665 77 HA THR 48 HA THR 48 2.449 4.993 3.694 78 HB THR 48 HB THR 48 2.883 3.607 1.653 79 HG1 THR 48 HG1 THR 48 0.237 4.539 2.058 80 HG21 THR 48 HG21 THR 48 0.434 2.080 2.520 81 HG22 THR 48 HG22 THR 48 2.087 1.468 2.472 82 HG23 THR 48 HG23 THR 48 1.269 1.914 0.968 83 H VAL 49 HN VAL 49 1.459 1.887 5.057 84 HA VAL 49 HA VAL 49 -1.181 2.895 5.516 85 HB VAL 49 HB VAL 49 -1.696 0.848 6.676 86 HG11 VAL 49 HG11 VAL 49 -1.218 -0.837 4.972 87 HG12 VAL 49 HG12 VAL 49 -0.039 0.259 4.250 88 HG13 VAL 49 HG13 VAL 49 -1.746 0.704 4.295 89 HG21 VAL 49 HG21 VAL 49 0.313 0.501 8.013 90 HG22 VAL 49 HG22 VAL 49 1.250 0.143 6.565 91 HG23 VAL 49 HG23 VAL 49 -0.032 -0.955 7.080 92 H ALA 50 HN ALA 50 1.783 2.514 7.284 93 HA ALA 50 HA ALA 50 0.935 2.898 9.873 94 HB1 ALA 50 HB1 ALA 50 3.227 3.352 10.353 95 HB2 ALA 50 HB2 ALA 50 3.541 3.723 8.663 96 HB3 ALA 50 HB3 ALA 50 3.134 2.072 9.140 97 H LYS 51 HN LYS 51 1.826 5.249 7.409 98 HA LYS 51 HA LYS 51 1.933 7.455 9.168 99 HB2 LYS 51 HB2 LYS 51 1.348 7.560 6.198 100 HB3 LYS 51 HB1 LYS 51 1.898 8.905 7.179 101 HG2 LYS 51 HG2 LYS 51 3.440 6.412 6.467 102 HG3 LYS 51 HG1 LYS 51 3.749 8.048 5.884 103 HD2 LYS 51 HD2 LYS 51 4.001 7.135 8.764 104 HD3 LYS 51 HD1 LYS 51 5.339 7.291 7.637 105 HE2 LYS 51 HE2 LYS 51 3.538 9.572 8.453 106 HE3 LYS 51 HE1 LYS 51 5.064 9.199 9.242 107 HZ1 LYS 51 HZ1 LYS 51 4.761 9.995 6.368 108 HZ2 LYS 51 HZ2 LYS 51 6.194 9.599 7.135 109 HZ3 LYS 51 HZ3 LYS 51 5.352 10.939 7.629 110 H GLY 52 HN GLY 52 -0.703 5.844 7.674 111 HA2 GLY 52 HA2 GLY 52 -2.596 7.979 8.228 112 HA3 GLY 52 HA1 GLY 52 -2.954 6.426 7.481 113 H ASP 53 HN ASP 53 -1.439 5.009 9.597 114 HA ASP 53 HA ASP 53 -3.651 4.670 11.405 115 HB2 ASP 53 HB2 ASP 53 -0.977 3.285 11.231 116 HB3 ASP 53 HB1 ASP 53 -2.185 2.910 12.457 117 H ILE 54 HN ILE 54 -0.418 5.934 11.620 118 HA ILE 54 HA ILE 54 -0.602 6.613 14.355 119 HB ILE 54 HB ILE 54 1.187 8.284 13.927 120 HG12 ILE 54 HG12 ILE 54 0.862 7.425 11.048 121 HG13 ILE 54 HG11 ILE 54 0.443 8.996 11.702 122 HG21 ILE 54 HG21 ILE 54 1.649 5.578 12.691 123 HG22 ILE 54 HG22 ILE 54 1.807 6.003 14.400 124 HG23 ILE 54 HG23 ILE 54 2.908 6.698 13.205 125 HD11 ILE 54 HD11 ILE 54 3.192 7.819 11.521 126 HD12 ILE 54 HD12 ILE 54 2.782 9.412 12.179 127 HD13 ILE 54 HD13 ILE 54 2.506 9.061 10.472 128 H LYS 55 HN LYS 55 -1.675 8.217 11.422 129 HA LYS 55 HA LYS 55 -2.264 10.711 12.645 130 HB2 LYS 55 HB2 LYS 55 -2.178 9.842 10.055 131 HB3 LYS 55 HB1 LYS 55 -3.915 9.957 10.329 132 HG2 LYS 55 HG2 LYS 55 -3.222 12.049 9.456 133 HG3 LYS 55 HG1 LYS 55 -3.504 12.295 11.184 134 HD2 LYS 55 HD2 LYS 55 -1.025 11.825 11.505 135 HD3 LYS 55 HD1 LYS 55 -0.887 11.952 9.759 136 HE2 LYS 55 HE2 LYS 55 -0.297 14.061 10.741 137 HE3 LYS 55 HE1 LYS 55 -1.823 14.236 9.879 138 HZ1 LYS 55 HZ1 LYS 55 -1.528 13.885 12.822 139 HZ2 LYS 55 HZ2 LYS 55 -3.000 14.133 12.019 140 HZ3 LYS 55 HZ3 LYS 55 -1.829 15.327 12.042 141 H ALA 56 HN ALA 56 -3.945 7.717 12.263 142 HA ALA 56 HA ALA 56 -6.552 8.472 12.997 143 HB1 ALA 56 HB1 ALA 56 -6.846 6.104 13.525 144 HB2 ALA 56 HB2 ALA 56 -5.098 5.888 13.512 145 HB3 ALA 56 HB3 ALA 56 -5.946 6.282 12.011 146 H ILE 57 HN ILE 57 -3.734 7.465 14.812 147 HA ILE 57 HA ILE 57 -4.898 7.439 17.384 148 HB ILE 57 HB ILE 57 -1.996 7.873 16.617 149 HG12 ILE 57 HG12 ILE 57 -3.423 5.348 17.415 150 HG13 ILE 57 HG11 ILE 57 -3.112 5.812 15.747 151 HG21 ILE 57 HG21 ILE 57 -1.538 6.985 18.897 152 HG22 ILE 57 HG22 ILE 57 -3.269 7.026 19.231 153 HG23 ILE 57 HG23 ILE 57 -2.396 8.527 18.932 154 HD11 ILE 57 HD11 ILE 57 -0.991 5.319 17.828 155 HD12 ILE 57 HD12 ILE 57 -0.766 5.707 16.118 156 HD13 ILE 57 HD13 ILE 57 -1.519 4.192 16.570 157 H ALA 58 HN ALA 58 -3.383 9.970 15.485 158 HA ALA 58 HA ALA 58 -3.179 11.911 17.523 159 HB1 ALA 58 HB1 ALA 58 -3.024 13.566 15.744 160 HB2 ALA 58 HB2 ALA 58 -3.623 12.386 14.578 161 HB3 ALA 58 HB3 ALA 58 -2.057 12.145 15.349 162 H ALA 59 HN ALA 59 -5.879 10.813 15.663 163 HA ALA 59 HA ALA 59 -7.589 13.018 16.423 164 HB1 ALA 59 HB1 ALA 59 -9.354 11.747 15.280 165 HB2 ALA 59 HB2 ALA 59 -8.252 10.378 15.106 166 HB3 ALA 59 HB3 ALA 59 -7.920 11.889 14.264 167 H ALA 60 HN ALA 60 -6.838 9.790 17.445 168 HA ALA 60 HA ALA 60 -9.041 9.573 19.250 169 HB1 ALA 60 HB1 ALA 60 -6.526 7.944 19.040 170 HB2 ALA 60 HB2 ALA 60 -8.023 7.615 18.168 171 HB3 ALA 60 HB3 ALA 60 -7.965 7.481 19.924 172 H LEU 61 HN LEU 61 -5.710 10.639 19.427 173 HA LEU 61 HA LEU 61 -5.508 10.677 22.235 174 HB2 LEU 61 HB2 LEU 61 -3.816 11.132 20.115 175 HB3 LEU 61 HB1 LEU 61 -4.028 12.747 20.748 176 HG LEU 61 HG LEU 61 -1.996 11.637 21.610 177 HD11 LEU 61 HD11 LEU 61 -4.089 12.119 23.713 178 HD12 LEU 61 HD12 LEU 61 -3.015 13.328 23.000 179 HD13 LEU 61 HD13 LEU 61 -2.352 12.035 23.995 180 HD21 LEU 61 HD21 LEU 61 -2.136 9.833 23.156 181 HD22 LEU 61 HD22 LEU 61 -2.887 9.341 21.617 182 HD23 LEU 61 HD23 LEU 61 -3.885 9.821 23.009 183 H ASP 62 HN ASP 62 -6.810 12.853 19.877 184 HA ASP 62 HA ASP 62 -7.343 15.033 21.583 185 HB2 ASP 62 HB2 ASP 62 -7.523 15.507 19.267 186 HB3 ASP 62 HB1 ASP 62 -8.551 14.116 18.971 187 H MET 63 HN MET 63 -8.920 11.996 21.017 188 HA MET 63 HA MET 63 -11.327 12.704 22.391 189 HB2 MET 63 HB2 MET 63 -10.253 10.014 21.550 190 HB3 MET 63 HB1 MET 63 -11.794 10.235 22.370 191 HG2 MET 63 HG2 MET 63 -12.604 11.583 20.525 192 HG3 MET 63 HG1 MET 63 -11.047 11.433 19.713 193 HE1 MET 63 HE1 MET 63 -12.936 8.574 21.724 194 HE2 MET 63 HE2 MET 63 -13.914 7.871 20.437 195 HE3 MET 63 HE3 MET 63 -14.234 9.514 20.992 196 H TYR 64 HN TYR 64 -8.288 11.165 23.248 197 HA TYR 64 HA TYR 64 -9.050 10.618 25.964 198 HB2 TYR 64 HB2 TYR 64 -7.065 9.567 24.941 199 HB3 TYR 64 HB1 TYR 64 -6.280 11.146 24.883 200 HD1 TYR 64 HD2 TYR 64 -7.507 8.454 27.225 201 HD2 TYR 64 HD1 TYR 64 -5.372 12.181 26.923 202 HE1 TYR 64 HE2 TYR 64 -6.703 8.149 29.326 203 HE2 TYR 64 HE1 TYR 64 -4.573 11.838 29.151 204 HH TYR 64 HH TYR 64 -5.038 8.817 30.673 205 H LYS 65 HN LYS 65 -7.595 13.440 24.268 206 HA LYS 65 HA LYS 65 -7.138 14.789 26.646 207 HB2 LYS 65 HB2 LYS 65 -6.589 16.736 25.496 208 HB3 LYS 65 HB1 LYS 65 -6.224 15.469 24.349 209 HG2 LYS 65 HG2 LYS 65 -8.221 15.992 23.093 210 HG3 LYS 65 HG1 LYS 65 -8.713 17.159 24.318 211 HD2 LYS 65 HD2 LYS 65 -6.653 18.440 23.910 212 HD3 LYS 65 HD1 LYS 65 -6.219 17.308 22.638 213 HE2 LYS 65 HE2 LYS 65 -7.171 19.283 21.679 214 HE3 LYS 65 HE1 LYS 65 -8.278 17.933 21.442 215 HZ1 LYS 65 HZ1 LYS 65 -9.422 19.942 22.144 216 HZ2 LYS 65 HZ2 LYS 65 -8.533 20.008 23.559 217 HZ3 LYS 65 HZ3 LYS 65 -9.600 18.728 23.286 218 H LEU 66 HN LEU 66 -9.895 14.109 24.911 219 HA LEU 66 HA LEU 66 -11.605 16.081 26.121 220 HB2 LEU 66 HB2 LEU 66 -11.954 15.298 23.827 221 HB3 LEU 66 HB1 LEU 66 -12.150 13.665 24.410 222 HG LEU 66 HG LEU 66 -14.230 14.293 25.520 223 HD11 LEU 66 HD11 LEU 66 -13.778 16.994 24.256 224 HD12 LEU 66 HD12 LEU 66 -13.715 16.644 25.985 225 HD13 LEU 66 HD13 LEU 66 -15.231 16.475 25.106 226 HD21 LEU 66 HD21 LEU 66 -14.325 13.438 23.273 227 HD22 LEU 66 HD22 LEU 66 -14.024 15.048 22.620 228 HD23 LEU 66 HD23 LEU 66 -15.532 14.713 23.467 229 H ASP 67 HN ASP 67 -10.772 12.636 26.501 230 HA ASP 67 HA ASP 67 -12.817 12.016 28.422 231 HB2 ASP 67 HB2 ASP 67 -11.850 10.285 27.010 232 HB3 ASP 67 HB1 ASP 67 -10.253 10.624 27.653 233 H ASN 68 HN ASN 68 -9.544 13.244 28.678 234 HA ASN 68 HA ASN 68 -10.017 13.472 31.626 235 HB2 ASN 68 HB2 ASN 68 -7.872 12.095 30.390 236 HB3 ASN 68 HB1 ASN 68 -7.427 13.773 30.860 237 HD21 ASN 68 HD21 ASN 68 -8.872 14.150 33.153 238 HD22 ASN 68 HD22 ASN 68 -8.269 13.099 34.382 239 H PHE 69 HN PHE 69 -10.538 15.157 29.308 240 HA PHE 69 HA PHE 69 -10.384 17.373 28.675 241 HB2 PHE 69 HB2 PHE 69 -10.603 18.894 30.710 242 HB3 PHE 69 HB1 PHE 69 -11.814 17.638 30.508 243 HD1 PHE 69 HD2 PHE 69 -8.766 18.484 32.325 244 HD2 PHE 69 HD1 PHE 69 -12.085 16.012 32.093 245 HE1 PHE 69 HE2 PHE 69 -8.304 17.751 34.620 246 HE2 PHE 69 HE1 PHE 69 -11.717 15.192 34.355 247 HZ PHE 69 HZ PHE 69 -9.798 16.056 35.665 248 H ALA 70 HN ALA 70 -7.796 16.176 28.655 249 HA ALA 70 HA ALA 70 -6.047 18.340 28.446 250 HB1 ALA 70 HB1 ALA 70 -4.640 17.863 30.426 251 HB2 ALA 70 HB2 ALA 70 -5.868 16.671 30.908 252 HB3 ALA 70 HB3 ALA 70 -6.289 18.370 30.903 253 H TYR 71 HN TYR 71 -3.933 17.507 27.882 254 HA TYR 71 HA TYR 71 -4.012 14.858 26.869 255 HB2 TYR 71 HB2 TYR 71 -1.984 17.058 26.833 256 HB3 TYR 71 HB1 TYR 71 -1.519 15.430 26.351 257 HD1 TYR 71 HD2 TYR 71 -3.748 14.396 24.913 258 HD2 TYR 71 HD1 TYR 71 -2.231 18.364 24.957 259 HE1 TYR 71 HE2 TYR 71 -4.671 14.692 22.815 260 HE2 TYR 71 HE1 TYR 71 -3.147 18.728 22.730 261 HH TYR 71 HH TYR 71 -3.835 17.363 20.765 262 HA PRO 72 HA PRO 72 -2.403 12.495 30.159 263 HB2 PRO 72 HB2 PRO 72 -0.543 10.935 28.879 264 HB3 PRO 72 HB1 PRO 72 -2.286 10.673 28.757 265 HG2 PRO 72 HG2 PRO 72 -0.445 12.116 26.887 266 HG3 PRO 72 HG1 PRO 72 -1.702 10.921 26.511 267 HD2 PRO 72 HD2 PRO 72 -2.165 13.491 26.184 268 HD3 PRO 72 HD1 PRO 72 -3.413 12.428 26.859 269 H SER 73 HN SER 73 -0.461 12.165 31.566 270 HA SER 73 HA SER 73 1.682 14.024 30.897 271 HB2 SER 73 HB2 SER 73 2.382 13.619 33.282 272 HB3 SER 73 HB1 SER 73 0.750 14.261 33.157 273 HG SER 73 HG SER 73 0.029 12.596 34.012 274 H THR 74 HN THR 74 3.964 13.074 31.090 275 HA THR 74 HA THR 74 3.819 10.652 29.586 276 HB THR 74 HB THR 74 5.581 12.610 29.388 277 HG1 THR 74 HG1 THR 74 7.084 10.838 28.553 278 HG21 THR 74 HG21 THR 74 6.990 10.674 31.260 279 HG22 THR 74 HG22 THR 74 6.490 12.289 31.692 280 HG23 THR 74 HG23 THR 74 7.748 12.060 30.464 281 H GLN 75 HN GLN 75 3.906 11.202 32.836 282 HA GLN 75 HA GLN 75 4.704 8.446 33.294 283 HB2 GLN 75 HB2 GLN 75 4.218 10.761 35.127 284 HB3 GLN 75 HB1 GLN 75 4.505 9.119 35.729 285 HG2 GLN 75 HG2 GLN 75 6.711 9.169 34.677 286 HG3 GLN 75 HG1 GLN 75 6.387 10.787 34.063 287 HE21 GLN 75 HE21 GLN 75 6.356 12.514 35.495 288 HE22 GLN 75 HE22 GLN 75 7.000 12.391 37.091 289 H GLN 76 HN GLN 76 1.962 10.641 34.372 290 HA GLN 76 HA GLN 76 0.490 8.294 35.224 291 HB2 GLN 76 HB2 GLN 76 -0.378 11.173 35.114 292 HB3 GLN 76 HB1 GLN 76 -1.194 9.854 35.937 293 HG2 GLN 76 HG2 GLN 76 0.672 9.657 37.495 294 HG3 GLN 76 HG1 GLN 76 1.537 10.925 36.628 295 HE21 GLN 76 HE21 GLN 76 1.618 12.283 38.397 296 HE22 GLN 76 HE22 GLN 76 0.223 13.102 39.005 297 H GLY 77 HN GLY 77 0.334 10.629 32.621 298 HA2 GLY 77 HA2 GLY 77 -2.154 9.538 31.743 299 HA3 GLY 77 HA1 GLY 77 -1.173 10.680 30.854 300 H LEU 78 HN LEU 78 1.160 8.706 31.220 301 HA LEU 78 HA LEU 78 0.768 7.461 28.682 302 HB2 LEU 78 HB2 LEU 78 3.004 8.213 29.612 303 HB3 LEU 78 HB1 LEU 78 2.926 6.884 30.733 304 HG LEU 78 HG LEU 78 3.037 6.491 27.732 305 HD11 LEU 78 HD11 LEU 78 5.269 6.475 29.738 306 HD12 LEU 78 HD12 LEU 78 5.005 7.688 28.484 307 HD13 LEU 78 HD13 LEU 78 5.398 6.027 28.039 308 HD21 LEU 78 HD21 LEU 78 2.206 4.557 29.020 309 HD22 LEU 78 HD22 LEU 78 3.644 4.628 30.032 310 HD23 LEU 78 HD23 LEU 78 3.794 4.236 28.316 311 H GLU 79 HN GLU 79 1.018 6.281 31.993 312 HA GLU 79 HA GLU 79 0.295 3.649 31.298 313 HB2 GLU 79 HB2 GLU 79 -0.077 3.326 33.690 314 HB3 GLU 79 HB1 GLU 79 1.493 4.067 33.310 315 HG2 GLU 79 HG2 GLU 79 0.710 6.185 34.038 316 HG3 GLU 79 HG1 GLU 79 -0.928 5.551 34.248 317 H ALA 80 HN ALA 80 -1.425 6.487 31.920 318 HA ALA 80 HA ALA 80 -4.012 5.243 32.199 319 HB1 ALA 80 HB1 ALA 80 -3.489 7.491 33.150 320 HB2 ALA 80 HB2 ALA 80 -4.944 7.427 32.117 321 HB3 ALA 80 HB3 ALA 80 -3.449 8.089 31.486 322 H LEU 81 HN LEU 81 -2.034 5.847 29.548 323 HA LEU 81 HA LEU 81 -4.231 5.796 27.627 324 HB2 LEU 81 HB2 LEU 81 -1.232 5.605 27.219 325 HB3 LEU 81 HB1 LEU 81 -2.427 5.618 25.942 326 HG LEU 81 HG LEU 81 -1.938 7.918 27.833 327 HD11 LEU 81 HD11 LEU 81 0.014 7.532 26.409 328 HD12 LEU 81 HD12 LEU 81 -0.839 8.989 25.915 329 HD13 LEU 81 HD13 LEU 81 -1.023 7.506 24.984 330 HD21 LEU 81 HD21 LEU 81 -3.276 9.183 26.210 331 HD22 LEU 81 HD22 LEU 81 -4.205 7.866 26.918 332 HD23 LEU 81 HD23 LEU 81 -3.550 7.706 25.288 333 H VAL 82 HN VAL 82 -2.055 3.751 29.245 334 HA VAL 82 HA VAL 82 -2.546 1.426 27.549 335 HB VAL 82 HB VAL 82 -1.062 1.543 30.173 336 HG11 VAL 82 HG11 VAL 82 -1.643 -0.695 29.445 337 HG12 VAL 82 HG12 VAL 82 0.101 -0.436 29.346 338 HG13 VAL 82 HG13 VAL 82 -0.886 -0.397 27.882 339 HG21 VAL 82 HG21 VAL 82 -0.014 1.985 27.389 340 HG22 VAL 82 HG22 VAL 82 0.990 1.806 28.831 341 HG23 VAL 82 HG23 VAL 82 -0.111 3.179 28.673 342 H LYS 83 HN LYS 83 -3.162 2.459 30.838 343 HA LYS 83 HA LYS 83 -5.115 0.337 31.292 344 HB2 LYS 83 HB2 LYS 83 -3.195 -0.012 32.702 345 HB3 LYS 83 HB1 LYS 83 -3.114 1.695 33.109 346 HG2 LYS 83 HG2 LYS 83 -5.232 1.484 34.322 347 HG3 LYS 83 HG1 LYS 83 -5.265 -0.234 33.942 348 HD2 LYS 83 HD2 LYS 83 -3.304 -0.631 35.235 349 HD3 LYS 83 HD1 LYS 83 -3.014 1.101 35.426 350 HE2 LYS 83 HE2 LYS 83 -5.425 -0.369 36.472 351 HE3 LYS 83 HE1 LYS 83 -4.010 0.055 37.433 352 HZ1 LYS 83 HZ1 LYS 83 -5.796 2.025 36.063 353 HZ2 LYS 83 HZ2 LYS 83 -4.450 2.381 37.009 354 HZ3 LYS 83 HZ3 LYS 83 -5.798 1.653 37.701 355 H LYS 84 HN LYS 84 -6.997 1.030 32.487 356 HA LYS 84 HA LYS 84 -8.178 3.414 31.720 357 HB2 LYS 84 HB2 LYS 84 -9.175 1.280 32.780 358 HB3 LYS 84 HB1 LYS 84 -8.778 2.005 34.326 359 HG2 LYS 84 HG2 LYS 84 -11.039 2.496 33.956 360 HG3 LYS 84 HG1 LYS 84 -10.180 3.988 33.584 361 HD2 LYS 84 HD2 LYS 84 -11.655 3.811 31.789 362 HD3 LYS 84 HD1 LYS 84 -10.181 3.087 31.151 363 HE2 LYS 84 HE2 LYS 84 -12.545 1.568 32.271 364 HE3 LYS 84 HE1 LYS 84 -12.198 1.787 30.567 365 HZ1 LYS 84 HZ1 LYS 84 -11.542 -0.383 31.359 366 HZ2 LYS 84 HZ2 LYS 84 -10.524 0.250 32.509 367 HZ3 LYS 84 HZ3 LYS 84 -10.169 0.433 30.867 368 HA PRO 85 HA PRO 85 -5.866 6.423 33.978 369 HB2 PRO 85 HB2 PRO 85 -7.741 8.430 33.925 370 HB3 PRO 85 HB1 PRO 85 -6.731 8.011 32.536 371 HG2 PRO 85 HG2 PRO 85 -9.513 7.137 33.127 372 HG3 PRO 85 HG1 PRO 85 -8.811 7.732 31.607 373 HD2 PRO 85 HD2 PRO 85 -9.182 5.163 32.002 374 HD3 PRO 85 HD1 PRO 85 -7.697 5.736 31.214 375 H THR 86 HN THR 86 -5.521 6.592 36.047 376 HA THR 86 HA THR 86 -7.686 6.174 37.908 377 HB THR 86 HB THR 86 -5.597 6.275 39.516 378 HG1 THR 86 HG1 THR 86 -3.958 6.758 38.283 379 HG21 THR 86 HG21 THR 86 -6.099 3.966 37.633 380 HG22 THR 86 HG22 THR 86 -6.983 4.288 39.124 381 HG23 THR 86 HG23 THR 86 -5.273 3.862 39.187 382 H GLY 87 HN GLY 87 -8.758 7.914 38.456 383 HA2 GLY 87 HA2 GLY 87 -8.081 10.004 39.901 384 HA3 GLY 87 HA1 GLY 87 -7.538 10.534 38.306 385 H ASN 88 HN ASN 88 -9.054 11.976 37.611 386 HA ASN 88 HA ASN 88 -11.742 10.894 37.585 387 HB2 ASN 88 HB2 ASN 88 -12.716 13.198 37.903 388 HB3 ASN 88 HB1 ASN 88 -11.908 12.539 39.311 389 HD21 ASN 88 HD21 ASN 88 -10.074 13.549 40.067 390 HD22 ASN 88 HD22 ASN 88 -9.559 15.103 39.527 391 HA PRO 89 HA PRO 89 -11.263 12.064 33.303 392 HB2 PRO 89 HB2 PRO 89 -12.098 9.510 32.416 393 HB3 PRO 89 HB1 PRO 89 -10.438 10.029 32.474 394 HG2 PRO 89 HG2 PRO 89 -11.610 8.026 34.092 395 HG3 PRO 89 HG1 PRO 89 -10.010 8.755 34.301 396 HD2 PRO 89 HD2 PRO 89 -12.548 9.325 35.739 397 HD3 PRO 89 HD1 PRO 89 -10.870 9.433 36.308 398 H GLN 90 HN GLN 90 -13.073 12.073 31.710 399 HA GLN 90 HA GLN 90 -15.614 12.068 33.166 400 HB2 GLN 90 HB2 GLN 90 -14.755 13.799 30.832 401 HB3 GLN 90 HB1 GLN 90 -16.336 13.869 31.612 402 HG2 GLN 90 HG2 GLN 90 -15.303 14.509 33.715 403 HG3 GLN 90 HG1 GLN 90 -13.707 14.382 32.993 404 HE21 GLN 90 HE21 GLN 90 -14.918 16.625 34.294 405 HE22 GLN 90 HE22 GLN 90 -14.912 17.903 33.121 406 HA PRO 91 HA PRO 91 -17.225 8.764 30.886 407 HB2 PRO 91 HB2 PRO 91 -19.574 10.444 30.160 408 HB3 PRO 91 HB1 PRO 91 -19.521 8.835 30.886 409 HG2 PRO 91 HG2 PRO 91 -20.038 10.924 32.390 410 HG3 PRO 91 HG1 PRO 91 -18.957 9.649 32.983 411 HD2 PRO 91 HD2 PRO 91 -18.290 12.364 31.928 412 HD3 PRO 91 HD1 PRO 91 -17.559 11.459 33.273 413 H LYS 92 HN LYS 92 -15.839 8.588 29.245 414 HA LYS 92 HA LYS 92 -16.929 8.855 26.618 415 HB2 LYS 92 HB2 LYS 92 -14.150 9.898 27.354 416 HB3 LYS 92 HB1 LYS 92 -14.548 9.395 25.725 417 HG2 LYS 92 HG2 LYS 92 -14.768 11.720 25.645 418 HG3 LYS 92 HG1 LYS 92 -16.425 11.170 25.856 419 HD2 LYS 92 HD2 LYS 92 -16.027 11.536 28.362 420 HD3 LYS 92 HD1 LYS 92 -14.587 12.424 27.874 421 HE2 LYS 92 HE2 LYS 92 -16.439 13.944 28.226 422 HE3 LYS 92 HE1 LYS 92 -15.970 13.925 26.527 423 HZ1 LYS 92 HZ1 LYS 92 -17.848 12.585 25.991 424 HZ2 LYS 92 HZ2 LYS 92 -18.428 13.834 26.975 425 HZ3 LYS 92 HZ3 LYS 92 -18.200 12.301 27.612 426 H ASN 93 HN ASN 93 -16.091 7.214 25.258 427 HA ASN 93 HA ASN 93 -15.501 4.849 26.758 428 HB2 ASN 93 HB2 ASN 93 -15.743 5.219 23.764 429 HB3 ASN 93 HB1 ASN 93 -15.478 3.668 24.547 430 HD21 ASN 93 HD21 ASN 93 -17.747 6.182 23.876 431 HD22 ASN 93 HD22 ASN 93 -19.149 5.357 24.434 432 H TRP 94 HN TRP 94 -13.537 5.174 27.708 433 HA TRP 94 HA TRP 94 -11.185 5.936 26.579 434 HB2 TRP 94 HB2 TRP 94 -11.565 5.776 28.972 435 HB3 TRP 94 HB1 TRP 94 -11.696 4.026 28.867 436 HD1 TRP 94 HD1 TRP 94 -9.082 6.857 28.842 437 HE1 TRP 94 HE1 TRP 94 -6.744 5.764 29.070 438 HE3 TRP 94 HE3 TRP 94 -10.379 1.918 28.497 439 HZ2 TRP 94 HZ2 TRP 94 -5.635 3.238 29.100 440 HZ3 TRP 94 HZ3 TRP 94 -8.598 0.230 28.655 441 HH2 TRP 94 HH2 TRP 94 -6.286 0.884 28.950 442 H ASN 95 HN ASN 95 -9.452 4.928 25.756 443 HA ASN 95 HA ASN 95 -9.850 2.242 24.796 444 HB2 ASN 95 HB2 ASN 95 -10.257 3.610 22.898 445 HB3 ASN 95 HB1 ASN 95 -8.894 4.632 23.276 446 HD21 ASN 95 HD21 ASN 95 -9.672 1.377 22.042 447 HD22 ASN 95 HD22 ASN 95 -8.070 1.208 21.382 448 H LYS 96 HN LYS 96 -8.065 0.920 24.904 449 HA LYS 96 HA LYS 96 -5.827 1.791 26.532 450 HB2 LYS 96 HB2 LYS 96 -5.205 -0.484 26.618 451 HB3 LYS 96 HB1 LYS 96 -6.964 -0.444 26.812 452 HG2 LYS 96 HG2 LYS 96 -7.174 -1.013 24.392 453 HG3 LYS 96 HG1 LYS 96 -5.410 -1.052 24.329 454 HD2 LYS 96 HD2 LYS 96 -5.380 -2.904 25.917 455 HD3 LYS 96 HD1 LYS 96 -7.147 -2.870 25.981 456 HE2 LYS 96 HE2 LYS 96 -7.277 -3.366 23.621 457 HE3 LYS 96 HE1 LYS 96 -5.521 -3.332 23.490 458 HZ1 LYS 96 HZ1 LYS 96 -7.105 -5.255 25.091 459 HZ2 LYS 96 HZ2 LYS 96 -5.422 -5.219 24.979 460 HZ3 LYS 96 HZ3 LYS 96 -6.349 -5.569 23.612 461 H ASP 97 HN ASP 97 -3.687 1.014 25.928 462 HA ASP 97 HA ASP 97 -1.886 0.612 24.704 463 HB2 ASP 97 HB2 ASP 97 -3.316 -1.178 23.672 464 HB3 ASP 97 HB1 ASP 97 -3.707 -0.058 22.378 465 H GLY 98 HN GLY 98 -3.565 3.187 24.486 466 HA2 GLY 98 HA2 GLY 98 -1.861 5.053 24.212 467 HA3 GLY 98 HA1 GLY 98 -1.567 4.350 22.649 468 H TYR 99 HN TYR 99 -4.802 4.196 23.368 469 HA TYR 99 HA TYR 99 -6.557 5.035 22.437 470 HB2 TYR 99 HB2 TYR 99 -5.313 7.399 23.503 471 HB3 TYR 99 HB1 TYR 99 -6.042 7.840 21.953 472 HD1 TYR 99 HD2 TYR 99 -6.560 6.669 25.361 473 HD2 TYR 99 HD1 TYR 99 -8.432 7.733 21.707 474 HE1 TYR 99 HE2 TYR 99 -8.726 6.816 26.489 475 HE2 TYR 99 HE1 TYR 99 -10.577 7.869 22.828 476 HH TYR 99 HH TYR 99 -10.784 7.658 26.233 477 H LEU 100 HN LEU 100 -6.348 3.799 20.885 478 HA LEU 100 HA LEU 100 -5.516 4.751 18.227 479 HB2 LEU 100 HB2 LEU 100 -4.002 3.068 19.132 480 HB3 LEU 100 HB1 LEU 100 -5.348 2.056 19.586 481 HG LEU 100 HG LEU 100 -5.832 1.691 17.188 482 HD11 LEU 100 HD11 LEU 100 -3.258 3.163 16.745 483 HD12 LEU 100 HD12 LEU 100 -4.864 3.690 16.239 484 HD13 LEU 100 HD13 LEU 100 -4.136 2.252 15.519 485 HD21 LEU 100 HD21 LEU 100 -4.536 0.082 18.440 486 HD22 LEU 100 HD22 LEU 100 -3.055 0.977 18.100 487 HD23 LEU 100 HD23 LEU 100 -3.933 0.191 16.787 488 H LYS 101 HN LYS 101 -6.769 3.490 16.568 489 HA LYS 101 HA LYS 101 -9.619 3.503 17.172 490 HB2 LYS 101 HB2 LYS 101 -8.123 2.818 14.627 491 HB3 LYS 101 HB1 LYS 101 -9.852 3.078 14.752 492 HG2 LYS 101 HG2 LYS 101 -7.726 5.152 15.245 493 HG3 LYS 101 HG1 LYS 101 -8.661 4.971 13.757 494 HD2 LYS 101 HD2 LYS 101 -10.720 5.369 15.075 495 HD3 LYS 101 HD1 LYS 101 -9.715 5.649 16.494 496 HE2 LYS 101 HE2 LYS 101 -8.664 7.549 15.439 497 HE3 LYS 101 HE1 LYS 101 -9.522 7.228 13.933 498 HZ1 LYS 101 HZ1 LYS 101 -10.581 9.014 15.213 499 HZ2 LYS 101 HZ2 LYS 101 -10.810 7.978 16.503 500 HZ3 LYS 101 HZ3 LYS 101 -11.596 7.693 15.051 501 H LYS 102 HN LYS 102 -10.559 1.417 15.593 502 HA LYS 102 HA LYS 102 -9.734 -0.901 17.055 503 HB2 LYS 102 HB2 LYS 102 -11.515 -2.175 15.885 504 HB3 LYS 102 HB1 LYS 102 -12.162 -0.614 16.340 505 HG2 LYS 102 HG2 LYS 102 -11.201 -1.316 13.616 506 HG3 LYS 102 HG1 LYS 102 -12.865 -1.491 14.165 507 HD2 LYS 102 HD2 LYS 102 -12.884 0.957 14.620 508 HD3 LYS 102 HD1 LYS 102 -11.265 1.052 13.910 509 HE2 LYS 102 HE2 LYS 102 -12.091 0.105 11.861 510 HE3 LYS 102 HE1 LYS 102 -13.684 -0.045 12.605 511 HZ1 LYS 102 HZ1 LYS 102 -13.892 2.341 12.687 512 HZ2 LYS 102 HZ2 LYS 102 -13.504 1.924 11.115 513 HZ3 LYS 102 HZ3 LYS 102 -12.329 2.588 12.116 514 H LEU 103 HN LEU 103 -7.551 -0.650 16.474 515 HA LEU 103 HA LEU 103 -6.824 -1.945 13.959 516 HB2 LEU 103 HB2 LEU 103 -5.553 0.508 15.166 517 HB3 LEU 103 HB1 LEU 103 -4.898 -0.386 13.810 518 HG LEU 103 HG LEU 103 -7.560 1.027 13.817 519 HD11 LEU 103 HD11 LEU 103 -4.935 1.826 12.572 520 HD12 LEU 103 HD12 LEU 103 -5.724 2.617 13.937 521 HD13 LEU 103 HD13 LEU 103 -6.475 2.651 12.342 522 HD21 LEU 103 HD21 LEU 103 -7.500 0.633 11.400 523 HD22 LEU 103 HD22 LEU 103 -7.509 -0.875 12.302 524 HD23 LEU 103 HD23 LEU 103 -6.007 -0.287 11.589 525 HA PRO 104 HA PRO 104 -4.085 -4.262 16.621 526 HB2 PRO 104 HB2 PRO 104 -2.488 -5.338 14.738 527 HB3 PRO 104 HB1 PRO 104 -4.171 -5.850 14.907 528 HG2 PRO 104 HG2 PRO 104 -2.966 -3.930 12.960 529 HG3 PRO 104 HG1 PRO 104 -4.160 -5.211 12.683 530 HD2 PRO 104 HD2 PRO 104 -4.816 -2.585 12.958 531 HD3 PRO 104 HD1 PRO 104 -5.903 -3.916 13.392 532 H VAL 105 HN VAL 105 -1.431 -4.645 16.306 533 HA VAL 105 HA VAL 105 -0.343 -2.027 16.841 534 HB VAL 105 HB VAL 105 0.184 -4.165 18.118 535 HG11 VAL 105 HG11 VAL 105 1.986 -4.748 15.798 536 HG12 VAL 105 HG12 VAL 105 0.578 -5.685 16.299 537 HG13 VAL 105 HG13 VAL 105 2.000 -5.594 17.341 538 HG21 VAL 105 HG21 VAL 105 1.463 -2.123 18.465 539 HG22 VAL 105 HG22 VAL 105 2.538 -2.573 17.146 540 HG23 VAL 105 HG23 VAL 105 2.449 -3.578 18.603 541 H ASP 106 HN ASP 106 1.991 -1.510 15.722 542 HA ASP 106 HA ASP 106 1.237 -1.371 12.936 543 HB2 ASP 106 HB2 ASP 106 2.543 0.479 14.542 544 HB3 ASP 106 HB1 ASP 106 3.905 -0.287 13.730 545 HA PRO 107 HA PRO 107 3.677 -4.673 11.220 546 HB2 PRO 107 HB2 PRO 107 4.961 -2.619 9.531 547 HB3 PRO 107 HB1 PRO 107 4.247 -4.175 9.111 548 HG2 PRO 107 HG2 PRO 107 2.890 -1.910 8.632 549 HG3 PRO 107 HG1 PRO 107 2.073 -3.387 9.175 550 HD2 PRO 107 HD2 PRO 107 2.710 -0.916 10.698 551 HD3 PRO 107 HD1 PRO 107 1.349 -2.045 10.866 552 H TRP 108 HN TRP 108 5.890 -5.253 10.626 553 HA TRP 108 HA TRP 108 8.008 -5.660 11.005 554 HB2 TRP 108 HB2 TRP 108 8.388 -3.000 12.423 555 HB3 TRP 108 HB1 TRP 108 9.622 -3.972 11.642 556 HD1 TRP 108 HD1 TRP 108 9.107 -4.191 8.827 557 HE1 TRP 108 HE1 TRP 108 8.515 -2.237 7.229 558 HE3 TRP 108 HE3 TRP 108 7.444 -0.903 12.302 559 HZ2 TRP 108 HZ2 TRP 108 7.436 0.413 7.507 560 HZ3 TRP 108 HZ3 TRP 108 6.631 1.290 11.614 561 HH2 TRP 108 HH2 TRP 108 6.591 1.950 9.342 562 H GLY 109 HN GLY 109 5.795 -5.769 12.987 563 HA2 GLY 109 HA2 GLY 109 5.314 -6.534 15.113 564 HA3 GLY 109 HA1 GLY 109 6.981 -7.090 15.191 565 H ASN 110 HN ASN 110 6.612 -3.751 14.678 566 HA ASN 110 HA ASN 110 7.567 -3.255 17.294 567 HB2 ASN 110 HB2 ASN 110 7.249 -1.475 14.891 568 HB3 ASN 110 HB1 ASN 110 7.753 -0.866 16.467 569 HD21 ASN 110 HD21 ASN 110 9.183 -0.929 13.984 570 HD22 ASN 110 HD22 ASN 110 10.633 -1.815 14.248 571 HA PRO 111 HA PRO 111 3.696 -2.120 18.933 572 HB2 PRO 111 HB2 PRO 111 4.570 -1.144 21.255 573 HB3 PRO 111 HB1 PRO 111 4.617 -2.877 20.912 574 HG2 PRO 111 HG2 PRO 111 6.822 -0.860 20.768 575 HG3 PRO 111 HG1 PRO 111 6.846 -2.509 21.426 576 HD2 PRO 111 HD2 PRO 111 7.779 -1.878 18.951 577 HD3 PRO 111 HD1 PRO 111 7.100 -3.466 19.370 578 H TYR 112 HN TYR 112 2.510 -0.228 19.314 579 HA TYR 112 HA TYR 112 3.680 2.132 18.252 580 HB2 TYR 112 HB2 TYR 112 1.057 1.621 19.684 581 HB3 TYR 112 HB1 TYR 112 1.576 3.245 19.263 582 HD1 TYR 112 HD1 TYR 112 1.941 3.801 16.818 583 HD2 TYR 112 HD2 TYR 112 -0.027 0.239 18.074 584 HE1 TYR 112 HE1 TYR 112 0.946 3.603 14.604 585 HE2 TYR 112 HE2 TYR 112 -1.039 0.010 15.838 586 HH TYR 112 HH TYR 112 -0.059 1.777 13.107 587 H GLN 113 HN GLN 113 4.565 3.723 19.316 588 HA GLN 113 HA GLN 113 5.247 3.207 22.139 589 HB2 GLN 113 HB2 GLN 113 6.461 5.476 20.618 590 HB3 GLN 113 HB1 GLN 113 7.174 4.486 21.862 591 HG2 GLN 113 HG2 GLN 113 6.815 3.756 18.970 592 HG3 GLN 113 HG1 GLN 113 8.297 4.295 19.718 593 HE21 GLN 113 HE21 GLN 113 7.850 2.574 22.123 594 HE22 GLN 113 HE22 GLN 113 8.198 0.984 21.570 595 H TYR 114 HN TYR 114 3.950 4.256 23.421 596 HA TYR 114 HA TYR 114 2.814 6.780 22.528 597 HB2 TYR 114 HB2 TYR 114 1.316 6.264 24.670 598 HB3 TYR 114 HB1 TYR 114 0.942 5.594 23.090 599 HD1 TYR 114 HD1 TYR 114 3.329 4.506 25.818 600 HD2 TYR 114 HD2 TYR 114 0.038 3.512 23.344 601 HE1 TYR 114 HE1 TYR 114 3.304 2.235 26.757 602 HE2 TYR 114 HE2 TYR 114 -0.024 1.260 24.277 603 HH TYR 114 HH TYR 114 1.815 0.412 27.036 604 H LEU 115 HN LEU 115 3.742 8.506 23.253 605 HA LEU 115 HA LEU 115 4.689 8.513 26.000 606 HB2 LEU 115 HB2 LEU 115 5.985 9.818 23.613 607 HB3 LEU 115 HB1 LEU 115 6.485 10.052 25.282 608 HG LEU 115 HG LEU 115 6.656 7.472 23.716 609 HD11 LEU 115 HD11 LEU 115 9.049 7.844 23.763 610 HD12 LEU 115 HD12 LEU 115 8.812 9.345 24.652 611 HD13 LEU 115 HD13 LEU 115 8.241 9.212 22.991 612 HD21 LEU 115 HD21 LEU 115 7.613 8.162 26.495 613 HD22 LEU 115 HD22 LEU 115 7.942 6.656 25.638 614 HD23 LEU 115 HD23 LEU 115 6.290 7.065 26.095 615 H ALA 116 HN ALA 116 4.534 10.627 26.998 616 HA ALA 116 HA ALA 116 2.538 12.209 25.669 617 HB1 ALA 116 HB1 ALA 116 2.999 12.072 28.633 618 HB2 ALA 116 HB2 ALA 116 1.972 10.922 27.781 619 HB3 ALA 116 HB3 ALA 116 1.556 12.631 27.772 620 HA PRO 117 HA PRO 117 4.702 15.858 25.382 621 HB2 PRO 117 HB2 PRO 117 4.652 17.631 27.459 622 HB3 PRO 117 HB1 PRO 117 3.414 17.435 26.249 623 HG2 PRO 117 HG2 PRO 117 3.461 16.231 28.989 624 HG3 PRO 117 HG1 PRO 117 2.110 16.980 28.114 625 HD2 PRO 117 HD2 PRO 117 2.410 14.304 28.264 626 HD3 PRO 117 HD1 PRO 117 1.759 15.074 26.793 627 H GLY 118 HN GLY 118 6.597 15.576 25.024 628 HA2 GLY 118 HA2 GLY 118 8.471 15.039 27.216 629 HA3 GLY 118 HA1 GLY 118 8.687 14.580 25.526 630 H THR 119 HN THR 119 9.215 16.133 24.003 631 HA THR 119 HA THR 119 10.555 18.412 25.249 632 HB THR 119 HB THR 119 11.040 17.485 22.461 633 HG1 THR 119 HG1 THR 119 11.530 16.065 24.671 634 HG21 THR 119 HG21 THR 119 13.268 18.484 22.891 635 HG22 THR 119 HG22 THR 119 12.712 18.947 24.501 636 HG23 THR 119 HG23 THR 119 11.942 19.628 23.071 637 H LYS 120 HN LYS 120 8.870 19.769 25.262 638 HA LYS 120 HA LYS 120 7.756 21.598 24.557 639 HB2 LYS 120 HB2 LYS 120 8.972 21.136 21.837 640 HB3 LYS 120 HB1 LYS 120 8.292 22.633 22.453 641 HG2 LYS 120 HG2 LYS 120 10.742 21.235 23.468 642 HG3 LYS 120 HG1 LYS 120 10.726 22.697 22.477 643 HD2 LYS 120 HD2 LYS 120 9.531 23.881 24.256 644 HD3 LYS 120 HD1 LYS 120 9.553 22.430 25.255 645 HE2 LYS 120 HE2 LYS 120 12.015 22.489 25.233 646 HE3 LYS 120 HE1 LYS 120 11.956 23.983 24.298 647 HZ1 LYS 120 HZ1 LYS 120 10.898 23.576 27.040 648 HZ2 LYS 120 HZ2 LYS 120 10.749 25.010 26.155 649 HZ3 LYS 120 HZ3 LYS 120 12.278 24.441 26.618 650 H GLY 121 HN GLY 121 6.700 18.624 23.809 651 HA2 GLY 121 HA2 GLY 121 4.435 19.825 22.471 652 HA3 GLY 121 HA1 GLY 121 5.198 18.423 21.703 653 HA PRO 122 HA PRO 122 1.617 17.982 25.291 654 HB2 PRO 122 HB2 PRO 122 0.337 17.707 22.618 655 HB3 PRO 122 HB1 PRO 122 -0.403 18.083 24.182 656 HG2 PRO 122 HG2 PRO 122 0.170 20.065 22.608 657 HG3 PRO 122 HG1 PRO 122 0.666 20.172 24.310 658 HD2 PRO 122 HD2 PRO 122 2.300 19.658 21.890 659 HD3 PRO 122 HD1 PRO 122 2.714 20.523 23.390 660 H PHE 123 HN PHE 123 2.778 16.083 22.519 661 HA PHE 123 HA PHE 123 2.959 13.836 24.117 662 HB2 PHE 123 HB2 PHE 123 1.365 12.253 23.102 663 HB3 PHE 123 HB1 PHE 123 0.519 13.572 23.876 664 HD1 PHE 123 HD1 PHE 123 -0.741 15.190 22.517 665 HD2 PHE 123 HD2 PHE 123 1.260 11.878 20.737 666 HE1 PHE 123 HE1 PHE 123 -2.086 15.469 20.484 667 HE2 PHE 123 HE2 PHE 123 -0.077 12.163 18.695 668 HZ PHE 123 HZ PHE 123 -1.757 13.958 18.567 669 H ASP 124 HN ASP 124 3.644 11.899 22.887 670 HA ASP 124 HA ASP 124 4.732 12.568 20.255 671 HB2 ASP 124 HB2 ASP 124 6.301 11.381 22.561 672 HB3 ASP 124 HB1 ASP 124 6.817 11.218 20.889 673 H LEU 125 HN LEU 125 3.754 11.165 18.954 674 HA LEU 125 HA LEU 125 3.436 8.439 19.958 675 HB2 LEU 125 HB2 LEU 125 1.305 9.677 19.747 676 HB3 LEU 125 HB1 LEU 125 1.650 9.984 18.066 677 HG LEU 125 HG LEU 125 -0.067 8.262 18.493 678 HD11 LEU 125 HD11 LEU 125 2.361 7.355 16.982 679 HD12 LEU 125 HD12 LEU 125 0.963 8.228 16.343 680 HD13 LEU 125 HD13 LEU 125 0.796 6.562 16.903 681 HD21 LEU 125 HD21 LEU 125 0.856 7.220 20.477 682 HD22 LEU 125 HD22 LEU 125 2.235 6.624 19.549 683 HD23 LEU 125 HD23 LEU 125 0.619 6.011 19.215 684 H TYR 126 HN TYR 126 4.369 6.878 18.763 685 HA TYR 126 HA TYR 126 4.751 7.007 15.983 686 HB2 TYR 126 HB2 TYR 126 7.226 7.100 15.867 687 HB3 TYR 126 HB1 TYR 126 6.585 8.595 16.518 688 HD1 TYR 126 HD2 TYR 126 6.722 8.966 19.027 689 HD2 TYR 126 HD1 TYR 126 8.920 5.839 17.079 690 HE1 TYR 126 HE2 TYR 126 8.253 8.834 20.925 691 HE2 TYR 126 HE1 TYR 126 10.420 5.726 18.976 692 HH TYR 126 HH TYR 126 11.185 7.328 20.791 693 H SER 127 HN SER 127 6.019 5.164 15.222 694 HA SER 127 HA SER 127 6.195 3.005 17.210 695 HB2 SER 127 HB2 SER 127 5.677 2.727 14.236 696 HB3 SER 127 HB1 SER 127 5.617 1.452 15.450 697 HG SER 127 HG SER 127 3.598 2.448 14.672 698 H LEU 128 HN LEU 128 8.219 1.946 17.147 699 HA LEU 128 HA LEU 128 10.372 3.264 15.927 700 HB2 LEU 128 HB2 LEU 128 9.976 0.683 17.276 701 HB3 LEU 128 HB1 LEU 128 11.328 0.727 16.181 702 HG LEU 128 HG LEU 128 12.360 2.570 17.407 703 HD11 LEU 128 HD11 LEU 128 10.379 3.764 18.096 704 HD12 LEU 128 HD12 LEU 128 11.440 3.439 19.468 705 HD13 LEU 128 HD13 LEU 128 9.983 2.473 19.228 706 HD21 LEU 128 HD21 LEU 128 12.792 0.289 18.173 707 HD22 LEU 128 HD22 LEU 128 11.446 0.425 19.306 708 HD23 LEU 128 HD23 LEU 128 12.861 1.457 19.490 709 H GLY 129 HN GLY 129 11.516 3.009 14.089 710 HA2 GLY 129 HA2 GLY 129 10.243 2.086 11.726 711 HA3 GLY 129 HA1 GLY 129 11.933 2.491 11.848 712 H ALA 130 HN ALA 130 11.402 0.680 10.162 713 HA ALA 130 HA ALA 130 11.069 -1.987 10.938 714 HB1 ALA 130 HB1 ALA 130 11.676 -2.543 8.725 715 HB2 ALA 130 HB2 ALA 130 12.493 -0.995 8.524 716 HB3 ALA 130 HB3 ALA 130 10.726 -1.049 8.689 717 H ASP 131 HN ASP 131 13.606 -0.236 11.852 718 HA ASP 131 HA ASP 131 15.647 -2.280 11.406 719 HB2 ASP 131 HB2 ASP 131 16.199 0.150 11.149 720 HB3 ASP 131 HB1 ASP 131 15.825 0.382 12.851 721 H GLY 132 HN GLY 132 13.214 -1.467 13.554 722 HA2 GLY 132 HA2 GLY 132 12.545 -2.604 15.474 723 HA3 GLY 132 HA1 GLY 132 14.096 -3.438 15.496 724 H LYS 133 HN LYS 133 14.759 -0.329 15.055 725 HA LYS 133 HA LYS 133 14.823 0.466 17.818 726 HB2 LYS 133 HB2 LYS 133 16.981 -0.774 17.194 727 HB3 LYS 133 HB1 LYS 133 17.312 0.567 16.094 728 HG2 LYS 133 HG2 LYS 133 17.104 2.097 18.006 729 HG3 LYS 133 HG1 LYS 133 16.925 0.707 19.058 730 HD2 LYS 133 HD2 LYS 133 19.157 -0.050 18.401 731 HD3 LYS 133 HD1 LYS 133 19.332 1.381 17.377 732 HE2 LYS 133 HE2 LYS 133 18.982 1.303 20.372 733 HE3 LYS 133 HE1 LYS 133 20.391 1.855 19.470 734 HZ1 LYS 133 HZ1 LYS 133 17.709 3.181 19.498 735 HZ2 LYS 133 HZ2 LYS 133 19.027 3.707 18.593 736 HZ3 LYS 133 HZ3 LYS 133 19.099 3.720 20.272 737 H GLU 134 HN GLU 134 15.153 2.846 17.939 738 HA GLU 134 HA GLU 134 13.559 4.084 15.941 739 HB2 GLU 134 HB2 GLU 134 15.132 5.951 17.568 740 HB3 GLU 134 HB1 GLU 134 13.397 5.818 17.378 741 HG2 GLU 134 HG2 GLU 134 13.736 5.501 19.643 742 HG3 GLU 134 HG1 GLU 134 13.607 3.851 19.030 743 H GLY 135 HN GLY 135 14.266 4.656 14.008 744 HA2 GLY 135 HA2 GLY 135 16.987 5.721 13.646 745 HA3 GLY 135 HA1 GLY 135 16.500 4.320 12.702 746 H GLY 136 HN GLY 136 17.171 6.042 10.969 747 HA2 GLY 136 HA2 GLY 136 14.679 7.299 10.123 748 HA3 GLY 136 HA1 GLY 136 16.150 8.261 10.178 749 H SER 137 HN SER 137 14.248 6.891 8.111 750 HA SER 137 HA SER 137 15.771 6.794 5.857 751 HB2 SER 137 HB2 SER 137 15.119 4.082 7.048 752 HB3 SER 137 HB1 SER 137 15.609 4.310 5.367 753 HG SER 137 HG SER 137 17.290 5.392 7.258 754 H ASP 138 HN ASP 138 14.127 5.422 4.158 755 HA ASP 138 HA ASP 138 11.517 6.564 4.499 756 HB2 ASP 138 HB2 ASP 138 12.575 4.444 2.641 757 HB3 ASP 138 HB1 ASP 138 10.867 4.839 2.707 758 H ASN 139 HN ASN 139 12.530 3.192 4.870 759 HA ASN 139 HA ASN 139 10.000 2.881 6.326 760 HB2 ASN 139 HB2 ASN 139 10.125 0.472 5.965 761 HB3 ASN 139 HB1 ASN 139 10.241 1.332 4.439 762 HD21 ASN 139 HD21 ASN 139 11.918 -0.513 6.792 763 HD22 ASN 139 HD22 ASN 139 13.259 -0.968 5.804 764 H ASP 140 HN ASP 140 13.310 3.066 6.901 765 HA ASP 140 HA ASP 140 13.015 1.557 9.388 766 HB2 ASP 140 HB2 ASP 140 15.583 2.755 8.261 767 HB3 ASP 140 HB1 ASP 140 15.436 1.827 9.731 768 H ALA 141 HN ALA 141 12.089 4.399 8.603 769 HA ALA 141 HA ALA 141 13.211 5.936 10.811 770 HB1 ALA 141 HB1 ALA 141 11.753 7.722 10.105 771 HB2 ALA 141 HB2 ALA 141 10.940 6.647 8.978 772 HB3 ALA 141 HB3 ALA 141 12.603 7.112 8.684 773 H ASP 142 HN ASP 142 11.932 6.701 12.446 774 HA ASP 142 HA ASP 142 9.890 4.875 13.295 775 HB2 ASP 142 HB2 ASP 142 10.613 7.547 14.509 776 HB3 ASP 142 HB1 ASP 142 9.740 6.226 15.274 777 H ILE 143 HN ILE 143 7.883 5.115 12.833 778 HA ILE 143 HA ILE 143 7.191 7.537 11.444 779 HB ILE 143 HB ILE 143 5.193 6.236 10.564 780 HG12 ILE 143 HG12 ILE 143 5.596 3.682 10.491 781 HG13 ILE 143 HG11 ILE 143 6.655 3.917 11.867 782 HG21 ILE 143 HG21 ILE 143 6.520 5.027 8.892 783 HG22 ILE 143 HG22 ILE 143 7.943 5.234 9.921 784 HG23 ILE 143 HG23 ILE 143 7.146 6.646 9.225 785 HD11 ILE 143 HD11 ILE 143 3.729 4.606 11.803 786 HD12 ILE 143 HD12 ILE 143 4.802 4.671 13.201 787 HD13 ILE 143 HD13 ILE 143 4.412 3.118 12.455 788 H GLY 144 HN GLY 144 6.003 9.036 12.324 789 HA2 GLY 144 HA2 GLY 144 3.992 8.363 14.208 790 HA3 GLY 144 HA1 GLY 144 5.431 9.037 14.950 791 H ASN 145 HN ASN 145 3.479 10.417 15.466 792 HA ASN 145 HA ASN 145 3.758 12.858 14.109 793 HB2 ASN 145 HB2 ASN 145 1.558 13.165 13.178 794 HB3 ASN 145 HB1 ASN 145 2.103 11.606 12.603 795 HD21 ASN 145 HD21 ASN 145 1.428 10.240 15.182 796 HD22 ASN 145 HD22 ASN 145 -0.300 10.135 15.154 797 H TRP 146 HN TRP 146 2.475 14.483 15.288 798 HA TRP 146 HA TRP 146 1.250 13.762 17.711 799 HB2 TRP 146 HB2 TRP 146 3.044 14.700 19.231 800 HB3 TRP 146 HB1 TRP 146 3.321 13.099 18.569 801 HD1 TRP 146 HD1 TRP 146 4.434 16.761 17.825 802 HE1 TRP 146 HE1 TRP 146 6.857 16.678 16.991 803 HE3 TRP 146 HE3 TRP 146 5.054 11.717 17.760 804 HZ2 TRP 146 HZ2 TRP 146 8.800 14.694 16.373 805 HZ3 TRP 146 HZ3 TRP 146 7.222 10.785 17.039 806 HH2 TRP 146 HH2 TRP 146 9.050 12.239 16.365 807 H ASP 147 HN ASP 147 1.345 15.673 19.260 808 HA ASP 147 HA ASP 147 0.850 18.099 17.702 809 HB2 ASP 147 HB2 ASP 147 -1.137 17.166 18.906 810 HB3 ASP 147 HB1 ASP 147 -0.252 17.315 20.416 811 H ASN 148 HN ASN 148 2.334 19.564 18.000 812 HA ASN 148 HA ASN 148 3.670 19.677 20.543 813 HB2 ASN 148 HB2 ASN 148 5.818 20.367 19.375 814 HB3 ASN 148 HB1 ASN 148 5.335 18.696 19.168 815 HD21 ASN 148 HD21 ASN 148 4.076 21.428 17.345 816 HD22 ASN 148 HD22 ASN 148 4.730 20.954 15.812 Start of MODEL 4 1 H1 MET 39 HT1 MET 39 4.536 5.781 0.990 2 H2 MET 39 HT2 MET 39 3.870 6.412 -0.423 3 H3 MET 39 HT3 MET 39 5.134 7.229 0.343 4 HA MET 39 HA MET 39 5.945 6.030 -1.587 5 HB2 MET 39 HB2 MET 39 7.116 6.125 0.811 6 HB3 MET 39 HB1 MET 39 6.811 4.410 0.819 7 HG2 MET 39 HG2 MET 39 8.480 5.955 -1.161 8 HG3 MET 39 HG1 MET 39 9.064 4.880 0.098 9 HE1 MET 39 HE1 MET 39 10.068 2.968 -3.111 10 HE2 MET 39 HE2 MET 39 10.595 3.578 -1.546 11 HE3 MET 39 HE3 MET 39 10.121 4.705 -2.815 12 H SER 40 HN SER 40 5.222 4.431 -2.960 13 HA SER 40 HA SER 40 3.680 2.273 -1.752 14 HB2 SER 40 HB2 SER 40 2.562 2.275 -4.058 15 HB3 SER 40 HB1 SER 40 2.165 3.586 -2.935 16 HG SER 40 HG SER 40 3.875 3.618 -5.187 17 H ARG 41 HN ARG 41 5.522 0.943 -1.558 18 HA ARG 41 HA ARG 41 6.108 -0.655 -3.893 19 HB2 ARG 41 HB2 ARG 41 8.245 0.853 -2.338 20 HB3 ARG 41 HB1 ARG 41 8.607 -0.565 -3.295 21 HG2 ARG 41 HG2 ARG 41 7.475 2.018 -4.346 22 HG3 ARG 41 HG1 ARG 41 9.170 1.520 -4.457 23 HD2 ARG 41 HD2 ARG 41 8.487 -0.425 -5.783 24 HD3 ARG 41 HD1 ARG 41 6.807 0.092 -5.669 25 HE ARG 41 HE ARG 41 8.676 1.980 -6.788 26 HH11 ARG 41 HH11 ARG 41 6.083 -0.387 -7.383 27 HH12 ARG 41 HH12 ARG 41 5.894 -0.002 -9.015 28 HH21 ARG 41 HH21 ARG 41 8.375 2.518 -9.086 29 HH22 ARG 41 HH22 ARG 41 7.236 1.664 -10.004 30 HA PRO 42 HA PRO 42 6.184 -3.962 -0.817 31 HB2 PRO 42 HB2 PRO 42 8.858 -4.856 -1.128 32 HB3 PRO 42 HB1 PRO 42 7.427 -5.533 -1.902 33 HG2 PRO 42 HG2 PRO 42 9.414 -3.594 -2.963 34 HG3 PRO 42 HG1 PRO 42 8.500 -4.845 -3.821 35 HD2 PRO 42 HD2 PRO 42 7.836 -2.281 -4.083 36 HD3 PRO 42 HD1 PRO 42 6.585 -3.529 -3.945 37 H ASP 43 HN ASP 43 6.601 -4.004 1.332 38 HA ASP 43 HA ASP 43 7.411 -3.568 3.387 39 HB2 ASP 43 HB2 ASP 43 9.825 -2.372 1.974 40 HB3 ASP 43 HB1 ASP 43 9.676 -2.483 3.721 41 H GLN 44 HN GLN 44 7.934 -1.007 1.139 42 HA GLN 44 HA GLN 44 7.508 1.181 2.893 43 HB2 GLN 44 HB2 GLN 44 7.173 1.069 -0.099 44 HB3 GLN 44 HB1 GLN 44 7.445 2.503 0.881 45 HG2 GLN 44 HG2 GLN 44 9.388 0.239 0.467 46 HG3 GLN 44 HG1 GLN 44 9.470 1.834 -0.281 47 HE21 GLN 44 HE21 GLN 44 11.371 0.452 1.413 48 HE22 GLN 44 HE22 GLN 44 11.655 1.485 2.765 49 H ALA 45 HN ALA 45 5.462 -0.903 1.108 50 HA ALA 45 HA ALA 45 3.111 0.608 1.020 51 HB1 ALA 45 HB1 ALA 45 1.970 -1.513 0.642 52 HB2 ALA 45 HB2 ALA 45 3.405 -2.386 1.176 53 HB3 ALA 45 HB3 ALA 45 3.460 -1.413 -0.296 54 H LYS 46 HN LYS 46 4.635 -1.186 3.574 55 HA LYS 46 HA LYS 46 2.297 -1.072 5.272 56 HB2 LYS 46 HB2 LYS 46 5.139 -1.952 5.772 57 HB3 LYS 46 HB1 LYS 46 3.878 -1.987 6.994 58 HG2 LYS 46 HG2 LYS 46 2.604 -3.566 5.653 59 HG3 LYS 46 HG1 LYS 46 3.846 -3.508 4.398 60 HD2 LYS 46 HD2 LYS 46 5.482 -4.419 5.943 61 HD3 LYS 46 HD1 LYS 46 4.299 -4.391 7.246 62 HE2 LYS 46 HE2 LYS 46 4.107 -6.044 4.724 63 HE3 LYS 46 HE1 LYS 46 4.577 -6.614 6.330 64 HZ1 LYS 46 HZ1 LYS 46 1.903 -5.474 5.683 65 HZ2 LYS 46 HZ2 LYS 46 2.415 -6.076 7.157 66 HZ3 LYS 46 HZ3 LYS 46 2.265 -7.110 5.858 67 H VAL 47 HN VAL 47 5.085 0.770 4.520 68 HA VAL 47 HA VAL 47 5.150 2.338 6.914 69 HB VAL 47 HB VAL 47 6.257 3.039 4.166 70 HG11 VAL 47 HG11 VAL 47 7.784 4.501 5.383 71 HG12 VAL 47 HG12 VAL 47 6.984 4.079 6.896 72 HG13 VAL 47 HG13 VAL 47 6.098 4.955 5.648 73 HG21 VAL 47 HG21 VAL 47 7.148 0.902 4.970 74 HG22 VAL 47 HG22 VAL 47 7.681 1.696 6.462 75 HG23 VAL 47 HG23 VAL 47 8.368 2.170 4.901 76 H THR 48 HN THR 48 3.827 2.648 3.685 77 HA THR 48 HA THR 48 2.894 5.272 4.024 78 HB THR 48 HB THR 48 3.349 4.311 1.787 79 HG1 THR 48 HG1 THR 48 0.722 4.934 1.384 80 HG21 THR 48 HG21 THR 48 0.770 2.797 2.192 81 HG22 THR 48 HG22 THR 48 2.385 2.099 2.148 82 HG23 THR 48 HG23 THR 48 1.718 2.860 0.699 83 H VAL 49 HN VAL 49 1.432 2.221 4.927 84 HA VAL 49 HA VAL 49 -1.119 3.507 5.307 85 HB VAL 49 HB VAL 49 -1.941 1.448 6.302 86 HG11 VAL 49 HG11 VAL 49 -0.312 0.892 3.852 87 HG12 VAL 49 HG12 VAL 49 -1.940 1.561 3.907 88 HG13 VAL 49 HG13 VAL 49 -1.650 -0.099 4.437 89 HG21 VAL 49 HG21 VAL 49 -0.528 -0.565 6.553 90 HG22 VAL 49 HG22 VAL 49 0.004 0.753 7.595 91 HG23 VAL 49 HG23 VAL 49 0.889 0.396 6.115 92 H ALA 50 HN ALA 50 1.641 2.622 7.198 93 HA ALA 50 HA ALA 50 0.723 3.003 9.761 94 HB1 ALA 50 HB1 ALA 50 2.866 1.996 9.075 95 HB2 ALA 50 HB2 ALA 50 3.017 3.221 10.335 96 HB3 ALA 50 HB3 ALA 50 3.436 3.623 8.670 97 H LYS 51 HN LYS 51 1.838 5.299 7.377 98 HA LYS 51 HA LYS 51 2.147 7.513 9.068 99 HB2 LYS 51 HB2 LYS 51 1.409 7.452 6.132 100 HB3 LYS 51 HB1 LYS 51 1.924 8.891 6.991 101 HG2 LYS 51 HG2 LYS 51 3.635 6.428 6.701 102 HG3 LYS 51 HG1 LYS 51 3.664 7.772 5.562 103 HD2 LYS 51 HD2 LYS 51 4.332 9.282 7.387 104 HD3 LYS 51 HD1 LYS 51 4.327 7.921 8.514 105 HE2 LYS 51 HE2 LYS 51 6.097 6.838 7.259 106 HE3 LYS 51 HE1 LYS 51 6.031 8.097 6.030 107 HZ1 LYS 51 HZ1 LYS 51 6.789 8.595 8.869 108 HZ2 LYS 51 HZ2 LYS 51 6.860 9.684 7.598 109 HZ3 LYS 51 HZ3 LYS 51 7.886 8.345 7.614 110 H GLY 52 HN GLY 52 -0.642 6.008 7.665 111 HA2 GLY 52 HA2 GLY 52 -2.404 8.262 8.179 112 HA3 GLY 52 HA1 GLY 52 -2.852 6.718 7.458 113 H ASP 53 HN ASP 53 -1.530 5.160 9.461 114 HA ASP 53 HA ASP 53 -3.696 5.046 11.308 115 HB2 ASP 53 HB2 ASP 53 -1.185 3.416 11.085 116 HB3 ASP 53 HB1 ASP 53 -2.435 3.125 12.292 117 H ILE 54 HN ILE 54 -0.416 6.179 11.518 118 HA ILE 54 HA ILE 54 -0.600 6.785 14.274 119 HB ILE 54 HB ILE 54 1.257 8.416 13.885 120 HG12 ILE 54 HG12 ILE 54 0.839 7.567 11.016 121 HG13 ILE 54 HG11 ILE 54 0.692 9.185 11.671 122 HG21 ILE 54 HG21 ILE 54 1.612 5.664 12.721 123 HG22 ILE 54 HG22 ILE 54 1.748 6.112 14.422 124 HG23 ILE 54 HG23 ILE 54 2.922 6.712 13.251 125 HD11 ILE 54 HD11 ILE 54 3.199 7.579 11.347 126 HD12 ILE 54 HD12 ILE 54 3.112 9.169 12.105 127 HD13 ILE 54 HD13 ILE 54 2.704 8.984 10.398 128 H LYS 55 HN LYS 55 -1.623 8.531 11.384 129 HA LYS 55 HA LYS 55 -2.327 10.949 12.713 130 HB2 LYS 55 HB2 LYS 55 -2.889 9.762 10.077 131 HB3 LYS 55 HB1 LYS 55 -4.133 10.845 10.669 132 HG2 LYS 55 HG2 LYS 55 -2.561 12.025 9.236 133 HG3 LYS 55 HG1 LYS 55 -2.492 12.636 10.881 134 HD2 LYS 55 HD2 LYS 55 -0.445 11.365 11.276 135 HD3 LYS 55 HD1 LYS 55 -0.542 10.686 9.649 136 HE2 LYS 55 HE2 LYS 55 -0.391 12.950 8.714 137 HE3 LYS 55 HE1 LYS 55 -0.240 13.602 10.342 138 HZ1 LYS 55 HZ1 LYS 55 1.690 11.735 9.060 139 HZ2 LYS 55 HZ2 LYS 55 1.860 12.452 10.588 140 HZ3 LYS 55 HZ3 LYS 55 1.872 13.383 9.223 141 H ALA 56 HN ALA 56 -3.900 7.899 12.337 142 HA ALA 56 HA ALA 56 -6.518 8.563 13.176 143 HB1 ALA 56 HB1 ALA 56 -6.753 6.171 13.621 144 HB2 ALA 56 HB2 ALA 56 -5.002 5.998 13.551 145 HB3 ALA 56 HB3 ALA 56 -5.896 6.429 12.090 146 H ILE 57 HN ILE 57 -3.621 7.583 14.858 147 HA ILE 57 HA ILE 57 -4.770 7.380 17.423 148 HB ILE 57 HB ILE 57 -1.872 7.878 16.687 149 HG12 ILE 57 HG12 ILE 57 -3.333 5.311 17.278 150 HG13 ILE 57 HG11 ILE 57 -2.939 5.878 15.664 151 HG21 ILE 57 HG21 ILE 57 -3.120 6.794 19.232 152 HG22 ILE 57 HG22 ILE 57 -2.370 8.380 19.047 153 HG23 ILE 57 HG23 ILE 57 -1.388 6.919 18.905 154 HD11 ILE 57 HD11 ILE 57 -1.397 4.200 16.424 155 HD12 ILE 57 HD12 ILE 57 -0.932 5.212 17.808 156 HD13 ILE 57 HD13 ILE 57 -0.590 5.736 16.165 157 H ALA 58 HN ALA 58 -3.306 10.041 15.670 158 HA ALA 58 HA ALA 58 -3.157 11.899 17.761 159 HB1 ALA 58 HB1 ALA 58 -2.182 12.307 15.555 160 HB2 ALA 58 HB2 ALA 58 -3.243 13.630 16.038 161 HB3 ALA 58 HB3 ALA 58 -3.799 12.435 14.865 162 H ALA 59 HN ALA 59 -5.862 10.856 15.805 163 HA ALA 59 HA ALA 59 -7.656 12.886 16.720 164 HB1 ALA 59 HB1 ALA 59 -8.249 10.242 15.374 165 HB2 ALA 59 HB2 ALA 59 -7.964 11.770 14.547 166 HB3 ALA 59 HB3 ALA 59 -9.384 11.578 15.574 167 H ALA 60 HN ALA 60 -6.747 9.678 17.695 168 HA ALA 60 HA ALA 60 -8.854 9.385 19.625 169 HB1 ALA 60 HB1 ALA 60 -7.921 7.401 18.593 170 HB2 ALA 60 HB2 ALA 60 -7.568 7.381 20.336 171 HB3 ALA 60 HB3 ALA 60 -6.322 7.828 19.193 172 H LEU 61 HN LEU 61 -5.569 10.559 19.603 173 HA LEU 61 HA LEU 61 -5.210 10.701 22.405 174 HB2 LEU 61 HB2 LEU 61 -3.560 10.889 20.355 175 HB3 LEU 61 HB1 LEU 61 -3.991 12.580 20.390 176 HG LEU 61 HG LEU 61 -1.823 12.008 21.475 177 HD11 LEU 61 HD11 LEU 61 -3.887 13.186 23.306 178 HD12 LEU 61 HD12 LEU 61 -2.955 14.051 22.080 179 HD13 LEU 61 HD13 LEU 61 -2.140 13.348 23.477 180 HD21 LEU 61 HD21 LEU 61 -2.481 9.872 22.459 181 HD22 LEU 61 HD22 LEU 61 -3.543 10.754 23.581 182 HD23 LEU 61 HD23 LEU 61 -1.802 10.988 23.650 183 H ASP 62 HN ASP 62 -6.704 12.762 19.985 184 HA ASP 62 HA ASP 62 -7.382 14.850 21.795 185 HB2 ASP 62 HB2 ASP 62 -8.318 14.134 19.046 186 HB3 ASP 62 HB1 ASP 62 -9.303 15.232 19.996 187 H MET 63 HN MET 63 -8.582 11.725 21.302 188 HA MET 63 HA MET 63 -11.130 12.389 22.441 189 HB2 MET 63 HB2 MET 63 -10.053 9.730 21.539 190 HB3 MET 63 HB1 MET 63 -11.569 9.878 22.406 191 HG2 MET 63 HG2 MET 63 -12.275 11.492 20.584 192 HG3 MET 63 HG1 MET 63 -10.875 10.922 19.680 193 HE1 MET 63 HE1 MET 63 -10.587 8.389 18.849 194 HE2 MET 63 HE2 MET 63 -11.752 7.118 19.199 195 HE3 MET 63 HE3 MET 63 -10.785 7.809 20.506 196 H TYR 64 HN TYR 64 -8.136 10.964 23.544 197 HA TYR 64 HA TYR 64 -9.134 10.408 26.192 198 HB2 TYR 64 HB2 TYR 64 -6.969 9.517 25.355 199 HB3 TYR 64 HB1 TYR 64 -6.323 11.157 25.348 200 HD1 TYR 64 HD2 TYR 64 -7.577 8.426 27.590 201 HD2 TYR 64 HD1 TYR 64 -5.636 12.223 27.384 202 HE1 TYR 64 HE2 TYR 64 -6.941 8.177 29.762 203 HE2 TYR 64 HE1 TYR 64 -5.012 11.984 29.699 204 HH TYR 64 HH TYR 64 -5.359 8.981 31.222 205 H LYS 65 HN LYS 65 -7.603 13.140 24.543 206 HA LYS 65 HA LYS 65 -7.538 15.092 26.448 207 HB2 LYS 65 HB2 LYS 65 -6.692 15.298 24.216 208 HB3 LYS 65 HB1 LYS 65 -8.302 15.102 23.564 209 HG2 LYS 65 HG2 LYS 65 -8.925 17.269 24.393 210 HG3 LYS 65 HG1 LYS 65 -7.298 17.498 25.086 211 HD2 LYS 65 HD2 LYS 65 -6.332 17.132 22.860 212 HD3 LYS 65 HD1 LYS 65 -7.945 16.964 22.194 213 HE2 LYS 65 HE2 LYS 65 -8.412 19.274 22.690 214 HE3 LYS 65 HE1 LYS 65 -6.837 19.446 23.485 215 HZ1 LYS 65 HZ1 LYS 65 -5.744 18.982 21.429 216 HZ2 LYS 65 HZ2 LYS 65 -6.858 20.229 21.104 217 HZ3 LYS 65 HZ3 LYS 65 -7.184 18.624 20.667 218 H LEU 66 HN LEU 66 -10.227 13.761 24.684 219 HA LEU 66 HA LEU 66 -12.182 15.602 25.712 220 HB2 LEU 66 HB2 LEU 66 -12.352 14.575 23.464 221 HB3 LEU 66 HB1 LEU 66 -12.499 13.003 24.212 222 HG LEU 66 HG LEU 66 -14.638 13.725 25.226 223 HD11 LEU 66 HD11 LEU 66 -14.279 16.156 23.467 224 HD12 LEU 66 HD12 LEU 66 -14.234 16.150 25.224 225 HD13 LEU 66 HD13 LEU 66 -15.731 15.750 24.382 226 HD21 LEU 66 HD21 LEU 66 -14.612 12.452 23.163 227 HD22 LEU 66 HD22 LEU 66 -14.455 13.939 22.226 228 HD23 LEU 66 HD23 LEU 66 -15.928 13.626 23.145 229 H ASP 67 HN ASP 67 -11.007 12.333 26.480 230 HA ASP 67 HA ASP 67 -13.209 11.622 28.187 231 HB2 ASP 67 HB2 ASP 67 -11.975 9.922 26.978 232 HB3 ASP 67 HB1 ASP 67 -10.487 10.393 27.777 233 H ASN 68 HN ASN 68 -10.005 13.066 28.697 234 HA ASN 68 HA ASN 68 -10.713 13.451 31.582 235 HB2 ASN 68 HB2 ASN 68 -7.935 13.098 30.456 236 HB3 ASN 68 HB1 ASN 68 -8.383 13.707 32.045 237 HD21 ASN 68 HD21 ASN 68 -9.836 10.903 30.416 238 HD22 ASN 68 HD22 ASN 68 -9.282 9.776 31.534 239 H PHE 69 HN PHE 69 -11.161 14.988 29.168 240 HA PHE 69 HA PHE 69 -11.021 17.163 28.433 241 HB2 PHE 69 HB2 PHE 69 -11.523 18.787 30.338 242 HB3 PHE 69 HB1 PHE 69 -12.651 17.465 30.079 243 HD1 PHE 69 HD2 PHE 69 -9.900 18.584 32.163 244 HD2 PHE 69 HD1 PHE 69 -13.050 15.947 31.712 245 HE1 PHE 69 HE2 PHE 69 -9.680 18.019 34.541 246 HE2 PHE 69 HE1 PHE 69 -12.931 15.285 34.045 247 HZ PHE 69 HZ PHE 69 -11.221 16.327 35.520 248 H ALA 70 HN ALA 70 -8.441 16.125 28.625 249 HA ALA 70 HA ALA 70 -6.734 18.334 28.561 250 HB1 ALA 70 HB1 ALA 70 -7.141 18.435 30.964 251 HB2 ALA 70 HB2 ALA 70 -5.483 17.850 30.694 252 HB3 ALA 70 HB3 ALA 70 -6.796 16.728 31.110 253 H TYR 71 HN TYR 71 -4.546 17.578 28.211 254 HA TYR 71 HA TYR 71 -4.468 15.007 27.033 255 HB2 TYR 71 HB2 TYR 71 -2.429 17.184 27.398 256 HB3 TYR 71 HB1 TYR 71 -1.958 15.599 26.801 257 HD1 TYR 71 HD1 TYR 71 -4.217 14.864 25.123 258 HD2 TYR 71 HD2 TYR 71 -2.250 18.605 25.567 259 HE1 TYR 71 HE1 TYR 71 -4.879 15.399 22.949 260 HE2 TYR 71 HE2 TYR 71 -2.914 19.213 23.289 261 HH TYR 71 HH TYR 71 -3.572 18.048 21.186 262 HA PRO 72 HA PRO 72 -2.738 12.695 30.388 263 HB2 PRO 72 HB2 PRO 72 -0.965 11.146 28.752 264 HB3 PRO 72 HB1 PRO 72 -2.571 10.691 29.311 265 HG2 PRO 72 HG2 PRO 72 -1.823 11.187 26.673 266 HG3 PRO 72 HG1 PRO 72 -3.477 11.099 27.293 267 HD2 PRO 72 HD2 PRO 72 -1.829 13.442 26.613 268 HD3 PRO 72 HD1 PRO 72 -3.591 13.239 26.582 269 H SER 73 HN SER 73 -0.561 12.328 31.556 270 HA SER 73 HA SER 73 1.412 14.222 30.556 271 HB2 SER 73 HB2 SER 73 2.432 13.914 32.814 272 HB3 SER 73 HB1 SER 73 0.760 14.451 32.918 273 HG SER 73 HG SER 73 0.962 12.855 34.312 274 H THR 74 HN THR 74 3.730 13.326 30.448 275 HA THR 74 HA THR 74 3.421 10.797 29.180 276 HB THR 74 HB THR 74 5.031 12.754 28.499 277 HG1 THR 74 HG1 THR 74 5.622 11.368 27.108 278 HG21 THR 74 HG21 THR 74 6.376 12.818 30.547 279 HG22 THR 74 HG22 THR 74 7.386 12.354 29.178 280 HG23 THR 74 HG23 THR 74 6.832 11.130 30.319 281 H GLN 75 HN GLN 75 3.727 11.580 32.329 282 HA GLN 75 HA GLN 75 5.011 9.046 33.076 283 HB2 GLN 75 HB2 GLN 75 5.650 11.183 34.188 284 HB3 GLN 75 HB1 GLN 75 4.004 11.333 34.765 285 HG2 GLN 75 HG2 GLN 75 5.394 10.519 36.527 286 HG3 GLN 75 HG1 GLN 75 4.307 9.226 36.012 287 HE21 GLN 75 HE21 GLN 75 7.486 10.448 35.840 288 HE22 GLN 75 HE22 GLN 75 8.291 8.974 35.437 289 H GLN 76 HN GLN 76 2.176 10.960 34.216 290 HA GLN 76 HA GLN 76 0.835 8.551 35.138 291 HB2 GLN 76 HB2 GLN 76 -0.025 11.436 35.217 292 HB3 GLN 76 HB1 GLN 76 -0.914 10.107 35.911 293 HG2 GLN 76 HG2 GLN 76 1.852 10.947 36.756 294 HG3 GLN 76 HG1 GLN 76 0.358 11.332 37.615 295 HE21 GLN 76 HE21 GLN 76 2.648 8.880 36.817 296 HE22 GLN 76 HE22 GLN 76 2.091 7.708 37.953 297 H GLY 77 HN GLY 77 0.473 10.837 32.554 298 HA2 GLY 77 HA2 GLY 77 -2.039 9.707 31.807 299 HA3 GLY 77 HA1 GLY 77 -1.062 10.776 30.818 300 H LEU 78 HN LEU 78 1.257 8.788 31.246 301 HA LEU 78 HA LEU 78 0.770 7.347 28.827 302 HB2 LEU 78 HB2 LEU 78 3.044 8.097 29.619 303 HB3 LEU 78 HB1 LEU 78 2.960 6.886 30.869 304 HG LEU 78 HG LEU 78 2.930 6.191 27.928 305 HD11 LEU 78 HD11 LEU 78 5.247 6.319 29.833 306 HD12 LEU 78 HD12 LEU 78 4.953 7.415 28.484 307 HD13 LEU 78 HD13 LEU 78 5.300 5.709 28.180 308 HD21 LEU 78 HD21 LEU 78 3.617 4.552 30.378 309 HD22 LEU 78 HD22 LEU 78 3.687 3.984 28.708 310 HD23 LEU 78 HD23 LEU 78 2.135 4.412 29.435 311 H GLU 79 HN GLU 79 1.139 6.434 32.200 312 HA GLU 79 HA GLU 79 0.311 3.798 31.781 313 HB2 GLU 79 HB2 GLU 79 -0.072 3.698 34.199 314 HB3 GLU 79 HB1 GLU 79 1.514 4.356 33.760 315 HG2 GLU 79 HG2 GLU 79 0.857 6.519 34.344 316 HG3 GLU 79 HG1 GLU 79 -0.837 6.052 34.484 317 H ALA 80 HN ALA 80 -1.368 6.741 32.247 318 HA ALA 80 HA ALA 80 -3.936 5.539 32.647 319 HB1 ALA 80 HB1 ALA 80 -4.857 7.689 32.556 320 HB2 ALA 80 HB2 ALA 80 -3.497 8.294 31.629 321 HB3 ALA 80 HB3 ALA 80 -3.263 7.893 33.331 322 H LEU 81 HN LEU 81 -2.058 5.879 29.889 323 HA LEU 81 HA LEU 81 -4.362 5.646 28.118 324 HB2 LEU 81 HB2 LEU 81 -1.399 5.618 27.515 325 HB3 LEU 81 HB1 LEU 81 -2.676 5.455 26.328 326 HG LEU 81 HG LEU 81 -2.248 7.904 28.032 327 HD11 LEU 81 HD11 LEU 81 -1.403 8.934 25.983 328 HD12 LEU 81 HD12 LEU 81 -1.541 7.388 25.146 329 HD13 LEU 81 HD13 LEU 81 -0.397 7.573 26.476 330 HD21 LEU 81 HD21 LEU 81 -4.566 7.616 27.320 331 HD22 LEU 81 HD22 LEU 81 -4.032 7.379 25.657 332 HD23 LEU 81 HD23 LEU 81 -3.806 8.943 26.441 333 H VAL 82 HN VAL 82 -2.128 3.713 29.771 334 HA VAL 82 HA VAL 82 -2.815 1.284 28.221 335 HB VAL 82 HB VAL 82 -1.009 1.531 30.638 336 HG11 VAL 82 HG11 VAL 82 -1.246 -0.650 28.583 337 HG12 VAL 82 HG12 VAL 82 -1.752 -0.742 30.269 338 HG13 VAL 82 HG13 VAL 82 -0.040 -0.592 29.867 339 HG21 VAL 82 HG21 VAL 82 0.870 1.519 29.055 340 HG22 VAL 82 HG22 VAL 82 -0.166 2.934 28.853 341 HG23 VAL 82 HG23 VAL 82 -0.275 1.594 27.716 342 H LYS 83 HN LYS 83 -3.200 2.696 31.311 343 HA LYS 83 HA LYS 83 -4.912 0.592 32.390 344 HB2 LYS 83 HB2 LYS 83 -2.930 0.415 33.574 345 HB3 LYS 83 HB1 LYS 83 -2.508 2.080 33.305 346 HG2 LYS 83 HG2 LYS 83 -4.061 2.735 35.086 347 HG3 LYS 83 HG1 LYS 83 -4.438 1.023 35.357 348 HD2 LYS 83 HD2 LYS 83 -2.168 0.528 35.927 349 HD3 LYS 83 HD1 LYS 83 -1.633 2.125 35.423 350 HE2 LYS 83 HE2 LYS 83 -3.496 1.598 37.732 351 HE3 LYS 83 HE1 LYS 83 -1.752 1.800 37.871 352 HZ1 LYS 83 HZ1 LYS 83 -3.623 3.868 36.820 353 HZ2 LYS 83 HZ2 LYS 83 -1.959 4.064 37.017 354 HZ3 LYS 83 HZ3 LYS 83 -2.942 3.840 38.350 355 H LYS 84 HN LYS 84 -6.643 1.455 33.641 356 HA LYS 84 HA LYS 84 -7.900 3.742 32.558 357 HB2 LYS 84 HB2 LYS 84 -8.482 2.143 35.058 358 HB3 LYS 84 HB1 LYS 84 -9.440 3.542 34.611 359 HG2 LYS 84 HG2 LYS 84 -10.584 1.572 33.878 360 HG3 LYS 84 HG1 LYS 84 -9.983 2.437 32.470 361 HD2 LYS 84 HD2 LYS 84 -9.613 0.126 32.083 362 HD3 LYS 84 HD1 LYS 84 -8.049 0.841 32.440 363 HE2 LYS 84 HE2 LYS 84 -8.140 -0.002 34.717 364 HE3 LYS 84 HE1 LYS 84 -9.758 -0.644 34.436 365 HZ1 LYS 84 HZ1 LYS 84 -7.248 -1.549 33.112 366 HZ2 LYS 84 HZ2 LYS 84 -8.790 -2.079 32.705 367 HZ3 LYS 84 HZ3 LYS 84 -8.173 -2.417 34.228 368 HA PRO 85 HA PRO 85 -5.867 7.065 34.476 369 HB2 PRO 85 HB2 PRO 85 -7.814 8.959 34.099 370 HB3 PRO 85 HB1 PRO 85 -6.758 8.392 32.801 371 HG2 PRO 85 HG2 PRO 85 -9.531 7.532 33.470 372 HG3 PRO 85 HG1 PRO 85 -8.819 7.914 31.888 373 HD2 PRO 85 HD2 PRO 85 -9.137 5.403 32.699 374 HD3 PRO 85 HD1 PRO 85 -7.707 5.893 31.765 375 H THR 86 HN THR 86 -5.651 7.557 36.529 376 HA THR 86 HA THR 86 -7.844 7.109 38.329 377 HB THR 86 HB THR 86 -5.906 7.614 40.028 378 HG1 THR 86 HG1 THR 86 -3.970 7.772 39.163 379 HG21 THR 86 HG21 THR 86 -5.233 5.246 39.933 380 HG22 THR 86 HG22 THR 86 -5.987 5.111 38.341 381 HG23 THR 86 HG23 THR 86 -6.977 5.443 39.763 382 H GLY 87 HN GLY 87 -9.139 8.725 38.543 383 HA2 GLY 87 HA2 GLY 87 -8.766 11.036 39.805 384 HA3 GLY 87 HA1 GLY 87 -8.277 11.426 38.150 385 H ASN 88 HN ASN 88 -9.954 12.703 37.561 386 HA ASN 88 HA ASN 88 -12.600 11.421 37.641 387 HB2 ASN 88 HB2 ASN 88 -11.935 14.368 37.772 388 HB3 ASN 88 HB1 ASN 88 -13.556 13.714 37.595 389 HD21 ASN 88 HD21 ASN 88 -12.365 15.372 39.676 390 HD22 ASN 88 HD22 ASN 88 -12.629 14.522 41.148 391 HA PRO 89 HA PRO 89 -12.039 12.319 33.252 392 HB2 PRO 89 HB2 PRO 89 -12.442 9.705 32.356 393 HB3 PRO 89 HB1 PRO 89 -10.875 10.405 32.640 394 HG2 PRO 89 HG2 PRO 89 -12.124 8.315 34.143 395 HG3 PRO 89 HG1 PRO 89 -10.558 9.082 34.455 396 HD2 PRO 89 HD2 PRO 89 -13.190 9.571 35.733 397 HD3 PRO 89 HD1 PRO 89 -11.554 9.838 36.374 398 H GLN 90 HN GLN 90 -13.699 12.160 31.595 399 HA GLN 90 HA GLN 90 -16.347 12.216 32.828 400 HB2 GLN 90 HB2 GLN 90 -15.278 13.177 30.173 401 HB3 GLN 90 HB1 GLN 90 -16.989 13.214 30.570 402 HG2 GLN 90 HG2 GLN 90 -16.538 14.703 32.441 403 HG3 GLN 90 HG1 GLN 90 -14.813 14.632 32.097 404 HE21 GLN 90 HE21 GLN 90 -14.805 16.883 31.822 405 HE22 GLN 90 HE22 GLN 90 -15.386 17.617 30.371 406 HA PRO 91 HA PRO 91 -17.630 8.371 31.024 407 HB2 PRO 91 HB2 PRO 91 -20.114 8.985 29.959 408 HB3 PRO 91 HB1 PRO 91 -19.828 8.605 31.660 409 HG2 PRO 91 HG2 PRO 91 -20.128 11.266 30.338 410 HG3 PRO 91 HG1 PRO 91 -20.724 10.726 31.916 411 HD2 PRO 91 HD2 PRO 91 -18.547 12.297 31.663 412 HD3 PRO 91 HD1 PRO 91 -18.679 11.076 32.943 413 H LYS 92 HN LYS 92 -16.198 8.090 29.377 414 HA LYS 92 HA LYS 92 -17.110 8.588 26.705 415 HB2 LYS 92 HB2 LYS 92 -15.690 10.588 27.555 416 HB3 LYS 92 HB1 LYS 92 -14.346 9.472 27.626 417 HG2 LYS 92 HG2 LYS 92 -15.861 10.067 25.090 418 HG3 LYS 92 HG1 LYS 92 -14.463 10.999 25.610 419 HD2 LYS 92 HD2 LYS 92 -13.080 8.989 25.482 420 HD3 LYS 92 HD1 LYS 92 -14.493 8.034 25.045 421 HE2 LYS 92 HE2 LYS 92 -13.436 10.353 23.447 422 HE3 LYS 92 HE1 LYS 92 -13.051 8.656 23.123 423 HZ1 LYS 92 HZ1 LYS 92 -15.438 8.275 22.703 424 HZ2 LYS 92 HZ2 LYS 92 -14.802 9.442 21.690 425 HZ3 LYS 92 HZ3 LYS 92 -15.754 9.914 22.970 426 H ASN 93 HN ASN 93 -16.158 7.023 25.331 427 HA ASN 93 HA ASN 93 -15.342 4.604 26.549 428 HB2 ASN 93 HB2 ASN 93 -15.090 5.434 23.646 429 HB3 ASN 93 HB1 ASN 93 -14.788 3.815 24.244 430 HD21 ASN 93 HD21 ASN 93 -17.162 6.105 23.280 431 HD22 ASN 93 HD22 ASN 93 -18.533 5.093 23.463 432 H TRP 94 HN TRP 94 -13.475 5.125 27.897 433 HA TRP 94 HA TRP 94 -11.055 5.951 26.875 434 HB2 TRP 94 HB2 TRP 94 -11.537 5.919 29.264 435 HB3 TRP 94 HB1 TRP 94 -11.767 4.176 29.229 436 HD1 TRP 94 HD1 TRP 94 -9.048 6.833 29.288 437 HE1 TRP 94 HE1 TRP 94 -6.762 5.669 29.731 438 HE3 TRP 94 HE3 TRP 94 -10.517 1.960 29.000 439 HZ2 TRP 94 HZ2 TRP 94 -5.770 3.080 29.940 440 HZ3 TRP 94 HZ3 TRP 94 -8.843 0.199 29.349 441 HH2 TRP 94 HH2 TRP 94 -6.518 0.758 29.808 442 H ASN 95 HN ASN 95 -9.361 4.811 26.036 443 HA ASN 95 HA ASN 95 -9.765 1.981 25.457 444 HB2 ASN 95 HB2 ASN 95 -10.200 3.181 23.375 445 HB3 ASN 95 HB1 ASN 95 -8.722 4.111 23.571 446 HD21 ASN 95 HD21 ASN 95 -9.061 0.569 24.058 447 HD22 ASN 95 HD22 ASN 95 -7.973 0.182 22.787 448 H LYS 96 HN LYS 96 -8.034 0.778 25.953 449 HA LYS 96 HA LYS 96 -5.698 1.905 27.175 450 HB2 LYS 96 HB2 LYS 96 -4.919 -0.365 27.291 451 HB3 LYS 96 HB1 LYS 96 -6.630 -0.371 27.754 452 HG2 LYS 96 HG2 LYS 96 -7.163 -1.108 25.415 453 HG3 LYS 96 HG1 LYS 96 -5.427 -1.119 25.116 454 HD2 LYS 96 HD2 LYS 96 -5.138 -2.835 26.830 455 HD3 LYS 96 HD1 LYS 96 -6.884 -2.838 27.109 456 HE2 LYS 96 HE2 LYS 96 -7.262 -3.510 24.787 457 HE3 LYS 96 HE1 LYS 96 -5.524 -3.503 24.500 458 HZ1 LYS 96 HZ1 LYS 96 -6.939 -5.257 26.422 459 HZ2 LYS 96 HZ2 LYS 96 -5.282 -5.294 26.087 460 HZ3 LYS 96 HZ3 LYS 96 -6.398 -5.709 24.896 461 H ASP 97 HN ASP 97 -3.598 0.654 26.219 462 HA ASP 97 HA ASP 97 -2.125 0.164 24.565 463 HB2 ASP 97 HB2 ASP 97 -4.055 -1.219 23.737 464 HB3 ASP 97 HB1 ASP 97 -4.547 0.144 22.748 465 H GLY 98 HN GLY 98 -3.426 2.911 25.076 466 HA2 GLY 98 HA2 GLY 98 -1.961 4.844 24.698 467 HA3 GLY 98 HA1 GLY 98 -1.661 4.199 23.114 468 H TYR 99 HN TYR 99 -4.924 3.939 23.916 469 HA TYR 99 HA TYR 99 -6.746 4.771 22.956 470 HB2 TYR 99 HB2 TYR 99 -5.453 7.105 24.044 471 HB3 TYR 99 HB1 TYR 99 -6.126 7.555 22.472 472 HD1 TYR 99 HD1 TYR 99 -8.494 7.555 22.186 473 HD2 TYR 99 HD2 TYR 99 -6.666 6.526 25.859 474 HE1 TYR 99 HE1 TYR 99 -10.604 7.966 23.339 475 HE2 TYR 99 HE2 TYR 99 -8.743 6.906 27.019 476 HH TYR 99 HH TYR 99 -11.662 7.262 25.445 477 H LEU 100 HN LEU 100 -6.794 3.726 21.114 478 HA LEU 100 HA LEU 100 -5.560 4.961 18.735 479 HB2 LEU 100 HB2 LEU 100 -4.544 2.776 19.900 480 HB3 LEU 100 HB1 LEU 100 -5.903 2.005 19.134 481 HG LEU 100 HG LEU 100 -3.618 3.387 17.700 482 HD11 LEU 100 HD11 LEU 100 -4.245 0.480 18.065 483 HD12 LEU 100 HD12 LEU 100 -2.922 1.380 18.804 484 HD13 LEU 100 HD13 LEU 100 -2.956 1.137 17.058 485 HD21 LEU 100 HD21 LEU 100 -4.494 2.324 15.664 486 HD22 LEU 100 HD22 LEU 100 -5.650 3.467 16.333 487 HD23 LEU 100 HD23 LEU 100 -5.888 1.735 16.569 488 H LYS 101 HN LYS 101 -6.908 4.555 16.857 489 HA LYS 101 HA LYS 101 -9.700 4.317 17.317 490 HB2 LYS 101 HB2 LYS 101 -8.055 4.232 14.785 491 HB3 LYS 101 HB1 LYS 101 -9.811 4.205 14.775 492 HG2 LYS 101 HG2 LYS 101 -8.147 6.422 15.980 493 HG3 LYS 101 HG1 LYS 101 -8.796 6.456 14.343 494 HD2 LYS 101 HD2 LYS 101 -10.491 6.151 16.824 495 HD3 LYS 101 HD1 LYS 101 -10.156 7.703 16.053 496 HE2 LYS 101 HE2 LYS 101 -11.511 5.342 14.726 497 HE3 LYS 101 HE1 LYS 101 -12.349 6.728 15.409 498 HZ1 LYS 101 HZ1 LYS 101 -12.080 6.936 13.009 499 HZ2 LYS 101 HZ2 LYS 101 -10.402 6.872 13.145 500 HZ3 LYS 101 HZ3 LYS 101 -11.257 8.155 13.806 501 H LYS 102 HN LYS 102 -10.750 2.598 15.450 502 HA LYS 102 HA LYS 102 -10.416 0.095 16.746 503 HB2 LYS 102 HB2 LYS 102 -12.181 -0.684 15.036 504 HB3 LYS 102 HB1 LYS 102 -12.659 0.596 16.135 505 HG2 LYS 102 HG2 LYS 102 -13.554 1.079 14.037 506 HG3 LYS 102 HG1 LYS 102 -12.185 2.166 14.218 507 HD2 LYS 102 HD2 LYS 102 -10.858 0.884 12.737 508 HD3 LYS 102 HD1 LYS 102 -11.997 -0.462 12.786 509 HE2 LYS 102 HE2 LYS 102 -13.661 0.885 11.759 510 HE3 LYS 102 HE1 LYS 102 -12.575 2.272 11.704 511 HZ1 LYS 102 HZ1 LYS 102 -12.215 -0.301 10.232 512 HZ2 LYS 102 HZ2 LYS 102 -11.122 0.973 10.185 513 HZ3 LYS 102 HZ3 LYS 102 -12.664 1.169 9.557 514 H LEU 103 HN LEU 103 -8.062 0.865 15.417 515 HA LEU 103 HA LEU 103 -7.792 -1.149 13.325 516 HB2 LEU 103 HB2 LEU 103 -6.183 1.346 13.864 517 HB3 LEU 103 HB1 LEU 103 -5.612 0.080 12.808 518 HG LEU 103 HG LEU 103 -6.455 1.779 11.436 519 HD11 LEU 103 HD11 LEU 103 -8.572 -0.337 11.547 520 HD12 LEU 103 HD12 LEU 103 -7.025 -0.438 10.710 521 HD13 LEU 103 HD13 LEU 103 -8.226 0.735 10.188 522 HD21 LEU 103 HD21 LEU 103 -8.755 2.681 11.598 523 HD22 LEU 103 HD22 LEU 103 -7.764 3.052 13.007 524 HD23 LEU 103 HD23 LEU 103 -8.975 1.774 13.097 525 HA PRO 104 HA PRO 104 -5.207 -3.502 16.092 526 HB2 PRO 104 HB2 PRO 104 -3.586 -4.296 13.762 527 HB3 PRO 104 HB1 PRO 104 -4.575 -5.303 14.822 528 HG2 PRO 104 HG2 PRO 104 -5.294 -4.782 12.289 529 HG3 PRO 104 HG1 PRO 104 -6.486 -4.957 13.589 530 HD2 PRO 104 HD2 PRO 104 -5.439 -2.466 12.301 531 HD3 PRO 104 HD1 PRO 104 -7.090 -2.889 12.807 532 H VAL 105 HN VAL 105 -2.601 -4.077 15.985 533 HA VAL 105 HA VAL 105 -1.381 -1.528 16.464 534 HB VAL 105 HB VAL 105 -1.110 -3.742 17.759 535 HG11 VAL 105 HG11 VAL 105 -0.507 -5.234 16.012 536 HG12 VAL 105 HG12 VAL 105 0.808 -5.145 17.185 537 HG13 VAL 105 HG13 VAL 105 0.942 -4.299 15.649 538 HG21 VAL 105 HG21 VAL 105 0.096 -1.702 18.329 539 HG22 VAL 105 HG22 VAL 105 1.360 -2.123 17.176 540 HG23 VAL 105 HG23 VAL 105 1.034 -3.166 18.581 541 H ASP 106 HN ASP 106 1.197 -1.495 15.465 542 HA ASP 106 HA ASP 106 0.493 -1.037 12.704 543 HB2 ASP 106 HB2 ASP 106 2.061 0.417 14.406 544 HB3 ASP 106 HB1 ASP 106 3.299 -0.586 13.662 545 HA PRO 107 HA PRO 107 2.410 -4.600 10.628 546 HB2 PRO 107 HB2 PRO 107 4.345 -3.184 9.202 547 HB3 PRO 107 HB1 PRO 107 2.760 -3.674 8.609 548 HG2 PRO 107 HG2 PRO 107 3.632 -1.047 9.709 549 HG3 PRO 107 HG1 PRO 107 2.434 -1.388 8.446 550 HD2 PRO 107 HD2 PRO 107 1.652 -0.673 10.858 551 HD3 PRO 107 HD1 PRO 107 0.795 -1.978 10.002 552 H TRP 108 HN TRP 108 4.431 -5.589 10.300 553 HA TRP 108 HA TRP 108 6.426 -6.408 10.762 554 HB2 TRP 108 HB2 TRP 108 7.259 -3.913 12.233 555 HB3 TRP 108 HB1 TRP 108 8.268 -5.038 11.339 556 HD1 TRP 108 HD1 TRP 108 7.528 -5.012 8.521 557 HE1 TRP 108 HE1 TRP 108 7.253 -2.890 7.091 558 HE3 TRP 108 HE3 TRP 108 6.754 -1.648 12.253 559 HZ2 TRP 108 HZ2 TRP 108 6.775 -0.151 7.522 560 HZ3 TRP 108 HZ3 TRP 108 6.371 0.699 11.696 561 HH2 TRP 108 HH2 TRP 108 6.351 1.456 9.433 562 H GLY 109 HN GLY 109 4.163 -6.038 12.793 563 HA2 GLY 109 HA2 GLY 109 3.625 -6.949 14.850 564 HA3 GLY 109 HA1 GLY 109 5.259 -7.593 14.932 565 H ASN 110 HN ASN 110 5.641 -4.332 14.467 566 HA ASN 110 HA ASN 110 6.463 -3.855 17.081 567 HB2 ASN 110 HB2 ASN 110 6.039 -1.939 14.789 568 HB3 ASN 110 HB1 ASN 110 6.804 -1.518 16.311 569 HD21 ASN 110 HD21 ASN 110 7.874 -1.338 13.735 570 HD22 ASN 110 HD22 ASN 110 9.289 -2.308 13.673 571 HA PRO 111 HA PRO 111 2.688 -2.219 18.716 572 HB2 PRO 111 HB2 PRO 111 3.618 -1.479 21.101 573 HB3 PRO 111 HB1 PRO 111 3.427 -3.191 20.700 574 HG2 PRO 111 HG2 PRO 111 5.903 -1.516 20.704 575 HG3 PRO 111 HG1 PRO 111 5.672 -3.174 21.287 576 HD2 PRO 111 HD2 PRO 111 6.750 -2.547 18.843 577 HD3 PRO 111 HD1 PRO 111 5.913 -4.072 19.197 578 H TYR 112 HN TYR 112 1.869 -0.099 19.076 579 HA TYR 112 HA TYR 112 3.580 1.965 18.114 580 HB2 TYR 112 HB2 TYR 112 0.818 2.114 19.349 581 HB3 TYR 112 HB1 TYR 112 1.714 3.516 18.808 582 HD1 TYR 112 HD1 TYR 112 2.168 3.842 16.383 583 HD2 TYR 112 HD2 TYR 112 -0.365 0.727 17.786 584 HE1 TYR 112 HE1 TYR 112 1.183 3.663 14.149 585 HE2 TYR 112 HE2 TYR 112 -1.365 0.525 15.557 586 HH TYR 112 HH TYR 112 -0.100 1.978 12.743 587 H GLN 113 HN GLN 113 4.463 3.545 19.282 588 HA GLN 113 HA GLN 113 4.876 2.882 22.121 589 HB2 GLN 113 HB2 GLN 113 6.440 5.082 20.880 590 HB3 GLN 113 HB1 GLN 113 6.969 3.846 21.994 591 HG2 GLN 113 HG2 GLN 113 6.666 3.580 19.009 592 HG3 GLN 113 HG1 GLN 113 8.167 3.745 19.892 593 HE21 GLN 113 HE21 GLN 113 7.229 1.821 21.976 594 HE22 GLN 113 HE22 GLN 113 7.340 0.280 21.218 595 H TYR 114 HN TYR 114 3.639 4.019 23.364 596 HA TYR 114 HA TYR 114 2.538 6.506 22.355 597 HB2 TYR 114 HB2 TYR 114 0.941 6.029 24.427 598 HB3 TYR 114 HB1 TYR 114 0.671 5.317 22.848 599 HD1 TYR 114 HD1 TYR 114 2.660 4.426 25.957 600 HD2 TYR 114 HD2 TYR 114 0.043 3.113 22.877 601 HE1 TYR 114 HE1 TYR 114 2.611 2.160 26.948 602 HE2 TYR 114 HE2 TYR 114 -0.051 0.879 23.879 603 HH TYR 114 HH TYR 114 1.560 -0.493 25.290 604 H LEU 115 HN LEU 115 3.403 8.296 23.036 605 HA LEU 115 HA LEU 115 4.072 8.491 25.841 606 HB2 LEU 115 HB2 LEU 115 5.523 9.541 23.455 607 HB3 LEU 115 HB1 LEU 115 5.792 10.207 25.063 608 HG LEU 115 HG LEU 115 6.354 7.373 24.167 609 HD11 LEU 115 HD11 LEU 115 8.213 9.670 24.774 610 HD12 LEU 115 HD12 LEU 115 7.871 9.006 23.175 611 HD13 LEU 115 HD13 LEU 115 8.698 8.021 24.384 612 HD21 LEU 115 HD21 LEU 115 7.476 7.165 26.327 613 HD22 LEU 115 HD22 LEU 115 5.761 7.486 26.516 614 HD23 LEU 115 HD23 LEU 115 6.932 8.783 26.772 615 H ALA 116 HN ALA 116 3.510 10.390 26.761 616 HA ALA 116 HA ALA 116 1.767 12.042 25.178 617 HB1 ALA 116 HB1 ALA 116 0.668 12.578 27.214 618 HB2 ALA 116 HB2 ALA 116 1.944 11.838 28.190 619 HB3 ALA 116 HB3 ALA 116 0.870 10.828 27.195 620 HA PRO 117 HA PRO 117 4.320 15.547 25.181 621 HB2 PRO 117 HB2 PRO 117 4.180 17.185 27.408 622 HB3 PRO 117 HB1 PRO 117 3.184 17.309 25.975 623 HG2 PRO 117 HG2 PRO 117 2.526 16.028 28.595 624 HG3 PRO 117 HG1 PRO 117 1.464 16.918 27.489 625 HD2 PRO 117 HD2 PRO 117 1.470 14.215 27.679 626 HD3 PRO 117 HD1 PRO 117 1.113 15.032 26.133 627 H GLY 118 HN GLY 118 6.226 14.795 25.125 628 HA2 GLY 118 HA2 GLY 118 7.505 14.127 27.648 629 HA3 GLY 118 HA1 GLY 118 7.921 13.517 26.042 630 H THR 119 HN THR 119 8.975 14.852 24.620 631 HA THR 119 HA THR 119 10.624 16.681 26.165 632 HB THR 119 HB THR 119 11.205 15.926 23.351 633 HG1 THR 119 HG1 THR 119 11.076 14.267 25.557 634 HG21 THR 119 HG21 THR 119 13.545 16.174 24.143 635 HG22 THR 119 HG22 THR 119 12.935 16.582 25.746 636 HG23 THR 119 HG23 THR 119 12.591 17.635 24.375 637 H LYS 120 HN LYS 120 9.362 18.392 26.264 638 HA LYS 120 HA LYS 120 8.845 20.532 25.804 639 HB2 LYS 120 HB2 LYS 120 10.223 20.192 23.142 640 HB3 LYS 120 HB1 LYS 120 9.932 21.691 24.006 641 HG2 LYS 120 HG2 LYS 120 11.753 19.460 24.859 642 HG3 LYS 120 HG1 LYS 120 12.268 21.012 24.195 643 HD2 LYS 120 HD2 LYS 120 11.313 22.167 26.147 644 HD3 LYS 120 HD1 LYS 120 10.749 20.621 26.781 645 HE2 LYS 120 HE2 LYS 120 13.085 19.852 26.914 646 HE3 LYS 120 HE1 LYS 120 13.617 21.432 26.354 647 HZ1 LYS 120 HZ1 LYS 120 13.755 21.200 28.762 648 HZ2 LYS 120 HZ2 LYS 120 12.103 20.948 28.882 649 HZ3 LYS 120 HZ3 LYS 120 12.693 22.435 28.348 650 H GLY 121 HN GLY 121 7.204 18.083 24.331 651 HA2 GLY 121 HA2 GLY 121 5.487 20.013 23.024 652 HA3 GLY 121 HA1 GLY 121 6.068 18.647 22.061 653 HA PRO 122 HA PRO 122 1.838 18.455 24.718 654 HB2 PRO 122 HB2 PRO 122 1.070 18.290 21.842 655 HB3 PRO 122 HB1 PRO 122 0.138 18.868 23.228 656 HG2 PRO 122 HG2 PRO 122 1.367 20.604 21.661 657 HG3 PRO 122 HG1 PRO 122 1.378 20.824 23.423 658 HD2 PRO 122 HD2 PRO 122 3.583 19.969 21.613 659 HD3 PRO 122 HD1 PRO 122 3.646 20.822 23.168 660 H PHE 123 HN PHE 123 3.240 16.401 22.126 661 HA PHE 123 HA PHE 123 2.962 14.167 23.689 662 HB2 PHE 123 HB2 PHE 123 1.279 12.763 22.519 663 HB3 PHE 123 HB1 PHE 123 0.568 14.153 23.287 664 HD1 PHE 123 HD2 PHE 123 1.588 12.797 19.993 665 HD2 PHE 123 HD1 PHE 123 -0.776 15.713 22.048 666 HE1 PHE 123 HE2 PHE 123 0.436 13.355 17.892 667 HE2 PHE 123 HE1 PHE 123 -1.911 16.258 19.957 668 HZ PHE 123 HZ PHE 123 -1.315 15.085 17.873 669 H ASP 124 HN ASP 124 3.887 12.307 22.906 670 HA ASP 124 HA ASP 124 5.421 12.687 20.405 671 HB2 ASP 124 HB2 ASP 124 6.304 11.166 22.919 672 HB3 ASP 124 HB1 ASP 124 7.201 11.320 21.417 673 H LEU 125 HN LEU 125 4.380 11.275 18.936 674 HA LEU 125 HA LEU 125 3.695 8.639 20.034 675 HB2 LEU 125 HB2 LEU 125 1.749 10.201 19.778 676 HB3 LEU 125 HB1 LEU 125 2.048 10.211 18.060 677 HG LEU 125 HG LEU 125 0.157 8.838 18.781 678 HD11 LEU 125 HD11 LEU 125 2.359 7.288 17.426 679 HD12 LEU 125 HD12 LEU 125 1.151 8.313 16.646 680 HD13 LEU 125 HD13 LEU 125 0.662 6.816 17.446 681 HD21 LEU 125 HD21 LEU 125 0.540 6.651 19.849 682 HD22 LEU 125 HD22 LEU 125 0.989 8.000 20.889 683 HD23 LEU 125 HD23 LEU 125 2.235 7.072 20.059 684 H TYR 126 HN TYR 126 4.425 6.910 18.860 685 HA TYR 126 HA TYR 126 4.812 6.996 16.053 686 HB2 TYR 126 HB2 TYR 126 7.273 6.776 15.968 687 HB3 TYR 126 HB1 TYR 126 6.791 8.341 16.589 688 HD1 TYR 126 HD2 TYR 126 6.959 8.728 19.110 689 HD2 TYR 126 HD1 TYR 126 8.784 5.361 17.205 690 HE1 TYR 126 HE2 TYR 126 8.472 8.456 21.021 691 HE2 TYR 126 HE1 TYR 126 10.287 5.109 19.095 692 HH TYR 126 HH TYR 126 11.213 6.408 20.885 693 H SER 127 HN SER 127 5.824 5.039 15.240 694 HA SER 127 HA SER 127 5.776 2.790 17.113 695 HB2 SER 127 HB2 SER 127 3.806 2.754 15.540 696 HB3 SER 127 HB1 SER 127 4.931 2.841 14.190 697 HG SER 127 HG SER 127 4.767 0.780 14.291 698 H LEU 128 HN LEU 128 7.589 1.491 16.895 699 HA LEU 128 HA LEU 128 9.897 2.583 15.733 700 HB2 LEU 128 HB2 LEU 128 9.166 0.101 17.068 701 HB3 LEU 128 HB1 LEU 128 10.497 -0.057 15.969 702 HG LEU 128 HG LEU 128 11.787 1.648 17.143 703 HD11 LEU 128 HD11 LEU 128 10.027 3.142 17.812 704 HD12 LEU 128 HD12 LEU 128 11.035 2.685 19.184 705 HD13 LEU 128 HD13 LEU 128 9.445 1.950 18.974 706 HD21 LEU 128 HD21 LEU 128 12.067 0.541 19.292 707 HD22 LEU 128 HD22 LEU 128 11.978 -0.608 17.958 708 HD23 LEU 128 HD23 LEU 128 10.583 -0.369 19.014 709 H GLY 129 HN GLY 129 11.271 1.875 14.048 710 HA2 GLY 129 HA2 GLY 129 10.025 1.251 11.566 711 HA3 GLY 129 HA1 GLY 129 11.747 1.226 11.868 712 H ALA 130 HN ALA 130 10.686 -0.540 10.245 713 HA ALA 130 HA ALA 130 9.513 -2.821 11.149 714 HB1 ALA 130 HB1 ALA 130 10.251 -3.858 9.139 715 HB2 ALA 130 HB2 ALA 130 11.481 -2.606 8.917 716 HB3 ALA 130 HB3 ALA 130 9.764 -2.191 8.853 717 H ASP 131 HN ASP 131 12.896 -2.053 11.651 718 HA ASP 131 HA ASP 131 13.342 -4.851 12.358 719 HB2 ASP 131 HB2 ASP 131 15.668 -4.475 12.167 720 HB3 ASP 131 HB1 ASP 131 14.914 -3.722 10.766 721 H GLY 132 HN GLY 132 12.383 -2.106 13.837 722 HA2 GLY 132 HA2 GLY 132 11.943 -2.029 16.150 723 HA3 GLY 132 HA1 GLY 132 13.229 -3.194 16.412 724 H LYS 133 HN LYS 133 13.490 -0.161 14.603 725 HA LYS 133 HA LYS 133 15.129 0.937 16.799 726 HB2 LYS 133 HB2 LYS 133 15.658 1.383 13.870 727 HB3 LYS 133 HB1 LYS 133 16.604 1.985 15.211 728 HG2 LYS 133 HG2 LYS 133 17.178 -0.415 15.716 729 HG3 LYS 133 HG1 LYS 133 16.415 -0.824 14.176 730 HD2 LYS 133 HD2 LYS 133 18.792 0.995 14.603 731 HD3 LYS 133 HD1 LYS 133 18.794 -0.578 13.819 732 HE2 LYS 133 HE2 LYS 133 17.356 1.883 12.779 733 HE3 LYS 133 HE1 LYS 133 18.923 1.319 12.234 734 HZ1 LYS 133 HZ1 LYS 133 17.129 0.629 10.746 735 HZ2 LYS 133 HZ2 LYS 133 16.408 -0.268 11.990 736 HZ3 LYS 133 HZ3 LYS 133 17.906 -0.691 11.435 737 H GLU 134 HN GLU 134 14.830 3.153 17.141 738 HA GLU 134 HA GLU 134 12.993 4.368 15.266 739 HB2 GLU 134 HB2 GLU 134 12.648 6.187 16.918 740 HB3 GLU 134 HB1 GLU 134 12.251 4.627 17.602 741 HG2 GLU 134 HG2 GLU 134 14.234 4.613 18.907 742 HG3 GLU 134 HG1 GLU 134 14.861 6.030 18.067 743 H GLY 135 HN GLY 135 13.991 5.202 13.662 744 HA2 GLY 135 HA2 GLY 135 16.234 6.976 14.043 745 HA3 GLY 135 HA1 GLY 135 16.554 5.527 13.094 746 H GLY 136 HN GLY 136 16.990 7.498 11.612 747 HA2 GLY 136 HA2 GLY 136 14.528 8.140 10.179 748 HA3 GLY 136 HA1 GLY 136 16.077 8.945 9.943 749 H SER 137 HN SER 137 14.088 7.263 8.261 750 HA SER 137 HA SER 137 15.725 6.027 6.407 751 HB2 SER 137 HB2 SER 137 16.240 4.377 8.197 752 HB3 SER 137 HB1 SER 137 14.526 4.151 8.505 753 HG SER 137 HG SER 137 16.091 2.876 6.772 754 H ASP 138 HN ASP 138 14.112 4.383 5.190 755 HA ASP 138 HA ASP 138 11.556 5.769 4.988 756 HB2 ASP 138 HB2 ASP 138 12.896 3.667 3.306 757 HB3 ASP 138 HB1 ASP 138 11.166 3.912 3.166 758 H ASN 139 HN ASN 139 12.515 2.414 5.131 759 HA ASN 139 HA ASN 139 9.954 1.660 6.326 760 HB2 ASN 139 HB2 ASN 139 10.677 0.406 4.410 761 HB3 ASN 139 HB1 ASN 139 12.239 0.100 5.143 762 HD21 ASN 139 HD21 ASN 139 12.396 -1.440 6.800 763 HD22 ASN 139 HD22 ASN 139 11.175 -2.639 6.973 764 H ASP 140 HN ASP 140 13.336 1.858 7.146 765 HA ASP 140 HA ASP 140 12.877 0.323 9.598 766 HB2 ASP 140 HB2 ASP 140 15.405 1.130 8.161 767 HB3 ASP 140 HB1 ASP 140 15.436 0.498 9.799 768 H ALA 141 HN ALA 141 12.143 3.147 8.943 769 HA ALA 141 HA ALA 141 13.432 4.619 11.134 770 HB1 ALA 141 HB1 ALA 141 12.218 6.523 10.257 771 HB2 ALA 141 HB2 ALA 141 11.461 5.488 9.046 772 HB3 ALA 141 HB3 ALA 141 13.201 5.768 9.003 773 H ASP 142 HN ASP 142 12.054 5.649 12.694 774 HA ASP 142 HA ASP 142 9.729 4.052 13.263 775 HB2 ASP 142 HB2 ASP 142 9.457 5.369 15.288 776 HB3 ASP 142 HB1 ASP 142 11.115 4.823 15.192 777 H ILE 143 HN ILE 143 7.734 4.654 13.003 778 HA ILE 143 HA ILE 143 7.404 7.085 11.470 779 HB ILE 143 HB ILE 143 5.322 6.040 10.515 780 HG12 ILE 143 HG12 ILE 143 5.372 3.430 10.536 781 HG13 ILE 143 HG11 ILE 143 6.315 3.604 12.005 782 HG21 ILE 143 HG21 ILE 143 6.513 4.572 8.950 783 HG22 ILE 143 HG22 ILE 143 7.916 4.627 10.023 784 HG23 ILE 143 HG23 ILE 143 7.340 6.104 9.249 785 HD11 ILE 143 HD11 ILE 143 3.544 4.694 11.597 786 HD12 ILE 143 HD12 ILE 143 4.470 4.707 13.096 787 HD13 ILE 143 HD13 ILE 143 3.927 3.175 12.401 788 H GLY 144 HN GLY 144 6.315 8.697 12.312 789 HA2 GLY 144 HA2 GLY 144 4.239 8.136 14.211 790 HA3 GLY 144 HA1 GLY 144 5.690 8.864 14.883 791 H ASN 145 HN ASN 145 3.815 10.287 15.358 792 HA ASN 145 HA ASN 145 3.950 12.447 13.497 793 HB2 ASN 145 HB2 ASN 145 1.577 12.941 13.456 794 HB3 ASN 145 HB1 ASN 145 1.784 11.291 12.925 795 HD21 ASN 145 HD21 ASN 145 2.006 10.255 15.728 796 HD22 ASN 145 HD22 ASN 145 0.391 10.374 16.331 797 H TRP 146 HN TRP 146 3.425 14.459 14.608 798 HA TRP 146 HA TRP 146 4.058 14.113 17.445 799 HB2 TRP 146 HB2 TRP 146 5.942 14.248 15.482 800 HB3 TRP 146 HB1 TRP 146 5.761 15.930 15.943 801 HD1 TRP 146 HD1 TRP 146 6.611 16.617 18.343 802 HE1 TRP 146 HE1 TRP 146 8.221 15.437 19.981 803 HE3 TRP 146 HE3 TRP 146 6.537 11.920 16.353 804 HZ2 TRP 146 HZ2 TRP 146 9.302 12.907 20.361 805 HZ3 TRP 146 HZ3 TRP 146 7.898 10.167 17.461 806 HH2 TRP 146 HH2 TRP 146 9.241 10.661 19.396 807 H ASP 147 HN ASP 147 3.436 15.871 18.602 808 HA ASP 147 HA ASP 147 2.789 18.276 17.117 809 HB2 ASP 147 HB2 ASP 147 0.676 17.128 17.866 810 HB3 ASP 147 HB1 ASP 147 1.239 17.296 19.527 811 H ASN 148 HN ASN 148 4.528 19.256 17.511 812 HA ASN 148 HA ASN 148 5.246 20.069 20.201 813 HB2 ASN 148 HB2 ASN 148 6.629 18.086 19.866 814 HB3 ASN 148 HB1 ASN 148 7.098 18.652 18.265 815 HD21 ASN 148 HD21 ASN 148 9.257 18.560 18.755 816 HD22 ASN 148 HD22 ASN 148 10.023 19.695 19.805 Start of MODEL 5 1 H1 MET 39 HT1 MET 39 2.014 4.770 0.040 2 H2 MET 39 HT2 MET 39 1.816 5.038 -1.591 3 H3 MET 39 HT3 MET 39 2.433 6.268 -0.632 4 HA MET 39 HA MET 39 4.164 5.254 -1.963 5 HB2 MET 39 HB2 MET 39 4.459 5.925 0.616 6 HB3 MET 39 HB1 MET 39 4.650 4.201 0.832 7 HG2 MET 39 HG2 MET 39 6.523 4.168 -0.670 8 HG3 MET 39 HG1 MET 39 6.327 5.894 -0.980 9 HE1 MET 39 HE1 MET 39 8.706 6.602 -0.311 10 HE2 MET 39 HE2 MET 39 9.108 4.893 -0.143 11 HE3 MET 39 HE3 MET 39 9.546 6.032 1.132 12 H SER 40 HN SER 40 3.748 3.562 -3.344 13 HA SER 40 HA SER 40 3.021 1.016 -2.126 14 HB2 SER 40 HB2 SER 40 2.595 1.978 -4.953 15 HB3 SER 40 HB1 SER 40 1.978 0.481 -4.250 16 HG SER 40 HG SER 40 0.779 1.721 -2.793 17 H ARG 41 HN ARG 41 5.141 0.356 -1.654 18 HA ARG 41 HA ARG 41 6.411 -1.109 -3.777 19 HB2 ARG 41 HB2 ARG 41 7.913 1.008 -2.183 20 HB3 ARG 41 HB1 ARG 41 8.725 -0.320 -2.980 21 HG2 ARG 41 HG2 ARG 41 7.094 1.813 -4.343 22 HG3 ARG 41 HG1 ARG 41 8.858 1.758 -4.252 23 HD2 ARG 41 HD2 ARG 41 8.859 -0.338 -5.492 24 HD3 ARG 41 HD1 ARG 41 7.098 -0.324 -5.550 25 HE ARG 41 HE ARG 41 8.232 2.042 -6.607 26 HH11 ARG 41 HH11 ARG 41 7.494 -1.323 -7.414 27 HH12 ARG 41 HH12 ARG 41 7.376 -1.030 -9.098 28 HH21 ARG 41 HH21 ARG 41 8.075 2.411 -8.934 29 HH22 ARG 41 HH22 ARG 41 7.714 1.098 -9.962 30 HA PRO 42 HA PRO 42 6.918 -4.132 -0.545 31 HB2 PRO 42 HB2 PRO 42 9.847 -4.081 -1.164 32 HB3 PRO 42 HB1 PRO 42 8.768 -5.472 -0.981 33 HG2 PRO 42 HG2 PRO 42 9.487 -4.702 -3.400 34 HG3 PRO 42 HG1 PRO 42 7.802 -5.157 -3.083 35 HD2 PRO 42 HD2 PRO 42 8.994 -2.434 -3.410 36 HD3 PRO 42 HD1 PRO 42 7.424 -3.054 -3.958 37 H ASP 43 HN ASP 43 6.868 -3.714 1.485 38 HA ASP 43 HA ASP 43 7.283 -3.142 3.583 39 HB2 ASP 43 HB2 ASP 43 9.796 -3.625 2.910 40 HB3 ASP 43 HB1 ASP 43 9.912 -1.863 3.009 41 H GLN 44 HN GLN 44 7.993 -0.771 1.170 42 HA GLN 44 HA GLN 44 7.473 1.507 2.822 43 HB2 GLN 44 HB2 GLN 44 7.146 1.344 -0.174 44 HB3 GLN 44 HB1 GLN 44 7.388 2.793 0.792 45 HG2 GLN 44 HG2 GLN 44 9.632 1.883 1.444 46 HG3 GLN 44 HG1 GLN 44 9.382 0.598 0.265 47 HE21 GLN 44 HE21 GLN 44 11.466 2.535 0.280 48 HE22 GLN 44 HE22 GLN 44 11.313 3.455 -1.171 49 H ALA 45 HN ALA 45 5.574 -0.786 1.244 50 HA ALA 45 HA ALA 45 3.079 0.518 1.222 51 HB1 ALA 45 HB1 ALA 45 3.710 -2.416 1.473 52 HB2 ALA 45 HB2 ALA 45 3.531 -1.527 -0.040 53 HB3 ALA 45 HB3 ALA 45 2.147 -1.729 1.037 54 H LYS 46 HN LYS 46 5.030 -0.746 3.734 55 HA LYS 46 HA LYS 46 2.865 -1.070 5.648 56 HB2 LYS 46 HB2 LYS 46 5.857 -1.091 5.996 57 HB3 LYS 46 HB1 LYS 46 4.678 -1.615 7.180 58 HG2 LYS 46 HG2 LYS 46 4.067 -3.489 5.835 59 HG3 LYS 46 HG1 LYS 46 5.056 -2.902 4.493 60 HD2 LYS 46 HD2 LYS 46 7.050 -3.110 5.903 61 HD3 LYS 46 HD1 LYS 46 6.047 -3.747 7.205 62 HE2 LYS 46 HE2 LYS 46 5.443 -5.622 5.904 63 HE3 LYS 46 HE1 LYS 46 6.277 -4.997 4.475 64 HZ1 LYS 46 HZ1 LYS 46 7.504 -5.873 7.033 65 HZ2 LYS 46 HZ2 LYS 46 8.339 -5.078 5.810 66 HZ3 LYS 46 HZ3 LYS 46 7.678 -6.606 5.516 67 H VAL 47 HN VAL 47 5.191 1.239 4.550 68 HA VAL 47 HA VAL 47 5.206 2.943 6.860 69 HB VAL 47 HB VAL 47 5.866 3.662 3.990 70 HG11 VAL 47 HG11 VAL 47 5.606 5.604 5.431 71 HG12 VAL 47 HG12 VAL 47 7.293 5.395 4.955 72 HG13 VAL 47 HG13 VAL 47 6.769 4.921 6.568 73 HG21 VAL 47 HG21 VAL 47 7.164 1.727 4.720 74 HG22 VAL 47 HG22 VAL 47 7.750 2.661 6.103 75 HG23 VAL 47 HG23 VAL 47 8.154 3.159 4.455 76 H THR 48 HN THR 48 3.646 2.824 3.765 77 HA THR 48 HA THR 48 2.348 5.288 3.952 78 HB THR 48 HB THR 48 2.879 4.113 1.827 79 HG1 THR 48 HG1 THR 48 1.040 5.705 2.201 80 HG21 THR 48 HG21 THR 48 0.508 2.376 2.505 81 HG22 THR 48 HG22 THR 48 2.200 1.877 2.455 82 HG23 THR 48 HG23 THR 48 1.392 2.384 0.971 83 H VAL 49 HN VAL 49 1.409 2.092 5.106 84 HA VAL 49 HA VAL 49 -1.303 2.982 5.566 85 HB VAL 49 HB VAL 49 -1.799 0.830 6.507 86 HG11 VAL 49 HG11 VAL 49 -0.052 0.487 4.104 87 HG12 VAL 49 HG12 VAL 49 -1.768 0.893 4.125 88 HG13 VAL 49 HG13 VAL 49 -1.228 -0.685 4.697 89 HG21 VAL 49 HG21 VAL 49 0.158 0.435 7.884 90 HG22 VAL 49 HG22 VAL 49 1.166 0.230 6.456 91 HG23 VAL 49 HG23 VAL 49 -0.097 -0.951 6.822 92 H ALA 50 HN ALA 50 1.652 2.634 7.341 93 HA ALA 50 HA ALA 50 0.486 2.833 9.900 94 HB1 ALA 50 HB1 ALA 50 2.677 1.783 9.442 95 HB2 ALA 50 HB2 ALA 50 2.704 2.998 10.719 96 HB3 ALA 50 HB3 ALA 50 3.321 3.401 9.116 97 H LYS 51 HN LYS 51 1.785 5.198 7.606 98 HA LYS 51 HA LYS 51 1.796 7.226 9.513 99 HB2 LYS 51 HB2 LYS 51 1.768 7.414 6.509 100 HB3 LYS 51 HB1 LYS 51 2.016 8.792 7.580 101 HG2 LYS 51 HG2 LYS 51 3.984 7.716 8.531 102 HG3 LYS 51 HG1 LYS 51 3.733 6.323 7.489 103 HD2 LYS 51 HD2 LYS 51 5.462 7.706 6.572 104 HD3 LYS 51 HD1 LYS 51 4.031 7.769 5.537 105 HE2 LYS 51 HE2 LYS 51 3.446 9.939 6.354 106 HE3 LYS 51 HE1 LYS 51 4.651 9.845 7.633 107 HZ1 LYS 51 HZ1 LYS 51 5.252 9.984 4.716 108 HZ2 LYS 51 HZ2 LYS 51 6.376 9.888 5.972 109 HZ3 LYS 51 HZ3 LYS 51 5.423 11.242 5.833 110 H GLY 52 HN GLY 52 -0.724 5.924 7.550 111 HA2 GLY 52 HA2 GLY 52 -2.528 8.140 8.054 112 HA3 GLY 52 HA1 GLY 52 -2.956 6.598 7.300 113 H ASP 53 HN ASP 53 -1.533 5.224 9.475 114 HA ASP 53 HA ASP 53 -3.841 4.792 11.107 115 HB2 ASP 53 HB2 ASP 53 -2.256 3.012 10.207 116 HB3 ASP 53 HB1 ASP 53 -1.109 3.560 11.420 117 H ILE 54 HN ILE 54 -0.579 6.096 11.534 118 HA ILE 54 HA ILE 54 -0.887 6.699 14.277 119 HB ILE 54 HB ILE 54 0.917 8.406 13.997 120 HG12 ILE 54 HG12 ILE 54 0.743 7.565 11.116 121 HG13 ILE 54 HG11 ILE 54 0.380 9.151 11.764 122 HG21 ILE 54 HG21 ILE 54 2.694 6.857 13.439 123 HG22 ILE 54 HG22 ILE 54 1.509 5.715 12.799 124 HG23 ILE 54 HG23 ILE 54 1.503 6.128 14.521 125 HD11 ILE 54 HD11 ILE 54 3.074 7.842 11.709 126 HD12 ILE 54 HD12 ILE 54 2.721 9.456 12.350 127 HD13 ILE 54 HD13 ILE 54 2.508 9.114 10.628 128 H LYS 55 HN LYS 55 -1.955 8.385 11.407 129 HA LYS 55 HA LYS 55 -2.652 10.780 12.813 130 HB2 LYS 55 HB2 LYS 55 -3.215 9.731 10.083 131 HB3 LYS 55 HB1 LYS 55 -4.289 10.970 10.703 132 HG2 LYS 55 HG2 LYS 55 -2.433 11.876 9.308 133 HG3 LYS 55 HG1 LYS 55 -2.466 12.528 10.945 134 HD2 LYS 55 HD2 LYS 55 -0.688 11.002 11.596 135 HD3 LYS 55 HD1 LYS 55 -0.687 10.289 9.984 136 HE2 LYS 55 HE2 LYS 55 -0.020 13.151 10.653 137 HE3 LYS 55 HE1 LYS 55 1.144 11.872 10.318 138 HZ1 LYS 55 HZ1 LYS 55 0.043 11.656 8.094 139 HZ2 LYS 55 HZ2 LYS 55 0.886 13.068 8.354 140 HZ3 LYS 55 HZ3 LYS 55 -0.795 13.094 8.439 141 H ALA 56 HN ALA 56 -4.147 7.756 12.253 142 HA ALA 56 HA ALA 56 -6.776 8.372 13.110 143 HB1 ALA 56 HB1 ALA 56 -7.012 5.985 13.351 144 HB2 ALA 56 HB2 ALA 56 -5.253 5.818 13.365 145 HB3 ALA 56 HB3 ALA 56 -6.064 6.324 11.886 146 H ILE 57 HN ILE 57 -3.961 6.986 14.716 147 HA ILE 57 HA ILE 57 -5.033 6.675 17.298 148 HB ILE 57 HB ILE 57 -2.194 7.414 16.695 149 HG12 ILE 57 HG12 ILE 57 -3.345 4.629 16.677 150 HG13 ILE 57 HG11 ILE 57 -2.966 5.550 15.230 151 HG21 ILE 57 HG21 ILE 57 -1.715 5.988 18.702 152 HG22 ILE 57 HG22 ILE 57 -3.450 5.737 18.897 153 HG23 ILE 57 HG23 ILE 57 -2.768 7.353 19.076 154 HD11 ILE 57 HD11 ILE 57 -1.234 4.000 15.648 155 HD12 ILE 57 HD12 ILE 57 -1.007 4.587 17.310 156 HD13 ILE 57 HD13 ILE 57 -0.589 5.614 15.953 157 H ALA 58 HN ALA 58 -3.282 9.343 15.763 158 HA ALA 58 HA ALA 58 -3.077 11.032 17.971 159 HB1 ALA 58 HB1 ALA 58 -1.838 11.352 15.877 160 HB2 ALA 58 HB2 ALA 58 -2.676 12.819 16.382 161 HB3 ALA 58 HB3 ALA 58 -3.335 11.830 15.078 162 H ALA 59 HN ALA 59 -5.782 10.381 15.906 163 HA ALA 59 HA ALA 59 -7.262 12.710 16.750 164 HB1 ALA 59 HB1 ALA 59 -9.077 11.777 15.394 165 HB2 ALA 59 HB2 ALA 59 -8.137 10.300 15.157 166 HB3 ALA 59 HB3 ALA 59 -7.567 11.825 14.485 167 H ALA 60 HN ALA 60 -6.835 9.420 17.656 168 HA ALA 60 HA ALA 60 -9.098 9.419 19.438 169 HB1 ALA 60 HB1 ALA 60 -8.248 7.204 20.127 170 HB2 ALA 60 HB2 ALA 60 -6.811 7.463 19.142 171 HB3 ALA 60 HB3 ALA 60 -8.390 7.323 18.374 172 H LEU 61 HN LEU 61 -5.701 10.096 19.496 173 HA LEU 61 HA LEU 61 -5.358 10.338 22.304 174 HB2 LEU 61 HB2 LEU 61 -3.670 10.215 20.279 175 HB3 LEU 61 HB1 LEU 61 -3.925 11.937 20.192 176 HG LEU 61 HG LEU 61 -1.833 11.217 21.339 177 HD11 LEU 61 HD11 LEU 61 -3.761 12.773 23.024 178 HD12 LEU 61 HD12 LEU 61 -2.717 13.415 21.751 179 HD13 LEU 61 HD13 LEU 61 -2.010 12.747 23.220 180 HD21 LEU 61 HD21 LEU 61 -1.935 10.385 23.600 181 HD22 LEU 61 HD22 LEU 61 -2.730 9.252 22.492 182 HD23 LEU 61 HD23 LEU 61 -3.690 10.335 23.515 183 H ASP 62 HN ASP 62 -6.557 12.458 19.754 184 HA ASP 62 HA ASP 62 -7.038 14.707 21.415 185 HB2 ASP 62 HB2 ASP 62 -8.101 13.878 18.738 186 HB3 ASP 62 HB1 ASP 62 -8.987 15.101 19.627 187 H MET 63 HN MET 63 -8.645 11.716 21.009 188 HA MET 63 HA MET 63 -11.049 12.641 22.252 189 HB2 MET 63 HB2 MET 63 -10.155 9.911 21.409 190 HB3 MET 63 HB1 MET 63 -11.545 10.109 22.464 191 HG2 MET 63 HG2 MET 63 -11.237 11.370 19.761 192 HG3 MET 63 HG1 MET 63 -12.160 9.906 20.108 193 HE1 MET 63 HE1 MET 63 -14.289 10.958 18.989 194 HE2 MET 63 HE2 MET 63 -13.396 12.438 18.633 195 HE3 MET 63 HE3 MET 63 -14.966 12.525 19.429 196 H TYR 64 HN TYR 64 -8.147 10.993 23.319 197 HA TYR 64 HA TYR 64 -9.122 10.634 25.992 198 HB2 TYR 64 HB2 TYR 64 -7.058 9.487 25.118 199 HB3 TYR 64 HB1 TYR 64 -6.228 11.045 25.193 200 HD1 TYR 64 HD2 TYR 64 -7.744 8.352 27.214 201 HD2 TYR 64 HD1 TYR 64 -5.652 12.061 27.363 202 HE1 TYR 64 HE2 TYR 64 -7.290 7.993 29.468 203 HE2 TYR 64 HE1 TYR 64 -5.215 11.708 29.683 204 HH TYR 64 HH TYR 64 -6.371 10.480 31.428 205 H LYS 65 HN LYS 65 -7.382 13.156 24.243 206 HA LYS 65 HA LYS 65 -6.969 15.094 26.111 207 HB2 LYS 65 HB2 LYS 65 -6.203 15.239 23.895 208 HB3 LYS 65 HB1 LYS 65 -7.824 15.079 23.263 209 HG2 LYS 65 HG2 LYS 65 -8.345 17.304 24.050 210 HG3 LYS 65 HG1 LYS 65 -6.679 17.492 24.651 211 HD2 LYS 65 HD2 LYS 65 -5.851 16.972 22.403 212 HD3 LYS 65 HD1 LYS 65 -7.505 16.870 21.824 213 HE2 LYS 65 HE2 LYS 65 -7.813 19.231 22.282 214 HE3 LYS 65 HE1 LYS 65 -6.178 19.318 22.955 215 HZ1 LYS 65 HZ1 LYS 65 -6.809 18.497 20.175 216 HZ2 LYS 65 HZ2 LYS 65 -5.286 18.653 20.843 217 HZ3 LYS 65 HZ3 LYS 65 -6.239 20.034 20.607 218 H LEU 66 HN LEU 66 -9.927 14.195 24.456 219 HA LEU 66 HA LEU 66 -11.434 16.290 25.724 220 HB2 LEU 66 HB2 LEU 66 -12.215 14.029 23.936 221 HB3 LEU 66 HB1 LEU 66 -13.364 15.203 24.560 222 HG LEU 66 HG LEU 66 -11.042 15.781 22.722 223 HD11 LEU 66 HD11 LEU 66 -12.811 14.521 21.624 224 HD12 LEU 66 HD12 LEU 66 -12.751 16.179 21.033 225 HD13 LEU 66 HD13 LEU 66 -14.002 15.696 22.180 226 HD21 LEU 66 HD21 LEU 66 -12.094 17.999 22.503 227 HD22 LEU 66 HD22 LEU 66 -11.512 17.688 24.135 228 HD23 LEU 66 HD23 LEU 66 -13.236 17.568 23.775 229 H ASP 67 HN ASP 67 -10.808 12.862 26.226 230 HA ASP 67 HA ASP 67 -13.037 12.413 27.983 231 HB2 ASP 67 HB2 ASP 67 -12.126 10.580 26.711 232 HB3 ASP 67 HB1 ASP 67 -10.520 10.873 27.354 233 H ASN 68 HN ASN 68 -9.724 13.504 28.395 234 HA ASN 68 HA ASN 68 -10.186 13.731 31.345 235 HB2 ASN 68 HB2 ASN 68 -8.237 12.231 30.010 236 HB3 ASN 68 HB1 ASN 68 -7.661 13.897 30.358 237 HD21 ASN 68 HD21 ASN 68 -6.096 12.676 31.585 238 HD22 ASN 68 HD22 ASN 68 -6.424 12.352 33.252 239 H PHE 69 HN PHE 69 -10.628 15.425 28.982 240 HA PHE 69 HA PHE 69 -10.389 17.638 28.316 241 HB2 PHE 69 HB2 PHE 69 -10.533 19.189 30.325 242 HB3 PHE 69 HB1 PHE 69 -11.790 17.969 30.166 243 HD1 PHE 69 HD2 PHE 69 -8.646 18.696 31.907 244 HD2 PHE 69 HD1 PHE 69 -12.114 16.429 31.796 245 HE1 PHE 69 HE2 PHE 69 -8.174 17.978 34.200 246 HE2 PHE 69 HE1 PHE 69 -11.737 15.626 34.061 247 HZ PHE 69 HZ PHE 69 -9.730 16.400 35.316 248 H ALA 70 HN ALA 70 -7.831 16.368 28.336 249 HA ALA 70 HA ALA 70 -5.991 18.447 28.159 250 HB1 ALA 70 HB1 ALA 70 -4.660 18.008 30.197 251 HB2 ALA 70 HB2 ALA 70 -5.928 16.889 30.730 252 HB3 ALA 70 HB3 ALA 70 -6.288 18.599 30.594 253 H TYR 71 HN TYR 71 -3.864 17.526 27.766 254 HA TYR 71 HA TYR 71 -4.039 14.867 26.777 255 HB2 TYR 71 HB2 TYR 71 -1.785 16.856 26.905 256 HB3 TYR 71 HB1 TYR 71 -1.511 15.201 26.380 257 HD1 TYR 71 HD2 TYR 71 -3.690 14.499 24.712 258 HD2 TYR 71 HD1 TYR 71 -1.790 18.281 25.122 259 HE1 TYR 71 HE2 TYR 71 -4.422 15.034 22.534 260 HE2 TYR 71 HE1 TYR 71 -2.514 18.887 22.850 261 HH TYR 71 HH TYR 71 -3.194 17.826 20.804 262 HA PRO 72 HA PRO 72 -2.697 12.483 30.260 263 HB2 PRO 72 HB2 PRO 72 -0.890 10.821 28.952 264 HB3 PRO 72 HB1 PRO 72 -2.646 10.584 28.937 265 HG2 PRO 72 HG2 PRO 72 -0.854 11.870 26.921 266 HG3 PRO 72 HG1 PRO 72 -2.194 10.742 26.666 267 HD2 PRO 72 HD2 PRO 72 -2.494 13.325 26.244 268 HD3 PRO 72 HD1 PRO 72 -3.787 12.375 26.998 269 H SER 73 HN SER 73 -0.640 12.082 31.629 270 HA SER 73 HA SER 73 1.405 13.974 30.829 271 HB2 SER 73 HB2 SER 73 2.268 13.530 33.185 272 HB3 SER 73 HB1 SER 73 0.642 14.184 33.135 273 HG SER 73 HG SER 73 -0.106 12.484 33.921 274 H THR 74 HN THR 74 3.716 13.104 30.838 275 HA THR 74 HA THR 74 3.657 10.678 29.308 276 HB THR 74 HB THR 74 5.317 12.740 29.171 277 HG1 THR 74 HG1 THR 74 6.484 11.487 27.831 278 HG21 THR 74 HG21 THR 74 6.848 10.842 31.008 279 HG22 THR 74 HG22 THR 74 6.268 12.408 31.486 280 HG23 THR 74 HG23 THR 74 7.520 12.283 30.247 281 H GLN 75 HN GLN 75 3.773 11.290 32.539 282 HA GLN 75 HA GLN 75 4.899 8.705 33.225 283 HB2 GLN 75 HB2 GLN 75 5.788 10.657 34.271 284 HB3 GLN 75 HB1 GLN 75 4.190 11.174 34.741 285 HG2 GLN 75 HG2 GLN 75 4.070 9.514 36.408 286 HG3 GLN 75 HG1 GLN 75 5.543 8.725 35.805 287 HE21 GLN 75 HE21 GLN 75 4.304 11.685 37.197 288 HE22 GLN 75 HE22 GLN 75 5.846 12.232 37.751 289 H GLN 76 HN GLN 76 2.008 10.694 34.313 290 HA GLN 76 HA GLN 76 0.726 8.191 35.114 291 HB2 GLN 76 HB2 GLN 76 -0.063 11.068 35.504 292 HB3 GLN 76 HB1 GLN 76 -1.017 9.689 36.026 293 HG2 GLN 76 HG2 GLN 76 0.829 8.979 37.476 294 HG3 GLN 76 HG1 GLN 76 1.747 10.395 36.974 295 HE21 GLN 76 HE21 GLN 76 1.840 11.111 39.074 296 HE22 GLN 76 HE22 GLN 76 0.496 11.850 39.860 297 H GLY 77 HN GLY 77 0.491 10.558 32.642 298 HA2 GLY 77 HA2 GLY 77 -1.987 9.517 31.751 299 HA3 GLY 77 HA1 GLY 77 -0.900 10.527 30.817 300 H LEU 78 HN LEU 78 1.342 8.519 31.371 301 HA LEU 78 HA LEU 78 0.901 6.887 29.073 302 HB2 LEU 78 HB2 LEU 78 3.167 7.593 30.138 303 HB3 LEU 78 HB1 LEU 78 2.890 6.300 31.274 304 HG LEU 78 HG LEU 78 3.158 5.888 28.291 305 HD11 LEU 78 HD11 LEU 78 5.201 5.539 30.462 306 HD12 LEU 78 HD12 LEU 78 5.208 6.776 29.201 307 HD13 LEU 78 HD13 LEU 78 5.391 5.072 28.772 308 HD21 LEU 78 HD21 LEU 78 1.952 4.080 29.423 309 HD22 LEU 78 HD22 LEU 78 3.268 3.922 30.585 310 HD23 LEU 78 HD23 LEU 78 3.543 3.535 28.884 311 H GLU 79 HN GLU 79 0.893 6.308 32.551 312 HA GLU 79 HA GLU 79 -0.168 3.707 32.449 313 HB2 GLU 79 HB2 GLU 79 -0.222 5.800 34.594 314 HB3 GLU 79 HB1 GLU 79 -0.996 4.236 34.787 315 HG2 GLU 79 HG2 GLU 79 1.927 4.737 34.314 316 HG3 GLU 79 HG1 GLU 79 1.096 4.242 35.811 317 H ALA 80 HN ALA 80 -1.574 6.770 31.974 318 HA ALA 80 HA ALA 80 -4.256 5.796 32.483 319 HB1 ALA 80 HB1 ALA 80 -4.961 8.039 32.236 320 HB2 ALA 80 HB2 ALA 80 -3.506 8.433 31.353 321 HB3 ALA 80 HB3 ALA 80 -3.391 8.112 33.088 322 H LEU 81 HN LEU 81 -2.123 5.723 29.995 323 HA LEU 81 HA LEU 81 -4.201 5.618 27.958 324 HB2 LEU 81 HB2 LEU 81 -1.318 6.081 28.013 325 HB3 LEU 81 HB1 LEU 81 -1.797 5.021 26.715 326 HG LEU 81 HG LEU 81 -3.251 6.789 25.784 327 HD11 LEU 81 HD11 LEU 81 -2.397 8.470 28.105 328 HD12 LEU 81 HD12 LEU 81 -4.003 7.789 27.850 329 HD13 LEU 81 HD13 LEU 81 -3.367 8.988 26.726 330 HD21 LEU 81 HD21 LEU 81 -1.534 8.431 25.200 331 HD22 LEU 81 HD22 LEU 81 -0.909 6.789 25.119 332 HD23 LEU 81 HD23 LEU 81 -0.499 7.815 26.488 333 H VAL 82 HN VAL 82 -2.256 3.623 29.916 334 HA VAL 82 HA VAL 82 -3.130 1.258 28.393 335 HB VAL 82 HB VAL 82 -0.985 1.359 30.548 336 HG11 VAL 82 HG11 VAL 82 -1.653 -0.811 28.558 337 HG12 VAL 82 HG12 VAL 82 -1.963 -0.866 30.291 338 HG13 VAL 82 HG13 VAL 82 -0.304 -0.837 29.691 339 HG21 VAL 82 HG21 VAL 82 -0.659 1.339 27.538 340 HG22 VAL 82 HG22 VAL 82 0.655 1.212 28.706 341 HG23 VAL 82 HG23 VAL 82 -0.304 2.687 28.613 342 H LYS 83 HN LYS 83 -3.365 2.827 31.516 343 HA LYS 83 HA LYS 83 -5.296 0.844 32.471 344 HB2 LYS 83 HB2 LYS 83 -3.059 2.278 33.966 345 HB3 LYS 83 HB1 LYS 83 -4.514 1.839 34.832 346 HG2 LYS 83 HG2 LYS 83 -2.817 0.190 35.196 347 HG3 LYS 83 HG1 LYS 83 -4.093 -0.527 34.223 348 HD2 LYS 83 HD2 LYS 83 -2.699 -0.040 32.207 349 HD3 LYS 83 HD1 LYS 83 -1.401 0.452 33.295 350 HE2 LYS 83 HE2 LYS 83 -1.099 -1.844 32.569 351 HE3 LYS 83 HE1 LYS 83 -1.408 -1.776 34.304 352 HZ1 LYS 83 HZ1 LYS 83 -3.467 -2.421 32.248 353 HZ2 LYS 83 HZ2 LYS 83 -3.687 -2.457 33.910 354 HZ3 LYS 83 HZ3 LYS 83 -2.655 -3.549 33.181 355 H LYS 84 HN LYS 84 -7.094 1.822 33.632 356 HA LYS 84 HA LYS 84 -8.122 4.120 32.399 357 HB2 LYS 84 HB2 LYS 84 -8.926 2.896 35.054 358 HB3 LYS 84 HB1 LYS 84 -9.848 4.132 34.212 359 HG2 LYS 84 HG2 LYS 84 -10.187 2.623 32.335 360 HG3 LYS 84 HG1 LYS 84 -9.220 1.395 33.136 361 HD2 LYS 84 HD2 LYS 84 -11.511 0.799 33.447 362 HD3 LYS 84 HD1 LYS 84 -10.923 1.387 34.990 363 HE2 LYS 84 HE2 LYS 84 -12.483 3.098 33.049 364 HE3 LYS 84 HE1 LYS 84 -13.258 2.124 34.287 365 HZ1 LYS 84 HZ1 LYS 84 -13.085 4.304 35.086 366 HZ2 LYS 84 HZ2 LYS 84 -11.489 4.488 34.672 367 HZ3 LYS 84 HZ3 LYS 84 -11.922 3.451 35.944 368 HA PRO 85 HA PRO 85 -5.960 7.586 33.966 369 HB2 PRO 85 HB2 PRO 85 -8.075 9.397 33.990 370 HB3 PRO 85 HB1 PRO 85 -7.105 8.972 32.571 371 HG2 PRO 85 HG2 PRO 85 -9.729 7.880 33.447 372 HG3 PRO 85 HG1 PRO 85 -9.198 8.369 31.823 373 HD2 PRO 85 HD2 PRO 85 -9.271 5.820 32.463 374 HD3 PRO 85 HD1 PRO 85 -7.873 6.453 31.567 375 H THR 86 HN THR 86 -5.638 8.879 35.758 376 HA THR 86 HA THR 86 -7.134 8.048 38.099 377 HB THR 86 HB THR 86 -5.161 9.126 39.308 378 HG1 THR 86 HG1 THR 86 -3.643 8.820 36.983 379 HG21 THR 86 HG21 THR 86 -5.343 6.701 39.054 380 HG22 THR 86 HG22 THR 86 -3.661 7.200 38.861 381 HG23 THR 86 HG23 THR 86 -4.634 6.800 37.447 382 H GLY 87 HN GLY 87 -8.363 9.471 39.206 383 HA2 GLY 87 HA2 GLY 87 -8.763 11.725 39.974 384 HA3 GLY 87 HA1 GLY 87 -8.239 12.286 38.386 385 H ASN 88 HN ASN 88 -10.068 13.216 37.574 386 HA ASN 88 HA ASN 88 -12.289 11.375 37.255 387 HB2 ASN 88 HB2 ASN 88 -13.969 13.082 37.687 388 HB3 ASN 88 HB1 ASN 88 -12.897 12.990 39.068 389 HD21 ASN 88 HD21 ASN 88 -11.439 14.735 39.411 390 HD22 ASN 88 HD22 ASN 88 -11.738 16.295 38.734 391 HA PRO 89 HA PRO 89 -11.629 12.948 33.137 392 HB2 PRO 89 HB2 PRO 89 -12.225 10.666 31.806 393 HB3 PRO 89 HB1 PRO 89 -10.706 10.810 32.631 394 HG2 PRO 89 HG2 PRO 89 -13.176 9.388 33.526 395 HG3 PRO 89 HG1 PRO 89 -11.482 8.927 33.740 396 HD2 PRO 89 HD2 PRO 89 -13.091 10.140 35.664 397 HD3 PRO 89 HD1 PRO 89 -11.320 10.078 35.691 398 H GLN 90 HN GLN 90 -13.232 13.175 31.353 399 HA GLN 90 HA GLN 90 -15.900 13.583 32.483 400 HB2 GLN 90 HB2 GLN 90 -14.621 14.607 29.927 401 HB3 GLN 90 HB1 GLN 90 -16.275 14.973 30.419 402 HG2 GLN 90 HG2 GLN 90 -15.503 16.086 32.391 403 HG3 GLN 90 HG1 GLN 90 -13.843 15.624 32.058 404 HE21 GLN 90 HE21 GLN 90 -14.898 18.244 32.472 405 HE22 GLN 90 HE22 GLN 90 -14.577 19.155 31.046 406 HA PRO 91 HA PRO 91 -17.762 10.105 30.785 407 HB2 PRO 91 HB2 PRO 91 -19.835 11.595 29.310 408 HB3 PRO 91 HB1 PRO 91 -20.002 10.411 30.607 409 HG2 PRO 91 HG2 PRO 91 -20.408 13.012 31.055 410 HG3 PRO 91 HG1 PRO 91 -19.639 11.977 32.268 411 HD2 PRO 91 HD2 PRO 91 -18.396 13.944 30.393 412 HD3 PRO 91 HD1 PRO 91 -18.009 13.608 32.095 413 H LYS 92 HN LYS 92 -16.230 9.331 29.393 414 HA LYS 92 HA LYS 92 -17.163 8.916 26.738 415 HB2 LYS 92 HB2 LYS 92 -14.386 10.002 27.292 416 HB3 LYS 92 HB1 LYS 92 -14.750 9.054 25.864 417 HG2 LYS 92 HG2 LYS 92 -16.429 10.785 25.231 418 HG3 LYS 92 HG1 LYS 92 -15.860 11.746 26.603 419 HD2 LYS 92 HD2 LYS 92 -13.611 11.770 25.662 420 HD3 LYS 92 HD1 LYS 92 -14.161 10.791 24.302 421 HE2 LYS 92 HE2 LYS 92 -15.191 13.528 25.010 422 HE3 LYS 92 HE1 LYS 92 -13.975 13.201 23.783 423 HZ1 LYS 92 HZ1 LYS 92 -15.609 11.948 22.531 424 HZ2 LYS 92 HZ2 LYS 92 -16.176 13.499 22.840 425 HZ3 LYS 92 HZ3 LYS 92 -16.771 12.211 23.714 426 H ASN 93 HN ASN 93 -16.402 6.939 25.938 427 HA ASN 93 HA ASN 93 -15.755 5.113 28.096 428 HB2 ASN 93 HB2 ASN 93 -16.325 4.561 25.173 429 HB3 ASN 93 HB1 ASN 93 -15.994 3.314 26.366 430 HD21 ASN 93 HD21 ASN 93 -18.284 5.641 25.226 431 HD22 ASN 93 HD22 ASN 93 -19.627 5.084 26.143 432 H TRP 94 HN TRP 94 -13.706 5.384 28.708 433 HA TRP 94 HA TRP 94 -11.499 5.968 27.238 434 HB2 TRP 94 HB2 TRP 94 -11.587 6.159 29.619 435 HB3 TRP 94 HB1 TRP 94 -11.785 4.424 29.814 436 HD1 TRP 94 HD1 TRP 94 -9.150 7.102 29.109 437 HE1 TRP 94 HE1 TRP 94 -6.808 5.994 29.351 438 HE3 TRP 94 HE3 TRP 94 -10.555 2.217 29.662 439 HZ2 TRP 94 HZ2 TRP 94 -5.745 3.457 29.702 440 HZ3 TRP 94 HZ3 TRP 94 -8.815 0.514 29.956 441 HH2 TRP 94 HH2 TRP 94 -6.455 1.131 29.976 442 H ASN 95 HN ASN 95 -9.869 4.850 26.336 443 HA ASN 95 HA ASN 95 -10.319 2.043 25.798 444 HB2 ASN 95 HB2 ASN 95 -10.771 3.345 23.768 445 HB3 ASN 95 HB1 ASN 95 -9.245 4.186 24.000 446 HD21 ASN 95 HD21 ASN 95 -9.498 0.624 24.321 447 HD22 ASN 95 HD22 ASN 95 -8.464 0.359 22.972 448 H LYS 96 HN LYS 96 -8.396 0.763 26.153 449 HA LYS 96 HA LYS 96 -6.048 2.163 27.084 450 HB2 LYS 96 HB2 LYS 96 -5.063 0.028 27.552 451 HB3 LYS 96 HB1 LYS 96 -6.734 -0.063 28.098 452 HG2 LYS 96 HG2 LYS 96 -7.272 -1.353 26.057 453 HG3 LYS 96 HG1 LYS 96 -5.570 -1.190 25.576 454 HD2 LYS 96 HD2 LYS 96 -4.902 -2.350 27.655 455 HD3 LYS 96 HD1 LYS 96 -6.604 -2.604 28.033 456 HE2 LYS 96 HE2 LYS 96 -5.223 -3.606 25.551 457 HE3 LYS 96 HE1 LYS 96 -5.500 -4.570 26.996 458 HZ1 LYS 96 HZ1 LYS 96 -7.639 -3.356 25.315 459 HZ2 LYS 96 HZ2 LYS 96 -7.866 -4.358 26.656 460 HZ3 LYS 96 HZ3 LYS 96 -7.151 -4.963 25.269 461 H ASP 97 HN ASP 97 -4.004 0.490 25.955 462 HA ASP 97 HA ASP 97 -2.610 0.457 24.304 463 HB2 ASP 97 HB2 ASP 97 -5.106 0.288 22.588 464 HB3 ASP 97 HB1 ASP 97 -3.432 0.160 22.041 465 H GLY 98 HN GLY 98 -3.821 2.950 25.263 466 HA2 GLY 98 HA2 GLY 98 -2.871 5.032 25.115 467 HA3 GLY 98 HA1 GLY 98 -2.062 4.540 23.636 468 H TYR 99 HN TYR 99 -5.451 4.097 24.032 469 HA TYR 99 HA TYR 99 -7.165 4.779 22.872 470 HB2 TYR 99 HB2 TYR 99 -5.918 7.236 23.728 471 HB3 TYR 99 HB1 TYR 99 -6.676 7.515 22.139 472 HD1 TYR 99 HD1 TYR 99 -7.080 6.514 25.623 473 HD2 TYR 99 HD2 TYR 99 -9.053 7.561 22.020 474 HE1 TYR 99 HE1 TYR 99 -9.188 6.752 26.842 475 HE2 TYR 99 HE2 TYR 99 -11.164 7.798 23.237 476 HH TYR 99 HH TYR 99 -11.198 7.652 26.682 477 H LEU 100 HN LEU 100 -6.762 3.365 21.427 478 HA LEU 100 HA LEU 100 -5.364 4.111 18.946 479 HB2 LEU 100 HB2 LEU 100 -4.194 2.443 20.351 480 HB3 LEU 100 HB1 LEU 100 -5.636 1.462 20.385 481 HG LEU 100 HG LEU 100 -5.382 1.054 17.954 482 HD11 LEU 100 HD11 LEU 100 -2.812 2.576 18.296 483 HD12 LEU 100 HD12 LEU 100 -4.218 3.025 17.316 484 HD13 LEU 100 HD13 LEU 100 -3.256 1.615 16.882 485 HD21 LEU 100 HD21 LEU 100 -3.464 -0.451 18.137 486 HD22 LEU 100 HD22 LEU 100 -4.481 -0.528 19.576 487 HD23 LEU 100 HD23 LEU 100 -2.963 0.365 19.617 488 H LYS 101 HN LYS 101 -6.290 2.805 17.092 489 HA LYS 101 HA LYS 101 -9.175 2.817 17.282 490 HB2 LYS 101 HB2 LYS 101 -7.315 2.286 14.960 491 HB3 LYS 101 HB1 LYS 101 -9.058 2.301 14.842 492 HG2 LYS 101 HG2 LYS 101 -7.351 4.656 15.637 493 HG3 LYS 101 HG1 LYS 101 -8.093 4.381 14.057 494 HD2 LYS 101 HD2 LYS 101 -10.314 4.435 15.084 495 HD3 LYS 101 HD1 LYS 101 -9.573 4.705 16.660 496 HE2 LYS 101 HE2 LYS 101 -8.671 6.815 15.915 497 HE3 LYS 101 HE1 LYS 101 -9.306 6.546 14.293 498 HZ1 LYS 101 HZ1 LYS 101 -11.533 6.562 15.219 499 HZ2 LYS 101 HZ2 LYS 101 -10.747 8.004 15.527 500 HZ3 LYS 101 HZ3 LYS 101 -10.931 6.871 16.765 501 H LYS 102 HN LYS 102 -10.012 0.790 15.715 502 HA LYS 102 HA LYS 102 -9.286 -1.490 17.370 503 HB2 LYS 102 HB2 LYS 102 -11.670 -0.915 15.621 504 HB3 LYS 102 HB1 LYS 102 -11.324 -2.545 16.163 505 HG2 LYS 102 HG2 LYS 102 -12.930 -1.647 17.685 506 HG3 LYS 102 HG1 LYS 102 -11.376 -1.707 18.505 507 HD2 LYS 102 HD2 LYS 102 -12.499 0.352 19.071 508 HD3 LYS 102 HD1 LYS 102 -11.092 0.715 18.073 509 HE2 LYS 102 HE2 LYS 102 -13.037 2.045 17.400 510 HE3 LYS 102 HE1 LYS 102 -12.525 0.948 16.123 511 HZ1 LYS 102 HZ1 LYS 102 -14.818 0.504 17.958 512 HZ2 LYS 102 HZ2 LYS 102 -14.298 -0.565 16.780 513 HZ3 LYS 102 HZ3 LYS 102 -14.901 0.927 16.329 514 H LEU 103 HN LEU 103 -7.499 -0.632 15.591 515 HA LEU 103 HA LEU 103 -7.406 -2.737 13.587 516 HB2 LEU 103 HB2 LEU 103 -6.172 0.021 13.537 517 HB3 LEU 103 HB1 LEU 103 -5.645 -1.254 12.463 518 HG LEU 103 HG LEU 103 -8.052 -1.352 11.637 519 HD11 LEU 103 HD11 LEU 103 -9.392 0.656 11.850 520 HD12 LEU 103 HD12 LEU 103 -8.221 1.320 12.990 521 HD13 LEU 103 HD13 LEU 103 -9.139 -0.129 13.409 522 HD21 LEU 103 HD21 LEU 103 -6.313 -0.468 10.293 523 HD22 LEU 103 HD22 LEU 103 -6.355 1.063 11.150 524 HD23 LEU 103 HD23 LEU 103 -7.724 0.580 10.142 525 HA PRO 104 HA PRO 104 -4.033 -4.654 15.688 526 HB2 PRO 104 HB2 PRO 104 -2.665 -4.741 13.051 527 HB3 PRO 104 HB1 PRO 104 -3.010 -6.053 14.181 528 HG2 PRO 104 HG2 PRO 104 -4.439 -5.790 11.966 529 HG3 PRO 104 HG1 PRO 104 -5.225 -6.232 13.493 530 HD2 PRO 104 HD2 PRO 104 -5.166 -3.602 12.081 531 HD3 PRO 104 HD1 PRO 104 -6.496 -4.399 12.951 532 H VAL 105 HN VAL 105 -1.572 -4.625 15.768 533 HA VAL 105 HA VAL 105 -0.741 -1.914 16.185 534 HB VAL 105 HB VAL 105 -0.326 -3.954 17.677 535 HG11 VAL 105 HG11 VAL 105 1.764 -5.180 17.344 536 HG12 VAL 105 HG12 VAL 105 1.885 -4.473 15.733 537 HG13 VAL 105 HG13 VAL 105 0.521 -5.513 16.140 538 HG21 VAL 105 HG21 VAL 105 0.680 -1.729 18.064 539 HG22 VAL 105 HG22 VAL 105 2.106 -2.270 17.149 540 HG23 VAL 105 HG23 VAL 105 1.616 -3.100 18.634 541 H ASP 106 HN ASP 106 1.934 -1.621 15.444 542 HA ASP 106 HA ASP 106 1.406 -1.203 12.713 543 HB2 ASP 106 HB2 ASP 106 3.626 -0.063 12.642 544 HB3 ASP 106 HB1 ASP 106 2.556 0.544 13.891 545 HA PRO 107 HA PRO 107 3.506 -4.404 10.485 546 HB2 PRO 107 HB2 PRO 107 5.047 -2.279 9.203 547 HB3 PRO 107 HB1 PRO 107 4.101 -3.570 8.477 548 HG2 PRO 107 HG2 PRO 107 3.118 -1.073 8.449 549 HG3 PRO 107 HG1 PRO 107 2.060 -2.456 8.783 550 HD2 PRO 107 HD2 PRO 107 3.243 -0.481 10.666 551 HD3 PRO 107 HD1 PRO 107 1.624 -1.217 10.663 552 H TRP 108 HN TRP 108 5.682 -5.040 9.882 553 HA TRP 108 HA TRP 108 7.738 -5.648 10.346 554 HB2 TRP 108 HB2 TRP 108 8.135 -3.147 12.008 555 HB3 TRP 108 HB1 TRP 108 9.383 -4.131 11.264 556 HD1 TRP 108 HD1 TRP 108 9.192 -4.089 8.462 557 HE1 TRP 108 HE1 TRP 108 8.927 -1.977 6.977 558 HE3 TRP 108 HE3 TRP 108 7.177 -0.961 11.912 559 HZ2 TRP 108 HZ2 TRP 108 7.971 0.631 7.257 560 HZ3 TRP 108 HZ3 TRP 108 6.599 1.356 11.235 561 HH2 TRP 108 HH2 TRP 108 6.974 2.126 8.970 562 H GLY 109 HN GLY 109 5.388 -5.670 12.194 563 HA2 GLY 109 HA2 GLY 109 4.648 -6.397 14.213 564 HA3 GLY 109 HA1 GLY 109 6.130 -7.357 14.250 565 H ASN 110 HN ASN 110 5.970 -3.711 14.404 566 HA ASN 110 HA ASN 110 7.178 -4.034 17.008 567 HB2 ASN 110 HB2 ASN 110 6.606 -1.388 15.675 568 HB3 ASN 110 HB1 ASN 110 7.751 -1.733 16.951 569 HD21 ASN 110 HD21 ASN 110 7.109 -1.575 13.721 570 HD22 ASN 110 HD22 ASN 110 8.691 -1.866 13.088 571 HA PRO 111 HA PRO 111 3.419 -2.467 18.801 572 HB2 PRO 111 HB2 PRO 111 4.384 -1.779 21.233 573 HB3 PRO 111 HB1 PRO 111 4.050 -3.458 20.792 574 HG2 PRO 111 HG2 PRO 111 6.648 -2.010 20.930 575 HG3 PRO 111 HG1 PRO 111 6.273 -3.691 21.341 576 HD2 PRO 111 HD2 PRO 111 7.463 -2.906 18.977 577 HD3 PRO 111 HD1 PRO 111 6.551 -4.403 19.209 578 H TYR 112 HN TYR 112 2.567 -0.440 18.810 579 HA TYR 112 HA TYR 112 4.077 1.816 18.000 580 HB2 TYR 112 HB2 TYR 112 1.243 1.468 18.931 581 HB3 TYR 112 HB1 TYR 112 1.906 3.085 18.769 582 HD1 TYR 112 HD2 TYR 112 2.782 3.753 16.474 583 HD2 TYR 112 HD1 TYR 112 0.306 0.354 17.093 584 HE1 TYR 112 HE2 TYR 112 2.152 3.796 14.100 585 HE2 TYR 112 HE1 TYR 112 -0.342 0.393 14.715 586 HH TYR 112 HH TYR 112 -0.446 2.042 12.870 587 H GLN 113 HN GLN 113 4.645 3.659 19.138 588 HA GLN 113 HA GLN 113 5.100 3.149 22.008 589 HB2 GLN 113 HB2 GLN 113 6.341 5.523 20.781 590 HB3 GLN 113 HB1 GLN 113 7.075 4.330 21.839 591 HG2 GLN 113 HG2 GLN 113 6.731 4.219 18.849 592 HG3 GLN 113 HG1 GLN 113 8.213 4.534 19.721 593 HE21 GLN 113 HE21 GLN 113 7.609 2.341 21.663 594 HE22 GLN 113 HE22 GLN 113 7.910 0.907 20.750 595 H TYR 114 HN TYR 114 3.736 4.253 23.359 596 HA TYR 114 HA TYR 114 2.458 6.690 22.300 597 HB2 TYR 114 HB2 TYR 114 1.573 5.320 24.828 598 HB3 TYR 114 HB1 TYR 114 0.630 6.269 23.698 599 HD1 TYR 114 HD1 TYR 114 1.069 4.848 21.147 600 HD2 TYR 114 HD2 TYR 114 0.468 3.287 25.069 601 HE1 TYR 114 HE1 TYR 114 0.191 2.767 20.196 602 HE2 TYR 114 HE2 TYR 114 -0.403 1.205 24.116 603 HH TYR 114 HH TYR 114 -1.547 0.638 21.879 604 H LEU 115 HN LEU 115 3.456 8.491 23.074 605 HA LEU 115 HA LEU 115 4.302 8.473 25.861 606 HB2 LEU 115 HB2 LEU 115 5.689 9.670 23.501 607 HB3 LEU 115 HB1 LEU 115 6.131 10.068 25.157 608 HG LEU 115 HG LEU 115 6.382 7.366 23.814 609 HD11 LEU 115 HD11 LEU 115 7.995 8.998 22.988 610 HD12 LEU 115 HD12 LEU 115 8.785 7.761 23.968 611 HD13 LEU 115 HD13 LEU 115 8.484 9.361 24.643 612 HD21 LEU 115 HD21 LEU 115 7.618 6.728 25.842 613 HD22 LEU 115 HD22 LEU 115 5.932 7.107 26.189 614 HD23 LEU 115 HD23 LEU 115 7.198 8.276 26.575 615 H ALA 116 HN ALA 116 4.184 10.614 26.882 616 HA ALA 116 HA ALA 116 2.241 12.233 25.503 617 HB1 ALA 116 HB1 ALA 116 1.046 12.457 27.524 618 HB2 ALA 116 HB2 ALA 116 2.373 11.815 28.468 619 HB3 ALA 116 HB3 ALA 116 1.444 10.739 27.396 620 HA PRO 117 HA PRO 117 4.610 15.762 25.962 621 HB2 PRO 117 HB2 PRO 117 3.863 17.555 27.821 622 HB3 PRO 117 HB1 PRO 117 3.043 17.276 26.311 623 HG2 PRO 117 HG2 PRO 117 2.308 16.178 29.002 624 HG3 PRO 117 HG1 PRO 117 1.249 16.835 27.740 625 HD2 PRO 117 HD2 PRO 117 1.660 14.154 28.106 626 HD3 PRO 117 HD1 PRO 117 1.292 14.845 26.506 627 H GLY 118 HN GLY 118 6.545 15.762 26.369 628 HA2 GLY 118 HA2 GLY 118 7.430 15.311 29.139 629 HA3 GLY 118 HA1 GLY 118 8.270 14.722 27.690 630 H THR 119 HN THR 119 9.281 16.141 26.358 631 HA THR 119 HA THR 119 10.044 18.632 27.681 632 HB THR 119 HB THR 119 11.519 17.299 25.441 633 HG1 THR 119 HG1 THR 119 11.315 15.767 27.189 634 HG21 THR 119 HG21 THR 119 12.399 19.075 27.717 635 HG22 THR 119 HG22 THR 119 12.164 19.571 26.041 636 HG23 THR 119 HG23 THR 119 13.454 18.443 26.456 637 H LYS 120 HN LYS 120 8.721 20.132 26.819 638 HA LYS 120 HA LYS 120 8.067 21.737 25.360 639 HB2 LYS 120 HB2 LYS 120 9.783 20.303 23.356 640 HB3 LYS 120 HB1 LYS 120 9.025 21.866 23.114 641 HG2 LYS 120 HG2 LYS 120 11.082 21.181 25.170 642 HG3 LYS 120 HG1 LYS 120 11.377 22.063 23.668 643 HD2 LYS 120 HD2 LYS 120 9.652 23.733 24.440 644 HD3 LYS 120 HD1 LYS 120 9.683 22.922 25.997 645 HE2 LYS 120 HE2 LYS 120 12.053 24.184 24.641 646 HE3 LYS 120 HE1 LYS 120 11.130 24.918 25.940 647 HZ1 LYS 120 HZ1 LYS 120 11.784 23.072 27.367 648 HZ2 LYS 120 HZ2 LYS 120 13.128 23.895 26.778 649 HZ3 LYS 120 HZ3 LYS 120 12.707 22.408 26.123 650 H GLY 121 HN GLY 121 7.097 18.550 24.926 651 HA2 GLY 121 HA2 GLY 121 5.297 19.518 22.824 652 HA3 GLY 121 HA1 GLY 121 6.167 17.996 22.590 653 HA PRO 122 HA PRO 122 1.793 18.199 25.082 654 HB2 PRO 122 HB2 PRO 122 0.995 17.895 22.226 655 HB3 PRO 122 HB1 PRO 122 0.068 18.546 23.583 656 HG2 PRO 122 HG2 PRO 122 1.243 20.180 21.903 657 HG3 PRO 122 HG1 PRO 122 1.305 20.516 23.645 658 HD2 PRO 122 HD2 PRO 122 3.422 19.529 21.816 659 HD3 PRO 122 HD1 PRO 122 3.574 20.522 23.277 660 H PHE 123 HN PHE 123 3.275 16.207 22.525 661 HA PHE 123 HA PHE 123 3.156 13.936 24.075 662 HB2 PHE 123 HB2 PHE 123 1.571 12.457 22.887 663 HB3 PHE 123 HB1 PHE 123 0.736 13.803 23.628 664 HD1 PHE 123 HD1 PHE 123 -0.226 15.603 22.166 665 HD2 PHE 123 HD2 PHE 123 1.538 12.071 20.558 666 HE1 PHE 123 HE1 PHE 123 -1.363 16.007 20.032 667 HE2 PHE 123 HE2 PHE 123 0.401 12.481 18.417 668 HZ PHE 123 HZ PHE 123 -1.048 14.447 18.152 669 H ASP 124 HN ASP 124 3.764 11.938 22.810 670 HA ASP 124 HA ASP 124 5.089 12.572 20.271 671 HB2 ASP 124 HB2 ASP 124 6.454 11.052 22.549 672 HB3 ASP 124 HB1 ASP 124 7.061 11.137 20.909 673 H LEU 125 HN LEU 125 4.115 11.222 18.850 674 HA LEU 125 HA LEU 125 3.466 8.531 19.831 675 HB2 LEU 125 HB2 LEU 125 1.453 9.839 19.619 676 HB3 LEU 125 HB1 LEU 125 1.903 10.319 17.996 677 HG LEU 125 HG LEU 125 1.775 7.910 17.350 678 HD11 LEU 125 HD11 LEU 125 1.959 6.901 19.548 679 HD12 LEU 125 HD12 LEU 125 0.460 6.417 18.762 680 HD13 LEU 125 HD13 LEU 125 0.433 7.639 20.033 681 HD21 LEU 125 HD21 LEU 125 0.050 9.623 16.902 682 HD22 LEU 125 HD22 LEU 125 -0.803 9.076 18.364 683 HD23 LEU 125 HD23 LEU 125 -0.500 7.965 17.015 684 H TYR 126 HN TYR 126 4.314 6.901 18.588 685 HA TYR 126 HA TYR 126 4.762 7.167 15.833 686 HB2 TYR 126 HB2 TYR 126 7.205 7.264 15.704 687 HB3 TYR 126 HB1 TYR 126 6.582 8.683 16.519 688 HD1 TYR 126 HD1 TYR 126 6.791 8.783 19.073 689 HD2 TYR 126 HD2 TYR 126 8.844 5.921 16.686 690 HE1 TYR 126 HE1 TYR 126 8.405 8.422 20.890 691 HE2 TYR 126 HE2 TYR 126 10.452 5.554 18.491 692 HH TYR 126 HH TYR 126 11.305 6.665 20.394 693 H SER 127 HN SER 127 6.023 5.328 14.960 694 HA SER 127 HA SER 127 6.213 3.098 16.816 695 HB2 SER 127 HB2 SER 127 5.658 1.638 14.861 696 HB3 SER 127 HB1 SER 127 4.322 2.668 15.361 697 HG SER 127 HG SER 127 5.335 2.427 13.034 698 H LEU 128 HN LEU 128 8.046 1.850 16.538 699 HA LEU 128 HA LEU 128 10.306 3.071 15.331 700 HB2 LEU 128 HB2 LEU 128 9.871 0.244 16.286 701 HB3 LEU 128 HB1 LEU 128 11.435 0.862 15.778 702 HG LEU 128 HG LEU 128 9.809 1.788 18.152 703 HD11 LEU 128 HD11 LEU 128 11.605 0.826 19.474 704 HD12 LEU 128 HD12 LEU 128 12.398 0.272 18.002 705 HD13 LEU 128 HD13 LEU 128 10.836 -0.397 18.463 706 HD21 LEU 128 HD21 LEU 128 11.050 3.661 17.203 707 HD22 LEU 128 HD22 LEU 128 12.525 2.696 17.190 708 HD23 LEU 128 HD23 LEU 128 11.782 3.148 18.723 709 H GLY 129 HN GLY 129 11.422 2.573 13.419 710 HA2 GLY 129 HA2 GLY 129 9.744 1.570 11.285 711 HA3 GLY 129 HA1 GLY 129 11.360 2.218 11.109 712 H ALA 130 HN ALA 130 11.315 0.395 9.584 713 HA ALA 130 HA ALA 130 11.264 -2.293 10.339 714 HB1 ALA 130 HB1 ALA 130 12.240 -2.745 8.184 715 HB2 ALA 130 HB2 ALA 130 12.742 -1.060 8.035 716 HB3 ALA 130 HB3 ALA 130 11.027 -1.468 8.055 717 H ASP 131 HN ASP 131 13.616 -0.073 11.143 718 HA ASP 131 HA ASP 131 15.785 -2.043 11.179 719 HB2 ASP 131 HB2 ASP 131 16.159 0.344 10.439 720 HB3 ASP 131 HB1 ASP 131 15.860 0.838 12.099 721 H GLY 132 HN GLY 132 13.249 -1.044 13.147 722 HA2 GLY 132 HA2 GLY 132 12.681 -1.611 15.308 723 HA3 GLY 132 HA1 GLY 132 14.205 -2.479 15.439 724 H LYS 133 HN LYS 133 14.537 0.678 14.391 725 HA LYS 133 HA LYS 133 15.078 1.746 17.042 726 HB2 LYS 133 HB2 LYS 133 17.161 0.780 16.313 727 HB3 LYS 133 HB1 LYS 133 17.043 1.568 14.749 728 HG2 LYS 133 HG2 LYS 133 18.692 2.677 16.116 729 HG3 LYS 133 HG1 LYS 133 17.308 3.749 15.899 730 HD2 LYS 133 HD2 LYS 133 16.473 3.060 18.106 731 HD3 LYS 133 HD1 LYS 133 17.914 2.061 18.325 732 HE2 LYS 133 HE2 LYS 133 19.315 4.058 18.118 733 HE3 LYS 133 HE1 LYS 133 17.875 5.038 17.885 734 HZ1 LYS 133 HZ1 LYS 133 17.141 4.361 20.115 735 HZ2 LYS 133 HZ2 LYS 133 18.567 5.226 20.124 736 HZ3 LYS 133 HZ3 LYS 133 18.612 3.555 20.356 737 H GLU 134 HN GLU 134 14.914 3.988 17.117 738 HA GLU 134 HA GLU 134 13.519 5.167 14.925 739 HB2 GLU 134 HB2 GLU 134 13.364 7.158 16.451 740 HB3 GLU 134 HB1 GLU 134 12.627 5.690 17.053 741 HG2 GLU 134 HG2 GLU 134 14.582 5.331 18.490 742 HG3 GLU 134 HG1 GLU 134 15.271 6.846 17.903 743 H GLY 135 HN GLY 135 14.440 6.078 13.299 744 HA2 GLY 135 HA2 GLY 135 16.824 7.692 13.542 745 HA3 GLY 135 HA1 GLY 135 16.973 6.255 12.531 746 H GLY 136 HN GLY 136 17.394 8.207 10.938 747 HA2 GLY 136 HA2 GLY 136 14.769 9.044 9.884 748 HA3 GLY 136 HA1 GLY 136 16.272 9.937 9.627 749 H SER 137 HN SER 137 14.165 8.284 8.008 750 HA SER 137 HA SER 137 15.544 7.429 5.785 751 HB2 SER 137 HB2 SER 137 15.018 5.303 7.882 752 HB3 SER 137 HB1 SER 137 15.185 4.880 6.164 753 HG SER 137 HG SER 137 17.182 6.453 7.123 754 H ASP 138 HN ASP 138 13.809 5.737 4.609 755 HA ASP 138 HA ASP 138 11.238 6.925 5.277 756 HB2 ASP 138 HB2 ASP 138 12.133 5.403 2.866 757 HB3 ASP 138 HB1 ASP 138 10.415 5.471 3.253 758 H ASN 139 HN ASN 139 12.108 3.531 4.669 759 HA ASN 139 HA ASN 139 9.814 2.882 6.357 760 HB2 ASN 139 HB2 ASN 139 9.930 0.620 5.541 761 HB3 ASN 139 HB1 ASN 139 10.117 1.690 4.164 762 HD21 ASN 139 HD21 ASN 139 11.554 -0.647 6.155 763 HD22 ASN 139 HD22 ASN 139 13.003 -0.930 5.272 764 H ASP 140 HN ASP 140 13.213 2.964 6.544 765 HA ASP 140 HA ASP 140 13.385 1.138 8.805 766 HB2 ASP 140 HB2 ASP 140 15.484 2.936 7.572 767 HB3 ASP 140 HB1 ASP 140 15.791 1.811 8.886 768 H ALA 141 HN ALA 141 12.406 4.193 8.420 769 HA ALA 141 HA ALA 141 13.592 5.309 10.831 770 HB1 ALA 141 HB1 ALA 141 11.718 6.526 8.852 771 HB2 ALA 141 HB2 ALA 141 13.475 6.671 8.837 772 HB3 ALA 141 HB3 ALA 141 12.545 7.351 10.170 773 H ASP 142 HN ASP 142 12.283 6.268 12.421 774 HA ASP 142 HA ASP 142 9.960 4.726 13.032 775 HB2 ASP 142 HB2 ASP 142 9.928 6.109 15.083 776 HB3 ASP 142 HB1 ASP 142 11.486 5.329 14.853 777 H ILE 143 HN ILE 143 8.077 5.259 12.337 778 HA ILE 143 HA ILE 143 7.762 7.934 11.303 779 HB ILE 143 HB ILE 143 5.813 7.115 10.030 780 HG12 ILE 143 HG12 ILE 143 5.670 4.496 9.802 781 HG13 ILE 143 HG11 ILE 143 6.383 4.491 11.405 782 HG21 ILE 143 HG21 ILE 143 8.276 5.462 9.601 783 HG22 ILE 143 HG22 ILE 143 7.972 7.088 8.990 784 HG23 ILE 143 HG23 ILE 143 6.996 5.730 8.418 785 HD11 ILE 143 HD11 ILE 143 3.761 5.739 10.603 786 HD12 ILE 143 HD12 ILE 143 4.495 5.863 12.199 787 HD13 ILE 143 HD13 ILE 143 4.001 4.289 11.585 788 H GLY 144 HN GLY 144 6.415 9.333 12.173 789 HA2 GLY 144 HA2 GLY 144 4.327 8.483 13.880 790 HA3 GLY 144 HA1 GLY 144 5.716 9.093 14.765 791 H ASN 145 HN ASN 145 3.715 10.409 15.268 792 HA ASN 145 HA ASN 145 4.085 12.907 14.006 793 HB2 ASN 145 HB2 ASN 145 1.857 13.333 13.205 794 HB3 ASN 145 HB1 ASN 145 2.334 11.778 12.554 795 HD21 ASN 145 HD21 ASN 145 1.695 10.262 15.003 796 HD22 ASN 145 HD22 ASN 145 -0.032 10.253 15.073 797 H TRP 146 HN TRP 146 3.397 14.543 15.326 798 HA TRP 146 HA TRP 146 1.942 13.979 17.690 799 HB2 TRP 146 HB2 TRP 146 3.808 14.678 19.229 800 HB3 TRP 146 HB1 TRP 146 3.963 13.079 18.522 801 HD1 TRP 146 HD1 TRP 146 5.389 16.658 17.907 802 HE1 TRP 146 HE1 TRP 146 7.802 16.383 17.035 803 HE3 TRP 146 HE3 TRP 146 5.556 11.607 17.677 804 HZ2 TRP 146 HZ2 TRP 146 9.552 14.276 16.360 805 HZ3 TRP 146 HZ3 TRP 146 7.643 10.499 16.920 806 HH2 TRP 146 HH2 TRP 146 9.592 11.817 16.275 807 H ASP 147 HN ASP 147 2.195 15.909 19.156 808 HA ASP 147 HA ASP 147 2.221 18.294 17.465 809 HB2 ASP 147 HB2 ASP 147 -0.037 17.590 18.533 810 HB3 ASP 147 HB1 ASP 147 0.696 18.052 20.067 811 H ASN 148 HN ASN 148 3.779 19.583 17.922 812 HA ASN 148 HA ASN 148 5.055 19.586 20.558 813 HB2 ASN 148 HB2 ASN 148 6.519 18.327 19.110 814 HB3 ASN 148 HB1 ASN 148 6.326 19.491 17.811 815 HD21 ASN 148 HD21 ASN 148 6.923 20.408 21.202 816 HD22 ASN 148 HD22 ASN 148 8.502 21.009 20.871 Start of MODEL 6 1 H1 MET 39 HT1 MET 39 2.875 5.724 -0.253 2 H2 MET 39 HT2 MET 39 2.838 6.377 -1.782 3 H3 MET 39 HT3 MET 39 3.898 7.010 -0.630 4 HA MET 39 HA MET 39 5.023 5.587 -2.247 5 HB2 MET 39 HB2 MET 39 4.868 4.527 0.590 6 HB3 MET 39 HB1 MET 39 5.897 3.864 -0.665 7 HG2 MET 39 HG2 MET 39 6.021 6.736 0.155 8 HG3 MET 39 HG1 MET 39 6.995 5.474 0.913 9 HE1 MET 39 HE1 MET 39 9.252 6.742 0.289 10 HE2 MET 39 HE2 MET 39 8.252 8.036 -0.366 11 HE3 MET 39 HE3 MET 39 9.579 7.375 -1.322 12 H SER 40 HN SER 40 4.294 4.328 -3.821 13 HA SER 40 HA SER 40 2.607 2.068 -3.068 14 HB2 SER 40 HB2 SER 40 2.952 3.331 -5.801 15 HB3 SER 40 HB1 SER 40 1.792 2.073 -5.365 16 HG SER 40 HG SER 40 1.888 4.631 -4.156 17 H ARG 41 HN ARG 41 4.588 1.004 -2.358 18 HA ARG 41 HA ARG 41 5.794 -0.618 -4.401 19 HB2 ARG 41 HB2 ARG 41 7.432 1.381 -2.818 20 HB3 ARG 41 HB1 ARG 41 8.145 -0.106 -3.417 21 HG2 ARG 41 HG2 ARG 41 7.635 0.558 -5.706 22 HG3 ARG 41 HG1 ARG 41 6.857 2.025 -5.115 23 HD2 ARG 41 HD2 ARG 41 9.750 1.327 -4.639 24 HD3 ARG 41 HD1 ARG 41 9.189 2.317 -5.970 25 HE ARG 41 HE ARG 41 8.198 3.751 -4.118 26 HH11 ARG 41 HH11 ARG 41 11.152 1.892 -3.557 27 HH12 ARG 41 HH12 ARG 41 11.960 3.150 -2.758 28 HH21 ARG 41 HH21 ARG 41 9.352 5.482 -3.002 29 HH22 ARG 41 HH22 ARG 41 10.954 5.216 -2.466 30 HA PRO 42 HA PRO 42 5.684 -3.717 -1.163 31 HB2 PRO 42 HB2 PRO 42 8.487 -4.297 -2.035 32 HB3 PRO 42 HB1 PRO 42 7.144 -5.415 -1.773 33 HG2 PRO 42 HG2 PRO 42 7.812 -4.741 -4.233 34 HG3 PRO 42 HG1 PRO 42 6.100 -4.839 -3.778 35 HD2 PRO 42 HD2 PRO 42 7.826 -2.435 -4.191 36 HD3 PRO 42 HD1 PRO 42 6.118 -2.687 -4.598 37 H ASP 43 HN ASP 43 6.019 -3.591 0.892 38 HA ASP 43 HA ASP 43 6.714 -3.186 2.958 39 HB2 ASP 43 HB2 ASP 43 9.011 -3.968 2.279 40 HB3 ASP 43 HB1 ASP 43 9.387 -2.285 1.909 41 H GLN 44 HN GLN 44 7.472 -0.793 0.613 42 HA GLN 44 HA GLN 44 7.238 1.466 2.341 43 HB2 GLN 44 HB2 GLN 44 6.721 1.308 -0.643 44 HB3 GLN 44 HB1 GLN 44 6.926 2.746 0.361 45 HG2 GLN 44 HG2 GLN 44 9.085 0.697 0.046 46 HG3 GLN 44 HG1 GLN 44 8.929 2.100 -1.011 47 HE21 GLN 44 HE21 GLN 44 9.263 4.145 -0.161 48 HE22 GLN 44 HE22 GLN 44 10.124 4.413 1.301 49 H ALA 45 HN ALA 45 5.005 -0.606 0.754 50 HA ALA 45 HA ALA 45 2.672 0.939 0.997 51 HB1 ALA 45 HB1 ALA 45 1.467 -1.163 0.716 52 HB2 ALA 45 HB2 ALA 45 2.937 -2.065 1.060 53 HB3 ALA 45 HB3 ALA 45 2.831 -1.087 -0.403 54 H LYS 46 HN LYS 46 4.531 -0.950 3.236 55 HA LYS 46 HA LYS 46 2.499 -1.055 5.275 56 HB2 LYS 46 HB2 LYS 46 5.487 -1.483 5.351 57 HB3 LYS 46 HB1 LYS 46 4.403 -1.827 6.685 58 HG2 LYS 46 HG2 LYS 46 3.304 -3.539 5.374 59 HG3 LYS 46 HG1 LYS 46 4.326 -3.148 3.988 60 HD2 LYS 46 HD2 LYS 46 6.303 -3.815 5.221 61 HD3 LYS 46 HD1 LYS 46 5.335 -4.107 6.665 62 HE2 LYS 46 HE2 LYS 46 4.136 -5.865 5.520 63 HE3 LYS 46 HE1 LYS 46 5.073 -5.588 4.045 64 HZ1 LYS 46 HZ1 LYS 46 6.154 -6.478 6.671 65 HZ2 LYS 46 HZ2 LYS 46 7.063 -6.258 5.260 66 HZ3 LYS 46 HZ3 LYS 46 5.915 -7.459 5.336 67 H VAL 47 HN VAL 47 4.950 1.089 4.194 68 HA VAL 47 HA VAL 47 5.295 2.580 6.611 69 HB VAL 47 HB VAL 47 5.990 3.361 3.761 70 HG11 VAL 47 HG11 VAL 47 7.026 4.423 6.380 71 HG12 VAL 47 HG12 VAL 47 5.985 5.263 5.227 72 HG13 VAL 47 HG13 VAL 47 7.643 4.856 4.784 73 HG21 VAL 47 HG21 VAL 47 7.065 1.251 4.381 74 HG22 VAL 47 HG22 VAL 47 7.771 2.026 5.807 75 HG23 VAL 47 HG23 VAL 47 8.224 2.556 4.183 76 H THR 48 HN THR 48 3.539 2.922 3.603 77 HA THR 48 HA THR 48 2.573 5.488 4.216 78 HB THR 48 HB THR 48 2.868 4.700 1.884 79 HG1 THR 48 HG1 THR 48 0.201 5.206 1.699 80 HG21 THR 48 HG21 THR 48 1.200 3.247 0.835 81 HG22 THR 48 HG22 THR 48 0.418 3.022 2.405 82 HG23 THR 48 HG23 THR 48 2.062 2.432 2.143 83 H VAL 49 HN VAL 49 1.238 2.232 4.843 84 HA VAL 49 HA VAL 49 -1.300 3.312 5.634 85 HB VAL 49 HB VAL 49 -1.948 1.207 6.485 86 HG11 VAL 49 HG11 VAL 49 -0.257 0.700 4.077 87 HG12 VAL 49 HG12 VAL 49 -1.941 1.221 4.128 88 HG13 VAL 49 HG13 VAL 49 -1.498 -0.389 4.697 89 HG21 VAL 49 HG21 VAL 49 -0.073 0.637 7.898 90 HG22 VAL 49 HG22 VAL 49 0.947 0.321 6.496 91 HG23 VAL 49 HG23 VAL 49 -0.434 -0.728 6.841 92 H ALA 50 HN ALA 50 1.740 2.722 7.184 93 HA ALA 50 HA ALA 50 0.852 2.865 9.845 94 HB1 ALA 50 HB1 ALA 50 3.180 3.097 10.385 95 HB2 ALA 50 HB2 ALA 50 3.550 3.537 8.725 96 HB3 ALA 50 HB3 ALA 50 3.009 1.895 9.099 97 H LYS 51 HN LYS 51 2.081 5.267 7.544 98 HA LYS 51 HA LYS 51 2.059 7.321 9.429 99 HB2 LYS 51 HB2 LYS 51 2.015 7.430 6.423 100 HB3 LYS 51 HB1 LYS 51 2.243 8.839 7.458 101 HG2 LYS 51 HG2 LYS 51 4.247 7.807 8.407 102 HG3 LYS 51 HG1 LYS 51 4.012 6.412 7.352 103 HD2 LYS 51 HD2 LYS 51 4.287 7.751 5.422 104 HD3 LYS 51 HD1 LYS 51 4.362 9.232 6.385 105 HE2 LYS 51 HE2 LYS 51 6.416 8.287 7.493 106 HE3 LYS 51 HE1 LYS 51 6.363 6.956 6.348 107 HZ1 LYS 51 HZ1 LYS 51 6.775 9.823 5.757 108 HZ2 LYS 51 HZ2 LYS 51 6.535 8.670 4.554 109 HZ3 LYS 51 HZ3 LYS 51 7.896 8.572 5.558 110 H GLY 52 HN GLY 52 -0.425 5.939 7.472 111 HA2 GLY 52 HA2 GLY 52 -2.278 8.131 7.879 112 HA3 GLY 52 HA1 GLY 52 -2.660 6.550 7.186 113 H ASP 53 HN ASP 53 -1.300 5.241 9.409 114 HA ASP 53 HA ASP 53 -3.602 4.800 11.025 115 HB2 ASP 53 HB2 ASP 53 -1.707 3.174 10.254 116 HB3 ASP 53 HB1 ASP 53 -0.851 3.812 11.644 117 H ILE 54 HN ILE 54 -0.395 6.185 11.484 118 HA ILE 54 HA ILE 54 -0.751 6.896 14.183 119 HB ILE 54 HB ILE 54 1.110 8.509 13.895 120 HG12 ILE 54 HG12 ILE 54 0.872 7.726 10.992 121 HG13 ILE 54 HG11 ILE 54 0.568 9.307 11.677 122 HG21 ILE 54 HG21 ILE 54 1.551 5.800 12.657 123 HG22 ILE 54 HG22 ILE 54 1.653 6.212 14.373 124 HG23 ILE 54 HG23 ILE 54 2.829 6.869 13.232 125 HD11 ILE 54 HD11 ILE 54 3.223 7.921 11.551 126 HD12 ILE 54 HD12 ILE 54 2.926 9.524 12.235 127 HD13 ILE 54 HD13 ILE 54 2.678 9.236 10.509 128 H LYS 55 HN LYS 55 -1.796 8.459 11.244 129 HA LYS 55 HA LYS 55 -2.536 10.905 12.531 130 HB2 LYS 55 HB2 LYS 55 -3.038 9.735 9.844 131 HB3 LYS 55 HB1 LYS 55 -4.194 10.929 10.407 132 HG2 LYS 55 HG2 LYS 55 -2.428 11.930 9.025 133 HG3 LYS 55 HG1 LYS 55 -2.428 12.572 10.665 134 HD2 LYS 55 HD2 LYS 55 -0.592 11.040 11.225 135 HD3 LYS 55 HD1 LYS 55 -0.571 10.479 9.552 136 HE2 LYS 55 HE2 LYS 55 1.162 12.128 9.948 137 HE3 LYS 55 HE1 LYS 55 -0.031 12.745 8.811 138 HZ1 LYS 55 HZ1 LYS 55 -0.065 13.381 11.716 139 HZ2 LYS 55 HZ2 LYS 55 -0.971 14.130 10.507 140 HZ3 LYS 55 HZ3 LYS 55 0.691 14.332 10.556 141 H ALA 56 HN ALA 56 -4.022 7.840 12.049 142 HA ALA 56 HA ALA 56 -6.647 8.521 12.903 143 HB1 ALA 56 HB1 ALA 56 -6.929 6.109 13.189 144 HB2 ALA 56 HB2 ALA 56 -5.183 5.904 13.089 145 HB3 ALA 56 HB3 ALA 56 -6.083 6.448 11.667 146 H ILE 57 HN ILE 57 -3.794 7.236 14.485 147 HA ILE 57 HA ILE 57 -4.882 6.963 17.073 148 HB ILE 57 HB ILE 57 -1.970 7.518 16.442 149 HG12 ILE 57 HG12 ILE 57 -3.434 4.870 16.476 150 HG13 ILE 57 HG11 ILE 57 -2.912 5.710 15.036 151 HG21 ILE 57 HG21 ILE 57 -3.345 6.013 18.683 152 HG22 ILE 57 HG22 ILE 57 -2.599 7.607 18.809 153 HG23 ILE 57 HG23 ILE 57 -1.599 6.190 18.486 154 HD11 ILE 57 HD11 ILE 57 -1.070 4.657 17.170 155 HD12 ILE 57 HD12 ILE 57 -0.605 5.480 15.684 156 HD13 ILE 57 HD13 ILE 57 -1.431 3.924 15.601 157 H ALA 58 HN ALA 58 -3.161 9.587 15.482 158 HA ALA 58 HA ALA 58 -2.933 11.362 17.620 159 HB1 ALA 58 HB1 ALA 58 -2.780 13.144 15.952 160 HB2 ALA 58 HB2 ALA 58 -3.430 12.058 14.724 161 HB3 ALA 58 HB3 ALA 58 -1.854 11.732 15.445 162 H ALA 59 HN ALA 59 -5.689 10.558 15.673 163 HA ALA 59 HA ALA 59 -7.305 12.766 16.575 164 HB1 ALA 59 HB1 ALA 59 -9.114 11.681 15.339 165 HB2 ALA 59 HB2 ALA 59 -8.110 10.249 15.110 166 HB3 ALA 59 HB3 ALA 59 -7.656 11.772 14.348 167 H ALA 60 HN ALA 60 -6.703 9.468 17.466 168 HA ALA 60 HA ALA 60 -8.875 9.371 19.345 169 HB1 ALA 60 HB1 ALA 60 -7.846 7.249 20.063 170 HB2 ALA 60 HB2 ALA 60 -6.526 7.537 18.953 171 HB3 ALA 60 HB3 ALA 60 -8.166 7.290 18.324 172 H LEU 61 HN LEU 61 -5.489 10.199 19.361 173 HA LEU 61 HA LEU 61 -5.171 10.337 22.156 174 HB2 LEU 61 HB2 LEU 61 -3.528 10.578 20.026 175 HB3 LEU 61 HB1 LEU 61 -3.798 12.273 20.347 176 HG LEU 61 HG LEU 61 -1.709 11.438 21.324 177 HD11 LEU 61 HD11 LEU 61 -3.756 12.206 23.389 178 HD12 LEU 61 HD12 LEU 61 -2.759 13.305 22.429 179 HD13 LEU 61 HD13 LEU 61 -2.009 12.245 23.619 180 HD21 LEU 61 HD21 LEU 61 -3.474 9.768 23.049 181 HD22 LEU 61 HD22 LEU 61 -1.724 9.936 23.201 182 HD23 LEU 61 HD23 LEU 61 -2.422 9.153 21.767 183 H ASP 62 HN ASP 62 -6.544 12.429 19.731 184 HA ASP 62 HA ASP 62 -7.072 14.632 21.462 185 HB2 ASP 62 HB2 ASP 62 -8.365 13.850 18.844 186 HB3 ASP 62 HB1 ASP 62 -8.806 15.299 19.738 187 H MET 63 HN MET 63 -8.432 11.596 21.033 188 HA MET 63 HA MET 63 -10.975 12.319 22.140 189 HB2 MET 63 HB2 MET 63 -9.821 9.612 21.438 190 HB3 MET 63 HB1 MET 63 -11.397 9.814 22.180 191 HG2 MET 63 HG2 MET 63 -10.574 10.941 19.517 192 HG3 MET 63 HG1 MET 63 -11.531 9.477 19.760 193 HE1 MET 63 HE1 MET 63 -13.429 10.406 18.180 194 HE2 MET 63 HE2 MET 63 -12.481 11.866 17.899 195 HE3 MET 63 HE3 MET 63 -14.177 11.991 18.368 196 H TYR 64 HN TYR 64 -7.983 10.805 23.235 197 HA TYR 64 HA TYR 64 -8.908 10.448 25.928 198 HB2 TYR 64 HB2 TYR 64 -6.801 9.409 25.138 199 HB3 TYR 64 HB1 TYR 64 -6.084 11.015 24.984 200 HD1 TYR 64 HD2 TYR 64 -7.416 8.527 27.516 201 HD2 TYR 64 HD1 TYR 64 -5.258 12.189 26.913 202 HE1 TYR 64 HE2 TYR 64 -6.732 8.439 29.658 203 HE2 TYR 64 HE1 TYR 64 -4.572 12.098 29.220 204 HH TYR 64 HH TYR 64 -5.088 9.256 31.020 205 H LYS 65 HN LYS 65 -7.458 13.028 24.088 206 HA LYS 65 HA LYS 65 -7.186 14.952 25.989 207 HB2 LYS 65 HB2 LYS 65 -6.403 15.294 23.747 208 HB3 LYS 65 HB1 LYS 65 -8.040 15.162 23.122 209 HG2 LYS 65 HG2 LYS 65 -8.654 17.202 24.077 210 HG3 LYS 65 HG1 LYS 65 -7.094 17.387 24.905 211 HD2 LYS 65 HD2 LYS 65 -5.997 17.395 22.674 212 HD3 LYS 65 HD1 LYS 65 -7.587 17.340 21.920 213 HE2 LYS 65 HE2 LYS 65 -8.162 19.473 22.963 214 HE3 LYS 65 HE1 LYS 65 -6.586 19.513 23.752 215 HZ1 LYS 65 HZ1 LYS 65 -7.042 19.561 20.814 216 HZ2 LYS 65 HZ2 LYS 65 -5.532 19.673 21.566 217 HZ3 LYS 65 HZ3 LYS 65 -6.672 20.879 21.779 218 H LEU 66 HN LEU 66 -10.082 13.775 24.409 219 HA LEU 66 HA LEU 66 -11.808 15.675 25.742 220 HB2 LEU 66 HB2 LEU 66 -12.443 13.211 24.146 221 HB3 LEU 66 HB1 LEU 66 -13.644 14.311 24.783 222 HG LEU 66 HG LEU 66 -11.548 15.021 22.734 223 HD11 LEU 66 HD11 LEU 66 -13.197 13.476 21.846 224 HD12 LEU 66 HD12 LEU 66 -13.434 15.090 21.178 225 HD13 LEU 66 HD13 LEU 66 -14.499 14.495 22.454 226 HD21 LEU 66 HD21 LEU 66 -12.180 16.941 24.079 227 HD22 LEU 66 HD22 LEU 66 -13.885 16.567 23.845 228 HD23 LEU 66 HD23 LEU 66 -12.901 17.064 22.474 229 H ASP 67 HN ASP 67 -10.769 12.318 26.260 230 HA ASP 67 HA ASP 67 -12.820 11.676 28.159 231 HB2 ASP 67 HB2 ASP 67 -11.618 9.897 26.922 232 HB3 ASP 67 HB1 ASP 67 -10.124 10.357 27.721 233 H ASN 68 HN ASN 68 -9.686 13.175 28.417 234 HA ASN 68 HA ASN 68 -10.251 13.726 31.313 235 HB2 ASN 68 HB2 ASN 68 -7.621 13.046 30.048 236 HB3 ASN 68 HB1 ASN 68 -7.905 13.946 31.555 237 HD21 ASN 68 HD21 ASN 68 -8.663 10.839 30.025 238 HD22 ASN 68 HD22 ASN 68 -8.694 9.935 31.468 239 H PHE 69 HN PHE 69 -10.767 15.092 28.818 240 HA PHE 69 HA PHE 69 -10.565 17.195 27.918 241 HB2 PHE 69 HB2 PHE 69 -11.028 18.955 29.695 242 HB3 PHE 69 HB1 PHE 69 -12.186 17.648 29.526 243 HD1 PHE 69 HD1 PHE 69 -9.406 18.829 31.544 244 HD2 PHE 69 HD2 PHE 69 -12.622 16.276 31.256 245 HE1 PHE 69 HE1 PHE 69 -9.254 18.482 33.973 246 HE2 PHE 69 HE2 PHE 69 -12.584 15.815 33.644 247 HZ PHE 69 HZ PHE 69 -10.863 16.935 35.068 248 H ALA 70 HN ALA 70 -8.010 16.127 28.214 249 HA ALA 70 HA ALA 70 -6.289 18.327 28.060 250 HB1 ALA 70 HB1 ALA 70 -6.265 16.762 30.635 251 HB2 ALA 70 HB2 ALA 70 -6.756 18.432 30.479 252 HB3 ALA 70 HB3 ALA 70 -5.058 17.978 30.179 253 H TYR 71 HN TYR 71 -4.103 17.510 27.743 254 HA TYR 71 HA TYR 71 -4.066 14.840 26.748 255 HB2 TYR 71 HB2 TYR 71 -2.088 17.082 26.810 256 HB3 TYR 71 HB1 TYR 71 -1.566 15.466 26.352 257 HD1 TYR 71 HD1 TYR 71 -3.567 14.360 24.745 258 HD2 TYR 71 HD2 TYR 71 -2.372 18.422 24.980 259 HE1 TYR 71 HE1 TYR 71 -4.356 14.653 22.530 260 HE2 TYR 71 HE2 TYR 71 -3.153 18.788 22.703 261 HH TYR 71 HH TYR 71 -5.019 16.471 20.887 262 HA PRO 72 HA PRO 72 -2.413 12.677 30.196 263 HB2 PRO 72 HB2 PRO 72 -0.630 10.985 29.036 264 HB3 PRO 72 HB1 PRO 72 -2.378 10.794 28.848 265 HG2 PRO 72 HG2 PRO 72 -0.384 12.033 26.996 266 HG3 PRO 72 HG1 PRO 72 -1.693 10.896 26.629 267 HD2 PRO 72 HD2 PRO 72 -1.930 13.517 26.191 268 HD3 PRO 72 HD1 PRO 72 -3.304 12.526 26.705 269 H SER 73 HN SER 73 -0.468 12.451 31.635 270 HA SER 73 HA SER 73 1.691 14.209 30.813 271 HB2 SER 73 HB2 SER 73 2.429 13.872 33.196 272 HB3 SER 73 HB1 SER 73 0.814 14.569 33.080 273 HG SER 73 HG SER 73 0.427 13.037 34.392 274 H THR 74 HN THR 74 3.905 13.226 30.960 275 HA THR 74 HA THR 74 3.784 10.690 29.693 276 HB THR 74 HB THR 74 5.522 12.682 29.468 277 HG1 THR 74 HG1 THR 74 6.631 10.098 29.225 278 HG21 THR 74 HG21 THR 74 6.435 12.481 31.759 279 HG22 THR 74 HG22 THR 74 7.694 12.132 30.572 280 HG23 THR 74 HG23 THR 74 6.896 10.816 31.434 281 H GLN 75 HN GLN 75 3.682 11.530 32.874 282 HA GLN 75 HA GLN 75 4.714 8.945 33.724 283 HB2 GLN 75 HB2 GLN 75 4.011 11.470 35.155 284 HB3 GLN 75 HB1 GLN 75 4.383 9.974 36.011 285 HG2 GLN 75 HG2 GLN 75 6.574 9.942 35.067 286 HG3 GLN 75 HG1 GLN 75 6.202 11.330 34.046 287 HE21 GLN 75 HE21 GLN 75 6.679 10.250 37.271 288 HE22 GLN 75 HE22 GLN 75 7.078 11.790 37.943 289 H GLN 76 HN GLN 76 1.901 11.055 34.592 290 HA GLN 76 HA GLN 76 0.496 8.664 35.424 291 HB2 GLN 76 HB2 GLN 76 -0.355 11.548 35.507 292 HB3 GLN 76 HB1 GLN 76 -1.268 10.193 36.145 293 HG2 GLN 76 HG2 GLN 76 0.652 9.704 37.659 294 HG3 GLN 76 HG1 GLN 76 1.384 11.210 37.113 295 HE21 GLN 76 HE21 GLN 76 -1.263 12.533 36.947 296 HE22 GLN 76 HE22 GLN 76 -1.691 12.879 38.579 297 H GLY 77 HN GLY 77 0.307 11.004 32.856 298 HA2 GLY 77 HA2 GLY 77 -2.151 9.905 31.943 299 HA3 GLY 77 HA1 GLY 77 -1.111 10.941 30.999 300 H LEU 78 HN LEU 78 1.170 8.945 31.610 301 HA LEU 78 HA LEU 78 0.767 7.413 29.226 302 HB2 LEU 78 HB2 LEU 78 3.024 8.238 30.137 303 HB3 LEU 78 HB1 LEU 78 2.918 6.954 31.312 304 HG LEU 78 HG LEU 78 2.999 6.436 28.332 305 HD11 LEU 78 HD11 LEU 78 5.269 6.494 30.300 306 HD12 LEU 78 HD12 LEU 78 5.005 7.624 28.972 307 HD13 LEU 78 HD13 LEU 78 5.367 5.932 28.634 308 HD21 LEU 78 HD21 LEU 78 2.150 4.570 29.707 309 HD22 LEU 78 HD22 LEU 78 3.614 4.645 30.693 310 HD23 LEU 78 HD23 LEU 78 3.718 4.194 28.992 311 H GLU 79 HN GLU 79 0.915 6.651 32.679 312 HA GLU 79 HA GLU 79 0.094 3.986 32.358 313 HB2 GLU 79 HB2 GLU 79 0.031 5.846 34.712 314 HB3 GLU 79 HB1 GLU 79 -0.659 4.230 34.803 315 HG2 GLU 79 HG2 GLU 79 1.416 3.252 34.241 316 HG3 GLU 79 HG1 GLU 79 2.178 4.833 34.027 317 H ALA 80 HN ALA 80 -1.631 6.970 32.535 318 HA ALA 80 HA ALA 80 -4.219 5.738 32.748 319 HB1 ALA 80 HB1 ALA 80 -5.067 7.959 32.473 320 HB2 ALA 80 HB2 ALA 80 -3.481 8.518 31.973 321 HB3 ALA 80 HB3 ALA 80 -3.724 7.987 33.644 322 H LEU 81 HN LEU 81 -2.072 6.097 30.239 323 HA LEU 81 HA LEU 81 -4.119 6.311 28.175 324 HB2 LEU 81 HB2 LEU 81 -1.737 7.410 28.223 325 HB3 LEU 81 HB1 LEU 81 -1.191 5.820 27.747 326 HG LEU 81 HG LEU 81 -2.591 5.984 25.730 327 HD11 LEU 81 HD11 LEU 81 -3.025 8.817 26.658 328 HD12 LEU 81 HD12 LEU 81 -4.262 7.568 26.495 329 HD13 LEU 81 HD13 LEU 81 -3.441 8.190 25.065 330 HD21 LEU 81 HD21 LEU 81 -0.192 6.536 25.708 331 HD22 LEU 81 HD22 LEU 81 -0.559 8.198 26.121 332 HD23 LEU 81 HD23 LEU 81 -1.081 7.543 24.571 333 H VAL 82 HN VAL 82 -2.135 4.070 29.831 334 HA VAL 82 HA VAL 82 -2.772 1.862 27.998 335 HB VAL 82 HB VAL 82 -0.952 1.835 30.416 336 HG11 VAL 82 HG11 VAL 82 -0.027 -0.203 29.442 337 HG12 VAL 82 HG12 VAL 82 -1.197 -0.108 28.127 338 HG13 VAL 82 HG13 VAL 82 -1.751 -0.373 29.779 339 HG21 VAL 82 HG21 VAL 82 -0.246 2.200 27.508 340 HG22 VAL 82 HG22 VAL 82 0.909 1.978 28.822 341 HG23 VAL 82 HG23 VAL 82 -0.114 3.415 28.777 342 H LYS 83 HN LYS 83 -3.213 2.940 31.314 343 HA LYS 83 HA LYS 83 -5.150 0.841 31.847 344 HB2 LYS 83 HB2 LYS 83 -3.033 2.036 33.672 345 HB3 LYS 83 HB1 LYS 83 -4.360 1.014 34.237 346 HG2 LYS 83 HG2 LYS 83 -3.514 -0.841 32.939 347 HG3 LYS 83 HG1 LYS 83 -2.262 0.181 32.244 348 HD2 LYS 83 HD2 LYS 83 -1.351 -1.225 34.016 349 HD3 LYS 83 HD1 LYS 83 -1.267 0.475 34.461 350 HE2 LYS 83 HE2 LYS 83 -3.217 0.223 35.890 351 HE3 LYS 83 HE1 LYS 83 -3.396 -1.461 35.392 352 HZ1 LYS 83 HZ1 LYS 83 -1.048 -0.335 36.813 353 HZ2 LYS 83 HZ2 LYS 83 -1.261 -1.939 36.403 354 HZ3 LYS 83 HZ3 LYS 83 -2.259 -1.230 37.558 355 H LYS 84 HN LYS 84 -6.839 1.598 33.342 356 HA LYS 84 HA LYS 84 -7.995 3.918 32.311 357 HB2 LYS 84 HB2 LYS 84 -8.714 2.365 34.805 358 HB3 LYS 84 HB1 LYS 84 -9.757 3.551 34.017 359 HG2 LYS 84 HG2 LYS 84 -9.789 2.232 32.013 360 HG3 LYS 84 HG1 LYS 84 -8.675 1.078 32.730 361 HD2 LYS 84 HD2 LYS 84 -10.337 0.533 34.425 362 HD3 LYS 84 HD1 LYS 84 -11.455 1.695 33.688 363 HE2 LYS 84 HE2 LYS 84 -11.356 0.474 31.603 364 HE3 LYS 84 HE1 LYS 84 -10.236 -0.679 32.324 365 HZ1 LYS 84 HZ1 LYS 84 -13.012 -0.201 33.249 366 HZ2 LYS 84 HZ2 LYS 84 -11.956 -1.396 33.829 367 HZ3 LYS 84 HZ3 LYS 84 -12.539 -1.467 32.248 368 HA PRO 85 HA PRO 85 -5.938 7.266 34.096 369 HB2 PRO 85 HB2 PRO 85 -7.949 9.113 33.887 370 HB3 PRO 85 HB1 PRO 85 -6.877 8.651 32.567 371 HG2 PRO 85 HG2 PRO 85 -9.621 7.676 33.193 372 HG3 PRO 85 HG1 PRO 85 -8.907 8.077 31.619 373 HD2 PRO 85 HD2 PRO 85 -9.168 5.558 32.368 374 HD3 PRO 85 HD1 PRO 85 -7.701 6.095 31.528 375 H THR 86 HN THR 86 -5.461 7.592 36.021 376 HA THR 86 HA THR 86 -7.477 7.788 38.087 377 HB THR 86 HB THR 86 -5.263 7.815 39.486 378 HG1 THR 86 HG1 THR 86 -3.591 7.808 38.181 379 HG21 THR 86 HG21 THR 86 -6.114 5.336 37.973 380 HG22 THR 86 HG22 THR 86 -6.897 5.963 39.422 381 HG23 THR 86 HG23 THR 86 -5.235 5.370 39.505 382 H GLY 87 HN GLY 87 -8.115 9.780 38.559 383 HA2 GLY 87 HA2 GLY 87 -6.883 11.969 39.280 384 HA3 GLY 87 HA1 GLY 87 -6.610 12.034 37.535 385 H ASN 88 HN ASN 88 -8.105 13.116 36.419 386 HA ASN 88 HA ASN 88 -10.871 12.883 37.335 387 HB2 ASN 88 HB2 ASN 88 -9.639 15.546 36.565 388 HB3 ASN 88 HB1 ASN 88 -11.315 15.269 37.007 389 HD21 ASN 88 HD21 ASN 88 -8.120 15.776 38.115 390 HD22 ASN 88 HD22 ASN 88 -8.464 15.863 39.796 391 HA PRO 89 HA PRO 89 -11.221 12.764 32.807 392 HB2 PRO 89 HB2 PRO 89 -12.013 10.208 32.550 393 HB3 PRO 89 HB1 PRO 89 -10.315 10.601 32.662 394 HG2 PRO 89 HG2 PRO 89 -11.960 9.199 34.636 395 HG3 PRO 89 HG1 PRO 89 -10.208 9.433 34.632 396 HD2 PRO 89 HD2 PRO 89 -12.292 10.961 36.076 397 HD3 PRO 89 HD1 PRO 89 -10.544 10.876 36.389 398 H GLN 90 HN GLN 90 -12.822 12.372 31.531 399 HA GLN 90 HA GLN 90 -15.285 13.441 32.686 400 HB2 GLN 90 HB2 GLN 90 -13.521 14.627 31.210 401 HB3 GLN 90 HB1 GLN 90 -14.200 13.677 29.912 402 HG2 GLN 90 HG2 GLN 90 -15.711 15.430 31.693 403 HG3 GLN 90 HG1 GLN 90 -14.994 15.984 30.177 404 HE21 GLN 90 HE21 GLN 90 -15.598 13.471 28.780 405 HE22 GLN 90 HE22 GLN 90 -17.289 13.412 28.485 406 HA PRO 91 HA PRO 91 -17.049 9.462 31.380 407 HB2 PRO 91 HB2 PRO 91 -19.521 10.518 30.511 408 HB3 PRO 91 HB1 PRO 91 -19.154 9.855 32.105 409 HG2 PRO 91 HG2 PRO 91 -19.193 12.691 31.196 410 HG3 PRO 91 HG1 PRO 91 -19.625 12.013 32.773 411 HD2 PRO 91 HD2 PRO 91 -17.335 13.330 32.422 412 HD3 PRO 91 HD1 PRO 91 -17.396 11.890 33.463 413 H LYS 92 HN LYS 92 -15.868 8.910 29.658 414 HA LYS 92 HA LYS 92 -17.063 9.105 27.079 415 HB2 LYS 92 HB2 LYS 92 -15.459 11.034 27.200 416 HB3 LYS 92 HB1 LYS 92 -14.179 9.898 27.593 417 HG2 LYS 92 HG2 LYS 92 -14.437 8.823 25.440 418 HG3 LYS 92 HG1 LYS 92 -15.774 9.908 25.048 419 HD2 LYS 92 HD2 LYS 92 -14.267 11.816 25.204 420 HD3 LYS 92 HD1 LYS 92 -12.934 10.739 25.603 421 HE2 LYS 92 HE2 LYS 92 -12.851 11.329 23.253 422 HE3 LYS 92 HE1 LYS 92 -13.201 9.617 23.449 423 HZ1 LYS 92 HZ1 LYS 92 -15.255 11.693 22.905 424 HZ2 LYS 92 HZ2 LYS 92 -15.489 10.025 22.969 425 HZ3 LYS 92 HZ3 LYS 92 -14.564 10.693 21.749 426 H ASN 93 HN ASN 93 -16.379 7.218 25.838 427 HA ASN 93 HA ASN 93 -15.505 5.080 27.505 428 HB2 ASN 93 HB2 ASN 93 -17.087 4.645 25.660 429 HB3 ASN 93 HB1 ASN 93 -15.848 5.100 24.495 430 HD21 ASN 93 HD21 ASN 93 -15.246 3.172 27.398 431 HD22 ASN 93 HD22 ASN 93 -14.860 1.721 26.566 432 H TRP 94 HN TRP 94 -13.500 5.343 28.263 433 HA TRP 94 HA TRP 94 -11.221 6.139 26.965 434 HB2 TRP 94 HB2 TRP 94 -11.432 6.113 29.359 435 HB3 TRP 94 HB1 TRP 94 -11.693 4.376 29.373 436 HD1 TRP 94 HD1 TRP 94 -8.958 6.991 29.033 437 HE1 TRP 94 HE1 TRP 94 -6.662 5.827 29.375 438 HE3 TRP 94 HE3 TRP 94 -10.532 2.171 29.225 439 HZ2 TRP 94 HZ2 TRP 94 -5.700 3.228 29.683 440 HZ3 TRP 94 HZ3 TRP 94 -8.869 0.392 29.566 441 HH2 TRP 94 HH2 TRP 94 -6.509 0.916 29.788 442 H ASN 95 HN ASN 95 -9.559 5.040 26.008 443 HA ASN 95 HA ASN 95 -9.946 2.208 25.400 444 HB2 ASN 95 HB2 ASN 95 -10.325 3.426 23.325 445 HB3 ASN 95 HB1 ASN 95 -8.850 4.353 23.559 446 HD21 ASN 95 HD21 ASN 95 -9.282 0.820 24.022 447 HD22 ASN 95 HD22 ASN 95 -8.076 0.439 22.848 448 H LYS 96 HN LYS 96 -8.241 0.962 25.810 449 HA LYS 96 HA LYS 96 -5.996 1.946 27.276 450 HB2 LYS 96 HB2 LYS 96 -5.256 -0.323 27.279 451 HB3 LYS 96 HB1 LYS 96 -6.983 -0.284 27.682 452 HG2 LYS 96 HG2 LYS 96 -7.463 -0.910 25.311 453 HG3 LYS 96 HG1 LYS 96 -5.717 -0.951 25.048 454 HD2 LYS 96 HD2 LYS 96 -5.455 -2.781 26.566 455 HD3 LYS 96 HD1 LYS 96 -7.153 -2.698 27.040 456 HE2 LYS 96 HE2 LYS 96 -6.736 -4.515 25.441 457 HE3 LYS 96 HE1 LYS 96 -7.837 -3.307 24.793 458 HZ1 LYS 96 HZ1 LYS 96 -6.217 -3.988 23.155 459 HZ2 LYS 96 HZ2 LYS 96 -4.943 -3.567 24.140 460 HZ3 LYS 96 HZ3 LYS 96 -5.980 -2.375 23.525 461 H ASP 97 HN ASP 97 -3.872 1.173 26.697 462 HA ASP 97 HA ASP 97 -2.027 0.909 25.506 463 HB2 ASP 97 HB2 ASP 97 -3.348 -1.131 24.836 464 HB3 ASP 97 HB1 ASP 97 -3.775 -0.286 23.355 465 H GLY 98 HN GLY 98 -3.616 3.366 25.123 466 HA2 GLY 98 HA2 GLY 98 -1.943 5.084 24.268 467 HA3 GLY 98 HA1 GLY 98 -2.015 4.169 22.798 468 H TYR 99 HN TYR 99 -5.139 4.131 23.833 469 HA TYR 99 HA TYR 99 -6.944 4.900 22.852 470 HB2 TYR 99 HB2 TYR 99 -5.669 7.302 23.842 471 HB3 TYR 99 HB1 TYR 99 -6.409 7.655 22.283 472 HD1 TYR 99 HD1 TYR 99 -8.785 7.433 22.019 473 HD2 TYR 99 HD2 TYR 99 -6.845 6.863 25.734 474 HE1 TYR 99 HE1 TYR 99 -10.899 7.810 23.165 475 HE2 TYR 99 HE2 TYR 99 -8.934 7.222 26.896 476 HH TYR 99 HH TYR 99 -11.898 7.299 25.277 477 H LEU 100 HN LEU 100 -7.019 3.854 21.078 478 HA LEU 100 HA LEU 100 -5.929 5.029 18.629 479 HB2 LEU 100 HB2 LEU 100 -4.902 2.823 19.901 480 HB3 LEU 100 HB1 LEU 100 -6.156 2.082 18.945 481 HG LEU 100 HG LEU 100 -3.800 3.643 17.886 482 HD11 LEU 100 HD11 LEU 100 -4.364 0.703 17.884 483 HD12 LEU 100 HD12 LEU 100 -3.124 1.553 18.809 484 HD13 LEU 100 HD13 LEU 100 -3.025 1.489 17.049 485 HD21 LEU 100 HD21 LEU 100 -5.639 3.876 16.320 486 HD22 LEU 100 HD22 LEU 100 -5.960 2.145 16.391 487 HD23 LEU 100 HD23 LEU 100 -4.465 2.735 15.665 488 H LYS 101 HN LYS 101 -7.262 3.996 16.817 489 HA LYS 101 HA LYS 101 -10.071 3.817 17.569 490 HB2 LYS 101 HB2 LYS 101 -8.695 3.647 14.907 491 HB3 LYS 101 HB1 LYS 101 -10.437 3.703 15.127 492 HG2 LYS 101 HG2 LYS 101 -10.141 5.981 16.091 493 HG3 LYS 101 HG1 LYS 101 -8.427 5.880 15.654 494 HD2 LYS 101 HD2 LYS 101 -9.066 5.439 13.333 495 HD3 LYS 101 HD1 LYS 101 -10.756 5.591 13.795 496 HE2 LYS 101 HE2 LYS 101 -10.338 7.930 14.479 497 HE3 LYS 101 HE1 LYS 101 -8.661 7.764 13.965 498 HZ1 LYS 101 HZ1 LYS 101 -11.053 7.560 12.228 499 HZ2 LYS 101 HZ2 LYS 101 -9.480 7.318 11.695 500 HZ3 LYS 101 HZ3 LYS 101 -9.956 8.831 12.253 501 H LYS 102 HN LYS 102 -10.973 2.024 15.693 502 HA LYS 102 HA LYS 102 -9.964 -0.459 16.733 503 HB2 LYS 102 HB2 LYS 102 -11.865 -1.433 15.196 504 HB3 LYS 102 HB1 LYS 102 -12.265 -0.606 16.697 505 HG2 LYS 102 HG2 LYS 102 -13.801 -0.047 14.989 506 HG3 LYS 102 HG1 LYS 102 -12.819 1.368 15.343 507 HD2 LYS 102 HD2 LYS 102 -11.579 1.098 13.345 508 HD3 LYS 102 HD1 LYS 102 -12.267 -0.507 13.060 509 HE2 LYS 102 HE2 LYS 102 -14.409 0.383 12.792 510 HE3 LYS 102 HE1 LYS 102 -13.877 2.007 13.229 511 HZ1 LYS 102 HZ1 LYS 102 -13.008 0.491 10.812 512 HZ2 LYS 102 HZ2 LYS 102 -12.491 2.033 11.243 513 HZ3 LYS 102 HZ3 LYS 102 -14.102 1.778 10.826 514 H LEU 103 HN LEU 103 -8.194 0.911 15.204 515 HA LEU 103 HA LEU 103 -7.842 -0.596 12.760 516 HB2 LEU 103 HB2 LEU 103 -6.648 1.955 13.800 517 HB3 LEU 103 HB1 LEU 103 -5.750 1.025 12.626 518 HG LEU 103 HG LEU 103 -7.646 1.250 11.037 519 HD11 LEU 103 HD11 LEU 103 -8.814 3.151 13.048 520 HD12 LEU 103 HD12 LEU 103 -9.459 1.563 12.636 521 HD13 LEU 103 HD13 LEU 103 -9.412 2.841 11.420 522 HD21 LEU 103 HD21 LEU 103 -6.539 3.834 12.101 523 HD22 LEU 103 HD22 LEU 103 -7.267 3.602 10.512 524 HD23 LEU 103 HD23 LEU 103 -5.770 2.767 10.927 525 HA PRO 104 HA PRO 104 -4.887 -3.377 14.538 526 HB2 PRO 104 HB2 PRO 104 -3.214 -3.096 12.123 527 HB3 PRO 104 HB1 PRO 104 -4.031 -4.523 12.756 528 HG2 PRO 104 HG2 PRO 104 -4.896 -3.277 10.549 529 HG3 PRO 104 HG1 PRO 104 -6.017 -4.026 11.698 530 HD2 PRO 104 HD2 PRO 104 -5.314 -1.144 11.337 531 HD3 PRO 104 HD1 PRO 104 -6.888 -1.902 11.653 532 H VAL 105 HN VAL 105 -2.226 -3.623 14.253 533 HA VAL 105 HA VAL 105 -1.228 -1.149 15.434 534 HB VAL 105 HB VAL 105 -1.193 -3.420 16.656 535 HG11 VAL 105 HG11 VAL 105 1.166 -3.930 14.892 536 HG12 VAL 105 HG12 VAL 105 -0.347 -4.829 14.936 537 HG13 VAL 105 HG13 VAL 105 0.738 -4.863 16.327 538 HG21 VAL 105 HG21 VAL 105 -0.028 -1.446 17.506 539 HG22 VAL 105 HG22 VAL 105 1.409 -1.887 16.577 540 HG23 VAL 105 HG23 VAL 105 0.800 -2.952 17.850 541 H ASP 106 HN ASP 106 1.444 -1.061 14.902 542 HA ASP 106 HA ASP 106 1.423 -0.570 12.124 543 HB2 ASP 106 HB2 ASP 106 2.837 1.006 12.953 544 HB3 ASP 106 HB1 ASP 106 3.352 0.026 14.355 545 HA PRO 107 HA PRO 107 2.886 -4.297 10.212 546 HB2 PRO 107 HB2 PRO 107 4.794 -3.086 8.638 547 HB3 PRO 107 HB1 PRO 107 3.124 -3.397 8.168 548 HG2 PRO 107 HG2 PRO 107 4.358 -0.871 9.179 549 HG3 PRO 107 HG1 PRO 107 3.048 -1.076 8.004 550 HD2 PRO 107 HD2 PRO 107 2.557 -0.279 10.468 551 HD3 PRO 107 HD1 PRO 107 1.457 -1.418 9.656 552 H TRP 108 HN TRP 108 4.966 -5.333 9.691 553 HA TRP 108 HA TRP 108 6.846 -6.295 10.289 554 HB2 TRP 108 HB2 TRP 108 7.847 -3.788 11.666 555 HB3 TRP 108 HB1 TRP 108 8.787 -5.015 10.833 556 HD1 TRP 108 HD1 TRP 108 8.251 -5.048 8.039 557 HE1 TRP 108 HE1 TRP 108 8.016 -2.996 6.486 558 HE3 TRP 108 HE3 TRP 108 7.283 -1.594 11.574 559 HZ2 TRP 108 HZ2 TRP 108 7.429 -0.175 6.833 560 HZ3 TRP 108 HZ3 TRP 108 6.868 0.707 10.971 561 HH2 TRP 108 HH2 TRP 108 6.876 1.446 8.799 562 H GLY 109 HN GLY 109 4.593 -5.615 12.186 563 HA2 GLY 109 HA2 GLY 109 3.796 -6.537 14.130 564 HA3 GLY 109 HA1 GLY 109 5.358 -7.298 14.347 565 H ASN 110 HN ASN 110 5.583 -3.738 14.163 566 HA ASN 110 HA ASN 110 6.390 -3.793 16.868 567 HB2 ASN 110 HB2 ASN 110 6.012 -1.329 15.173 568 HB3 ASN 110 HB1 ASN 110 6.994 -1.497 16.613 569 HD21 ASN 110 HD21 ASN 110 6.817 -1.655 13.318 570 HD22 ASN 110 HD22 ASN 110 8.430 -2.125 12.960 571 HA PRO 111 HA PRO 111 2.456 -2.379 18.568 572 HB2 PRO 111 HB2 PRO 111 4.211 -2.136 20.944 573 HB3 PRO 111 HB1 PRO 111 2.673 -2.992 20.788 574 HG2 PRO 111 HG2 PRO 111 4.956 -4.337 20.985 575 HG3 PRO 111 HG1 PRO 111 3.670 -4.886 19.894 576 HD2 PRO 111 HD2 PRO 111 6.181 -3.391 19.248 577 HD3 PRO 111 HD1 PRO 111 5.418 -4.753 18.395 578 H TYR 112 HN TYR 112 1.848 -0.259 19.080 579 HA TYR 112 HA TYR 112 3.667 1.719 18.221 580 HB2 TYR 112 HB2 TYR 112 0.821 1.891 19.181 581 HB3 TYR 112 HB1 TYR 112 1.779 3.350 18.955 582 HD1 TYR 112 HD1 TYR 112 2.694 3.862 16.695 583 HD2 TYR 112 HD2 TYR 112 -0.133 0.752 17.315 584 HE1 TYR 112 HE1 TYR 112 2.193 3.856 14.287 585 HE2 TYR 112 HE2 TYR 112 -0.642 0.741 14.900 586 HH TYR 112 HH TYR 112 -0.479 2.243 12.970 587 H GLN 113 HN GLN 113 4.468 3.452 19.254 588 HA GLN 113 HA GLN 113 5.166 2.869 22.056 589 HB2 GLN 113 HB2 GLN 113 6.471 5.090 20.582 590 HB3 GLN 113 HB1 GLN 113 7.179 3.963 21.703 591 HG2 GLN 113 HG2 GLN 113 6.632 3.562 18.784 592 HG3 GLN 113 HG1 GLN 113 8.188 3.789 19.541 593 HE21 GLN 113 HE21 GLN 113 7.495 1.931 21.735 594 HE22 GLN 113 HE22 GLN 113 7.565 0.354 21.054 595 H TYR 114 HN TYR 114 4.085 4.073 23.443 596 HA TYR 114 HA TYR 114 3.009 6.604 22.498 597 HB2 TYR 114 HB2 TYR 114 1.385 6.161 24.525 598 HB3 TYR 114 HB1 TYR 114 1.064 5.511 22.930 599 HD1 TYR 114 HD1 TYR 114 3.326 4.194 25.685 600 HD2 TYR 114 HD2 TYR 114 -0.104 3.562 23.267 601 HE1 TYR 114 HE1 TYR 114 3.057 1.923 26.630 602 HE2 TYR 114 HE2 TYR 114 -0.375 1.317 24.221 603 HH TYR 114 HH TYR 114 0.735 -0.313 25.282 604 H LEU 115 HN LEU 115 3.931 8.301 23.275 605 HA LEU 115 HA LEU 115 4.628 8.308 26.079 606 HB2 LEU 115 HB2 LEU 115 6.251 9.465 23.814 607 HB3 LEU 115 HB1 LEU 115 6.518 9.868 25.498 608 HG LEU 115 HG LEU 115 6.852 7.123 24.277 609 HD11 LEU 115 HD11 LEU 115 8.892 9.162 25.157 610 HD12 LEU 115 HD12 LEU 115 8.543 8.690 23.493 611 HD13 LEU 115 HD13 LEU 115 9.239 7.519 24.614 612 HD21 LEU 115 HD21 LEU 115 6.221 7.014 26.637 613 HD22 LEU 115 HD22 LEU 115 7.490 8.166 27.041 614 HD23 LEU 115 HD23 LEU 115 7.914 6.567 26.428 615 H ALA 116 HN ALA 116 4.515 10.434 27.075 616 HA ALA 116 HA ALA 116 2.623 12.022 25.625 617 HB1 ALA 116 HB1 ALA 116 2.033 10.929 27.853 618 HB2 ALA 116 HB2 ALA 116 1.676 12.619 27.628 619 HB3 ALA 116 HB3 ALA 116 3.098 12.156 28.588 620 HA PRO 117 HA PRO 117 4.702 15.727 25.007 621 HB2 PRO 117 HB2 PRO 117 5.032 17.400 27.186 622 HB3 PRO 117 HB1 PRO 117 3.681 17.385 26.079 623 HG2 PRO 117 HG2 PRO 117 3.871 16.044 28.746 624 HG3 PRO 117 HG1 PRO 117 2.505 16.905 28.007 625 HD2 PRO 117 HD2 PRO 117 2.590 14.254 28.056 626 HD3 PRO 117 HD1 PRO 117 1.959 15.098 26.614 627 H GLY 118 HN GLY 118 6.529 15.297 24.376 628 HA2 GLY 118 HA2 GLY 118 8.663 14.582 26.190 629 HA3 GLY 118 HA1 GLY 118 8.719 14.604 24.429 630 H THR 119 HN THR 119 9.080 16.526 23.361 631 HA THR 119 HA THR 119 10.449 18.450 25.110 632 HB THR 119 HB THR 119 10.832 18.284 22.162 633 HG1 THR 119 HG1 THR 119 11.494 16.419 24.014 634 HG21 THR 119 HG21 THR 119 12.588 19.210 24.441 635 HG22 THR 119 HG22 THR 119 11.743 20.233 23.279 636 HG23 THR 119 HG23 THR 119 13.068 19.200 22.746 637 H LYS 120 HN LYS 120 8.743 19.688 25.556 638 HA LYS 120 HA LYS 120 7.425 21.513 25.407 639 HB2 LYS 120 HB2 LYS 120 8.412 21.897 22.587 640 HB3 LYS 120 HB1 LYS 120 7.755 23.117 23.663 641 HG2 LYS 120 HG2 LYS 120 10.371 21.668 23.965 642 HG3 LYS 120 HG1 LYS 120 10.174 23.342 23.459 643 HD2 LYS 120 HD2 LYS 120 9.150 23.834 25.675 644 HD3 LYS 120 HD1 LYS 120 9.489 22.175 26.158 645 HE2 LYS 120 HE2 LYS 120 11.879 22.557 25.794 646 HE3 LYS 120 HE1 LYS 120 11.540 24.213 25.310 647 HZ1 LYS 120 HZ1 LYS 120 10.631 24.611 27.534 648 HZ2 LYS 120 HZ2 LYS 120 12.253 24.151 27.573 649 HZ3 LYS 120 HZ3 LYS 120 11.059 23.032 27.989 650 H GLY 121 HN GLY 121 6.888 18.847 23.493 651 HA2 GLY 121 HA2 GLY 121 4.467 20.006 22.351 652 HA3 GLY 121 HA1 GLY 121 5.354 18.647 21.655 653 HA PRO 122 HA PRO 122 1.664 18.091 25.111 654 HB2 PRO 122 HB2 PRO 122 0.419 17.776 22.422 655 HB3 PRO 122 HB1 PRO 122 -0.351 18.134 23.976 656 HG2 PRO 122 HG2 PRO 122 0.232 20.114 22.366 657 HG3 PRO 122 HG1 PRO 122 0.602 20.265 24.098 658 HD2 PRO 122 HD2 PRO 122 2.420 19.864 21.796 659 HD3 PRO 122 HD1 PRO 122 2.725 20.658 23.359 660 H PHE 123 HN PHE 123 2.876 16.144 22.356 661 HA PHE 123 HA PHE 123 2.984 13.939 24.065 662 HB2 PHE 123 HB2 PHE 123 1.441 12.325 23.014 663 HB3 PHE 123 HB1 PHE 123 0.581 13.667 23.732 664 HD1 PHE 123 HD1 PHE 123 -0.565 15.321 22.264 665 HD2 PHE 123 HD2 PHE 123 1.347 11.845 20.692 666 HE1 PHE 123 HE1 PHE 123 -1.823 15.565 20.172 667 HE2 PHE 123 HE2 PHE 123 0.088 12.095 18.604 668 HZ PHE 123 HZ PHE 123 -1.495 13.950 18.335 669 H ASP 124 HN ASP 124 3.558 11.834 22.892 670 HA ASP 124 HA ASP 124 4.918 12.327 20.355 671 HB2 ASP 124 HB2 ASP 124 6.143 11.277 22.887 672 HB3 ASP 124 HB1 ASP 124 6.689 10.616 21.355 673 H LEU 125 HN LEU 125 3.743 11.002 19.050 674 HA LEU 125 HA LEU 125 3.286 8.284 20.035 675 HB2 LEU 125 HB2 LEU 125 1.219 9.672 19.876 676 HB3 LEU 125 HB1 LEU 125 1.538 9.920 18.180 677 HG LEU 125 HG LEU 125 -0.269 8.308 18.717 678 HD11 LEU 125 HD11 LEU 125 2.034 7.177 17.142 679 HD12 LEU 125 HD12 LEU 125 0.738 8.210 16.529 680 HD13 LEU 125 HD13 LEU 125 0.377 6.580 17.098 681 HD21 LEU 125 HD21 LEU 125 0.679 7.249 20.676 682 HD22 LEU 125 HD22 LEU 125 1.989 6.571 19.709 683 HD23 LEU 125 HD23 LEU 125 0.334 6.031 19.450 684 H TYR 126 HN TYR 126 4.132 6.680 18.761 685 HA TYR 126 HA TYR 126 4.554 6.950 15.998 686 HB2 TYR 126 HB2 TYR 126 6.994 7.037 15.885 687 HB3 TYR 126 HB1 TYR 126 6.397 8.450 16.732 688 HD1 TYR 126 HD1 TYR 126 6.690 8.596 19.232 689 HD2 TYR 126 HD2 TYR 126 8.552 5.539 16.904 690 HE1 TYR 126 HE1 TYR 126 8.333 8.201 21.024 691 HE2 TYR 126 HE2 TYR 126 10.163 5.164 18.665 692 HH TYR 126 HH TYR 126 11.139 6.519 20.506 693 H SER 127 HN SER 127 5.759 5.036 15.144 694 HA SER 127 HA SER 127 5.993 2.884 17.111 695 HB2 SER 127 HB2 SER 127 4.058 2.564 15.468 696 HB3 SER 127 HB1 SER 127 5.280 2.499 14.199 697 HG SER 127 HG SER 127 5.454 0.479 14.675 698 H LEU 128 HN LEU 128 7.747 1.486 16.669 699 HA LEU 128 HA LEU 128 9.983 2.785 15.442 700 HB2 LEU 128 HB2 LEU 128 9.499 0.223 16.812 701 HB3 LEU 128 HB1 LEU 128 10.860 0.274 15.732 702 HG LEU 128 HG LEU 128 11.896 2.113 16.971 703 HD11 LEU 128 HD11 LEU 128 10.985 2.999 19.010 704 HD12 LEU 128 HD12 LEU 128 9.521 2.044 18.774 705 HD13 LEU 128 HD13 LEU 128 9.941 3.317 17.626 706 HD21 LEU 128 HD21 LEU 128 12.347 -0.142 17.754 707 HD22 LEU 128 HD22 LEU 128 10.962 -0.039 18.845 708 HD23 LEU 128 HD23 LEU 128 12.357 1.016 19.083 709 H GLY 129 HN GLY 129 11.264 1.973 13.655 710 HA2 GLY 129 HA2 GLY 129 9.611 1.244 11.422 711 HA3 GLY 129 HA1 GLY 129 11.343 1.462 11.385 712 H ALA 130 HN ALA 130 11.035 -0.295 9.915 713 HA ALA 130 HA ALA 130 10.182 -2.871 10.645 714 HB1 ALA 130 HB1 ALA 130 11.194 -3.622 8.597 715 HB2 ALA 130 HB2 ALA 130 12.128 -2.128 8.483 716 HB3 ALA 130 HB3 ALA 130 10.368 -2.082 8.350 717 H ASP 131 HN ASP 131 13.146 -1.301 11.249 718 HA ASP 131 HA ASP 131 14.521 -3.818 11.835 719 HB2 ASP 131 HB2 ASP 131 15.789 -2.146 10.621 720 HB3 ASP 131 HB1 ASP 131 15.483 -0.942 11.863 721 H GLY 132 HN GLY 132 12.369 -1.926 13.397 722 HA2 GLY 132 HA2 GLY 132 11.832 -1.601 15.601 723 HA3 GLY 132 HA1 GLY 132 13.041 -2.828 15.993 724 H LYS 133 HN LYS 133 13.279 0.266 14.380 725 HA LYS 133 HA LYS 133 15.270 1.173 16.340 726 HB2 LYS 133 HB2 LYS 133 16.247 0.097 14.234 727 HB3 LYS 133 HB1 LYS 133 15.502 1.405 13.339 728 HG2 LYS 133 HG2 LYS 133 17.558 2.304 13.561 729 HG3 LYS 133 HG1 LYS 133 16.904 2.840 15.109 730 HD2 LYS 133 HD2 LYS 133 18.531 0.323 14.678 731 HD3 LYS 133 HD1 LYS 133 19.159 1.846 15.293 732 HE2 LYS 133 HE2 LYS 133 17.780 1.658 17.276 733 HE3 LYS 133 HE1 LYS 133 16.980 0.232 16.619 734 HZ1 LYS 133 HZ1 LYS 133 19.864 0.397 17.305 735 HZ2 LYS 133 HZ2 LYS 133 19.039 -0.969 16.749 736 HZ3 LYS 133 HZ3 LYS 133 18.665 -0.305 18.249 737 H GLU 134 HN GLU 134 15.104 3.408 16.665 738 HA GLU 134 HA GLU 134 13.138 4.680 15.004 739 HB2 GLU 134 HB2 GLU 134 12.928 6.457 16.825 740 HB3 GLU 134 HB1 GLU 134 12.329 4.866 17.215 741 HG2 GLU 134 HG2 GLU 134 13.361 5.579 19.165 742 HG3 GLU 134 HG1 GLU 134 14.570 4.543 18.428 743 H GLY 135 HN GLY 135 13.859 5.718 13.380 744 HA2 GLY 135 HA2 GLY 135 16.097 7.554 13.679 745 HA3 GLY 135 HA1 GLY 135 16.304 6.214 12.552 746 H GLY 136 HN GLY 136 16.550 8.336 11.172 747 HA2 GLY 136 HA2 GLY 136 13.853 8.868 10.090 748 HA3 GLY 136 HA1 GLY 136 15.227 9.971 9.900 749 H SER 137 HN SER 137 13.472 8.066 8.113 750 HA SER 137 HA SER 137 15.219 7.236 6.116 751 HB2 SER 137 HB2 SER 137 14.531 5.117 8.181 752 HB3 SER 137 HB1 SER 137 15.157 4.771 6.567 753 HG SER 137 HG SER 137 16.644 4.837 8.526 754 H ASP 138 HN ASP 138 13.946 5.242 4.911 755 HA ASP 138 HA ASP 138 11.227 6.088 4.603 756 HB2 ASP 138 HB2 ASP 138 12.722 3.713 3.480 757 HB3 ASP 138 HB1 ASP 138 11.001 3.924 3.231 758 H ASN 139 HN ASN 139 12.355 2.822 5.368 759 HA ASN 139 HA ASN 139 9.976 2.494 7.104 760 HB2 ASN 139 HB2 ASN 139 10.185 0.121 6.786 761 HB3 ASN 139 HB1 ASN 139 10.251 0.885 5.202 762 HD21 ASN 139 HD21 ASN 139 11.346 -1.583 6.515 763 HD22 ASN 139 HD22 ASN 139 12.992 -1.684 5.975 764 H ASP 140 HN ASP 140 13.233 2.947 7.150 765 HA ASP 140 HA ASP 140 13.790 1.407 9.551 766 HB2 ASP 140 HB2 ASP 140 15.470 1.439 7.803 767 HB3 ASP 140 HB1 ASP 140 15.469 3.186 7.762 768 H ALA 141 HN ALA 141 12.225 4.041 8.932 769 HA ALA 141 HA ALA 141 13.265 5.867 10.936 770 HB1 ALA 141 HB1 ALA 141 11.596 7.376 10.118 771 HB2 ALA 141 HB2 ALA 141 10.885 6.098 9.136 772 HB3 ALA 141 HB3 ALA 141 12.499 6.693 8.759 773 H ASP 142 HN ASP 142 11.942 6.598 12.632 774 HA ASP 142 HA ASP 142 9.937 4.677 13.431 775 HB2 ASP 142 HB2 ASP 142 9.762 5.880 15.525 776 HB3 ASP 142 HB1 ASP 142 11.461 5.653 15.200 777 H ILE 143 HN ILE 143 7.919 4.932 12.953 778 HA ILE 143 HA ILE 143 7.317 7.406 11.617 779 HB ILE 143 HB ILE 143 5.321 6.161 10.605 780 HG12 ILE 143 HG12 ILE 143 5.780 3.637 10.327 781 HG13 ILE 143 HG11 ILE 143 6.830 3.778 11.724 782 HG21 ILE 143 HG21 ILE 143 6.702 5.139 8.859 783 HG22 ILE 143 HG22 ILE 143 8.107 5.306 9.912 784 HG23 ILE 143 HG23 ILE 143 7.269 6.746 9.330 785 HD11 ILE 143 HD11 ILE 143 3.893 4.407 11.696 786 HD12 ILE 143 HD12 ILE 143 4.957 4.386 13.103 787 HD13 ILE 143 HD13 ILE 143 4.601 2.886 12.236 788 H GLY 144 HN GLY 144 6.296 8.894 12.567 789 HA2 GLY 144 HA2 GLY 144 4.018 8.281 14.169 790 HA3 GLY 144 HA1 GLY 144 5.418 8.789 15.095 791 H ASN 145 HN ASN 145 3.593 10.306 15.557 792 HA ASN 145 HA ASN 145 4.207 12.763 14.392 793 HB2 ASN 145 HB2 ASN 145 2.165 13.363 13.296 794 HB3 ASN 145 HB1 ASN 145 2.641 11.808 12.640 795 HD21 ASN 145 HD21 ASN 145 1.525 10.399 15.116 796 HD22 ASN 145 HD22 ASN 145 -0.179 10.444 14.834 797 H TRP 146 HN TRP 146 3.004 14.452 15.506 798 HA TRP 146 HA TRP 146 1.432 13.743 17.743 799 HB2 TRP 146 HB2 TRP 146 3.101 14.702 19.397 800 HB3 TRP 146 HB1 TRP 146 3.403 13.079 18.808 801 HD1 TRP 146 HD1 TRP 146 4.701 16.701 18.211 802 HE1 TRP 146 HE1 TRP 146 7.175 16.529 17.490 803 HE3 TRP 146 HE3 TRP 146 5.094 11.654 17.995 804 HZ2 TRP 146 HZ2 TRP 146 9.051 14.483 16.925 805 HZ3 TRP 146 HZ3 TRP 146 7.261 10.635 17.370 806 HH2 TRP 146 HH2 TRP 146 9.192 12.027 16.848 807 H ASP 147 HN ASP 147 1.374 15.727 19.211 808 HA ASP 147 HA ASP 147 1.178 18.053 17.459 809 HB2 ASP 147 HB2 ASP 147 -0.987 17.452 18.514 810 HB3 ASP 147 HB1 ASP 147 -0.236 17.572 20.103 811 H ASN 148 HN ASN 148 2.631 19.440 17.680 812 HA ASN 148 HA ASN 148 3.744 20.181 20.223 813 HB2 ASN 148 HB2 ASN 148 5.290 18.402 19.482 814 HB3 ASN 148 HB1 ASN 148 5.425 19.150 17.900 815 HD21 ASN 148 HD21 ASN 148 7.681 19.277 18.145 816 HD22 ASN 148 HD22 ASN 148 8.419 20.435 19.186 Start of MODEL 7 1 H1 MET 39 HT1 MET 39 2.380 4.481 -0.391 2 H2 MET 39 HT2 MET 39 2.370 4.474 -2.044 3 H3 MET 39 HT3 MET 39 3.383 5.547 -1.257 4 HA MET 39 HA MET 39 4.587 3.689 -2.195 5 HB2 MET 39 HB2 MET 39 4.480 3.532 0.854 6 HB3 MET 39 HB1 MET 39 5.676 2.752 -0.129 7 HG2 MET 39 HG2 MET 39 5.234 5.709 0.007 8 HG3 MET 39 HG1 MET 39 6.475 4.816 0.881 9 HE1 MET 39 HE1 MET 39 8.350 6.382 -0.057 10 HE2 MET 39 HE2 MET 39 7.140 7.328 -0.925 11 HE3 MET 39 HE3 MET 39 8.576 6.747 -1.767 12 H SER 40 HN SER 40 3.514 2.131 -3.319 13 HA SER 40 HA SER 40 2.393 -0.074 -1.745 14 HB2 SER 40 HB2 SER 40 1.860 0.691 -4.612 15 HB3 SER 40 HB1 SER 40 1.044 -0.593 -3.715 16 HG SER 40 HG SER 40 0.373 1.127 -2.227 17 H ARG 41 HN ARG 41 4.839 -0.395 -1.595 18 HA ARG 41 HA ARG 41 5.582 -2.448 -3.407 19 HB2 ARG 41 HB2 ARG 41 7.773 -1.357 -4.037 20 HB3 ARG 41 HB1 ARG 41 6.371 -0.552 -4.710 21 HG2 ARG 41 HG2 ARG 41 6.526 1.130 -2.965 22 HG3 ARG 41 HG1 ARG 41 7.979 0.339 -2.333 23 HD2 ARG 41 HD2 ARG 41 9.025 0.626 -4.574 24 HD3 ARG 41 HD1 ARG 41 7.603 1.533 -5.076 25 HE ARG 41 HE ARG 41 8.998 2.459 -2.712 26 HH11 ARG 41 HH11 ARG 41 8.352 2.961 -6.155 27 HH12 ARG 41 HH12 ARG 41 9.093 4.494 -6.201 28 HH21 ARG 41 HH21 ARG 41 9.975 4.530 -2.790 29 HH22 ARG 41 HH22 ARG 41 10.040 5.425 -4.232 30 HA PRO 42 HA PRO 42 7.621 -4.677 -0.218 31 HB2 PRO 42 HB2 PRO 42 10.312 -3.766 -0.866 32 HB3 PRO 42 HB1 PRO 42 9.611 -5.381 -0.957 33 HG2 PRO 42 HG2 PRO 42 9.872 -3.358 -3.064 34 HG3 PRO 42 HG1 PRO 42 9.545 -5.092 -3.211 35 HD2 PRO 42 HD2 PRO 42 7.671 -3.279 -3.792 36 HD3 PRO 42 HD1 PRO 42 7.256 -4.801 -2.984 37 H ASP 43 HN ASP 43 7.359 -4.100 1.727 38 HA ASP 43 HA ASP 43 7.537 -3.339 3.786 39 HB2 ASP 43 HB2 ASP 43 10.049 -3.708 3.166 40 HB3 ASP 43 HB1 ASP 43 10.134 -1.953 3.321 41 H GLN 44 HN GLN 44 8.265 -0.865 1.455 42 HA GLN 44 HA GLN 44 7.554 1.309 3.148 43 HB2 GLN 44 HB2 GLN 44 7.553 1.162 0.137 44 HB3 GLN 44 HB1 GLN 44 7.377 2.633 1.088 45 HG2 GLN 44 HG2 GLN 44 9.600 2.249 2.065 46 HG3 GLN 44 HG1 GLN 44 9.785 0.824 1.046 47 HE21 GLN 44 HE21 GLN 44 11.366 3.212 1.161 48 HE22 GLN 44 HE22 GLN 44 11.352 3.908 -0.419 49 H ALA 45 HN ALA 45 5.790 -0.981 1.410 50 HA ALA 45 HA ALA 45 3.279 0.260 1.271 51 HB1 ALA 45 HB1 ALA 45 3.795 -1.839 0.115 52 HB2 ALA 45 HB2 ALA 45 2.375 -2.018 1.149 53 HB3 ALA 45 HB3 ALA 45 3.931 -2.664 1.669 54 H LYS 46 HN LYS 46 5.092 -1.041 3.909 55 HA LYS 46 HA LYS 46 2.853 -1.279 5.738 56 HB2 LYS 46 HB2 LYS 46 5.831 -1.337 6.149 57 HB3 LYS 46 HB1 LYS 46 4.645 -1.797 7.344 58 HG2 LYS 46 HG2 LYS 46 4.017 -3.709 6.069 59 HG3 LYS 46 HG1 LYS 46 5.021 -3.182 4.707 60 HD2 LYS 46 HD2 LYS 46 7.003 -3.331 6.151 61 HD3 LYS 46 HD1 LYS 46 5.987 -3.922 7.461 62 HE2 LYS 46 HE2 LYS 46 5.451 -5.880 6.266 63 HE3 LYS 46 HE1 LYS 46 6.213 -5.270 4.792 64 HZ1 LYS 46 HZ1 LYS 46 8.315 -5.199 6.065 65 HZ2 LYS 46 HZ2 LYS 46 7.730 -6.737 5.772 66 HZ3 LYS 46 HZ3 LYS 46 7.578 -6.075 7.320 67 H VAL 47 HN VAL 47 5.236 0.995 4.700 68 HA VAL 47 HA VAL 47 5.296 2.648 7.044 69 HB VAL 47 HB VAL 47 6.072 3.337 4.201 70 HG11 VAL 47 HG11 VAL 47 5.808 5.316 5.603 71 HG12 VAL 47 HG12 VAL 47 7.508 5.045 5.216 72 HG13 VAL 47 HG13 VAL 47 6.889 4.620 6.810 73 HG21 VAL 47 HG21 VAL 47 7.217 1.370 5.056 74 HG22 VAL 47 HG22 VAL 47 7.809 2.315 6.430 75 HG23 VAL 47 HG23 VAL 47 8.302 2.727 4.776 76 H THR 48 HN THR 48 3.750 2.742 3.926 77 HA THR 48 HA THR 48 2.623 5.285 4.243 78 HB THR 48 HB THR 48 3.035 4.248 2.050 79 HG1 THR 48 HG1 THR 48 0.287 4.592 1.905 80 HG21 THR 48 HG21 THR 48 2.377 1.977 2.554 81 HG22 THR 48 HG22 THR 48 1.500 2.572 1.149 82 HG23 THR 48 HG23 THR 48 0.692 2.470 2.720 83 H VAL 49 HN VAL 49 1.363 2.052 5.078 84 HA VAL 49 HA VAL 49 -1.226 3.107 5.648 85 HB VAL 49 HB VAL 49 -1.840 0.980 6.590 86 HG11 VAL 49 HG11 VAL 49 -0.150 0.573 4.148 87 HG12 VAL 49 HG12 VAL 49 -1.844 1.062 4.210 88 HG13 VAL 49 HG13 VAL 49 -1.372 -0.553 4.743 89 HG21 VAL 49 HG21 VAL 49 0.101 0.441 7.937 90 HG22 VAL 49 HG22 VAL 49 1.089 0.213 6.496 91 HG23 VAL 49 HG23 VAL 49 -0.229 -0.906 6.848 92 H ALA 50 HN ALA 50 1.700 2.517 7.453 93 HA ALA 50 HA ALA 50 0.622 2.872 10.016 94 HB1 ALA 50 HB1 ALA 50 2.851 3.134 10.766 95 HB2 ALA 50 HB2 ALA 50 3.400 3.551 9.150 96 HB3 ALA 50 HB3 ALA 50 2.870 1.891 9.502 97 H LYS 51 HN LYS 51 1.767 5.082 7.564 98 HA LYS 51 HA LYS 51 1.895 7.362 9.174 99 HB2 LYS 51 HB2 LYS 51 1.354 7.105 6.210 100 HB3 LYS 51 HB1 LYS 51 1.628 8.642 7.011 101 HG2 LYS 51 HG2 LYS 51 3.618 6.387 6.995 102 HG3 LYS 51 HG1 LYS 51 3.595 7.672 5.790 103 HD2 LYS 51 HD2 LYS 51 3.895 9.331 7.606 104 HD3 LYS 51 HD1 LYS 51 3.992 8.008 8.771 105 HE2 LYS 51 HE2 LYS 51 5.986 7.157 7.708 106 HE3 LYS 51 HE1 LYS 51 5.851 8.339 6.414 107 HZ1 LYS 51 HZ1 LYS 51 6.398 9.018 9.287 108 HZ2 LYS 51 HZ2 LYS 51 6.256 10.096 8.019 109 HZ3 LYS 51 HZ3 LYS 51 7.516 9.005 8.024 110 H GLY 52 HN GLY 52 -0.749 5.663 7.729 111 HA2 GLY 52 HA2 GLY 52 -2.630 7.834 8.114 112 HA3 GLY 52 HA1 GLY 52 -3.000 6.226 7.490 113 H ASP 53 HN ASP 53 -1.564 4.942 9.646 114 HA ASP 53 HA ASP 53 -3.793 4.796 11.434 115 HB2 ASP 53 HB2 ASP 53 -1.153 3.317 11.524 116 HB3 ASP 53 HB1 ASP 53 -2.515 3.000 12.590 117 H ILE 54 HN ILE 54 -0.543 6.065 11.559 118 HA ILE 54 HA ILE 54 -0.654 6.766 14.295 119 HB ILE 54 HB ILE 54 1.162 8.399 13.825 120 HG12 ILE 54 HG12 ILE 54 0.720 7.548 10.962 121 HG13 ILE 54 HG11 ILE 54 0.437 9.141 11.634 122 HG21 ILE 54 HG21 ILE 54 1.560 5.671 12.614 123 HG22 ILE 54 HG22 ILE 54 1.767 6.118 14.312 124 HG23 ILE 54 HG23 ILE 54 2.854 6.771 13.085 125 HD11 ILE 54 HD11 ILE 54 3.082 7.778 11.330 126 HD12 ILE 54 HD12 ILE 54 2.828 9.390 12.022 127 HD13 ILE 54 HD13 ILE 54 2.447 9.081 10.322 128 H LYS 55 HN LYS 55 -1.775 8.391 11.374 129 HA LYS 55 HA LYS 55 -2.472 10.817 12.681 130 HB2 LYS 55 HB2 LYS 55 -3.056 9.641 10.032 131 HB3 LYS 55 HB1 LYS 55 -4.247 10.785 10.628 132 HG2 LYS 55 HG2 LYS 55 -2.630 11.914 9.228 133 HG3 LYS 55 HG1 LYS 55 -2.488 12.479 10.886 134 HD2 LYS 55 HD2 LYS 55 -0.585 10.888 11.170 135 HD3 LYS 55 HD1 LYS 55 -0.679 10.552 9.438 136 HE2 LYS 55 HE2 LYS 55 -0.129 13.218 10.738 137 HE3 LYS 55 HE1 LYS 55 1.035 12.198 9.907 138 HZ1 LYS 55 HZ1 LYS 55 0.266 14.032 8.546 139 HZ2 LYS 55 HZ2 LYS 55 -1.324 13.483 8.630 140 HZ3 LYS 55 HZ3 LYS 55 -0.145 12.555 7.844 141 H ALA 56 HN ALA 56 -4.023 7.787 12.294 142 HA ALA 56 HA ALA 56 -6.632 8.422 13.142 143 HB1 ALA 56 HB1 ALA 56 -5.995 6.307 12.068 144 HB2 ALA 56 HB2 ALA 56 -6.804 6.023 13.618 145 HB3 ALA 56 HB3 ALA 56 -5.048 5.890 13.497 146 H ILE 57 HN ILE 57 -3.756 7.359 14.861 147 HA ILE 57 HA ILE 57 -4.892 7.225 17.442 148 HB ILE 57 HB ILE 57 -1.979 7.718 16.732 149 HG12 ILE 57 HG12 ILE 57 -3.417 5.126 17.254 150 HG13 ILE 57 HG11 ILE 57 -3.036 5.721 15.654 151 HG21 ILE 57 HG21 ILE 57 -3.287 6.572 19.219 152 HG22 ILE 57 HG22 ILE 57 -2.515 8.152 19.099 153 HG23 ILE 57 HG23 ILE 57 -1.550 6.685 18.940 154 HD11 ILE 57 HD11 ILE 57 -1.469 4.013 16.469 155 HD12 ILE 57 HD12 ILE 57 -0.914 5.140 17.733 156 HD13 ILE 57 HD13 ILE 57 -0.716 5.527 16.031 157 H ALA 58 HN ALA 58 -3.268 9.802 15.673 158 HA ALA 58 HA ALA 58 -3.035 11.652 17.765 159 HB1 ALA 58 HB1 ALA 58 -2.807 13.355 16.030 160 HB2 ALA 58 HB2 ALA 58 -3.442 12.230 14.830 161 HB3 ALA 58 HB3 ALA 58 -1.893 11.907 15.608 162 H ALA 59 HN ALA 59 -5.784 10.711 15.901 163 HA ALA 59 HA ALA 59 -7.371 13.021 16.629 164 HB1 ALA 59 HB1 ALA 59 -9.183 11.879 15.439 165 HB2 ALA 59 HB2 ALA 59 -8.175 10.442 15.268 166 HB3 ALA 59 HB3 ALA 59 -7.727 11.937 14.451 167 H ALA 60 HN ALA 60 -6.871 9.728 17.621 168 HA ALA 60 HA ALA 60 -9.103 9.742 19.422 169 HB1 ALA 60 HB1 ALA 60 -6.884 7.727 19.140 170 HB2 ALA 60 HB2 ALA 60 -8.417 7.688 18.271 171 HB3 ALA 60 HB3 ALA 60 -8.391 7.497 20.024 172 H LEU 61 HN LEU 61 -5.692 10.350 19.604 173 HA LEU 61 HA LEU 61 -5.375 10.419 22.432 174 HB2 LEU 61 HB2 LEU 61 -3.668 10.458 20.422 175 HB3 LEU 61 HB1 LEU 61 -3.963 12.175 20.429 176 HG LEU 61 HG LEU 61 -1.857 11.382 21.558 177 HD11 LEU 61 HD11 LEU 61 -2.024 12.909 23.445 178 HD12 LEU 61 HD12 LEU 61 -3.775 12.966 23.233 179 HD13 LEU 61 HD13 LEU 61 -2.709 13.594 21.973 180 HD21 LEU 61 HD21 LEU 61 -2.797 9.423 22.689 181 HD22 LEU 61 HD22 LEU 61 -3.752 10.509 23.717 182 HD23 LEU 61 HD23 LEU 61 -1.997 10.528 23.810 183 H ASP 62 HN ASP 62 -6.663 12.644 20.083 184 HA ASP 62 HA ASP 62 -7.018 14.782 21.925 185 HB2 ASP 62 HB2 ASP 62 -6.967 15.300 19.559 186 HB3 ASP 62 HB1 ASP 62 -8.338 14.234 19.259 187 H MET 63 HN MET 63 -8.762 11.909 21.175 188 HA MET 63 HA MET 63 -11.154 12.819 22.464 189 HB2 MET 63 HB2 MET 63 -10.411 10.029 21.555 190 HB3 MET 63 HB1 MET 63 -11.957 10.448 22.280 191 HG2 MET 63 HG2 MET 63 -12.251 12.113 20.403 192 HG3 MET 63 HG1 MET 63 -10.841 11.381 19.644 193 HE1 MET 63 HE1 MET 63 -11.255 8.281 20.429 194 HE2 MET 63 HE2 MET 63 -10.818 8.769 18.789 195 HE3 MET 63 HE3 MET 63 -12.179 7.684 19.054 196 H TYR 64 HN TYR 64 -8.252 11.162 23.426 197 HA TYR 64 HA TYR 64 -9.150 10.553 26.112 198 HB2 TYR 64 HB2 TYR 64 -7.006 9.626 25.108 199 HB3 TYR 64 HB1 TYR 64 -6.310 11.241 25.278 200 HD1 TYR 64 HD1 TYR 64 -6.146 12.260 27.678 201 HD2 TYR 64 HD2 TYR 64 -7.131 8.171 26.987 202 HE1 TYR 64 HE1 TYR 64 -5.631 11.763 29.922 203 HE2 TYR 64 HE2 TYR 64 -6.612 7.674 29.234 204 HH TYR 64 HH TYR 64 -6.310 10.177 31.489 205 H LYS 65 HN LYS 65 -7.538 13.235 24.475 206 HA LYS 65 HA LYS 65 -7.201 14.999 26.522 207 HB2 LYS 65 HB2 LYS 65 -6.296 15.529 24.428 208 HB3 LYS 65 HB1 LYS 65 -7.848 15.340 23.635 209 HG2 LYS 65 HG2 LYS 65 -8.624 17.417 24.503 210 HG3 LYS 65 HG1 LYS 65 -7.183 17.589 25.512 211 HD2 LYS 65 HD2 LYS 65 -5.794 17.983 23.683 212 HD3 LYS 65 HD1 LYS 65 -6.925 17.249 22.556 213 HE2 LYS 65 HE2 LYS 65 -7.484 19.805 24.028 214 HE3 LYS 65 HE1 LYS 65 -6.745 19.742 22.425 215 HZ1 LYS 65 HZ1 LYS 65 -9.453 18.734 23.160 216 HZ2 LYS 65 HZ2 LYS 65 -8.706 18.465 21.691 217 HZ3 LYS 65 HZ3 LYS 65 -9.093 20.041 22.151 218 H LEU 66 HN LEU 66 -10.098 14.320 24.645 219 HA LEU 66 HA LEU 66 -11.805 16.210 25.914 220 HB2 LEU 66 HB2 LEU 66 -12.320 15.293 23.731 221 HB3 LEU 66 HB1 LEU 66 -12.361 13.672 24.382 222 HG LEU 66 HG LEU 66 -14.385 14.291 25.686 223 HD11 LEU 66 HD11 LEU 66 -14.244 16.842 24.103 224 HD12 LEU 66 HD12 LEU 66 -14.030 16.680 25.847 225 HD13 LEU 66 HD13 LEU 66 -15.595 16.326 25.113 226 HD21 LEU 66 HD21 LEU 66 -14.588 13.159 23.541 227 HD22 LEU 66 HD22 LEU 66 -14.573 14.711 22.707 228 HD23 LEU 66 HD23 LEU 66 -15.914 14.298 23.775 229 H ASP 67 HN ASP 67 -10.925 12.880 26.556 230 HA ASP 67 HA ASP 67 -13.016 12.227 28.401 231 HB2 ASP 67 HB2 ASP 67 -11.845 10.527 27.098 232 HB3 ASP 67 HB1 ASP 67 -10.328 10.989 27.825 233 H ASN 68 HN ASN 68 -9.910 13.757 28.749 234 HA ASN 68 HA ASN 68 -10.320 14.060 31.731 235 HB2 ASN 68 HB2 ASN 68 -7.633 13.813 30.398 236 HB3 ASN 68 HB1 ASN 68 -8.030 14.130 32.076 237 HD21 ASN 68 HD21 ASN 68 -9.494 11.617 30.107 238 HD22 ASN 68 HD22 ASN 68 -8.903 10.275 30.958 239 H PHE 69 HN PHE 69 -10.936 15.579 29.328 240 HA PHE 69 HA PHE 69 -10.765 17.727 28.525 241 HB2 PHE 69 HB2 PHE 69 -11.088 19.403 30.445 242 HB3 PHE 69 HB1 PHE 69 -12.289 18.132 30.271 243 HD1 PHE 69 HD1 PHE 69 -9.371 19.156 32.160 244 HD2 PHE 69 HD2 PHE 69 -12.644 16.631 31.980 245 HE1 PHE 69 HE1 PHE 69 -9.026 18.650 34.539 246 HE2 PHE 69 HE2 PHE 69 -12.399 16.025 34.318 247 HZ PHE 69 HZ PHE 69 -10.558 17.039 35.660 248 H ALA 70 HN ALA 70 -8.275 16.550 28.659 249 HA ALA 70 HA ALA 70 -6.338 18.538 28.433 250 HB1 ALA 70 HB1 ALA 70 -5.092 18.080 30.548 251 HB2 ALA 70 HB2 ALA 70 -6.493 17.119 31.081 252 HB3 ALA 70 HB3 ALA 70 -6.671 18.842 30.842 253 H TYR 71 HN TYR 71 -4.261 17.519 28.098 254 HA TYR 71 HA TYR 71 -4.458 14.882 27.094 255 HB2 TYR 71 HB2 TYR 71 -2.207 16.833 27.386 256 HB3 TYR 71 HB1 TYR 71 -1.896 15.182 26.879 257 HD1 TYR 71 HD1 TYR 71 -4.171 14.618 25.091 258 HD2 TYR 71 HD2 TYR 71 -1.838 18.151 25.565 259 HE1 TYR 71 HE1 TYR 71 -4.648 15.170 22.862 260 HE2 TYR 71 HE2 TYR 71 -2.296 18.761 23.237 261 HH TYR 71 HH TYR 71 -4.652 17.249 21.318 262 HA PRO 72 HA PRO 72 -2.930 12.423 30.513 263 HB2 PRO 72 HB2 PRO 72 -1.495 10.560 29.042 264 HB3 PRO 72 HB1 PRO 72 -3.264 10.562 29.118 265 HG2 PRO 72 HG2 PRO 72 -1.405 11.599 27.035 266 HG3 PRO 72 HG1 PRO 72 -2.907 10.681 26.847 267 HD2 PRO 72 HD2 PRO 72 -2.768 13.338 26.493 268 HD3 PRO 72 HD1 PRO 72 -4.217 12.527 27.106 269 H SER 73 HN SER 73 -0.707 11.945 31.659 270 HA SER 73 HA SER 73 1.235 13.877 30.698 271 HB2 SER 73 HB2 SER 73 2.327 13.437 32.904 272 HB3 SER 73 HB1 SER 73 0.651 13.931 33.078 273 HG SER 73 HG SER 73 0.510 12.263 34.222 274 H THR 74 HN THR 74 3.569 13.082 30.439 275 HA THR 74 HA THR 74 3.422 10.694 28.926 276 HB THR 74 HB THR 74 5.062 12.622 28.500 277 HG1 THR 74 HG1 THR 74 6.533 10.244 28.475 278 HG21 THR 74 HG21 THR 74 6.635 11.131 30.616 279 HG22 THR 74 HG22 THR 74 6.050 12.787 30.731 280 HG23 THR 74 HG23 THR 74 7.298 12.374 29.553 281 H GLN 75 HN GLN 75 3.908 11.193 32.227 282 HA GLN 75 HA GLN 75 4.949 8.494 32.556 283 HB2 GLN 75 HB2 GLN 75 4.460 10.764 34.425 284 HB3 GLN 75 HB1 GLN 75 4.834 9.146 35.007 285 HG2 GLN 75 HG2 GLN 75 6.563 10.760 33.154 286 HG3 GLN 75 HG1 GLN 75 6.797 10.620 34.897 287 HE21 GLN 75 HE21 GLN 75 7.239 8.616 35.744 288 HE22 GLN 75 HE22 GLN 75 8.059 7.392 34.846 289 H GLN 76 HN GLN 76 2.243 10.364 34.040 290 HA GLN 76 HA GLN 76 0.977 7.836 34.775 291 HB2 GLN 76 HB2 GLN 76 0.172 10.683 35.303 292 HB3 GLN 76 HB1 GLN 76 -0.689 9.263 35.873 293 HG2 GLN 76 HG2 GLN 76 2.143 9.989 36.606 294 HG3 GLN 76 HG1 GLN 76 0.721 10.295 37.596 295 HE21 GLN 76 HE21 GLN 76 1.492 9.068 39.255 296 HE22 GLN 76 HE22 GLN 76 1.587 7.346 39.219 297 H GLY 77 HN GLY 77 0.525 10.351 32.476 298 HA2 GLY 77 HA2 GLY 77 -2.015 9.341 31.732 299 HA3 GLY 77 HA1 GLY 77 -1.023 10.447 30.807 300 H LEU 78 HN LEU 78 1.275 8.461 30.933 301 HA LEU 78 HA LEU 78 0.703 7.039 28.524 302 HB2 LEU 78 HB2 LEU 78 3.005 7.735 29.467 303 HB3 LEU 78 HB1 LEU 78 2.874 6.348 30.516 304 HG LEU 78 HG LEU 78 2.952 6.200 27.499 305 HD11 LEU 78 HD11 LEU 78 5.131 5.746 29.521 306 HD12 LEU 78 HD12 LEU 78 5.019 7.076 28.365 307 HD13 LEU 78 HD13 LEU 78 5.252 5.424 27.788 308 HD21 LEU 78 HD21 LEU 78 3.234 4.041 29.600 309 HD22 LEU 78 HD22 LEU 78 3.471 3.810 27.868 310 HD23 LEU 78 HD23 LEU 78 1.878 4.242 28.491 311 H GLU 79 HN GLU 79 0.998 6.152 31.898 312 HA GLU 79 HA GLU 79 0.057 3.510 31.537 313 HB2 GLU 79 HB2 GLU 79 0.435 5.252 33.935 314 HB3 GLU 79 HB1 GLU 79 -0.271 3.643 34.060 315 HG2 GLU 79 HG2 GLU 79 1.701 2.653 33.141 316 HG3 GLU 79 HG1 GLU 79 2.407 4.241 32.846 317 H ALA 80 HN ALA 80 -1.466 6.498 31.623 318 HA ALA 80 HA ALA 80 -4.056 5.421 32.338 319 HB1 ALA 80 HB1 ALA 80 -4.829 7.701 32.127 320 HB2 ALA 80 HB2 ALA 80 -3.364 8.112 31.282 321 HB3 ALA 80 HB3 ALA 80 -3.270 7.716 33.005 322 H LEU 81 HN LEU 81 -2.133 5.675 29.624 323 HA LEU 81 HA LEU 81 -4.367 5.546 27.772 324 HB2 LEU 81 HB2 LEU 81 -1.382 5.414 27.376 325 HB3 LEU 81 HB1 LEU 81 -2.543 5.213 26.084 326 HG LEU 81 HG LEU 81 -2.232 7.725 27.742 327 HD11 LEU 81 HD11 LEU 81 -1.200 8.686 25.743 328 HD12 LEU 81 HD12 LEU 81 -1.283 7.117 24.943 329 HD13 LEU 81 HD13 LEU 81 -0.256 7.329 26.356 330 HD21 LEU 81 HD21 LEU 81 -3.825 7.153 25.240 331 HD22 LEU 81 HD22 LEU 81 -3.635 8.736 25.991 332 HD23 LEU 81 HD23 LEU 81 -4.487 7.454 26.848 333 H VAL 82 HN VAL 82 -2.228 3.523 29.485 334 HA VAL 82 HA VAL 82 -3.105 1.184 27.940 335 HB VAL 82 HB VAL 82 -0.932 1.330 30.055 336 HG11 VAL 82 HG11 VAL 82 -1.615 -0.897 28.127 337 HG12 VAL 82 HG12 VAL 82 -1.875 -0.921 29.871 338 HG13 VAL 82 HG13 VAL 82 -0.234 -0.877 29.226 339 HG21 VAL 82 HG21 VAL 82 -0.340 2.631 28.084 340 HG22 VAL 82 HG22 VAL 82 -0.727 1.272 27.041 341 HG23 VAL 82 HG23 VAL 82 0.640 1.164 28.150 342 H LYS 83 HN LYS 83 -3.312 2.553 31.177 343 HA LYS 83 HA LYS 83 -5.137 0.403 31.999 344 HB2 LYS 83 HB2 LYS 83 -2.816 0.501 33.149 345 HB3 LYS 83 HB1 LYS 83 -3.308 2.050 33.786 346 HG2 LYS 83 HG2 LYS 83 -3.780 0.685 35.559 347 HG3 LYS 83 HG1 LYS 83 -5.333 0.688 34.732 348 HD2 LYS 83 HD2 LYS 83 -3.205 -1.469 34.557 349 HD3 LYS 83 HD1 LYS 83 -4.718 -1.578 35.444 350 HE2 LYS 83 HE2 LYS 83 -5.930 -1.386 33.267 351 HE3 LYS 83 HE1 LYS 83 -4.363 -1.366 32.464 352 HZ1 LYS 83 HZ1 LYS 83 -5.356 -3.540 32.432 353 HZ2 LYS 83 HZ2 LYS 83 -5.393 -3.587 34.118 354 HZ3 LYS 83 HZ3 LYS 83 -3.916 -3.573 33.311 355 H LYS 84 HN LYS 84 -6.973 1.291 33.354 356 HA LYS 84 HA LYS 84 -8.063 3.622 32.200 357 HB2 LYS 84 HB2 LYS 84 -8.789 2.266 34.813 358 HB3 LYS 84 HB1 LYS 84 -9.737 3.545 34.066 359 HG2 LYS 84 HG2 LYS 84 -10.028 2.127 32.098 360 HG3 LYS 84 HG1 LYS 84 -9.172 0.829 32.932 361 HD2 LYS 84 HD2 LYS 84 -10.846 0.902 34.718 362 HD3 LYS 84 HD1 LYS 84 -11.708 2.170 33.843 363 HE2 LYS 84 HE2 LYS 84 -11.944 0.643 31.942 364 HE3 LYS 84 HE1 LYS 84 -11.176 -0.624 32.906 365 HZ1 LYS 84 HZ1 LYS 84 -13.706 0.770 33.551 366 HZ2 LYS 84 HZ2 LYS 84 -12.986 -0.404 34.514 367 HZ3 LYS 84 HZ3 LYS 84 -13.576 -0.811 32.981 368 HA PRO 85 HA PRO 85 -5.940 6.926 33.448 369 HB2 PRO 85 HB2 PRO 85 -7.893 8.844 33.608 370 HB3 PRO 85 HB1 PRO 85 -7.143 8.256 32.127 371 HG2 PRO 85 HG2 PRO 85 -9.741 7.454 33.362 372 HG3 PRO 85 HG1 PRO 85 -9.335 7.712 31.657 373 HD2 PRO 85 HD2 PRO 85 -9.535 5.272 32.705 374 HD3 PRO 85 HD1 PRO 85 -8.333 5.658 31.458 375 H THR 86 HN THR 86 -5.043 7.816 35.009 376 HA THR 86 HA THR 86 -6.109 7.809 37.674 377 HB THR 86 HB THR 86 -3.738 8.822 37.985 378 HG1 THR 86 HG1 THR 86 -2.712 7.661 35.816 379 HG21 THR 86 HG21 THR 86 -2.676 6.593 37.839 380 HG22 THR 86 HG22 THR 86 -4.054 6.006 36.907 381 HG23 THR 86 HG23 THR 86 -4.269 6.503 38.585 382 H GLY 87 HN GLY 87 -5.319 10.131 38.787 383 HA2 GLY 87 HA2 GLY 87 -5.575 12.400 38.835 384 HA3 GLY 87 HA1 GLY 87 -5.635 12.388 37.074 385 H ASN 88 HN ASN 88 -7.460 13.380 36.477 386 HA ASN 88 HA ASN 88 -9.924 12.355 37.597 387 HB2 ASN 88 HB2 ASN 88 -9.218 15.281 37.548 388 HB3 ASN 88 HB1 ASN 88 -10.889 14.731 37.558 389 HD21 ASN 88 HD21 ASN 88 -7.951 14.991 39.360 390 HD22 ASN 88 HD22 ASN 88 -8.619 14.609 40.899 391 HA PRO 89 HA PRO 89 -10.759 12.693 33.221 392 HB2 PRO 89 HB2 PRO 89 -11.455 10.137 32.796 393 HB3 PRO 89 HB1 PRO 89 -9.767 10.598 32.860 394 HG2 PRO 89 HG2 PRO 89 -11.394 9.169 34.903 395 HG3 PRO 89 HG1 PRO 89 -9.661 9.067 34.592 396 HD2 PRO 89 HD2 PRO 89 -10.954 10.570 36.618 397 HD3 PRO 89 HD1 PRO 89 -9.231 10.601 36.198 398 H GLN 90 HN GLN 90 -12.912 12.379 32.205 399 HA GLN 90 HA GLN 90 -15.048 12.522 34.225 400 HB2 GLN 90 HB2 GLN 90 -15.023 13.392 31.320 401 HB3 GLN 90 HB1 GLN 90 -16.398 13.550 32.403 402 HG2 GLN 90 HG2 GLN 90 -15.090 15.038 33.835 403 HG3 GLN 90 HG1 GLN 90 -13.728 14.888 32.729 404 HE21 GLN 90 HE21 GLN 90 -15.208 17.228 33.542 405 HE22 GLN 90 HE22 GLN 90 -15.813 17.950 32.094 406 HA PRO 91 HA PRO 91 -16.737 8.593 32.900 407 HB2 PRO 91 HB2 PRO 91 -19.405 9.866 32.583 408 HB3 PRO 91 HB1 PRO 91 -18.940 8.495 33.594 409 HG2 PRO 91 HG2 PRO 91 -19.458 10.866 34.684 410 HG3 PRO 91 HG1 PRO 91 -18.141 9.849 35.297 411 HD2 PRO 91 HD2 PRO 91 -18.003 12.265 33.534 412 HD3 PRO 91 HD1 PRO 91 -16.946 11.789 34.881 413 H LYS 92 HN LYS 92 -15.838 8.324 30.918 414 HA LYS 92 HA LYS 92 -17.429 8.827 28.599 415 HB2 LYS 92 HB2 LYS 92 -16.099 10.919 28.926 416 HB3 LYS 92 HB1 LYS 92 -14.634 9.979 28.999 417 HG2 LYS 92 HG2 LYS 92 -16.369 10.115 26.539 418 HG3 LYS 92 HG1 LYS 92 -15.070 11.258 26.872 419 HD2 LYS 92 HD2 LYS 92 -13.473 9.397 26.946 420 HD3 LYS 92 HD1 LYS 92 -14.782 8.274 26.622 421 HE2 LYS 92 HE2 LYS 92 -15.201 9.391 24.500 422 HE3 LYS 92 HE1 LYS 92 -13.834 10.468 24.809 423 HZ1 LYS 92 HZ1 LYS 92 -13.684 7.516 24.611 424 HZ2 LYS 92 HZ2 LYS 92 -12.393 8.508 24.883 425 HZ3 LYS 92 HZ3 LYS 92 -13.247 8.582 23.391 426 H ASN 93 HN ASN 93 -16.851 7.336 26.961 427 HA ASN 93 HA ASN 93 -15.757 4.878 27.826 428 HB2 ASN 93 HB2 ASN 93 -16.486 5.854 25.070 429 HB3 ASN 93 HB1 ASN 93 -15.767 4.273 25.317 430 HD21 ASN 93 HD21 ASN 93 -18.572 6.245 25.800 431 HD22 ASN 93 HD22 ASN 93 -19.665 4.980 26.190 432 H TRP 94 HN TRP 94 -13.712 5.260 28.631 433 HA TRP 94 HA TRP 94 -11.452 6.164 27.261 434 HB2 TRP 94 HB2 TRP 94 -11.586 6.018 29.669 435 HB3 TRP 94 HB1 TRP 94 -11.850 4.282 29.585 436 HD1 TRP 94 HD1 TRP 94 -9.119 6.904 29.085 437 HE1 TRP 94 HE1 TRP 94 -6.823 5.711 29.287 438 HE3 TRP 94 HE3 TRP 94 -10.700 2.074 29.432 439 HZ2 TRP 94 HZ2 TRP 94 -5.851 3.143 29.550 440 HZ3 TRP 94 HZ3 TRP 94 -9.000 0.301 29.675 441 HH2 TRP 94 HH2 TRP 94 -6.639 0.836 29.731 442 H ASN 95 HN ASN 95 -9.851 5.103 26.221 443 HA ASN 95 HA ASN 95 -10.396 2.371 25.407 444 HB2 ASN 95 HB2 ASN 95 -10.834 3.882 23.504 445 HB3 ASN 95 HB1 ASN 95 -9.251 4.612 23.774 446 HD21 ASN 95 HD21 ASN 95 -9.749 1.089 23.850 447 HD22 ASN 95 HD22 ASN 95 -8.753 0.841 22.473 448 H LYS 96 HN LYS 96 -8.592 1.002 25.844 449 HA LYS 96 HA LYS 96 -6.153 2.266 26.754 450 HB2 LYS 96 HB2 LYS 96 -5.284 0.130 27.208 451 HB3 LYS 96 HB1 LYS 96 -6.962 0.066 27.776 452 HG2 LYS 96 HG2 LYS 96 -7.497 -1.177 25.655 453 HG3 LYS 96 HG1 LYS 96 -5.766 -1.068 25.276 454 HD2 LYS 96 HD2 LYS 96 -5.240 -2.287 27.334 455 HD3 LYS 96 HD1 LYS 96 -6.961 -2.459 27.668 456 HE2 LYS 96 HE2 LYS 96 -7.249 -3.745 25.623 457 HE3 LYS 96 HE1 LYS 96 -5.544 -3.531 25.231 458 HZ1 LYS 96 HZ1 LYS 96 -6.640 -5.031 27.555 459 HZ2 LYS 96 HZ2 LYS 96 -5.011 -4.752 27.298 460 HZ3 LYS 96 HZ3 LYS 96 -5.870 -5.693 26.212 461 H ASP 97 HN ASP 97 -4.179 0.840 25.843 462 HA ASP 97 HA ASP 97 -2.780 0.352 24.185 463 HB2 ASP 97 HB2 ASP 97 -4.667 -1.211 23.486 464 HB3 ASP 97 HB1 ASP 97 -5.213 0.049 22.392 465 H GLY 98 HN GLY 98 -3.888 2.972 24.783 466 HA2 GLY 98 HA2 GLY 98 -2.506 4.862 24.286 467 HA3 GLY 98 HA1 GLY 98 -2.228 4.165 22.721 468 H TYR 99 HN TYR 99 -5.476 3.989 23.510 469 HA TYR 99 HA TYR 99 -7.252 4.878 22.526 470 HB2 TYR 99 HB2 TYR 99 -5.788 7.180 23.521 471 HB3 TYR 99 HB1 TYR 99 -6.620 7.625 22.021 472 HD1 TYR 99 HD1 TYR 99 -6.915 6.523 25.505 473 HD2 TYR 99 HD2 TYR 99 -9.020 7.758 22.028 474 HE1 TYR 99 HE1 TYR 99 -8.904 6.894 26.837 475 HE2 TYR 99 HE2 TYR 99 -11.019 8.119 23.377 476 HH TYR 99 HH TYR 99 -10.842 7.883 26.836 477 H LEU 100 HN LEU 100 -6.953 3.620 20.831 478 HA LEU 100 HA LEU 100 -5.623 4.756 18.452 479 HB2 LEU 100 HB2 LEU 100 -4.646 2.723 19.942 480 HB3 LEU 100 HB1 LEU 100 -5.780 1.819 18.980 481 HG LEU 100 HG LEU 100 -3.391 3.358 17.945 482 HD11 LEU 100 HD11 LEU 100 -2.485 1.178 17.406 483 HD12 LEU 100 HD12 LEU 100 -3.865 0.424 18.205 484 HD13 LEU 100 HD13 LEU 100 -2.738 1.409 19.136 485 HD21 LEU 100 HD21 LEU 100 -5.329 1.602 16.425 486 HD22 LEU 100 HD22 LEU 100 -3.838 2.288 15.780 487 HD23 LEU 100 HD23 LEU 100 -5.164 3.350 16.253 488 H LYS 101 HN LYS 101 -6.748 4.179 16.520 489 HA LYS 101 HA LYS 101 -9.547 3.550 16.807 490 HB2 LYS 101 HB2 LYS 101 -7.791 3.871 14.370 491 HB3 LYS 101 HB1 LYS 101 -9.530 3.650 14.290 492 HG2 LYS 101 HG2 LYS 101 -8.148 5.968 15.653 493 HG3 LYS 101 HG1 LYS 101 -8.823 6.008 14.024 494 HD2 LYS 101 HD2 LYS 101 -10.452 5.318 16.448 495 HD3 LYS 101 HD1 LYS 101 -10.286 6.980 15.855 496 HE2 LYS 101 HE2 LYS 101 -11.201 6.206 13.676 497 HE3 LYS 101 HE1 LYS 101 -11.416 4.603 14.368 498 HZ1 LYS 101 HZ1 LYS 101 -12.943 5.572 15.997 499 HZ2 LYS 101 HZ2 LYS 101 -13.456 5.817 14.413 500 HZ3 LYS 101 HZ3 LYS 101 -12.756 7.089 15.267 501 H LYS 102 HN LYS 102 -10.285 1.768 14.994 502 HA LYS 102 HA LYS 102 -9.014 -0.569 16.052 503 HB2 LYS 102 HB2 LYS 102 -11.568 -0.306 14.523 504 HB3 LYS 102 HB1 LYS 102 -10.799 -1.872 14.687 505 HG2 LYS 102 HG2 LYS 102 -12.429 -1.719 16.405 506 HG3 LYS 102 HG1 LYS 102 -10.856 -1.562 17.171 507 HD2 LYS 102 HD2 LYS 102 -12.292 0.040 18.192 508 HD3 LYS 102 HD1 LYS 102 -11.221 0.939 17.119 509 HE2 LYS 102 HE2 LYS 102 -13.513 1.740 16.919 510 HE3 LYS 102 HE1 LYS 102 -12.981 0.998 15.413 511 HZ1 LYS 102 HZ1 LYS 102 -15.232 0.343 16.029 512 HZ2 LYS 102 HZ2 LYS 102 -14.676 -0.345 17.462 513 HZ3 LYS 102 HZ3 LYS 102 -14.210 -0.985 15.970 514 H LEU 103 HN LEU 103 -7.120 0.045 15.050 515 HA LEU 103 HA LEU 103 -6.688 -1.543 12.649 516 HB2 LEU 103 HB2 LEU 103 -5.349 1.014 13.576 517 HB3 LEU 103 HB1 LEU 103 -4.625 -0.037 12.375 518 HG LEU 103 HG LEU 103 -5.527 1.739 11.236 519 HD11 LEU 103 HD11 LEU 103 -7.552 -0.461 10.991 520 HD12 LEU 103 HD12 LEU 103 -6.013 -0.333 10.141 521 HD13 LEU 103 HD13 LEU 103 -7.298 0.834 9.821 522 HD21 LEU 103 HD21 LEU 103 -8.096 1.449 12.782 523 HD22 LEU 103 HD22 LEU 103 -7.848 2.560 11.431 524 HD23 LEU 103 HD23 LEU 103 -6.909 2.749 12.911 525 HA PRO 104 HA PRO 104 -4.262 -3.860 15.535 526 HB2 PRO 104 HB2 PRO 104 -2.338 -4.902 13.935 527 HB3 PRO 104 HB1 PRO 104 -4.019 -5.455 13.878 528 HG2 PRO 104 HG2 PRO 104 -2.613 -3.488 12.107 529 HG3 PRO 104 HG1 PRO 104 -3.672 -4.839 11.655 530 HD2 PRO 104 HD2 PRO 104 -4.579 -2.312 11.745 531 HD3 PRO 104 HD1 PRO 104 -5.594 -3.687 12.227 532 H VAL 105 HN VAL 105 -1.663 -4.310 15.792 533 HA VAL 105 HA VAL 105 -0.589 -1.727 16.379 534 HB VAL 105 HB VAL 105 -0.360 -3.928 17.730 535 HG11 VAL 105 HG11 VAL 105 1.902 -4.407 15.819 536 HG12 VAL 105 HG12 VAL 105 0.477 -5.412 16.067 537 HG13 VAL 105 HG13 VAL 105 1.671 -5.232 17.354 538 HG21 VAL 105 HG21 VAL 105 2.059 -2.178 17.350 539 HG22 VAL 105 HG22 VAL 105 1.707 -3.228 18.739 540 HG23 VAL 105 HG23 VAL 105 0.679 -1.847 18.394 541 H ASP 106 HN ASP 106 2.051 -1.610 15.598 542 HA ASP 106 HA ASP 106 1.501 -1.321 12.815 543 HB2 ASP 106 HB2 ASP 106 3.649 -0.064 12.723 544 HB3 ASP 106 HB1 ASP 106 2.516 0.562 13.912 545 HA PRO 107 HA PRO 107 3.756 -4.588 10.884 546 HB2 PRO 107 HB2 PRO 107 5.426 -3.049 9.334 547 HB3 PRO 107 HB1 PRO 107 3.837 -3.636 8.837 548 HG2 PRO 107 HG2 PRO 107 4.603 -0.942 9.913 549 HG3 PRO 107 HG1 PRO 107 3.377 -1.340 8.696 550 HD2 PRO 107 HD2 PRO 107 2.650 -0.706 11.124 551 HD3 PRO 107 HD1 PRO 107 1.855 -2.045 10.271 552 H TRP 108 HN TRP 108 5.995 -5.229 10.429 553 HA TRP 108 HA TRP 108 8.034 -5.777 11.033 554 HB2 TRP 108 HB2 TRP 108 8.370 -3.113 12.428 555 HB3 TRP 108 HB1 TRP 108 9.639 -4.146 11.790 556 HD1 TRP 108 HD1 TRP 108 9.455 -4.417 8.975 557 HE1 TRP 108 HE1 TRP 108 9.095 -2.480 7.271 558 HE3 TRP 108 HE3 TRP 108 7.350 -1.040 12.101 559 HZ2 TRP 108 HZ2 TRP 108 8.014 0.130 7.297 560 HZ3 TRP 108 HZ3 TRP 108 6.664 1.173 11.215 561 HH2 TRP 108 HH2 TRP 108 6.986 1.736 8.867 562 H GLY 109 HN GLY 109 5.651 -5.685 12.818 563 HA2 GLY 109 HA2 GLY 109 4.913 -6.438 14.838 564 HA3 GLY 109 HA1 GLY 109 6.489 -7.196 15.008 565 H ASN 110 HN ASN 110 6.136 -3.587 14.833 566 HA ASN 110 HA ASN 110 7.220 -3.617 17.511 567 HB2 ASN 110 HB2 ASN 110 6.503 -1.110 16.010 568 HB3 ASN 110 HB1 ASN 110 7.687 -1.322 17.283 569 HD21 ASN 110 HD21 ASN 110 6.995 -1.327 14.068 570 HD22 ASN 110 HD22 ASN 110 8.566 -1.576 13.409 571 HA PRO 111 HA PRO 111 3.299 -2.182 19.032 572 HB2 PRO 111 HB2 PRO 111 4.105 -1.296 21.449 573 HB3 PRO 111 HB1 PRO 111 3.932 -3.023 21.120 574 HG2 PRO 111 HG2 PRO 111 6.396 -1.357 21.270 575 HG3 PRO 111 HG1 PRO 111 6.149 -3.040 21.758 576 HD2 PRO 111 HD2 PRO 111 7.339 -2.214 19.390 577 HD3 PRO 111 HD1 PRO 111 6.646 -3.821 19.678 578 H TYR 112 HN TYR 112 2.385 -0.141 18.923 579 HA TYR 112 HA TYR 112 3.972 2.024 18.018 580 HB2 TYR 112 HB2 TYR 112 1.141 1.915 19.111 581 HB3 TYR 112 HB1 TYR 112 1.884 3.433 18.642 582 HD1 TYR 112 HD1 TYR 112 0.379 0.299 17.441 583 HD2 TYR 112 HD2 TYR 112 2.202 3.961 16.287 584 HE1 TYR 112 HE1 TYR 112 -0.432 -0.014 15.130 585 HE2 TYR 112 HE2 TYR 112 1.407 3.647 13.986 586 HH TYR 112 HH TYR 112 -0.896 1.318 13.057 587 H GLN 113 HN GLN 113 4.692 3.759 19.166 588 HA GLN 113 HA GLN 113 5.040 3.193 22.042 589 HB2 GLN 113 HB2 GLN 113 6.542 5.486 20.932 590 HB3 GLN 113 HB1 GLN 113 7.119 4.211 21.979 591 HG2 GLN 113 HG2 GLN 113 6.921 4.171 18.965 592 HG3 GLN 113 HG1 GLN 113 8.376 4.418 19.897 593 HE21 GLN 113 HE21 GLN 113 7.681 2.181 21.767 594 HE22 GLN 113 HE22 GLN 113 7.962 0.774 20.802 595 H TYR 114 HN TYR 114 3.711 4.249 23.302 596 HA TYR 114 HA TYR 114 2.434 6.705 22.333 597 HB2 TYR 114 HB2 TYR 114 1.716 5.164 24.850 598 HB3 TYR 114 HB1 TYR 114 0.724 6.318 23.978 599 HD1 TYR 114 HD2 TYR 114 1.036 5.291 21.224 600 HD2 TYR 114 HD1 TYR 114 0.393 3.225 24.888 601 HE1 TYR 114 HE2 TYR 114 0.041 3.443 19.999 602 HE2 TYR 114 HE1 TYR 114 -0.629 1.350 23.659 603 HH TYR 114 HH TYR 114 -1.739 1.075 21.332 604 H LEU 115 HN LEU 115 3.371 8.521 23.006 605 HA LEU 115 HA LEU 115 4.315 8.625 25.743 606 HB2 LEU 115 HB2 LEU 115 5.524 9.828 23.280 607 HB3 LEU 115 HB1 LEU 115 5.993 10.333 24.901 608 HG LEU 115 HG LEU 115 6.415 7.600 23.655 609 HD11 LEU 115 HD11 LEU 115 8.780 8.189 23.702 610 HD12 LEU 115 HD12 LEU 115 8.378 9.782 24.345 611 HD13 LEU 115 HD13 LEU 115 7.861 9.333 22.721 612 HD21 LEU 115 HD21 LEU 115 7.273 8.674 26.347 613 HD22 LEU 115 HD22 LEU 115 7.750 7.121 25.663 614 HD23 LEU 115 HD23 LEU 115 6.063 7.419 26.070 615 H ALA 116 HN ALA 116 4.057 10.799 26.640 616 HA ALA 116 HA ALA 116 1.983 12.197 25.234 617 HB1 ALA 116 HB1 ALA 116 1.967 11.764 28.214 618 HB2 ALA 116 HB2 ALA 116 1.321 10.561 27.111 619 HB3 ALA 116 HB3 ALA 116 0.604 12.160 27.144 620 HA PRO 117 HA PRO 117 4.222 15.827 26.143 621 HB2 PRO 117 HB2 PRO 117 2.959 17.483 27.780 622 HB3 PRO 117 HB1 PRO 117 2.502 17.177 26.121 623 HG2 PRO 117 HG2 PRO 117 1.297 15.950 28.588 624 HG3 PRO 117 HG1 PRO 117 0.460 16.632 27.176 625 HD2 PRO 117 HD2 PRO 117 0.919 13.973 27.463 626 HD3 PRO 117 HD1 PRO 117 0.915 14.740 25.854 627 H GLY 118 HN GLY 118 5.963 16.153 27.143 628 HA2 GLY 118 HA2 GLY 118 6.136 16.379 29.985 629 HA3 GLY 118 HA1 GLY 118 6.894 14.909 29.369 630 H THR 119 HN THR 119 8.359 15.368 27.407 631 HA THR 119 HA THR 119 10.149 17.470 28.286 632 HB THR 119 HB THR 119 11.699 16.321 26.676 633 HG1 THR 119 HG1 THR 119 9.934 15.337 25.540 634 HG21 THR 119 HG21 THR 119 12.120 14.400 28.181 635 HG22 THR 119 HG22 THR 119 10.536 14.641 28.914 636 HG23 THR 119 HG23 THR 119 11.787 15.869 29.098 637 H LYS 120 HN LYS 120 9.315 19.316 27.410 638 HA LYS 120 HA LYS 120 8.553 20.835 25.974 639 HB2 LYS 120 HB2 LYS 120 9.949 21.226 23.901 640 HB3 LYS 120 HB1 LYS 120 10.775 21.288 25.438 641 HG2 LYS 120 HG2 LYS 120 10.828 18.742 23.902 642 HG3 LYS 120 HG1 LYS 120 11.815 20.078 23.318 643 HD2 LYS 120 HD2 LYS 120 12.782 20.230 25.639 644 HD3 LYS 120 HD1 LYS 120 11.916 18.743 26.018 645 HE2 LYS 120 HE2 LYS 120 13.134 17.538 24.338 646 HE3 LYS 120 HE1 LYS 120 13.907 19.015 23.770 647 HZ1 LYS 120 HZ1 LYS 120 15.381 17.749 25.166 648 HZ2 LYS 120 HZ2 LYS 120 14.266 17.741 26.421 649 HZ3 LYS 120 HZ3 LYS 120 14.994 19.198 25.962 650 H GLY 121 HN GLY 121 7.183 18.284 25.607 651 HA2 GLY 121 HA2 GLY 121 6.129 18.821 22.902 652 HA3 GLY 121 HA1 GLY 121 6.382 17.206 23.564 653 HA PRO 122 HA PRO 122 2.051 18.801 24.741 654 HB2 PRO 122 HB2 PRO 122 1.461 18.375 21.873 655 HB3 PRO 122 HB1 PRO 122 0.773 19.554 22.993 656 HG2 PRO 122 HG2 PRO 122 2.516 20.283 21.127 657 HG3 PRO 122 HG1 PRO 122 2.546 21.018 22.739 658 HD2 PRO 122 HD2 PRO 122 4.345 18.919 21.583 659 HD3 PRO 122 HD1 PRO 122 4.722 20.281 22.666 660 H PHE 123 HN PHE 123 3.466 16.513 22.364 661 HA PHE 123 HA PHE 123 3.074 14.274 23.878 662 HB2 PHE 123 HB2 PHE 123 1.270 12.978 22.813 663 HB3 PHE 123 HB1 PHE 123 0.613 14.444 23.504 664 HD1 PHE 123 HD2 PHE 123 -0.303 16.198 22.035 665 HD2 PHE 123 HD1 PHE 123 1.261 12.564 20.434 666 HE1 PHE 123 HE2 PHE 123 -1.421 16.649 19.900 667 HE2 PHE 123 HE1 PHE 123 0.127 13.013 18.307 668 HZ PHE 123 HZ PHE 123 -1.213 15.059 18.032 669 H ASP 124 HN ASP 124 3.495 12.184 22.642 670 HA ASP 124 HA ASP 124 4.711 12.662 20.025 671 HB2 ASP 124 HB2 ASP 124 6.172 11.251 22.288 672 HB3 ASP 124 HB1 ASP 124 6.665 11.232 20.603 673 H LEU 125 HN LEU 125 3.940 11.150 18.655 674 HA LEU 125 HA LEU 125 3.382 8.523 19.782 675 HB2 LEU 125 HB2 LEU 125 1.310 9.871 19.481 676 HB3 LEU 125 HB1 LEU 125 1.703 10.063 17.793 677 HG LEU 125 HG LEU 125 -0.094 8.442 18.331 678 HD11 LEU 125 HD11 LEU 125 2.286 7.353 16.842 679 HD12 LEU 125 HD12 LEU 125 0.957 8.304 16.168 680 HD13 LEU 125 HD13 LEU 125 0.664 6.675 16.778 681 HD21 LEU 125 HD21 LEU 125 0.822 7.448 20.329 682 HD22 LEU 125 HD22 LEU 125 2.177 6.790 19.410 683 HD23 LEU 125 HD23 LEU 125 0.546 6.196 19.116 684 H TYR 126 HN TYR 126 4.431 6.935 18.653 685 HA TYR 126 HA TYR 126 4.844 7.037 15.877 686 HB2 TYR 126 HB2 TYR 126 7.243 7.332 15.696 687 HB3 TYR 126 HB1 TYR 126 6.525 8.730 16.470 688 HD1 TYR 126 HD2 TYR 126 6.929 9.106 18.932 689 HD2 TYR 126 HD1 TYR 126 8.913 6.009 16.776 690 HE1 TYR 126 HE2 TYR 126 8.637 8.958 20.701 691 HE2 TYR 126 HE1 TYR 126 10.613 5.866 18.523 692 HH TYR 126 HH TYR 126 11.551 7.370 20.240 693 H SER 127 HN SER 127 6.203 5.252 15.132 694 HA SER 127 HA SER 127 6.653 3.181 17.149 695 HB2 SER 127 HB2 SER 127 5.724 2.831 14.306 696 HB3 SER 127 HB1 SER 127 6.171 1.523 15.401 697 HG SER 127 HG SER 127 4.246 1.579 15.960 698 H LEU 128 HN LEU 128 8.410 1.820 16.703 699 HA LEU 128 HA LEU 128 10.693 3.101 15.581 700 HB2 LEU 128 HB2 LEU 128 10.225 0.259 16.446 701 HB3 LEU 128 HB1 LEU 128 11.805 0.882 15.983 702 HG LEU 128 HG LEU 128 10.121 1.728 18.339 703 HD11 LEU 128 HD11 LEU 128 12.739 0.253 18.180 704 HD12 LEU 128 HD12 LEU 128 11.174 -0.434 18.625 705 HD13 LEU 128 HD13 LEU 128 11.932 0.776 19.658 706 HD21 LEU 128 HD21 LEU 128 11.325 3.641 17.462 707 HD22 LEU 128 HD22 LEU 128 12.824 2.711 17.433 708 HD23 LEU 128 HD23 LEU 128 12.055 3.102 18.971 709 H GLY 129 HN GLY 129 11.956 2.514 13.730 710 HA2 GLY 129 HA2 GLY 129 10.369 1.773 11.443 711 HA3 GLY 129 HA1 GLY 129 12.080 2.150 11.436 712 H ALA 130 HN ALA 130 11.622 0.307 9.833 713 HA ALA 130 HA ALA 130 11.144 -2.313 10.540 714 HB1 ALA 130 HB1 ALA 130 12.224 -2.930 8.492 715 HB2 ALA 130 HB2 ALA 130 12.987 -1.339 8.395 716 HB3 ALA 130 HB3 ALA 130 11.234 -1.490 8.271 717 H ASP 131 HN ASP 131 14.043 -0.535 11.105 718 HA ASP 131 HA ASP 131 15.528 -3.007 11.551 719 HB2 ASP 131 HB2 ASP 131 16.628 -1.165 10.341 720 HB3 ASP 131 HB1 ASP 131 16.465 -0.143 11.766 721 H GLY 132 HN GLY 132 13.538 -1.010 13.333 722 HA2 GLY 132 HA2 GLY 132 13.027 -1.210 15.612 723 HA3 GLY 132 HA1 GLY 132 14.526 -2.098 15.856 724 H LYS 133 HN LYS 133 15.130 0.505 14.029 725 HA LYS 133 HA LYS 133 16.271 2.032 16.235 726 HB2 LYS 133 HB2 LYS 133 17.791 1.341 14.447 727 HB3 LYS 133 HB1 LYS 133 16.731 2.036 13.243 728 HG2 LYS 133 HG2 LYS 133 18.621 3.486 13.530 729 HG3 LYS 133 HG1 LYS 133 17.192 4.282 14.176 730 HD2 LYS 133 HD2 LYS 133 19.057 4.652 15.659 731 HD3 LYS 133 HD1 LYS 133 17.893 3.594 16.452 732 HE2 LYS 133 HE2 LYS 133 19.262 1.658 15.937 733 HE3 LYS 133 HE1 LYS 133 20.382 2.663 15.018 734 HZ1 LYS 133 HZ1 LYS 133 19.854 2.878 17.932 735 HZ2 LYS 133 HZ2 LYS 133 20.914 3.845 17.053 736 HZ3 LYS 133 HZ3 LYS 133 21.227 2.208 17.229 737 H GLU 134 HN GLU 134 15.635 4.167 16.561 738 HA GLU 134 HA GLU 134 13.500 5.093 14.845 739 HB2 GLU 134 HB2 GLU 134 13.074 6.815 16.632 740 HB3 GLU 134 HB1 GLU 134 12.868 5.174 17.188 741 HG2 GLU 134 HG2 GLU 134 15.304 6.858 17.699 742 HG3 GLU 134 HG1 GLU 134 13.942 6.737 18.805 743 H GLY 135 HN GLY 135 14.247 6.144 13.156 744 HA2 GLY 135 HA2 GLY 135 16.209 8.249 13.489 745 HA3 GLY 135 HA1 GLY 135 16.667 6.903 12.454 746 H GLY 136 HN GLY 136 16.738 8.911 10.991 747 HA2 GLY 136 HA2 GLY 136 14.072 9.356 9.829 748 HA3 GLY 136 HA1 GLY 136 15.496 10.369 9.543 749 H SER 137 HN SER 137 13.619 8.456 7.929 750 HA SER 137 HA SER 137 15.239 7.521 5.906 751 HB2 SER 137 HB2 SER 137 14.712 5.570 8.148 752 HB3 SER 137 HB1 SER 137 14.993 4.995 6.493 753 HG SER 137 HG SER 137 16.733 6.737 7.840 754 H ASP 138 HN ASP 138 13.812 5.603 4.764 755 HA ASP 138 HA ASP 138 11.141 6.651 4.893 756 HB2 ASP 138 HB2 ASP 138 10.646 5.019 2.978 757 HB3 ASP 138 HB1 ASP 138 11.766 6.312 2.619 758 H ASN 139 HN ASN 139 12.221 3.278 4.812 759 HA ASN 139 HA ASN 139 9.914 2.617 6.473 760 HB2 ASN 139 HB2 ASN 139 10.184 0.362 5.748 761 HB3 ASN 139 HB1 ASN 139 10.459 1.368 4.332 762 HD21 ASN 139 HD21 ASN 139 11.738 -0.856 6.481 763 HD22 ASN 139 HD22 ASN 139 13.304 -1.081 5.771 764 H ASP 140 HN ASP 140 13.240 3.132 6.840 765 HA ASP 140 HA ASP 140 13.414 1.428 9.233 766 HB2 ASP 140 HB2 ASP 140 15.592 3.050 7.871 767 HB3 ASP 140 HB1 ASP 140 15.834 2.014 9.266 768 H ALA 141 HN ALA 141 12.199 4.244 8.649 769 HA ALA 141 HA ALA 141 13.452 5.922 10.661 770 HB1 ALA 141 HB1 ALA 141 12.691 6.869 8.562 771 HB2 ALA 141 HB2 ALA 141 11.886 7.590 9.956 772 HB3 ALA 141 HB3 ALA 141 11.039 6.407 8.959 773 H ASP 142 HN ASP 142 12.291 6.881 12.402 774 HA ASP 142 HA ASP 142 10.284 5.140 13.482 775 HB2 ASP 142 HB2 ASP 142 10.217 6.650 15.443 776 HB3 ASP 142 HB1 ASP 142 11.852 6.143 15.111 777 H ILE 143 HN ILE 143 8.353 5.249 12.922 778 HA ILE 143 HA ILE 143 7.570 7.608 11.479 779 HB ILE 143 HB ILE 143 5.711 6.178 10.487 780 HG12 ILE 143 HG12 ILE 143 6.375 3.667 10.366 781 HG13 ILE 143 HG11 ILE 143 7.301 3.968 11.823 782 HG21 ILE 143 HG21 ILE 143 8.565 5.462 9.917 783 HG22 ILE 143 HG22 ILE 143 7.650 6.814 9.251 784 HG23 ILE 143 HG23 ILE 143 7.200 5.155 8.844 785 HD11 ILE 143 HD11 ILE 143 4.335 4.338 11.518 786 HD12 ILE 143 HD12 ILE 143 5.262 4.554 13.003 787 HD13 ILE 143 HD13 ILE 143 5.126 2.952 12.267 788 H GLY 144 HN GLY 144 6.283 9.018 12.251 789 HA2 GLY 144 HA2 GLY 144 4.070 8.302 13.858 790 HA3 GLY 144 HA1 GLY 144 5.400 8.930 14.814 791 H ASN 145 HN ASN 145 3.491 10.336 15.181 792 HA ASN 145 HA ASN 145 3.917 12.778 13.810 793 HB2 ASN 145 HB2 ASN 145 1.674 13.212 13.039 794 HB3 ASN 145 HB1 ASN 145 2.144 11.663 12.378 795 HD21 ASN 145 HD21 ASN 145 1.524 10.318 15.059 796 HD22 ASN 145 HD22 ASN 145 -0.205 10.254 15.049 797 H TRP 146 HN TRP 146 3.071 14.504 15.020 798 HA TRP 146 HA TRP 146 1.861 14.113 17.533 799 HB2 TRP 146 HB2 TRP 146 3.870 14.698 18.923 800 HB3 TRP 146 HB1 TRP 146 3.900 13.086 18.213 801 HD1 TRP 146 HD1 TRP 146 5.375 16.594 17.297 802 HE1 TRP 146 HE1 TRP 146 7.692 16.189 16.257 803 HE3 TRP 146 HE3 TRP 146 5.438 11.542 17.494 804 HZ2 TRP 146 HZ2 TRP 146 9.334 13.997 15.615 805 HZ3 TRP 146 HZ3 TRP 146 7.438 10.343 16.671 806 HH2 TRP 146 HH2 TRP 146 9.324 11.544 15.746 807 H ASP 147 HN ASP 147 2.416 16.095 18.905 808 HA ASP 147 HA ASP 147 2.761 18.367 17.131 809 HB2 ASP 147 HB2 ASP 147 0.395 18.176 18.022 810 HB3 ASP 147 HB1 ASP 147 1.060 18.385 19.641 811 H ASN 148 HN ASN 148 4.145 19.895 17.818 812 HA ASN 148 HA ASN 148 5.630 19.415 20.277 813 HB2 ASN 148 HB2 ASN 148 7.757 19.580 19.029 814 HB3 ASN 148 HB1 ASN 148 6.829 18.182 18.513 815 HD21 ASN 148 HD21 ASN 148 8.088 21.276 17.600 816 HD22 ASN 148 HD22 ASN 148 7.709 21.178 15.927 Start of MODEL 8 1 H1 MET 39 HT1 MET 39 3.638 6.076 0.218 2 H2 MET 39 HT2 MET 39 3.169 6.056 -1.386 3 H3 MET 39 HT3 MET 39 4.177 7.278 -0.838 4 HA MET 39 HA MET 39 5.408 5.650 -2.118 5 HB2 MET 39 HB2 MET 39 6.298 6.766 0.091 6 HB3 MET 39 HB1 MET 39 6.109 5.171 0.793 7 HG2 MET 39 HG2 MET 39 8.386 5.494 0.091 8 HG3 MET 39 HG1 MET 39 7.623 4.265 -0.916 9 HE1 MET 39 HE1 MET 39 9.768 4.632 -2.555 10 HE2 MET 39 HE2 MET 39 10.361 5.984 -1.585 11 HE3 MET 39 HE3 MET 39 10.136 6.175 -3.322 12 H SER 40 HN SER 40 4.509 3.777 -2.977 13 HA SER 40 HA SER 40 3.783 1.711 -1.033 14 HB2 SER 40 HB2 SER 40 2.483 2.350 -3.632 15 HB3 SER 40 HB1 SER 40 2.063 0.978 -2.593 16 HG SER 40 HG SER 40 1.371 2.349 -1.032 17 H ARG 41 HN ARG 41 5.692 0.698 -1.131 18 HA ARG 41 HA ARG 41 5.986 -1.229 -3.190 19 HB2 ARG 41 HB2 ARG 41 8.446 -0.608 -3.539 20 HB3 ARG 41 HB1 ARG 41 7.298 0.514 -4.241 21 HG2 ARG 41 HG2 ARG 41 7.549 1.964 -2.360 22 HG3 ARG 41 HG1 ARG 41 8.751 0.878 -1.644 23 HD2 ARG 41 HD2 ARG 41 9.936 2.635 -2.787 24 HD3 ARG 41 HD1 ARG 41 10.117 1.160 -3.729 25 HE ARG 41 HE ARG 41 7.895 2.761 -4.548 26 HH11 ARG 41 HH11 ARG 41 11.384 2.341 -4.942 27 HH12 ARG 41 HH12 ARG 41 11.450 3.044 -6.482 28 HH21 ARG 41 HH21 ARG 41 7.990 3.787 -6.691 29 HH22 ARG 41 HH22 ARG 41 9.484 3.896 -7.474 30 HA PRO 42 HA PRO 42 7.375 -3.916 0.110 31 HB2 PRO 42 HB2 PRO 42 10.210 -3.619 -0.817 32 HB3 PRO 42 HB1 PRO 42 9.360 -5.083 -0.297 33 HG2 PRO 42 HG2 PRO 42 9.668 -4.627 -2.871 34 HG3 PRO 42 HG1 PRO 42 8.103 -5.199 -2.265 35 HD2 PRO 42 HD2 PRO 42 8.903 -2.490 -3.192 36 HD3 PRO 42 HD1 PRO 42 7.332 -3.303 -3.337 37 H ASP 43 HN ASP 43 7.452 -3.377 2.140 38 HA ASP 43 HA ASP 43 7.870 -2.492 4.129 39 HB2 ASP 43 HB2 ASP 43 10.555 -1.856 2.946 40 HB3 ASP 43 HB1 ASP 43 10.127 -1.259 4.543 41 H GLN 44 HN GLN 44 8.284 -0.339 1.502 42 HA GLN 44 HA GLN 44 7.760 2.042 3.015 43 HB2 GLN 44 HB2 GLN 44 7.372 1.560 0.066 44 HB3 GLN 44 HB1 GLN 44 7.403 3.119 0.877 45 HG2 GLN 44 HG2 GLN 44 9.706 1.185 0.690 46 HG3 GLN 44 HG1 GLN 44 9.516 2.650 -0.267 47 HE21 GLN 44 HE21 GLN 44 11.616 1.859 1.544 48 HE22 GLN 44 HE22 GLN 44 11.735 3.081 2.741 49 H ALA 45 HN ALA 45 5.860 -0.359 1.415 50 HA ALA 45 HA ALA 45 3.355 0.877 1.433 51 HB1 ALA 45 HB1 ALA 45 3.789 -1.251 0.294 52 HB2 ALA 45 HB2 ALA 45 2.431 -1.402 1.408 53 HB3 ALA 45 HB3 ALA 45 4.012 -2.046 1.853 54 H LYS 46 HN LYS 46 5.246 -0.659 3.903 55 HA LYS 46 HA LYS 46 3.197 -0.804 5.903 56 HB2 LYS 46 HB2 LYS 46 6.203 -0.894 6.140 57 HB3 LYS 46 HB1 LYS 46 5.059 -1.356 7.390 58 HG2 LYS 46 HG2 LYS 46 4.237 -3.169 5.972 59 HG3 LYS 46 HG1 LYS 46 5.387 -2.708 4.713 60 HD2 LYS 46 HD2 LYS 46 7.230 -3.158 6.229 61 HD3 LYS 46 HD1 LYS 46 6.112 -3.583 7.511 62 HE2 LYS 46 HE2 LYS 46 6.585 -5.059 4.913 63 HE3 LYS 46 HE1 LYS 46 6.944 -5.556 6.573 64 HZ1 LYS 46 HZ1 LYS 46 4.608 -5.663 7.047 65 HZ2 LYS 46 HZ2 LYS 46 5.025 -6.662 5.769 66 HZ3 LYS 46 HZ3 LYS 46 4.220 -5.221 5.451 67 H VAL 47 HN VAL 47 5.464 1.587 4.763 68 HA VAL 47 HA VAL 47 5.390 3.281 7.084 69 HB VAL 47 HB VAL 47 6.121 4.020 4.222 70 HG11 VAL 47 HG11 VAL 47 7.395 5.857 5.226 71 HG12 VAL 47 HG12 VAL 47 6.790 5.406 6.817 72 HG13 VAL 47 HG13 VAL 47 5.671 5.980 5.582 73 HG21 VAL 47 HG21 VAL 47 7.512 2.198 5.040 74 HG22 VAL 47 HG22 VAL 47 7.931 3.162 6.463 75 HG23 VAL 47 HG23 VAL 47 8.421 3.697 4.849 76 H THR 48 HN THR 48 3.833 3.137 3.945 77 HA THR 48 HA THR 48 2.472 5.573 4.376 78 HB THR 48 HB THR 48 3.139 4.831 2.110 79 HG1 THR 48 HG1 THR 48 0.407 5.428 2.628 80 HG21 THR 48 HG21 THR 48 1.781 3.191 0.907 81 HG22 THR 48 HG22 THR 48 0.852 2.884 2.380 82 HG23 THR 48 HG23 THR 48 2.568 2.477 2.318 83 H VAL 49 HN VAL 49 1.545 2.185 4.881 84 HA VAL 49 HA VAL 49 -1.164 2.908 5.402 85 HB VAL 49 HB VAL 49 -1.483 0.720 6.441 86 HG11 VAL 49 HG11 VAL 49 0.128 0.545 3.917 87 HG12 VAL 49 HG12 VAL 49 -1.619 0.768 4.062 88 HG13 VAL 49 HG13 VAL 49 -0.877 -0.751 4.567 89 HG21 VAL 49 HG21 VAL 49 0.580 0.452 7.682 90 HG22 VAL 49 HG22 VAL 49 1.504 0.365 6.188 91 HG23 VAL 49 HG23 VAL 49 0.380 -0.933 6.603 92 H ALA 50 HN ALA 50 1.755 2.670 7.299 93 HA ALA 50 HA ALA 50 0.617 2.980 9.813 94 HB1 ALA 50 HB1 ALA 50 3.318 3.891 8.911 95 HB2 ALA 50 HB2 ALA 50 2.924 2.227 9.371 96 HB3 ALA 50 HB3 ALA 50 2.797 3.535 10.557 97 H LYS 51 HN LYS 51 1.464 5.294 7.312 98 HA LYS 51 HA LYS 51 1.487 7.575 8.943 99 HB2 LYS 51 HB2 LYS 51 0.728 7.381 6.018 100 HB3 LYS 51 HB1 LYS 51 1.043 8.885 6.855 101 HG2 LYS 51 HG2 LYS 51 3.058 6.674 6.479 102 HG3 LYS 51 HG1 LYS 51 2.915 8.084 5.439 103 HD2 LYS 51 HD2 LYS 51 3.561 8.148 8.400 104 HD3 LYS 51 HD1 LYS 51 4.738 8.291 7.096 105 HE2 LYS 51 HE2 LYS 51 3.486 10.300 6.291 106 HE3 LYS 51 HE1 LYS 51 2.488 10.190 7.741 107 HZ1 LYS 51 HZ1 LYS 51 5.418 10.602 7.661 108 HZ2 LYS 51 HZ2 LYS 51 4.503 10.529 9.085 109 HZ3 LYS 51 HZ3 LYS 51 4.271 11.781 7.987 110 H GLY 52 HN GLY 52 -1.084 5.717 7.601 111 HA2 GLY 52 HA2 GLY 52 -3.121 7.697 8.149 112 HA3 GLY 52 HA1 GLY 52 -3.384 6.065 7.540 113 H ASP 53 HN ASP 53 -1.765 4.829 9.614 114 HA ASP 53 HA ASP 53 -3.868 4.788 11.564 115 HB2 ASP 53 HB2 ASP 53 -1.620 2.911 11.038 116 HB3 ASP 53 HB1 ASP 53 -2.522 2.835 12.554 117 H ILE 54 HN ILE 54 -0.699 6.002 11.457 118 HA ILE 54 HA ILE 54 -0.664 6.584 14.252 119 HB ILE 54 HB ILE 54 1.152 8.182 13.739 120 HG12 ILE 54 HG12 ILE 54 0.480 7.534 10.857 121 HG13 ILE 54 HG11 ILE 54 0.329 9.096 11.639 122 HG21 ILE 54 HG21 ILE 54 1.383 5.510 12.367 123 HG22 ILE 54 HG22 ILE 54 1.774 5.879 14.048 124 HG23 ILE 54 HG23 ILE 54 2.751 6.550 12.742 125 HD11 ILE 54 HD11 ILE 54 2.867 7.632 11.014 126 HD12 ILE 54 HD12 ILE 54 2.772 9.169 11.875 127 HD13 ILE 54 HD13 ILE 54 2.243 9.067 10.192 128 H LYS 55 HN LYS 55 -1.958 8.136 11.392 129 HA LYS 55 HA LYS 55 -2.634 10.612 12.591 130 HB2 LYS 55 HB2 LYS 55 -2.599 9.667 10.043 131 HB3 LYS 55 HB1 LYS 55 -4.315 9.548 10.395 132 HG2 LYS 55 HG2 LYS 55 -3.913 11.651 9.363 133 HG3 LYS 55 HG1 LYS 55 -4.268 11.946 11.070 134 HD2 LYS 55 HD2 LYS 55 -1.800 11.958 11.495 135 HD3 LYS 55 HD1 LYS 55 -1.561 11.853 9.769 136 HE2 LYS 55 HE2 LYS 55 -2.995 14.097 11.201 137 HE3 LYS 55 HE1 LYS 55 -1.369 14.177 10.538 138 HZ1 LYS 55 HZ1 LYS 55 -3.864 13.786 8.972 139 HZ2 LYS 55 HZ2 LYS 55 -2.322 13.841 8.316 140 HZ3 LYS 55 HZ3 LYS 55 -2.965 15.199 9.094 141 H ALA 56 HN ALA 56 -4.028 7.481 12.488 142 HA ALA 56 HA ALA 56 -6.659 8.027 13.363 143 HB1 ALA 56 HB1 ALA 56 -6.726 5.668 13.962 144 HB2 ALA 56 HB2 ALA 56 -4.968 5.591 13.853 145 HB3 ALA 56 HB3 ALA 56 -5.924 5.868 12.395 146 H ILE 57 HN ILE 57 -3.690 7.119 15.035 147 HA ILE 57 HA ILE 57 -4.686 7.069 17.650 148 HB ILE 57 HB ILE 57 -1.872 7.783 16.761 149 HG12 ILE 57 HG12 ILE 57 -3.007 5.119 17.559 150 HG13 ILE 57 HG11 ILE 57 -2.820 5.623 15.884 151 HG21 ILE 57 HG21 ILE 57 -2.924 6.690 19.388 152 HG22 ILE 57 HG22 ILE 57 -2.339 8.333 19.121 153 HG23 ILE 57 HG23 ILE 57 -1.227 6.970 18.996 154 HD11 ILE 57 HD11 ILE 57 -1.051 4.153 16.604 155 HD12 ILE 57 HD12 ILE 57 -0.565 5.308 17.865 156 HD13 ILE 57 HD13 ILE 57 -0.447 5.736 16.154 157 H ALA 58 HN ALA 58 -3.124 9.623 15.801 158 HA ALA 58 HA ALA 58 -3.058 11.643 17.687 159 HB1 ALA 58 HB1 ALA 58 -2.987 13.191 15.817 160 HB2 ALA 58 HB2 ALA 58 -3.566 11.915 14.740 161 HB3 ALA 58 HB3 ALA 58 -1.988 11.771 15.509 162 H ALA 59 HN ALA 59 -5.797 10.429 15.934 163 HA ALA 59 HA ALA 59 -7.406 12.757 16.551 164 HB1 ALA 59 HB1 ALA 59 -8.166 10.185 15.178 165 HB2 ALA 59 HB2 ALA 59 -7.658 11.673 14.378 166 HB3 ALA 59 HB3 ALA 59 -9.167 11.635 15.292 167 H ALA 60 HN ALA 60 -7.117 9.369 17.524 168 HA ALA 60 HA ALA 60 -9.370 9.578 19.280 169 HB1 ALA 60 HB1 ALA 60 -8.799 7.334 20.012 170 HB2 ALA 60 HB2 ALA 60 -7.256 7.441 19.179 171 HB3 ALA 60 HB3 ALA 60 -8.761 7.430 18.248 172 H LEU 61 HN LEU 61 -5.928 10.012 19.569 173 HA LEU 61 HA LEU 61 -5.762 10.091 22.406 174 HB2 LEU 61 HB2 LEU 61 -3.942 9.905 20.531 175 HB3 LEU 61 HB1 LEU 61 -4.065 11.640 20.449 176 HG LEU 61 HG LEU 61 -2.125 10.700 21.748 177 HD11 LEU 61 HD11 LEU 61 -2.801 13.001 22.054 178 HD12 LEU 61 HD12 LEU 61 -2.286 12.297 23.589 179 HD13 LEU 61 HD13 LEU 61 -4.005 12.499 23.237 180 HD21 LEU 61 HD21 LEU 61 -3.336 8.891 22.852 181 HD22 LEU 61 HD22 LEU 61 -4.236 10.113 23.778 182 HD23 LEU 61 HD23 LEU 61 -2.498 9.950 23.994 183 H ASP 62 HN ASP 62 -6.833 12.254 19.956 184 HA ASP 62 HA ASP 62 -6.935 14.572 21.630 185 HB2 ASP 62 HB2 ASP 62 -6.812 14.479 19.042 186 HB3 ASP 62 HB1 ASP 62 -8.537 14.155 19.099 187 H MET 63 HN MET 63 -8.910 11.792 21.096 188 HA MET 63 HA MET 63 -11.271 12.938 22.288 189 HB2 MET 63 HB2 MET 63 -10.563 10.043 21.732 190 HB3 MET 63 HB1 MET 63 -12.046 10.523 22.526 191 HG2 MET 63 HG2 MET 63 -12.671 11.786 20.497 192 HG3 MET 63 HG1 MET 63 -11.211 11.178 19.713 193 HE1 MET 63 HE1 MET 63 -14.171 9.129 18.047 194 HE2 MET 63 HE2 MET 63 -12.845 10.251 17.745 195 HE3 MET 63 HE3 MET 63 -14.271 10.788 18.634 196 H TYR 64 HN TYR 64 -8.556 10.963 23.350 197 HA TYR 64 HA TYR 64 -9.276 10.641 26.094 198 HB2 TYR 64 HB2 TYR 64 -7.316 9.526 25.109 199 HB3 TYR 64 HB1 TYR 64 -6.526 11.090 24.908 200 HD1 TYR 64 HD1 TYR 64 -7.630 8.571 27.418 201 HD2 TYR 64 HD2 TYR 64 -5.582 12.264 26.817 202 HE1 TYR 64 HE1 TYR 64 -6.774 8.380 29.487 203 HE2 TYR 64 HE2 TYR 64 -4.698 12.094 29.037 204 HH TYR 64 HH TYR 64 -5.053 9.162 30.767 205 H LYS 65 HN LYS 65 -7.710 13.174 24.259 206 HA LYS 65 HA LYS 65 -7.047 14.972 26.199 207 HB2 LYS 65 HB2 LYS 65 -6.357 15.391 24.001 208 HB3 LYS 65 HB1 LYS 65 -7.998 15.313 23.392 209 HG2 LYS 65 HG2 LYS 65 -8.506 17.414 24.475 210 HG3 LYS 65 HG1 LYS 65 -6.833 17.528 25.069 211 HD2 LYS 65 HD2 LYS 65 -6.005 17.518 22.809 212 HD3 LYS 65 HD1 LYS 65 -7.622 17.254 22.177 213 HE2 LYS 65 HE2 LYS 65 -8.286 19.454 23.056 214 HE3 LYS 65 HE1 LYS 65 -6.624 19.709 23.601 215 HZ1 LYS 65 HZ1 LYS 65 -7.412 19.214 20.775 216 HZ2 LYS 65 HZ2 LYS 65 -5.863 19.571 21.339 217 HZ3 LYS 65 HZ3 LYS 65 -7.064 20.732 21.432 218 H LEU 66 HN LEU 66 -10.146 14.466 24.592 219 HA LEU 66 HA LEU 66 -11.376 16.415 26.268 220 HB2 LEU 66 HB2 LEU 66 -12.442 14.602 24.167 221 HB3 LEU 66 HB1 LEU 66 -13.531 15.326 25.335 222 HG LEU 66 HG LEU 66 -13.525 16.614 23.316 223 HD11 LEU 66 HD11 LEU 66 -12.131 18.115 25.511 224 HD12 LEU 66 HD12 LEU 66 -13.855 17.778 25.401 225 HD13 LEU 66 HD13 LEU 66 -13.082 18.808 24.198 226 HD21 LEU 66 HD21 LEU 66 -11.309 16.103 22.446 227 HD22 LEU 66 HD22 LEU 66 -10.571 17.021 23.756 228 HD23 LEU 66 HD23 LEU 66 -11.547 17.849 22.542 229 H ASP 67 HN ASP 67 -10.970 12.908 26.506 230 HA ASP 67 HA ASP 67 -13.032 12.489 28.441 231 HB2 ASP 67 HB2 ASP 67 -12.179 10.610 27.226 232 HB3 ASP 67 HB1 ASP 67 -10.546 10.880 27.826 233 H ASN 68 HN ASN 68 -9.687 13.555 28.634 234 HA ASN 68 HA ASN 68 -10.037 14.014 31.570 235 HB2 ASN 68 HB2 ASN 68 -7.549 13.160 30.119 236 HB3 ASN 68 HB1 ASN 68 -7.678 13.840 31.752 237 HD21 ASN 68 HD21 ASN 68 -8.676 11.138 29.761 238 HD22 ASN 68 HD22 ASN 68 -8.947 10.029 31.021 239 H PHE 69 HN PHE 69 -10.490 15.600 29.193 240 HA PHE 69 HA PHE 69 -10.161 17.769 28.471 241 HB2 PHE 69 HB2 PHE 69 -10.272 19.387 30.457 242 HB3 PHE 69 HB1 PHE 69 -11.586 18.236 30.269 243 HD1 PHE 69 HD1 PHE 69 -8.534 18.909 32.112 244 HD2 PHE 69 HD2 PHE 69 -12.030 16.686 31.916 245 HE1 PHE 69 HE1 PHE 69 -8.172 18.242 34.444 246 HE2 PHE 69 HE2 PHE 69 -11.763 15.934 34.214 247 HZ PHE 69 HZ PHE 69 -9.792 16.725 35.530 248 H ALA 70 HN ALA 70 -7.728 16.421 28.445 249 HA ALA 70 HA ALA 70 -5.744 18.396 28.280 250 HB1 ALA 70 HB1 ALA 70 -5.981 18.509 30.698 251 HB2 ALA 70 HB2 ALA 70 -4.422 17.740 30.301 252 HB3 ALA 70 HB3 ALA 70 -5.821 16.767 30.797 253 H TYR 71 HN TYR 71 -3.865 17.460 27.464 254 HA TYR 71 HA TYR 71 -4.034 14.762 26.620 255 HB2 TYR 71 HB2 TYR 71 -1.914 16.882 26.403 256 HB3 TYR 71 HB1 TYR 71 -1.577 15.229 25.928 257 HD1 TYR 71 HD1 TYR 71 -3.911 14.332 24.524 258 HD2 TYR 71 HD2 TYR 71 -2.146 18.191 24.564 259 HE1 TYR 71 HE1 TYR 71 -4.800 14.700 22.361 260 HE2 TYR 71 HE2 TYR 71 -3.033 18.622 22.322 261 HH TYR 71 HH TYR 71 -5.403 16.714 20.802 262 HA PRO 72 HA PRO 72 -2.283 12.527 29.965 263 HB2 PRO 72 HB2 PRO 72 -0.584 10.839 28.606 264 HB3 PRO 72 HB1 PRO 72 -2.338 10.629 28.661 265 HG2 PRO 72 HG2 PRO 72 -0.637 11.912 26.557 266 HG3 PRO 72 HG1 PRO 72 -1.957 10.738 26.367 267 HD2 PRO 72 HD2 PRO 72 -2.381 13.298 25.933 268 HD3 PRO 72 HD1 PRO 72 -3.585 12.321 26.797 269 H SER 73 HN SER 73 -0.189 12.122 31.197 270 HA SER 73 HA SER 73 1.946 13.879 30.246 271 HB2 SER 73 HB2 SER 73 2.842 13.594 32.574 272 HB3 SER 73 HB1 SER 73 1.228 14.304 32.565 273 HG SER 73 HG SER 73 0.456 12.630 33.483 274 H THR 74 HN THR 74 4.169 12.861 30.263 275 HA THR 74 HA THR 74 3.883 10.330 29.042 276 HB THR 74 HB THR 74 5.681 12.244 28.640 277 HG1 THR 74 HG1 THR 74 6.566 10.901 27.317 278 HG21 THR 74 HG21 THR 74 7.168 10.386 30.499 279 HG22 THR 74 HG22 THR 74 6.649 11.990 30.925 280 HG23 THR 74 HG23 THR 74 7.864 11.772 29.643 281 H GLN 75 HN GLN 75 4.020 11.153 32.247 282 HA GLN 75 HA GLN 75 4.942 8.487 32.999 283 HB2 GLN 75 HB2 GLN 75 4.432 10.985 34.537 284 HB3 GLN 75 HB1 GLN 75 4.633 9.448 35.388 285 HG2 GLN 75 HG2 GLN 75 6.702 10.497 35.531 286 HG3 GLN 75 HG1 GLN 75 6.910 9.410 34.170 287 HE21 GLN 75 HE21 GLN 75 5.160 12.496 34.055 288 HE22 GLN 75 HE22 GLN 75 6.295 13.256 33.009 289 H GLN 76 HN GLN 76 2.243 10.727 33.980 290 HA GLN 76 HA GLN 76 0.746 8.464 35.013 291 HB2 GLN 76 HB2 GLN 76 -0.063 11.356 34.763 292 HB3 GLN 76 HB1 GLN 76 -0.865 10.123 35.714 293 HG2 GLN 76 HG2 GLN 76 1.084 9.950 37.145 294 HG3 GLN 76 HG1 GLN 76 1.910 11.176 36.184 295 HE21 GLN 76 HE21 GLN 76 1.208 13.313 36.296 296 HE22 GLN 76 HE22 GLN 76 0.187 13.862 37.573 297 H GLY 77 HN GLY 77 0.588 10.633 32.291 298 HA2 GLY 77 HA2 GLY 77 -1.956 9.597 31.540 299 HA3 GLY 77 HA1 GLY 77 -0.948 10.634 30.560 300 H LEU 78 HN LEU 78 1.321 8.598 30.965 301 HA LEU 78 HA LEU 78 0.798 7.120 28.572 302 HB2 LEU 78 HB2 LEU 78 3.107 7.770 29.450 303 HB3 LEU 78 HB1 LEU 78 2.925 6.527 30.659 304 HG LEU 78 HG LEU 78 2.951 5.930 27.695 305 HD11 LEU 78 HD11 LEU 78 5.292 5.300 27.989 306 HD12 LEU 78 HD12 LEU 78 5.235 5.867 29.657 307 HD13 LEU 78 HD13 LEU 78 5.043 7.013 28.329 308 HD21 LEU 78 HD21 LEU 78 2.012 4.147 29.116 309 HD22 LEU 78 HD22 LEU 78 3.479 4.161 30.097 310 HD23 LEU 78 HD23 LEU 78 3.552 3.662 28.407 311 H GLU 79 HN GLU 79 1.004 6.254 31.959 312 HA GLU 79 HA GLU 79 -0.014 3.669 31.561 313 HB2 GLU 79 HB2 GLU 79 0.496 5.355 33.942 314 HB3 GLU 79 HB1 GLU 79 -0.544 3.941 34.109 315 HG2 GLU 79 HG2 GLU 79 1.105 2.494 33.430 316 HG3 GLU 79 HG1 GLU 79 2.153 3.784 32.830 317 H ALA 80 HN ALA 80 -1.509 6.741 31.930 318 HA ALA 80 HA ALA 80 -4.101 5.624 32.447 319 HB1 ALA 80 HB1 ALA 80 -3.451 8.346 31.415 320 HB2 ALA 80 HB2 ALA 80 -3.360 7.914 33.112 321 HB3 ALA 80 HB3 ALA 80 -4.924 7.842 32.248 322 H LEU 81 HN LEU 81 -2.182 5.852 29.724 323 HA LEU 81 HA LEU 81 -4.399 5.769 27.847 324 HB2 LEU 81 HB2 LEU 81 -1.416 5.565 27.471 325 HB3 LEU 81 HB1 LEU 81 -2.578 5.391 26.180 326 HG LEU 81 HG LEU 81 -2.103 7.888 27.810 327 HD11 LEU 81 HD11 LEU 81 -0.246 7.398 26.303 328 HD12 LEU 81 HD12 LEU 81 -1.153 8.793 25.739 329 HD13 LEU 81 HD13 LEU 81 -1.366 7.232 24.954 330 HD21 LEU 81 HD21 LEU 81 -3.902 7.404 25.429 331 HD22 LEU 81 HD22 LEU 81 -3.570 8.972 26.160 332 HD23 LEU 81 HD23 LEU 81 -4.428 7.740 27.082 333 H VAL 82 HN VAL 82 -2.301 3.715 29.594 334 HA VAL 82 HA VAL 82 -3.158 1.423 27.978 335 HB VAL 82 HB VAL 82 -1.014 1.513 30.122 336 HG11 VAL 82 HG11 VAL 82 -1.693 -0.656 28.135 337 HG12 VAL 82 HG12 VAL 82 -1.982 -0.723 29.872 338 HG13 VAL 82 HG13 VAL 82 -0.330 -0.671 29.254 339 HG21 VAL 82 HG21 VAL 82 -0.782 1.489 27.110 340 HG22 VAL 82 HG22 VAL 82 0.571 1.422 28.243 341 HG23 VAL 82 HG23 VAL 82 -0.449 2.858 28.159 342 H LYS 83 HN LYS 83 -3.343 2.609 31.276 343 HA LYS 83 HA LYS 83 -5.325 0.547 31.893 344 HB2 LYS 83 HB2 LYS 83 -4.569 0.437 34.168 345 HB3 LYS 83 HB1 LYS 83 -3.080 0.511 33.243 346 HG2 LYS 83 HG2 LYS 83 -2.823 2.851 33.745 347 HG3 LYS 83 HG1 LYS 83 -4.361 2.860 34.608 348 HD2 LYS 83 HD2 LYS 83 -3.459 1.224 36.193 349 HD3 LYS 83 HD1 LYS 83 -1.921 1.247 35.330 350 HE2 LYS 83 HE2 LYS 83 -1.696 3.649 35.832 351 HE3 LYS 83 HE1 LYS 83 -3.219 3.593 36.715 352 HZ1 LYS 83 HZ1 LYS 83 -0.765 2.073 37.414 353 HZ2 LYS 83 HZ2 LYS 83 -2.222 1.991 38.224 354 HZ3 LYS 83 HZ3 LYS 83 -1.358 3.432 38.230 355 H LYS 84 HN LYS 84 -7.166 1.382 33.191 356 HA LYS 84 HA LYS 84 -8.202 3.708 32.157 357 HB2 LYS 84 HB2 LYS 84 -9.288 1.699 33.178 358 HB3 LYS 84 HB1 LYS 84 -8.846 2.338 34.747 359 HG2 LYS 84 HG2 LYS 84 -10.273 4.234 34.434 360 HG3 LYS 84 HG1 LYS 84 -10.610 3.746 32.766 361 HD2 LYS 84 HD2 LYS 84 -12.465 2.925 33.992 362 HD3 LYS 84 HD1 LYS 84 -11.312 1.596 33.689 363 HE2 LYS 84 HE2 LYS 84 -10.472 1.667 35.911 364 HE3 LYS 84 HE1 LYS 84 -11.412 3.113 36.281 365 HZ1 LYS 84 HZ1 LYS 84 -12.531 0.424 35.687 366 HZ2 LYS 84 HZ2 LYS 84 -13.416 1.820 36.006 367 HZ3 LYS 84 HZ3 LYS 84 -12.454 1.164 37.202 368 HA PRO 85 HA PRO 85 -5.907 6.845 34.204 369 HB2 PRO 85 HB2 PRO 85 -7.748 8.866 34.051 370 HB3 PRO 85 HB1 PRO 85 -6.762 8.352 32.677 371 HG2 PRO 85 HG2 PRO 85 -9.559 7.574 33.356 372 HG3 PRO 85 HG1 PRO 85 -8.872 8.038 31.785 373 HD2 PRO 85 HD2 PRO 85 -9.281 5.501 32.379 374 HD3 PRO 85 HD1 PRO 85 -7.813 5.991 31.511 375 H THR 86 HN THR 86 -5.552 7.085 36.254 376 HA THR 86 HA THR 86 -7.673 6.605 38.136 377 HB THR 86 HB THR 86 -5.768 6.853 39.853 378 HG1 THR 86 HG1 THR 86 -4.412 7.882 38.083 379 HG21 THR 86 HG21 THR 86 -5.602 4.679 37.760 380 HG22 THR 86 HG22 THR 86 -6.670 4.687 39.164 381 HG23 THR 86 HG23 THR 86 -4.926 4.588 39.387 382 H GLY 87 HN GLY 87 -8.879 8.113 38.882 383 HA2 GLY 87 HA2 GLY 87 -8.534 10.279 40.229 384 HA3 GLY 87 HA1 GLY 87 -8.070 10.881 38.631 385 H ASN 88 HN ASN 88 -9.786 12.156 38.156 386 HA ASN 88 HA ASN 88 -12.244 10.661 37.640 387 HB2 ASN 88 HB2 ASN 88 -12.142 13.387 38.948 388 HB3 ASN 88 HB1 ASN 88 -13.568 12.795 38.122 389 HD21 ASN 88 HD21 ASN 88 -11.599 12.526 40.942 390 HD22 ASN 88 HD22 ASN 88 -12.641 11.483 41.825 391 HA PRO 89 HA PRO 89 -11.389 12.753 33.726 392 HB2 PRO 89 HB2 PRO 89 -12.241 10.349 32.350 393 HB3 PRO 89 HB1 PRO 89 -10.605 10.918 32.484 394 HG2 PRO 89 HG2 PRO 89 -11.563 8.626 33.707 395 HG3 PRO 89 HG1 PRO 89 -10.105 9.509 34.187 396 HD2 PRO 89 HD2 PRO 89 -12.833 9.539 35.403 397 HD3 PRO 89 HD1 PRO 89 -11.235 9.610 36.182 398 H GLN 90 HN GLN 90 -12.993 13.165 31.968 399 HA GLN 90 HA GLN 90 -15.678 13.257 33.125 400 HB2 GLN 90 HB2 GLN 90 -14.510 14.775 30.781 401 HB3 GLN 90 HB1 GLN 90 -16.172 14.922 31.330 402 HG2 GLN 90 HG2 GLN 90 -13.713 15.634 32.904 403 HG3 GLN 90 HG1 GLN 90 -14.808 16.765 32.113 404 HE21 GLN 90 HE21 GLN 90 -17.239 15.260 32.923 405 HE22 GLN 90 HE22 GLN 90 -17.392 15.545 34.610 406 HA PRO 91 HA PRO 91 -16.568 9.391 31.309 407 HB2 PRO 91 HB2 PRO 91 -19.166 10.830 30.993 408 HB3 PRO 91 HB1 PRO 91 -18.873 9.139 31.429 409 HG2 PRO 91 HG2 PRO 91 -19.299 10.932 33.329 410 HG3 PRO 91 HG1 PRO 91 -18.068 9.676 33.534 411 HD2 PRO 91 HD2 PRO 91 -17.715 12.576 33.097 412 HD3 PRO 91 HD1 PRO 91 -16.600 11.398 33.812 413 H LYS 92 HN LYS 92 -15.350 9.373 29.512 414 HA LYS 92 HA LYS 92 -16.884 9.430 27.102 415 HB2 LYS 92 HB2 LYS 92 -14.149 10.592 27.513 416 HB3 LYS 92 HB1 LYS 92 -14.633 9.984 25.931 417 HG2 LYS 92 HG2 LYS 92 -16.624 11.536 26.139 418 HG3 LYS 92 HG1 LYS 92 -15.767 12.221 27.526 419 HD2 LYS 92 HD2 LYS 92 -13.980 12.952 26.187 420 HD3 LYS 92 HD1 LYS 92 -14.535 12.002 24.802 421 HE2 LYS 92 HE2 LYS 92 -16.025 14.329 26.028 422 HE3 LYS 92 HE1 LYS 92 -15.056 14.391 24.556 423 HZ1 LYS 92 HZ1 LYS 92 -17.493 12.710 24.911 424 HZ2 LYS 92 HZ2 LYS 92 -16.519 12.789 23.545 425 HZ3 LYS 92 HZ3 LYS 92 -17.380 14.139 24.010 426 H ASN 93 HN ASN 93 -16.257 7.840 25.684 427 HA ASN 93 HA ASN 93 -15.644 5.410 26.905 428 HB2 ASN 93 HB2 ASN 93 -15.473 6.109 23.956 429 HB3 ASN 93 HB1 ASN 93 -15.427 4.478 24.597 430 HD21 ASN 93 HD21 ASN 93 -17.255 3.829 23.508 431 HD22 ASN 93 HD22 ASN 93 -18.838 4.377 23.881 432 H TRP 94 HN TRP 94 -13.724 5.627 28.093 433 HA TRP 94 HA TRP 94 -11.285 6.286 27.035 434 HB2 TRP 94 HB2 TRP 94 -11.664 6.276 29.425 435 HB3 TRP 94 HB1 TRP 94 -12.034 4.552 29.407 436 HD1 TRP 94 HD1 TRP 94 -9.105 6.983 29.097 437 HE1 TRP 94 HE1 TRP 94 -6.894 5.633 29.414 438 HE3 TRP 94 HE3 TRP 94 -11.037 2.262 29.330 439 HZ2 TRP 94 HZ2 TRP 94 -6.131 2.959 29.718 440 HZ3 TRP 94 HZ3 TRP 94 -9.512 0.368 29.647 441 HH2 TRP 94 HH2 TRP 94 -7.110 0.712 29.840 442 H ASN 95 HN ASN 95 -9.639 5.061 26.274 443 HA ASN 95 HA ASN 95 -10.263 2.339 25.606 444 HB2 ASN 95 HB2 ASN 95 -10.770 3.624 23.619 445 HB3 ASN 95 HB1 ASN 95 -9.229 4.463 23.762 446 HD21 ASN 95 HD21 ASN 95 -9.544 0.924 24.163 447 HD22 ASN 95 HD22 ASN 95 -8.595 0.628 22.755 448 H LYS 96 HN LYS 96 -8.431 1.032 26.061 449 HA LYS 96 HA LYS 96 -6.011 2.320 26.926 450 HB2 LYS 96 HB2 LYS 96 -5.100 0.163 27.321 451 HB3 LYS 96 HB1 LYS 96 -6.772 0.073 27.882 452 HG2 LYS 96 HG2 LYS 96 -7.340 -1.163 25.805 453 HG3 LYS 96 HG1 LYS 96 -5.661 -0.940 25.286 454 HD2 LYS 96 HD2 LYS 96 -4.878 -2.222 27.213 455 HD3 LYS 96 HD1 LYS 96 -6.548 -2.493 27.712 456 HE2 LYS 96 HE2 LYS 96 -6.996 -3.726 25.681 457 HE3 LYS 96 HE1 LYS 96 -5.388 -3.353 25.064 458 HZ1 LYS 96 HZ1 LYS 96 -5.975 -4.975 27.472 459 HZ2 LYS 96 HZ2 LYS 96 -4.446 -4.641 26.891 460 HZ3 LYS 96 HZ3 LYS 96 -5.516 -5.587 25.974 461 H ASP 97 HN ASP 97 -4.001 0.988 25.924 462 HA ASP 97 HA ASP 97 -2.631 0.542 24.203 463 HB2 ASP 97 HB2 ASP 97 -4.719 -0.899 23.509 464 HB3 ASP 97 HB1 ASP 97 -4.973 0.355 22.304 465 H GLY 98 HN GLY 98 -3.827 3.150 24.867 466 HA2 GLY 98 HA2 GLY 98 -2.600 5.147 24.372 467 HA3 GLY 98 HA1 GLY 98 -2.260 4.471 22.806 468 H TYR 99 HN TYR 99 -5.516 4.118 23.679 469 HA TYR 99 HA TYR 99 -7.376 4.865 22.717 470 HB2 TYR 99 HB2 TYR 99 -6.025 7.335 23.537 471 HB3 TYR 99 HB1 TYR 99 -6.956 7.629 22.058 472 HD1 TYR 99 HD1 TYR 99 -6.948 6.615 25.563 473 HD2 TYR 99 HD2 TYR 99 -9.268 7.818 22.231 474 HE1 TYR 99 HE1 TYR 99 -8.829 7.135 27.048 475 HE2 TYR 99 HE2 TYR 99 -11.143 8.340 23.708 476 HH TYR 99 HH TYR 99 -11.909 7.791 25.909 477 H LEU 100 HN LEU 100 -7.139 3.555 21.088 478 HA LEU 100 HA LEU 100 -6.024 4.523 18.544 479 HB2 LEU 100 HB2 LEU 100 -4.423 3.037 19.645 480 HB3 LEU 100 HB1 LEU 100 -5.671 1.854 19.931 481 HG LEU 100 HG LEU 100 -5.810 1.487 17.468 482 HD11 LEU 100 HD11 LEU 100 -4.926 3.644 16.733 483 HD12 LEU 100 HD12 LEU 100 -4.076 2.280 16.016 484 HD13 LEU 100 HD13 LEU 100 -3.334 3.172 17.341 485 HD21 LEU 100 HD21 LEU 100 -4.502 -0.002 18.869 486 HD22 LEU 100 HD22 LEU 100 -3.105 1.062 18.717 487 HD23 LEU 100 HD23 LEU 100 -3.723 0.212 17.301 488 H LYS 101 HN LYS 101 -6.865 3.050 16.769 489 HA LYS 101 HA LYS 101 -9.704 2.632 16.997 490 HB2 LYS 101 HB2 LYS 101 -7.760 1.846 14.806 491 HB3 LYS 101 HB1 LYS 101 -9.510 1.784 14.679 492 HG2 LYS 101 HG2 LYS 101 -7.876 4.280 15.071 493 HG3 LYS 101 HG1 LYS 101 -8.547 3.727 13.534 494 HD2 LYS 101 HD2 LYS 101 -10.808 3.926 14.461 495 HD3 LYS 101 HD1 LYS 101 -10.130 4.459 16.000 496 HE2 LYS 101 HE2 LYS 101 -10.901 6.364 14.727 497 HE3 LYS 101 HE1 LYS 101 -9.144 6.407 14.877 498 HZ1 LYS 101 HZ1 LYS 101 -9.042 5.496 12.571 499 HZ2 LYS 101 HZ2 LYS 101 -9.789 6.981 12.678 500 HZ3 LYS 101 HZ3 LYS 101 -10.723 5.610 12.493 501 H LYS 102 HN LYS 102 -10.168 0.235 15.779 502 HA LYS 102 HA LYS 102 -9.090 -1.579 17.741 503 HB2 LYS 102 HB2 LYS 102 -10.788 -3.270 16.855 504 HB3 LYS 102 HB1 LYS 102 -11.436 -1.854 17.657 505 HG2 LYS 102 HG2 LYS 102 -11.231 -1.937 14.679 506 HG3 LYS 102 HG1 LYS 102 -12.561 -2.763 15.486 507 HD2 LYS 102 HD2 LYS 102 -11.922 0.198 15.800 508 HD3 LYS 102 HD1 LYS 102 -13.138 -0.456 14.708 509 HE2 LYS 102 HE2 LYS 102 -14.367 -1.344 16.627 510 HE3 LYS 102 HE1 LYS 102 -13.119 -0.754 17.719 511 HZ1 LYS 102 HZ1 LYS 102 -14.844 0.943 15.994 512 HZ2 LYS 102 HZ2 LYS 102 -13.612 1.499 16.974 513 HZ3 LYS 102 HZ3 LYS 102 -14.963 0.777 17.673 514 H LEU 103 HN LEU 103 -7.168 -1.189 16.800 515 HA LEU 103 HA LEU 103 -6.525 -2.651 14.319 516 HB2 LEU 103 HB2 LEU 103 -6.255 -0.237 14.224 517 HB3 LEU 103 HB1 LEU 103 -5.245 -0.273 15.646 518 HG LEU 103 HG LEU 103 -3.625 -1.680 14.269 519 HD11 LEU 103 HD11 LEU 103 -5.278 -0.591 12.016 520 HD12 LEU 103 HD12 LEU 103 -5.175 -2.282 12.485 521 HD13 LEU 103 HD13 LEU 103 -3.747 -1.449 11.863 522 HD21 LEU 103 HD21 LEU 103 -2.659 0.304 13.211 523 HD22 LEU 103 HD22 LEU 103 -3.195 0.623 14.859 524 HD23 LEU 103 HD23 LEU 103 -4.165 1.177 13.492 525 HA PRO 104 HA PRO 104 -3.622 -5.091 16.908 526 HB2 PRO 104 HB2 PRO 104 -2.300 -5.581 14.295 527 HB3 PRO 104 HB1 PRO 104 -2.944 -6.750 15.450 528 HG2 PRO 104 HG2 PRO 104 -4.193 -6.310 13.149 529 HG3 PRO 104 HG1 PRO 104 -5.113 -6.546 14.647 530 HD2 PRO 104 HD2 PRO 104 -4.414 -4.002 13.239 531 HD3 PRO 104 HD1 PRO 104 -5.980 -4.520 13.911 532 H VAL 105 HN VAL 105 -0.950 -5.332 16.362 533 HA VAL 105 HA VAL 105 -0.028 -2.671 16.954 534 HB VAL 105 HB VAL 105 0.715 -4.905 17.990 535 HG11 VAL 105 HG11 VAL 105 2.494 -5.015 15.590 536 HG12 VAL 105 HG12 VAL 105 1.222 -6.157 16.010 537 HG13 VAL 105 HG13 VAL 105 2.655 -6.015 17.033 538 HG21 VAL 105 HG21 VAL 105 1.760 -2.814 18.574 539 HG22 VAL 105 HG22 VAL 105 2.822 -2.933 17.179 540 HG23 VAL 105 HG23 VAL 105 2.930 -4.124 18.481 541 H ASP 106 HN ASP 106 2.285 -2.049 15.696 542 HA ASP 106 HA ASP 106 1.381 -1.691 12.970 543 HB2 ASP 106 HB2 ASP 106 2.654 0.082 14.598 544 HB3 ASP 106 HB1 ASP 106 4.079 -0.710 13.937 545 HA PRO 107 HA PRO 107 3.966 -4.772 10.775 546 HB2 PRO 107 HB2 PRO 107 5.322 -2.396 9.627 547 HB3 PRO 107 HB1 PRO 107 4.756 -3.876 8.864 548 HG2 PRO 107 HG2 PRO 107 3.320 -1.644 8.635 549 HG3 PRO 107 HG1 PRO 107 2.535 -3.218 8.850 550 HD2 PRO 107 HD2 PRO 107 2.877 -0.998 10.784 551 HD3 PRO 107 HD1 PRO 107 1.590 -2.213 10.672 552 H TRP 108 HN TRP 108 6.115 -5.331 10.402 553 HA TRP 108 HA TRP 108 8.197 -5.827 10.835 554 HB2 TRP 108 HB2 TRP 108 8.610 -3.288 12.419 555 HB3 TRP 108 HB1 TRP 108 9.812 -4.224 11.549 556 HD1 TRP 108 HD1 TRP 108 9.268 -4.230 8.751 557 HE1 TRP 108 HE1 TRP 108 8.726 -2.141 7.317 558 HE3 TRP 108 HE3 TRP 108 7.654 -1.201 12.464 559 HZ2 TRP 108 HZ2 TRP 108 7.683 0.473 7.784 560 HZ3 TRP 108 HZ3 TRP 108 6.870 1.051 11.945 561 HH2 TRP 108 HH2 TRP 108 6.843 1.880 9.735 562 H GLY 109 HN GLY 109 5.936 -5.928 12.875 563 HA2 GLY 109 HA2 GLY 109 5.586 -7.023 14.908 564 HA3 GLY 109 HA1 GLY 109 7.318 -7.299 14.994 565 H ASN 110 HN ASN 110 7.201 -4.088 14.606 566 HA ASN 110 HA ASN 110 7.850 -3.514 17.268 567 HB2 ASN 110 HB2 ASN 110 7.383 -1.700 14.911 568 HB3 ASN 110 HB1 ASN 110 7.930 -1.131 16.477 569 HD21 ASN 110 HD21 ASN 110 9.188 -0.984 13.945 570 HD22 ASN 110 HD22 ASN 110 10.720 -1.737 14.050 571 HA PRO 111 HA PRO 111 3.854 -2.396 18.875 572 HB2 PRO 111 HB2 PRO 111 4.695 -1.432 21.230 573 HB3 PRO 111 HB1 PRO 111 4.698 -3.164 20.885 574 HG2 PRO 111 HG2 PRO 111 6.964 -1.215 20.779 575 HG3 PRO 111 HG1 PRO 111 6.933 -2.853 21.459 576 HD2 PRO 111 HD2 PRO 111 7.952 -2.297 19.004 577 HD3 PRO 111 HD1 PRO 111 7.184 -3.845 19.398 578 H TYR 112 HN TYR 112 2.615 -0.538 18.923 579 HA TYR 112 HA TYR 112 3.872 1.874 18.098 580 HB2 TYR 112 HB2 TYR 112 1.103 1.306 19.158 581 HB3 TYR 112 HB1 TYR 112 1.683 2.932 18.917 582 HD1 TYR 112 HD1 TYR 112 2.399 3.575 16.500 583 HD2 TYR 112 HD2 TYR 112 -0.000 0.182 17.450 584 HE1 TYR 112 HE1 TYR 112 1.448 3.643 14.255 585 HE2 TYR 112 HE2 TYR 112 -0.956 0.217 15.193 586 HH TYR 112 HH TYR 112 0.219 2.129 12.618 587 H GLN 113 HN GLN 113 4.584 3.403 19.275 588 HA GLN 113 HA GLN 113 4.863 2.940 22.154 589 HB2 GLN 113 HB2 GLN 113 6.423 4.615 20.215 590 HB3 GLN 113 HB1 GLN 113 6.790 4.436 21.933 591 HG2 GLN 113 HG2 GLN 113 7.270 2.124 21.674 592 HG3 GLN 113 HG1 GLN 113 6.560 2.160 20.040 593 HE21 GLN 113 HE21 GLN 113 9.177 3.103 22.015 594 HE22 GLN 113 HE22 GLN 113 10.274 3.312 20.695 595 H TYR 114 HN TYR 114 3.504 4.093 23.335 596 HA TYR 114 HA TYR 114 2.429 6.616 22.275 597 HB2 TYR 114 HB2 TYR 114 1.458 5.296 24.809 598 HB3 TYR 114 HB1 TYR 114 0.564 6.302 23.679 599 HD1 TYR 114 HD2 TYR 114 0.802 5.052 21.143 600 HD2 TYR 114 HD1 TYR 114 0.496 3.184 24.956 601 HE1 TYR 114 HE2 TYR 114 -0.004 3.007 20.080 602 HE2 TYR 114 HE1 TYR 114 -0.325 1.128 23.894 603 HH TYR 114 HH TYR 114 -1.340 0.397 21.752 604 H LEU 115 HN LEU 115 3.508 8.351 22.993 605 HA LEU 115 HA LEU 115 4.393 8.347 25.749 606 HB2 LEU 115 HB2 LEU 115 5.772 9.494 23.338 607 HB3 LEU 115 HB1 LEU 115 6.282 9.810 24.993 608 HG LEU 115 HG LEU 115 6.364 7.162 23.529 609 HD11 LEU 115 HD11 LEU 115 8.777 7.458 23.616 610 HD12 LEU 115 HD12 LEU 115 8.562 9.023 24.397 611 HD13 LEU 115 HD13 LEU 115 8.004 8.782 22.742 612 HD21 LEU 115 HD21 LEU 115 7.333 7.903 26.285 613 HD22 LEU 115 HD22 LEU 115 7.615 6.361 25.477 614 HD23 LEU 115 HD23 LEU 115 5.977 6.836 25.917 615 H ALA 116 HN ALA 116 4.325 10.495 26.657 616 HA ALA 116 HA ALA 116 2.412 12.098 25.231 617 HB1 ALA 116 HB1 ALA 116 1.447 12.649 27.355 618 HB2 ALA 116 HB2 ALA 116 2.805 11.929 28.203 619 HB3 ALA 116 HB3 ALA 116 1.679 10.901 27.320 620 HA PRO 117 HA PRO 117 4.607 15.701 24.810 621 HB2 PRO 117 HB2 PRO 117 4.633 17.481 26.904 622 HB3 PRO 117 HB1 PRO 117 3.404 17.364 25.662 623 HG2 PRO 117 HG2 PRO 117 3.370 16.224 28.422 624 HG3 PRO 117 HG1 PRO 117 2.044 16.951 27.491 625 HD2 PRO 117 HD2 PRO 117 2.318 14.286 27.779 626 HD3 PRO 117 HD1 PRO 117 1.672 14.987 26.272 627 H GLY 118 HN GLY 118 6.501 15.135 24.447 628 HA2 GLY 118 HA2 GLY 118 8.386 14.578 26.509 629 HA3 GLY 118 HA1 GLY 118 8.654 14.636 24.763 630 H THR 119 HN THR 119 9.166 16.512 23.791 631 HA THR 119 HA THR 119 10.200 18.536 25.659 632 HB THR 119 HB THR 119 11.208 18.166 22.884 633 HG1 THR 119 HG1 THR 119 11.278 16.287 24.611 634 HG21 THR 119 HG21 THR 119 12.439 19.229 25.427 635 HG22 THR 119 HG22 THR 119 11.857 20.185 24.066 636 HG23 THR 119 HG23 THR 119 13.262 19.136 23.870 637 H LYS 120 HN LYS 120 8.488 19.863 25.659 638 HA LYS 120 HA LYS 120 7.344 21.753 25.117 639 HB2 LYS 120 HB2 LYS 120 8.795 21.773 22.467 640 HB3 LYS 120 HB1 LYS 120 7.997 23.126 23.248 641 HG2 LYS 120 HG2 LYS 120 10.456 21.703 24.225 642 HG3 LYS 120 HG1 LYS 120 10.427 23.265 23.410 643 HD2 LYS 120 HD2 LYS 120 9.151 24.219 25.267 644 HD3 LYS 120 HD1 LYS 120 9.129 22.645 26.066 645 HE2 LYS 120 HE2 LYS 120 10.845 24.095 27.023 646 HE3 LYS 120 HE1 LYS 120 11.559 22.687 26.245 647 HZ1 LYS 120 HZ1 LYS 120 12.073 24.077 24.313 648 HZ2 LYS 120 HZ2 LYS 120 12.796 24.663 25.704 649 HZ3 LYS 120 HZ3 LYS 120 11.438 25.438 25.090 650 H GLY 121 HN GLY 121 6.873 18.877 23.570 651 HA2 GLY 121 HA2 GLY 121 4.659 20.019 22.050 652 HA3 GLY 121 HA1 GLY 121 5.600 18.640 21.463 653 HA PRO 122 HA PRO 122 1.681 18.191 24.690 654 HB2 PRO 122 HB2 PRO 122 0.481 17.885 21.977 655 HB3 PRO 122 HB1 PRO 122 -0.292 18.337 23.504 656 HG2 PRO 122 HG2 PRO 122 0.417 20.223 21.832 657 HG3 PRO 122 HG1 PRO 122 0.759 20.420 23.563 658 HD2 PRO 122 HD2 PRO 122 2.603 19.811 21.315 659 HD3 PRO 122 HD1 PRO 122 2.898 20.710 22.822 660 H PHE 123 HN PHE 123 2.827 16.194 21.913 661 HA PHE 123 HA PHE 123 3.061 14.062 23.601 662 HB2 PHE 123 HB2 PHE 123 1.441 12.387 22.757 663 HB3 PHE 123 HB1 PHE 123 0.667 13.718 23.581 664 HD1 PHE 123 HD1 PHE 123 -0.572 15.461 22.153 665 HD2 PHE 123 HD2 PHE 123 0.878 11.756 20.614 666 HE1 PHE 123 HE1 PHE 123 -2.132 15.628 20.281 667 HE2 PHE 123 HE2 PHE 123 -0.681 11.927 18.741 668 HZ PHE 123 HZ PHE 123 -2.194 13.865 18.562 669 H ASP 124 HN ASP 124 3.964 12.226 22.836 670 HA ASP 124 HA ASP 124 5.458 12.610 20.324 671 HB2 ASP 124 HB2 ASP 124 6.186 11.300 22.964 672 HB3 ASP 124 HB1 ASP 124 7.149 11.082 21.511 673 H LEU 125 HN LEU 125 4.557 11.190 18.852 674 HA LEU 125 HA LEU 125 3.789 8.564 19.897 675 HB2 LEU 125 HB2 LEU 125 1.873 10.091 19.392 676 HB3 LEU 125 HB1 LEU 125 2.398 10.144 17.730 677 HG LEU 125 HG LEU 125 0.435 8.735 18.171 678 HD11 LEU 125 HD11 LEU 125 2.815 7.263 17.058 679 HD12 LEU 125 HD12 LEU 125 1.693 8.289 16.164 680 HD13 LEU 125 HD13 LEU 125 1.138 6.764 16.859 681 HD21 LEU 125 HD21 LEU 125 2.380 6.996 19.682 682 HD22 LEU 125 HD22 LEU 125 0.768 6.496 19.201 683 HD23 LEU 125 HD23 LEU 125 0.969 7.830 20.337 684 H TYR 126 HN TYR 126 4.726 6.859 18.858 685 HA TYR 126 HA TYR 126 5.238 6.838 16.095 686 HB2 TYR 126 HB2 TYR 126 7.673 6.730 16.036 687 HB3 TYR 126 HB1 TYR 126 7.146 8.300 16.615 688 HD1 TYR 126 HD1 TYR 126 7.561 8.961 18.944 689 HD2 TYR 126 HD2 TYR 126 8.942 5.162 17.522 690 HE1 TYR 126 HE1 TYR 126 9.053 8.740 20.888 691 HE2 TYR 126 HE2 TYR 126 10.354 4.947 19.416 692 HH TYR 126 HH TYR 126 11.528 6.555 20.991 693 H SER 127 HN SER 127 6.213 4.983 15.327 694 HA SER 127 HA SER 127 6.607 2.845 17.264 695 HB2 SER 127 HB2 SER 127 4.542 2.518 15.784 696 HB3 SER 127 HB1 SER 127 5.620 2.568 14.391 697 HG SER 127 HG SER 127 5.680 0.533 14.705 698 H LEU 128 HN LEU 128 8.629 1.983 17.056 699 HA LEU 128 HA LEU 128 10.681 3.214 15.671 700 HB2 LEU 128 HB2 LEU 128 10.331 0.718 17.127 701 HB3 LEU 128 HB1 LEU 128 11.516 0.591 15.867 702 HG LEU 128 HG LEU 128 12.811 2.430 16.835 703 HD11 LEU 128 HD11 LEU 128 10.723 2.488 18.959 704 HD12 LEU 128 HD12 LEU 128 11.094 3.759 17.790 705 HD13 LEU 128 HD13 LEU 128 12.277 3.313 19.024 706 HD21 LEU 128 HD21 LEU 128 13.536 1.321 18.875 707 HD22 LEU 128 HD22 LEU 128 13.298 0.175 17.555 708 HD23 LEU 128 HD23 LEU 128 12.092 0.310 18.837 709 H GLY 129 HN GLY 129 11.960 2.597 13.909 710 HA2 GLY 129 HA2 GLY 129 10.519 1.873 11.600 711 HA3 GLY 129 HA1 GLY 129 12.241 2.175 11.708 712 H ALA 130 HN ALA 130 11.577 0.418 10.034 713 HA ALA 130 HA ALA 130 10.868 -2.131 10.519 714 HB1 ALA 130 HB1 ALA 130 11.859 -2.696 8.437 715 HB2 ALA 130 HB2 ALA 130 12.861 -1.237 8.480 716 HB3 ALA 130 HB3 ALA 130 11.097 -1.110 8.373 717 H ASP 131 HN ASP 131 14.109 -0.901 11.245 718 HA ASP 131 HA ASP 131 15.085 -3.639 11.475 719 HB2 ASP 131 HB2 ASP 131 17.280 -2.731 11.665 720 HB3 ASP 131 HB1 ASP 131 16.467 -1.830 10.397 721 H GLY 132 HN GLY 132 13.542 -1.451 13.423 722 HA2 GLY 132 HA2 GLY 132 12.959 -1.810 15.655 723 HA3 GLY 132 HA1 GLY 132 14.245 -3.003 15.773 724 H LYS 133 HN LYS 133 14.853 0.172 14.485 725 HA LYS 133 HA LYS 133 16.146 0.942 16.999 726 HB2 LYS 133 HB2 LYS 133 17.781 0.203 15.318 727 HB3 LYS 133 HB1 LYS 133 17.131 1.342 14.162 728 HG2 LYS 133 HG2 LYS 133 19.192 2.201 15.016 729 HG3 LYS 133 HG1 LYS 133 17.886 3.188 15.673 730 HD2 LYS 133 HD2 LYS 133 18.011 2.047 17.777 731 HD3 LYS 133 HD1 LYS 133 19.173 0.886 17.136 732 HE2 LYS 133 HE2 LYS 133 20.280 2.542 18.504 733 HE3 LYS 133 HE1 LYS 133 20.791 2.700 16.830 734 HZ1 LYS 133 HZ1 LYS 133 18.731 4.424 18.136 735 HZ2 LYS 133 HZ2 LYS 133 19.374 4.634 16.585 736 HZ3 LYS 133 HZ3 LYS 133 20.342 4.833 17.931 737 H GLU 134 HN GLU 134 15.674 3.041 17.623 738 HA GLU 134 HA GLU 134 13.783 4.484 16.050 739 HB2 GLU 134 HB2 GLU 134 14.336 6.326 17.894 740 HB3 GLU 134 HB1 GLU 134 13.261 4.988 18.211 741 HG2 GLU 134 HG2 GLU 134 14.622 5.277 20.107 742 HG3 GLU 134 HG1 GLU 134 15.212 3.843 19.278 743 H GLY 135 HN GLY 135 14.383 5.465 14.279 744 HA2 GLY 135 HA2 GLY 135 16.709 7.187 14.259 745 HA3 GLY 135 HA1 GLY 135 16.802 5.789 13.203 746 H GLY 136 HN GLY 136 17.103 7.762 11.761 747 HA2 GLY 136 HA2 GLY 136 14.476 8.538 10.703 748 HA3 GLY 136 HA1 GLY 136 15.904 9.568 10.587 749 H SER 137 HN SER 137 14.080 7.973 8.670 750 HA SER 137 HA SER 137 15.783 7.214 6.621 751 HB2 SER 137 HB2 SER 137 14.930 4.993 8.482 752 HB3 SER 137 HB1 SER 137 15.358 4.676 6.795 753 HG SER 137 HG SER 137 17.068 6.019 8.605 754 H ASP 138 HN ASP 138 14.354 5.554 5.144 755 HA ASP 138 HA ASP 138 11.744 6.749 4.914 756 HB2 ASP 138 HB2 ASP 138 13.142 4.532 3.437 757 HB3 ASP 138 HB1 ASP 138 11.434 4.862 3.189 758 H ASN 139 HN ASN 139 12.519 3.296 5.172 759 HA ASN 139 HA ASN 139 10.012 3.033 6.643 760 HB2 ASN 139 HB2 ASN 139 10.113 0.616 6.136 761 HB3 ASN 139 HB1 ASN 139 10.121 1.606 4.687 762 HD21 ASN 139 HD21 ASN 139 11.905 -0.594 6.653 763 HD22 ASN 139 HD22 ASN 139 13.203 -0.840 5.550 764 H ASP 140 HN ASP 140 13.218 3.240 7.255 765 HA ASP 140 HA ASP 140 13.008 1.607 9.683 766 HB2 ASP 140 HB2 ASP 140 15.440 2.922 8.440 767 HB3 ASP 140 HB1 ASP 140 15.463 2.030 9.952 768 H ALA 141 HN ALA 141 12.013 4.458 8.984 769 HA ALA 141 HA ALA 141 13.162 6.038 11.130 770 HB1 ALA 141 HB1 ALA 141 11.689 7.793 10.398 771 HB2 ALA 141 HB2 ALA 141 10.846 6.665 9.336 772 HB3 ALA 141 HB3 ALA 141 12.523 7.094 9.005 773 H ASP 142 HN ASP 142 11.899 6.930 12.823 774 HA ASP 142 HA ASP 142 9.939 5.148 13.970 775 HB2 ASP 142 HB2 ASP 142 10.456 8.043 14.732 776 HB3 ASP 142 HB1 ASP 142 9.660 6.808 15.688 777 H ILE 143 HN ILE 143 7.993 5.111 13.114 778 HA ILE 143 HA ILE 143 7.080 7.515 11.821 779 HB ILE 143 HB ILE 143 5.338 6.067 10.685 780 HG12 ILE 143 HG12 ILE 143 5.953 3.602 10.490 781 HG13 ILE 143 HG11 ILE 143 6.973 3.810 11.903 782 HG21 ILE 143 HG21 ILE 143 8.230 5.413 10.238 783 HG22 ILE 143 HG22 ILE 143 7.339 6.774 9.544 784 HG23 ILE 143 HG23 ILE 143 6.935 5.116 9.080 785 HD11 ILE 143 HD11 ILE 143 5.051 4.282 13.246 786 HD12 ILE 143 HD12 ILE 143 4.762 2.776 12.355 787 HD13 ILE 143 HD13 ILE 143 4.018 4.293 11.832 788 H GLY 144 HN GLY 144 5.592 8.758 12.578 789 HA2 GLY 144 HA2 GLY 144 3.425 7.897 14.121 790 HA3 GLY 144 HA1 GLY 144 4.706 8.526 15.153 791 H ASN 145 HN ASN 145 2.554 9.910 15.303 792 HA ASN 145 HA ASN 145 2.954 12.148 13.470 793 HB2 ASN 145 HB2 ASN 145 0.746 12.896 14.012 794 HB3 ASN 145 HB1 ASN 145 0.594 11.161 13.805 795 HD21 ASN 145 HD21 ASN 145 0.397 13.800 15.965 796 HD22 ASN 145 HD22 ASN 145 -0.207 12.922 17.326 797 H TRP 146 HN TRP 146 2.850 14.313 14.672 798 HA TRP 146 HA TRP 146 3.951 14.039 17.362 799 HB2 TRP 146 HB2 TRP 146 5.688 14.027 15.406 800 HB3 TRP 146 HB1 TRP 146 5.313 15.742 15.315 801 HD1 TRP 146 HD1 TRP 146 6.193 17.281 17.331 802 HE1 TRP 146 HE1 TRP 146 8.023 16.857 19.108 803 HE3 TRP 146 HE3 TRP 146 6.627 12.238 16.852 804 HZ2 TRP 146 HZ2 TRP 146 9.446 14.668 20.147 805 HZ3 TRP 146 HZ3 TRP 146 8.244 11.040 18.266 806 HH2 TRP 146 HH2 TRP 146 9.618 12.234 19.878 807 H ASP 147 HN ASP 147 2.980 15.548 18.563 808 HA ASP 147 HA ASP 147 1.858 17.876 17.159 809 HB2 ASP 147 HB2 ASP 147 0.241 16.288 18.373 810 HB3 ASP 147 HB1 ASP 147 0.984 16.846 19.865 811 H ASN 148 HN ASN 148 3.112 19.543 17.465 812 HA ASN 148 HA ASN 148 4.214 19.990 20.087 813 HB2 ASN 148 HB2 ASN 148 6.455 20.491 19.222 814 HB3 ASN 148 HB1 ASN 148 6.002 18.843 18.833 815 HD21 ASN 148 HD21 ASN 148 6.856 21.903 17.623 816 HD22 ASN 148 HD22 ASN 148 6.896 21.492 15.945 Start of MODEL 9 1 H1 MET 39 HT1 MET 39 2.916 5.926 -0.585 2 H2 MET 39 HT2 MET 39 3.176 6.172 -2.203 3 H3 MET 39 HT3 MET 39 3.929 7.193 -1.092 4 HA MET 39 HA MET 39 5.468 5.616 -2.049 5 HB2 MET 39 HB2 MET 39 4.852 4.785 0.819 6 HB3 MET 39 HB1 MET 39 6.360 4.584 -0.033 7 HG2 MET 39 HG2 MET 39 6.642 6.341 1.503 8 HG3 MET 39 HG1 MET 39 6.593 7.058 -0.103 9 HE1 MET 39 HE1 MET 39 6.240 9.451 1.023 10 HE2 MET 39 HE2 MET 39 6.274 8.701 2.618 11 HE3 MET 39 HE3 MET 39 4.962 9.797 2.190 12 H SER 40 HN SER 40 4.814 4.150 -3.570 13 HA SER 40 HA SER 40 3.581 1.748 -2.480 14 HB2 SER 40 HB2 SER 40 2.009 2.984 -3.941 15 HB3 SER 40 HB1 SER 40 3.172 2.885 -5.259 16 HG SER 40 HG SER 40 1.429 1.019 -4.290 17 H ARG 41 HN ARG 41 5.543 0.877 -2.066 18 HA ARG 41 HA ARG 41 6.757 -0.595 -4.225 19 HB2 ARG 41 HB2 ARG 41 8.300 1.307 -2.437 20 HB3 ARG 41 HB1 ARG 41 9.084 -0.022 -3.260 21 HG2 ARG 41 HG2 ARG 41 8.497 1.009 -5.414 22 HG3 ARG 41 HG1 ARG 41 7.721 2.341 -4.549 23 HD2 ARG 41 HD2 ARG 41 9.840 2.894 -3.480 24 HD3 ARG 41 HD1 ARG 41 10.619 1.543 -4.290 25 HE ARG 41 HE ARG 41 9.444 3.217 -6.198 26 HH11 ARG 41 HH11 ARG 41 12.124 3.335 -3.859 27 HH12 ARG 41 HH12 ARG 41 13.118 4.287 -4.838 28 HH21 ARG 41 HH21 ARG 41 10.833 4.554 -7.545 29 HH22 ARG 41 HH22 ARG 41 12.375 4.994 -6.979 30 HA PRO 42 HA PRO 42 6.958 -3.721 -0.990 31 HB2 PRO 42 HB2 PRO 42 9.916 -3.812 -1.385 32 HB3 PRO 42 HB1 PRO 42 8.751 -5.143 -1.343 33 HG2 PRO 42 HG2 PRO 42 9.717 -4.354 -3.659 34 HG3 PRO 42 HG1 PRO 42 7.989 -4.715 -3.503 35 HD2 PRO 42 HD2 PRO 42 9.370 -2.070 -3.598 36 HD3 PRO 42 HD1 PRO 42 7.844 -2.562 -4.354 37 H ASP 43 HN ASP 43 6.946 -3.479 1.095 38 HA ASP 43 HA ASP 43 7.205 -2.793 3.169 39 HB2 ASP 43 HB2 ASP 43 10.022 -2.258 2.325 40 HB3 ASP 43 HB1 ASP 43 9.464 -1.765 3.922 41 H GLN 44 HN GLN 44 7.949 -0.492 0.794 42 HA GLN 44 HA GLN 44 7.526 1.866 2.347 43 HB2 GLN 44 HB2 GLN 44 7.090 1.376 -0.597 44 HB3 GLN 44 HB1 GLN 44 7.228 2.939 0.185 45 HG2 GLN 44 HG2 GLN 44 9.440 0.893 0.192 46 HG3 GLN 44 HG1 GLN 44 9.291 2.148 -1.028 47 HE21 GLN 44 HE21 GLN 44 8.387 4.188 0.774 48 HE22 GLN 44 HE22 GLN 44 9.768 4.656 1.688 49 H ALA 45 HN ALA 45 5.512 -0.365 0.608 50 HA ALA 45 HA ALA 45 3.089 1.067 0.732 51 HB1 ALA 45 HB1 ALA 45 2.026 -1.062 0.183 52 HB2 ALA 45 HB2 ALA 45 3.520 -1.911 0.568 53 HB3 ALA 45 HB3 ALA 45 3.465 -0.810 -0.809 54 H LYS 46 HN LYS 46 4.872 -0.636 3.112 55 HA LYS 46 HA LYS 46 2.559 -0.994 4.826 56 HB2 LYS 46 HB2 LYS 46 5.488 -1.406 5.420 57 HB3 LYS 46 HB1 LYS 46 4.159 -1.917 6.434 58 HG2 LYS 46 HG2 LYS 46 3.459 -3.444 4.549 59 HG3 LYS 46 HG1 LYS 46 4.986 -3.008 3.765 60 HD2 LYS 46 HD2 LYS 46 6.200 -3.767 5.792 61 HD3 LYS 46 HD1 LYS 46 4.663 -4.285 6.472 62 HE2 LYS 46 HE2 LYS 46 5.754 -6.196 5.611 63 HE3 LYS 46 HE1 LYS 46 4.406 -5.822 4.545 64 HZ1 LYS 46 HZ1 LYS 46 7.230 -5.048 4.027 65 HZ2 LYS 46 HZ2 LYS 46 5.934 -4.896 2.934 66 HZ3 LYS 46 HZ3 LYS 46 6.492 -6.409 3.397 67 H VAL 47 HN VAL 47 5.058 1.279 4.162 68 HA VAL 47 HA VAL 47 5.126 2.578 6.706 69 HB VAL 47 HB VAL 47 6.029 3.605 3.989 70 HG11 VAL 47 HG11 VAL 47 6.795 4.548 6.743 71 HG12 VAL 47 HG12 VAL 47 5.772 5.413 5.597 72 HG13 VAL 47 HG13 VAL 47 7.476 5.137 5.228 73 HG21 VAL 47 HG21 VAL 47 7.173 1.551 4.562 74 HG22 VAL 47 HG22 VAL 47 7.623 2.228 6.132 75 HG23 VAL 47 HG23 VAL 47 8.267 2.928 4.647 76 H THR 48 HN THR 48 3.714 3.069 3.566 77 HA THR 48 HA THR 48 2.615 5.584 4.044 78 HB THR 48 HB THR 48 3.096 4.689 1.776 79 HG1 THR 48 HG1 THR 48 0.479 5.189 1.312 80 HG21 THR 48 HG21 THR 48 2.273 2.422 2.082 81 HG22 THR 48 HG22 THR 48 1.514 3.175 0.681 82 HG23 THR 48 HG23 THR 48 0.615 3.015 2.195 83 H VAL 49 HN VAL 49 1.374 2.384 4.809 84 HA VAL 49 HA VAL 49 -1.236 3.500 5.305 85 HB VAL 49 HB VAL 49 -2.007 1.329 5.999 86 HG11 VAL 49 HG11 VAL 49 -0.280 1.099 3.556 87 HG12 VAL 49 HG12 VAL 49 -1.937 1.701 3.642 88 HG13 VAL 49 HG13 VAL 49 -1.597 0.007 3.983 89 HG21 VAL 49 HG21 VAL 49 -0.100 0.545 7.292 90 HG22 VAL 49 HG22 VAL 49 0.860 0.362 5.822 91 HG23 VAL 49 HG23 VAL 49 -0.548 -0.670 6.092 92 H ALA 50 HN ALA 50 1.574 2.520 7.112 93 HA ALA 50 HA ALA 50 0.483 2.634 9.692 94 HB1 ALA 50 HB1 ALA 50 2.779 2.712 10.448 95 HB2 ALA 50 HB2 ALA 50 3.314 3.152 8.833 96 HB3 ALA 50 HB3 ALA 50 2.628 1.546 9.126 97 H LYS 51 HN LYS 51 1.988 5.087 7.615 98 HA LYS 51 HA LYS 51 1.954 6.994 9.614 99 HB2 LYS 51 HB2 LYS 51 2.069 7.381 6.629 100 HB3 LYS 51 HB1 LYS 51 2.352 8.656 7.814 101 HG2 LYS 51 HG2 LYS 51 4.203 7.346 8.769 102 HG3 LYS 51 HG1 LYS 51 3.938 6.111 7.544 103 HD2 LYS 51 HD2 LYS 51 5.764 7.448 6.848 104 HD3 LYS 51 HD1 LYS 51 4.373 7.829 5.828 105 HE2 LYS 51 HE2 LYS 51 3.949 9.857 7.110 106 HE3 LYS 51 HE1 LYS 51 5.247 9.454 8.225 107 HZ1 LYS 51 HZ1 LYS 51 5.562 10.085 5.346 108 HZ2 LYS 51 HZ2 LYS 51 6.822 9.701 6.402 109 HZ3 LYS 51 HZ3 LYS 51 5.913 11.111 6.627 110 H GLY 52 HN GLY 52 -0.542 5.825 7.594 111 HA2 GLY 52 HA2 GLY 52 -2.306 8.062 8.033 112 HA3 GLY 52 HA1 GLY 52 -2.760 6.480 7.397 113 H ASP 53 HN ASP 53 -1.441 5.092 9.573 114 HA ASP 53 HA ASP 53 -3.700 5.052 11.320 115 HB2 ASP 53 HB2 ASP 53 -1.193 3.372 11.264 116 HB3 ASP 53 HB1 ASP 53 -2.443 3.176 12.493 117 H ILE 54 HN ILE 54 -0.421 6.193 11.528 118 HA ILE 54 HA ILE 54 -0.592 6.841 14.279 119 HB ILE 54 HB ILE 54 1.235 8.501 13.891 120 HG12 ILE 54 HG12 ILE 54 0.806 7.699 11.030 121 HG13 ILE 54 HG11 ILE 54 0.639 9.288 11.734 122 HG21 ILE 54 HG21 ILE 54 1.840 6.236 14.382 123 HG22 ILE 54 HG22 ILE 54 2.933 6.904 13.155 124 HG23 ILE 54 HG23 ILE 54 1.655 5.786 12.680 125 HD11 ILE 54 HD11 ILE 54 3.208 7.779 11.429 126 HD12 ILE 54 HD12 ILE 54 3.031 9.408 12.103 127 HD13 ILE 54 HD13 ILE 54 2.644 9.096 10.404 128 H LYS 55 HN LYS 55 -1.763 8.467 11.392 129 HA LYS 55 HA LYS 55 -2.523 10.859 12.753 130 HB2 LYS 55 HB2 LYS 55 -3.319 9.667 10.123 131 HB3 LYS 55 HB1 LYS 55 -4.373 10.884 10.816 132 HG2 LYS 55 HG2 LYS 55 -2.864 11.895 9.225 133 HG3 LYS 55 HG1 LYS 55 -2.487 12.471 10.846 134 HD2 LYS 55 HD2 LYS 55 -0.647 10.857 10.954 135 HD3 LYS 55 HD1 LYS 55 -1.024 10.329 9.317 136 HE2 LYS 55 HE2 LYS 55 -0.565 12.580 8.493 137 HE3 LYS 55 HE1 LYS 55 -0.185 13.107 10.132 138 HZ1 LYS 55 HZ1 LYS 55 1.265 11.027 8.597 139 HZ2 LYS 55 HZ2 LYS 55 1.703 11.573 10.148 140 HZ3 LYS 55 HZ3 LYS 55 1.791 12.588 8.830 141 H ALA 56 HN ALA 56 -3.956 7.752 12.353 142 HA ALA 56 HA ALA 56 -6.530 8.306 13.384 143 HB1 ALA 56 HB1 ALA 56 -6.708 5.896 13.703 144 HB2 ALA 56 HB2 ALA 56 -4.962 5.749 13.527 145 HB3 ALA 56 HB3 ALA 56 -5.944 6.247 12.142 146 H ILE 57 HN ILE 57 -3.575 7.088 14.908 147 HA ILE 57 HA ILE 57 -4.597 6.799 17.526 148 HB ILE 57 HB ILE 57 -1.713 7.460 16.827 149 HG12 ILE 57 HG12 ILE 57 -2.864 4.719 17.168 150 HG13 ILE 57 HG11 ILE 57 -2.776 5.474 15.566 151 HG21 ILE 57 HG21 ILE 57 -1.229 6.213 18.897 152 HG22 ILE 57 HG22 ILE 57 -2.954 5.937 19.134 153 HG23 ILE 57 HG23 ILE 57 -2.308 7.574 19.223 154 HD11 ILE 57 HD11 ILE 57 -0.517 4.774 17.426 155 HD12 ILE 57 HD12 ILE 57 -0.355 5.641 15.898 156 HD13 ILE 57 HD13 ILE 57 -0.973 3.990 15.903 157 H ALA 58 HN ALA 58 -2.961 9.481 15.913 158 HA ALA 58 HA ALA 58 -2.779 11.205 18.133 159 HB1 ALA 58 HB1 ALA 58 -2.412 12.986 16.500 160 HB2 ALA 58 HB2 ALA 58 -2.989 11.927 15.213 161 HB3 ALA 58 HB3 ALA 58 -1.500 11.538 16.075 162 H ALA 59 HN ALA 59 -5.445 10.342 16.181 163 HA ALA 59 HA ALA 59 -7.023 12.683 16.830 164 HB1 ALA 59 HB1 ALA 59 -8.768 11.576 15.511 165 HB2 ALA 59 HB2 ALA 59 -7.736 10.150 15.357 166 HB3 ALA 59 HB3 ALA 59 -7.249 11.675 14.620 167 H ALA 60 HN ALA 60 -6.686 9.335 17.757 168 HA ALA 60 HA ALA 60 -8.981 9.456 19.472 169 HB1 ALA 60 HB1 ALA 60 -8.352 7.214 20.147 170 HB2 ALA 60 HB2 ALA 60 -6.855 7.364 19.261 171 HB3 ALA 60 HB3 ALA 60 -8.399 7.352 18.384 172 H LEU 61 HN LEU 61 -5.541 9.847 19.757 173 HA LEU 61 HA LEU 61 -5.330 9.958 22.563 174 HB2 LEU 61 HB2 LEU 61 -3.518 9.859 20.734 175 HB3 LEU 61 HB1 LEU 61 -3.804 11.559 20.492 176 HG LEU 61 HG LEU 61 -1.761 10.967 21.791 177 HD11 LEU 61 HD11 LEU 61 -3.773 12.661 23.241 178 HD12 LEU 61 HD12 LEU 61 -2.690 13.195 21.962 179 HD13 LEU 61 HD13 LEU 61 -2.035 12.675 23.515 180 HD21 LEU 61 HD21 LEU 61 -1.970 10.331 24.113 181 HD22 LEU 61 HD22 LEU 61 -2.701 9.107 23.063 182 HD23 LEU 61 HD23 LEU 61 -3.718 10.260 23.938 183 H ASP 62 HN ASP 62 -6.432 12.128 20.107 184 HA ASP 62 HA ASP 62 -6.783 14.437 21.761 185 HB2 ASP 62 HB2 ASP 62 -6.541 14.516 19.273 186 HB3 ASP 62 HB1 ASP 62 -8.106 13.733 19.127 187 H MET 63 HN MET 63 -8.478 11.506 21.319 188 HA MET 63 HA MET 63 -10.917 12.597 22.395 189 HB2 MET 63 HB2 MET 63 -10.237 9.685 21.874 190 HB3 MET 63 HB1 MET 63 -11.805 10.265 22.408 191 HG2 MET 63 HG2 MET 63 -11.930 11.586 20.286 192 HG3 MET 63 HG1 MET 63 -10.477 10.756 19.744 193 HE1 MET 63 HE1 MET 63 -10.449 7.926 19.643 194 HE2 MET 63 HE2 MET 63 -11.917 6.974 19.836 195 HE3 MET 63 HE3 MET 63 -11.229 7.818 21.222 196 H TYR 64 HN TYR 64 -8.127 10.772 23.556 197 HA TYR 64 HA TYR 64 -9.035 10.475 26.261 198 HB2 TYR 64 HB2 TYR 64 -6.824 9.543 25.326 199 HB3 TYR 64 HB1 TYR 64 -6.180 11.180 25.462 200 HD1 TYR 64 HD1 TYR 64 -6.069 12.273 27.780 201 HD2 TYR 64 HD2 TYR 64 -7.032 8.148 27.294 202 HE1 TYR 64 HE1 TYR 64 -5.642 11.910 30.077 203 HE2 TYR 64 HE2 TYR 64 -6.597 7.772 29.578 204 HH TYR 64 HH TYR 64 -6.396 10.427 31.689 205 H LYS 65 HN LYS 65 -7.584 13.104 24.377 206 HA LYS 65 HA LYS 65 -7.307 15.056 26.314 207 HB2 LYS 65 HB2 LYS 65 -6.448 15.413 24.092 208 HB3 LYS 65 HB1 LYS 65 -8.069 15.396 23.416 209 HG2 LYS 65 HG2 LYS 65 -8.613 17.412 24.560 210 HG3 LYS 65 HG1 LYS 65 -7.018 17.482 25.333 211 HD2 LYS 65 HD2 LYS 65 -6.010 17.606 23.067 212 HD3 LYS 65 HD1 LYS 65 -7.623 17.637 22.370 213 HE2 LYS 65 HE2 LYS 65 -6.824 19.914 22.452 214 HE3 LYS 65 HE1 LYS 65 -8.074 19.731 23.664 215 HZ1 LYS 65 HZ1 LYS 65 -5.145 19.697 24.233 216 HZ2 LYS 65 HZ2 LYS 65 -6.384 19.628 25.394 217 HZ3 LYS 65 HZ3 LYS 65 -6.172 20.985 24.469 218 H LEU 66 HN LEU 66 -10.123 14.103 24.463 219 HA LEU 66 HA LEU 66 -11.918 16.079 25.508 220 HB2 LEU 66 HB2 LEU 66 -12.281 14.986 23.349 221 HB3 LEU 66 HB1 LEU 66 -12.373 13.427 24.136 222 HG LEU 66 HG LEU 66 -14.468 14.160 25.249 223 HD11 LEU 66 HD11 LEU 66 -14.130 16.543 25.231 224 HD12 LEU 66 HD12 LEU 66 -15.629 16.135 24.395 225 HD13 LEU 66 HD13 LEU 66 -14.192 16.571 23.469 226 HD21 LEU 66 HD21 LEU 66 -15.867 14.003 23.242 227 HD22 LEU 66 HD22 LEU 66 -14.549 12.834 23.221 228 HD23 LEU 66 HD23 LEU 66 -14.447 14.295 22.238 229 H ASP 67 HN ASP 67 -10.984 12.829 26.321 230 HA ASP 67 HA ASP 67 -13.077 12.222 28.133 231 HB2 ASP 67 HB2 ASP 67 -11.785 10.619 26.803 232 HB3 ASP 67 HB1 ASP 67 -10.342 11.039 27.707 233 H ASN 68 HN ASN 68 -9.917 13.762 28.473 234 HA ASN 68 HA ASN 68 -10.377 14.243 31.432 235 HB2 ASN 68 HB2 ASN 68 -7.702 13.811 30.111 236 HB3 ASN 68 HB1 ASN 68 -8.044 14.337 31.747 237 HD21 ASN 68 HD21 ASN 68 -9.640 11.651 30.097 238 HD22 ASN 68 HD22 ASN 68 -9.069 10.422 31.102 239 H PHE 69 HN PHE 69 -11.001 15.686 29.009 240 HA PHE 69 HA PHE 69 -10.810 17.804 28.140 241 HB2 PHE 69 HB2 PHE 69 -11.050 19.555 29.987 242 HB3 PHE 69 HB1 PHE 69 -12.264 18.290 29.921 243 HD1 PHE 69 HD1 PHE 69 -9.260 19.335 31.647 244 HD2 PHE 69 HD2 PHE 69 -12.585 16.891 31.676 245 HE1 PHE 69 HE1 PHE 69 -8.826 18.891 34.020 246 HE2 PHE 69 HE2 PHE 69 -12.251 16.340 34.020 247 HZ PHE 69 HZ PHE 69 -10.335 17.346 35.243 248 H ALA 70 HN ALA 70 -8.308 16.585 28.279 249 HA ALA 70 HA ALA 70 -6.447 18.615 27.919 250 HB1 ALA 70 HB1 ALA 70 -5.104 18.316 29.984 251 HB2 ALA 70 HB2 ALA 70 -6.401 17.275 30.616 252 HB3 ALA 70 HB3 ALA 70 -6.719 18.970 30.323 253 H TYR 71 HN TYR 71 -4.329 17.634 27.556 254 HA TYR 71 HA TYR 71 -4.524 14.927 26.715 255 HB2 TYR 71 HB2 TYR 71 -2.322 16.962 26.667 256 HB3 TYR 71 HB1 TYR 71 -1.984 15.279 26.280 257 HD1 TYR 71 HD1 TYR 71 -4.178 14.366 24.767 258 HD2 TYR 71 HD2 TYR 71 -2.391 18.211 24.724 259 HE1 TYR 71 HE1 TYR 71 -4.958 14.646 22.548 260 HE2 TYR 71 HE2 TYR 71 -3.166 18.539 22.419 261 HH TYR 71 HH TYR 71 -5.517 16.601 20.955 262 HA PRO 72 HA PRO 72 -3.005 12.724 30.249 263 HB2 PRO 72 HB2 PRO 72 -1.395 10.870 28.980 264 HB3 PRO 72 HB1 PRO 72 -3.162 10.759 29.006 265 HG2 PRO 72 HG2 PRO 72 -1.327 11.804 26.895 266 HG3 PRO 72 HG1 PRO 72 -2.741 10.748 26.725 267 HD2 PRO 72 HD2 PRO 72 -2.867 13.348 26.180 268 HD3 PRO 72 HD1 PRO 72 -4.227 12.495 26.930 269 H SER 73 HN SER 73 -0.930 12.470 31.552 270 HA SER 73 HA SER 73 1.143 14.245 30.502 271 HB2 SER 73 HB2 SER 73 2.065 13.998 32.852 272 HB3 SER 73 HB1 SER 73 0.464 14.734 32.781 273 HG SER 73 HG SER 73 -0.284 13.168 33.831 274 H THR 74 HN THR 74 3.458 13.371 30.560 275 HA THR 74 HA THR 74 3.263 10.718 29.518 276 HB THR 74 HB THR 74 4.881 12.639 28.713 277 HG1 THR 74 HG1 THR 74 6.450 10.690 28.265 278 HG21 THR 74 HG21 THR 74 6.077 12.851 30.882 279 HG22 THR 74 HG22 THR 74 7.158 12.419 29.561 280 HG23 THR 74 HG23 THR 74 6.632 11.186 30.707 281 H GLN 75 HN GLN 75 3.470 11.785 32.599 282 HA GLN 75 HA GLN 75 4.512 9.182 33.386 283 HB2 GLN 75 HB2 GLN 75 5.497 11.023 34.644 284 HB3 GLN 75 HB1 GLN 75 3.896 11.601 35.082 285 HG2 GLN 75 HG2 GLN 75 5.017 10.407 36.922 286 HG3 GLN 75 HG1 GLN 75 3.492 9.670 36.445 287 HE21 GLN 75 HE21 GLN 75 6.480 9.286 34.625 288 HE22 GLN 75 HE22 GLN 75 6.686 7.620 34.991 289 H GLN 76 HN GLN 76 1.689 11.302 34.324 290 HA GLN 76 HA GLN 76 0.364 9.005 35.482 291 HB2 GLN 76 HB2 GLN 76 -0.722 11.768 34.936 292 HB3 GLN 76 HB1 GLN 76 -1.432 10.543 35.966 293 HG2 GLN 76 HG2 GLN 76 0.426 10.764 37.526 294 HG3 GLN 76 HG1 GLN 76 1.183 11.953 36.465 295 HE21 GLN 76 HE21 GLN 76 0.264 12.236 39.229 296 HE22 GLN 76 HE22 GLN 76 -0.856 13.546 39.210 297 H GLY 77 HN GLY 77 -0.021 11.079 32.693 298 HA2 GLY 77 HA2 GLY 77 -2.360 9.769 31.815 299 HA3 GLY 77 HA1 GLY 77 -1.380 10.871 30.895 300 H LEU 78 HN LEU 78 1.027 9.042 31.433 301 HA LEU 78 HA LEU 78 0.676 7.513 29.034 302 HB2 LEU 78 HB2 LEU 78 2.892 8.483 29.802 303 HB3 LEU 78 HB1 LEU 78 2.928 7.257 31.046 304 HG LEU 78 HG LEU 78 2.872 6.533 28.114 305 HD11 LEU 78 HD11 LEU 78 5.287 6.988 29.856 306 HD12 LEU 78 HD12 LEU 78 4.780 8.002 28.506 307 HD13 LEU 78 HD13 LEU 78 5.295 6.341 28.217 308 HD21 LEU 78 HD21 LEU 78 3.908 4.450 28.890 309 HD22 LEU 78 HD22 LEU 78 2.374 4.720 29.719 310 HD23 LEU 78 HD23 LEU 78 3.894 5.051 30.547 311 H GLU 79 HN GLU 79 1.048 6.668 32.514 312 HA GLU 79 HA GLU 79 0.535 4.009 32.218 313 HB2 GLU 79 HB2 GLU 79 1.381 5.315 34.242 314 HB3 GLU 79 HB1 GLU 79 -0.309 5.731 34.532 315 HG2 GLU 79 HG2 GLU 79 -0.834 3.352 34.470 316 HG3 GLU 79 HG1 GLU 79 0.912 3.064 34.351 317 H ALA 80 HN ALA 80 -1.501 6.849 32.472 318 HA ALA 80 HA ALA 80 -3.973 5.430 32.684 319 HB1 ALA 80 HB1 ALA 80 -3.678 7.653 33.621 320 HB2 ALA 80 HB2 ALA 80 -4.982 7.627 32.391 321 HB3 ALA 80 HB3 ALA 80 -3.415 8.265 31.993 322 H LEU 81 HN LEU 81 -1.979 5.984 30.062 323 HA LEU 81 HA LEU 81 -4.185 6.093 28.170 324 HB2 LEU 81 HB2 LEU 81 -1.902 7.333 27.992 325 HB3 LEU 81 HB1 LEU 81 -1.279 5.770 27.504 326 HG LEU 81 HG LEU 81 -2.831 5.756 25.618 327 HD11 LEU 81 HD11 LEU 81 -4.585 7.187 26.469 328 HD12 LEU 81 HD12 LEU 81 -3.934 7.864 24.977 329 HD13 LEU 81 HD13 LEU 81 -3.469 8.551 26.531 330 HD21 LEU 81 HD21 LEU 81 -0.520 6.533 25.367 331 HD22 LEU 81 HD22 LEU 81 -1.021 8.166 25.786 332 HD23 LEU 81 HD23 LEU 81 -1.607 7.419 24.300 333 H VAL 82 HN VAL 82 -2.004 3.952 29.632 334 HA VAL 82 HA VAL 82 -2.693 1.735 27.831 335 HB VAL 82 HB VAL 82 -0.727 1.787 30.141 336 HG11 VAL 82 HG11 VAL 82 -1.446 -0.452 29.608 337 HG12 VAL 82 HG12 VAL 82 0.227 -0.209 29.096 338 HG13 VAL 82 HG13 VAL 82 -1.074 -0.192 27.904 339 HG21 VAL 82 HG21 VAL 82 1.029 1.972 28.430 340 HG22 VAL 82 HG22 VAL 82 -0.044 3.372 28.443 341 HG23 VAL 82 HG23 VAL 82 -0.216 2.144 27.191 342 H LYS 83 HN LYS 83 -3.007 2.797 31.135 343 HA LYS 83 HA LYS 83 -4.725 0.561 31.911 344 HB2 LYS 83 HB2 LYS 83 -2.574 0.262 32.912 345 HB3 LYS 83 HB1 LYS 83 -2.406 1.964 33.237 346 HG2 LYS 83 HG2 LYS 83 -3.971 1.799 35.064 347 HG3 LYS 83 HG1 LYS 83 -4.285 0.101 34.661 348 HD2 LYS 83 HD2 LYS 83 -2.073 -0.543 35.176 349 HD3 LYS 83 HD1 LYS 83 -1.520 1.124 35.253 350 HE2 LYS 83 HE2 LYS 83 -3.505 -0.100 37.155 351 HE3 LYS 83 HE1 LYS 83 -1.772 0.006 37.463 352 HZ1 LYS 83 HZ1 LYS 83 -3.625 2.307 37.082 353 HZ2 LYS 83 HZ2 LYS 83 -1.947 2.431 37.253 354 HZ3 LYS 83 HZ3 LYS 83 -2.869 1.813 38.503 355 H LYS 84 HN LYS 84 -6.427 1.318 33.463 356 HA LYS 84 HA LYS 84 -7.684 3.641 32.510 357 HB2 LYS 84 HB2 LYS 84 -8.204 2.171 35.102 358 HB3 LYS 84 HB1 LYS 84 -9.278 3.355 34.372 359 HG2 LYS 84 HG2 LYS 84 -9.524 1.954 32.412 360 HG3 LYS 84 HG1 LYS 84 -8.446 0.749 33.105 361 HD2 LYS 84 HD2 LYS 84 -10.675 -0.002 33.465 362 HD3 LYS 84 HD1 LYS 84 -10.066 0.558 35.021 363 HE2 LYS 84 HE2 LYS 84 -11.237 2.701 34.682 364 HE3 LYS 84 HE1 LYS 84 -11.859 2.101 33.148 365 HZ1 LYS 84 HZ1 LYS 84 -12.403 0.937 35.814 366 HZ2 LYS 84 HZ2 LYS 84 -13.015 0.351 34.358 367 HZ3 LYS 84 HZ3 LYS 84 -13.469 1.873 34.912 368 HA PRO 85 HA PRO 85 -5.981 7.274 33.960 369 HB2 PRO 85 HB2 PRO 85 -8.327 8.559 34.817 370 HB3 PRO 85 HB1 PRO 85 -7.616 8.611 33.201 371 HG2 PRO 85 HG2 PRO 85 -9.795 6.868 34.246 372 HG3 PRO 85 HG1 PRO 85 -9.621 7.617 32.649 373 HD2 PRO 85 HD2 PRO 85 -9.142 5.049 32.963 374 HD3 PRO 85 HD1 PRO 85 -8.062 6.027 31.946 375 H THR 86 HN THR 86 -5.009 8.044 35.596 376 HA THR 86 HA THR 86 -5.794 7.210 38.288 377 HB THR 86 HB THR 86 -3.519 6.585 37.584 378 HG1 THR 86 HG1 THR 86 -3.157 8.690 39.439 379 HG21 THR 86 HG21 THR 86 -3.029 9.546 37.272 380 HG22 THR 86 HG22 THR 86 -3.066 8.356 35.972 381 HG23 THR 86 HG23 THR 86 -1.787 8.297 37.183 382 H GLY 87 HN GLY 87 -5.890 9.780 36.178 383 HA2 GLY 87 HA2 GLY 87 -5.840 11.817 38.268 384 HA3 GLY 87 HA1 GLY 87 -5.857 12.106 36.531 385 H ASN 88 HN ASN 88 -7.611 13.470 36.579 386 HA ASN 88 HA ASN 88 -10.112 12.170 37.308 387 HB2 ASN 88 HB2 ASN 88 -11.073 14.438 37.827 388 HB3 ASN 88 HB1 ASN 88 -9.812 13.918 38.925 389 HD21 ASN 88 HD21 ASN 88 -7.772 14.946 38.787 390 HD22 ASN 88 HD22 ASN 88 -7.617 16.513 38.090 391 HA PRO 89 HA PRO 89 -11.010 13.071 33.039 392 HB2 PRO 89 HB2 PRO 89 -11.930 10.642 32.417 393 HB3 PRO 89 HB1 PRO 89 -10.210 10.945 32.577 394 HG2 PRO 89 HG2 PRO 89 -12.000 9.449 34.380 395 HG3 PRO 89 HG1 PRO 89 -10.246 9.363 34.213 396 HD2 PRO 89 HD2 PRO 89 -11.790 10.821 36.182 397 HD3 PRO 89 HD1 PRO 89 -10.027 10.631 36.059 398 H GLN 90 HN GLN 90 -13.005 13.045 31.878 399 HA GLN 90 HA GLN 90 -15.365 13.489 33.537 400 HB2 GLN 90 HB2 GLN 90 -14.784 13.894 30.601 401 HB3 GLN 90 HB1 GLN 90 -16.343 14.247 31.343 402 HG2 GLN 90 HG2 GLN 90 -13.758 15.466 32.173 403 HG3 GLN 90 HG1 GLN 90 -14.852 16.229 31.013 404 HE21 GLN 90 HE21 GLN 90 -13.956 17.203 33.535 405 HE22 GLN 90 HE22 GLN 90 -15.337 17.413 34.540 406 HA PRO 91 HA PRO 91 -17.111 9.534 32.575 407 HB2 PRO 91 HB2 PRO 91 -19.683 10.760 31.794 408 HB3 PRO 91 HB1 PRO 91 -19.334 9.609 33.092 409 HG2 PRO 91 HG2 PRO 91 -19.888 12.165 33.643 410 HG3 PRO 91 HG1 PRO 91 -18.676 11.266 34.571 411 HD2 PRO 91 HD2 PRO 91 -18.276 13.265 32.375 412 HD3 PRO 91 HD1 PRO 91 -17.391 13.076 33.902 413 H LYS 92 HN LYS 92 -15.994 8.968 30.789 414 HA LYS 92 HA LYS 92 -17.465 8.713 28.354 415 HB2 LYS 92 HB2 LYS 92 -14.617 9.811 28.376 416 HB3 LYS 92 HB1 LYS 92 -15.434 9.140 26.991 417 HG2 LYS 92 HG2 LYS 92 -15.469 11.429 26.637 418 HG3 LYS 92 HG1 LYS 92 -17.091 11.079 27.231 419 HD2 LYS 92 HD2 LYS 92 -16.532 11.935 29.389 420 HD3 LYS 92 HD1 LYS 92 -14.832 12.088 28.965 421 HE2 LYS 92 HE2 LYS 92 -15.824 14.255 28.846 422 HE3 LYS 92 HE1 LYS 92 -15.502 13.730 27.200 423 HZ1 LYS 92 HZ1 LYS 92 -18.133 13.744 28.578 424 HZ2 LYS 92 HZ2 LYS 92 -17.875 13.064 27.062 425 HZ3 LYS 92 HZ3 LYS 92 -17.651 14.702 27.283 426 H ASN 93 HN ASN 93 -16.721 6.866 27.227 427 HA ASN 93 HA ASN 93 -15.618 4.897 29.013 428 HB2 ASN 93 HB2 ASN 93 -16.530 4.602 26.135 429 HB3 ASN 93 HB1 ASN 93 -16.064 3.280 27.195 430 HD21 ASN 93 HD21 ASN 93 -17.497 2.584 28.778 431 HD22 ASN 93 HD22 ASN 93 -19.127 3.134 28.845 432 H TRP 94 HN TRP 94 -13.559 5.280 29.344 433 HA TRP 94 HA TRP 94 -11.443 5.964 27.708 434 HB2 TRP 94 HB2 TRP 94 -11.376 5.980 30.116 435 HB3 TRP 94 HB1 TRP 94 -11.632 4.243 30.175 436 HD1 TRP 94 HD1 TRP 94 -8.955 6.868 29.443 437 HE1 TRP 94 HE1 TRP 94 -6.644 5.671 29.570 438 HE3 TRP 94 HE3 TRP 94 -10.526 2.035 29.875 439 HZ2 TRP 94 HZ2 TRP 94 -5.673 3.083 29.788 440 HZ3 TRP 94 HZ3 TRP 94 -8.841 0.254 30.039 441 HH2 TRP 94 HH2 TRP 94 -6.469 0.774 29.995 442 H ASN 95 HN ASN 95 -9.972 4.960 26.560 443 HA ASN 95 HA ASN 95 -10.381 2.165 25.829 444 HB2 ASN 95 HB2 ASN 95 -10.747 3.640 23.893 445 HB3 ASN 95 HB1 ASN 95 -9.228 4.449 24.245 446 HD21 ASN 95 HD21 ASN 95 -9.595 0.889 24.273 447 HD22 ASN 95 HD22 ASN 95 -8.469 0.722 22.971 448 H LYS 96 HN LYS 96 -8.549 0.839 26.134 449 HA LYS 96 HA LYS 96 -6.209 1.979 27.387 450 HB2 LYS 96 HB2 LYS 96 -5.287 -0.178 27.371 451 HB3 LYS 96 HB1 LYS 96 -6.927 -0.307 28.082 452 HG2 LYS 96 HG2 LYS 96 -7.573 -1.155 25.731 453 HG3 LYS 96 HG1 LYS 96 -5.834 -1.133 25.406 454 HD2 LYS 96 HD2 LYS 96 -5.485 -2.655 27.329 455 HD3 LYS 96 HD1 LYS 96 -7.231 -2.756 27.522 456 HE2 LYS 96 HE2 LYS 96 -5.705 -3.550 25.055 457 HE3 LYS 96 HE1 LYS 96 -6.295 -4.669 26.282 458 HZ1 LYS 96 HZ1 LYS 96 -7.956 -2.950 24.505 459 HZ2 LYS 96 HZ2 LYS 96 -8.551 -3.927 25.754 460 HZ3 LYS 96 HZ3 LYS 96 -7.786 -4.631 24.444 461 H ASP 97 HN ASP 97 -4.153 1.120 26.655 462 HA ASP 97 HA ASP 97 -2.472 0.882 25.277 463 HB2 ASP 97 HB2 ASP 97 -3.700 -1.239 24.875 464 HB3 ASP 97 HB1 ASP 97 -4.479 -0.494 23.487 465 H GLY 98 HN GLY 98 -3.741 3.311 25.160 466 HA2 GLY 98 HA2 GLY 98 -2.205 4.931 24.083 467 HA3 GLY 98 HA1 GLY 98 -2.379 3.978 22.642 468 H TYR 99 HN TYR 99 -5.364 3.934 23.676 469 HA TYR 99 HA TYR 99 -7.221 4.798 22.879 470 HB2 TYR 99 HB2 TYR 99 -5.831 7.158 23.836 471 HB3 TYR 99 HB1 TYR 99 -6.718 7.564 22.370 472 HD1 TYR 99 HD2 TYR 99 -9.112 7.474 22.345 473 HD2 TYR 99 HD1 TYR 99 -6.920 6.491 25.857 474 HE1 TYR 99 HE2 TYR 99 -11.141 7.666 23.692 475 HE2 TYR 99 HE1 TYR 99 -8.910 6.682 27.162 476 HH TYR 99 HH TYR 99 -11.025 7.682 27.081 477 H LEU 100 HN LEU 100 -7.464 3.836 21.109 478 HA LEU 100 HA LEU 100 -6.731 5.171 18.628 479 HB2 LEU 100 HB2 LEU 100 -4.989 3.484 19.017 480 HB3 LEU 100 HB1 LEU 100 -6.204 2.265 19.315 481 HG LEU 100 HG LEU 100 -6.898 2.390 16.964 482 HD11 LEU 100 HD11 LEU 100 -6.331 4.678 16.439 483 HD12 LEU 100 HD12 LEU 100 -5.538 3.578 15.315 484 HD13 LEU 100 HD13 LEU 100 -4.618 4.319 16.619 485 HD21 LEU 100 HD21 LEU 100 -5.249 0.740 17.624 486 HD22 LEU 100 HD22 LEU 100 -3.949 1.901 17.356 487 HD23 LEU 100 HD23 LEU 100 -4.907 1.322 15.995 488 H LYS 101 HN LYS 101 -8.014 4.142 16.854 489 HA LYS 101 HA LYS 101 -10.746 3.675 17.669 490 HB2 LYS 101 HB2 LYS 101 -9.430 3.529 14.936 491 HB3 LYS 101 HB1 LYS 101 -11.158 3.546 15.252 492 HG2 LYS 101 HG2 LYS 101 -9.251 5.814 15.805 493 HG3 LYS 101 HG1 LYS 101 -10.339 5.703 14.425 494 HD2 LYS 101 HD2 LYS 101 -12.240 5.578 16.059 495 HD3 LYS 101 HD1 LYS 101 -11.081 5.915 17.334 496 HE2 LYS 101 HE2 LYS 101 -12.191 7.986 16.659 497 HE3 LYS 101 HE1 LYS 101 -10.480 8.039 16.256 498 HZ1 LYS 101 HZ1 LYS 101 -11.941 8.884 14.486 499 HZ2 LYS 101 HZ2 LYS 101 -12.623 7.350 14.310 500 HZ3 LYS 101 HZ3 LYS 101 -10.991 7.596 13.962 501 H LYS 102 HN LYS 102 -11.588 1.642 15.998 502 HA LYS 102 HA LYS 102 -10.096 -0.579 17.047 503 HB2 LYS 102 HB2 LYS 102 -12.783 -0.382 15.714 504 HB3 LYS 102 HB1 LYS 102 -11.960 -1.932 15.768 505 HG2 LYS 102 HG2 LYS 102 -13.536 -1.773 17.595 506 HG3 LYS 102 HG1 LYS 102 -11.894 -1.809 18.219 507 HD2 LYS 102 HD2 LYS 102 -13.079 -0.189 19.513 508 HD3 LYS 102 HD1 LYS 102 -12.040 0.704 18.417 509 HE2 LYS 102 HE2 LYS 102 -13.894 1.206 16.971 510 HE3 LYS 102 HE1 LYS 102 -14.958 0.154 17.906 511 HZ1 LYS 102 HZ1 LYS 102 -13.704 2.672 18.914 512 HZ2 LYS 102 HZ2 LYS 102 -14.698 1.639 19.801 513 HZ3 LYS 102 HZ3 LYS 102 -15.319 2.463 18.488 514 H LEU 103 HN LEU 103 -8.246 -0.125 15.960 515 HA LEU 103 HA LEU 103 -8.114 -1.153 13.221 516 HB2 LEU 103 HB2 LEU 103 -6.617 1.221 14.359 517 HB3 LEU 103 HB1 LEU 103 -6.285 0.494 12.802 518 HG LEU 103 HG LEU 103 -8.855 1.892 13.568 519 HD11 LEU 103 HD11 LEU 103 -6.582 2.773 11.796 520 HD12 LEU 103 HD12 LEU 103 -6.985 3.438 13.378 521 HD13 LEU 103 HD13 LEU 103 -8.101 3.634 12.026 522 HD21 LEU 103 HD21 LEU 103 -9.232 0.142 11.908 523 HD22 LEU 103 HD22 LEU 103 -7.919 0.782 10.919 524 HD23 LEU 103 HD23 LEU 103 -9.377 1.738 11.172 525 HA PRO 104 HA PRO 104 -5.036 -3.735 15.088 526 HB2 PRO 104 HB2 PRO 104 -3.599 -4.477 12.905 527 HB3 PRO 104 HB1 PRO 104 -5.216 -5.100 13.246 528 HG2 PRO 104 HG2 PRO 104 -4.369 -2.984 11.328 529 HG3 PRO 104 HG1 PRO 104 -5.613 -4.227 11.156 530 HD2 PRO 104 HD2 PRO 104 -6.140 -1.606 11.781 531 HD3 PRO 104 HD1 PRO 104 -7.196 -2.961 12.209 532 H VAL 105 HN VAL 105 -2.549 -4.121 14.944 533 HA VAL 105 HA VAL 105 -1.306 -1.548 15.416 534 HB VAL 105 HB VAL 105 -1.189 -3.664 16.883 535 HG11 VAL 105 HG11 VAL 105 0.984 -4.439 14.964 536 HG12 VAL 105 HG12 VAL 105 -0.527 -5.287 15.272 537 HG13 VAL 105 HG13 VAL 105 0.691 -5.176 16.539 538 HG21 VAL 105 HG21 VAL 105 0.050 -1.617 17.398 539 HG22 VAL 105 HG22 VAL 105 1.390 -2.149 16.387 540 HG23 VAL 105 HG23 VAL 105 0.929 -3.068 17.827 541 H ASP 106 HN ASP 106 1.365 -1.679 14.571 542 HA ASP 106 HA ASP 106 0.764 -1.419 11.786 543 HB2 ASP 106 HB2 ASP 106 3.039 -0.408 11.577 544 HB3 ASP 106 HB1 ASP 106 2.025 0.385 12.775 545 HA PRO 107 HA PRO 107 2.653 -4.916 9.867 546 HB2 PRO 107 HB2 PRO 107 4.419 -3.551 8.260 547 HB3 PRO 107 HB1 PRO 107 2.794 -4.069 7.791 548 HG2 PRO 107 HG2 PRO 107 3.745 -1.383 8.702 549 HG3 PRO 107 HG1 PRO 107 2.439 -1.778 7.572 550 HD2 PRO 107 HD2 PRO 107 1.907 -0.953 10.025 551 HD3 PRO 107 HD1 PRO 107 0.941 -2.231 9.263 552 H TRP 108 HN TRP 108 4.796 -5.775 9.341 553 HA TRP 108 HA TRP 108 6.800 -6.543 9.891 554 HB2 TRP 108 HB2 TRP 108 7.462 -3.910 11.242 555 HB3 TRP 108 HB1 TRP 108 8.596 -5.082 10.598 556 HD1 TRP 108 HD1 TRP 108 8.351 -5.338 7.784 557 HE1 TRP 108 HE1 TRP 108 8.207 -3.425 6.077 558 HE3 TRP 108 HE3 TRP 108 6.714 -1.747 10.948 559 HZ2 TRP 108 HZ2 TRP 108 7.424 -0.576 6.151 560 HZ3 TRP 108 HZ3 TRP 108 6.285 0.531 10.103 561 HH2 TRP 108 HH2 TRP 108 6.623 1.090 7.774 562 H GLY 109 HN GLY 109 4.498 -6.128 11.723 563 HA2 GLY 109 HA2 GLY 109 3.733 -6.649 13.804 564 HA3 GLY 109 HA1 GLY 109 5.173 -7.645 13.939 565 H ASN 110 HN ASN 110 5.154 -3.924 13.784 566 HA ASN 110 HA ASN 110 6.418 -4.125 16.348 567 HB2 ASN 110 HB2 ASN 110 5.828 -1.579 14.825 568 HB3 ASN 110 HB1 ASN 110 6.963 -1.803 16.140 569 HD21 ASN 110 HD21 ASN 110 6.386 -1.917 12.889 570 HD22 ASN 110 HD22 ASN 110 7.978 -2.298 12.320 571 HA PRO 111 HA PRO 111 2.702 -2.502 18.204 572 HB2 PRO 111 HB2 PRO 111 3.708 -2.177 20.725 573 HB3 PRO 111 HB1 PRO 111 3.173 -3.736 20.101 574 HG2 PRO 111 HG2 PRO 111 5.887 -2.799 20.654 575 HG3 PRO 111 HG1 PRO 111 5.307 -4.446 20.388 576 HD2 PRO 111 HD2 PRO 111 6.667 -2.701 18.530 577 HD3 PRO 111 HD1 PRO 111 6.150 -4.385 18.307 578 H TYR 112 HN TYR 112 2.006 -0.407 18.412 579 HA TYR 112 HA TYR 112 3.814 1.674 17.784 580 HB2 TYR 112 HB2 TYR 112 0.915 1.668 18.581 581 HB3 TYR 112 HB1 TYR 112 1.788 3.180 18.401 582 HD1 TYR 112 HD2 TYR 112 2.606 3.852 16.172 583 HD2 TYR 112 HD1 TYR 112 0.164 0.409 16.672 584 HE1 TYR 112 HE2 TYR 112 2.113 3.872 13.773 585 HE2 TYR 112 HE1 TYR 112 -0.348 0.427 14.257 586 HH TYR 112 HH TYR 112 -0.324 1.920 12.317 587 H GLN 113 HN GLN 113 4.561 3.335 19.001 588 HA GLN 113 HA GLN 113 4.754 2.727 21.885 589 HB2 GLN 113 HB2 GLN 113 6.468 4.893 20.838 590 HB3 GLN 113 HB1 GLN 113 6.907 3.554 21.878 591 HG2 GLN 113 HG2 GLN 113 6.801 3.620 18.869 592 HG3 GLN 113 HG1 GLN 113 8.232 3.631 19.864 593 HE21 GLN 113 HE21 GLN 113 7.226 1.455 21.633 594 HE22 GLN 113 HE22 GLN 113 7.317 0.045 20.624 595 H TYR 114 HN TYR 114 3.501 3.974 23.158 596 HA TYR 114 HA TYR 114 2.421 6.492 22.098 597 HB2 TYR 114 HB2 TYR 114 1.450 5.099 24.574 598 HB3 TYR 114 HB1 TYR 114 0.578 6.186 23.507 599 HD1 TYR 114 HD1 TYR 114 0.831 4.986 20.883 600 HD2 TYR 114 HD2 TYR 114 0.365 3.091 24.666 601 HE1 TYR 114 HE1 TYR 114 -0.176 3.032 19.784 602 HE2 TYR 114 HE2 TYR 114 -0.694 1.144 23.584 603 HH TYR 114 HH TYR 114 -1.768 0.555 21.475 604 H LEU 115 HN LEU 115 3.405 8.323 22.903 605 HA LEU 115 HA LEU 115 4.120 8.328 25.729 606 HB2 LEU 115 HB2 LEU 115 5.571 9.672 23.449 607 HB3 LEU 115 HB1 LEU 115 5.911 9.951 25.145 608 HG LEU 115 HG LEU 115 6.251 7.284 23.767 609 HD11 LEU 115 HD11 LEU 115 8.303 9.366 24.501 610 HD12 LEU 115 HD12 LEU 115 7.774 8.978 22.865 611 HD13 LEU 115 HD13 LEU 115 8.632 7.770 23.823 612 HD21 LEU 115 HD21 LEU 115 5.865 7.150 26.176 613 HD22 LEU 115 HD22 LEU 115 7.161 8.314 26.452 614 HD23 LEU 115 HD23 LEU 115 7.526 6.730 25.770 615 H ALA 116 HN ALA 116 3.890 10.446 26.744 616 HA ALA 116 HA ALA 116 1.928 12.030 25.374 617 HB1 ALA 116 HB1 ALA 116 1.285 10.654 27.440 618 HB2 ALA 116 HB2 ALA 116 0.849 12.340 27.392 619 HB3 ALA 116 HB3 ALA 116 2.243 11.841 28.363 620 HA PRO 117 HA PRO 117 4.205 15.705 25.444 621 HB2 PRO 117 HB2 PRO 117 3.928 17.345 27.614 622 HB3 PRO 117 HB1 PRO 117 2.843 17.264 26.250 623 HG2 PRO 117 HG2 PRO 117 2.556 15.896 28.896 624 HG3 PRO 117 HG1 PRO 117 1.315 16.709 27.919 625 HD2 PRO 117 HD2 PRO 117 1.577 14.028 27.937 626 HD3 PRO 117 HD1 PRO 117 1.114 14.889 26.448 627 H GLY 118 HN GLY 118 6.169 15.518 25.359 628 HA2 GLY 118 HA2 GLY 118 7.662 14.794 27.774 629 HA3 GLY 118 HA1 GLY 118 8.177 14.441 26.122 630 H THR 119 HN THR 119 8.850 16.179 24.813 631 HA THR 119 HA THR 119 10.053 18.278 26.446 632 HB THR 119 HB THR 119 10.783 17.440 23.659 633 HG1 THR 119 HG1 THR 119 11.335 15.692 24.954 634 HG21 THR 119 HG21 THR 119 12.285 19.045 25.731 635 HG22 THR 119 HG22 THR 119 11.508 19.688 24.286 636 HG23 THR 119 HG23 THR 119 12.905 18.620 24.137 637 H LYS 120 HN LYS 120 8.491 19.681 26.480 638 HA LYS 120 HA LYS 120 7.003 21.259 26.005 639 HB2 LYS 120 HB2 LYS 120 7.575 22.939 24.308 640 HB3 LYS 120 HB1 LYS 120 8.896 22.550 25.394 641 HG2 LYS 120 HG2 LYS 120 9.867 22.841 23.249 642 HG3 LYS 120 HG1 LYS 120 9.817 21.106 23.534 643 HD2 LYS 120 HD2 LYS 120 9.167 21.383 21.270 644 HD3 LYS 120 HD1 LYS 120 7.683 21.069 22.148 645 HE2 LYS 120 HE2 LYS 120 8.635 23.829 21.316 646 HE3 LYS 120 HE1 LYS 120 7.508 22.848 20.398 647 HZ1 LYS 120 HZ1 LYS 120 7.056 24.089 23.076 648 HZ2 LYS 120 HZ2 LYS 120 6.035 22.940 22.430 649 HZ3 LYS 120 HZ3 LYS 120 6.246 24.404 21.629 650 H GLY 121 HN GLY 121 6.515 18.637 24.462 651 HA2 GLY 121 HA2 GLY 121 4.499 19.880 22.750 652 HA3 GLY 121 HA1 GLY 121 5.429 18.463 22.216 653 HA PRO 122 HA PRO 122 1.162 18.085 24.939 654 HB2 PRO 122 HB2 PRO 122 0.345 17.648 22.115 655 HB3 PRO 122 HB1 PRO 122 -0.618 18.196 23.493 656 HG2 PRO 122 HG2 PRO 122 0.339 19.933 21.765 657 HG3 PRO 122 HG1 PRO 122 0.351 20.294 23.499 658 HD2 PRO 122 HD2 PRO 122 2.594 19.648 21.688 659 HD3 PRO 122 HD1 PRO 122 2.574 20.557 23.214 660 H PHE 123 HN PHE 123 2.788 16.144 22.451 661 HA PHE 123 HA PHE 123 2.708 13.841 23.963 662 HB2 PHE 123 HB2 PHE 123 1.168 12.364 22.699 663 HB3 PHE 123 HB1 PHE 123 0.306 13.660 23.498 664 HD1 PHE 123 HD1 PHE 123 -0.704 15.483 22.158 665 HD2 PHE 123 HD2 PHE 123 1.183 12.141 20.322 666 HE1 PHE 123 HE1 PHE 123 -1.838 16.010 20.042 667 HE2 PHE 123 HE2 PHE 123 0.055 12.666 18.199 668 HZ PHE 123 HZ PHE 123 -1.458 14.604 18.059 669 H ASP 124 HN ASP 124 3.517 11.942 22.773 670 HA ASP 124 HA ASP 124 4.722 12.534 20.168 671 HB2 ASP 124 HB2 ASP 124 6.257 11.468 22.557 672 HB3 ASP 124 HB1 ASP 124 6.802 11.321 20.894 673 H LEU 125 HN LEU 125 4.033 10.878 18.853 674 HA LEU 125 HA LEU 125 4.336 8.299 19.990 675 HB2 LEU 125 HB2 LEU 125 2.085 7.451 19.358 676 HB3 LEU 125 HB1 LEU 125 2.122 8.561 20.701 677 HG LEU 125 HG LEU 125 1.429 10.327 18.927 678 HD11 LEU 125 HD11 LEU 125 0.553 7.790 17.573 679 HD12 LEU 125 HD12 LEU 125 1.748 8.932 16.963 680 HD13 LEU 125 HD13 LEU 125 0.057 9.422 17.119 681 HD21 LEU 125 HD21 LEU 125 -0.939 9.730 19.355 682 HD22 LEU 125 HD22 LEU 125 0.094 9.668 20.789 683 HD23 LEU 125 HD23 LEU 125 -0.368 8.176 19.988 684 H TYR 126 HN TYR 126 4.637 6.621 18.713 685 HA TYR 126 HA TYR 126 4.738 6.849 15.897 686 HB2 TYR 126 HB2 TYR 126 7.218 6.926 15.678 687 HB3 TYR 126 HB1 TYR 126 6.592 8.393 16.410 688 HD1 TYR 126 HD2 TYR 126 6.898 8.795 18.848 689 HD2 TYR 126 HD1 TYR 126 8.817 5.573 16.828 690 HE1 TYR 126 HE2 TYR 126 8.513 8.634 20.669 691 HE2 TYR 126 HE1 TYR 126 10.453 5.401 18.637 692 HH TYR 126 HH TYR 126 11.372 6.993 20.361 693 H SER 127 HN SER 127 5.877 4.896 15.058 694 HA SER 127 HA SER 127 6.245 2.864 17.119 695 HB2 SER 127 HB2 SER 127 4.147 2.505 15.699 696 HB3 SER 127 HB1 SER 127 5.246 2.250 14.344 697 HG SER 127 HG SER 127 4.693 0.298 15.349 698 H LEU 128 HN LEU 128 7.749 1.296 16.525 699 HA LEU 128 HA LEU 128 10.106 2.360 15.350 700 HB2 LEU 128 HB2 LEU 128 9.354 -0.428 16.170 701 HB3 LEU 128 HB1 LEU 128 10.984 0.043 15.710 702 HG LEU 128 HG LEU 128 9.426 1.062 18.100 703 HD11 LEU 128 HD11 LEU 128 11.836 -0.721 17.945 704 HD12 LEU 128 HD12 LEU 128 10.210 -1.155 18.500 705 HD13 LEU 128 HD13 LEU 128 11.184 -0.016 19.419 706 HD21 LEU 128 HD21 LEU 128 10.813 2.852 17.246 707 HD22 LEU 128 HD22 LEU 128 12.208 1.777 17.181 708 HD23 LEU 128 HD23 LEU 128 11.509 2.221 18.736 709 H GLY 129 HN GLY 129 11.253 1.599 13.449 710 HA2 GLY 129 HA2 GLY 129 9.498 1.195 11.207 711 HA3 GLY 129 HA1 GLY 129 11.240 1.318 11.140 712 H ALA 130 HN ALA 130 10.932 -0.286 9.497 713 HA ALA 130 HA ALA 130 9.913 -2.858 9.833 714 HB1 ALA 130 HB1 ALA 130 11.142 -3.459 7.849 715 HB2 ALA 130 HB2 ALA 130 12.161 -2.029 8.024 716 HB3 ALA 130 HB3 ALA 130 10.442 -1.848 7.673 717 H ASP 131 HN ASP 131 12.779 -1.599 11.107 718 HA ASP 131 HA ASP 131 13.899 -4.290 11.500 719 HB2 ASP 131 HB2 ASP 131 15.333 -2.510 10.410 720 HB3 ASP 131 HB1 ASP 131 15.274 -1.632 11.929 721 H GLY 132 HN GLY 132 11.852 -2.297 12.995 722 HA2 GLY 132 HA2 GLY 132 11.158 -1.968 15.131 723 HA3 GLY 132 HA1 GLY 132 12.097 -3.387 15.560 724 H LYS 133 HN LYS 133 13.132 -0.280 14.257 725 HA LYS 133 HA LYS 133 14.624 0.305 16.696 726 HB2 LYS 133 HB2 LYS 133 15.906 -1.034 14.821 727 HB3 LYS 133 HB1 LYS 133 15.905 0.491 13.965 728 HG2 LYS 133 HG2 LYS 133 17.125 0.050 16.690 729 HG3 LYS 133 HG1 LYS 133 18.018 -0.021 15.178 730 HD2 LYS 133 HD2 LYS 133 17.488 2.325 14.771 731 HD3 LYS 133 HD1 LYS 133 16.544 2.368 16.259 732 HE2 LYS 133 HE2 LYS 133 18.588 1.745 17.506 733 HE3 LYS 133 HE1 LYS 133 19.498 1.883 16.004 734 HZ1 LYS 133 HZ1 LYS 133 17.930 4.022 17.293 735 HZ2 LYS 133 HZ2 LYS 133 18.835 4.227 15.879 736 HZ3 LYS 133 HZ3 LYS 133 19.608 3.902 17.362 737 H GLU 134 HN GLU 134 14.864 2.586 16.936 738 HA GLU 134 HA GLU 134 13.330 4.158 15.069 739 HB2 GLU 134 HB2 GLU 134 13.830 6.050 16.850 740 HB3 GLU 134 HB1 GLU 134 12.584 4.858 17.130 741 HG2 GLU 134 HG2 GLU 134 13.831 5.253 19.155 742 HG3 GLU 134 HG1 GLU 134 14.115 3.615 18.577 743 H GLY 135 HN GLY 135 14.301 4.871 13.381 744 HA2 GLY 135 HA2 GLY 135 16.803 6.325 13.656 745 HA3 GLY 135 HA1 GLY 135 16.836 4.910 12.606 746 H GLY 136 HN GLY 136 17.445 6.975 11.223 747 HA2 GLY 136 HA2 GLY 136 14.936 8.020 10.083 748 HA3 GLY 136 HA1 GLY 136 16.524 8.778 9.897 749 H SER 137 HN SER 137 14.364 7.356 8.130 750 HA SER 137 HA SER 137 15.849 6.313 6.068 751 HB2 SER 137 HB2 SER 137 14.865 4.308 8.104 752 HB3 SER 137 HB1 SER 137 15.174 3.840 6.422 753 HG SER 137 HG SER 137 17.168 5.203 7.678 754 H ASP 138 HN ASP 138 14.134 4.769 4.767 755 HA ASP 138 HA ASP 138 11.600 6.180 4.826 756 HB2 ASP 138 HB2 ASP 138 12.947 4.343 2.950 757 HB3 ASP 138 HB1 ASP 138 11.203 4.165 3.050 758 H ASN 139 HN ASN 139 12.213 2.716 4.637 759 HA ASN 139 HA ASN 139 9.840 2.318 6.292 760 HB2 ASN 139 HB2 ASN 139 9.896 -0.034 5.617 761 HB3 ASN 139 HB1 ASN 139 9.943 1.009 4.208 762 HD21 ASN 139 HD21 ASN 139 11.739 -1.230 6.178 763 HD22 ASN 139 HD22 ASN 139 13.017 -1.498 5.053 764 H ASP 140 HN ASP 140 13.190 2.303 6.571 765 HA ASP 140 HA ASP 140 13.209 0.464 8.844 766 HB2 ASP 140 HB2 ASP 140 15.499 2.073 7.669 767 HB3 ASP 140 HB1 ASP 140 15.644 0.823 8.893 768 H ALA 141 HN ALA 141 12.221 3.421 8.471 769 HA ALA 141 HA ALA 141 13.486 4.659 10.798 770 HB1 ALA 141 HB1 ALA 141 12.385 6.661 10.108 771 HB2 ALA 141 HB2 ALA 141 11.541 5.785 8.829 772 HB3 ALA 141 HB3 ALA 141 13.294 5.970 8.767 773 H ASP 142 HN ASP 142 12.168 5.639 12.405 774 HA ASP 142 HA ASP 142 9.877 4.050 13.048 775 HB2 ASP 142 HB2 ASP 142 9.788 5.381 15.104 776 HB3 ASP 142 HB1 ASP 142 11.420 4.788 14.850 777 H ILE 143 HN ILE 143 7.852 4.674 12.908 778 HA ILE 143 HA ILE 143 7.438 7.109 11.404 779 HB ILE 143 HB ILE 143 5.319 5.989 10.491 780 HG12 ILE 143 HG12 ILE 143 5.616 3.423 10.276 781 HG13 ILE 143 HG11 ILE 143 6.689 3.546 11.657 782 HG21 ILE 143 HG21 ILE 143 7.261 6.394 9.136 783 HG22 ILE 143 HG22 ILE 143 6.574 4.810 8.753 784 HG23 ILE 143 HG23 ILE 143 8.020 4.922 9.759 785 HD11 ILE 143 HD11 ILE 143 3.774 4.286 11.609 786 HD12 ILE 143 HD12 ILE 143 4.842 4.363 13.012 787 HD13 ILE 143 HD13 ILE 143 4.458 2.805 12.275 788 H GLY 144 HN GLY 144 6.322 8.720 12.258 789 HA2 GLY 144 HA2 GLY 144 4.142 8.180 14.022 790 HA3 GLY 144 HA1 GLY 144 5.578 8.691 14.868 791 H ASN 145 HN ASN 145 3.651 10.157 15.335 792 HA ASN 145 HA ASN 145 4.292 12.637 14.163 793 HB2 ASN 145 HB2 ASN 145 2.019 13.293 13.419 794 HB3 ASN 145 HB1 ASN 145 2.678 11.941 12.511 795 HD21 ASN 145 HD21 ASN 145 1.268 11.221 15.665 796 HD22 ASN 145 HD22 ASN 145 -0.162 10.523 14.980 797 H TRP 146 HN TRP 146 3.265 14.384 15.288 798 HA TRP 146 HA TRP 146 1.945 13.815 17.730 799 HB2 TRP 146 HB2 TRP 146 3.854 14.737 19.131 800 HB3 TRP 146 HB1 TRP 146 3.992 13.095 18.508 801 HD1 TRP 146 HD1 TRP 146 5.319 16.640 17.511 802 HE1 TRP 146 HE1 TRP 146 7.666 16.307 16.497 803 HE3 TRP 146 HE3 TRP 146 5.553 11.581 17.757 804 HZ2 TRP 146 HZ2 TRP 146 9.400 14.150 15.900 805 HZ3 TRP 146 HZ3 TRP 146 7.585 10.430 16.967 806 HH2 TRP 146 HH2 TRP 146 9.470 11.699 16.051 807 H ASP 147 HN ASP 147 2.114 15.841 19.120 808 HA ASP 147 HA ASP 147 2.074 18.195 17.394 809 HB2 ASP 147 HB2 ASP 147 -0.249 17.625 18.127 810 HB3 ASP 147 HB1 ASP 147 0.286 17.711 19.803 811 H ASN 148 HN ASN 148 3.286 19.793 18.084 812 HA ASN 148 HA ASN 148 4.496 19.527 20.687 813 HB2 ASN 148 HB2 ASN 148 6.740 20.058 19.626 814 HB3 ASN 148 HB1 ASN 148 6.092 18.469 19.258 815 HD21 ASN 148 HD21 ASN 148 7.107 21.480 17.976 816 HD22 ASN 148 HD22 ASN 148 6.869 21.123 16.313 Start of MODEL 10 1 H1 MET 39 HT1 MET 39 3.089 5.921 0.790 2 H2 MET 39 HT2 MET 39 2.965 6.750 -0.647 3 H3 MET 39 HT3 MET 39 3.964 7.348 0.558 4 HA MET 39 HA MET 39 5.189 6.359 -1.273 5 HB2 MET 39 HB2 MET 39 5.441 4.602 1.189 6 HB3 MET 39 HB1 MET 39 6.638 4.895 -0.061 7 HG2 MET 39 HG2 MET 39 7.336 6.104 1.816 8 HG3 MET 39 HG1 MET 39 6.677 7.290 0.693 9 HE1 MET 39 HE1 MET 39 7.264 7.834 3.760 10 HE2 MET 39 HE2 MET 39 5.833 8.744 4.232 11 HE3 MET 39 HE3 MET 39 6.604 9.058 2.675 12 H SER 40 HN SER 40 4.504 5.234 -3.034 13 HA SER 40 HA SER 40 3.214 2.675 -2.510 14 HB2 SER 40 HB2 SER 40 3.184 4.369 -5.011 15 HB3 SER 40 HB1 SER 40 2.336 2.835 -4.812 16 HG SER 40 HG SER 40 1.894 4.714 -2.840 17 H ARG 41 HN ARG 41 5.245 1.667 -2.057 18 HA ARG 41 HA ARG 41 6.418 0.368 -4.351 19 HB2 ARG 41 HB2 ARG 41 8.134 1.945 -2.395 20 HB3 ARG 41 HB1 ARG 41 8.762 0.745 -3.498 21 HG2 ARG 41 HG2 ARG 41 8.054 2.171 -5.386 22 HG3 ARG 41 HG1 ARG 41 7.506 3.384 -4.220 23 HD2 ARG 41 HD2 ARG 41 9.772 3.419 -3.264 24 HD3 ARG 41 HD1 ARG 41 10.299 2.323 -4.538 25 HE ARG 41 HE ARG 41 9.370 4.283 -6.000 26 HH11 ARG 41 HH11 ARG 41 11.375 4.385 -3.081 27 HH12 ARG 41 HH12 ARG 41 12.059 5.893 -3.426 28 HH21 ARG 41 HH21 ARG 41 10.359 6.373 -6.494 29 HH22 ARG 41 HH22 ARG 41 11.498 7.029 -5.392 30 HA PRO 42 HA PRO 42 6.504 -2.995 -1.348 31 HB2 PRO 42 HB2 PRO 42 9.348 -3.457 -2.126 32 HB3 PRO 42 HB1 PRO 42 8.005 -4.602 -2.083 33 HG2 PRO 42 HG2 PRO 42 8.919 -3.651 -4.397 34 HG3 PRO 42 HG1 PRO 42 7.191 -3.927 -4.144 35 HD2 PRO 42 HD2 PRO 42 8.712 -1.363 -4.181 36 HD3 PRO 42 HD1 PRO 42 7.060 -1.709 -4.731 37 H ASP 43 HN ASP 43 7.141 -3.273 0.754 38 HA ASP 43 HA ASP 43 7.912 -2.810 2.816 39 HB2 ASP 43 HB2 ASP 43 10.254 -1.481 1.415 40 HB3 ASP 43 HB1 ASP 43 10.109 -1.560 3.163 41 H GLN 44 HN GLN 44 8.268 -0.010 0.755 42 HA GLN 44 HA GLN 44 7.573 1.832 2.818 43 HB2 GLN 44 HB2 GLN 44 7.399 2.222 -0.169 44 HB3 GLN 44 HB1 GLN 44 7.312 3.463 1.073 45 HG2 GLN 44 HG2 GLN 44 9.603 2.917 1.759 46 HG3 GLN 44 HG1 GLN 44 9.698 1.767 0.422 47 HE21 GLN 44 HE21 GLN 44 11.280 4.201 0.895 48 HE22 GLN 44 HE22 GLN 44 11.019 5.174 -0.483 49 H ALA 45 HN ALA 45 5.779 -0.206 0.810 50 HA ALA 45 HA ALA 45 3.251 0.955 0.898 51 HB1 ALA 45 HB1 ALA 45 2.416 -1.316 0.528 52 HB2 ALA 45 HB2 ALA 45 3.989 -1.969 0.979 53 HB3 ALA 45 HB3 ALA 45 3.829 -0.989 -0.477 54 H LYS 46 HN LYS 46 5.144 -0.682 3.344 55 HA LYS 46 HA LYS 46 2.885 -0.946 5.145 56 HB2 LYS 46 HB2 LYS 46 5.839 -1.440 5.509 57 HB3 LYS 46 HB1 LYS 46 4.633 -1.738 6.744 58 HG2 LYS 46 HG2 LYS 46 3.564 -3.373 5.253 59 HG3 LYS 46 HG1 LYS 46 4.867 -3.117 4.086 60 HD2 LYS 46 HD2 LYS 46 6.501 -3.881 5.700 61 HD3 LYS 46 HD1 LYS 46 5.253 -4.031 6.934 62 HE2 LYS 46 HE2 LYS 46 5.437 -5.638 4.380 63 HE3 LYS 46 HE1 LYS 46 5.816 -6.171 6.025 64 HZ1 LYS 46 HZ1 LYS 46 3.125 -5.321 5.105 65 HZ2 LYS 46 HZ2 LYS 46 3.539 -5.897 6.641 66 HZ3 LYS 46 HZ3 LYS 46 3.643 -6.914 5.319 67 H VAL 47 HN VAL 47 5.404 1.229 4.360 68 HA VAL 47 HA VAL 47 5.489 2.651 6.839 69 HB VAL 47 HB VAL 47 6.430 3.481 4.062 70 HG11 VAL 47 HG11 VAL 47 7.857 5.122 5.188 71 HG12 VAL 47 HG12 VAL 47 7.137 4.689 6.733 72 HG13 VAL 47 HG13 VAL 47 6.145 5.442 5.481 73 HG21 VAL 47 HG21 VAL 47 7.573 1.479 4.866 74 HG22 VAL 47 HG22 VAL 47 8.001 2.320 6.360 75 HG23 VAL 47 HG23 VAL 47 8.666 2.864 4.820 76 H THR 48 HN THR 48 3.976 3.060 3.711 77 HA THR 48 HA THR 48 2.868 5.593 4.186 78 HB THR 48 HB THR 48 3.372 4.546 1.950 79 HG1 THR 48 HG1 THR 48 0.729 5.556 2.200 80 HG21 THR 48 HG21 THR 48 0.745 3.123 2.389 81 HG22 THR 48 HG22 THR 48 2.341 2.377 2.272 82 HG23 THR 48 HG23 THR 48 1.643 3.184 0.868 83 H VAL 49 HN VAL 49 1.712 2.364 4.871 84 HA VAL 49 HA VAL 49 -1.001 3.143 5.361 85 HB VAL 49 HB VAL 49 0.512 0.599 6.056 86 HG11 VAL 49 HG11 VAL 49 -1.314 0.976 7.694 87 HG12 VAL 49 HG12 VAL 49 -1.628 -0.405 6.650 88 HG13 VAL 49 HG13 VAL 49 -2.457 1.123 6.358 89 HG21 VAL 49 HG21 VAL 49 0.107 0.951 3.688 90 HG22 VAL 49 HG22 VAL 49 -1.612 1.195 4.012 91 HG23 VAL 49 HG23 VAL 49 -0.874 -0.379 4.303 92 H ALA 50 HN ALA 50 1.818 2.392 7.328 93 HA ALA 50 HA ALA 50 0.603 2.544 9.822 94 HB1 ALA 50 HB1 ALA 50 3.442 3.148 9.093 95 HB2 ALA 50 HB2 ALA 50 2.790 1.531 9.395 96 HB3 ALA 50 HB3 ALA 50 2.845 2.732 10.695 97 H LYS 51 HN LYS 51 2.119 5.100 7.814 98 HA LYS 51 HA LYS 51 1.956 6.979 9.821 99 HB2 LYS 51 HB2 LYS 51 2.051 7.437 6.852 100 HB3 LYS 51 HB1 LYS 51 2.344 8.663 8.084 101 HG2 LYS 51 HG2 LYS 51 4.170 7.247 8.966 102 HG3 LYS 51 HG1 LYS 51 3.955 6.179 7.580 103 HD2 LYS 51 HD2 LYS 51 5.733 7.617 7.054 104 HD3 LYS 51 HD1 LYS 51 4.318 8.172 6.148 105 HE2 LYS 51 HE2 LYS 51 3.908 9.949 7.737 106 HE3 LYS 51 HE1 LYS 51 5.174 9.353 8.802 107 HZ1 LYS 51 HZ1 LYS 51 6.799 9.933 7.080 108 HZ2 LYS 51 HZ2 LYS 51 5.921 11.261 7.598 109 HZ3 LYS 51 HZ3 LYS 51 5.569 10.570 6.115 110 H GLY 52 HN GLY 52 -0.437 5.748 7.727 111 HA2 GLY 52 HA2 GLY 52 -2.215 7.982 7.959 112 HA3 GLY 52 HA1 GLY 52 -2.628 6.373 7.352 113 H ASP 53 HN ASP 53 -1.651 4.988 9.637 114 HA ASP 53 HA ASP 53 -4.052 5.310 11.153 115 HB2 ASP 53 HB2 ASP 53 -1.867 3.248 11.382 116 HB3 ASP 53 HB1 ASP 53 -3.257 3.300 12.465 117 H ILE 54 HN ILE 54 -0.779 6.214 11.567 118 HA ILE 54 HA ILE 54 -1.126 6.788 14.334 119 HB ILE 54 HB ILE 54 0.905 8.220 14.169 120 HG12 ILE 54 HG12 ILE 54 0.710 7.431 11.280 121 HG13 ILE 54 HG11 ILE 54 0.622 9.050 11.934 122 HG21 ILE 54 HG21 ILE 54 1.142 5.469 12.972 123 HG22 ILE 54 HG22 ILE 54 1.112 5.867 14.692 124 HG23 ILE 54 HG23 ILE 54 2.463 6.390 13.688 125 HD11 ILE 54 HD11 ILE 54 3.015 7.260 11.907 126 HD12 ILE 54 HD12 ILE 54 2.969 8.881 12.614 127 HD13 ILE 54 HD13 ILE 54 2.737 8.660 10.874 128 H LYS 55 HN LYS 55 -1.931 8.529 11.422 129 HA LYS 55 HA LYS 55 -2.496 10.951 12.851 130 HB2 LYS 55 HB2 LYS 55 -3.164 9.997 10.100 131 HB3 LYS 55 HB1 LYS 55 -4.121 11.303 10.772 132 HG2 LYS 55 HG2 LYS 55 -2.352 12.243 9.434 133 HG3 LYS 55 HG1 LYS 55 -2.049 12.607 11.124 134 HD2 LYS 55 HD2 LYS 55 -0.455 10.751 11.225 135 HD3 LYS 55 HD1 LYS 55 -0.736 10.426 9.513 136 HE2 LYS 55 HE2 LYS 55 0.443 12.923 10.724 137 HE3 LYS 55 HE1 LYS 55 1.289 11.702 9.780 138 HZ1 LYS 55 HZ1 LYS 55 -0.137 12.291 7.878 139 HZ2 LYS 55 HZ2 LYS 55 0.790 13.596 8.412 140 HZ3 LYS 55 HZ3 LYS 55 -0.839 13.523 8.800 141 H ALA 56 HN ALA 56 -4.170 8.043 12.137 142 HA ALA 56 HA ALA 56 -6.750 8.743 13.033 143 HB1 ALA 56 HB1 ALA 56 -7.068 6.344 13.301 144 HB2 ALA 56 HB2 ALA 56 -5.320 6.125 13.247 145 HB3 ALA 56 HB3 ALA 56 -6.175 6.679 11.799 146 H ILE 57 HN ILE 57 -3.919 7.430 14.674 147 HA ILE 57 HA ILE 57 -5.028 7.190 17.243 148 HB ILE 57 HB ILE 57 -2.119 7.700 16.525 149 HG12 ILE 57 HG12 ILE 57 -3.542 5.100 17.056 150 HG13 ILE 57 HG11 ILE 57 -3.229 5.728 15.446 151 HG21 ILE 57 HG21 ILE 57 -1.651 6.630 18.702 152 HG22 ILE 57 HG22 ILE 57 -3.385 6.530 19.019 153 HG23 ILE 57 HG23 ILE 57 -2.601 8.106 18.897 154 HD11 ILE 57 HD11 ILE 57 -0.843 5.623 15.880 155 HD12 ILE 57 HD12 ILE 57 -1.639 4.070 16.018 156 HD13 ILE 57 HD13 ILE 57 -1.147 4.951 17.484 157 H ALA 58 HN ALA 58 -3.544 9.889 15.583 158 HA ALA 58 HA ALA 58 -3.371 11.666 17.743 159 HB1 ALA 58 HB1 ALA 58 -2.340 12.105 15.563 160 HB2 ALA 58 HB2 ALA 58 -3.356 13.452 16.078 161 HB3 ALA 58 HB3 ALA 58 -3.940 12.324 14.854 162 H ALA 59 HN ALA 59 -6.107 10.657 15.809 163 HA ALA 59 HA ALA 59 -7.854 12.733 16.764 164 HB1 ALA 59 HB1 ALA 59 -8.167 11.733 14.537 165 HB2 ALA 59 HB2 ALA 59 -9.594 11.521 15.554 166 HB3 ALA 59 HB3 ALA 59 -8.486 10.174 15.298 167 H ALA 60 HN ALA 60 -6.950 9.510 17.623 168 HA ALA 60 HA ALA 60 -9.101 9.153 19.506 169 HB1 ALA 60 HB1 ALA 60 -8.151 7.193 18.417 170 HB2 ALA 60 HB2 ALA 60 -7.859 7.116 20.168 171 HB3 ALA 60 HB3 ALA 60 -6.568 7.586 19.084 172 H LEU 61 HN LEU 61 -5.817 10.258 19.528 173 HA LEU 61 HA LEU 61 -5.432 10.375 22.328 174 HB2 LEU 61 HB2 LEU 61 -3.838 10.621 20.184 175 HB3 LEU 61 HB1 LEU 61 -4.188 12.316 20.409 176 HG LEU 61 HG LEU 61 -2.021 11.583 21.370 177 HD11 LEU 61 HD11 LEU 61 -4.017 12.541 23.390 178 HD12 LEU 61 HD12 LEU 61 -3.065 13.539 22.283 179 HD13 LEU 61 HD13 LEU 61 -2.265 12.620 23.555 180 HD21 LEU 61 HD21 LEU 61 -3.718 10.093 23.318 181 HD22 LEU 61 HD22 LEU 61 -1.970 10.292 23.397 182 HD23 LEU 61 HD23 LEU 61 -2.697 9.347 22.078 183 H ASP 62 HN ASP 62 -6.959 12.372 19.938 184 HA ASP 62 HA ASP 62 -7.481 14.612 21.568 185 HB2 ASP 62 HB2 ASP 62 -7.696 14.879 19.185 186 HB3 ASP 62 HB1 ASP 62 -8.885 13.587 19.099 187 H MET 63 HN MET 63 -8.974 11.502 21.197 188 HA MET 63 HA MET 63 -11.418 12.250 22.465 189 HB2 MET 63 HB2 MET 63 -10.268 9.483 22.068 190 HB3 MET 63 HB1 MET 63 -11.884 9.808 22.680 191 HG2 MET 63 HG2 MET 63 -12.345 10.975 20.514 192 HG3 MET 63 HG1 MET 63 -10.802 10.361 19.927 193 HE1 MET 63 HE1 MET 63 -10.911 7.439 21.519 194 HE2 MET 63 HE2 MET 63 -10.307 7.580 19.865 195 HE3 MET 63 HE3 MET 63 -11.562 6.411 20.246 196 H TYR 64 HN TYR 64 -8.359 10.892 23.532 197 HA TYR 64 HA TYR 64 -9.181 10.590 26.260 198 HB2 TYR 64 HB2 TYR 64 -7.086 9.552 25.279 199 HB3 TYR 64 HB1 TYR 64 -6.360 11.161 25.318 200 HD1 TYR 64 HD2 TYR 64 -6.085 12.332 27.585 201 HD2 TYR 64 HD1 TYR 64 -7.274 8.257 27.291 202 HE1 TYR 64 HE2 TYR 64 -5.495 11.998 29.854 203 HE2 TYR 64 HE1 TYR 64 -6.704 7.919 29.526 204 HH TYR 64 HH TYR 64 -6.371 10.500 31.552 205 H LYS 65 HN LYS 65 -7.660 13.151 24.332 206 HA LYS 65 HA LYS 65 -7.268 15.102 26.194 207 HB2 LYS 65 HB2 LYS 65 -6.470 15.505 24.043 208 HB3 LYS 65 HB1 LYS 65 -8.003 15.037 23.332 209 HG2 LYS 65 HG2 LYS 65 -8.986 17.120 23.947 210 HG3 LYS 65 HG1 LYS 65 -7.507 17.614 24.787 211 HD2 LYS 65 HD2 LYS 65 -6.285 17.727 22.770 212 HD3 LYS 65 HD1 LYS 65 -7.506 16.824 21.890 213 HE2 LYS 65 HE2 LYS 65 -7.958 19.568 23.047 214 HE3 LYS 65 HE1 LYS 65 -7.483 19.259 21.375 215 HZ1 LYS 65 HZ1 LYS 65 -9.996 18.427 22.721 216 HZ2 LYS 65 HZ2 LYS 65 -9.496 17.861 21.208 217 HZ3 LYS 65 HZ3 LYS 65 -9.829 19.494 21.413 218 H LEU 66 HN LEU 66 -10.261 14.162 24.602 219 HA LEU 66 HA LEU 66 -11.806 16.145 25.983 220 HB2 LEU 66 HB2 LEU 66 -12.443 13.965 24.079 221 HB3 LEU 66 HB1 LEU 66 -13.721 14.529 25.131 222 HG LEU 66 HG LEU 66 -13.850 15.612 22.984 223 HD11 LEU 66 HD11 LEU 66 -14.572 16.831 24.932 224 HD12 LEU 66 HD12 LEU 66 -13.951 17.903 23.681 225 HD13 LEU 66 HD13 LEU 66 -12.968 17.550 25.098 226 HD21 LEU 66 HD21 LEU 66 -11.506 15.551 22.304 227 HD22 LEU 66 HD22 LEU 66 -11.112 16.725 23.557 228 HD23 LEU 66 HD23 LEU 66 -12.150 17.191 22.207 229 H ASP 67 HN ASP 67 -11.018 12.757 26.467 230 HA ASP 67 HA ASP 67 -12.977 12.230 28.469 231 HB2 ASP 67 HB2 ASP 67 -11.930 10.406 27.223 232 HB3 ASP 67 HB1 ASP 67 -10.351 10.893 27.809 233 H ASN 68 HN ASN 68 -9.813 13.697 28.571 234 HA ASN 68 HA ASN 68 -10.179 14.094 31.535 235 HB2 ASN 68 HB2 ASN 68 -7.554 13.695 30.109 236 HB3 ASN 68 HB1 ASN 68 -7.825 14.368 31.713 237 HD21 ASN 68 HD21 ASN 68 -9.597 11.562 30.551 238 HD22 ASN 68 HD22 ASN 68 -8.872 10.440 31.569 239 H PHE 69 HN PHE 69 -10.797 15.644 29.072 240 HA PHE 69 HA PHE 69 -10.626 17.803 28.283 241 HB2 PHE 69 HB2 PHE 69 -10.975 19.475 30.207 242 HB3 PHE 69 HB1 PHE 69 -12.175 18.211 30.003 243 HD1 PHE 69 HD2 PHE 69 -9.337 19.249 31.968 244 HD2 PHE 69 HD1 PHE 69 -12.518 16.644 31.665 245 HE1 PHE 69 HE2 PHE 69 -9.017 18.689 34.344 246 HE2 PHE 69 HE1 PHE 69 -12.308 15.978 34.002 247 HZ PHE 69 HZ PHE 69 -10.526 17.008 35.398 248 H ALA 70 HN ALA 70 -8.133 16.635 28.426 249 HA ALA 70 HA ALA 70 -6.269 18.683 28.232 250 HB1 ALA 70 HB1 ALA 70 -6.534 18.947 30.621 251 HB2 ALA 70 HB2 ALA 70 -4.971 18.152 30.342 252 HB3 ALA 70 HB3 ALA 70 -6.389 17.220 30.863 253 H TYR 71 HN TYR 71 -4.126 17.670 27.894 254 HA TYR 71 HA TYR 71 -4.368 15.008 26.891 255 HB2 TYR 71 HB2 TYR 71 -2.153 17.025 26.931 256 HB3 TYR 71 HB1 TYR 71 -1.850 15.361 26.455 257 HD1 TYR 71 HD1 TYR 71 -3.944 14.524 24.824 258 HD2 TYR 71 HD2 TYR 71 -2.306 18.426 25.145 259 HE1 TYR 71 HE1 TYR 71 -4.666 14.929 22.626 260 HE2 TYR 71 HE2 TYR 71 -3.015 18.918 22.877 261 HH TYR 71 HH TYR 71 -4.993 16.665 21.018 262 HA PRO 72 HA PRO 72 -2.703 12.681 30.314 263 HB2 PRO 72 HB2 PRO 72 -1.109 10.918 28.875 264 HB3 PRO 72 HB1 PRO 72 -2.867 10.753 29.013 265 HG2 PRO 72 HG2 PRO 72 -1.198 11.922 26.834 266 HG3 PRO 72 HG1 PRO 72 -2.599 10.842 26.717 267 HD2 PRO 72 HD2 PRO 72 -2.806 13.455 26.273 268 HD3 PRO 72 HD1 PRO 72 -4.100 12.552 27.087 269 H SER 73 HN SER 73 -0.534 12.309 31.469 270 HA SER 73 HA SER 73 1.485 14.146 30.443 271 HB2 SER 73 HB2 SER 73 2.489 13.858 32.718 272 HB3 SER 73 HB1 SER 73 0.847 14.495 32.774 273 HG SER 73 HG SER 73 0.183 12.789 33.688 274 H THR 74 HN THR 74 3.775 13.292 30.419 275 HA THR 74 HA THR 74 3.695 10.795 29.093 276 HB THR 74 HB THR 74 5.352 12.780 28.721 277 HG1 THR 74 HG1 THR 74 6.720 11.375 27.693 278 HG21 THR 74 HG21 THR 74 6.863 11.204 30.827 279 HG22 THR 74 HG22 THR 74 6.273 12.850 31.004 280 HG23 THR 74 HG23 THR 74 7.549 12.494 29.834 281 H GLN 75 HN GLN 75 3.876 11.543 32.379 282 HA GLN 75 HA GLN 75 4.853 8.866 32.993 283 HB2 GLN 75 HB2 GLN 75 4.423 11.286 34.711 284 HB3 GLN 75 HB1 GLN 75 4.898 9.714 35.358 285 HG2 GLN 75 HG2 GLN 75 6.947 9.797 34.072 286 HG3 GLN 75 HG1 GLN 75 6.442 11.314 33.330 287 HE21 GLN 75 HE21 GLN 75 6.453 13.149 34.532 288 HE22 GLN 75 HE22 GLN 75 7.336 13.326 36.000 289 H GLN 76 HN GLN 76 2.157 11.013 34.214 290 HA GLN 76 HA GLN 76 0.755 8.657 35.177 291 HB2 GLN 76 HB2 GLN 76 -0.041 11.557 35.139 292 HB3 GLN 76 HB1 GLN 76 -0.991 10.262 35.842 293 HG2 GLN 76 HG2 GLN 76 0.921 9.811 37.375 294 HG3 GLN 76 HG1 GLN 76 1.691 11.255 36.728 295 HE21 GLN 76 HE21 GLN 76 -0.879 12.698 36.458 296 HE22 GLN 76 HE22 GLN 76 -1.317 13.122 38.066 297 H GLY 77 HN GLY 77 0.563 10.799 32.476 298 HA2 GLY 77 HA2 GLY 77 -1.967 9.721 31.719 299 HA3 GLY 77 HA1 GLY 77 -0.938 10.736 30.730 300 H LEU 78 HN LEU 78 1.350 8.784 31.225 301 HA LEU 78 HA LEU 78 0.913 7.075 28.984 302 HB2 LEU 78 HB2 LEU 78 3.165 7.872 29.985 303 HB3 LEU 78 HB1 LEU 78 2.944 6.632 31.189 304 HG LEU 78 HG LEU 78 3.220 6.110 28.223 305 HD11 LEU 78 HD11 LEU 78 5.234 5.844 30.435 306 HD12 LEU 78 HD12 LEU 78 5.241 7.047 29.144 307 HD13 LEU 78 HD13 LEU 78 5.471 5.339 28.759 308 HD21 LEU 78 HD21 LEU 78 3.627 3.774 28.885 309 HD22 LEU 78 HD22 LEU 78 2.022 4.312 29.385 310 HD23 LEU 78 HD23 LEU 78 3.321 4.201 30.570 311 H GLU 79 HN GLU 79 1.072 6.577 32.475 312 HA GLU 79 HA GLU 79 0.150 3.946 32.501 313 HB2 GLU 79 HB2 GLU 79 -0.174 6.093 34.574 314 HB3 GLU 79 HB1 GLU 79 -0.599 4.407 34.822 315 HG2 GLU 79 HG2 GLU 79 1.709 3.809 34.338 316 HG3 GLU 79 HG1 GLU 79 2.128 5.536 34.304 317 H ALA 80 HN ALA 80 -1.508 6.980 32.326 318 HA ALA 80 HA ALA 80 -4.076 5.808 32.722 319 HB1 ALA 80 HB1 ALA 80 -4.939 7.983 32.464 320 HB2 ALA 80 HB2 ALA 80 -3.505 8.500 31.605 321 HB3 ALA 80 HB3 ALA 80 -3.395 8.147 33.333 322 H LEU 81 HN LEU 81 -2.048 5.889 30.068 323 HA LEU 81 HA LEU 81 -4.264 5.631 28.183 324 HB2 LEU 81 HB2 LEU 81 -1.276 5.579 27.784 325 HB3 LEU 81 HB1 LEU 81 -2.422 5.253 26.507 326 HG LEU 81 HG LEU 81 -2.189 7.873 27.995 327 HD11 LEU 81 HD11 LEU 81 -1.267 7.095 25.232 328 HD12 LEU 81 HD12 LEU 81 -0.231 7.452 26.614 329 HD13 LEU 81 HD13 LEU 81 -1.230 8.721 25.905 330 HD21 LEU 81 HD21 LEU 81 -4.452 7.468 27.159 331 HD22 LEU 81 HD22 LEU 81 -3.803 7.092 25.564 332 HD23 LEU 81 HD23 LEU 81 -3.654 8.725 26.214 333 H VAL 82 HN VAL 82 -2.234 3.769 30.107 334 HA VAL 82 HA VAL 82 -2.936 1.311 28.628 335 HB VAL 82 HB VAL 82 -0.908 1.635 30.852 336 HG11 VAL 82 HG11 VAL 82 -1.337 -0.637 28.913 337 HG12 VAL 82 HG12 VAL 82 -1.712 -0.661 30.634 338 HG13 VAL 82 HG13 VAL 82 -0.037 -0.532 30.099 339 HG21 VAL 82 HG21 VAL 82 0.793 1.577 29.075 340 HG22 VAL 82 HG22 VAL 82 -0.292 2.960 28.901 341 HG23 VAL 82 HG23 VAL 82 -0.486 1.564 27.861 342 H LYS 83 HN LYS 83 -3.285 2.873 31.696 343 HA LYS 83 HA LYS 83 -5.049 0.796 32.775 344 HB2 LYS 83 HB2 LYS 83 -2.941 0.886 34.021 345 HB3 LYS 83 HB1 LYS 83 -3.005 2.626 34.094 346 HG2 LYS 83 HG2 LYS 83 -5.032 2.436 35.523 347 HG3 LYS 83 HG1 LYS 83 -4.805 0.685 35.526 348 HD2 LYS 83 HD2 LYS 83 -2.601 0.954 36.485 349 HD3 LYS 83 HD1 LYS 83 -2.780 2.705 36.464 350 HE2 LYS 83 HE2 LYS 83 -4.684 2.528 37.999 351 HE3 LYS 83 HE1 LYS 83 -4.496 0.776 38.023 352 HZ1 LYS 83 HZ1 LYS 83 -2.451 2.726 38.937 353 HZ2 LYS 83 HZ2 LYS 83 -2.321 1.044 38.991 354 HZ3 LYS 83 HZ3 LYS 83 -3.458 1.816 39.941 355 H LYS 84 HN LYS 84 -6.905 1.743 33.843 356 HA LYS 84 HA LYS 84 -7.964 4.049 32.629 357 HB2 LYS 84 HB2 LYS 84 -8.818 2.736 35.238 358 HB3 LYS 84 HB1 LYS 84 -9.755 3.940 34.367 359 HG2 LYS 84 HG2 LYS 84 -9.907 2.446 32.475 360 HG3 LYS 84 HG1 LYS 84 -9.002 1.228 33.376 361 HD2 LYS 84 HD2 LYS 84 -10.714 1.179 35.080 362 HD3 LYS 84 HD1 LYS 84 -11.601 2.462 34.257 363 HE2 LYS 84 HE2 LYS 84 -12.601 0.346 33.737 364 HE3 LYS 84 HE1 LYS 84 -11.822 1.060 32.318 365 HZ1 LYS 84 HZ1 LYS 84 -10.612 -1.101 33.984 366 HZ2 LYS 84 HZ2 LYS 84 -9.984 -0.487 32.540 367 HZ3 LYS 84 HZ3 LYS 84 -11.414 -1.340 32.536 368 HA PRO 85 HA PRO 85 -5.875 7.400 34.452 369 HB2 PRO 85 HB2 PRO 85 -7.774 9.336 34.066 370 HB3 PRO 85 HB1 PRO 85 -6.794 8.683 32.751 371 HG2 PRO 85 HG2 PRO 85 -9.552 7.921 33.588 372 HG3 PRO 85 HG1 PRO 85 -8.923 8.257 31.961 373 HD2 PRO 85 HD2 PRO 85 -9.236 5.763 32.801 374 HD3 PRO 85 HD1 PRO 85 -7.817 6.223 31.837 375 H THR 86 HN THR 86 -5.789 8.626 36.305 376 HA THR 86 HA THR 86 -7.877 8.012 38.221 377 HB THR 86 HB THR 86 -6.138 8.997 39.899 378 HG1 THR 86 HG1 THR 86 -4.428 8.299 37.728 379 HG21 THR 86 HG21 THR 86 -6.830 6.640 39.795 380 HG22 THR 86 HG22 THR 86 -5.117 6.777 40.147 381 HG23 THR 86 HG23 THR 86 -5.652 6.347 38.522 382 H GLY 87 HN GLY 87 -8.845 9.593 39.464 383 HA2 GLY 87 HA2 GLY 87 -9.052 11.940 40.009 384 HA3 GLY 87 HA1 GLY 87 -8.595 12.287 38.343 385 H ASN 88 HN ASN 88 -10.469 13.368 37.849 386 HA ASN 88 HA ASN 88 -12.716 11.573 37.512 387 HB2 ASN 88 HB2 ASN 88 -14.301 13.505 37.914 388 HB3 ASN 88 HB1 ASN 88 -13.432 12.952 39.331 389 HD21 ASN 88 HD21 ASN 88 -11.889 14.335 40.268 390 HD22 ASN 88 HD22 ASN 88 -11.819 16.008 39.863 391 HA PRO 89 HA PRO 89 -11.848 13.181 33.400 392 HB2 PRO 89 HB2 PRO 89 -12.131 10.528 32.295 393 HB3 PRO 89 HB1 PRO 89 -10.644 11.379 32.556 394 HG2 PRO 89 HG2 PRO 89 -11.451 9.121 33.966 395 HG3 PRO 89 HG1 PRO 89 -10.184 10.247 34.472 396 HD2 PRO 89 HD2 PRO 89 -13.031 10.064 35.357 397 HD3 PRO 89 HD1 PRO 89 -11.570 10.455 36.298 398 H GLN 90 HN GLN 90 -13.214 13.313 31.545 399 HA GLN 90 HA GLN 90 -16.010 13.464 32.276 400 HB2 GLN 90 HB2 GLN 90 -14.508 14.317 29.799 401 HB3 GLN 90 HB1 GLN 90 -16.240 14.541 30.003 402 HG2 GLN 90 HG2 GLN 90 -15.859 15.950 31.926 403 HG3 GLN 90 HG1 GLN 90 -14.132 15.677 31.812 404 HE21 GLN 90 HE21 GLN 90 -14.076 15.891 28.879 405 HE22 GLN 90 HE22 GLN 90 -14.324 17.550 28.517 406 HA PRO 91 HA PRO 91 -17.453 9.642 30.792 407 HB2 PRO 91 HB2 PRO 91 -19.728 10.467 29.414 408 HB3 PRO 91 HB1 PRO 91 -19.630 10.120 31.143 409 HG2 PRO 91 HG2 PRO 91 -19.444 12.743 29.725 410 HG3 PRO 91 HG1 PRO 91 -20.273 12.348 31.242 411 HD2 PRO 91 HD2 PRO 91 -17.952 13.611 31.280 412 HD3 PRO 91 HD1 PRO 91 -18.277 12.311 32.450 413 H LYS 92 HN LYS 92 -15.997 8.928 29.381 414 HA LYS 92 HA LYS 92 -16.695 8.912 26.590 415 HB2 LYS 92 HB2 LYS 92 -13.944 9.645 27.658 416 HB3 LYS 92 HB1 LYS 92 -14.231 9.119 26.011 417 HG2 LYS 92 HG2 LYS 92 -15.356 11.619 27.276 418 HG3 LYS 92 HG1 LYS 92 -13.966 11.549 26.191 419 HD2 LYS 92 HD2 LYS 92 -15.401 10.659 24.415 420 HD3 LYS 92 HD1 LYS 92 -16.787 10.719 25.505 421 HE2 LYS 92 HE2 LYS 92 -16.484 13.158 25.704 422 HE3 LYS 92 HE1 LYS 92 -15.159 13.060 24.546 423 HZ1 LYS 92 HZ1 LYS 92 -17.956 12.255 23.987 424 HZ2 LYS 92 HZ2 LYS 92 -16.690 12.235 22.898 425 HZ3 LYS 92 HZ3 LYS 92 -17.254 13.709 23.494 426 H ASN 93 HN ASN 93 -15.967 6.969 25.676 427 HA ASN 93 HA ASN 93 -15.577 4.879 27.634 428 HB2 ASN 93 HB2 ASN 93 -15.797 4.760 24.611 429 HB3 ASN 93 HB1 ASN 93 -15.429 3.351 25.583 430 HD21 ASN 93 HD21 ASN 93 -17.708 5.827 26.618 431 HD22 ASN 93 HD22 ASN 93 -19.109 4.859 26.450 432 H TRP 94 HN TRP 94 -13.615 5.275 28.575 433 HA TRP 94 HA TRP 94 -11.272 5.905 27.351 434 HB2 TRP 94 HB2 TRP 94 -11.568 6.062 29.741 435 HB3 TRP 94 HB1 TRP 94 -11.748 4.312 29.877 436 HD1 TRP 94 HD1 TRP 94 -9.112 7.033 29.337 437 HE1 TRP 94 HE1 TRP 94 -6.770 5.939 29.669 438 HE3 TRP 94 HE3 TRP 94 -10.496 2.141 29.828 439 HZ2 TRP 94 HZ2 TRP 94 -5.709 3.424 30.073 440 HZ3 TRP 94 HZ3 TRP 94 -8.748 0.457 30.201 441 HH2 TRP 94 HH2 TRP 94 -6.409 1.094 30.323 442 H ASN 95 HN ASN 95 -9.617 4.851 26.533 443 HA ASN 95 HA ASN 95 -10.034 2.063 25.948 444 HB2 ASN 95 HB2 ASN 95 -10.579 3.368 23.988 445 HB3 ASN 95 HB1 ASN 95 -9.055 4.232 24.112 446 HD21 ASN 95 HD21 ASN 95 -9.530 0.736 24.545 447 HD22 ASN 95 HD22 ASN 95 -8.503 0.341 23.215 448 H LYS 96 HN LYS 96 -8.144 0.813 26.285 449 HA LYS 96 HA LYS 96 -5.801 2.249 27.227 450 HB2 LYS 96 HB2 LYS 96 -4.951 0.172 27.965 451 HB3 LYS 96 HB1 LYS 96 -6.644 0.232 28.468 452 HG2 LYS 96 HG2 LYS 96 -7.119 -1.166 26.391 453 HG3 LYS 96 HG1 LYS 96 -5.355 -1.300 26.274 454 HD2 LYS 96 HD2 LYS 96 -5.229 -2.322 28.469 455 HD3 LYS 96 HD1 LYS 96 -6.958 -2.110 28.696 456 HE2 LYS 96 HE2 LYS 96 -5.687 -3.831 26.571 457 HE3 LYS 96 HE1 LYS 96 -6.367 -4.424 28.085 458 HZ1 LYS 96 HZ1 LYS 96 -7.869 -3.022 25.935 459 HZ2 LYS 96 HZ2 LYS 96 -8.540 -3.582 27.377 460 HZ3 LYS 96 HZ3 LYS 96 -7.913 -4.666 26.253 461 H ASP 97 HN ASP 97 -3.763 0.927 26.598 462 HA ASP 97 HA ASP 97 -2.212 0.258 25.157 463 HB2 ASP 97 HB2 ASP 97 -4.035 -1.399 24.392 464 HB3 ASP 97 HB1 ASP 97 -4.336 -0.281 23.069 465 H GLY 98 HN GLY 98 -3.699 2.887 25.187 466 HA2 GLY 98 HA2 GLY 98 -2.204 4.750 24.640 467 HA3 GLY 98 HA1 GLY 98 -1.931 3.975 23.104 468 H TYR 99 HN TYR 99 -5.172 3.726 23.843 469 HA TYR 99 HA TYR 99 -7.009 4.596 22.977 470 HB2 TYR 99 HB2 TYR 99 -5.599 6.967 23.826 471 HB3 TYR 99 HB1 TYR 99 -6.418 7.336 22.304 472 HD1 TYR 99 HD2 TYR 99 -6.711 6.374 25.790 473 HD2 TYR 99 HD1 TYR 99 -8.810 7.381 22.252 474 HE1 TYR 99 HE2 TYR 99 -8.741 6.689 27.086 475 HE2 TYR 99 HE1 TYR 99 -10.865 7.704 23.569 476 HH TYR 99 HH TYR 99 -10.770 7.634 26.989 477 H LEU 100 HN LEU 100 -7.242 3.475 21.257 478 HA LEU 100 HA LEU 100 -6.224 4.513 18.710 479 HB2 LEU 100 HB2 LEU 100 -4.792 2.657 19.444 480 HB3 LEU 100 HB1 LEU 100 -6.194 1.653 19.712 481 HG LEU 100 HG LEU 100 -6.624 1.688 17.253 482 HD11 LEU 100 HD11 LEU 100 -3.944 3.034 17.124 483 HD12 LEU 100 HD12 LEU 100 -5.496 3.756 16.689 484 HD13 LEU 100 HD13 LEU 100 -4.854 2.406 15.751 485 HD21 LEU 100 HD21 LEU 100 -5.459 -0.181 18.280 486 HD22 LEU 100 HD22 LEU 100 -3.921 0.665 18.112 487 HD23 LEU 100 HD23 LEU 100 -4.806 0.149 16.677 488 H LYS 101 HN LYS 101 -7.580 3.840 16.938 489 HA LYS 101 HA LYS 101 -10.375 3.466 17.620 490 HB2 LYS 101 HB2 LYS 101 -8.915 3.803 14.991 491 HB3 LYS 101 HB1 LYS 101 -10.655 3.610 15.103 492 HG2 LYS 101 HG2 LYS 101 -9.111 5.872 16.377 493 HG3 LYS 101 HG1 LYS 101 -9.884 5.961 14.793 494 HD2 LYS 101 HD2 LYS 101 -12.049 5.446 15.865 495 HD3 LYS 101 HD1 LYS 101 -11.257 5.461 17.438 496 HE2 LYS 101 HE2 LYS 101 -10.681 7.800 17.169 497 HE3 LYS 101 HE1 LYS 101 -11.321 7.799 15.529 498 HZ1 LYS 101 HZ1 LYS 101 -12.977 7.320 17.969 499 HZ2 LYS 101 HZ2 LYS 101 -13.540 7.475 16.390 500 HZ3 LYS 101 HZ3 LYS 101 -12.841 8.781 17.150 501 H LYS 102 HN LYS 102 -11.364 1.824 15.710 502 HA LYS 102 HA LYS 102 -10.213 -0.706 16.416 503 HB2 LYS 102 HB2 LYS 102 -12.091 -1.844 15.216 504 HB3 LYS 102 HB1 LYS 102 -12.695 -0.629 16.317 505 HG2 LYS 102 HG2 LYS 102 -12.410 -0.207 13.391 506 HG3 LYS 102 HG1 LYS 102 -13.857 -0.868 14.150 507 HD2 LYS 102 HD2 LYS 102 -13.915 1.241 15.550 508 HD3 LYS 102 HD1 LYS 102 -12.658 1.875 14.479 509 HE2 LYS 102 HE2 LYS 102 -14.084 1.448 12.573 510 HE3 LYS 102 HE1 LYS 102 -15.320 0.867 13.694 511 HZ1 LYS 102 HZ1 LYS 102 -15.369 3.072 14.719 512 HZ2 LYS 102 HZ2 LYS 102 -15.780 3.163 13.093 513 HZ3 LYS 102 HZ3 LYS 102 -14.257 3.652 13.588 514 H LEU 103 HN LEU 103 -8.228 -0.261 15.565 515 HA LEU 103 HA LEU 103 -7.927 -0.742 12.669 516 HB2 LEU 103 HB2 LEU 103 -6.262 1.007 14.469 517 HB3 LEU 103 HB1 LEU 103 -5.980 0.735 12.761 518 HG LEU 103 HG LEU 103 -8.391 2.113 13.925 519 HD11 LEU 103 HD11 LEU 103 -6.368 3.404 14.279 520 HD12 LEU 103 HD12 LEU 103 -7.379 4.151 13.040 521 HD13 LEU 103 HD13 LEU 103 -5.945 3.235 12.575 522 HD21 LEU 103 HD21 LEU 103 -8.806 2.799 11.617 523 HD22 LEU 103 HD22 LEU 103 -8.851 1.045 11.792 524 HD23 LEU 103 HD23 LEU 103 -7.434 1.830 11.089 525 HA PRO 104 HA PRO 104 -5.113 -3.906 14.165 526 HB2 PRO 104 HB2 PRO 104 -3.599 -4.228 11.914 527 HB3 PRO 104 HB1 PRO 104 -5.219 -4.916 12.074 528 HG2 PRO 104 HG2 PRO 104 -4.332 -2.461 10.641 529 HG3 PRO 104 HG1 PRO 104 -5.555 -3.650 10.171 530 HD2 PRO 104 HD2 PRO 104 -6.159 -1.221 11.259 531 HD3 PRO 104 HD1 PRO 104 -7.190 -2.651 11.429 532 H VAL 105 HN VAL 105 -2.805 -4.075 14.642 533 HA VAL 105 HA VAL 105 -1.749 -1.460 15.153 534 HB VAL 105 HB VAL 105 -1.805 -3.433 16.754 535 HG11 VAL 105 HG11 VAL 105 0.602 -4.339 15.244 536 HG12 VAL 105 HG12 VAL 105 -0.953 -5.160 15.382 537 HG13 VAL 105 HG13 VAL 105 0.065 -4.955 16.807 538 HG21 VAL 105 HG21 VAL 105 0.094 -2.766 17.971 539 HG22 VAL 105 HG22 VAL 105 -0.552 -1.313 17.196 540 HG23 VAL 105 HG23 VAL 105 0.889 -2.099 16.557 541 H ASP 106 HN ASP 106 1.005 -1.475 14.840 542 HA ASP 106 HA ASP 106 0.930 -1.026 12.050 543 HB2 ASP 106 HB2 ASP 106 3.225 -0.081 12.359 544 HB3 ASP 106 HB1 ASP 106 2.016 0.614 13.430 545 HA PRO 107 HA PRO 107 3.008 -4.397 10.040 546 HB2 PRO 107 HB2 PRO 107 5.105 -3.012 8.944 547 HB3 PRO 107 HB1 PRO 107 3.541 -3.266 8.167 548 HG2 PRO 107 HG2 PRO 107 4.533 -0.876 9.674 549 HG3 PRO 107 HG1 PRO 107 3.492 -0.927 8.240 550 HD2 PRO 107 HD2 PRO 107 2.435 -0.423 10.590 551 HD3 PRO 107 HD1 PRO 107 1.615 -1.533 9.477 552 H TRP 108 HN TRP 108 5.084 -5.399 9.878 553 HA TRP 108 HA TRP 108 6.912 -6.328 10.675 554 HB2 TRP 108 HB2 TRP 108 7.546 -3.844 12.288 555 HB3 TRP 108 HB1 TRP 108 8.681 -5.016 11.637 556 HD1 TRP 108 HD1 TRP 108 8.616 -5.035 8.763 557 HE1 TRP 108 HE1 TRP 108 8.651 -2.951 7.224 558 HE3 TRP 108 HE3 TRP 108 6.959 -1.553 12.099 559 HZ2 TRP 108 HZ2 TRP 108 8.092 -0.210 7.437 560 HZ3 TRP 108 HZ3 TRP 108 6.738 0.790 11.365 561 HH2 TRP 108 HH2 TRP 108 7.272 1.450 9.090 562 H GLY 109 HN GLY 109 4.349 -5.886 12.183 563 HA2 GLY 109 HA2 GLY 109 3.271 -6.537 14.055 564 HA3 GLY 109 HA1 GLY 109 4.626 -7.623 14.320 565 H ASN 110 HN ASN 110 4.899 -3.937 14.452 566 HA ASN 110 HA ASN 110 5.648 -4.397 17.181 567 HB2 ASN 110 HB2 ASN 110 5.505 -1.693 15.875 568 HB3 ASN 110 HB1 ASN 110 6.510 -2.214 17.214 569 HD21 ASN 110 HD21 ASN 110 6.130 -1.901 13.948 570 HD22 ASN 110 HD22 ASN 110 7.678 -2.416 13.404 571 HA PRO 111 HA PRO 111 1.868 -2.374 18.497 572 HB2 PRO 111 HB2 PRO 111 2.958 -1.833 21.082 573 HB3 PRO 111 HB1 PRO 111 1.848 -3.135 20.658 574 HG2 PRO 111 HG2 PRO 111 4.482 -3.486 21.468 575 HG3 PRO 111 HG1 PRO 111 3.513 -4.681 20.589 576 HD2 PRO 111 HD2 PRO 111 5.580 -2.790 19.568 577 HD3 PRO 111 HD1 PRO 111 5.201 -4.455 19.064 578 H TYR 112 HN TYR 112 1.304 -0.193 18.888 579 HA TYR 112 HA TYR 112 3.245 1.671 18.018 580 HB2 TYR 112 HB2 TYR 112 0.421 2.032 19.020 581 HB3 TYR 112 HB1 TYR 112 1.449 3.398 18.599 582 HD1 TYR 112 HD2 TYR 112 2.333 3.555 16.252 583 HD2 TYR 112 HD1 TYR 112 -0.750 0.836 17.333 584 HE1 TYR 112 HE2 TYR 112 1.703 3.348 13.888 585 HE2 TYR 112 HE1 TYR 112 -1.393 0.624 14.958 586 HH TYR 112 HH TYR 112 -1.183 1.852 12.847 587 H GLN 113 HN GLN 113 4.193 3.321 19.104 588 HA GLN 113 HA GLN 113 4.588 2.682 21.957 589 HB2 GLN 113 HB2 GLN 113 6.324 4.757 20.751 590 HB3 GLN 113 HB1 GLN 113 6.745 3.455 21.827 591 HG2 GLN 113 HG2 GLN 113 6.490 3.333 18.828 592 HG3 GLN 113 HG1 GLN 113 7.972 3.328 19.750 593 HE21 GLN 113 HE21 GLN 113 6.817 1.396 21.703 594 HE22 GLN 113 HE22 GLN 113 6.818 -0.114 20.857 595 H TYR 114 HN TYR 114 3.681 3.979 23.343 596 HA TYR 114 HA TYR 114 2.674 6.562 22.428 597 HB2 TYR 114 HB2 TYR 114 1.078 6.171 24.491 598 HB3 TYR 114 HB1 TYR 114 0.747 5.425 22.938 599 HD1 TYR 114 HD2 TYR 114 2.865 4.482 25.940 600 HD2 TYR 114 HD1 TYR 114 -0.119 3.294 23.160 601 HE1 TYR 114 HE2 TYR 114 2.765 2.251 26.986 602 HE2 TYR 114 HE1 TYR 114 -0.248 1.067 24.247 603 HH TYR 114 HH TYR 114 1.406 -0.319 25.483 604 H LEU 115 HN LEU 115 3.707 8.272 23.184 605 HA LEU 115 HA LEU 115 4.341 8.339 26.006 606 HB2 LEU 115 HB2 LEU 115 6.068 9.245 23.718 607 HB3 LEU 115 HB1 LEU 115 6.303 9.879 25.351 608 HG LEU 115 HG LEU 115 6.580 7.003 24.455 609 HD11 LEU 115 HD11 LEU 115 8.655 9.078 25.124 610 HD12 LEU 115 HD12 LEU 115 8.306 8.431 23.521 611 HD13 LEU 115 HD13 LEU 115 8.973 7.381 24.772 612 HD21 LEU 115 HD21 LEU 115 7.611 6.664 26.657 613 HD22 LEU 115 HD22 LEU 115 5.929 7.164 26.800 614 HD23 LEU 115 HD23 LEU 115 7.221 8.328 27.096 615 H ALA 116 HN ALA 116 4.210 10.594 26.896 616 HA ALA 116 HA ALA 116 2.361 12.072 25.257 617 HB1 ALA 116 HB1 ALA 116 2.274 11.950 28.276 618 HB2 ALA 116 HB2 ALA 116 1.435 10.807 27.227 619 HB3 ALA 116 HB3 ALA 116 1.017 12.510 27.149 620 HA PRO 117 HA PRO 117 4.413 15.845 25.248 621 HB2 PRO 117 HB2 PRO 117 3.852 17.620 27.239 622 HB3 PRO 117 HB1 PRO 117 2.889 17.366 25.797 623 HG2 PRO 117 HG2 PRO 117 2.459 16.240 28.534 624 HG3 PRO 117 HG1 PRO 117 1.265 16.859 27.379 625 HD2 PRO 117 HD2 PRO 117 1.721 14.205 27.733 626 HD3 PRO 117 HD1 PRO 117 1.272 14.860 26.137 627 H GLY 118 HN GLY 118 6.345 15.594 25.280 628 HA2 GLY 118 HA2 GLY 118 7.824 15.192 27.728 629 HA3 GLY 118 HA1 GLY 118 8.452 15.184 26.077 630 H THR 119 HN THR 119 9.018 17.069 25.091 631 HA THR 119 HA THR 119 9.443 19.241 27.008 632 HB THR 119 HB THR 119 10.855 19.063 24.391 633 HG1 THR 119 HG1 THR 119 11.268 17.056 25.349 634 HG21 THR 119 HG21 THR 119 11.101 21.083 25.735 635 HG22 THR 119 HG22 THR 119 12.634 20.222 25.643 636 HG23 THR 119 HG23 THR 119 11.659 20.125 27.106 637 H LYS 120 HN LYS 120 7.589 20.334 26.719 638 HA LYS 120 HA LYS 120 6.243 21.971 25.899 639 HB2 LYS 120 HB2 LYS 120 8.155 22.131 23.565 640 HB3 LYS 120 HB1 LYS 120 6.982 23.347 24.036 641 HG2 LYS 120 HG2 LYS 120 9.345 22.450 25.651 642 HG3 LYS 120 HG1 LYS 120 9.266 23.937 24.707 643 HD2 LYS 120 HD2 LYS 120 7.361 24.703 26.084 644 HD3 LYS 120 HD1 LYS 120 7.482 23.232 27.050 645 HE2 LYS 120 HE2 LYS 120 9.634 25.326 26.772 646 HE3 LYS 120 HE1 LYS 120 8.530 25.187 28.136 647 HZ1 LYS 120 HZ1 LYS 120 10.543 23.162 27.308 648 HZ2 LYS 120 HZ2 LYS 120 9.467 22.991 28.600 649 HZ3 LYS 120 HZ3 LYS 120 10.633 24.173 28.646 650 H GLY 121 HN GLY 121 6.708 19.125 24.147 651 HA2 GLY 121 HA2 GLY 121 4.634 19.853 22.234 652 HA3 GLY 121 HA1 GLY 121 5.772 18.514 22.030 653 HA PRO 122 HA PRO 122 1.361 18.043 24.544 654 HB2 PRO 122 HB2 PRO 122 0.558 17.751 21.688 655 HB3 PRO 122 HB1 PRO 122 -0.435 18.157 23.097 656 HG2 PRO 122 HG2 PRO 122 0.441 20.094 21.581 657 HG3 PRO 122 HG1 PRO 122 0.554 20.255 23.345 658 HD2 PRO 122 HD2 PRO 122 2.702 19.716 21.353 659 HD3 PRO 122 HD1 PRO 122 2.779 20.604 22.890 660 H PHE 123 HN PHE 123 2.908 16.090 21.910 661 HA PHE 123 HA PHE 123 2.812 13.866 23.557 662 HB2 PHE 123 HB2 PHE 123 1.212 12.342 22.416 663 HB3 PHE 123 HB1 PHE 123 0.451 13.700 23.197 664 HD1 PHE 123 HD1 PHE 123 1.401 12.347 19.895 665 HD2 PHE 123 HD2 PHE 123 -0.916 15.253 21.994 666 HE1 PHE 123 HE1 PHE 123 0.184 12.872 17.838 667 HE2 PHE 123 HE2 PHE 123 -2.122 15.779 19.933 668 HZ PHE 123 HZ PHE 123 -1.580 14.593 17.846 669 H ASP 124 HN ASP 124 3.675 11.966 22.810 670 HA ASP 124 HA ASP 124 5.419 12.178 20.428 671 HB2 ASP 124 HB2 ASP 124 5.655 10.925 23.126 672 HB3 ASP 124 HB1 ASP 124 6.616 10.269 21.803 673 H LEU 125 HN LEU 125 4.269 10.901 18.860 674 HA LEU 125 HA LEU 125 3.402 8.284 19.823 675 HB2 LEU 125 HB2 LEU 125 1.552 9.990 19.536 676 HB3 LEU 125 HB1 LEU 125 1.910 9.987 17.830 677 HG LEU 125 HG LEU 125 -0.067 8.704 18.476 678 HD11 LEU 125 HD11 LEU 125 2.126 7.050 17.236 679 HD12 LEU 125 HD12 LEU 125 1.022 8.136 16.392 680 HD13 LEU 125 HD13 LEU 125 0.406 6.671 17.163 681 HD21 LEU 125 HD21 LEU 125 0.637 7.852 20.615 682 HD22 LEU 125 HD22 LEU 125 1.892 6.873 19.853 683 HD23 LEU 125 HD23 LEU 125 0.199 6.499 19.573 684 H TYR 126 HN TYR 126 4.228 6.622 18.612 685 HA TYR 126 HA TYR 126 4.817 6.839 15.851 686 HB2 TYR 126 HB2 TYR 126 7.283 6.762 15.937 687 HB3 TYR 126 HB1 TYR 126 6.681 8.257 16.631 688 HD1 TYR 126 HD1 TYR 126 6.593 8.418 19.210 689 HD2 TYR 126 HD2 TYR 126 8.747 5.383 17.136 690 HE1 TYR 126 HE1 TYR 126 7.922 7.994 21.222 691 HE2 TYR 126 HE2 TYR 126 10.083 4.957 19.145 692 HH TYR 126 HH TYR 126 9.197 6.164 22.187 693 H SER 127 HN SER 127 5.894 4.828 15.038 694 HA SER 127 HA SER 127 5.945 2.689 17.027 695 HB2 SER 127 HB2 SER 127 5.220 1.145 15.226 696 HB3 SER 127 HB1 SER 127 3.999 2.358 15.601 697 HG SER 127 HG SER 127 4.947 1.777 13.335 698 H LEU 128 HN LEU 128 7.619 1.172 16.741 699 HA LEU 128 HA LEU 128 10.054 2.237 15.741 700 HB2 LEU 128 HB2 LEU 128 9.279 -0.520 16.603 701 HB3 LEU 128 HB1 LEU 128 10.920 -0.113 16.145 702 HG LEU 128 HG LEU 128 9.353 0.942 18.506 703 HD11 LEU 128 HD11 LEU 128 11.880 -0.684 18.331 704 HD12 LEU 128 HD12 LEU 128 10.290 -1.286 18.788 705 HD13 LEU 128 HD13 LEU 128 11.117 -0.114 19.816 706 HD21 LEU 128 HD21 LEU 128 11.387 2.208 19.090 707 HD22 LEU 128 HD22 LEU 128 10.662 2.782 17.598 708 HD23 LEU 128 HD23 LEU 128 12.103 1.760 17.541 709 H GLY 129 HN GLY 129 11.061 2.073 13.787 710 HA2 GLY 129 HA2 GLY 129 9.799 0.901 11.494 711 HA3 GLY 129 HA1 GLY 129 11.443 1.495 11.551 712 H ALA 130 HN ALA 130 11.154 -0.587 10.076 713 HA ALA 130 HA ALA 130 10.891 -3.110 11.202 714 HB1 ALA 130 HB1 ALA 130 11.739 -4.002 9.178 715 HB2 ALA 130 HB2 ALA 130 12.510 -2.463 8.784 716 HB3 ALA 130 HB3 ALA 130 10.751 -2.578 8.827 717 H ASP 131 HN ASP 131 13.704 -1.119 11.409 718 HA ASP 131 HA ASP 131 15.366 -3.472 11.971 719 HB2 ASP 131 HB2 ASP 131 16.136 -1.388 10.587 720 HB3 ASP 131 HB1 ASP 131 16.367 -0.638 12.162 721 H GLY 132 HN GLY 132 13.238 -1.660 13.601 722 HA2 GLY 132 HA2 GLY 132 12.729 -1.609 15.838 723 HA3 GLY 132 HA1 GLY 132 14.243 -2.446 16.181 724 H LYS 133 HN LYS 133 14.165 0.411 14.262 725 HA LYS 133 HA LYS 133 15.611 1.802 16.393 726 HB2 LYS 133 HB2 LYS 133 15.816 2.091 13.407 727 HB3 LYS 133 HB1 LYS 133 16.608 3.136 14.568 728 HG2 LYS 133 HG2 LYS 133 17.884 1.227 15.394 729 HG3 LYS 133 HG1 LYS 133 17.095 0.193 14.197 730 HD2 LYS 133 HD2 LYS 133 18.014 1.556 12.394 731 HD3 LYS 133 HD1 LYS 133 18.758 2.634 13.573 732 HE2 LYS 133 HE2 LYS 133 19.378 -0.294 13.227 733 HE3 LYS 133 HE1 LYS 133 20.372 1.035 12.636 734 HZ1 LYS 133 HZ1 LYS 133 19.764 0.432 15.481 735 HZ2 LYS 133 HZ2 LYS 133 20.667 1.749 14.936 736 HZ3 LYS 133 HZ3 LYS 133 21.235 0.192 14.699 737 H GLU 134 HN GLU 134 15.087 3.816 16.887 738 HA GLU 134 HA GLU 134 12.960 5.105 15.384 739 HB2 GLU 134 HB2 GLU 134 12.588 5.030 17.764 740 HB3 GLU 134 HB1 GLU 134 14.221 5.545 18.135 741 HG2 GLU 134 HG2 GLU 134 12.218 7.351 16.780 742 HG3 GLU 134 HG1 GLU 134 12.281 7.184 18.530 743 H GLY 135 HN GLY 135 13.802 6.012 13.715 744 HA2 GLY 135 HA2 GLY 135 16.215 7.575 13.770 745 HA3 GLY 135 HA1 GLY 135 16.353 6.065 12.877 746 H GLY 136 HN GLY 136 16.810 7.900 11.251 747 HA2 GLY 136 HA2 GLY 136 14.280 8.436 9.858 748 HA3 GLY 136 HA1 GLY 136 15.748 9.412 9.667 749 H SER 137 HN SER 137 14.065 7.374 7.954 750 HA SER 137 HA SER 137 16.023 6.299 6.296 751 HB2 SER 137 HB2 SER 137 14.915 4.428 8.423 752 HB3 SER 137 HB1 SER 137 15.634 3.830 6.922 753 HG SER 137 HG SER 137 17.100 5.619 8.442 754 H ASP 138 HN ASP 138 14.782 4.367 5.024 755 HA ASP 138 HA ASP 138 12.227 5.425 4.157 756 HB2 ASP 138 HB2 ASP 138 13.586 2.803 3.455 757 HB3 ASP 138 HB1 ASP 138 12.156 3.450 2.680 758 H ASN 139 HN ASN 139 13.085 2.213 5.249 759 HA ASN 139 HA ASN 139 10.369 1.908 6.364 760 HB2 ASN 139 HB2 ASN 139 10.857 0.563 4.362 761 HB3 ASN 139 HB1 ASN 139 12.267 -0.101 5.164 762 HD21 ASN 139 HD21 ASN 139 12.003 -1.664 6.696 763 HD22 ASN 139 HD22 ASN 139 10.528 -2.536 6.848 764 H ASP 140 HN ASP 140 13.721 1.892 7.053 765 HA ASP 140 HA ASP 140 13.555 0.203 9.415 766 HB2 ASP 140 HB2 ASP 140 15.809 1.996 8.484 767 HB3 ASP 140 HB1 ASP 140 15.887 0.935 9.878 768 H ALA 141 HN ALA 141 12.677 3.260 8.721 769 HA ALA 141 HA ALA 141 13.533 4.573 11.168 770 HB1 ALA 141 HB1 ALA 141 12.426 6.513 10.245 771 HB2 ALA 141 HB2 ALA 141 11.823 5.544 8.901 772 HB3 ALA 141 HB3 ALA 141 13.554 5.821 9.084 773 H ASP 142 HN ASP 142 12.053 5.505 12.600 774 HA ASP 142 HA ASP 142 9.680 3.966 13.021 775 HB2 ASP 142 HB2 ASP 142 9.415 5.289 15.037 776 HB3 ASP 142 HB1 ASP 142 11.085 4.757 14.948 777 H ILE 143 HN ILE 143 7.715 4.665 12.561 778 HA ILE 143 HA ILE 143 7.609 7.205 11.191 779 HB ILE 143 HB ILE 143 5.399 6.467 10.285 780 HG12 ILE 143 HG12 ILE 143 5.113 3.843 10.323 781 HG13 ILE 143 HG11 ILE 143 6.016 3.958 11.821 782 HG21 ILE 143 HG21 ILE 143 7.376 6.212 8.945 783 HG22 ILE 143 HG22 ILE 143 6.284 4.856 8.667 784 HG23 ILE 143 HG23 ILE 143 7.711 4.645 9.685 785 HD11 ILE 143 HD11 ILE 143 3.659 3.910 12.276 786 HD12 ILE 143 HD12 ILE 143 3.392 5.282 11.206 787 HD13 ILE 143 HD13 ILE 143 4.313 5.492 12.701 788 H GLY 144 HN GLY 144 6.464 8.894 12.005 789 HA2 GLY 144 HA2 GLY 144 4.979 8.316 14.431 790 HA3 GLY 144 HA1 GLY 144 6.382 9.361 14.549 791 H ASN 145 HN ASN 145 3.769 9.882 15.220 792 HA ASN 145 HA ASN 145 3.121 12.133 13.458 793 HB2 ASN 145 HB2 ASN 145 1.307 10.446 13.400 794 HB3 ASN 145 HB1 ASN 145 1.263 10.426 15.160 795 HD21 ASN 145 HD21 ASN 145 0.296 12.079 16.217 796 HD22 ASN 145 HD22 ASN 145 -0.711 13.267 15.459 797 H TRP 146 HN TRP 146 3.163 14.073 14.592 798 HA TRP 146 HA TRP 146 3.650 13.852 17.475 799 HB2 TRP 146 HB2 TRP 146 5.725 13.659 15.963 800 HB3 TRP 146 HB1 TRP 146 5.435 15.343 15.579 801 HD1 TRP 146 HD1 TRP 146 5.438 16.998 17.962 802 HE1 TRP 146 HE1 TRP 146 7.168 16.845 19.889 803 HE3 TRP 146 HE3 TRP 146 7.170 12.277 17.131 804 HZ2 TRP 146 HZ2 TRP 146 9.010 14.977 20.882 805 HZ3 TRP 146 HZ3 TRP 146 8.925 11.389 18.602 806 HH2 TRP 146 HH2 TRP 146 9.816 12.711 20.427 807 H ASP 147 HN ASP 147 3.039 15.700 18.508 808 HA ASP 147 HA ASP 147 2.368 18.013 16.879 809 HB2 ASP 147 HB2 ASP 147 0.258 16.858 17.534 810 HB3 ASP 147 HB1 ASP 147 0.726 17.034 19.224 811 H ASN 148 HN ASN 148 3.632 19.523 17.446 812 HA ASN 148 HA ASN 148 4.399 19.843 20.243 813 HB2 ASN 148 HB2 ASN 148 6.321 18.966 18.929 814 HB3 ASN 148 HB1 ASN 148 6.142 20.298 17.794 815 HD21 ASN 148 HD21 ASN 148 6.865 22.336 18.395 816 HD22 ASN 148 HD22 ASN 148 7.814 22.615 19.817 Start of MODEL 11 1 H1 MET 39 HT1 MET 39 2.500 4.813 -0.499 2 H2 MET 39 HT2 MET 39 2.598 5.516 -2.000 3 H3 MET 39 HT3 MET 39 3.248 6.330 -0.667 4 HA MET 39 HA MET 39 4.894 5.319 -2.111 5 HB2 MET 39 HB2 MET 39 4.747 3.912 0.597 6 HB3 MET 39 HB1 MET 39 6.151 4.035 -0.436 7 HG2 MET 39 HG2 MET 39 6.393 5.590 1.334 8 HG3 MET 39 HG1 MET 39 6.108 6.491 -0.152 9 HE1 MET 39 HE1 MET 39 5.918 7.848 2.685 10 HE2 MET 39 HE2 MET 39 4.436 8.786 2.512 11 HE3 MET 39 HE3 MET 39 5.579 8.691 1.173 12 H SER 40 HN SER 40 4.482 4.111 -3.848 13 HA SER 40 HA SER 40 3.074 1.619 -3.508 14 HB2 SER 40 HB2 SER 40 3.838 3.106 -6.024 15 HB3 SER 40 HB1 SER 40 2.742 1.726 -5.918 16 HG SER 40 HG SER 40 1.408 2.966 -4.583 17 H ARG 41 HN ARG 41 5.242 0.979 -2.405 18 HA ARG 41 HA ARG 41 6.453 -0.900 -4.216 19 HB2 ARG 41 HB2 ARG 41 8.152 1.019 -2.558 20 HB3 ARG 41 HB1 ARG 41 8.769 -0.493 -3.184 21 HG2 ARG 41 HG2 ARG 41 8.132 0.432 -5.497 22 HG3 ARG 41 HG1 ARG 41 7.986 1.989 -4.684 23 HD2 ARG 41 HD2 ARG 41 10.469 0.250 -4.729 24 HD3 ARG 41 HD1 ARG 41 10.209 1.667 -5.725 25 HE ARG 41 HE ARG 41 9.948 2.699 -3.281 26 HH11 ARG 41 HH11 ARG 41 12.439 0.452 -4.460 27 HH12 ARG 41 HH12 ARG 41 13.681 1.118 -3.531 28 HH21 ARG 41 HH21 ARG 41 11.655 3.609 -2.023 29 HH22 ARG 41 HH22 ARG 41 13.237 2.992 -2.092 30 HA PRO 42 HA PRO 42 5.828 -3.553 -0.648 31 HB2 PRO 42 HB2 PRO 42 8.533 -4.626 -1.331 32 HB3 PRO 42 HB1 PRO 42 7.026 -5.501 -1.057 33 HG2 PRO 42 HG2 PRO 42 7.971 -5.176 -3.517 34 HG3 PRO 42 HG1 PRO 42 6.229 -5.072 -3.192 35 HD2 PRO 42 HD2 PRO 42 8.194 -2.895 -3.738 36 HD3 PRO 42 HD1 PRO 42 6.487 -3.019 -4.201 37 H ASP 43 HN ASP 43 6.653 -3.750 1.481 38 HA ASP 43 HA ASP 43 7.622 -3.078 3.370 39 HB2 ASP 43 HB2 ASP 43 9.870 -2.004 1.610 40 HB3 ASP 43 HB1 ASP 43 9.888 -1.877 3.361 41 H GLN 44 HN GLN 44 8.021 -0.513 0.960 42 HA GLN 44 HA GLN 44 7.327 1.517 2.834 43 HB2 GLN 44 HB2 GLN 44 7.226 1.681 -0.170 44 HB3 GLN 44 HB1 GLN 44 7.050 3.022 0.952 45 HG2 GLN 44 HG2 GLN 44 9.323 2.558 1.794 46 HG3 GLN 44 HG1 GLN 44 9.494 1.349 0.518 47 HE21 GLN 44 HE21 GLN 44 9.289 4.758 1.226 48 HE22 GLN 44 HE22 GLN 44 9.756 5.275 -0.345 49 H ALA 45 HN ALA 45 5.492 -0.655 1.045 50 HA ALA 45 HA ALA 45 2.981 0.652 1.050 51 HB1 ALA 45 HB1 ALA 45 2.029 -1.592 0.804 52 HB2 ALA 45 HB2 ALA 45 3.578 -2.307 1.246 53 HB3 ALA 45 HB3 ALA 45 3.424 -1.396 -0.256 54 H LYS 46 HN LYS 46 4.862 -0.889 3.521 55 HA LYS 46 HA LYS 46 2.674 -1.005 5.402 56 HB2 LYS 46 HB2 LYS 46 5.649 -1.299 5.807 57 HB3 LYS 46 HB1 LYS 46 4.423 -1.655 7.008 58 HG2 LYS 46 HG2 LYS 46 3.559 -3.426 5.523 59 HG3 LYS 46 HG1 LYS 46 4.905 -3.105 4.421 60 HD2 LYS 46 HD2 LYS 46 6.482 -3.600 6.229 61 HD3 LYS 46 HD1 LYS 46 5.133 -3.937 7.309 62 HE2 LYS 46 HE2 LYS 46 5.926 -5.475 4.837 63 HE3 LYS 46 HE1 LYS 46 6.001 -5.968 6.539 64 HZ1 LYS 46 HZ1 LYS 46 3.495 -5.426 5.050 65 HZ2 LYS 46 HZ2 LYS 46 3.612 -5.948 6.648 66 HZ3 LYS 46 HZ3 LYS 46 4.125 -6.943 5.401 67 H VAL 47 HN VAL 47 5.113 1.156 4.337 68 HA VAL 47 HA VAL 47 5.208 2.802 6.668 69 HB VAL 47 HB VAL 47 6.050 3.411 3.818 70 HG11 VAL 47 HG11 VAL 47 6.756 4.818 6.388 71 HG12 VAL 47 HG12 VAL 47 5.753 5.448 5.077 72 HG13 VAL 47 HG13 VAL 47 7.470 5.149 4.807 73 HG21 VAL 47 HG21 VAL 47 7.190 1.485 4.807 74 HG22 VAL 47 HG22 VAL 47 7.721 2.507 6.149 75 HG23 VAL 47 HG23 VAL 47 8.263 2.844 4.495 76 H THR 48 HN THR 48 3.565 2.947 3.551 77 HA THR 48 HA THR 48 2.448 5.485 4.002 78 HB THR 48 HB THR 48 2.710 4.675 1.733 79 HG1 THR 48 HG1 THR 48 1.065 6.184 2.044 80 HG21 THR 48 HG21 THR 48 0.563 2.645 2.372 81 HG22 THR 48 HG22 THR 48 2.262 2.303 2.061 82 HG23 THR 48 HG23 THR 48 1.243 2.945 0.770 83 H VAL 49 HN VAL 49 1.183 2.248 4.646 84 HA VAL 49 HA VAL 49 -1.364 3.221 5.444 85 HB VAL 49 HB VAL 49 -1.213 0.914 4.675 86 HG11 VAL 49 HG11 VAL 49 1.028 0.388 5.282 87 HG12 VAL 49 HG12 VAL 49 -0.059 -0.833 5.948 88 HG13 VAL 49 HG13 VAL 49 0.623 0.417 6.999 89 HG21 VAL 49 HG21 VAL 49 -1.858 0.985 7.622 90 HG22 VAL 49 HG22 VAL 49 -2.323 -0.300 6.507 91 HG23 VAL 49 HG23 VAL 49 -2.970 1.326 6.295 92 H ALA 50 HN ALA 50 1.678 2.645 7.083 93 HA ALA 50 HA ALA 50 0.687 2.724 9.705 94 HB1 ALA 50 HB1 ALA 50 3.412 3.454 8.697 95 HB2 ALA 50 HB2 ALA 50 2.864 1.808 9.052 96 HB3 ALA 50 HB3 ALA 50 2.964 3.008 10.346 97 H LYS 51 HN LYS 51 1.907 5.195 7.472 98 HA LYS 51 HA LYS 51 1.941 7.254 9.348 99 HB2 LYS 51 HB2 LYS 51 1.651 7.364 6.353 100 HB3 LYS 51 HB1 LYS 51 1.869 8.789 7.358 101 HG2 LYS 51 HG2 LYS 51 4.033 7.941 8.110 102 HG3 LYS 51 HG1 LYS 51 3.770 6.481 7.149 103 HD2 LYS 51 HD2 LYS 51 3.797 7.700 5.121 104 HD3 LYS 51 HD1 LYS 51 3.813 9.252 5.964 105 HE2 LYS 51 HE2 LYS 51 6.022 7.193 6.133 106 HE3 LYS 51 HE1 LYS 51 6.034 8.556 5.015 107 HZ1 LYS 51 HZ1 LYS 51 5.978 8.782 7.994 108 HZ2 LYS 51 HZ2 LYS 51 6.035 10.051 6.898 109 HZ3 LYS 51 HZ3 LYS 51 7.323 9.004 7.002 110 H GLY 52 HN GLY 52 -0.626 5.820 7.571 111 HA2 GLY 52 HA2 GLY 52 -2.447 7.997 8.008 112 HA3 GLY 52 HA1 GLY 52 -2.863 6.408 7.357 113 H ASP 53 HN ASP 53 -1.526 5.042 9.559 114 HA ASP 53 HA ASP 53 -3.769 5.317 11.312 115 HB2 ASP 53 HB2 ASP 53 -1.930 2.999 10.910 116 HB3 ASP 53 HB1 ASP 53 -3.124 3.048 12.217 117 H ILE 54 HN ILE 54 -0.495 6.025 11.485 118 HA ILE 54 HA ILE 54 -0.585 6.478 14.295 119 HB ILE 54 HB ILE 54 1.274 8.136 13.927 120 HG12 ILE 54 HG12 ILE 54 0.858 7.340 11.049 121 HG13 ILE 54 HG11 ILE 54 0.616 8.931 11.740 122 HG21 ILE 54 HG21 ILE 54 1.634 5.426 12.679 123 HG22 ILE 54 HG22 ILE 54 1.777 5.833 14.393 124 HG23 ILE 54 HG23 ILE 54 2.933 6.482 13.232 125 HD11 ILE 54 HD11 ILE 54 2.649 8.857 10.467 126 HD12 ILE 54 HD12 ILE 54 3.226 7.494 11.427 127 HD13 ILE 54 HD13 ILE 54 3.019 9.078 12.177 128 H LYS 55 HN LYS 55 -1.724 8.193 11.510 129 HA LYS 55 HA LYS 55 -2.356 10.598 12.926 130 HB2 LYS 55 HB2 LYS 55 -2.884 9.547 10.222 131 HB3 LYS 55 HB1 LYS 55 -4.022 10.734 10.830 132 HG2 LYS 55 HG2 LYS 55 -2.231 11.774 9.507 133 HG3 LYS 55 HG1 LYS 55 -2.247 12.340 11.175 134 HD2 LYS 55 HD2 LYS 55 -0.409 10.789 11.685 135 HD3 LYS 55 HD1 LYS 55 -0.382 10.284 9.994 136 HE2 LYS 55 HE2 LYS 55 0.139 13.066 11.035 137 HE3 LYS 55 HE1 LYS 55 1.359 11.926 10.474 138 HZ1 LYS 55 HZ1 LYS 55 -0.815 13.091 8.821 139 HZ2 LYS 55 HZ2 LYS 55 0.370 12.023 8.265 140 HZ3 LYS 55 HZ3 LYS 55 0.800 13.566 8.810 141 H ALA 56 HN ALA 56 -3.888 7.605 12.348 142 HA ALA 56 HA ALA 56 -6.510 8.154 13.163 143 HB1 ALA 56 HB1 ALA 56 -6.616 5.757 13.659 144 HB2 ALA 56 HB2 ALA 56 -4.847 5.711 13.615 145 HB3 ALA 56 HB3 ALA 56 -5.749 6.067 12.137 146 H ILE 57 HN ILE 57 -3.636 7.232 14.957 147 HA ILE 57 HA ILE 57 -4.754 7.077 17.550 148 HB ILE 57 HB ILE 57 -1.922 7.972 16.959 149 HG12 ILE 57 HG12 ILE 57 -2.875 5.141 17.229 150 HG13 ILE 57 HG11 ILE 57 -2.641 5.904 15.656 151 HG21 ILE 57 HG21 ILE 57 -3.175 6.409 19.230 152 HG22 ILE 57 HG22 ILE 57 -2.634 8.086 19.296 153 HG23 ILE 57 HG23 ILE 57 -1.458 6.786 19.075 154 HD11 ILE 57 HD11 ILE 57 -0.567 5.359 17.761 155 HD12 ILE 57 HD12 ILE 57 -0.301 6.282 16.282 156 HD13 ILE 57 HD13 ILE 57 -0.787 4.587 16.180 157 H ALA 58 HN ALA 58 -3.240 9.702 15.774 158 HA ALA 58 HA ALA 58 -3.191 11.666 17.760 159 HB1 ALA 58 HB1 ALA 58 -3.006 13.288 15.960 160 HB2 ALA 58 HB2 ALA 58 -3.565 12.083 14.800 161 HB3 ALA 58 HB3 ALA 58 -2.018 11.868 15.620 162 H ALA 59 HN ALA 59 -5.844 10.473 15.923 163 HA ALA 59 HA ALA 59 -7.555 12.724 16.524 164 HB1 ALA 59 HB1 ALA 59 -9.264 11.475 15.309 165 HB2 ALA 59 HB2 ALA 59 -8.191 10.079 15.220 166 HB3 ALA 59 HB3 ALA 59 -7.771 11.568 14.373 167 H ALA 60 HN ALA 60 -6.965 9.444 17.627 168 HA ALA 60 HA ALA 60 -9.272 9.477 19.343 169 HB1 ALA 60 HB1 ALA 60 -8.538 7.300 20.099 170 HB2 ALA 60 HB2 ALA 60 -7.009 7.506 19.277 171 HB3 ALA 60 HB3 ALA 60 -8.504 7.367 18.332 172 H LEU 61 HN LEU 61 -5.862 10.157 19.664 173 HA LEU 61 HA LEU 61 -5.897 10.275 22.515 174 HB2 LEU 61 HB2 LEU 61 -3.926 10.332 20.652 175 HB3 LEU 61 HB1 LEU 61 -4.052 12.045 20.994 176 HG LEU 61 HG LEU 61 -3.494 9.916 23.073 177 HD11 LEU 61 HD11 LEU 61 -1.624 11.835 21.735 178 HD12 LEU 61 HD12 LEU 61 -1.674 10.084 21.517 179 HD13 LEU 61 HD13 LEU 61 -1.223 10.767 23.081 180 HD21 LEU 61 HD21 LEU 61 -2.871 11.783 24.508 181 HD22 LEU 61 HD22 LEU 61 -4.558 11.905 24.003 182 HD23 LEU 61 HD23 LEU 61 -3.332 12.917 23.239 183 H ASP 62 HN ASP 62 -6.837 12.405 19.974 184 HA ASP 62 HA ASP 62 -7.302 14.731 21.539 185 HB2 ASP 62 HB2 ASP 62 -7.162 14.891 19.109 186 HB3 ASP 62 HB1 ASP 62 -8.517 13.794 18.917 187 H MET 63 HN MET 63 -8.967 11.769 21.084 188 HA MET 63 HA MET 63 -11.465 12.633 22.215 189 HB2 MET 63 HB2 MET 63 -11.433 10.786 20.617 190 HB3 MET 63 HB1 MET 63 -10.374 9.863 21.663 191 HG2 MET 63 HG2 MET 63 -12.180 9.773 23.352 192 HG3 MET 63 HG1 MET 63 -13.224 10.633 22.232 193 HE1 MET 63 HE1 MET 63 -12.393 9.359 19.402 194 HE2 MET 63 HE2 MET 63 -14.019 9.741 19.948 195 HE3 MET 63 HE3 MET 63 -13.668 8.141 19.292 196 H TYR 64 HN TYR 64 -8.569 10.928 23.368 197 HA TYR 64 HA TYR 64 -9.381 10.544 26.108 198 HB2 TYR 64 HB2 TYR 64 -7.367 9.492 25.166 199 HB3 TYR 64 HB1 TYR 64 -6.624 11.081 24.982 200 HD1 TYR 64 HD1 TYR 64 -7.790 8.575 27.494 201 HD2 TYR 64 HD2 TYR 64 -5.664 12.224 26.877 202 HE1 TYR 64 HE1 TYR 64 -6.951 8.403 29.608 203 HE2 TYR 64 HE2 TYR 64 -4.807 12.054 29.115 204 HH TYR 64 HH TYR 64 -5.222 9.139 30.835 205 H LYS 65 HN LYS 65 -7.764 13.103 24.333 206 HA LYS 65 HA LYS 65 -7.319 15.041 26.206 207 HB2 LYS 65 HB2 LYS 65 -6.573 15.257 24.005 208 HB3 LYS 65 HB1 LYS 65 -8.180 15.005 23.370 209 HG2 LYS 65 HG2 LYS 65 -8.808 17.219 24.232 210 HG3 LYS 65 HG1 LYS 65 -7.102 17.484 24.679 211 HD2 LYS 65 HD2 LYS 65 -6.439 17.015 22.390 212 HD3 LYS 65 HD1 LYS 65 -8.115 16.736 21.950 213 HE2 LYS 65 HE2 LYS 65 -8.625 19.033 22.431 214 HE3 LYS 65 HE1 LYS 65 -6.949 19.322 22.910 215 HZ1 LYS 65 HZ1 LYS 65 -7.825 18.377 20.242 216 HZ2 LYS 65 HZ2 LYS 65 -6.240 18.711 20.711 217 HZ3 LYS 65 HZ3 LYS 65 -7.367 19.973 20.604 218 H LEU 66 HN LEU 66 -10.293 14.116 24.596 219 HA LEU 66 HA LEU 66 -11.779 16.160 25.942 220 HB2 LEU 66 HB2 LEU 66 -12.401 15.349 23.706 221 HB3 LEU 66 HB1 LEU 66 -12.743 13.771 24.380 222 HG LEU 66 HG LEU 66 -14.561 14.776 25.731 223 HD11 LEU 66 HD11 LEU 66 -15.335 17.014 25.215 224 HD12 LEU 66 HD12 LEU 66 -13.958 17.250 24.139 225 HD13 LEU 66 HD13 LEU 66 -13.701 17.047 25.871 226 HD21 LEU 66 HD21 LEU 66 -14.712 15.251 22.769 227 HD22 LEU 66 HD22 LEU 66 -16.088 15.122 23.868 228 HD23 LEU 66 HD23 LEU 66 -15.026 13.734 23.612 229 H ASP 67 HN ASP 67 -11.089 12.698 26.450 230 HA ASP 67 HA ASP 67 -13.134 12.228 28.357 231 HB2 ASP 67 HB2 ASP 67 -12.016 10.425 27.118 232 HB3 ASP 67 HB1 ASP 67 -10.524 10.772 27.976 233 H ASN 68 HN ASN 68 -9.818 13.469 28.635 234 HA ASN 68 HA ASN 68 -10.331 13.982 31.552 235 HB2 ASN 68 HB2 ASN 68 -7.644 13.495 30.277 236 HB3 ASN 68 HB1 ASN 68 -7.995 14.100 31.890 237 HD21 ASN 68 HD21 ASN 68 -9.720 11.407 30.380 238 HD22 ASN 68 HD22 ASN 68 -9.155 10.208 31.427 239 H PHE 69 HN PHE 69 -10.791 15.488 29.059 240 HA PHE 69 HA PHE 69 -10.475 17.590 28.227 241 HB2 PHE 69 HB2 PHE 69 -10.765 19.342 30.092 242 HB3 PHE 69 HB1 PHE 69 -12.045 18.173 29.839 243 HD1 PHE 69 HD2 PHE 69 -9.302 19.100 31.939 244 HD2 PHE 69 HD1 PHE 69 -12.556 16.605 31.485 245 HE1 PHE 69 HE2 PHE 69 -9.178 18.611 34.348 246 HE2 PHE 69 HE1 PHE 69 -12.542 16.015 33.856 247 HZ PHE 69 HZ PHE 69 -10.823 17.024 35.343 248 H ALA 70 HN ALA 70 -8.010 16.337 28.396 249 HA ALA 70 HA ALA 70 -6.115 18.407 28.240 250 HB1 ALA 70 HB1 ALA 70 -6.439 18.522 30.637 251 HB2 ALA 70 HB2 ALA 70 -4.845 17.781 30.325 252 HB3 ALA 70 HB3 ALA 70 -6.255 16.788 30.759 253 H TYR 71 HN TYR 71 -4.021 17.481 27.747 254 HA TYR 71 HA TYR 71 -4.145 14.770 26.810 255 HB2 TYR 71 HB2 TYR 71 -1.975 16.870 26.682 256 HB3 TYR 71 HB1 TYR 71 -1.704 15.226 26.142 257 HD1 TYR 71 HD2 TYR 71 -4.034 14.477 24.658 258 HD2 TYR 71 HD1 TYR 71 -2.145 18.281 24.900 259 HE1 TYR 71 HE2 TYR 71 -4.958 15.038 22.509 260 HE2 TYR 71 HE1 TYR 71 -3.058 18.874 22.711 261 HH TYR 71 HH TYR 71 -3.881 17.704 20.666 262 HA PRO 72 HA PRO 72 -2.477 12.614 30.260 263 HB2 PRO 72 HB2 PRO 72 -0.755 10.895 28.975 264 HB3 PRO 72 HB1 PRO 72 -2.514 10.704 28.973 265 HG2 PRO 72 HG2 PRO 72 -0.724 11.947 26.925 266 HG3 PRO 72 HG1 PRO 72 -2.035 10.771 26.698 267 HD2 PRO 72 HD2 PRO 72 -2.443 13.323 26.212 268 HD3 PRO 72 HD1 PRO 72 -3.677 12.354 27.039 269 H SER 73 HN SER 73 -0.415 12.225 31.566 270 HA SER 73 HA SER 73 1.733 13.984 30.681 271 HB2 SER 73 HB2 SER 73 2.630 13.599 32.985 272 HB3 SER 73 HB1 SER 73 1.011 14.292 33.018 273 HG SER 73 HG SER 73 0.358 12.669 33.997 274 H THR 74 HN THR 74 3.917 13.019 30.738 275 HA THR 74 HA THR 74 3.841 10.598 29.306 276 HB THR 74 HB THR 74 5.594 12.644 29.400 277 HG1 THR 74 HG1 THR 74 6.166 11.559 27.765 278 HG21 THR 74 HG21 THR 74 6.955 10.439 30.978 279 HG22 THR 74 HG22 THR 74 6.437 11.963 31.649 280 HG23 THR 74 HG23 THR 74 7.721 11.938 30.424 281 H GLN 75 HN GLN 75 3.831 11.238 32.619 282 HA GLN 75 HA GLN 75 4.811 8.557 33.237 283 HB2 GLN 75 HB2 GLN 75 3.966 10.552 35.319 284 HB3 GLN 75 HB1 GLN 75 5.147 9.249 35.441 285 HG2 GLN 75 HG2 GLN 75 6.506 11.076 35.472 286 HG3 GLN 75 HG1 GLN 75 6.468 10.747 33.738 287 HE21 GLN 75 HE21 GLN 75 5.427 12.851 36.261 288 HE22 GLN 75 HE22 GLN 75 4.845 14.127 35.254 289 H GLN 76 HN GLN 76 2.097 10.698 34.321 290 HA GLN 76 HA GLN 76 0.571 8.388 35.243 291 HB2 GLN 76 HB2 GLN 76 -0.105 11.325 35.234 292 HB3 GLN 76 HB1 GLN 76 -1.040 10.055 35.987 293 HG2 GLN 76 HG2 GLN 76 1.777 10.760 36.772 294 HG3 GLN 76 HG1 GLN 76 0.327 11.328 37.603 295 HE21 GLN 76 HE21 GLN 76 2.377 8.584 36.966 296 HE22 GLN 76 HE22 GLN 76 1.695 7.565 38.169 297 H GLY 77 HN GLY 77 0.470 10.682 32.627 298 HA2 GLY 77 HA2 GLY 77 -2.074 9.662 31.836 299 HA3 GLY 77 HA1 GLY 77 -1.063 10.716 30.875 300 H LEU 78 HN LEU 78 1.233 8.710 31.266 301 HA LEU 78 HA LEU 78 0.720 7.168 28.916 302 HB2 LEU 78 HB2 LEU 78 3.019 7.897 29.832 303 HB3 LEU 78 HB1 LEU 78 2.861 6.607 30.994 304 HG LEU 78 HG LEU 78 2.963 6.163 27.999 305 HD11 LEU 78 HD11 LEU 78 5.153 5.936 30.039 306 HD12 LEU 78 HD12 LEU 78 5.020 7.160 28.777 307 HD13 LEU 78 HD13 LEU 78 5.269 5.467 28.342 308 HD21 LEU 78 HD21 LEU 78 1.918 4.315 29.247 309 HD22 LEU 78 HD22 LEU 78 3.328 4.237 30.304 310 HD23 LEU 78 HD23 LEU 78 3.488 3.843 28.591 311 H GLU 79 HN GLU 79 0.940 6.448 32.362 312 HA GLU 79 HA GLU 79 0.022 3.825 32.229 313 HB2 GLU 79 HB2 GLU 79 -0.286 5.865 34.432 314 HB3 GLU 79 HB1 GLU 79 -0.735 4.173 34.591 315 HG2 GLU 79 HG2 GLU 79 1.610 3.583 34.064 316 HG3 GLU 79 HG1 GLU 79 2.010 5.302 34.145 317 H ALA 80 HN ALA 80 -1.657 6.882 32.309 318 HA ALA 80 HA ALA 80 -4.239 5.693 32.544 319 HB1 ALA 80 HB1 ALA 80 -3.599 8.442 31.602 320 HB2 ALA 80 HB2 ALA 80 -3.566 7.988 33.290 321 HB3 ALA 80 HB3 ALA 80 -5.093 7.872 32.351 322 H LEU 81 HN LEU 81 -2.159 5.874 29.960 323 HA LEU 81 HA LEU 81 -4.281 5.849 27.965 324 HB2 LEU 81 HB2 LEU 81 -1.285 5.659 27.740 325 HB3 LEU 81 HB1 LEU 81 -2.362 5.445 26.383 326 HG LEU 81 HG LEU 81 -2.060 7.977 28.007 327 HD11 LEU 81 HD11 LEU 81 -1.092 7.295 25.232 328 HD12 LEU 81 HD12 LEU 81 -0.081 7.518 26.658 329 HD13 LEU 81 HD13 LEU 81 -0.985 8.878 25.999 330 HD21 LEU 81 HD21 LEU 81 -4.315 7.763 27.098 331 HD22 LEU 81 HD22 LEU 81 -3.654 7.411 25.503 332 HD23 LEU 81 HD23 LEU 81 -3.421 9.004 26.220 333 H VAL 82 HN VAL 82 -2.315 3.720 29.780 334 HA VAL 82 HA VAL 82 -3.206 1.446 28.106 335 HB VAL 82 HB VAL 82 -1.102 1.386 30.279 336 HG11 VAL 82 HG11 VAL 82 -1.678 -0.525 28.022 337 HG12 VAL 82 HG12 VAL 82 -2.005 -0.796 29.735 338 HG13 VAL 82 HG13 VAL 82 -0.342 -0.658 29.164 339 HG21 VAL 82 HG21 VAL 82 -0.729 1.787 27.311 340 HG22 VAL 82 HG22 VAL 82 0.570 1.516 28.470 341 HG23 VAL 82 HG23 VAL 82 -0.419 2.972 28.572 342 H LYS 83 HN LYS 83 -3.529 2.867 31.189 343 HA LYS 83 HA LYS 83 -5.168 0.704 32.309 344 HB2 LYS 83 HB2 LYS 83 -2.908 0.880 33.288 345 HB3 LYS 83 HB1 LYS 83 -3.138 2.588 33.532 346 HG2 LYS 83 HG2 LYS 83 -4.918 2.033 35.178 347 HG3 LYS 83 HG1 LYS 83 -4.473 0.328 34.978 348 HD2 LYS 83 HD2 LYS 83 -2.152 0.879 35.558 349 HD3 LYS 83 HD1 LYS 83 -2.628 2.552 35.818 350 HE2 LYS 83 HE2 LYS 83 -4.160 1.804 37.580 351 HE3 LYS 83 HE1 LYS 83 -3.582 0.151 37.346 352 HZ1 LYS 83 HZ1 LYS 83 -1.968 2.482 38.204 353 HZ2 LYS 83 HZ2 LYS 83 -1.339 0.939 37.903 354 HZ3 LYS 83 HZ3 LYS 83 -2.424 1.173 39.156 355 H LYS 84 HN LYS 84 -7.056 1.594 33.480 356 HA LYS 84 HA LYS 84 -8.307 3.776 32.386 357 HB2 LYS 84 HB2 LYS 84 -9.230 1.807 33.541 358 HB3 LYS 84 HB1 LYS 84 -8.654 2.449 35.062 359 HG2 LYS 84 HG2 LYS 84 -10.193 4.248 34.970 360 HG3 LYS 84 HG1 LYS 84 -10.646 3.838 33.307 361 HD2 LYS 84 HD2 LYS 84 -12.364 2.841 34.583 362 HD3 LYS 84 HD1 LYS 84 -11.169 1.593 34.178 363 HE2 LYS 84 HE2 LYS 84 -11.922 1.336 36.486 364 HE3 LYS 84 HE1 LYS 84 -10.206 1.697 36.391 365 HZ1 LYS 84 HZ1 LYS 84 -10.651 3.956 37.076 366 HZ2 LYS 84 HZ2 LYS 84 -11.432 2.924 38.158 367 HZ3 LYS 84 HZ3 LYS 84 -12.310 3.716 36.974 368 HA PRO 85 HA PRO 85 -6.225 7.203 34.337 369 HB2 PRO 85 HB2 PRO 85 -8.074 9.116 33.659 370 HB3 PRO 85 HB1 PRO 85 -6.893 8.498 32.511 371 HG2 PRO 85 HG2 PRO 85 -9.745 7.760 32.870 372 HG3 PRO 85 HG1 PRO 85 -8.819 7.984 31.375 373 HD2 PRO 85 HD2 PRO 85 -9.385 5.548 32.352 374 HD3 PRO 85 HD1 PRO 85 -7.873 5.890 31.494 375 H THR 86 HN THR 86 -6.266 7.826 36.385 376 HA THR 86 HA THR 86 -8.778 7.640 37.802 377 HB THR 86 HB THR 86 -6.850 6.435 38.794 378 HG1 THR 86 HG1 THR 86 -6.955 7.662 40.924 379 HG21 THR 86 HG21 THR 86 -5.651 9.180 39.144 380 HG22 THR 86 HG22 THR 86 -5.027 7.899 38.100 381 HG23 THR 86 HG23 THR 86 -5.013 7.697 39.850 382 H GLY 87 HN GLY 87 -8.625 9.451 39.741 383 HA2 GLY 87 HA2 GLY 87 -8.615 11.775 40.148 384 HA3 GLY 87 HA1 GLY 87 -8.215 12.048 38.445 385 H ASN 88 HN ASN 88 -9.881 13.043 37.453 386 HA ASN 88 HA ASN 88 -12.388 11.665 37.628 387 HB2 ASN 88 HB2 ASN 88 -13.776 13.730 37.978 388 HB3 ASN 88 HB1 ASN 88 -12.801 13.284 39.362 389 HD21 ASN 88 HD21 ASN 88 -13.496 15.680 37.032 390 HD22 ASN 88 HD22 ASN 88 -12.409 16.890 37.603 391 HA PRO 89 HA PRO 89 -11.792 12.847 33.330 392 HB2 PRO 89 HB2 PRO 89 -12.113 10.242 32.366 393 HB3 PRO 89 HB1 PRO 89 -10.573 10.974 32.695 394 HG2 PRO 89 HG2 PRO 89 -11.897 8.863 34.151 395 HG3 PRO 89 HG1 PRO 89 -10.266 9.500 34.376 396 HD2 PRO 89 HD2 PRO 89 -12.665 9.995 35.955 397 HD3 PRO 89 HD1 PRO 89 -10.985 10.429 36.309 398 H GLN 90 HN GLN 90 -13.437 13.172 31.870 399 HA GLN 90 HA GLN 90 -16.109 12.683 32.884 400 HB2 GLN 90 HB2 GLN 90 -15.165 14.248 30.463 401 HB3 GLN 90 HB1 GLN 90 -16.840 14.140 30.993 402 HG2 GLN 90 HG2 GLN 90 -16.194 15.176 33.134 403 HG3 GLN 90 HG1 GLN 90 -14.552 15.355 32.519 404 HE21 GLN 90 HE21 GLN 90 -17.795 16.431 32.344 405 HE22 GLN 90 HE22 GLN 90 -17.523 17.861 31.425 406 HA PRO 91 HA PRO 91 -15.967 8.791 30.961 407 HB2 PRO 91 HB2 PRO 91 -18.914 8.956 30.900 408 HB3 PRO 91 HB1 PRO 91 -17.862 7.703 31.557 409 HG2 PRO 91 HG2 PRO 91 -19.089 9.423 33.166 410 HG3 PRO 91 HG1 PRO 91 -17.432 8.885 33.496 411 HD2 PRO 91 HD2 PRO 91 -18.398 11.476 32.372 412 HD3 PRO 91 HD1 PRO 91 -17.053 11.134 33.492 413 H LYS 92 HN LYS 92 -15.074 9.262 29.025 414 HA LYS 92 HA LYS 92 -16.893 8.889 26.809 415 HB2 LYS 92 HB2 LYS 92 -14.012 9.824 27.033 416 HB3 LYS 92 HB1 LYS 92 -14.571 9.062 25.568 417 HG2 LYS 92 HG2 LYS 92 -14.497 11.434 25.227 418 HG3 LYS 92 HG1 LYS 92 -16.180 10.947 25.269 419 HD2 LYS 92 HD2 LYS 92 -14.986 11.868 27.818 420 HD3 LYS 92 HD1 LYS 92 -15.217 13.094 26.571 421 HE2 LYS 92 HE2 LYS 92 -17.330 11.260 27.697 422 HE3 LYS 92 HE1 LYS 92 -17.091 12.948 28.141 423 HZ1 LYS 92 HZ1 LYS 92 -17.839 11.968 25.430 424 HZ2 LYS 92 HZ2 LYS 92 -17.609 13.578 25.863 425 HZ3 LYS 92 HZ3 LYS 92 -18.864 12.709 26.533 426 H ASN 93 HN ASN 93 -16.437 6.954 25.705 427 HA ASN 93 HA ASN 93 -15.574 4.819 27.346 428 HB2 ASN 93 HB2 ASN 93 -15.940 4.888 24.337 429 HB3 ASN 93 HB1 ASN 93 -15.535 3.428 25.230 430 HD21 ASN 93 HD21 ASN 93 -17.087 2.497 26.560 431 HD22 ASN 93 HD22 ASN 93 -18.749 2.903 26.466 432 H TRP 94 HN TRP 94 -13.626 4.983 28.179 433 HA TRP 94 HA TRP 94 -11.342 5.916 26.987 434 HB2 TRP 94 HB2 TRP 94 -11.629 5.824 29.389 435 HB3 TRP 94 HB1 TRP 94 -11.792 4.077 29.342 436 HD1 TRP 94 HD1 TRP 94 -9.165 6.835 29.052 437 HE1 TRP 94 HE1 TRP 94 -6.821 5.741 29.373 438 HE3 TRP 94 HE3 TRP 94 -10.556 1.941 29.219 439 HZ2 TRP 94 HZ2 TRP 94 -5.769 3.180 29.659 440 HZ3 TRP 94 HZ3 TRP 94 -8.829 0.228 29.537 441 HH2 TRP 94 HH2 TRP 94 -6.486 0.844 29.751 442 H ASN 95 HN ASN 95 -9.640 4.914 26.040 443 HA ASN 95 HA ASN 95 -10.033 2.151 25.362 444 HB2 ASN 95 HB2 ASN 95 -10.547 3.387 23.360 445 HB3 ASN 95 HB1 ASN 95 -9.094 4.362 23.537 446 HD21 ASN 95 HD21 ASN 95 -9.326 0.814 23.881 447 HD22 ASN 95 HD22 ASN 95 -8.218 0.520 22.595 448 H LYS 96 HN LYS 96 -8.149 0.925 25.689 449 HA LYS 96 HA LYS 96 -5.872 2.271 26.832 450 HB2 LYS 96 HB2 LYS 96 -4.960 0.140 27.258 451 HB3 LYS 96 HB1 LYS 96 -6.664 0.072 27.699 452 HG2 LYS 96 HG2 LYS 96 -7.122 -1.085 25.553 453 HG3 LYS 96 HG1 LYS 96 -5.389 -0.978 25.206 454 HD2 LYS 96 HD2 LYS 96 -6.530 -2.333 27.615 455 HD3 LYS 96 HD1 LYS 96 -6.105 -3.199 26.127 456 HE2 LYS 96 HE2 LYS 96 -3.773 -2.314 26.397 457 HE3 LYS 96 HE1 LYS 96 -4.258 -1.634 27.946 458 HZ1 LYS 96 HZ1 LYS 96 -4.270 -4.502 27.229 459 HZ2 LYS 96 HZ2 LYS 96 -4.729 -3.874 28.739 460 HZ3 LYS 96 HZ3 LYS 96 -3.154 -3.725 28.210 461 H ASP 97 HN ASP 97 -3.714 1.200 26.079 462 HA ASP 97 HA ASP 97 -2.099 0.770 24.599 463 HB2 ASP 97 HB2 ASP 97 -3.872 -0.829 23.594 464 HB3 ASP 97 HB1 ASP 97 -4.147 0.444 22.410 465 H GLY 98 HN GLY 98 -3.718 3.345 24.884 466 HA2 GLY 98 HA2 GLY 98 -2.327 5.351 24.534 467 HA3 GLY 98 HA1 GLY 98 -1.987 4.720 22.949 468 H TYR 99 HN TYR 99 -5.224 4.234 23.701 469 HA TYR 99 HA TYR 99 -7.116 5.000 22.787 470 HB2 TYR 99 HB2 TYR 99 -5.851 7.479 23.715 471 HB3 TYR 99 HB1 TYR 99 -6.800 7.768 22.259 472 HD1 TYR 99 HD2 TYR 99 -6.815 6.601 25.708 473 HD2 TYR 99 HD1 TYR 99 -9.105 7.823 22.368 474 HE1 TYR 99 HE2 TYR 99 -8.766 6.900 27.143 475 HE2 TYR 99 HE1 TYR 99 -11.054 8.135 23.804 476 HH TYR 99 HH TYR 99 -11.874 7.540 25.890 477 H LEU 100 HN LEU 100 -7.135 3.967 20.976 478 HA LEU 100 HA LEU 100 -6.080 5.270 18.591 479 HB2 LEU 100 HB2 LEU 100 -4.496 3.577 19.726 480 HB3 LEU 100 HB1 LEU 100 -5.663 2.356 19.311 481 HG LEU 100 HG LEU 100 -4.412 4.016 17.143 482 HD11 LEU 100 HD11 LEU 100 -2.613 2.339 17.018 483 HD12 LEU 100 HD12 LEU 100 -3.237 1.565 18.476 484 HD13 LEU 100 HD13 LEU 100 -2.574 3.196 18.557 485 HD21 LEU 100 HD21 LEU 100 -6.228 2.458 16.562 486 HD22 LEU 100 HD22 LEU 100 -5.294 1.134 17.264 487 HD23 LEU 100 HD23 LEU 100 -4.684 1.994 15.850 488 H LYS 101 HN LYS 101 -7.101 4.092 16.674 489 HA LYS 101 HA LYS 101 -9.929 3.700 17.035 490 HB2 LYS 101 HB2 LYS 101 -8.114 3.081 14.694 491 HB3 LYS 101 HB1 LYS 101 -9.865 3.137 14.625 492 HG2 LYS 101 HG2 LYS 101 -8.136 5.501 15.322 493 HG3 LYS 101 HG1 LYS 101 -8.645 5.112 13.681 494 HD2 LYS 101 HD2 LYS 101 -10.997 5.276 14.418 495 HD3 LYS 101 HD1 LYS 101 -10.433 5.749 16.019 496 HE2 LYS 101 HE2 LYS 101 -9.435 7.749 15.182 497 HE3 LYS 101 HE1 LYS 101 -9.659 7.237 13.514 498 HZ1 LYS 101 HZ1 LYS 101 -11.854 7.931 15.406 499 HZ2 LYS 101 HZ2 LYS 101 -12.033 7.456 13.791 500 HZ3 LYS 101 HZ3 LYS 101 -11.273 8.897 14.148 501 H LYS 102 HN LYS 102 -10.830 1.484 15.938 502 HA LYS 102 HA LYS 102 -9.440 -0.660 17.248 503 HB2 LYS 102 HB2 LYS 102 -12.058 -0.538 15.809 504 HB3 LYS 102 HB1 LYS 102 -11.283 -2.104 15.996 505 HG2 LYS 102 HG2 LYS 102 -12.883 -1.760 17.765 506 HG3 LYS 102 HG1 LYS 102 -11.251 -1.788 18.426 507 HD2 LYS 102 HD2 LYS 102 -12.437 -0.046 19.539 508 HD3 LYS 102 HD1 LYS 102 -11.327 0.720 18.410 509 HE2 LYS 102 HE2 LYS 102 -13.135 1.056 16.825 510 HE3 LYS 102 HE1 LYS 102 -14.250 0.226 17.895 511 HZ1 LYS 102 HZ1 LYS 102 -12.839 2.755 18.534 512 HZ2 LYS 102 HZ2 LYS 102 -13.866 1.925 19.562 513 HZ3 LYS 102 HZ3 LYS 102 -14.483 2.604 18.150 514 H LEU 103 HN LEU 103 -7.552 -0.508 16.281 515 HA LEU 103 HA LEU 103 -7.283 -1.726 13.636 516 HB2 LEU 103 HB2 LEU 103 -5.719 0.587 14.760 517 HB3 LEU 103 HB1 LEU 103 -5.385 -0.216 13.240 518 HG LEU 103 HG LEU 103 -7.933 1.262 13.838 519 HD11 LEU 103 HD11 LEU 103 -5.983 2.745 13.884 520 HD12 LEU 103 HD12 LEU 103 -7.016 3.056 12.497 521 HD13 LEU 103 HD13 LEU 103 -5.508 2.162 12.290 522 HD21 LEU 103 HD21 LEU 103 -8.108 -0.469 12.107 523 HD22 LEU 103 HD22 LEU 103 -6.757 0.265 11.237 524 HD23 LEU 103 HD23 LEU 103 -8.271 1.148 11.434 525 HA PRO 104 HA PRO 104 -4.368 -4.229 15.925 526 HB2 PRO 104 HB2 PRO 104 -2.735 -4.524 13.517 527 HB3 PRO 104 HB1 PRO 104 -3.667 -5.752 14.375 528 HG2 PRO 104 HG2 PRO 104 -4.367 -4.809 11.932 529 HG3 PRO 104 HG1 PRO 104 -5.543 -5.387 13.125 530 HD2 PRO 104 HD2 PRO 104 -4.797 -2.594 12.383 531 HD3 PRO 104 HD1 PRO 104 -6.386 -3.285 12.781 532 H VAL 105 HN VAL 105 -1.704 -4.452 15.701 533 HA VAL 105 HA VAL 105 -0.813 -1.802 16.381 534 HB VAL 105 HB VAL 105 -0.309 -4.055 17.573 535 HG11 VAL 105 HG11 VAL 105 1.880 -4.137 15.536 536 HG12 VAL 105 HG12 VAL 105 0.585 -5.311 15.749 537 HG13 VAL 105 HG13 VAL 105 1.816 -5.113 17.002 538 HG21 VAL 105 HG21 VAL 105 0.552 -1.885 18.281 539 HG22 VAL 105 HG22 VAL 105 1.925 -2.079 17.191 540 HG23 VAL 105 HG23 VAL 105 1.654 -3.229 18.529 541 H ASP 106 HN ASP 106 1.722 -1.408 15.484 542 HA ASP 106 HA ASP 106 1.168 -0.959 12.700 543 HB2 ASP 106 HB2 ASP 106 2.681 0.466 14.567 544 HB3 ASP 106 HB1 ASP 106 3.920 -0.370 13.628 545 HA PRO 107 HA PRO 107 3.258 -4.397 10.660 546 HB2 PRO 107 HB2 PRO 107 5.143 -2.937 9.251 547 HB3 PRO 107 HB1 PRO 107 3.553 -3.433 8.661 548 HG2 PRO 107 HG2 PRO 107 4.400 -0.802 9.807 549 HG3 PRO 107 HG1 PRO 107 3.225 -1.130 8.520 550 HD2 PRO 107 HD2 PRO 107 2.387 -0.472 10.918 551 HD3 PRO 107 HD1 PRO 107 1.580 -1.783 10.028 552 H TRP 108 HN TRP 108 5.321 -5.313 10.322 553 HA TRP 108 HA TRP 108 7.364 -6.055 10.820 554 HB2 TRP 108 HB2 TRP 108 7.972 -3.526 12.347 555 HB3 TRP 108 HB1 TRP 108 9.115 -4.595 11.542 556 HD1 TRP 108 HD1 TRP 108 8.599 -4.624 8.711 557 HE1 TRP 108 HE1 TRP 108 8.314 -2.544 7.223 558 HE3 TRP 108 HE3 TRP 108 7.288 -1.231 12.305 559 HZ2 TRP 108 HZ2 TRP 108 7.631 0.130 7.546 560 HZ3 TRP 108 HZ3 TRP 108 6.804 1.065 11.638 561 HH2 TRP 108 HH2 TRP 108 6.922 1.760 9.395 562 H GLY 109 HN GLY 109 5.011 -5.826 12.751 563 HA2 GLY 109 HA2 GLY 109 4.410 -6.790 14.755 564 HA3 GLY 109 HA1 GLY 109 6.056 -7.361 14.920 565 H ASN 110 HN ASN 110 6.390 -4.107 14.539 566 HA ASN 110 HA ASN 110 6.982 -3.716 17.244 567 HB2 ASN 110 HB2 ASN 110 6.972 -1.785 14.933 568 HB3 ASN 110 HB1 ASN 110 7.343 -1.277 16.573 569 HD21 ASN 110 HD21 ASN 110 8.489 -2.788 13.767 570 HD22 ASN 110 HD22 ASN 110 10.092 -3.123 14.319 571 HA PRO 111 HA PRO 111 3.162 -2.130 18.802 572 HB2 PRO 111 HB2 PRO 111 4.150 -1.156 21.124 573 HB3 PRO 111 HB1 PRO 111 3.866 -2.883 20.883 574 HG2 PRO 111 HG2 PRO 111 6.421 -1.340 20.689 575 HG3 PRO 111 HG1 PRO 111 6.125 -2.921 21.433 576 HD2 PRO 111 HD2 PRO 111 7.219 -2.656 18.986 577 HD3 PRO 111 HD1 PRO 111 6.170 -4.023 19.411 578 H TYR 112 HN TYR 112 2.231 -0.030 19.038 579 HA TYR 112 HA TYR 112 3.821 2.082 17.948 580 HB2 TYR 112 HB2 TYR 112 1.083 2.072 19.252 581 HB3 TYR 112 HB1 TYR 112 1.881 3.542 18.746 582 HD1 TYR 112 HD2 TYR 112 2.341 3.891 16.300 583 HD2 TYR 112 HD1 TYR 112 -0.170 0.751 17.691 584 HE1 TYR 112 HE2 TYR 112 1.277 3.778 14.091 585 HE2 TYR 112 HE1 TYR 112 -1.256 0.637 15.479 586 HH TYR 112 HH TYR 112 -0.056 2.358 12.711 587 H GLN 113 HN GLN 113 4.769 3.703 19.090 588 HA GLN 113 HA GLN 113 5.137 3.106 21.958 589 HB2 GLN 113 HB2 GLN 113 6.761 5.256 20.695 590 HB3 GLN 113 HB1 GLN 113 7.248 4.064 21.869 591 HG2 GLN 113 HG2 GLN 113 7.043 3.690 18.879 592 HG3 GLN 113 HG1 GLN 113 8.510 3.937 19.789 593 HE21 GLN 113 HE21 GLN 113 7.608 2.001 21.914 594 HE22 GLN 113 HE22 GLN 113 7.826 0.462 21.186 595 H TYR 114 HN TYR 114 3.823 4.276 23.177 596 HA TYR 114 HA TYR 114 2.990 6.917 22.314 597 HB2 TYR 114 HB2 TYR 114 1.279 6.491 24.290 598 HB3 TYR 114 HB1 TYR 114 1.012 5.819 22.695 599 HD1 TYR 114 HD2 TYR 114 3.059 4.649 25.666 600 HD2 TYR 114 HD1 TYR 114 -0.016 3.771 22.865 601 HE1 TYR 114 HE2 TYR 114 2.836 2.380 26.609 602 HE2 TYR 114 HE1 TYR 114 -0.248 1.511 23.820 603 HH TYR 114 HH TYR 114 1.308 0.558 26.719 604 H LEU 115 HN LEU 115 3.936 8.618 23.173 605 HA LEU 115 HA LEU 115 4.544 8.579 26.011 606 HB2 LEU 115 HB2 LEU 115 6.174 9.758 23.777 607 HB3 LEU 115 HB1 LEU 115 6.412 10.192 25.458 608 HG LEU 115 HG LEU 115 6.772 7.420 24.310 609 HD11 LEU 115 HD11 LEU 115 8.808 9.502 25.087 610 HD12 LEU 115 HD12 LEU 115 8.426 8.980 23.445 611 HD13 LEU 115 HD13 LEU 115 9.159 7.849 24.579 612 HD21 LEU 115 HD21 LEU 115 7.863 6.965 26.473 613 HD22 LEU 115 HD22 LEU 115 6.167 7.384 26.668 614 HD23 LEU 115 HD23 LEU 115 7.413 8.576 27.029 615 H ALA 116 HN ALA 116 4.308 10.677 27.016 616 HA ALA 116 HA ALA 116 2.528 12.332 25.477 617 HB1 ALA 116 HB1 ALA 116 2.669 12.049 28.471 618 HB2 ALA 116 HB2 ALA 116 1.634 11.069 27.426 619 HB3 ALA 116 HB3 ALA 116 1.387 12.810 27.508 620 HA PRO 117 HA PRO 117 4.720 15.926 25.373 621 HB2 PRO 117 HB2 PRO 117 4.388 17.790 27.302 622 HB3 PRO 117 HB1 PRO 117 3.294 17.483 25.982 623 HG2 PRO 117 HG2 PRO 117 3.085 16.469 28.795 624 HG3 PRO 117 HG1 PRO 117 1.806 17.108 27.745 625 HD2 PRO 117 HD2 PRO 117 2.188 14.446 28.106 626 HD3 PRO 117 HD1 PRO 117 1.620 15.096 26.547 627 H GLY 118 HN GLY 118 6.637 15.730 25.252 628 HA2 GLY 118 HA2 GLY 118 8.246 15.574 27.698 629 HA3 GLY 118 HA1 GLY 118 8.774 15.091 26.083 630 H THR 119 HN THR 119 9.338 16.651 24.605 631 HA THR 119 HA THR 119 10.172 19.097 25.916 632 HB THR 119 HB THR 119 11.662 19.078 23.684 633 HG1 THR 119 HG1 THR 119 11.555 16.359 24.433 634 HG21 THR 119 HG21 THR 119 12.262 17.591 26.250 635 HG22 THR 119 HG22 THR 119 12.519 19.312 25.960 636 HG23 THR 119 HG23 THR 119 13.469 18.118 25.077 637 H LYS 120 HN LYS 120 8.515 20.373 25.644 638 HA LYS 120 HA LYS 120 7.147 21.907 24.764 639 HB2 LYS 120 HB2 LYS 120 9.026 21.774 22.403 640 HB3 LYS 120 HB1 LYS 120 7.885 23.070 22.728 641 HG2 LYS 120 HG2 LYS 120 10.253 22.315 24.439 642 HG3 LYS 120 HG1 LYS 120 10.142 23.704 23.363 643 HD2 LYS 120 HD2 LYS 120 8.333 24.631 24.717 644 HD3 LYS 120 HD1 LYS 120 8.383 23.218 25.771 645 HE2 LYS 120 HE2 LYS 120 10.652 23.763 26.436 646 HE3 LYS 120 HE1 LYS 120 10.663 25.149 25.350 647 HZ1 LYS 120 HZ1 LYS 120 8.887 24.802 27.705 648 HZ2 LYS 120 HZ2 LYS 120 8.871 26.124 26.651 649 HZ3 LYS 120 HZ3 LYS 120 10.217 25.829 27.601 650 H GLY 121 HN GLY 121 6.669 18.960 24.086 651 HA2 GLY 121 HA2 GLY 121 4.731 19.586 22.007 652 HA3 GLY 121 HA1 GLY 121 5.769 18.155 21.845 653 HA PRO 122 HA PRO 122 1.758 18.126 24.953 654 HB2 PRO 122 HB2 PRO 122 0.467 17.938 22.267 655 HB3 PRO 122 HB1 PRO 122 -0.239 18.416 23.819 656 HG2 PRO 122 HG2 PRO 122 0.505 20.312 22.213 657 HG3 PRO 122 HG1 PRO 122 1.033 20.403 23.905 658 HD2 PRO 122 HD2 PRO 122 2.591 19.600 21.482 659 HD3 PRO 122 HD1 PRO 122 3.099 20.570 22.884 660 H PHE 123 HN PHE 123 2.785 16.171 22.133 661 HA PHE 123 HA PHE 123 2.848 13.913 23.726 662 HB2 PHE 123 HB2 PHE 123 1.150 12.422 22.717 663 HB3 PHE 123 HB1 PHE 123 0.436 13.766 23.561 664 HD1 PHE 123 HD1 PHE 123 1.115 12.376 20.206 665 HD2 PHE 123 HD2 PHE 123 -0.995 15.314 22.453 666 HE1 PHE 123 HE1 PHE 123 -0.302 12.843 18.257 667 HE2 PHE 123 HE2 PHE 123 -2.412 15.789 20.503 668 HZ PHE 123 HZ PHE 123 -2.072 14.553 18.402 669 H ASP 124 HN ASP 124 3.839 12.129 22.872 670 HA ASP 124 HA ASP 124 5.090 12.603 20.237 671 HB2 ASP 124 HB2 ASP 124 6.460 11.036 22.406 672 HB3 ASP 124 HB1 ASP 124 7.145 11.805 21.007 673 H LEU 125 HN LEU 125 4.417 10.944 18.945 674 HA LEU 125 HA LEU 125 4.605 8.342 20.044 675 HB2 LEU 125 HB2 LEU 125 2.376 7.556 19.324 676 HB3 LEU 125 HB1 LEU 125 2.347 8.690 20.647 677 HG LEU 125 HG LEU 125 1.772 10.436 18.814 678 HD11 LEU 125 HD11 LEU 125 0.971 7.888 17.430 679 HD12 LEU 125 HD12 LEU 125 2.194 9.029 16.880 680 HD13 LEU 125 HD13 LEU 125 0.494 9.516 16.945 681 HD21 LEU 125 HD21 LEU 125 -0.106 8.304 19.749 682 HD22 LEU 125 HD22 LEU 125 -0.606 9.870 19.097 683 HD23 LEU 125 HD23 LEU 125 0.326 9.782 20.600 684 H TYR 126 HN TYR 126 4.924 6.720 18.689 685 HA TYR 126 HA TYR 126 5.002 7.007 15.895 686 HB2 TYR 126 HB2 TYR 126 7.509 7.041 15.636 687 HB3 TYR 126 HB1 TYR 126 6.878 8.532 16.302 688 HD1 TYR 126 HD2 TYR 126 7.360 9.180 18.606 689 HD2 TYR 126 HD1 TYR 126 8.976 5.593 16.962 690 HE1 TYR 126 HE2 TYR 126 9.012 9.101 20.409 691 HE2 TYR 126 HE1 TYR 126 10.637 5.522 18.765 692 HH TYR 126 HH TYR 126 11.733 7.163 20.299 693 H SER 127 HN SER 127 6.149 5.065 14.974 694 HA SER 127 HA SER 127 6.320 2.930 16.954 695 HB2 SER 127 HB2 SER 127 5.598 1.486 14.921 696 HB3 SER 127 HB1 SER 127 4.355 2.436 15.740 697 HG SER 127 HG SER 127 4.663 2.519 13.254 698 H LEU 128 HN LEU 128 8.166 1.711 16.853 699 HA LEU 128 HA LEU 128 10.329 2.690 15.329 700 HB2 LEU 128 HB2 LEU 128 9.905 0.286 17.002 701 HB3 LEU 128 HB1 LEU 128 11.239 0.241 15.886 702 HG LEU 128 HG LEU 128 12.273 2.194 16.935 703 HD11 LEU 128 HD11 LEU 128 9.950 2.203 18.831 704 HD12 LEU 128 HD12 LEU 128 10.304 3.422 17.607 705 HD13 LEU 128 HD13 LEU 128 11.404 3.190 18.967 706 HD21 LEU 128 HD21 LEU 128 12.826 0.029 17.843 707 HD22 LEU 128 HD22 LEU 128 11.449 0.114 18.940 708 HD23 LEU 128 HD23 LEU 128 12.789 1.236 19.128 709 H GLY 129 HN GLY 129 11.184 2.210 13.422 710 HA2 GLY 129 HA2 GLY 129 9.557 0.948 11.453 711 HA3 GLY 129 HA1 GLY 129 11.183 1.522 11.205 712 H ALA 130 HN ALA 130 11.053 -0.362 9.860 713 HA ALA 130 HA ALA 130 10.850 -2.971 10.838 714 HB1 ALA 130 HB1 ALA 130 11.625 -3.647 8.697 715 HB2 ALA 130 HB2 ALA 130 12.290 -2.036 8.406 716 HB3 ALA 130 HB3 ALA 130 10.546 -2.251 8.534 717 H ASP 131 HN ASP 131 13.380 -0.847 11.346 718 HA ASP 131 HA ASP 131 15.347 -2.999 11.421 719 HB2 ASP 131 HB2 ASP 131 15.949 -0.760 10.442 720 HB3 ASP 131 HB1 ASP 131 15.811 -0.078 12.058 721 H GLY 132 HN GLY 132 13.048 -1.698 13.415 722 HA2 GLY 132 HA2 GLY 132 12.585 -2.056 15.638 723 HA3 GLY 132 HA1 GLY 132 13.983 -3.123 15.689 724 H LYS 133 HN LYS 133 14.413 0.081 14.578 725 HA LYS 133 HA LYS 133 15.398 1.006 17.154 726 HB2 LYS 133 HB2 LYS 133 17.287 -0.016 15.914 727 HB3 LYS 133 HB1 LYS 133 16.944 1.033 14.552 728 HG2 LYS 133 HG2 LYS 133 17.493 2.983 15.940 729 HG3 LYS 133 HG1 LYS 133 17.880 1.898 17.281 730 HD2 LYS 133 HD2 LYS 133 19.600 0.821 15.890 731 HD3 LYS 133 HD1 LYS 133 19.220 1.936 14.581 732 HE2 LYS 133 HE2 LYS 133 20.264 2.706 17.306 733 HE3 LYS 133 HE1 LYS 133 21.218 2.621 15.827 734 HZ1 LYS 133 HZ1 LYS 133 18.940 4.481 16.308 735 HZ2 LYS 133 HZ2 LYS 133 19.884 4.425 14.901 736 HZ3 LYS 133 HZ3 LYS 133 20.569 4.860 16.358 737 H GLU 134 HN GLU 134 15.102 3.244 17.342 738 HA GLU 134 HA GLU 134 13.552 4.420 15.243 739 HB2 GLU 134 HB2 GLU 134 13.333 6.400 16.774 740 HB3 GLU 134 HB1 GLU 134 12.774 4.898 17.476 741 HG2 GLU 134 HG2 GLU 134 14.894 4.755 18.744 742 HG3 GLU 134 HG1 GLU 134 15.360 6.316 18.070 743 H GLY 135 HN GLY 135 14.392 5.259 13.555 744 HA2 GLY 135 HA2 GLY 135 16.824 6.842 13.649 745 HA3 GLY 135 HA1 GLY 135 16.892 5.344 12.731 746 H GLY 136 HN GLY 136 17.395 7.124 11.063 747 HA2 GLY 136 HA2 GLY 136 14.866 8.122 9.924 748 HA3 GLY 136 HA1 GLY 136 16.426 8.918 9.718 749 H SER 137 HN SER 137 14.312 7.428 8.024 750 HA SER 137 HA SER 137 15.703 6.489 5.876 751 HB2 SER 137 HB2 SER 137 15.007 4.376 7.935 752 HB3 SER 137 HB1 SER 137 15.092 3.954 6.219 753 HG SER 137 HG SER 137 17.163 5.183 7.710 754 H ASP 138 HN ASP 138 13.885 4.912 4.632 755 HA ASP 138 HA ASP 138 11.419 6.356 5.120 756 HB2 ASP 138 HB2 ASP 138 12.125 4.411 2.909 757 HB3 ASP 138 HB1 ASP 138 10.511 5.074 3.124 758 H ASN 139 HN ASN 139 12.307 2.958 4.851 759 HA ASN 139 HA ASN 139 9.879 2.238 6.334 760 HB2 ASN 139 HB2 ASN 139 10.286 1.084 4.212 761 HB3 ASN 139 HB1 ASN 139 11.846 0.531 4.802 762 HD21 ASN 139 HD21 ASN 139 11.916 -1.186 6.263 763 HD22 ASN 139 HD22 ASN 139 10.525 -2.162 6.519 764 H ASP 140 HN ASP 140 13.345 2.211 6.612 765 HA ASP 140 HA ASP 140 13.231 0.638 9.065 766 HB2 ASP 140 HB2 ASP 140 15.550 1.798 7.539 767 HB3 ASP 140 HB1 ASP 140 15.759 1.144 9.159 768 H ALA 141 HN ALA 141 12.304 3.535 8.571 769 HA ALA 141 HA ALA 141 13.631 4.836 10.831 770 HB1 ALA 141 HB1 ALA 141 12.488 6.812 10.113 771 HB2 ALA 141 HB2 ALA 141 11.604 5.884 8.906 772 HB3 ALA 141 HB3 ALA 141 13.350 6.077 8.759 773 H ASP 142 HN ASP 142 12.373 5.739 12.497 774 HA ASP 142 HA ASP 142 9.962 4.297 13.071 775 HB2 ASP 142 HB2 ASP 142 9.957 5.574 15.176 776 HB3 ASP 142 HB1 ASP 142 11.523 4.821 14.922 777 H ILE 143 HN ILE 143 8.025 4.998 12.610 778 HA ILE 143 HA ILE 143 7.832 7.654 11.427 779 HB ILE 143 HB ILE 143 5.903 6.794 10.094 780 HG12 ILE 143 HG12 ILE 143 5.776 4.174 9.931 781 HG13 ILE 143 HG11 ILE 143 6.463 4.198 11.541 782 HG21 ILE 143 HG21 ILE 143 8.369 5.109 9.796 783 HG22 ILE 143 HG22 ILE 143 8.130 6.725 9.134 784 HG23 ILE 143 HG23 ILE 143 7.150 5.376 8.552 785 HD11 ILE 143 HD11 ILE 143 3.855 5.408 10.671 786 HD12 ILE 143 HD12 ILE 143 4.572 5.581 12.272 787 HD13 ILE 143 HD13 ILE 143 4.096 3.989 11.700 788 H GLY 144 HN GLY 144 6.128 9.062 12.136 789 HA2 GLY 144 HA2 GLY 144 4.169 8.106 13.933 790 HA3 GLY 144 HA1 GLY 144 5.524 8.780 14.813 791 H ASN 145 HN ASN 145 3.233 9.833 15.258 792 HA ASN 145 HA ASN 145 3.174 12.346 13.764 793 HB2 ASN 145 HB2 ASN 145 1.032 11.145 13.520 794 HB3 ASN 145 HB1 ASN 145 0.912 10.985 15.269 795 HD21 ASN 145 HD21 ASN 145 0.328 12.796 16.499 796 HD22 ASN 145 HD22 ASN 145 -0.329 14.219 15.777 797 H TRP 146 HN TRP 146 3.319 14.179 15.028 798 HA TRP 146 HA TRP 146 3.825 13.740 17.881 799 HB2 TRP 146 HB2 TRP 146 5.884 13.422 16.480 800 HB3 TRP 146 HB1 TRP 146 5.659 15.040 15.867 801 HD1 TRP 146 HD1 TRP 146 5.788 16.992 18.022 802 HE1 TRP 146 HE1 TRP 146 7.659 17.097 19.784 803 HE3 TRP 146 HE3 TRP 146 7.340 12.168 17.772 804 HZ2 TRP 146 HZ2 TRP 146 9.548 15.333 20.929 805 HZ3 TRP 146 HZ3 TRP 146 9.182 11.428 19.214 806 HH2 TRP 146 HH2 TRP 146 10.270 12.985 20.769 807 H ASP 147 HN ASP 147 2.843 15.360 18.887 808 HA ASP 147 HA ASP 147 2.041 17.666 17.274 809 HB2 ASP 147 HB2 ASP 147 0.176 16.405 18.350 810 HB3 ASP 147 HB1 ASP 147 0.880 16.769 19.922 811 H ASN 148 HN ASN 148 3.243 19.329 17.527 812 HA ASN 148 HA ASN 148 4.261 19.948 20.137 813 HB2 ASN 148 HB2 ASN 148 6.469 20.563 19.212 814 HB3 ASN 148 HB1 ASN 148 6.147 18.856 18.988 815 HD21 ASN 148 HD21 ASN 148 5.696 18.128 16.851 816 HD22 ASN 148 HD22 ASN 148 6.228 19.000 15.468 Start of MODEL 12 1 H1 MET 39 HT1 MET 39 2.886 5.789 0.598 2 H2 MET 39 HT2 MET 39 3.076 6.281 -1.007 3 H3 MET 39 HT3 MET 39 3.796 7.168 0.225 4 HA MET 39 HA MET 39 5.385 5.873 -1.006 5 HB2 MET 39 HB2 MET 39 5.110 4.627 1.780 6 HB3 MET 39 HB1 MET 39 6.555 4.847 0.849 7 HG2 MET 39 HG2 MET 39 6.566 6.385 2.631 8 HG3 MET 39 HG1 MET 39 6.332 7.305 1.148 9 HE1 MET 39 HE1 MET 39 5.520 9.434 2.469 10 HE2 MET 39 HE2 MET 39 5.837 8.577 3.978 11 HE3 MET 39 HE3 MET 39 4.298 9.402 3.739 12 H SER 40 HN SER 40 4.213 4.593 -2.615 13 HA SER 40 HA SER 40 3.439 1.975 -1.635 14 HB2 SER 40 HB2 SER 40 2.769 3.358 -4.231 15 HB3 SER 40 HB1 SER 40 2.254 1.721 -3.808 16 HG SER 40 HG SER 40 0.698 2.576 -2.781 17 H ARG 41 HN ARG 41 5.429 1.110 -1.393 18 HA ARG 41 HA ARG 41 6.591 -0.085 -3.775 19 HB2 ARG 41 HB2 ARG 41 8.267 1.373 -1.672 20 HB3 ARG 41 HB1 ARG 41 8.904 0.353 -2.939 21 HG2 ARG 41 HG2 ARG 41 8.123 1.957 -4.610 22 HG3 ARG 41 HG1 ARG 41 7.494 2.980 -3.317 23 HD2 ARG 41 HD2 ARG 41 9.679 3.776 -4.041 24 HD3 ARG 41 HD1 ARG 41 9.764 3.176 -2.385 25 HE ARG 41 HE ARG 41 10.417 1.070 -4.049 26 HH11 ARG 41 HH11 ARG 41 11.818 4.190 -3.168 27 HH12 ARG 41 HH12 ARG 41 13.407 3.772 -3.620 28 HH21 ARG 41 HH21 ARG 41 12.547 0.504 -4.673 29 HH22 ARG 41 HH22 ARG 41 13.833 1.603 -4.496 30 HA PRO 42 HA PRO 42 6.797 -3.691 -1.027 31 HB2 PRO 42 HB2 PRO 42 9.748 -3.734 -1.535 32 HB3 PRO 42 HB1 PRO 42 8.576 -5.051 -1.648 33 HG2 PRO 42 HG2 PRO 42 9.496 -3.914 -3.848 34 HG3 PRO 42 HG1 PRO 42 7.781 -4.343 -3.712 35 HD2 PRO 42 HD2 PRO 42 9.077 -1.664 -3.535 36 HD3 PRO 42 HD1 PRO 42 7.507 -2.118 -4.227 37 H ASP 43 HN ASP 43 6.842 -3.724 1.150 38 HA ASP 43 HA ASP 43 7.276 -3.380 3.320 39 HB2 ASP 43 HB2 ASP 43 9.724 -3.907 2.682 40 HB3 ASP 43 HB1 ASP 43 9.926 -2.150 2.646 41 H GLN 44 HN GLN 44 8.039 -0.766 1.217 42 HA GLN 44 HA GLN 44 7.530 1.382 3.023 43 HB2 GLN 44 HB2 GLN 44 7.245 1.257 0.029 44 HB3 GLN 44 HB1 GLN 44 7.228 2.735 0.976 45 HG2 GLN 44 HG2 GLN 44 9.543 0.816 0.799 46 HG3 GLN 44 HG1 GLN 44 9.403 2.327 -0.096 47 HE21 GLN 44 HE21 GLN 44 8.214 3.790 2.111 48 HE22 GLN 44 HE22 GLN 44 9.467 4.095 3.228 49 H ALA 45 HN ALA 45 5.582 -0.799 1.306 50 HA ALA 45 HA ALA 45 3.104 0.511 1.357 51 HB1 ALA 45 HB1 ALA 45 2.121 -1.716 1.184 52 HB2 ALA 45 HB2 ALA 45 3.665 -2.440 1.624 53 HB3 ALA 45 HB3 ALA 45 3.507 -1.562 0.102 54 H LYS 46 HN LYS 46 4.955 -1.096 3.867 55 HA LYS 46 HA LYS 46 2.795 -1.199 5.806 56 HB2 LYS 46 HB2 LYS 46 5.783 -1.343 6.187 57 HB3 LYS 46 HB1 LYS 46 4.548 -1.883 7.306 58 HG2 LYS 46 HG2 LYS 46 3.968 -3.723 5.905 59 HG3 LYS 46 HG1 LYS 46 4.958 -3.096 4.581 60 HD2 LYS 46 HD2 LYS 46 6.960 -3.350 5.998 61 HD3 LYS 46 HD1 LYS 46 5.957 -4.041 7.264 62 HE2 LYS 46 HE2 LYS 46 5.445 -5.938 5.912 63 HE3 LYS 46 HE1 LYS 46 6.206 -5.197 4.499 64 HZ1 LYS 46 HZ1 LYS 46 7.609 -6.106 6.977 65 HZ2 LYS 46 HZ2 LYS 46 8.291 -5.194 5.740 66 HZ3 LYS 46 HZ3 LYS 46 7.755 -6.749 5.408 67 H VAL 47 HN VAL 47 5.293 0.965 4.701 68 HA VAL 47 HA VAL 47 5.328 2.671 7.007 69 HB VAL 47 HB VAL 47 6.307 3.279 4.200 70 HG11 VAL 47 HG11 VAL 47 6.043 5.297 5.500 71 HG12 VAL 47 HG12 VAL 47 7.759 4.944 5.281 72 HG13 VAL 47 HG13 VAL 47 6.979 4.601 6.823 73 HG21 VAL 47 HG21 VAL 47 7.484 1.302 5.055 74 HG22 VAL 47 HG22 VAL 47 7.846 2.169 6.548 75 HG23 VAL 47 HG23 VAL 47 8.548 2.710 5.031 76 H THR 48 HN THR 48 3.858 2.757 3.828 77 HA THR 48 HA THR 48 2.822 5.362 4.071 78 HB THR 48 HB THR 48 3.289 4.204 1.894 79 HG1 THR 48 HG1 THR 48 0.657 4.888 1.523 80 HG21 THR 48 HG21 THR 48 2.345 2.051 2.364 81 HG22 THR 48 HG22 THR 48 1.592 2.731 0.918 82 HG23 THR 48 HG23 THR 48 0.727 2.738 2.463 83 H VAL 49 HN VAL 49 1.439 2.191 4.839 84 HA VAL 49 HA VAL 49 -1.150 3.288 5.343 85 HB VAL 49 HB VAL 49 -0.999 0.951 4.666 86 HG11 VAL 49 HG11 VAL 49 0.508 0.467 7.213 87 HG12 VAL 49 HG12 VAL 49 1.115 0.326 5.559 88 HG13 VAL 49 HG13 VAL 49 -0.116 -0.792 6.143 89 HG21 VAL 49 HG21 VAL 49 -2.028 1.199 7.491 90 HG22 VAL 49 HG22 VAL 49 -2.386 -0.137 6.399 91 HG23 VAL 49 HG23 VAL 49 -2.933 1.489 6.004 92 H ALA 50 HN ALA 50 1.704 2.601 7.246 93 HA ALA 50 HA ALA 50 0.637 2.890 9.797 94 HB1 ALA 50 HB1 ALA 50 3.368 3.637 8.824 95 HB2 ALA 50 HB2 ALA 50 2.876 1.996 9.266 96 HB3 ALA 50 HB3 ALA 50 2.905 3.280 10.484 97 H LYS 51 HN LYS 51 1.674 5.211 7.399 98 HA LYS 51 HA LYS 51 1.842 7.462 9.051 99 HB2 LYS 51 HB2 LYS 51 1.226 7.219 6.114 100 HB3 LYS 51 HB1 LYS 51 1.473 8.763 6.907 101 HG2 LYS 51 HG2 LYS 51 3.507 6.556 6.891 102 HG3 LYS 51 HG1 LYS 51 3.449 7.834 5.672 103 HD2 LYS 51 HD2 LYS 51 3.679 9.517 7.475 104 HD3 LYS 51 HD1 LYS 51 3.821 8.200 8.643 105 HE2 LYS 51 HE2 LYS 51 5.862 7.460 7.681 106 HE3 LYS 51 HE1 LYS 51 5.662 8.521 6.289 107 HZ1 LYS 51 HZ1 LYS 51 5.914 10.414 7.747 108 HZ2 LYS 51 HZ2 LYS 51 7.260 9.453 7.809 109 HZ3 LYS 51 HZ3 LYS 51 6.162 9.446 9.095 110 H GLY 52 HN GLY 52 -0.832 5.816 7.625 111 HA2 GLY 52 HA2 GLY 52 -2.700 7.976 8.061 112 HA3 GLY 52 HA1 GLY 52 -3.087 6.372 7.441 113 H ASP 53 HN ASP 53 -1.640 5.039 9.589 114 HA ASP 53 HA ASP 53 -3.846 5.040 11.409 115 HB2 ASP 53 HB2 ASP 53 -1.399 3.288 11.308 116 HB3 ASP 53 HB1 ASP 53 -2.588 3.184 12.601 117 H ILE 54 HN ILE 54 -0.544 6.124 11.514 118 HA ILE 54 HA ILE 54 -0.649 6.838 14.254 119 HB ILE 54 HB ILE 54 1.204 8.430 13.778 120 HG12 ILE 54 HG12 ILE 54 0.741 7.551 10.928 121 HG13 ILE 54 HG11 ILE 54 0.567 9.175 11.571 122 HG21 ILE 54 HG21 ILE 54 1.743 6.164 14.324 123 HG22 ILE 54 HG22 ILE 54 2.855 6.731 13.073 124 HG23 ILE 54 HG23 ILE 54 1.519 5.665 12.645 125 HD11 ILE 54 HD11 ILE 54 3.111 7.621 11.280 126 HD12 ILE 54 HD12 ILE 54 2.974 9.242 11.981 127 HD13 ILE 54 HD13 ILE 54 2.572 8.973 10.282 128 H LYS 55 HN LYS 55 -1.840 8.382 11.361 129 HA LYS 55 HA LYS 55 -2.388 10.887 12.625 130 HB2 LYS 55 HB2 LYS 55 -2.396 9.976 10.006 131 HB3 LYS 55 HB1 LYS 55 -4.107 10.198 10.356 132 HG2 LYS 55 HG2 LYS 55 -3.194 12.210 9.369 133 HG3 LYS 55 HG1 LYS 55 -3.647 12.510 11.053 134 HD2 LYS 55 HD2 LYS 55 -1.285 12.167 11.723 135 HD3 LYS 55 HD1 LYS 55 -0.889 11.896 10.034 136 HE2 LYS 55 HE2 LYS 55 -1.516 14.165 9.487 137 HE3 LYS 55 HE1 LYS 55 -2.041 14.444 11.149 138 HZ1 LYS 55 HZ1 LYS 55 0.212 14.082 11.897 139 HZ2 LYS 55 HZ2 LYS 55 0.188 15.334 10.765 140 HZ3 LYS 55 HZ3 LYS 55 0.743 13.805 10.320 141 H ALA 56 HN ALA 56 -4.004 7.868 12.231 142 HA ALA 56 HA ALA 56 -6.612 8.494 13.081 143 HB1 ALA 56 HB1 ALA 56 -5.026 5.970 13.466 144 HB2 ALA 56 HB2 ALA 56 -5.978 6.352 12.024 145 HB3 ALA 56 HB3 ALA 56 -6.781 6.094 13.584 146 H ILE 57 HN ILE 57 -3.699 7.562 14.768 147 HA ILE 57 HA ILE 57 -4.809 7.311 17.355 148 HB ILE 57 HB ILE 57 -1.942 8.064 16.746 149 HG12 ILE 57 HG12 ILE 57 -3.258 5.341 16.781 150 HG13 ILE 57 HG11 ILE 57 -2.646 6.173 15.387 151 HG21 ILE 57 HG21 ILE 57 -3.270 6.582 19.027 152 HG22 ILE 57 HG22 ILE 57 -2.590 8.210 19.089 153 HG23 ILE 57 HG23 ILE 57 -1.530 6.817 18.854 154 HD11 ILE 57 HD11 ILE 57 -1.175 4.440 16.101 155 HD12 ILE 57 HD12 ILE 57 -0.930 5.239 17.669 156 HD13 ILE 57 HD13 ILE 57 -0.390 6.011 16.175 157 H ALA 58 HN ALA 58 -3.290 9.947 15.639 158 HA ALA 58 HA ALA 58 -3.205 11.825 17.707 159 HB1 ALA 58 HB1 ALA 58 -3.113 13.521 15.939 160 HB2 ALA 58 HB2 ALA 58 -3.603 12.299 14.760 161 HB3 ALA 58 HB3 ALA 58 -2.058 12.151 15.592 162 H ALA 59 HN ALA 59 -5.881 10.719 15.795 163 HA ALA 59 HA ALA 59 -7.606 12.914 16.550 164 HB1 ALA 59 HB1 ALA 59 -9.324 11.718 15.271 165 HB2 ALA 59 HB2 ALA 59 -8.230 10.348 15.081 166 HB3 ALA 59 HB3 ALA 59 -7.841 11.897 14.334 167 H ALA 60 HN ALA 60 -6.887 9.665 17.569 168 HA ALA 60 HA ALA 60 -9.199 9.545 19.300 169 HB1 ALA 60 HB1 ALA 60 -8.384 7.336 19.914 170 HB2 ALA 60 HB2 ALA 60 -6.903 7.626 19.020 171 HB3 ALA 60 HB3 ALA 60 -8.443 7.514 18.156 172 H LEU 61 HN LEU 61 -5.796 10.234 19.547 173 HA LEU 61 HA LEU 61 -5.627 10.285 22.387 174 HB2 LEU 61 HB2 LEU 61 -3.802 10.230 20.493 175 HB3 LEU 61 HB1 LEU 61 -4.024 11.957 20.450 176 HG LEU 61 HG LEU 61 -2.035 11.127 21.728 177 HD11 LEU 61 HD11 LEU 61 -4.044 12.710 23.298 178 HD12 LEU 61 HD12 LEU 61 -2.900 13.356 22.127 179 HD13 LEU 61 HD13 LEU 61 -2.317 12.634 23.627 180 HD21 LEU 61 HD21 LEU 61 -3.083 9.187 22.767 181 HD22 LEU 61 HD22 LEU 61 -4.092 10.294 23.729 182 HD23 LEU 61 HD23 LEU 61 -2.349 10.279 23.949 183 H ASP 62 HN ASP 62 -6.710 12.404 19.913 184 HA ASP 62 HA ASP 62 -7.181 14.738 21.477 185 HB2 ASP 62 HB2 ASP 62 -7.037 14.824 19.034 186 HB3 ASP 62 HB1 ASP 62 -8.402 13.734 18.885 187 H MET 63 HN MET 63 -8.789 11.737 21.020 188 HA MET 63 HA MET 63 -11.243 12.586 22.243 189 HB2 MET 63 HB2 MET 63 -10.255 9.838 21.471 190 HB3 MET 63 HB1 MET 63 -11.792 10.111 22.275 191 HG2 MET 63 HG2 MET 63 -11.014 11.286 19.620 192 HG3 MET 63 HG1 MET 63 -11.994 9.835 19.837 193 HE1 MET 63 HE1 MET 63 -13.911 10.893 18.319 194 HE2 MET 63 HE2 MET 63 -12.915 12.328 18.090 195 HE3 MET 63 HE3 MET 63 -14.597 12.495 18.593 196 H TYR 64 HN TYR 64 -8.295 10.895 23.294 197 HA TYR 64 HA TYR 64 -9.192 10.546 26.006 198 HB2 TYR 64 HB2 TYR 64 -7.064 9.496 25.093 199 HB3 TYR 64 HB1 TYR 64 -6.320 11.099 25.176 200 HD1 TYR 64 HD1 TYR 64 -5.889 12.172 27.427 201 HD2 TYR 64 HD2 TYR 64 -7.542 8.241 27.160 202 HE1 TYR 64 HE1 TYR 64 -5.428 11.810 29.730 203 HE2 TYR 64 HE2 TYR 64 -7.065 7.896 29.439 204 HH TYR 64 HH TYR 64 -6.437 10.435 31.437 205 H LYS 65 HN LYS 65 -7.785 13.159 24.161 206 HA LYS 65 HA LYS 65 -7.404 15.023 26.166 207 HB2 LYS 65 HB2 LYS 65 -6.580 15.511 23.996 208 HB3 LYS 65 HB1 LYS 65 -8.172 15.321 23.279 209 HG2 LYS 65 HG2 LYS 65 -8.922 17.330 24.310 210 HG3 LYS 65 HG1 LYS 65 -7.371 17.544 25.139 211 HD2 LYS 65 HD2 LYS 65 -6.251 17.850 23.050 212 HD3 LYS 65 HD1 LYS 65 -7.685 17.378 22.151 213 HE2 LYS 65 HE2 LYS 65 -7.451 19.793 22.089 214 HE3 LYS 65 HE1 LYS 65 -8.871 19.330 23.010 215 HZ1 LYS 65 HZ1 LYS 65 -6.279 20.144 24.225 216 HZ2 LYS 65 HZ2 LYS 65 -7.716 19.794 25.058 217 HZ3 LYS 65 HZ3 LYS 65 -7.636 21.119 24.054 218 H LEU 66 HN LEU 66 -10.377 14.062 24.523 219 HA LEU 66 HA LEU 66 -12.050 15.902 25.988 220 HB2 LEU 66 HB2 LEU 66 -12.816 13.281 24.690 221 HB3 LEU 66 HB1 LEU 66 -13.934 14.448 25.313 222 HG LEU 66 HG LEU 66 -12.127 14.813 22.933 223 HD11 LEU 66 HD11 LEU 66 -14.014 13.357 22.518 224 HD12 LEU 66 HD12 LEU 66 -14.255 14.905 21.704 225 HD13 LEU 66 HD13 LEU 66 -15.113 14.551 23.203 226 HD21 LEU 66 HD21 LEU 66 -14.113 16.728 24.170 227 HD22 LEU 66 HD22 LEU 66 -13.304 16.961 22.626 228 HD23 LEU 66 HD23 LEU 66 -12.362 16.935 24.115 229 H ASP 67 HN ASP 67 -10.871 12.668 26.478 230 HA ASP 67 HA ASP 67 -12.710 11.797 28.480 231 HB2 ASP 67 HB2 ASP 67 -11.217 10.441 26.907 232 HB3 ASP 67 HB1 ASP 67 -9.892 10.860 27.970 233 H ASN 68 HN ASN 68 -9.680 13.559 28.532 234 HA ASN 68 HA ASN 68 -9.796 13.809 31.538 235 HB2 ASN 68 HB2 ASN 68 -7.782 12.607 30.005 236 HB3 ASN 68 HB1 ASN 68 -7.446 14.350 30.327 237 HD21 ASN 68 HD21 ASN 68 -6.929 15.032 32.225 238 HD22 ASN 68 HD22 ASN 68 -6.640 14.036 33.624 239 H PHE 69 HN PHE 69 -10.666 15.399 29.109 240 HA PHE 69 HA PHE 69 -10.584 17.575 28.315 241 HB2 PHE 69 HB2 PHE 69 -10.795 19.229 30.249 242 HB3 PHE 69 HB1 PHE 69 -11.974 17.928 30.171 243 HD1 PHE 69 HD2 PHE 69 -8.917 18.988 31.834 244 HD2 PHE 69 HD1 PHE 69 -12.136 16.424 31.851 245 HE1 PHE 69 HE2 PHE 69 -8.383 18.466 34.169 246 HE2 PHE 69 HE1 PHE 69 -11.721 15.785 34.173 247 HZ PHE 69 HZ PHE 69 -9.795 16.816 35.388 248 H ALA 70 HN ALA 70 -7.988 16.439 28.346 249 HA ALA 70 HA ALA 70 -6.196 18.554 28.008 250 HB1 ALA 70 HB1 ALA 70 -6.031 17.111 30.651 251 HB2 ALA 70 HB2 ALA 70 -6.447 18.804 30.454 252 HB3 ALA 70 HB3 ALA 70 -4.817 18.237 30.027 253 H TYR 71 HN TYR 71 -4.057 17.663 27.588 254 HA TYR 71 HA TYR 71 -4.220 14.955 26.761 255 HB2 TYR 71 HB2 TYR 71 -2.028 17.008 26.627 256 HB3 TYR 71 HB1 TYR 71 -1.744 15.331 26.187 257 HD1 TYR 71 HD2 TYR 71 -4.096 14.525 24.739 258 HD2 TYR 71 HD1 TYR 71 -2.096 18.274 24.703 259 HE1 TYR 71 HE2 TYR 71 -4.935 14.907 22.546 260 HE2 TYR 71 HE1 TYR 71 -2.953 18.693 22.448 261 HH TYR 71 HH TYR 71 -5.425 16.915 21.055 262 HA PRO 72 HA PRO 72 -2.621 12.714 30.236 263 HB2 PRO 72 HB2 PRO 72 -0.848 11.094 28.782 264 HB3 PRO 72 HB1 PRO 72 -2.580 10.763 29.009 265 HG2 PRO 72 HG2 PRO 72 -1.106 12.004 26.728 266 HG3 PRO 72 HG1 PRO 72 -2.461 10.867 26.708 267 HD2 PRO 72 HD2 PRO 72 -2.808 13.434 26.214 268 HD3 PRO 72 HD1 PRO 72 -4.000 12.514 27.149 269 H SER 73 HN SER 73 -0.420 12.136 31.383 270 HA SER 73 HA SER 73 1.584 14.113 30.601 271 HB2 SER 73 HB2 SER 73 2.503 13.742 32.899 272 HB3 SER 73 HB1 SER 73 0.820 14.230 32.946 273 HG SER 73 HG SER 73 0.235 12.395 33.632 274 H THR 74 HN THR 74 3.898 13.225 30.592 275 HA THR 74 HA THR 74 3.675 10.850 29.040 276 HB THR 74 HB THR 74 5.299 12.838 28.635 277 HG1 THR 74 HG1 THR 74 5.869 11.557 27.168 278 HG21 THR 74 HG21 THR 74 6.469 12.762 30.783 279 HG22 THR 74 HG22 THR 74 7.599 12.449 29.461 280 HG23 THR 74 HG23 THR 74 6.998 11.117 30.451 281 H GLN 75 HN GLN 75 4.187 11.343 32.323 282 HA GLN 75 HA GLN 75 5.053 8.586 32.667 283 HB2 GLN 75 HB2 GLN 75 5.013 10.960 34.449 284 HB3 GLN 75 HB1 GLN 75 4.787 9.395 35.215 285 HG2 GLN 75 HG2 GLN 75 7.119 10.161 35.265 286 HG3 GLN 75 HG1 GLN 75 6.935 8.647 34.391 287 HE21 GLN 75 HE21 GLN 75 7.644 12.034 34.151 288 HE22 GLN 75 HE22 GLN 75 8.294 11.981 32.563 289 H GLN 76 HN GLN 76 2.382 10.684 34.026 290 HA GLN 76 HA GLN 76 0.985 8.285 34.922 291 HB2 GLN 76 HB2 GLN 76 0.175 11.192 34.967 292 HB3 GLN 76 HB1 GLN 76 -0.731 9.873 35.675 293 HG2 GLN 76 HG2 GLN 76 1.126 9.464 37.229 294 HG3 GLN 76 HG1 GLN 76 1.995 10.826 36.517 295 HE21 GLN 76 HE21 GLN 76 1.248 12.930 36.893 296 HE22 GLN 76 HE22 GLN 76 0.142 13.265 38.162 297 H GLY 77 HN GLY 77 0.701 10.616 32.344 298 HA2 GLY 77 HA2 GLY 77 -1.792 9.571 31.526 299 HA3 GLY 77 HA1 GLY 77 -0.730 10.576 30.572 300 H LEU 78 HN LEU 78 1.494 8.571 30.987 301 HA LEU 78 HA LEU 78 1.023 6.964 28.678 302 HB2 LEU 78 HB2 LEU 78 3.289 7.670 29.699 303 HB3 LEU 78 HB1 LEU 78 3.044 6.392 30.861 304 HG LEU 78 HG LEU 78 3.308 5.962 27.880 305 HD11 LEU 78 HD11 LEU 78 5.339 6.846 28.807 306 HD12 LEU 78 HD12 LEU 78 5.548 5.138 28.411 307 HD13 LEU 78 HD13 LEU 78 5.311 5.639 30.091 308 HD21 LEU 78 HD21 LEU 78 2.095 4.145 29.006 309 HD22 LEU 78 HD22 LEU 78 3.413 3.993 30.170 310 HD23 LEU 78 HD23 LEU 78 3.690 3.606 28.471 311 H GLU 79 HN GLU 79 1.004 6.385 32.140 312 HA GLU 79 HA GLU 79 0.000 3.724 31.847 313 HB2 GLU 79 HB2 GLU 79 0.504 5.450 34.267 314 HB3 GLU 79 HB1 GLU 79 -0.106 3.799 34.360 315 HG2 GLU 79 HG2 GLU 79 1.838 2.938 33.330 316 HG3 GLU 79 HG1 GLU 79 2.461 4.554 32.991 317 H ALA 80 HN ALA 80 -1.379 6.665 31.574 318 HA ALA 80 HA ALA 80 -4.011 5.779 32.486 319 HB1 ALA 80 HB1 ALA 80 -3.203 8.095 33.021 320 HB2 ALA 80 HB2 ALA 80 -4.732 8.038 32.084 321 HB3 ALA 80 HB3 ALA 80 -3.231 8.404 31.278 322 H LEU 81 HN LEU 81 -2.069 5.799 29.810 323 HA LEU 81 HA LEU 81 -4.304 5.613 27.954 324 HB2 LEU 81 HB2 LEU 81 -1.431 6.126 27.779 325 HB3 LEU 81 HB1 LEU 81 -2.031 5.092 26.510 326 HG LEU 81 HG LEU 81 -3.558 6.858 25.748 327 HD11 LEU 81 HD11 LEU 81 -2.511 8.519 28.020 328 HD12 LEU 81 HD12 LEU 81 -4.130 7.832 27.902 329 HD13 LEU 81 HD13 LEU 81 -3.604 9.053 26.743 330 HD21 LEU 81 HD21 LEU 81 -1.927 8.528 25.051 331 HD22 LEU 81 HD22 LEU 81 -1.283 6.898 24.889 332 HD23 LEU 81 HD23 LEU 81 -0.781 7.915 26.240 333 H VAL 82 HN VAL 82 -2.072 3.704 29.672 334 HA VAL 82 HA VAL 82 -2.858 1.309 28.176 335 HB VAL 82 HB VAL 82 -0.624 1.662 30.209 336 HG11 VAL 82 HG11 VAL 82 -1.273 -0.712 28.456 337 HG12 VAL 82 HG12 VAL 82 -1.430 -0.646 30.211 338 HG13 VAL 82 HG13 VAL 82 0.165 -0.547 29.464 339 HG21 VAL 82 HG21 VAL 82 -0.219 2.869 28.127 340 HG22 VAL 82 HG22 VAL 82 -0.552 1.422 27.198 341 HG23 VAL 82 HG23 VAL 82 0.868 1.484 28.251 342 H LYS 83 HN LYS 83 -3.263 2.839 31.284 343 HA LYS 83 HA LYS 83 -4.992 0.667 32.166 344 HB2 LYS 83 HB2 LYS 83 -2.844 0.603 33.433 345 HB3 LYS 83 HB1 LYS 83 -3.027 2.295 33.823 346 HG2 LYS 83 HG2 LYS 83 -5.007 1.784 35.167 347 HG3 LYS 83 HG1 LYS 83 -4.844 0.073 34.760 348 HD2 LYS 83 HD2 LYS 83 -2.654 0.017 35.825 349 HD3 LYS 83 HD1 LYS 83 -2.782 1.735 36.201 350 HE2 LYS 83 HE2 LYS 83 -4.699 1.291 37.633 351 HE3 LYS 83 HE1 LYS 83 -4.628 -0.421 37.224 352 HZ1 LYS 83 HZ1 LYS 83 -3.582 0.031 39.364 353 HZ2 LYS 83 HZ2 LYS 83 -2.492 1.089 38.643 354 HZ3 LYS 83 HZ3 LYS 83 -2.444 -0.535 38.263 355 H LYS 84 HN LYS 84 -6.819 1.551 33.457 356 HA LYS 84 HA LYS 84 -7.922 3.839 32.270 357 HB2 LYS 84 HB2 LYS 84 -8.661 2.413 34.839 358 HB3 LYS 84 HB1 LYS 84 -9.529 3.851 34.311 359 HG2 LYS 84 HG2 LYS 84 -10.784 1.964 33.716 360 HG3 LYS 84 HG1 LYS 84 -10.074 2.589 32.232 361 HD2 LYS 84 HD2 LYS 84 -8.393 0.859 32.274 362 HD3 LYS 84 HD1 LYS 84 -8.996 0.267 33.828 363 HE2 LYS 84 HE2 LYS 84 -11.139 -0.174 32.824 364 HE3 LYS 84 HE1 LYS 84 -10.548 0.401 31.269 365 HZ1 LYS 84 HZ1 LYS 84 -8.912 -1.442 31.297 366 HZ2 LYS 84 HZ2 LYS 84 -10.481 -2.004 31.332 367 HZ3 LYS 84 HZ3 LYS 84 -9.564 -2.003 32.740 368 HA PRO 85 HA PRO 85 -5.806 7.310 33.543 369 HB2 PRO 85 HB2 PRO 85 -7.990 9.020 33.913 370 HB3 PRO 85 HB1 PRO 85 -7.081 8.755 32.428 371 HG2 PRO 85 HG2 PRO 85 -9.650 7.542 33.300 372 HG3 PRO 85 HG1 PRO 85 -9.106 7.990 31.674 373 HD2 PRO 85 HD2 PRO 85 -9.172 5.458 32.468 374 HD3 PRO 85 HD1 PRO 85 -7.857 6.059 31.435 375 H THR 86 HN THR 86 -4.861 7.839 35.256 376 HA THR 86 HA THR 86 -6.086 7.718 37.836 377 HB THR 86 HB THR 86 -3.704 7.062 37.504 378 HG1 THR 86 HG1 THR 86 -2.799 8.404 39.169 379 HG21 THR 86 HG21 THR 86 -3.104 8.631 35.719 380 HG22 THR 86 HG22 THR 86 -1.984 8.772 37.071 381 HG23 THR 86 HG23 THR 86 -3.249 9.981 36.846 382 H GLY 87 HN GLY 87 -6.422 9.621 39.165 383 HA2 GLY 87 HA2 GLY 87 -6.637 11.944 39.487 384 HA3 GLY 87 HA1 GLY 87 -6.356 12.189 37.763 385 H ASN 88 HN ASN 88 -8.437 13.590 37.728 386 HA ASN 88 HA ASN 88 -10.748 12.051 37.989 387 HB2 ASN 88 HB2 ASN 88 -10.581 14.001 39.360 388 HB3 ASN 88 HB1 ASN 88 -10.001 14.965 38.003 389 HD21 ASN 88 HD21 ASN 88 -12.519 12.594 37.943 390 HD22 ASN 88 HD22 ASN 88 -13.683 13.765 37.485 391 HA PRO 89 HA PRO 89 -10.691 12.834 33.484 392 HB2 PRO 89 HB2 PRO 89 -11.317 10.381 32.585 393 HB3 PRO 89 HB1 PRO 89 -9.686 10.745 33.079 394 HG2 PRO 89 HG2 PRO 89 -11.738 9.140 34.506 395 HG3 PRO 89 HG1 PRO 89 -9.978 9.055 34.626 396 HD2 PRO 89 HD2 PRO 89 -11.801 10.382 36.401 397 HD3 PRO 89 HD1 PRO 89 -10.032 10.329 36.503 398 H GLN 90 HN GLN 90 -12.527 12.714 31.991 399 HA GLN 90 HA GLN 90 -15.034 13.131 33.396 400 HB2 GLN 90 HB2 GLN 90 -14.145 13.646 30.560 401 HB3 GLN 90 HB1 GLN 90 -15.830 13.794 31.041 402 HG2 GLN 90 HG2 GLN 90 -15.224 15.450 32.691 403 HG3 GLN 90 HG1 GLN 90 -13.535 15.298 32.247 404 HE21 GLN 90 HE21 GLN 90 -14.109 15.154 29.351 405 HE22 GLN 90 HE22 GLN 90 -14.604 16.719 28.886 406 HA PRO 91 HA PRO 91 -16.815 9.250 32.362 407 HB2 PRO 91 HB2 PRO 91 -19.319 10.483 31.445 408 HB3 PRO 91 HB1 PRO 91 -19.039 9.432 32.831 409 HG2 PRO 91 HG2 PRO 91 -19.580 12.060 33.125 410 HG3 PRO 91 HG1 PRO 91 -18.513 11.180 34.233 411 HD2 PRO 91 HD2 PRO 91 -17.811 13.026 31.991 412 HD3 PRO 91 HD1 PRO 91 -17.073 12.863 33.600 413 H LYS 92 HN LYS 92 -15.678 8.594 30.611 414 HA LYS 92 HA LYS 92 -17.021 8.701 28.084 415 HB2 LYS 92 HB2 LYS 92 -15.523 10.655 27.989 416 HB3 LYS 92 HB1 LYS 92 -14.169 9.666 28.492 417 HG2 LYS 92 HG2 LYS 92 -14.087 8.550 26.409 418 HG3 LYS 92 HG1 LYS 92 -15.671 9.175 25.937 419 HD2 LYS 92 HD2 LYS 92 -14.775 11.397 25.790 420 HD3 LYS 92 HD1 LYS 92 -13.206 10.834 26.368 421 HE2 LYS 92 HE2 LYS 92 -13.344 11.125 23.899 422 HE3 LYS 92 HE1 LYS 92 -12.887 9.502 24.410 423 HZ1 LYS 92 HZ1 LYS 92 -15.647 10.299 23.616 424 HZ2 LYS 92 HZ2 LYS 92 -15.100 8.742 23.981 425 HZ3 LYS 92 HZ3 LYS 92 -14.548 9.521 22.609 426 H ASN 93 HN ASN 93 -16.486 6.877 26.855 427 HA ASN 93 HA ASN 93 -15.544 4.678 28.406 428 HB2 ASN 93 HB2 ASN 93 -16.429 4.850 25.535 429 HB3 ASN 93 HB1 ASN 93 -15.741 3.376 26.205 430 HD21 ASN 93 HD21 ASN 93 -18.518 5.400 26.005 431 HD22 ASN 93 HD22 ASN 93 -19.540 4.394 26.957 432 H TRP 94 HN TRP 94 -13.521 5.104 28.964 433 HA TRP 94 HA TRP 94 -11.436 5.919 27.434 434 HB2 TRP 94 HB2 TRP 94 -11.373 5.846 29.831 435 HB3 TRP 94 HB1 TRP 94 -11.507 4.091 29.822 436 HD1 TRP 94 HD1 TRP 94 -9.003 6.926 29.066 437 HE1 TRP 94 HE1 TRP 94 -6.655 5.901 29.146 438 HE3 TRP 94 HE3 TRP 94 -10.233 1.981 29.551 439 HZ2 TRP 94 HZ2 TRP 94 -5.473 3.388 29.352 440 HZ3 TRP 94 HZ3 TRP 94 -8.416 0.335 29.684 441 HH2 TRP 94 HH2 TRP 94 -6.086 1.029 29.585 442 H ASN 95 HN ASN 95 -9.963 4.978 26.236 443 HA ASN 95 HA ASN 95 -10.420 2.243 25.464 444 HB2 ASN 95 HB2 ASN 95 -10.867 3.695 23.595 445 HB3 ASN 95 HB1 ASN 95 -9.366 4.574 23.892 446 HD21 ASN 95 HD21 ASN 95 -9.628 1.022 23.882 447 HD22 ASN 95 HD22 ASN 95 -8.563 0.892 22.519 448 H LYS 96 HN LYS 96 -8.650 0.893 25.804 449 HA LYS 96 HA LYS 96 -6.287 1.892 27.051 450 HB2 LYS 96 HB2 LYS 96 -5.387 -0.266 26.856 451 HB3 LYS 96 HB1 LYS 96 -7.027 -0.410 27.549 452 HG2 LYS 96 HG2 LYS 96 -7.744 -1.086 25.190 453 HG3 LYS 96 HG1 LYS 96 -6.028 -0.991 24.775 454 HD2 LYS 96 HD2 LYS 96 -7.084 -2.733 26.957 455 HD3 LYS 96 HD1 LYS 96 -6.859 -3.308 25.296 456 HE2 LYS 96 HE2 LYS 96 -4.484 -2.755 25.442 457 HE3 LYS 96 HE1 LYS 96 -4.703 -2.145 27.074 458 HZ1 LYS 96 HZ1 LYS 96 -5.030 -4.944 26.160 459 HZ2 LYS 96 HZ2 LYS 96 -5.407 -4.404 27.714 460 HZ3 LYS 96 HZ3 LYS 96 -3.819 -4.323 27.158 461 H ASP 97 HN ASP 97 -4.222 1.122 26.243 462 HA ASP 97 HA ASP 97 -2.555 0.890 24.809 463 HB2 ASP 97 HB2 ASP 97 -4.185 -0.944 24.008 464 HB3 ASP 97 HB1 ASP 97 -4.562 0.157 22.686 465 H GLY 98 HN GLY 98 -3.992 3.298 25.171 466 HA2 GLY 98 HA2 GLY 98 -2.787 5.290 24.742 467 HA3 GLY 98 HA1 GLY 98 -2.318 4.635 23.198 468 H TYR 99 HN TYR 99 -5.611 4.196 23.747 469 HA TYR 99 HA TYR 99 -7.396 4.949 22.658 470 HB2 TYR 99 HB2 TYR 99 -6.195 7.402 23.691 471 HB3 TYR 99 HB1 TYR 99 -6.985 7.726 22.145 472 HD1 TYR 99 HD2 TYR 99 -7.346 6.757 25.618 473 HD2 TYR 99 HD1 TYR 99 -9.354 7.539 21.973 474 HE1 TYR 99 HE2 TYR 99 -9.471 6.943 26.830 475 HE2 TYR 99 HE1 TYR 99 -11.474 7.720 23.158 476 HH TYR 99 HH TYR 99 -11.605 7.713 26.631 477 H LEU 100 HN LEU 100 -7.121 3.788 20.940 478 HA LEU 100 HA LEU 100 -5.919 5.013 18.559 479 HB2 LEU 100 HB2 LEU 100 -4.553 3.223 20.095 480 HB3 LEU 100 HB1 LEU 100 -5.498 2.128 19.118 481 HG LEU 100 HG LEU 100 -3.462 4.114 18.135 482 HD11 LEU 100 HD11 LEU 100 -3.354 1.126 18.242 483 HD12 LEU 100 HD12 LEU 100 -2.462 2.251 19.265 484 HD13 LEU 100 HD13 LEU 100 -2.132 2.179 17.534 485 HD21 LEU 100 HD21 LEU 100 -5.188 3.842 16.428 486 HD22 LEU 100 HD22 LEU 100 -5.056 2.090 16.553 487 HD23 LEU 100 HD23 LEU 100 -3.705 3.033 15.921 488 H LYS 101 HN LYS 101 -6.955 4.077 16.652 489 HA LYS 101 HA LYS 101 -9.555 3.031 16.968 490 HB2 LYS 101 HB2 LYS 101 -7.667 2.983 14.599 491 HB3 LYS 101 HB1 LYS 101 -9.319 2.402 14.521 492 HG2 LYS 101 HG2 LYS 101 -8.503 5.232 15.174 493 HG3 LYS 101 HG1 LYS 101 -9.097 4.668 13.609 494 HD2 LYS 101 HD2 LYS 101 -11.205 3.983 14.675 495 HD3 LYS 101 HD1 LYS 101 -10.621 4.594 16.219 496 HE2 LYS 101 HE2 LYS 101 -11.141 6.211 13.723 497 HE3 LYS 101 HE1 LYS 101 -12.119 6.193 15.186 498 HZ1 LYS 101 HZ1 LYS 101 -9.332 7.178 14.954 499 HZ2 LYS 101 HZ2 LYS 101 -10.235 7.099 16.403 500 HZ3 LYS 101 HZ3 LYS 101 -10.723 8.114 15.175 501 H LYS 102 HN LYS 102 -10.274 0.881 16.874 502 HA LYS 102 HA LYS 102 -8.368 -0.927 17.974 503 HB2 LYS 102 HB2 LYS 102 -11.208 -1.583 17.213 504 HB3 LYS 102 HB1 LYS 102 -10.175 -2.507 18.287 505 HG2 LYS 102 HG2 LYS 102 -11.229 0.261 18.751 506 HG3 LYS 102 HG1 LYS 102 -11.814 -1.206 19.534 507 HD2 LYS 102 HD2 LYS 102 -9.006 -0.094 19.828 508 HD3 LYS 102 HD1 LYS 102 -10.316 0.300 20.918 509 HE2 LYS 102 HE2 LYS 102 -9.048 -1.394 22.004 510 HE3 LYS 102 HE1 LYS 102 -10.499 -2.180 21.413 511 HZ1 LYS 102 HZ1 LYS 102 -9.227 -3.192 19.644 512 HZ2 LYS 102 HZ2 LYS 102 -8.401 -3.428 21.096 513 HZ3 LYS 102 HZ3 LYS 102 -7.863 -2.274 20.041 514 H LEU 103 HN LEU 103 -6.976 -1.008 16.348 515 HA LEU 103 HA LEU 103 -7.468 -3.109 14.384 516 HB2 LEU 103 HB2 LEU 103 -5.956 -0.523 13.980 517 HB3 LEU 103 HB1 LEU 103 -5.641 -1.929 12.990 518 HG LEU 103 HG LEU 103 -8.125 -1.788 12.352 519 HD11 LEU 103 HD11 LEU 103 -9.146 0.388 12.476 520 HD12 LEU 103 HD12 LEU 103 -7.781 0.995 13.412 521 HD13 LEU 103 HD13 LEU 103 -8.833 -0.250 14.091 522 HD21 LEU 103 HD21 LEU 103 -6.186 0.341 11.507 523 HD22 LEU 103 HD22 LEU 103 -7.652 -0.112 10.639 524 HD23 LEU 103 HD23 LEU 103 -6.344 -1.281 10.829 525 HA PRO 104 HA PRO 104 -3.956 -5.094 16.250 526 HB2 PRO 104 HB2 PRO 104 -2.727 -6.038 13.947 527 HB3 PRO 104 HB1 PRO 104 -4.040 -6.856 14.800 528 HG2 PRO 104 HG2 PRO 104 -4.156 -5.082 12.398 529 HG3 PRO 104 HG1 PRO 104 -5.039 -6.584 12.722 530 HD2 PRO 104 HD2 PRO 104 -6.223 -4.219 12.986 531 HD3 PRO 104 HD1 PRO 104 -6.554 -5.524 14.146 532 H VAL 105 HN VAL 105 -1.500 -5.163 15.939 533 HA VAL 105 HA VAL 105 -0.704 -2.408 15.853 534 HB VAL 105 HB VAL 105 -0.090 -4.270 17.528 535 HG11 VAL 105 HG11 VAL 105 2.043 -5.385 17.192 536 HG12 VAL 105 HG12 VAL 105 2.082 -4.812 15.535 537 HG13 VAL 105 HG13 VAL 105 0.806 -5.909 16.053 538 HG21 VAL 105 HG21 VAL 105 0.738 -1.929 17.584 539 HG22 VAL 105 HG22 VAL 105 2.163 -2.486 16.676 540 HG23 VAL 105 HG23 VAL 105 1.755 -3.182 18.265 541 H ASP 106 HN ASP 106 1.761 -2.072 14.795 542 HA ASP 106 HA ASP 106 1.026 -2.415 12.019 543 HB2 ASP 106 HB2 ASP 106 1.979 -0.170 13.117 544 HB3 ASP 106 HB1 ASP 106 3.539 -0.943 12.881 545 HA PRO 107 HA PRO 107 3.801 -5.651 10.679 546 HB2 PRO 107 HB2 PRO 107 4.756 -3.385 8.967 547 HB3 PRO 107 HB1 PRO 107 4.595 -5.103 8.574 548 HG2 PRO 107 HG2 PRO 107 2.692 -3.421 7.873 549 HG3 PRO 107 HG1 PRO 107 2.256 -4.987 8.584 550 HD2 PRO 107 HD2 PRO 107 2.177 -2.276 9.800 551 HD3 PRO 107 HD1 PRO 107 1.145 -3.686 10.114 552 H TRP 108 HN TRP 108 6.052 -5.996 10.267 553 HA TRP 108 HA TRP 108 8.153 -6.210 10.780 554 HB2 TRP 108 HB2 TRP 108 8.205 -3.486 12.113 555 HB3 TRP 108 HB1 TRP 108 9.583 -4.383 11.514 556 HD1 TRP 108 HD1 TRP 108 9.340 -4.760 8.663 557 HE1 TRP 108 HE1 TRP 108 8.851 -2.883 6.949 558 HE3 TRP 108 HE3 TRP 108 7.196 -1.442 11.825 559 HZ2 TRP 108 HZ2 TRP 108 7.652 -0.250 7.022 560 HZ3 TRP 108 HZ3 TRP 108 6.404 0.711 10.987 561 HH2 TRP 108 HH2 TRP 108 6.592 1.304 8.705 562 H GLY 109 HN GLY 109 5.799 -6.378 12.628 563 HA2 GLY 109 HA2 GLY 109 5.185 -6.961 14.781 564 HA3 GLY 109 HA1 GLY 109 6.857 -7.531 14.999 565 H ASN 110 HN ASN 110 6.244 -4.262 14.207 566 HA ASN 110 HA ASN 110 7.319 -3.409 16.684 567 HB2 ASN 110 HB2 ASN 110 6.567 -1.917 14.188 568 HB3 ASN 110 HB1 ASN 110 7.114 -1.113 15.653 569 HD21 ASN 110 HD21 ASN 110 8.294 -1.174 13.081 570 HD22 ASN 110 HD22 ASN 110 9.894 -1.788 13.261 571 HA PRO 111 HA PRO 111 3.409 -2.369 18.370 572 HB2 PRO 111 HB2 PRO 111 4.315 -1.527 20.748 573 HB3 PRO 111 HB1 PRO 111 4.232 -3.244 20.343 574 HG2 PRO 111 HG2 PRO 111 6.584 -1.415 20.388 575 HG3 PRO 111 HG1 PRO 111 6.484 -3.123 20.848 576 HD2 PRO 111 HD2 PRO 111 7.458 -2.190 18.433 577 HD3 PRO 111 HD1 PRO 111 6.850 -3.833 18.721 578 H TYR 112 HN TYR 112 2.364 -0.398 18.784 579 HA TYR 112 HA TYR 112 3.822 1.929 17.929 580 HB2 TYR 112 HB2 TYR 112 0.971 1.464 18.787 581 HB3 TYR 112 HB1 TYR 112 1.625 3.088 18.660 582 HD1 TYR 112 HD2 TYR 112 2.164 4.041 16.539 583 HD2 TYR 112 HD1 TYR 112 0.518 0.132 16.770 584 HE1 TYR 112 HE2 TYR 112 1.630 4.141 14.158 585 HE2 TYR 112 HE1 TYR 112 -0.033 0.230 14.360 586 HH TYR 112 HH TYR 112 -0.379 1.873 12.594 587 H GLN 113 HN GLN 113 4.491 3.536 19.231 588 HA GLN 113 HA GLN 113 4.661 2.849 22.092 589 HB2 GLN 113 HB2 GLN 113 6.255 5.135 21.113 590 HB3 GLN 113 HB1 GLN 113 6.726 3.844 22.185 591 HG2 GLN 113 HG2 GLN 113 6.729 3.818 19.171 592 HG3 GLN 113 HG1 GLN 113 8.122 3.920 20.222 593 HE21 GLN 113 HE21 GLN 113 6.960 1.785 21.996 594 HE22 GLN 113 HE22 GLN 113 7.237 0.336 21.105 595 H TYR 114 HN TYR 114 3.335 3.994 23.368 596 HA TYR 114 HA TYR 114 2.242 6.517 22.319 597 HB2 TYR 114 HB2 TYR 114 1.208 5.039 24.742 598 HB3 TYR 114 HB1 TYR 114 0.353 6.164 23.694 599 HD1 TYR 114 HD2 TYR 114 0.644 5.194 21.063 600 HD2 TYR 114 HD1 TYR 114 0.235 2.930 24.646 601 HE1 TYR 114 HE2 TYR 114 -0.176 3.295 19.764 602 HE2 TYR 114 HE1 TYR 114 -0.624 1.014 23.361 603 HH TYR 114 HH TYR 114 -1.633 0.583 21.062 604 H LEU 115 HN LEU 115 3.257 8.259 23.117 605 HA LEU 115 HA LEU 115 3.990 8.250 25.917 606 HB2 LEU 115 HB2 LEU 115 5.546 9.314 23.575 607 HB3 LEU 115 HB1 LEU 115 5.928 9.730 25.245 608 HG LEU 115 HG LEU 115 6.067 6.973 24.003 609 HD11 LEU 115 HD11 LEU 115 8.243 8.895 24.778 610 HD12 LEU 115 HD12 LEU 115 7.744 8.502 23.135 611 HD13 LEU 115 HD13 LEU 115 8.469 7.258 24.160 612 HD21 LEU 115 HD21 LEU 115 5.586 6.891 26.397 613 HD22 LEU 115 HD22 LEU 115 6.942 7.975 26.704 614 HD23 LEU 115 HD23 LEU 115 7.236 6.357 26.066 615 H ALA 116 HN ALA 116 3.889 10.443 26.838 616 HA ALA 116 HA ALA 116 1.970 11.946 25.310 617 HB1 ALA 116 HB1 ALA 116 2.179 11.925 28.322 618 HB2 ALA 116 HB2 ALA 116 1.314 10.697 27.424 619 HB3 ALA 116 HB3 ALA 116 0.784 12.356 27.306 620 HA PRO 117 HA PRO 117 4.108 15.697 25.039 621 HB2 PRO 117 HB2 PRO 117 3.704 17.343 27.249 622 HB3 PRO 117 HB1 PRO 117 2.772 17.333 25.754 623 HG2 PRO 117 HG2 PRO 117 2.183 16.056 28.374 624 HG3 PRO 117 HG1 PRO 117 1.066 16.728 27.174 625 HD2 PRO 117 HD2 PRO 117 1.431 14.091 27.506 626 HD3 PRO 117 HD1 PRO 117 1.074 14.774 25.895 627 H GLY 118 HN GLY 118 6.159 15.207 25.085 628 HA2 GLY 118 HA2 GLY 118 7.499 16.066 27.483 629 HA3 GLY 118 HA1 GLY 118 7.869 14.424 26.890 630 H THR 119 HN THR 119 8.269 14.614 24.359 631 HA THR 119 HA THR 119 10.562 16.340 24.330 632 HB THR 119 HB THR 119 9.601 14.554 22.119 633 HG1 THR 119 HG1 THR 119 9.839 13.217 23.742 634 HG21 THR 119 HG21 THR 119 12.342 15.599 22.854 635 HG22 THR 119 HG22 THR 119 11.343 16.162 21.517 636 HG23 THR 119 HG23 THR 119 11.989 14.520 21.505 637 H LYS 120 HN LYS 120 10.055 18.278 24.023 638 HA LYS 120 HA LYS 120 9.604 20.209 23.138 639 HB2 LYS 120 HB2 LYS 120 9.550 20.575 20.761 640 HB3 LYS 120 HB1 LYS 120 10.754 19.371 21.163 641 HG2 LYS 120 HG2 LYS 120 9.067 17.628 20.446 642 HG3 LYS 120 HG1 LYS 120 8.096 18.963 19.816 643 HD2 LYS 120 HD2 LYS 120 9.903 19.655 18.419 644 HD3 LYS 120 HD1 LYS 120 10.935 18.389 19.113 645 HE2 LYS 120 HE2 LYS 120 9.376 16.684 18.204 646 HE3 LYS 120 HE1 LYS 120 8.450 17.973 17.441 647 HZ1 LYS 120 HZ1 LYS 120 10.454 18.543 16.149 648 HZ2 LYS 120 HZ2 LYS 120 9.946 16.978 15.847 649 HZ3 LYS 120 HZ3 LYS 120 11.276 17.240 16.823 650 H GLY 121 HN GLY 121 6.996 17.930 22.905 651 HA2 GLY 121 HA2 GLY 121 5.205 20.165 23.195 652 HA3 GLY 121 HA1 GLY 121 5.097 19.423 21.613 653 HA PRO 122 HA PRO 122 1.493 18.435 24.603 654 HB2 PRO 122 HB2 PRO 122 0.704 18.266 21.736 655 HB3 PRO 122 HB1 PRO 122 -0.275 18.710 23.143 656 HG2 PRO 122 HG2 PRO 122 0.850 20.569 21.644 657 HG3 PRO 122 HG1 PRO 122 0.785 20.743 23.408 658 HD2 PRO 122 HD2 PRO 122 3.120 20.224 21.663 659 HD3 PRO 122 HD1 PRO 122 3.080 20.869 23.307 660 H PHE 123 HN PHE 123 2.875 16.370 21.989 661 HA PHE 123 HA PHE 123 2.775 14.261 23.710 662 HB2 PHE 123 HB2 PHE 123 1.204 12.630 22.725 663 HB3 PHE 123 HB1 PHE 123 0.388 14.007 23.419 664 HD1 PHE 123 HD1 PHE 123 1.323 12.315 20.300 665 HD2 PHE 123 HD2 PHE 123 -1.033 15.378 22.071 666 HE1 PHE 123 HE1 PHE 123 -0.005 12.472 18.242 667 HE2 PHE 123 HE2 PHE 123 -2.362 15.552 20.012 668 HZ PHE 123 HZ PHE 123 -1.852 14.094 18.092 669 H ASP 124 HN ASP 124 3.595 12.314 23.056 670 HA ASP 124 HA ASP 124 5.433 12.657 20.790 671 HB2 ASP 124 HB2 ASP 124 5.707 11.196 23.440 672 HB3 ASP 124 HB1 ASP 124 6.869 11.077 22.121 673 H LEU 125 HN LEU 125 4.541 11.338 19.158 674 HA LEU 125 HA LEU 125 3.548 8.721 20.033 675 HB2 LEU 125 HB2 LEU 125 1.740 10.353 19.599 676 HB3 LEU 125 HB1 LEU 125 2.334 10.572 17.977 677 HG LEU 125 HG LEU 125 0.275 9.260 18.187 678 HD11 LEU 125 HD11 LEU 125 2.584 7.754 16.967 679 HD12 LEU 125 HD12 LEU 125 1.610 8.992 16.180 680 HD13 LEU 125 HD13 LEU 125 0.882 7.449 16.629 681 HD21 LEU 125 HD21 LEU 125 0.672 8.061 20.232 682 HD22 LEU 125 HD22 LEU 125 2.063 7.241 19.528 683 HD23 LEU 125 HD23 LEU 125 0.448 6.878 18.937 684 H TYR 126 HN TYR 126 4.475 7.006 18.936 685 HA TYR 126 HA TYR 126 5.050 7.162 16.194 686 HB2 TYR 126 HB2 TYR 126 7.490 6.942 16.165 687 HB3 TYR 126 HB1 TYR 126 7.011 8.478 16.847 688 HD1 TYR 126 HD2 TYR 126 7.185 8.765 19.382 689 HD2 TYR 126 HD1 TYR 126 8.942 5.435 17.353 690 HE1 TYR 126 HE2 TYR 126 8.698 8.390 21.276 691 HE2 TYR 126 HE1 TYR 126 10.441 5.085 19.231 692 HH TYR 126 HH TYR 126 11.408 6.308 21.063 693 H SER 127 HN SER 127 6.045 5.248 15.355 694 HA SER 127 HA SER 127 5.966 2.939 17.150 695 HB2 SER 127 HB2 SER 127 4.055 3.031 15.463 696 HB3 SER 127 HB1 SER 127 5.268 3.026 14.187 697 HG SER 127 HG SER 127 5.236 0.951 14.349 698 H LEU 128 HN LEU 128 7.808 1.655 16.902 699 HA LEU 128 HA LEU 128 10.129 2.839 15.879 700 HB2 LEU 128 HB2 LEU 128 9.411 0.214 16.962 701 HB3 LEU 128 HB1 LEU 128 10.820 0.227 15.939 702 HG LEU 128 HG LEU 128 11.990 1.750 17.388 703 HD11 LEU 128 HD11 LEU 128 11.043 2.699 19.393 704 HD12 LEU 128 HD12 LEU 128 9.469 2.024 18.981 705 HD13 LEU 128 HD13 LEU 128 10.195 3.257 17.953 706 HD21 LEU 128 HD21 LEU 128 12.011 0.507 19.493 707 HD22 LEU 128 HD22 LEU 128 12.018 -0.553 18.084 708 HD23 LEU 128 HD23 LEU 128 10.532 -0.320 19.006 709 H GLY 129 HN GLY 129 11.580 2.248 14.184 710 HA2 GLY 129 HA2 GLY 129 10.285 1.835 11.664 711 HA3 GLY 129 HA1 GLY 129 12.003 2.057 11.935 712 H ALA 130 HN ALA 130 11.423 0.406 10.112 713 HA ALA 130 HA ALA 130 10.529 -2.112 10.431 714 HB1 ALA 130 HB1 ALA 130 11.681 -2.707 8.479 715 HB2 ALA 130 HB2 ALA 130 12.803 -1.352 8.671 716 HB3 ALA 130 HB3 ALA 130 11.086 -1.052 8.343 717 H ASP 131 HN ASP 131 13.732 -1.116 11.550 718 HA ASP 131 HA ASP 131 14.468 -3.935 11.771 719 HB2 ASP 131 HB2 ASP 131 16.703 -3.212 12.282 720 HB3 ASP 131 HB1 ASP 131 16.123 -2.298 10.896 721 H GLY 132 HN GLY 132 12.790 -1.814 13.571 722 HA2 GLY 132 HA2 GLY 132 11.917 -2.292 15.683 723 HA3 GLY 132 HA1 GLY 132 13.243 -3.415 15.954 724 H LYS 133 HN LYS 133 13.912 -0.250 14.768 725 HA LYS 133 HA LYS 133 14.549 0.737 17.420 726 HB2 LYS 133 HB2 LYS 133 16.601 -0.290 16.728 727 HB3 LYS 133 HB1 LYS 133 16.477 0.394 15.124 728 HG2 LYS 133 HG2 LYS 133 18.237 1.456 16.441 729 HG3 LYS 133 HG1 LYS 133 16.969 2.600 16.015 730 HD2 LYS 133 HD2 LYS 133 16.075 2.510 18.229 731 HD3 LYS 133 HD1 LYS 133 17.187 1.214 18.687 732 HE2 LYS 133 HE2 LYS 133 17.869 3.471 19.496 733 HE3 LYS 133 HE1 LYS 133 19.067 2.693 18.476 734 HZ1 LYS 133 HZ1 LYS 133 18.437 4.071 16.641 735 HZ2 LYS 133 HZ2 LYS 133 18.719 5.071 17.951 736 HZ3 LYS 133 HZ3 LYS 133 17.147 4.757 17.467 737 H GLU 134 HN GLU 134 14.424 2.983 17.558 738 HA GLU 134 HA GLU 134 13.088 4.288 15.388 739 HB2 GLU 134 HB2 GLU 134 12.902 6.222 16.920 740 HB3 GLU 134 HB1 GLU 134 12.328 4.740 17.656 741 HG2 GLU 134 HG2 GLU 134 14.437 4.579 18.925 742 HG3 GLU 134 HG1 GLU 134 14.975 6.077 18.174 743 H GLY 135 HN GLY 135 14.053 5.275 13.766 744 HA2 GLY 135 HA2 GLY 135 16.509 6.786 14.140 745 HA3 GLY 135 HA1 GLY 135 16.577 5.441 13.004 746 H GLY 136 HN GLY 136 17.100 7.546 11.628 747 HA2 GLY 136 HA2 GLY 136 14.529 8.528 10.535 748 HA3 GLY 136 HA1 GLY 136 16.063 9.391 10.396 749 H SER 137 HN SER 137 14.006 7.954 8.471 750 HA SER 137 HA SER 137 15.650 7.152 6.410 751 HB2 SER 137 HB2 SER 137 16.318 5.327 8.028 752 HB3 SER 137 HB1 SER 137 14.639 4.803 8.037 753 HG SER 137 HG SER 137 16.597 4.531 6.098 754 H ASP 138 HN ASP 138 14.239 5.488 4.986 755 HA ASP 138 HA ASP 138 11.532 6.554 4.700 756 HB2 ASP 138 HB2 ASP 138 12.909 4.213 3.353 757 HB3 ASP 138 HB1 ASP 138 11.303 4.790 2.946 758 H ASN 139 HN ASN 139 12.547 3.192 5.040 759 HA ASN 139 HA ASN 139 10.080 2.733 6.560 760 HB2 ASN 139 HB2 ASN 139 10.467 0.344 6.142 761 HB3 ASN 139 HB1 ASN 139 10.456 1.262 4.641 762 HD21 ASN 139 HD21 ASN 139 12.349 -0.592 6.825 763 HD22 ASN 139 HD22 ASN 139 13.755 -0.723 5.832 764 H ASP 140 HN ASP 140 13.415 3.057 7.059 765 HA ASP 140 HA ASP 140 13.388 1.420 9.463 766 HB2 ASP 140 HB2 ASP 140 15.633 2.948 8.126 767 HB3 ASP 140 HB1 ASP 140 15.816 2.005 9.597 768 H ALA 141 HN ALA 141 12.155 4.191 8.895 769 HA ALA 141 HA ALA 141 13.319 5.725 11.077 770 HB1 ALA 141 HB1 ALA 141 11.028 6.409 9.266 771 HB2 ALA 141 HB2 ALA 141 12.705 6.821 8.961 772 HB3 ALA 141 HB3 ALA 141 11.873 7.499 10.371 773 H ASP 142 HN ASP 142 12.096 6.374 12.840 774 HA ASP 142 HA ASP 142 9.923 4.623 13.520 775 HB2 ASP 142 HB2 ASP 142 9.749 6.025 15.588 776 HB3 ASP 142 HB1 ASP 142 11.341 5.318 15.383 777 H ILE 143 HN ILE 143 7.981 4.999 12.973 778 HA ILE 143 HA ILE 143 7.498 7.544 11.703 779 HB ILE 143 HB ILE 143 5.585 6.419 10.514 780 HG12 ILE 143 HG12 ILE 143 5.787 3.839 10.385 781 HG13 ILE 143 HG11 ILE 143 6.671 3.943 11.896 782 HG21 ILE 143 HG21 ILE 143 7.015 5.153 8.970 783 HG22 ILE 143 HG22 ILE 143 8.298 5.182 10.180 784 HG23 ILE 143 HG23 ILE 143 7.745 6.693 9.452 785 HD11 ILE 143 HD11 ILE 143 3.839 4.842 11.451 786 HD12 ILE 143 HD12 ILE 143 4.711 4.874 12.982 787 HD13 ILE 143 HD13 ILE 143 4.329 3.331 12.215 788 H GLY 144 HN GLY 144 6.114 8.979 12.444 789 HA2 GLY 144 HA2 GLY 144 4.066 8.153 14.247 790 HA3 GLY 144 HA1 GLY 144 5.425 8.932 15.038 791 H ASN 145 HN ASN 145 3.434 10.139 15.524 792 HA ASN 145 HA ASN 145 3.120 12.394 13.688 793 HB2 ASN 145 HB2 ASN 145 1.055 11.039 13.695 794 HB3 ASN 145 HB1 ASN 145 1.037 11.052 15.454 795 HD21 ASN 145 HD21 ASN 145 0.394 12.914 16.525 796 HD22 ASN 145 HD22 ASN 145 -0.428 14.200 15.733 797 H TRP 146 HN TRP 146 2.989 14.398 14.901 798 HA TRP 146 HA TRP 146 3.684 14.114 17.729 799 HB2 TRP 146 HB2 TRP 146 5.627 14.353 15.841 800 HB3 TRP 146 HB1 TRP 146 5.279 16.040 16.195 801 HD1 TRP 146 HD1 TRP 146 5.990 16.947 18.615 802 HE1 TRP 146 HE1 TRP 146 7.549 15.916 20.442 803 HE3 TRP 146 HE3 TRP 146 6.248 12.182 16.856 804 HZ2 TRP 146 HZ2 TRP 146 8.707 13.389 20.991 805 HZ3 TRP 146 HZ3 TRP 146 7.577 10.527 18.087 806 HH2 TRP 146 HH2 TRP 146 8.775 11.122 20.089 807 H ASP 147 HN ASP 147 2.826 15.787 18.850 808 HA ASP 147 HA ASP 147 1.676 17.893 17.176 809 HB2 ASP 147 HB2 ASP 147 0.024 16.356 18.372 810 HB3 ASP 147 HB1 ASP 147 0.581 17.106 19.864 811 H ASN 148 HN ASN 148 2.986 19.464 17.322 812 HA ASN 148 HA ASN 148 3.465 20.663 19.882 813 HB2 ASN 148 HB2 ASN 148 5.523 19.345 19.475 814 HB3 ASN 148 HB1 ASN 148 5.671 20.073 17.884 815 HD21 ASN 148 HD21 ASN 148 4.639 21.918 20.708 816 HD22 ASN 148 HD22 ASN 148 6.064 22.854 20.821 Start of MODEL 13 1 H1 MET 39 HT1 MET 39 3.002 6.996 -0.637 2 H2 MET 39 HT2 MET 39 2.594 5.696 0.357 3 H3 MET 39 HT3 MET 39 2.056 5.742 -1.235 4 HA MET 39 HA MET 39 4.233 5.542 -2.084 5 HB2 MET 39 HB2 MET 39 5.227 6.622 0.125 6 HB3 MET 39 HB1 MET 39 5.243 4.980 0.732 7 HG2 MET 39 HG2 MET 39 6.756 4.279 -0.955 8 HG3 MET 39 HG1 MET 39 6.612 5.825 -1.794 9 HE1 MET 39 HE1 MET 39 9.259 6.110 -1.838 10 HE2 MET 39 HE2 MET 39 9.433 4.556 -1.026 11 HE3 MET 39 HE3 MET 39 10.274 5.974 -0.403 12 H SER 40 HN SER 40 3.101 3.814 -2.910 13 HA SER 40 HA SER 40 2.707 1.534 -1.121 14 HB2 SER 40 HB2 SER 40 0.723 2.768 -2.130 15 HB3 SER 40 HB1 SER 40 1.277 2.102 -3.672 16 HG SER 40 HG SER 40 0.375 0.668 -1.381 17 H ARG 41 HN ARG 41 4.658 0.624 -1.444 18 HA ARG 41 HA ARG 41 5.005 -1.003 -3.744 19 HB2 ARG 41 HB2 ARG 41 7.426 -0.151 -4.021 20 HB3 ARG 41 HB1 ARG 41 6.171 0.925 -4.620 21 HG2 ARG 41 HG2 ARG 41 6.311 2.170 -2.526 22 HG3 ARG 41 HG1 ARG 41 7.670 1.143 -2.034 23 HD2 ARG 41 HD2 ARG 41 7.580 2.957 -4.453 24 HD3 ARG 41 HD1 ARG 41 8.467 3.273 -2.966 25 HE ARG 41 HE ARG 41 9.229 0.801 -4.178 26 HH11 ARG 41 HH11 ARG 41 9.794 4.315 -4.352 27 HH12 ARG 41 HH12 ARG 41 11.314 4.160 -5.086 28 HH21 ARG 41 HH21 ARG 41 11.276 0.610 -5.230 29 HH22 ARG 41 HH22 ARG 41 12.174 2.008 -5.601 30 HA PRO 42 HA PRO 42 6.483 -4.033 -0.870 31 HB2 PRO 42 HB2 PRO 42 9.266 -4.071 -1.546 32 HB3 PRO 42 HB1 PRO 42 8.018 -5.231 -1.994 33 HG2 PRO 42 HG2 PRO 42 9.092 -2.937 -3.539 34 HG3 PRO 42 HG1 PRO 42 8.368 -4.444 -4.122 35 HD2 PRO 42 HD2 PRO 42 7.047 -2.138 -4.299 36 HD3 PRO 42 HD1 PRO 42 6.199 -3.635 -3.864 37 H ASP 43 HN ASP 43 6.572 -3.635 1.157 38 HA ASP 43 HA ASP 43 7.176 -3.136 3.240 39 HB2 ASP 43 HB2 ASP 43 9.558 -3.723 2.516 40 HB3 ASP 43 HB1 ASP 43 9.747 -1.980 2.261 41 H GLN 44 HN GLN 44 7.755 -0.645 0.903 42 HA GLN 44 HA GLN 44 7.425 1.562 2.681 43 HB2 GLN 44 HB2 GLN 44 6.870 1.429 -0.272 44 HB3 GLN 44 HB1 GLN 44 7.023 2.895 0.682 45 HG2 GLN 44 HG2 GLN 44 9.208 0.881 0.246 46 HG3 GLN 44 HG1 GLN 44 9.053 2.412 -0.607 47 HE21 GLN 44 HE21 GLN 44 11.175 1.407 1.099 48 HE22 GLN 44 HE22 GLN 44 11.397 2.594 2.331 49 H ALA 45 HN ALA 45 5.318 -0.575 1.052 50 HA ALA 45 HA ALA 45 2.894 0.778 1.287 51 HB1 ALA 45 HB1 ALA 45 1.856 -1.455 1.173 52 HB2 ALA 45 HB2 ALA 45 3.435 -2.184 1.452 53 HB3 ALA 45 HB3 ALA 45 3.138 -1.267 -0.024 54 H LYS 46 HN LYS 46 4.876 -0.919 3.599 55 HA LYS 46 HA LYS 46 2.836 -0.929 5.596 56 HB2 LYS 46 HB2 LYS 46 5.771 -1.606 5.683 57 HB3 LYS 46 HB1 LYS 46 4.714 -1.717 7.082 58 HG2 LYS 46 HG2 LYS 46 3.320 -3.347 5.885 59 HG3 LYS 46 HG1 LYS 46 4.418 -3.260 4.509 60 HD2 LYS 46 HD2 LYS 46 6.238 -4.091 5.874 61 HD3 LYS 46 HD1 LYS 46 5.203 -4.097 7.298 62 HE2 LYS 46 HE2 LYS 46 4.801 -5.775 4.819 63 HE3 LYS 46 HE1 LYS 46 5.445 -6.329 6.365 64 HZ1 LYS 46 HZ1 LYS 46 2.677 -5.297 5.928 65 HZ2 LYS 46 HZ2 LYS 46 3.324 -5.796 7.405 66 HZ3 LYS 46 HZ3 LYS 46 3.135 -6.902 6.175 67 H VAL 47 HN VAL 47 5.294 1.216 4.482 68 HA VAL 47 HA VAL 47 5.487 2.824 6.853 69 HB VAL 47 HB VAL 47 6.039 3.676 3.989 70 HG11 VAL 47 HG11 VAL 47 7.071 4.756 6.601 71 HG12 VAL 47 HG12 VAL 47 5.942 5.545 5.496 72 HG13 VAL 47 HG13 VAL 47 7.617 5.271 5.009 73 HG21 VAL 47 HG21 VAL 47 7.338 1.631 4.563 74 HG22 VAL 47 HG22 VAL 47 8.085 2.536 5.894 75 HG23 VAL 47 HG23 VAL 47 8.293 3.066 4.215 76 H THR 48 HN THR 48 3.747 2.910 3.787 77 HA THR 48 HA THR 48 2.503 5.374 4.306 78 HB THR 48 HB THR 48 2.831 4.511 1.995 79 HG1 THR 48 HG1 THR 48 0.902 5.964 2.778 80 HG21 THR 48 HG21 THR 48 0.529 2.675 2.625 81 HG22 THR 48 HG22 THR 48 2.210 2.196 2.434 82 HG23 THR 48 HG23 THR 48 1.324 2.854 1.051 83 H VAL 49 HN VAL 49 1.499 2.030 5.033 84 HA VAL 49 HA VAL 49 -1.106 2.862 5.781 85 HB VAL 49 HB VAL 49 -1.478 0.727 6.836 86 HG11 VAL 49 HG11 VAL 49 0.081 0.326 4.323 87 HG12 VAL 49 HG12 VAL 49 -1.640 0.668 4.473 88 HG13 VAL 49 HG13 VAL 49 -0.989 -0.864 5.059 89 HG21 VAL 49 HG21 VAL 49 1.489 0.190 6.620 90 HG22 VAL 49 HG22 VAL 49 0.283 -1.018 7.077 91 HG23 VAL 49 HG23 VAL 49 0.553 0.391 8.101 92 H ALA 50 HN ALA 50 1.913 2.457 7.500 93 HA ALA 50 HA ALA 50 1.062 2.753 10.116 94 HB1 ALA 50 HB1 ALA 50 3.645 3.589 8.836 95 HB2 ALA 50 HB2 ALA 50 3.256 1.962 9.402 96 HB3 ALA 50 HB3 ALA 50 3.369 3.296 10.552 97 H LYS 51 HN LYS 51 2.076 5.109 7.718 98 HA LYS 51 HA LYS 51 1.939 7.307 9.436 99 HB2 LYS 51 HB2 LYS 51 1.848 7.218 6.423 100 HB3 LYS 51 HB1 LYS 51 2.035 8.696 7.369 101 HG2 LYS 51 HG2 LYS 51 4.091 7.843 8.350 102 HG3 LYS 51 HG1 LYS 51 3.882 6.330 7.475 103 HD2 LYS 51 HD2 LYS 51 5.538 7.721 6.372 104 HD3 LYS 51 HD1 LYS 51 4.110 7.537 5.356 105 HE2 LYS 51 HE2 LYS 51 3.348 9.738 5.937 106 HE3 LYS 51 HE1 LYS 51 4.626 9.906 7.140 107 HZ1 LYS 51 HZ1 LYS 51 5.095 9.607 4.219 108 HZ2 LYS 51 HZ2 LYS 51 6.255 9.925 5.403 109 HZ3 LYS 51 HZ3 LYS 51 5.080 11.075 5.042 110 H GLY 52 HN GLY 52 -0.504 5.579 7.819 111 HA2 GLY 52 HA2 GLY 52 -2.490 7.683 8.055 112 HA3 GLY 52 HA1 GLY 52 -2.754 6.040 7.469 113 H ASP 53 HN ASP 53 -1.375 4.821 9.714 114 HA ASP 53 HA ASP 53 -3.583 4.593 11.503 115 HB2 ASP 53 HB2 ASP 53 -0.817 3.444 11.555 116 HB3 ASP 53 HB1 ASP 53 -2.005 3.147 12.822 117 H ILE 54 HN ILE 54 -0.458 6.078 11.660 118 HA ILE 54 HA ILE 54 -0.866 7.009 14.294 119 HB ILE 54 HB ILE 54 0.995 8.597 13.877 120 HG12 ILE 54 HG12 ILE 54 0.872 7.399 11.116 121 HG13 ILE 54 HG11 ILE 54 0.592 9.077 11.536 122 HG21 ILE 54 HG21 ILE 54 1.487 5.744 13.087 123 HG22 ILE 54 HG22 ILE 54 1.443 6.395 14.726 124 HG23 ILE 54 HG23 ILE 54 2.722 6.885 13.615 125 HD11 ILE 54 HD11 ILE 54 3.184 7.586 11.695 126 HD12 ILE 54 HD12 ILE 54 2.948 9.259 12.219 127 HD13 ILE 54 HD13 ILE 54 2.741 8.824 10.518 128 H LYS 55 HN LYS 55 -1.898 8.181 11.214 129 HA LYS 55 HA LYS 55 -2.588 10.808 12.082 130 HB2 LYS 55 HB2 LYS 55 -2.660 9.474 9.669 131 HB3 LYS 55 HB1 LYS 55 -4.366 9.620 10.069 132 HG2 LYS 55 HG2 LYS 55 -3.708 11.495 8.705 133 HG3 LYS 55 HG1 LYS 55 -4.038 12.063 10.344 134 HD2 LYS 55 HD2 LYS 55 -1.722 12.172 10.864 135 HD3 LYS 55 HD1 LYS 55 -1.292 11.340 9.375 136 HE2 LYS 55 HE2 LYS 55 -2.173 13.276 8.103 137 HE3 LYS 55 HE1 LYS 55 -2.497 14.097 9.629 138 HZ1 LYS 55 HZ1 LYS 55 -0.124 13.972 10.130 139 HZ2 LYS 55 HZ2 LYS 55 -0.395 14.809 8.697 140 HZ3 LYS 55 HZ3 LYS 55 0.166 13.229 8.643 141 H ALA 56 HN ALA 56 -4.103 7.679 12.230 142 HA ALA 56 HA ALA 56 -6.663 8.499 13.202 143 HB1 ALA 56 HB1 ALA 56 -6.235 6.270 12.184 144 HB2 ALA 56 HB2 ALA 56 -6.977 6.177 13.787 145 HB3 ALA 56 HB3 ALA 56 -5.252 5.878 13.606 146 H ILE 57 HN ILE 57 -3.584 7.774 14.594 147 HA ILE 57 HA ILE 57 -4.190 7.604 17.314 148 HB ILE 57 HB ILE 57 -1.784 8.764 15.902 149 HG12 ILE 57 HG12 ILE 57 -2.200 6.278 15.679 150 HG13 ILE 57 HG11 ILE 57 -0.632 6.722 16.350 151 HG21 ILE 57 HG21 ILE 57 -2.075 8.247 18.836 152 HG22 ILE 57 HG22 ILE 57 -1.905 9.812 18.035 153 HG23 ILE 57 HG23 ILE 57 -0.573 8.653 18.001 154 HD11 ILE 57 HD11 ILE 57 -1.386 6.149 18.547 155 HD12 ILE 57 HD12 ILE 57 -1.652 4.798 17.436 156 HD13 ILE 57 HD13 ILE 57 -3.018 5.819 17.929 157 H ALA 58 HN ALA 58 -3.395 10.421 15.282 158 HA ALA 58 HA ALA 58 -3.547 12.386 17.271 159 HB1 ALA 58 HB1 ALA 58 -2.631 12.794 15.030 160 HB2 ALA 58 HB2 ALA 58 -3.809 14.005 15.521 161 HB3 ALA 58 HB3 ALA 58 -4.270 12.747 14.364 162 H ALA 59 HN ALA 59 -6.024 10.847 15.427 163 HA ALA 59 HA ALA 59 -8.101 12.684 16.093 164 HB1 ALA 59 HB1 ALA 59 -8.226 11.287 14.094 165 HB2 ALA 59 HB2 ALA 59 -9.603 10.986 15.161 166 HB3 ALA 59 HB3 ALA 59 -8.264 9.841 15.103 167 H ALA 60 HN ALA 60 -7.004 9.592 17.417 168 HA ALA 60 HA ALA 60 -9.181 9.568 19.309 169 HB1 ALA 60 HB1 ALA 60 -6.896 7.667 18.949 170 HB2 ALA 60 HB2 ALA 60 -8.514 7.482 18.263 171 HB3 ALA 60 HB3 ALA 60 -8.264 7.418 20.013 172 H LEU 61 HN LEU 61 -5.767 10.347 19.339 173 HA LEU 61 HA LEU 61 -5.423 10.448 22.174 174 HB2 LEU 61 HB2 LEU 61 -3.741 10.474 20.105 175 HB3 LEU 61 HB1 LEU 61 -3.984 12.197 20.196 176 HG LEU 61 HG LEU 61 -1.902 11.351 21.271 177 HD11 LEU 61 HD11 LEU 61 -2.087 12.663 23.320 178 HD12 LEU 61 HD12 LEU 61 -3.839 12.717 23.108 179 HD13 LEU 61 HD13 LEU 61 -2.780 13.495 21.930 180 HD21 LEU 61 HD21 LEU 61 -2.812 9.280 22.197 181 HD22 LEU 61 HD22 LEU 61 -3.763 10.254 23.342 182 HD23 LEU 61 HD23 LEU 61 -2.007 10.278 23.415 183 H ASP 62 HN ASP 62 -6.675 12.570 19.747 184 HA ASP 62 HA ASP 62 -7.089 14.844 21.399 185 HB2 ASP 62 HB2 ASP 62 -7.097 15.062 18.985 186 HB3 ASP 62 HB1 ASP 62 -8.428 13.922 18.845 187 H MET 63 HN MET 63 -8.773 11.882 20.885 188 HA MET 63 HA MET 63 -11.171 12.735 22.206 189 HB2 MET 63 HB2 MET 63 -10.250 9.969 21.399 190 HB3 MET 63 HB1 MET 63 -11.814 10.306 22.123 191 HG2 MET 63 HG2 MET 63 -12.453 11.653 20.239 192 HG3 MET 63 HG1 MET 63 -10.840 11.503 19.547 193 HE1 MET 63 HE1 MET 63 -13.135 9.451 17.112 194 HE2 MET 63 HE2 MET 63 -11.994 10.788 17.250 195 HE3 MET 63 HE3 MET 63 -13.585 10.903 18.003 196 H TYR 64 HN TYR 64 -8.205 11.091 23.132 197 HA TYR 64 HA TYR 64 -9.013 10.582 25.845 198 HB2 TYR 64 HB2 TYR 64 -6.998 9.506 24.908 199 HB3 TYR 64 HB1 TYR 64 -6.219 11.086 24.771 200 HD1 TYR 64 HD2 TYR 64 -7.521 8.575 27.265 201 HD2 TYR 64 HD1 TYR 64 -5.256 12.166 26.686 202 HE1 TYR 64 HE2 TYR 64 -6.777 8.431 29.427 203 HE2 TYR 64 HE1 TYR 64 -4.500 12.005 28.979 204 HH TYR 64 HH TYR 64 -5.054 9.177 30.718 205 H LYS 65 HN LYS 65 -7.495 13.240 24.118 206 HA LYS 65 HA LYS 65 -7.030 15.049 26.138 207 HB2 LYS 65 HB2 LYS 65 -6.273 15.593 23.970 208 HB3 LYS 65 HB1 LYS 65 -7.867 15.370 23.277 209 HG2 LYS 65 HG2 LYS 65 -8.641 17.378 24.299 210 HG3 LYS 65 HG1 LYS 65 -7.084 17.627 25.107 211 HD2 LYS 65 HD2 LYS 65 -5.985 17.943 22.999 212 HD3 LYS 65 HD1 LYS 65 -7.417 17.439 22.114 213 HE2 LYS 65 HE2 LYS 65 -7.152 19.868 22.053 214 HE3 LYS 65 HE1 LYS 65 -8.625 19.405 22.895 215 HZ1 LYS 65 HZ1 LYS 65 -6.082 20.249 24.193 216 HZ2 LYS 65 HZ2 LYS 65 -7.499 19.829 25.004 217 HZ3 LYS 65 HZ3 LYS 65 -7.471 21.176 24.018 218 H LEU 66 HN LEU 66 -9.989 14.135 24.598 219 HA LEU 66 HA LEU 66 -11.665 16.017 26.002 220 HB2 LEU 66 HB2 LEU 66 -12.283 15.375 23.773 221 HB3 LEU 66 HB1 LEU 66 -12.205 13.678 24.178 222 HG LEU 66 HG LEU 66 -14.200 13.909 25.568 223 HD11 LEU 66 HD11 LEU 66 -14.251 16.766 24.555 224 HD12 LEU 66 HD12 LEU 66 -13.961 16.265 26.221 225 HD13 LEU 66 HD13 LEU 66 -15.535 15.982 25.479 226 HD21 LEU 66 HD21 LEU 66 -14.436 13.261 23.248 227 HD22 LEU 66 HD22 LEU 66 -14.517 14.953 22.758 228 HD23 LEU 66 HD23 LEU 66 -15.805 14.256 23.742 229 H ASP 67 HN ASP 67 -10.579 12.723 26.404 230 HA ASP 67 HA ASP 67 -12.671 11.759 28.147 231 HB2 ASP 67 HB2 ASP 67 -11.271 10.368 26.641 232 HB3 ASP 67 HB1 ASP 67 -9.866 10.816 27.587 233 H ASN 68 HN ASN 68 -9.507 13.261 28.574 234 HA ASN 68 HA ASN 68 -9.967 13.393 31.535 235 HB2 ASN 68 HB2 ASN 68 -7.823 12.093 30.229 236 HB3 ASN 68 HB1 ASN 68 -7.395 13.767 30.716 237 HD21 ASN 68 HD21 ASN 68 -6.578 11.078 31.764 238 HD22 ASN 68 HD22 ASN 68 -6.776 11.225 33.483 239 H PHE 69 HN PHE 69 -10.518 15.136 29.211 240 HA PHE 69 HA PHE 69 -10.295 17.352 28.604 241 HB2 PHE 69 HB2 PHE 69 -10.473 18.866 30.661 242 HB3 PHE 69 HB1 PHE 69 -11.734 17.668 30.421 243 HD1 PHE 69 HD2 PHE 69 -8.738 18.413 32.308 244 HD2 PHE 69 HD1 PHE 69 -12.048 15.994 31.938 245 HE1 PHE 69 HE2 PHE 69 -8.334 17.635 34.607 246 HE2 PHE 69 HE1 PHE 69 -11.770 15.113 34.205 247 HZ PHE 69 HZ PHE 69 -9.873 15.931 35.589 248 H ALA 70 HN ALA 70 -7.726 16.098 28.528 249 HA ALA 70 HA ALA 70 -5.916 18.250 28.457 250 HB1 ALA 70 HB1 ALA 70 -4.555 17.686 30.420 251 HB2 ALA 70 HB2 ALA 70 -5.722 16.411 30.825 252 HB3 ALA 70 HB3 ALA 70 -6.219 18.081 30.922 253 H TYR 71 HN TYR 71 -3.843 17.487 27.791 254 HA TYR 71 HA TYR 71 -3.833 14.840 26.738 255 HB2 TYR 71 HB2 TYR 71 -1.824 17.082 26.700 256 HB3 TYR 71 HB1 TYR 71 -1.412 15.474 26.134 257 HD1 TYR 71 HD1 TYR 71 -3.640 14.539 24.635 258 HD2 TYR 71 HD2 TYR 71 -2.121 18.501 24.938 259 HE1 TYR 71 HE1 TYR 71 -4.523 14.991 22.486 260 HE2 TYR 71 HE2 TYR 71 -3.015 19.005 22.717 261 HH TYR 71 HH TYR 71 -5.214 16.955 21.094 262 HA PRO 72 HA PRO 72 -2.055 12.613 30.059 263 HB2 PRO 72 HB2 PRO 72 -0.356 10.962 28.663 264 HB3 PRO 72 HB1 PRO 72 -2.111 10.741 28.719 265 HG2 PRO 72 HG2 PRO 72 -0.405 12.036 26.636 266 HG3 PRO 72 HG1 PRO 72 -1.745 10.890 26.436 267 HD2 PRO 72 HD2 PRO 72 -2.097 13.485 26.047 268 HD3 PRO 72 HD1 PRO 72 -3.341 12.491 26.830 269 H SER 73 HN SER 73 0.058 12.076 31.178 270 HA SER 73 HA SER 73 2.402 13.718 30.322 271 HB2 SER 73 HB2 SER 73 3.040 13.567 32.683 272 HB3 SER 73 HB1 SER 73 1.429 14.257 32.589 273 HG SER 73 HG SER 73 0.609 12.620 33.471 274 H THR 74 HN THR 74 4.346 12.771 30.418 275 HA THR 74 HA THR 74 4.269 10.307 29.157 276 HB THR 74 HB THR 74 6.154 12.321 29.830 277 HG1 THR 74 HG1 THR 74 6.059 12.081 27.731 278 HG21 THR 74 HG21 THR 74 7.245 9.525 30.036 279 HG22 THR 74 HG22 THR 74 7.000 10.705 31.329 280 HG23 THR 74 HG23 THR 74 8.199 11.046 30.061 281 H GLN 75 HN GLN 75 4.304 11.045 32.490 282 HA GLN 75 HA GLN 75 4.931 8.283 33.165 283 HB2 GLN 75 HB2 GLN 75 4.616 10.798 34.715 284 HB3 GLN 75 HB1 GLN 75 4.605 9.232 35.532 285 HG2 GLN 75 HG2 GLN 75 6.819 10.328 33.813 286 HG3 GLN 75 HG1 GLN 75 6.784 10.343 35.578 287 HE21 GLN 75 HE21 GLN 75 6.783 8.380 36.645 288 HE22 GLN 75 HE22 GLN 75 7.522 6.973 35.970 289 H GLN 76 HN GLN 76 2.374 10.649 34.118 290 HA GLN 76 HA GLN 76 0.699 8.481 35.076 291 HB2 GLN 76 HB2 GLN 76 0.050 11.402 34.784 292 HB3 GLN 76 HB1 GLN 76 -0.854 10.206 35.696 293 HG2 GLN 76 HG2 GLN 76 1.100 9.929 37.174 294 HG3 GLN 76 HG1 GLN 76 1.903 11.222 36.287 295 HE21 GLN 76 HE21 GLN 76 -0.661 10.416 38.443 296 HE22 GLN 76 HE22 GLN 76 -1.005 12.022 38.960 297 H GLY 77 HN GLY 77 0.789 10.567 32.298 298 HA2 GLY 77 HA2 GLY 77 -1.796 9.623 31.504 299 HA3 GLY 77 HA1 GLY 77 -0.742 10.621 30.534 300 H LEU 78 HN LEU 78 1.473 8.548 31.029 301 HA LEU 78 HA LEU 78 0.890 6.974 28.708 302 HB2 LEU 78 HB2 LEU 78 3.222 7.682 29.538 303 HB3 LEU 78 HB1 LEU 78 3.068 6.444 30.756 304 HG LEU 78 HG LEU 78 3.039 5.835 27.793 305 HD11 LEU 78 HD11 LEU 78 5.356 5.793 29.705 306 HD12 LEU 78 HD12 LEU 78 5.126 6.915 28.366 307 HD13 LEU 78 HD13 LEU 78 5.377 5.197 28.047 308 HD21 LEU 78 HD21 LEU 78 2.107 4.065 29.228 309 HD22 LEU 78 HD22 LEU 78 3.571 4.088 30.205 310 HD23 LEU 78 HD23 LEU 78 3.646 3.569 28.522 311 H GLU 79 HN GLU 79 1.092 6.395 32.176 312 HA GLU 79 HA GLU 79 0.116 3.791 32.141 313 HB2 GLU 79 HB2 GLU 79 0.038 5.942 34.220 314 HB3 GLU 79 HB1 GLU 79 -0.787 4.409 34.474 315 HG2 GLU 79 HG2 GLU 79 2.141 4.751 33.906 316 HG3 GLU 79 HG1 GLU 79 1.388 4.422 35.480 317 H ALA 80 HN ALA 80 -1.499 6.877 32.184 318 HA ALA 80 HA ALA 80 -4.092 5.707 32.349 319 HB1 ALA 80 HB1 ALA 80 -3.474 7.947 33.199 320 HB2 ALA 80 HB2 ALA 80 -4.917 7.915 32.155 321 HB3 ALA 80 HB3 ALA 80 -3.374 8.479 31.519 322 H LEU 81 HN LEU 81 -1.988 5.785 29.819 323 HA LEU 81 HA LEU 81 -4.134 5.788 27.834 324 HB2 LEU 81 HB2 LEU 81 -1.145 5.754 27.569 325 HB3 LEU 81 HB1 LEU 81 -2.205 5.429 26.219 326 HG LEU 81 HG LEU 81 -2.068 8.016 27.784 327 HD11 LEU 81 HD11 LEU 81 -1.086 8.943 25.744 328 HD12 LEU 81 HD12 LEU 81 -1.101 7.340 25.014 329 HD13 LEU 81 HD13 LEU 81 -0.089 7.656 26.422 330 HD21 LEU 81 HD21 LEU 81 -4.318 7.636 26.913 331 HD22 LEU 81 HD22 LEU 81 -3.656 7.292 25.317 332 HD23 LEU 81 HD23 LEU 81 -3.513 8.911 26.000 333 H VAL 82 HN VAL 82 -2.144 3.662 29.617 334 HA VAL 82 HA VAL 82 -3.031 1.422 27.897 335 HB VAL 82 HB VAL 82 -0.769 1.405 29.922 336 HG11 VAL 82 HG11 VAL 82 -1.494 -0.579 27.778 337 HG12 VAL 82 HG12 VAL 82 -1.726 -0.800 29.509 338 HG13 VAL 82 HG13 VAL 82 -0.091 -0.685 28.844 339 HG21 VAL 82 HG21 VAL 82 -0.261 2.923 28.086 340 HG22 VAL 82 HG22 VAL 82 -0.651 1.671 26.917 341 HG23 VAL 82 HG23 VAL 82 0.744 1.477 27.981 342 H LYS 83 HN LYS 83 -3.200 2.756 31.020 343 HA LYS 83 HA LYS 83 -4.842 0.607 32.139 344 HB2 LYS 83 HB2 LYS 83 -2.649 0.742 33.206 345 HB3 LYS 83 HB1 LYS 83 -2.758 2.469 33.376 346 HG2 LYS 83 HG2 LYS 83 -4.623 2.138 34.989 347 HG3 LYS 83 HG1 LYS 83 -4.355 0.393 34.871 348 HD2 LYS 83 HD2 LYS 83 -2.266 2.410 35.717 349 HD3 LYS 83 HD1 LYS 83 -3.200 1.403 36.820 350 HE2 LYS 83 HE2 LYS 83 -2.227 -0.602 35.905 351 HE3 LYS 83 HE1 LYS 83 -1.421 0.310 34.638 352 HZ1 LYS 83 HZ1 LYS 83 -0.839 0.678 37.524 353 HZ2 LYS 83 HZ2 LYS 83 0.016 1.293 36.170 354 HZ3 LYS 83 HZ3 LYS 83 0.020 -0.336 36.486 355 H LYS 84 HN LYS 84 -6.702 1.519 33.283 356 HA LYS 84 HA LYS 84 -7.801 3.784 32.018 357 HB2 LYS 84 HB2 LYS 84 -8.705 2.524 34.622 358 HB3 LYS 84 HB1 LYS 84 -9.589 3.779 33.785 359 HG2 LYS 84 HG2 LYS 84 -10.713 1.866 33.128 360 HG3 LYS 84 HG1 LYS 84 -9.609 2.134 31.786 361 HD2 LYS 84 HD2 LYS 84 -9.626 -0.212 32.333 362 HD3 LYS 84 HD1 LYS 84 -8.062 0.447 32.813 363 HE2 LYS 84 HE2 LYS 84 -8.844 0.618 35.129 364 HE3 LYS 84 HE1 LYS 84 -10.425 0.028 34.627 365 HZ1 LYS 84 HZ1 LYS 84 -9.166 -1.681 35.644 366 HZ2 LYS 84 HZ2 LYS 84 -7.876 -1.468 34.602 367 HZ3 LYS 84 HZ3 LYS 84 -9.332 -2.089 34.010 368 HA PRO 85 HA PRO 85 -5.936 7.223 33.746 369 HB2 PRO 85 HB2 PRO 85 -8.417 8.785 33.650 370 HB3 PRO 85 HB1 PRO 85 -6.951 8.949 32.684 371 HG2 PRO 85 HG2 PRO 85 -9.281 8.038 31.695 372 HG3 PRO 85 HG1 PRO 85 -7.691 7.587 31.064 373 HD2 PRO 85 HD2 PRO 85 -9.545 6.048 32.796 374 HD3 PRO 85 HD1 PRO 85 -8.460 5.501 31.502 375 H THR 86 HN THR 86 -5.385 7.555 35.644 376 HA THR 86 HA THR 86 -6.907 6.803 37.905 377 HB THR 86 HB THR 86 -4.943 7.686 39.159 378 HG1 THR 86 HG1 THR 86 -4.479 8.877 36.747 379 HG21 THR 86 HG21 THR 86 -4.342 5.850 36.833 380 HG22 THR 86 HG22 THR 86 -5.014 5.364 38.391 381 HG23 THR 86 HG23 THR 86 -3.371 5.997 38.297 382 H GLY 87 HN GLY 87 -7.937 8.063 39.396 383 HA2 GLY 87 HA2 GLY 87 -8.324 10.105 40.511 384 HA3 GLY 87 HA1 GLY 87 -7.736 10.958 39.086 385 H ASN 88 HN ASN 88 -9.223 11.845 37.855 386 HA ASN 88 HA ASN 88 -11.761 10.519 37.621 387 HB2 ASN 88 HB2 ASN 88 -13.063 12.608 38.119 388 HB3 ASN 88 HB1 ASN 88 -12.263 11.896 39.507 389 HD21 ASN 88 HD21 ASN 88 -12.456 14.652 37.419 390 HD22 ASN 88 HD22 ASN 88 -11.402 15.668 38.326 391 HA PRO 89 HA PRO 89 -11.071 12.342 33.578 392 HB2 PRO 89 HB2 PRO 89 -11.660 10.114 32.130 393 HB3 PRO 89 HB1 PRO 89 -10.062 10.333 32.792 394 HG2 PRO 89 HG2 PRO 89 -12.273 8.608 33.766 395 HG3 PRO 89 HG1 PRO 89 -10.529 8.333 33.833 396 HD2 PRO 89 HD2 PRO 89 -12.126 9.220 35.951 397 HD3 PRO 89 HD1 PRO 89 -10.359 9.334 35.874 398 H GLN 90 HN GLN 90 -12.832 12.580 31.921 399 HA GLN 90 HA GLN 90 -15.360 12.930 33.284 400 HB2 GLN 90 HB2 GLN 90 -14.466 13.503 30.457 401 HB3 GLN 90 HB1 GLN 90 -16.097 13.828 31.028 402 HG2 GLN 90 HG2 GLN 90 -15.254 15.350 32.683 403 HG3 GLN 90 HG1 GLN 90 -13.602 14.975 32.222 404 HE21 GLN 90 HE21 GLN 90 -14.202 14.988 29.342 405 HE22 GLN 90 HE22 GLN 90 -14.460 16.630 28.931 406 HA PRO 91 HA PRO 91 -17.377 9.189 32.012 407 HB2 PRO 91 HB2 PRO 91 -19.631 10.767 30.882 408 HB3 PRO 91 HB1 PRO 91 -19.666 9.498 32.109 409 HG2 PRO 91 HG2 PRO 91 -19.996 12.054 32.795 410 HG3 PRO 91 HG1 PRO 91 -19.072 10.940 33.818 411 HD2 PRO 91 HD2 PRO 91 -18.084 13.054 31.948 412 HD3 PRO 91 HD1 PRO 91 -17.469 12.587 33.547 413 H LYS 92 HN LYS 92 -16.092 8.511 30.369 414 HA LYS 92 HA LYS 92 -16.987 8.932 27.677 415 HB2 LYS 92 HB2 LYS 92 -15.322 10.786 28.459 416 HB3 LYS 92 HB1 LYS 92 -14.118 9.521 28.480 417 HG2 LYS 92 HG2 LYS 92 -15.671 10.359 26.036 418 HG3 LYS 92 HG1 LYS 92 -14.071 10.961 26.463 419 HD2 LYS 92 HD2 LYS 92 -13.216 8.689 26.380 420 HD3 LYS 92 HD1 LYS 92 -14.817 8.107 25.938 421 HE2 LYS 92 HE2 LYS 92 -14.714 9.547 23.934 422 HE3 LYS 92 HE1 LYS 92 -13.063 9.973 24.372 423 HZ1 LYS 92 HZ1 LYS 92 -13.046 8.109 22.809 424 HZ2 LYS 92 HZ2 LYS 92 -14.092 7.267 23.798 425 HZ3 LYS 92 HZ3 LYS 92 -12.529 7.576 24.347 426 H ASN 93 HN ASN 93 -16.376 7.018 26.456 427 HA ASN 93 HA ASN 93 -15.451 4.814 28.062 428 HB2 ASN 93 HB2 ASN 93 -16.346 4.949 25.182 429 HB3 ASN 93 HB1 ASN 93 -15.561 3.519 25.828 430 HD21 ASN 93 HD21 ASN 93 -18.388 5.522 25.936 431 HD22 ASN 93 HD22 ASN 93 -19.389 4.379 26.742 432 H TRP 94 HN TRP 94 -13.457 5.128 28.647 433 HA TRP 94 HA TRP 94 -11.293 5.988 27.197 434 HB2 TRP 94 HB2 TRP 94 -11.362 5.882 29.617 435 HB3 TRP 94 HB1 TRP 94 -11.470 4.132 29.566 436 HD1 TRP 94 HD1 TRP 94 -8.970 6.995 28.948 437 HE1 TRP 94 HE1 TRP 94 -6.591 5.975 29.080 438 HE3 TRP 94 HE3 TRP 94 -10.192 2.054 29.356 439 HZ2 TRP 94 HZ2 TRP 94 -5.431 3.462 29.307 440 HZ3 TRP 94 HZ3 TRP 94 -8.380 0.407 29.537 441 HH2 TRP 94 HH2 TRP 94 -6.057 1.104 29.511 442 H ASN 95 HN ASN 95 -9.679 5.036 26.176 443 HA ASN 95 HA ASN 95 -10.020 2.289 25.248 444 HB2 ASN 95 HB2 ASN 95 -10.435 3.881 23.418 445 HB3 ASN 95 HB1 ASN 95 -8.930 4.693 23.846 446 HD21 ASN 95 HD21 ASN 95 -9.187 1.130 23.628 447 HD22 ASN 95 HD22 ASN 95 -8.056 1.106 22.332 448 H LYS 96 HN LYS 96 -8.178 1.032 25.518 449 HA LYS 96 HA LYS 96 -5.910 2.234 26.826 450 HB2 LYS 96 HB2 LYS 96 -5.098 0.017 27.108 451 HB3 LYS 96 HB1 LYS 96 -6.815 0.006 27.480 452 HG2 LYS 96 HG2 LYS 96 -7.197 -0.857 25.143 453 HG3 LYS 96 HG1 LYS 96 -5.441 -1.004 25.029 454 HD2 LYS 96 HD2 LYS 96 -7.134 -2.302 27.129 455 HD3 LYS 96 HD1 LYS 96 -6.539 -3.127 25.681 456 HE2 LYS 96 HE2 LYS 96 -4.231 -2.667 26.419 457 HE3 LYS 96 HE1 LYS 96 -4.864 -1.891 27.869 458 HZ1 LYS 96 HZ1 LYS 96 -4.205 -4.129 28.314 459 HZ2 LYS 96 HZ2 LYS 96 -5.239 -4.731 27.125 460 HZ3 LYS 96 HZ3 LYS 96 -5.877 -4.000 28.494 461 H ASP 97 HN ASP 97 -3.751 1.027 25.889 462 HA ASP 97 HA ASP 97 -2.189 1.067 24.447 463 HB2 ASP 97 HB2 ASP 97 -4.409 0.060 22.712 464 HB3 ASP 97 HB1 ASP 97 -2.759 0.335 22.131 465 H GLY 98 HN GLY 98 -3.443 3.517 24.907 466 HA2 GLY 98 HA2 GLY 98 -2.253 5.536 24.359 467 HA3 GLY 98 HA1 GLY 98 -1.839 4.801 22.835 468 H TYR 99 HN TYR 99 -5.071 4.335 23.396 469 HA TYR 99 HA TYR 99 -6.895 5.100 22.474 470 HB2 TYR 99 HB2 TYR 99 -5.724 7.505 23.562 471 HB3 TYR 99 HB1 TYR 99 -6.511 7.921 22.039 472 HD1 TYR 99 HD1 TYR 99 -8.888 7.657 21.849 473 HD2 TYR 99 HD2 TYR 99 -6.862 6.803 25.480 474 HE1 TYR 99 HE1 TYR 99 -10.994 7.739 23.038 475 HE2 TYR 99 HE2 TYR 99 -8.968 6.892 26.672 476 HH TYR 99 HH TYR 99 -11.163 7.709 26.462 477 H LEU 100 HN LEU 100 -6.884 4.018 20.712 478 HA LEU 100 HA LEU 100 -6.228 5.380 18.212 479 HB2 LEU 100 HB2 LEU 100 -4.329 3.869 18.749 480 HB3 LEU 100 HB1 LEU 100 -5.441 2.535 18.924 481 HG LEU 100 HG LEU 100 -5.960 2.644 16.523 482 HD11 LEU 100 HD11 LEU 100 -3.865 4.801 16.413 483 HD12 LEU 100 HD12 LEU 100 -5.589 5.002 16.103 484 HD13 LEU 100 HD13 LEU 100 -4.602 4.017 15.024 485 HD21 LEU 100 HD21 LEU 100 -3.014 2.472 17.134 486 HD22 LEU 100 HD22 LEU 100 -3.799 1.831 15.692 487 HD23 LEU 100 HD23 LEU 100 -4.186 1.164 17.277 488 H LYS 101 HN LYS 101 -7.296 4.021 16.385 489 HA LYS 101 HA LYS 101 -10.053 3.566 17.186 490 HB2 LYS 101 HB2 LYS 101 -8.764 3.485 14.447 491 HB3 LYS 101 HB1 LYS 101 -10.491 3.421 14.754 492 HG2 LYS 101 HG2 LYS 101 -8.636 5.745 15.253 493 HG3 LYS 101 HG1 LYS 101 -9.892 5.616 14.021 494 HD2 LYS 101 HD2 LYS 101 -11.566 5.419 15.875 495 HD3 LYS 101 HD1 LYS 101 -10.266 5.780 17.011 496 HE2 LYS 101 HE2 LYS 101 -11.467 7.812 16.554 497 HE3 LYS 101 HE1 LYS 101 -9.880 7.916 15.792 498 HZ1 LYS 101 HZ1 LYS 101 -12.432 7.244 14.441 499 HZ2 LYS 101 HZ2 LYS 101 -10.953 7.280 13.667 500 HZ3 LYS 101 HZ3 LYS 101 -11.618 8.697 14.282 501 H LYS 102 HN LYS 102 -10.872 1.639 15.391 502 HA LYS 102 HA LYS 102 -10.066 -0.814 16.606 503 HB2 LYS 102 HB2 LYS 102 -11.637 -1.959 15.150 504 HB3 LYS 102 HB1 LYS 102 -12.366 -0.469 15.699 505 HG2 LYS 102 HG2 LYS 102 -11.038 -0.675 13.005 506 HG3 LYS 102 HG1 LYS 102 -12.693 -1.207 13.254 507 HD2 LYS 102 HD2 LYS 102 -11.693 1.601 13.811 508 HD3 LYS 102 HD1 LYS 102 -12.463 1.075 12.324 509 HE2 LYS 102 HE2 LYS 102 -14.481 0.479 13.503 510 HE3 LYS 102 HE1 LYS 102 -13.749 0.909 15.046 511 HZ1 LYS 102 HZ1 LYS 102 -13.606 3.186 14.321 512 HZ2 LYS 102 HZ2 LYS 102 -15.190 2.643 14.174 513 HZ3 LYS 102 HZ3 LYS 102 -14.234 2.793 12.803 514 H LEU 103 HN LEU 103 -7.803 0.247 15.614 515 HA LEU 103 HA LEU 103 -7.068 -1.150 13.158 516 HB2 LEU 103 HB2 LEU 103 -5.776 1.160 14.602 517 HB3 LEU 103 HB1 LEU 103 -5.184 0.454 13.111 518 HG LEU 103 HG LEU 103 -7.871 1.793 13.416 519 HD11 LEU 103 HD11 LEU 103 -6.878 3.611 12.107 520 HD12 LEU 103 HD12 LEU 103 -5.303 2.821 12.237 521 HD13 LEU 103 HD13 LEU 103 -6.122 3.410 13.683 522 HD21 LEU 103 HD21 LEU 103 -6.387 0.829 10.968 523 HD22 LEU 103 HD22 LEU 103 -7.890 1.750 10.960 524 HD23 LEU 103 HD23 LEU 103 -7.857 0.127 11.647 525 HA PRO 104 HA PRO 104 -4.495 -3.943 15.489 526 HB2 PRO 104 HB2 PRO 104 -2.700 -4.626 13.597 527 HB3 PRO 104 HB1 PRO 104 -4.391 -5.126 13.491 528 HG2 PRO 104 HG2 PRO 104 -3.013 -2.834 12.142 529 HG3 PRO 104 HG1 PRO 104 -4.119 -4.034 11.447 530 HD2 PRO 104 HD2 PRO 104 -4.937 -1.563 12.166 531 HD3 PRO 104 HD1 PRO 104 -5.993 -2.979 12.289 532 H VAL 105 HN VAL 105 -1.818 -4.387 15.403 533 HA VAL 105 HA VAL 105 -0.729 -1.885 16.360 534 HB VAL 105 HB VAL 105 -0.396 -4.229 17.437 535 HG11 VAL 105 HG11 VAL 105 0.355 -5.470 15.531 536 HG12 VAL 105 HG12 VAL 105 1.594 -5.469 16.785 537 HG13 VAL 105 HG13 VAL 105 1.769 -4.423 15.377 538 HG21 VAL 105 HG21 VAL 105 0.693 -2.220 18.282 539 HG22 VAL 105 HG22 VAL 105 2.001 -2.417 17.122 540 HG23 VAL 105 HG23 VAL 105 1.730 -3.635 18.377 541 H ASP 106 HN ASP 106 1.814 -1.575 15.493 542 HA ASP 106 HA ASP 106 1.261 -1.034 12.719 543 HB2 ASP 106 HB2 ASP 106 2.675 0.390 14.636 544 HB3 ASP 106 HB1 ASP 106 3.961 -0.398 13.717 545 HA PRO 107 HA PRO 107 3.425 -4.357 10.694 546 HB2 PRO 107 HB2 PRO 107 5.147 -2.934 9.090 547 HB3 PRO 107 HB1 PRO 107 3.494 -3.378 8.655 548 HG2 PRO 107 HG2 PRO 107 4.536 -0.808 9.769 549 HG3 PRO 107 HG1 PRO 107 3.299 -1.064 8.523 550 HD2 PRO 107 HD2 PRO 107 2.575 -0.422 10.960 551 HD3 PRO 107 HD1 PRO 107 1.699 -1.695 10.074 552 H TRP 108 HN TRP 108 5.553 -5.127 10.172 553 HA TRP 108 HA TRP 108 7.592 -5.832 10.631 554 HB2 TRP 108 HB2 TRP 108 8.279 -3.268 12.070 555 HB3 TRP 108 HB1 TRP 108 9.349 -4.324 11.164 556 HD1 TRP 108 HD1 TRP 108 8.722 -4.345 8.400 557 HE1 TRP 108 HE1 TRP 108 8.202 -2.307 6.915 558 HE3 TRP 108 HE3 TRP 108 7.352 -1.151 12.068 559 HZ2 TRP 108 HZ2 TRP 108 7.286 0.400 7.344 560 HZ3 TRP 108 HZ3 TRP 108 6.650 1.124 11.517 561 HH2 TRP 108 HH2 TRP 108 6.571 1.896 9.291 562 H GLY 109 HN GLY 109 5.332 -5.620 12.615 563 HA2 GLY 109 HA2 GLY 109 4.788 -6.557 14.650 564 HA3 GLY 109 HA1 GLY 109 6.411 -7.215 14.693 565 H ASN 110 HN ASN 110 5.771 -3.727 14.546 566 HA ASN 110 HA ASN 110 7.104 -3.535 17.098 567 HB2 ASN 110 HB2 ASN 110 6.443 -1.359 15.105 568 HB3 ASN 110 HB1 ASN 110 7.239 -1.097 16.646 569 HD21 ASN 110 HD21 ASN 110 7.565 -2.059 13.432 570 HD22 ASN 110 HD22 ASN 110 9.281 -2.244 13.417 571 HA PRO 111 HA PRO 111 3.175 -2.623 19.096 572 HB2 PRO 111 HB2 PRO 111 5.132 -2.045 21.259 573 HB3 PRO 111 HB1 PRO 111 3.676 -3.044 21.310 574 HG2 PRO 111 HG2 PRO 111 6.079 -4.170 21.306 575 HG3 PRO 111 HG1 PRO 111 4.744 -4.881 20.379 576 HD2 PRO 111 HD2 PRO 111 7.062 -3.258 19.419 577 HD3 PRO 111 HD1 PRO 111 6.281 -4.670 18.686 578 H TYR 112 HN TYR 112 2.317 -0.615 19.445 579 HA TYR 112 HA TYR 112 3.811 1.601 18.479 580 HB2 TYR 112 HB2 TYR 112 1.096 1.332 19.679 581 HB3 TYR 112 HB1 TYR 112 1.766 2.933 19.382 582 HD1 TYR 112 HD2 TYR 112 2.282 3.530 16.946 583 HD2 TYR 112 HD1 TYR 112 -0.004 0.114 18.043 584 HE1 TYR 112 HE2 TYR 112 1.293 3.472 14.688 585 HE2 TYR 112 HE1 TYR 112 -1.004 0.062 15.798 586 HH TYR 112 HH TYR 112 0.146 1.817 13.148 587 H GLN 113 HN GLN 113 4.532 3.362 19.549 588 HA GLN 113 HA GLN 113 5.183 2.900 22.406 589 HB2 GLN 113 HB2 GLN 113 6.432 5.234 21.131 590 HB3 GLN 113 HB1 GLN 113 7.196 3.954 22.049 591 HG2 GLN 113 HG2 GLN 113 6.493 3.864 19.118 592 HG3 GLN 113 HG1 GLN 113 8.069 4.261 19.766 593 HE21 GLN 113 HE21 GLN 113 8.007 2.212 21.807 594 HE22 GLN 113 HE22 GLN 113 8.187 0.711 20.983 595 H TYR 114 HN TYR 114 3.825 4.013 23.750 596 HA TYR 114 HA TYR 114 2.490 6.401 22.667 597 HB2 TYR 114 HB2 TYR 114 1.799 5.130 25.324 598 HB3 TYR 114 HB1 TYR 114 0.750 6.009 24.224 599 HD1 TYR 114 HD1 TYR 114 0.885 4.633 21.731 600 HD2 TYR 114 HD2 TYR 114 1.003 2.949 25.628 601 HE1 TYR 114 HE1 TYR 114 0.124 2.500 20.836 602 HE2 TYR 114 HE2 TYR 114 0.249 0.776 24.718 603 HH TYR 114 HH TYR 114 -0.814 -0.190 22.818 604 H LEU 115 HN LEU 115 3.532 8.279 23.216 605 HA LEU 115 HA LEU 115 4.507 8.525 25.933 606 HB2 LEU 115 HB2 LEU 115 5.859 9.557 23.439 607 HB3 LEU 115 HB1 LEU 115 6.281 10.072 25.057 608 HG LEU 115 HG LEU 115 6.620 7.288 23.923 609 HD11 LEU 115 HD11 LEU 115 8.182 8.984 23.053 610 HD12 LEU 115 HD12 LEU 115 8.984 7.762 24.039 611 HD13 LEU 115 HD13 LEU 115 8.660 9.362 24.707 612 HD21 LEU 115 HD21 LEU 115 7.821 6.819 26.024 613 HD22 LEU 115 HD22 LEU 115 6.123 7.183 26.307 614 HD23 LEU 115 HD23 LEU 115 7.353 8.407 26.638 615 H ALA 116 HN ALA 116 4.446 10.687 26.728 616 HA ALA 116 HA ALA 116 2.468 12.245 25.334 617 HB1 ALA 116 HB1 ALA 116 1.576 12.817 27.461 618 HB2 ALA 116 HB2 ALA 116 2.982 12.148 28.285 619 HB3 ALA 116 HB3 ALA 116 1.839 11.075 27.472 620 HA PRO 117 HA PRO 117 4.732 15.892 24.852 621 HB2 PRO 117 HB2 PRO 117 4.954 17.537 27.071 622 HB3 PRO 117 HB1 PRO 117 3.716 17.591 25.849 623 HG2 PRO 117 HG2 PRO 117 3.579 16.280 28.525 624 HG3 PRO 117 HG1 PRO 117 2.313 17.141 27.632 625 HD2 PRO 117 HD2 PRO 117 2.398 14.465 27.768 626 HD3 PRO 117 HD1 PRO 117 1.838 15.272 26.275 627 H GLY 118 HN GLY 118 6.541 15.372 24.314 628 HA2 GLY 118 HA2 GLY 118 8.468 14.419 26.215 629 HA3 GLY 118 HA1 GLY 118 8.681 14.565 24.473 630 H THR 119 HN THR 119 9.304 16.494 23.609 631 HA THR 119 HA THR 119 10.555 18.287 25.579 632 HB THR 119 HB THR 119 11.321 18.175 22.731 633 HG1 THR 119 HG1 THR 119 11.640 16.230 24.695 634 HG21 THR 119 HG21 THR 119 12.878 18.688 25.260 635 HG22 THR 119 HG22 THR 119 12.251 19.916 24.157 636 HG23 THR 119 HG23 THR 119 13.519 18.813 23.624 637 H LYS 120 HN LYS 120 8.807 19.686 25.769 638 HA LYS 120 HA LYS 120 7.734 21.632 25.353 639 HB2 LYS 120 HB2 LYS 120 9.360 21.760 22.810 640 HB3 LYS 120 HB1 LYS 120 8.510 23.091 23.580 641 HG2 LYS 120 HG2 LYS 120 10.816 21.560 24.722 642 HG3 LYS 120 HG1 LYS 120 10.934 23.160 23.996 643 HD2 LYS 120 HD2 LYS 120 9.337 24.026 25.715 644 HD3 LYS 120 HD1 LYS 120 9.349 22.441 26.480 645 HE2 LYS 120 HE2 LYS 120 11.750 22.680 26.916 646 HE3 LYS 120 HE1 LYS 120 11.736 24.262 26.143 647 HZ1 LYS 120 HZ1 LYS 120 10.225 23.512 28.595 648 HZ2 LYS 120 HZ2 LYS 120 10.179 25.023 27.866 649 HZ3 LYS 120 HZ3 LYS 120 11.608 24.466 28.552 650 H GLY 121 HN GLY 121 6.991 18.926 23.865 651 HA2 GLY 121 HA2 GLY 121 4.998 20.223 22.161 652 HA3 GLY 121 HA1 GLY 121 5.864 18.760 21.657 653 HA PRO 122 HA PRO 122 1.683 18.640 24.499 654 HB2 PRO 122 HB2 PRO 122 0.748 18.000 21.744 655 HB3 PRO 122 HB1 PRO 122 -0.155 18.668 23.107 656 HG2 PRO 122 HG2 PRO 122 0.787 20.267 21.215 657 HG3 PRO 122 HG1 PRO 122 0.826 20.751 22.916 658 HD2 PRO 122 HD2 PRO 122 3.053 19.967 21.137 659 HD3 PRO 122 HD1 PRO 122 3.077 20.963 22.608 660 H PHE 123 HN PHE 123 3.100 16.381 22.087 661 HA PHE 123 HA PHE 123 3.021 14.263 23.869 662 HB2 PHE 123 HB2 PHE 123 1.372 12.709 22.772 663 HB3 PHE 123 HB1 PHE 123 0.626 14.058 23.601 664 HD1 PHE 123 HD2 PHE 123 -0.529 15.826 22.292 665 HD2 PHE 123 HD1 PHE 123 1.158 12.395 20.375 666 HE1 PHE 123 HE2 PHE 123 -1.847 16.285 20.292 667 HE2 PHE 123 HE1 PHE 123 -0.182 12.862 18.386 668 HZ PHE 123 HZ PHE 123 -1.688 14.807 18.338 669 H ASP 124 HN ASP 124 3.569 12.096 22.809 670 HA ASP 124 HA ASP 124 4.850 12.398 20.205 671 HB2 ASP 124 HB2 ASP 124 6.221 11.561 22.753 672 HB3 ASP 124 HB1 ASP 124 6.711 10.836 21.228 673 H LEU 125 HN LEU 125 3.741 10.960 19.083 674 HA LEU 125 HA LEU 125 3.320 8.323 20.300 675 HB2 LEU 125 HB2 LEU 125 1.383 10.205 19.417 676 HB3 LEU 125 HB1 LEU 125 1.379 8.851 18.307 677 HG LEU 125 HG LEU 125 -0.298 8.579 20.014 678 HD11 LEU 125 HD11 LEU 125 1.972 6.624 20.399 679 HD12 LEU 125 HD12 LEU 125 0.789 6.594 19.101 680 HD13 LEU 125 HD13 LEU 125 0.265 6.336 20.769 681 HD21 LEU 125 HD21 LEU 125 0.701 9.860 21.813 682 HD22 LEU 125 HD22 LEU 125 1.976 8.658 21.997 683 HD23 LEU 125 HD23 LEU 125 0.304 8.237 22.377 684 H TYR 126 HN TYR 126 4.043 6.664 19.047 685 HA TYR 126 HA TYR 126 4.393 6.909 16.262 686 HB2 TYR 126 HB2 TYR 126 6.805 7.105 16.067 687 HB3 TYR 126 HB1 TYR 126 6.133 8.493 16.894 688 HD1 TYR 126 HD1 TYR 126 6.422 8.596 19.450 689 HD2 TYR 126 HD2 TYR 126 8.544 5.857 16.982 690 HE1 TYR 126 HE1 TYR 126 8.109 8.317 21.208 691 HE2 TYR 126 HE2 TYR 126 10.231 5.566 18.741 692 HH TYR 126 HH TYR 126 9.762 6.639 21.904 693 H SER 127 HN SER 127 5.752 5.208 15.370 694 HA SER 127 HA SER 127 6.002 2.871 17.114 695 HB2 SER 127 HB2 SER 127 4.109 2.608 15.510 696 HB3 SER 127 HB1 SER 127 5.230 2.932 14.186 697 HG SER 127 HG SER 127 5.356 0.896 14.198 698 H LEU 128 HN LEU 128 7.855 1.653 16.725 699 HA LEU 128 HA LEU 128 10.145 3.005 15.683 700 HB2 LEU 128 HB2 LEU 128 9.804 0.074 16.310 701 HB3 LEU 128 HB1 LEU 128 11.333 0.902 16.094 702 HG LEU 128 HG LEU 128 9.362 1.400 18.320 703 HD11 LEU 128 HD11 LEU 128 12.024 0.015 18.368 704 HD12 LEU 128 HD12 LEU 128 10.446 -0.751 18.517 705 HD13 LEU 128 HD13 LEU 128 11.004 0.366 19.763 706 HD21 LEU 128 HD21 LEU 128 10.589 3.419 17.783 707 HD22 LEU 128 HD22 LEU 128 12.116 2.540 17.858 708 HD23 LEU 128 HD23 LEU 128 11.151 2.758 19.318 709 H GLY 129 HN GLY 129 11.477 2.358 13.848 710 HA2 GLY 129 HA2 GLY 129 9.946 1.901 11.481 711 HA3 GLY 129 HA1 GLY 129 11.680 2.084 11.564 712 H ALA 130 HN ALA 130 11.245 0.494 9.810 713 HA ALA 130 HA ALA 130 10.346 -2.073 10.163 714 HB1 ALA 130 HB1 ALA 130 11.489 -2.630 8.133 715 HB2 ALA 130 HB2 ALA 130 12.502 -1.191 8.297 716 HB3 ALA 130 HB3 ALA 130 10.754 -1.027 8.031 717 H ASP 131 HN ASP 131 13.449 -0.862 11.227 718 HA ASP 131 HA ASP 131 14.419 -3.600 11.525 719 HB2 ASP 131 HB2 ASP 131 16.566 -2.686 12.142 720 HB3 ASP 131 HB1 ASP 131 16.002 -1.859 10.699 721 H GLY 132 HN GLY 132 12.555 -1.514 13.277 722 HA2 GLY 132 HA2 GLY 132 11.644 -2.048 15.351 723 HA3 GLY 132 HA1 GLY 132 12.996 -3.128 15.648 724 H LYS 133 HN LYS 133 13.816 0.012 14.543 725 HA LYS 133 HA LYS 133 14.026 1.016 17.247 726 HB2 LYS 133 HB2 LYS 133 16.210 -0.103 16.596 727 HB3 LYS 133 HB1 LYS 133 16.374 1.122 15.346 728 HG2 LYS 133 HG2 LYS 133 16.381 2.870 17.022 729 HG3 LYS 133 HG1 LYS 133 16.157 1.674 18.294 730 HD2 LYS 133 HD2 LYS 133 18.314 0.645 17.611 731 HD3 LYS 133 HD1 LYS 133 18.534 1.975 16.470 732 HE2 LYS 133 HE2 LYS 133 18.217 2.231 19.451 733 HE3 LYS 133 HE1 LYS 133 19.733 2.385 18.568 734 HZ1 LYS 133 HZ1 LYS 133 17.360 4.180 18.341 735 HZ2 LYS 133 HZ2 LYS 133 18.795 4.339 17.442 736 HZ3 LYS 133 HZ3 LYS 133 18.821 4.530 19.104 737 H GLU 134 HN GLU 134 14.084 3.292 17.361 738 HA GLU 134 HA GLU 134 12.793 4.546 15.160 739 HB2 GLU 134 HB2 GLU 134 12.603 6.523 16.572 740 HB3 GLU 134 HB1 GLU 134 12.169 5.102 17.497 741 HG2 GLU 134 HG2 GLU 134 14.749 6.654 17.675 742 HG3 GLU 134 HG1 GLU 134 13.428 6.679 18.839 743 H GLY 135 HN GLY 135 13.719 5.551 13.517 744 HA2 GLY 135 HA2 GLY 135 16.223 6.960 13.873 745 HA3 GLY 135 HA1 GLY 135 16.220 5.634 12.711 746 H GLY 136 HN GLY 136 16.791 7.725 11.416 747 HA2 GLY 136 HA2 GLY 136 14.237 8.721 10.339 748 HA3 GLY 136 HA1 GLY 136 15.751 9.640 10.297 749 H SER 137 HN SER 137 13.850 8.165 8.248 750 HA SER 137 HA SER 137 15.625 7.353 6.274 751 HB2 SER 137 HB2 SER 137 14.544 5.131 8.031 752 HB3 SER 137 HB1 SER 137 15.177 4.857 6.411 753 HG SER 137 HG SER 137 16.819 6.228 8.148 754 H ASP 138 HN ASP 138 14.244 5.774 4.743 755 HA ASP 138 HA ASP 138 11.527 6.788 4.627 756 HB2 ASP 138 HB2 ASP 138 11.329 5.307 2.570 757 HB3 ASP 138 HB1 ASP 138 12.542 6.569 2.459 758 H ASN 139 HN ASN 139 12.629 3.399 4.618 759 HA ASN 139 HA ASN 139 10.135 2.805 6.023 760 HB2 ASN 139 HB2 ASN 139 10.545 0.461 5.557 761 HB3 ASN 139 HB1 ASN 139 10.780 1.386 4.083 762 HD21 ASN 139 HD21 ASN 139 12.289 -0.460 6.542 763 HD22 ASN 139 HD22 ASN 139 13.822 -0.691 5.773 764 H ASP 140 HN ASP 140 13.453 3.124 6.711 765 HA ASP 140 HA ASP 140 13.266 1.563 9.182 766 HB2 ASP 140 HB2 ASP 140 15.622 2.992 7.928 767 HB3 ASP 140 HB1 ASP 140 15.691 2.132 9.457 768 H ALA 141 HN ALA 141 12.035 4.287 8.569 769 HA ALA 141 HA ALA 141 13.204 5.955 10.649 770 HB1 ALA 141 HB1 ALA 141 11.641 7.626 9.923 771 HB2 ALA 141 HB2 ALA 141 10.846 6.456 8.874 772 HB3 ALA 141 HB3 ALA 141 12.499 6.961 8.532 773 H ASP 142 HN ASP 142 11.969 6.754 12.361 774 HA ASP 142 HA ASP 142 9.921 4.951 13.295 775 HB2 ASP 142 HB2 ASP 142 9.792 6.363 15.296 776 HB3 ASP 142 HB1 ASP 142 11.474 6.024 14.942 777 H ILE 143 HN ILE 143 7.842 5.239 12.943 778 HA ILE 143 HA ILE 143 7.179 7.656 11.518 779 HB ILE 143 HB ILE 143 5.120 6.449 10.726 780 HG12 ILE 143 HG12 ILE 143 5.381 3.824 10.884 781 HG13 ILE 143 HG11 ILE 143 6.292 4.190 12.337 782 HG21 ILE 143 HG21 ILE 143 7.738 5.097 10.144 783 HG22 ILE 143 HG22 ILE 143 7.089 6.527 9.338 784 HG23 ILE 143 HG23 ILE 143 6.289 4.963 9.149 785 HD11 ILE 143 HD11 ILE 143 3.449 5.028 11.833 786 HD12 ILE 143 HD12 ILE 143 4.362 5.241 13.329 787 HD13 ILE 143 HD13 ILE 143 3.937 3.622 12.768 788 H GLY 144 HN GLY 144 6.021 9.210 12.417 789 HA2 GLY 144 HA2 GLY 144 4.646 8.519 14.885 790 HA3 GLY 144 HA1 GLY 144 5.966 9.665 14.962 791 H ASN 145 HN ASN 145 3.323 9.967 15.707 792 HA ASN 145 HA ASN 145 2.523 12.241 14.047 793 HB2 ASN 145 HB2 ASN 145 0.871 10.597 13.580 794 HB3 ASN 145 HB1 ASN 145 0.814 10.083 15.269 795 HD21 ASN 145 HD21 ASN 145 -0.299 11.319 16.732 796 HD22 ASN 145 HD22 ASN 145 -1.449 12.525 16.289 797 H TRP 146 HN TRP 146 2.655 13.981 15.292 798 HA TRP 146 HA TRP 146 1.727 13.882 17.953 799 HB2 TRP 146 HB2 TRP 146 3.877 14.638 18.991 800 HB3 TRP 146 HB1 TRP 146 3.801 12.957 18.498 801 HD1 TRP 146 HD1 TRP 146 5.147 16.255 16.880 802 HE1 TRP 146 HE1 TRP 146 7.418 15.684 15.789 803 HE3 TRP 146 HE3 TRP 146 5.330 11.307 17.992 804 HZ2 TRP 146 HZ2 TRP 146 9.064 13.428 15.474 805 HZ3 TRP 146 HZ3 TRP 146 7.306 9.998 17.278 806 HH2 TRP 146 HH2 TRP 146 9.115 11.036 16.047 807 H ASP 147 HN ASP 147 2.369 15.953 19.055 808 HA ASP 147 HA ASP 147 2.458 18.106 17.132 809 HB2 ASP 147 HB2 ASP 147 0.676 17.794 19.524 810 HB3 ASP 147 HB1 ASP 147 1.252 19.405 19.099 811 H ASN 148 HN ASN 148 4.211 19.152 17.297 812 HA ASN 148 HA ASN 148 5.489 19.685 19.797 813 HB2 ASN 148 HB2 ASN 148 6.286 17.358 19.237 814 HB3 ASN 148 HB1 ASN 148 6.895 17.978 17.710 815 HD21 ASN 148 HD21 ASN 148 7.414 17.698 21.057 816 HD22 ASN 148 HD22 ASN 148 8.933 18.518 21.124 Start of MODEL 14 1 H1 MET 39 HT1 MET 39 2.494 5.635 0.637 2 H2 MET 39 HT2 MET 39 2.055 6.081 -0.914 3 H3 MET 39 HT3 MET 39 3.057 7.093 -0.020 4 HA MET 39 HA MET 39 4.241 5.853 -1.737 5 HB2 MET 39 HB2 MET 39 4.984 4.923 1.079 6 HB3 MET 39 HB1 MET 39 6.028 4.898 -0.317 7 HG2 MET 39 HG2 MET 39 6.688 6.721 1.029 8 HG3 MET 39 HG1 MET 39 5.902 7.378 -0.404 9 HE1 MET 39 HE1 MET 39 4.146 5.761 2.775 10 HE2 MET 39 HE2 MET 39 3.935 7.191 3.785 11 HE3 MET 39 HE3 MET 39 5.554 6.597 3.426 12 H SER 40 HN SER 40 3.901 4.091 -3.001 13 HA SER 40 HA SER 40 2.961 1.675 -1.638 14 HB2 SER 40 HB2 SER 40 2.082 2.649 -4.362 15 HB3 SER 40 HB1 SER 40 1.540 1.178 -3.550 16 HG SER 40 HG SER 40 0.170 2.297 -2.499 17 H ARG 41 HN ARG 41 5.147 1.008 -1.542 18 HA ARG 41 HA ARG 41 6.048 -0.488 -3.849 19 HB2 ARG 41 HB2 ARG 41 7.797 1.529 -2.374 20 HB3 ARG 41 HB1 ARG 41 8.414 0.328 -3.487 21 HG2 ARG 41 HG2 ARG 41 7.203 1.398 -5.310 22 HG3 ARG 41 HG1 ARG 41 6.558 2.596 -4.190 23 HD2 ARG 41 HD2 ARG 41 8.897 3.261 -3.666 24 HD3 ARG 41 HD1 ARG 41 9.444 2.138 -4.913 25 HE ARG 41 HE ARG 41 7.511 4.122 -5.727 26 HH11 ARG 41 HH11 ARG 41 10.915 3.281 -5.520 27 HH12 ARG 41 HH12 ARG 41 11.414 4.331 -6.765 28 HH21 ARG 41 HH21 ARG 41 8.183 5.620 -7.399 29 HH22 ARG 41 HH22 ARG 41 9.814 5.703 -7.857 30 HA PRO 42 HA PRO 42 7.026 -3.529 -0.670 31 HB2 PRO 42 HB2 PRO 42 9.847 -3.690 -1.097 32 HB3 PRO 42 HB1 PRO 42 8.612 -4.797 -1.694 33 HG2 PRO 42 HG2 PRO 42 9.951 -2.540 -3.069 34 HG3 PRO 42 HG1 PRO 42 9.258 -4.019 -3.749 35 HD2 PRO 42 HD2 PRO 42 8.046 -1.652 -4.054 36 HD3 PRO 42 HD1 PRO 42 7.110 -3.137 -3.802 37 H ASP 43 HN ASP 43 7.230 -3.215 1.395 38 HA ASP 43 HA ASP 43 7.722 -2.495 3.398 39 HB2 ASP 43 HB2 ASP 43 10.311 -1.634 2.177 40 HB3 ASP 43 HB1 ASP 43 9.910 -1.130 3.816 41 H GLN 44 HN GLN 44 8.064 0.021 1.037 42 HA GLN 44 HA GLN 44 7.220 2.093 2.832 43 HB2 GLN 44 HB2 GLN 44 7.192 1.903 -0.166 44 HB3 GLN 44 HB1 GLN 44 6.522 3.276 0.695 45 HG2 GLN 44 HG2 GLN 44 8.700 3.716 1.698 46 HG3 GLN 44 HG1 GLN 44 9.355 2.324 0.826 47 HE21 GLN 44 HE21 GLN 44 9.897 5.362 0.668 48 HE22 GLN 44 HE22 GLN 44 9.766 5.651 -1.017 49 H ALA 45 HN ALA 45 5.654 -0.320 1.093 50 HA ALA 45 HA ALA 45 3.012 0.642 1.206 51 HB1 ALA 45 HB1 ALA 45 2.333 -1.655 0.806 52 HB2 ALA 45 HB2 ALA 45 3.946 -2.215 1.232 53 HB3 ALA 45 HB3 ALA 45 3.711 -1.239 -0.219 54 H LYS 46 HN LYS 46 5.112 -0.639 3.648 55 HA LYS 46 HA LYS 46 2.934 -1.212 5.504 56 HB2 LYS 46 HB2 LYS 46 5.916 -0.988 5.965 57 HB3 LYS 46 HB1 LYS 46 4.759 -1.659 7.091 58 HG2 LYS 46 HG2 LYS 46 4.322 -3.492 5.475 59 HG3 LYS 46 HG1 LYS 46 5.569 -2.799 4.431 60 HD2 LYS 46 HD2 LYS 46 7.221 -3.086 6.209 61 HD3 LYS 46 HD1 LYS 46 5.988 -3.757 7.264 62 HE2 LYS 46 HE2 LYS 46 7.255 -5.560 6.388 63 HE3 LYS 46 HE1 LYS 46 5.678 -5.594 5.609 64 HZ1 LYS 46 HZ1 LYS 46 8.201 -4.529 4.439 65 HZ2 LYS 46 HZ2 LYS 46 6.702 -4.556 3.637 66 HZ3 LYS 46 HZ3 LYS 46 7.467 -5.984 4.040 67 H VAL 47 HN VAL 47 5.067 1.314 4.533 68 HA VAL 47 HA VAL 47 4.970 2.856 6.927 69 HB VAL 47 HB VAL 47 5.808 3.756 4.157 70 HG11 VAL 47 HG11 VAL 47 5.407 5.614 5.652 71 HG12 VAL 47 HG12 VAL 47 7.139 5.430 5.360 72 HG13 VAL 47 HG13 VAL 47 6.439 4.878 6.877 73 HG21 VAL 47 HG21 VAL 47 7.073 1.801 4.888 74 HG22 VAL 47 HG22 VAL 47 7.525 2.656 6.371 75 HG23 VAL 47 HG23 VAL 47 8.066 3.251 4.796 76 H THR 48 HN THR 48 3.427 2.888 3.784 77 HA THR 48 HA THR 48 2.054 5.317 4.065 78 HB THR 48 HB THR 48 2.437 4.205 1.881 79 HG1 THR 48 HG1 THR 48 -0.345 4.419 2.127 80 HG21 THR 48 HG21 THR 48 0.256 2.302 2.752 81 HG22 THR 48 HG22 THR 48 1.960 1.911 2.524 82 HG23 THR 48 HG23 THR 48 0.977 2.383 1.138 83 H VAL 49 HN VAL 49 1.302 2.097 5.193 84 HA VAL 49 HA VAL 49 -1.398 2.671 5.925 85 HB VAL 49 HB VAL 49 0.497 0.514 6.928 86 HG11 VAL 49 HG11 VAL 49 -2.498 0.747 7.297 87 HG12 VAL 49 HG12 VAL 49 -1.284 0.950 8.557 88 HG13 VAL 49 HG13 VAL 49 -1.501 -0.623 7.794 89 HG21 VAL 49 HG21 VAL 49 0.006 0.315 4.552 90 HG22 VAL 49 HG22 VAL 49 -1.725 0.389 4.890 91 HG23 VAL 49 HG23 VAL 49 -0.773 -0.982 5.457 92 H ALA 50 HN ALA 50 1.739 2.612 7.514 93 HA ALA 50 HA ALA 50 0.992 3.089 10.116 94 HB1 ALA 50 HB1 ALA 50 3.275 3.817 10.405 95 HB2 ALA 50 HB2 ALA 50 3.465 3.956 8.661 96 HB3 ALA 50 HB3 ALA 50 3.201 2.369 9.400 97 H LYS 51 HN LYS 51 1.728 5.373 7.516 98 HA LYS 51 HA LYS 51 1.625 7.656 9.179 99 HB2 LYS 51 HB2 LYS 51 1.154 7.553 6.196 100 HB3 LYS 51 HB1 LYS 51 1.552 8.995 7.119 101 HG2 LYS 51 HG2 LYS 51 3.305 6.573 6.733 102 HG3 LYS 51 HG1 LYS 51 3.523 8.142 5.951 103 HD2 LYS 51 HD2 LYS 51 3.658 7.667 8.947 104 HD3 LYS 51 HD1 LYS 51 5.055 7.737 7.885 105 HE2 LYS 51 HE2 LYS 51 3.070 9.984 8.217 106 HE3 LYS 51 HE1 LYS 51 4.564 9.865 9.127 107 HZ1 LYS 51 HZ1 LYS 51 4.384 10.047 6.164 108 HZ2 LYS 51 HZ2 LYS 51 5.807 10.000 7.079 109 HZ3 LYS 51 HZ3 LYS 51 4.750 11.303 7.217 110 H GLY 52 HN GLY 52 -0.896 5.836 7.674 111 HA2 GLY 52 HA2 GLY 52 -2.878 7.916 8.172 112 HA3 GLY 52 HA1 GLY 52 -3.182 6.336 7.447 113 H ASP 53 HN ASP 53 -1.495 5.182 9.655 114 HA ASP 53 HA ASP 53 -3.727 4.605 11.375 115 HB2 ASP 53 HB2 ASP 53 -2.064 2.917 10.442 116 HB3 ASP 53 HB1 ASP 53 -0.911 3.571 11.596 117 H ILE 54 HN ILE 54 -0.537 6.089 11.607 118 HA ILE 54 HA ILE 54 -0.751 6.808 14.317 119 HB ILE 54 HB ILE 54 0.943 8.553 13.884 120 HG12 ILE 54 HG12 ILE 54 0.622 7.764 10.983 121 HG13 ILE 54 HG11 ILE 54 0.165 9.305 11.688 122 HG21 ILE 54 HG21 ILE 54 1.479 5.868 12.654 123 HG22 ILE 54 HG22 ILE 54 1.789 6.394 14.320 124 HG23 ILE 54 HG23 ILE 54 2.724 7.066 12.983 125 HD11 ILE 54 HD11 ILE 54 2.950 8.224 11.443 126 HD12 ILE 54 HD12 ILE 54 2.509 9.768 12.173 127 HD13 ILE 54 HD13 ILE 54 2.227 9.492 10.448 128 H LYS 55 HN LYS 55 -1.944 8.286 11.363 129 HA LYS 55 HA LYS 55 -2.782 10.710 12.538 130 HB2 LYS 55 HB2 LYS 55 -2.669 9.747 9.981 131 HB3 LYS 55 HB1 LYS 55 -4.398 9.705 10.302 132 HG2 LYS 55 HG2 LYS 55 -3.833 11.807 9.267 133 HG3 LYS 55 HG1 LYS 55 -4.294 12.096 10.949 134 HD2 LYS 55 HD2 LYS 55 -1.894 12.141 11.570 135 HD3 LYS 55 HD1 LYS 55 -1.479 11.887 9.886 136 HE2 LYS 55 HE2 LYS 55 -2.557 14.009 9.290 137 HE3 LYS 55 HE1 LYS 55 -3.001 14.259 10.976 138 HZ1 LYS 55 HZ1 LYS 55 -0.225 14.145 9.901 139 HZ2 LYS 55 HZ2 LYS 55 -0.628 14.310 11.528 140 HZ3 LYS 55 HZ3 LYS 55 -1.032 15.515 10.446 141 H ALA 56 HN ALA 56 -4.160 7.530 12.341 142 HA ALA 56 HA ALA 56 -6.776 8.084 13.253 143 HB1 ALA 56 HB1 ALA 56 -5.081 5.648 13.750 144 HB2 ALA 56 HB2 ALA 56 -6.033 5.915 12.294 145 HB3 ALA 56 HB3 ALA 56 -6.843 5.712 13.859 146 H ILE 57 HN ILE 57 -3.767 7.276 14.883 147 HA ILE 57 HA ILE 57 -4.731 7.313 17.530 148 HB ILE 57 HB ILE 57 -1.908 7.900 16.571 149 HG12 ILE 57 HG12 ILE 57 -3.091 5.298 17.512 150 HG13 ILE 57 HG11 ILE 57 -2.920 5.725 15.810 151 HG21 ILE 57 HG21 ILE 57 -2.945 6.956 19.261 152 HG22 ILE 57 HG22 ILE 57 -2.314 8.564 18.914 153 HG23 ILE 57 HG23 ILE 57 -1.249 7.161 18.830 154 HD11 ILE 57 HD11 ILE 57 -0.511 5.836 16.103 155 HD12 ILE 57 HD12 ILE 57 -1.169 4.263 16.515 156 HD13 ILE 57 HD13 ILE 57 -0.677 5.386 17.801 157 H ALA 58 HN ALA 58 -3.351 9.813 15.462 158 HA ALA 58 HA ALA 58 -3.195 11.879 17.347 159 HB1 ALA 58 HB1 ALA 58 -2.213 12.034 15.108 160 HB2 ALA 58 HB2 ALA 58 -3.242 13.426 15.457 161 HB3 ALA 58 HB3 ALA 58 -3.828 12.133 14.408 162 H ALA 59 HN ALA 59 -5.945 10.527 15.780 163 HA ALA 59 HA ALA 59 -7.695 12.738 16.467 164 HB1 ALA 59 HB1 ALA 59 -9.438 11.407 15.398 165 HB2 ALA 59 HB2 ALA 59 -8.318 10.054 15.246 166 HB3 ALA 59 HB3 ALA 59 -8.024 11.545 14.351 167 H ALA 60 HN ALA 60 -6.864 9.536 17.554 168 HA ALA 60 HA ALA 60 -9.053 9.461 19.411 169 HB1 ALA 60 HB1 ALA 60 -8.266 7.250 19.990 170 HB2 ALA 60 HB2 ALA 60 -6.786 7.518 19.071 171 HB3 ALA 60 HB3 ALA 60 -8.338 7.435 18.239 172 H LEU 61 HN LEU 61 -5.658 10.244 19.520 173 HA LEU 61 HA LEU 61 -5.421 10.299 22.360 174 HB2 LEU 61 HB2 LEU 61 -3.628 10.241 20.450 175 HB3 LEU 61 HB1 LEU 61 -3.880 11.964 20.364 176 HG LEU 61 HG LEU 61 -1.851 11.143 21.625 177 HD11 LEU 61 HD11 LEU 61 -2.044 12.778 23.424 178 HD12 LEU 61 HD12 LEU 61 -3.781 12.880 23.132 179 HD13 LEU 61 HD13 LEU 61 -2.644 13.415 21.894 180 HD21 LEU 61 HD21 LEU 61 -2.135 10.416 23.911 181 HD22 LEU 61 HD22 LEU 61 -2.947 9.292 22.805 182 HD23 LEU 61 HD23 LEU 61 -3.881 10.486 23.721 183 H ASP 62 HN ASP 62 -6.708 12.343 19.932 184 HA ASP 62 HA ASP 62 -7.101 14.654 21.565 185 HB2 ASP 62 HB2 ASP 62 -7.061 14.845 19.122 186 HB3 ASP 62 HB1 ASP 62 -8.461 13.791 19.001 187 H MET 63 HN MET 63 -8.613 11.646 21.157 188 HA MET 63 HA MET 63 -11.162 12.404 22.254 189 HB2 MET 63 HB2 MET 63 -9.976 9.695 21.607 190 HB3 MET 63 HB1 MET 63 -11.595 9.924 22.255 191 HG2 MET 63 HG2 MET 63 -12.335 11.007 20.300 192 HG3 MET 63 HG1 MET 63 -10.688 11.231 19.723 193 HE1 MET 63 HE1 MET 63 -13.452 8.506 20.514 194 HE2 MET 63 HE2 MET 63 -12.012 7.899 21.333 195 HE3 MET 63 HE3 MET 63 -12.647 7.050 19.925 196 H TYR 64 HN TYR 64 -8.132 11.014 23.394 197 HA TYR 64 HA TYR 64 -9.004 10.597 26.124 198 HB2 TYR 64 HB2 TYR 64 -6.802 9.762 25.081 199 HB3 TYR 64 HB1 TYR 64 -6.222 11.416 25.270 200 HD1 TYR 64 HD1 TYR 64 -6.432 12.434 27.756 201 HD2 TYR 64 HD2 TYR 64 -6.539 8.264 26.862 202 HE1 TYR 64 HE1 TYR 64 -5.804 11.924 29.999 203 HE2 TYR 64 HE2 TYR 64 -5.951 7.771 29.056 204 HH TYR 64 HH TYR 64 -4.879 8.812 30.760 205 H LYS 65 HN LYS 65 -7.530 13.213 24.263 206 HA LYS 65 HA LYS 65 -7.395 15.192 26.162 207 HB2 LYS 65 HB2 LYS 65 -6.406 15.608 24.059 208 HB3 LYS 65 HB1 LYS 65 -7.904 15.243 23.221 209 HG2 LYS 65 HG2 LYS 65 -8.853 17.318 23.843 210 HG3 LYS 65 HG1 LYS 65 -7.500 17.693 24.918 211 HD2 LYS 65 HD2 LYS 65 -6.027 18.028 23.126 212 HD3 LYS 65 HD1 LYS 65 -7.052 17.147 22.005 213 HE2 LYS 65 HE2 LYS 65 -7.832 19.778 23.248 214 HE3 LYS 65 HE1 LYS 65 -7.012 19.641 21.692 215 HZ1 LYS 65 HZ1 LYS 65 -9.680 18.513 22.375 216 HZ2 LYS 65 HZ2 LYS 65 -8.852 18.215 20.952 217 HZ3 LYS 65 HZ3 LYS 65 -9.364 19.786 21.307 218 H LEU 66 HN LEU 66 -10.128 13.888 24.517 219 HA LEU 66 HA LEU 66 -11.984 15.858 25.504 220 HB2 LEU 66 HB2 LEU 66 -12.328 14.785 23.324 221 HB3 LEU 66 HB1 LEU 66 -12.406 13.223 24.102 222 HG LEU 66 HG LEU 66 -14.497 13.879 25.214 223 HD11 LEU 66 HD11 LEU 66 -14.201 16.415 23.615 224 HD12 LEU 66 HD12 LEU 66 -14.161 16.269 25.376 225 HD13 LEU 66 HD13 LEU 66 -15.645 15.917 24.492 226 HD21 LEU 66 HD21 LEU 66 -14.494 14.267 22.225 227 HD22 LEU 66 HD22 LEU 66 -15.904 13.893 23.212 228 HD23 LEU 66 HD23 LEU 66 -14.590 12.726 23.079 229 H ASP 67 HN ASP 67 -10.935 12.557 26.340 230 HA ASP 67 HA ASP 67 -13.038 12.026 28.198 231 HB2 ASP 67 HB2 ASP 67 -11.787 10.229 27.116 232 HB3 ASP 67 HB1 ASP 67 -10.308 10.775 27.881 233 H ASN 68 HN ASN 68 -9.892 13.543 28.404 234 HA ASN 68 HA ASN 68 -10.288 14.122 31.334 235 HB2 ASN 68 HB2 ASN 68 -7.661 13.593 29.958 236 HB3 ASN 68 HB1 ASN 68 -7.902 14.322 31.533 237 HD21 ASN 68 HD21 ASN 68 -9.528 11.448 30.222 238 HD22 ASN 68 HD22 ASN 68 -8.922 10.375 31.361 239 H PHE 69 HN PHE 69 -10.869 15.512 28.801 240 HA PHE 69 HA PHE 69 -10.707 17.652 27.943 241 HB2 PHE 69 HB2 PHE 69 -11.013 19.381 29.811 242 HB3 PHE 69 HB1 PHE 69 -12.228 18.124 29.676 243 HD1 PHE 69 HD1 PHE 69 -9.323 19.193 31.540 244 HD2 PHE 69 HD2 PHE 69 -12.580 16.636 31.401 245 HE1 PHE 69 HE1 PHE 69 -8.946 18.682 33.914 246 HE2 PHE 69 HE2 PHE 69 -12.307 16.049 33.743 247 HZ PHE 69 HZ PHE 69 -10.457 17.074 35.051 248 H ALA 70 HN ALA 70 -8.151 16.487 28.137 249 HA ALA 70 HA ALA 70 -6.325 18.577 27.842 250 HB1 ALA 70 HB1 ALA 70 -6.293 17.184 30.524 251 HB2 ALA 70 HB2 ALA 70 -6.750 18.845 30.274 252 HB3 ALA 70 HB3 ALA 70 -5.072 18.340 29.958 253 H TYR 71 HN TYR 71 -4.205 17.671 27.501 254 HA TYR 71 HA TYR 71 -4.294 14.984 26.631 255 HB2 TYR 71 HB2 TYR 71 -2.132 17.058 26.672 256 HB3 TYR 71 HB1 TYR 71 -1.771 15.390 26.240 257 HD1 TYR 71 HD2 TYR 71 -4.177 14.637 24.714 258 HD2 TYR 71 HD1 TYR 71 -1.914 18.238 24.694 259 HE1 TYR 71 HE2 TYR 71 -4.889 15.014 22.505 260 HE2 TYR 71 HE1 TYR 71 -2.619 18.653 22.386 261 HH TYR 71 HH TYR 71 -3.435 17.353 20.445 262 HA PRO 72 HA PRO 72 -2.729 12.849 30.158 263 HB2 PRO 72 HB2 PRO 72 -1.032 11.140 28.496 264 HB3 PRO 72 HB1 PRO 72 -2.533 10.732 29.334 265 HG2 PRO 72 HG2 PRO 72 -2.327 10.857 26.640 266 HG3 PRO 72 HG1 PRO 72 -3.822 11.194 27.525 267 HD2 PRO 72 HD2 PRO 72 -1.850 13.081 26.344 268 HD3 PRO 72 HD1 PRO 72 -3.625 13.156 26.366 269 H SER 73 HN SER 73 -0.576 12.181 31.290 270 HA SER 73 HA SER 73 1.560 13.974 30.419 271 HB2 SER 73 HB2 SER 73 2.388 13.617 32.783 272 HB3 SER 73 HB1 SER 73 0.817 14.400 32.690 273 HG SER 73 HG SER 73 -0.095 12.785 33.520 274 H THR 74 HN THR 74 3.822 12.951 30.533 275 HA THR 74 HA THR 74 3.559 10.437 29.225 276 HB THR 74 HB THR 74 5.367 12.326 28.832 277 HG1 THR 74 HG1 THR 74 6.578 10.807 27.770 278 HG21 THR 74 HG21 THR 74 6.807 10.531 30.811 279 HG22 THR 74 HG22 THR 74 6.307 12.171 31.143 280 HG23 THR 74 HG23 THR 74 7.534 11.864 29.904 281 H GLN 75 HN GLN 75 3.800 11.309 32.434 282 HA GLN 75 HA GLN 75 4.629 8.627 33.191 283 HB2 GLN 75 HB2 GLN 75 4.153 11.110 34.787 284 HB3 GLN 75 HB1 GLN 75 4.577 9.555 35.514 285 HG2 GLN 75 HG2 GLN 75 6.690 9.607 34.283 286 HG3 GLN 75 HG1 GLN 75 6.239 11.154 33.576 287 HE21 GLN 75 HE21 GLN 75 6.209 12.963 34.861 288 HE22 GLN 75 HE22 GLN 75 6.975 13.023 36.405 289 H GLN 76 HN GLN 76 1.926 10.920 34.165 290 HA GLN 76 HA GLN 76 0.467 8.655 35.224 291 HB2 GLN 76 HB2 GLN 76 -0.384 11.535 34.878 292 HB3 GLN 76 HB1 GLN 76 -1.268 10.297 35.743 293 HG2 GLN 76 HG2 GLN 76 0.470 10.144 37.406 294 HG3 GLN 76 HG1 GLN 76 1.468 11.287 36.507 295 HE21 GLN 76 HE21 GLN 76 -1.303 10.910 38.586 296 HE22 GLN 76 HE22 GLN 76 -1.526 12.586 38.907 297 H GLY 77 HN GLY 77 0.337 10.719 32.422 298 HA2 GLY 77 HA2 GLY 77 -2.134 9.612 31.544 299 HA3 GLY 77 HA1 GLY 77 -1.010 10.571 30.605 300 H LEU 78 HN LEU 78 1.209 8.542 31.230 301 HA LEU 78 HA LEU 78 0.696 6.971 28.877 302 HB2 LEU 78 HB2 LEU 78 3.001 7.780 29.683 303 HB3 LEU 78 HB1 LEU 78 2.933 6.501 30.867 304 HG LEU 78 HG LEU 78 2.877 5.989 27.886 305 HD11 LEU 78 HD11 LEU 78 5.236 5.439 28.079 306 HD12 LEU 78 HD12 LEU 78 5.209 5.920 29.772 307 HD13 LEU 78 HD13 LEU 78 4.940 7.124 28.512 308 HD21 LEU 78 HD21 LEU 78 2.024 4.143 29.280 309 HD22 LEU 78 HD22 LEU 78 3.522 4.165 30.213 310 HD23 LEU 78 HD23 LEU 78 3.552 3.723 28.504 311 H GLU 79 HN GLU 79 1.012 6.286 32.309 312 HA GLU 79 HA GLU 79 0.184 3.618 32.170 313 HB2 GLU 79 HB2 GLU 79 0.074 5.633 34.394 314 HB3 GLU 79 HB1 GLU 79 -0.547 3.996 34.587 315 HG2 GLU 79 HG2 GLU 79 1.563 3.094 34.038 316 HG3 GLU 79 HG1 GLU 79 2.263 4.704 33.802 317 H ALA 80 HN ALA 80 -1.516 6.587 32.118 318 HA ALA 80 HA ALA 80 -4.079 5.329 32.459 319 HB1 ALA 80 HB1 ALA 80 -4.955 7.568 32.171 320 HB2 ALA 80 HB2 ALA 80 -3.329 8.131 31.779 321 HB3 ALA 80 HB3 ALA 80 -3.672 7.528 33.396 322 H LEU 81 HN LEU 81 -2.010 5.598 29.882 323 HA LEU 81 HA LEU 81 -4.144 5.551 27.889 324 HB2 LEU 81 HB2 LEU 81 -1.145 5.494 27.696 325 HB3 LEU 81 HB1 LEU 81 -2.152 5.174 26.309 326 HG LEU 81 HG LEU 81 -2.113 7.761 27.876 327 HD11 LEU 81 HD11 LEU 81 -0.938 7.088 25.182 328 HD12 LEU 81 HD12 LEU 81 -0.029 7.387 26.662 329 HD13 LEU 81 HD13 LEU 81 -0.970 8.685 25.928 330 HD21 LEU 81 HD21 LEU 81 -3.418 8.638 25.989 331 HD22 LEU 81 HD22 LEU 81 -4.275 7.353 26.829 332 HD23 LEU 81 HD23 LEU 81 -3.482 7.023 25.287 333 H VAL 82 HN VAL 82 -2.156 3.478 29.700 334 HA VAL 82 HA VAL 82 -2.967 1.172 28.049 335 HB VAL 82 HB VAL 82 -0.845 1.264 30.219 336 HG11 VAL 82 HG11 VAL 82 -1.428 -0.842 28.146 337 HG12 VAL 82 HG12 VAL 82 -1.735 -0.971 29.878 338 HG13 VAL 82 HG13 VAL 82 -0.078 -0.863 29.282 339 HG21 VAL 82 HG21 VAL 82 -0.539 1.392 27.218 340 HG22 VAL 82 HG22 VAL 82 0.789 1.241 28.371 341 HG23 VAL 82 HG23 VAL 82 -0.214 2.692 28.357 342 H LYS 83 HN LYS 83 -3.248 2.560 31.220 343 HA LYS 83 HA LYS 83 -5.134 0.516 32.102 344 HB2 LYS 83 HB2 LYS 83 -2.985 2.007 33.651 345 HB3 LYS 83 HB1 LYS 83 -4.295 1.137 34.444 346 HG2 LYS 83 HG2 LYS 83 -3.489 -0.937 33.474 347 HG3 LYS 83 HG1 LYS 83 -2.236 -0.055 32.604 348 HD2 LYS 83 HD2 LYS 83 -1.222 0.634 34.689 349 HD3 LYS 83 HD1 LYS 83 -2.524 -0.134 35.602 350 HE2 LYS 83 HE2 LYS 83 -1.872 -2.302 34.767 351 HE3 LYS 83 HE1 LYS 83 -0.636 -1.570 33.746 352 HZ1 LYS 83 HZ1 LYS 83 -0.674 -1.497 36.712 353 HZ2 LYS 83 HZ2 LYS 83 0.521 -0.855 35.724 354 HZ3 LYS 83 HZ3 LYS 83 0.274 -2.520 35.779 355 H LYS 84 HN LYS 84 -6.854 1.472 33.417 356 HA LYS 84 HA LYS 84 -7.965 3.762 32.221 357 HB2 LYS 84 HB2 LYS 84 -8.677 2.468 34.872 358 HB3 LYS 84 HB1 LYS 84 -9.644 3.696 34.076 359 HG2 LYS 84 HG2 LYS 84 -9.945 2.214 32.177 360 HG3 LYS 84 HG1 LYS 84 -9.020 0.967 33.024 361 HD2 LYS 84 HD2 LYS 84 -10.619 0.918 34.810 362 HD3 LYS 84 HD1 LYS 84 -11.493 2.286 34.122 363 HE2 LYS 84 HE2 LYS 84 -12.676 0.293 33.616 364 HE3 LYS 84 HE1 LYS 84 -11.943 0.948 32.146 365 HZ1 LYS 84 HZ1 LYS 84 -10.763 -1.273 33.729 366 HZ2 LYS 84 HZ2 LYS 84 -10.280 -0.779 32.179 367 HZ3 LYS 84 HZ3 LYS 84 -11.776 -1.507 32.423 368 HA PRO 85 HA PRO 85 -6.137 7.434 33.606 369 HB2 PRO 85 HB2 PRO 85 -8.483 8.837 34.239 370 HB3 PRO 85 HB1 PRO 85 -7.651 8.815 32.681 371 HG2 PRO 85 HG2 PRO 85 -9.988 7.225 33.597 372 HG3 PRO 85 HG1 PRO 85 -9.622 7.885 31.990 373 HD2 PRO 85 HD2 PRO 85 -9.338 5.303 32.495 374 HD3 PRO 85 HD1 PRO 85 -8.147 6.159 31.493 375 H THR 86 HN THR 86 -5.220 8.086 35.310 376 HA THR 86 HA THR 86 -6.222 7.231 37.904 377 HB THR 86 HB THR 86 -3.943 6.634 37.212 378 HG1 THR 86 HG1 THR 86 -4.503 7.101 39.469 379 HG21 THR 86 HG21 THR 86 -3.391 9.604 37.265 380 HG22 THR 86 HG22 THR 86 -3.355 8.554 35.848 381 HG23 THR 86 HG23 THR 86 -2.157 8.352 37.126 382 H GLY 87 HN GLY 87 -6.488 9.819 35.994 383 HA2 GLY 87 HA2 GLY 87 -6.304 11.829 38.123 384 HA3 GLY 87 HA1 GLY 87 -6.488 12.178 36.409 385 H ASN 88 HN ASN 88 -8.311 13.374 36.412 386 HA ASN 88 HA ASN 88 -10.715 12.060 37.381 387 HB2 ASN 88 HB2 ASN 88 -11.650 14.284 38.103 388 HB3 ASN 88 HB1 ASN 88 -10.290 13.745 39.069 389 HD21 ASN 88 HD21 ASN 88 -8.315 14.868 38.866 390 HD22 ASN 88 HD22 ASN 88 -8.249 16.466 38.216 391 HA PRO 89 HA PRO 89 -11.383 13.211 33.075 392 HB2 PRO 89 HB2 PRO 89 -12.053 10.814 32.136 393 HB3 PRO 89 HB1 PRO 89 -10.392 11.175 32.519 394 HG2 PRO 89 HG2 PRO 89 -12.348 9.529 34.045 395 HG3 PRO 89 HG1 PRO 89 -10.593 9.360 33.924 396 HD2 PRO 89 HD2 PRO 89 -12.053 10.591 36.029 397 HD3 PRO 89 HD1 PRO 89 -10.293 10.585 35.807 398 H GLN 90 HN GLN 90 -13.293 13.198 31.722 399 HA GLN 90 HA GLN 90 -15.786 13.204 33.288 400 HB2 GLN 90 HB2 GLN 90 -15.043 14.571 30.704 401 HB3 GLN 90 HB1 GLN 90 -16.685 14.525 31.321 402 HG2 GLN 90 HG2 GLN 90 -15.922 15.719 33.324 403 HG3 GLN 90 HG1 GLN 90 -14.301 15.810 32.632 404 HE21 GLN 90 HE21 GLN 90 -14.374 18.060 32.603 405 HE22 GLN 90 HE22 GLN 90 -15.316 18.938 31.465 406 HA PRO 91 HA PRO 91 -17.198 9.358 31.730 407 HB2 PRO 91 HB2 PRO 91 -19.722 10.376 30.795 408 HB3 PRO 91 HB1 PRO 91 -19.386 9.442 32.253 409 HG2 PRO 91 HG2 PRO 91 -19.659 12.366 31.916 410 HG3 PRO 91 HG1 PRO 91 -19.908 11.373 33.360 411 HD2 PRO 91 HD2 PRO 91 -17.798 12.998 33.123 412 HD3 PRO 91 HD1 PRO 91 -17.639 11.419 33.920 413 H LYS 92 HN LYS 92 -15.956 8.870 30.023 414 HA LYS 92 HA LYS 92 -17.090 9.165 27.407 415 HB2 LYS 92 HB2 LYS 92 -15.527 11.155 27.865 416 HB3 LYS 92 HB1 LYS 92 -14.228 10.000 28.020 417 HG2 LYS 92 HG2 LYS 92 -15.853 10.255 25.512 418 HG3 LYS 92 HG1 LYS 92 -14.446 11.270 25.813 419 HD2 LYS 92 HD2 LYS 92 -13.064 9.224 25.959 420 HD3 LYS 92 HD1 LYS 92 -14.502 8.259 25.653 421 HE2 LYS 92 HE2 LYS 92 -13.398 10.340 23.781 422 HE3 LYS 92 HE1 LYS 92 -13.118 8.604 23.639 423 HZ1 LYS 92 HZ1 LYS 92 -15.786 9.928 23.505 424 HZ2 LYS 92 HZ2 LYS 92 -15.478 8.276 23.328 425 HZ3 LYS 92 HZ3 LYS 92 -14.898 9.354 22.202 426 H ASN 93 HN ASN 93 -16.384 7.381 26.115 427 HA ASN 93 HA ASN 93 -15.533 5.130 27.585 428 HB2 ASN 93 HB2 ASN 93 -15.932 5.510 24.617 429 HB3 ASN 93 HB1 ASN 93 -15.430 3.991 25.334 430 HD21 ASN 93 HD21 ASN 93 -17.228 2.909 24.664 431 HD22 ASN 93 HD22 ASN 93 -18.794 3.161 25.345 432 H TRP 94 HN TRP 94 -13.604 5.216 28.400 433 HA TRP 94 HA TRP 94 -11.243 6.077 27.169 434 HB2 TRP 94 HB2 TRP 94 -11.518 5.947 29.578 435 HB3 TRP 94 HB1 TRP 94 -11.724 4.202 29.491 436 HD1 TRP 94 HD1 TRP 94 -9.073 6.911 29.041 437 HE1 TRP 94 HE1 TRP 94 -6.725 5.783 29.293 438 HE3 TRP 94 HE3 TRP 94 -10.520 2.048 29.385 439 HZ2 TRP 94 HZ2 TRP 94 -5.698 3.233 29.575 440 HZ3 TRP 94 HZ3 TRP 94 -8.801 0.323 29.644 441 HH2 TRP 94 HH2 TRP 94 -6.438 0.911 29.739 442 H ASN 95 HN ASN 95 -9.603 4.953 26.241 443 HA ASN 95 HA ASN 95 -10.058 2.154 25.536 444 HB2 ASN 95 HB2 ASN 95 -10.602 3.542 23.556 445 HB3 ASN 95 HB1 ASN 95 -9.042 4.343 23.747 446 HD21 ASN 95 HD21 ASN 95 -9.504 0.811 24.076 447 HD22 ASN 95 HD22 ASN 95 -8.499 0.499 22.708 448 H LYS 96 HN LYS 96 -8.276 0.963 25.910 449 HA LYS 96 HA LYS 96 -5.826 2.188 26.842 450 HB2 LYS 96 HB2 LYS 96 -5.123 -0.082 27.280 451 HB3 LYS 96 HB1 LYS 96 -6.806 0.048 27.766 452 HG2 LYS 96 HG2 LYS 96 -7.330 -0.878 25.421 453 HG3 LYS 96 HG1 LYS 96 -5.614 -1.289 25.411 454 HD2 LYS 96 HD2 LYS 96 -5.860 -2.644 27.384 455 HD3 LYS 96 HD1 LYS 96 -7.553 -2.167 27.546 456 HE2 LYS 96 HE2 LYS 96 -7.968 -3.169 25.308 457 HE3 LYS 96 HE1 LYS 96 -6.312 -3.761 25.331 458 HZ1 LYS 96 HZ1 LYS 96 -8.422 -4.448 27.282 459 HZ2 LYS 96 HZ2 LYS 96 -6.847 -5.025 27.330 460 HZ3 LYS 96 HZ3 LYS 96 -7.871 -5.455 26.056 461 H ASP 97 HN ASP 97 -3.901 0.576 25.710 462 HA ASP 97 HA ASP 97 -2.604 0.181 23.893 463 HB2 ASP 97 HB2 ASP 97 -4.729 -1.081 23.143 464 HB3 ASP 97 HB1 ASP 97 -5.134 0.338 22.199 465 H GLY 98 HN GLY 98 -3.654 2.856 24.786 466 HA2 GLY 98 HA2 GLY 98 -2.559 4.878 24.491 467 HA3 GLY 98 HA1 GLY 98 -1.978 4.315 22.940 468 H TYR 99 HN TYR 99 -5.329 3.906 23.540 469 HA TYR 99 HA TYR 99 -7.146 4.695 22.568 470 HB2 TYR 99 HB2 TYR 99 -5.755 7.125 23.368 471 HB3 TYR 99 HB1 TYR 99 -6.706 7.414 21.899 472 HD1 TYR 99 HD1 TYR 99 -6.675 6.673 25.456 473 HD2 TYR 99 HD2 TYR 99 -9.086 7.343 22.029 474 HE1 TYR 99 HE1 TYR 99 -8.572 7.162 26.889 475 HE2 TYR 99 HE2 TYR 99 -11.000 7.824 23.466 476 HH TYR 99 HH TYR 99 -11.739 7.451 25.673 477 H LEU 100 HN LEU 100 -7.102 3.475 20.859 478 HA LEU 100 HA LEU 100 -6.400 4.702 18.305 479 HB2 LEU 100 HB2 LEU 100 -4.500 3.264 18.887 480 HB3 LEU 100 HB1 LEU 100 -5.573 1.936 19.243 481 HG LEU 100 HG LEU 100 -6.177 1.826 16.840 482 HD11 LEU 100 HD11 LEU 100 -4.001 3.862 16.460 483 HD12 LEU 100 HD12 LEU 100 -5.724 4.131 16.210 484 HD13 LEU 100 HD13 LEU 100 -4.845 2.998 15.180 485 HD21 LEU 100 HD21 LEU 100 -4.444 0.363 17.709 486 HD22 LEU 100 HD22 LEU 100 -3.229 1.612 17.425 487 HD23 LEU 100 HD23 LEU 100 -4.053 0.861 16.063 488 H LYS 101 HN LYS 101 -7.457 3.326 16.546 489 HA LYS 101 HA LYS 101 -10.187 2.773 17.383 490 HB2 LYS 101 HB2 LYS 101 -8.946 2.735 14.612 491 HB3 LYS 101 HB1 LYS 101 -10.661 2.674 14.970 492 HG2 LYS 101 HG2 LYS 101 -8.809 4.999 15.494 493 HG3 LYS 101 HG1 LYS 101 -10.029 4.897 14.225 494 HD2 LYS 101 HD2 LYS 101 -11.782 4.761 15.917 495 HD3 LYS 101 HD1 LYS 101 -10.574 4.833 17.194 496 HE2 LYS 101 HE2 LYS 101 -11.563 7.023 16.916 497 HE3 LYS 101 HE1 LYS 101 -9.887 7.071 16.379 498 HZ1 LYS 101 HZ1 LYS 101 -10.673 6.962 14.070 499 HZ2 LYS 101 HZ2 LYS 101 -11.413 8.253 14.874 500 HZ3 LYS 101 HZ3 LYS 101 -12.264 6.851 14.608 501 H LYS 102 HN LYS 102 -10.982 0.760 15.762 502 HA LYS 102 HA LYS 102 -9.589 -1.471 16.908 503 HB2 LYS 102 HB2 LYS 102 -11.315 -2.980 15.964 504 HB3 LYS 102 HB1 LYS 102 -12.079 -1.588 16.699 505 HG2 LYS 102 HG2 LYS 102 -11.645 -1.973 13.786 506 HG3 LYS 102 HG1 LYS 102 -13.136 -2.355 14.651 507 HD2 LYS 102 HD2 LYS 102 -13.181 0.057 15.353 508 HD3 LYS 102 HD1 LYS 102 -11.852 0.324 14.212 509 HE2 LYS 102 HE2 LYS 102 -13.248 -0.671 12.466 510 HE3 LYS 102 HE1 LYS 102 -14.553 -0.732 13.656 511 HZ1 LYS 102 HZ1 LYS 102 -13.200 1.732 12.708 512 HZ2 LYS 102 HZ2 LYS 102 -14.421 1.694 13.864 513 HZ3 LYS 102 HZ3 LYS 102 -14.752 1.262 12.254 514 H LEU 103 HN LEU 103 -7.622 -0.946 16.039 515 HA LEU 103 HA LEU 103 -7.121 -2.029 13.379 516 HB2 LEU 103 HB2 LEU 103 -5.931 0.442 14.658 517 HB3 LEU 103 HB1 LEU 103 -5.386 -0.251 13.146 518 HG LEU 103 HG LEU 103 -8.182 0.812 13.578 519 HD11 LEU 103 HD11 LEU 103 -7.476 2.751 12.267 520 HD12 LEU 103 HD12 LEU 103 -5.813 2.153 12.286 521 HD13 LEU 103 HD13 LEU 103 -6.598 2.636 13.789 522 HD21 LEU 103 HD21 LEU 103 -8.015 -0.835 11.799 523 HD22 LEU 103 HD22 LEU 103 -6.662 0.042 11.091 524 HD23 LEU 103 HD23 LEU 103 -8.267 0.775 11.126 525 HA PRO 104 HA PRO 104 -4.105 -4.413 15.698 526 HB2 PRO 104 HB2 PRO 104 -2.422 -4.615 13.313 527 HB3 PRO 104 HB1 PRO 104 -3.371 -5.875 14.099 528 HG2 PRO 104 HG2 PRO 104 -4.016 -4.872 11.670 529 HG3 PRO 104 HG1 PRO 104 -5.230 -5.464 12.816 530 HD2 PRO 104 HD2 PRO 104 -4.402 -2.656 12.212 531 HD3 PRO 104 HD1 PRO 104 -6.028 -3.334 12.459 532 H VAL 105 HN VAL 105 -1.457 -4.598 15.531 533 HA VAL 105 HA VAL 105 -0.524 -1.918 16.173 534 HB VAL 105 HB VAL 105 -0.104 -4.069 17.544 535 HG11 VAL 105 HG11 VAL 105 2.052 -4.509 15.511 536 HG12 VAL 105 HG12 VAL 105 0.672 -5.548 15.854 537 HG13 VAL 105 HG13 VAL 105 1.934 -5.333 17.065 538 HG21 VAL 105 HG21 VAL 105 0.939 -1.926 18.092 539 HG22 VAL 105 HG22 VAL 105 2.282 -2.298 17.005 540 HG23 VAL 105 HG23 VAL 105 1.973 -3.304 18.425 541 H ASP 106 HN ASP 106 2.062 -1.632 15.287 542 HA ASP 106 HA ASP 106 1.476 -1.350 12.475 543 HB2 ASP 106 HB2 ASP 106 2.725 0.426 14.031 544 HB3 ASP 106 HB1 ASP 106 4.143 -0.555 13.670 545 HA PRO 107 HA PRO 107 3.696 -4.812 10.653 546 HB2 PRO 107 HB2 PRO 107 5.122 -2.719 9.121 547 HB3 PRO 107 HB1 PRO 107 4.397 -4.231 8.572 548 HG2 PRO 107 HG2 PRO 107 3.085 -1.949 8.159 549 HG3 PRO 107 HG1 PRO 107 2.214 -3.394 8.695 550 HD2 PRO 107 HD2 PRO 107 3.020 -0.987 10.245 551 HD3 PRO 107 HD1 PRO 107 1.561 -1.987 10.372 552 H TRP 108 HN TRP 108 5.875 -5.472 10.080 553 HA TRP 108 HA TRP 108 7.909 -6.069 10.537 554 HB2 TRP 108 HB2 TRP 108 8.462 -3.539 12.129 555 HB3 TRP 108 HB1 TRP 108 9.625 -4.565 11.314 556 HD1 TRP 108 HD1 TRP 108 9.248 -4.522 8.496 557 HE1 TRP 108 HE1 TRP 108 8.877 -2.421 7.034 558 HE3 TRP 108 HE3 TRP 108 7.618 -1.430 12.114 559 HZ2 TRP 108 HZ2 TRP 108 7.931 0.305 7.464 560 HZ3 TRP 108 HZ3 TRP 108 6.991 0.872 11.582 561 HH2 TRP 108 HH2 TRP 108 7.107 1.724 9.383 562 H GLY 109 HN GLY 109 5.592 -6.021 12.421 563 HA2 GLY 109 HA2 GLY 109 4.914 -6.781 14.511 564 HA3 GLY 109 HA1 GLY 109 6.486 -7.572 14.610 565 H ASN 110 HN ASN 110 5.924 -4.111 14.342 566 HA ASN 110 HA ASN 110 7.359 -3.799 16.814 567 HB2 ASN 110 HB2 ASN 110 6.815 -1.859 14.580 568 HB3 ASN 110 HB1 ASN 110 7.486 -1.364 16.131 569 HD21 ASN 110 HD21 ASN 110 8.643 -1.229 13.563 570 HD22 ASN 110 HD22 ASN 110 10.129 -2.095 13.571 571 HA PRO 111 HA PRO 111 3.663 -2.541 18.850 572 HB2 PRO 111 HB2 PRO 111 4.782 -1.893 21.213 573 HB3 PRO 111 HB1 PRO 111 4.572 -3.573 20.712 574 HG2 PRO 111 HG2 PRO 111 7.030 -1.880 20.679 575 HG3 PRO 111 HG1 PRO 111 6.860 -3.596 21.081 576 HD2 PRO 111 HD2 PRO 111 7.739 -2.633 18.654 577 HD3 PRO 111 HD1 PRO 111 7.012 -4.235 18.898 578 H TYR 112 HN TYR 112 2.744 -0.559 19.446 579 HA TYR 112 HA TYR 112 4.112 1.736 18.397 580 HB2 TYR 112 HB2 TYR 112 1.364 1.154 19.322 581 HB3 TYR 112 HB1 TYR 112 1.915 2.817 19.491 582 HD1 TYR 112 HD1 TYR 112 2.558 4.089 17.498 583 HD2 TYR 112 HD2 TYR 112 0.780 0.242 17.190 584 HE1 TYR 112 HE1 TYR 112 1.982 4.559 15.172 585 HE2 TYR 112 HE2 TYR 112 0.198 0.704 14.840 586 HH TYR 112 HH TYR 112 -0.177 2.628 13.404 587 H GLN 113 HN GLN 113 4.832 3.466 19.516 588 HA GLN 113 HA GLN 113 5.186 3.001 22.390 589 HB2 GLN 113 HB2 GLN 113 6.624 5.272 21.205 590 HB3 GLN 113 HB1 GLN 113 7.250 4.025 22.262 591 HG2 GLN 113 HG2 GLN 113 6.997 3.976 19.255 592 HG3 GLN 113 HG1 GLN 113 8.466 4.158 20.181 593 HE21 GLN 113 HE21 GLN 113 7.649 1.925 22.040 594 HE22 GLN 113 HE22 GLN 113 7.884 0.514 21.060 595 H TYR 114 HN TYR 114 3.701 4.094 23.540 596 HA TYR 114 HA TYR 114 2.541 6.538 22.399 597 HB2 TYR 114 HB2 TYR 114 1.606 5.470 25.037 598 HB3 TYR 114 HB1 TYR 114 0.672 6.182 23.741 599 HD1 TYR 114 HD1 TYR 114 1.176 4.359 21.481 600 HD2 TYR 114 HD2 TYR 114 0.588 3.462 25.610 601 HE1 TYR 114 HE1 TYR 114 0.400 2.103 20.905 602 HE2 TYR 114 HE2 TYR 114 -0.183 1.200 25.008 603 HH TYR 114 HH TYR 114 0.122 0.009 21.787 604 H LEU 115 HN LEU 115 3.589 8.366 23.059 605 HA LEU 115 HA LEU 115 4.401 8.453 25.831 606 HB2 LEU 115 HB2 LEU 115 5.899 9.400 23.415 607 HB3 LEU 115 HB1 LEU 115 6.280 9.988 25.032 608 HG LEU 115 HG LEU 115 6.514 7.134 24.043 609 HD11 LEU 115 HD11 LEU 115 8.169 8.617 23.046 610 HD12 LEU 115 HD12 LEU 115 8.921 7.517 24.201 611 HD13 LEU 115 HD13 LEU 115 8.626 9.198 24.647 612 HD21 LEU 115 HD21 LEU 115 6.018 7.208 26.429 613 HD22 LEU 115 HD22 LEU 115 7.305 8.386 26.677 614 HD23 LEU 115 HD23 LEU 115 7.700 6.746 26.170 615 H ALA 116 HN ALA 116 4.101 10.436 26.806 616 HA ALA 116 HA ALA 116 2.433 12.177 25.250 617 HB1 ALA 116 HB1 ALA 116 1.227 12.681 27.219 618 HB2 ALA 116 HB2 ALA 116 2.446 11.941 28.260 619 HB3 ALA 116 HB3 ALA 116 1.425 10.929 27.223 620 HA PRO 117 HA PRO 117 4.697 15.788 25.245 621 HB2 PRO 117 HB2 PRO 117 4.833 17.133 27.740 622 HB3 PRO 117 HB1 PRO 117 3.786 17.505 26.372 623 HG2 PRO 117 HG2 PRO 117 3.190 15.985 28.838 624 HG3 PRO 117 HG1 PRO 117 2.114 16.929 27.804 625 HD2 PRO 117 HD2 PRO 117 2.129 14.233 27.844 626 HD3 PRO 117 HD1 PRO 117 1.736 15.143 26.359 627 H GLY 118 HN GLY 118 6.655 15.067 24.849 628 HA2 GLY 118 HA2 GLY 118 8.459 14.909 27.143 629 HA3 GLY 118 HA1 GLY 118 8.440 13.698 25.853 630 H THR 119 HN THR 119 8.830 14.523 23.669 631 HA THR 119 HA THR 119 11.175 16.183 23.888 632 HB THR 119 HB THR 119 9.987 15.128 21.366 633 HG1 THR 119 HG1 THR 119 10.275 13.375 22.717 634 HG21 THR 119 HG21 THR 119 12.810 15.874 22.163 635 HG22 THR 119 HG22 THR 119 11.766 16.704 21.004 636 HG23 THR 119 HG23 THR 119 12.387 15.102 20.639 637 H LYS 120 HN LYS 120 10.438 18.075 24.366 638 HA LYS 120 HA LYS 120 10.138 20.255 23.935 639 HB2 LYS 120 HB2 LYS 120 9.597 19.552 21.067 640 HB3 LYS 120 HB1 LYS 120 10.083 21.106 21.712 641 HG2 LYS 120 HG2 LYS 120 11.707 18.591 21.651 642 HG3 LYS 120 HG1 LYS 120 11.931 19.997 20.617 643 HD2 LYS 120 HD2 LYS 120 12.146 20.115 23.606 644 HD3 LYS 120 HD1 LYS 120 13.528 19.712 22.600 645 HE2 LYS 120 HE2 LYS 120 13.675 22.038 23.157 646 HE3 LYS 120 HE1 LYS 120 13.238 21.935 21.463 647 HZ1 LYS 120 HZ1 LYS 120 12.038 23.639 22.701 648 HZ2 LYS 120 HZ2 LYS 120 11.331 22.509 23.690 649 HZ3 LYS 120 HZ3 LYS 120 10.971 22.544 22.038 650 H GLY 121 HN GLY 121 7.530 18.066 23.367 651 HA2 GLY 121 HA2 GLY 121 5.745 20.243 23.761 652 HA3 GLY 121 HA1 GLY 121 5.715 19.676 22.117 653 HA PRO 122 HA PRO 122 2.130 18.306 24.878 654 HB2 PRO 122 HB2 PRO 122 1.194 18.303 22.052 655 HB3 PRO 122 HB1 PRO 122 0.311 18.707 23.532 656 HG2 PRO 122 HG2 PRO 122 1.315 20.634 22.038 657 HG3 PRO 122 HG1 PRO 122 1.427 20.724 23.803 658 HD2 PRO 122 HD2 PRO 122 3.549 20.145 21.806 659 HD3 PRO 122 HD1 PRO 122 3.676 20.910 23.399 660 H PHE 123 HN PHE 123 3.271 16.541 21.890 661 HA PHE 123 HA PHE 123 3.264 14.274 23.511 662 HB2 PHE 123 HB2 PHE 123 1.596 12.774 22.511 663 HB3 PHE 123 HB1 PHE 123 0.873 14.159 23.267 664 HD1 PHE 123 HD1 PHE 123 1.772 12.747 19.949 665 HD2 PHE 123 HD2 PHE 123 -0.662 15.520 22.092 666 HE1 PHE 123 HE1 PHE 123 0.414 13.118 17.930 667 HE2 PHE 123 HE2 PHE 123 -2.009 15.895 20.076 668 HZ PHE 123 HZ PHE 123 -1.477 14.692 17.992 669 H ASP 124 HN ASP 124 4.114 12.431 22.842 670 HA ASP 124 HA ASP 124 5.765 12.657 20.409 671 HB2 ASP 124 HB2 ASP 124 6.251 11.227 23.055 672 HB3 ASP 124 HB1 ASP 124 7.303 11.109 21.650 673 H LEU 125 HN LEU 125 4.648 11.280 18.933 674 HA LEU 125 HA LEU 125 3.808 8.715 20.060 675 HB2 LEU 125 HB2 LEU 125 1.912 10.288 19.748 676 HB3 LEU 125 HB1 LEU 125 2.296 10.382 18.052 677 HG LEU 125 HG LEU 125 0.333 9.019 18.652 678 HD11 LEU 125 HD11 LEU 125 1.369 8.677 16.490 679 HD12 LEU 125 HD12 LEU 125 0.798 7.134 17.131 680 HD13 LEU 125 HD13 LEU 125 2.513 7.530 17.193 681 HD21 LEU 125 HD21 LEU 125 0.673 6.727 19.522 682 HD22 LEU 125 HD22 LEU 125 1.112 7.978 20.683 683 HD23 LEU 125 HD23 LEU 125 2.369 7.116 19.798 684 H TYR 126 HN TYR 126 4.598 6.966 18.979 685 HA TYR 126 HA TYR 126 4.947 6.960 16.207 686 HB2 TYR 126 HB2 TYR 126 7.403 6.812 16.029 687 HB3 TYR 126 HB1 TYR 126 6.873 8.385 16.581 688 HD1 TYR 126 HD2 TYR 126 7.143 8.938 19.054 689 HD2 TYR 126 HD1 TYR 126 8.972 5.546 17.259 690 HE1 TYR 126 HE2 TYR 126 8.753 8.839 20.899 691 HE2 TYR 126 HE1 TYR 126 10.599 5.441 19.089 692 HH TYR 126 HH TYR 126 10.201 7.257 21.957 693 H SER 127 HN SER 127 5.974 5.024 15.437 694 HA SER 127 HA SER 127 6.196 2.894 17.427 695 HB2 SER 127 HB2 SER 127 4.137 2.619 15.965 696 HB3 SER 127 HB1 SER 127 5.199 2.613 14.563 697 HG SER 127 HG SER 127 5.277 0.583 14.878 698 H LEU 128 HN LEU 128 7.927 1.482 16.968 699 HA LEU 128 HA LEU 128 10.198 2.670 15.781 700 HB2 LEU 128 HB2 LEU 128 9.652 -0.197 16.519 701 HB3 LEU 128 HB1 LEU 128 11.220 0.391 15.995 702 HG LEU 128 HG LEU 128 9.743 1.240 18.481 703 HD11 LEU 128 HD11 LEU 128 10.539 -1.060 18.581 704 HD12 LEU 128 HD12 LEU 128 11.453 -0.012 19.662 705 HD13 LEU 128 HD13 LEU 128 12.158 -0.523 18.127 706 HD21 LEU 128 HD21 LEU 128 11.150 3.038 17.623 707 HD22 LEU 128 HD22 LEU 128 12.511 1.924 17.487 708 HD23 LEU 128 HD23 LEU 128 11.861 2.332 19.074 709 H GLY 129 HN GLY 129 11.208 2.343 13.842 710 HA2 GLY 129 HA2 GLY 129 9.566 1.282 11.696 711 HA3 GLY 129 HA1 GLY 129 11.105 2.102 11.515 712 H ALA 130 HN ALA 130 11.297 0.343 9.983 713 HA ALA 130 HA ALA 130 11.535 -2.347 10.758 714 HB1 ALA 130 HB1 ALA 130 12.428 -2.698 8.546 715 HB2 ALA 130 HB2 ALA 130 12.724 -0.968 8.373 716 HB3 ALA 130 HB3 ALA 130 11.071 -1.568 8.482 717 H ASP 131 HN ASP 131 13.603 0.165 11.465 718 HA ASP 131 HA ASP 131 16.010 -1.507 11.492 719 HB2 ASP 131 HB2 ASP 131 16.135 0.833 10.644 720 HB3 ASP 131 HB1 ASP 131 15.709 1.412 12.248 721 H GLY 132 HN GLY 132 13.432 -0.783 13.465 722 HA2 GLY 132 HA2 GLY 132 12.938 -1.412 15.624 723 HA3 GLY 132 HA1 GLY 132 14.515 -2.173 15.706 724 H LYS 133 HN LYS 133 14.760 1.039 14.822 725 HA LYS 133 HA LYS 133 15.120 2.012 17.537 726 HB2 LYS 133 HB2 LYS 133 17.283 1.097 16.709 727 HB3 LYS 133 HB1 LYS 133 17.143 2.123 15.296 728 HG2 LYS 133 HG2 LYS 133 17.395 4.106 16.697 729 HG3 LYS 133 HG1 LYS 133 17.452 3.091 18.141 730 HD2 LYS 133 HD2 LYS 133 19.716 3.708 17.506 731 HD3 LYS 133 HD1 LYS 133 19.477 1.981 17.249 732 HE2 LYS 133 HE2 LYS 133 19.010 2.498 14.834 733 HE3 LYS 133 HE1 LYS 133 19.483 4.160 15.165 734 HZ1 LYS 133 HZ1 LYS 133 21.186 1.749 15.447 735 HZ2 LYS 133 HZ2 LYS 133 21.695 3.320 15.812 736 HZ3 LYS 133 HZ3 LYS 133 21.278 2.899 14.232 737 H GLU 134 HN GLU 134 14.817 4.321 17.571 738 HA GLU 134 HA GLU 134 13.408 5.187 15.268 739 HB2 GLU 134 HB2 GLU 134 12.925 7.301 16.552 740 HB3 GLU 134 HB1 GLU 134 12.347 5.825 17.281 741 HG2 GLU 134 HG2 GLU 134 13.127 7.128 19.044 742 HG3 GLU 134 HG1 GLU 134 14.405 5.951 18.769 743 H GLY 135 HN GLY 135 14.067 6.211 13.624 744 HA2 GLY 135 HA2 GLY 135 16.382 7.943 13.702 745 HA3 GLY 135 HA1 GLY 135 16.522 6.487 12.716 746 H GLY 136 HN GLY 136 16.793 8.396 11.092 747 HA2 GLY 136 HA2 GLY 136 14.106 9.077 10.083 748 HA3 GLY 136 HA1 GLY 136 15.533 10.089 9.832 749 H SER 137 HN SER 137 13.606 8.299 8.142 750 HA SER 137 HA SER 137 15.156 7.461 6.022 751 HB2 SER 137 HB2 SER 137 14.553 5.329 8.096 752 HB3 SER 137 HB1 SER 137 14.927 4.934 6.408 753 HG SER 137 HG SER 137 16.611 6.503 8.015 754 H ASP 138 HN ASP 138 13.644 5.692 4.788 755 HA ASP 138 HA ASP 138 10.954 6.664 4.998 756 HB2 ASP 138 HB2 ASP 138 12.302 4.680 3.212 757 HB3 ASP 138 HB1 ASP 138 10.550 4.638 3.350 758 H ASN 139 HN ASN 139 12.009 3.288 5.006 759 HA ASN 139 HA ASN 139 9.784 2.780 6.838 760 HB2 ASN 139 HB2 ASN 139 10.010 0.396 6.255 761 HB3 ASN 139 HB1 ASN 139 9.768 1.400 4.834 762 HD21 ASN 139 HD21 ASN 139 12.001 -0.582 6.591 763 HD22 ASN 139 HD22 ASN 139 13.160 -0.735 5.321 764 H ASP 140 HN ASP 140 13.129 3.046 6.878 765 HA ASP 140 HA ASP 140 13.417 1.368 9.246 766 HB2 ASP 140 HB2 ASP 140 15.438 2.996 7.699 767 HB3 ASP 140 HB1 ASP 140 15.849 2.132 9.167 768 H ALA 141 HN ALA 141 12.152 4.202 8.782 769 HA ALA 141 HA ALA 141 13.338 5.665 11.008 770 HB1 ALA 141 HB1 ALA 141 11.889 7.464 10.322 771 HB2 ALA 141 HB2 ALA 141 11.135 6.416 9.120 772 HB3 ALA 141 HB3 ALA 141 12.834 6.866 8.957 773 H ASP 142 HN ASP 142 11.958 6.485 12.667 774 HA ASP 142 HA ASP 142 9.921 4.607 13.443 775 HB2 ASP 142 HB2 ASP 142 9.652 6.035 15.424 776 HB3 ASP 142 HB1 ASP 142 11.351 5.649 15.188 777 H ILE 143 HN ILE 143 7.869 4.850 12.993 778 HA ILE 143 HA ILE 143 7.205 7.268 11.598 779 HB ILE 143 HB ILE 143 5.144 5.937 10.777 780 HG12 ILE 143 HG12 ILE 143 5.639 3.457 10.511 781 HG13 ILE 143 HG11 ILE 143 6.891 3.644 11.723 782 HG21 ILE 143 HG21 ILE 143 7.916 5.244 9.873 783 HG22 ILE 143 HG22 ILE 143 6.917 6.590 9.307 784 HG23 ILE 143 HG23 ILE 143 6.446 4.922 8.961 785 HD11 ILE 143 HD11 ILE 143 3.964 4.172 12.166 786 HD12 ILE 143 HD12 ILE 143 5.246 4.220 13.367 787 HD13 ILE 143 HD13 ILE 143 4.820 2.688 12.581 788 H GLY 144 HN GLY 144 6.100 8.783 12.453 789 HA2 GLY 144 HA2 GLY 144 3.852 8.278 14.067 790 HA3 GLY 144 HA1 GLY 144 5.257 8.679 15.038 791 H ASN 145 HN ASN 145 3.025 10.151 14.979 792 HA ASN 145 HA ASN 145 3.870 12.548 13.558 793 HB2 ASN 145 HB2 ASN 145 1.537 13.407 13.956 794 HB3 ASN 145 HB1 ASN 145 1.632 12.003 12.909 795 HD21 ASN 145 HD21 ASN 145 1.826 11.656 16.451 796 HD22 ASN 145 HD22 ASN 145 0.256 10.939 16.576 797 H TRP 146 HN TRP 146 3.466 14.590 14.840 798 HA TRP 146 HA TRP 146 4.147 14.096 17.655 799 HB2 TRP 146 HB2 TRP 146 6.051 14.328 15.755 800 HB3 TRP 146 HB1 TRP 146 5.771 16.020 16.129 801 HD1 TRP 146 HD1 TRP 146 6.485 16.849 18.610 802 HE1 TRP 146 HE1 TRP 146 8.140 15.820 20.287 803 HE3 TRP 146 HE3 TRP 146 6.830 12.176 16.601 804 HZ2 TRP 146 HZ2 TRP 146 9.437 13.311 20.674 805 HZ3 TRP 146 HZ3 TRP 146 8.287 10.524 17.691 806 HH2 TRP 146 HH2 TRP 146 9.555 11.084 19.670 807 H ASP 147 HN ASP 147 3.341 15.773 18.892 808 HA ASP 147 HA ASP 147 2.263 17.982 17.318 809 HB2 ASP 147 HB2 ASP 147 0.560 16.733 18.660 810 HB3 ASP 147 HB1 ASP 147 1.412 17.246 20.113 811 H ASN 148 HN ASN 148 4.009 19.075 17.127 812 HA ASN 148 HA ASN 148 4.467 21.215 18.675 813 HB2 ASN 148 HB2 ASN 148 5.495 19.646 20.318 814 HB3 ASN 148 HB1 ASN 148 6.691 19.200 19.112 815 HD21 ASN 148 HD21 ASN 148 8.349 20.600 18.636 816 HD22 ASN 148 HD22 ASN 148 8.662 22.054 19.523 Start of MODEL 15 1 H1 MET 39 HT1 MET 39 2.434 5.474 0.342 2 H2 MET 39 HT2 MET 39 2.477 6.050 -1.225 3 H3 MET 39 HT3 MET 39 2.787 7.096 0.065 4 HA MET 39 HA MET 39 4.832 6.501 -1.097 5 HB2 MET 39 HB2 MET 39 4.612 6.718 1.558 6 HB3 MET 39 HB1 MET 39 4.879 4.988 1.536 7 HG2 MET 39 HG2 MET 39 6.926 6.093 1.968 8 HG3 MET 39 HG1 MET 39 6.995 5.357 0.365 9 HE1 MET 39 HE1 MET 39 9.179 6.902 -0.003 10 HE2 MET 39 HE2 MET 39 8.945 7.696 1.554 11 HE3 MET 39 HE3 MET 39 9.145 8.661 0.094 12 H SER 40 HN SER 40 4.984 4.992 -2.776 13 HA SER 40 HA SER 40 4.482 2.224 -2.000 14 HB2 SER 40 HB2 SER 40 2.692 3.093 -3.438 15 HB3 SER 40 HB1 SER 40 3.883 3.489 -4.674 16 HG SER 40 HG SER 40 2.774 1.488 -4.989 17 H ARG 41 HN ARG 41 6.443 1.534 -1.643 18 HA ARG 41 HA ARG 41 8.012 0.693 -3.872 19 HB2 ARG 41 HB2 ARG 41 9.251 2.288 -1.588 20 HB3 ARG 41 HB1 ARG 41 10.180 1.313 -2.698 21 HG2 ARG 41 HG2 ARG 41 9.500 2.809 -4.526 22 HG3 ARG 41 HG1 ARG 41 8.624 3.802 -3.355 23 HD2 ARG 41 HD2 ARG 41 10.789 3.964 -2.076 24 HD3 ARG 41 HD1 ARG 41 11.571 3.255 -3.491 25 HE ARG 41 HE ARG 41 10.284 5.288 -4.573 26 HH11 ARG 41 HH11 ARG 41 12.411 5.114 -1.755 27 HH12 ARG 41 HH12 ARG 41 12.787 6.784 -1.778 28 HH21 ARG 41 HH21 ARG 41 10.789 7.534 -4.598 29 HH22 ARG 41 HH22 ARG 41 11.832 8.200 -3.427 30 HA PRO 42 HA PRO 42 8.338 -2.949 -1.256 31 HB2 PRO 42 HB2 PRO 42 11.297 -2.504 -1.220 32 HB3 PRO 42 HB1 PRO 42 10.403 -3.999 -1.509 33 HG2 PRO 42 HG2 PRO 42 11.452 -2.689 -3.543 34 HG3 PRO 42 HG1 PRO 42 9.825 -3.388 -3.676 35 HD2 PRO 42 HD2 PRO 42 10.652 -0.553 -3.329 36 HD3 PRO 42 HD1 PRO 42 9.278 -1.221 -4.226 37 H ASP 43 HN ASP 43 7.839 -2.945 0.738 38 HA ASP 43 HA ASP 43 7.702 -2.770 2.949 39 HB2 ASP 43 HB2 ASP 43 10.253 -3.119 2.922 40 HB3 ASP 43 HB1 ASP 43 10.373 -1.377 3.144 41 H GLN 44 HN GLN 44 8.457 0.033 1.127 42 HA GLN 44 HA GLN 44 7.545 1.918 3.066 43 HB2 GLN 44 HB2 GLN 44 7.503 2.228 0.065 44 HB3 GLN 44 HB1 GLN 44 7.258 3.509 1.237 45 HG2 GLN 44 HG2 GLN 44 9.597 2.972 2.071 46 HG3 GLN 44 HG1 GLN 44 9.775 2.028 0.590 47 HE21 GLN 44 HE21 GLN 44 11.208 4.377 1.354 48 HE22 GLN 44 HE22 GLN 44 10.889 5.591 0.180 49 H ALA 45 HN ALA 45 6.053 -0.280 1.002 50 HA ALA 45 HA ALA 45 3.443 0.725 0.879 51 HB1 ALA 45 HB1 ALA 45 4.214 -1.185 -0.445 52 HB2 ALA 45 HB2 ALA 45 2.772 -1.595 0.488 53 HB3 ALA 45 HB3 ALA 45 4.358 -2.146 1.027 54 H LYS 46 HN LYS 46 5.279 -0.608 3.517 55 HA LYS 46 HA LYS 46 2.933 -1.061 5.173 56 HB2 LYS 46 HB2 LYS 46 5.882 -1.125 5.823 57 HB3 LYS 46 HB1 LYS 46 4.596 -1.664 6.878 58 HG2 LYS 46 HG2 LYS 46 4.056 -3.432 5.217 59 HG3 LYS 46 HG1 LYS 46 5.474 -2.920 4.294 60 HD2 LYS 46 HD2 LYS 46 6.912 -3.357 6.211 61 HD3 LYS 46 HD1 LYS 46 5.516 -3.824 7.172 62 HE2 LYS 46 HE2 LYS 46 6.622 -5.261 4.761 63 HE3 LYS 46 HE1 LYS 46 6.648 -5.755 6.460 64 HZ1 LYS 46 HZ1 LYS 46 4.183 -5.437 4.849 65 HZ2 LYS 46 HZ2 LYS 46 4.274 -5.944 6.446 66 HZ3 LYS 46 HZ3 LYS 46 4.936 -6.901 5.221 67 H VAL 47 HN VAL 47 5.307 1.329 4.455 68 HA VAL 47 HA VAL 47 5.104 2.875 6.871 69 HB VAL 47 HB VAL 47 6.098 3.732 4.132 70 HG11 VAL 47 HG11 VAL 47 6.586 4.980 6.838 71 HG12 VAL 47 HG12 VAL 47 5.615 5.665 5.533 72 HG13 VAL 47 HG13 VAL 47 7.359 5.476 5.335 73 HG21 VAL 47 HG21 VAL 47 7.308 1.813 5.022 74 HG22 VAL 47 HG22 VAL 47 7.686 2.747 6.481 75 HG23 VAL 47 HG23 VAL 47 8.300 3.266 4.905 76 H THR 48 HN THR 48 3.761 2.956 3.673 77 HA THR 48 HA THR 48 2.433 5.396 3.909 78 HB THR 48 HB THR 48 3.033 4.287 1.770 79 HG1 THR 48 HG1 THR 48 0.520 5.368 2.273 80 HG21 THR 48 HG21 THR 48 0.661 2.523 2.341 81 HG22 THR 48 HG22 THR 48 2.350 2.028 2.309 82 HG23 THR 48 HG23 THR 48 1.572 2.578 0.827 83 H VAL 49 HN VAL 49 1.518 2.172 5.029 84 HA VAL 49 HA VAL 49 -1.218 3.019 5.407 85 HB VAL 49 HB VAL 49 -1.742 0.900 6.325 86 HG11 VAL 49 HG11 VAL 49 0.270 0.449 4.172 87 HG12 VAL 49 HG12 VAL 49 -1.448 0.804 3.990 88 HG13 VAL 49 HG13 VAL 49 -0.932 -0.725 4.708 89 HG21 VAL 49 HG21 VAL 49 0.057 0.616 7.956 90 HG22 VAL 49 HG22 VAL 49 1.210 0.300 6.664 91 HG23 VAL 49 HG23 VAL 49 -0.101 -0.839 6.973 92 H ALA 50 HN ALA 50 1.720 2.727 7.203 93 HA ALA 50 HA ALA 50 0.774 3.036 9.797 94 HB1 ALA 50 HB1 ALA 50 3.058 2.342 9.215 95 HB2 ALA 50 HB2 ALA 50 3.023 3.718 10.328 96 HB3 ALA 50 HB3 ALA 50 3.362 3.982 8.622 97 H LYS 51 HN LYS 51 1.416 5.313 7.259 98 HA LYS 51 HA LYS 51 1.491 7.666 8.780 99 HB2 LYS 51 HB2 LYS 51 0.539 7.306 5.941 100 HB3 LYS 51 HB1 LYS 51 0.968 8.845 6.660 101 HG2 LYS 51 HG2 LYS 51 2.861 6.530 6.249 102 HG3 LYS 51 HG1 LYS 51 2.709 7.908 5.168 103 HD2 LYS 51 HD2 LYS 51 3.531 8.059 8.073 104 HD3 LYS 51 HD1 LYS 51 4.635 8.071 6.701 105 HE2 LYS 51 HE2 LYS 51 3.504 10.130 5.873 106 HE3 LYS 51 HE1 LYS 51 2.517 10.128 7.330 107 HZ1 LYS 51 HZ1 LYS 51 5.469 10.347 7.244 108 HZ2 LYS 51 HZ2 LYS 51 4.538 10.326 8.640 109 HZ3 LYS 51 HZ3 LYS 51 4.392 11.601 7.561 110 H GLY 52 HN GLY 52 -1.110 5.681 7.680 111 HA2 GLY 52 HA2 GLY 52 -3.140 7.686 8.231 112 HA3 GLY 52 HA1 GLY 52 -3.409 6.076 7.568 113 H ASP 53 HN ASP 53 -1.642 4.926 9.674 114 HA ASP 53 HA ASP 53 -3.788 4.546 11.553 115 HB2 ASP 53 HB2 ASP 53 -1.047 3.239 11.468 116 HB3 ASP 53 HB1 ASP 53 -2.297 2.840 12.637 117 H ILE 54 HN ILE 54 -0.608 6.009 11.535 118 HA ILE 54 HA ILE 54 -0.710 6.809 14.255 119 HB ILE 54 HB ILE 54 1.021 8.487 13.680 120 HG12 ILE 54 HG12 ILE 54 0.625 7.518 10.838 121 HG13 ILE 54 HG11 ILE 54 0.235 9.117 11.446 122 HG21 ILE 54 HG21 ILE 54 1.484 5.725 12.594 123 HG22 ILE 54 HG22 ILE 54 1.781 6.309 14.243 124 HG23 ILE 54 HG23 ILE 54 2.750 6.912 12.893 125 HD11 ILE 54 HD11 ILE 54 2.613 9.517 11.866 126 HD12 ILE 54 HD12 ILE 54 2.275 9.146 10.170 127 HD13 ILE 54 HD13 ILE 54 2.969 7.908 11.224 128 H LYS 55 HN LYS 55 -1.992 8.125 11.282 129 HA LYS 55 HA LYS 55 -2.745 10.672 12.150 130 HB2 LYS 55 HB2 LYS 55 -2.750 9.393 9.801 131 HB3 LYS 55 HB1 LYS 55 -4.430 9.138 10.241 132 HG2 LYS 55 HG2 LYS 55 -4.287 11.066 8.864 133 HG3 LYS 55 HG1 LYS 55 -4.648 11.596 10.515 134 HD2 LYS 55 HD2 LYS 55 -2.299 12.071 10.891 135 HD3 LYS 55 HD1 LYS 55 -1.915 11.502 9.280 136 HE2 LYS 55 HE2 LYS 55 -3.288 13.289 8.311 137 HE3 LYS 55 HE1 LYS 55 -3.700 13.848 9.930 138 HZ1 LYS 55 HZ1 LYS 55 -1.946 15.171 8.971 139 HZ2 LYS 55 HZ2 LYS 55 -0.974 13.807 8.760 140 HZ3 LYS 55 HZ3 LYS 55 -1.367 14.334 10.308 141 H ALA 56 HN ALA 56 -4.183 7.505 12.385 142 HA ALA 56 HA ALA 56 -6.738 8.242 13.340 143 HB1 ALA 56 HB1 ALA 56 -6.915 5.918 14.056 144 HB2 ALA 56 HB2 ALA 56 -5.176 5.723 13.848 145 HB3 ALA 56 HB3 ALA 56 -6.202 6.006 12.438 146 H ILE 57 HN ILE 57 -3.714 7.381 14.916 147 HA ILE 57 HA ILE 57 -4.726 7.475 17.559 148 HB ILE 57 HB ILE 57 -1.835 7.843 16.715 149 HG12 ILE 57 HG12 ILE 57 -3.274 5.321 17.468 150 HG13 ILE 57 HG11 ILE 57 -2.981 5.790 15.793 151 HG21 ILE 57 HG21 ILE 57 -3.161 6.909 19.264 152 HG22 ILE 57 HG22 ILE 57 -2.279 8.424 19.033 153 HG23 ILE 57 HG23 ILE 57 -1.426 6.868 18.957 154 HD11 ILE 57 HD11 ILE 57 -0.904 5.188 17.886 155 HD12 ILE 57 HD12 ILE 57 -0.586 5.701 16.222 156 HD13 ILE 57 HD13 ILE 57 -1.393 4.163 16.529 157 H ALA 58 HN ALA 58 -3.171 9.819 15.480 158 HA ALA 58 HA ALA 58 -2.831 11.909 17.321 159 HB1 ALA 58 HB1 ALA 58 -2.772 13.404 15.396 160 HB2 ALA 58 HB2 ALA 58 -3.496 12.152 14.386 161 HB3 ALA 58 HB3 ALA 58 -1.879 11.922 15.045 162 H ALA 59 HN ALA 59 -5.650 10.711 15.756 163 HA ALA 59 HA ALA 59 -7.301 12.987 16.467 164 HB1 ALA 59 HB1 ALA 59 -9.098 11.729 15.370 165 HB2 ALA 59 HB2 ALA 59 -7.996 10.369 15.134 166 HB3 ALA 59 HB3 ALA 59 -7.691 11.906 14.323 167 H ALA 60 HN ALA 60 -6.728 9.643 17.439 168 HA ALA 60 HA ALA 60 -8.889 9.580 19.309 169 HB1 ALA 60 HB1 ALA 60 -6.490 7.785 19.060 170 HB2 ALA 60 HB2 ALA 60 -8.079 7.502 18.333 171 HB3 ALA 60 HB3 ALA 60 -7.871 7.485 20.092 172 H LEU 61 HN LEU 61 -5.536 10.484 19.463 173 HA LEU 61 HA LEU 61 -5.290 10.559 22.270 174 HB2 LEU 61 HB2 LEU 61 -3.606 10.880 20.150 175 HB3 LEU 61 HB1 LEU 61 -3.836 12.550 20.604 176 HG LEU 61 HG LEU 61 -1.778 11.558 21.539 177 HD11 LEU 61 HD11 LEU 61 -2.080 12.247 23.864 178 HD12 LEU 61 HD12 LEU 61 -3.828 12.287 23.609 179 HD13 LEU 61 HD13 LEU 61 -2.781 13.395 22.728 180 HD21 LEU 61 HD21 LEU 61 -2.602 9.279 21.821 181 HD22 LEU 61 HD22 LEU 61 -3.631 9.861 23.149 182 HD23 LEU 61 HD23 LEU 61 -1.881 9.939 23.297 183 H ASP 62 HN ASP 62 -6.622 12.645 19.866 184 HA ASP 62 HA ASP 62 -7.113 14.935 21.496 185 HB2 ASP 62 HB2 ASP 62 -7.027 15.199 19.093 186 HB3 ASP 62 HB1 ASP 62 -8.278 13.987 18.868 187 H MET 63 HN MET 63 -8.595 11.898 21.041 188 HA MET 63 HA MET 63 -11.142 12.736 22.068 189 HB2 MET 63 HB2 MET 63 -10.134 9.935 21.463 190 HB3 MET 63 HB1 MET 63 -11.791 10.338 21.896 191 HG2 MET 63 HG2 MET 63 -12.046 11.633 19.870 192 HG3 MET 63 HG1 MET 63 -10.358 11.363 19.456 193 HE1 MET 63 HE1 MET 63 -10.953 10.518 17.057 194 HE2 MET 63 HE2 MET 63 -12.652 10.852 17.386 195 HE3 MET 63 HE3 MET 63 -12.175 9.293 16.714 196 H TYR 64 HN TYR 64 -8.332 10.913 23.199 197 HA TYR 64 HA TYR 64 -9.236 10.561 25.855 198 HB2 TYR 64 HB2 TYR 64 -7.199 9.477 25.004 199 HB3 TYR 64 HB1 TYR 64 -6.410 11.052 24.886 200 HD1 TYR 64 HD1 TYR 64 -7.885 8.614 27.359 201 HD2 TYR 64 HD2 TYR 64 -5.428 12.069 26.796 202 HE1 TYR 64 HE1 TYR 64 -7.186 8.447 29.542 203 HE2 TYR 64 HE2 TYR 64 -4.719 11.887 29.092 204 HH TYR 64 HH TYR 64 -5.467 9.100 30.857 205 H LYS 65 HN LYS 65 -7.647 13.190 24.133 206 HA LYS 65 HA LYS 65 -7.209 15.028 26.112 207 HB2 LYS 65 HB2 LYS 65 -6.406 15.416 23.904 208 HB3 LYS 65 HB1 LYS 65 -8.035 15.354 23.254 209 HG2 LYS 65 HG2 LYS 65 -8.586 17.392 24.280 210 HG3 LYS 65 HG1 LYS 65 -6.986 17.526 25.049 211 HD2 LYS 65 HD2 LYS 65 -5.986 17.507 22.772 212 HD3 LYS 65 HD1 LYS 65 -7.610 17.492 22.088 213 HE2 LYS 65 HE2 LYS 65 -8.070 19.643 23.191 214 HE3 LYS 65 HE1 LYS 65 -6.428 19.657 23.825 215 HZ1 LYS 65 HZ1 LYS 65 -7.170 19.676 20.951 216 HZ2 LYS 65 HZ2 LYS 65 -5.594 19.704 21.552 217 HZ3 LYS 65 HZ3 LYS 65 -6.622 20.996 21.843 218 H LEU 66 HN LEU 66 -10.251 14.232 24.529 219 HA LEU 66 HA LEU 66 -11.572 16.172 26.222 220 HB2 LEU 66 HB2 LEU 66 -12.519 14.503 23.960 221 HB3 LEU 66 HB1 LEU 66 -13.694 15.090 25.117 222 HG LEU 66 HG LEU 66 -13.622 16.547 23.213 223 HD11 LEU 66 HD11 LEU 66 -13.229 18.684 24.289 224 HD12 LEU 66 HD12 LEU 66 -12.341 17.888 25.580 225 HD13 LEU 66 HD13 LEU 66 -14.059 17.566 25.369 226 HD21 LEU 66 HD21 LEU 66 -11.649 17.836 22.582 227 HD22 LEU 66 HD22 LEU 66 -11.314 16.107 22.461 228 HD23 LEU 66 HD23 LEU 66 -10.711 17.027 23.834 229 H ASP 67 HN ASP 67 -11.017 12.774 26.175 230 HA ASP 67 HA ASP 67 -13.115 11.965 27.969 231 HB2 ASP 67 HB2 ASP 67 -12.073 10.370 26.424 232 HB3 ASP 67 HB1 ASP 67 -10.511 10.707 27.157 233 H ASN 68 HN ASN 68 -9.862 13.169 28.430 234 HA ASN 68 HA ASN 68 -10.343 13.216 31.400 235 HB2 ASN 68 HB2 ASN 68 -8.270 11.958 30.010 236 HB3 ASN 68 HB1 ASN 68 -7.893 13.685 30.368 237 HD21 ASN 68 HD21 ASN 68 -6.177 12.775 31.599 238 HD22 ASN 68 HD22 ASN 68 -6.454 12.390 33.260 239 H PHE 69 HN PHE 69 -10.869 14.903 29.025 240 HA PHE 69 HA PHE 69 -10.655 17.072 28.318 241 HB2 PHE 69 HB2 PHE 69 -11.010 18.667 30.252 242 HB3 PHE 69 HB1 PHE 69 -12.209 17.409 29.994 243 HD1 PHE 69 HD2 PHE 69 -9.350 18.348 32.016 244 HD2 PHE 69 HD1 PHE 69 -12.599 15.874 31.582 245 HE1 PHE 69 HE2 PHE 69 -9.150 17.810 34.397 246 HE2 PHE 69 HE1 PHE 69 -12.520 15.217 33.930 247 HZ PHE 69 HZ PHE 69 -10.760 16.197 35.396 248 H ALA 70 HN ALA 70 -8.084 15.917 28.501 249 HA ALA 70 HA ALA 70 -6.367 18.129 28.418 250 HB1 ALA 70 HB1 ALA 70 -6.734 18.117 30.829 251 HB2 ALA 70 HB2 ALA 70 -5.064 17.629 30.452 252 HB3 ALA 70 HB3 ALA 70 -6.292 16.419 30.877 253 H TYR 71 HN TYR 71 -4.231 17.399 27.946 254 HA TYR 71 HA TYR 71 -4.095 14.774 26.895 255 HB2 TYR 71 HB2 TYR 71 -2.185 17.067 27.049 256 HB3 TYR 71 HB1 TYR 71 -1.614 15.473 26.574 257 HD1 TYR 71 HD2 TYR 71 -3.680 14.400 24.948 258 HD2 TYR 71 HD1 TYR 71 -2.308 18.389 25.201 259 HE1 TYR 71 HE2 TYR 71 -4.423 14.729 22.709 260 HE2 TYR 71 HE1 TYR 71 -3.045 18.790 22.903 261 HH TYR 71 HH TYR 71 -5.038 16.593 21.168 262 HA PRO 72 HA PRO 72 -2.423 12.510 30.274 263 HB2 PRO 72 HB2 PRO 72 -0.598 10.960 28.902 264 HB3 PRO 72 HB1 PRO 72 -2.341 10.654 28.911 265 HG2 PRO 72 HG2 PRO 72 -0.635 12.005 26.866 266 HG3 PRO 72 HG1 PRO 72 -1.960 10.855 26.646 267 HD2 PRO 72 HD2 PRO 72 -2.268 13.475 26.284 268 HD3 PRO 72 HD1 PRO 72 -3.558 12.450 26.936 269 H SER 73 HN SER 73 -0.310 12.202 31.563 270 HA SER 73 HA SER 73 1.751 14.076 30.691 271 HB2 SER 73 HB2 SER 73 2.652 13.639 33.015 272 HB3 SER 73 HB1 SER 73 1.026 14.327 33.015 273 HG SER 73 HG SER 73 0.339 12.662 33.919 274 H THR 74 HN THR 74 4.016 13.142 30.659 275 HA THR 74 HA THR 74 3.848 10.670 29.267 276 HB THR 74 HB THR 74 5.581 12.586 28.926 277 HG1 THR 74 HG1 THR 74 6.449 9.867 28.897 278 HG21 THR 74 HG21 THR 74 7.023 10.877 30.979 279 HG22 THR 74 HG22 THR 74 6.488 12.523 31.243 280 HG23 THR 74 HG23 THR 74 7.755 12.193 30.054 281 H GLN 75 HN GLN 75 4.012 11.288 32.531 282 HA GLN 75 HA GLN 75 4.925 8.577 33.033 283 HB2 GLN 75 HB2 GLN 75 4.501 10.898 34.874 284 HB3 GLN 75 HB1 GLN 75 4.938 9.280 35.442 285 HG2 GLN 75 HG2 GLN 75 6.996 9.450 34.079 286 HG3 GLN 75 HG1 GLN 75 6.540 11.104 33.664 287 HE21 GLN 75 HE21 GLN 75 6.588 12.672 35.268 288 HE22 GLN 75 HE22 GLN 75 7.467 12.438 36.738 289 H GLN 76 HN GLN 76 2.253 10.740 34.260 290 HA GLN 76 HA GLN 76 0.772 8.402 35.189 291 HB2 GLN 76 HB2 GLN 76 0.044 11.322 35.141 292 HB3 GLN 76 HB1 GLN 76 -0.829 10.040 35.965 293 HG2 GLN 76 HG2 GLN 76 0.987 9.720 37.495 294 HG3 GLN 76 HG1 GLN 76 1.995 10.855 36.596 295 HE21 GLN 76 HE21 GLN 76 1.117 10.904 39.359 296 HE22 GLN 76 HE22 GLN 76 0.315 12.420 39.577 297 H GLY 77 HN GLY 77 0.675 10.659 32.568 298 HA2 GLY 77 HA2 GLY 77 -1.850 9.621 31.731 299 HA3 GLY 77 HA1 GLY 77 -0.849 10.708 30.801 300 H LEU 78 HN LEU 78 1.460 8.716 31.188 301 HA LEU 78 HA LEU 78 0.905 7.131 28.859 302 HB2 LEU 78 HB2 LEU 78 3.232 7.884 29.750 303 HB3 LEU 78 HB1 LEU 78 3.079 6.580 30.899 304 HG LEU 78 HG LEU 78 3.092 6.157 27.910 305 HD11 LEU 78 HD11 LEU 78 5.182 7.172 28.641 306 HD12 LEU 78 HD12 LEU 78 5.411 5.501 28.143 307 HD13 LEU 78 HD13 LEU 78 5.379 5.908 29.858 308 HD21 LEU 78 HD21 LEU 78 2.102 4.308 29.187 309 HD22 LEU 78 HD22 LEU 78 3.539 4.236 30.203 310 HD23 LEU 78 HD23 LEU 78 3.651 3.836 28.488 311 H GLU 79 HN GLU 79 1.164 6.580 32.300 312 HA GLU 79 HA GLU 79 0.163 3.972 32.334 313 HB2 GLU 79 HB2 GLU 79 0.611 6.103 34.321 314 HB3 GLU 79 HB1 GLU 79 -0.589 4.889 34.739 315 HG2 GLU 79 HG2 GLU 79 2.242 4.305 33.923 316 HG3 GLU 79 HG1 GLU 79 1.618 4.347 35.583 317 H ALA 80 HN ALA 80 -1.369 6.933 31.751 318 HA ALA 80 HA ALA 80 -4.000 5.855 32.402 319 HB1 ALA 80 HB1 ALA 80 -3.251 8.192 33.053 320 HB2 ALA 80 HB2 ALA 80 -4.845 7.994 32.290 321 HB3 ALA 80 HB3 ALA 80 -3.496 8.599 31.339 322 H LEU 81 HN LEU 81 -1.946 5.944 29.872 323 HA LEU 81 HA LEU 81 -4.039 5.783 27.849 324 HB2 LEU 81 HB2 LEU 81 -1.162 6.311 27.895 325 HB3 LEU 81 HB1 LEU 81 -1.618 5.183 26.645 326 HG LEU 81 HG LEU 81 -3.048 6.836 25.594 327 HD11 LEU 81 HD11 LEU 81 -3.291 9.093 26.440 328 HD12 LEU 81 HD12 LEU 81 -2.361 8.668 27.878 329 HD13 LEU 81 HD13 LEU 81 -3.934 7.924 27.592 330 HD21 LEU 81 HD21 LEU 81 -1.378 8.553 25.028 331 HD22 LEU 81 HD22 LEU 81 -0.705 6.928 25.005 332 HD23 LEU 81 HD23 LEU 81 -0.359 7.996 26.356 333 H VAL 82 HN VAL 82 -2.169 3.913 29.919 334 HA VAL 82 HA VAL 82 -2.879 1.475 28.428 335 HB VAL 82 HB VAL 82 -0.835 1.693 30.649 336 HG11 VAL 82 HG11 VAL 82 -1.723 -0.546 30.389 337 HG12 VAL 82 HG12 VAL 82 -0.058 -0.487 29.795 338 HG13 VAL 82 HG13 VAL 82 -1.404 -0.493 28.657 339 HG21 VAL 82 HG21 VAL 82 0.864 1.569 28.860 340 HG22 VAL 82 HG22 VAL 82 -0.122 3.030 28.754 341 HG23 VAL 82 HG23 VAL 82 -0.423 1.698 27.657 342 H LYS 83 HN LYS 83 -3.001 2.973 31.627 343 HA LYS 83 HA LYS 83 -4.941 0.959 32.527 344 HB2 LYS 83 HB2 LYS 83 -2.792 0.963 33.810 345 HB3 LYS 83 HB1 LYS 83 -2.965 2.664 34.122 346 HG2 LYS 83 HG2 LYS 83 -5.018 2.181 35.430 347 HG3 LYS 83 HG1 LYS 83 -4.753 0.465 35.138 348 HD2 LYS 83 HD2 LYS 83 -3.887 0.836 37.286 349 HD3 LYS 83 HD1 LYS 83 -2.472 0.793 36.245 350 HE2 LYS 83 HE2 LYS 83 -3.823 3.318 37.233 351 HE3 LYS 83 HE1 LYS 83 -2.431 2.572 37.994 352 HZ1 LYS 83 HZ1 LYS 83 -2.531 3.808 35.287 353 HZ2 LYS 83 HZ2 LYS 83 -1.192 2.971 35.881 354 HZ3 LYS 83 HZ3 LYS 83 -1.726 4.378 36.642 355 H LYS 84 HN LYS 84 -6.793 1.907 33.665 356 HA LYS 84 HA LYS 84 -7.888 4.188 32.462 357 HB2 LYS 84 HB2 LYS 84 -8.559 2.850 35.089 358 HB3 LYS 84 HB1 LYS 84 -9.516 4.143 34.380 359 HG2 LYS 84 HG2 LYS 84 -10.043 2.788 32.483 360 HG3 LYS 84 HG1 LYS 84 -8.949 1.526 33.025 361 HD2 LYS 84 HD2 LYS 84 -11.283 0.934 33.475 362 HD3 LYS 84 HD1 LYS 84 -10.378 1.102 34.970 363 HE2 LYS 84 HE2 LYS 84 -12.046 3.356 33.867 364 HE3 LYS 84 HE1 LYS 84 -12.768 2.072 34.823 365 HZ1 LYS 84 HZ1 LYS 84 -10.595 3.904 35.789 366 HZ2 LYS 84 HZ2 LYS 84 -11.313 2.650 36.650 367 HZ3 LYS 84 HZ3 LYS 84 -12.232 3.970 36.192 368 HA PRO 85 HA PRO 85 -5.825 7.583 34.273 369 HB2 PRO 85 HB2 PRO 85 -7.752 9.508 33.858 370 HB3 PRO 85 HB1 PRO 85 -6.763 8.841 32.550 371 HG2 PRO 85 HG2 PRO 85 -9.499 8.052 33.401 372 HG3 PRO 85 HG1 PRO 85 -8.885 8.403 31.771 373 HD2 PRO 85 HD2 PRO 85 -9.146 5.895 32.609 374 HD3 PRO 85 HD1 PRO 85 -7.741 6.380 31.641 375 H THR 86 HN THR 86 -5.635 8.472 36.226 376 HA THR 86 HA THR 86 -7.555 7.773 38.244 377 HB THR 86 HB THR 86 -5.892 8.883 39.790 378 HG1 THR 86 HG1 THR 86 -4.841 9.657 37.380 379 HG21 THR 86 HG21 THR 86 -4.814 6.720 37.969 380 HG22 THR 86 HG22 THR 86 -5.835 6.466 39.383 381 HG23 THR 86 HG23 THR 86 -4.204 7.104 39.578 382 H GLY 87 HN GLY 87 -7.869 9.667 39.983 383 HA2 GLY 87 HA2 GLY 87 -8.677 11.754 40.470 384 HA3 GLY 87 HA1 GLY 87 -8.119 12.295 38.890 385 H ASN 88 HN ASN 88 -9.638 12.828 37.493 386 HA ASN 88 HA ASN 88 -12.056 11.287 37.432 387 HB2 ASN 88 HB2 ASN 88 -13.605 13.162 37.709 388 HB3 ASN 88 HB1 ASN 88 -12.574 13.029 39.111 389 HD21 ASN 88 HD21 ASN 88 -13.508 14.953 36.444 390 HD22 ASN 88 HD22 ASN 88 -12.618 16.377 36.826 391 HA PRO 89 HA PRO 89 -11.608 12.626 33.164 392 HB2 PRO 89 HB2 PRO 89 -12.063 10.251 32.029 393 HB3 PRO 89 HB1 PRO 89 -10.570 10.513 32.885 394 HG2 PRO 89 HG2 PRO 89 -12.940 8.938 33.739 395 HG3 PRO 89 HG1 PRO 89 -11.246 8.741 34.198 396 HD2 PRO 89 HD2 PRO 89 -13.332 10.086 35.663 397 HD3 PRO 89 HD1 PRO 89 -11.624 9.874 36.110 398 H GLN 90 HN GLN 90 -13.218 12.672 31.370 399 HA GLN 90 HA GLN 90 -15.927 13.047 32.327 400 HB2 GLN 90 HB2 GLN 90 -14.630 13.397 29.628 401 HB3 GLN 90 HB1 GLN 90 -16.366 13.534 29.840 402 HG2 GLN 90 HG2 GLN 90 -16.033 15.351 31.411 403 HG3 GLN 90 HG1 GLN 90 -14.290 15.206 31.208 404 HE21 GLN 90 HE21 GLN 90 -14.201 17.340 30.460 405 HE22 GLN 90 HE22 GLN 90 -14.717 17.774 28.876 406 HA PRO 91 HA PRO 91 -17.385 9.065 31.077 407 HB2 PRO 91 HB2 PRO 91 -19.874 10.187 29.982 408 HB3 PRO 91 HB1 PRO 91 -19.651 9.122 31.369 409 HG2 PRO 91 HG2 PRO 91 -20.342 11.696 31.704 410 HG3 PRO 91 HG1 PRO 91 -19.243 10.874 32.826 411 HD2 PRO 91 HD2 PRO 91 -18.583 12.728 30.561 412 HD3 PRO 91 HD1 PRO 91 -17.951 12.714 32.226 413 H LYS 92 HN LYS 92 -16.014 8.564 29.457 414 HA LYS 92 HA LYS 92 -17.164 8.312 26.833 415 HB2 LYS 92 HB2 LYS 92 -14.376 9.403 27.375 416 HB3 LYS 92 HB1 LYS 92 -14.823 8.652 25.860 417 HG2 LYS 92 HG2 LYS 92 -16.482 10.462 25.506 418 HG3 LYS 92 HG1 LYS 92 -15.904 11.220 27.001 419 HD2 LYS 92 HD2 LYS 92 -13.699 11.444 26.080 420 HD3 LYS 92 HD1 LYS 92 -14.178 10.578 24.621 421 HE2 LYS 92 HE2 LYS 92 -15.349 13.191 25.545 422 HE3 LYS 92 HE1 LYS 92 -14.047 13.032 24.374 423 HZ1 LYS 92 HZ1 LYS 92 -16.794 11.945 24.036 424 HZ2 LYS 92 HZ2 LYS 92 -15.519 11.821 22.929 425 HZ3 LYS 92 HZ3 LYS 92 -16.156 13.321 23.304 426 H ASN 93 HN ASN 93 -16.384 6.375 25.880 427 HA ASN 93 HA ASN 93 -15.448 4.555 27.871 428 HB2 ASN 93 HB2 ASN 93 -16.089 4.084 24.949 429 HB3 ASN 93 HB1 ASN 93 -15.463 2.827 26.013 430 HD21 ASN 93 HD21 ASN 93 -18.177 4.745 25.166 431 HD22 ASN 93 HD22 ASN 93 -19.342 3.937 26.142 432 H TRP 94 HN TRP 94 -13.515 5.174 28.500 433 HA TRP 94 HA TRP 94 -11.312 5.902 27.115 434 HB2 TRP 94 HB2 TRP 94 -11.500 6.113 29.490 435 HB3 TRP 94 HB1 TRP 94 -11.657 4.374 29.696 436 HD1 TRP 94 HD1 TRP 94 -9.048 7.106 29.102 437 HE1 TRP 94 HE1 TRP 94 -6.694 6.046 29.453 438 HE3 TRP 94 HE3 TRP 94 -10.383 2.207 29.641 439 HZ2 TRP 94 HZ2 TRP 94 -5.603 3.535 29.896 440 HZ3 TRP 94 HZ3 TRP 94 -8.629 0.545 30.043 441 HH2 TRP 94 HH2 TRP 94 -6.290 1.197 30.168 442 H ASN 95 HN ASN 95 -9.581 4.915 26.313 443 HA ASN 95 HA ASN 95 -9.846 2.094 25.721 444 HB2 ASN 95 HB2 ASN 95 -10.338 3.405 23.729 445 HB3 ASN 95 HB1 ASN 95 -8.852 4.314 23.949 446 HD21 ASN 95 HD21 ASN 95 -9.265 0.766 24.218 447 HD22 ASN 95 HD22 ASN 95 -8.133 0.444 22.959 448 H LYS 96 HN LYS 96 -7.906 0.930 26.119 449 HA LYS 96 HA LYS 96 -5.612 2.457 27.045 450 HB2 LYS 96 HB2 LYS 96 -4.625 0.380 27.720 451 HB3 LYS 96 HB1 LYS 96 -6.303 0.338 28.225 452 HG2 LYS 96 HG2 LYS 96 -6.814 -1.133 26.309 453 HG3 LYS 96 HG1 LYS 96 -5.108 -1.017 25.838 454 HD2 LYS 96 HD2 LYS 96 -4.423 -2.024 27.941 455 HD3 LYS 96 HD1 LYS 96 -6.102 -2.119 28.463 456 HE2 LYS 96 HE2 LYS 96 -6.596 -3.645 26.632 457 HE3 LYS 96 HE1 LYS 96 -4.935 -3.499 26.059 458 HZ1 LYS 96 HZ1 LYS 96 -5.684 -4.571 28.723 459 HZ2 LYS 96 HZ2 LYS 96 -4.144 -4.534 28.056 460 HZ3 LYS 96 HZ3 LYS 96 -5.336 -5.511 27.376 461 H ASP 97 HN ASP 97 -3.481 1.032 26.197 462 HA ASP 97 HA ASP 97 -2.077 0.504 24.520 463 HB2 ASP 97 HB2 ASP 97 -3.877 -1.046 23.767 464 HB3 ASP 97 HB1 ASP 97 -4.564 0.249 22.806 465 H GLY 98 HN GLY 98 -3.434 3.141 25.005 466 HA2 GLY 98 HA2 GLY 98 -2.165 5.110 24.656 467 HA3 GLY 98 HA1 GLY 98 -1.670 4.489 23.100 468 H TYR 99 HN TYR 99 -4.957 4.082 23.689 469 HA TYR 99 HA TYR 99 -6.804 4.895 22.804 470 HB2 TYR 99 HB2 TYR 99 -5.535 7.305 23.767 471 HB3 TYR 99 HB1 TYR 99 -6.310 7.677 22.226 472 HD1 TYR 99 HD2 TYR 99 -6.729 6.510 25.655 473 HD2 TYR 99 HD1 TYR 99 -8.682 7.696 22.079 474 HE1 TYR 99 HE2 TYR 99 -8.813 6.697 26.865 475 HE2 TYR 99 HE1 TYR 99 -10.792 7.882 23.295 476 HH TYR 99 HH TYR 99 -10.848 7.633 26.746 477 H LEU 100 HN LEU 100 -6.899 3.764 21.085 478 HA LEU 100 HA LEU 100 -6.204 4.982 18.520 479 HB2 LEU 100 HB2 LEU 100 -4.346 3.502 18.959 480 HB3 LEU 100 HB1 LEU 100 -5.413 2.232 19.498 481 HG LEU 100 HG LEU 100 -6.263 2.027 17.172 482 HD11 LEU 100 HD11 LEU 100 -5.076 2.979 15.316 483 HD12 LEU 100 HD12 LEU 100 -3.978 3.807 16.403 484 HD13 LEU 100 HD13 LEU 100 -5.685 4.270 16.357 485 HD21 LEU 100 HD21 LEU 100 -4.576 0.513 18.013 486 HD22 LEU 100 HD22 LEU 100 -3.300 1.631 17.526 487 HD23 LEU 100 HD23 LEU 100 -4.301 0.849 16.305 488 H LYS 101 HN LYS 101 -7.511 4.146 16.843 489 HA LYS 101 HA LYS 101 -10.142 3.300 17.661 490 HB2 LYS 101 HB2 LYS 101 -8.893 3.662 14.924 491 HB3 LYS 101 HB1 LYS 101 -10.592 3.324 15.201 492 HG2 LYS 101 HG2 LYS 101 -9.145 5.770 16.209 493 HG3 LYS 101 HG1 LYS 101 -10.107 5.712 14.733 494 HD2 LYS 101 HD2 LYS 101 -11.192 4.999 17.436 495 HD3 LYS 101 HD1 LYS 101 -11.306 6.645 16.776 496 HE2 LYS 101 HE2 LYS 101 -12.518 5.613 14.830 497 HE3 LYS 101 HE1 LYS 101 -12.496 4.086 15.706 498 HZ1 LYS 101 HZ1 LYS 101 -14.581 5.218 16.017 499 HZ2 LYS 101 HZ2 LYS 101 -13.831 6.590 16.589 500 HZ3 LYS 101 HZ3 LYS 101 -13.777 5.165 17.495 501 H LYS 102 HN LYS 102 -10.993 1.403 16.006 502 HA LYS 102 HA LYS 102 -9.313 -0.824 16.779 503 HB2 LYS 102 HB2 LYS 102 -12.090 -0.785 15.604 504 HB3 LYS 102 HB1 LYS 102 -11.150 -2.262 15.634 505 HG2 LYS 102 HG2 LYS 102 -12.617 -2.295 17.509 506 HG3 LYS 102 HG1 LYS 102 -10.987 -2.040 18.110 507 HD2 LYS 102 HD2 LYS 102 -12.517 -0.626 19.322 508 HD3 LYS 102 HD1 LYS 102 -11.492 0.378 18.294 509 HE2 LYS 102 HE2 LYS 102 -13.254 0.643 16.692 510 HE3 LYS 102 HE1 LYS 102 -14.255 -0.533 17.538 511 HZ1 LYS 102 HZ1 LYS 102 -14.884 1.782 17.962 512 HZ2 LYS 102 HZ2 LYS 102 -13.410 2.068 18.745 513 HZ3 LYS 102 HZ3 LYS 102 -14.505 0.932 19.341 514 H LEU 103 HN LEU 103 -7.603 -0.204 15.558 515 HA LEU 103 HA LEU 103 -7.626 -1.159 12.790 516 HB2 LEU 103 HB2 LEU 103 -6.133 1.232 13.904 517 HB3 LEU 103 HB1 LEU 103 -5.989 0.619 12.272 518 HG LEU 103 HG LEU 103 -8.478 1.855 13.456 519 HD11 LEU 103 HD11 LEU 103 -6.473 2.936 11.500 520 HD12 LEU 103 HD12 LEU 103 -6.721 3.486 13.156 521 HD13 LEU 103 HD13 LEU 103 -7.989 3.716 11.950 522 HD21 LEU 103 HD21 LEU 103 -7.862 0.987 10.630 523 HD22 LEU 103 HD22 LEU 103 -9.309 1.845 11.156 524 HD23 LEU 103 HD23 LEU 103 -8.999 0.208 11.732 525 HA PRO 104 HA PRO 104 -4.379 -3.767 14.337 526 HB2 PRO 104 HB2 PRO 104 -2.720 -3.905 12.164 527 HB3 PRO 104 HB1 PRO 104 -4.239 -4.803 12.299 528 HG2 PRO 104 HG2 PRO 104 -3.704 -2.199 10.922 529 HG3 PRO 104 HG1 PRO 104 -4.618 -3.601 10.331 530 HD2 PRO 104 HD2 PRO 104 -5.881 -1.472 11.312 531 HD3 PRO 104 HD1 PRO 104 -6.456 -3.112 11.679 532 H VAL 105 HN VAL 105 -2.074 -3.891 14.735 533 HA VAL 105 HA VAL 105 -0.995 -1.355 15.539 534 HB VAL 105 HB VAL 105 -0.937 -3.572 16.823 535 HG11 VAL 105 HG11 VAL 105 1.381 -4.176 15.030 536 HG12 VAL 105 HG12 VAL 105 -0.129 -5.076 15.193 537 HG13 VAL 105 HG13 VAL 105 1.013 -5.020 16.533 538 HG21 VAL 105 HG21 VAL 105 0.282 -1.559 17.586 539 HG22 VAL 105 HG22 VAL 105 1.715 -2.106 16.710 540 HG23 VAL 105 HG23 VAL 105 1.043 -3.074 18.014 541 H ASP 106 HN ASP 106 1.673 -1.256 15.113 542 HA ASP 106 HA ASP 106 1.760 -0.650 12.373 543 HB2 ASP 106 HB2 ASP 106 3.043 0.903 13.408 544 HB3 ASP 106 HB1 ASP 106 3.538 -0.177 14.735 545 HA PRO 107 HA PRO 107 3.532 -4.223 10.305 546 HB2 PRO 107 HB2 PRO 107 5.458 -2.755 8.981 547 HB3 PRO 107 HB1 PRO 107 3.865 -3.182 8.356 548 HG2 PRO 107 HG2 PRO 107 4.780 -0.616 9.583 549 HG3 PRO 107 HG1 PRO 107 3.564 -0.868 8.322 550 HD2 PRO 107 HD2 PRO 107 2.863 -0.266 10.778 551 HD3 PRO 107 HD1 PRO 107 1.924 -1.452 9.842 552 H TRP 108 HN TRP 108 5.657 -5.118 9.868 553 HA TRP 108 HA TRP 108 7.545 -6.019 10.496 554 HB2 TRP 108 HB2 TRP 108 8.356 -3.589 12.121 555 HB3 TRP 108 HB1 TRP 108 9.404 -4.703 11.254 556 HD1 TRP 108 HD1 TRP 108 9.025 -4.525 8.447 557 HE1 TRP 108 HE1 TRP 108 8.746 -2.349 7.038 558 HE3 TRP 108 HE3 TRP 108 7.690 -1.413 12.158 559 HZ2 TRP 108 HZ2 TRP 108 7.976 0.396 7.550 560 HZ3 TRP 108 HZ3 TRP 108 7.186 0.917 11.699 561 HH2 TRP 108 HH2 TRP 108 7.267 1.817 9.570 562 H GLY 109 HN GLY 109 5.148 -5.642 12.295 563 HA2 GLY 109 HA2 GLY 109 4.255 -6.482 14.243 564 HA3 GLY 109 HA1 GLY 109 5.752 -7.375 14.441 565 H ASN 110 HN ASN 110 5.633 -3.742 14.465 566 HA ASN 110 HA ASN 110 6.614 -3.950 17.154 567 HB2 ASN 110 HB2 ASN 110 6.336 -1.443 15.505 568 HB3 ASN 110 HB1 ASN 110 7.279 -1.661 16.968 569 HD21 ASN 110 HD21 ASN 110 7.125 -1.918 13.674 570 HD22 ASN 110 HD22 ASN 110 8.720 -2.455 13.338 571 HA PRO 111 HA PRO 111 2.690 -2.436 18.736 572 HB2 PRO 111 HB2 PRO 111 3.616 -2.048 21.286 573 HB3 PRO 111 HB1 PRO 111 2.999 -3.598 20.711 574 HG2 PRO 111 HG2 PRO 111 5.799 -2.678 21.074 575 HG3 PRO 111 HG1 PRO 111 5.109 -4.292 21.320 576 HD2 PRO 111 HD2 PRO 111 6.587 -3.599 19.147 577 HD3 PRO 111 HD1 PRO 111 5.333 -4.852 19.110 578 H TYR 112 HN TYR 112 2.031 -0.344 19.290 579 HA TYR 112 HA TYR 112 3.816 1.671 18.402 580 HB2 TYR 112 HB2 TYR 112 0.968 1.707 19.313 581 HB3 TYR 112 HB1 TYR 112 1.854 3.224 19.227 582 HD1 TYR 112 HD2 TYR 112 2.632 4.083 17.087 583 HD2 TYR 112 HD1 TYR 112 0.305 0.530 17.282 584 HE1 TYR 112 HE2 TYR 112 2.210 4.243 14.673 585 HE2 TYR 112 HE1 TYR 112 -0.128 0.684 14.855 586 HH TYR 112 HH TYR 112 -0.063 2.222 12.985 587 H GLN 113 HN GLN 113 4.686 3.363 19.440 588 HA GLN 113 HA GLN 113 5.109 2.905 22.323 589 HB2 GLN 113 HB2 GLN 113 6.689 5.052 21.073 590 HB3 GLN 113 HB1 GLN 113 7.226 3.773 22.135 591 HG2 GLN 113 HG2 GLN 113 6.885 3.642 19.149 592 HG3 GLN 113 HG1 GLN 113 8.397 3.806 20.009 593 HE21 GLN 113 HE21 GLN 113 7.646 1.785 22.039 594 HE22 GLN 113 HE22 GLN 113 7.726 0.277 21.207 595 H TYR 114 HN TYR 114 3.872 4.119 23.482 596 HA TYR 114 HA TYR 114 2.972 6.661 22.405 597 HB2 TYR 114 HB2 TYR 114 1.209 6.292 24.372 598 HB3 TYR 114 HB1 TYR 114 0.966 5.659 22.755 599 HD1 TYR 114 HD1 TYR 114 2.641 4.531 25.949 600 HD2 TYR 114 HD2 TYR 114 0.160 3.510 22.651 601 HE1 TYR 114 HE1 TYR 114 2.331 2.256 26.860 602 HE2 TYR 114 HE2 TYR 114 -0.146 1.258 23.574 603 HH TYR 114 HH TYR 114 0.814 -0.238 25.003 604 H LEU 115 HN LEU 115 3.785 8.396 23.207 605 HA LEU 115 HA LEU 115 4.521 8.429 26.014 606 HB2 LEU 115 HB2 LEU 115 6.035 9.599 23.683 607 HB3 LEU 115 HB1 LEU 115 6.353 10.059 25.345 608 HG LEU 115 HG LEU 115 6.744 7.299 24.161 609 HD11 LEU 115 HD11 LEU 115 8.748 9.412 24.949 610 HD12 LEU 115 HD12 LEU 115 8.343 8.942 23.299 611 HD13 LEU 115 HD13 LEU 115 9.126 7.786 24.379 612 HD21 LEU 115 HD21 LEU 115 6.206 7.194 26.534 613 HD22 LEU 115 HD22 LEU 115 7.424 8.420 26.881 614 HD23 LEU 115 HD23 LEU 115 7.916 6.838 26.284 615 H ALA 116 HN ALA 116 4.383 10.592 26.947 616 HA ALA 116 HA ALA 116 2.399 12.103 25.511 617 HB1 ALA 116 HB1 ALA 116 2.568 11.851 28.502 618 HB2 ALA 116 HB2 ALA 116 1.712 10.678 27.516 619 HB3 ALA 116 HB3 ALA 116 1.183 12.350 27.522 620 HA PRO 117 HA PRO 117 4.631 15.802 25.721 621 HB2 PRO 117 HB2 PRO 117 3.998 17.461 27.767 622 HB3 PRO 117 HB1 PRO 117 3.107 17.310 26.270 623 HG2 PRO 117 HG2 PRO 117 2.509 16.031 28.906 624 HG3 PRO 117 HG1 PRO 117 1.387 16.748 27.733 625 HD2 PRO 117 HD2 PRO 117 1.773 14.086 27.925 626 HD3 PRO 117 HD1 PRO 117 1.439 14.846 26.347 627 H GLY 118 HN GLY 118 6.543 15.717 25.871 628 HA2 GLY 118 HA2 GLY 118 7.809 15.081 28.402 629 HA3 GLY 118 HA1 GLY 118 8.588 15.143 26.815 630 H THR 119 HN THR 119 9.229 17.029 25.991 631 HA THR 119 HA THR 119 9.378 19.194 27.959 632 HB THR 119 HB THR 119 11.307 19.037 25.709 633 HG1 THR 119 HG1 THR 119 11.548 16.981 26.380 634 HG21 THR 119 HG21 THR 119 11.357 20.881 27.336 635 HG22 THR 119 HG22 THR 119 12.826 19.915 27.438 636 HG23 THR 119 HG23 THR 119 11.559 19.721 28.649 637 H LYS 120 HN LYS 120 7.702 20.449 27.321 638 HA LYS 120 HA LYS 120 6.598 22.072 26.229 639 HB2 LYS 120 HB2 LYS 120 8.927 22.111 24.304 640 HB3 LYS 120 HB1 LYS 120 7.728 23.378 24.508 641 HG2 LYS 120 HG2 LYS 120 9.741 22.467 26.545 642 HG3 LYS 120 HG1 LYS 120 9.809 23.965 25.619 643 HD2 LYS 120 HD2 LYS 120 7.706 24.705 26.675 644 HD3 LYS 120 HD1 LYS 120 7.662 23.213 27.605 645 HE2 LYS 120 HE2 LYS 120 9.764 23.804 28.694 646 HE3 LYS 120 HE1 LYS 120 9.829 25.296 27.755 647 HZ1 LYS 120 HZ1 LYS 120 7.725 24.576 29.715 648 HZ2 LYS 120 HZ2 LYS 120 7.782 26.007 28.821 649 HZ3 LYS 120 HZ3 LYS 120 8.962 25.687 29.977 650 H GLY 121 HN GLY 121 6.643 19.118 25.152 651 HA2 GLY 121 HA2 GLY 121 5.151 19.797 22.724 652 HA3 GLY 121 HA1 GLY 121 6.231 18.394 22.821 653 HA PRO 122 HA PRO 122 1.584 18.355 24.987 654 HB2 PRO 122 HB2 PRO 122 0.862 18.005 22.118 655 HB3 PRO 122 HB1 PRO 122 -0.134 18.579 23.462 656 HG2 PRO 122 HG2 PRO 122 0.961 20.352 21.892 657 HG3 PRO 122 HG1 PRO 122 1.077 20.588 23.648 658 HD2 PRO 122 HD2 PRO 122 3.169 19.682 21.717 659 HD3 PRO 122 HD1 PRO 122 3.326 20.702 23.161 660 H PHE 123 HN PHE 123 3.131 16.215 22.597 661 HA PHE 123 HA PHE 123 2.913 13.949 24.122 662 HB2 PHE 123 HB2 PHE 123 1.192 12.544 23.055 663 HB3 PHE 123 HB1 PHE 123 0.449 13.969 23.748 664 HD1 PHE 123 HD2 PHE 123 -0.493 15.720 22.260 665 HD2 PHE 123 HD1 PHE 123 1.159 12.111 20.705 666 HE1 PHE 123 HE2 PHE 123 -1.618 16.124 20.118 667 HE2 PHE 123 HE1 PHE 123 0.024 12.510 18.565 668 HZ PHE 123 HZ PHE 123 -1.364 14.517 18.266 669 H ASP 124 HN ASP 124 3.458 11.903 22.860 670 HA ASP 124 HA ASP 124 4.684 12.460 20.258 671 HB2 ASP 124 HB2 ASP 124 6.100 11.190 22.618 672 HB3 ASP 124 HB1 ASP 124 6.644 11.042 20.948 673 H LEU 125 HN LEU 125 3.711 10.969 18.919 674 HA LEU 125 HA LEU 125 3.349 8.295 20.060 675 HB2 LEU 125 HB2 LEU 125 1.351 10.070 19.136 676 HB3 LEU 125 HB1 LEU 125 1.473 8.772 17.967 677 HG LEU 125 HG LEU 125 -0.230 8.287 19.556 678 HD11 LEU 125 HD11 LEU 125 2.180 6.526 20.016 679 HD12 LEU 125 HD12 LEU 125 1.038 6.409 18.686 680 HD13 LEU 125 HD13 LEU 125 0.501 6.080 20.335 681 HD21 LEU 125 HD21 LEU 125 0.254 7.930 21.937 682 HD22 LEU 125 HD22 LEU 125 0.514 9.602 21.432 683 HD23 LEU 125 HD23 LEU 125 1.895 8.531 21.680 684 H TYR 126 HN TYR 126 4.363 6.727 18.942 685 HA TYR 126 HA TYR 126 4.625 6.797 16.101 686 HB2 TYR 126 HB2 TYR 126 7.081 6.936 16.018 687 HB3 TYR 126 HB1 TYR 126 6.385 8.408 16.676 688 HD1 TYR 126 HD1 TYR 126 6.392 8.658 19.249 689 HD2 TYR 126 HD2 TYR 126 8.788 5.819 17.171 690 HE1 TYR 126 HE1 TYR 126 7.890 8.515 21.181 691 HE2 TYR 126 HE2 TYR 126 10.291 5.668 19.088 692 HH TYR 126 HH TYR 126 10.902 7.229 21.012 693 H SER 127 HN SER 127 5.844 4.887 15.357 694 HA SER 127 HA SER 127 6.240 2.873 17.439 695 HB2 SER 127 HB2 SER 127 4.226 2.389 15.981 696 HB3 SER 127 HB1 SER 127 5.331 2.307 14.610 697 HG SER 127 HG SER 127 5.659 0.340 15.140 698 H LEU 128 HN LEU 128 7.965 1.454 16.985 699 HA LEU 128 HA LEU 128 10.259 2.723 15.894 700 HB2 LEU 128 HB2 LEU 128 9.747 -0.114 16.718 701 HB3 LEU 128 HB1 LEU 128 11.328 0.469 16.233 702 HG LEU 128 HG LEU 128 9.736 1.405 18.627 703 HD11 LEU 128 HD11 LEU 128 10.657 -0.823 18.922 704 HD12 LEU 128 HD12 LEU 128 11.513 0.339 19.935 705 HD13 LEU 128 HD13 LEU 128 12.253 -0.244 18.446 706 HD21 LEU 128 HD21 LEU 128 12.491 2.219 17.684 707 HD22 LEU 128 HD22 LEU 128 11.775 2.657 19.230 708 HD23 LEU 128 HD23 LEU 128 11.056 3.245 17.736 709 H GLY 129 HN GLY 129 11.033 2.754 13.859 710 HA2 GLY 129 HA2 GLY 129 9.643 1.530 11.680 711 HA3 GLY 129 HA1 GLY 129 11.194 2.334 11.567 712 H ALA 130 HN ALA 130 11.190 0.449 9.982 713 HA ALA 130 HA ALA 130 11.313 -2.208 10.757 714 HB1 ALA 130 HB1 ALA 130 11.038 -1.411 8.465 715 HB2 ALA 130 HB2 ALA 130 12.262 -2.672 8.625 716 HB3 ALA 130 HB3 ALA 130 12.751 -0.987 8.428 717 H ASP 131 HN ASP 131 13.738 0.130 11.327 718 HA ASP 131 HA ASP 131 15.859 -1.896 11.521 719 HB2 ASP 131 HB2 ASP 131 16.301 0.347 10.479 720 HB3 ASP 131 HB1 ASP 131 16.024 1.086 12.050 721 H GLY 132 HN GLY 132 13.457 -0.587 13.403 722 HA2 GLY 132 HA2 GLY 132 12.905 -0.994 15.599 723 HA3 GLY 132 HA1 GLY 132 14.446 -1.811 15.798 724 H LYS 133 HN LYS 133 14.804 1.222 14.445 725 HA LYS 133 HA LYS 133 15.354 2.400 17.043 726 HB2 LYS 133 HB2 LYS 133 17.083 2.550 14.566 727 HB3 LYS 133 HB1 LYS 133 17.291 3.604 15.947 728 HG2 LYS 133 HG2 LYS 133 17.437 0.611 16.233 729 HG3 LYS 133 HG1 LYS 133 18.824 1.549 15.699 730 HD2 LYS 133 HD2 LYS 133 18.925 1.083 18.118 731 HD3 LYS 133 HD1 LYS 133 18.794 2.809 17.809 732 HE2 LYS 133 HE2 LYS 133 16.519 2.824 18.433 733 HE3 LYS 133 HE1 LYS 133 16.438 1.054 18.515 734 HZ1 LYS 133 HZ1 LYS 133 17.988 2.874 20.269 735 HZ2 LYS 133 HZ2 LYS 133 17.898 1.187 20.438 736 HZ3 LYS 133 HZ3 LYS 133 16.524 2.128 20.638 737 H GLU 134 HN GLU 134 15.077 4.583 17.229 738 HA GLU 134 HA GLU 134 13.209 5.653 15.327 739 HB2 GLU 134 HB2 GLU 134 12.857 7.429 17.050 740 HB3 GLU 134 HB1 GLU 134 12.574 5.819 17.655 741 HG2 GLU 134 HG2 GLU 134 15.160 7.285 18.124 742 HG3 GLU 134 HG1 GLU 134 13.783 7.441 19.196 743 H GLY 135 HN GLY 135 14.095 6.558 13.638 744 HA2 GLY 135 HA2 GLY 135 16.164 8.549 13.931 745 HA3 GLY 135 HA1 GLY 135 16.589 7.126 12.990 746 H GLY 136 HN GLY 136 16.831 9.030 11.398 747 HA2 GLY 136 HA2 GLY 136 14.235 9.537 10.146 748 HA3 GLY 136 HA1 GLY 136 15.690 10.517 9.901 749 H SER 137 HN SER 137 13.837 8.602 8.304 750 HA SER 137 HA SER 137 15.512 7.660 6.333 751 HB2 SER 137 HB2 SER 137 14.822 5.685 8.536 752 HB3 SER 137 HB1 SER 137 15.180 5.127 6.894 753 HG SER 137 HG SER 137 16.935 6.811 8.298 754 H ASP 138 HN ASP 138 14.028 5.780 5.177 755 HA ASP 138 HA ASP 138 11.355 6.942 5.061 756 HB2 ASP 138 HB2 ASP 138 12.606 4.665 3.506 757 HB3 ASP 138 HB1 ASP 138 10.966 5.248 3.272 758 H ASN 139 HN ASN 139 12.331 3.566 5.149 759 HA ASN 139 HA ASN 139 9.920 3.039 6.742 760 HB2 ASN 139 HB2 ASN 139 10.054 0.748 5.982 761 HB3 ASN 139 HB1 ASN 139 10.206 1.812 4.590 762 HD21 ASN 139 HD21 ASN 139 11.719 -0.497 6.571 763 HD22 ASN 139 HD22 ASN 139 13.171 -0.702 5.646 764 H ASP 140 HN ASP 140 13.301 3.117 6.938 765 HA ASP 140 HA ASP 140 13.477 1.337 9.217 766 HB2 ASP 140 HB2 ASP 140 15.530 3.178 7.978 767 HB3 ASP 140 HB1 ASP 140 15.867 2.086 9.313 768 H ALA 141 HN ALA 141 12.477 4.360 8.718 769 HA ALA 141 HA ALA 141 13.418 5.598 11.173 770 HB1 ALA 141 HB1 ALA 141 12.069 7.487 10.453 771 HB2 ALA 141 HB2 ALA 141 11.478 6.537 9.087 772 HB3 ALA 141 HB3 ALA 141 13.183 6.973 9.188 773 H ASP 142 HN ASP 142 11.885 6.370 12.718 774 HA ASP 142 HA ASP 142 9.872 4.412 13.245 775 HB2 ASP 142 HB2 ASP 142 9.478 5.726 15.279 776 HB3 ASP 142 HB1 ASP 142 11.192 5.385 15.099 777 H ILE 143 HN ILE 143 7.767 4.680 12.926 778 HA ILE 143 HA ILE 143 7.053 7.070 11.488 779 HB ILE 143 HB ILE 143 4.946 5.758 10.815 780 HG12 ILE 143 HG12 ILE 143 5.423 3.234 10.599 781 HG13 ILE 143 HG11 ILE 143 6.633 3.465 11.847 782 HG21 ILE 143 HG21 ILE 143 6.089 4.662 8.955 783 HG22 ILE 143 HG22 ILE 143 7.631 4.964 9.762 784 HG23 ILE 143 HG23 ILE 143 6.626 6.317 9.240 785 HD11 ILE 143 HD11 ILE 143 3.695 4.041 12.158 786 HD12 ILE 143 HD12 ILE 143 4.934 4.135 13.409 787 HD13 ILE 143 HD13 ILE 143 4.522 2.576 12.688 788 H GLY 144 HN GLY 144 5.974 8.601 12.380 789 HA2 GLY 144 HA2 GLY 144 3.825 8.078 14.122 790 HA3 GLY 144 HA1 GLY 144 5.273 8.504 15.013 791 H ASN 145 HN ASN 145 3.147 9.957 15.256 792 HA ASN 145 HA ASN 145 4.050 12.434 14.203 793 HB2 ASN 145 HB2 ASN 145 1.781 13.219 13.506 794 HB3 ASN 145 HB1 ASN 145 2.430 11.936 12.502 795 HD21 ASN 145 HD21 ASN 145 0.986 11.046 15.596 796 HD22 ASN 145 HD22 ASN 145 -0.447 10.386 14.874 797 H TRP 146 HN TRP 146 3.351 14.188 15.407 798 HA TRP 146 HA TRP 146 1.755 13.837 17.685 799 HB2 TRP 146 HB2 TRP 146 3.507 14.190 19.361 800 HB3 TRP 146 HB1 TRP 146 3.667 12.660 18.518 801 HD1 TRP 146 HD1 TRP 146 5.280 16.191 18.447 802 HE1 TRP 146 HE1 TRP 146 7.731 15.923 17.798 803 HE3 TRP 146 HE3 TRP 146 5.287 11.203 17.664 804 HZ2 TRP 146 HZ2 TRP 146 9.482 13.812 17.064 805 HZ3 TRP 146 HZ3 TRP 146 7.400 10.094 17.005 806 HH2 TRP 146 HH2 TRP 146 9.453 11.389 16.703 807 H ASP 147 HN ASP 147 2.340 15.785 19.174 808 HA ASP 147 HA ASP 147 2.689 18.092 17.408 809 HB2 ASP 147 HB2 ASP 147 0.323 17.809 18.198 810 HB3 ASP 147 HB1 ASP 147 0.910 17.942 19.854 811 H ASN 148 HN ASN 148 4.446 19.200 17.970 812 HA ASN 148 HA ASN 148 5.120 19.416 20.756 813 HB2 ASN 148 HB2 ASN 148 7.476 18.949 20.438 814 HB3 ASN 148 HB1 ASN 148 6.580 17.597 19.777 815 HD21 ASN 148 HD21 ASN 148 8.780 20.133 19.149 816 HD22 ASN 148 HD22 ASN 148 9.089 19.766 17.486 Start of MODEL 16 1 H1 MET 39 HT1 MET 39 3.048 5.375 -0.629 2 H2 MET 39 HT2 MET 39 3.376 6.053 -2.131 3 H3 MET 39 HT3 MET 39 3.974 6.781 -0.742 4 HA MET 39 HA MET 39 5.682 5.613 -1.919 5 HB2 MET 39 HB2 MET 39 5.032 4.038 0.587 6 HB3 MET 39 HB1 MET 39 6.590 4.387 -0.160 7 HG2 MET 39 HG2 MET 39 6.433 5.665 1.819 8 HG3 MET 39 HG1 MET 39 6.315 6.749 0.437 9 HE1 MET 39 HE1 MET 39 4.115 8.383 3.252 10 HE2 MET 39 HE2 MET 39 5.470 8.624 2.152 11 HE3 MET 39 HE3 MET 39 5.590 7.440 3.452 12 H SER 40 HN SER 40 5.418 4.310 -3.697 13 HA SER 40 HA SER 40 3.954 1.836 -3.223 14 HB2 SER 40 HB2 SER 40 2.950 3.364 -4.918 15 HB3 SER 40 HB1 SER 40 4.416 3.207 -5.883 16 HG SER 40 HG SER 40 2.495 1.228 -5.245 17 H ARG 41 HN ARG 41 5.824 0.968 -2.290 18 HA ARG 41 HA ARG 41 7.347 -0.590 -4.149 19 HB2 ARG 41 HB2 ARG 41 8.733 1.347 -2.266 20 HB3 ARG 41 HB1 ARG 41 9.505 -0.134 -2.793 21 HG2 ARG 41 HG2 ARG 41 9.249 0.662 -5.142 22 HG3 ARG 41 HG1 ARG 41 8.663 2.193 -4.493 23 HD2 ARG 41 HD2 ARG 41 10.756 2.514 -3.304 24 HD3 ARG 41 HD1 ARG 41 11.334 0.947 -3.858 25 HE ARG 41 HE ARG 41 10.685 2.332 -6.127 26 HH11 ARG 41 HH11 ARG 41 12.990 2.802 -3.456 27 HH12 ARG 41 HH12 ARG 41 14.080 3.692 -4.408 28 HH21 ARG 41 HH21 ARG 41 12.210 3.533 -7.391 29 HH22 ARG 41 HH22 ARG 41 13.641 4.110 -6.679 30 HA PRO 42 HA PRO 42 6.793 -3.643 -0.930 31 HB2 PRO 42 HB2 PRO 42 9.712 -4.204 -1.259 32 HB3 PRO 42 HB1 PRO 42 8.350 -5.335 -1.272 33 HG2 PRO 42 HG2 PRO 42 9.520 -4.668 -3.548 34 HG3 PRO 42 HG1 PRO 42 7.754 -4.789 -3.457 35 HD2 PRO 42 HD2 PRO 42 9.484 -2.354 -3.487 36 HD3 PRO 42 HD1 PRO 42 7.913 -2.633 -4.273 37 H ASP 43 HN ASP 43 6.931 -3.608 1.203 38 HA ASP 43 HA ASP 43 7.377 -3.133 3.334 39 HB2 ASP 43 HB2 ASP 43 9.924 -3.479 2.595 40 HB3 ASP 43 HB1 ASP 43 9.924 -1.717 2.791 41 H GLN 44 HN GLN 44 8.165 -0.620 1.068 42 HA GLN 44 HA GLN 44 7.396 1.539 2.743 43 HB2 GLN 44 HB2 GLN 44 7.447 1.298 -0.257 44 HB3 GLN 44 HB1 GLN 44 7.026 2.760 0.621 45 HG2 GLN 44 HG2 GLN 44 9.247 2.795 1.642 46 HG3 GLN 44 HG1 GLN 44 9.670 1.331 0.751 47 HE21 GLN 44 HE21 GLN 44 11.360 2.402 -0.279 48 HE22 GLN 44 HE22 GLN 44 11.094 3.561 -1.531 49 H ALA 45 HN ALA 45 5.717 -0.788 0.941 50 HA ALA 45 HA ALA 45 3.147 0.353 0.878 51 HB1 ALA 45 HB1 ALA 45 2.359 -1.936 0.580 52 HB2 ALA 45 HB2 ALA 45 3.933 -2.544 1.091 53 HB3 ALA 45 HB3 ALA 45 3.789 -1.634 -0.412 54 H LYS 46 HN LYS 46 5.081 -0.793 3.445 55 HA LYS 46 HA LYS 46 2.833 -1.193 5.247 56 HB2 LYS 46 HB2 LYS 46 5.820 -1.314 5.687 57 HB3 LYS 46 HB1 LYS 46 4.608 -1.715 6.888 58 HG2 LYS 46 HG2 LYS 46 3.866 -3.590 5.534 59 HG3 LYS 46 HG1 LYS 46 5.037 -3.162 4.288 60 HD2 LYS 46 HD2 LYS 46 6.874 -3.553 5.815 61 HD3 LYS 46 HD1 LYS 46 5.751 -3.851 7.137 62 HE2 LYS 46 HE2 LYS 46 5.991 -5.530 4.640 63 HE3 LYS 46 HE1 LYS 46 6.675 -5.896 6.229 64 HZ1 LYS 46 HZ1 LYS 46 4.520 -6.041 7.157 65 HZ2 LYS 46 HZ2 LYS 46 4.584 -7.061 5.837 66 HZ3 LYS 46 HZ3 LYS 46 3.759 -5.591 5.729 67 H VAL 47 HN VAL 47 5.170 1.182 4.253 68 HA VAL 47 HA VAL 47 5.094 2.843 6.585 69 HB VAL 47 HB VAL 47 5.796 3.563 3.706 70 HG11 VAL 47 HG11 VAL 47 5.216 5.555 4.966 71 HG12 VAL 47 HG12 VAL 47 6.952 5.518 4.644 72 HG13 VAL 47 HG13 VAL 47 6.344 5.101 6.243 73 HG21 VAL 47 HG21 VAL 47 8.083 3.459 4.347 74 HG22 VAL 47 HG22 VAL 47 7.366 1.868 4.685 75 HG23 VAL 47 HG23 VAL 47 7.683 3.023 5.992 76 H THR 48 HN THR 48 3.517 2.762 3.464 77 HA THR 48 HA THR 48 2.027 5.122 3.761 78 HB THR 48 HB THR 48 2.598 4.078 1.573 79 HG1 THR 48 HG1 THR 48 0.284 5.239 2.167 80 HG21 THR 48 HG21 THR 48 0.474 2.067 2.277 81 HG22 THR 48 HG22 THR 48 2.204 1.760 2.152 82 HG23 THR 48 HG23 THR 48 1.281 2.206 0.713 83 H VAL 49 HN VAL 49 1.563 2.026 5.124 84 HA VAL 49 HA VAL 49 -1.265 2.358 5.670 85 HB VAL 49 HB VAL 49 0.761 0.361 6.760 86 HG11 VAL 49 HG11 VAL 49 -2.249 0.369 7.073 87 HG12 VAL 49 HG12 VAL 49 -1.078 0.693 8.352 88 HG13 VAL 49 HG13 VAL 49 -1.156 -0.904 7.618 89 HG21 VAL 49 HG21 VAL 49 -0.380 -1.250 5.324 90 HG22 VAL 49 HG22 VAL 49 0.318 0.076 4.392 91 HG23 VAL 49 HG23 VAL 49 -1.416 0.035 4.707 92 H ALA 50 HN ALA 50 1.768 2.322 7.453 93 HA ALA 50 HA ALA 50 0.798 2.899 9.979 94 HB1 ALA 50 HB1 ALA 50 3.030 2.019 9.470 95 HB2 ALA 50 HB2 ALA 50 3.030 3.411 10.560 96 HB3 ALA 50 HB3 ALA 50 3.474 3.629 8.869 97 H LYS 51 HN LYS 51 1.663 5.087 7.357 98 HA LYS 51 HA LYS 51 1.826 7.432 8.902 99 HB2 LYS 51 HB2 LYS 51 0.941 7.236 6.007 100 HB3 LYS 51 HB1 LYS 51 1.558 8.676 6.790 101 HG2 LYS 51 HG2 LYS 51 3.144 6.147 6.359 102 HG3 LYS 51 HG1 LYS 51 3.164 7.527 5.275 103 HD2 LYS 51 HD2 LYS 51 3.933 7.700 8.188 104 HD3 LYS 51 HD1 LYS 51 5.088 7.361 6.899 105 HE2 LYS 51 HE2 LYS 51 4.422 9.474 5.809 106 HE3 LYS 51 HE1 LYS 51 3.370 9.819 7.177 107 HZ1 LYS 51 HZ1 LYS 51 6.313 9.479 7.288 108 HZ2 LYS 51 HZ2 LYS 51 5.338 9.802 8.613 109 HZ3 LYS 51 HZ3 LYS 51 5.481 10.941 7.371 110 H GLY 52 HN GLY 52 -0.840 5.615 7.668 111 HA2 GLY 52 HA2 GLY 52 -2.792 7.712 8.109 112 HA3 GLY 52 HA1 GLY 52 -3.113 6.082 7.517 113 H ASP 53 HN ASP 53 -1.464 4.959 9.696 114 HA ASP 53 HA ASP 53 -3.661 4.689 11.534 115 HB2 ASP 53 HB2 ASP 53 -0.922 3.425 11.599 116 HB3 ASP 53 HB1 ASP 53 -2.219 3.058 12.734 117 H ILE 54 HN ILE 54 -0.516 6.158 11.552 118 HA ILE 54 HA ILE 54 -0.647 6.971 14.252 119 HB ILE 54 HB ILE 54 1.084 8.641 13.680 120 HG12 ILE 54 HG12 ILE 54 0.683 7.667 10.841 121 HG13 ILE 54 HG11 ILE 54 0.233 9.250 11.447 122 HG21 ILE 54 HG21 ILE 54 2.778 7.058 12.913 123 HG22 ILE 54 HG22 ILE 54 1.502 5.900 12.516 124 HG23 ILE 54 HG23 ILE 54 1.759 6.400 14.195 125 HD11 ILE 54 HD11 ILE 54 3.014 8.155 11.244 126 HD12 ILE 54 HD12 ILE 54 2.576 9.764 11.843 127 HD13 ILE 54 HD13 ILE 54 2.264 9.325 10.156 128 H LYS 55 HN LYS 55 -1.876 8.323 11.251 129 HA LYS 55 HA LYS 55 -2.685 10.817 12.294 130 HB2 LYS 55 HB2 LYS 55 -2.683 9.594 9.801 131 HB3 LYS 55 HB1 LYS 55 -4.388 9.737 10.195 132 HG2 LYS 55 HG2 LYS 55 -3.725 11.683 8.977 133 HG3 LYS 55 HG1 LYS 55 -4.050 12.137 10.651 134 HD2 LYS 55 HD2 LYS 55 -2.003 13.242 10.047 135 HD3 LYS 55 HD1 LYS 55 -1.597 11.863 11.079 136 HE2 LYS 55 HE2 LYS 55 -0.961 10.530 9.196 137 HE3 LYS 55 HE1 LYS 55 -1.468 11.799 8.080 138 HZ1 LYS 55 HZ1 LYS 55 0.274 13.203 8.924 139 HZ2 LYS 55 HZ2 LYS 55 0.939 11.745 8.446 140 HZ3 LYS 55 HZ3 LYS 55 0.725 12.075 10.074 141 H ALA 56 HN ALA 56 -4.043 7.646 12.296 142 HA ALA 56 HA ALA 56 -6.672 8.267 13.107 143 HB1 ALA 56 HB1 ALA 56 -6.023 6.083 12.165 144 HB2 ALA 56 HB2 ALA 56 -6.768 5.900 13.756 145 HB3 ALA 56 HB3 ALA 56 -5.019 5.794 13.588 146 H ILE 57 HN ILE 57 -3.729 7.389 14.820 147 HA ILE 57 HA ILE 57 -4.814 7.479 17.415 148 HB ILE 57 HB ILE 57 -1.920 7.910 16.609 149 HG12 ILE 57 HG12 ILE 57 -3.259 5.436 17.566 150 HG13 ILE 57 HG11 ILE 57 -3.092 5.775 15.838 151 HG21 ILE 57 HG21 ILE 57 -3.234 7.102 19.215 152 HG22 ILE 57 HG22 ILE 57 -2.363 8.609 18.904 153 HG23 ILE 57 HG23 ILE 57 -1.498 7.063 18.919 154 HD11 ILE 57 HD11 ILE 57 -0.821 5.448 17.816 155 HD12 ILE 57 HD12 ILE 57 -0.682 5.755 16.083 156 HD13 ILE 57 HD13 ILE 57 -1.384 4.249 16.647 157 H ALA 58 HN ALA 58 -3.331 9.876 15.342 158 HA ALA 58 HA ALA 58 -3.032 11.948 17.217 159 HB1 ALA 58 HB1 ALA 58 -2.970 13.462 15.322 160 HB2 ALA 58 HB2 ALA 58 -3.621 12.199 14.273 161 HB3 ALA 58 HB3 ALA 58 -2.020 12.013 14.998 162 H ALA 59 HN ALA 59 -5.837 10.741 15.608 163 HA ALA 59 HA ALA 59 -7.464 13.028 16.327 164 HB1 ALA 59 HB1 ALA 59 -7.870 11.867 14.202 165 HB2 ALA 59 HB2 ALA 59 -9.280 11.794 15.260 166 HB3 ALA 59 HB3 ALA 59 -8.232 10.385 15.086 167 H ALA 60 HN ALA 60 -6.794 9.767 17.365 168 HA ALA 60 HA ALA 60 -8.972 9.738 19.217 169 HB1 ALA 60 HB1 ALA 60 -8.239 7.499 19.771 170 HB2 ALA 60 HB2 ALA 60 -6.738 7.759 18.898 171 HB3 ALA 60 HB3 ALA 60 -8.269 7.718 18.022 172 H LEU 61 HN LEU 61 -5.532 10.430 19.435 173 HA LEU 61 HA LEU 61 -5.341 10.441 22.294 174 HB2 LEU 61 HB2 LEU 61 -3.513 10.437 20.397 175 HB3 LEU 61 HB1 LEU 61 -3.788 12.160 20.364 176 HG LEU 61 HG LEU 61 -1.773 11.347 21.626 177 HD11 LEU 61 HD11 LEU 61 -2.615 13.587 21.959 178 HD12 LEU 61 HD12 LEU 61 -2.044 12.911 23.486 179 HD13 LEU 61 HD13 LEU 61 -3.773 12.991 23.147 180 HD21 LEU 61 HD21 LEU 61 -2.807 9.432 22.731 181 HD22 LEU 61 HD22 LEU 61 -3.814 10.549 23.675 182 HD23 LEU 61 HD23 LEU 61 -2.069 10.547 23.886 183 H ASP 62 HN ASP 62 -6.431 12.604 19.883 184 HA ASP 62 HA ASP 62 -6.891 14.866 21.550 185 HB2 ASP 62 HB2 ASP 62 -6.661 15.078 19.122 186 HB3 ASP 62 HB1 ASP 62 -8.049 14.039 18.875 187 H MET 63 HN MET 63 -8.500 11.897 20.984 188 HA MET 63 HA MET 63 -11.018 12.775 22.100 189 HB2 MET 63 HB2 MET 63 -10.067 9.970 21.448 190 HB3 MET 63 HB1 MET 63 -11.702 10.389 21.941 191 HG2 MET 63 HG2 MET 63 -12.051 11.630 19.930 192 HG3 MET 63 HG1 MET 63 -10.363 11.432 19.461 193 HE1 MET 63 HE1 MET 63 -10.976 10.530 17.090 194 HE2 MET 63 HE2 MET 63 -12.682 10.796 17.455 195 HE3 MET 63 HE3 MET 63 -12.152 9.249 16.795 196 H TYR 64 HN TYR 64 -8.112 11.108 23.180 197 HA TYR 64 HA TYR 64 -9.018 10.565 25.865 198 HB2 TYR 64 HB2 TYR 64 -6.888 9.630 24.897 199 HB3 TYR 64 HB1 TYR 64 -6.195 11.251 24.980 200 HD1 TYR 64 HD1 TYR 64 -5.706 12.285 27.169 201 HD2 TYR 64 HD2 TYR 64 -7.235 8.302 26.981 202 HE1 TYR 64 HE1 TYR 64 -5.089 11.904 29.471 203 HE2 TYR 64 HE2 TYR 64 -6.627 7.944 29.166 204 HH TYR 64 HH TYR 64 -5.214 8.753 30.721 205 H LYS 65 HN LYS 65 -7.548 13.290 24.178 206 HA LYS 65 HA LYS 65 -7.256 15.112 26.209 207 HB2 LYS 65 HB2 LYS 65 -6.439 15.605 24.023 208 HB3 LYS 65 HB1 LYS 65 -8.042 15.472 23.326 209 HG2 LYS 65 HG2 LYS 65 -8.724 17.487 24.374 210 HG3 LYS 65 HG1 LYS 65 -7.175 17.646 25.227 211 HD2 LYS 65 HD2 LYS 65 -6.031 17.796 23.050 212 HD3 LYS 65 HD1 LYS 65 -7.580 17.646 22.228 213 HE2 LYS 65 HE2 LYS 65 -8.327 19.741 23.241 214 HE3 LYS 65 HE1 LYS 65 -6.791 19.879 24.093 215 HZ1 LYS 65 HZ1 LYS 65 -7.080 19.829 21.136 216 HZ2 LYS 65 HZ2 LYS 65 -5.652 20.095 21.994 217 HZ3 LYS 65 HZ3 LYS 65 -6.898 21.223 22.052 218 H LEU 66 HN LEU 66 -10.172 14.227 24.419 219 HA LEU 66 HA LEU 66 -11.926 15.978 25.862 220 HB2 LEU 66 HB2 LEU 66 -12.304 13.698 24.010 221 HB3 LEU 66 HB1 LEU 66 -13.641 14.117 25.029 222 HG LEU 66 HG LEU 66 -13.810 15.110 22.831 223 HD11 LEU 66 HD11 LEU 66 -14.278 17.421 23.502 224 HD12 LEU 66 HD12 LEU 66 -13.377 17.165 24.993 225 HD13 LEU 66 HD13 LEU 66 -14.859 16.258 24.691 226 HD21 LEU 66 HD21 LEU 66 -11.311 16.618 23.555 227 HD22 LEU 66 HD22 LEU 66 -12.350 16.971 22.178 228 HD23 LEU 66 HD23 LEU 66 -11.495 15.428 22.263 229 H ASP 67 HN ASP 67 -10.827 12.705 26.272 230 HA ASP 67 HA ASP 67 -12.860 11.736 28.032 231 HB2 ASP 67 HB2 ASP 67 -11.321 10.428 26.539 232 HB3 ASP 67 HB1 ASP 67 -10.007 10.851 27.620 233 H ASN 68 HN ASN 68 -9.790 13.380 28.490 234 HA ASN 68 HA ASN 68 -10.315 13.634 31.424 235 HB2 ASN 68 HB2 ASN 68 -7.686 13.029 30.108 236 HB3 ASN 68 HB1 ASN 68 -7.948 13.711 31.727 237 HD21 ASN 68 HD21 ASN 68 -8.628 10.901 29.728 238 HD22 ASN 68 HD22 ASN 68 -8.804 9.785 31.008 239 H PHE 69 HN PHE 69 -10.820 15.266 29.101 240 HA PHE 69 HA PHE 69 -10.635 17.470 28.458 241 HB2 PHE 69 HB2 PHE 69 -10.970 19.006 30.481 242 HB3 PHE 69 HB1 PHE 69 -12.174 17.755 30.203 243 HD1 PHE 69 HD1 PHE 69 -9.280 18.637 32.202 244 HD2 PHE 69 HD2 PHE 69 -12.550 16.138 31.789 245 HE1 PHE 69 HE1 PHE 69 -8.959 17.945 34.534 246 HE2 PHE 69 HE2 PHE 69 -12.329 15.345 34.078 247 HZ PHE 69 HZ PHE 69 -10.495 16.253 35.512 248 H ALA 70 HN ALA 70 -8.069 16.297 28.555 249 HA ALA 70 HA ALA 70 -6.272 18.422 28.498 250 HB1 ALA 70 HB1 ALA 70 -6.269 16.753 31.015 251 HB2 ALA 70 HB2 ALA 70 -6.671 18.447 30.929 252 HB3 ALA 70 HB3 ALA 70 -5.005 17.919 30.583 253 H TYR 71 HN TYR 71 -4.134 17.542 28.054 254 HA TYR 71 HA TYR 71 -4.193 14.881 27.012 255 HB2 TYR 71 HB2 TYR 71 -2.053 16.986 27.146 256 HB3 TYR 71 HB1 TYR 71 -1.696 15.362 26.583 257 HD1 TYR 71 HD1 TYR 71 -3.895 14.609 24.887 258 HD2 TYR 71 HD2 TYR 71 -2.090 18.434 25.422 259 HE1 TYR 71 HE1 TYR 71 -4.586 15.205 22.695 260 HE2 TYR 71 HE2 TYR 71 -2.784 19.064 23.170 261 HH TYR 71 HH TYR 71 -3.346 17.980 21.090 262 HA PRO 72 HA PRO 72 -2.607 12.539 30.417 263 HB2 PRO 72 HB2 PRO 72 -0.832 10.924 29.014 264 HB3 PRO 72 HB1 PRO 72 -2.581 10.647 29.087 265 HG2 PRO 72 HG2 PRO 72 -0.899 11.905 26.972 266 HG3 PRO 72 HG1 PRO 72 -2.286 10.822 26.812 267 HD2 PRO 72 HD2 PRO 72 -2.479 13.446 26.407 268 HD3 PRO 72 HD1 PRO 72 -3.797 12.496 27.112 269 H SER 73 HN SER 73 -0.443 12.059 31.649 270 HA SER 73 HA SER 73 1.572 14.039 30.886 271 HB2 SER 73 HB2 SER 73 2.529 13.522 33.151 272 HB3 SER 73 HB1 SER 73 0.884 14.124 33.243 273 HG SER 73 HG SER 73 0.216 12.337 33.930 274 H THR 74 HN THR 74 3.870 13.237 30.821 275 HA THR 74 HA THR 74 3.835 10.907 29.220 276 HB THR 74 HB THR 74 5.484 12.995 29.196 277 HG1 THR 74 HG1 THR 74 6.111 11.894 27.570 278 HG21 THR 74 HG21 THR 74 7.044 10.932 30.788 279 HG22 THR 74 HG22 THR 74 6.530 12.504 31.380 280 HG23 THR 74 HG23 THR 74 7.721 12.403 30.080 281 H GLN 75 HN GLN 75 4.054 11.288 32.563 282 HA GLN 75 HA GLN 75 4.978 8.545 32.807 283 HB2 GLN 75 HB2 GLN 75 4.636 10.716 34.850 284 HB3 GLN 75 HB1 GLN 75 5.067 9.053 35.270 285 HG2 GLN 75 HG2 GLN 75 7.084 9.254 33.903 286 HG3 GLN 75 HG1 GLN 75 6.646 10.907 33.493 287 HE21 GLN 75 HE21 GLN 75 5.683 11.489 36.217 288 HE22 GLN 75 HE22 GLN 75 7.099 11.645 37.177 289 H GLN 76 HN GLN 76 2.280 10.543 34.258 290 HA GLN 76 HA GLN 76 0.905 8.091 35.048 291 HB2 GLN 76 HB2 GLN 76 0.026 10.971 35.181 292 HB3 GLN 76 HB1 GLN 76 -0.802 9.599 35.898 293 HG2 GLN 76 HG2 GLN 76 1.103 9.240 37.381 294 HG3 GLN 76 HG1 GLN 76 1.915 10.633 36.663 295 HE21 GLN 76 HE21 GLN 76 -0.676 9.564 38.696 296 HE22 GLN 76 HE22 GLN 76 -1.065 11.108 39.350 297 H GLY 77 HN GLY 77 0.568 10.535 32.601 298 HA2 GLY 77 HA2 GLY 77 -1.904 9.413 31.776 299 HA3 GLY 77 HA1 GLY 77 -0.975 10.572 30.861 300 H LEU 78 HN LEU 78 1.404 8.637 31.088 301 HA LEU 78 HA LEU 78 1.003 7.269 28.626 302 HB2 LEU 78 HB2 LEU 78 3.235 7.925 29.719 303 HB3 LEU 78 HB1 LEU 78 3.021 6.552 30.772 304 HG LEU 78 HG LEU 78 3.306 6.347 27.768 305 HD11 LEU 78 HD11 LEU 78 5.360 5.967 29.925 306 HD12 LEU 78 HD12 LEU 78 5.292 7.288 28.756 307 HD13 LEU 78 HD13 LEU 78 5.580 5.638 28.204 308 HD21 LEU 78 HD21 LEU 78 2.202 4.395 28.801 309 HD22 LEU 78 HD22 LEU 78 3.552 4.236 29.924 310 HD23 LEU 78 HD23 LEU 78 3.807 3.985 28.196 311 H GLU 79 HN GLU 79 1.068 6.251 31.977 312 HA GLU 79 HA GLU 79 0.171 3.639 31.405 313 HB2 GLU 79 HB2 GLU 79 0.302 5.180 33.971 314 HB3 GLU 79 HB1 GLU 79 -0.272 3.521 33.866 315 HG2 GLU 79 HG2 GLU 79 1.883 2.878 32.875 316 HG3 GLU 79 HG1 GLU 79 2.454 4.528 33.136 317 H ALA 80 HN ALA 80 -1.395 6.644 31.852 318 HA ALA 80 HA ALA 80 -3.984 5.466 32.283 319 HB1 ALA 80 HB1 ALA 80 -3.397 8.259 31.429 320 HB2 ALA 80 HB2 ALA 80 -3.246 7.744 33.105 321 HB3 ALA 80 HB3 ALA 80 -4.831 7.676 32.263 322 H LEU 81 HN LEU 81 -2.021 5.790 29.673 323 HA LEU 81 HA LEU 81 -4.171 5.830 27.703 324 HB2 LEU 81 HB2 LEU 81 -1.186 5.674 27.510 325 HB3 LEU 81 HB1 LEU 81 -2.224 5.464 26.125 326 HG LEU 81 HG LEU 81 -1.999 7.967 27.814 327 HD11 LEU 81 HD11 LEU 81 -0.901 8.937 25.853 328 HD12 LEU 81 HD12 LEU 81 -0.967 7.376 25.040 329 HD13 LEU 81 HD13 LEU 81 0.010 7.574 26.494 330 HD21 LEU 81 HD21 LEU 81 -4.231 7.751 26.863 331 HD22 LEU 81 HD22 LEU 81 -3.541 7.437 25.272 332 HD23 LEU 81 HD23 LEU 81 -3.337 9.016 26.024 333 H VAL 82 HN VAL 82 -2.018 3.660 29.298 334 HA VAL 82 HA VAL 82 -2.889 1.439 27.579 335 HB VAL 82 HB VAL 82 -0.798 1.369 29.772 336 HG11 VAL 82 HG11 VAL 82 -1.305 -0.514 27.473 337 HG12 VAL 82 HG12 VAL 82 -1.675 -0.827 29.167 338 HG13 VAL 82 HG13 VAL 82 0.005 -0.646 28.648 339 HG21 VAL 82 HG21 VAL 82 -0.432 1.806 26.807 340 HG22 VAL 82 HG22 VAL 82 0.872 1.566 27.970 341 HG23 VAL 82 HG23 VAL 82 -0.159 2.993 28.074 342 H LYS 83 HN LYS 83 -3.154 2.602 30.832 343 HA LYS 83 HA LYS 83 -4.918 0.406 31.662 344 HB2 LYS 83 HB2 LYS 83 -2.800 0.398 32.902 345 HB3 LYS 83 HB1 LYS 83 -2.908 2.130 33.119 346 HG2 LYS 83 HG2 LYS 83 -4.851 1.781 34.615 347 HG3 LYS 83 HG1 LYS 83 -4.637 0.037 34.437 348 HD2 LYS 83 HD2 LYS 83 -3.573 0.808 36.504 349 HD3 LYS 83 HD1 LYS 83 -2.360 0.226 35.369 350 HE2 LYS 83 HE2 LYS 83 -1.885 2.578 34.712 351 HE3 LYS 83 HE1 LYS 83 -3.073 3.127 35.889 352 HZ1 LYS 83 HZ1 LYS 83 -0.546 1.671 36.482 353 HZ2 LYS 83 HZ2 LYS 83 -1.682 2.110 37.630 354 HZ3 LYS 83 HZ3 LYS 83 -0.847 3.296 36.792 355 H LYS 84 HN LYS 84 -6.793 1.242 32.844 356 HA LYS 84 HA LYS 84 -7.873 3.620 31.853 357 HB2 LYS 84 HB2 LYS 84 -8.629 1.999 34.281 358 HB3 LYS 84 HB1 LYS 84 -9.459 3.494 33.910 359 HG2 LYS 84 HG2 LYS 84 -10.794 1.719 33.078 360 HG3 LYS 84 HG1 LYS 84 -10.069 2.515 31.690 361 HD2 LYS 84 HD2 LYS 84 -10.009 0.133 31.356 362 HD3 LYS 84 HD1 LYS 84 -8.363 0.706 31.618 363 HE2 LYS 84 HE2 LYS 84 -8.409 -0.074 33.895 364 HE3 LYS 84 HE1 LYS 84 -10.114 -0.502 33.748 365 HZ1 LYS 84 HZ1 LYS 84 -8.716 -2.442 33.527 366 HZ2 LYS 84 HZ2 LYS 84 -7.866 -1.748 32.256 367 HZ3 LYS 84 HZ3 LYS 84 -9.488 -2.138 32.066 368 HA PRO 85 HA PRO 85 -5.865 6.948 33.789 369 HB2 PRO 85 HB2 PRO 85 -8.615 8.196 33.954 370 HB3 PRO 85 HB1 PRO 85 -7.141 8.836 33.202 371 HG2 PRO 85 HG2 PRO 85 -9.063 7.912 31.740 372 HG3 PRO 85 HG1 PRO 85 -7.376 7.528 31.352 373 HD2 PRO 85 HD2 PRO 85 -9.439 5.827 32.683 374 HD3 PRO 85 HD1 PRO 85 -8.266 5.424 31.409 375 H THR 86 HN THR 86 -5.274 7.552 35.765 376 HA THR 86 HA THR 86 -6.501 6.106 37.921 377 HB THR 86 HB THR 86 -4.088 5.990 37.757 378 HG1 THR 86 HG1 THR 86 -5.323 6.449 39.910 379 HG21 THR 86 HG21 THR 86 -2.645 7.977 38.132 380 HG22 THR 86 HG22 THR 86 -4.085 8.997 38.107 381 HG23 THR 86 HG23 THR 86 -3.607 8.110 36.663 382 H GLY 87 HN GLY 87 -6.470 9.300 36.736 383 HA2 GLY 87 HA2 GLY 87 -7.498 10.427 39.197 384 HA3 GLY 87 HA1 GLY 87 -7.309 11.275 37.666 385 H ASN 88 HN ASN 88 -9.396 12.101 37.636 386 HA ASN 88 HA ASN 88 -11.427 10.048 37.249 387 HB2 ASN 88 HB2 ASN 88 -11.717 12.836 38.348 388 HB3 ASN 88 HB1 ASN 88 -13.081 11.834 37.880 389 HD21 ASN 88 HD21 ASN 88 -12.327 12.929 40.468 390 HD22 ASN 88 HD22 ASN 88 -12.206 11.582 41.543 391 HA PRO 89 HA PRO 89 -11.328 12.067 33.198 392 HB2 PRO 89 HB2 PRO 89 -11.972 9.869 31.761 393 HB3 PRO 89 HB1 PRO 89 -10.325 10.151 32.279 394 HG2 PRO 89 HG2 PRO 89 -12.399 8.366 33.481 395 HG3 PRO 89 HG1 PRO 89 -10.671 8.056 33.250 396 HD2 PRO 89 HD2 PRO 89 -11.777 8.811 35.633 397 HD3 PRO 89 HD1 PRO 89 -10.097 9.161 35.188 398 H GLN 90 HN GLN 90 -13.183 12.261 31.703 399 HA GLN 90 HA GLN 90 -15.616 12.364 33.293 400 HB2 GLN 90 HB2 GLN 90 -15.013 13.388 30.515 401 HB3 GLN 90 HB1 GLN 90 -16.538 13.627 31.356 402 HG2 GLN 90 HG2 GLN 90 -13.848 14.657 32.190 403 HG3 GLN 90 HG1 GLN 90 -15.184 15.609 31.531 404 HE21 GLN 90 HE21 GLN 90 -13.893 14.019 34.325 405 HE22 GLN 90 HE22 GLN 90 -15.042 14.614 35.447 406 HA PRO 91 HA PRO 91 -17.534 8.751 31.648 407 HB2 PRO 91 HB2 PRO 91 -19.886 10.339 30.760 408 HB3 PRO 91 HB1 PRO 91 -19.829 8.941 31.836 409 HG2 PRO 91 HG2 PRO 91 -20.244 11.381 32.818 410 HG3 PRO 91 HG1 PRO 91 -19.225 10.216 33.679 411 HD2 PRO 91 HD2 PRO 91 -18.422 12.564 32.018 412 HD3 PRO 91 HD1 PRO 91 -17.722 11.962 33.534 413 H LYS 92 HN LYS 92 -16.236 8.375 29.968 414 HA LYS 92 HA LYS 92 -17.332 8.689 27.353 415 HB2 LYS 92 HB2 LYS 92 -15.808 10.690 27.657 416 HB3 LYS 92 HB1 LYS 92 -14.491 9.578 28.002 417 HG2 LYS 92 HG2 LYS 92 -14.685 8.637 25.759 418 HG3 LYS 92 HG1 LYS 92 -16.011 9.768 25.404 419 HD2 LYS 92 HD2 LYS 92 -14.486 11.600 25.628 420 HD3 LYS 92 HD1 LYS 92 -13.194 10.489 26.102 421 HE2 LYS 92 HE2 LYS 92 -14.626 10.582 23.453 422 HE3 LYS 92 HE1 LYS 92 -12.953 11.025 23.762 423 HZ1 LYS 92 HZ1 LYS 92 -14.130 8.293 23.979 424 HZ2 LYS 92 HZ2 LYS 92 -12.583 8.623 24.463 425 HZ3 LYS 92 HZ3 LYS 92 -13.016 8.778 22.839 426 H ASN 93 HN ASN 93 -16.538 6.973 26.062 427 HA ASN 93 HA ASN 93 -15.626 4.744 27.618 428 HB2 ASN 93 HB2 ASN 93 -16.283 4.971 24.673 429 HB3 ASN 93 HB1 ASN 93 -15.716 3.484 25.418 430 HD21 ASN 93 HD21 ASN 93 -18.387 5.684 25.083 431 HD22 ASN 93 HD22 ASN 93 -19.558 4.691 25.859 432 H TRP 94 HN TRP 94 -13.582 5.252 28.329 433 HA TRP 94 HA TRP 94 -11.400 6.110 26.962 434 HB2 TRP 94 HB2 TRP 94 -11.510 5.929 29.387 435 HB3 TRP 94 HB1 TRP 94 -11.622 4.177 29.277 436 HD1 TRP 94 HD1 TRP 94 -9.083 7.064 29.092 437 HE1 TRP 94 HE1 TRP 94 -6.712 6.005 29.173 438 HE3 TRP 94 HE3 TRP 94 -10.293 2.098 28.755 439 HZ2 TRP 94 HZ2 TRP 94 -5.549 3.510 29.114 440 HZ3 TRP 94 HZ3 TRP 94 -8.481 0.448 28.797 441 HH2 TRP 94 HH2 TRP 94 -6.158 1.143 28.970 442 H ASN 95 HN ASN 95 -9.706 5.134 25.948 443 HA ASN 95 HA ASN 95 -10.159 2.442 24.954 444 HB2 ASN 95 HB2 ASN 95 -10.631 3.989 23.168 445 HB3 ASN 95 HB1 ASN 95 -9.151 4.874 23.531 446 HD21 ASN 95 HD21 ASN 95 -9.436 1.307 23.226 447 HD22 ASN 95 HD22 ASN 95 -8.342 1.298 21.886 448 H LYS 96 HN LYS 96 -8.323 1.129 25.068 449 HA LYS 96 HA LYS 96 -5.991 2.177 26.419 450 HB2 LYS 96 HB2 LYS 96 -5.241 -0.085 26.620 451 HB3 LYS 96 HB1 LYS 96 -6.952 -0.055 27.003 452 HG2 LYS 96 HG2 LYS 96 -7.448 -0.930 24.740 453 HG3 LYS 96 HG1 LYS 96 -5.706 -0.921 24.421 454 HD2 LYS 96 HD2 LYS 96 -5.305 -2.546 26.123 455 HD3 LYS 96 HD1 LYS 96 -6.981 -2.476 26.665 456 HE2 LYS 96 HE2 LYS 96 -6.057 -3.432 23.957 457 HE3 LYS 96 HE1 LYS 96 -6.478 -4.477 25.307 458 HZ1 LYS 96 HZ1 LYS 96 -8.326 -4.278 23.789 459 HZ2 LYS 96 HZ2 LYS 96 -8.338 -2.612 23.909 460 HZ3 LYS 96 HZ3 LYS 96 -8.726 -3.561 25.255 461 H ASP 97 HN ASP 97 -3.897 1.289 25.662 462 HA ASP 97 HA ASP 97 -2.193 0.975 24.298 463 HB2 ASP 97 HB2 ASP 97 -3.757 -0.669 23.117 464 HB3 ASP 97 HB1 ASP 97 -4.068 0.614 21.955 465 H GLY 98 HN GLY 98 -3.733 3.524 24.596 466 HA2 GLY 98 HA2 GLY 98 -2.361 5.560 24.329 467 HA3 GLY 98 HA1 GLY 98 -1.879 4.915 22.784 468 H TYR 99 HN TYR 99 -5.135 4.435 23.414 469 HA TYR 99 HA TYR 99 -6.934 5.088 22.357 470 HB2 TYR 99 HB2 TYR 99 -5.814 7.533 23.398 471 HB3 TYR 99 HB1 TYR 99 -6.551 7.902 21.830 472 HD1 TYR 99 HD2 TYR 99 -6.993 6.898 25.290 473 HD2 TYR 99 HD1 TYR 99 -8.946 7.685 21.609 474 HE1 TYR 99 HE2 TYR 99 -9.125 7.101 26.463 475 HE2 TYR 99 HE1 TYR 99 -11.071 7.893 22.767 476 HH TYR 99 HH TYR 99 -11.277 7.866 26.237 477 H LEU 100 HN LEU 100 -6.661 3.880 20.657 478 HA LEU 100 HA LEU 100 -5.600 5.035 18.185 479 HB2 LEU 100 HB2 LEU 100 -4.001 3.455 19.497 480 HB3 LEU 100 HB1 LEU 100 -5.150 2.193 19.162 481 HG LEU 100 HG LEU 100 -3.637 3.700 17.018 482 HD11 LEU 100 HD11 LEU 100 -2.072 2.551 18.439 483 HD12 LEU 100 HD12 LEU 100 -2.193 1.730 16.883 484 HD13 LEU 100 HD13 LEU 100 -2.995 1.056 18.300 485 HD21 LEU 100 HD21 LEU 100 -4.194 1.791 15.600 486 HD22 LEU 100 HD22 LEU 100 -5.638 2.613 16.190 487 HD23 LEU 100 HD23 LEU 100 -5.136 1.085 16.918 488 H LYS 101 HN LYS 101 -6.800 4.140 16.386 489 HA LYS 101 HA LYS 101 -9.515 3.480 16.951 490 HB2 LYS 101 HB2 LYS 101 -7.971 3.297 14.359 491 HB3 LYS 101 HB1 LYS 101 -9.721 3.226 14.506 492 HG2 LYS 101 HG2 LYS 101 -8.048 5.580 15.353 493 HG3 LYS 101 HG1 LYS 101 -8.833 5.429 13.778 494 HD2 LYS 101 HD2 LYS 101 -10.322 5.242 16.368 495 HD3 LYS 101 HD1 LYS 101 -10.067 6.797 15.549 496 HE2 LYS 101 HE2 LYS 101 -11.515 4.358 14.514 497 HE3 LYS 101 HE1 LYS 101 -12.247 5.875 15.020 498 HZ1 LYS 101 HZ1 LYS 101 -10.456 5.518 12.650 499 HZ2 LYS 101 HZ2 LYS 101 -11.088 6.977 13.166 500 HZ3 LYS 101 HZ3 LYS 101 -12.118 5.768 12.641 501 H LYS 102 HN LYS 102 -10.428 1.483 15.497 502 HA LYS 102 HA LYS 102 -9.216 -0.772 16.755 503 HB2 LYS 102 HB2 LYS 102 -11.166 -2.090 15.631 504 HB3 LYS 102 HB1 LYS 102 -11.554 -0.942 16.901 505 HG2 LYS 102 HG2 LYS 102 -13.189 -0.712 15.287 506 HG3 LYS 102 HG1 LYS 102 -12.102 0.632 14.969 507 HD2 LYS 102 HD2 LYS 102 -11.144 -0.460 13.122 508 HD3 LYS 102 HD1 LYS 102 -11.910 -1.990 13.552 509 HE2 LYS 102 HE2 LYS 102 -14.070 -0.959 13.244 510 HE3 LYS 102 HE1 LYS 102 -13.292 0.526 12.688 511 HZ1 LYS 102 HZ1 LYS 102 -13.140 -2.149 11.404 512 HZ2 LYS 102 HZ2 LYS 102 -12.271 -0.813 10.887 513 HZ3 LYS 102 HZ3 LYS 102 -13.960 -0.811 10.796 514 H LEU 103 HN LEU 103 -7.346 -0.100 15.521 515 HA LEU 103 HA LEU 103 -6.983 -1.627 13.041 516 HB2 LEU 103 HB2 LEU 103 -5.567 0.865 14.000 517 HB3 LEU 103 HB1 LEU 103 -5.251 0.027 12.495 518 HG LEU 103 HG LEU 103 -7.867 1.364 13.177 519 HD11 LEU 103 HD11 LEU 103 -7.155 3.101 11.611 520 HD12 LEU 103 HD12 LEU 103 -5.580 2.318 11.474 521 HD13 LEU 103 HD13 LEU 103 -6.091 3.004 13.013 522 HD21 LEU 103 HD21 LEU 103 -6.790 0.257 10.586 523 HD22 LEU 103 HD22 LEU 103 -8.315 1.117 10.785 524 HD23 LEU 103 HD23 LEU 103 -8.081 -0.451 11.557 525 HA PRO 104 HA PRO 104 -4.040 -3.889 15.487 526 HB2 PRO 104 HB2 PRO 104 -2.318 -4.365 13.194 527 HB3 PRO 104 HB1 PRO 104 -3.370 -5.501 14.037 528 HG2 PRO 104 HG2 PRO 104 -3.841 -4.598 11.509 529 HG3 PRO 104 HG1 PRO 104 -5.116 -5.134 12.611 530 HD2 PRO 104 HD2 PRO 104 -4.268 -2.365 11.888 531 HD3 PRO 104 HD1 PRO 104 -5.891 -3.015 12.196 532 H VAL 105 HN VAL 105 -1.510 -4.230 15.560 533 HA VAL 105 HA VAL 105 -0.385 -1.652 16.131 534 HB VAL 105 HB VAL 105 -0.142 -3.858 17.458 535 HG11 VAL 105 HG11 VAL 105 2.092 -4.370 15.523 536 HG12 VAL 105 HG12 VAL 105 0.619 -5.310 15.734 537 HG13 VAL 105 HG13 VAL 105 1.807 -5.235 17.034 538 HG21 VAL 105 HG21 VAL 105 0.966 -1.811 18.151 539 HG22 VAL 105 HG22 VAL 105 2.308 -2.127 17.060 540 HG23 VAL 105 HG23 VAL 105 1.979 -3.218 18.414 541 H ASP 106 HN ASP 106 2.246 -1.519 15.326 542 HA ASP 106 HA ASP 106 1.678 -1.131 12.557 543 HB2 ASP 106 HB2 ASP 106 3.826 0.157 12.525 544 HB3 ASP 106 HB1 ASP 106 2.663 0.723 13.718 545 HA PRO 107 HA PRO 107 4.063 -4.232 10.421 546 HB2 PRO 107 HB2 PRO 107 5.712 -2.614 8.978 547 HB3 PRO 107 HB1 PRO 107 4.102 -3.129 8.454 548 HG2 PRO 107 HG2 PRO 107 4.936 -0.550 9.746 549 HG3 PRO 107 HG1 PRO 107 3.753 -0.801 8.447 550 HD2 PRO 107 HD2 PRO 107 2.907 -0.357 10.883 551 HD3 PRO 107 HD1 PRO 107 2.150 -1.632 9.911 552 H TRP 108 HN TRP 108 6.254 -4.852 10.026 553 HA TRP 108 HA TRP 108 8.313 -5.379 10.617 554 HB2 TRP 108 HB2 TRP 108 8.657 -2.716 12.027 555 HB3 TRP 108 HB1 TRP 108 9.913 -3.726 11.327 556 HD1 TRP 108 HD1 TRP 108 9.634 -3.948 8.507 557 HE1 TRP 108 HE1 TRP 108 9.150 -2.018 6.845 558 HE3 TRP 108 HE3 TRP 108 7.634 -0.650 11.783 559 HZ2 TRP 108 HZ2 TRP 108 8.026 0.606 6.971 560 HZ3 TRP 108 HZ3 TRP 108 6.871 1.559 10.971 561 HH2 TRP 108 HH2 TRP 108 7.051 2.166 8.632 562 H GLY 109 HN GLY 109 5.916 -5.281 12.401 563 HA2 GLY 109 HA2 GLY 109 5.182 -6.103 14.366 564 HA3 GLY 109 HA1 GLY 109 6.757 -6.867 14.518 565 H ASN 110 HN ASN 110 6.498 -3.247 14.468 566 HA ASN 110 HA ASN 110 7.560 -3.398 17.100 567 HB2 ASN 110 HB2 ASN 110 6.714 -0.847 15.718 568 HB3 ASN 110 HB1 ASN 110 7.871 -1.035 17.019 569 HD21 ASN 110 HD21 ASN 110 7.278 -1.062 13.745 570 HD22 ASN 110 HD22 ASN 110 8.906 -1.189 13.168 571 HA PRO 111 HA PRO 111 3.592 -2.261 18.840 572 HB2 PRO 111 HB2 PRO 111 4.711 -1.746 21.392 573 HB3 PRO 111 HB1 PRO 111 3.954 -3.247 20.866 574 HG2 PRO 111 HG2 PRO 111 6.665 -2.927 21.499 575 HG3 PRO 111 HG1 PRO 111 5.953 -4.284 20.619 576 HD2 PRO 111 HD2 PRO 111 7.393 -1.897 19.571 577 HD3 PRO 111 HD1 PRO 111 7.358 -3.576 18.976 578 H TYR 112 HN TYR 112 2.610 -0.300 19.371 579 HA TYR 112 HA TYR 112 4.057 1.996 18.575 580 HB2 TYR 112 HB2 TYR 112 1.268 1.625 19.677 581 HB3 TYR 112 HB1 TYR 112 1.937 3.238 19.468 582 HD1 TYR 112 HD1 TYR 112 0.904 0.171 17.656 583 HD2 TYR 112 HD2 TYR 112 2.087 4.237 17.307 584 HE1 TYR 112 HE1 TYR 112 0.252 0.160 15.270 585 HE2 TYR 112 HE2 TYR 112 1.442 4.232 14.935 586 HH TYR 112 HH TYR 112 -0.376 1.747 13.463 587 H GLN 113 HN GLN 113 4.746 3.680 19.695 588 HA GLN 113 HA GLN 113 5.469 3.124 22.520 589 HB2 GLN 113 HB2 GLN 113 6.589 5.546 21.217 590 HB3 GLN 113 HB1 GLN 113 7.395 4.394 22.239 591 HG2 GLN 113 HG2 GLN 113 6.841 4.040 19.313 592 HG3 GLN 113 HG1 GLN 113 8.331 4.676 19.955 593 HE21 GLN 113 HE21 GLN 113 8.444 2.721 22.142 594 HE22 GLN 113 HE22 GLN 113 8.879 1.244 21.346 595 H TYR 114 HN TYR 114 4.308 4.189 23.945 596 HA TYR 114 HA TYR 114 2.570 6.395 23.081 597 HB2 TYR 114 HB2 TYR 114 2.535 5.387 25.878 598 HB3 TYR 114 HB1 TYR 114 1.202 5.844 24.842 599 HD1 TYR 114 HD1 TYR 114 3.548 3.121 25.689 600 HD2 TYR 114 HD2 TYR 114 -0.031 4.183 23.675 601 HE1 TYR 114 HE1 TYR 114 2.981 0.737 25.459 602 HE2 TYR 114 HE2 TYR 114 -0.594 1.799 23.440 603 HH TYR 114 HH TYR 114 0.254 -0.260 23.524 604 H LEU 115 HN LEU 115 3.580 8.385 23.400 605 HA LEU 115 HA LEU 115 4.622 8.762 26.066 606 HB2 LEU 115 HB2 LEU 115 5.748 9.856 23.513 607 HB3 LEU 115 HB1 LEU 115 6.121 10.573 25.072 608 HG LEU 115 HG LEU 115 6.856 7.793 24.127 609 HD11 LEU 115 HD11 LEU 115 8.545 10.227 24.681 610 HD12 LEU 115 HD12 LEU 115 8.122 9.621 23.087 611 HD13 LEU 115 HD13 LEU 115 9.137 8.650 24.159 612 HD21 LEU 115 HD21 LEU 115 6.431 7.807 26.541 613 HD22 LEU 115 HD22 LEU 115 7.499 9.200 26.728 614 HD23 LEU 115 HD23 LEU 115 8.156 7.649 26.209 615 H ALA 116 HN ALA 116 4.238 10.822 26.932 616 HA ALA 116 HA ALA 116 2.184 12.263 25.533 617 HB1 ALA 116 HB1 ALA 116 1.375 10.771 27.429 618 HB2 ALA 116 HB2 ALA 116 0.960 12.452 27.558 619 HB3 ALA 116 HB3 ALA 116 2.280 11.814 28.541 620 HA PRO 117 HA PRO 117 4.518 15.855 26.038 621 HB2 PRO 117 HB2 PRO 117 3.798 17.508 28.073 622 HB3 PRO 117 HB1 PRO 117 3.033 17.416 26.509 623 HG2 PRO 117 HG2 PRO 117 2.150 16.124 29.061 624 HG3 PRO 117 HG1 PRO 117 1.165 16.886 27.798 625 HD2 PRO 117 HD2 PRO 117 1.480 14.191 28.011 626 HD3 PRO 117 HD1 PRO 117 1.239 14.977 26.430 627 H GLY 118 HN GLY 118 6.479 15.663 26.395 628 HA2 GLY 118 HA2 GLY 118 7.354 14.880 29.070 629 HA3 GLY 118 HA1 GLY 118 8.247 14.646 27.564 630 H THR 119 HN THR 119 9.160 16.433 26.545 631 HA THR 119 HA THR 119 9.724 18.541 28.491 632 HB THR 119 HB THR 119 11.498 17.931 26.183 633 HG1 THR 119 HG1 THR 119 11.387 15.956 27.178 634 HG21 THR 119 HG21 THR 119 11.932 19.936 27.505 635 HG22 THR 119 HG22 THR 119 13.228 18.765 27.751 636 HG23 THR 119 HG23 THR 119 11.984 18.973 28.982 637 H LYS 120 HN LYS 120 8.160 19.888 27.888 638 HA LYS 120 HA LYS 120 7.242 21.702 26.883 639 HB2 LYS 120 HB2 LYS 120 9.563 21.693 24.951 640 HB3 LYS 120 HB1 LYS 120 8.590 23.066 25.445 641 HG2 LYS 120 HG2 LYS 120 10.558 21.537 27.131 642 HG3 LYS 120 HG1 LYS 120 10.786 23.159 26.486 643 HD2 LYS 120 HD2 LYS 120 8.941 23.981 27.895 644 HD3 LYS 120 HD1 LYS 120 8.679 22.347 28.510 645 HE2 LYS 120 HE2 LYS 120 10.980 22.346 29.399 646 HE3 LYS 120 HE1 LYS 120 11.172 24.013 28.860 647 HZ1 LYS 120 HZ1 LYS 120 9.387 24.650 30.384 648 HZ2 LYS 120 HZ2 LYS 120 10.617 23.854 31.218 649 HZ3 LYS 120 HZ3 LYS 120 9.204 23.041 30.855 650 H GLY 121 HN GLY 121 6.837 18.874 25.716 651 HA2 GLY 121 HA2 GLY 121 5.582 19.824 23.234 652 HA3 GLY 121 HA1 GLY 121 6.521 18.321 23.287 653 HA PRO 122 HA PRO 122 1.827 18.554 25.279 654 HB2 PRO 122 HB2 PRO 122 1.212 18.446 22.369 655 HB3 PRO 122 HB1 PRO 122 0.199 19.001 23.712 656 HG2 PRO 122 HG2 PRO 122 1.475 20.786 22.320 657 HG3 PRO 122 HG1 PRO 122 1.537 20.890 24.091 658 HD2 PRO 122 HD2 PRO 122 3.627 19.974 22.174 659 HD3 PRO 122 HD1 PRO 122 3.805 20.877 23.695 660 H PHE 123 HN PHE 123 3.331 16.492 22.808 661 HA PHE 123 HA PHE 123 2.973 14.171 24.184 662 HB2 PHE 123 HB2 PHE 123 1.234 12.881 22.967 663 HB3 PHE 123 HB1 PHE 123 0.535 14.236 23.820 664 HD1 PHE 123 HD1 PHE 123 -0.467 16.111 22.557 665 HD2 PHE 123 HD2 PHE 123 1.197 12.724 20.561 666 HE1 PHE 123 HE1 PHE 123 -1.654 16.730 20.510 667 HE2 PHE 123 HE2 PHE 123 0.004 13.353 18.510 668 HZ PHE 123 HZ PHE 123 -1.421 15.355 18.479 669 H ASP 124 HN ASP 124 3.660 12.253 23.049 670 HA ASP 124 HA ASP 124 4.894 12.758 20.441 671 HB2 ASP 124 HB2 ASP 124 6.252 11.603 22.895 672 HB3 ASP 124 HB1 ASP 124 6.835 11.285 21.264 673 H LEU 125 HN LEU 125 3.742 11.331 19.182 674 HA LEU 125 HA LEU 125 3.364 8.656 20.313 675 HB2 LEU 125 HB2 LEU 125 1.253 9.877 20.035 676 HB3 LEU 125 HB1 LEU 125 1.636 10.194 18.364 677 HG LEU 125 HG LEU 125 -0.115 8.478 18.790 678 HD11 LEU 125 HD11 LEU 125 2.278 7.584 17.197 679 HD12 LEU 125 HD12 LEU 125 0.918 8.549 16.617 680 HD13 LEU 125 HD13 LEU 125 0.674 6.869 17.092 681 HD21 LEU 125 HD21 LEU 125 0.862 7.364 20.715 682 HD22 LEU 125 HD22 LEU 125 2.212 6.799 19.729 683 HD23 LEU 125 HD23 LEU 125 0.584 6.201 19.418 684 H TYR 126 HN TYR 126 4.368 7.005 19.221 685 HA TYR 126 HA TYR 126 4.686 7.040 16.434 686 HB2 TYR 126 HB2 TYR 126 7.102 7.272 16.165 687 HB3 TYR 126 HB1 TYR 126 6.422 8.733 16.853 688 HD1 TYR 126 HD1 TYR 126 6.678 9.034 19.423 689 HD2 TYR 126 HD2 TYR 126 8.945 6.225 17.159 690 HE1 TYR 126 HE1 TYR 126 8.389 8.984 21.185 691 HE2 TYR 126 HE2 TYR 126 10.640 6.164 18.920 692 HH TYR 126 HH TYR 126 10.167 7.389 21.998 693 H SER 127 HN SER 127 5.959 5.238 15.636 694 HA SER 127 HA SER 127 6.662 3.218 17.639 695 HB2 SER 127 HB2 SER 127 5.619 2.832 14.843 696 HB3 SER 127 HB1 SER 127 6.209 1.551 15.898 697 HG SER 127 HG SER 127 4.210 1.484 16.263 698 H LEU 128 HN LEU 128 8.543 2.103 17.157 699 HA LEU 128 HA LEU 128 10.631 3.551 15.977 700 HB2 LEU 128 HB2 LEU 128 10.364 0.623 16.609 701 HB3 LEU 128 HB1 LEU 128 11.888 1.375 16.143 702 HG LEU 128 HG LEU 128 10.259 1.971 18.618 703 HD11 LEU 128 HD11 LEU 128 12.884 0.540 18.286 704 HD12 LEU 128 HD12 LEU 128 11.339 -0.194 18.721 705 HD13 LEU 128 HD13 LEU 128 12.116 0.942 19.821 706 HD21 LEU 128 HD21 LEU 128 11.425 3.971 17.863 707 HD22 LEU 128 HD22 LEU 128 12.933 3.066 17.734 708 HD23 LEU 128 HD23 LEU 128 12.194 3.327 19.313 709 H GLY 129 HN GLY 129 11.750 3.339 14.035 710 HA2 GLY 129 HA2 GLY 129 10.263 2.781 11.694 711 HA3 GLY 129 HA1 GLY 129 11.978 3.100 11.754 712 H ALA 130 HN ALA 130 11.728 1.581 9.894 713 HA ALA 130 HA ALA 130 11.002 -1.081 10.082 714 HB1 ALA 130 HB1 ALA 130 12.159 -1.406 8.001 715 HB2 ALA 130 HB2 ALA 130 13.050 0.098 8.234 716 HB3 ALA 130 HB3 ALA 130 11.303 0.138 7.987 717 H ASP 131 HN ASP 131 14.083 0.365 10.990 718 HA ASP 131 HA ASP 131 15.245 -2.299 11.300 719 HB2 ASP 131 HB2 ASP 131 16.578 -0.350 10.394 720 HB3 ASP 131 HB1 ASP 131 16.497 0.367 11.997 721 H GLY 132 HN GLY 132 13.237 -0.396 13.095 722 HA2 GLY 132 HA2 GLY 132 12.589 -0.546 15.306 723 HA3 GLY 132 HA1 GLY 132 13.857 -1.742 15.560 724 H LYS 133 HN LYS 133 14.495 1.323 14.146 725 HA LYS 133 HA LYS 133 15.937 2.184 16.556 726 HB2 LYS 133 HB2 LYS 133 17.434 1.271 14.771 727 HB3 LYS 133 HB1 LYS 133 16.782 2.454 13.655 728 HG2 LYS 133 HG2 LYS 133 18.924 3.190 14.432 729 HG3 LYS 133 HG1 LYS 133 17.683 4.250 15.106 730 HD2 LYS 133 HD2 LYS 133 17.758 2.965 17.201 731 HD3 LYS 133 HD1 LYS 133 19.025 1.953 16.510 732 HE2 LYS 133 HE2 LYS 133 20.481 3.897 16.296 733 HE3 LYS 133 HE1 LYS 133 19.203 4.927 16.941 734 HZ1 LYS 133 HZ1 LYS 133 20.785 4.390 18.644 735 HZ2 LYS 133 HZ2 LYS 133 20.613 2.753 18.384 736 HZ3 LYS 133 HZ3 LYS 133 19.324 3.639 19.022 737 H GLU 134 HN GLU 134 15.670 4.420 16.987 738 HA GLU 134 HA GLU 134 13.641 5.636 15.412 739 HB2 GLU 134 HB2 GLU 134 13.899 7.568 17.180 740 HB3 GLU 134 HB1 GLU 134 13.063 6.089 17.579 741 HG2 GLU 134 HG2 GLU 134 14.397 6.713 19.439 742 HG3 GLU 134 HG1 GLU 134 15.135 5.302 18.698 743 H GLY 135 HN GLY 135 13.945 6.620 13.694 744 HA2 GLY 135 HA2 GLY 135 16.125 8.518 13.420 745 HA3 GLY 135 HA1 GLY 135 16.202 7.125 12.357 746 H GLY 136 HN GLY 136 16.179 9.395 11.136 747 HA2 GLY 136 HA2 GLY 136 13.416 10.003 10.340 748 HA3 GLY 136 HA1 GLY 136 14.803 11.075 10.100 749 H SER 137 HN SER 137 12.794 9.485 8.327 750 HA SER 137 HA SER 137 14.319 8.910 6.094 751 HB2 SER 137 HB2 SER 137 13.789 6.621 7.975 752 HB3 SER 137 HB1 SER 137 13.943 6.311 6.235 753 HG SER 137 HG SER 137 15.842 7.729 7.743 754 H ASP 138 HN ASP 138 12.762 7.342 4.649 755 HA ASP 138 HA ASP 138 9.988 8.097 5.351 756 HB2 ASP 138 HB2 ASP 138 10.889 8.504 2.981 757 HB3 ASP 138 HB1 ASP 138 10.919 6.743 2.841 758 H ASN 139 HN ASN 139 11.871 5.301 4.496 759 HA ASN 139 HA ASN 139 9.678 3.578 5.311 760 HB2 ASN 139 HB2 ASN 139 11.290 3.181 3.320 761 HB3 ASN 139 HB1 ASN 139 12.430 2.708 4.579 762 HD21 ASN 139 HD21 ASN 139 10.310 1.377 6.263 763 HD22 ASN 139 HD22 ASN 139 9.978 -0.073 5.383 764 H ASP 140 HN ASP 140 12.914 4.426 6.405 765 HA ASP 140 HA ASP 140 12.567 2.568 8.644 766 HB2 ASP 140 HB2 ASP 140 14.764 3.143 7.113 767 HB3 ASP 140 HB1 ASP 140 15.069 4.077 8.579 768 H ALA 141 HN ALA 141 11.306 5.231 8.256 769 HA ALA 141 HA ALA 141 12.318 6.907 10.375 770 HB1 ALA 141 HB1 ALA 141 10.390 8.284 9.909 771 HB2 ALA 141 HB2 ALA 141 9.771 7.055 8.804 772 HB3 ALA 141 HB3 ALA 141 11.274 7.903 8.431 773 H ASP 142 HN ASP 142 11.112 7.412 12.205 774 HA ASP 142 HA ASP 142 9.643 5.222 13.330 775 HB2 ASP 142 HB2 ASP 142 9.769 8.094 14.301 776 HB3 ASP 142 HB1 ASP 142 9.266 6.689 15.218 777 H ILE 143 HN ILE 143 7.514 5.042 13.188 778 HA ILE 143 HA ILE 143 6.314 7.139 11.628 779 HB ILE 143 HB ILE 143 4.471 5.522 11.097 780 HG12 ILE 143 HG12 ILE 143 5.218 3.006 11.385 781 HG13 ILE 143 HG11 ILE 143 6.161 3.620 12.731 782 HG21 ILE 143 HG21 ILE 143 7.256 4.664 10.393 783 HG22 ILE 143 HG22 ILE 143 6.267 5.855 9.543 784 HG23 ILE 143 HG23 ILE 143 5.803 4.151 9.537 785 HD11 ILE 143 HD11 ILE 143 3.160 3.857 12.454 786 HD12 ILE 143 HD12 ILE 143 4.130 4.364 13.831 787 HD13 ILE 143 HD13 ILE 143 4.014 2.655 13.416 788 H GLY 144 HN GLY 144 5.365 8.617 12.586 789 HA2 GLY 144 HA2 GLY 144 3.406 8.180 14.532 790 HA3 GLY 144 HA1 GLY 144 4.934 8.668 15.255 791 H ASN 145 HN ASN 145 3.102 10.254 15.691 792 HA ASN 145 HA ASN 145 3.932 12.574 14.402 793 HB2 ASN 145 HB2 ASN 145 1.629 13.391 13.744 794 HB3 ASN 145 HB1 ASN 145 2.295 12.109 12.749 795 HD21 ASN 145 HD21 ASN 145 0.805 11.365 15.869 796 HD22 ASN 145 HD22 ASN 145 -0.587 10.615 15.153 797 H TRP 146 HN TRP 146 3.277 14.384 15.514 798 HA TRP 146 HA TRP 146 2.047 13.987 18.052 799 HB2 TRP 146 HB2 TRP 146 4.095 14.652 19.338 800 HB3 TRP 146 HB1 TRP 146 4.082 13.035 18.647 801 HD1 TRP 146 HD1 TRP 146 5.455 16.498 17.478 802 HE1 TRP 146 HE1 TRP 146 7.787 16.097 16.481 803 HE3 TRP 146 HE3 TRP 146 5.690 11.490 18.115 804 HZ2 TRP 146 HZ2 TRP 146 9.524 13.902 16.036 805 HZ3 TRP 146 HZ3 TRP 146 7.731 10.277 17.399 806 HH2 TRP 146 HH2 TRP 146 9.602 11.468 16.375 807 H ASP 147 HN ASP 147 2.591 16.001 19.457 808 HA ASP 147 HA ASP 147 2.611 18.325 17.697 809 HB2 ASP 147 HB2 ASP 147 0.289 17.875 18.520 810 HB3 ASP 147 HB1 ASP 147 0.885 18.073 20.167 811 H ASN 148 HN ASN 148 4.325 19.415 18.090 812 HA ASN 148 HA ASN 148 5.081 19.927 20.810 813 HB2 ASN 148 HB2 ASN 148 7.494 19.573 20.257 814 HB3 ASN 148 HB1 ASN 148 6.547 18.099 20.167 815 HD21 ASN 148 HD21 ASN 148 9.114 18.775 18.983 816 HD22 ASN 148 HD22 ASN 148 8.931 18.521 17.287 Start of MODEL 17 1 H1 MET 39 HT1 MET 39 2.453 5.721 0.785 2 H2 MET 39 HT2 MET 39 2.470 6.246 -0.799 3 H3 MET 39 HT3 MET 39 2.937 7.307 0.425 4 HA MET 39 HA MET 39 4.829 6.547 -0.779 5 HB2 MET 39 HB2 MET 39 4.725 6.559 1.935 6 HB3 MET 39 HB1 MET 39 4.976 4.846 1.717 7 HG2 MET 39 HG2 MET 39 7.041 5.263 0.538 8 HG3 MET 39 HG1 MET 39 6.786 6.998 0.714 9 HE1 MET 39 HE1 MET 39 9.462 5.651 1.744 10 HE2 MET 39 HE2 MET 39 9.639 6.422 3.318 11 HE3 MET 39 HE3 MET 39 9.105 7.369 1.929 12 H SER 40 HN SER 40 4.415 5.236 -2.547 13 HA SER 40 HA SER 40 3.628 2.492 -1.979 14 HB2 SER 40 HB2 SER 40 3.276 4.067 -4.521 15 HB3 SER 40 HB1 SER 40 2.697 2.426 -4.225 16 HG SER 40 HG SER 40 1.602 4.775 -3.553 17 H ARG 41 HN ARG 41 5.631 1.716 -1.567 18 HA ARG 41 HA ARG 41 6.999 0.635 -3.836 19 HB2 ARG 41 HB2 ARG 41 8.510 2.230 -1.701 20 HB3 ARG 41 HB1 ARG 41 9.279 1.170 -2.864 21 HG2 ARG 41 HG2 ARG 41 8.516 2.655 -4.679 22 HG3 ARG 41 HG1 ARG 41 7.792 3.719 -3.480 23 HD2 ARG 41 HD2 ARG 41 10.032 4.037 -2.467 24 HD3 ARG 41 HD1 ARG 41 10.723 3.051 -3.756 25 HE ARG 41 HE ARG 41 9.239 5.059 -4.948 26 HH11 ARG 41 HH11 ARG 41 12.209 4.796 -3.057 27 HH12 ARG 41 HH12 ARG 41 12.860 6.260 -3.616 28 HH21 ARG 41 HH21 ARG 41 10.142 7.040 -5.743 29 HH22 ARG 41 HH22 ARG 41 11.672 7.564 -5.209 30 HA PRO 42 HA PRO 42 6.871 -2.819 -0.981 31 HB2 PRO 42 HB2 PRO 42 9.500 -3.768 -1.237 32 HB3 PRO 42 HB1 PRO 42 8.137 -4.261 -2.243 33 HG2 PRO 42 HG2 PRO 42 10.252 -2.238 -2.772 34 HG3 PRO 42 HG1 PRO 42 9.485 -3.368 -3.902 35 HD2 PRO 42 HD2 PRO 42 8.825 -0.784 -3.897 36 HD3 PRO 42 HD1 PRO 42 7.581 -2.032 -4.123 37 H ASP 43 HN ASP 43 7.290 -3.114 1.150 38 HA ASP 43 HA ASP 43 7.935 -2.760 3.270 39 HB2 ASP 43 HB2 ASP 43 10.392 -1.371 2.145 40 HB3 ASP 43 HB1 ASP 43 10.135 -1.715 3.848 41 H GLN 44 HN GLN 44 8.123 -0.043 1.164 42 HA GLN 44 HA GLN 44 7.442 1.831 3.204 43 HB2 GLN 44 HB2 GLN 44 7.406 2.032 0.209 44 HB3 GLN 44 HB1 GLN 44 7.115 3.379 1.307 45 HG2 GLN 44 HG2 GLN 44 9.313 3.149 2.264 46 HG3 GLN 44 HG1 GLN 44 9.620 1.721 1.284 47 HE21 GLN 44 HE21 GLN 44 11.405 2.635 0.419 48 HE22 GLN 44 HE22 GLN 44 11.366 3.887 -0.757 49 H ALA 45 HN ALA 45 5.811 -0.398 1.346 50 HA ALA 45 HA ALA 45 3.224 0.607 1.181 51 HB1 ALA 45 HB1 ALA 45 2.525 -1.723 1.016 52 HB2 ALA 45 HB2 ALA 45 4.093 -2.213 1.662 53 HB3 ALA 45 HB3 ALA 45 4.001 -1.443 0.075 54 H LYS 46 HN LYS 46 4.949 -0.927 3.797 55 HA LYS 46 HA LYS 46 2.639 -0.812 5.565 56 HB2 LYS 46 HB2 LYS 46 4.314 -1.761 7.249 57 HB3 LYS 46 HB1 LYS 46 3.771 -2.788 5.935 58 HG2 LYS 46 HG2 LYS 46 5.866 -2.170 4.736 59 HG3 LYS 46 HG1 LYS 46 6.416 -1.398 6.226 60 HD2 LYS 46 HD2 LYS 46 7.332 -3.637 6.058 61 HD3 LYS 46 HD1 LYS 46 6.167 -3.578 7.380 62 HE2 LYS 46 HE2 LYS 46 4.496 -4.654 6.032 63 HE3 LYS 46 HE1 LYS 46 5.521 -4.534 4.601 64 HZ1 LYS 46 HZ1 LYS 46 7.041 -6.058 5.577 65 HZ2 LYS 46 HZ2 LYS 46 5.488 -6.738 5.615 66 HZ3 LYS 46 HZ3 LYS 46 6.182 -6.103 7.020 67 H VAL 47 HN VAL 47 5.343 1.120 4.752 68 HA VAL 47 HA VAL 47 5.337 2.709 7.153 69 HB VAL 47 HB VAL 47 6.265 3.522 4.375 70 HG11 VAL 47 HG11 VAL 47 5.983 5.432 5.858 71 HG12 VAL 47 HG12 VAL 47 7.693 5.139 5.525 72 HG13 VAL 47 HG13 VAL 47 7.003 4.652 7.070 73 HG21 VAL 47 HG21 VAL 47 7.395 1.507 5.157 74 HG22 VAL 47 HG22 VAL 47 7.923 2.388 6.606 75 HG23 VAL 47 HG23 VAL 47 8.456 2.904 4.996 76 H THR 48 HN THR 48 3.866 2.971 3.955 77 HA THR 48 HA THR 48 2.726 5.500 4.330 78 HB THR 48 HB THR 48 3.068 4.525 2.090 79 HG1 THR 48 HG1 THR 48 0.426 5.296 2.745 80 HG21 THR 48 HG21 THR 48 0.714 2.765 2.746 81 HG22 THR 48 HG22 THR 48 2.379 2.229 2.531 82 HG23 THR 48 HG23 THR 48 1.488 2.910 1.168 83 H VAL 49 HN VAL 49 1.452 2.283 5.032 84 HA VAL 49 HA VAL 49 -1.174 3.199 5.622 85 HB VAL 49 HB VAL 49 0.235 0.637 6.455 86 HG11 VAL 49 HG11 VAL 49 -2.034 -0.237 6.902 87 HG12 VAL 49 HG12 VAL 49 -2.693 1.368 6.579 88 HG13 VAL 49 HG13 VAL 49 -1.627 1.116 7.959 89 HG21 VAL 49 HG21 VAL 49 -0.009 0.850 4.043 90 HG22 VAL 49 HG22 VAL 49 -1.735 1.167 4.240 91 HG23 VAL 49 HG23 VAL 49 -1.074 -0.409 4.673 92 H ALA 50 HN ALA 50 1.758 2.633 7.414 93 HA ALA 50 HA ALA 50 0.916 2.918 10.014 94 HB1 ALA 50 HB1 ALA 50 3.196 3.478 10.474 95 HB2 ALA 50 HB2 ALA 50 3.474 3.856 8.774 96 HB3 ALA 50 HB3 ALA 50 3.131 2.193 9.265 97 H LYS 51 HN LYS 51 1.821 5.343 7.638 98 HA LYS 51 HA LYS 51 1.800 7.549 9.394 99 HB2 LYS 51 HB2 LYS 51 1.367 7.497 6.402 100 HB3 LYS 51 HB1 LYS 51 1.719 8.943 7.339 101 HG2 LYS 51 HG2 LYS 51 3.539 6.546 7.088 102 HG3 LYS 51 HG1 LYS 51 3.691 8.032 6.155 103 HD2 LYS 51 HD2 LYS 51 3.790 7.958 9.179 104 HD3 LYS 51 HD1 LYS 51 5.214 7.820 8.160 105 HE2 LYS 51 HE2 LYS 51 3.299 10.153 8.045 106 HE3 LYS 51 HE1 LYS 51 4.774 10.133 9.007 107 HZ1 LYS 51 HZ1 LYS 51 5.089 11.197 6.838 108 HZ2 LYS 51 HZ2 LYS 51 4.701 9.749 6.055 109 HZ3 LYS 51 HZ3 LYS 51 6.060 9.840 7.034 110 H GLY 52 HN GLY 52 -0.730 5.860 7.783 111 HA2 GLY 52 HA2 GLY 52 -2.674 7.979 8.224 112 HA3 GLY 52 HA1 GLY 52 -2.981 6.411 7.481 113 H ASP 53 HN ASP 53 -1.579 5.044 9.689 114 HA ASP 53 HA ASP 53 -3.907 4.890 11.373 115 HB2 ASP 53 HB2 ASP 53 -1.477 3.139 11.172 116 HB3 ASP 53 HB1 ASP 53 -2.697 2.928 12.427 117 H ILE 54 HN ILE 54 -0.666 6.028 11.649 118 HA ILE 54 HA ILE 54 -0.984 6.595 14.424 119 HB ILE 54 HB ILE 54 0.940 8.149 14.183 120 HG12 ILE 54 HG12 ILE 54 0.752 7.380 11.263 121 HG13 ILE 54 HG11 ILE 54 0.545 8.989 11.938 122 HG21 ILE 54 HG21 ILE 54 1.316 5.432 12.956 123 HG22 ILE 54 HG22 ILE 54 1.324 5.823 14.676 124 HG23 ILE 54 HG23 ILE 54 2.599 6.439 13.624 125 HD11 ILE 54 HD11 ILE 54 2.684 8.804 10.874 126 HD12 ILE 54 HD12 ILE 54 3.072 7.378 11.833 127 HD13 ILE 54 HD13 ILE 54 2.923 8.952 12.620 128 H LYS 55 HN LYS 55 -1.943 8.234 11.481 129 HA LYS 55 HA LYS 55 -2.603 10.666 12.725 130 HB2 LYS 55 HB2 LYS 55 -2.324 9.944 10.165 131 HB3 LYS 55 HB1 LYS 55 -4.061 9.707 10.312 132 HG2 LYS 55 HG2 LYS 55 -3.636 11.915 9.475 133 HG3 LYS 55 HG1 LYS 55 -4.252 12.040 11.132 134 HD2 LYS 55 HD2 LYS 55 -1.871 12.125 11.914 135 HD3 LYS 55 HD1 LYS 55 -1.396 12.180 10.243 136 HE2 LYS 55 HE2 LYS 55 -2.576 14.273 9.898 137 HE3 LYS 55 HE1 LYS 55 -3.203 14.230 11.548 138 HZ1 LYS 55 HZ1 LYS 55 -1.329 15.714 11.470 139 HZ2 LYS 55 HZ2 LYS 55 -0.370 14.566 10.719 140 HZ3 LYS 55 HZ3 LYS 55 -0.846 14.333 12.302 141 H ALA 56 HN ALA 56 -4.138 7.599 12.349 142 HA ALA 56 HA ALA 56 -6.775 8.275 13.118 143 HB1 ALA 56 HB1 ALA 56 -6.164 6.113 12.113 144 HB2 ALA 56 HB2 ALA 56 -6.988 5.890 13.665 145 HB3 ALA 56 HB3 ALA 56 -5.233 5.723 13.562 146 H ILE 57 HN ILE 57 -3.929 7.215 14.884 147 HA ILE 57 HA ILE 57 -5.034 7.199 17.465 148 HB ILE 57 HB ILE 57 -2.148 7.685 16.666 149 HG12 ILE 57 HG12 ILE 57 -3.538 5.139 17.453 150 HG13 ILE 57 HG11 ILE 57 -3.233 5.615 15.788 151 HG21 ILE 57 HG21 ILE 57 -3.360 6.732 19.281 152 HG22 ILE 57 HG22 ILE 57 -2.614 8.306 19.010 153 HG23 ILE 57 HG23 ILE 57 -1.635 6.842 18.932 154 HD11 ILE 57 HD11 ILE 57 -1.116 5.126 17.872 155 HD12 ILE 57 HD12 ILE 57 -0.881 5.520 16.159 156 HD13 ILE 57 HD13 ILE 57 -1.645 4.006 16.610 157 H ALA 58 HN ALA 58 -3.579 9.725 15.546 158 HA ALA 58 HA ALA 58 -3.362 11.693 17.532 159 HB1 ALA 58 HB1 ALA 58 -3.998 12.114 14.619 160 HB2 ALA 58 HB2 ALA 58 -2.387 11.894 15.307 161 HB3 ALA 58 HB3 ALA 58 -3.350 13.311 15.743 162 H ALA 59 HN ALA 59 -6.115 10.598 15.678 163 HA ALA 59 HA ALA 59 -7.797 12.780 16.497 164 HB1 ALA 59 HB1 ALA 59 -9.556 11.588 15.284 165 HB2 ALA 59 HB2 ALA 59 -8.477 10.208 15.072 166 HB3 ALA 59 HB3 ALA 59 -8.101 11.751 14.302 167 H ALA 60 HN ALA 60 -7.006 9.574 17.528 168 HA ALA 60 HA ALA 60 -9.258 9.435 19.325 169 HB1 ALA 60 HB1 ALA 60 -8.338 7.281 19.993 170 HB2 ALA 60 HB2 ALA 60 -6.863 7.627 19.114 171 HB3 ALA 60 HB3 ALA 60 -8.382 7.407 18.235 172 H LEU 61 HN LEU 61 -5.860 10.288 19.486 173 HA LEU 61 HA LEU 61 -5.707 10.409 22.320 174 HB2 LEU 61 HB2 LEU 61 -3.906 10.470 20.294 175 HB3 LEU 61 HB1 LEU 61 -4.038 12.184 20.608 176 HG LEU 61 HG LEU 61 -2.113 11.125 21.721 177 HD11 LEU 61 HD11 LEU 61 -4.200 12.142 23.635 178 HD12 LEU 61 HD12 LEU 61 -3.039 13.120 22.730 179 HD13 LEU 61 HD13 LEU 61 -2.476 12.006 23.975 180 HD21 LEU 61 HD21 LEU 61 -3.120 8.945 22.137 181 HD22 LEU 61 HD22 LEU 61 -4.164 9.715 23.357 182 HD23 LEU 61 HD23 LEU 61 -2.421 9.673 23.593 183 H ASP 62 HN ASP 62 -6.759 12.450 19.787 184 HA ASP 62 HA ASP 62 -7.194 14.846 21.212 185 HB2 ASP 62 HB2 ASP 62 -7.267 14.794 18.781 186 HB3 ASP 62 HB1 ASP 62 -8.574 13.624 18.809 187 H MET 63 HN MET 63 -8.921 11.858 20.869 188 HA MET 63 HA MET 63 -11.312 12.751 22.161 189 HB2 MET 63 HB2 MET 63 -10.343 9.964 21.521 190 HB3 MET 63 HB1 MET 63 -11.913 10.332 22.215 191 HG2 MET 63 HG2 MET 63 -12.487 11.615 20.218 192 HG3 MET 63 HG1 MET 63 -10.911 11.232 19.532 193 HE1 MET 63 HE1 MET 63 -12.119 10.313 17.355 194 HE2 MET 63 HE2 MET 63 -13.697 10.665 18.062 195 HE3 MET 63 HE3 MET 63 -13.371 9.069 17.384 196 H TYR 64 HN TYR 64 -8.314 11.165 23.095 197 HA TYR 64 HA TYR 64 -9.051 10.676 25.802 198 HB2 TYR 64 HB2 TYR 64 -7.073 9.613 24.827 199 HB3 TYR 64 HB1 TYR 64 -6.313 11.192 24.626 200 HD1 TYR 64 HD2 TYR 64 -7.580 8.797 27.270 201 HD2 TYR 64 HD1 TYR 64 -5.154 12.237 26.440 202 HE1 TYR 64 HE2 TYR 64 -6.718 8.659 29.364 203 HE2 TYR 64 HE1 TYR 64 -4.278 12.091 28.682 204 HH TYR 64 HH TYR 64 -4.952 9.338 30.584 205 H LYS 65 HN LYS 65 -7.586 13.491 24.086 206 HA LYS 65 HA LYS 65 -7.160 14.842 26.448 207 HB2 LYS 65 HB2 LYS 65 -6.712 16.857 25.302 208 HB3 LYS 65 HB1 LYS 65 -6.171 15.569 24.251 209 HG2 LYS 65 HG2 LYS 65 -8.155 15.872 22.873 210 HG3 LYS 65 HG1 LYS 65 -8.712 17.119 23.999 211 HD2 LYS 65 HD2 LYS 65 -6.802 18.506 23.525 212 HD3 LYS 65 HD1 LYS 65 -6.068 17.245 22.548 213 HE2 LYS 65 HE2 LYS 65 -6.985 18.953 21.112 214 HE3 LYS 65 HE1 LYS 65 -7.914 17.471 20.929 215 HZ1 LYS 65 HZ1 LYS 65 -9.366 19.367 21.050 216 HZ2 LYS 65 HZ2 LYS 65 -8.697 19.842 22.516 217 HZ3 LYS 65 HZ3 LYS 65 -9.577 18.415 22.419 218 H LEU 66 HN LEU 66 -9.946 14.230 24.630 219 HA LEU 66 HA LEU 66 -11.635 16.162 25.946 220 HB2 LEU 66 HB2 LEU 66 -12.156 15.467 23.694 221 HB3 LEU 66 HB1 LEU 66 -12.188 13.788 24.178 222 HG LEU 66 HG LEU 66 -14.202 14.267 25.543 223 HD11 LEU 66 HD11 LEU 66 -15.424 16.339 25.186 224 HD12 LEU 66 HD12 LEU 66 -14.101 16.959 24.199 225 HD13 LEU 66 HD13 LEU 66 -13.849 16.648 25.915 226 HD21 LEU 66 HD21 LEU 66 -14.404 13.335 23.316 227 HD22 LEU 66 HD22 LEU 66 -14.380 14.955 22.618 228 HD23 LEU 66 HD23 LEU 66 -15.730 14.454 23.635 229 H ASP 67 HN ASP 67 -10.853 12.655 26.252 230 HA ASP 67 HA ASP 67 -12.959 11.978 28.029 231 HB2 ASP 67 HB2 ASP 67 -11.786 10.385 26.601 232 HB3 ASP 67 HB1 ASP 67 -10.295 10.713 27.457 233 H ASN 68 HN ASN 68 -9.659 13.131 28.480 234 HA ASN 68 HA ASN 68 -10.160 13.233 31.416 235 HB2 ASN 68 HB2 ASN 68 -8.132 11.787 30.155 236 HB3 ASN 68 HB1 ASN 68 -7.563 13.457 30.521 237 HD21 ASN 68 HD21 ASN 68 -7.154 14.109 32.514 238 HD22 ASN 68 HD22 ASN 68 -7.229 13.077 33.916 239 H PHE 69 HN PHE 69 -10.581 15.010 29.080 240 HA PHE 69 HA PHE 69 -10.385 17.240 28.592 241 HB2 PHE 69 HB2 PHE 69 -10.549 18.657 30.730 242 HB3 PHE 69 HB1 PHE 69 -11.824 17.493 30.412 243 HD1 PHE 69 HD1 PHE 69 -8.820 18.068 32.357 244 HD2 PHE 69 HD2 PHE 69 -12.207 15.734 31.860 245 HE1 PHE 69 HE1 PHE 69 -8.447 17.157 34.608 246 HE2 PHE 69 HE2 PHE 69 -11.944 14.744 34.070 247 HZ PHE 69 HZ PHE 69 -10.029 15.445 35.498 248 H ALA 70 HN ALA 70 -7.813 15.964 28.516 249 HA ALA 70 HA ALA 70 -6.003 18.104 28.491 250 HB1 ALA 70 HB1 ALA 70 -4.690 17.529 30.480 251 HB2 ALA 70 HB2 ALA 70 -5.886 16.268 30.858 252 HB3 ALA 70 HB3 ALA 70 -6.361 17.944 30.940 253 H TYR 71 HN TYR 71 -4.011 17.366 27.738 254 HA TYR 71 HA TYR 71 -3.941 14.734 26.723 255 HB2 TYR 71 HB2 TYR 71 -2.112 17.080 26.707 256 HB3 TYR 71 HB1 TYR 71 -1.486 15.511 26.218 257 HD1 TYR 71 HD1 TYR 71 -3.792 14.372 24.787 258 HD2 TYR 71 HD2 TYR 71 -2.244 18.317 24.807 259 HE1 TYR 71 HE1 TYR 71 -4.622 14.611 22.663 260 HE2 TYR 71 HE2 TYR 71 -3.061 18.647 22.539 261 HH TYR 71 HH TYR 71 -3.660 17.373 20.631 262 HA PRO 72 HA PRO 72 -2.056 12.525 29.980 263 HB2 PRO 72 HB2 PRO 72 -0.298 10.919 28.697 264 HB3 PRO 72 HB1 PRO 72 -2.049 10.716 28.559 265 HG2 PRO 72 HG2 PRO 72 -0.148 12.097 26.700 266 HG3 PRO 72 HG1 PRO 72 -1.418 10.916 26.320 267 HD2 PRO 72 HD2 PRO 72 -1.810 13.528 25.998 268 HD3 PRO 72 HD1 PRO 72 -3.103 12.460 26.571 269 H SER 73 HN SER 73 -0.078 12.224 31.279 270 HA SER 73 HA SER 73 2.191 13.897 30.454 271 HB2 SER 73 HB2 SER 73 2.838 13.666 32.861 272 HB3 SER 73 HB1 SER 73 1.249 14.400 32.677 273 HG SER 73 HG SER 73 0.421 12.851 33.673 274 H THR 74 HN THR 74 4.341 12.810 30.696 275 HA THR 74 HA THR 74 4.072 10.302 29.423 276 HB THR 74 HB THR 74 5.977 12.200 29.302 277 HG1 THR 74 HG1 THR 74 7.298 10.417 28.314 278 HG21 THR 74 HG21 THR 74 7.221 10.023 31.005 279 HG22 THR 74 HG22 THR 74 6.801 11.621 31.569 280 HG23 THR 74 HG23 THR 74 8.069 11.435 30.338 281 H GLN 75 HN GLN 75 4.107 11.093 32.661 282 HA GLN 75 HA GLN 75 4.726 8.335 33.368 283 HB2 GLN 75 HB2 GLN 75 4.356 10.812 34.997 284 HB3 GLN 75 HB1 GLN 75 4.520 9.213 35.741 285 HG2 GLN 75 HG2 GLN 75 6.737 9.047 34.655 286 HG3 GLN 75 HG1 GLN 75 6.527 10.689 34.049 287 HE21 GLN 75 HE21 GLN 75 6.609 12.411 35.508 288 HE22 GLN 75 HE22 GLN 75 7.265 12.209 37.096 289 H GLN 76 HN GLN 76 2.170 10.795 34.211 290 HA GLN 76 HA GLN 76 0.485 8.684 35.261 291 HB2 GLN 76 HB2 GLN 76 -0.061 11.621 34.897 292 HB3 GLN 76 HB1 GLN 76 -1.022 10.473 35.804 293 HG2 GLN 76 HG2 GLN 76 0.604 10.274 37.511 294 HG3 GLN 76 HG1 GLN 76 1.854 11.024 36.518 295 HE21 GLN 76 HE21 GLN 76 0.925 11.734 39.193 296 HE22 GLN 76 HE22 GLN 76 0.426 13.377 39.094 297 H GLY 77 HN GLY 77 0.651 10.684 32.417 298 HA2 GLY 77 HA2 GLY 77 -1.951 9.741 31.616 299 HA3 GLY 77 HA1 GLY 77 -0.918 10.780 30.665 300 H LEU 78 HN LEU 78 1.332 8.762 31.152 301 HA LEU 78 HA LEU 78 0.781 7.225 28.798 302 HB2 LEU 78 HB2 LEU 78 3.091 8.052 29.645 303 HB3 LEU 78 HB1 LEU 78 3.031 6.706 30.754 304 HG LEU 78 HG LEU 78 3.002 6.395 27.742 305 HD11 LEU 78 HD11 LEU 78 5.298 6.171 29.661 306 HD12 LEU 78 HD12 LEU 78 5.064 7.422 28.435 307 HD13 LEU 78 HD13 LEU 78 5.332 5.749 27.950 308 HD21 LEU 78 HD21 LEU 78 2.069 4.477 28.955 309 HD22 LEU 78 HD22 LEU 78 3.515 4.409 29.954 310 HD23 LEU 78 HD23 LEU 78 3.625 4.068 28.224 311 H GLU 79 HN GLU 79 1.040 6.576 32.265 312 HA GLU 79 HA GLU 79 0.127 3.928 32.056 313 HB2 GLU 79 HB2 GLU 79 0.130 5.869 34.333 314 HB3 GLU 79 HB1 GLU 79 -0.500 4.225 34.492 315 HG2 GLU 79 HG2 GLU 79 1.608 3.359 33.798 316 HG3 GLU 79 HG1 GLU 79 2.298 4.995 33.712 317 H ALA 80 HN ALA 80 -1.498 6.959 32.057 318 HA ALA 80 HA ALA 80 -4.112 5.769 32.375 319 HB1 ALA 80 HB1 ALA 80 -4.968 7.997 32.163 320 HB2 ALA 80 HB2 ALA 80 -3.466 8.527 31.437 321 HB3 ALA 80 HB3 ALA 80 -3.481 8.116 33.144 322 H LEU 81 HN LEU 81 -1.968 5.952 29.874 323 HA LEU 81 HA LEU 81 -3.979 6.030 27.755 324 HB2 LEU 81 HB2 LEU 81 -1.207 6.622 27.976 325 HB3 LEU 81 HB1 LEU 81 -1.362 5.296 26.847 326 HG LEU 81 HG LEU 81 -2.840 6.667 25.430 327 HD11 LEU 81 HD11 LEU 81 -2.338 8.840 27.448 328 HD12 LEU 81 HD12 LEU 81 -3.883 8.045 27.143 329 HD13 LEU 81 HD13 LEU 81 -3.142 9.038 25.892 330 HD21 LEU 81 HD21 LEU 81 -0.215 7.994 26.173 331 HD22 LEU 81 HD22 LEU 81 -1.136 8.303 24.707 332 HD23 LEU 81 HD23 LEU 81 -0.460 6.706 25.000 333 H VAL 82 HN VAL 82 -2.052 3.863 29.578 334 HA VAL 82 HA VAL 82 -2.867 1.606 27.872 335 HB VAL 82 HB VAL 82 -0.882 1.516 30.157 336 HG11 VAL 82 HG11 VAL 82 -1.376 -0.381 27.865 337 HG12 VAL 82 HG12 VAL 82 -1.807 -0.659 29.551 338 HG13 VAL 82 HG13 VAL 82 -0.111 -0.555 29.079 339 HG21 VAL 82 HG21 VAL 82 -0.085 3.077 28.486 340 HG22 VAL 82 HG22 VAL 82 -0.353 1.888 27.215 341 HG23 VAL 82 HG23 VAL 82 0.879 1.600 28.443 342 H LYS 83 HN LYS 83 -2.963 2.761 31.219 343 HA LYS 83 HA LYS 83 -4.954 0.725 31.853 344 HB2 LYS 83 HB2 LYS 83 -2.925 2.165 33.598 345 HB3 LYS 83 HB1 LYS 83 -4.336 1.385 34.302 346 HG2 LYS 83 HG2 LYS 83 -2.501 -0.085 34.547 347 HG3 LYS 83 HG1 LYS 83 -3.493 -0.753 33.256 348 HD2 LYS 83 HD2 LYS 83 -1.970 0.280 31.612 349 HD3 LYS 83 HD1 LYS 83 -0.953 0.848 32.934 350 HE2 LYS 83 HE2 LYS 83 -1.584 -2.027 32.270 351 HE3 LYS 83 HE1 LYS 83 -0.064 -1.199 31.946 352 HZ1 LYS 83 HZ1 LYS 83 -1.202 -1.799 34.628 353 HZ2 LYS 83 HZ2 LYS 83 0.223 -0.929 34.349 354 HZ3 LYS 83 HZ3 LYS 83 0.123 -2.536 33.898 355 H LYS 84 HN LYS 84 -6.816 1.464 32.990 356 HA LYS 84 HA LYS 84 -8.036 3.744 31.988 357 HB2 LYS 84 HB2 LYS 84 -9.090 1.709 32.897 358 HB3 LYS 84 HB1 LYS 84 -8.531 2.145 34.496 359 HG2 LYS 84 HG2 LYS 84 -9.992 4.041 34.511 360 HG3 LYS 84 HG1 LYS 84 -10.508 3.682 32.854 361 HD2 LYS 84 HD2 LYS 84 -11.205 1.460 33.579 362 HD3 LYS 84 HD1 LYS 84 -10.760 1.872 35.225 363 HE2 LYS 84 HE2 LYS 84 -12.417 3.646 35.266 364 HE3 LYS 84 HE1 LYS 84 -12.837 3.314 33.584 365 HZ1 LYS 84 HZ1 LYS 84 -13.596 1.118 34.241 366 HZ2 LYS 84 HZ2 LYS 84 -14.404 2.305 35.167 367 HZ3 LYS 84 HZ3 LYS 84 -13.142 1.424 35.830 368 HA PRO 85 HA PRO 85 -5.914 7.003 33.970 369 HB2 PRO 85 HB2 PRO 85 -7.942 8.868 33.910 370 HB3 PRO 85 HB1 PRO 85 -6.910 8.475 32.530 371 HG2 PRO 85 HG2 PRO 85 -9.587 7.383 33.234 372 HG3 PRO 85 HG1 PRO 85 -9.018 7.983 31.652 373 HD2 PRO 85 HD2 PRO 85 -9.140 5.421 32.120 374 HD3 PRO 85 HD1 PRO 85 -7.683 6.077 31.338 375 H THR 86 HN THR 86 -5.450 7.316 35.964 376 HA THR 86 HA THR 86 -7.196 6.611 38.058 377 HB THR 86 HB THR 86 -5.167 7.650 39.366 378 HG1 THR 86 HG1 THR 86 -3.369 7.116 37.620 379 HG21 THR 86 HG21 THR 86 -4.915 5.163 37.655 380 HG22 THR 86 HG22 THR 86 -5.677 5.243 39.243 381 HG23 THR 86 HG23 THR 86 -3.943 5.524 39.083 382 H GLY 87 HN GLY 87 -8.668 7.872 38.870 383 HA2 GLY 87 HA2 GLY 87 -8.992 10.021 40.066 384 HA3 GLY 87 HA1 GLY 87 -8.378 10.782 38.592 385 H ASN 88 HN ASN 88 -10.269 11.851 38.045 386 HA ASN 88 HA ASN 88 -12.393 10.030 37.266 387 HB2 ASN 88 HB2 ASN 88 -12.718 12.626 38.737 388 HB3 ASN 88 HB1 ASN 88 -14.018 11.970 37.749 389 HD21 ASN 88 HD21 ASN 88 -12.139 11.571 40.633 390 HD22 ASN 88 HD22 ASN 88 -13.103 10.331 41.337 391 HA PRO 89 HA PRO 89 -11.660 12.303 33.394 392 HB2 PRO 89 HB2 PRO 89 -12.097 10.168 31.782 393 HB3 PRO 89 HB1 PRO 89 -10.551 10.320 32.579 394 HG2 PRO 89 HG2 PRO 89 -12.950 8.755 33.456 395 HG3 PRO 89 HG1 PRO 89 -11.280 8.193 33.310 396 HD2 PRO 89 HD2 PRO 89 -12.298 8.912 35.662 397 HD3 PRO 89 HD1 PRO 89 -10.616 9.312 35.254 398 H GLN 90 HN GLN 90 -13.404 12.596 31.711 399 HA GLN 90 HA GLN 90 -15.986 12.637 33.022 400 HB2 GLN 90 HB2 GLN 90 -16.827 13.736 31.000 401 HB3 GLN 90 HB1 GLN 90 -15.339 14.501 31.532 402 HG2 GLN 90 HG2 GLN 90 -14.101 13.489 29.781 403 HG3 GLN 90 HG1 GLN 90 -15.449 12.432 29.362 404 HE21 GLN 90 HE21 GLN 90 -15.919 15.789 30.173 405 HE22 GLN 90 HE22 GLN 90 -16.329 16.303 28.584 406 HA PRO 91 HA PRO 91 -17.559 8.802 31.352 407 HB2 PRO 91 HB2 PRO 91 -19.998 10.178 30.381 408 HB3 PRO 91 HB1 PRO 91 -19.864 8.840 31.523 409 HG2 PRO 91 HG2 PRO 91 -20.499 11.307 32.351 410 HG3 PRO 91 HG1 PRO 91 -19.479 10.238 33.326 411 HD2 PRO 91 HD2 PRO 91 -18.706 12.557 31.608 412 HD3 PRO 91 HD1 PRO 91 -18.065 12.057 33.189 413 H LYS 92 HN LYS 92 -16.179 8.531 29.646 414 HA LYS 92 HA LYS 92 -17.196 8.977 27.016 415 HB2 LYS 92 HB2 LYS 92 -15.807 11.030 27.764 416 HB3 LYS 92 HB1 LYS 92 -14.426 9.959 27.820 417 HG2 LYS 92 HG2 LYS 92 -16.031 10.472 25.318 418 HG3 LYS 92 HG1 LYS 92 -14.638 11.437 25.786 419 HD2 LYS 92 HD2 LYS 92 -13.248 9.387 25.703 420 HD3 LYS 92 HD1 LYS 92 -14.667 8.478 25.205 421 HE2 LYS 92 HE2 LYS 92 -13.512 10.809 23.695 422 HE3 LYS 92 HE1 LYS 92 -13.190 9.118 23.322 423 HZ1 LYS 92 HZ1 LYS 92 -15.841 10.463 23.215 424 HZ2 LYS 92 HZ2 LYS 92 -15.598 8.837 22.894 425 HZ3 LYS 92 HZ3 LYS 92 -14.922 9.999 21.896 426 H ASN 93 HN ASN 93 -16.215 7.429 25.623 427 HA ASN 93 HA ASN 93 -15.440 5.071 26.983 428 HB2 ASN 93 HB2 ASN 93 -15.595 5.663 24.058 429 HB3 ASN 93 HB1 ASN 93 -15.190 4.078 24.714 430 HD21 ASN 93 HD21 ASN 93 -17.410 5.025 23.159 431 HD22 ASN 93 HD22 ASN 93 -18.840 4.585 24.031 432 H TRP 94 HN TRP 94 -13.484 5.480 28.005 433 HA TRP 94 HA TRP 94 -11.113 6.224 26.814 434 HB2 TRP 94 HB2 TRP 94 -11.390 6.197 29.207 435 HB3 TRP 94 HB1 TRP 94 -11.673 4.456 29.202 436 HD1 TRP 94 HD1 TRP 94 -8.928 7.053 28.841 437 HE1 TRP 94 HE1 TRP 94 -6.632 5.874 29.168 438 HE3 TRP 94 HE3 TRP 94 -10.525 2.229 29.094 439 HZ2 TRP 94 HZ2 TRP 94 -5.685 3.266 29.493 440 HZ3 TRP 94 HZ3 TRP 94 -8.878 0.451 29.433 441 HH2 TRP 94 HH2 TRP 94 -6.507 0.964 29.631 442 H ASN 95 HN ASN 95 -9.435 5.048 25.985 443 HA ASN 95 HA ASN 95 -9.908 2.243 25.325 444 HB2 ASN 95 HB2 ASN 95 -10.450 3.543 23.341 445 HB3 ASN 95 HB1 ASN 95 -8.938 4.428 23.487 446 HD21 ASN 95 HD21 ASN 95 -9.362 0.908 23.894 447 HD22 ASN 95 HD22 ASN 95 -8.306 0.563 22.562 448 H LYS 96 HN LYS 96 -8.095 1.015 25.652 449 HA LYS 96 HA LYS 96 -5.748 2.309 26.743 450 HB2 LYS 96 HB2 LYS 96 -4.941 0.131 27.247 451 HB3 LYS 96 HB1 LYS 96 -6.645 0.166 27.700 452 HG2 LYS 96 HG2 LYS 96 -7.134 -1.020 25.534 453 HG3 LYS 96 HG1 LYS 96 -5.380 -1.087 25.301 454 HD2 LYS 96 HD2 LYS 96 -5.100 -2.372 27.318 455 HD3 LYS 96 HD1 LYS 96 -6.825 -2.268 27.669 456 HE2 LYS 96 HE2 LYS 96 -7.295 -3.511 25.601 457 HE3 LYS 96 HE1 LYS 96 -5.562 -3.612 25.295 458 HZ1 LYS 96 HZ1 LYS 96 -6.974 -4.791 27.624 459 HZ2 LYS 96 HZ2 LYS 96 -5.318 -4.858 27.358 460 HZ3 LYS 96 HZ3 LYS 96 -6.366 -5.644 26.302 461 H ASP 97 HN ASP 97 -3.686 1.020 25.994 462 HA ASP 97 HA ASP 97 -2.130 0.469 24.493 463 HB2 ASP 97 HB2 ASP 97 -4.056 -1.042 23.647 464 HB3 ASP 97 HB1 ASP 97 -4.261 0.165 22.385 465 H GLY 98 HN GLY 98 -3.595 3.127 24.702 466 HA2 GLY 98 HA2 GLY 98 -2.228 5.073 24.292 467 HA3 GLY 98 HA1 GLY 98 -1.798 4.380 22.745 468 H TYR 99 HN TYR 99 -5.117 4.105 23.554 469 HA TYR 99 HA TYR 99 -6.943 4.872 22.585 470 HB2 TYR 99 HB2 TYR 99 -5.609 7.266 23.508 471 HB3 TYR 99 HB1 TYR 99 -6.414 7.633 21.977 472 HD1 TYR 99 HD2 TYR 99 -8.806 7.518 21.884 473 HD2 TYR 99 HD1 TYR 99 -6.655 6.793 25.455 474 HE1 TYR 99 HE2 TYR 99 -10.820 7.968 23.167 475 HE2 TYR 99 HE1 TYR 99 -8.663 7.238 26.750 476 HH TYR 99 HH TYR 99 -11.722 7.548 25.331 477 H LEU 100 HN LEU 100 -6.994 3.707 20.858 478 HA LEU 100 HA LEU 100 -6.017 4.758 18.289 479 HB2 LEU 100 HB2 LEU 100 -4.530 2.983 19.048 480 HB3 LEU 100 HB1 LEU 100 -5.886 1.966 19.456 481 HG LEU 100 HG LEU 100 -6.409 1.796 17.028 482 HD11 LEU 100 HD11 LEU 100 -5.342 3.811 16.221 483 HD12 LEU 100 HD12 LEU 100 -4.739 2.383 15.379 484 HD13 LEU 100 HD13 LEU 100 -3.758 3.146 16.628 485 HD21 LEU 100 HD21 LEU 100 -4.596 0.224 16.518 486 HD22 LEU 100 HD22 LEU 100 -5.198 0.037 18.165 487 HD23 LEU 100 HD23 LEU 100 -3.670 0.870 17.872 488 H LYS 101 HN LYS 101 -7.266 3.606 16.522 489 HA LYS 101 HA LYS 101 -10.093 3.480 17.201 490 HB2 LYS 101 HB2 LYS 101 -8.642 3.243 14.547 491 HB3 LYS 101 HB1 LYS 101 -10.388 3.260 14.736 492 HG2 LYS 101 HG2 LYS 101 -8.560 5.510 15.546 493 HG3 LYS 101 HG1 LYS 101 -9.420 5.427 14.010 494 HD2 LYS 101 HD2 LYS 101 -10.791 5.293 16.676 495 HD3 LYS 101 HD1 LYS 101 -10.533 6.822 15.821 496 HE2 LYS 101 HE2 LYS 101 -11.804 5.815 13.899 497 HE3 LYS 101 HE1 LYS 101 -12.150 4.424 14.917 498 HZ1 LYS 101 HZ1 LYS 101 -12.983 7.229 15.414 499 HZ2 LYS 101 HZ2 LYS 101 -13.235 5.949 16.490 500 HZ3 LYS 101 HZ3 LYS 101 -13.980 5.935 14.987 501 H LYS 102 HN LYS 102 -11.191 1.552 15.874 502 HA LYS 102 HA LYS 102 -9.838 -0.782 16.867 503 HB2 LYS 102 HB2 LYS 102 -11.780 -2.224 16.197 504 HB3 LYS 102 HB1 LYS 102 -12.300 -0.831 17.114 505 HG2 LYS 102 HG2 LYS 102 -12.434 -0.909 14.163 506 HG3 LYS 102 HG1 LYS 102 -13.699 -1.578 15.196 507 HD2 LYS 102 HD2 LYS 102 -13.781 0.674 16.322 508 HD3 LYS 102 HD1 LYS 102 -12.742 1.263 15.025 509 HE2 LYS 102 HE2 LYS 102 -15.311 -0.121 14.676 510 HE3 LYS 102 HE1 LYS 102 -15.134 1.645 14.647 511 HZ1 LYS 102 HZ1 LYS 102 -13.915 -0.299 12.722 512 HZ2 LYS 102 HZ2 LYS 102 -13.634 1.358 12.711 513 HZ3 LYS 102 HZ3 LYS 102 -15.165 0.771 12.395 514 H LEU 103 HN LEU 103 -8.027 -0.502 15.778 515 HA LEU 103 HA LEU 103 -7.903 -1.717 13.116 516 HB2 LEU 103 HB2 LEU 103 -6.282 0.607 14.193 517 HB3 LEU 103 HB1 LEU 103 -5.995 -0.192 12.667 518 HG LEU 103 HG LEU 103 -8.491 1.370 13.341 519 HD11 LEU 103 HD11 LEU 103 -6.099 2.126 11.666 520 HD12 LEU 103 HD12 LEU 103 -6.529 2.815 13.230 521 HD13 LEU 103 HD13 LEU 103 -7.579 3.071 11.838 522 HD21 LEU 103 HD21 LEU 103 -8.860 -0.375 11.670 523 HD22 LEU 103 HD22 LEU 103 -7.492 0.222 10.732 524 HD23 LEU 103 HD23 LEU 103 -8.927 1.227 10.935 525 HA PRO 104 HA PRO 104 -4.882 -4.261 15.260 526 HB2 PRO 104 HB2 PRO 104 -3.305 -4.965 13.129 527 HB3 PRO 104 HB1 PRO 104 -4.856 -5.734 13.478 528 HG2 PRO 104 HG2 PRO 104 -4.206 -3.592 11.504 529 HG3 PRO 104 HG1 PRO 104 -5.286 -4.985 11.332 530 HD2 PRO 104 HD2 PRO 104 -6.208 -2.485 11.821 531 HD3 PRO 104 HD1 PRO 104 -7.022 -3.936 12.434 532 H VAL 105 HN VAL 105 -2.424 -4.370 15.437 533 HA VAL 105 HA VAL 105 -1.486 -1.674 15.758 534 HB VAL 105 HB VAL 105 -1.228 -3.646 17.375 535 HG11 VAL 105 HG11 VAL 105 1.079 -4.386 15.601 536 HG12 VAL 105 HG12 VAL 105 -0.374 -5.328 15.915 537 HG13 VAL 105 HG13 VAL 105 0.774 -5.019 17.214 538 HG21 VAL 105 HG21 VAL 105 0.712 -2.822 18.359 539 HG22 VAL 105 HG22 VAL 105 -0.112 -1.425 17.643 540 HG23 VAL 105 HG23 VAL 105 1.310 -2.126 16.859 541 H ASP 106 HN ASP 106 1.093 -1.402 15.080 542 HA ASP 106 HA ASP 106 0.794 -1.476 12.238 543 HB2 ASP 106 HB2 ASP 106 2.219 0.235 14.000 544 HB3 ASP 106 HB1 ASP 106 3.427 -0.530 12.962 545 HA PRO 107 HA PRO 107 3.092 -4.981 10.838 546 HB2 PRO 107 HB2 PRO 107 4.410 -2.849 9.155 547 HB3 PRO 107 HB1 PRO 107 3.913 -4.477 8.710 548 HG2 PRO 107 HG2 PRO 107 2.354 -2.462 8.115 549 HG3 PRO 107 HG1 PRO 107 1.635 -3.923 8.820 550 HD2 PRO 107 HD2 PRO 107 2.239 -1.300 10.131 551 HD3 PRO 107 HD1 PRO 107 0.838 -2.380 10.351 552 H TRP 108 HN TRP 108 5.301 -5.618 10.405 553 HA TRP 108 HA TRP 108 7.321 -6.124 10.990 554 HB2 TRP 108 HB2 TRP 108 7.642 -3.506 12.505 555 HB3 TRP 108 HB1 TRP 108 8.934 -4.562 11.977 556 HD1 TRP 108 HD1 TRP 108 9.030 -4.759 9.171 557 HE1 TRP 108 HE1 TRP 108 8.927 -2.793 7.494 558 HE3 TRP 108 HE3 TRP 108 6.746 -1.392 12.159 559 HZ2 TRP 108 HZ2 TRP 108 7.942 -0.099 7.504 560 HZ3 TRP 108 HZ3 TRP 108 6.224 0.855 11.303 561 HH2 TRP 108 HH2 TRP 108 6.776 1.496 9.065 562 H GLY 109 HN GLY 109 4.880 -6.121 12.630 563 HA2 GLY 109 HA2 GLY 109 3.973 -6.644 14.695 564 HA3 GLY 109 HA1 GLY 109 5.486 -7.530 14.973 565 H ASN 110 HN ASN 110 5.165 -4.029 14.512 566 HA ASN 110 HA ASN 110 6.366 -3.661 17.086 567 HB2 ASN 110 HB2 ASN 110 5.953 -1.817 14.741 568 HB3 ASN 110 HB1 ASN 110 6.524 -1.250 16.303 569 HD21 ASN 110 HD21 ASN 110 7.799 -1.245 13.730 570 HD22 ASN 110 HD22 ASN 110 9.288 -2.075 13.885 571 HA PRO 111 HA PRO 111 2.450 -2.281 18.741 572 HB2 PRO 111 HB2 PRO 111 4.012 -1.530 21.087 573 HB3 PRO 111 HB1 PRO 111 2.748 -2.753 20.961 574 HG2 PRO 111 HG2 PRO 111 5.376 -3.344 21.341 575 HG3 PRO 111 HG1 PRO 111 4.234 -4.430 20.538 576 HD2 PRO 111 HD2 PRO 111 6.308 -2.644 19.352 577 HD3 PRO 111 HD1 PRO 111 5.755 -4.258 18.842 578 H TYR 112 HN TYR 112 1.694 -0.121 19.215 579 HA TYR 112 HA TYR 112 3.398 1.872 18.106 580 HB2 TYR 112 HB2 TYR 112 0.715 2.073 19.474 581 HB3 TYR 112 HB1 TYR 112 1.604 3.476 18.906 582 HD1 TYR 112 HD1 TYR 112 2.135 3.627 16.438 583 HD2 TYR 112 HD2 TYR 112 -0.677 0.856 18.017 584 HE1 TYR 112 HE1 TYR 112 1.096 3.446 14.232 585 HE2 TYR 112 HE2 TYR 112 -1.730 0.656 15.806 586 HH TYR 112 HH TYR 112 -0.332 1.918 12.947 587 H GLN 113 HN GLN 113 4.421 3.504 19.155 588 HA GLN 113 HA GLN 113 4.978 2.872 21.971 589 HB2 GLN 113 HB2 GLN 113 6.550 4.991 20.621 590 HB3 GLN 113 HB1 GLN 113 7.089 3.745 21.713 591 HG2 GLN 113 HG2 GLN 113 6.612 3.476 18.753 592 HG3 GLN 113 HG1 GLN 113 8.163 3.599 19.548 593 HE21 GLN 113 HE21 GLN 113 7.353 1.682 21.700 594 HE22 GLN 113 HE22 GLN 113 7.362 0.155 20.887 595 H TYR 114 HN TYR 114 3.838 4.049 23.241 596 HA TYR 114 HA TYR 114 2.887 6.645 22.347 597 HB2 TYR 114 HB2 TYR 114 1.393 6.172 24.515 598 HB3 TYR 114 HB1 TYR 114 0.927 5.656 22.899 599 HD1 TYR 114 HD1 TYR 114 3.087 4.251 25.690 600 HD2 TYR 114 HD2 TYR 114 0.004 3.554 22.848 601 HE1 TYR 114 HE1 TYR 114 2.883 1.919 26.470 602 HE2 TYR 114 HE2 TYR 114 -0.224 1.234 23.653 603 HH TYR 114 HH TYR 114 1.224 -0.398 24.690 604 H LEU 115 HN LEU 115 3.891 8.324 23.094 605 HA LEU 115 HA LEU 115 4.741 8.299 25.858 606 HB2 LEU 115 HB2 LEU 115 6.224 9.418 23.487 607 HB3 LEU 115 HB1 LEU 115 6.653 9.793 25.150 608 HG LEU 115 HG LEU 115 6.774 7.073 23.831 609 HD11 LEU 115 HD11 LEU 115 8.439 8.610 22.958 610 HD12 LEU 115 HD12 LEU 115 9.199 7.381 23.970 611 HD13 LEU 115 HD13 LEU 115 8.948 9.011 24.596 612 HD21 LEU 115 HD21 LEU 115 7.681 7.984 26.567 613 HD22 LEU 115 HD22 LEU 115 7.972 6.394 25.864 614 HD23 LEU 115 HD23 LEU 115 6.327 6.906 26.230 615 H ALA 116 HN ALA 116 4.752 10.426 26.835 616 HA ALA 116 HA ALA 116 2.823 12.093 25.508 617 HB1 ALA 116 HB1 ALA 116 2.136 10.860 27.586 618 HB2 ALA 116 HB2 ALA 116 1.906 12.591 27.598 619 HB3 ALA 116 HB3 ALA 116 3.280 11.892 28.466 620 HA PRO 117 HA PRO 117 4.971 15.746 25.175 621 HB2 PRO 117 HB2 PRO 117 5.076 17.468 27.282 622 HB3 PRO 117 HB1 PRO 117 3.737 17.313 26.165 623 HG2 PRO 117 HG2 PRO 117 4.034 16.046 28.860 624 HG3 PRO 117 HG1 PRO 117 2.616 16.840 28.156 625 HD2 PRO 117 HD2 PRO 117 2.844 14.173 28.190 626 HD3 PRO 117 HD1 PRO 117 2.122 14.989 26.777 627 H GLY 118 HN GLY 118 6.820 15.468 24.676 628 HA2 GLY 118 HA2 GLY 118 8.907 14.886 26.594 629 HA3 GLY 118 HA1 GLY 118 9.092 15.033 24.848 630 H THR 119 HN THR 119 9.395 16.982 23.940 631 HA THR 119 HA THR 119 10.183 19.108 25.805 632 HB THR 119 HB THR 119 10.937 18.825 22.920 633 HG1 THR 119 HG1 THR 119 11.979 17.135 23.786 634 HG21 THR 119 HG21 THR 119 11.206 21.072 23.860 635 HG22 THR 119 HG22 THR 119 12.782 20.360 23.515 636 HG23 THR 119 HG23 THR 119 12.187 20.416 25.172 637 H LYS 120 HN LYS 120 8.336 20.122 26.031 638 HA LYS 120 HA LYS 120 6.509 21.293 25.758 639 HB2 LYS 120 HB2 LYS 120 6.602 23.299 24.323 640 HB3 LYS 120 HB1 LYS 120 8.023 23.064 25.313 641 HG2 LYS 120 HG2 LYS 120 8.795 23.879 23.240 642 HG3 LYS 120 HG1 LYS 120 9.135 22.146 23.228 643 HD2 LYS 120 HD2 LYS 120 7.195 21.745 21.836 644 HD3 LYS 120 HD1 LYS 120 6.736 23.444 21.938 645 HE2 LYS 120 HE2 LYS 120 9.292 22.412 20.722 646 HE3 LYS 120 HE1 LYS 120 7.856 22.858 19.804 647 HZ1 LYS 120 HZ1 LYS 120 9.495 24.687 21.496 648 HZ2 LYS 120 HZ2 LYS 120 8.089 25.128 20.691 649 HZ3 LYS 120 HZ3 LYS 120 9.434 24.646 19.811 650 H GLY 121 HN GLY 121 6.757 18.925 23.741 651 HA2 GLY 121 HA2 GLY 121 4.405 19.699 22.195 652 HA3 GLY 121 HA1 GLY 121 5.506 18.370 21.798 653 HA PRO 122 HA PRO 122 1.642 17.823 25.159 654 HB2 PRO 122 HB2 PRO 122 0.399 17.444 22.473 655 HB3 PRO 122 HB1 PRO 122 -0.384 17.789 24.025 656 HG2 PRO 122 HG2 PRO 122 0.107 19.783 22.429 657 HG3 PRO 122 HG1 PRO 122 0.534 19.939 24.143 658 HD2 PRO 122 HD2 PRO 122 2.301 19.546 21.790 659 HD3 PRO 122 HD1 PRO 122 2.631 20.403 23.310 660 H PHE 123 HN PHE 123 2.798 15.913 22.349 661 HA PHE 123 HA PHE 123 3.140 13.740 24.034 662 HB2 PHE 123 HB2 PHE 123 1.636 12.045 23.028 663 HB3 PHE 123 HB1 PHE 123 0.750 13.302 23.856 664 HD1 PHE 123 HD1 PHE 123 1.593 11.859 20.567 665 HD2 PHE 123 HD2 PHE 123 -0.837 14.681 22.653 666 HE1 PHE 123 HE1 PHE 123 0.134 12.056 18.608 667 HE2 PHE 123 HE2 PHE 123 -2.279 14.880 20.688 668 HZ PHE 123 HZ PHE 123 -1.803 13.570 18.662 669 H ASP 124 HN ASP 124 3.768 11.726 22.796 670 HA ASP 124 HA ASP 124 5.061 12.369 20.246 671 HB2 ASP 124 HB2 ASP 124 6.285 11.158 22.713 672 HB3 ASP 124 HB1 ASP 124 6.882 10.672 21.130 673 H LEU 125 HN LEU 125 3.910 11.052 18.876 674 HA LEU 125 HA LEU 125 3.392 8.360 19.865 675 HB2 LEU 125 HB2 LEU 125 1.368 9.806 19.672 676 HB3 LEU 125 HB1 LEU 125 1.722 10.035 17.980 677 HG LEU 125 HG LEU 125 -0.146 8.498 18.451 678 HD11 LEU 125 HD11 LEU 125 2.179 7.249 17.024 679 HD12 LEU 125 HD12 LEU 125 0.948 8.311 16.334 680 HD13 LEU 125 HD13 LEU 125 0.506 6.703 16.917 681 HD21 LEU 125 HD21 LEU 125 0.340 6.216 19.272 682 HD22 LEU 125 HD22 LEU 125 0.660 7.455 20.484 683 HD23 LEU 125 HD23 LEU 125 1.997 6.713 19.606 684 H TYR 126 HN TYR 126 4.246 6.760 18.655 685 HA TYR 126 HA TYR 126 4.632 6.976 15.874 686 HB2 TYR 126 HB2 TYR 126 7.083 6.941 15.766 687 HB3 TYR 126 HB1 TYR 126 6.536 8.413 16.537 688 HD1 TYR 126 HD2 TYR 126 6.952 8.754 18.968 689 HD2 TYR 126 HD1 TYR 126 8.430 5.333 16.914 690 HE1 TYR 126 HE2 TYR 126 8.530 8.335 20.804 691 HE2 TYR 126 HE1 TYR 126 10.015 4.911 18.740 692 HH TYR 126 HH TYR 126 11.071 5.961 20.515 693 H SER 127 HN SER 127 5.728 5.048 15.038 694 HA SER 127 HA SER 127 5.790 2.862 16.984 695 HB2 SER 127 HB2 SER 127 3.807 2.715 15.357 696 HB3 SER 127 HB1 SER 127 5.001 2.596 14.067 697 HG SER 127 HG SER 127 4.679 0.541 14.503 698 H LEU 128 HN LEU 128 7.536 1.455 16.670 699 HA LEU 128 HA LEU 128 9.867 2.606 15.561 700 HB2 LEU 128 HB2 LEU 128 9.288 -0.235 16.354 701 HB3 LEU 128 HB1 LEU 128 10.887 0.374 15.971 702 HG LEU 128 HG LEU 128 9.157 1.289 18.272 703 HD11 LEU 128 HD11 LEU 128 11.647 -0.381 18.243 704 HD12 LEU 128 HD12 LEU 128 10.015 -0.919 18.653 705 HD13 LEU 128 HD13 LEU 128 10.848 0.246 19.682 706 HD21 LEU 128 HD21 LEU 128 10.531 3.116 17.463 707 HD22 LEU 128 HD22 LEU 128 11.959 2.089 17.505 708 HD23 LEU 128 HD23 LEU 128 11.150 2.532 19.007 709 H GLY 129 HN GLY 129 11.172 1.874 13.792 710 HA2 GLY 129 HA2 GLY 129 9.606 1.140 11.482 711 HA3 GLY 129 HA1 GLY 129 11.312 1.549 11.499 712 H ALA 130 HN ALA 130 11.348 -0.226 9.982 713 HA ALA 130 HA ALA 130 10.749 -2.877 10.599 714 HB1 ALA 130 HB1 ALA 130 11.075 -2.020 8.346 715 HB2 ALA 130 HB2 ALA 130 12.045 -3.463 8.656 716 HB3 ALA 130 HB3 ALA 130 12.806 -1.869 8.655 717 H ASP 131 HN ASP 131 13.485 -1.023 11.529 718 HA ASP 131 HA ASP 131 15.000 -3.423 12.212 719 HB2 ASP 131 HB2 ASP 131 16.206 -1.517 11.190 720 HB3 ASP 131 HB1 ASP 131 15.748 -0.501 12.549 721 H GLY 132 HN GLY 132 12.588 -1.756 13.599 722 HA2 GLY 132 HA2 GLY 132 11.695 -1.821 15.726 723 HA3 GLY 132 HA1 GLY 132 12.995 -2.921 16.168 724 H LYS 133 HN LYS 133 13.670 0.180 14.806 725 HA LYS 133 HA LYS 133 14.181 1.345 17.393 726 HB2 LYS 133 HB2 LYS 133 16.290 0.935 15.284 727 HB3 LYS 133 HB1 LYS 133 16.408 2.237 16.462 728 HG2 LYS 133 HG2 LYS 133 16.186 0.524 18.247 729 HG3 LYS 133 HG1 LYS 133 16.326 -0.714 17.000 730 HD2 LYS 133 HD2 LYS 133 18.542 -0.047 16.488 731 HD3 LYS 133 HD1 LYS 133 18.377 1.443 17.429 732 HE2 LYS 133 HE2 LYS 133 18.361 -1.370 18.522 733 HE3 LYS 133 HE1 LYS 133 19.670 -0.198 18.677 734 HZ1 LYS 133 HZ1 LYS 133 18.120 1.253 19.920 735 HZ2 LYS 133 HZ2 LYS 133 18.364 -0.202 20.703 736 HZ3 LYS 133 HZ3 LYS 133 16.940 0.061 19.860 737 H GLU 134 HN GLU 134 14.194 3.588 17.441 738 HA GLU 134 HA GLU 134 12.851 4.662 15.175 739 HB2 GLU 134 HB2 GLU 134 12.603 6.771 16.548 740 HB3 GLU 134 HB1 GLU 134 11.829 5.356 17.220 741 HG2 GLU 134 HG2 GLU 134 14.531 6.288 18.139 742 HG3 GLU 134 HG1 GLU 134 13.037 6.935 18.809 743 H GLY 135 HN GLY 135 13.875 5.339 13.560 744 HA2 GLY 135 HA2 GLY 135 16.205 7.046 13.853 745 HA3 GLY 135 HA1 GLY 135 16.394 5.547 12.948 746 H GLY 136 HN GLY 136 16.940 7.320 11.294 747 HA2 GLY 136 HA2 GLY 136 14.463 8.144 9.935 748 HA3 GLY 136 HA1 GLY 136 15.977 9.048 9.830 749 H SER 137 HN SER 137 14.166 7.336 7.962 750 HA SER 137 HA SER 137 15.948 6.264 6.148 751 HB2 SER 137 HB2 SER 137 14.800 4.309 8.168 752 HB3 SER 137 HB1 SER 137 15.409 3.793 6.586 753 HG SER 137 HG SER 137 17.047 5.342 8.193 754 H ASP 138 HN ASP 138 14.456 4.536 4.787 755 HA ASP 138 HA ASP 138 11.893 5.835 4.410 756 HB2 ASP 138 HB2 ASP 138 13.206 3.468 3.054 757 HB3 ASP 138 HB1 ASP 138 11.575 4.007 2.675 758 H ASN 139 HN ASN 139 12.754 2.458 5.087 759 HA ASN 139 HA ASN 139 10.197 2.326 6.523 760 HB2 ASN 139 HB2 ASN 139 10.154 -0.099 6.105 761 HB3 ASN 139 HB1 ASN 139 10.202 0.825 4.612 762 HD21 ASN 139 HD21 ASN 139 11.897 -1.362 6.682 763 HD22 ASN 139 HD22 ASN 139 13.162 -1.722 5.577 764 H ASP 140 HN ASP 140 13.528 2.213 7.028 765 HA ASP 140 HA ASP 140 13.186 0.784 9.566 766 HB2 ASP 140 HB2 ASP 140 15.679 1.844 8.228 767 HB3 ASP 140 HB1 ASP 140 15.686 1.227 9.874 768 H ALA 141 HN ALA 141 12.294 3.532 8.718 769 HA ALA 141 HA ALA 141 13.400 5.213 10.823 770 HB1 ALA 141 HB1 ALA 141 11.262 5.771 8.789 771 HB2 ALA 141 HB2 ALA 141 12.971 6.139 8.603 772 HB3 ALA 141 HB3 ALA 141 12.027 6.948 9.860 773 H ASP 142 HN ASP 142 12.022 6.177 12.400 774 HA ASP 142 HA ASP 142 9.821 4.479 13.182 775 HB2 ASP 142 HB2 ASP 142 9.584 5.826 15.144 776 HB3 ASP 142 HB1 ASP 142 11.307 5.655 14.919 777 H ILE 143 HN ILE 143 7.773 4.946 12.840 778 HA ILE 143 HA ILE 143 7.374 7.281 11.202 779 HB ILE 143 HB ILE 143 5.150 6.215 10.565 780 HG12 ILE 143 HG12 ILE 143 5.279 3.590 10.798 781 HG13 ILE 143 HG11 ILE 143 6.282 3.940 12.190 782 HG21 ILE 143 HG21 ILE 143 7.676 4.727 9.937 783 HG22 ILE 143 HG22 ILE 143 7.047 6.146 9.091 784 HG23 ILE 143 HG23 ILE 143 6.178 4.605 9.018 785 HD11 ILE 143 HD11 ILE 143 3.487 4.970 11.827 786 HD12 ILE 143 HD12 ILE 143 4.480 5.059 13.284 787 HD13 ILE 143 HD13 ILE 143 3.897 3.499 12.694 788 H GLY 144 HN GLY 144 6.647 9.035 12.072 789 HA2 GLY 144 HA2 GLY 144 5.262 8.694 14.618 790 HA3 GLY 144 HA1 GLY 144 6.626 9.777 14.453 791 H ASN 145 HN ASN 145 4.020 10.229 15.328 792 HA ASN 145 HA ASN 145 3.475 12.586 13.823 793 HB2 ASN 145 HB2 ASN 145 1.926 11.153 12.670 794 HB3 ASN 145 HB1 ASN 145 1.435 10.378 14.171 795 HD21 ASN 145 HD21 ASN 145 -0.023 11.397 15.491 796 HD22 ASN 145 HD22 ASN 145 -0.919 12.803 15.021 797 H TRP 146 HN TRP 146 3.111 14.124 15.324 798 HA TRP 146 HA TRP 146 1.739 13.390 17.698 799 HB2 TRP 146 HB2 TRP 146 3.503 14.432 19.182 800 HB3 TRP 146 HB1 TRP 146 3.786 12.810 18.575 801 HD1 TRP 146 HD1 TRP 146 4.889 16.443 17.735 802 HE1 TRP 146 HE1 TRP 146 7.337 16.309 16.897 803 HE3 TRP 146 HE3 TRP 146 5.432 11.436 17.809 804 HZ2 TRP 146 HZ2 TRP 146 9.241 14.294 16.350 805 HZ3 TRP 146 HZ3 TRP 146 7.598 10.428 17.122 806 HH2 TRP 146 HH2 TRP 146 9.457 11.844 16.410 807 H ASP 147 HN ASP 147 1.265 15.077 19.037 808 HA ASP 147 HA ASP 147 0.728 17.483 17.475 809 HB2 ASP 147 HB2 ASP 147 -1.179 16.317 18.619 810 HB3 ASP 147 HB1 ASP 147 -0.402 16.643 20.160 811 H ASN 148 HN ASN 148 2.241 18.858 17.626 812 HA ASN 148 HA ASN 148 3.440 19.529 20.196 813 HB2 ASN 148 HB2 ASN 148 5.021 18.030 19.194 814 HB3 ASN 148 HB1 ASN 148 4.898 18.819 17.635 815 HD21 ASN 148 HD21 ASN 148 7.014 19.223 17.475 816 HD22 ASN 148 HD22 ASN 148 7.879 20.337 18.474 Start of MODEL 18 1 H1 MET 39 HT1 MET 39 2.546 5.270 0.170 2 H2 MET 39 HT2 MET 39 2.374 5.697 -1.425 3 H3 MET 39 HT3 MET 39 3.321 6.653 -0.406 4 HA MET 39 HA MET 39 4.729 5.328 -1.837 5 HB2 MET 39 HB2 MET 39 4.822 3.923 0.853 6 HB3 MET 39 HB1 MET 39 6.131 4.310 -0.243 7 HG2 MET 39 HG2 MET 39 6.367 5.659 1.664 8 HG3 MET 39 HG1 MET 39 5.841 6.709 0.357 9 HE1 MET 39 HE1 MET 39 4.183 8.339 3.475 10 HE2 MET 39 HE2 MET 39 5.137 8.615 2.023 11 HE3 MET 39 HE3 MET 39 5.782 7.607 3.320 12 H SER 40 HN SER 40 4.056 3.780 -3.358 13 HA SER 40 HA SER 40 3.013 1.330 -2.173 14 HB2 SER 40 HB2 SER 40 1.298 2.476 -3.556 15 HB3 SER 40 HB1 SER 40 2.388 2.405 -4.941 16 HG SER 40 HG SER 40 0.881 0.406 -3.720 17 H ARG 41 HN ARG 41 4.957 0.423 -1.891 18 HA ARG 41 HA ARG 41 6.023 -1.043 -4.090 19 HB2 ARG 41 HB2 ARG 41 7.732 0.939 -2.534 20 HB3 ARG 41 HB1 ARG 41 8.437 -0.482 -3.270 21 HG2 ARG 41 HG2 ARG 41 7.053 1.781 -4.706 22 HG3 ARG 41 HG1 ARG 41 8.790 1.483 -4.650 23 HD2 ARG 41 HD2 ARG 41 8.390 -0.718 -5.748 24 HD3 ARG 41 HD1 ARG 41 6.689 -0.286 -5.882 25 HE ARG 41 HE ARG 41 8.508 1.612 -7.017 26 HH11 ARG 41 HH11 ARG 41 6.448 -1.185 -7.638 27 HH12 ARG 41 HH12 ARG 41 6.487 -1.023 -9.328 28 HH21 ARG 41 HH21 ARG 41 8.573 1.841 -9.376 29 HH22 ARG 41 HH22 ARG 41 7.707 0.746 -10.339 30 HA PRO 42 HA PRO 42 6.398 -4.141 -0.840 31 HB2 PRO 42 HB2 PRO 42 9.291 -4.266 -1.571 32 HB3 PRO 42 HB1 PRO 42 8.146 -5.592 -1.344 33 HG2 PRO 42 HG2 PRO 42 8.837 -4.859 -3.799 34 HG3 PRO 42 HG1 PRO 42 7.151 -5.259 -3.432 35 HD2 PRO 42 HD2 PRO 42 8.412 -2.598 -3.862 36 HD3 PRO 42 HD1 PRO 42 6.782 -3.162 -4.281 37 H ASP 43 HN ASP 43 6.693 -3.894 1.295 38 HA ASP 43 HA ASP 43 7.284 -3.146 3.308 39 HB2 ASP 43 HB2 ASP 43 9.877 -2.333 1.977 40 HB3 ASP 43 HB1 ASP 43 9.546 -1.913 3.649 41 H GLN 44 HN GLN 44 7.631 -0.881 0.756 42 HA GLN 44 HA GLN 44 7.182 1.474 2.295 43 HB2 GLN 44 HB2 GLN 44 6.673 0.933 -0.627 44 HB3 GLN 44 HB1 GLN 44 6.699 2.516 0.130 45 HG2 GLN 44 HG2 GLN 44 9.039 0.624 0.017 46 HG3 GLN 44 HG1 GLN 44 8.793 1.987 -1.069 47 HE21 GLN 44 HE21 GLN 44 9.057 4.048 -0.296 48 HE22 GLN 44 HE22 GLN 44 9.839 4.389 1.198 49 H ALA 45 HN ALA 45 5.163 -0.947 0.937 50 HA ALA 45 HA ALA 45 2.672 0.348 1.153 51 HB1 ALA 45 HB1 ALA 45 3.005 -1.700 -0.159 52 HB2 ALA 45 HB2 ALA 45 1.713 -1.897 1.025 53 HB3 ALA 45 HB3 ALA 45 3.301 -2.600 1.330 54 H LYS 46 HN LYS 46 4.842 -0.875 3.513 55 HA LYS 46 HA LYS 46 2.823 -1.175 5.587 56 HB2 LYS 46 HB2 LYS 46 5.846 -1.179 5.695 57 HB3 LYS 46 HB1 LYS 46 4.782 -1.618 7.020 58 HG2 LYS 46 HG2 LYS 46 4.069 -3.588 5.887 59 HG3 LYS 46 HG1 LYS 46 4.868 -3.090 4.397 60 HD2 LYS 46 HD2 LYS 46 7.044 -3.232 5.509 61 HD3 LYS 46 HD1 LYS 46 6.250 -3.709 7.006 62 HE2 LYS 46 HE2 LYS 46 5.484 -5.710 6.071 63 HE3 LYS 46 HE1 LYS 46 6.004 -5.264 4.437 64 HZ1 LYS 46 HZ1 LYS 46 7.755 -5.863 6.782 65 HZ2 LYS 46 HZ2 LYS 46 8.336 -5.290 5.300 66 HZ3 LYS 46 HZ3 LYS 46 7.594 -6.790 5.394 67 H VAL 47 HN VAL 47 5.025 1.126 4.252 68 HA VAL 47 HA VAL 47 5.137 2.890 6.507 69 HB VAL 47 HB VAL 47 5.836 3.443 3.610 70 HG11 VAL 47 HG11 VAL 47 5.558 5.490 4.914 71 HG12 VAL 47 HG12 VAL 47 7.254 5.229 4.504 72 HG13 VAL 47 HG13 VAL 47 6.678 4.877 6.132 73 HG21 VAL 47 HG21 VAL 47 7.098 1.564 4.446 74 HG22 VAL 47 HG22 VAL 47 7.530 2.477 5.884 75 HG23 VAL 47 HG23 VAL 47 8.155 2.976 4.305 76 H THR 48 HN THR 48 3.419 2.755 3.468 77 HA THR 48 HA THR 48 2.182 5.253 3.692 78 HB THR 48 HB THR 48 2.455 4.063 1.546 79 HG1 THR 48 HG1 THR 48 0.760 5.679 1.811 80 HG21 THR 48 HG21 THR 48 0.228 2.270 2.514 81 HG22 THR 48 HG22 THR 48 1.919 1.814 2.322 82 HG23 THR 48 HG23 THR 48 0.961 2.253 0.902 83 H VAL 49 HN VAL 49 1.304 2.134 5.014 84 HA VAL 49 HA VAL 49 -1.318 3.091 5.694 85 HB VAL 49 HB VAL 49 -1.742 0.967 6.745 86 HG11 VAL 49 HG11 VAL 49 -0.324 0.625 4.126 87 HG12 VAL 49 HG12 VAL 49 -2.023 1.029 4.373 88 HG13 VAL 49 HG13 VAL 49 -1.413 -0.555 4.848 89 HG21 VAL 49 HG21 VAL 49 0.396 0.549 7.836 90 HG22 VAL 49 HG22 VAL 49 1.170 0.291 6.275 91 HG23 VAL 49 HG23 VAL 49 -0.054 -0.844 6.851 92 H ALA 50 HN ALA 50 1.778 2.648 7.202 93 HA ALA 50 HA ALA 50 1.124 2.988 9.872 94 HB1 ALA 50 HB1 ALA 50 3.576 3.906 8.415 95 HB2 ALA 50 HB2 ALA 50 3.308 2.261 9.008 96 HB3 ALA 50 HB3 ALA 50 3.431 3.611 10.146 97 H LYS 51 HN LYS 51 1.715 5.286 7.298 98 HA LYS 51 HA LYS 51 1.853 7.626 8.842 99 HB2 LYS 51 HB2 LYS 51 0.883 7.289 5.999 100 HB3 LYS 51 HB1 LYS 51 1.293 8.821 6.737 101 HG2 LYS 51 HG2 LYS 51 3.270 6.580 6.439 102 HG3 LYS 51 HG1 LYS 51 2.997 7.788 5.192 103 HD2 LYS 51 HD2 LYS 51 3.645 9.554 6.783 104 HD3 LYS 51 HD1 LYS 51 3.925 8.324 8.020 105 HE2 LYS 51 HE2 LYS 51 5.710 7.360 6.792 106 HE3 LYS 51 HE1 LYS 51 5.299 8.274 5.346 107 HZ1 LYS 51 HZ1 LYS 51 5.997 10.277 6.425 108 HZ2 LYS 51 HZ2 LYS 51 7.242 9.155 6.470 109 HZ3 LYS 51 HZ3 LYS 51 6.333 9.462 7.865 110 H GLY 52 HN GLY 52 -0.814 5.689 7.749 111 HA2 GLY 52 HA2 GLY 52 -2.739 7.812 8.222 112 HA3 GLY 52 HA1 GLY 52 -3.100 6.209 7.577 113 H ASP 53 HN ASP 53 -1.483 4.992 9.704 114 HA ASP 53 HA ASP 53 -3.639 4.932 11.585 115 HB2 ASP 53 HB2 ASP 53 -1.289 3.146 11.142 116 HB3 ASP 53 HB1 ASP 53 -2.278 3.012 12.596 117 H ILE 54 HN ILE 54 -0.431 6.166 11.523 118 HA ILE 54 HA ILE 54 -0.514 6.885 14.274 119 HB ILE 54 HB ILE 54 1.226 8.590 13.731 120 HG12 ILE 54 HG12 ILE 54 0.811 7.577 10.909 121 HG13 ILE 54 HG11 ILE 54 0.531 9.209 11.494 122 HG21 ILE 54 HG21 ILE 54 1.728 5.818 12.692 123 HG22 ILE 54 HG22 ILE 54 1.877 6.368 14.363 124 HG23 ILE 54 HG23 ILE 54 2.976 6.984 13.129 125 HD11 ILE 54 HD11 ILE 54 3.174 7.819 11.237 126 HD12 ILE 54 HD12 ILE 54 2.938 9.448 11.878 127 HD13 ILE 54 HD13 ILE 54 2.549 9.093 10.190 128 H LYS 55 HN LYS 55 -1.796 8.313 11.344 129 HA LYS 55 HA LYS 55 -2.607 10.749 12.589 130 HB2 LYS 55 HB2 LYS 55 -3.543 9.401 10.063 131 HB3 LYS 55 HB1 LYS 55 -4.143 10.963 10.584 132 HG2 LYS 55 HG2 LYS 55 -1.302 10.283 9.829 133 HG3 LYS 55 HG1 LYS 55 -2.430 11.293 8.923 134 HD2 LYS 55 HD2 LYS 55 -2.476 12.892 10.787 135 HD3 LYS 55 HD1 LYS 55 -1.346 11.843 11.660 136 HE2 LYS 55 HE2 LYS 55 0.342 12.197 9.973 137 HE3 LYS 55 HE1 LYS 55 -0.768 13.193 9.031 138 HZ1 LYS 55 HZ1 LYS 55 0.077 13.846 11.803 139 HZ2 LYS 55 HZ2 LYS 55 -0.774 14.844 10.735 140 HZ3 LYS 55 HZ3 LYS 55 0.825 14.466 10.431 141 H ALA 56 HN ALA 56 -3.871 7.596 12.448 142 HA ALA 56 HA ALA 56 -6.525 8.149 13.270 143 HB1 ALA 56 HB1 ALA 56 -6.603 5.768 13.848 144 HB2 ALA 56 HB2 ALA 56 -4.842 5.701 13.721 145 HB3 ALA 56 HB3 ALA 56 -5.812 6.017 12.280 146 H ILE 57 HN ILE 57 -3.529 7.438 14.928 147 HA ILE 57 HA ILE 57 -4.584 7.428 17.551 148 HB ILE 57 HB ILE 57 -1.736 7.984 16.655 149 HG12 ILE 57 HG12 ILE 57 -2.945 5.430 17.649 150 HG13 ILE 57 HG11 ILE 57 -2.824 5.809 15.927 151 HG21 ILE 57 HG21 ILE 57 -2.864 7.112 19.331 152 HG22 ILE 57 HG22 ILE 57 -2.179 8.697 18.966 153 HG23 ILE 57 HG23 ILE 57 -1.150 7.262 18.942 154 HD11 ILE 57 HD11 ILE 57 -0.418 5.895 16.141 155 HD12 ILE 57 HD12 ILE 57 -1.067 4.345 16.651 156 HD13 ILE 57 HD13 ILE 57 -0.531 5.523 17.863 157 H ALA 58 HN ALA 58 -3.294 9.913 15.458 158 HA ALA 58 HA ALA 58 -3.110 12.025 17.290 159 HB1 ALA 58 HB1 ALA 58 -2.279 12.171 15.002 160 HB2 ALA 58 HB2 ALA 58 -3.345 13.519 15.388 161 HB3 ALA 58 HB3 ALA 58 -3.937 12.179 14.394 162 H ALA 59 HN ALA 59 -5.853 10.640 15.685 163 HA ALA 59 HA ALA 59 -7.654 12.730 16.482 164 HB1 ALA 59 HB1 ALA 59 -9.368 11.347 15.411 165 HB2 ALA 59 HB2 ALA 59 -8.186 10.056 15.183 166 HB3 ALA 59 HB3 ALA 59 -7.985 11.595 14.344 167 H ALA 60 HN ALA 60 -6.769 9.469 17.487 168 HA ALA 60 HA ALA 60 -8.930 9.314 19.371 169 HB1 ALA 60 HB1 ALA 60 -8.111 7.279 18.330 170 HB2 ALA 60 HB2 ALA 60 -7.860 7.218 20.093 171 HB3 ALA 60 HB3 ALA 60 -6.521 7.565 19.035 172 H LEU 61 HN LEU 61 -5.550 10.269 19.531 173 HA LEU 61 HA LEU 61 -5.391 10.258 22.352 174 HB2 LEU 61 HB2 LEU 61 -3.621 10.577 20.312 175 HB3 LEU 61 HB1 LEU 61 -3.842 12.247 20.769 176 HG LEU 61 HG LEU 61 -1.855 11.266 21.788 177 HD11 LEU 61 HD11 LEU 61 -4.008 11.847 23.806 178 HD12 LEU 61 HD12 LEU 61 -2.930 13.022 23.038 179 HD13 LEU 61 HD13 LEU 61 -2.278 11.812 24.139 180 HD21 LEU 61 HD21 LEU 61 -2.008 9.575 23.474 181 HD22 LEU 61 HD22 LEU 61 -2.641 8.970 21.924 182 HD23 LEU 61 HD23 LEU 61 -3.745 9.478 23.220 183 H ASP 62 HN ASP 62 -6.539 12.388 19.914 184 HA ASP 62 HA ASP 62 -7.072 14.671 21.516 185 HB2 ASP 62 HB2 ASP 62 -6.872 14.844 19.095 186 HB3 ASP 62 HB1 ASP 62 -8.221 13.748 18.871 187 H MET 63 HN MET 63 -8.575 11.634 21.115 188 HA MET 63 HA MET 63 -11.158 12.475 22.088 189 HB2 MET 63 HB2 MET 63 -10.045 9.678 21.697 190 HB3 MET 63 HB1 MET 63 -11.707 10.038 22.133 191 HG2 MET 63 HG2 MET 63 -12.090 11.092 20.016 192 HG3 MET 63 HG1 MET 63 -10.387 10.952 19.591 193 HE1 MET 63 HE1 MET 63 -12.595 10.038 17.591 194 HE2 MET 63 HE2 MET 63 -11.993 8.466 17.071 195 HE3 MET 63 HE3 MET 63 -10.873 9.810 17.284 196 H TYR 64 HN TYR 64 -8.303 10.755 23.333 197 HA TYR 64 HA TYR 64 -9.231 10.468 26.019 198 HB2 TYR 64 HB2 TYR 64 -7.130 9.379 25.112 199 HB3 TYR 64 HB1 TYR 64 -6.353 10.964 25.173 200 HD1 TYR 64 HD2 TYR 64 -5.917 12.053 27.392 201 HD2 TYR 64 HD1 TYR 64 -7.555 8.133 27.162 202 HE1 TYR 64 HE2 TYR 64 -5.422 11.699 29.704 203 HE2 TYR 64 HE1 TYR 64 -7.081 7.786 29.426 204 HH TYR 64 HH TYR 64 -6.598 10.263 31.404 205 H LYS 65 HN LYS 65 -7.611 13.001 24.225 206 HA LYS 65 HA LYS 65 -7.112 14.936 26.083 207 HB2 LYS 65 HB2 LYS 65 -6.400 15.175 23.869 208 HB3 LYS 65 HB1 LYS 65 -8.031 14.976 23.265 209 HG2 LYS 65 HG2 LYS 65 -8.617 17.154 24.121 210 HG3 LYS 65 HG1 LYS 65 -6.940 17.396 24.678 211 HD2 LYS 65 HD2 LYS 65 -6.136 17.092 22.431 212 HD3 LYS 65 HD1 LYS 65 -7.754 16.722 21.863 213 HE2 LYS 65 HE2 LYS 65 -8.422 19.028 22.464 214 HE3 LYS 65 HE1 LYS 65 -6.727 19.360 22.864 215 HZ1 LYS 65 HZ1 LYS 65 -6.098 18.838 20.627 216 HZ2 LYS 65 HZ2 LYS 65 -7.334 19.982 20.536 217 HZ3 LYS 65 HZ3 LYS 65 -7.650 18.336 20.256 218 H LEU 66 HN LEU 66 -10.166 14.233 24.387 219 HA LEU 66 HA LEU 66 -11.560 16.219 25.906 220 HB2 LEU 66 HB2 LEU 66 -12.378 14.250 23.829 221 HB3 LEU 66 HB1 LEU 66 -13.604 14.833 24.934 222 HG LEU 66 HG LEU 66 -13.183 17.121 24.226 223 HD11 LEU 66 HD11 LEU 66 -11.253 15.936 22.237 224 HD12 LEU 66 HD12 LEU 66 -10.847 16.985 23.596 225 HD13 LEU 66 HD13 LEU 66 -11.807 17.611 22.255 226 HD21 LEU 66 HD21 LEU 66 -14.912 15.872 23.125 227 HD22 LEU 66 HD22 LEU 66 -13.753 15.206 21.980 228 HD23 LEU 66 HD23 LEU 66 -14.118 16.933 21.960 229 H ASP 67 HN ASP 67 -10.978 12.764 26.201 230 HA ASP 67 HA ASP 67 -13.039 12.257 28.127 231 HB2 ASP 67 HB2 ASP 67 -11.957 10.465 26.775 232 HB3 ASP 67 HB1 ASP 67 -10.464 10.758 27.656 233 H ASN 68 HN ASN 68 -9.828 13.565 28.418 234 HA ASN 68 HA ASN 68 -10.400 13.866 31.349 235 HB2 ASN 68 HB2 ASN 68 -7.662 13.454 30.170 236 HB3 ASN 68 HB1 ASN 68 -8.108 13.906 31.810 237 HD21 ASN 68 HD21 ASN 68 -9.717 11.377 29.962 238 HD22 ASN 68 HD22 ASN 68 -9.254 10.064 30.918 239 H PHE 69 HN PHE 69 -10.756 15.502 28.911 240 HA PHE 69 HA PHE 69 -10.432 17.651 28.215 241 HB2 PHE 69 HB2 PHE 69 -10.818 19.291 30.148 242 HB3 PHE 69 HB1 PHE 69 -12.062 18.099 29.810 243 HD1 PHE 69 HD2 PHE 69 -9.359 18.957 32.007 244 HD2 PHE 69 HD1 PHE 69 -12.610 16.506 31.377 245 HE1 PHE 69 HE2 PHE 69 -9.282 18.359 34.388 246 HE2 PHE 69 HE1 PHE 69 -12.637 15.804 33.707 247 HZ PHE 69 HZ PHE 69 -10.942 16.734 35.271 248 H ALA 70 HN ALA 70 -8.021 16.392 28.420 249 HA ALA 70 HA ALA 70 -6.089 18.394 28.404 250 HB1 ALA 70 HB1 ALA 70 -4.903 17.794 30.514 251 HB2 ALA 70 HB2 ALA 70 -6.293 16.754 30.923 252 HB3 ALA 70 HB3 ALA 70 -6.516 18.476 30.806 253 H TYR 71 HN TYR 71 -4.138 17.476 27.729 254 HA TYR 71 HA TYR 71 -4.231 14.773 26.894 255 HB2 TYR 71 HB2 TYR 71 -2.150 16.925 26.766 256 HB3 TYR 71 HB1 TYR 71 -1.721 15.264 26.387 257 HD1 TYR 71 HD2 TYR 71 -3.684 14.167 24.803 258 HD2 TYR 71 HD1 TYR 71 -2.500 18.229 24.921 259 HE1 TYR 71 HE2 TYR 71 -4.441 14.388 22.557 260 HE2 TYR 71 HE1 TYR 71 -3.251 18.518 22.620 261 HH TYR 71 HH TYR 71 -3.534 17.053 20.609 262 HA PRO 72 HA PRO 72 -2.718 12.564 30.384 263 HB2 PRO 72 HB2 PRO 72 -1.034 10.800 29.068 264 HB3 PRO 72 HB1 PRO 72 -2.794 10.630 29.125 265 HG2 PRO 72 HG2 PRO 72 -1.043 11.810 27.012 266 HG3 PRO 72 HG1 PRO 72 -2.407 10.690 26.836 267 HD2 PRO 72 HD2 PRO 72 -2.699 13.258 26.348 268 HD3 PRO 72 HD1 PRO 72 -3.972 12.358 27.199 269 H SER 73 HN SER 73 -0.644 12.161 31.686 270 HA SER 73 HA SER 73 1.469 13.968 30.824 271 HB2 SER 73 HB2 SER 73 2.298 13.591 33.164 272 HB3 SER 73 HB1 SER 73 0.672 14.265 33.115 273 HG SER 73 HG SER 73 -0.060 12.582 34.003 274 H THR 74 HN THR 74 3.737 13.034 30.924 275 HA THR 74 HA THR 74 3.606 10.572 29.524 276 HB THR 74 HB THR 74 5.316 12.534 29.230 277 HG1 THR 74 HG1 THR 74 6.946 10.603 28.773 278 HG21 THR 74 HG21 THR 74 6.720 10.836 31.315 279 HG22 THR 74 HG22 THR 74 6.223 12.508 31.515 280 HG23 THR 74 HG23 THR 74 7.498 12.103 30.366 281 H GLN 75 HN GLN 75 3.710 11.267 32.795 282 HA GLN 75 HA GLN 75 4.604 8.570 33.388 283 HB2 GLN 75 HB2 GLN 75 4.159 10.970 35.119 284 HB3 GLN 75 HB1 GLN 75 4.523 9.377 35.790 285 HG2 GLN 75 HG2 GLN 75 6.660 9.392 34.657 286 HG3 GLN 75 HG1 GLN 75 6.260 10.918 33.870 287 HE21 GLN 75 HE21 GLN 75 6.280 12.792 35.075 288 HE22 GLN 75 HE22 GLN 75 7.076 12.899 36.605 289 H GLN 76 HN GLN 76 1.868 10.738 34.495 290 HA GLN 76 HA GLN 76 0.390 8.396 35.429 291 HB2 GLN 76 HB2 GLN 76 -0.449 11.290 35.243 292 HB3 GLN 76 HB1 GLN 76 -1.310 10.003 36.066 293 HG2 GLN 76 HG2 GLN 76 0.481 9.805 37.679 294 HG3 GLN 76 HG1 GLN 76 1.409 11.040 36.832 295 HE21 GLN 76 HE21 GLN 76 0.432 11.008 39.555 296 HE22 GLN 76 HE22 GLN 76 -0.553 12.414 39.744 297 H GLY 77 HN GLY 77 0.238 10.651 32.781 298 HA2 GLY 77 HA2 GLY 77 -2.218 9.531 31.899 299 HA3 GLY 77 HA1 GLY 77 -1.216 10.631 30.985 300 H LEU 78 HN LEU 78 1.104 8.669 31.431 301 HA LEU 78 HA LEU 78 0.684 7.179 29.032 302 HB2 LEU 78 HB2 LEU 78 2.953 7.908 30.011 303 HB3 LEU 78 HB1 LEU 78 2.779 6.595 31.147 304 HG LEU 78 HG LEU 78 2.921 6.190 28.152 305 HD11 LEU 78 HD11 LEU 78 5.108 5.993 30.202 306 HD12 LEU 78 HD12 LEU 78 4.962 7.221 28.945 307 HD13 LEU 78 HD13 LEU 78 5.232 5.534 28.504 308 HD21 LEU 78 HD21 LEU 78 3.318 4.252 30.442 309 HD22 LEU 78 HD22 LEU 78 3.489 3.877 28.727 310 HD23 LEU 78 HD23 LEU 78 1.911 4.314 29.382 311 H GLU 79 HN GLU 79 0.743 6.401 32.459 312 HA GLU 79 HA GLU 79 -0.178 3.755 32.008 313 HB2 GLU 79 HB2 GLU 79 0.045 5.386 34.504 314 HB3 GLU 79 HB1 GLU 79 -0.584 3.741 34.493 315 HG2 GLU 79 HG2 GLU 79 1.451 3.037 33.394 316 HG3 GLU 79 HG1 GLU 79 2.141 4.655 33.660 317 H ALA 80 HN ALA 80 -1.684 6.681 31.897 318 HA ALA 80 HA ALA 80 -4.278 5.519 32.481 319 HB1 ALA 80 HB1 ALA 80 -5.154 7.729 32.365 320 HB2 ALA 80 HB2 ALA 80 -3.714 8.300 31.563 321 HB3 ALA 80 HB3 ALA 80 -3.619 7.840 33.272 322 H LEU 81 HN LEU 81 -2.186 5.846 29.916 323 HA LEU 81 HA LEU 81 -4.295 5.695 27.906 324 HB2 LEU 81 HB2 LEU 81 -1.280 5.612 27.668 325 HB3 LEU 81 HB1 LEU 81 -2.366 5.402 26.317 326 HG LEU 81 HG LEU 81 -2.117 7.916 27.976 327 HD11 LEU 81 HD11 LEU 81 -0.108 7.507 26.634 328 HD12 LEU 81 HD12 LEU 81 -1.029 8.858 25.984 329 HD13 LEU 81 HD13 LEU 81 -1.104 7.289 25.196 330 HD21 LEU 81 HD21 LEU 81 -4.359 7.634 27.027 331 HD22 LEU 81 HD22 LEU 81 -3.652 7.351 25.435 332 HD23 LEU 81 HD23 LEU 81 -3.491 8.927 26.201 333 H VAL 82 HN VAL 82 -2.312 3.770 29.820 334 HA VAL 82 HA VAL 82 -2.932 1.380 28.219 335 HB VAL 82 HB VAL 82 -0.972 1.598 30.502 336 HG11 VAL 82 HG11 VAL 82 -1.367 -0.537 28.406 337 HG12 VAL 82 HG12 VAL 82 -1.751 -0.681 30.121 338 HG13 VAL 82 HG13 VAL 82 -0.071 -0.513 29.604 339 HG21 VAL 82 HG21 VAL 82 -0.480 1.712 27.529 340 HG22 VAL 82 HG22 VAL 82 0.768 1.695 28.774 341 HG23 VAL 82 HG23 VAL 82 -0.346 3.053 28.653 342 H LYS 83 HN LYS 83 -3.086 2.593 31.568 343 HA LYS 83 HA LYS 83 -5.079 0.547 32.126 344 HB2 LYS 83 HB2 LYS 83 -3.100 1.968 33.893 345 HB3 LYS 83 HB1 LYS 83 -4.583 1.342 34.610 346 HG2 LYS 83 HG2 LYS 83 -3.138 -0.383 35.011 347 HG3 LYS 83 HG1 LYS 83 -3.745 -0.879 33.438 348 HD2 LYS 83 HD2 LYS 83 -1.385 -1.165 33.435 349 HD3 LYS 83 HD1 LYS 83 -1.746 0.243 32.423 350 HE2 LYS 83 HE2 LYS 83 -1.070 1.743 34.166 351 HE3 LYS 83 HE1 LYS 83 -0.950 0.428 35.331 352 HZ1 LYS 83 HZ1 LYS 83 1.198 1.152 34.542 353 HZ2 LYS 83 HZ2 LYS 83 0.815 0.737 32.939 354 HZ3 LYS 83 HZ3 LYS 83 0.915 -0.447 34.128 355 H LYS 84 HN LYS 84 -7.032 1.264 33.171 356 HA LYS 84 HA LYS 84 -8.239 3.493 32.064 357 HB2 LYS 84 HB2 LYS 84 -9.162 1.396 33.049 358 HB3 LYS 84 HB1 LYS 84 -8.771 2.041 34.626 359 HG2 LYS 84 HG2 LYS 84 -10.389 3.791 34.358 360 HG3 LYS 84 HG1 LYS 84 -10.704 3.267 32.692 361 HD2 LYS 84 HD2 LYS 84 -12.415 2.241 33.993 362 HD3 LYS 84 HD1 LYS 84 -11.159 1.050 33.587 363 HE2 LYS 84 HE2 LYS 84 -10.167 1.260 35.800 364 HE3 LYS 84 HE1 LYS 84 -11.393 2.452 36.240 365 HZ1 LYS 84 HZ1 LYS 84 -11.927 -0.355 35.490 366 HZ2 LYS 84 HZ2 LYS 84 -13.074 0.771 35.985 367 HZ3 LYS 84 HZ3 LYS 84 -11.887 0.237 37.071 368 HA PRO 85 HA PRO 85 -6.342 6.844 34.115 369 HB2 PRO 85 HB2 PRO 85 -8.424 8.629 34.071 370 HB3 PRO 85 HB1 PRO 85 -7.330 8.313 32.716 371 HG2 PRO 85 HG2 PRO 85 -10.054 7.196 33.225 372 HG3 PRO 85 HG1 PRO 85 -9.340 7.756 31.699 373 HD2 PRO 85 HD2 PRO 85 -9.510 5.166 32.267 374 HD3 PRO 85 HD1 PRO 85 -8.083 5.824 31.442 375 H THR 86 HN THR 86 -5.927 6.925 36.071 376 HA THR 86 HA THR 86 -7.901 6.412 38.112 377 HB THR 86 HB THR 86 -5.597 5.407 38.138 378 HG1 THR 86 HG1 THR 86 -6.952 6.430 40.173 379 HG21 THR 86 HG21 THR 86 -4.720 8.207 38.860 380 HG22 THR 86 HG22 THR 86 -4.339 7.358 37.366 381 HG23 THR 86 HG23 THR 86 -3.694 6.773 38.897 382 H GLY 87 HN GLY 87 -6.967 9.008 36.407 383 HA2 GLY 87 HA2 GLY 87 -7.087 11.032 38.495 384 HA3 GLY 87 HA1 GLY 87 -6.887 11.317 36.764 385 H ASN 88 HN ASN 88 -8.545 12.886 36.637 386 HA ASN 88 HA ASN 88 -11.238 11.807 37.144 387 HB2 ASN 88 HB2 ASN 88 -10.404 14.723 37.137 388 HB3 ASN 88 HB1 ASN 88 -12.025 14.125 37.418 389 HD21 ASN 88 HD21 ASN 88 -8.904 14.632 38.750 390 HD22 ASN 88 HD22 ASN 88 -9.304 14.198 40.375 391 HA PRO 89 HA PRO 89 -11.498 12.710 32.740 392 HB2 PRO 89 HB2 PRO 89 -12.275 10.297 31.899 393 HB3 PRO 89 HB1 PRO 89 -10.612 10.611 32.352 394 HG2 PRO 89 HG2 PRO 89 -12.656 9.031 33.794 395 HG3 PRO 89 HG1 PRO 89 -10.892 8.980 33.944 396 HD2 PRO 89 HD2 PRO 89 -12.820 10.408 35.601 397 HD3 PRO 89 HD1 PRO 89 -11.075 10.185 35.857 398 H GLN 90 HN GLN 90 -13.308 12.804 31.300 399 HA GLN 90 HA GLN 90 -15.965 12.701 32.583 400 HB2 GLN 90 HB2 GLN 90 -15.132 14.153 30.052 401 HB3 GLN 90 HB1 GLN 90 -16.729 14.193 30.777 402 HG2 GLN 90 HG2 GLN 90 -15.801 15.336 32.723 403 HG3 GLN 90 HG1 GLN 90 -14.210 15.317 31.963 404 HE21 GLN 90 HE21 GLN 90 -13.900 16.552 30.077 405 HE22 GLN 90 HE22 GLN 90 -14.897 17.900 29.706 406 HA PRO 91 HA PRO 91 -15.618 8.709 30.688 407 HB2 PRO 91 HB2 PRO 91 -18.568 8.961 30.929 408 HB3 PRO 91 HB1 PRO 91 -17.519 7.573 31.253 409 HG2 PRO 91 HG2 PRO 91 -18.339 9.094 33.256 410 HG3 PRO 91 HG1 PRO 91 -16.671 8.496 33.209 411 HD2 PRO 91 HD2 PRO 91 -17.708 11.236 32.716 412 HD3 PRO 91 HD1 PRO 91 -16.134 10.713 33.350 413 H LYS 92 HN LYS 92 -14.856 9.163 28.632 414 HA LYS 92 HA LYS 92 -16.843 8.604 26.598 415 HB2 LYS 92 HB2 LYS 92 -13.924 9.499 26.387 416 HB3 LYS 92 HB1 LYS 92 -14.763 8.755 25.050 417 HG2 LYS 92 HG2 LYS 92 -14.791 11.049 24.590 418 HG3 LYS 92 HG1 LYS 92 -16.401 10.711 25.208 419 HD2 LYS 92 HD2 LYS 92 -15.673 11.529 27.426 420 HD3 LYS 92 HD1 LYS 92 -14.095 11.843 26.702 421 HE2 LYS 92 HE2 LYS 92 -15.388 13.908 26.852 422 HE3 LYS 92 HE1 LYS 92 -15.057 13.467 25.185 423 HZ1 LYS 92 HZ1 LYS 92 -17.337 14.222 25.547 424 HZ2 LYS 92 HZ2 LYS 92 -17.628 12.901 26.561 425 HZ3 LYS 92 HZ3 LYS 92 -17.271 12.656 24.943 426 H ASN 93 HN ASN 93 -16.394 6.664 25.518 427 HA ASN 93 HA ASN 93 -15.595 4.557 27.216 428 HB2 ASN 93 HB2 ASN 93 -15.839 4.484 24.187 429 HB3 ASN 93 HB1 ASN 93 -15.633 3.066 25.200 430 HD21 ASN 93 HD21 ASN 93 -17.547 2.136 24.614 431 HD22 ASN 93 HD22 ASN 93 -19.096 2.760 25.057 432 H TRP 94 HN TRP 94 -13.620 4.897 28.069 433 HA TRP 94 HA TRP 94 -11.330 5.717 26.885 434 HB2 TRP 94 HB2 TRP 94 -11.669 5.687 29.270 435 HB3 TRP 94 HB1 TRP 94 -11.756 3.930 29.273 436 HD1 TRP 94 HD1 TRP 94 -9.221 6.816 29.005 437 HE1 TRP 94 HE1 TRP 94 -6.873 5.815 29.335 438 HE3 TRP 94 HE3 TRP 94 -10.412 1.849 29.124 439 HZ2 TRP 94 HZ2 TRP 94 -5.701 3.330 29.614 440 HZ3 TRP 94 HZ3 TRP 94 -8.607 0.232 29.446 441 HH2 TRP 94 HH2 TRP 94 -6.297 0.968 29.686 442 H ASN 95 HN ASN 95 -9.604 4.826 26.023 443 HA ASN 95 HA ASN 95 -9.867 2.085 25.190 444 HB2 ASN 95 HB2 ASN 95 -10.195 3.528 23.297 445 HB3 ASN 95 HB1 ASN 95 -8.732 4.416 23.681 446 HD21 ASN 95 HD21 ASN 95 -9.232 0.852 23.593 447 HD22 ASN 95 HD22 ASN 95 -7.966 0.635 22.438 448 H LYS 96 HN LYS 96 -7.930 0.832 25.489 449 HA LYS 96 HA LYS 96 -5.723 2.183 26.821 450 HB2 LYS 96 HB2 LYS 96 -4.857 0.053 27.354 451 HB3 LYS 96 HB1 LYS 96 -6.584 0.017 27.739 452 HG2 LYS 96 HG2 LYS 96 -6.932 -1.201 25.580 453 HG3 LYS 96 HG1 LYS 96 -5.170 -1.149 25.377 454 HD2 LYS 96 HD2 LYS 96 -4.885 -2.365 27.471 455 HD3 LYS 96 HD1 LYS 96 -6.636 -2.465 27.648 456 HE2 LYS 96 HE2 LYS 96 -6.798 -3.757 25.602 457 HE3 LYS 96 HE1 LYS 96 -5.059 -3.603 25.352 458 HZ1 LYS 96 HZ1 LYS 96 -6.400 -5.042 27.576 459 HZ2 LYS 96 HZ2 LYS 96 -4.740 -4.837 27.449 460 HZ3 LYS 96 HZ3 LYS 96 -5.555 -5.737 26.301 461 H ASP 97 HN ASP 97 -3.596 1.089 26.278 462 HA ASP 97 HA ASP 97 -1.839 0.686 25.014 463 HB2 ASP 97 HB2 ASP 97 -3.347 -1.201 24.151 464 HB3 ASP 97 HB1 ASP 97 -3.643 -0.199 22.739 465 H GLY 98 HN GLY 98 -3.390 3.172 24.924 466 HA2 GLY 98 HA2 GLY 98 -1.915 5.075 24.414 467 HA3 GLY 98 HA1 GLY 98 -1.606 4.314 22.876 468 H TYR 99 HN TYR 99 -4.859 4.039 23.621 469 HA TYR 99 HA TYR 99 -6.675 4.831 22.623 470 HB2 TYR 99 HB2 TYR 99 -5.471 7.195 23.758 471 HB3 TYR 99 HB1 TYR 99 -6.197 7.638 22.217 472 HD1 TYR 99 HD1 TYR 99 -6.725 6.409 25.597 473 HD2 TYR 99 HD2 TYR 99 -8.588 7.583 21.975 474 HE1 TYR 99 HE1 TYR 99 -8.857 6.583 26.742 475 HE2 TYR 99 HE2 TYR 99 -10.740 7.763 23.138 476 HH TYR 99 HH TYR 99 -10.922 7.570 26.535 477 H LEU 100 HN LEU 100 -6.611 3.797 20.823 478 HA LEU 100 HA LEU 100 -5.841 5.219 18.402 479 HB2 LEU 100 HB2 LEU 100 -4.102 3.474 19.278 480 HB3 LEU 100 HB1 LEU 100 -5.324 2.284 18.925 481 HG LEU 100 HG LEU 100 -4.093 4.075 16.830 482 HD11 LEU 100 HD11 LEU 100 -3.359 1.266 17.635 483 HD12 LEU 100 HD12 LEU 100 -2.378 2.712 17.875 484 HD13 LEU 100 HD13 LEU 100 -2.718 2.136 16.244 485 HD21 LEU 100 HD21 LEU 100 -6.227 3.061 16.169 486 HD22 LEU 100 HD22 LEU 100 -5.589 1.468 16.579 487 HD23 LEU 100 HD23 LEU 100 -4.875 2.397 15.256 488 H LYS 101 HN LYS 101 -7.306 4.530 16.716 489 HA LYS 101 HA LYS 101 -9.861 3.747 17.662 490 HB2 LYS 101 HB2 LYS 101 -8.796 3.925 14.866 491 HB3 LYS 101 HB1 LYS 101 -10.474 3.604 15.253 492 HG2 LYS 101 HG2 LYS 101 -10.452 5.781 16.550 493 HG3 LYS 101 HG1 LYS 101 -8.906 6.102 15.762 494 HD2 LYS 101 HD2 LYS 101 -11.448 5.435 14.363 495 HD3 LYS 101 HD1 LYS 101 -10.861 7.101 14.570 496 HE2 LYS 101 HE2 LYS 101 -8.800 6.387 13.313 497 HE3 LYS 101 HE1 LYS 101 -9.580 4.838 13.018 498 HZ1 LYS 101 HZ1 LYS 101 -10.541 7.485 12.138 499 HZ2 LYS 101 HZ2 LYS 101 -11.372 6.044 11.873 500 HZ3 LYS 101 HZ3 LYS 101 -9.854 6.307 11.161 501 H LYS 102 HN LYS 102 -10.927 1.936 15.930 502 HA LYS 102 HA LYS 102 -9.691 -0.430 16.989 503 HB2 LYS 102 HB2 LYS 102 -12.343 0.068 15.689 504 HB3 LYS 102 HB1 LYS 102 -11.720 -1.572 15.738 505 HG2 LYS 102 HG2 LYS 102 -13.250 -1.110 17.610 506 HG3 LYS 102 HG1 LYS 102 -11.632 -1.521 18.161 507 HD2 LYS 102 HD2 LYS 102 -12.367 0.278 19.534 508 HD3 LYS 102 HD1 LYS 102 -11.221 0.967 18.394 509 HE2 LYS 102 HE2 LYS 102 -13.096 2.454 18.630 510 HE3 LYS 102 HE1 LYS 102 -13.123 1.749 17.017 511 HZ1 LYS 102 HZ1 LYS 102 -14.741 0.762 19.300 512 HZ2 LYS 102 HZ2 LYS 102 -14.866 0.268 17.684 513 HZ3 LYS 102 HZ3 LYS 102 -15.306 1.830 18.133 514 H LEU 103 HN LEU 103 -7.845 0.022 15.852 515 HA LEU 103 HA LEU 103 -7.667 -1.352 13.278 516 HB2 LEU 103 HB2 LEU 103 -6.216 1.141 14.191 517 HB3 LEU 103 HB1 LEU 103 -5.828 0.264 12.721 518 HG LEU 103 HG LEU 103 -8.441 1.674 13.291 519 HD11 LEU 103 HD11 LEU 103 -6.118 2.472 11.550 520 HD12 LEU 103 HD12 LEU 103 -6.600 3.241 13.063 521 HD13 LEU 103 HD13 LEU 103 -7.663 3.312 11.657 522 HD21 LEU 103 HD21 LEU 103 -8.876 1.327 10.904 523 HD22 LEU 103 HD22 LEU 103 -8.700 -0.206 11.754 524 HD23 LEU 103 HD23 LEU 103 -7.379 0.409 10.763 525 HA PRO 104 HA PRO 104 -4.644 -3.794 15.565 526 HB2 PRO 104 HB2 PRO 104 -3.058 -3.955 13.077 527 HB3 PRO 104 HB1 PRO 104 -3.795 -5.254 14.015 528 HG2 PRO 104 HG2 PRO 104 -4.800 -4.535 11.657 529 HG3 PRO 104 HG1 PRO 104 -5.851 -4.998 13.008 530 HD2 PRO 104 HD2 PRO 104 -5.170 -2.269 11.999 531 HD3 PRO 104 HD1 PRO 104 -6.747 -2.929 12.496 532 H VAL 105 HN VAL 105 -2.049 -4.062 15.442 533 HA VAL 105 HA VAL 105 -1.020 -1.455 16.142 534 HB VAL 105 HB VAL 105 -0.733 -3.670 17.421 535 HG11 VAL 105 HG11 VAL 105 0.026 -5.107 15.703 536 HG12 VAL 105 HG12 VAL 105 1.265 -4.984 16.956 537 HG13 VAL 105 HG13 VAL 105 1.457 -4.109 15.440 538 HG21 VAL 105 HG21 VAL 105 1.332 -3.048 18.377 539 HG22 VAL 105 HG22 VAL 105 0.379 -1.584 18.086 540 HG23 VAL 105 HG23 VAL 105 1.740 -1.979 17.040 541 H ASP 106 HN ASP 106 1.607 -1.296 15.333 542 HA ASP 106 HA ASP 106 1.104 -0.766 12.539 543 HB2 ASP 106 HB2 ASP 106 2.545 0.631 14.416 544 HB3 ASP 106 HB1 ASP 106 3.828 -0.311 13.659 545 HA PRO 107 HA PRO 107 3.234 -4.198 10.441 546 HB2 PRO 107 HB2 PRO 107 5.049 -2.057 9.520 547 HB3 PRO 107 HB1 PRO 107 4.332 -3.391 8.625 548 HG2 PRO 107 HG2 PRO 107 3.288 -0.937 8.409 549 HG3 PRO 107 HG1 PRO 107 2.235 -2.359 8.487 550 HD2 PRO 107 HD2 PRO 107 2.774 -0.295 10.539 551 HD3 PRO 107 HD1 PRO 107 1.336 -1.307 10.287 552 H TRP 108 HN TRP 108 5.313 -5.126 10.206 553 HA TRP 108 HA TRP 108 7.224 -5.920 10.768 554 HB2 TRP 108 HB2 TRP 108 7.987 -3.466 12.347 555 HB3 TRP 108 HB1 TRP 108 9.050 -4.576 11.500 556 HD1 TRP 108 HD1 TRP 108 8.617 -4.487 8.692 557 HE1 TRP 108 HE1 TRP 108 8.373 -2.314 7.252 558 HE3 TRP 108 HE3 TRP 108 7.292 -1.205 12.348 559 HZ2 TRP 108 HZ2 TRP 108 7.703 0.346 7.657 560 HZ3 TRP 108 HZ3 TRP 108 6.835 1.121 11.766 561 HH2 TRP 108 HH2 TRP 108 6.992 1.901 9.549 562 H GLY 109 HN GLY 109 4.869 -5.660 12.628 563 HA2 GLY 109 HA2 GLY 109 4.134 -6.664 14.588 564 HA3 GLY 109 HA1 GLY 109 5.759 -7.290 14.806 565 H ASN 110 HN ASN 110 6.007 -3.993 14.555 566 HA ASN 110 HA ASN 110 6.699 -3.662 17.254 567 HB2 ASN 110 HB2 ASN 110 6.294 -1.542 15.158 568 HB3 ASN 110 HB1 ASN 110 7.012 -1.276 16.734 569 HD21 ASN 110 HD21 ASN 110 7.414 -2.360 13.610 570 HD22 ASN 110 HD22 ASN 110 9.094 -2.743 13.664 571 HA PRO 111 HA PRO 111 2.841 -2.143 18.984 572 HB2 PRO 111 HB2 PRO 111 4.638 -1.528 21.228 573 HB3 PRO 111 HB1 PRO 111 3.189 -2.531 21.223 574 HG2 PRO 111 HG2 PRO 111 5.656 -3.574 21.484 575 HG3 PRO 111 HG1 PRO 111 4.340 -4.431 20.665 576 HD2 PRO 111 HD2 PRO 111 6.671 -2.980 19.511 577 HD3 PRO 111 HD1 PRO 111 5.863 -4.459 18.957 578 H TYR 112 HN TYR 112 2.193 -0.016 19.219 579 HA TYR 112 HA TYR 112 3.954 1.951 18.176 580 HB2 TYR 112 HB2 TYR 112 1.204 2.176 19.414 581 HB3 TYR 112 HB1 TYR 112 2.128 3.572 18.905 582 HD1 TYR 112 HD1 TYR 112 2.513 4.009 16.521 583 HD2 TYR 112 HD2 TYR 112 0.127 0.734 17.805 584 HE1 TYR 112 HE1 TYR 112 1.530 3.867 14.276 585 HE2 TYR 112 HE2 TYR 112 -0.863 0.574 15.557 586 HH TYR 112 HH TYR 112 0.317 2.215 12.810 587 H GLN 113 HN GLN 113 4.867 3.636 19.242 588 HA GLN 113 HA GLN 113 5.390 3.027 22.086 589 HB2 GLN 113 HB2 GLN 113 6.908 5.251 20.873 590 HB3 GLN 113 HB1 GLN 113 7.502 3.910 21.821 591 HG2 GLN 113 HG2 GLN 113 6.931 3.877 18.863 592 HG3 GLN 113 HG1 GLN 113 8.509 4.067 19.595 593 HE21 GLN 113 HE21 GLN 113 8.028 2.011 21.617 594 HE22 GLN 113 HE22 GLN 113 8.082 0.518 20.757 595 H TYR 114 HN TYR 114 4.139 4.155 23.385 596 HA TYR 114 HA TYR 114 3.166 6.730 22.463 597 HB2 TYR 114 HB2 TYR 114 1.352 6.281 24.301 598 HB3 TYR 114 HB1 TYR 114 1.220 5.523 22.728 599 HD1 TYR 114 HD2 TYR 114 3.004 4.627 25.943 600 HD2 TYR 114 HD1 TYR 114 0.318 3.388 22.892 601 HE1 TYR 114 HE2 TYR 114 2.796 2.422 27.013 602 HE2 TYR 114 HE1 TYR 114 0.075 1.187 23.993 603 HH TYR 114 HH TYR 114 1.536 -0.213 25.462 604 H LEU 115 HN LEU 115 4.010 8.419 23.334 605 HA LEU 115 HA LEU 115 4.550 8.398 26.180 606 HB2 LEU 115 HB2 LEU 115 6.216 9.504 23.947 607 HB3 LEU 115 HB1 LEU 115 6.422 10.070 25.607 608 HG LEU 115 HG LEU 115 6.893 7.277 24.537 609 HD11 LEU 115 HD11 LEU 115 8.822 9.429 25.397 610 HD12 LEU 115 HD12 LEU 115 8.542 8.882 23.745 611 HD13 LEU 115 HD13 LEU 115 9.251 7.784 24.930 612 HD21 LEU 115 HD21 LEU 115 7.915 6.854 26.729 613 HD22 LEU 115 HD22 LEU 115 6.198 7.216 26.870 614 HD23 LEU 115 HD23 LEU 115 7.396 8.448 27.275 615 H ALA 116 HN ALA 116 4.260 10.560 27.141 616 HA ALA 116 HA ALA 116 2.291 11.961 25.578 617 HB1 ALA 116 HB1 ALA 116 2.539 12.028 28.573 618 HB2 ALA 116 HB2 ALA 116 1.720 10.724 27.717 619 HB3 ALA 116 HB3 ALA 116 1.108 12.363 27.561 620 HA PRO 117 HA PRO 117 4.033 15.891 25.194 621 HB2 PRO 117 HB2 PRO 117 3.921 17.452 27.511 622 HB3 PRO 117 HB1 PRO 117 2.786 17.458 26.169 623 HG2 PRO 117 HG2 PRO 117 2.603 16.052 28.779 624 HG3 PRO 117 HG1 PRO 117 1.314 16.753 27.787 625 HD2 PRO 117 HD2 PRO 117 1.750 14.110 27.910 626 HD3 PRO 117 HD1 PRO 117 1.219 14.868 26.384 627 H GLY 118 HN GLY 118 6.096 15.532 24.860 628 HA2 GLY 118 HA2 GLY 118 7.835 16.336 27.021 629 HA3 GLY 118 HA1 GLY 118 8.159 14.756 26.290 630 H THR 119 HN THR 119 8.164 15.095 23.697 631 HA THR 119 HA THR 119 10.316 17.012 23.439 632 HB THR 119 HB THR 119 9.158 15.451 21.190 633 HG1 THR 119 HG1 THR 119 9.735 13.804 22.547 634 HG21 THR 119 HG21 THR 119 11.911 16.554 21.733 635 HG22 THR 119 HG22 THR 119 10.744 17.119 20.530 636 HG23 THR 119 HG23 THR 119 11.509 15.547 20.345 637 H LYS 120 HN LYS 120 9.402 18.940 23.574 638 HA LYS 120 HA LYS 120 8.828 20.940 22.641 639 HB2 LYS 120 HB2 LYS 120 7.923 19.431 20.202 640 HB3 LYS 120 HB1 LYS 120 8.219 21.156 20.326 641 HG2 LYS 120 HG2 LYS 120 10.570 20.813 20.521 642 HG3 LYS 120 HG1 LYS 120 10.318 19.068 20.743 643 HD2 LYS 120 HD2 LYS 120 9.386 18.903 18.530 644 HD3 LYS 120 HD1 LYS 120 9.645 20.629 18.265 645 HE2 LYS 120 HE2 LYS 120 12.046 20.328 18.474 646 HE3 LYS 120 HE1 LYS 120 11.818 18.621 18.851 647 HZ1 LYS 120 HZ1 LYS 120 11.081 19.907 16.273 648 HZ2 LYS 120 HZ2 LYS 120 10.927 18.275 16.654 649 HZ3 LYS 120 HZ3 LYS 120 12.456 18.966 16.541 650 H GLY 121 HN GLY 121 6.454 18.352 22.739 651 HA2 GLY 121 HA2 GLY 121 4.446 20.316 23.250 652 HA3 GLY 121 HA1 GLY 121 4.297 19.593 21.662 653 HA PRO 122 HA PRO 122 1.264 17.937 24.968 654 HB2 PRO 122 HB2 PRO 122 0.174 17.761 22.211 655 HB3 PRO 122 HB1 PRO 122 -0.683 17.935 23.749 656 HG2 PRO 122 HG2 PRO 122 -0.169 20.071 22.346 657 HG3 PRO 122 HG1 PRO 122 0.149 20.100 24.092 658 HD2 PRO 122 HD2 PRO 122 2.081 19.953 21.829 659 HD3 PRO 122 HD1 PRO 122 2.287 20.663 23.440 660 H PHE 123 HN PHE 123 2.762 16.184 22.256 661 HA PHE 123 HA PHE 123 2.954 13.958 23.860 662 HB2 PHE 123 HB2 PHE 123 1.532 12.217 22.868 663 HB3 PHE 123 HB1 PHE 123 0.586 13.504 23.555 664 HD1 PHE 123 HD1 PHE 123 1.861 12.252 20.273 665 HD2 PHE 123 HD2 PHE 123 -1.152 14.454 22.322 666 HE1 PHE 123 HE1 PHE 123 0.539 12.332 18.227 667 HE2 PHE 123 HE2 PHE 123 -2.479 14.551 20.256 668 HZ PHE 123 HZ PHE 123 -1.638 13.490 18.202 669 H ASP 124 HN ASP 124 3.963 12.154 23.094 670 HA ASP 124 HA ASP 124 5.584 12.589 20.665 671 HB2 ASP 124 HB2 ASP 124 6.115 11.200 23.285 672 HB3 ASP 124 HB1 ASP 124 7.084 10.860 21.842 673 H LEU 125 HN LEU 125 4.578 11.285 19.110 674 HA LEU 125 HA LEU 125 3.829 8.603 20.007 675 HB2 LEU 125 HB2 LEU 125 1.895 10.141 19.728 676 HB3 LEU 125 HB1 LEU 125 2.337 10.363 18.058 677 HG LEU 125 HG LEU 125 0.401 8.918 18.440 678 HD11 LEU 125 HD11 LEU 125 2.723 7.539 17.102 679 HD12 LEU 125 HD12 LEU 125 1.587 8.663 16.353 680 HD13 LEU 125 HD13 LEU 125 1.032 7.084 16.914 681 HD21 LEU 125 HD21 LEU 125 0.754 6.598 19.274 682 HD22 LEU 125 HD22 LEU 125 1.034 7.829 20.499 683 HD23 LEU 125 HD23 LEU 125 2.400 7.045 19.711 684 H TYR 126 HN TYR 126 4.755 6.994 18.821 685 HA TYR 126 HA TYR 126 5.160 7.219 16.051 686 HB2 TYR 126 HB2 TYR 126 7.620 7.130 15.931 687 HB3 TYR 126 HB1 TYR 126 7.056 8.630 16.631 688 HD1 TYR 126 HD2 TYR 126 7.264 8.915 19.179 689 HD2 TYR 126 HD1 TYR 126 9.184 5.779 17.039 690 HE1 TYR 126 HE2 TYR 126 8.860 8.632 21.028 691 HE2 TYR 126 HE1 TYR 126 10.790 5.498 18.862 692 HH TYR 126 HH TYR 126 11.708 6.850 20.661 693 H SER 127 HN SER 127 6.263 5.363 15.131 694 HA SER 127 HA SER 127 6.259 3.004 16.870 695 HB2 SER 127 HB2 SER 127 4.297 2.987 15.338 696 HB3 SER 127 HB1 SER 127 5.384 3.215 13.973 697 HG SER 127 HG SER 127 5.228 1.163 13.931 698 H LEU 128 HN LEU 128 8.067 1.748 16.631 699 HA LEU 128 HA LEU 128 10.386 2.870 15.445 700 HB2 LEU 128 HB2 LEU 128 9.855 0.092 16.459 701 HB3 LEU 128 HB1 LEU 128 11.430 0.646 15.945 702 HG LEU 128 HG LEU 128 9.852 1.705 18.297 703 HD11 LEU 128 HD11 LEU 128 11.634 0.724 19.640 704 HD12 LEU 128 HD12 LEU 128 12.391 0.091 18.177 705 HD13 LEU 128 HD13 LEU 128 10.809 -0.502 18.677 706 HD21 LEU 128 HD21 LEU 128 11.148 3.505 17.276 707 HD22 LEU 128 HD22 LEU 128 12.590 2.492 17.280 708 HD23 LEU 128 HD23 LEU 128 11.880 3.018 18.804 709 H GLY 129 HN GLY 129 11.150 2.759 13.452 710 HA2 GLY 129 HA2 GLY 129 9.826 1.427 11.316 711 HA3 GLY 129 HA1 GLY 129 11.426 2.128 11.222 712 H ALA 130 HN ALA 130 11.085 -0.002 9.837 713 HA ALA 130 HA ALA 130 11.218 -2.494 11.103 714 HB1 ALA 130 HB1 ALA 130 11.628 -3.415 8.978 715 HB2 ALA 130 HB2 ALA 130 12.230 -1.867 8.383 716 HB3 ALA 130 HB3 ALA 130 10.525 -2.041 8.788 717 H ASP 131 HN ASP 131 13.694 -0.274 11.124 718 HA ASP 131 HA ASP 131 15.695 -2.418 11.208 719 HB2 ASP 131 HB2 ASP 131 16.253 -0.414 9.822 720 HB3 ASP 131 HB1 ASP 131 16.188 0.583 11.271 721 H GLY 132 HN GLY 132 13.591 -0.995 13.201 722 HA2 GLY 132 HA2 GLY 132 13.315 -1.052 15.487 723 HA3 GLY 132 HA1 GLY 132 14.825 -1.955 15.587 724 H LYS 133 HN LYS 133 14.256 1.234 14.231 725 HA LYS 133 HA LYS 133 16.027 2.443 16.247 726 HB2 LYS 133 HB2 LYS 133 16.205 2.880 13.272 727 HB3 LYS 133 HB1 LYS 133 17.220 3.592 14.504 728 HG2 LYS 133 HG2 LYS 133 17.128 0.651 13.951 729 HG3 LYS 133 HG1 LYS 133 18.212 1.750 13.114 730 HD2 LYS 133 HD2 LYS 133 19.177 2.384 15.292 731 HD3 LYS 133 HD1 LYS 133 18.127 1.189 16.070 732 HE2 LYS 133 HE2 LYS 133 20.417 0.336 15.622 733 HE3 LYS 133 HE1 LYS 133 19.148 -0.597 14.828 734 HZ1 LYS 133 HZ1 LYS 133 20.764 1.518 13.498 735 HZ2 LYS 133 HZ2 LYS 133 19.661 0.479 12.743 736 HZ3 LYS 133 HZ3 LYS 133 21.086 -0.123 13.388 737 H GLU 134 HN GLU 134 15.412 4.587 16.647 738 HA GLU 134 HA GLU 134 13.370 5.620 14.872 739 HB2 GLU 134 HB2 GLU 134 13.250 7.530 16.593 740 HB3 GLU 134 HB1 GLU 134 12.697 5.963 17.145 741 HG2 GLU 134 HG2 GLU 134 14.771 5.624 18.334 742 HG3 GLU 134 HG1 GLU 134 15.394 7.152 17.709 743 H GLY 135 HN GLY 135 14.165 6.447 13.171 744 HA2 GLY 135 HA2 GLY 135 16.461 8.186 13.156 745 HA3 GLY 135 HA1 GLY 135 16.654 6.630 12.345 746 H GLY 136 HN GLY 136 17.010 8.281 10.515 747 HA2 GLY 136 HA2 GLY 136 14.394 9.039 9.395 748 HA3 GLY 136 HA1 GLY 136 15.907 9.838 8.983 749 H SER 137 HN SER 137 13.722 8.048 7.698 750 HA SER 137 HA SER 137 14.972 6.980 5.518 751 HB2 SER 137 HB2 SER 137 14.586 5.087 7.839 752 HB3 SER 137 HB1 SER 137 14.464 4.463 6.177 753 HG SER 137 HG SER 137 16.652 5.912 7.235 754 H ASP 138 HN ASP 138 13.137 5.288 4.559 755 HA ASP 138 HA ASP 138 10.610 6.548 5.232 756 HB2 ASP 138 HB2 ASP 138 11.490 4.827 2.953 757 HB3 ASP 138 HB1 ASP 138 9.784 4.822 3.377 758 H ASN 139 HN ASN 139 11.629 3.205 4.774 759 HA ASN 139 HA ASN 139 9.435 2.250 6.432 760 HB2 ASN 139 HB2 ASN 139 9.844 1.076 4.380 761 HB3 ASN 139 HB1 ASN 139 11.547 0.896 4.749 762 HD21 ASN 139 HD21 ASN 139 12.166 -0.632 6.247 763 HD22 ASN 139 HD22 ASN 139 11.130 -1.951 6.677 764 H ASP 140 HN ASP 140 12.807 2.751 6.667 765 HA ASP 140 HA ASP 140 12.997 1.076 9.064 766 HB2 ASP 140 HB2 ASP 140 15.132 2.324 7.330 767 HB3 ASP 140 HB1 ASP 140 15.481 1.465 8.824 768 H ALA 141 HN ALA 141 11.992 3.952 8.600 769 HA ALA 141 HA ALA 141 13.433 5.313 10.766 770 HB1 ALA 141 HB1 ALA 141 12.236 7.276 10.040 771 HB2 ALA 141 HB2 ALA 141 11.398 6.320 8.815 772 HB3 ALA 141 HB3 ALA 141 13.140 6.561 8.708 773 H ASP 142 HN ASP 142 12.109 6.340 12.408 774 HA ASP 142 HA ASP 142 9.873 4.681 13.085 775 HB2 ASP 142 HB2 ASP 142 9.702 5.998 15.113 776 HB3 ASP 142 HB1 ASP 142 11.382 5.540 14.896 777 H ILE 143 HN ILE 143 7.905 5.132 12.611 778 HA ILE 143 HA ILE 143 7.425 7.652 11.285 779 HB ILE 143 HB ILE 143 5.257 6.573 10.496 780 HG12 ILE 143 HG12 ILE 143 5.464 3.964 10.397 781 HG13 ILE 143 HG11 ILE 143 6.493 4.159 11.801 782 HG21 ILE 143 HG21 ILE 143 6.322 5.235 8.743 783 HG22 ILE 143 HG22 ILE 143 7.835 5.307 9.648 784 HG23 ILE 143 HG23 ILE 143 7.108 6.791 9.019 785 HD11 ILE 143 HD11 ILE 143 3.650 5.102 11.619 786 HD12 ILE 143 HD12 ILE 143 4.687 5.143 13.045 787 HD13 ILE 143 HD13 ILE 143 4.176 3.596 12.359 788 H GLY 144 HN GLY 144 5.998 9.152 12.090 789 HA2 GLY 144 HA2 GLY 144 4.485 8.371 14.386 790 HA3 GLY 144 HA1 GLY 144 5.889 9.356 14.754 791 H ASN 145 HN ASN 145 3.656 10.215 15.529 792 HA ASN 145 HA ASN 145 2.987 12.419 13.763 793 HB2 ASN 145 HB2 ASN 145 1.135 10.807 13.593 794 HB3 ASN 145 HB1 ASN 145 1.041 10.703 15.349 795 HD21 ASN 145 HD21 ASN 145 0.096 12.340 16.481 796 HD22 ASN 145 HD22 ASN 145 -0.800 13.611 15.730 797 H TRP 146 HN TRP 146 2.437 14.306 15.043 798 HA TRP 146 HA TRP 146 3.326 14.066 17.829 799 HB2 TRP 146 HB2 TRP 146 5.011 14.640 15.762 800 HB3 TRP 146 HB1 TRP 146 4.513 16.238 16.289 801 HD1 TRP 146 HD1 TRP 146 5.496 17.109 18.539 802 HE1 TRP 146 HE1 TRP 146 7.324 16.209 20.110 803 HE3 TRP 146 HE3 TRP 146 5.874 12.378 16.678 804 HZ2 TRP 146 HZ2 TRP 146 8.746 13.755 20.482 805 HZ3 TRP 146 HZ3 TRP 146 7.483 10.819 17.721 806 HH2 TRP 146 HH2 TRP 146 8.876 11.513 19.561 807 H ASP 147 HN ASP 147 2.211 15.478 19.085 808 HA ASP 147 HA ASP 147 0.746 17.635 17.730 809 HB2 ASP 147 HB2 ASP 147 -0.565 16.055 19.252 810 HB3 ASP 147 HB1 ASP 147 0.374 16.698 20.588 811 H ASN 148 HN ASN 148 2.073 19.247 17.636 812 HA ASN 148 HA ASN 148 3.196 20.226 20.085 813 HB2 ASN 148 HB2 ASN 148 5.290 20.852 18.907 814 HB3 ASN 148 HB1 ASN 148 5.086 19.114 18.944 815 HD21 ASN 148 HD21 ASN 148 4.642 18.045 17.021 816 HD22 ASN 148 HD22 ASN 148 4.890 18.739 15.468 Start of MODEL 19 1 H1 MET 39 HT1 MET 39 3.207 5.443 0.551 2 H2 MET 39 HT2 MET 39 2.916 5.853 -1.059 3 H3 MET 39 HT3 MET 39 3.909 6.814 -0.125 4 HA MET 39 HA MET 39 5.120 5.484 -1.719 5 HB2 MET 39 HB2 MET 39 6.061 6.157 0.625 6 HB3 MET 39 HB1 MET 39 5.772 4.496 1.094 7 HG2 MET 39 HG2 MET 39 7.284 3.723 -0.650 8 HG3 MET 39 HG1 MET 39 7.573 5.391 -1.137 9 HE1 MET 39 HE1 MET 39 10.133 5.271 -0.906 10 HE2 MET 39 HE2 MET 39 10.058 3.557 -0.484 11 HE3 MET 39 HE3 MET 39 10.995 4.670 0.507 12 H SER 40 HN SER 40 3.684 3.978 -2.839 13 HA SER 40 HA SER 40 3.168 1.476 -1.457 14 HB2 SER 40 HB2 SER 40 2.126 2.547 -4.047 15 HB3 SER 40 HB1 SER 40 1.630 1.024 -3.292 16 HG SER 40 HG SER 40 0.763 2.147 -1.589 17 H ARG 41 HN ARG 41 5.088 0.499 -1.525 18 HA ARG 41 HA ARG 41 5.634 -1.031 -3.853 19 HB2 ARG 41 HB2 ARG 41 8.132 -0.446 -3.715 20 HB3 ARG 41 HB1 ARG 41 7.101 0.782 -4.430 21 HG2 ARG 41 HG2 ARG 41 7.062 1.981 -2.381 22 HG3 ARG 41 HG1 ARG 41 8.005 0.701 -1.604 23 HD2 ARG 41 HD2 ARG 41 9.519 2.475 -2.141 24 HD3 ARG 41 HD1 ARG 41 9.817 1.116 -3.221 25 HE ARG 41 HE ARG 41 8.042 2.923 -4.409 26 HH11 ARG 41 HH11 ARG 41 11.441 2.523 -3.519 27 HH12 ARG 41 HH12 ARG 41 12.050 3.604 -4.677 28 HH21 ARG 41 HH21 ARG 41 8.863 4.449 -6.022 29 HH22 ARG 41 HH22 ARG 41 10.543 4.739 -6.125 30 HA PRO 42 HA PRO 42 6.539 -4.348 -1.017 31 HB2 PRO 42 HB2 PRO 42 9.430 -4.072 -1.741 32 HB3 PRO 42 HB1 PRO 42 8.465 -5.540 -1.555 33 HG2 PRO 42 HG2 PRO 42 8.936 -4.617 -3.979 34 HG3 PRO 42 HG1 PRO 42 7.315 -5.195 -3.557 35 HD2 PRO 42 HD2 PRO 42 8.307 -2.429 -3.929 36 HD3 PRO 42 HD1 PRO 42 6.698 -3.106 -4.260 37 H ASP 43 HN ASP 43 6.375 -4.025 1.024 38 HA ASP 43 HA ASP 43 6.689 -3.691 3.195 39 HB2 ASP 43 HB2 ASP 43 9.140 -4.499 2.556 40 HB3 ASP 43 HB1 ASP 43 9.514 -2.833 3.030 41 H GLN 44 HN GLN 44 7.917 -1.234 1.162 42 HA GLN 44 HA GLN 44 7.790 0.923 3.026 43 HB2 GLN 44 HB2 GLN 44 7.263 1.150 0.089 44 HB3 GLN 44 HB1 GLN 44 7.963 2.352 1.151 45 HG2 GLN 44 HG2 GLN 44 9.306 -0.232 0.375 46 HG3 GLN 44 HG1 GLN 44 9.635 1.331 -0.349 47 HE21 GLN 44 HE21 GLN 44 9.520 2.761 2.235 48 HE22 GLN 44 HE22 GLN 44 11.008 2.321 2.981 49 H ALA 45 HN ALA 45 5.544 -0.841 1.146 50 HA ALA 45 HA ALA 45 3.252 0.782 1.295 51 HB1 ALA 45 HB1 ALA 45 2.023 -1.281 0.904 52 HB2 ALA 45 HB2 ALA 45 3.465 -2.213 1.311 53 HB3 ALA 45 HB3 ALA 45 3.446 -1.209 -0.143 54 H LYS 46 HN LYS 46 4.899 -1.180 3.664 55 HA LYS 46 HA LYS 46 2.661 -1.220 5.476 56 HB2 LYS 46 HB2 LYS 46 5.595 -1.767 5.929 57 HB3 LYS 46 HB1 LYS 46 4.325 -2.081 7.086 58 HG2 LYS 46 HG2 LYS 46 3.389 -3.765 5.518 59 HG3 LYS 46 HG1 LYS 46 4.771 -3.481 4.451 60 HD2 LYS 46 HD2 LYS 46 6.308 -4.093 6.272 61 HD3 LYS 46 HD1 LYS 46 4.939 -4.356 7.339 62 HE2 LYS 46 HE2 LYS 46 5.738 -6.465 6.590 63 HE3 LYS 46 HE1 LYS 46 4.182 -6.163 5.827 64 HZ1 LYS 46 HZ1 LYS 46 5.347 -5.518 3.813 65 HZ2 LYS 46 HZ2 LYS 46 5.817 -7.069 4.296 66 HZ3 LYS 46 HZ3 LYS 46 6.832 -5.765 4.586 67 H VAL 47 HN VAL 47 5.365 0.821 4.675 68 HA VAL 47 HA VAL 47 5.508 2.294 7.147 69 HB VAL 47 HB VAL 47 6.359 3.224 4.393 70 HG11 VAL 47 HG11 VAL 47 7.318 4.070 7.112 71 HG12 VAL 47 HG12 VAL 47 6.345 5.014 5.983 72 HG13 VAL 47 HG13 VAL 47 8.009 4.589 5.576 73 HG21 VAL 47 HG21 VAL 47 7.401 1.044 4.905 74 HG22 VAL 47 HG22 VAL 47 8.140 1.773 6.349 75 HG23 VAL 47 HG23 VAL 47 8.527 2.384 4.731 76 H THR 48 HN THR 48 4.101 2.699 3.997 77 HA THR 48 HA THR 48 3.204 5.331 4.431 78 HB THR 48 HB THR 48 3.837 4.348 2.237 79 HG1 THR 48 HG1 THR 48 1.982 6.144 2.698 80 HG21 THR 48 HG21 THR 48 1.132 3.043 2.367 81 HG22 THR 48 HG22 THR 48 2.693 2.242 2.459 82 HG23 THR 48 HG23 THR 48 2.215 3.057 0.963 83 H VAL 49 HN VAL 49 1.648 2.192 4.894 84 HA VAL 49 HA VAL 49 -0.919 3.387 5.218 85 HB VAL 49 HB VAL 49 -0.849 1.070 4.481 86 HG11 VAL 49 HG11 VAL 49 0.453 0.423 7.113 87 HG12 VAL 49 HG12 VAL 49 1.176 0.333 5.499 88 HG13 VAL 49 HG13 VAL 49 -0.131 -0.766 5.937 89 HG21 VAL 49 HG21 VAL 49 -2.420 0.035 6.058 90 HG22 VAL 49 HG22 VAL 49 -2.805 1.729 5.749 91 HG23 VAL 49 HG23 VAL 49 -2.006 1.266 7.252 92 H ALA 50 HN ALA 50 1.663 2.345 7.377 93 HA ALA 50 HA ALA 50 0.369 2.704 9.805 94 HB1 ALA 50 HB1 ALA 50 3.249 3.216 9.179 95 HB2 ALA 50 HB2 ALA 50 2.558 1.608 9.437 96 HB3 ALA 50 HB3 ALA 50 2.570 2.795 10.749 97 H LYS 51 HN LYS 51 1.857 4.989 7.635 98 HA LYS 51 HA LYS 51 2.003 7.137 9.410 99 HB2 LYS 51 HB2 LYS 51 1.783 7.156 6.395 100 HB3 LYS 51 HB1 LYS 51 2.162 8.580 7.352 101 HG2 LYS 51 HG2 LYS 51 4.205 7.564 8.144 102 HG3 LYS 51 HG1 LYS 51 3.801 6.052 7.340 103 HD2 LYS 51 HD2 LYS 51 5.428 7.201 6.002 104 HD3 LYS 51 HD1 LYS 51 3.887 7.272 5.157 105 HE2 LYS 51 HE2 LYS 51 5.018 9.403 5.031 106 HE3 LYS 51 HE1 LYS 51 3.554 9.562 5.998 107 HZ1 LYS 51 HZ1 LYS 51 6.303 9.252 7.098 108 HZ2 LYS 51 HZ2 LYS 51 4.905 9.484 8.001 109 HZ3 LYS 51 HZ3 LYS 51 5.456 10.701 6.999 110 H GLY 52 HN GLY 52 -0.630 5.818 7.617 111 HA2 GLY 52 HA2 GLY 52 -2.355 8.116 7.965 112 HA3 GLY 52 HA1 GLY 52 -2.821 6.544 7.309 113 H ASP 53 HN ASP 53 -1.571 5.131 9.523 114 HA ASP 53 HA ASP 53 -3.868 5.124 11.203 115 HB2 ASP 53 HB2 ASP 53 -1.317 3.509 11.409 116 HB3 ASP 53 HB1 ASP 53 -2.708 3.302 12.471 117 H ILE 54 HN ILE 54 -0.567 6.172 11.552 118 HA ILE 54 HA ILE 54 -0.792 6.891 14.260 119 HB ILE 54 HB ILE 54 1.092 8.491 13.870 120 HG12 ILE 54 HG12 ILE 54 0.750 7.549 11.031 121 HG13 ILE 54 HG11 ILE 54 0.490 9.174 11.626 122 HG21 ILE 54 HG21 ILE 54 1.422 5.718 12.751 123 HG22 ILE 54 HG22 ILE 54 1.548 6.191 14.448 124 HG23 ILE 54 HG23 ILE 54 2.742 6.758 13.277 125 HD11 ILE 54 HD11 ILE 54 3.108 7.726 11.500 126 HD12 ILE 54 HD12 ILE 54 2.860 9.375 12.091 127 HD13 ILE 54 HD13 ILE 54 2.546 8.984 10.399 128 H LYS 55 HN LYS 55 -1.726 8.662 11.337 129 HA LYS 55 HA LYS 55 -2.380 11.042 12.754 130 HB2 LYS 55 HB2 LYS 55 -2.932 10.051 10.011 131 HB3 LYS 55 HB1 LYS 55 -4.063 11.234 10.639 132 HG2 LYS 55 HG2 LYS 55 -2.345 12.340 9.337 133 HG3 LYS 55 HG1 LYS 55 -2.199 12.800 11.027 134 HD2 LYS 55 HD2 LYS 55 -0.379 11.148 11.276 135 HD3 LYS 55 HD1 LYS 55 -0.497 10.785 9.555 136 HE2 LYS 55 HE2 LYS 55 0.198 13.470 10.770 137 HE3 LYS 55 HE1 LYS 55 1.334 12.356 10.024 138 HZ1 LYS 55 HZ1 LYS 55 -0.892 13.769 8.631 139 HZ2 LYS 55 HZ2 LYS 55 0.136 12.659 7.911 140 HZ3 LYS 55 HZ3 LYS 55 0.754 14.103 8.497 141 H ALA 56 HN ALA 56 -4.043 8.092 12.157 142 HA ALA 56 HA ALA 56 -6.643 8.845 13.007 143 HB1 ALA 56 HB1 ALA 56 -7.017 6.455 13.214 144 HB2 ALA 56 HB2 ALA 56 -5.272 6.196 13.171 145 HB3 ALA 56 HB3 ALA 56 -6.103 6.807 11.731 146 H ILE 57 HN ILE 57 -3.883 7.421 14.649 147 HA ILE 57 HA ILE 57 -5.081 6.999 17.179 148 HB ILE 57 HB ILE 57 -2.165 7.652 16.754 149 HG12 ILE 57 HG12 ILE 57 -3.508 4.962 16.405 150 HG13 ILE 57 HG11 ILE 57 -2.899 5.978 15.129 151 HG21 ILE 57 HG21 ILE 57 -3.605 5.878 18.759 152 HG22 ILE 57 HG22 ILE 57 -2.932 7.471 19.085 153 HG23 ILE 57 HG23 ILE 57 -1.858 6.125 18.687 154 HD11 ILE 57 HD11 ILE 57 -0.635 5.796 16.041 155 HD12 ILE 57 HD12 ILE 57 -1.363 4.283 15.522 156 HD13 ILE 57 HD13 ILE 57 -1.241 4.657 17.254 157 H ALA 58 HN ALA 58 -3.223 9.656 15.830 158 HA ALA 58 HA ALA 58 -3.106 11.276 18.103 159 HB1 ALA 58 HB1 ALA 58 -1.746 11.652 16.110 160 HB2 ALA 58 HB2 ALA 58 -2.620 13.109 16.587 161 HB3 ALA 58 HB3 ALA 58 -3.190 12.143 15.224 162 H ALA 59 HN ALA 59 -5.708 10.731 15.875 163 HA ALA 59 HA ALA 59 -7.256 13.001 16.709 164 HB1 ALA 59 HB1 ALA 59 -7.560 12.020 14.484 165 HB2 ALA 59 HB2 ALA 59 -9.064 11.983 15.407 166 HB3 ALA 59 HB3 ALA 59 -8.102 10.514 15.223 167 H ALA 60 HN ALA 60 -6.883 9.669 17.622 168 HA ALA 60 HA ALA 60 -9.119 9.755 19.430 169 HB1 ALA 60 HB1 ALA 60 -8.342 7.535 20.148 170 HB2 ALA 60 HB2 ALA 60 -6.915 7.725 19.152 171 HB3 ALA 60 HB3 ALA 60 -8.507 7.628 18.394 172 H LEU 61 HN LEU 61 -5.705 10.390 19.554 173 HA LEU 61 HA LEU 61 -5.383 10.549 22.377 174 HB2 LEU 61 HB2 LEU 61 -3.673 10.599 20.339 175 HB3 LEU 61 HB1 LEU 61 -4.007 12.314 20.375 176 HG LEU 61 HG LEU 61 -1.878 11.523 21.486 177 HD11 LEU 61 HD11 LEU 61 -3.807 13.113 23.142 178 HD12 LEU 61 HD12 LEU 61 -2.758 13.738 21.871 179 HD13 LEU 61 HD13 LEU 61 -2.058 13.074 23.348 180 HD21 LEU 61 HD21 LEU 61 -3.786 10.671 23.637 181 HD22 LEU 61 HD22 LEU 61 -2.029 10.703 23.757 182 HD23 LEU 61 HD23 LEU 61 -2.818 9.580 22.638 183 H ASP 62 HN ASP 62 -6.603 12.731 19.945 184 HA ASP 62 HA ASP 62 -7.210 14.966 21.548 185 HB2 ASP 62 HB2 ASP 62 -7.302 15.192 19.155 186 HB3 ASP 62 HB1 ASP 62 -8.435 13.860 19.007 187 H MET 63 HN MET 63 -8.710 11.879 21.136 188 HA MET 63 HA MET 63 -11.148 12.727 22.380 189 HB2 MET 63 HB2 MET 63 -11.113 10.993 20.548 190 HB3 MET 63 HB1 MET 63 -10.322 9.902 21.673 191 HG2 MET 63 HG2 MET 63 -12.294 10.043 23.146 192 HG3 MET 63 HG1 MET 63 -13.088 11.049 21.939 193 HE1 MET 63 HE1 MET 63 -11.953 9.546 19.220 194 HE2 MET 63 HE2 MET 63 -13.581 10.187 19.422 195 HE3 MET 63 HE3 MET 63 -13.351 8.520 18.898 196 H TYR 64 HN TYR 64 -8.201 11.062 23.343 197 HA TYR 64 HA TYR 64 -9.135 10.548 26.036 198 HB2 TYR 64 HB2 TYR 64 -7.098 9.429 25.193 199 HB3 TYR 64 HB1 TYR 64 -6.293 10.992 25.061 200 HD1 TYR 64 HD1 TYR 64 -7.789 8.584 27.611 201 HD2 TYR 64 HD2 TYR 64 -5.288 12.011 26.953 202 HE1 TYR 64 HE1 TYR 64 -7.061 8.449 29.771 203 HE2 TYR 64 HE2 TYR 64 -4.548 11.848 29.245 204 HH TYR 64 HH TYR 64 -5.338 9.092 31.085 205 H LYS 65 HN LYS 65 -7.556 13.212 24.338 206 HA LYS 65 HA LYS 65 -7.306 15.018 26.384 207 HB2 LYS 65 HB2 LYS 65 -6.459 15.447 24.149 208 HB3 LYS 65 HB1 LYS 65 -8.091 15.472 23.501 209 HG2 LYS 65 HG2 LYS 65 -8.600 17.428 24.598 210 HG3 LYS 65 HG1 LYS 65 -7.085 17.459 25.522 211 HD2 LYS 65 HD2 LYS 65 -6.691 19.003 23.741 212 HD3 LYS 65 HD1 LYS 65 -5.988 17.488 23.179 213 HE2 LYS 65 HE2 LYS 65 -7.226 18.551 21.403 214 HE3 LYS 65 HE1 LYS 65 -7.966 17.024 21.855 215 HZ1 LYS 65 HZ1 LYS 65 -8.925 19.681 22.787 216 HZ2 LYS 65 HZ2 LYS 65 -9.715 18.188 22.987 217 HZ3 LYS 65 HZ3 LYS 65 -9.519 18.847 21.456 218 H LEU 66 HN LEU 66 -10.119 13.867 24.746 219 HA LEU 66 HA LEU 66 -11.976 15.707 25.992 220 HB2 LEU 66 HB2 LEU 66 -12.504 14.967 23.782 221 HB3 LEU 66 HB1 LEU 66 -12.291 13.289 24.228 222 HG LEU 66 HG LEU 66 -14.327 13.439 25.635 223 HD11 LEU 66 HD11 LEU 66 -14.641 16.154 24.383 224 HD12 LEU 66 HD12 LEU 66 -14.310 15.828 26.085 225 HD13 LEU 66 HD13 LEU 66 -15.842 15.321 25.369 226 HD21 LEU 66 HD21 LEU 66 -14.458 12.556 23.384 227 HD22 LEU 66 HD22 LEU 66 -14.675 14.184 22.739 228 HD23 LEU 66 HD23 LEU 66 -15.911 13.473 23.777 229 H ASP 67 HN ASP 67 -10.838 12.389 26.501 230 HA ASP 67 HA ASP 67 -12.988 11.545 28.229 231 HB2 ASP 67 HB2 ASP 67 -11.391 10.154 26.783 232 HB3 ASP 67 HB1 ASP 67 -10.191 10.418 28.028 233 H ASN 68 HN ASN 68 -9.807 12.993 28.678 234 HA ASN 68 HA ASN 68 -10.365 13.450 31.571 235 HB2 ASN 68 HB2 ASN 68 -7.760 12.641 30.322 236 HB3 ASN 68 HB1 ASN 68 -8.040 13.392 31.906 237 HD21 ASN 68 HD21 ASN 68 -8.668 12.225 33.557 238 HD22 ASN 68 HD22 ASN 68 -8.912 10.506 33.492 239 H PHE 69 HN PHE 69 -10.795 14.997 29.218 240 HA PHE 69 HA PHE 69 -10.513 17.168 28.487 241 HB2 PHE 69 HB2 PHE 69 -10.767 18.805 30.411 242 HB3 PHE 69 HB1 PHE 69 -12.002 17.563 30.268 243 HD1 PHE 69 HD1 PHE 69 -8.925 18.407 32.072 244 HD2 PHE 69 HD2 PHE 69 -12.413 16.188 31.974 245 HE1 PHE 69 HE1 PHE 69 -8.531 17.813 34.412 246 HE2 PHE 69 HE2 PHE 69 -12.123 15.505 34.275 247 HZ PHE 69 HZ PHE 69 -10.150 16.320 35.557 248 H ALA 70 HN ALA 70 -7.937 15.924 28.578 249 HA ALA 70 HA ALA 70 -6.170 18.104 28.507 250 HB1 ALA 70 HB1 ALA 70 -6.514 18.088 30.934 251 HB2 ALA 70 HB2 ALA 70 -4.859 17.581 30.541 252 HB3 ALA 70 HB3 ALA 70 -6.093 16.385 30.980 253 H TYR 71 HN TYR 71 -4.020 17.340 28.071 254 HA TYR 71 HA TYR 71 -3.986 14.742 26.915 255 HB2 TYR 71 HB2 TYR 71 -1.939 16.929 27.156 256 HB3 TYR 71 HB1 TYR 71 -1.508 15.350 26.518 257 HD1 TYR 71 HD1 TYR 71 -3.980 14.717 24.939 258 HD2 TYR 71 HD2 TYR 71 -1.739 18.317 25.324 259 HE1 TYR 71 HE1 TYR 71 -4.720 15.335 22.801 260 HE2 TYR 71 HE2 TYR 71 -2.461 19.011 23.108 261 HH TYR 71 HH TYR 71 -3.275 18.080 21.110 262 HA PRO 72 HA PRO 72 -2.342 12.483 30.292 263 HB2 PRO 72 HB2 PRO 72 -0.779 10.681 28.960 264 HB3 PRO 72 HB1 PRO 72 -2.544 10.607 28.946 265 HG2 PRO 72 HG2 PRO 72 -0.649 11.617 26.884 266 HG3 PRO 72 HG1 PRO 72 -2.147 10.698 26.690 267 HD2 PRO 72 HD2 PRO 72 -1.946 13.371 26.300 268 HD3 PRO 72 HD1 PRO 72 -3.441 12.554 26.772 269 H SER 73 HN SER 73 -0.244 12.118 31.554 270 HA SER 73 HA SER 73 1.846 13.884 30.578 271 HB2 SER 73 HB2 SER 73 2.847 13.452 32.822 272 HB3 SER 73 HB1 SER 73 1.202 14.066 32.944 273 HG SER 73 HG SER 73 0.699 12.397 33.938 274 H THR 74 HN THR 74 4.105 12.909 30.432 275 HA THR 74 HA THR 74 3.777 10.449 29.049 276 HB THR 74 HB THR 74 5.486 12.339 28.492 277 HG1 THR 74 HG1 THR 74 6.805 9.904 28.296 278 HG21 THR 74 HG21 THR 74 7.122 10.689 30.444 279 HG22 THR 74 HG22 THR 74 6.683 12.386 30.639 280 HG23 THR 74 HG23 THR 74 7.779 11.902 29.347 281 H GLN 75 HN GLN 75 4.123 11.059 32.276 282 HA GLN 75 HA GLN 75 5.106 8.348 32.755 283 HB2 GLN 75 HB2 GLN 75 6.118 10.100 34.091 284 HB3 GLN 75 HB1 GLN 75 4.539 10.631 34.640 285 HG2 GLN 75 HG2 GLN 75 5.780 9.316 36.315 286 HG3 GLN 75 HG1 GLN 75 4.227 8.597 35.875 287 HE21 GLN 75 HE21 GLN 75 7.583 8.467 35.427 288 HE22 GLN 75 HE22 GLN 75 7.719 6.815 34.931 289 H GLN 76 HN GLN 76 2.498 10.421 34.071 290 HA GLN 76 HA GLN 76 1.046 8.012 34.856 291 HB2 GLN 76 HB2 GLN 76 0.434 10.898 35.406 292 HB3 GLN 76 HB1 GLN 76 -0.434 9.516 36.025 293 HG2 GLN 76 HG2 GLN 76 1.516 8.705 37.206 294 HG3 GLN 76 HG1 GLN 76 2.481 10.037 36.584 295 HE21 GLN 76 HE21 GLN 76 2.270 12.039 37.524 296 HE22 GLN 76 HE22 GLN 76 1.408 12.301 38.995 297 H GLY 77 HN GLY 77 0.709 10.528 32.503 298 HA2 GLY 77 HA2 GLY 77 -1.905 9.541 31.912 299 HA3 GLY 77 HA1 GLY 77 -0.997 10.652 30.908 300 H LEU 78 HN LEU 78 1.338 8.704 31.011 301 HA LEU 78 HA LEU 78 0.688 7.223 28.676 302 HB2 LEU 78 HB2 LEU 78 3.026 7.939 29.455 303 HB3 LEU 78 HB1 LEU 78 2.948 6.640 30.615 304 HG LEU 78 HG LEU 78 2.862 6.224 27.619 305 HD11 LEU 78 HD11 LEU 78 5.179 6.005 29.521 306 HD12 LEU 78 HD12 LEU 78 4.959 7.239 28.279 307 HD13 LEU 78 HD13 LEU 78 5.204 5.553 27.816 308 HD21 LEU 78 HD21 LEU 78 1.929 4.345 28.902 309 HD22 LEU 78 HD22 LEU 78 3.397 4.278 29.875 310 HD23 LEU 78 HD23 LEU 78 3.463 3.900 28.154 311 H GLU 79 HN GLU 79 1.094 6.355 32.119 312 HA GLU 79 HA GLU 79 0.265 3.763 31.868 313 HB2 GLU 79 HB2 GLU 79 1.459 4.970 33.782 314 HB3 GLU 79 HB1 GLU 79 -0.145 5.515 34.266 315 HG2 GLU 79 HG2 GLU 79 -0.888 3.234 34.354 316 HG3 GLU 79 HG1 GLU 79 0.742 2.746 33.855 317 H ALA 80 HN ALA 80 -1.445 6.811 32.140 318 HA ALA 80 HA ALA 80 -4.024 5.637 32.606 319 HB1 ALA 80 HB1 ALA 80 -3.280 7.964 33.324 320 HB2 ALA 80 HB2 ALA 80 -4.876 7.818 32.519 321 HB3 ALA 80 HB3 ALA 80 -3.503 8.413 31.622 322 H LEU 81 HN LEU 81 -2.121 5.836 29.925 323 HA LEU 81 HA LEU 81 -4.353 5.841 28.045 324 HB2 LEU 81 HB2 LEU 81 -1.380 5.724 27.703 325 HB3 LEU 81 HB1 LEU 81 -2.495 5.454 26.389 326 HG LEU 81 HG LEU 81 -2.201 8.017 27.976 327 HD11 LEU 81 HD11 LEU 81 -1.230 8.924 25.922 328 HD12 LEU 81 HD12 LEU 81 -1.357 7.342 25.160 329 HD13 LEU 81 HD13 LEU 81 -0.280 7.572 26.534 330 HD21 LEU 81 HD21 LEU 81 -4.490 7.727 27.166 331 HD22 LEU 81 HD22 LEU 81 -3.886 7.394 25.545 332 HD23 LEU 81 HD23 LEU 81 -3.667 8.992 26.256 333 H VAL 82 HN VAL 82 -2.204 3.735 29.656 334 HA VAL 82 HA VAL 82 -3.073 1.483 27.984 335 HB VAL 82 HB VAL 82 -0.898 1.539 30.101 336 HG11 VAL 82 HG11 VAL 82 -1.539 -0.535 28.007 337 HG12 VAL 82 HG12 VAL 82 -1.818 -0.697 29.740 338 HG13 VAL 82 HG13 VAL 82 -0.171 -0.579 29.117 339 HG21 VAL 82 HG21 VAL 82 0.675 1.568 28.207 340 HG22 VAL 82 HG22 VAL 82 -0.362 2.997 28.212 341 HG23 VAL 82 HG23 VAL 82 -0.685 1.686 27.089 342 H LYS 83 HN LYS 83 -3.236 2.724 31.213 343 HA LYS 83 HA LYS 83 -5.055 0.595 32.090 344 HB2 LYS 83 HB2 LYS 83 -3.019 0.656 33.426 345 HB3 LYS 83 HB1 LYS 83 -3.140 2.397 33.598 346 HG2 LYS 83 HG2 LYS 83 -5.331 1.975 34.817 347 HG3 LYS 83 HG1 LYS 83 -4.857 0.279 34.858 348 HD2 LYS 83 HD2 LYS 83 -3.223 2.564 35.958 349 HD3 LYS 83 HD1 LYS 83 -4.254 1.513 36.922 350 HE2 LYS 83 HE2 LYS 83 -2.902 -0.409 36.280 351 HE3 LYS 83 HE1 LYS 83 -1.897 0.627 35.268 352 HZ1 LYS 83 HZ1 LYS 83 -0.922 0.148 37.436 353 HZ2 LYS 83 HZ2 LYS 83 -2.214 0.952 38.190 354 HZ3 LYS 83 HZ3 LYS 83 -1.153 1.804 37.183 355 H LYS 84 HN LYS 84 -7.027 1.396 33.038 356 HA LYS 84 HA LYS 84 -8.163 3.697 32.132 357 HB2 LYS 84 HB2 LYS 84 -9.171 1.655 33.047 358 HB3 LYS 84 HB1 LYS 84 -8.597 2.117 34.633 359 HG2 LYS 84 HG2 LYS 84 -10.070 4.028 34.627 360 HG3 LYS 84 HG1 LYS 84 -10.613 3.612 32.992 361 HD2 LYS 84 HD2 LYS 84 -12.239 2.643 34.441 362 HD3 LYS 84 HD1 LYS 84 -11.115 1.386 33.856 363 HE2 LYS 84 HE2 LYS 84 -9.924 1.344 35.920 364 HE3 LYS 84 HE1 LYS 84 -10.839 2.717 36.534 365 HZ1 LYS 84 HZ1 LYS 84 -11.938 0.043 35.892 366 HZ2 LYS 84 HZ2 LYS 84 -12.820 1.315 36.545 367 HZ3 LYS 84 HZ3 LYS 84 -11.606 0.581 37.439 368 HA PRO 85 HA PRO 85 -5.914 6.824 34.291 369 HB2 PRO 85 HB2 PRO 85 -7.787 8.814 34.143 370 HB3 PRO 85 HB1 PRO 85 -6.772 8.329 32.776 371 HG2 PRO 85 HG2 PRO 85 -9.554 7.492 33.430 372 HG3 PRO 85 HG1 PRO 85 -8.873 8.014 31.874 373 HD2 PRO 85 HD2 PRO 85 -9.222 5.452 32.386 374 HD3 PRO 85 HD1 PRO 85 -7.749 6.000 31.559 375 H THR 86 HN THR 86 -5.585 7.052 36.333 376 HA THR 86 HA THR 86 -7.801 6.816 38.148 377 HB THR 86 HB THR 86 -5.784 6.733 39.821 378 HG1 THR 86 HG1 THR 86 -4.238 5.468 38.047 379 HG21 THR 86 HG21 THR 86 -6.366 4.495 37.888 380 HG22 THR 86 HG22 THR 86 -7.333 4.913 39.297 381 HG23 THR 86 HG23 THR 86 -5.683 4.303 39.510 382 H GLY 87 HN GLY 87 -8.698 8.693 38.087 383 HA2 GLY 87 HA2 GLY 87 -7.807 10.818 39.601 384 HA3 GLY 87 HA1 GLY 87 -7.377 11.170 37.924 385 H ASN 88 HN ASN 88 -8.839 12.459 37.014 386 HA ASN 88 HA ASN 88 -11.665 11.935 37.645 387 HB2 ASN 88 HB2 ASN 88 -10.525 14.693 37.119 388 HB3 ASN 88 HB1 ASN 88 -12.157 14.290 37.622 389 HD21 ASN 88 HD21 ASN 88 -8.927 14.880 38.595 390 HD22 ASN 88 HD22 ASN 88 -9.185 14.799 40.293 391 HA PRO 89 HA PRO 89 -11.504 12.342 33.173 392 HB2 PRO 89 HB2 PRO 89 -12.446 9.894 32.469 393 HB3 PRO 89 HB1 PRO 89 -10.755 10.208 32.767 394 HG2 PRO 89 HG2 PRO 89 -12.606 8.640 34.412 395 HG3 PRO 89 HG1 PRO 89 -10.848 8.778 34.559 396 HD2 PRO 89 HD2 PRO 89 -12.963 10.181 36.054 397 HD3 PRO 89 HD1 PRO 89 -11.235 10.021 36.442 398 H GLN 90 HN GLN 90 -13.308 12.340 31.662 399 HA GLN 90 HA GLN 90 -15.831 13.016 33.006 400 HB2 GLN 90 HB2 GLN 90 -14.915 13.405 30.134 401 HB3 GLN 90 HB1 GLN 90 -16.456 13.962 30.765 402 HG2 GLN 90 HG2 GLN 90 -15.220 15.391 32.369 403 HG3 GLN 90 HG1 GLN 90 -13.728 14.857 31.599 404 HE21 GLN 90 HE21 GLN 90 -14.776 14.917 28.910 405 HE22 GLN 90 HE22 GLN 90 -14.998 16.563 28.473 406 HA PRO 91 HA PRO 91 -17.752 9.217 31.762 407 HB2 PRO 91 HB2 PRO 91 -20.150 10.029 30.633 408 HB3 PRO 91 HB1 PRO 91 -19.875 9.832 32.366 409 HG2 PRO 91 HG2 PRO 91 -19.836 12.321 30.716 410 HG3 PRO 91 HG1 PRO 91 -20.450 12.071 32.359 411 HD2 PRO 91 HD2 PRO 91 -18.092 13.276 31.886 412 HD3 PRO 91 HD1 PRO 91 -18.348 12.239 33.302 413 H LYS 92 HN LYS 92 -16.420 8.536 30.203 414 HA LYS 92 HA LYS 92 -17.325 8.597 27.482 415 HB2 LYS 92 HB2 LYS 92 -15.674 10.518 27.792 416 HB3 LYS 92 HB1 LYS 92 -14.483 9.332 28.292 417 HG2 LYS 92 HG2 LYS 92 -14.050 9.896 26.022 418 HG3 LYS 92 HG1 LYS 92 -14.717 8.263 26.053 419 HD2 LYS 92 HD2 LYS 92 -16.945 9.209 25.486 420 HD3 LYS 92 HD1 LYS 92 -16.200 10.801 25.376 421 HE2 LYS 92 HE2 LYS 92 -14.750 10.024 23.587 422 HE3 LYS 92 HE1 LYS 92 -15.446 8.409 23.713 423 HZ1 LYS 92 HZ1 LYS 92 -17.598 9.371 23.099 424 HZ2 LYS 92 HZ2 LYS 92 -16.442 9.566 21.906 425 HZ3 LYS 92 HZ3 LYS 92 -16.863 10.873 22.876 426 H ASN 93 HN ASN 93 -16.577 6.598 26.516 427 HA ASN 93 HA ASN 93 -15.715 4.675 28.499 428 HB2 ASN 93 HB2 ASN 93 -16.412 4.282 25.578 429 HB3 ASN 93 HB1 ASN 93 -15.919 2.983 26.653 430 HD21 ASN 93 HD21 ASN 93 -18.445 5.065 25.687 431 HD22 ASN 93 HD22 ASN 93 -19.693 4.389 26.669 432 H TRP 94 HN TRP 94 -13.611 5.148 29.010 433 HA TRP 94 HA TRP 94 -11.601 5.896 27.389 434 HB2 TRP 94 HB2 TRP 94 -11.451 6.062 29.749 435 HB3 TRP 94 HB1 TRP 94 -11.609 4.320 29.956 436 HD1 TRP 94 HD1 TRP 94 -9.070 7.040 29.162 437 HE1 TRP 94 HE1 TRP 94 -6.716 5.971 29.173 438 HE3 TRP 94 HE3 TRP 94 -10.376 2.136 29.590 439 HZ2 TRP 94 HZ2 TRP 94 -5.597 3.424 29.318 440 HZ3 TRP 94 HZ3 TRP 94 -8.606 0.439 29.671 441 HH2 TRP 94 HH2 TRP 94 -6.267 1.077 29.540 442 H ASN 95 HN ASN 95 -10.034 4.963 26.313 443 HA ASN 95 HA ASN 95 -10.350 2.191 25.475 444 HB2 ASN 95 HB2 ASN 95 -10.859 3.775 23.681 445 HB3 ASN 95 HB1 ASN 95 -9.367 4.637 24.064 446 HD21 ASN 95 HD21 ASN 95 -9.538 1.125 23.802 447 HD22 ASN 95 HD22 ASN 95 -8.459 1.094 22.456 448 H LYS 96 HN LYS 96 -8.450 0.910 25.816 449 HA LYS 96 HA LYS 96 -6.107 2.189 26.910 450 HB2 LYS 96 HB2 LYS 96 -5.038 0.070 26.942 451 HB3 LYS 96 HB1 LYS 96 -6.649 -0.140 27.656 452 HG2 LYS 96 HG2 LYS 96 -7.327 -1.120 25.415 453 HG3 LYS 96 HG1 LYS 96 -5.632 -0.952 24.942 454 HD2 LYS 96 HD2 LYS 96 -6.528 -2.481 27.344 455 HD3 LYS 96 HD1 LYS 96 -6.289 -3.249 25.768 456 HE2 LYS 96 HE2 LYS 96 -4.168 -1.786 27.393 457 HE3 LYS 96 HE1 LYS 96 -4.349 -3.530 27.313 458 HZ1 LYS 96 HZ1 LYS 96 -2.595 -2.768 25.833 459 HZ2 LYS 96 HZ2 LYS 96 -3.607 -1.768 24.999 460 HZ3 LYS 96 HZ3 LYS 96 -3.819 -3.428 24.924 461 H ASP 97 HN ASP 97 -4.003 1.302 25.944 462 HA ASP 97 HA ASP 97 -2.520 0.998 24.300 463 HB2 ASP 97 HB2 ASP 97 -4.418 -0.610 23.469 464 HB3 ASP 97 HB1 ASP 97 -4.738 0.658 22.292 465 H GLY 98 HN GLY 98 -3.851 3.484 25.013 466 HA2 GLY 98 HA2 GLY 98 -2.550 5.511 24.595 467 HA3 GLY 98 HA1 GLY 98 -2.254 4.884 23.008 468 H TYR 99 HN TYR 99 -5.454 4.446 23.801 469 HA TYR 99 HA TYR 99 -7.257 5.126 22.789 470 HB2 TYR 99 HB2 TYR 99 -6.195 7.566 23.909 471 HB3 TYR 99 HB1 TYR 99 -6.868 7.958 22.322 472 HD1 TYR 99 HD1 TYR 99 -9.220 7.639 21.926 473 HD2 TYR 99 HD2 TYR 99 -7.478 6.881 25.714 474 HE1 TYR 99 HE1 TYR 99 -11.432 7.650 22.931 475 HE2 TYR 99 HE2 TYR 99 -9.691 6.892 26.737 476 HH TYR 99 HH TYR 99 -11.879 7.596 26.334 477 H LEU 100 HN LEU 100 -7.057 4.010 21.070 478 HA LEU 100 HA LEU 100 -5.820 5.192 18.667 479 HB2 LEU 100 HB2 LEU 100 -4.587 3.288 20.072 480 HB3 LEU 100 HB1 LEU 100 -5.770 2.251 19.338 481 HG LEU 100 HG LEU 100 -3.640 3.837 17.899 482 HD11 LEU 100 HD11 LEU 100 -3.879 0.903 18.426 483 HD12 LEU 100 HD12 LEU 100 -2.714 2.021 19.136 484 HD13 LEU 100 HD13 LEU 100 -2.657 1.662 17.408 485 HD21 LEU 100 HD21 LEU 100 -4.257 2.563 15.888 486 HD22 LEU 100 HD22 LEU 100 -5.584 3.576 16.442 487 HD23 LEU 100 HD23 LEU 100 -5.609 1.843 16.764 488 H LYS 101 HN LYS 101 -7.031 4.560 16.784 489 HA LYS 101 HA LYS 101 -9.790 3.952 17.266 490 HB2 LYS 101 HB2 LYS 101 -8.295 4.173 14.636 491 HB3 LYS 101 HB1 LYS 101 -10.041 4.108 14.811 492 HG2 LYS 101 HG2 LYS 101 -8.225 6.309 15.792 493 HG3 LYS 101 HG1 LYS 101 -9.321 6.389 14.414 494 HD2 LYS 101 HD2 LYS 101 -11.230 6.049 15.946 495 HD3 LYS 101 HD1 LYS 101 -10.112 6.024 17.309 496 HE2 LYS 101 HE2 LYS 101 -11.084 8.209 17.185 497 HE3 LYS 101 HE1 LYS 101 -9.403 8.333 16.680 498 HZ1 LYS 101 HZ1 LYS 101 -10.926 9.595 15.253 499 HZ2 LYS 101 HZ2 LYS 101 -11.711 8.175 14.829 500 HZ3 LYS 101 HZ3 LYS 101 -10.130 8.403 14.369 501 H LYS 102 HN LYS 102 -10.711 2.198 15.452 502 HA LYS 102 HA LYS 102 -9.537 -0.231 16.448 503 HB2 LYS 102 HB2 LYS 102 -12.078 0.172 14.815 504 HB3 LYS 102 HB1 LYS 102 -11.499 -1.422 15.310 505 HG2 LYS 102 HG2 LYS 102 -13.185 -0.852 16.771 506 HG3 LYS 102 HG1 LYS 102 -11.717 -0.460 17.668 507 HD2 LYS 102 HD2 LYS 102 -11.947 1.871 17.110 508 HD3 LYS 102 HD1 LYS 102 -13.328 1.524 16.072 509 HE2 LYS 102 HE2 LYS 102 -14.226 2.328 18.074 510 HE3 LYS 102 HE1 LYS 102 -14.418 0.568 18.002 511 HZ1 LYS 102 HZ1 LYS 102 -12.633 0.274 19.578 512 HZ2 LYS 102 HZ2 LYS 102 -13.689 1.439 20.215 513 HZ3 LYS 102 HZ3 LYS 102 -12.260 1.923 19.491 514 H LEU 103 HN LEU 103 -7.659 0.119 15.483 515 HA LEU 103 HA LEU 103 -7.366 -0.768 12.708 516 HB2 LEU 103 HB2 LEU 103 -5.785 1.300 14.235 517 HB3 LEU 103 HB1 LEU 103 -5.410 0.725 12.626 518 HG LEU 103 HG LEU 103 -7.945 2.201 13.319 519 HD11 LEU 103 HD11 LEU 103 -6.870 4.135 12.305 520 HD12 LEU 103 HD12 LEU 103 -5.377 3.214 12.122 521 HD13 LEU 103 HD13 LEU 103 -5.989 3.595 13.733 522 HD21 LEU 103 HD21 LEU 103 -8.094 0.820 11.315 523 HD22 LEU 103 HD22 LEU 103 -6.608 1.537 10.696 524 HD23 LEU 103 HD23 LEU 103 -8.051 2.531 10.889 525 HA PRO 104 HA PRO 104 -4.664 -3.688 14.767 526 HB2 PRO 104 HB2 PRO 104 -2.914 -4.198 12.740 527 HB3 PRO 104 HB1 PRO 104 -4.547 -4.877 12.782 528 HG2 PRO 104 HG2 PRO 104 -3.525 -2.490 11.291 529 HG3 PRO 104 HG1 PRO 104 -4.604 -3.778 10.725 530 HD2 PRO 104 HD2 PRO 104 -5.539 -1.376 11.493 531 HD3 PRO 104 HD1 PRO 104 -6.448 -2.873 11.789 532 H VAL 105 HN VAL 105 -2.194 -3.978 15.007 533 HA VAL 105 HA VAL 105 -1.128 -1.418 15.783 534 HB VAL 105 HB VAL 105 -1.006 -3.693 17.025 535 HG11 VAL 105 HG11 VAL 105 -0.075 -5.072 15.327 536 HG12 VAL 105 HG12 VAL 105 1.051 -4.983 16.684 537 HG13 VAL 105 HG13 VAL 105 1.360 -4.055 15.227 538 HG21 VAL 105 HG21 VAL 105 0.045 -1.628 17.849 539 HG22 VAL 105 HG22 VAL 105 1.500 -2.014 16.924 540 HG23 VAL 105 HG23 VAL 105 0.942 -3.093 18.213 541 H ASP 106 HN ASP 106 1.463 -1.245 15.242 542 HA ASP 106 HA ASP 106 1.479 -0.815 12.466 543 HB2 ASP 106 HB2 ASP 106 2.692 0.850 13.516 544 HB3 ASP 106 HB1 ASP 106 3.439 -0.243 14.706 545 HA PRO 107 HA PRO 107 2.998 -4.595 10.799 546 HB2 PRO 107 HB2 PRO 107 4.756 -3.366 9.043 547 HB3 PRO 107 HB1 PRO 107 3.106 -3.881 8.673 548 HG2 PRO 107 HG2 PRO 107 4.143 -1.176 9.362 549 HG3 PRO 107 HG1 PRO 107 2.760 -1.617 8.346 550 HD2 PRO 107 HD2 PRO 107 2.457 -0.614 10.778 551 HD3 PRO 107 HD1 PRO 107 1.355 -1.866 10.158 552 H TRP 108 HN TRP 108 5.105 -5.568 10.183 553 HA TRP 108 HA TRP 108 7.115 -6.365 10.656 554 HB2 TRP 108 HB2 TRP 108 7.974 -3.806 12.050 555 HB3 TRP 108 HB1 TRP 108 8.981 -4.959 11.189 556 HD1 TRP 108 HD1 TRP 108 8.409 -4.983 8.420 557 HE1 TRP 108 HE1 TRP 108 8.032 -2.950 6.894 558 HE3 TRP 108 HE3 TRP 108 7.258 -1.667 11.994 559 HZ2 TRP 108 HZ2 TRP 108 7.251 -0.143 7.275 560 HZ3 TRP 108 HZ3 TRP 108 6.700 0.632 11.427 561 HH2 TRP 108 HH2 TRP 108 6.640 1.402 9.248 562 H GLY 109 HN GLY 109 4.871 -5.925 12.598 563 HA2 GLY 109 HA2 GLY 109 4.186 -6.641 14.659 564 HA3 GLY 109 HA1 GLY 109 5.722 -7.483 14.813 565 H ASN 110 HN ASN 110 5.326 -3.940 14.478 566 HA ASN 110 HA ASN 110 6.636 -3.611 17.025 567 HB2 ASN 110 HB2 ASN 110 5.874 -1.658 14.868 568 HB3 ASN 110 HB1 ASN 110 6.643 -1.220 16.377 569 HD21 ASN 110 HD21 ASN 110 7.363 -0.906 13.661 570 HD22 ASN 110 HD22 ASN 110 8.952 -1.533 13.450 571 HA PRO 111 HA PRO 111 2.625 -2.392 18.756 572 HB2 PRO 111 HB2 PRO 111 4.392 -2.015 21.109 573 HB3 PRO 111 HB1 PRO 111 2.872 -2.915 20.999 574 HG2 PRO 111 HG2 PRO 111 5.164 -4.226 21.208 575 HG3 PRO 111 HG1 PRO 111 3.903 -4.800 20.104 576 HD2 PRO 111 HD2 PRO 111 6.378 -3.233 19.480 577 HD3 PRO 111 HD1 PRO 111 5.702 -4.648 18.646 578 H TYR 112 HN TYR 112 1.950 -0.287 18.918 579 HA TYR 112 HA TYR 112 3.751 1.775 18.140 580 HB2 TYR 112 HB2 TYR 112 0.866 1.810 19.004 581 HB3 TYR 112 HB1 TYR 112 1.756 3.298 18.758 582 HD1 TYR 112 HD2 TYR 112 2.471 3.931 16.505 583 HD2 TYR 112 HD1 TYR 112 0.029 0.516 17.150 584 HE1 TYR 112 HE2 TYR 112 1.861 3.934 14.131 585 HE2 TYR 112 HE1 TYR 112 -0.602 0.523 14.760 586 HH TYR 112 HH TYR 112 -0.633 1.974 12.770 587 H GLN 113 HN GLN 113 4.466 3.525 19.282 588 HA GLN 113 HA GLN 113 4.743 2.979 22.164 589 HB2 GLN 113 HB2 GLN 113 6.358 5.179 21.088 590 HB3 GLN 113 HB1 GLN 113 6.875 3.826 22.074 591 HG2 GLN 113 HG2 GLN 113 6.602 3.915 19.075 592 HG3 GLN 113 HG1 GLN 113 8.094 3.998 19.984 593 HE21 GLN 113 HE21 GLN 113 7.255 1.819 21.826 594 HE22 GLN 113 HE22 GLN 113 7.349 0.386 20.858 595 H TYR 114 HN TYR 114 3.376 4.153 23.340 596 HA TYR 114 HA TYR 114 2.315 6.658 22.247 597 HB2 TYR 114 HB2 TYR 114 1.349 5.204 24.730 598 HB3 TYR 114 HB1 TYR 114 0.461 6.357 23.735 599 HD1 TYR 114 HD1 TYR 114 0.623 5.491 21.098 600 HD2 TYR 114 HD2 TYR 114 0.409 3.055 24.579 601 HE1 TYR 114 HE1 TYR 114 -0.209 3.651 19.746 602 HE2 TYR 114 HE2 TYR 114 -0.455 1.183 23.233 603 HH TYR 114 HH TYR 114 -1.652 0.938 20.838 604 H LEU 115 HN LEU 115 3.288 8.459 22.938 605 HA LEU 115 HA LEU 115 4.291 8.518 25.651 606 HB2 LEU 115 HB2 LEU 115 5.614 9.556 23.157 607 HB3 LEU 115 HB1 LEU 115 6.141 9.967 24.782 608 HG LEU 115 HG LEU 115 6.093 7.162 23.661 609 HD11 LEU 115 HD11 LEU 115 8.383 9.081 23.978 610 HD12 LEU 115 HD12 LEU 115 7.669 8.532 22.464 611 HD13 LEU 115 HD13 LEU 115 8.506 7.384 23.510 612 HD21 LEU 115 HD21 LEU 115 5.922 7.208 26.071 613 HD22 LEU 115 HD22 LEU 115 7.262 8.342 26.169 614 HD23 LEU 115 HD23 LEU 115 7.548 6.694 25.611 615 H ALA 116 HN ALA 116 4.357 10.708 26.515 616 HA ALA 116 HA ALA 116 2.296 12.285 25.269 617 HB1 ALA 116 HB1 ALA 116 2.642 11.878 28.219 618 HB2 ALA 116 HB2 ALA 116 1.738 10.748 27.231 619 HB3 ALA 116 HB3 ALA 116 1.182 12.403 27.350 620 HA PRO 117 HA PRO 117 4.847 15.822 25.718 621 HB2 PRO 117 HB2 PRO 117 4.024 17.482 27.653 622 HB3 PRO 117 HB1 PRO 117 3.282 17.319 26.076 623 HG2 PRO 117 HG2 PRO 117 2.396 16.034 28.645 624 HG3 PRO 117 HG1 PRO 117 1.403 16.843 27.413 625 HD2 PRO 117 HD2 PRO 117 1.660 14.175 27.524 626 HD3 PRO 117 HD1 PRO 117 1.534 15.001 25.948 627 H GLY 118 HN GLY 118 6.752 15.891 26.255 628 HA2 GLY 118 HA2 GLY 118 7.476 15.609 29.073 629 HA3 GLY 118 HA1 GLY 118 8.358 14.765 27.792 630 H THR 119 HN THR 119 9.548 15.926 26.355 631 HA THR 119 HA THR 119 10.474 18.490 27.421 632 HB THR 119 HB THR 119 12.595 17.862 26.120 633 HG1 THR 119 HG1 THR 119 11.681 16.174 24.923 634 HG21 THR 119 HG21 THR 119 11.765 16.184 28.499 635 HG22 THR 119 HG22 THR 119 12.487 17.791 28.572 636 HG23 THR 119 HG23 THR 119 13.425 16.430 27.957 637 H LYS 120 HN LYS 120 9.378 19.959 26.278 638 HA LYS 120 HA LYS 120 8.944 21.425 24.631 639 HB2 LYS 120 HB2 LYS 120 10.770 19.749 22.889 640 HB3 LYS 120 HB1 LYS 120 10.091 21.299 22.437 641 HG2 LYS 120 HG2 LYS 120 12.023 20.801 24.695 642 HG3 LYS 120 HG1 LYS 120 12.404 21.502 23.121 643 HD2 LYS 120 HD2 LYS 120 10.856 23.349 23.604 644 HD3 LYS 120 HD1 LYS 120 10.565 22.669 25.207 645 HE2 LYS 120 HE2 LYS 120 12.175 24.437 25.391 646 HE3 LYS 120 HE1 LYS 120 12.994 22.903 25.670 647 HZ1 LYS 120 HZ1 LYS 120 13.005 24.380 23.092 648 HZ2 LYS 120 HZ2 LYS 120 13.869 22.986 23.406 649 HZ3 LYS 120 HZ3 LYS 120 14.253 24.417 24.199 650 H GLY 121 HN GLY 121 7.960 18.319 24.617 651 HA2 GLY 121 HA2 GLY 121 6.364 18.577 22.168 652 HA3 GLY 121 HA1 GLY 121 6.749 17.099 23.058 653 HA PRO 122 HA PRO 122 2.658 19.047 24.730 654 HB2 PRO 122 HB2 PRO 122 1.642 18.746 21.941 655 HB3 PRO 122 HB1 PRO 122 1.154 19.906 23.185 656 HG2 PRO 122 HG2 PRO 122 2.676 20.682 21.176 657 HG3 PRO 122 HG1 PRO 122 3.008 21.271 22.817 658 HD2 PRO 122 HD2 PRO 122 4.442 19.131 21.252 659 HD3 PRO 122 HD1 PRO 122 5.094 20.394 22.323 660 H PHE 123 HN PHE 123 3.548 16.733 22.150 661 HA PHE 123 HA PHE 123 3.369 14.612 23.881 662 HB2 PHE 123 HB2 PHE 123 1.580 13.171 22.934 663 HB3 PHE 123 HB1 PHE 123 0.916 14.616 23.661 664 HD1 PHE 123 HD1 PHE 123 1.541 12.825 20.485 665 HD2 PHE 123 HD2 PHE 123 -0.344 16.186 22.338 666 HE1 PHE 123 HE1 PHE 123 0.183 13.171 18.482 667 HE2 PHE 123 HE2 PHE 123 -1.684 16.534 20.315 668 HZ PHE 123 HZ PHE 123 -1.426 15.030 18.388 669 H ASP 124 HN ASP 124 3.702 12.400 22.686 670 HA ASP 124 HA ASP 124 5.110 12.837 20.147 671 HB2 ASP 124 HB2 ASP 124 6.301 11.364 22.547 672 HB3 ASP 124 HB1 ASP 124 6.984 11.367 20.932 673 H LEU 125 HN LEU 125 4.083 11.387 18.771 674 HA LEU 125 HA LEU 125 3.312 8.819 19.981 675 HB2 LEU 125 HB2 LEU 125 1.405 10.301 19.792 676 HB3 LEU 125 HB1 LEU 125 1.744 10.555 18.099 677 HG LEU 125 HG LEU 125 1.152 8.239 17.621 678 HD11 LEU 125 HD11 LEU 125 0.544 8.076 20.577 679 HD12 LEU 125 HD12 LEU 125 1.834 7.213 19.729 680 HD13 LEU 125 HD13 LEU 125 0.147 6.854 19.368 681 HD21 LEU 125 HD21 LEU 125 -0.826 9.826 19.225 682 HD22 LEU 125 HD22 LEU 125 -1.229 8.442 18.231 683 HD23 LEU 125 HD23 LEU 125 -0.561 9.898 17.479 684 H TYR 126 HN TYR 126 4.088 7.034 18.832 685 HA TYR 126 HA TYR 126 4.434 7.062 16.057 686 HB2 TYR 126 HB2 TYR 126 6.876 7.126 15.843 687 HB3 TYR 126 HB1 TYR 126 6.287 8.617 16.552 688 HD1 TYR 126 HD2 TYR 126 6.769 9.172 18.873 689 HD2 TYR 126 HD1 TYR 126 8.292 5.628 17.084 690 HE1 TYR 126 HE2 TYR 126 8.404 8.965 20.682 691 HE2 TYR 126 HE1 TYR 126 9.937 5.416 18.884 692 HH TYR 126 HH TYR 126 9.789 7.230 21.765 693 H SER 127 HN SER 127 5.650 5.158 15.322 694 HA SER 127 HA SER 127 5.945 3.073 17.353 695 HB2 SER 127 HB2 SER 127 3.989 2.645 15.787 696 HB3 SER 127 HB1 SER 127 5.155 2.624 14.466 697 HG SER 127 HG SER 127 5.422 0.630 14.919 698 H LEU 128 HN LEU 128 7.591 1.553 16.728 699 HA LEU 128 HA LEU 128 9.967 2.815 15.772 700 HB2 LEU 128 HB2 LEU 128 9.331 -0.073 16.329 701 HB3 LEU 128 HB1 LEU 128 10.950 0.513 15.965 702 HG LEU 128 HG LEU 128 9.257 1.187 18.369 703 HD11 LEU 128 HD11 LEU 128 10.196 -1.050 18.422 704 HD12 LEU 128 HD12 LEU 128 10.955 -0.008 19.625 705 HD13 LEU 128 HD13 LEU 128 11.804 -0.390 18.127 706 HD21 LEU 128 HD21 LEU 128 11.236 2.393 19.188 707 HD22 LEU 128 HD22 LEU 128 10.564 3.122 17.740 708 HD23 LEU 128 HD23 LEU 128 12.025 2.135 17.634 709 H GLY 129 HN GLY 129 11.306 1.866 13.959 710 HA2 GLY 129 HA2 GLY 129 9.594 1.506 11.622 711 HA3 GLY 129 HA1 GLY 129 11.327 1.771 11.606 712 H ALA 130 HN ALA 130 10.974 0.046 9.950 713 HA ALA 130 HA ALA 130 10.339 -2.592 10.584 714 HB1 ALA 130 HB1 ALA 130 11.517 -3.165 8.538 715 HB2 ALA 130 HB2 ALA 130 12.205 -1.539 8.480 716 HB3 ALA 130 HB3 ALA 130 10.462 -1.769 8.322 717 H ASP 131 HN ASP 131 13.053 -0.827 11.467 718 HA ASP 131 HA ASP 131 14.787 -3.165 11.707 719 HB2 ASP 131 HB2 ASP 131 15.613 -0.962 10.820 720 HB3 ASP 131 HB1 ASP 131 15.393 -0.301 12.436 721 H GLY 132 HN GLY 132 12.464 -1.602 13.537 722 HA2 GLY 132 HA2 GLY 132 11.794 -1.946 15.713 723 HA3 GLY 132 HA1 GLY 132 13.175 -3.013 15.929 724 H LYS 133 HN LYS 133 13.671 0.190 14.751 725 HA LYS 133 HA LYS 133 14.472 1.178 17.372 726 HB2 LYS 133 HB2 LYS 133 16.266 1.181 14.924 727 HB3 LYS 133 HB1 LYS 133 16.630 1.985 16.443 728 HG2 LYS 133 HG2 LYS 133 16.661 -0.201 17.571 729 HG3 LYS 133 HG1 LYS 133 16.319 -0.983 16.035 730 HD2 LYS 133 HD2 LYS 133 18.435 -0.095 15.134 731 HD3 LYS 133 HD1 LYS 133 18.782 0.634 16.706 732 HE2 LYS 133 HE2 LYS 133 18.769 -1.562 17.750 733 HE3 LYS 133 HE1 LYS 133 18.345 -2.305 16.214 734 HZ1 LYS 133 HZ1 LYS 133 20.486 -1.513 15.329 735 HZ2 LYS 133 HZ2 LYS 133 20.662 -2.568 16.610 736 HZ3 LYS 133 HZ3 LYS 133 20.903 -0.921 16.855 737 H GLU 134 HN GLU 134 14.455 3.508 17.477 738 HA GLU 134 HA GLU 134 12.853 4.579 15.340 739 HB2 GLU 134 HB2 GLU 134 12.352 6.484 16.870 740 HB3 GLU 134 HB1 GLU 134 11.885 4.937 17.535 741 HG2 GLU 134 HG2 GLU 134 14.384 6.443 18.305 742 HG3 GLU 134 HG1 GLU 134 12.861 6.557 19.168 743 H GLY 135 HN GLY 135 13.883 5.377 13.723 744 HA2 GLY 135 HA2 GLY 135 15.939 7.381 14.120 745 HA3 GLY 135 HA1 GLY 135 16.414 5.939 13.233 746 H GLY 136 HN GLY 136 16.771 7.820 11.637 747 HA2 GLY 136 HA2 GLY 136 14.308 8.488 10.207 748 HA3 GLY 136 HA1 GLY 136 15.853 9.331 10.062 749 H SER 137 HN SER 137 13.961 7.659 8.245 750 HA SER 137 HA SER 137 15.766 6.506 6.486 751 HB2 SER 137 HB2 SER 137 14.602 4.747 8.606 752 HB3 SER 137 HB1 SER 137 14.918 4.053 7.012 753 HG SER 137 HG SER 137 16.863 5.481 8.468 754 H ASP 138 HN ASP 138 14.329 4.856 5.052 755 HA ASP 138 HA ASP 138 11.675 6.100 4.814 756 HB2 ASP 138 HB2 ASP 138 11.524 4.946 2.647 757 HB3 ASP 138 HB1 ASP 138 12.823 6.144 2.706 758 H ASN 139 HN ASN 139 13.135 3.140 5.575 759 HA ASN 139 HA ASN 139 10.437 1.969 5.904 760 HB2 ASN 139 HB2 ASN 139 11.714 0.927 4.074 761 HB3 ASN 139 HB1 ASN 139 13.021 0.584 5.181 762 HD21 ASN 139 HD21 ASN 139 9.635 0.091 6.161 763 HD22 ASN 139 HD22 ASN 139 9.745 -1.630 6.037 764 H ASP 140 HN ASP 140 13.649 2.364 7.163 765 HA ASP 140 HA ASP 140 12.973 0.866 9.590 766 HB2 ASP 140 HB2 ASP 140 15.591 2.152 8.805 767 HB3 ASP 140 HB1 ASP 140 15.332 1.132 10.212 768 H ALA 141 HN ALA 141 12.042 3.647 8.755 769 HA ALA 141 HA ALA 141 13.124 5.347 10.848 770 HB1 ALA 141 HB1 ALA 141 11.666 7.045 9.922 771 HB2 ALA 141 HB2 ALA 141 10.943 5.850 8.847 772 HB3 ALA 141 HB3 ALA 141 12.638 6.297 8.654 773 H ASP 142 HN ASP 142 11.774 6.289 12.441 774 HA ASP 142 HA ASP 142 9.713 4.506 13.336 775 HB2 ASP 142 HB2 ASP 142 9.472 6.045 15.259 776 HB3 ASP 142 HB1 ASP 142 11.152 5.600 15.035 777 H ILE 143 HN ILE 143 7.649 4.755 12.977 778 HA ILE 143 HA ILE 143 6.962 7.023 11.336 779 HB ILE 143 HB ILE 143 4.931 5.704 10.636 780 HG12 ILE 143 HG12 ILE 143 5.258 3.108 10.950 781 HG13 ILE 143 HG11 ILE 143 6.180 3.571 12.368 782 HG21 ILE 143 HG21 ILE 143 7.593 4.418 10.139 783 HG22 ILE 143 HG22 ILE 143 6.883 5.764 9.246 784 HG23 ILE 143 HG23 ILE 143 6.145 4.161 9.164 785 HD11 ILE 143 HD11 ILE 143 3.848 2.960 12.858 786 HD12 ILE 143 HD12 ILE 143 3.312 4.331 11.876 787 HD13 ILE 143 HD13 ILE 143 4.252 4.605 13.337 788 H GLY 144 HN GLY 144 5.967 8.659 12.174 789 HA2 GLY 144 HA2 GLY 144 3.976 8.263 14.184 790 HA3 GLY 144 HA1 GLY 144 5.488 8.889 14.813 791 H ASN 145 HN ASN 145 3.614 10.377 15.337 792 HA ASN 145 HA ASN 145 4.036 12.718 13.853 793 HB2 ASN 145 HB2 ASN 145 1.809 13.244 13.120 794 HB3 ASN 145 HB1 ASN 145 2.168 11.653 12.492 795 HD21 ASN 145 HD21 ASN 145 1.534 10.365 15.161 796 HD22 ASN 145 HD22 ASN 145 -0.192 10.414 15.236 797 H TRP 146 HN TRP 146 3.504 14.461 15.104 798 HA TRP 146 HA TRP 146 1.914 14.084 17.416 799 HB2 TRP 146 HB2 TRP 146 3.663 14.814 19.035 800 HB3 TRP 146 HB1 TRP 146 3.872 13.195 18.398 801 HD1 TRP 146 HD1 TRP 146 5.357 16.751 17.900 802 HE1 TRP 146 HE1 TRP 146 7.820 16.468 17.219 803 HE3 TRP 146 HE3 TRP 146 5.472 11.715 17.581 804 HZ2 TRP 146 HZ2 TRP 146 9.601 14.339 16.626 805 HZ3 TRP 146 HZ3 TRP 146 7.597 10.579 16.960 806 HH2 TRP 146 HH2 TRP 146 9.614 11.881 16.491 807 H ASP 147 HN ASP 147 1.995 16.032 18.750 808 HA ASP 147 HA ASP 147 1.908 18.305 16.899 809 HB2 ASP 147 HB2 ASP 147 -0.265 17.640 18.003 810 HB3 ASP 147 HB1 ASP 147 0.473 18.037 19.551 811 H ASN 148 HN ASN 148 3.410 19.746 17.191 812 HA ASN 148 HA ASN 148 4.226 20.412 19.829 813 HB2 ASN 148 HB2 ASN 148 6.602 20.311 19.392 814 HB3 ASN 148 HB1 ASN 148 5.917 18.740 19.060 815 HD21 ASN 148 HD21 ASN 148 7.708 21.372 17.826 816 HD22 ASN 148 HD22 ASN 148 7.975 20.759 16.237 Start of MODEL 20 1 H1 MET 39 HT1 MET 39 2.399 4.827 0.121 2 H2 MET 39 HT2 MET 39 1.847 4.868 -1.453 3 H3 MET 39 HT3 MET 39 2.793 6.120 -0.887 4 HA MET 39 HA MET 39 3.988 4.659 -2.382 5 HB2 MET 39 HB2 MET 39 5.257 5.831 -0.568 6 HB3 MET 39 HB1 MET 39 5.019 4.432 0.467 7 HG2 MET 39 HG2 MET 39 7.224 4.389 -0.475 8 HG3 MET 39 HG1 MET 39 6.244 3.063 -1.094 9 HE1 MET 39 HE1 MET 39 5.969 6.810 -2.312 10 HE2 MET 39 HE2 MET 39 7.169 6.824 -3.602 11 HE3 MET 39 HE3 MET 39 7.683 6.641 -1.928 12 H SER 40 HN SER 40 3.261 2.753 -3.208 13 HA SER 40 HA SER 40 3.102 0.519 -1.352 14 HB2 SER 40 HB2 SER 40 1.031 1.006 -2.601 15 HB3 SER 40 HB1 SER 40 1.907 0.798 -4.118 16 HG SER 40 HG SER 40 2.219 -1.317 -3.648 17 H ARG 41 HN ARG 41 5.208 -0.055 -1.262 18 HA ARG 41 HA ARG 41 6.241 -1.556 -3.488 19 HB2 ARG 41 HB2 ARG 41 7.789 0.738 -2.196 20 HB3 ARG 41 HB1 ARG 41 8.575 -0.525 -3.112 21 HG2 ARG 41 HG2 ARG 41 7.221 0.184 -5.097 22 HG3 ARG 41 HG1 ARG 41 6.629 1.535 -4.132 23 HD2 ARG 41 HD2 ARG 41 9.522 0.961 -4.751 24 HD3 ARG 41 HD1 ARG 41 8.533 2.158 -5.574 25 HE ARG 41 HE ARG 41 8.284 3.168 -3.272 26 HH11 ARG 41 HH11 ARG 41 11.236 1.477 -4.338 27 HH12 ARG 41 HH12 ARG 41 12.272 2.343 -3.310 28 HH21 ARG 41 HH21 ARG 41 9.770 4.354 -1.800 29 HH22 ARG 41 HH22 ARG 41 11.417 3.953 -1.830 30 HA PRO 42 HA PRO 42 7.538 -4.458 -0.317 31 HB2 PRO 42 HB2 PRO 42 10.349 -3.759 -1.108 32 HB3 PRO 42 HB1 PRO 42 9.660 -5.358 -0.792 33 HG2 PRO 42 HG2 PRO 42 9.959 -4.610 -3.282 34 HG3 PRO 42 HG1 PRO 42 8.424 -5.347 -2.787 35 HD2 PRO 42 HD2 PRO 42 9.065 -2.495 -3.344 36 HD3 PRO 42 HD1 PRO 42 7.587 -3.408 -3.705 37 H ASP 43 HN ASP 43 7.348 -3.945 1.741 38 HA ASP 43 HA ASP 43 7.620 -3.242 3.845 39 HB2 ASP 43 HB2 ASP 43 10.197 -3.510 3.273 40 HB3 ASP 43 HB1 ASP 43 10.148 -1.744 3.283 41 H GLN 44 HN GLN 44 8.114 -1.009 1.345 42 HA GLN 44 HA GLN 44 7.481 1.398 2.706 43 HB2 GLN 44 HB2 GLN 44 7.089 0.653 -0.186 44 HB3 GLN 44 HB1 GLN 44 7.024 2.275 0.493 45 HG2 GLN 44 HG2 GLN 44 9.459 0.499 0.484 46 HG3 GLN 44 HG1 GLN 44 9.149 1.811 -0.649 47 HE21 GLN 44 HE21 GLN 44 7.943 3.496 1.494 48 HE22 GLN 44 HE22 GLN 44 9.274 4.082 2.362 49 H ALA 45 HN ALA 45 5.646 -1.206 1.410 50 HA ALA 45 HA ALA 45 3.124 0.008 1.356 51 HB1 ALA 45 HB1 ALA 45 3.788 -2.902 1.804 52 HB2 ALA 45 HB2 ALA 45 3.634 -2.120 0.233 53 HB3 ALA 45 HB3 ALA 45 2.229 -2.255 1.291 54 H LYS 46 HN LYS 46 5.142 -0.981 3.967 55 HA LYS 46 HA LYS 46 2.981 -1.198 5.906 56 HB2 LYS 46 HB2 LYS 46 5.962 -0.985 6.308 57 HB3 LYS 46 HB1 LYS 46 4.777 -1.520 7.486 58 HG2 LYS 46 HG2 LYS 46 4.381 -3.534 6.278 59 HG3 LYS 46 HG1 LYS 46 5.349 -2.965 4.912 60 HD2 LYS 46 HD2 LYS 46 7.325 -2.906 6.396 61 HD3 LYS 46 HD1 LYS 46 6.340 -3.569 7.696 62 HE2 LYS 46 HE2 LYS 46 5.951 -5.575 6.422 63 HE3 LYS 46 HE1 LYS 46 6.818 -4.903 5.043 64 HZ1 LYS 46 HZ1 LYS 46 7.998 -5.582 7.694 65 HZ2 LYS 46 HZ2 LYS 46 8.809 -4.792 6.448 66 HZ3 LYS 46 HZ3 LYS 46 8.259 -6.369 6.219 67 H VAL 47 HN VAL 47 5.247 1.131 4.574 68 HA VAL 47 HA VAL 47 5.138 2.976 6.752 69 HB VAL 47 HB VAL 47 5.769 3.650 3.873 70 HG11 VAL 47 HG11 VAL 47 7.109 5.475 4.816 71 HG12 VAL 47 HG12 VAL 47 6.566 5.021 6.429 72 HG13 VAL 47 HG13 VAL 47 5.399 5.602 5.239 73 HG21 VAL 47 HG21 VAL 47 7.217 1.824 4.617 74 HG22 VAL 47 HG22 VAL 47 7.739 2.829 5.991 75 HG23 VAL 47 HG23 VAL 47 8.073 3.337 4.337 76 H THR 48 HN THR 48 3.649 2.626 3.626 77 HA THR 48 HA THR 48 2.395 5.086 3.437 78 HB THR 48 HB THR 48 2.865 3.608 1.526 79 HG1 THR 48 HG1 THR 48 0.088 4.025 1.427 80 HG21 THR 48 HG21 THR 48 2.197 1.489 2.463 81 HG22 THR 48 HG22 THR 48 1.335 1.782 0.950 82 HG23 THR 48 HG23 THR 48 0.510 1.999 2.500 83 H VAL 49 HN VAL 49 1.135 2.092 4.876 84 HA VAL 49 HA VAL 49 -1.408 3.387 5.244 85 HB VAL 49 HB VAL 49 -2.188 1.341 6.321 86 HG11 VAL 49 HG11 VAL 49 -1.986 -0.202 4.440 87 HG12 VAL 49 HG12 VAL 49 -0.651 0.751 3.802 88 HG13 VAL 49 HG13 VAL 49 -2.267 1.452 3.892 89 HG21 VAL 49 HG21 VAL 49 -0.173 0.692 7.501 90 HG22 VAL 49 HG22 VAL 49 0.629 0.320 5.973 91 HG23 VAL 49 HG23 VAL 49 -0.756 -0.640 6.506 92 H ALA 50 HN ALA 50 1.452 2.617 7.134 93 HA ALA 50 HA ALA 50 0.470 3.053 9.679 94 HB1 ALA 50 HB1 ALA 50 3.198 3.698 8.645 95 HB2 ALA 50 HB2 ALA 50 2.659 2.079 9.119 96 HB3 ALA 50 HB3 ALA 50 2.748 3.377 10.319 97 H LYS 51 HN LYS 51 1.518 5.325 7.227 98 HA LYS 51 HA LYS 51 1.770 7.565 8.908 99 HB2 LYS 51 HB2 LYS 51 1.001 7.549 5.972 100 HB3 LYS 51 HB1 LYS 51 1.627 8.928 6.860 101 HG2 LYS 51 HG2 LYS 51 3.172 6.369 6.474 102 HG3 LYS 51 HG1 LYS 51 3.274 7.734 5.373 103 HD2 LYS 51 HD2 LYS 51 3.866 7.987 8.320 104 HD3 LYS 51 HD1 LYS 51 5.094 7.520 7.146 105 HE2 LYS 51 HE2 LYS 51 3.488 10.079 7.104 106 HE3 LYS 51 HE1 LYS 51 5.165 9.924 7.622 107 HZ1 LYS 51 HZ1 LYS 51 4.126 9.412 4.881 108 HZ2 LYS 51 HZ2 LYS 51 5.740 9.222 5.329 109 HZ3 LYS 51 HZ3 LYS 51 5.017 10.739 5.362 110 H GLY 52 HN GLY 52 -0.972 5.967 7.530 111 HA2 GLY 52 HA2 GLY 52 -2.825 8.138 8.086 112 HA3 GLY 52 HA1 GLY 52 -3.222 6.574 7.383 113 H ASP 53 HN ASP 53 -1.546 5.328 9.547 114 HA ASP 53 HA ASP 53 -3.748 5.030 11.391 115 HB2 ASP 53 HB2 ASP 53 -1.098 3.576 11.280 116 HB3 ASP 53 HB1 ASP 53 -2.377 3.231 12.441 117 H ILE 54 HN ILE 54 -0.446 6.217 11.463 118 HA ILE 54 HA ILE 54 -0.475 6.954 14.182 119 HB ILE 54 HB ILE 54 1.296 8.604 13.635 120 HG12 ILE 54 HG12 ILE 54 0.809 7.759 10.774 121 HG13 ILE 54 HG11 ILE 54 0.417 9.326 11.457 122 HG21 ILE 54 HG21 ILE 54 2.955 7.011 12.747 123 HG22 ILE 54 HG22 ILE 54 1.643 5.879 12.410 124 HG23 ILE 54 HG23 ILE 54 1.986 6.377 14.074 125 HD11 ILE 54 HD11 ILE 54 3.171 8.174 11.155 126 HD12 ILE 54 HD12 ILE 54 2.776 9.765 11.820 127 HD13 ILE 54 HD13 ILE 54 2.433 9.403 10.123 128 H LYS 55 HN LYS 55 -1.748 8.467 11.315 129 HA LYS 55 HA LYS 55 -2.434 10.936 12.540 130 HB2 LYS 55 HB2 LYS 55 -2.840 9.688 9.952 131 HB3 LYS 55 HB1 LYS 55 -4.284 10.530 10.500 132 HG2 LYS 55 HG2 LYS 55 -2.881 11.969 9.129 133 HG3 LYS 55 HG1 LYS 55 -3.023 12.576 10.774 134 HD2 LYS 55 HD2 LYS 55 -0.816 11.543 11.291 135 HD3 LYS 55 HD1 LYS 55 -0.681 11.095 9.591 136 HE2 LYS 55 HE2 LYS 55 -0.993 13.907 10.625 137 HE3 LYS 55 HE1 LYS 55 0.534 13.178 10.154 138 HZ1 LYS 55 HZ1 LYS 55 -1.796 13.692 8.371 139 HZ2 LYS 55 HZ2 LYS 55 -0.357 12.934 7.897 140 HZ3 LYS 55 HZ3 LYS 55 -0.335 14.531 8.392 141 H ALA 56 HN ALA 56 -4.014 7.845 12.267 142 HA ALA 56 HA ALA 56 -6.553 8.592 13.243 143 HB1 ALA 56 HB1 ALA 56 -6.113 6.451 12.100 144 HB2 ALA 56 HB2 ALA 56 -6.861 6.205 13.682 145 HB3 ALA 56 HB3 ALA 56 -5.129 5.949 13.479 146 H ILE 57 HN ILE 57 -3.674 7.302 14.820 147 HA ILE 57 HA ILE 57 -4.734 7.195 17.435 148 HB ILE 57 HB ILE 57 -1.818 7.541 16.683 149 HG12 ILE 57 HG12 ILE 57 -3.355 4.994 17.134 150 HG13 ILE 57 HG11 ILE 57 -3.024 5.651 15.537 151 HG21 ILE 57 HG21 ILE 57 -3.174 6.355 19.124 152 HG22 ILE 57 HG22 ILE 57 -2.316 7.894 19.063 153 HG23 ILE 57 HG23 ILE 57 -1.434 6.383 18.832 154 HD11 ILE 57 HD11 ILE 57 -0.925 4.828 17.537 155 HD12 ILE 57 HD12 ILE 57 -0.669 5.417 15.891 156 HD13 ILE 57 HD13 ILE 57 -1.495 3.885 16.152 157 H ALA 58 HN ALA 58 -3.001 9.688 15.676 158 HA ALA 58 HA ALA 58 -2.615 11.509 17.760 159 HB1 ALA 58 HB1 ALA 58 -2.428 13.212 16.028 160 HB2 ALA 58 HB2 ALA 58 -3.146 12.112 14.852 161 HB3 ALA 58 HB3 ALA 58 -1.571 11.745 15.555 162 H ALA 59 HN ALA 59 -5.461 10.705 15.965 163 HA ALA 59 HA ALA 59 -6.935 13.013 16.921 164 HB1 ALA 59 HB1 ALA 59 -8.767 12.135 15.568 165 HB2 ALA 59 HB2 ALA 59 -7.826 10.681 15.229 166 HB3 ALA 59 HB3 ALA 59 -7.287 12.244 14.616 167 H ALA 60 HN ALA 60 -6.317 9.756 17.766 168 HA ALA 60 HA ALA 60 -8.674 9.515 19.426 169 HB1 ALA 60 HB1 ALA 60 -6.311 7.660 19.134 170 HB2 ALA 60 HB2 ALA 60 -7.806 7.552 18.210 171 HB3 ALA 60 HB3 ALA 60 -7.828 7.290 19.953 172 H LEU 61 HN LEU 61 -5.260 10.226 19.741 173 HA LEU 61 HA LEU 61 -5.162 10.219 22.564 174 HB2 LEU 61 HB2 LEU 61 -3.284 10.233 20.759 175 HB3 LEU 61 HB1 LEU 61 -3.552 11.950 20.671 176 HG LEU 61 HG LEU 61 -1.575 11.247 22.000 177 HD11 LEU 61 HD11 LEU 61 -2.542 13.431 22.394 178 HD12 LEU 61 HD12 LEU 61 -1.967 12.737 23.911 179 HD13 LEU 61 HD13 LEU 61 -3.690 12.735 23.530 180 HD21 LEU 61 HD21 LEU 61 -2.517 9.242 23.012 181 HD22 LEU 61 HD22 LEU 61 -3.615 10.262 23.961 182 HD23 LEU 61 HD23 LEU 61 -1.878 10.354 24.228 183 H ASP 62 HN ASP 62 -6.163 12.408 20.112 184 HA ASP 62 HA ASP 62 -6.679 14.687 21.747 185 HB2 ASP 62 HB2 ASP 62 -6.300 14.828 19.325 186 HB3 ASP 62 HB1 ASP 62 -7.750 13.888 19.027 187 H MET 63 HN MET 63 -8.291 11.727 21.121 188 HA MET 63 HA MET 63 -10.874 12.601 22.022 189 HB2 MET 63 HB2 MET 63 -10.764 10.742 20.431 190 HB3 MET 63 HB1 MET 63 -9.783 9.812 21.551 191 HG2 MET 63 HG2 MET 63 -11.665 9.692 23.107 192 HG3 MET 63 HG1 MET 63 -12.644 10.636 21.990 193 HE1 MET 63 HE1 MET 63 -14.511 8.703 22.134 194 HE2 MET 63 HE2 MET 63 -13.476 7.764 23.211 195 HE3 MET 63 HE3 MET 63 -14.181 7.007 21.784 196 H TYR 64 HN TYR 64 -8.053 10.982 23.406 197 HA TYR 64 HA TYR 64 -9.066 10.563 26.064 198 HB2 TYR 64 HB2 TYR 64 -6.799 9.786 25.109 199 HB3 TYR 64 HB1 TYR 64 -6.246 11.432 25.387 200 HD1 TYR 64 HD2 TYR 64 -7.094 12.231 28.012 201 HD2 TYR 64 HD1 TYR 64 -6.054 8.296 26.732 202 HE1 TYR 64 HE2 TYR 64 -6.563 11.644 30.236 203 HE2 TYR 64 HE1 TYR 64 -5.548 7.723 28.952 204 HH TYR 64 HH TYR 64 -5.016 8.696 30.842 205 H LYS 65 HN LYS 65 -7.541 13.230 24.398 206 HA LYS 65 HA LYS 65 -7.401 15.143 26.353 207 HB2 LYS 65 HB2 LYS 65 -6.417 15.571 24.279 208 HB3 LYS 65 HB1 LYS 65 -7.909 15.268 23.416 209 HG2 LYS 65 HG2 LYS 65 -8.822 17.342 24.332 210 HG3 LYS 65 HG1 LYS 65 -7.254 17.677 25.094 211 HD2 LYS 65 HD2 LYS 65 -6.175 17.691 22.964 212 HD3 LYS 65 HD1 LYS 65 -7.635 17.147 22.163 213 HE2 LYS 65 HE2 LYS 65 -8.746 19.256 22.803 214 HE3 LYS 65 HE1 LYS 65 -7.238 19.797 23.534 215 HZ1 LYS 65 HZ1 LYS 65 -7.516 19.015 20.701 216 HZ2 LYS 65 HZ2 LYS 65 -6.174 19.788 21.413 217 HZ3 LYS 65 HZ3 LYS 65 -7.621 20.604 21.225 218 H LEU 66 HN LEU 66 -10.132 14.108 24.435 219 HA LEU 66 HA LEU 66 -11.938 15.998 25.630 220 HB2 LEU 66 HB2 LEU 66 -12.458 13.557 23.960 221 HB3 LEU 66 HB1 LEU 66 -13.691 14.691 24.459 222 HG LEU 66 HG LEU 66 -11.366 15.312 22.638 223 HD11 LEU 66 HD11 LEU 66 -14.298 14.974 22.076 224 HD12 LEU 66 HD12 LEU 66 -13.008 13.869 21.598 225 HD13 LEU 66 HD13 LEU 66 -13.077 15.496 20.918 226 HD21 LEU 66 HD21 LEU 66 -12.537 17.431 22.260 227 HD22 LEU 66 HD22 LEU 66 -12.016 17.249 23.935 228 HD23 LEU 66 HD23 LEU 66 -13.709 16.997 23.502 229 H ASP 67 HN ASP 67 -11.046 12.594 26.195 230 HA ASP 67 HA ASP 67 -13.275 11.872 27.808 231 HB2 ASP 67 HB2 ASP 67 -11.922 10.219 26.671 232 HB3 ASP 67 HB1 ASP 67 -10.498 10.730 27.559 233 H ASN 68 HN ASN 68 -10.232 13.397 28.496 234 HA ASN 68 HA ASN 68 -10.958 13.680 31.402 235 HB2 ASN 68 HB2 ASN 68 -8.291 13.077 30.191 236 HB3 ASN 68 HB1 ASN 68 -8.557 13.969 31.701 237 HD21 ASN 68 HD21 ASN 68 -9.253 10.829 30.153 238 HD22 ASN 68 HD22 ASN 68 -9.324 9.948 31.599 239 H PHE 69 HN PHE 69 -11.272 15.253 28.941 240 HA PHE 69 HA PHE 69 -10.964 17.404 28.200 241 HB2 PHE 69 HB2 PHE 69 -11.543 19.063 30.062 242 HB3 PHE 69 HB1 PHE 69 -12.711 17.803 29.706 243 HD1 PHE 69 HD2 PHE 69 -10.120 18.820 32.008 244 HD2 PHE 69 HD1 PHE 69 -13.277 16.243 31.307 245 HE1 PHE 69 HE2 PHE 69 -10.120 18.273 34.399 246 HE2 PHE 69 HE1 PHE 69 -13.374 15.601 33.653 247 HZ PHE 69 HZ PHE 69 -11.769 16.625 35.260 248 H ALA 70 HN ALA 70 -8.511 16.211 28.600 249 HA ALA 70 HA ALA 70 -6.682 18.324 28.742 250 HB1 ALA 70 HB1 ALA 70 -7.213 18.290 31.108 251 HB2 ALA 70 HB2 ALA 70 -5.595 17.592 30.880 252 HB3 ALA 70 HB3 ALA 70 -7.004 16.551 31.149 253 H TYR 71 HN TYR 71 -4.576 17.450 28.268 254 HA TYR 71 HA TYR 71 -4.608 14.821 27.190 255 HB2 TYR 71 HB2 TYR 71 -2.510 16.955 27.386 256 HB3 TYR 71 HB1 TYR 71 -2.091 15.320 26.891 257 HD1 TYR 71 HD1 TYR 71 -3.983 14.403 25.123 258 HD2 TYR 71 HD2 TYR 71 -2.698 18.413 25.625 259 HE1 TYR 71 HE1 TYR 71 -4.621 14.841 22.867 260 HE2 TYR 71 HE2 TYR 71 -3.333 18.903 23.321 261 HH TYR 71 HH TYR 71 -5.216 16.737 21.405 262 HA PRO 72 HA PRO 72 -3.052 12.544 30.677 263 HB2 PRO 72 HB2 PRO 72 -1.590 10.670 29.229 264 HB3 PRO 72 HB1 PRO 72 -3.350 10.599 29.417 265 HG2 PRO 72 HG2 PRO 72 -1.682 11.623 27.170 266 HG3 PRO 72 HG1 PRO 72 -3.151 10.632 27.117 267 HD2 PRO 72 HD2 PRO 72 -3.185 13.258 26.634 268 HD3 PRO 72 HD1 PRO 72 -4.533 12.436 27.457 269 H SER 73 HN SER 73 -0.841 12.180 31.788 270 HA SER 73 HA SER 73 1.092 14.056 30.669 271 HB2 SER 73 HB2 SER 73 2.183 13.787 32.924 272 HB3 SER 73 HB1 SER 73 0.535 14.395 33.008 273 HG SER 73 HG SER 73 0.036 12.802 34.094 274 H THR 74 HN THR 74 3.435 13.270 30.526 275 HA THR 74 HA THR 74 3.359 10.724 29.284 276 HB THR 74 HB THR 74 4.984 12.688 28.767 277 HG1 THR 74 HG1 THR 74 6.201 11.307 27.718 278 HG21 THR 74 HG21 THR 74 5.978 12.959 30.968 279 HG22 THR 74 HG22 THR 74 7.232 12.404 29.853 280 HG23 THR 74 HG23 THR 74 6.481 11.276 30.986 281 H GLN 75 HN GLN 75 3.620 11.554 32.529 282 HA GLN 75 HA GLN 75 4.728 8.934 33.144 283 HB2 GLN 75 HB2 GLN 75 4.243 11.340 34.892 284 HB3 GLN 75 HB1 GLN 75 4.897 9.804 35.475 285 HG2 GLN 75 HG2 GLN 75 6.829 10.062 34.075 286 HG3 GLN 75 HG1 GLN 75 6.163 11.516 33.342 287 HE21 GLN 75 HE21 GLN 75 5.981 10.778 36.778 288 HE22 GLN 75 HE22 GLN 75 7.070 12.029 37.252 289 H GLN 76 HN GLN 76 1.943 10.957 34.438 290 HA GLN 76 HA GLN 76 0.615 8.561 35.464 291 HB2 GLN 76 HB2 GLN 76 -0.436 11.396 35.204 292 HB3 GLN 76 HB1 GLN 76 -1.197 10.082 36.068 293 HG2 GLN 76 HG2 GLN 76 -0.279 11.504 37.707 294 HG3 GLN 76 HG1 GLN 76 0.806 10.124 37.624 295 HE21 GLN 76 HE21 GLN 76 0.425 13.524 36.917 296 HE22 GLN 76 HE22 GLN 76 2.106 13.832 36.697 297 H GLY 77 HN GLY 77 0.316 10.717 32.783 298 HA2 GLY 77 HA2 GLY 77 -2.101 9.530 31.918 299 HA3 GLY 77 HA1 GLY 77 -1.048 10.587 31.000 300 H LEU 78 HN LEU 78 1.279 8.660 31.469 301 HA LEU 78 HA LEU 78 0.846 7.066 29.140 302 HB2 LEU 78 HB2 LEU 78 3.110 7.902 30.061 303 HB3 LEU 78 HB1 LEU 78 3.002 6.599 31.213 304 HG LEU 78 HG LEU 78 3.119 6.181 28.215 305 HD11 LEU 78 HD11 LEU 78 5.316 6.060 30.256 306 HD12 LEU 78 HD12 LEU 78 5.133 7.231 28.946 307 HD13 LEU 78 HD13 LEU 78 5.440 5.536 28.574 308 HD21 LEU 78 HD21 LEU 78 2.142 4.289 29.433 309 HD22 LEU 78 HD22 LEU 78 3.535 4.259 30.511 310 HD23 LEU 78 HD23 LEU 78 3.738 3.875 28.798 311 H GLU 79 HN GLU 79 1.067 6.341 32.600 312 HA GLU 79 HA GLU 79 0.258 3.667 32.476 313 HB2 GLU 79 HB2 GLU 79 0.002 5.755 34.596 314 HB3 GLU 79 HB1 GLU 79 -0.789 4.201 34.792 315 HG2 GLU 79 HG2 GLU 79 1.324 3.103 34.524 316 HG3 GLU 79 HG1 GLU 79 2.153 4.669 34.404 317 H ALA 80 HN ALA 80 -1.486 6.611 32.330 318 HA ALA 80 HA ALA 80 -4.060 5.380 32.550 319 HB1 ALA 80 HB1 ALA 80 -4.914 7.573 32.364 320 HB2 ALA 80 HB2 ALA 80 -3.387 8.129 31.693 321 HB3 ALA 80 HB3 ALA 80 -3.451 7.657 33.393 322 H LEU 81 HN LEU 81 -1.887 5.709 30.032 323 HA LEU 81 HA LEU 81 -3.912 5.689 27.939 324 HB2 LEU 81 HB2 LEU 81 -0.917 5.630 27.955 325 HB3 LEU 81 HB1 LEU 81 -1.792 5.273 26.496 326 HG LEU 81 HG LEU 81 -1.881 7.889 28.016 327 HD11 LEU 81 HD11 LEU 81 -0.646 8.782 26.104 328 HD12 LEU 81 HD12 LEU 81 -0.584 7.176 25.386 329 HD13 LEU 81 HD13 LEU 81 0.264 7.495 26.897 330 HD21 LEU 81 HD21 LEU 81 -3.092 8.722 26.044 331 HD22 LEU 81 HD22 LEU 81 -3.986 7.464 26.885 332 HD23 LEU 81 HD23 LEU 81 -3.133 7.087 25.387 333 H VAL 82 HN VAL 82 -1.989 3.594 29.785 334 HA VAL 82 HA VAL 82 -2.621 1.321 28.037 335 HB VAL 82 HB VAL 82 -0.810 1.345 30.455 336 HG11 VAL 82 HG11 VAL 82 -1.006 -0.565 28.139 337 HG12 VAL 82 HG12 VAL 82 -1.572 -0.862 29.781 338 HG13 VAL 82 HG13 VAL 82 0.155 -0.671 29.464 339 HG21 VAL 82 HG21 VAL 82 -0.102 1.768 27.557 340 HG22 VAL 82 HG22 VAL 82 1.064 1.545 28.861 341 HG23 VAL 82 HG23 VAL 82 0.009 2.959 28.845 342 H LYS 83 HN LYS 83 -3.123 2.570 31.268 343 HA LYS 83 HA LYS 83 -5.082 0.483 31.842 344 HB2 LYS 83 HB2 LYS 83 -3.068 1.776 33.732 345 HB3 LYS 83 HB1 LYS 83 -4.332 0.648 34.235 346 HG2 LYS 83 HG2 LYS 83 -3.282 -1.092 32.869 347 HG3 LYS 83 HG1 LYS 83 -2.053 0.060 32.355 348 HD2 LYS 83 HD2 LYS 83 -1.384 0.314 34.728 349 HD3 LYS 83 HD1 LYS 83 -2.532 -0.959 35.152 350 HE2 LYS 83 HE2 LYS 83 -1.351 -2.502 33.637 351 HE3 LYS 83 HE1 LYS 83 -0.186 -1.234 33.273 352 HZ1 LYS 83 HZ1 LYS 83 0.438 -1.248 35.658 353 HZ2 LYS 83 HZ2 LYS 83 0.692 -2.714 34.912 354 HZ3 LYS 83 HZ3 LYS 83 -0.637 -2.524 35.905 355 H LYS 84 HN LYS 84 -6.855 1.353 33.156 356 HA LYS 84 HA LYS 84 -7.790 3.740 32.042 357 HB2 LYS 84 HB2 LYS 84 -8.787 2.294 34.503 358 HB3 LYS 84 HB1 LYS 84 -9.659 3.588 33.682 359 HG2 LYS 84 HG2 LYS 84 -9.633 2.217 31.638 360 HG3 LYS 84 HG1 LYS 84 -8.908 0.915 32.575 361 HD2 LYS 84 HD2 LYS 84 -10.851 0.901 34.049 362 HD3 LYS 84 HD1 LYS 84 -11.564 2.216 33.112 363 HE2 LYS 84 HE2 LYS 84 -11.475 0.805 31.111 364 HE3 LYS 84 HE1 LYS 84 -10.858 -0.517 32.106 365 HZ1 LYS 84 HZ1 LYS 84 -12.921 -0.468 33.369 366 HZ2 LYS 84 HZ2 LYS 84 -13.233 -0.710 31.724 367 HZ3 LYS 84 HZ3 LYS 84 -13.497 0.799 32.412 368 HA PRO 85 HA PRO 85 -5.918 7.096 33.952 369 HB2 PRO 85 HB2 PRO 85 -7.929 8.939 33.879 370 HB3 PRO 85 HB1 PRO 85 -6.957 8.476 32.480 371 HG2 PRO 85 HG2 PRO 85 -9.666 7.531 33.297 372 HG3 PRO 85 HG1 PRO 85 -9.067 7.965 31.685 373 HD2 PRO 85 HD2 PRO 85 -9.311 5.416 32.452 374 HD3 PRO 85 HD1 PRO 85 -7.970 5.950 31.417 375 H THR 86 HN THR 86 -5.709 8.321 35.696 376 HA THR 86 HA THR 86 -7.376 7.608 37.952 377 HB THR 86 HB THR 86 -5.202 8.377 39.164 378 HG1 THR 86 HG1 THR 86 -3.790 9.016 37.763 379 HG21 THR 86 HG21 THR 86 -4.324 6.093 39.031 380 HG22 THR 86 HG22 THR 86 -5.259 5.824 37.557 381 HG23 THR 86 HG23 THR 86 -6.093 6.079 39.089 382 H GLY 87 HN GLY 87 -8.734 9.196 38.382 383 HA2 GLY 87 HA2 GLY 87 -8.349 11.544 39.467 384 HA3 GLY 87 HA1 GLY 87 -7.986 11.942 37.789 385 H ASN 88 HN ASN 88 -9.629 12.837 36.752 386 HA ASN 88 HA ASN 88 -12.306 11.793 37.282 387 HB2 ASN 88 HB2 ASN 88 -11.598 14.738 37.249 388 HB3 ASN 88 HB1 ASN 88 -13.231 14.104 37.227 389 HD21 ASN 88 HD21 ASN 88 -10.438 14.755 39.141 390 HD22 ASN 88 HD22 ASN 88 -11.151 14.410 40.674 391 HA PRO 89 HA PRO 89 -12.088 12.540 32.850 392 HB2 PRO 89 HB2 PRO 89 -12.717 9.953 32.105 393 HB3 PRO 89 HB1 PRO 89 -11.082 10.575 32.257 394 HG2 PRO 89 HG2 PRO 89 -12.354 8.590 33.911 395 HG3 PRO 89 HG1 PRO 89 -10.718 9.244 34.058 396 HD2 PRO 89 HD2 PRO 89 -13.169 9.960 35.550 397 HD3 PRO 89 HD1 PRO 89 -11.465 10.146 36.015 398 H GLN 90 HN GLN 90 -13.845 12.395 31.327 399 HA GLN 90 HA GLN 90 -16.482 12.517 32.607 400 HB2 GLN 90 HB2 GLN 90 -15.623 13.072 29.751 401 HB3 GLN 90 HB1 GLN 90 -17.228 13.361 30.394 402 HG2 GLN 90 HG2 GLN 90 -16.272 15.038 31.926 403 HG3 GLN 90 HG1 GLN 90 -14.694 14.764 31.192 404 HE21 GLN 90 HE21 GLN 90 -15.882 14.423 28.518 405 HE22 GLN 90 HE22 GLN 90 -16.293 16.003 27.977 406 HA PRO 91 HA PRO 91 -17.523 8.482 30.980 407 HB2 PRO 91 HB2 PRO 91 -20.094 8.879 30.014 408 HB3 PRO 91 HB1 PRO 91 -19.711 8.539 31.705 409 HG2 PRO 91 HG2 PRO 91 -20.320 11.136 30.382 410 HG3 PRO 91 HG1 PRO 91 -20.748 10.575 32.006 411 HD2 PRO 91 HD2 PRO 91 -18.734 12.333 31.547 412 HD3 PRO 91 HD1 PRO 91 -18.703 11.179 32.890 413 H LYS 92 HN LYS 92 -16.137 8.312 29.269 414 HA LYS 92 HA LYS 92 -17.231 8.632 26.657 415 HB2 LYS 92 HB2 LYS 92 -15.942 10.796 27.349 416 HB3 LYS 92 HB1 LYS 92 -14.498 9.798 27.234 417 HG2 LYS 92 HG2 LYS 92 -14.924 9.362 24.905 418 HG3 LYS 92 HG1 LYS 92 -16.465 10.210 24.997 419 HD2 LYS 92 HD2 LYS 92 -15.174 12.271 25.620 420 HD3 LYS 92 HD1 LYS 92 -13.701 11.374 25.250 421 HE2 LYS 92 HE2 LYS 92 -14.314 12.673 23.312 422 HE3 LYS 92 HE1 LYS 92 -14.579 10.968 22.964 423 HZ1 LYS 92 HZ1 LYS 92 -16.971 11.301 23.368 424 HZ2 LYS 92 HZ2 LYS 92 -16.413 12.334 22.172 425 HZ3 LYS 92 HZ3 LYS 92 -16.689 12.927 23.712 426 H ASN 93 HN ASN 93 -16.091 7.239 25.200 427 HA ASN 93 HA ASN 93 -15.238 4.871 26.496 428 HB2 ASN 93 HB2 ASN 93 -15.223 5.595 23.567 429 HB3 ASN 93 HB1 ASN 93 -14.682 4.034 24.167 430 HD21 ASN 93 HD21 ASN 93 -17.385 6.053 23.504 431 HD22 ASN 93 HD22 ASN 93 -18.620 4.896 23.820 432 H TRP 94 HN TRP 94 -13.418 5.177 27.730 433 HA TRP 94 HA TRP 94 -10.970 6.026 26.712 434 HB2 TRP 94 HB2 TRP 94 -11.450 5.984 29.100 435 HB3 TRP 94 HB1 TRP 94 -11.685 4.240 29.053 436 HD1 TRP 94 HD1 TRP 94 -8.961 6.885 28.934 437 HE1 TRP 94 HE1 TRP 94 -6.653 5.726 29.359 438 HE3 TRP 94 HE3 TRP 94 -10.461 2.016 28.925 439 HZ2 TRP 94 HZ2 TRP 94 -5.672 3.146 29.640 440 HZ3 TRP 94 HZ3 TRP 94 -8.786 0.262 29.286 441 HH2 TRP 94 HH2 TRP 94 -6.439 0.820 29.636 442 H ASN 95 HN ASN 95 -9.273 4.824 25.900 443 HA ASN 95 HA ASN 95 -9.707 1.995 25.516 444 HB2 ASN 95 HB2 ASN 95 -10.275 2.963 23.354 445 HB3 ASN 95 HB1 ASN 95 -8.788 3.907 23.358 446 HD21 ASN 95 HD21 ASN 95 -9.115 0.460 24.262 447 HD22 ASN 95 HD22 ASN 95 -8.025 -0.058 23.023 448 H LYS 96 HN LYS 96 -7.856 0.800 25.890 449 HA LYS 96 HA LYS 96 -5.497 2.100 26.865 450 HB2 LYS 96 HB2 LYS 96 -4.659 -0.128 27.294 451 HB3 LYS 96 HB1 LYS 96 -6.357 -0.102 27.732 452 HG2 LYS 96 HG2 LYS 96 -6.873 -1.184 25.545 453 HG3 LYS 96 HG1 LYS 96 -5.130 -1.258 25.266 454 HD2 LYS 96 HD2 LYS 96 -4.828 -2.633 27.239 455 HD3 LYS 96 HD1 LYS 96 -6.551 -2.536 27.599 456 HE2 LYS 96 HE2 LYS 96 -6.102 -4.654 26.558 457 HE3 LYS 96 HE1 LYS 96 -7.017 -3.656 25.436 458 HZ1 LYS 96 HZ1 LYS 96 -5.224 -4.804 24.309 459 HZ2 LYS 96 HZ2 LYS 96 -4.085 -4.147 25.337 460 HZ3 LYS 96 HZ3 LYS 96 -4.916 -3.150 24.265 461 H ASP 97 HN ASP 97 -3.408 0.531 25.811 462 HA ASP 97 HA ASP 97 -1.954 0.368 24.241 463 HB2 ASP 97 HB2 ASP 97 -4.308 0.326 22.345 464 HB3 ASP 97 HB1 ASP 97 -2.611 0.004 21.969 465 H GLY 98 HN GLY 98 -3.438 2.979 24.858 466 HA2 GLY 98 HA2 GLY 98 -2.293 5.060 24.725 467 HA3 GLY 98 HA1 GLY 98 -1.562 4.530 23.222 468 H TYR 99 HN TYR 99 -4.880 3.920 23.690 469 HA TYR 99 HA TYR 99 -6.761 4.637 22.758 470 HB2 TYR 99 HB2 TYR 99 -5.406 7.122 23.314 471 HB3 TYR 99 HB1 TYR 99 -6.358 7.273 21.826 472 HD1 TYR 99 HD1 TYR 99 -6.352 6.713 25.404 473 HD2 TYR 99 HD2 TYR 99 -8.706 7.237 21.928 474 HE1 TYR 99 HE1 TYR 99 -8.293 7.224 26.798 475 HE2 TYR 99 HE2 TYR 99 -10.652 7.744 23.298 476 HH TYR 99 HH TYR 99 -11.417 7.398 25.489 477 H LEU 100 HN LEU 100 -6.866 3.339 21.117 478 HA LEU 100 HA LEU 100 -5.849 4.303 18.552 479 HB2 LEU 100 HB2 LEU 100 -4.388 2.561 19.431 480 HB3 LEU 100 HB1 LEU 100 -5.756 1.515 19.710 481 HG LEU 100 HG LEU 100 -6.098 1.375 17.254 482 HD11 LEU 100 HD11 LEU 100 -3.511 2.898 17.132 483 HD12 LEU 100 HD12 LEU 100 -5.089 3.483 16.596 484 HD13 LEU 100 HD13 LEU 100 -4.316 2.133 15.766 485 HD21 LEU 100 HD21 LEU 100 -3.355 0.608 18.235 486 HD22 LEU 100 HD22 LEU 100 -4.176 -0.065 16.824 487 HD23 LEU 100 HD23 LEU 100 -4.835 -0.329 18.437 488 H LYS 101 HN LYS 101 -7.165 3.661 16.795 489 HA LYS 101 HA LYS 101 -9.948 3.249 17.475 490 HB2 LYS 101 HB2 LYS 101 -8.595 3.402 14.761 491 HB3 LYS 101 HB1 LYS 101 -10.329 3.434 15.033 492 HG2 LYS 101 HG2 LYS 101 -8.337 5.537 15.873 493 HG3 LYS 101 HG1 LYS 101 -9.522 5.671 14.577 494 HD2 LYS 101 HD2 LYS 101 -11.337 5.461 16.238 495 HD3 LYS 101 HD1 LYS 101 -10.133 5.356 17.520 496 HE2 LYS 101 HE2 LYS 101 -10.921 7.605 17.483 497 HE3 LYS 101 HE1 LYS 101 -9.301 7.600 16.801 498 HZ1 LYS 101 HZ1 LYS 101 -11.837 7.728 15.282 499 HZ2 LYS 101 HZ2 LYS 101 -10.342 7.649 14.559 500 HZ3 LYS 101 HZ3 LYS 101 -10.752 8.986 15.506 501 H LYS 102 HN LYS 102 -10.900 1.540 15.579 502 HA LYS 102 HA LYS 102 -9.831 -0.955 16.409 503 HB2 LYS 102 HB2 LYS 102 -11.576 -2.082 15.036 504 HB3 LYS 102 HB1 LYS 102 -12.281 -0.775 15.958 505 HG2 LYS 102 HG2 LYS 102 -11.574 -0.637 13.074 506 HG3 LYS 102 HG1 LYS 102 -13.162 -1.070 13.701 507 HD2 LYS 102 HD2 LYS 102 -13.191 1.173 14.844 508 HD3 LYS 102 HD1 LYS 102 -11.713 1.564 13.941 509 HE2 LYS 102 HE2 LYS 102 -12.895 1.043 11.878 510 HE3 LYS 102 HE1 LYS 102 -14.331 0.744 12.858 511 HZ1 LYS 102 HZ1 LYS 102 -12.956 3.383 12.553 512 HZ2 LYS 102 HZ2 LYS 102 -14.254 3.090 13.579 513 HZ3 LYS 102 HZ3 LYS 102 -14.464 2.956 11.928 514 H LEU 103 HN LEU 103 -7.756 -0.520 15.847 515 HA LEU 103 HA LEU 103 -6.952 -1.312 13.147 516 HB2 LEU 103 HB2 LEU 103 -5.763 0.829 14.911 517 HB3 LEU 103 HB1 LEU 103 -5.021 0.249 13.433 518 HG LEU 103 HG LEU 103 -7.671 1.695 13.603 519 HD11 LEU 103 HD11 LEU 103 -5.790 3.138 14.187 520 HD12 LEU 103 HD12 LEU 103 -6.471 3.570 12.621 521 HD13 LEU 103 HD13 LEU 103 -4.961 2.662 12.704 522 HD21 LEU 103 HD21 LEU 103 -7.539 0.179 11.697 523 HD22 LEU 103 HD22 LEU 103 -5.981 0.875 11.250 524 HD23 LEU 103 HD23 LEU 103 -7.442 1.860 11.167 525 HA PRO 104 HA PRO 104 -4.454 -4.081 15.652 526 HB2 PRO 104 HB2 PRO 104 -2.771 -5.005 13.803 527 HB3 PRO 104 HB1 PRO 104 -4.498 -5.384 13.711 528 HG2 PRO 104 HG2 PRO 104 -2.941 -3.316 12.202 529 HG3 PRO 104 HG1 PRO 104 -4.173 -4.443 11.604 530 HD2 PRO 104 HD2 PRO 104 -4.673 -1.820 12.248 531 HD3 PRO 104 HD1 PRO 104 -5.898 -3.104 12.287 532 H VAL 105 HN VAL 105 -1.824 -4.545 15.640 533 HA VAL 105 HA VAL 105 -0.616 -1.959 16.127 534 HB VAL 105 HB VAL 105 -0.349 -4.163 17.521 535 HG11 VAL 105 HG11 VAL 105 1.815 -4.689 15.491 536 HG12 VAL 105 HG12 VAL 105 0.390 -5.673 15.798 537 HG13 VAL 105 HG13 VAL 105 1.636 -5.510 17.030 538 HG21 VAL 105 HG21 VAL 105 0.764 -2.071 18.080 539 HG22 VAL 105 HG22 VAL 105 2.062 -2.455 16.956 540 HG23 VAL 105 HG23 VAL 105 1.750 -3.500 18.360 541 H ASP 106 HN ASP 106 1.937 -1.954 15.103 542 HA ASP 106 HA ASP 106 1.174 -2.245 12.309 543 HB2 ASP 106 HB2 ASP 106 2.062 0.031 13.372 544 HB3 ASP 106 HB1 ASP 106 3.639 -0.699 13.082 545 HA PRO 107 HA PRO 107 4.060 -5.431 10.996 546 HB2 PRO 107 HB2 PRO 107 4.817 -3.077 9.316 547 HB3 PRO 107 HB1 PRO 107 4.823 -4.795 8.903 548 HG2 PRO 107 HG2 PRO 107 2.770 -3.306 8.246 549 HG3 PRO 107 HG1 PRO 107 2.494 -4.926 8.914 550 HD2 PRO 107 HD2 PRO 107 2.052 -2.280 10.197 551 HD3 PRO 107 HD1 PRO 107 1.291 -3.849 10.529 552 H TRP 108 HN TRP 108 6.328 -5.599 10.479 553 HA TRP 108 HA TRP 108 8.400 -5.756 11.102 554 HB2 TRP 108 HB2 TRP 108 8.203 -3.065 12.505 555 HB3 TRP 108 HB1 TRP 108 9.690 -3.865 12.030 556 HD1 TRP 108 HD1 TRP 108 9.758 -4.155 9.168 557 HE1 TRP 108 HE1 TRP 108 9.296 -2.221 7.457 558 HE3 TRP 108 HE3 TRP 108 7.070 -1.080 12.168 559 HZ2 TRP 108 HZ2 TRP 108 7.932 0.270 7.450 560 HZ3 TRP 108 HZ3 TRP 108 6.212 1.053 11.271 561 HH2 TRP 108 HH2 TRP 108 6.612 1.703 9.004 562 H GLY 109 HN GLY 109 5.940 -6.075 12.736 563 HA2 GLY 109 HA2 GLY 109 5.074 -6.652 14.773 564 HA3 GLY 109 HA1 GLY 109 6.671 -7.355 15.076 565 H ASN 110 HN ASN 110 6.172 -3.871 14.644 566 HA ASN 110 HA ASN 110 7.068 -3.619 17.352 567 HB2 ASN 110 HB2 ASN 110 7.046 -1.620 15.103 568 HB3 ASN 110 HB1 ASN 110 7.284 -1.119 16.772 569 HD21 ASN 110 HD21 ASN 110 8.680 -2.497 14.030 570 HD22 ASN 110 HD22 ASN 110 10.271 -2.760 14.636 571 HA PRO 111 HA PRO 111 3.086 -2.257 18.816 572 HB2 PRO 111 HB2 PRO 111 4.608 -1.347 21.146 573 HB3 PRO 111 HB1 PRO 111 3.333 -2.563 21.069 574 HG2 PRO 111 HG2 PRO 111 5.903 -3.210 21.542 575 HG3 PRO 111 HG1 PRO 111 4.804 -4.274 20.642 576 HD2 PRO 111 HD2 PRO 111 6.935 -2.449 19.614 577 HD3 PRO 111 HD1 PRO 111 6.466 -4.087 19.095 578 H TYR 112 HN TYR 112 2.152 -0.232 18.957 579 HA TYR 112 HA TYR 112 3.766 1.902 18.031 580 HB2 TYR 112 HB2 TYR 112 0.901 1.701 18.899 581 HB3 TYR 112 HB1 TYR 112 1.643 3.291 18.785 582 HD1 TYR 112 HD2 TYR 112 2.296 4.204 16.651 583 HD2 TYR 112 HD1 TYR 112 0.437 0.380 16.866 584 HE1 TYR 112 HE2 TYR 112 1.862 4.292 14.239 585 HE2 TYR 112 HE1 TYR 112 -0.005 0.466 14.436 586 HH TYR 112 HH TYR 112 -0.154 2.028 12.583 587 H GLN 113 HN GLN 113 4.515 3.594 19.102 588 HA GLN 113 HA GLN 113 5.026 3.031 21.950 589 HB2 GLN 113 HB2 GLN 113 6.482 5.257 20.642 590 HB3 GLN 113 HB1 GLN 113 7.068 4.081 21.781 591 HG2 GLN 113 HG2 GLN 113 6.787 3.761 18.799 592 HG3 GLN 113 HG1 GLN 113 8.271 4.001 19.692 593 HE21 GLN 113 HE21 GLN 113 7.334 2.018 21.757 594 HE22 GLN 113 HE22 GLN 113 7.546 0.486 20.996 595 H TYR 114 HN TYR 114 3.823 4.134 23.229 596 HA TYR 114 HA TYR 114 2.736 6.689 22.378 597 HB2 TYR 114 HB2 TYR 114 1.223 6.206 24.487 598 HB3 TYR 114 HB1 TYR 114 0.874 5.489 22.924 599 HD1 TYR 114 HD2 TYR 114 3.101 4.558 25.848 600 HD2 TYR 114 HD1 TYR 114 0.113 3.341 23.086 601 HE1 TYR 114 HE2 TYR 114 3.102 2.301 26.833 602 HE2 TYR 114 HE1 TYR 114 0.087 1.108 24.064 603 HH TYR 114 HH TYR 114 1.739 0.368 26.999 604 H LEU 115 HN LEU 115 3.648 8.437 23.105 605 HA LEU 115 HA LEU 115 4.419 8.529 25.902 606 HB2 LEU 115 HB2 LEU 115 5.813 9.673 23.510 607 HB3 LEU 115 HB1 LEU 115 6.126 10.283 25.135 608 HG LEU 115 HG LEU 115 6.643 7.472 24.137 609 HD11 LEU 115 HD11 LEU 115 8.153 9.128 23.159 610 HD12 LEU 115 HD12 LEU 115 8.994 8.076 24.296 611 HD13 LEU 115 HD13 LEU 115 8.555 9.715 24.773 612 HD21 LEU 115 HD21 LEU 115 7.280 8.794 26.777 613 HD22 LEU 115 HD22 LEU 115 7.849 7.209 26.271 614 HD23 LEU 115 HD23 LEU 115 6.128 7.480 26.521 615 H ALA 116 HN ALA 116 3.869 10.498 26.936 616 HA ALA 116 HA ALA 116 1.945 11.980 25.400 617 HB1 ALA 116 HB1 ALA 116 0.577 12.064 27.307 618 HB2 ALA 116 HB2 ALA 116 1.897 11.657 28.383 619 HB3 ALA 116 HB3 ALA 116 1.205 10.411 27.321 620 HA PRO 117 HA PRO 117 4.119 15.659 26.141 621 HB2 PRO 117 HB2 PRO 117 2.979 17.380 27.828 622 HB3 PRO 117 HB1 PRO 117 2.429 17.051 26.210 623 HG2 PRO 117 HG2 PRO 117 1.335 15.900 28.753 624 HG3 PRO 117 HG1 PRO 117 0.449 16.513 27.345 625 HD2 PRO 117 HD2 PRO 117 0.943 13.853 27.750 626 HD3 PRO 117 HD1 PRO 117 0.809 14.542 26.113 627 H GLY 118 HN GLY 118 5.861 15.992 26.871 628 HA2 GLY 118 HA2 GLY 118 6.412 15.526 29.724 629 HA3 GLY 118 HA1 GLY 118 7.512 15.196 28.364 630 H THR 119 HN THR 119 8.562 16.723 27.378 631 HA THR 119 HA THR 119 8.685 19.270 28.801 632 HB THR 119 HB THR 119 10.679 18.087 26.886 633 HG1 THR 119 HG1 THR 119 10.042 17.317 29.393 634 HG21 THR 119 HG21 THR 119 12.251 19.620 28.012 635 HG22 THR 119 HG22 THR 119 10.945 20.185 29.054 636 HG23 THR 119 HG23 THR 119 10.888 20.501 27.320 637 H LYS 120 HN LYS 120 7.348 20.543 27.805 638 HA LYS 120 HA LYS 120 6.351 21.961 26.408 639 HB2 LYS 120 HB2 LYS 120 7.486 22.963 24.566 640 HB3 LYS 120 HB1 LYS 120 8.652 22.673 25.847 641 HG2 LYS 120 HG2 LYS 120 9.581 20.814 24.681 642 HG3 LYS 120 HG1 LYS 120 8.307 20.858 23.470 643 HD2 LYS 120 HD2 LYS 120 10.355 23.009 23.937 644 HD3 LYS 120 HD1 LYS 120 10.429 21.756 22.686 645 HE2 LYS 120 HE2 LYS 120 8.322 22.602 21.729 646 HE3 LYS 120 HE1 LYS 120 8.276 23.853 22.967 647 HZ1 LYS 120 HZ1 LYS 120 10.367 23.583 20.877 648 HZ2 LYS 120 HZ2 LYS 120 10.321 24.771 22.062 649 HZ3 LYS 120 HZ3 LYS 120 9.112 24.711 20.897 650 H GLY 121 HN GLY 121 6.779 18.816 25.277 651 HA2 GLY 121 HA2 GLY 121 5.140 19.347 22.902 652 HA3 GLY 121 HA1 GLY 121 6.087 17.885 23.231 653 HA PRO 122 HA PRO 122 1.361 18.221 25.016 654 HB2 PRO 122 HB2 PRO 122 0.809 18.059 22.091 655 HB3 PRO 122 HB1 PRO 122 -0.217 18.675 23.399 656 HG2 PRO 122 HG2 PRO 122 1.113 20.397 21.952 657 HG3 PRO 122 HG1 PRO 122 1.136 20.568 23.719 658 HD2 PRO 122 HD2 PRO 122 3.234 19.492 21.896 659 HD3 PRO 122 HD1 PRO 122 3.417 20.511 23.345 660 H PHE 123 HN PHE 123 3.005 16.255 22.564 661 HA PHE 123 HA PHE 123 2.757 13.950 23.993 662 HB2 PHE 123 HB2 PHE 123 1.193 12.513 22.698 663 HB3 PHE 123 HB1 PHE 123 0.364 13.813 23.520 664 HD1 PHE 123 HD2 PHE 123 -0.738 15.597 22.234 665 HD2 PHE 123 HD1 PHE 123 1.278 12.376 20.291 666 HE1 PHE 123 HE2 PHE 123 -1.882 16.147 20.140 667 HE2 PHE 123 HE1 PHE 123 0.111 12.923 18.192 668 HZ PHE 123 HZ PHE 123 -1.469 14.809 18.120 669 H ASP 124 HN ASP 124 3.386 11.965 22.754 670 HA ASP 124 HA ASP 124 4.820 12.574 20.279 671 HB2 ASP 124 HB2 ASP 124 6.024 11.389 22.774 672 HB3 ASP 124 HB1 ASP 124 6.733 11.086 21.190 673 H LEU 125 HN LEU 125 3.841 11.175 18.865 674 HA LEU 125 HA LEU 125 3.425 8.457 19.848 675 HB2 LEU 125 HB2 LEU 125 1.329 9.785 19.627 676 HB3 LEU 125 HB1 LEU 125 1.675 10.005 17.933 677 HG LEU 125 HG LEU 125 -0.085 8.343 18.490 678 HD11 LEU 125 HD11 LEU 125 0.942 8.254 16.305 679 HD12 LEU 125 HD12 LEU 125 0.641 6.613 16.889 680 HD13 LEU 125 HD13 LEU 125 2.272 7.286 16.942 681 HD21 LEU 125 HD21 LEU 125 2.234 6.723 19.530 682 HD22 LEU 125 HD22 LEU 125 0.618 6.092 19.241 683 HD23 LEU 125 HD23 LEU 125 0.869 7.338 20.465 684 H TYR 126 HN TYR 126 4.295 6.847 18.616 685 HA TYR 126 HA TYR 126 4.761 7.060 15.845 686 HB2 TYR 126 HB2 TYR 126 7.234 7.070 15.833 687 HB3 TYR 126 HB1 TYR 126 6.590 8.558 16.490 688 HD1 TYR 126 HD2 TYR 126 6.638 8.848 19.052 689 HD2 TYR 126 HD1 TYR 126 8.784 5.795 17.017 690 HE1 TYR 126 HE2 TYR 126 8.126 8.604 20.994 691 HE2 TYR 126 HE1 TYR 126 10.277 5.548 18.930 692 HH TYR 126 HH TYR 126 11.034 6.820 20.795 693 H SER 127 HN SER 127 5.803 5.112 14.985 694 HA SER 127 HA SER 127 6.066 2.924 16.939 695 HB2 SER 127 HB2 SER 127 3.992 2.670 15.512 696 HB3 SER 127 HB1 SER 127 5.032 2.665 14.092 697 HG SER 127 HG SER 127 5.232 0.623 14.414 698 H LEU 128 HN LEU 128 7.965 1.784 16.736 699 HA LEU 128 HA LEU 128 10.062 2.896 15.196 700 HB2 LEU 128 HB2 LEU 128 9.784 0.472 16.878 701 HB3 LEU 128 HB1 LEU 128 11.096 0.476 15.727 702 HG LEU 128 HG LEU 128 12.085 2.444 16.774 703 HD11 LEU 128 HD11 LEU 128 9.765 2.388 18.684 704 HD12 LEU 128 HD12 LEU 128 10.069 3.614 17.450 705 HD13 LEU 128 HD13 LEU 128 11.187 3.425 18.802 706 HD21 LEU 128 HD21 LEU 128 12.643 1.508 18.954 707 HD22 LEU 128 HD22 LEU 128 12.673 0.285 17.686 708 HD23 LEU 128 HD23 LEU 128 11.310 0.363 18.805 709 H GLY 129 HN GLY 129 10.899 2.491 13.234 710 HA2 GLY 129 HA2 GLY 129 9.292 0.905 11.407 711 HA3 GLY 129 HA1 GLY 129 10.598 1.979 10.971 712 H ALA 130 HN ALA 130 11.264 0.417 9.553 713 HA ALA 130 HA ALA 130 11.792 -2.247 10.181 714 HB1 ALA 130 HB1 ALA 130 12.949 -0.664 7.912 715 HB2 ALA 130 HB2 ALA 130 11.336 -1.360 7.942 716 HB3 ALA 130 HB3 ALA 130 12.753 -2.416 8.004 717 H ASP 131 HN ASP 131 13.733 0.469 10.990 718 HA ASP 131 HA ASP 131 16.147 -1.200 11.063 719 HB2 ASP 131 HB2 ASP 131 16.393 1.097 10.247 720 HB3 ASP 131 HB1 ASP 131 15.795 1.734 11.779 721 H GLY 132 HN GLY 132 13.545 -0.475 12.997 722 HA2 GLY 132 HA2 GLY 132 13.035 -1.041 15.166 723 HA3 GLY 132 HA1 GLY 132 14.571 -1.897 15.227 724 H LYS 133 HN LYS 133 14.752 1.358 14.354 725 HA LYS 133 HA LYS 133 15.298 2.256 17.071 726 HB2 LYS 133 HB2 LYS 133 17.431 1.526 16.188 727 HB3 LYS 133 HB1 LYS 133 17.166 2.416 14.702 728 HG2 LYS 133 HG2 LYS 133 18.767 3.564 16.069 729 HG3 LYS 133 HG1 LYS 133 17.290 4.518 15.979 730 HD2 LYS 133 HD2 LYS 133 16.640 3.793 18.191 731 HD3 LYS 133 HD1 LYS 133 18.022 2.695 18.270 732 HE2 LYS 133 HE2 LYS 133 18.173 5.701 18.040 733 HE3 LYS 133 HE1 LYS 133 18.431 4.776 19.517 734 HZ1 LYS 133 HZ1 LYS 133 20.086 4.559 17.048 735 HZ2 LYS 133 HZ2 LYS 133 20.312 3.692 18.468 736 HZ3 LYS 133 HZ3 LYS 133 20.518 5.368 18.468 737 H GLU 134 HN GLU 134 14.636 4.357 17.356 738 HA GLU 134 HA GLU 134 13.228 5.539 15.200 739 HB2 GLU 134 HB2 GLU 134 12.693 7.354 16.786 740 HB3 GLU 134 HB1 GLU 134 12.313 5.767 17.417 741 HG2 GLU 134 HG2 GLU 134 14.294 5.836 18.816 742 HG3 GLU 134 HG1 GLU 134 14.727 7.406 18.135 743 H GLY 135 HN GLY 135 14.098 6.644 13.676 744 HA2 GLY 135 HA2 GLY 135 16.319 8.445 14.081 745 HA3 GLY 135 HA1 GLY 135 16.635 7.065 13.023 746 H GLY 136 HN GLY 136 16.886 9.083 11.487 747 HA2 GLY 136 HA2 GLY 136 14.188 9.701 10.484 748 HA3 GLY 136 HA1 GLY 136 15.604 10.717 10.202 749 H SER 137 HN SER 137 13.604 8.890 8.640 750 HA SER 137 HA SER 137 14.967 8.269 6.365 751 HB2 SER 137 HB2 SER 137 14.821 6.004 8.378 752 HB3 SER 137 HB1 SER 137 14.873 5.669 6.637 753 HG SER 137 HG SER 137 16.725 7.387 7.740 754 H ASP 138 HN ASP 138 13.422 6.412 5.203 755 HA ASP 138 HA ASP 138 10.731 7.424 5.755 756 HB2 ASP 138 HB2 ASP 138 11.660 7.559 3.433 757 HB3 ASP 138 HB1 ASP 138 11.647 5.799 3.401 758 H ASN 139 HN ASN 139 12.135 4.190 5.132 759 HA ASN 139 HA ASN 139 9.784 3.171 6.599 760 HB2 ASN 139 HB2 ASN 139 9.876 1.133 5.403 761 HB3 ASN 139 HB1 ASN 139 10.240 2.348 4.191 762 HD21 ASN 139 HD21 ASN 139 11.315 -0.386 5.880 763 HD22 ASN 139 HD22 ASN 139 12.850 -0.553 5.084 764 H ASP 140 HN ASP 140 13.178 3.371 6.683 765 HA ASP 140 HA ASP 140 13.612 1.254 8.617 766 HB2 ASP 140 HB2 ASP 140 15.352 3.553 7.717 767 HB3 ASP 140 HB1 ASP 140 15.865 2.442 8.965 768 H ALA 141 HN ALA 141 12.781 4.460 8.589 769 HA ALA 141 HA ALA 141 13.468 5.088 11.305 770 HB1 ALA 141 HB1 ALA 141 12.403 7.205 10.867 771 HB2 ALA 141 HB2 ALA 141 11.944 6.640 9.258 772 HB3 ALA 141 HB3 ALA 141 13.644 6.831 9.687 773 H ASP 142 HN ASP 142 11.937 5.889 12.744 774 HA ASP 142 HA ASP 142 9.673 4.186 12.975 775 HB2 ASP 142 HB2 ASP 142 9.356 5.415 15.074 776 HB3 ASP 142 HB1 ASP 142 11.022 4.865 14.935 777 H ILE 143 HN ILE 143 7.665 4.782 12.549 778 HA ILE 143 HA ILE 143 7.321 7.342 11.263 779 HB ILE 143 HB ILE 143 5.103 6.301 10.413 780 HG12 ILE 143 HG12 ILE 143 5.310 3.779 10.027 781 HG13 ILE 143 HG11 ILE 143 6.558 3.774 11.256 782 HG21 ILE 143 HG21 ILE 143 7.748 5.305 9.415 783 HG22 ILE 143 HG22 ILE 143 6.932 6.807 8.957 784 HG23 ILE 143 HG23 ILE 143 6.231 5.241 8.525 785 HD11 ILE 143 HD11 ILE 143 3.699 4.599 11.672 786 HD12 ILE 143 HD12 ILE 143 4.947 4.485 12.912 787 HD13 ILE 143 HD13 ILE 143 4.384 3.027 12.081 788 H GLY 144 HN GLY 144 6.097 8.901 12.081 789 HA2 GLY 144 HA2 GLY 144 4.014 8.361 13.907 790 HA3 GLY 144 HA1 GLY 144 5.488 8.840 14.733 791 H ASN 145 HN ASN 145 3.744 10.447 15.289 792 HA ASN 145 HA ASN 145 4.338 12.871 14.028 793 HB2 ASN 145 HB2 ASN 145 2.184 13.508 13.134 794 HB3 ASN 145 HB1 ASN 145 2.606 11.971 12.410 795 HD21 ASN 145 HD21 ASN 145 1.763 10.412 14.796 796 HD22 ASN 145 HD22 ASN 145 0.032 10.456 14.766 797 H TRP 146 HN TRP 146 3.407 14.584 15.242 798 HA TRP 146 HA TRP 146 1.856 14.041 17.534 799 HB2 TRP 146 HB2 TRP 146 3.630 14.686 19.207 800 HB3 TRP 146 HB1 TRP 146 3.771 13.083 18.501 801 HD1 TRP 146 HD1 TRP 146 5.326 16.611 17.829 802 HE1 TRP 146 HE1 TRP 146 7.800 16.248 17.217 803 HE3 TRP 146 HE3 TRP 146 5.448 11.539 18.012 804 HZ2 TRP 146 HZ2 TRP 146 9.575 14.088 16.893 805 HZ3 TRP 146 HZ3 TRP 146 7.584 10.378 17.549 806 HH2 TRP 146 HH2 TRP 146 9.599 11.639 17.001 807 H ASP 147 HN ASP 147 2.133 15.970 19.094 808 HA ASP 147 HA ASP 147 2.224 18.389 17.452 809 HB2 ASP 147 HB2 ASP 147 -0.095 17.800 18.248 810 HB3 ASP 147 HB1 ASP 147 0.490 17.912 19.903 811 H ASN 148 HN ASN 148 3.691 19.777 18.088 812 HA ASN 148 HA ASN 148 4.667 19.889 20.805 813 HB2 ASN 148 HB2 ASN 148 6.058 18.118 19.807 814 HB3 ASN 148 HB1 ASN 148 6.461 19.188 18.469 815 HD21 ASN 148 HD21 ASN 148 8.642 19.101 18.922 816 HD22 ASN 148 HD22 ASN 148 9.345 19.871 20.291
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