NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
563046 | 2m7a | 19178 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLU 14 H GLU 14 1.884 0.000 0.829 2 HA GLU 14 HA GLU 14 1.793 0.924 -1.752 3 HB2 GLU 14 HB2 GLU 14 4.114 0.237 -1.903 4 HB3 GLU 14 HB3 GLU 14 3.822 0.803 -0.270 5 HG2 GLU 14 HG2 GLU 14 3.584 -2.145 -0.990 6 HG3 GLU 14 HG3 GLU 14 5.127 -1.433 -0.564 7 HE2 GLU 14 HE2 GLU 14 2.921 -3.183 0.957 8 H ASP 15 H ASP 15 2.263 -0.231 -3.820 9 HA ASP 15 HA ASP 15 0.925 -2.811 -3.775 10 HB2 ASP 15 HB2 ASP 15 0.126 -0.777 -5.215 11 HB3 ASP 15 HB3 ASP 15 1.513 -1.114 -6.232 12 HD2 ASP 15 HD2 ASP 15 -0.359 -4.458 -6.326 13 H GLN 16 H GLN 16 1.944 -4.622 -4.878 14 HA GLN 16 HA GLN 16 4.760 -4.475 -4.918 15 HB2 GLN 16 HB2 GLN 16 2.682 -6.594 -5.420 16 HB3 GLN 16 HB3 GLN 16 4.305 -6.891 -6.011 17 HG2 GLN 16 HG2 GLN 16 3.692 -7.655 -3.576 18 HG3 GLN 16 HG3 GLN 16 5.247 -6.895 -3.852 19 HE21 GLN 16 HE21 GLN 16 5.789 -5.207 -2.686 20 HE22 GLN 16 HE22 GLN 16 4.738 -4.233 -1.712 21 H GLU 17 H GLU 17 2.199 -4.927 -7.451 22 HA GLU 17 HA GLU 17 3.827 -5.210 -9.599 23 HB2 GLU 17 HB2 GLU 17 1.096 -3.929 -9.272 24 HB3 GLU 17 HB3 GLU 17 1.854 -4.025 -10.849 25 HG2 GLU 17 HG2 GLU 17 1.166 -6.361 -9.009 26 HG3 GLU 17 HG3 GLU 17 0.416 -5.981 -10.547 27 HE2 GLU 17 HE2 GLU 17 2.501 -5.570 -12.153 28 H GLN 18 H GLN 18 2.974 -2.254 -7.788 29 HA GLN 18 HA GLN 18 3.928 -0.477 -9.732 30 HB2 GLN 18 HB2 GLN 18 3.477 -0.178 -6.733 31 HB3 GLN 18 HB3 GLN 18 3.932 1.159 -7.770 32 HG2 GLN 18 HG2 GLN 18 1.538 -0.563 -8.487 33 HG3 GLN 18 HG3 GLN 18 1.376 0.701 -7.283 34 HE21 GLN 18 HE21 GLN 18 0.957 0.010 -10.424 35 HE22 GLN 18 HE22 GLN 18 1.118 1.570 -11.159 36 H TRP 19 H TRP 19 5.425 -2.364 -7.121 37 HA TRP 19 HA TRP 19 7.802 -0.886 -6.908 38 HB2 TRP 19 HB2 TRP 19 7.092 -2.445 -5.206 39 HB3 TRP 19 HB3 TRP 19 7.179 -3.786 -6.332 40 HD1 TRP 19 HD1 TRP 19 9.655 -1.201 -4.756 41 HE1 TRP 19 HE1 TRP 19 12.033 -2.292 -4.412 42 HE3 TRP 19 HE3 TRP 19 8.503 -5.657 -6.919 43 HZ2 TRP 19 HZ2 TRP 19 13.140 -4.839 -5.068 44 HZ3 TRP 19 HZ3 TRP 19 10.290 -7.391 -7.027 45 HH2 TRP 19 HH2 TRP 19 12.543 -7.040 -6.146 46 H ALA 20 H ALA 20 6.678 -3.582 -9.020 47 HA ALA 20 HA ALA 20 9.093 -4.209 -10.205 48 HB1 ALA 20 HB1 ALA 20 7.777 -5.325 -11.824 49 HB2 ALA 20 HB2 ALA 20 6.765 -5.326 -10.360 50 HB3 ALA 20 HB3 ALA 20 6.438 -4.162 -11.666 51 H MET 21 H MET 21 6.635 -1.700 -11.087 52 HA MET 21 HA MET 21 7.758 -0.841 -13.398 53 HB2 MET 21 HB2 MET 21 6.436 0.789 -11.158 54 HB3 MET 21 HB3 MET 21 6.660 1.383 -12.791 55 HG2 MET 21 HG2 MET 21 5.267 -0.498 -13.674 56 HG3 MET 21 HG3 MET 21 5.052 -1.109 -12.046 57 HE1 MET 21 HE1 MET 21 4.671 2.612 -13.831 58 HE2 MET 21 HE2 MET 21 4.170 1.162 -14.735 59 HE3 MET 21 HE3 MET 21 2.943 2.294 -14.117 60 H GLN 22 H GLN 22 8.822 -0.264 -10.050 61 HA GLN 22 HA GLN 22 10.288 1.937 -10.195 62 HB2 GLN 22 HB2 GLN 22 10.057 0.195 -8.290 63 HB3 GLN 22 HB3 GLN 22 11.445 -0.607 -8.998 64 HG2 GLN 22 HG2 GLN 22 12.692 1.629 -8.855 65 HG3 GLN 22 HG3 GLN 22 11.334 2.253 -7.939 66 HE21 GLN 22 HE21 GLN 22 10.684 1.069 -5.997 67 HE22 GLN 22 HE22 GLN 22 11.893 0.321 -5.008 68 H THR 23 H THR 23 11.874 -1.287 -10.781 69 HA THR 23 HA THR 23 14.001 -0.023 -12.223 70 HB THR 23 HB THR 23 13.195 -2.891 -11.545 71 HG1 THR 23 HG1 THR 23 14.524 -2.325 -9.864 72 HG21 THR 23 HG21 THR 23 14.555 -3.472 -13.337 73 HG22 THR 23 HG22 THR 23 15.291 -1.854 -13.426 74 HG23 THR 23 HG23 THR 23 15.853 -3.022 -12.206 75 H LEU 24 H LEU 24 11.378 -2.354 -13.153 76 HA LEU 24 HA LEU 24 11.845 -2.630 -15.759 77 HB2 LEU 24 HB2 LEU 24 10.006 -3.688 -14.672 78 HB3 LEU 24 HB3 LEU 24 9.222 -2.154 -14.351 79 HG LEU 24 HG LEU 24 9.713 -3.155 -17.161 80 HD11 LEU 24 HD11 LEU 24 8.269 -4.650 -15.516 81 HD12 LEU 24 HD12 LEU 24 7.023 -3.437 -15.898 82 HD13 LEU 24 HD13 LEU 24 7.785 -4.373 -17.207 83 HD21 LEU 24 HD21 LEU 24 8.107 -0.934 -15.931 84 HD22 LEU 24 HD22 LEU 24 9.229 -0.898 -17.313 85 HD23 LEU 24 HD23 LEU 24 7.622 -1.643 -17.489 86 H MET 25 H MET 25 9.777 0.091 -14.507 87 HA MET 25 HA MET 25 9.969 1.428 -16.978 88 HB2 MET 25 HB2 MET 25 8.202 2.548 -16.029 89 HB3 MET 25 HB3 MET 25 8.427 1.575 -14.589 90 HG2 MET 25 HG2 MET 25 10.168 3.271 -13.803 91 HG3 MET 25 HG3 MET 25 9.738 4.272 -15.176 92 HE1 MET 25 HE1 MET 25 7.505 4.837 -15.814 93 HE2 MET 25 HE2 MET 25 6.198 3.843 -15.127 94 HE3 MET 25 HE3 MET 25 6.356 5.552 -14.657 95 H GLY 26 H GLY 26 11.827 1.437 -13.958 96 HA2 GLY 26 HA2 GLY 26 13.076 3.956 -14.253 97 HA3 GLY 26 HA3 GLY 26 13.626 2.606 -13.280 98 H SER 27 H SER 27 13.276 1.110 -16.164 99 HA SER 27 HA SER 27 16.013 1.046 -16.646 100 HB2 SER 27 HB2 SER 27 15.485 -0.663 -18.073 101 HB3 SER 27 HB3 SER 27 13.907 -0.539 -17.320 102 HG SER 27 HG SER 27 13.396 1.059 -19.093 103 H GLY 28 H GLY 28 13.724 3.457 -17.322 104 HA2 GLY 28 HA2 GLY 28 14.339 5.495 -18.290 105 HA3 GLY 28 HA3 GLY 28 15.521 4.679 -19.295 106 H VAL 29 H VAL 29 12.609 2.861 -19.139 107 HA VAL 29 HA VAL 29 12.058 3.404 -21.878 108 HB VAL 29 HB VAL 29 10.701 1.743 -19.752 109 HG11 VAL 29 HG11 VAL 29 9.494 2.686 -22.079 110 HG12 VAL 29 HG12 VAL 29 10.048 1.051 -22.511 111 HG13 VAL 29 HG13 VAL 29 8.979 1.286 -21.107 112 HG21 VAL 29 HG21 VAL 29 12.117 0.101 -20.303 113 HG22 VAL 29 HG22 VAL 29 11.853 0.357 -22.045 114 HG23 VAL 29 HG23 VAL 29 13.063 1.331 -21.176 115 H LEU 30 H LEU 30 10.457 4.127 -18.716 116 HA LEU 30 HA LEU 30 8.647 5.907 -20.180 117 HB2 LEU 30 HB2 LEU 30 8.450 4.491 -17.533 118 HB3 LEU 30 HB3 LEU 30 7.418 5.851 -17.927 119 HG LEU 30 HG LEU 30 7.594 3.361 -19.639 120 HD11 LEU 30 HD11 LEU 30 5.170 3.168 -18.434 121 HD12 LEU 30 HD12 LEU 30 6.637 2.319 -17.892 122 HD13 LEU 30 HD13 LEU 30 6.149 3.841 -17.109 123 HD21 LEU 30 HD21 LEU 30 5.160 5.037 -19.610 124 HD22 LEU 30 HD22 LEU 30 6.610 5.794 -20.314 125 HD23 LEU 30 HD23 LEU 30 6.007 4.250 -20.964 126 H ALA 31 H ALA 31 7.962 7.834 -18.509 127 HA ALA 31 HA ALA 31 10.502 8.949 -17.533 128 HB1 ALA 31 HB1 ALA 31 9.826 9.957 -19.695 129 HB2 ALA 31 HB2 ALA 31 8.252 10.396 -18.989 130 HB3 ALA 31 HB3 ALA 31 9.745 11.136 -18.364 131 H ARG 32 H ARG 32 10.455 9.726 -15.459 132 HA ARG 32 HA ARG 32 7.799 9.975 -14.293 133 HB2 ARG 32 HB2 ARG 32 8.894 9.199 -12.111 134 HB3 ARG 32 HB3 ARG 32 8.752 7.965 -13.347 135 HG2 ARG 32 HG2 ARG 32 11.123 8.414 -14.048 136 HG3 ARG 32 HG3 ARG 32 11.260 9.619 -12.783 137 HD2 ARG 32 HD2 ARG 32 10.490 7.656 -11.178 138 HD3 ARG 32 HD3 ARG 32 10.973 6.611 -12.499 139 HE ARG 32 HE ARG 32 13.204 7.051 -11.974 140 HH11 ARG 32 HH22 ARG 32 11.206 9.629 -10.653 141 HH12 ARG 32 HH21 ARG 32 12.522 10.406 -9.838 142 HH21 ARG 32 HH12 ARG 32 14.941 8.076 -10.900 143 HH22 ARG 32 HH11 ARG 32 14.661 9.516 -9.980 144 H CYS 33 H CYS 33 7.634 11.592 -12.525 145 HA CYS 33 HA CYS 33 9.484 13.764 -12.986 146 HB2 CYS 33 HB2 CYS 33 7.019 14.148 -13.004 147 HB3 CYS 33 HB3 CYS 33 6.953 13.707 -11.310 148 H ARG 34 H ARG 34 10.930 14.546 -11.403 149 HA ARG 34 HA ARG 34 11.794 12.739 -9.517 150 HB2 ARG 34 HB2 ARG 34 13.112 14.668 -10.539 151 HB3 ARG 34 HB3 ARG 34 12.229 15.768 -9.499 152 HG2 ARG 34 HG2 ARG 34 13.045 14.200 -7.540 153 HG3 ARG 34 HG3 ARG 34 14.216 13.615 -8.705 154 HD2 ARG 34 HD2 ARG 34 15.074 15.916 -9.051 155 HD3 ARG 34 HD3 ARG 34 13.846 16.563 -7.981 156 HE ARG 34 HE ARG 34 15.095 14.692 -6.385 157 HH11 ARG 34 HH22 ARG 34 16.290 17.354 -8.351 158 HH12 ARG 34 HH21 ARG 34 17.669 17.646 -7.345 159 HH21 ARG 34 HH12 ARG 34 16.914 15.077 -5.057 160 HH22 ARG 34 HH11 ARG 34 18.026 16.342 -5.458 161 H ILE 35 H ILE 35 9.232 15.140 -9.452 162 HA ILE 35 HA ILE 35 9.148 15.167 -6.549 163 HB ILE 35 HB ILE 35 7.571 16.622 -8.671 164 HG12 ILE 35 HG12 ILE 35 9.606 17.656 -6.676 165 HG13 ILE 35 HG13 ILE 35 9.963 17.281 -8.351 166 HG21 ILE 35 HG21 ILE 35 6.166 16.154 -6.703 167 HG22 ILE 35 HG22 ILE 35 7.389 16.920 -5.660 168 HG23 ILE 35 HG23 ILE 35 6.529 17.888 -6.881 169 HD11 ILE 35 HD11 ILE 35 7.630 18.907 -8.425 170 HD12 ILE 35 HD12 ILE 35 8.724 19.664 -7.242 171 HD13 ILE 35 HD13 ILE 35 9.281 19.366 -8.906 172 H HIS 36 H HIS 36 7.865 13.431 -9.271 173 HA HIS 36 HA HIS 36 5.901 12.222 -7.464 174 HB2 HIS 36 HB2 HIS 36 5.411 12.242 -10.413 175 HB3 HIS 36 HB3 HIS 36 4.268 12.166 -9.087 176 HD1 HIS 36 HD1 HIS 36 5.098 14.725 -7.515 177 HD2 HIS 36 HD2 HIS 36 4.615 14.546 -11.678 178 HE1 HIS 36 HE1 HIS 36 4.632 17.113 -8.283 179 H ASN 37 H ASN 37 6.856 10.327 -6.858 180 HA ASN 37 HA ASN 37 8.384 8.920 -8.865 181 HB2 ASN 37 HB2 ASN 37 7.957 8.250 -5.906 182 HB3 ASN 37 HB3 ASN 37 9.141 7.508 -6.964 183 HD21 ASN 37 HD21 ASN 37 11.055 8.133 -6.305 184 HD22 ASN 37 HD22 ASN 37 11.574 9.756 -5.994 185 H ASP 38 H ASP 38 5.209 9.122 -7.638 186 HA ASP 38 HA ASP 38 4.727 6.288 -8.067 187 HB2 ASP 38 HB2 ASP 38 3.944 7.377 -5.917 188 HB3 ASP 38 HB3 ASP 38 2.902 8.422 -6.862 189 HD2 ASP 38 HD2 ASP 38 1.294 7.671 -5.763 190 H VAL 39 H VAL 39 5.109 8.697 -10.049 191 HA VAL 39 HA VAL 39 2.522 8.413 -11.417 192 HB VAL 39 HB VAL 39 3.515 10.705 -10.496 193 HG11 VAL 39 HG11 VAL 39 4.784 10.401 -13.238 194 HG12 VAL 39 HG12 VAL 39 4.631 11.938 -12.354 195 HG13 VAL 39 HG13 VAL 39 5.623 10.620 -11.684 196 HG21 VAL 39 HG21 VAL 39 2.305 10.713 -13.260 197 HG22 VAL 39 HG22 VAL 39 1.376 10.147 -11.851 198 HG23 VAL 39 HG23 VAL 39 2.002 11.813 -11.893 199 H ILE 40 H ILE 40 2.569 8.069 -13.716 200 HA ILE 40 HA ILE 40 5.207 7.247 -14.708 201 HB ILE 40 HB ILE 40 4.393 5.174 -14.479 202 HG12 ILE 40 HG12 ILE 40 2.974 6.065 -17.005 203 HG13 ILE 40 HG13 ILE 40 4.612 5.457 -16.881 204 HG21 ILE 40 HG21 ILE 40 2.490 5.439 -13.209 205 HG22 ILE 40 HG22 ILE 40 1.691 6.476 -14.416 206 HG23 ILE 40 HG23 ILE 40 1.825 4.723 -14.697 207 HD11 ILE 40 HD11 ILE 40 2.005 3.958 -16.540 208 HD12 ILE 40 HD12 ILE 40 3.418 3.539 -17.538 209 HD13 ILE 40 HD13 ILE 40 3.488 3.343 -15.770 210 H LEU 41 H LEU 41 5.793 8.226 -16.578 211 HA LEU 41 HA LEU 41 3.630 9.517 -18.092 212 HB2 LEU 41 HB2 LEU 41 6.453 10.523 -18.067 213 HB3 LEU 41 HB3 LEU 41 4.979 11.360 -18.509 214 HG LEU 41 HG LEU 41 5.419 10.462 -15.670 215 HD11 LEU 41 HD11 LEU 41 6.142 13.250 -16.181 216 HD12 LEU 41 HD12 LEU 41 6.952 12.011 -15.192 217 HD13 LEU 41 HD13 LEU 41 7.249 12.085 -16.945 218 HD21 LEU 41 HD21 LEU 41 3.346 11.293 -15.567 219 HD22 LEU 41 HD22 LEU 41 4.134 12.887 -15.644 220 HD23 LEU 41 HD23 LEU 41 3.501 12.136 -17.128 221 H ASP 42 H ASP 42 3.681 9.347 -20.364 222 HA ASP 42 HA ASP 42 5.065 7.032 -21.253 223 HB2 ASP 42 HB2 ASP 42 3.073 8.981 -22.407 224 HB3 ASP 42 HB3 ASP 42 3.991 7.998 -23.531 225 HD2 ASP 42 HD2 ASP 42 2.092 6.909 -24.115 226 H SER 43 H SER 43 6.918 7.001 -22.612 227 HA SER 43 HA SER 43 8.001 9.636 -23.228 228 HB2 SER 43 HB2 SER 43 9.212 7.868 -21.662 229 HB3 SER 43 HB3 SER 43 9.669 7.114 -23.176 230 HG SER 43 HG SER 43 10.416 9.666 -22.123 231 H GLY 44 H GLY 44 7.467 6.271 -24.415 232 HA2 GLY 44 HA2 GLY 44 6.811 5.749 -26.578 233 HA3 GLY 44 HA3 GLY 44 7.403 7.295 -27.153 234 H ASN 45 H ASN 45 9.323 5.227 -24.964 235 HA ASN 45 HA ASN 45 11.289 5.047 -27.067 236 HB2 ASN 45 HB2 ASN 45 11.653 5.706 -24.499 237 HB3 ASN 45 HB3 ASN 45 11.677 3.971 -24.253 238 HD21 ASN 45 HD21 ASN 45 13.642 3.232 -24.115 239 HD22 ASN 45 HD22 ASN 45 15.016 3.699 -25.061 240 H ASP 46 H ASP 46 12.631 2.765 -26.814 241 HA ASP 46 HA ASP 46 11.083 0.814 -27.829 242 HB2 ASP 46 HB2 ASP 46 13.628 0.636 -26.160 243 HB3 ASP 46 HB3 ASP 46 12.936 -0.769 -26.947 244 HD2 ASP 46 HD2 ASP 46 15.345 0.047 -29.162 245 H ALA 47 H ALA 47 9.201 0.058 -26.799 246 HA ALA 47 HA ALA 47 9.084 -0.170 -23.951 247 HB1 ALA 47 HB1 ALA 47 7.226 0.402 -25.722 248 HB2 ALA 47 HB2 ALA 47 7.085 -1.366 -25.869 249 HB3 ALA 47 HB3 ALA 47 6.811 -0.579 -24.296 250 H SER 48 H SER 48 9.824 -2.258 -26.724 251 HA SER 48 HA SER 48 9.290 -4.700 -25.676 252 HB2 SER 48 HB2 SER 48 11.615 -3.816 -27.438 253 HB3 SER 48 HB3 SER 48 11.216 -5.497 -27.142 254 HG SER 48 HG SER 48 9.113 -3.786 -28.027 255 H SER 49 H SER 49 12.235 -2.638 -25.247 256 HA SER 49 HA SER 49 13.680 -4.487 -23.794 257 HB2 SER 49 HB2 SER 49 15.201 -2.757 -23.445 258 HB3 SER 49 HB3 SER 49 14.328 -2.150 -24.838 259 HG SER 49 HG SER 49 14.684 -0.772 -22.719 260 H ALA 50 H ALA 50 11.329 -1.930 -22.797 261 HA ALA 50 HA ALA 50 11.689 -2.139 -20.054 262 HB1 ALA 50 HB1 ALA 50 8.936 -1.619 -20.667 263 HB2 ALA 50 HB2 ALA 50 10.207 -0.461 -20.207 264 HB3 ALA 50 HB3 ALA 50 9.938 -0.853 -21.923 265 H TYR 51 H TYR 51 9.403 -3.880 -22.271 266 HA TYR 51 HA TYR 51 8.094 -5.370 -20.365 267 HB2 TYR 51 HB2 TYR 51 9.007 -5.738 -23.264 268 HB3 TYR 51 HB3 TYR 51 8.118 -7.032 -22.485 269 HD1 TYR 51 HD2 TYR 51 5.858 -6.226 -21.274 270 HD2 TYR 51 HD1 TYR 51 7.805 -4.166 -24.478 271 HE1 TYR 51 HE2 TYR 51 3.672 -5.074 -21.872 272 HE2 TYR 51 HE1 TYR 51 5.612 -3.021 -25.065 273 HH TYR 51 HH TYR 51 3.381 -3.156 -24.778 274 H LYS 52 H LYS 52 11.170 -6.118 -22.129 275 HA LYS 52 HA LYS 52 11.495 -8.660 -21.021 276 HB2 LYS 52 HB2 LYS 52 13.205 -6.687 -22.464 277 HB3 LYS 52 HB3 LYS 52 14.024 -7.963 -21.586 278 HG2 LYS 52 HG2 LYS 52 12.307 -9.573 -22.765 279 HG3 LYS 52 HG3 LYS 52 12.020 -8.229 -23.854 280 HD2 LYS 52 HD2 LYS 52 14.627 -8.147 -24.118 281 HD3 LYS 52 HD3 LYS 52 14.617 -9.740 -23.389 282 HE2 LYS 52 HE2 LYS 52 12.907 -10.431 -25.185 283 HE3 LYS 52 HE3 LYS 52 13.223 -8.896 -25.969 284 HZ1 LYS 52 HZ1 LYS 52 15.630 -10.199 -25.319 285 HZ2 LYS 52 HZ2 LYS 52 14.683 -11.180 -26.217 286 HZ3 LYS 52 HZ3 LYS 52 15.091 -9.701 -26.778 287 H LEU 53 H LEU 53 12.756 -5.416 -20.013 288 HA LEU 53 HA LEU 53 14.201 -6.334 -17.827 289 HB2 LEU 53 HB2 LEU 53 12.819 -3.670 -18.171 290 HB3 LEU 53 HB3 LEU 53 14.132 -4.029 -17.067 291 HG LEU 53 HG LEU 53 14.614 -4.545 -19.966 292 HD11 LEU 53 HD11 LEU 53 14.050 -2.501 -20.632 293 HD12 LEU 53 HD12 LEU 53 13.738 -1.966 -18.963 294 HD13 LEU 53 HD13 LEU 53 15.386 -1.887 -19.630 295 HD21 LEU 53 HD21 LEU 53 16.173 -4.730 -17.767 296 HD22 LEU 53 HD22 LEU 53 16.793 -4.418 -19.406 297 HD23 LEU 53 HD23 LEU 53 16.541 -3.065 -18.277 298 H GLY 54 H GLY 54 10.726 -5.642 -18.275 299 HA2 GLY 54 HA2 GLY 54 9.997 -5.627 -15.553 300 HA3 GLY 54 HA3 GLY 54 8.953 -5.944 -16.925 301 H THR 55 H THR 55 10.057 -8.257 -18.062 302 HA THR 55 HA THR 55 9.085 -10.233 -16.280 303 HB THR 55 HB THR 55 10.283 -10.076 -19.050 304 HG1 THR 55 HG1 THR 55 7.966 -9.849 -18.501 305 HG21 THR 55 HG21 THR 55 9.605 -12.712 -17.660 306 HG22 THR 55 HG22 THR 55 10.268 -12.488 -19.297 307 HG23 THR 55 HG23 THR 55 11.281 -12.151 -17.873 308 H TYR 56 H TYR 56 12.323 -8.977 -17.065 309 HA TYR 56 HA TYR 56 13.787 -11.100 -15.990 310 HB2 TYR 56 HB2 TYR 56 14.579 -9.150 -17.431 311 HB3 TYR 56 HB3 TYR 56 14.255 -8.054 -16.102 312 HD1 TYR 56 HD1 TYR 56 15.644 -11.312 -15.248 313 HD2 TYR 56 HD2 TYR 56 16.621 -7.283 -16.303 314 HE1 TYR 56 HE1 TYR 56 18.012 -11.654 -14.387 315 HE2 TYR 56 HE2 TYR 56 18.986 -7.638 -15.438 316 HH TYR 56 HH TYR 56 19.939 -9.458 -13.502 317 H LEU 57 H LEU 57 12.718 -7.959 -14.506 318 HA LEU 57 HA LEU 57 13.783 -8.641 -11.972 319 HB2 LEU 57 HB2 LEU 57 13.583 -6.356 -12.614 320 HB3 LEU 57 HB3 LEU 57 11.867 -6.520 -12.930 321 HG LEU 57 HG LEU 57 12.764 -7.129 -10.159 322 HD11 LEU 57 HD11 LEU 57 12.318 -4.279 -10.419 323 HD12 LEU 57 HD12 LEU 57 13.649 -5.161 -9.632 324 HD13 LEU 57 HD13 LEU 57 13.728 -4.802 -11.374 325 HD21 LEU 57 HD21 LEU 57 10.510 -7.245 -10.176 326 HD22 LEU 57 HD22 LEU 57 10.640 -5.486 -9.935 327 HD23 LEU 57 HD23 LEU 57 10.349 -6.142 -11.564 328 H TYR 58 H TYR 58 10.458 -8.667 -13.410 329 HA TYR 58 HA TYR 58 8.981 -9.386 -11.272 330 HB2 TYR 58 HB2 TYR 58 9.107 -10.044 -14.231 331 HB3 TYR 58 HB3 TYR 58 7.979 -10.994 -13.285 332 HD1 TYR 58 HD2 TYR 58 7.007 -8.946 -11.336 333 HD2 TYR 58 HD1 TYR 58 7.731 -8.669 -15.543 334 HE1 TYR 58 HE2 TYR 58 5.291 -7.078 -11.516 335 HE2 TYR 58 HE1 TYR 58 6.013 -6.803 -15.709 336 HH TYR 58 HH TYR 58 4.582 -5.410 -12.830 337 H GLN 59 H GLN 59 10.831 -11.669 -13.410 338 HA GLN 59 HA GLN 59 11.550 -13.285 -11.281 339 HB2 GLN 59 HB2 GLN 59 8.991 -13.764 -11.514 340 HB3 GLN 59 HB3 GLN 59 9.423 -14.639 -12.971 341 HG2 GLN 59 HG2 GLN 59 10.928 -16.118 -11.701 342 HG3 GLN 59 HG3 GLN 59 10.681 -15.180 -10.241 343 HE21 GLN 59 HE21 GLN 59 10.193 -17.609 -9.775 344 HE22 GLN 59 HE22 GLN 59 8.519 -18.053 -9.788 345 H LYS 60 H LYS 60 12.993 -14.996 -11.972 346 HA LYS 60 HA LYS 60 14.416 -14.467 -14.253 347 HB2 LYS 60 HB2 LYS 60 14.650 -16.151 -12.083 348 HB3 LYS 60 HB3 LYS 60 14.464 -17.285 -13.405 349 HG2 LYS 60 HG2 LYS 60 16.228 -15.550 -14.561 350 HG3 LYS 60 HG3 LYS 60 16.668 -15.321 -12.881 351 HD2 LYS 60 HD2 LYS 60 16.511 -18.030 -14.286 352 HD3 LYS 60 HD3 LYS 60 17.993 -17.144 -13.989 353 HE2 LYS 60 HE2 LYS 60 17.959 -18.583 -12.140 354 HE3 LYS 60 HE3 LYS 60 17.198 -17.157 -11.463 355 HZ1 LYS 60 HZ1 LYS 60 15.184 -18.148 -11.468 356 HZ2 LYS 60 HZ2 LYS 60 15.484 -19.096 -12.763 357 HZ3 LYS 60 HZ3 LYS 60 16.097 -19.491 -11.302 358 H ASP 61 H ASP 61 14.792 -16.502 -15.932 359 HA ASP 61 HA ASP 61 12.776 -16.282 -17.716 360 HB2 ASP 61 HB2 ASP 61 15.025 -17.152 -18.257 361 HB3 ASP 61 HB3 ASP 61 14.731 -18.591 -17.301 362 HD2 ASP 61 HD2 ASP 61 13.469 -17.420 -20.659 363 H ASN 62 H ASN 62 10.632 -16.756 -17.056 364 HA ASN 62 HA ASN 62 10.210 -19.248 -15.657 365 HB2 ASN 62 HB2 ASN 62 9.087 -16.740 -15.338 366 HB3 ASN 62 HB3 ASN 62 7.879 -17.500 -16.355 367 HD21 ASN 62 HD21 ASN 62 8.331 -20.181 -15.467 368 HD22 ASN 62 HD22 ASN 62 7.695 -20.343 -13.864 369 H SER 63 H SER 63 10.850 -18.735 -18.693 370 HA SER 63 HA SER 63 8.652 -19.105 -20.241 371 HB2 SER 63 HB2 SER 63 10.303 -20.300 -21.826 372 HB3 SER 63 HB3 SER 63 10.705 -18.665 -21.341 373 HG SER 63 HG SER 63 12.553 -20.047 -21.154 374 H CYS 64 H CYS 64 7.053 -20.581 -19.668 375 HA CYS 64 HA CYS 64 7.872 -23.370 -19.715 376 HB2 CYS 64 HB2 CYS 64 7.529 -22.285 -17.286 377 HB3 CYS 64 HB3 CYS 64 5.849 -22.634 -17.642 378 HG CYS 64 HG CYS 64 7.729 -24.471 -16.330 379 H ASN 65 H ASN 65 5.439 -24.602 -19.423 380 HA ASN 65 HA ASN 65 4.213 -24.132 -21.817 381 HB2 ASN 65 HB2 ASN 65 2.944 -25.345 -19.304 382 HB3 ASN 65 HB3 ASN 65 2.397 -25.608 -20.948 383 HD21 ASN 65 HD21 ASN 65 3.611 -26.841 -22.379 384 HD22 ASN 65 HD22 ASN 65 4.844 -27.942 -21.862 385 H LEU 66 H LEU 66 1.435 -23.955 -21.460 386 HA LEU 66 HA LEU 66 0.938 -21.281 -21.319 387 HB2 LEU 66 HB2 LEU 66 -0.487 -23.250 -22.151 388 HB3 LEU 66 HB3 LEU 66 -1.080 -23.358 -20.506 389 HG LEU 66 HG LEU 66 -1.222 -20.767 -22.043 390 HD11 LEU 66 HD11 LEU 66 -3.763 -21.829 -22.195 391 HD12 LEU 66 HD12 LEU 66 -2.581 -21.739 -23.523 392 HD13 LEU 66 HD13 LEU 66 -2.721 -23.227 -22.555 393 HD21 LEU 66 HD21 LEU 66 -2.394 -21.863 -19.524 394 HD22 LEU 66 HD22 LEU 66 -1.742 -20.246 -19.882 395 HD23 LEU 66 HD23 LEU 66 -3.355 -20.708 -20.477 396 H PHE 67 H PHE 67 1.498 -23.553 -18.702 397 HA PHE 67 HA PHE 67 0.187 -22.636 -16.590 398 HB2 PHE 67 HB2 PHE 67 2.171 -24.319 -16.845 399 HB3 PHE 67 HB3 PHE 67 3.244 -22.941 -16.702 400 HD1 PHE 67 HD2 PHE 67 2.785 -21.426 -14.563 401 HD2 PHE 67 HD1 PHE 67 1.663 -25.502 -14.931 402 HE1 PHE 67 HE2 PHE 67 2.718 -21.633 -12.062 403 HE2 PHE 67 HE1 PHE 67 1.596 -25.709 -12.430 404 HZ PHE 67 HZ PHE 67 2.125 -23.773 -11.026 405 H ASN 68 H ASN 68 3.393 -21.195 -17.546 406 HA ASN 68 HA ASN 68 2.690 -18.883 -15.982 407 HB2 ASN 68 HB2 ASN 68 5.210 -19.951 -17.279 408 HB3 ASN 68 HB3 ASN 68 5.129 -18.235 -16.936 409 HD21 ASN 68 HD21 ASN 68 4.915 -21.464 -15.564 410 HD22 ASN 68 HD22 ASN 68 5.318 -21.058 -13.929 411 H THR 69 H THR 69 1.899 -17.004 -16.964 412 HA THR 69 HA THR 69 2.219 -16.804 -19.887 413 HB THR 69 HB THR 69 -0.047 -15.514 -18.342 414 HG1 THR 69 HG1 THR 69 -0.633 -17.573 -17.786 415 HG21 THR 69 HG21 THR 69 0.441 -15.429 -20.968 416 HG22 THR 69 HG22 THR 69 -0.232 -17.077 -20.933 417 HG23 THR 69 HG23 THR 69 -1.219 -15.701 -20.384 418 H LEU 70 H LEU 70 3.508 -15.222 -20.566 419 HA LEU 70 HA LEU 70 4.448 -13.284 -18.705 420 HB2 LEU 70 HB2 LEU 70 5.576 -14.456 -20.776 421 HB3 LEU 70 HB3 LEU 70 4.894 -13.101 -21.655 422 HG LEU 70 HG LEU 70 7.230 -12.720 -21.006 423 HD11 LEU 70 HD11 LEU 70 6.988 -10.486 -20.440 424 HD12 LEU 70 HD12 LEU 70 5.400 -10.885 -21.139 425 HD13 LEU 70 HD13 LEU 70 5.598 -10.795 -19.373 426 HD21 LEU 70 HD21 LEU 70 8.080 -13.009 -18.953 427 HD22 LEU 70 HD22 LEU 70 6.669 -12.275 -18.152 428 HD23 LEU 70 HD23 LEU 70 6.617 -13.980 -18.662 429 H THR 71 H THR 71 1.719 -13.558 -20.839 430 HA THR 71 HA THR 71 1.309 -10.954 -21.639 431 HB THR 71 HB THR 71 0.023 -13.136 -22.189 432 HG1 THR 71 HG1 THR 71 -0.769 -10.458 -21.730 433 HG21 THR 71 HG21 THR 71 -0.556 -13.618 -19.720 434 HG22 THR 71 HG22 THR 71 -1.650 -12.216 -19.801 435 HG23 THR 71 HG23 THR 71 -1.936 -13.631 -20.843 436 H GLU 72 H GLU 72 0.979 -12.395 -18.412 437 HA GLU 72 HA GLU 72 -0.639 -10.463 -17.308 438 HB2 GLU 72 HB2 GLU 72 -0.142 -12.549 -16.149 439 HB3 GLU 72 HB3 GLU 72 1.566 -12.168 -16.078 440 HG2 GLU 72 HG2 GLU 72 0.844 -11.551 -13.926 441 HG3 GLU 72 HG3 GLU 72 0.812 -10.015 -14.771 442 HE2 GLU 72 HE2 GLU 72 -1.507 -12.106 -13.054 443 H ALA 73 H ALA 73 2.983 -10.656 -17.474 444 HA ALA 73 HA ALA 73 3.416 -8.220 -16.153 445 HB1 ALA 73 HB1 ALA 73 4.947 -10.326 -16.970 446 HB2 ALA 73 HB2 ALA 73 5.383 -9.111 -18.195 447 HB3 ALA 73 HB3 ALA 73 5.610 -8.753 -16.466 448 H ARG 74 H ARG 74 3.324 -9.100 -19.675 449 HA ARG 74 HA ARG 74 3.868 -6.625 -20.644 450 HB2 ARG 74 HB2 ARG 74 3.803 -8.272 -22.304 451 HB3 ARG 74 HB3 ARG 74 2.362 -9.027 -21.652 452 HG2 ARG 74 HG2 ARG 74 0.939 -7.241 -22.531 453 HG3 ARG 74 HG3 ARG 74 2.334 -6.288 -22.996 454 HD2 ARG 74 HD2 ARG 74 1.630 -7.324 -25.027 455 HD3 ARG 74 HD3 ARG 74 3.010 -8.275 -24.517 456 HE ARG 74 HE ARG 74 0.451 -9.285 -23.494 457 HH11 ARG 74 HH22 ARG 74 2.745 -9.387 -26.160 458 HH12 ARG 74 HH21 ARG 74 2.209 -10.932 -26.730 459 HH21 ARG 74 HH12 ARG 74 -0.256 -11.324 -24.245 460 HH22 ARG 74 HH11 ARG 74 0.490 -12.041 -25.633 461 H ASP 75 H ASP 75 0.808 -7.990 -19.382 462 HA ASP 75 HA ASP 75 -0.788 -5.880 -20.346 463 HB2 ASP 75 HB2 ASP 75 -1.577 -8.211 -19.690 464 HB3 ASP 75 HB3 ASP 75 -1.313 -7.779 -18.012 465 HD2 ASP 75 HD2 ASP 75 -4.530 -7.783 -18.407 466 H ALA 76 H ALA 76 1.200 -6.554 -17.475 467 HA ALA 76 HA ALA 76 0.033 -4.724 -15.705 468 HB1 ALA 76 HB1 ALA 76 1.635 -5.521 -14.323 469 HB2 ALA 76 HB2 ALA 76 2.042 -6.634 -15.651 470 HB3 ALA 76 HB3 ALA 76 2.942 -5.110 -15.460 471 H ILE 77 H ILE 77 2.865 -4.442 -17.962 472 HA ILE 77 HA ILE 77 3.132 -1.655 -17.382 473 HB ILE 77 HB ILE 77 4.746 -1.853 -19.380 474 HG12 ILE 77 HG12 ILE 77 3.501 -4.281 -19.744 475 HG13 ILE 77 HG13 ILE 77 5.033 -3.794 -20.443 476 HG21 ILE 77 HG21 ILE 77 5.671 -1.622 -17.247 477 HG22 ILE 77 HG22 ILE 77 5.062 -3.204 -16.704 478 HG23 ILE 77 HG23 ILE 77 6.399 -3.120 -17.876 479 HD11 ILE 77 HD11 ILE 77 4.974 -6.034 -19.132 480 HD12 ILE 77 HD12 ILE 77 6.303 -4.908 -18.760 481 HD13 ILE 77 HD13 ILE 77 4.903 -5.026 -17.667 482 H LYS 78 H LYS 78 1.586 -3.702 -19.874 483 HA LYS 78 HA LYS 78 1.081 -1.610 -21.684 484 HB2 LYS 78 HB2 LYS 78 1.071 -3.929 -22.378 485 HB3 LYS 78 HB3 LYS 78 -0.238 -4.307 -21.277 486 HG2 LYS 78 HG2 LYS 78 -1.287 -4.022 -23.407 487 HG3 LYS 78 HG3 LYS 78 -1.646 -2.550 -22.526 488 HD2 LYS 78 HD2 LYS 78 -0.019 -1.281 -23.739 489 HD3 LYS 78 HD3 LYS 78 0.806 -2.716 -24.313 490 HE2 LYS 78 HE2 LYS 78 -0.412 -2.093 -26.221 491 HE3 LYS 78 HE3 LYS 78 -1.489 -3.271 -25.498 492 HZ1 LYS 78 HZ1 LYS 78 -2.510 -1.119 -26.146 493 HZ2 LYS 78 HZ2 LYS 78 -2.795 -1.564 -24.601 494 HZ3 LYS 78 HZ3 LYS 78 -1.694 -0.402 -24.926 495 H ASP 79 H ASP 79 -0.475 -2.726 -18.699 496 HA ASP 79 HA ASP 79 -2.888 -1.354 -19.215 497 HB2 ASP 79 HB2 ASP 79 -2.906 -3.236 -17.686 498 HB3 ASP 79 HB3 ASP 79 -1.617 -2.547 -16.718 499 HD2 ASP 79 HD2 ASP 79 -5.308 -1.113 -16.704 500 H ALA 80 H ALA 80 0.002 -0.862 -17.052 501 HA ALA 80 HA ALA 80 -0.807 1.578 -15.982 502 HB1 ALA 80 HB1 ALA 80 0.938 0.733 -14.781 503 HB2 ALA 80 HB2 ALA 80 1.683 -0.034 -16.204 504 HB3 ALA 80 HB3 ALA 80 1.914 1.705 -15.908 505 H TYR 81 H TYR 81 1.178 0.765 -18.896 506 HA TYR 81 HA TYR 81 1.809 3.389 -19.585 507 HB2 TYR 81 HB2 TYR 81 1.384 0.709 -21.011 508 HB3 TYR 81 HB3 TYR 81 1.836 2.120 -21.947 509 HD1 TYR 81 HD2 TYR 81 3.023 1.133 -18.541 510 HD2 TYR 81 HD1 TYR 81 4.015 1.632 -22.673 511 HE1 TYR 81 HE2 TYR 81 5.473 0.705 -18.012 512 HE2 TYR 81 HE1 TYR 81 6.461 1.203 -22.130 513 HH TYR 81 HH TYR 81 7.494 -0.245 -19.494 514 H GLU 82 H GLU 82 -0.924 1.255 -20.659 515 HA GLU 82 HA GLU 82 -2.001 3.249 -22.311 516 HB2 GLU 82 HB2 GLU 82 -2.504 0.937 -22.782 517 HB3 GLU 82 HB3 GLU 82 -3.116 0.662 -21.163 518 HG2 GLU 82 HG2 GLU 82 -5.088 1.970 -21.558 519 HG3 GLU 82 HG3 GLU 82 -4.405 2.731 -22.981 520 HE2 GLU 82 HE2 GLU 82 -4.878 0.880 -25.168 521 H SER 83 H SER 83 -2.143 2.569 -18.872 522 HA SER 83 HA SER 83 -4.611 3.802 -18.387 523 HB2 SER 83 HB2 SER 83 -2.257 2.916 -16.741 524 HB3 SER 83 HB3 SER 83 -3.373 4.044 -15.998 525 HG SER 83 HG SER 83 -3.850 1.689 -15.705 526 H TYR 84 H TYR 84 -1.162 4.904 -18.221 527 HA TYR 84 HA TYR 84 -2.083 7.625 -17.716 528 HB2 TYR 84 HB2 TYR 84 0.561 6.063 -17.765 529 HB3 TYR 84 HB3 TYR 84 0.572 7.812 -17.653 530 HD1 TYR 84 HD1 TYR 84 -0.280 4.684 -15.899 531 HD2 TYR 84 HD2 TYR 84 -0.095 8.948 -15.607 532 HE1 TYR 84 HE1 TYR 84 -0.546 4.530 -13.375 533 HE2 TYR 84 HE2 TYR 84 -0.361 8.780 -13.085 534 HH TYR 84 HH TYR 84 0.184 6.976 -11.335 535 H CYS 85 H CYS 85 -1.550 5.618 -20.373 536 HA CYS 85 HA CYS 85 0.033 7.018 -22.078 537 HB2 CYS 85 HB2 CYS 85 -0.684 4.969 -22.894 538 HB3 CYS 85 HB3 CYS 85 -2.362 5.253 -22.475 539 HG CYS 85 HG CYS 85 -2.902 5.676 -24.753 540 H GLY 86 H GLY 86 -0.240 8.849 -23.433 541 HA2 GLY 86 HA2 GLY 86 -1.591 10.456 -24.509 542 HA3 GLY 86 HA3 GLY 86 -2.827 10.246 -23.285 543 H ILE 87 H ILE 87 0.104 10.152 -21.639 544 HA ILE 87 HA ILE 87 0.136 13.068 -21.301 545 HB ILE 87 HB ILE 87 0.120 12.928 -19.007 546 HG12 ILE 87 HG12 ILE 87 0.956 10.043 -19.324 547 HG13 ILE 87 HG13 ILE 87 1.838 11.356 -18.570 548 HG21 ILE 87 HG21 ILE 87 -1.850 11.719 -18.390 549 HG22 ILE 87 HG22 ILE 87 -2.065 12.313 -20.054 550 HG23 ILE 87 HG23 ILE 87 -1.665 10.603 -19.765 551 HD11 ILE 87 HD11 ILE 87 0.975 10.246 -16.697 552 HD12 ILE 87 HD12 ILE 87 -0.271 11.489 -16.964 553 HD13 ILE 87 HD13 ILE 87 -0.544 9.821 -17.522 554 H ASP 88 H ASP 88 2.085 13.913 -21.781 555 HA ASP 88 HA ASP 88 4.326 12.057 -21.692 556 HB2 ASP 88 HB2 ASP 88 5.425 13.726 -23.251 557 HB3 ASP 88 HB3 ASP 88 4.004 12.946 -23.917 558 HD2 ASP 88 HD2 ASP 88 2.688 16.420 -22.757 559 H ASP 89 H ASP 89 2.807 14.466 -19.932 560 HA ASP 89 HA ASP 89 5.229 15.061 -18.533 561 HB2 ASP 89 HB2 ASP 89 3.651 17.111 -20.089 562 HB3 ASP 89 HB3 ASP 89 4.319 17.597 -18.543 563 HD2 ASP 89 HD2 ASP 89 7.122 16.331 -19.018 564 H CYS 90 H CYS 90 4.714 15.165 -16.315 565 HA CYS 90 HA CYS 90 2.214 14.477 -15.428 566 HB2 CYS 90 HB2 CYS 90 3.057 15.346 -13.177 567 HB3 CYS 90 HB3 CYS 90 4.005 14.094 -13.956 568 HA PRO 91 HA PRO 91 0.140 18.314 -15.801 569 HB2 PRO 91 HB2 PRO 91 -2.223 17.622 -14.614 570 HB3 PRO 91 HB3 PRO 91 -1.854 17.272 -16.291 571 HG2 PRO 91 HG2 PRO 91 -1.897 15.430 -13.980 572 HG3 PRO 91 HG3 PRO 91 -1.953 15.048 -15.689 573 HD2 PRO 91 HD2 PRO 91 0.313 14.799 -13.949 574 HD3 PRO 91 HD3 PRO 91 0.286 14.528 -15.680 575 H GLN 92 H GLN 92 0.852 16.782 -12.839 576 HA GLN 92 HA GLN 92 -0.193 18.674 -11.130 577 HB2 GLN 92 HB2 GLN 92 2.060 16.671 -10.962 578 HB3 GLN 92 HB3 GLN 92 1.861 17.827 -9.660 579 HG2 GLN 92 HG2 GLN 92 -0.322 15.952 -10.688 580 HG3 GLN 92 HG3 GLN 92 0.621 15.694 -9.234 581 HE21 GLN 92 HE21 GLN 92 -2.110 17.114 -10.603 582 HE22 GLN 92 HE22 GLN 92 -2.655 18.072 -9.267 583 H CYS 93 H CYS 93 3.084 18.436 -12.664 584 HA CYS 93 HA CYS 93 4.118 20.714 -11.449 585 HB2 CYS 93 HB2 CYS 93 4.842 19.055 -13.831 586 HB3 CYS 93 HB3 CYS 93 5.581 20.637 -13.685 587 H SER 94 H SER 94 2.038 20.147 -14.297 588 HA SER 94 HA SER 94 2.333 22.831 -15.210 589 HB2 SER 94 HB2 SER 94 1.806 20.640 -16.577 590 HB3 SER 94 HB3 SER 94 0.146 20.930 -16.096 591 HG SER 94 HG SER 94 1.546 22.111 -18.098 592 H LYS 95 H LYS 95 0.539 21.200 -12.773 593 HA LYS 95 HA LYS 95 -1.599 23.198 -12.863 594 HB2 LYS 95 HB2 LYS 95 -2.351 20.884 -12.843 595 HB3 LYS 95 HB3 LYS 95 -1.396 20.542 -11.414 596 HG2 LYS 95 HG2 LYS 95 -3.785 20.962 -10.843 597 HG3 LYS 95 HG3 LYS 95 -2.725 22.130 -10.080 598 HD2 LYS 95 HD2 LYS 95 -3.339 23.869 -11.591 599 HD3 LYS 95 HD3 LYS 95 -3.964 22.745 -12.781 600 HE2 LYS 95 HE2 LYS 95 -5.836 23.856 -11.630 601 HE3 LYS 95 HE3 LYS 95 -5.841 22.146 -11.245 602 HZ1 LYS 95 HZ1 LYS 95 -4.813 22.619 -9.172 603 HZ2 LYS 95 HZ2 LYS 95 -4.611 24.197 -9.539 604 HZ3 LYS 95 HZ3 LYS 95 -6.113 23.597 -9.314 605 H TYR 96 H TYR 96 1.446 22.576 -11.490 606 HA TYR 96 HA TYR 96 0.797 24.383 -9.262 607 HB2 TYR 96 HB2 TYR 96 1.259 21.819 -8.810 608 HB3 TYR 96 HB3 TYR 96 2.898 22.139 -9.342 609 HD1 TYR 96 HD2 TYR 96 0.399 23.599 -6.941 610 HD2 TYR 96 HD1 TYR 96 4.475 22.539 -7.693 611 HE1 TYR 96 HE2 TYR 96 1.029 24.322 -4.586 612 HE2 TYR 96 HE1 TYR 96 5.091 23.266 -5.336 613 HH TYR 96 HH TYR 96 3.512 23.407 -3.026 614 H ILE 97 H ILE 97 3.162 25.096 -8.293 615 HA ILE 97 HA ILE 97 4.490 26.255 -10.624 616 HB ILE 97 HB ILE 97 4.461 27.050 -7.712 617 HG12 ILE 97 HG12 ILE 97 3.375 29.140 -8.865 618 HG13 ILE 97 HG13 ILE 97 3.004 28.016 -10.158 619 HG21 ILE 97 HG21 ILE 97 6.466 27.945 -8.199 620 HG22 ILE 97 HG22 ILE 97 6.205 27.851 -9.957 621 HG23 ILE 97 HG23 ILE 97 5.495 29.189 -9.022 622 HD11 ILE 97 HD11 ILE 97 1.314 27.090 -8.966 623 HD12 ILE 97 HD12 ILE 97 2.381 26.814 -7.569 624 HD13 ILE 97 HD13 ILE 97 1.552 28.377 -7.761 625 H ASP 98 H ASP 98 6.690 25.980 -11.022 626 HA ASP 98 HA ASP 98 7.822 23.753 -9.577 627 HB2 ASP 98 HB2 ASP 98 7.912 23.582 -11.994 628 HB3 ASP 98 HB3 ASP 98 8.553 25.205 -12.152 629 HD2 ASP 98 HD2 ASP 98 10.551 23.507 -13.335 630 H ASP 99 H ASP 99 8.851 24.509 -7.688 631 HA ASP 99 HA ASP 99 9.803 27.011 -7.284 632 HB2 ASP 99 HB2 ASP 99 10.646 24.311 -6.164 633 HB3 ASP 99 HB3 ASP 99 11.392 25.791 -5.593 634 HD2 ASP 99 HD2 ASP 99 9.233 24.390 -3.556 Start of MODEL 2 1 H GLU 14 H GLU 14 4.664 1.631 -2.672 2 HA GLU 14 HA GLU 14 3.681 0.368 -0.252 3 HB2 GLU 14 HB2 GLU 14 2.739 2.627 -1.999 4 HB3 GLU 14 HB3 GLU 14 1.519 1.709 -1.138 5 HG2 GLU 14 HG2 GLU 14 2.395 3.723 0.133 6 HG3 GLU 14 HG3 GLU 14 2.516 2.211 1.011 7 HE2 GLU 14 HE2 GLU 14 5.381 4.567 0.136 8 H ASP 15 H ASP 15 4.369 -0.688 -3.211 9 HA ASP 15 HA ASP 15 2.112 -2.474 -3.196 10 HB2 ASP 15 HB2 ASP 15 2.768 -0.518 -5.377 11 HB3 ASP 15 HB3 ASP 15 2.341 -2.136 -5.895 12 HD2 ASP 15 HD2 ASP 15 -0.359 0.374 -4.433 13 H GLN 16 H GLN 16 2.675 -4.543 -4.223 14 HA GLN 16 HA GLN 16 5.454 -5.042 -4.189 15 HB2 GLN 16 HB2 GLN 16 3.091 -6.800 -4.981 16 HB3 GLN 16 HB3 GLN 16 4.736 -7.382 -4.822 17 HG2 GLN 16 HG2 GLN 16 2.969 -6.217 -2.630 18 HG3 GLN 16 HG3 GLN 16 3.599 -7.849 -2.732 19 HE21 GLN 16 HE21 GLN 16 5.867 -8.203 -2.525 20 HE22 GLN 16 HE22 GLN 16 6.864 -7.125 -1.607 21 H GLU 17 H GLU 17 2.893 -4.875 -6.734 22 HA GLU 17 HA GLU 17 4.553 -5.662 -8.816 23 HB2 GLU 17 HB2 GLU 17 2.782 -4.619 -10.273 24 HB3 GLU 17 HB3 GLU 17 2.146 -5.727 -9.073 25 HG2 GLU 17 HG2 GLU 17 1.410 -3.916 -7.644 26 HG3 GLU 17 HG3 GLU 17 2.323 -2.729 -8.556 27 HE2 GLU 17 HE2 GLU 17 -0.566 -1.903 -9.341 28 H GLN 18 H GLN 18 3.923 -2.508 -7.254 29 HA GLN 18 HA GLN 18 4.979 -0.888 -9.207 30 HB2 GLN 18 HB2 GLN 18 4.764 -0.636 -6.191 31 HB3 GLN 18 HB3 GLN 18 5.505 0.636 -7.142 32 HG2 GLN 18 HG2 GLN 18 2.676 -0.455 -7.510 33 HG3 GLN 18 HG3 GLN 18 3.095 1.092 -6.802 34 HE21 GLN 18 HE21 GLN 18 2.340 -0.593 -9.608 35 HE22 GLN 18 HE22 GLN 18 2.714 0.609 -10.797 36 H TRP 19 H TRP 19 6.539 -2.977 -6.795 37 HA TRP 19 HA TRP 19 9.047 -1.850 -6.681 38 HB2 TRP 19 HB2 TRP 19 8.327 -3.653 -5.240 39 HB3 TRP 19 HB3 TRP 19 8.214 -4.754 -6.599 40 HD1 TRP 19 HD1 TRP 19 11.187 -2.440 -5.516 41 HE1 TRP 19 HE1 TRP 19 13.417 -3.838 -5.332 42 HE3 TRP 19 HE3 TRP 19 9.084 -6.928 -6.649 43 HZ2 TRP 19 HZ2 TRP 19 14.038 -6.603 -5.674 44 HZ3 TRP 19 HZ3 TRP 19 10.572 -8.927 -6.703 45 HH2 TRP 19 HH2 TRP 19 12.969 -8.816 -6.239 46 H ALA 20 H ALA 20 7.506 -3.987 -9.140 47 HA ALA 20 HA ALA 20 9.827 -4.431 -10.651 48 HB1 ALA 20 HB1 ALA 20 7.434 -4.406 -12.268 49 HB2 ALA 20 HB2 ALA 20 8.382 -5.798 -11.693 50 HB3 ALA 20 HB3 ALA 20 7.072 -5.136 -10.686 51 H MET 21 H MET 21 7.189 -1.958 -10.860 52 HA MET 21 HA MET 21 7.967 -0.736 -13.146 53 HB2 MET 21 HB2 MET 21 6.061 -0.303 -11.237 54 HB3 MET 21 HB3 MET 21 7.154 0.997 -10.805 55 HG2 MET 21 HG2 MET 21 6.914 2.077 -12.915 56 HG3 MET 21 HG3 MET 21 6.337 0.623 -13.705 57 HE1 MET 21 HE1 MET 21 3.790 -0.007 -13.905 58 HE2 MET 21 HE2 MET 21 2.790 1.465 -13.949 59 HE3 MET 21 HE3 MET 21 4.361 1.431 -14.785 60 H GLN 22 H GLN 22 9.454 -0.570 -9.917 61 HA GLN 22 HA GLN 22 10.835 1.728 -10.034 62 HB2 GLN 22 HB2 GLN 22 10.785 -0.221 -8.263 63 HB3 GLN 22 HB3 GLN 22 12.207 -0.807 -9.102 64 HG2 GLN 22 HG2 GLN 22 12.051 2.096 -8.231 65 HG3 GLN 22 HG3 GLN 22 12.490 0.858 -7.071 66 HE21 GLN 22 HE21 GLN 22 14.482 0.050 -7.038 67 HE22 GLN 22 HE22 GLN 22 15.752 0.425 -8.154 68 H THR 23 H THR 23 12.405 -1.432 -10.928 69 HA THR 23 HA THR 23 14.368 -0.051 -12.494 70 HB THR 23 HB THR 23 13.740 -2.862 -11.598 71 HG1 THR 23 HG1 THR 23 15.241 -0.966 -10.770 72 HG21 THR 23 HG21 THR 23 15.713 -3.638 -13.007 73 HG22 THR 23 HG22 THR 23 14.255 -3.286 -13.965 74 HG23 THR 23 HG23 THR 23 15.594 -2.114 -13.919 75 H LEU 24 H LEU 24 11.666 -2.347 -13.255 76 HA LEU 24 HA LEU 24 11.896 -2.562 -15.899 77 HB2 LEU 24 HB2 LEU 24 10.146 -3.631 -14.695 78 HB3 LEU 24 HB3 LEU 24 9.423 -2.101 -14.239 79 HG LEU 24 HG LEU 24 9.618 -3.021 -17.114 80 HD11 LEU 24 HD11 LEU 24 8.268 -4.488 -15.348 81 HD12 LEU 24 HD12 LEU 24 7.039 -3.232 -15.637 82 HD13 LEU 24 HD13 LEU 24 7.671 -4.190 -16.998 83 HD21 LEU 24 HD21 LEU 24 7.453 -1.418 -16.994 84 HD22 LEU 24 HD22 LEU 24 8.445 -0.691 -15.708 85 HD23 LEU 24 HD23 LEU 24 9.097 -0.838 -17.358 86 H MET 25 H MET 25 9.987 0.150 -14.399 87 HA MET 25 HA MET 25 10.001 1.550 -16.849 88 HB2 MET 25 HB2 MET 25 8.318 2.665 -15.752 89 HB3 MET 25 HB3 MET 25 8.615 1.629 -14.370 90 HG2 MET 25 HG2 MET 25 10.370 3.252 -13.562 91 HG3 MET 25 HG3 MET 25 10.001 4.300 -14.917 92 HE1 MET 25 HE1 MET 25 6.294 5.212 -14.353 93 HE2 MET 25 HE2 MET 25 7.519 4.731 -15.550 94 HE3 MET 25 HE3 MET 25 6.502 3.495 -14.772 95 H GLY 26 H GLY 26 12.042 1.489 -13.944 96 HA2 GLY 26 HA2 GLY 26 13.287 4.002 -14.257 97 HA3 GLY 26 HA3 GLY 26 13.897 2.622 -13.364 98 H SER 27 H SER 27 13.344 1.217 -16.263 99 HA SER 27 HA SER 27 16.035 1.134 -16.928 100 HB2 SER 27 HB2 SER 27 15.346 -0.217 -18.805 101 HB3 SER 27 HB3 SER 27 14.282 -0.607 -17.468 102 HG SER 27 HG SER 27 13.642 1.291 -19.562 103 H GLY 28 H GLY 28 13.723 3.595 -17.391 104 HA2 GLY 28 HA2 GLY 28 14.301 5.672 -18.294 105 HA3 GLY 28 HA3 GLY 28 15.453 4.903 -19.367 106 H VAL 29 H VAL 29 12.634 2.997 -19.279 107 HA VAL 29 HA VAL 29 11.962 3.742 -21.942 108 HB VAL 29 HB VAL 29 10.800 1.829 -19.918 109 HG11 VAL 29 HG11 VAL 29 9.635 0.906 -22.076 110 HG12 VAL 29 HG12 VAL 29 8.899 2.254 -21.177 111 HG13 VAL 29 HG13 VAL 29 9.823 2.575 -22.664 112 HG21 VAL 29 HG21 VAL 29 12.182 0.279 -20.775 113 HG22 VAL 29 HG22 VAL 29 11.875 0.797 -22.450 114 HG23 VAL 29 HG23 VAL 29 13.081 1.654 -21.460 115 H LEU 30 H LEU 30 10.437 4.115 -18.683 116 HA LEU 30 HA LEU 30 8.451 5.866 -19.927 117 HB2 LEU 30 HB2 LEU 30 8.542 4.490 -17.240 118 HB3 LEU 30 HB3 LEU 30 7.306 5.639 -17.714 119 HG LEU 30 HG LEU 30 7.870 3.028 -19.147 120 HD11 LEU 30 HD11 LEU 30 6.849 2.071 -17.409 121 HD12 LEU 30 HD12 LEU 30 6.305 3.632 -16.750 122 HD13 LEU 30 HD13 LEU 30 5.359 2.826 -18.025 123 HD21 LEU 30 HD21 LEU 30 6.880 4.311 -20.774 124 HD22 LEU 30 HD22 LEU 30 5.450 3.596 -19.991 125 HD23 LEU 30 HD23 LEU 30 5.933 5.266 -19.608 126 H ALA 31 H ALA 31 7.782 7.693 -18.148 127 HA ALA 31 HA ALA 31 10.312 8.929 -17.304 128 HB1 ALA 31 HB1 ALA 31 9.833 10.289 -19.095 129 HB2 ALA 31 HB2 ALA 31 8.087 9.951 -19.027 130 HB3 ALA 31 HB3 ALA 31 8.819 11.090 -17.871 131 H ARG 32 H ARG 32 10.352 9.630 -15.205 132 HA ARG 32 HA ARG 32 7.762 9.718 -13.880 133 HB2 ARG 32 HB2 ARG 32 8.586 7.868 -12.765 134 HB3 ARG 32 HB3 ARG 32 10.250 8.232 -13.179 135 HG2 ARG 32 HG2 ARG 32 10.438 9.868 -11.402 136 HG3 ARG 32 HG3 ARG 32 8.707 9.877 -11.130 137 HD2 ARG 32 HD2 ARG 32 9.933 8.541 -9.399 138 HD3 ARG 32 HD3 ARG 32 8.764 7.574 -10.276 139 HE ARG 32 HE ARG 32 11.389 7.487 -11.532 140 HH11 ARG 32 HH22 ARG 32 9.452 6.132 -8.925 141 HH12 ARG 32 HH21 ARG 32 10.358 4.657 -8.847 142 HH21 ARG 32 HH12 ARG 32 12.584 5.542 -11.429 143 HH22 ARG 32 HH11 ARG 32 12.151 4.319 -10.281 144 H CYS 33 H CYS 33 7.470 11.438 -12.358 145 HA CYS 33 HA CYS 33 9.407 13.562 -12.656 146 HB2 CYS 33 HB2 CYS 33 6.983 14.013 -12.966 147 HB3 CYS 33 HB3 CYS 33 6.694 13.581 -11.292 148 H ARG 34 H ARG 34 10.706 14.328 -10.951 149 HA ARG 34 HA ARG 34 11.346 12.573 -8.958 150 HB2 ARG 34 HB2 ARG 34 12.930 14.282 -9.592 151 HB3 ARG 34 HB3 ARG 34 11.787 15.572 -9.274 152 HG2 ARG 34 HG2 ARG 34 12.470 13.762 -6.970 153 HG3 ARG 34 HG3 ARG 34 13.721 14.866 -7.508 154 HD2 ARG 34 HD2 ARG 34 10.945 15.985 -7.130 155 HD3 ARG 34 HD3 ARG 34 11.865 15.596 -5.690 156 HE ARG 34 HE ARG 34 12.390 17.782 -7.545 157 HH11 ARG 34 HH22 ARG 34 13.891 15.601 -5.226 158 HH12 ARG 34 HH21 ARG 34 15.215 16.665 -4.889 159 HH21 ARG 34 HH12 ARG 34 14.138 19.186 -7.101 160 HH22 ARG 34 HH11 ARG 34 15.357 18.718 -5.963 161 H ILE 35 H ILE 35 8.759 14.939 -9.183 162 HA ILE 35 HA ILE 35 8.340 14.937 -6.306 163 HB ILE 35 HB ILE 35 7.021 16.423 -8.578 164 HG12 ILE 35 HG12 ILE 35 8.092 18.313 -6.975 165 HG13 ILE 35 HG13 ILE 35 9.232 17.016 -6.678 166 HG21 ILE 35 HG21 ILE 35 5.883 17.724 -6.783 167 HG22 ILE 35 HG22 ILE 35 5.336 16.035 -6.913 168 HG23 ILE 35 HG23 ILE 35 6.445 16.513 -5.606 169 HD11 ILE 35 HD11 ILE 35 9.839 18.526 -8.627 170 HD12 ILE 35 HD12 ILE 35 9.739 16.798 -9.044 171 HD13 ILE 35 HD13 ILE 35 8.408 17.897 -9.479 172 H HIS 36 H HIS 36 7.389 13.242 -9.187 173 HA HIS 36 HA HIS 36 5.183 12.054 -7.668 174 HB2 HIS 36 HB2 HIS 36 5.220 12.045 -10.667 175 HB3 HIS 36 HB3 HIS 36 3.862 11.896 -9.570 176 HD1 HIS 36 HD1 HIS 36 4.167 14.431 -7.853 177 HD2 HIS 36 HD2 HIS 36 4.681 14.363 -12.016 178 HE1 HIS 36 HE1 HIS 36 3.776 16.819 -8.661 179 H ASN 37 H ASN 37 6.012 10.176 -6.856 180 HA ASN 37 HA ASN 37 7.830 8.702 -8.551 181 HB2 ASN 37 HB2 ASN 37 7.105 8.668 -5.608 182 HB3 ASN 37 HB3 ASN 37 7.788 7.213 -6.306 183 HD21 ASN 37 HD21 ASN 37 8.421 10.562 -7.244 184 HD22 ASN 37 HD22 ASN 37 10.100 10.609 -6.818 185 H ASP 38 H ASP 38 4.551 8.731 -7.199 186 HA ASP 38 HA ASP 38 4.125 5.964 -7.830 187 HB2 ASP 38 HB2 ASP 38 2.444 8.192 -6.633 188 HB3 ASP 38 HB3 ASP 38 1.679 6.706 -7.160 189 HD2 ASP 38 HD2 ASP 38 3.061 4.680 -4.898 190 H VAL 39 H VAL 39 4.490 8.647 -9.669 191 HA VAL 39 HA VAL 39 2.151 8.143 -11.365 192 HB VAL 39 HB VAL 39 4.003 10.495 -11.014 193 HG11 VAL 39 HG11 VAL 39 3.814 10.859 -13.227 194 HG12 VAL 39 HG12 VAL 39 2.494 9.678 -13.408 195 HG13 VAL 39 HG13 VAL 39 2.139 11.332 -12.855 196 HG21 VAL 39 HG21 VAL 39 2.293 10.661 -9.442 197 HG22 VAL 39 HG22 VAL 39 1.659 11.612 -10.806 198 HG23 VAL 39 HG23 VAL 39 1.078 9.952 -10.533 199 H ILE 40 H ILE 40 2.420 7.618 -13.570 200 HA ILE 40 HA ILE 40 5.192 7.036 -14.342 201 HB ILE 40 HB ILE 40 4.387 4.929 -13.848 202 HG12 ILE 40 HG12 ILE 40 5.195 5.370 -16.296 203 HG13 ILE 40 HG13 ILE 40 4.549 3.805 -15.844 204 HG21 ILE 40 HG21 ILE 40 2.205 4.846 -13.340 205 HG22 ILE 40 HG22 ILE 40 1.767 6.069 -14.557 206 HG23 ILE 40 HG23 ILE 40 1.997 4.372 -15.043 207 HD11 ILE 40 HD11 ILE 40 2.453 5.712 -16.699 208 HD12 ILE 40 HD12 ILE 40 3.650 5.351 -17.966 209 HD13 ILE 40 HD13 ILE 40 2.733 4.028 -17.206 210 H LEU 41 H LEU 41 5.805 8.057 -16.172 211 HA LEU 41 HA LEU 41 3.638 9.051 -17.889 212 HB2 LEU 41 HB2 LEU 41 6.385 10.250 -17.762 213 HB3 LEU 41 HB3 LEU 41 4.895 10.956 -18.357 214 HG LEU 41 HG LEU 41 5.254 10.275 -15.438 215 HD11 LEU 41 HD11 LEU 41 6.652 12.321 -16.950 216 HD12 LEU 41 HD12 LEU 41 5.626 13.028 -15.679 217 HD13 LEU 41 HD13 LEU 41 6.852 11.809 -15.257 218 HD21 LEU 41 HD21 LEU 41 3.406 11.602 -15.038 219 HD22 LEU 41 HD22 LEU 41 3.590 12.509 -16.559 220 HD23 LEU 41 HD23 LEU 41 2.986 10.835 -16.589 221 H ASP 42 H ASP 42 4.160 9.158 -20.238 222 HA ASP 42 HA ASP 42 5.614 6.765 -20.923 223 HB2 ASP 42 HB2 ASP 42 3.287 7.274 -21.815 224 HB3 ASP 42 HB3 ASP 42 3.965 8.633 -22.689 225 HD2 ASP 42 HD2 ASP 42 3.442 5.967 -24.853 226 H SER 43 H SER 43 7.530 6.820 -22.209 227 HA SER 43 HA SER 43 8.651 9.463 -22.537 228 HB2 SER 43 HB2 SER 43 9.838 7.405 -21.435 229 HB3 SER 43 HB3 SER 43 10.084 6.842 -23.076 230 HG SER 43 HG SER 43 11.240 9.057 -21.724 231 H GLY 44 H GLY 44 7.838 6.466 -24.379 232 HA2 GLY 44 HA2 GLY 44 6.953 6.594 -26.561 233 HA3 GLY 44 HA3 GLY 44 7.846 8.074 -26.844 234 H ASN 45 H ASN 45 9.244 5.193 -25.233 235 HA ASN 45 HA ASN 45 10.982 4.942 -27.558 236 HB2 ASN 45 HB2 ASN 45 11.867 5.527 -25.120 237 HB3 ASN 45 HB3 ASN 45 11.619 3.822 -24.801 238 HD21 ASN 45 HD21 ASN 45 12.810 5.758 -27.550 239 HD22 ASN 45 HD22 ASN 45 14.291 4.896 -27.799 240 H ASP 46 H ASP 46 12.004 2.474 -27.449 241 HA ASP 46 HA ASP 46 9.980 0.794 -28.142 242 HB2 ASP 46 HB2 ASP 46 11.675 -1.021 -27.957 243 HB3 ASP 46 HB3 ASP 46 12.327 0.399 -28.750 244 HD2 ASP 46 HD2 ASP 46 13.569 0.754 -25.113 245 H ALA 47 H ALA 47 8.301 0.251 -26.712 246 HA ALA 47 HA ALA 47 8.706 0.081 -23.915 247 HB1 ALA 47 HB1 ALA 47 6.392 -0.998 -25.568 248 HB2 ALA 47 HB2 ALA 47 6.369 -0.498 -23.860 249 HB3 ALA 47 HB3 ALA 47 6.580 0.720 -25.140 250 H SER 48 H SER 48 9.122 -2.113 -26.617 251 HA SER 48 HA SER 48 8.611 -4.515 -25.451 252 HB2 SER 48 HB2 SER 48 9.225 -4.141 -27.846 253 HB3 SER 48 HB3 SER 48 10.883 -3.832 -27.371 254 HG SER 48 HG SER 48 11.239 -5.937 -27.296 255 H SER 49 H SER 49 11.524 -2.409 -25.215 256 HA SER 49 HA SER 49 13.136 -4.240 -23.916 257 HB2 SER 49 HB2 SER 49 13.883 -2.077 -24.955 258 HB3 SER 49 HB3 SER 49 13.125 -1.201 -23.640 259 HG SER 49 HG SER 49 14.789 -3.182 -22.660 260 H ALA 50 H ALA 50 10.975 -1.616 -22.629 261 HA ALA 50 HA ALA 50 11.484 -1.947 -19.954 262 HB1 ALA 50 HB1 ALA 50 8.911 -1.231 -19.877 263 HB2 ALA 50 HB2 ALA 50 10.175 -0.106 -20.431 264 HB3 ALA 50 HB3 ALA 50 9.181 -0.983 -21.619 265 H TYR 51 H TYR 51 9.277 -3.788 -22.129 266 HA TYR 51 HA TYR 51 8.039 -5.295 -20.130 267 HB2 TYR 51 HB2 TYR 51 8.839 -6.055 -23.006 268 HB3 TYR 51 HB3 TYR 51 7.484 -6.723 -22.118 269 HD1 TYR 51 HD1 TYR 51 7.169 -3.556 -21.063 270 HD2 TYR 51 HD2 TYR 51 6.965 -5.707 -24.756 271 HE1 TYR 51 HE1 TYR 51 5.650 -1.762 -22.033 272 HE2 TYR 51 HE2 TYR 51 5.448 -3.906 -25.713 273 HH TYR 51 HH TYR 51 3.999 -1.537 -23.745 274 H LYS 52 H LYS 52 10.987 -5.930 -22.139 275 HA LYS 52 HA LYS 52 11.446 -8.498 -21.170 276 HB2 LYS 52 HB2 LYS 52 12.543 -7.846 -23.151 277 HB3 LYS 52 HB3 LYS 52 13.193 -6.387 -22.431 278 HG2 LYS 52 HG2 LYS 52 14.972 -8.072 -22.607 279 HG3 LYS 52 HG3 LYS 52 14.627 -7.766 -20.916 280 HD2 LYS 52 HD2 LYS 52 13.384 -9.816 -20.683 281 HD3 LYS 52 HD3 LYS 52 13.266 -10.037 -22.418 282 HE2 LYS 52 HE2 LYS 52 14.976 -11.556 -21.508 283 HE3 LYS 52 HE3 LYS 52 15.738 -10.373 -22.552 284 HZ1 LYS 52 HZ1 LYS 52 15.694 -10.390 -19.623 285 HZ2 LYS 52 HZ2 LYS 52 16.994 -10.458 -20.608 286 HZ3 LYS 52 HZ3 LYS 52 16.143 -9.071 -20.476 287 H LEU 53 H LEU 53 12.583 -5.265 -20.017 288 HA LEU 53 HA LEU 53 14.141 -6.331 -17.927 289 HB2 LEU 53 HB2 LEU 53 12.904 -3.587 -18.030 290 HB3 LEU 53 HB3 LEU 53 14.356 -4.088 -17.187 291 HG LEU 53 HG LEU 53 14.385 -4.487 -20.126 292 HD11 LEU 53 HD11 LEU 53 15.170 -1.841 -19.938 293 HD12 LEU 53 HD12 LEU 53 13.656 -2.447 -20.650 294 HD13 LEU 53 HD13 LEU 53 13.688 -1.905 -18.955 295 HD21 LEU 53 HD21 LEU 53 16.660 -4.038 -19.933 296 HD22 LEU 53 HD22 LEU 53 16.453 -3.100 -18.435 297 HD23 LEU 53 HD23 LEU 53 16.273 -4.871 -18.408 298 H GLY 54 H GLY 54 10.700 -5.473 -18.293 299 HA2 GLY 54 HA2 GLY 54 10.011 -5.428 -15.569 300 HA3 GLY 54 HA3 GLY 54 8.938 -5.729 -16.921 301 H THR 55 H THR 55 9.817 -8.080 -18.056 302 HA THR 55 HA THR 55 8.900 -9.998 -16.186 303 HB THR 55 HB THR 55 10.247 -10.305 -18.922 304 HG1 THR 55 HG1 THR 55 8.358 -9.013 -19.092 305 HG21 THR 55 HG21 THR 55 9.506 -12.494 -18.940 306 HG22 THR 55 HG22 THR 55 9.575 -12.338 -17.169 307 HG23 THR 55 HG23 THR 55 8.033 -12.095 -18.024 308 H TYR 56 H TYR 56 12.124 -8.905 -17.237 309 HA TYR 56 HA TYR 56 13.588 -11.070 -16.287 310 HB2 TYR 56 HB2 TYR 56 14.736 -9.433 -17.602 311 HB3 TYR 56 HB3 TYR 56 13.910 -8.099 -16.822 312 HD1 TYR 56 HD1 TYR 56 16.718 -10.478 -16.546 313 HD2 TYR 56 HD2 TYR 56 14.789 -7.080 -14.804 314 HE1 TYR 56 HE1 TYR 56 18.757 -10.061 -15.086 315 HE2 TYR 56 HE2 TYR 56 16.834 -6.674 -13.349 316 HH TYR 56 HH TYR 56 19.461 -8.988 -13.247 317 H LEU 57 H LEU 57 12.715 -7.945 -14.648 318 HA LEU 57 HA LEU 57 13.912 -8.754 -12.206 319 HB2 LEU 57 HB2 LEU 57 13.741 -6.430 -12.862 320 HB3 LEU 57 HB3 LEU 57 11.991 -6.528 -12.896 321 HG LEU 57 HG LEU 57 13.389 -7.184 -10.332 322 HD11 LEU 57 HD11 LEU 57 12.740 -4.351 -10.515 323 HD12 LEU 57 HD12 LEU 57 14.210 -5.157 -9.916 324 HD13 LEU 57 HD13 LEU 57 14.022 -4.827 -11.655 325 HD21 LEU 57 HD21 LEU 57 11.244 -5.629 -9.728 326 HD22 LEU 57 HD22 LEU 57 10.697 -6.388 -11.242 327 HD23 LEU 57 HD23 LEU 57 11.202 -7.402 -9.869 328 H TYR 58 H TYR 58 10.510 -8.569 -13.436 329 HA TYR 58 HA TYR 58 9.157 -9.308 -11.206 330 HB2 TYR 58 HB2 TYR 58 8.997 -9.786 -14.200 331 HB3 TYR 58 HB3 TYR 58 7.877 -10.702 -13.213 332 HD1 TYR 58 HD1 TYR 58 7.216 -8.716 -11.087 333 HD2 TYR 58 HD2 TYR 58 7.650 -8.224 -15.314 334 HE1 TYR 58 HE1 TYR 58 5.647 -6.717 -11.022 335 HE2 TYR 58 HE2 TYR 58 6.079 -6.227 -15.236 336 HH TYR 58 HH TYR 58 5.048 -4.863 -12.209 337 H GLN 59 H GLN 59 10.973 -11.444 -13.478 338 HA GLN 59 HA GLN 59 11.273 -13.627 -13.457 339 HB2 GLN 59 HB2 GLN 59 12.906 -12.521 -11.748 340 HB3 GLN 59 HB3 GLN 59 11.929 -13.287 -10.512 341 HG2 GLN 59 HG2 GLN 59 12.313 -15.515 -11.600 342 HG3 GLN 59 HG3 GLN 59 13.306 -14.742 -12.820 343 HE21 GLN 59 HE21 GLN 59 15.344 -14.044 -12.358 344 HE22 GLN 59 HE22 GLN 59 16.191 -14.409 -10.891 345 H LYS 60 H LYS 60 8.480 -12.876 -12.861 346 HA LYS 60 HA LYS 60 7.296 -14.073 -10.759 347 HB2 LYS 60 HB2 LYS 60 5.311 -14.109 -12.031 348 HB3 LYS 60 HB3 LYS 60 6.243 -12.760 -12.648 349 HG2 LYS 60 HG2 LYS 60 6.354 -15.529 -13.919 350 HG3 LYS 60 HG3 LYS 60 5.174 -14.328 -14.401 351 HD2 LYS 60 HD2 LYS 60 7.459 -12.814 -14.518 352 HD3 LYS 60 HD3 LYS 60 8.126 -14.392 -14.886 353 HE2 LYS 60 HE2 LYS 60 7.510 -13.755 -17.032 354 HE3 LYS 60 HE3 LYS 60 6.017 -14.531 -16.543 355 HZ1 LYS 60 HZ1 LYS 60 4.976 -12.567 -16.377 356 HZ2 LYS 60 HZ2 LYS 60 6.287 -11.745 -15.853 357 HZ3 LYS 60 HZ3 LYS 60 6.113 -12.078 -17.442 358 H ASP 61 H ASP 61 8.944 -15.628 -13.481 359 HA ASP 61 HA ASP 61 8.376 -18.163 -12.169 360 HB2 ASP 61 HB2 ASP 61 7.886 -19.242 -14.186 361 HB3 ASP 61 HB3 ASP 61 7.165 -17.669 -14.461 362 HD2 ASP 61 HD2 ASP 61 9.082 -16.399 -16.536 363 H ASN 62 H ASN 62 10.203 -19.658 -12.221 364 HA ASN 62 HA ASN 62 12.665 -18.351 -13.059 365 HB2 ASN 62 HB2 ASN 62 13.801 -19.623 -11.350 366 HB3 ASN 62 HB3 ASN 62 12.328 -19.045 -10.596 367 HD21 ASN 62 HD21 ASN 62 14.239 -21.548 -10.596 368 HD22 ASN 62 HD22 ASN 62 13.150 -22.885 -10.437 369 H SER 63 H SER 63 10.413 -20.921 -13.666 370 HA SER 63 HA SER 63 12.341 -22.130 -15.470 371 HB2 SER 63 HB2 SER 63 12.070 -23.531 -13.371 372 HB3 SER 63 HB3 SER 63 10.375 -23.727 -13.772 373 HG SER 63 HG SER 63 12.535 -25.104 -14.734 374 H CYS 64 H CYS 64 11.339 -23.127 -17.386 375 HA CYS 64 HA CYS 64 9.168 -21.668 -18.333 376 HB2 CYS 64 HB2 CYS 64 10.631 -24.112 -19.320 377 HB3 CYS 64 HB3 CYS 64 9.192 -23.548 -20.145 378 HG CYS 64 HG CYS 64 11.002 -22.506 -21.528 379 H ASN 65 H ASN 65 7.045 -21.877 -17.717 380 HA ASN 65 HA ASN 65 6.066 -24.567 -17.308 381 HB2 ASN 65 HB2 ASN 65 6.701 -23.288 -15.071 382 HB3 ASN 65 HB3 ASN 65 5.251 -22.355 -15.382 383 HD21 ASN 65 HD21 ASN 65 6.032 -24.369 -13.310 384 HD22 ASN 65 HD22 ASN 65 4.760 -25.545 -13.281 385 H LEU 66 H LEU 66 3.662 -24.660 -17.588 386 HA LEU 66 HA LEU 66 2.746 -22.506 -19.303 387 HB2 LEU 66 HB2 LEU 66 1.193 -24.001 -20.144 388 HB3 LEU 66 HB3 LEU 66 2.632 -24.967 -19.884 389 HG LEU 66 HG LEU 66 0.504 -24.885 -17.764 390 HD11 LEU 66 HD11 LEU 66 0.247 -26.061 -20.469 391 HD12 LEU 66 HD12 LEU 66 -0.197 -27.121 -19.109 392 HD13 LEU 66 HD13 LEU 66 -1.000 -25.545 -19.308 393 HD21 LEU 66 HD21 LEU 66 2.380 -26.023 -17.001 394 HD22 LEU 66 HD22 LEU 66 1.333 -27.332 -17.601 395 HD23 LEU 66 HD23 LEU 66 2.705 -26.766 -18.585 396 H PHE 67 H PHE 67 3.010 -22.665 -16.125 397 HA PHE 67 HA PHE 67 0.247 -22.142 -15.437 398 HB2 PHE 67 HB2 PHE 67 1.832 -23.482 -13.986 399 HB3 PHE 67 HB3 PHE 67 2.917 -22.109 -13.904 400 HD1 PHE 67 HD1 PHE 67 -0.766 -22.541 -13.400 401 HD2 PHE 67 HD2 PHE 67 2.920 -21.161 -11.813 402 HE1 PHE 67 HE1 PHE 67 -1.956 -21.724 -11.347 403 HE2 PHE 67 HE2 PHE 67 1.729 -20.343 -9.760 404 HZ PHE 67 HZ PHE 67 -0.694 -20.634 -9.551 405 H ASN 68 H ASN 68 3.445 -20.438 -15.056 406 HA ASN 68 HA ASN 68 2.159 -18.012 -14.456 407 HB2 ASN 68 HB2 ASN 68 4.490 -17.057 -14.682 408 HB3 ASN 68 HB3 ASN 68 4.432 -18.460 -13.633 409 HD21 ASN 68 HD21 ASN 68 5.561 -17.113 -16.591 410 HD22 ASN 68 HD22 ASN 68 6.546 -18.431 -17.131 411 H THR 69 H THR 69 1.655 -16.276 -15.878 412 HA THR 69 HA THR 69 2.297 -16.734 -18.718 413 HB THR 69 HB THR 69 -0.087 -15.134 -17.736 414 HG1 THR 69 HG1 THR 69 -1.172 -17.211 -17.577 415 HG21 THR 69 HG21 THR 69 -0.968 -16.683 -19.777 416 HG22 THR 69 HG22 THR 69 -0.157 -15.127 -20.075 417 HG23 THR 69 HG23 THR 69 0.760 -16.647 -20.204 418 H LEU 70 H LEU 70 3.566 -15.287 -19.691 419 HA LEU 70 HA LEU 70 4.562 -13.099 -18.207 420 HB2 LEU 70 HB2 LEU 70 6.148 -13.814 -19.623 421 HB3 LEU 70 HB3 LEU 70 5.000 -14.357 -20.831 422 HG LEU 70 HG LEU 70 4.690 -12.030 -21.593 423 HD11 LEU 70 HD11 LEU 70 5.500 -10.207 -20.567 424 HD12 LEU 70 HD12 LEU 70 5.620 -11.273 -19.146 425 HD13 LEU 70 HD13 LEU 70 7.049 -10.988 -20.168 426 HD21 LEU 70 HD21 LEU 70 6.598 -13.694 -22.336 427 HD22 LEU 70 HD22 LEU 70 6.536 -12.024 -22.947 428 HD23 LEU 70 HD23 LEU 70 7.651 -12.447 -21.626 429 H THR 71 H THR 71 1.741 -13.606 -20.185 430 HA THR 71 HA THR 71 1.354 -11.078 -21.255 431 HB THR 71 HB THR 71 -0.643 -13.145 -20.190 432 HG1 THR 71 HG1 THR 71 -0.344 -13.949 -22.331 433 HG21 THR 71 HG21 THR 71 -2.323 -11.978 -21.242 434 HG22 THR 71 HG22 THR 71 -1.230 -10.578 -21.131 435 HG23 THR 71 HG23 THR 71 -1.273 -11.557 -22.617 436 H GLU 72 H GLU 72 1.004 -12.239 -17.918 437 HA GLU 72 HA GLU 72 -0.605 -10.194 -17.005 438 HB2 GLU 72 HB2 GLU 72 1.461 -11.976 -15.681 439 HB3 GLU 72 HB3 GLU 72 0.627 -10.744 -14.756 440 HG2 GLU 72 HG2 GLU 72 -1.554 -11.720 -15.287 441 HG3 GLU 72 HG3 GLU 72 -0.833 -12.838 -16.429 442 HE2 GLU 72 HE2 GLU 72 0.004 -13.533 -12.546 443 H ALA 73 H ALA 73 3.011 -10.483 -17.104 444 HA ALA 73 HA ALA 73 3.494 -7.970 -15.959 445 HB1 ALA 73 HB1 ALA 73 5.222 -9.576 -17.883 446 HB2 ALA 73 HB2 ALA 73 5.774 -8.335 -16.733 447 HB3 ALA 73 HB3 ALA 73 5.110 -9.874 -16.132 448 H ARG 74 H ARG 74 3.410 -9.093 -19.412 449 HA ARG 74 HA ARG 74 4.000 -6.680 -20.528 450 HB2 ARG 74 HB2 ARG 74 3.609 -9.091 -21.567 451 HB3 ARG 74 HB3 ARG 74 1.961 -8.542 -21.797 452 HG2 ARG 74 HG2 ARG 74 2.582 -7.397 -23.650 453 HG3 ARG 74 HG3 ARG 74 3.682 -6.422 -22.695 454 HD2 ARG 74 HD2 ARG 74 4.279 -9.040 -24.132 455 HD3 ARG 74 HD3 ARG 74 5.035 -7.479 -24.383 456 HE ARG 74 HE ARG 74 5.433 -8.271 -21.653 457 HH11 ARG 74 HH22 ARG 74 6.490 -9.101 -24.905 458 HH12 ARG 74 HH21 ARG 74 8.026 -9.713 -24.387 459 HH21 ARG 74 HH12 ARG 74 7.458 -9.079 -20.969 460 HH22 ARG 74 HH11 ARG 74 8.580 -9.701 -22.134 461 H ASP 75 H ASP 75 0.927 -7.956 -19.223 462 HA ASP 75 HA ASP 75 -0.661 -5.934 -20.379 463 HB2 ASP 75 HB2 ASP 75 -1.712 -8.017 -19.747 464 HB3 ASP 75 HB3 ASP 75 -1.069 -7.932 -18.119 465 HD2 ASP 75 HD2 ASP 75 -3.618 -5.931 -16.946 466 H ALA 76 H ALA 76 1.275 -6.385 -17.430 467 HA ALA 76 HA ALA 76 0.061 -4.424 -15.832 468 HB1 ALA 76 HB1 ALA 76 1.584 -5.173 -14.347 469 HB2 ALA 76 HB2 ALA 76 2.087 -6.331 -15.602 470 HB3 ALA 76 HB3 ALA 76 2.942 -4.780 -15.428 471 H ILE 77 H ILE 77 2.966 -4.341 -18.010 472 HA ILE 77 HA ILE 77 3.270 -1.529 -17.631 473 HB ILE 77 HB ILE 77 4.964 -1.807 -19.459 474 HG12 ILE 77 HG12 ILE 77 3.585 -4.298 -19.810 475 HG13 ILE 77 HG13 ILE 77 4.853 -3.585 -20.787 476 HG21 ILE 77 HG21 ILE 77 6.573 -2.844 -18.037 477 HG22 ILE 77 HG22 ILE 77 5.428 -1.962 -16.998 478 HG23 ILE 77 HG23 ILE 77 5.310 -3.732 -17.150 479 HD11 ILE 77 HD11 ILE 77 5.656 -5.733 -19.998 480 HD12 ILE 77 HD12 ILE 77 6.551 -4.474 -19.112 481 HD13 ILE 77 HD13 ILE 77 5.213 -5.340 -18.319 482 H LYS 78 H LYS 78 1.680 -3.702 -19.977 483 HA LYS 78 HA LYS 78 1.230 -1.685 -21.909 484 HB2 LYS 78 HB2 LYS 78 1.272 -4.045 -22.496 485 HB3 LYS 78 HB3 LYS 78 -0.086 -4.376 -21.439 486 HG2 LYS 78 HG2 LYS 78 -0.422 -2.249 -23.556 487 HG3 LYS 78 HG3 LYS 78 -0.430 -3.926 -24.065 488 HD2 LYS 78 HD2 LYS 78 -2.131 -3.181 -21.690 489 HD3 LYS 78 HD3 LYS 78 -2.678 -2.667 -23.273 490 HE2 LYS 78 HE2 LYS 78 -2.283 -5.137 -24.019 491 HE3 LYS 78 HE3 LYS 78 -2.171 -5.510 -22.310 492 HZ1 LYS 78 HZ1 LYS 78 -4.437 -3.940 -23.214 493 HZ2 LYS 78 HZ2 LYS 78 -4.435 -5.541 -23.535 494 HZ3 LYS 78 HZ3 LYS 78 -4.345 -5.018 -21.991 495 H ASP 79 H ASP 79 -0.340 -2.678 -18.899 496 HA ASP 79 HA ASP 79 -2.790 -1.420 -19.506 497 HB2 ASP 79 HB2 ASP 79 -2.811 -3.155 -17.845 498 HB3 ASP 79 HB3 ASP 79 -1.471 -2.445 -16.967 499 HD2 ASP 79 HD2 ASP 79 -4.977 -1.557 -17.554 500 H ALA 80 H ALA 80 0.120 -0.657 -17.459 501 HA ALA 80 HA ALA 80 -0.801 1.836 -16.567 502 HB1 ALA 80 HB1 ALA 80 1.599 2.167 -15.969 503 HB2 ALA 80 HB2 ALA 80 0.977 0.582 -15.450 504 HB3 ALA 80 HB3 ALA 80 2.008 0.704 -16.896 505 H TYR 81 H TYR 81 1.324 0.850 -19.332 506 HA TYR 81 HA TYR 81 1.917 3.394 -20.241 507 HB2 TYR 81 HB2 TYR 81 1.509 0.604 -21.435 508 HB3 TYR 81 HB3 TYR 81 1.921 1.930 -22.503 509 HD1 TYR 81 HD1 TYR 81 3.172 1.251 -19.042 510 HD2 TYR 81 HD2 TYR 81 4.102 1.444 -23.214 511 HE1 TYR 81 HE1 TYR 81 5.637 0.915 -18.516 512 HE2 TYR 81 HE2 TYR 81 6.564 1.108 -22.673 513 HH TYR 81 HH TYR 81 7.614 0.535 -19.337 514 H GLU 82 H GLU 82 -0.828 1.198 -21.141 515 HA GLU 82 HA GLU 82 -1.893 3.140 -22.902 516 HB2 GLU 82 HB2 GLU 82 -2.207 0.689 -23.222 517 HB3 GLU 82 HB3 GLU 82 -3.147 0.610 -21.745 518 HG2 GLU 82 HG2 GLU 82 -4.782 2.264 -22.745 519 HG3 GLU 82 HG3 GLU 82 -3.867 2.223 -24.239 520 HE2 GLU 82 HE2 GLU 82 -3.923 0.351 -25.403 521 H SER 83 H SER 83 -2.077 2.477 -19.469 522 HA SER 83 HA SER 83 -4.595 3.749 -19.127 523 HB2 SER 83 HB2 SER 83 -3.969 2.041 -17.538 524 HB3 SER 83 HB3 SER 83 -2.430 2.811 -17.206 525 HG SER 83 HG SER 83 -5.033 3.481 -16.277 526 H TYR 84 H TYR 84 -1.187 4.670 -19.256 527 HA TYR 84 HA TYR 84 -1.919 7.376 -18.360 528 HB2 TYR 84 HB2 TYR 84 0.571 5.595 -18.298 529 HB3 TYR 84 HB3 TYR 84 0.769 7.334 -18.203 530 HD1 TYR 84 HD2 TYR 84 -0.393 8.586 -16.290 531 HD2 TYR 84 HD1 TYR 84 0.016 4.328 -16.378 532 HE1 TYR 84 HE2 TYR 84 -0.801 8.488 -13.783 533 HE2 TYR 84 HE1 TYR 84 -0.393 4.245 -13.870 534 HH TYR 84 HH TYR 84 -1.542 5.644 -12.188 535 H CYS 85 H CYS 85 -1.513 5.548 -21.113 536 HA CYS 85 HA CYS 85 0.304 6.762 -22.686 537 HB2 CYS 85 HB2 CYS 85 -1.102 6.152 -24.602 538 HB3 CYS 85 HB3 CYS 85 -1.039 4.861 -23.418 539 HG CYS 85 HG CYS 85 -3.456 6.273 -24.712 540 H GLY 86 H GLY 86 0.404 8.698 -23.934 541 HA2 GLY 86 HA2 GLY 86 -0.536 10.640 -24.851 542 HA3 GLY 86 HA3 GLY 86 -1.845 10.571 -23.688 543 H ILE 87 H ILE 87 -0.039 9.965 -21.368 544 HA ILE 87 HA ILE 87 0.679 12.700 -20.828 545 HB ILE 87 HB ILE 87 1.012 10.287 -19.053 546 HG12 ILE 87 HG12 ILE 87 -1.451 12.026 -19.380 547 HG13 ILE 87 HG13 ILE 87 -1.296 10.370 -19.931 548 HG21 ILE 87 HG21 ILE 87 2.001 12.716 -18.626 549 HG22 ILE 87 HG22 ILE 87 0.340 13.017 -18.060 550 HG23 ILE 87 HG23 ILE 87 1.314 11.727 -17.315 551 HD11 ILE 87 HD11 ILE 87 -1.734 9.557 -17.860 552 HD12 ILE 87 HD12 ILE 87 -0.490 10.597 -17.126 553 HD13 ILE 87 HD13 ILE 87 -2.137 11.223 -17.378 554 H ASP 88 H ASP 88 2.457 13.253 -22.094 555 HA ASP 88 HA ASP 88 4.662 11.467 -22.232 556 HB2 ASP 88 HB2 ASP 88 5.685 13.170 -23.630 557 HB3 ASP 88 HB3 ASP 88 3.995 13.047 -24.079 558 HD2 ASP 88 HD2 ASP 88 5.584 15.860 -24.261 559 H ASP 89 H ASP 89 3.685 14.458 -20.495 560 HA ASP 89 HA ASP 89 5.731 13.977 -18.572 561 HB2 ASP 89 HB2 ASP 89 5.690 16.531 -20.243 562 HB3 ASP 89 HB3 ASP 89 6.555 16.397 -18.725 563 HD2 ASP 89 HD2 ASP 89 7.562 16.919 -21.269 564 H CYS 90 H CYS 90 4.988 14.752 -16.538 565 HA CYS 90 HA CYS 90 2.359 15.400 -16.214 566 HB2 CYS 90 HB2 CYS 90 2.971 16.093 -13.924 567 HB3 CYS 90 HB3 CYS 90 3.715 14.574 -14.383 568 HA PRO 91 HA PRO 91 2.633 19.562 -17.703 569 HB2 PRO 91 HB2 PRO 91 -0.049 19.962 -18.044 570 HB3 PRO 91 HB3 PRO 91 0.978 19.253 -19.274 571 HG2 PRO 91 HG2 PRO 91 -0.980 17.924 -17.502 572 HG3 PRO 91 HG3 PRO 91 -0.271 17.334 -18.992 573 HD2 PRO 91 HD2 PRO 91 0.436 16.547 -16.326 574 HD3 PRO 91 HD3 PRO 91 1.221 16.046 -17.809 575 H GLN 92 H GLN 92 1.231 18.329 -14.899 576 HA GLN 92 HA GLN 92 0.164 20.679 -13.890 577 HB2 GLN 92 HB2 GLN 92 1.168 18.101 -12.672 578 HB3 GLN 92 HB3 GLN 92 0.719 19.426 -11.618 579 HG2 GLN 92 HG2 GLN 92 -1.339 18.354 -11.801 580 HG3 GLN 92 HG3 GLN 92 -1.480 19.495 -13.124 581 HE21 GLN 92 HE21 GLN 92 -2.161 18.701 -14.950 582 HE22 GLN 92 HE22 GLN 92 -1.961 17.084 -15.539 583 H CYS 93 H CYS 93 3.484 19.353 -13.958 584 HA CYS 93 HA CYS 93 4.541 21.134 -12.060 585 HB2 CYS 93 HB2 CYS 93 5.625 19.197 -14.041 586 HB3 CYS 93 HB3 CYS 93 6.708 20.485 -13.552 587 H SER 94 H SER 94 4.048 21.164 -15.624 588 HA SER 94 HA SER 94 5.544 23.488 -16.058 589 HB2 SER 94 HB2 SER 94 5.055 21.930 -17.877 590 HB3 SER 94 HB3 SER 94 3.329 22.154 -17.671 591 HG SER 94 HG SER 94 5.012 23.579 -19.228 592 H LYS 95 H LYS 95 2.221 22.811 -15.013 593 HA LYS 95 HA LYS 95 1.396 25.548 -15.475 594 HB2 LYS 95 HB2 LYS 95 0.063 22.983 -14.723 595 HB3 LYS 95 HB3 LYS 95 -0.693 24.473 -14.196 596 HG2 LYS 95 HG2 LYS 95 -1.645 24.060 -16.340 597 HG3 LYS 95 HG3 LYS 95 -0.445 25.303 -16.634 598 HD2 LYS 95 HD2 LYS 95 1.169 23.225 -17.076 599 HD3 LYS 95 HD3 LYS 95 -0.334 22.360 -17.329 600 HE2 LYS 95 HE2 LYS 95 0.294 24.984 -18.752 601 HE3 LYS 95 HE3 LYS 95 0.743 23.427 -19.418 602 HZ1 LYS 95 HZ1 LYS 95 -1.870 23.171 -18.693 603 HZ2 LYS 95 HZ2 LYS 95 -1.785 24.656 -19.367 604 HZ3 LYS 95 HZ3 LYS 95 -1.295 23.347 -20.212 605 H TYR 96 H TYR 96 2.949 23.628 -13.040 606 HA TYR 96 HA TYR 96 2.084 25.401 -10.899 607 HB2 TYR 96 HB2 TYR 96 3.614 22.795 -11.307 608 HB3 TYR 96 HB3 TYR 96 3.898 23.672 -9.817 609 HD1 TYR 96 HD2 TYR 96 1.184 24.712 -9.198 610 HD2 TYR 96 HD1 TYR 96 2.416 20.888 -10.671 611 HE1 TYR 96 HE2 TYR 96 -0.888 23.645 -8.182 612 HE2 TYR 96 HE1 TYR 96 0.340 19.834 -9.649 613 HH TYR 96 HH TYR 96 -1.984 21.822 -7.834 614 H ILE 97 H ILE 97 3.137 27.308 -10.655 615 HA ILE 97 HA ILE 97 5.813 27.576 -11.691 616 HB ILE 97 HB ILE 97 4.043 29.563 -10.263 617 HG12 ILE 97 HG12 ILE 97 4.470 29.502 -13.236 618 HG13 ILE 97 HG13 ILE 97 3.270 28.447 -12.516 619 HG21 ILE 97 HG21 ILE 97 5.517 31.230 -11.404 620 HG22 ILE 97 HG22 ILE 97 6.325 30.270 -10.142 621 HG23 ILE 97 HG23 ILE 97 6.594 29.889 -11.860 622 HD11 ILE 97 HD11 ILE 97 3.347 31.464 -12.593 623 HD12 ILE 97 HD12 ILE 97 1.990 30.360 -12.925 624 HD13 ILE 97 HD13 ILE 97 2.505 30.659 -11.247 625 H ASP 98 H ASP 98 7.516 28.672 -10.262 626 HA ASP 98 HA ASP 98 7.569 27.159 -7.805 627 HB2 ASP 98 HB2 ASP 98 9.785 28.910 -8.945 628 HB3 ASP 98 HB3 ASP 98 9.951 27.599 -7.795 629 HD2 ASP 98 HD2 ASP 98 10.952 25.837 -8.970 630 H ASP 99 H ASP 99 6.504 28.327 -6.163 631 HA ASP 99 HA ASP 99 6.460 31.131 -6.158 632 HB2 ASP 99 HB2 ASP 99 5.540 30.747 -3.776 633 HB3 ASP 99 HB3 ASP 99 4.627 30.048 -5.098 634 HD2 ASP 99 HD2 ASP 99 6.586 27.554 -2.633 Start of MODEL 3 1 H GLU 14 H GLU 14 -2.727 -5.609 -5.722 2 HA GLU 14 HA GLU 14 -2.237 -4.764 -8.315 3 HB2 GLU 14 HB2 GLU 14 -3.759 -3.469 -6.016 4 HB3 GLU 14 HB3 GLU 14 -3.767 -2.823 -7.645 5 HG2 GLU 14 HG2 GLU 14 -4.439 -5.745 -7.221 6 HG3 GLU 14 HG3 GLU 14 -5.653 -4.532 -6.862 7 HE2 GLU 14 HE2 GLU 14 -4.597 -5.462 -10.555 8 H ASP 15 H ASP 15 -1.235 -3.456 -5.106 9 HA ASP 15 HA ASP 15 -0.025 -1.181 -6.261 10 HB2 ASP 15 HB2 ASP 15 0.194 -2.500 -3.519 11 HB3 ASP 15 HB3 ASP 15 1.030 -1.012 -3.917 12 HD2 ASP 15 HD2 ASP 15 -2.005 -0.248 -5.294 13 H GLN 16 H GLN 16 0.872 -4.524 -5.470 14 HA GLN 16 HA GLN 16 3.596 -4.242 -5.240 15 HB2 GLN 16 HB2 GLN 16 1.895 -6.544 -6.280 16 HB3 GLN 16 HB3 GLN 16 3.621 -6.688 -6.013 17 HG2 GLN 16 HG2 GLN 16 3.426 -6.481 -3.677 18 HG3 GLN 16 HG3 GLN 16 1.921 -5.589 -3.772 19 HE21 GLN 16 HE21 GLN 16 3.355 -8.543 -3.195 20 HE22 GLN 16 HE22 GLN 16 1.974 -9.587 -3.273 21 H GLU 17 H GLU 17 1.473 -4.438 -8.117 22 HA GLU 17 HA GLU 17 3.310 -5.003 -10.028 23 HB2 GLU 17 HB2 GLU 17 0.782 -3.353 -9.991 24 HB3 GLU 17 HB3 GLU 17 1.753 -3.371 -11.450 25 HG2 GLU 17 HG2 GLU 17 -0.080 -5.153 -11.330 26 HG3 GLU 17 HG3 GLU 17 1.523 -5.749 -11.713 27 HE2 GLU 17 HE2 GLU 17 -0.525 -6.865 -8.620 28 H GLN 18 H GLN 18 2.627 -1.871 -8.400 29 HA GLN 18 HA GLN 18 4.152 -0.301 -10.094 30 HB2 GLN 18 HB2 GLN 18 2.781 0.960 -8.711 31 HB3 GLN 18 HB3 GLN 18 3.059 -0.058 -7.312 32 HG2 GLN 18 HG2 GLN 18 5.344 0.871 -7.049 33 HG3 GLN 18 HG3 GLN 18 5.145 1.831 -8.502 34 HE21 GLN 18 HE21 GLN 18 5.806 2.966 -6.100 35 HE22 GLN 18 HE22 GLN 18 4.513 3.955 -5.508 36 H TRP 19 H TRP 19 5.006 -2.458 -7.402 37 HA TRP 19 HA TRP 19 7.544 -1.429 -6.848 38 HB2 TRP 19 HB2 TRP 19 6.138 -3.102 -5.533 39 HB3 TRP 19 HB3 TRP 19 6.737 -4.326 -6.636 40 HD1 TRP 19 HD1 TRP 19 8.187 -1.764 -4.076 41 HE1 TRP 19 HE1 TRP 19 10.444 -2.661 -3.042 42 HE3 TRP 19 HE3 TRP 19 8.470 -5.933 -6.974 43 HZ2 TRP 19 HZ2 TRP 19 12.057 -4.961 -3.541 44 HZ3 TRP 19 HZ3 TRP 19 10.418 -7.451 -6.637 45 HH2 TRP 19 HH2 TRP 19 12.173 -7.021 -4.991 46 H ALA 20 H ALA 20 6.243 -3.653 -9.344 47 HA ALA 20 HA ALA 20 8.786 -4.482 -10.285 48 HB1 ALA 20 HB1 ALA 20 6.026 -4.494 -11.574 49 HB2 ALA 20 HB2 ALA 20 7.451 -5.374 -12.178 50 HB3 ALA 20 HB3 ALA 20 6.741 -5.804 -10.604 51 H MET 21 H MET 21 6.378 -1.973 -11.288 52 HA MET 21 HA MET 21 7.588 -1.138 -13.562 53 HB2 MET 21 HB2 MET 21 6.168 0.474 -11.371 54 HB3 MET 21 HB3 MET 21 6.513 1.124 -12.961 55 HG2 MET 21 HG2 MET 21 5.086 -0.524 -14.044 56 HG3 MET 21 HG3 MET 21 4.929 -1.454 -12.567 57 HE1 MET 21 HE1 MET 21 3.614 1.394 -14.716 58 HE2 MET 21 HE2 MET 21 2.906 2.546 -13.559 59 HE3 MET 21 HE3 MET 21 4.671 2.335 -13.637 60 H GLN 22 H GLN 22 8.689 -0.771 -10.245 61 HA GLN 22 HA GLN 22 10.114 1.481 -10.246 62 HB2 GLN 22 HB2 GLN 22 9.913 -0.414 -8.471 63 HB3 GLN 22 HB3 GLN 22 11.329 -1.112 -9.231 64 HG2 GLN 22 HG2 GLN 22 12.738 0.607 -8.529 65 HG3 GLN 22 HG3 GLN 22 11.468 1.814 -8.559 66 HE21 GLN 22 HE21 GLN 22 11.502 -1.392 -7.043 67 HE22 GLN 22 HE22 GLN 22 11.296 -0.870 -5.404 68 H THR 23 H THR 23 11.740 -1.677 -11.035 69 HA THR 23 HA THR 23 13.828 -0.298 -12.427 70 HB THR 23 HB THR 23 14.150 -2.380 -11.054 71 HG1 THR 23 HG1 THR 23 14.488 -2.598 -13.964 72 HG21 THR 23 HG21 THR 23 11.987 -3.531 -11.786 73 HG22 THR 23 HG22 THR 23 12.731 -3.763 -13.386 74 HG23 THR 23 HG23 THR 23 13.441 -4.544 -11.953 75 H LEU 24 H LEU 24 11.140 -2.515 -13.423 76 HA LEU 24 HA LEU 24 11.583 -2.720 -16.045 77 HB2 LEU 24 HB2 LEU 24 9.706 -3.710 -14.870 78 HB3 LEU 24 HB3 LEU 24 8.950 -2.140 -14.683 79 HG LEU 24 HG LEU 24 9.563 -3.110 -17.451 80 HD11 LEU 24 HD11 LEU 24 6.966 -3.914 -16.190 81 HD12 LEU 24 HD12 LEU 24 7.806 -4.586 -17.608 82 HD13 LEU 24 HD13 LEU 24 8.406 -4.936 -15.969 83 HD21 LEU 24 HD21 LEU 24 7.715 -1.763 -18.083 84 HD22 LEU 24 HD22 LEU 24 7.166 -1.597 -16.399 85 HD23 LEU 24 HD23 LEU 24 8.672 -0.808 -16.925 86 H MET 25 H MET 25 9.695 0.047 -14.621 87 HA MET 25 HA MET 25 9.825 1.462 -17.048 88 HB2 MET 25 HB2 MET 25 8.276 2.784 -15.960 89 HB3 MET 25 HB3 MET 25 8.342 1.583 -14.686 90 HG2 MET 25 HG2 MET 25 10.270 2.896 -13.647 91 HG3 MET 25 HG3 MET 25 10.005 4.142 -14.851 92 HE1 MET 25 HE1 MET 25 7.423 4.586 -15.465 93 HE2 MET 25 HE2 MET 25 6.412 3.345 -14.688 94 HE3 MET 25 HE3 MET 25 6.256 5.051 -14.204 95 H GLY 26 H GLY 26 11.807 1.332 -14.091 96 HA2 GLY 26 HA2 GLY 26 13.196 3.754 -14.391 97 HA3 GLY 26 HA3 GLY 26 13.735 2.334 -13.517 98 H SER 27 H SER 27 13.159 0.935 -16.384 99 HA SER 27 HA SER 27 15.844 0.795 -17.062 100 HB2 SER 27 HB2 SER 27 13.437 0.135 -18.817 101 HB3 SER 27 HB3 SER 27 15.065 -0.479 -19.026 102 HG SER 27 HG SER 27 14.213 -2.107 -17.863 103 H GLY 28 H GLY 28 13.598 3.303 -17.527 104 HA2 GLY 28 HA2 GLY 28 14.225 5.350 -18.470 105 HA3 GLY 28 HA3 GLY 28 15.320 4.528 -19.564 106 H VAL 29 H VAL 29 12.453 2.709 -19.382 107 HA VAL 29 HA VAL 29 11.725 3.462 -22.030 108 HB VAL 29 HB VAL 29 10.694 1.535 -19.964 109 HG11 VAL 29 HG11 VAL 29 9.458 2.123 -22.675 110 HG12 VAL 29 HG12 VAL 29 9.077 0.709 -21.664 111 HG13 VAL 29 HG13 VAL 29 8.700 2.347 -21.080 112 HG21 VAL 29 HG21 VAL 29 12.356 0.358 -20.922 113 HG22 VAL 29 HG22 VAL 29 11.220 0.149 -22.276 114 HG23 VAL 29 HG23 VAL 29 12.444 1.441 -22.332 115 H LEU 30 H LEU 30 10.308 3.876 -18.728 116 HA LEU 30 HA LEU 30 8.335 5.680 -19.920 117 HB2 LEU 30 HB2 LEU 30 8.417 4.395 -17.186 118 HB3 LEU 30 HB3 LEU 30 7.143 5.434 -17.794 119 HG LEU 30 HG LEU 30 7.904 2.751 -18.983 120 HD11 LEU 30 HD11 LEU 30 6.315 3.408 -16.669 121 HD12 LEU 30 HD12 LEU 30 5.299 2.661 -17.925 122 HD13 LEU 30 HD13 LEU 30 6.750 1.816 -17.335 123 HD21 LEU 30 HD21 LEU 30 5.321 3.415 -19.776 124 HD22 LEU 30 HD22 LEU 30 6.236 4.933 -19.939 125 HD23 LEU 30 HD23 LEU 30 6.794 3.464 -20.774 126 H ALA 31 H ALA 31 7.748 7.505 -18.110 127 HA ALA 31 HA ALA 31 10.325 8.664 -17.299 128 HB1 ALA 31 HB1 ALA 31 9.808 9.993 -19.133 129 HB2 ALA 31 HB2 ALA 31 8.052 9.811 -18.906 130 HB3 ALA 31 HB3 ALA 31 8.983 10.884 -17.833 131 H ARG 32 H ARG 32 10.370 9.635 -15.264 132 HA ARG 32 HA ARG 32 7.831 9.529 -13.844 133 HB2 ARG 32 HB2 ARG 32 9.475 9.145 -11.775 134 HB3 ARG 32 HB3 ARG 32 8.970 7.791 -12.766 135 HG2 ARG 32 HG2 ARG 32 11.045 7.634 -13.866 136 HG3 ARG 32 HG3 ARG 32 11.440 9.320 -13.594 137 HD2 ARG 32 HD2 ARG 32 11.175 7.452 -11.218 138 HD3 ARG 32 HD3 ARG 32 12.647 7.433 -12.169 139 HE ARG 32 HE ARG 32 11.998 10.155 -11.561 140 HH11 ARG 32 HH22 ARG 32 13.117 7.224 -9.966 141 HH12 ARG 32 HH21 ARG 32 13.964 8.075 -8.717 142 HH21 ARG 32 HH12 ARG 32 13.115 11.277 -9.913 143 HH22 ARG 32 HH11 ARG 32 13.963 10.395 -8.687 144 H CYS 33 H CYS 33 7.217 11.578 -13.231 145 HA CYS 33 HA CYS 33 8.969 13.751 -13.458 146 HB2 CYS 33 HB2 CYS 33 6.276 13.504 -13.423 147 HB3 CYS 33 HB3 CYS 33 6.530 14.046 -11.776 148 H ARG 34 H ARG 34 10.380 14.634 -11.956 149 HA ARG 34 HA ARG 34 10.996 13.195 -9.690 150 HB2 ARG 34 HB2 ARG 34 12.458 15.145 -9.123 151 HB3 ARG 34 HB3 ARG 34 12.606 14.699 -10.811 152 HG2 ARG 34 HG2 ARG 34 11.277 16.553 -11.544 153 HG3 ARG 34 HG3 ARG 34 10.618 16.828 -9.943 154 HD2 ARG 34 HD2 ARG 34 12.260 18.547 -10.238 155 HD3 ARG 34 HD3 ARG 34 13.021 17.377 -9.178 156 HE ARG 34 HE ARG 34 14.600 16.960 -10.844 157 HH11 ARG 34 HH22 ARG 34 11.739 18.368 -12.332 158 HH12 ARG 34 HH21 ARG 34 12.454 18.475 -13.906 159 HH21 ARG 34 HH12 ARG 34 15.543 17.101 -12.921 160 HH22 ARG 34 HH11 ARG 34 14.632 17.750 -14.243 161 H ILE 35 H ILE 35 8.560 15.634 -10.319 162 HA ILE 35 HA ILE 35 8.311 16.486 -7.596 163 HB ILE 35 HB ILE 35 7.782 18.072 -9.239 164 HG12 ILE 35 HG12 ILE 35 5.255 16.968 -7.989 165 HG13 ILE 35 HG13 ILE 35 6.312 18.207 -7.342 166 HG21 ILE 35 HG21 ILE 35 5.563 17.206 -10.676 167 HG22 ILE 35 HG22 ILE 35 7.231 17.367 -11.275 168 HG23 ILE 35 HG23 ILE 35 6.654 15.800 -10.659 169 HD11 ILE 35 HD11 ILE 35 4.101 18.503 -9.187 170 HD12 ILE 35 HD12 ILE 35 5.082 19.772 -8.416 171 HD13 ILE 35 HD13 ILE 35 5.595 19.071 -9.970 172 H HIS 36 H HIS 36 7.306 13.762 -9.502 173 HA HIS 36 HA HIS 36 5.938 12.705 -7.229 174 HB2 HIS 36 HB2 HIS 36 3.925 12.152 -8.877 175 HB3 HIS 36 HB3 HIS 36 3.947 13.576 -7.856 176 HD1 HIS 36 HD1 HIS 36 4.534 12.524 -11.463 177 HD2 HIS 36 HD2 HIS 36 3.964 16.011 -9.202 178 HE1 HIS 36 HE1 HIS 36 4.222 14.421 -13.141 179 H ASN 37 H ASN 37 6.932 10.759 -7.094 180 HA ASN 37 HA ASN 37 7.866 9.553 -9.521 181 HB2 ASN 37 HB2 ASN 37 8.064 8.645 -6.600 182 HB3 ASN 37 HB3 ASN 37 8.882 7.864 -7.938 183 HD21 ASN 37 HD21 ASN 37 10.018 9.585 -9.432 184 HD22 ASN 37 HD22 ASN 37 11.079 10.681 -8.612 185 H ASP 38 H ASP 38 5.013 9.615 -7.665 186 HA ASP 38 HA ASP 38 4.402 6.832 -7.958 187 HB2 ASP 38 HB2 ASP 38 3.609 8.009 -5.961 188 HB3 ASP 38 HB3 ASP 38 2.823 9.234 -6.937 189 HD2 ASP 38 HD2 ASP 38 2.076 6.299 -5.334 190 H VAL 39 H VAL 39 4.772 9.061 -10.213 191 HA VAL 39 HA VAL 39 2.276 8.399 -11.615 192 HB VAL 39 HB VAL 39 3.464 10.971 -10.977 193 HG11 VAL 39 HG11 VAL 39 2.917 10.359 -13.900 194 HG12 VAL 39 HG12 VAL 39 3.067 11.998 -13.221 195 HG13 VAL 39 HG13 VAL 39 4.456 10.885 -13.177 196 HG21 VAL 39 HG21 VAL 39 1.270 11.772 -11.341 197 HG22 VAL 39 HG22 VAL 39 0.863 10.417 -12.421 198 HG23 VAL 39 HG23 VAL 39 1.065 10.134 -10.675 199 H ILE 40 H ILE 40 2.509 8.209 -13.978 200 HA ILE 40 HA ILE 40 5.284 7.628 -14.743 201 HB ILE 40 HB ILE 40 4.305 5.525 -14.402 202 HG12 ILE 40 HG12 ILE 40 4.633 6.429 -17.209 203 HG13 ILE 40 HG13 ILE 40 5.481 5.183 -16.316 204 HG21 ILE 40 HG21 ILE 40 1.948 6.370 -14.287 205 HG22 ILE 40 HG22 ILE 40 1.908 6.326 -16.066 206 HG23 ILE 40 HG23 ILE 40 2.149 4.823 -15.144 207 HD11 ILE 40 HD11 ILE 40 3.515 3.679 -16.490 208 HD12 ILE 40 HD12 ILE 40 2.620 4.949 -17.359 209 HD13 ILE 40 HD13 ILE 40 4.057 4.206 -18.102 210 H LEU 41 H LEU 41 5.917 8.285 -16.813 211 HA LEU 41 HA LEU 41 3.872 9.821 -18.260 212 HB2 LEU 41 HB2 LEU 41 6.601 10.536 -17.366 213 HB3 LEU 41 HB3 LEU 41 6.178 11.014 -18.998 214 HG LEU 41 HG LEU 41 4.387 12.386 -18.254 215 HD11 LEU 41 HD11 LEU 41 4.714 10.994 -15.596 216 HD12 LEU 41 HD12 LEU 41 3.846 12.539 -15.765 217 HD13 LEU 41 HD13 LEU 41 3.273 11.096 -16.636 218 HD21 LEU 41 HD21 LEU 41 5.539 14.072 -17.179 219 HD22 LEU 41 HD22 LEU 41 6.421 12.947 -16.119 220 HD23 LEU 41 HD23 LEU 41 6.865 13.085 -17.838 221 H ASP 42 H ASP 42 3.679 9.451 -20.452 222 HA ASP 42 HA ASP 42 5.073 7.128 -21.373 223 HB2 ASP 42 HB2 ASP 42 2.844 8.884 -22.457 224 HB3 ASP 42 HB3 ASP 42 3.614 7.702 -23.496 225 HD2 ASP 42 HD2 ASP 42 2.697 5.883 -23.518 226 H SER 43 H SER 43 7.174 7.550 -22.122 227 HA SER 43 HA SER 43 7.679 10.068 -23.407 228 HB2 SER 43 HB2 SER 43 9.303 9.181 -21.768 229 HB3 SER 43 HB3 SER 43 9.515 7.729 -22.726 230 HG SER 43 HG SER 43 11.208 9.339 -23.071 231 H GLY 44 H GLY 44 7.491 6.558 -24.144 232 HA2 GLY 44 HA2 GLY 44 6.742 5.813 -26.252 233 HA3 GLY 44 HA3 GLY 44 7.433 7.236 -27.008 234 H ASN 45 H ASN 45 9.626 6.206 -24.644 235 HA ASN 45 HA ASN 45 11.551 5.529 -26.466 236 HB2 ASN 45 HB2 ASN 45 11.191 5.111 -23.488 237 HB3 ASN 45 HB3 ASN 45 12.537 4.309 -24.272 238 HD21 ASN 45 HD21 ASN 45 14.094 5.553 -25.413 239 HD22 ASN 45 HD22 ASN 45 14.406 7.207 -25.003 240 H ASP 46 H ASP 46 12.709 3.294 -26.571 241 HA ASP 46 HA ASP 46 11.021 1.400 -27.522 242 HB2 ASP 46 HB2 ASP 46 13.801 1.162 -26.296 243 HB3 ASP 46 HB3 ASP 46 13.008 -0.201 -27.060 244 HD2 ASP 46 HD2 ASP 46 12.082 1.040 -29.475 245 H ALA 47 H ALA 47 9.370 0.427 -26.316 246 HA ALA 47 HA ALA 47 9.645 0.067 -23.493 247 HB1 ALA 47 HB1 ALA 47 7.512 0.664 -24.643 248 HB2 ALA 47 HB2 ALA 47 7.520 -0.931 -25.434 249 HB3 ALA 47 HB3 ALA 47 7.372 -0.816 -23.664 250 H SER 48 H SER 48 10.669 -1.649 -26.289 251 HA SER 48 HA SER 48 10.225 -4.247 -25.635 252 HB2 SER 48 HB2 SER 48 11.784 -4.751 -27.281 253 HB3 SER 48 HB3 SER 48 11.445 -3.078 -27.681 254 HG SER 48 HG SER 48 13.647 -3.109 -27.615 255 H SER 49 H SER 49 12.992 -2.107 -24.659 256 HA SER 49 HA SER 49 14.312 -4.055 -23.199 257 HB2 SER 49 HB2 SER 49 14.318 -1.038 -22.748 258 HB3 SER 49 HB3 SER 49 15.543 -2.159 -22.189 259 HG SER 49 HG SER 49 15.963 -2.699 -24.462 260 H ALA 50 H ALA 50 11.525 -1.984 -22.492 261 HA ALA 50 HA ALA 50 11.668 -2.244 -19.667 262 HB1 ALA 50 HB1 ALA 50 10.399 -0.419 -20.211 263 HB2 ALA 50 HB2 ALA 50 9.806 -1.148 -21.722 264 HB3 ALA 50 HB3 ALA 50 9.080 -1.613 -20.165 265 H TYR 51 H TYR 51 10.076 -4.018 -22.359 266 HA TYR 51 HA TYR 51 8.541 -5.684 -20.658 267 HB2 TYR 51 HB2 TYR 51 9.566 -5.648 -23.546 268 HB3 TYR 51 HB3 TYR 51 8.664 -7.037 -22.972 269 HD1 TYR 51 HD2 TYR 51 6.343 -6.433 -21.787 270 HD2 TYR 51 HD1 TYR 51 8.398 -3.921 -24.574 271 HE1 TYR 51 HE2 TYR 51 4.166 -5.233 -22.321 272 HE2 TYR 51 HE1 TYR 51 6.214 -2.730 -25.099 273 HH TYR 51 HH TYR 51 4.126 -2.340 -24.235 274 H LYS 52 H LYS 52 11.691 -6.081 -22.407 275 HA LYS 52 HA LYS 52 12.080 -8.736 -21.622 276 HB2 LYS 52 HB2 LYS 52 13.713 -6.553 -22.810 277 HB3 LYS 52 HB3 LYS 52 14.599 -7.845 -22.026 278 HG2 LYS 52 HG2 LYS 52 14.366 -8.708 -24.192 279 HG3 LYS 52 HG3 LYS 52 12.994 -9.444 -23.387 280 HD2 LYS 52 HD2 LYS 52 12.014 -8.581 -25.347 281 HD3 LYS 52 HD3 LYS 52 11.656 -7.330 -24.174 282 HE2 LYS 52 HE2 LYS 52 12.517 -6.043 -25.929 283 HE3 LYS 52 HE3 LYS 52 13.963 -6.289 -24.970 284 HZ1 LYS 52 HZ1 LYS 52 13.539 -7.057 -27.572 285 HZ2 LYS 52 HZ2 LYS 52 14.854 -7.362 -26.653 286 HZ3 LYS 52 HZ3 LYS 52 13.632 -8.443 -26.714 287 H LEU 53 H LEU 53 13.217 -5.604 -20.196 288 HA LEU 53 HA LEU 53 14.526 -6.884 -18.039 289 HB2 LEU 53 HB2 LEU 53 15.160 -4.692 -18.883 290 HB3 LEU 53 HB3 LEU 53 13.600 -4.035 -18.430 291 HG LEU 53 HG LEU 53 15.603 -3.551 -16.911 292 HD11 LEU 53 HD11 LEU 53 13.974 -4.304 -14.843 293 HD12 LEU 53 HD12 LEU 53 13.795 -2.821 -15.812 294 HD13 LEU 53 HD13 LEU 53 12.840 -4.268 -16.215 295 HD21 LEU 53 HD21 LEU 53 16.067 -6.197 -16.969 296 HD22 LEU 53 HD22 LEU 53 16.574 -5.141 -15.629 297 HD23 LEU 53 HD23 LEU 53 15.083 -6.104 -15.489 298 H GLY 54 H GLY 54 11.219 -5.706 -18.662 299 HA2 GLY 54 HA2 GLY 54 10.276 -5.642 -16.030 300 HA3 GLY 54 HA3 GLY 54 9.320 -5.893 -17.477 301 H THR 55 H THR 55 10.095 -8.293 -18.523 302 HA THR 55 HA THR 55 8.921 -10.139 -16.739 303 HB THR 55 HB THR 55 10.375 -10.335 -19.420 304 HG1 THR 55 HG1 THR 55 8.164 -9.294 -18.979 305 HG21 THR 55 HG21 THR 55 8.772 -12.557 -19.284 306 HG22 THR 55 HG22 THR 55 10.514 -12.598 -18.919 307 HG23 THR 55 HG23 THR 55 9.329 -12.474 -17.596 308 H TYR 56 H TYR 56 12.299 -9.290 -17.523 309 HA TYR 56 HA TYR 56 13.541 -11.510 -16.442 310 HB2 TYR 56 HB2 TYR 56 14.506 -9.528 -17.754 311 HB3 TYR 56 HB3 TYR 56 14.263 -8.514 -16.346 312 HD1 TYR 56 HD1 TYR 56 15.235 -11.778 -15.330 313 HD2 TYR 56 HD2 TYR 56 16.798 -8.109 -16.880 314 HE1 TYR 56 HE1 TYR 56 17.551 -12.398 -14.483 315 HE2 TYR 56 HE2 TYR 56 19.108 -8.741 -16.028 316 HH TYR 56 HH TYR 56 19.961 -10.255 -14.099 317 H LEU 57 H LEU 57 12.572 -8.401 -14.839 318 HA LEU 57 HA LEU 57 13.500 -9.308 -12.301 319 HB2 LEU 57 HB2 LEU 57 13.330 -6.918 -13.208 320 HB3 LEU 57 HB3 LEU 57 11.623 -7.015 -12.826 321 HG LEU 57 HG LEU 57 12.750 -7.826 -10.459 322 HD11 LEU 57 HD11 LEU 57 14.939 -7.354 -10.521 323 HD12 LEU 57 HD12 LEU 57 14.774 -6.290 -11.938 324 HD13 LEU 57 HD13 LEU 57 14.421 -5.665 -10.310 325 HD21 LEU 57 HD21 LEU 57 11.183 -6.308 -9.995 326 HD22 LEU 57 HD22 LEU 57 12.486 -5.102 -10.118 327 HD23 LEU 57 HD23 LEU 57 11.446 -5.435 -11.524 328 H TYR 58 H TYR 58 10.265 -8.888 -13.875 329 HA TYR 58 HA TYR 58 8.691 -9.652 -11.764 330 HB2 TYR 58 HB2 TYR 58 8.688 -9.798 -14.795 331 HB3 TYR 58 HB3 TYR 58 7.437 -10.717 -13.983 332 HD1 TYR 58 HD2 TYR 58 6.621 -9.033 -11.754 333 HD2 TYR 58 HD1 TYR 58 7.714 -7.909 -15.735 334 HE1 TYR 58 HE2 TYR 58 5.211 -6.927 -11.554 335 HE2 TYR 58 HE1 TYR 58 6.300 -5.807 -15.522 336 HH TYR 58 HH TYR 58 5.380 -4.414 -13.919 337 H GLN 59 H GLN 59 10.676 -11.657 -13.959 338 HA GLN 59 HA GLN 59 9.715 -13.976 -12.470 339 HB2 GLN 59 HB2 GLN 59 9.412 -13.712 -15.110 340 HB3 GLN 59 HB3 GLN 59 11.081 -14.244 -15.148 341 HG2 GLN 59 HG2 GLN 59 8.652 -15.730 -14.103 342 HG3 GLN 59 HG3 GLN 59 9.825 -16.261 -15.292 343 HE21 GLN 59 HE21 GLN 59 12.200 -16.034 -14.324 344 HE22 GLN 59 HE22 GLN 59 12.442 -16.863 -12.823 345 H LYS 60 H LYS 60 11.183 -14.584 -10.942 346 HA LYS 60 HA LYS 60 14.018 -14.229 -11.626 347 HB2 LYS 60 HB2 LYS 60 14.353 -14.191 -9.127 348 HB3 LYS 60 HB3 LYS 60 13.523 -12.805 -9.804 349 HG2 LYS 60 HG2 LYS 60 11.379 -13.562 -9.029 350 HG3 LYS 60 HG3 LYS 60 11.964 -15.187 -8.733 351 HD2 LYS 60 HD2 LYS 60 11.890 -14.251 -6.563 352 HD3 LYS 60 HD3 LYS 60 13.581 -14.095 -6.997 353 HE2 LYS 60 HE2 LYS 60 13.121 -11.729 -7.775 354 HE3 LYS 60 HE3 LYS 60 11.467 -11.899 -7.222 355 HZ1 LYS 60 HZ1 LYS 60 12.161 -11.387 -5.216 356 HZ2 LYS 60 HZ2 LYS 60 13.137 -12.696 -5.163 357 HZ3 LYS 60 HZ3 LYS 60 13.710 -11.272 -5.721 358 H ASP 61 H ASP 61 15.361 -15.999 -11.595 359 HA ASP 61 HA ASP 61 16.016 -18.062 -11.421 360 HB2 ASP 61 HB2 ASP 61 13.610 -18.715 -9.671 361 HB3 ASP 61 HB3 ASP 61 15.146 -19.558 -9.719 362 HD2 ASP 61 HD2 ASP 61 16.176 -19.044 -7.724 363 H ASN 62 H ASN 62 14.413 -17.323 -13.620 364 HA ASN 62 HA ASN 62 12.133 -18.668 -14.096 365 HB2 ASN 62 HB2 ASN 62 13.139 -18.769 -16.576 366 HB3 ASN 62 HB3 ASN 62 12.745 -17.226 -15.844 367 HD21 ASN 62 HD21 ASN 62 14.319 -16.554 -17.517 368 HD22 ASN 62 HD22 ASN 62 15.999 -16.486 -17.102 369 H SER 63 H SER 63 15.559 -19.760 -14.646 370 HA SER 63 HA SER 63 16.460 -21.708 -14.964 371 HB2 SER 63 HB2 SER 63 14.059 -22.809 -13.436 372 HB3 SER 63 HB3 SER 63 15.578 -23.648 -13.683 373 HG SER 63 HG SER 63 15.998 -22.737 -11.759 374 H CYS 64 H CYS 64 14.724 -20.717 -17.065 375 HA CYS 64 HA CYS 64 13.710 -21.330 -18.914 376 HB2 CYS 64 HB2 CYS 64 15.908 -22.794 -18.872 377 HB3 CYS 64 HB3 CYS 64 14.784 -24.129 -18.711 378 HG CYS 64 HG CYS 64 14.046 -21.771 -20.838 379 H ASN 65 H ASN 65 12.077 -21.410 -16.639 380 HA ASN 65 HA ASN 65 10.566 -23.869 -17.038 381 HB2 ASN 65 HB2 ASN 65 11.434 -23.349 -14.686 382 HB3 ASN 65 HB3 ASN 65 10.420 -21.919 -14.680 383 HD21 ASN 65 HD21 ASN 65 10.617 -24.998 -13.670 384 HD22 ASN 65 HD22 ASN 65 8.947 -25.438 -13.538 385 H LEU 66 H LEU 66 10.538 -20.282 -16.788 386 HA LEU 66 HA LEU 66 9.045 -18.738 -17.310 387 HB2 LEU 66 HB2 LEU 66 8.618 -20.855 -19.364 388 HB3 LEU 66 HB3 LEU 66 7.472 -19.531 -19.299 389 HG LEU 66 HG LEU 66 9.297 -17.911 -19.606 390 HD11 LEU 66 HD11 LEU 66 11.133 -19.051 -18.554 391 HD12 LEU 66 HD12 LEU 66 11.067 -20.365 -19.754 392 HD13 LEU 66 HD13 LEU 66 11.557 -18.728 -20.252 393 HD21 LEU 66 HD21 LEU 66 10.051 -19.065 -21.954 394 HD22 LEU 66 HD22 LEU 66 8.582 -19.992 -21.567 395 HD23 LEU 66 HD23 LEU 66 8.509 -18.217 -21.685 396 H PHE 67 H PHE 67 8.422 -20.116 -14.988 397 HA PHE 67 HA PHE 67 5.891 -21.258 -14.937 398 HB2 PHE 67 HB2 PHE 67 7.822 -21.123 -13.175 399 HB3 PHE 67 HB3 PHE 67 7.248 -19.509 -12.806 400 HD1 PHE 67 HD1 PHE 67 5.724 -22.901 -13.235 401 HD2 PHE 67 HD2 PHE 67 5.956 -19.354 -10.916 402 HE1 PHE 67 HE1 PHE 67 4.076 -23.860 -11.603 403 HE2 PHE 67 HE2 PHE 67 4.308 -20.313 -9.285 404 HZ PHE 67 HZ PHE 67 3.387 -22.554 -9.647 405 H ASN 68 H ASN 68 6.840 -17.913 -13.849 406 HA ASN 68 HA ASN 68 4.186 -17.095 -13.658 407 HB2 ASN 68 HB2 ASN 68 6.386 -16.068 -12.635 408 HB3 ASN 68 HB3 ASN 68 6.537 -15.217 -14.160 409 HD21 ASN 68 HD21 ASN 68 5.499 -13.382 -14.442 410 HD22 ASN 68 HD22 ASN 68 4.246 -12.734 -13.436 411 H THR 69 H THR 69 2.820 -16.160 -15.233 412 HA THR 69 HA THR 69 3.660 -16.311 -17.963 413 HB THR 69 HB THR 69 1.380 -16.925 -17.325 414 HG1 THR 69 HG1 THR 69 0.863 -15.859 -19.192 415 HG21 THR 69 HG21 THR 69 1.425 -14.189 -16.017 416 HG22 THR 69 HG22 THR 69 -0.108 -14.810 -16.672 417 HG23 THR 69 HG23 THR 69 0.745 -15.712 -15.397 418 H LEU 70 H LEU 70 4.383 -14.770 -19.326 419 HA LEU 70 HA LEU 70 5.208 -12.306 -18.166 420 HB2 LEU 70 HB2 LEU 70 6.733 -12.940 -19.689 421 HB3 LEU 70 HB3 LEU 70 5.564 -13.773 -20.696 422 HG LEU 70 HG LEU 70 4.825 -11.646 -21.657 423 HD11 LEU 70 HD11 LEU 70 6.922 -9.900 -20.775 424 HD12 LEU 70 HD12 LEU 70 5.158 -9.691 -20.669 425 HD13 LEU 70 HD13 LEU 70 6.036 -10.520 -19.361 426 HD21 LEU 70 HD21 LEU 70 7.101 -10.993 -22.710 427 HD22 LEU 70 HD22 LEU 70 7.746 -12.355 -21.762 428 HD23 LEU 70 HD23 LEU 70 6.465 -12.636 -22.966 429 H THR 71 H THR 71 2.320 -13.484 -19.713 430 HA THR 71 HA THR 71 1.418 -11.134 -20.927 431 HB THR 71 HB THR 71 -0.317 -13.245 -19.569 432 HG1 THR 71 HG1 THR 71 0.305 -14.572 -21.361 433 HG21 THR 71 HG21 THR 71 -1.077 -11.151 -21.147 434 HG22 THR 71 HG22 THR 71 -0.637 -12.323 -22.412 435 HG23 THR 71 HG23 THR 71 -1.886 -12.736 -21.213 436 H GLU 72 H GLU 72 1.497 -12.157 -17.525 437 HA GLU 72 HA GLU 72 -0.362 -10.247 -16.667 438 HB2 GLU 72 HB2 GLU 72 1.671 -12.040 -15.371 439 HB3 GLU 72 HB3 GLU 72 1.059 -10.703 -14.418 440 HG2 GLU 72 HG2 GLU 72 -0.742 -12.698 -15.867 441 HG3 GLU 72 HG3 GLU 72 -0.260 -12.873 -14.191 442 HE2 GLU 72 HE2 GLU 72 -1.470 -9.413 -13.998 443 H ALA 73 H ALA 73 3.266 -10.339 -16.711 444 HA ALA 73 HA ALA 73 3.638 -7.826 -15.564 445 HB1 ALA 73 HB1 ALA 73 5.292 -9.567 -17.421 446 HB2 ALA 73 HB2 ALA 73 5.895 -8.026 -16.766 447 HB3 ALA 73 HB3 ALA 73 5.464 -9.354 -15.662 448 H ARG 74 H ARG 74 3.362 -8.878 -19.020 449 HA ARG 74 HA ARG 74 3.801 -6.367 -20.071 450 HB2 ARG 74 HB2 ARG 74 3.924 -8.045 -21.693 451 HB3 ARG 74 HB3 ARG 74 2.572 -8.939 -21.028 452 HG2 ARG 74 HG2 ARG 74 1.994 -6.225 -22.201 453 HG3 ARG 74 HG3 ARG 74 2.370 -7.522 -23.319 454 HD2 ARG 74 HD2 ARG 74 0.590 -8.851 -21.758 455 HD3 ARG 74 HD3 ARG 74 0.006 -7.222 -21.480 456 HE ARG 74 HE ARG 74 -0.869 -7.235 -23.639 457 HH11 ARG 74 HH22 ARG 74 1.783 -9.545 -23.499 458 HH12 ARG 74 HH21 ARG 74 1.556 -10.097 -25.125 459 HH21 ARG 74 HH12 ARG 74 -1.168 -7.964 -25.784 460 HH22 ARG 74 HH11 ARG 74 -0.133 -9.192 -26.433 461 H ASP 75 H ASP 75 0.899 -7.960 -18.738 462 HA ASP 75 HA ASP 75 -0.941 -6.156 -19.833 463 HB2 ASP 75 HB2 ASP 75 -1.747 -8.283 -19.052 464 HB3 ASP 75 HB3 ASP 75 -0.985 -8.087 -17.486 465 HD2 ASP 75 HD2 ASP 75 -4.028 -8.456 -17.591 466 H ALA 76 H ALA 76 1.160 -6.261 -16.955 467 HA ALA 76 HA ALA 76 -0.193 -4.271 -15.469 468 HB1 ALA 76 HB1 ALA 76 1.181 -5.347 -14.028 469 HB2 ALA 76 HB2 ALA 76 2.278 -5.874 -15.327 470 HB3 ALA 76 HB3 ALA 76 2.443 -4.245 -14.629 471 H ILE 77 H ILE 77 2.728 -4.247 -17.624 472 HA ILE 77 HA ILE 77 3.003 -1.425 -17.410 473 HB ILE 77 HB ILE 77 4.692 -1.724 -19.168 474 HG12 ILE 77 HG12 ILE 77 3.356 -4.356 -19.442 475 HG13 ILE 77 HG13 ILE 77 4.144 -3.357 -20.646 476 HG21 ILE 77 HG21 ILE 77 5.264 -2.016 -16.801 477 HG22 ILE 77 HG22 ILE 77 4.882 -3.750 -16.922 478 HG23 ILE 77 HG23 ILE 77 6.239 -3.071 -17.852 479 HD11 ILE 77 HD11 ILE 77 5.493 -5.353 -20.333 480 HD12 ILE 77 HD12 ILE 77 6.380 -3.985 -19.620 481 HD13 ILE 77 HD13 ILE 77 5.507 -5.125 -18.568 482 H LYS 78 H LYS 78 1.204 -3.676 -19.469 483 HA LYS 78 HA LYS 78 0.752 -1.835 -21.570 484 HB2 LYS 78 HB2 LYS 78 0.592 -4.177 -22.015 485 HB3 LYS 78 HB3 LYS 78 -0.580 -4.420 -20.735 486 HG2 LYS 78 HG2 LYS 78 -2.301 -3.237 -21.930 487 HG3 LYS 78 HG3 LYS 78 -1.153 -2.530 -23.050 488 HD2 LYS 78 HD2 LYS 78 -2.040 -4.260 -24.355 489 HD3 LYS 78 HD3 LYS 78 -0.615 -5.038 -23.696 490 HE2 LYS 78 HE2 LYS 78 -1.850 -6.358 -22.193 491 HE3 LYS 78 HE3 LYS 78 -3.180 -5.220 -22.114 492 HZ1 LYS 78 HZ1 LYS 78 -3.097 -5.982 -24.712 493 HZ2 LYS 78 HZ2 LYS 78 -2.786 -7.367 -23.905 494 HZ3 LYS 78 HZ3 LYS 78 -4.148 -6.525 -23.586 495 H ASP 79 H ASP 79 -0.896 -2.648 -18.491 496 HA ASP 79 HA ASP 79 -3.158 -1.084 -19.109 497 HB2 ASP 79 HB2 ASP 79 -3.371 -2.870 -17.488 498 HB3 ASP 79 HB3 ASP 79 -2.028 -2.265 -16.540 499 HD2 ASP 79 HD2 ASP 79 -5.584 -0.432 -16.305 500 H ALA 80 H ALA 80 -0.103 -0.696 -17.209 501 HA ALA 80 HA ALA 80 -0.710 1.795 -16.089 502 HB1 ALA 80 HB1 ALA 80 1.052 0.515 -15.140 503 HB2 ALA 80 HB2 ALA 80 1.857 0.304 -16.713 504 HB3 ALA 80 HB3 ALA 80 1.858 1.897 -15.919 505 H TYR 81 H TYR 81 1.125 0.869 -19.082 506 HA TYR 81 HA TYR 81 1.736 3.452 -19.886 507 HB2 TYR 81 HB2 TYR 81 1.205 0.733 -21.188 508 HB3 TYR 81 HB3 TYR 81 1.569 2.104 -22.216 509 HD1 TYR 81 HD2 TYR 81 3.019 1.171 -18.889 510 HD2 TYR 81 HD1 TYR 81 3.701 1.695 -23.080 511 HE1 TYR 81 HE2 TYR 81 5.507 0.779 -18.541 512 HE2 TYR 81 HE1 TYR 81 6.186 1.301 -22.718 513 HH TYR 81 HH TYR 81 7.450 0.642 -19.459 514 H GLU 82 H GLU 82 -1.095 1.351 -20.750 515 HA GLU 82 HA GLU 82 -2.222 3.350 -22.376 516 HB2 GLU 82 HB2 GLU 82 -2.590 0.735 -22.321 517 HB3 GLU 82 HB3 GLU 82 -3.821 1.101 -21.129 518 HG2 GLU 82 HG2 GLU 82 -5.141 2.330 -22.662 519 HG3 GLU 82 HG3 GLU 82 -3.787 2.658 -23.725 520 HE2 GLU 82 HE2 GLU 82 -5.287 -0.860 -23.080 521 H SER 83 H SER 83 -2.196 2.684 -18.933 522 HA SER 83 HA SER 83 -4.629 3.880 -18.293 523 HB2 SER 83 HB2 SER 83 -2.114 3.150 -16.812 524 HB3 SER 83 HB3 SER 83 -3.227 4.246 -16.018 525 HG SER 83 HG SER 83 -3.827 2.142 -15.432 526 H TYR 84 H TYR 84 -1.223 5.114 -18.437 527 HA TYR 84 HA TYR 84 -2.253 7.825 -18.033 528 HB2 TYR 84 HB2 TYR 84 0.465 6.390 -17.981 529 HB3 TYR 84 HB3 TYR 84 0.377 8.139 -17.938 530 HD1 TYR 84 HD1 TYR 84 -0.269 5.041 -16.063 531 HD2 TYR 84 HD2 TYR 84 -0.421 9.315 -15.950 532 HE1 TYR 84 HE1 TYR 84 -0.554 4.971 -13.537 533 HE2 TYR 84 HE2 TYR 84 -0.705 9.231 -13.425 534 HH TYR 84 HH TYR 84 -0.270 6.294 -11.660 535 H CYS 85 H CYS 85 -1.663 5.687 -20.555 536 HA CYS 85 HA CYS 85 -0.091 6.850 -22.365 537 HB2 CYS 85 HB2 CYS 85 -1.060 4.919 -23.149 538 HB3 CYS 85 HB3 CYS 85 -2.664 5.348 -22.589 539 HG CYS 85 HG CYS 85 -1.355 5.582 -25.395 540 H GLY 86 H GLY 86 -0.021 8.782 -23.510 541 HA2 GLY 86 HA2 GLY 86 -1.160 10.511 -24.691 542 HA3 GLY 86 HA3 GLY 86 -2.457 10.449 -23.514 543 H ILE 87 H ILE 87 -0.370 10.104 -21.260 544 HA ILE 87 HA ILE 87 0.333 12.949 -21.130 545 HB ILE 87 HB ILE 87 -0.068 10.991 -18.868 546 HG12 ILE 87 HG12 ILE 87 -2.129 12.759 -18.671 547 HG13 ILE 87 HG13 ILE 87 -1.987 12.636 -20.413 548 HG21 ILE 87 HG21 ILE 87 -0.066 13.993 -18.661 549 HG22 ILE 87 HG22 ILE 87 0.181 12.770 -17.392 550 HG23 ILE 87 HG23 ILE 87 1.451 13.065 -18.604 551 HD11 ILE 87 HD11 ILE 87 -2.487 10.344 -20.442 552 HD12 ILE 87 HD12 ILE 87 -1.930 10.099 -18.769 553 HD13 ILE 87 HD13 ILE 87 -3.486 10.905 -19.080 554 H ASP 88 H ASP 88 2.412 13.299 -21.701 555 HA ASP 88 HA ASP 88 4.312 11.240 -20.902 556 HB2 ASP 88 HB2 ASP 88 5.730 11.998 -22.724 557 HB3 ASP 88 HB3 ASP 88 4.120 11.737 -23.364 558 HD2 ASP 88 HD2 ASP 88 5.738 14.873 -24.426 559 H ASP 89 H ASP 89 3.412 14.702 -20.906 560 HA ASP 89 HA ASP 89 5.424 15.127 -18.868 561 HB2 ASP 89 HB2 ASP 89 5.094 16.654 -21.459 562 HB3 ASP 89 HB3 ASP 89 5.616 17.528 -20.033 563 HD2 ASP 89 HD2 ASP 89 8.163 16.120 -19.247 564 H CYS 90 H CYS 90 4.775 16.842 -17.351 565 HA CYS 90 HA CYS 90 1.937 17.233 -17.307 566 HB2 CYS 90 HB2 CYS 90 3.799 18.518 -15.331 567 HB3 CYS 90 HB3 CYS 90 2.188 17.872 -15.088 568 HA PRO 91 HA PRO 91 2.146 21.197 -19.115 569 HB2 PRO 91 HB2 PRO 91 -0.305 22.181 -18.413 570 HB3 PRO 91 HB3 PRO 91 -0.060 21.095 -19.766 571 HG2 PRO 91 HG2 PRO 91 -1.211 20.511 -17.107 572 HG3 PRO 91 HG3 PRO 91 -1.343 19.583 -18.588 573 HD2 PRO 91 HD2 PRO 91 0.339 18.997 -16.339 574 HD3 PRO 91 HD3 PRO 91 0.292 18.137 -17.865 575 H GLN 92 H GLN 92 1.431 20.884 -15.739 576 HA GLN 92 HA GLN 92 1.922 23.643 -15.270 577 HB2 GLN 92 HB2 GLN 92 0.434 21.995 -13.903 578 HB3 GLN 92 HB3 GLN 92 1.929 21.453 -13.166 579 HG2 GLN 92 HG2 GLN 92 1.220 23.152 -11.690 580 HG3 GLN 92 HG3 GLN 92 2.390 23.986 -12.694 581 HE21 GLN 92 HE21 GLN 92 -0.071 24.807 -11.167 582 HE22 GLN 92 HE22 GLN 92 -1.029 25.728 -12.278 583 H CYS 93 H CYS 93 3.683 20.529 -14.675 584 HA CYS 93 HA CYS 93 5.888 21.604 -13.434 585 HB2 CYS 93 HB2 CYS 93 5.687 19.166 -15.231 586 HB3 CYS 93 HB3 CYS 93 7.079 19.550 -14.239 587 H SER 94 H SER 94 4.894 21.475 -16.859 588 HA SER 94 HA SER 94 7.472 22.375 -17.731 589 HB2 SER 94 HB2 SER 94 5.845 20.774 -18.991 590 HB3 SER 94 HB3 SER 94 4.952 22.219 -19.421 591 HG SER 94 HG SER 94 6.554 22.891 -20.745 592 H LYS 95 H LYS 95 4.232 23.644 -16.985 593 HA LYS 95 HA LYS 95 4.743 26.180 -18.233 594 HB2 LYS 95 HB2 LYS 95 2.494 25.396 -18.264 595 HB3 LYS 95 HB3 LYS 95 2.494 25.074 -16.542 596 HG2 LYS 95 HG2 LYS 95 3.132 27.888 -17.375 597 HG3 LYS 95 HG3 LYS 95 1.480 27.358 -17.621 598 HD2 LYS 95 HD2 LYS 95 1.306 26.700 -15.233 599 HD3 LYS 95 HD3 LYS 95 2.982 27.138 -14.969 600 HE2 LYS 95 HE2 LYS 95 0.752 29.050 -15.812 601 HE3 LYS 95 HE3 LYS 95 1.464 28.951 -14.214 602 HZ1 LYS 95 HZ1 LYS 95 2.446 30.260 -16.510 603 HZ2 LYS 95 HZ2 LYS 95 2.916 30.415 -14.954 604 HZ3 LYS 95 HZ3 LYS 95 3.574 29.253 -15.894 605 H TYR 96 H TYR 96 5.905 24.642 -15.480 606 HA TYR 96 HA TYR 96 5.745 26.802 -13.635 607 HB2 TYR 96 HB2 TYR 96 6.835 25.188 -12.290 608 HB3 TYR 96 HB3 TYR 96 6.244 24.117 -13.544 609 HD1 TYR 96 HD2 TYR 96 8.161 24.840 -15.763 610 HD2 TYR 96 HD1 TYR 96 8.813 24.107 -11.598 611 HE1 TYR 96 HE2 TYR 96 10.546 24.111 -16.257 612 HE2 TYR 96 HE1 TYR 96 11.196 23.381 -12.106 613 HH TYR 96 HH TYR 96 12.226 22.489 -15.008 614 H ILE 97 H ILE 97 8.132 27.356 -12.595 615 HA ILE 97 HA ILE 97 9.798 28.219 -14.850 616 HB ILE 97 HB ILE 97 8.338 30.046 -14.025 617 HG12 ILE 97 HG12 ILE 97 10.320 31.652 -13.591 618 HG13 ILE 97 HG13 ILE 97 11.341 30.246 -13.817 619 HG21 ILE 97 HG21 ILE 97 9.760 30.723 -11.640 620 HG22 ILE 97 HG22 ILE 97 8.022 30.411 -11.863 621 HG23 ILE 97 HG23 ILE 97 9.125 29.068 -11.478 622 HD11 ILE 97 HD11 ILE 97 10.954 30.161 -16.073 623 HD12 ILE 97 HD12 ILE 97 9.230 30.563 -15.889 624 HD13 ILE 97 HD13 ILE 97 10.453 31.856 -15.861 625 H ASP 98 H ASP 98 11.977 27.877 -14.597 626 HA ASP 98 HA ASP 98 12.684 26.477 -12.175 627 HB2 ASP 98 HB2 ASP 98 13.256 25.534 -14.435 628 HB3 ASP 98 HB3 ASP 98 14.251 26.940 -14.757 629 HD2 ASP 98 HD2 ASP 98 15.002 24.197 -12.057 630 H ASP 99 H ASP 99 13.257 27.978 -10.558 631 HA ASP 99 HA ASP 99 14.292 29.578 -9.526 632 HB2 ASP 99 HB2 ASP 99 16.292 29.034 -11.746 633 HB3 ASP 99 HB3 ASP 99 16.602 30.303 -10.579 634 HD2 ASP 99 HD2 ASP 99 17.312 28.308 -7.987 Start of MODEL 4 1 H GLU 14 H GLU 14 3.014 3.628 -4.152 2 HA GLU 14 HA GLU 14 2.953 2.330 -1.545 3 HB2 GLU 14 HB2 GLU 14 0.629 3.847 -2.764 4 HB3 GLU 14 HB3 GLU 14 0.943 3.508 -1.073 5 HG2 GLU 14 HG2 GLU 14 1.602 5.751 -1.204 6 HG3 GLU 14 HG3 GLU 14 3.136 4.941 -1.452 7 HE2 GLU 14 HE2 GLU 14 3.462 6.138 -4.679 8 H ASP 15 H ASP 15 2.505 1.770 -4.858 9 HA ASP 15 HA ASP 15 0.488 -0.256 -4.301 10 HB2 ASP 15 HB2 ASP 15 1.266 1.279 -6.800 11 HB3 ASP 15 HB3 ASP 15 0.438 -0.258 -6.948 12 HD2 ASP 15 HD2 ASP 15 -2.034 1.042 -4.749 13 H GLN 16 H GLN 16 0.944 -2.452 -5.008 14 HA GLN 16 HA GLN 16 3.682 -3.081 -5.055 15 HB2 GLN 16 HB2 GLN 16 1.248 -4.830 -5.627 16 HB3 GLN 16 HB3 GLN 16 2.869 -5.429 -5.335 17 HG2 GLN 16 HG2 GLN 16 2.669 -3.947 -3.111 18 HG3 GLN 16 HG3 GLN 16 0.950 -4.127 -3.398 19 HE21 GLN 16 HE21 GLN 16 1.478 -5.182 -1.199 20 HE22 GLN 16 HE22 GLN 16 1.697 -6.900 -1.207 21 H GLU 17 H GLU 17 1.102 -2.763 -7.517 22 HA GLU 17 HA GLU 17 2.504 -4.008 -9.574 23 HB2 GLU 17 HB2 GLU 17 0.404 -1.808 -9.802 24 HB3 GLU 17 HB3 GLU 17 0.847 -2.951 -11.055 25 HG2 GLU 17 HG2 GLU 17 -0.716 -3.426 -8.517 26 HG3 GLU 17 HG3 GLU 17 -1.075 -3.955 -10.148 27 HE2 GLU 17 HE2 GLU 17 0.357 -5.707 -10.940 28 H GLN 18 H GLN 18 2.195 -0.539 -8.575 29 HA GLN 18 HA GLN 18 3.826 0.382 -10.660 30 HB2 GLN 18 HB2 GLN 18 2.120 1.712 -9.283 31 HB3 GLN 18 HB3 GLN 18 3.307 1.764 -7.996 32 HG2 GLN 18 HG2 GLN 18 4.887 2.613 -10.037 33 HG3 GLN 18 HG3 GLN 18 3.339 3.137 -10.669 34 HE21 GLN 18 HE21 GLN 18 5.842 3.685 -8.424 35 HE22 GLN 18 HE22 GLN 18 5.197 5.070 -7.609 36 H TRP 19 H TRP 19 4.404 -0.651 -7.271 37 HA TRP 19 HA TRP 19 6.993 0.293 -6.987 38 HB2 TRP 19 HB2 TRP 19 5.766 -0.498 -5.107 39 HB3 TRP 19 HB3 TRP 19 5.568 -2.091 -5.811 40 HD1 TRP 19 HD1 TRP 19 8.511 0.130 -4.512 41 HE1 TRP 19 HE1 TRP 19 10.414 -1.375 -3.473 42 HE3 TRP 19 HE3 TRP 19 6.346 -4.324 -5.668 43 HZ2 TRP 19 HZ2 TRP 19 10.792 -4.195 -3.257 44 HZ3 TRP 19 HZ3 TRP 19 7.548 -6.405 -5.007 45 HH2 TRP 19 HH2 TRP 19 9.697 -6.390 -3.842 46 H ALA 20 H ALA 20 5.613 -2.522 -8.704 47 HA ALA 20 HA ALA 20 8.061 -3.872 -9.086 48 HB1 ALA 20 HB1 ALA 20 5.265 -3.984 -10.161 49 HB2 ALA 20 HB2 ALA 20 6.546 -4.793 -11.095 50 HB3 ALA 20 HB3 ALA 20 6.249 -5.260 -9.404 51 H MET 21 H MET 21 6.298 -1.285 -10.828 52 HA MET 21 HA MET 21 7.705 -1.401 -13.186 53 HB2 MET 21 HB2 MET 21 5.618 0.020 -12.436 54 HB3 MET 21 HB3 MET 21 6.783 1.187 -11.844 55 HG2 MET 21 HG2 MET 21 6.910 2.042 -13.944 56 HG3 MET 21 HG3 MET 21 7.678 0.553 -14.459 57 HE1 MET 21 HE1 MET 21 4.283 2.033 -13.429 58 HE2 MET 21 HE2 MET 21 4.620 2.823 -14.988 59 HE3 MET 21 HE3 MET 21 3.255 1.691 -14.842 60 H GLN 22 H GLN 22 8.828 -0.617 -10.029 61 HA GLN 22 HA GLN 22 10.496 1.382 -10.139 62 HB2 GLN 22 HB2 GLN 22 10.399 -0.123 -8.224 63 HB3 GLN 22 HB3 GLN 22 11.136 -1.424 -9.138 64 HG2 GLN 22 HG2 GLN 22 13.266 -0.343 -9.202 65 HG3 GLN 22 HG3 GLN 22 12.588 1.222 -8.800 66 HE21 GLN 22 HE21 GLN 22 12.795 -2.098 -7.530 67 HE22 GLN 22 HE22 GLN 22 13.049 -1.684 -5.868 68 H THR 23 H THR 23 12.115 -1.778 -10.781 69 HA THR 23 HA THR 23 14.097 -0.580 -12.380 70 HB THR 23 HB THR 23 13.364 -3.527 -12.458 71 HG1 THR 23 HG1 THR 23 14.637 -1.971 -10.318 72 HG21 THR 23 HG21 THR 23 15.483 -3.383 -13.403 73 HG22 THR 23 HG22 THR 23 15.823 -1.814 -12.635 74 HG23 THR 23 HG23 THR 23 15.986 -3.318 -11.697 75 H LEU 24 H LEU 24 11.270 -2.666 -13.281 76 HA LEU 24 HA LEU 24 11.545 -2.885 -15.900 77 HB2 LEU 24 HB2 LEU 24 9.633 -3.679 -14.629 78 HB3 LEU 24 HB3 LEU 24 9.035 -2.042 -14.448 79 HG LEU 24 HG LEU 24 9.457 -3.028 -17.231 80 HD11 LEU 24 HD11 LEU 24 8.318 -4.853 -15.714 81 HD12 LEU 24 HD12 LEU 24 6.893 -3.801 -15.893 82 HD13 LEU 24 HD13 LEU 24 7.686 -4.479 -17.336 83 HD21 LEU 24 HD21 LEU 24 7.426 -1.716 -17.646 84 HD22 LEU 24 HD22 LEU 24 7.292 -1.371 -15.905 85 HD23 LEU 24 HD23 LEU 24 8.681 -0.752 -16.831 86 H MET 25 H MET 25 9.668 -0.036 -14.660 87 HA MET 25 HA MET 25 10.011 1.350 -17.047 88 HB2 MET 25 HB2 MET 25 8.165 2.050 -15.734 89 HB3 MET 25 HB3 MET 25 9.070 1.968 -14.235 90 HG2 MET 25 HG2 MET 25 10.356 4.005 -14.878 91 HG3 MET 25 HG3 MET 25 9.506 4.075 -16.409 92 HE1 MET 25 HE1 MET 25 7.003 3.682 -16.458 93 HE2 MET 25 HE2 MET 25 5.856 4.559 -15.417 94 HE3 MET 25 HE3 MET 25 6.926 5.459 -16.518 95 H GLY 26 H GLY 26 11.896 1.208 -14.020 96 HA2 GLY 26 HA2 GLY 26 13.407 3.528 -14.263 97 HA3 GLY 26 HA3 GLY 26 13.902 2.050 -13.462 98 H SER 27 H SER 27 13.336 0.684 -16.285 99 HA SER 27 HA SER 27 16.004 0.606 -17.027 100 HB2 SER 27 HB2 SER 27 13.428 -0.260 -18.378 101 HB3 SER 27 HB3 SER 27 14.972 -0.463 -19.182 102 HG SER 27 HG SER 27 15.068 -1.367 -16.557 103 H GLY 28 H GLY 28 13.622 3.015 -17.519 104 HA2 GLY 28 HA2 GLY 28 14.127 5.080 -18.480 105 HA3 GLY 28 HA3 GLY 28 15.315 4.324 -19.523 106 H VAL 29 H VAL 29 12.250 2.644 -19.147 107 HA VAL 29 HA VAL 29 11.716 2.935 -21.928 108 HB VAL 29 HB VAL 29 10.425 1.569 -19.589 109 HG11 VAL 29 HG11 VAL 29 9.257 1.653 -22.391 110 HG12 VAL 29 HG12 VAL 29 8.635 0.734 -20.999 111 HG13 VAL 29 HG13 VAL 29 8.594 2.513 -20.981 112 HG21 VAL 29 HG21 VAL 29 11.550 -0.212 -20.326 113 HG22 VAL 29 HG22 VAL 29 10.880 -0.022 -21.965 114 HG23 VAL 29 HG23 VAL 29 12.361 0.851 -21.502 115 H LEU 30 H LEU 30 10.228 4.150 -18.862 116 HA LEU 30 HA LEU 30 8.700 6.026 -20.527 117 HB2 LEU 30 HB2 LEU 30 8.083 4.652 -17.931 118 HB3 LEU 30 HB3 LEU 30 7.308 6.169 -18.342 119 HG LEU 30 HG LEU 30 7.227 3.781 -20.192 120 HD11 LEU 30 HD11 LEU 30 4.874 3.468 -19.210 121 HD12 LEU 30 HD12 LEU 30 6.262 2.870 -18.269 122 HD13 LEU 30 HD13 LEU 30 5.475 4.402 -17.818 123 HD21 LEU 30 HD21 LEU 30 5.435 4.877 -21.268 124 HD22 LEU 30 HD22 LEU 30 5.260 6.062 -19.951 125 HD23 LEU 30 HD23 LEU 30 6.684 6.121 -21.017 126 H ALA 31 H ALA 31 8.105 8.063 -18.954 127 HA ALA 31 HA ALA 31 10.685 8.908 -17.822 128 HB1 ALA 31 HB1 ALA 31 10.570 10.256 -19.688 129 HB2 ALA 31 HB2 ALA 31 8.791 10.211 -19.746 130 HB3 ALA 31 HB3 ALA 31 9.617 11.249 -18.559 131 H ARG 32 H ARG 32 10.636 9.648 -15.737 132 HA ARG 32 HA ARG 32 7.979 10.168 -14.668 133 HB2 ARG 32 HB2 ARG 32 8.963 9.264 -12.446 134 HB3 ARG 32 HB3 ARG 32 8.600 8.077 -13.683 135 HG2 ARG 32 HG2 ARG 32 10.904 7.829 -14.294 136 HG3 ARG 32 HG3 ARG 32 11.368 9.320 -13.498 137 HD2 ARG 32 HD2 ARG 32 10.450 8.081 -11.312 138 HD3 ARG 32 HD3 ARG 32 10.722 6.634 -12.262 139 HE ARG 32 HE ARG 32 12.765 8.347 -11.101 140 HH11 ARG 32 HH22 ARG 32 12.101 6.167 -13.782 141 HH12 ARG 32 HH21 ARG 32 13.766 5.759 -14.030 142 HH21 ARG 32 HH12 ARG 32 14.962 7.810 -11.428 143 HH22 ARG 32 HH11 ARG 32 15.404 6.700 -12.681 144 H CYS 33 H CYS 33 7.974 11.699 -12.775 145 HA CYS 33 HA CYS 33 10.011 13.709 -13.177 146 HB2 CYS 33 HB2 CYS 33 7.552 14.265 -13.120 147 HB3 CYS 33 HB3 CYS 33 7.544 13.850 -11.418 148 H ARG 34 H ARG 34 11.527 14.308 -11.573 149 HA ARG 34 HA ARG 34 12.246 12.346 -9.777 150 HB2 ARG 34 HB2 ARG 34 13.054 15.166 -10.369 151 HB3 ARG 34 HB3 ARG 34 13.469 14.604 -8.762 152 HG2 ARG 34 HG2 ARG 34 14.162 13.097 -11.328 153 HG3 ARG 34 HG3 ARG 34 15.265 14.179 -10.499 154 HD2 ARG 34 HD2 ARG 34 13.986 12.025 -8.834 155 HD3 ARG 34 HD3 ARG 34 15.182 11.507 -10.005 156 HE ARG 34 HE ARG 34 16.223 13.766 -8.585 157 HH11 ARG 34 HH22 ARG 34 15.430 10.378 -8.061 158 HH12 ARG 34 HH21 ARG 34 16.605 10.165 -6.806 159 HH21 ARG 34 HH12 ARG 34 17.773 13.486 -6.929 160 HH22 ARG 34 HH11 ARG 34 17.946 11.945 -6.157 161 H ILE 35 H ILE 35 9.968 15.029 -9.567 162 HA ILE 35 HA ILE 35 9.888 14.882 -6.666 163 HB ILE 35 HB ILE 35 9.889 17.049 -7.889 164 HG12 ILE 35 HG12 ILE 35 7.600 17.749 -6.605 165 HG13 ILE 35 HG13 ILE 35 7.917 16.204 -5.841 166 HG21 ILE 35 HG21 ILE 35 7.695 15.796 -9.292 167 HG22 ILE 35 HG22 ILE 35 7.180 17.334 -8.559 168 HG23 ILE 35 HG23 ILE 35 8.577 17.297 -9.662 169 HD11 ILE 35 HD11 ILE 35 9.336 18.752 -5.532 170 HD12 ILE 35 HD12 ILE 35 9.387 17.299 -4.505 171 HD13 ILE 35 HD13 ILE 35 10.449 17.421 -5.928 172 H HIS 36 H HIS 36 8.405 13.496 -9.481 173 HA HIS 36 HA HIS 36 6.232 12.520 -7.772 174 HB2 HIS 36 HB2 HIS 36 6.028 12.691 -10.771 175 HB3 HIS 36 HB3 HIS 36 4.745 12.537 -9.587 176 HD1 HIS 36 HD1 HIS 36 4.877 14.826 -7.780 177 HD2 HIS 36 HD2 HIS 36 6.042 15.209 -11.792 178 HE1 HIS 36 HE1 HIS 36 4.732 17.313 -8.332 179 H ASN 37 H ASN 37 6.892 10.526 -7.093 180 HA ASN 37 HA ASN 37 8.326 8.897 -9.002 181 HB2 ASN 37 HB2 ASN 37 8.990 9.247 -6.486 182 HB3 ASN 37 HB3 ASN 37 7.663 8.165 -6.114 183 HD21 ASN 37 HD21 ASN 37 10.895 8.391 -6.793 184 HD22 ASN 37 HD22 ASN 37 11.253 6.755 -7.237 185 H ASP 38 H ASP 38 5.158 9.496 -7.794 186 HA ASP 38 HA ASP 38 4.332 6.756 -8.276 187 HB2 ASP 38 HB2 ASP 38 2.136 7.566 -7.279 188 HB3 ASP 38 HB3 ASP 38 3.501 7.606 -6.181 189 HD2 ASP 38 HD2 ASP 38 1.191 9.852 -7.703 190 H VAL 39 H VAL 39 5.067 9.090 -10.246 191 HA VAL 39 HA VAL 39 2.516 9.080 -11.707 192 HB VAL 39 HB VAL 39 3.670 11.268 -10.690 193 HG11 VAL 39 HG11 VAL 39 4.931 10.953 -13.435 194 HG12 VAL 39 HG12 VAL 39 4.917 12.453 -12.477 195 HG13 VAL 39 HG13 VAL 39 5.781 11.019 -11.872 196 HG21 VAL 39 HG21 VAL 39 1.561 10.781 -12.282 197 HG22 VAL 39 HG22 VAL 39 2.127 12.425 -11.902 198 HG23 VAL 39 HG23 VAL 39 2.591 11.657 -13.439 199 H ILE 40 H ILE 40 2.614 8.695 -13.976 200 HA ILE 40 HA ILE 40 5.239 7.765 -14.905 201 HB ILE 40 HB ILE 40 4.368 5.722 -14.753 202 HG12 ILE 40 HG12 ILE 40 2.917 6.731 -17.215 203 HG13 ILE 40 HG13 ILE 40 4.517 6.020 -17.148 204 HG21 ILE 40 HG21 ILE 40 1.979 5.184 -14.579 205 HG22 ILE 40 HG22 ILE 40 2.466 6.433 -13.408 206 HG23 ILE 40 HG23 ILE 40 1.574 6.892 -14.879 207 HD11 ILE 40 HD11 ILE 40 3.029 4.270 -17.865 208 HD12 ILE 40 HD12 ILE 40 3.427 3.913 -16.168 209 HD13 ILE 40 HD13 ILE 40 1.858 4.647 -16.578 210 H LEU 41 H LEU 41 5.891 8.608 -16.832 211 HA LEU 41 HA LEU 41 3.835 10.061 -18.349 212 HB2 LEU 41 HB2 LEU 41 6.711 10.865 -18.401 213 HB3 LEU 41 HB3 LEU 41 5.276 11.813 -18.737 214 HG LEU 41 HG LEU 41 6.093 10.861 -15.978 215 HD11 LEU 41 HD11 LEU 41 7.687 12.427 -16.155 216 HD12 LEU 41 HD12 LEU 41 6.929 13.187 -17.576 217 HD13 LEU 41 HD13 LEU 41 6.348 13.581 -15.940 218 HD21 LEU 41 HD21 LEU 41 4.205 13.123 -16.383 219 HD22 LEU 41 HD22 LEU 41 3.597 11.483 -16.716 220 HD23 LEU 41 HD23 LEU 41 4.261 11.878 -15.112 221 H ASP 42 H ASP 42 3.970 9.963 -20.653 222 HA ASP 42 HA ASP 42 5.222 7.525 -21.503 223 HB2 ASP 42 HB2 ASP 42 3.906 7.791 -23.529 224 HB3 ASP 42 HB3 ASP 42 2.870 8.146 -22.160 225 HD2 ASP 42 HD2 ASP 42 4.771 10.730 -24.245 226 H SER 43 H SER 43 7.264 7.565 -22.457 227 HA SER 43 HA SER 43 8.228 10.144 -23.351 228 HB2 SER 43 HB2 SER 43 9.553 7.546 -22.538 229 HB3 SER 43 HB3 SER 43 10.445 8.709 -23.498 230 HG SER 43 HG SER 43 10.850 9.713 -21.659 231 H GLY 44 H GLY 44 7.827 6.708 -24.410 232 HA2 GLY 44 HA2 GLY 44 7.083 6.190 -26.586 233 HA3 GLY 44 HA3 GLY 44 7.829 7.653 -27.198 234 H ASN 45 H ASN 45 9.459 5.506 -24.849 235 HA ASN 45 HA ASN 45 11.533 5.130 -26.802 236 HB2 ASN 45 HB2 ASN 45 11.290 4.460 -23.828 237 HB3 ASN 45 HB3 ASN 45 12.689 3.997 -24.776 238 HD21 ASN 45 HD21 ASN 45 13.635 5.812 -26.136 239 HD22 ASN 45 HD22 ASN 45 13.843 7.350 -25.367 240 H ASP 46 H ASP 46 12.604 2.743 -26.629 241 HA ASP 46 HA ASP 46 10.726 0.985 -27.628 242 HB2 ASP 46 HB2 ASP 46 12.665 -0.733 -27.068 243 HB3 ASP 46 HB3 ASP 46 12.901 0.486 -28.305 244 HD2 ASP 46 HD2 ASP 46 14.498 -0.763 -25.645 245 H ALA 47 H ALA 47 9.020 0.307 -26.274 246 HA ALA 47 HA ALA 47 9.315 -0.026 -23.494 247 HB1 ALA 47 HB1 ALA 47 7.222 -0.852 -25.532 248 HB2 ALA 47 HB2 ALA 47 7.046 -1.177 -23.791 249 HB3 ALA 47 HB3 ALA 47 7.162 0.500 -24.376 250 H SER 48 H SER 48 10.238 -1.956 -26.219 251 HA SER 48 HA SER 48 9.816 -4.488 -25.334 252 HB2 SER 48 HB2 SER 48 10.666 -4.244 -27.527 253 HB3 SER 48 HB3 SER 48 11.983 -3.209 -27.013 254 HG SER 48 HG SER 48 13.209 -4.942 -26.811 255 H SER 49 H SER 49 12.194 -2.061 -24.272 256 HA SER 49 HA SER 49 13.838 -3.905 -22.921 257 HB2 SER 49 HB2 SER 49 14.446 -1.543 -23.737 258 HB3 SER 49 HB3 SER 49 13.568 -0.925 -22.353 259 HG SER 49 HG SER 49 15.994 -1.312 -22.149 260 H ALA 50 H ALA 50 10.939 -1.974 -22.132 261 HA ALA 50 HA ALA 50 11.134 -2.336 -19.322 262 HB1 ALA 50 HB1 ALA 50 9.718 -0.601 -19.633 263 HB2 ALA 50 HB2 ALA 50 9.330 -1.107 -21.295 264 HB3 ALA 50 HB3 ALA 50 8.469 -1.836 -19.919 265 H TYR 51 H TYR 51 9.591 -4.081 -22.056 266 HA TYR 51 HA TYR 51 8.131 -5.855 -20.389 267 HB2 TYR 51 HB2 TYR 51 9.147 -5.802 -23.293 268 HB3 TYR 51 HB3 TYR 51 8.128 -7.102 -22.709 269 HD1 TYR 51 HD2 TYR 51 5.877 -6.264 -21.503 270 HD2 TYR 51 HD1 TYR 51 8.125 -4.012 -24.363 271 HE1 TYR 51 HE2 TYR 51 3.813 -4.883 -22.049 272 HE2 TYR 51 HE1 TYR 51 6.054 -2.639 -24.899 273 HH TYR 51 HH TYR 51 3.527 -2.380 -23.012 274 H LYS 52 H LYS 52 11.257 -6.074 -22.211 275 HA LYS 52 HA LYS 52 11.745 -8.744 -21.489 276 HB2 LYS 52 HB2 LYS 52 13.689 -8.514 -22.669 277 HB3 LYS 52 HB3 LYS 52 12.772 -7.183 -23.346 278 HG2 LYS 52 HG2 LYS 52 13.864 -5.592 -21.791 279 HG3 LYS 52 HG3 LYS 52 14.719 -6.906 -21.008 280 HD2 LYS 52 HD2 LYS 52 15.007 -6.276 -23.980 281 HD3 LYS 52 HD3 LYS 52 16.063 -5.601 -22.756 282 HE2 LYS 52 HE2 LYS 52 15.672 -8.573 -23.352 283 HE3 LYS 52 HE3 LYS 52 17.087 -7.619 -23.750 284 HZ1 LYS 52 HZ1 LYS 52 16.340 -8.759 -21.260 285 HZ2 LYS 52 HZ2 LYS 52 17.808 -8.265 -21.776 286 HZ3 LYS 52 HZ3 LYS 52 16.771 -7.191 -21.115 287 H LEU 53 H LEU 53 12.863 -5.586 -20.106 288 HA LEU 53 HA LEU 53 14.290 -6.859 -18.010 289 HB2 LEU 53 HB2 LEU 53 14.864 -4.661 -18.924 290 HB3 LEU 53 HB3 LEU 53 13.347 -4.007 -18.339 291 HG LEU 53 HG LEU 53 15.511 -3.578 -16.994 292 HD11 LEU 53 HD11 LEU 53 14.161 -3.932 -14.793 293 HD12 LEU 53 HD12 LEU 53 13.575 -2.781 -16.018 294 HD13 LEU 53 HD13 LEU 53 12.841 -4.398 -15.892 295 HD21 LEU 53 HD21 LEU 53 14.928 -6.141 -15.577 296 HD22 LEU 53 HD22 LEU 53 15.919 -6.195 -17.054 297 HD23 LEU 53 HD23 LEU 53 16.433 -5.195 -15.674 298 H GLY 54 H GLY 54 10.955 -5.734 -18.517 299 HA2 GLY 54 HA2 GLY 54 10.135 -5.640 -15.832 300 HA3 GLY 54 HA3 GLY 54 9.113 -5.872 -17.236 301 H THR 55 H THR 55 9.946 -8.287 -18.321 302 HA THR 55 HA THR 55 8.780 -10.135 -16.518 303 HB THR 55 HB THR 55 9.922 -10.091 -19.305 304 HG1 THR 55 HG1 THR 55 7.612 -11.343 -18.005 305 HG21 THR 55 HG21 THR 55 10.837 -12.219 -18.135 306 HG22 THR 55 HG22 THR 55 9.136 -12.693 -17.909 307 HG23 THR 55 HG23 THR 55 9.794 -12.493 -19.551 308 H TYR 56 H TYR 56 12.146 -9.336 -17.439 309 HA TYR 56 HA TYR 56 13.388 -11.553 -16.346 310 HB2 TYR 56 HB2 TYR 56 14.384 -9.687 -17.753 311 HB3 TYR 56 HB3 TYR 56 14.135 -8.563 -16.432 312 HD1 TYR 56 HD2 TYR 56 15.776 -11.908 -16.953 313 HD2 TYR 56 HD1 TYR 56 16.010 -8.015 -15.192 314 HE1 TYR 56 HE2 TYR 56 18.090 -12.448 -16.049 315 HE2 TYR 56 HE1 TYR 56 18.323 -8.569 -14.294 316 HH TYR 56 HH TYR 56 20.224 -10.343 -15.191 317 H LEU 57 H LEU 57 12.572 -8.370 -14.799 318 HA LEU 57 HA LEU 57 13.588 -9.206 -12.279 319 HB2 LEU 57 HB2 LEU 57 13.675 -6.914 -12.768 320 HB3 LEU 57 HB3 LEU 57 11.996 -6.857 -13.269 321 HG LEU 57 HG LEU 57 12.745 -7.495 -10.418 322 HD11 LEU 57 HD11 LEU 57 13.069 -5.331 -9.820 323 HD12 LEU 57 HD12 LEU 57 13.678 -5.231 -11.490 324 HD13 LEU 57 HD13 LEU 57 12.023 -4.694 -11.113 325 HD21 LEU 57 HD21 LEU 57 10.300 -7.282 -11.871 326 HD22 LEU 57 HD22 LEU 57 10.551 -7.641 -10.145 327 HD23 LEU 57 HD23 LEU 57 10.367 -5.955 -10.686 328 H TYR 58 H TYR 58 10.284 -8.839 -13.718 329 HA TYR 58 HA TYR 58 8.790 -9.508 -11.531 330 HB2 TYR 58 HB2 TYR 58 8.692 -9.896 -14.548 331 HB3 TYR 58 HB3 TYR 58 7.449 -10.698 -13.608 332 HD1 TYR 58 HD2 TYR 58 6.948 -8.674 -11.470 333 HD2 TYR 58 HD1 TYR 58 7.548 -8.189 -15.678 334 HE1 TYR 58 HE2 TYR 58 5.601 -6.519 -11.421 335 HE2 TYR 58 HE1 TYR 58 6.200 -6.035 -15.615 336 HH TYR 58 HH TYR 58 5.447 -4.465 -12.737 337 H GLN 59 H GLN 59 10.826 -11.598 -13.563 338 HA GLN 59 HA GLN 59 9.722 -13.907 -12.190 339 HB2 GLN 59 HB2 GLN 59 11.121 -13.469 -14.802 340 HB3 GLN 59 HB3 GLN 59 11.449 -14.988 -13.992 341 HG2 GLN 59 HG2 GLN 59 9.484 -15.088 -15.579 342 HG3 GLN 59 HG3 GLN 59 9.093 -15.577 -13.943 343 HE21 GLN 59 HE21 GLN 59 9.299 -12.621 -15.921 344 HE22 GLN 59 HE22 GLN 59 7.838 -11.879 -15.361 345 H LYS 60 H LYS 60 13.017 -12.936 -13.398 346 HA LYS 60 HA LYS 60 15.027 -13.193 -12.513 347 HB2 LYS 60 HB2 LYS 60 13.771 -11.474 -10.951 348 HB3 LYS 60 HB3 LYS 60 13.934 -12.743 -9.755 349 HG2 LYS 60 HG2 LYS 60 16.416 -12.839 -10.260 350 HG3 LYS 60 HG3 LYS 60 16.213 -11.483 -11.352 351 HD2 LYS 60 HD2 LYS 60 15.111 -10.273 -9.291 352 HD3 LYS 60 HD3 LYS 60 15.862 -11.534 -8.335 353 HE2 LYS 60 HE2 LYS 60 17.548 -9.911 -8.314 354 HE3 LYS 60 HE3 LYS 60 18.056 -10.889 -9.677 355 HZ1 LYS 60 HZ1 LYS 60 17.112 -8.216 -9.649 356 HZ2 LYS 60 HZ2 LYS 60 17.965 -9.002 -10.799 357 HZ3 LYS 60 HZ3 LYS 60 16.336 -9.123 -10.765 358 H ASP 61 H ASP 61 13.756 -15.600 -13.074 359 HA ASP 61 HA ASP 61 15.233 -17.304 -11.417 360 HB2 ASP 61 HB2 ASP 61 12.932 -16.727 -10.169 361 HB3 ASP 61 HB3 ASP 61 12.273 -17.906 -11.286 362 HD2 ASP 61 HD2 ASP 61 12.299 -20.073 -9.927 363 H ASN 62 H ASN 62 15.196 -19.537 -12.336 364 HA ASN 62 HA ASN 62 13.919 -19.559 -14.956 365 HB2 ASN 62 HB2 ASN 62 15.732 -21.103 -15.661 366 HB3 ASN 62 HB3 ASN 62 16.420 -19.623 -15.021 367 HD21 ASN 62 HD21 ASN 62 16.607 -22.898 -14.995 368 HD22 ASN 62 HD22 ASN 62 17.420 -23.182 -13.492 369 H SER 63 H SER 63 13.619 -20.671 -11.828 370 HA SER 63 HA SER 63 13.097 -23.419 -12.466 371 HB2 SER 63 HB2 SER 63 13.040 -23.790 -10.163 372 HB3 SER 63 HB3 SER 63 14.119 -22.413 -10.256 373 HG SER 63 HG SER 63 12.546 -22.031 -8.631 374 H CYS 64 H CYS 64 11.491 -20.709 -13.223 375 HA CYS 64 HA CYS 64 8.959 -21.056 -12.073 376 HB2 CYS 64 HB2 CYS 64 9.547 -19.736 -14.737 377 HB3 CYS 64 HB3 CYS 64 8.189 -19.437 -13.671 378 HG CYS 64 HG CYS 64 11.342 -18.611 -13.499 379 H ASN 65 H ASN 65 10.775 -22.849 -14.396 380 HA ASN 65 HA ASN 65 10.323 -24.576 -15.626 381 HB2 ASN 65 HB2 ASN 65 8.729 -25.066 -13.550 382 HB3 ASN 65 HB3 ASN 65 7.437 -24.688 -14.672 383 HD21 ASN 65 HD21 ASN 65 7.084 -27.026 -13.927 384 HD22 ASN 65 HD22 ASN 65 7.695 -28.272 -14.964 385 H LEU 66 H LEU 66 10.071 -22.095 -16.872 386 HA LEU 66 HA LEU 66 9.007 -20.883 -18.420 387 HB2 LEU 66 HB2 LEU 66 8.735 -22.029 -20.467 388 HB3 LEU 66 HB3 LEU 66 10.080 -22.761 -19.615 389 HG LEU 66 HG LEU 66 7.411 -24.038 -19.259 390 HD11 LEU 66 HD11 LEU 66 7.105 -23.840 -21.530 391 HD12 LEU 66 HD12 LEU 66 8.849 -23.871 -21.883 392 HD13 LEU 66 HD13 LEU 66 8.006 -25.373 -21.434 393 HD21 LEU 66 HD21 LEU 66 9.741 -25.671 -19.969 394 HD22 LEU 66 HD22 LEU 66 9.983 -24.663 -18.523 395 HD23 LEU 66 HD23 LEU 66 8.616 -25.800 -18.596 396 H PHE 67 H PHE 67 7.353 -21.319 -16.137 397 HA PHE 67 HA PHE 67 4.737 -21.833 -17.337 398 HB2 PHE 67 HB2 PHE 67 5.655 -22.957 -15.166 399 HB3 PHE 67 HB3 PHE 67 5.584 -21.375 -14.417 400 HD1 PHE 67 HD2 PHE 67 3.284 -23.469 -16.499 401 HD2 PHE 67 HD1 PHE 67 3.781 -21.073 -13.032 402 HE1 PHE 67 HE2 PHE 67 0.885 -23.870 -15.878 403 HE2 PHE 67 HE1 PHE 67 1.382 -21.474 -12.411 404 HZ PHE 67 HZ PHE 67 -0.037 -22.868 -13.841 405 H ASN 68 H ASN 68 6.754 -19.365 -15.711 406 HA ASN 68 HA ASN 68 4.805 -17.560 -15.097 407 HB2 ASN 68 HB2 ASN 68 6.583 -15.932 -14.974 408 HB3 ASN 68 HB3 ASN 68 7.331 -17.466 -14.576 409 HD21 ASN 68 HD21 ASN 68 7.160 -14.833 -16.761 410 HD22 ASN 68 HD22 ASN 68 8.405 -15.308 -17.866 411 H THR 69 H THR 69 3.531 -16.159 -16.358 412 HA THR 69 HA THR 69 4.002 -16.230 -19.249 413 HB THR 69 HB THR 69 1.592 -15.345 -19.232 414 HG1 THR 69 HG1 THR 69 0.640 -15.302 -17.122 415 HG21 THR 69 HG21 THR 69 0.891 -17.521 -19.257 416 HG22 THR 69 HG22 THR 69 2.513 -17.991 -18.693 417 HG23 THR 69 HG23 THR 69 1.215 -17.681 -17.515 418 H LEU 70 H LEU 70 4.988 -14.597 -20.243 419 HA LEU 70 HA LEU 70 5.662 -12.257 -18.808 420 HB2 LEU 70 HB2 LEU 70 7.262 -12.661 -20.322 421 HB3 LEU 70 HB3 LEU 70 6.169 -13.438 -21.450 422 HG LEU 70 HG LEU 70 5.325 -11.143 -22.087 423 HD11 LEU 70 HD11 LEU 70 6.377 -9.185 -21.413 424 HD12 LEU 70 HD12 LEU 70 6.286 -10.131 -19.908 425 HD13 LEU 70 HD13 LEU 70 7.817 -10.041 -20.811 426 HD21 LEU 70 HD21 LEU 70 8.278 -11.595 -22.583 427 HD22 LEU 70 HD22 LEU 70 6.967 -12.468 -23.412 428 HD23 LEU 70 HD23 LEU 70 7.128 -10.706 -23.610 429 H THR 71 H THR 71 2.863 -13.281 -20.610 430 HA THR 71 HA THR 71 1.973 -10.826 -21.594 431 HB THR 71 HB THR 71 1.134 -13.214 -22.076 432 HG1 THR 71 HG1 THR 71 -0.687 -11.097 -21.166 433 HG21 THR 71 HG21 THR 71 -0.865 -12.761 -19.871 434 HG22 THR 71 HG22 THR 71 -0.324 -14.290 -20.605 435 HG23 THR 71 HG23 THR 71 0.699 -13.469 -19.402 436 H GLU 72 H GLU 72 1.964 -12.184 -18.314 437 HA GLU 72 HA GLU 72 0.039 -10.408 -17.326 438 HB2 GLU 72 HB2 GLU 72 0.917 -12.624 -16.305 439 HB3 GLU 72 HB3 GLU 72 2.267 -11.686 -15.699 440 HG2 GLU 72 HG2 GLU 72 0.724 -11.622 -13.906 441 HG3 GLU 72 HG3 GLU 72 0.477 -10.078 -14.696 442 HE2 GLU 72 HE2 GLU 72 -1.692 -13.043 -15.952 443 H ALA 73 H ALA 73 3.627 -10.332 -17.595 444 HA ALA 73 HA ALA 73 3.923 -7.951 -16.092 445 HB1 ALA 73 HB1 ALA 73 5.876 -9.184 -16.186 446 HB2 ALA 73 HB2 ALA 73 5.611 -9.679 -17.876 447 HB3 ALA 73 HB3 ALA 73 6.181 -8.033 -17.509 448 H ARG 74 H ARG 74 3.886 -8.697 -19.646 449 HA ARG 74 HA ARG 74 4.179 -6.056 -20.409 450 HB2 ARG 74 HB2 ARG 74 3.860 -6.855 -22.599 451 HB3 ARG 74 HB3 ARG 74 4.327 -8.327 -21.771 452 HG2 ARG 74 HG2 ARG 74 2.409 -9.065 -22.876 453 HG3 ARG 74 HG3 ARG 74 1.716 -8.585 -21.339 454 HD2 ARG 74 HD2 ARG 74 0.294 -7.306 -22.595 455 HD3 ARG 74 HD3 ARG 74 1.637 -6.188 -22.720 456 HE ARG 74 HE ARG 74 1.637 -8.344 -24.733 457 HH11 ARG 74 HH22 ARG 74 0.678 -5.045 -23.969 458 HH12 ARG 74 HH21 ARG 74 0.524 -4.570 -25.627 459 HH21 ARG 74 HH12 ARG 74 1.435 -7.717 -26.921 460 HH22 ARG 74 HH11 ARG 74 0.958 -6.100 -27.318 461 H ASP 75 H ASP 75 1.384 -7.978 -19.369 462 HA ASP 75 HA ASP 75 -0.542 -6.237 -20.469 463 HB2 ASP 75 HB2 ASP 75 -1.229 -8.489 -20.021 464 HB3 ASP 75 HB3 ASP 75 -0.578 -8.454 -18.394 465 HD2 ASP 75 HD2 ASP 75 -2.669 -8.180 -16.849 466 H ALA 76 H ALA 76 1.287 -6.572 -17.415 467 HA ALA 76 HA ALA 76 -0.336 -4.878 -15.849 468 HB1 ALA 76 HB1 ALA 76 2.630 -5.280 -15.435 469 HB2 ALA 76 HB2 ALA 76 1.331 -5.155 -14.224 470 HB3 ALA 76 HB3 ALA 76 1.496 -6.632 -15.203 471 H ILE 77 H ILE 77 2.743 -4.359 -17.701 472 HA ILE 77 HA ILE 77 2.779 -1.583 -17.122 473 HB ILE 77 HB ILE 77 4.594 -1.522 -18.761 474 HG12 ILE 77 HG12 ILE 77 3.892 -4.429 -19.263 475 HG13 ILE 77 HG13 ILE 77 3.709 -3.107 -20.399 476 HG21 ILE 77 HG21 ILE 77 5.639 -2.025 -16.844 477 HG22 ILE 77 HG22 ILE 77 4.488 -3.320 -16.434 478 HG23 ILE 77 HG23 ILE 77 5.827 -3.644 -17.560 479 HD11 ILE 77 HD11 ILE 77 6.025 -4.711 -19.957 480 HD12 ILE 77 HD12 ILE 77 5.868 -3.310 -21.043 481 HD13 ILE 77 HD13 ILE 77 6.419 -3.078 -19.367 482 H LYS 78 H LYS 78 1.292 -3.647 -19.592 483 HA LYS 78 HA LYS 78 0.819 -1.556 -21.443 484 HB2 LYS 78 HB2 LYS 78 0.883 -3.790 -22.254 485 HB3 LYS 78 HB3 LYS 78 -0.297 -4.342 -21.083 486 HG2 LYS 78 HG2 LYS 78 -1.880 -2.541 -22.207 487 HG3 LYS 78 HG3 LYS 78 -0.739 -2.612 -23.535 488 HD2 LYS 78 HD2 LYS 78 -2.111 -4.328 -24.233 489 HD3 LYS 78 HD3 LYS 78 -1.086 -5.277 -23.175 490 HE2 LYS 78 HE2 LYS 78 -2.863 -4.481 -21.314 491 HE3 LYS 78 HE3 LYS 78 -3.902 -4.293 -22.712 492 HZ1 LYS 78 HZ1 LYS 78 -2.909 -6.658 -23.217 493 HZ2 LYS 78 HZ2 LYS 78 -2.784 -6.701 -21.589 494 HZ3 LYS 78 HZ3 LYS 78 -4.238 -6.456 -22.290 495 H ASP 79 H ASP 79 -0.837 -2.821 -18.555 496 HA ASP 79 HA ASP 79 -3.270 -1.543 -19.106 497 HB2 ASP 79 HB2 ASP 79 -3.271 -3.369 -17.542 498 HB3 ASP 79 HB3 ASP 79 -1.967 -2.671 -16.602 499 HD2 ASP 79 HD2 ASP 79 -3.366 -3.154 -15.008 500 H ALA 80 H ALA 80 -0.439 -0.845 -16.923 501 HA ALA 80 HA ALA 80 -1.412 1.572 -15.921 502 HB1 ALA 80 HB1 ALA 80 0.915 1.911 -15.205 503 HB2 ALA 80 HB2 ALA 80 0.419 0.224 -14.929 504 HB3 ALA 80 HB3 ALA 80 1.458 0.631 -16.316 505 H TYR 81 H TYR 81 0.846 0.849 -18.670 506 HA TYR 81 HA TYR 81 1.363 3.432 -19.437 507 HB2 TYR 81 HB2 TYR 81 0.965 0.733 -20.832 508 HB3 TYR 81 HB3 TYR 81 1.397 2.136 -21.790 509 HD1 TYR 81 HD1 TYR 81 2.647 1.515 -18.351 510 HD2 TYR 81 HD2 TYR 81 3.538 1.364 -22.533 511 HE1 TYR 81 HE1 TYR 81 5.103 1.125 -17.821 512 HE2 TYR 81 HE2 TYR 81 5.991 0.975 -21.989 513 HH TYR 81 HH TYR 81 7.058 0.627 -18.625 514 H GLU 82 H GLU 82 -1.355 1.275 -20.505 515 HA GLU 82 HA GLU 82 -2.437 3.314 -22.132 516 HB2 GLU 82 HB2 GLU 82 -3.609 0.684 -21.130 517 HB3 GLU 82 HB3 GLU 82 -4.389 1.714 -22.313 518 HG2 GLU 82 HG2 GLU 82 -1.523 0.904 -22.808 519 HG3 GLU 82 HG3 GLU 82 -2.773 -0.299 -23.055 520 HE2 GLU 82 HE2 GLU 82 -3.727 3.032 -24.825 521 H SER 83 H SER 83 -2.632 2.436 -18.743 522 HA SER 83 HA SER 83 -5.146 3.686 -18.325 523 HB2 SER 83 HB2 SER 83 -4.400 1.852 -16.871 524 HB3 SER 83 HB3 SER 83 -2.974 2.754 -16.398 525 HG SER 83 HG SER 83 -5.440 2.811 -15.277 526 H TYR 84 H TYR 84 -1.768 4.651 -18.488 527 HA TYR 84 HA TYR 84 -2.467 7.265 -17.335 528 HB2 TYR 84 HB2 TYR 84 0.055 5.551 -17.655 529 HB3 TYR 84 HB3 TYR 84 0.214 7.273 -17.375 530 HD1 TYR 84 HD1 TYR 84 -1.168 8.195 -15.287 531 HD2 TYR 84 HD2 TYR 84 0.028 4.122 -15.820 532 HE1 TYR 84 HE1 TYR 84 -1.371 7.800 -12.783 533 HE2 TYR 84 HE2 TYR 84 -0.180 3.740 -13.315 534 HH TYR 84 HH TYR 84 -0.735 4.584 -11.409 535 H CYS 85 H CYS 85 -2.029 5.601 -20.263 536 HA CYS 85 HA CYS 85 -0.439 7.181 -21.787 537 HB2 CYS 85 HB2 CYS 85 -1.331 5.180 -22.718 538 HB3 CYS 85 HB3 CYS 85 -2.986 5.703 -22.481 539 HG CYS 85 HG CYS 85 -1.143 5.963 -24.937 540 H GLY 86 H GLY 86 -0.682 9.181 -22.890 541 HA2 GLY 86 HA2 GLY 86 -2.070 10.923 -23.728 542 HA3 GLY 86 HA3 GLY 86 -3.208 10.634 -22.427 543 H ILE 87 H ILE 87 -0.119 10.264 -21.110 544 HA ILE 87 HA ILE 87 -0.020 13.107 -20.375 545 HB ILE 87 HB ILE 87 0.701 10.800 -18.573 546 HG12 ILE 87 HG12 ILE 87 -1.885 12.376 -18.512 547 HG13 ILE 87 HG13 ILE 87 -1.734 10.798 -19.259 548 HG21 ILE 87 HG21 ILE 87 0.378 12.623 -16.829 549 HG22 ILE 87 HG22 ILE 87 1.816 12.754 -17.870 550 HG23 ILE 87 HG23 ILE 87 0.395 13.780 -18.182 551 HD11 ILE 87 HD11 ILE 87 -1.501 11.544 -16.338 552 HD12 ILE 87 HD12 ILE 87 -2.440 10.235 -17.093 553 HD13 ILE 87 HD13 ILE 87 -0.673 10.088 -16.939 554 H ASP 88 H ASP 88 1.645 13.920 -21.561 555 HA ASP 88 HA ASP 88 3.847 12.266 -22.219 556 HB2 ASP 88 HB2 ASP 88 3.101 15.171 -22.638 557 HB3 ASP 88 HB3 ASP 88 4.748 14.664 -22.957 558 HD2 ASP 88 HD2 ASP 88 1.737 13.763 -25.359 559 H ASP 89 H ASP 89 3.076 14.950 -19.940 560 HA ASP 89 HA ASP 89 5.307 14.180 -18.336 561 HB2 ASP 89 HB2 ASP 89 6.574 15.753 -19.544 562 HB3 ASP 89 HB3 ASP 89 5.192 16.785 -19.854 563 HD2 ASP 89 HD2 ASP 89 7.617 15.978 -17.823 564 H CYS 90 H CYS 90 5.054 15.053 -16.119 565 HA CYS 90 HA CYS 90 2.481 15.275 -15.248 566 HB2 CYS 90 HB2 CYS 90 3.549 16.345 -13.171 567 HB3 CYS 90 HB3 CYS 90 4.080 14.738 -13.625 568 HA PRO 91 HA PRO 91 1.560 19.369 -16.530 569 HB2 PRO 91 HB2 PRO 91 -0.999 19.502 -15.580 570 HB3 PRO 91 HB3 PRO 91 -0.587 18.788 -17.126 571 HG2 PRO 91 HG2 PRO 91 -1.327 17.440 -14.602 572 HG3 PRO 91 HG3 PRO 91 -1.329 16.796 -16.231 573 HD2 PRO 91 HD2 PRO 91 0.622 16.294 -14.190 574 HD3 PRO 91 HD3 PRO 91 0.681 15.745 -15.853 575 H GLN 92 H GLN 92 1.498 18.243 -13.299 576 HA GLN 92 HA GLN 92 0.867 20.597 -12.036 577 HB2 GLN 92 HB2 GLN 92 2.544 18.195 -11.266 578 HB3 GLN 92 HB3 GLN 92 2.415 19.558 -10.173 579 HG2 GLN 92 HG2 GLN 92 -0.040 19.358 -10.127 580 HG3 GLN 92 HG3 GLN 92 0.002 18.105 -11.352 581 HE21 GLN 92 HE21 GLN 92 -0.429 18.607 -8.202 582 HE22 GLN 92 HE22 GLN 92 0.139 17.125 -7.510 583 H CYS 93 H CYS 93 4.064 19.325 -13.156 584 HA CYS 93 HA CYS 93 5.597 21.383 -12.104 585 HB2 CYS 93 HB2 CYS 93 5.972 19.313 -14.224 586 HB3 CYS 93 HB3 CYS 93 7.084 20.667 -14.225 587 H SER 94 H SER 94 3.635 21.040 -15.078 588 HA SER 94 HA SER 94 4.666 23.461 -16.178 589 HB2 SER 94 HB2 SER 94 3.746 21.346 -17.425 590 HB3 SER 94 HB3 SER 94 2.161 22.027 -17.114 591 HG SER 94 HG SER 94 2.825 23.972 -18.239 592 H LYS 95 H LYS 95 2.304 22.557 -13.836 593 HA LYS 95 HA LYS 95 0.637 24.883 -14.351 594 HB2 LYS 95 HB2 LYS 95 -0.524 22.823 -13.880 595 HB3 LYS 95 HB3 LYS 95 0.406 22.561 -12.419 596 HG2 LYS 95 HG2 LYS 95 -1.851 23.495 -11.919 597 HG3 LYS 95 HG3 LYS 95 -0.573 24.562 -11.370 598 HD2 LYS 95 HD2 LYS 95 -0.826 25.949 -13.426 599 HD3 LYS 95 HD3 LYS 95 -2.075 24.869 -14.014 600 HE2 LYS 95 HE2 LYS 95 -2.195 26.648 -11.539 601 HE3 LYS 95 HE3 LYS 95 -3.173 26.782 -12.987 602 HZ1 LYS 95 HZ1 LYS 95 -4.593 25.547 -11.840 603 HZ2 LYS 95 HZ2 LYS 95 -3.640 24.271 -12.201 604 HZ3 LYS 95 HZ3 LYS 95 -3.481 25.027 -10.763 605 H TYR 96 H TYR 96 3.431 23.917 -12.542 606 HA TYR 96 HA TYR 96 3.181 26.384 -10.963 607 HB2 TYR 96 HB2 TYR 96 4.337 23.617 -10.240 608 HB3 TYR 96 HB3 TYR 96 4.415 25.012 -9.183 609 HD1 TYR 96 HD2 TYR 96 1.805 26.178 -9.155 610 HD2 TYR 96 HD1 TYR 96 2.855 22.039 -9.420 611 HE1 TYR 96 HE2 TYR 96 -0.441 25.536 -8.151 612 HE2 TYR 96 HE1 TYR 96 0.606 21.411 -8.416 613 HH TYR 96 HH TYR 96 -1.423 22.163 -7.940 614 H ILE 97 H ILE 97 5.583 26.705 -9.880 615 HA ILE 97 HA ILE 97 7.204 27.418 -12.032 616 HB ILE 97 HB ILE 97 7.122 28.430 -9.745 617 HG12 ILE 97 HG12 ILE 97 9.912 27.694 -10.666 618 HG13 ILE 97 HG13 ILE 97 8.895 28.855 -11.495 619 HG21 ILE 97 HG21 ILE 97 8.374 25.814 -9.064 620 HG22 ILE 97 HG22 ILE 97 8.989 27.267 -8.239 621 HG23 ILE 97 HG23 ILE 97 7.264 26.841 -8.125 622 HD11 ILE 97 HD11 ILE 97 8.649 29.904 -9.043 623 HD12 ILE 97 HD12 ILE 97 10.192 29.055 -8.785 624 HD13 ILE 97 HD13 ILE 97 10.054 30.281 -10.068 625 H ASP 98 H ASP 98 9.339 26.608 -12.645 626 HA ASP 98 HA ASP 98 9.324 23.725 -12.525 627 HB2 ASP 98 HB2 ASP 98 9.572 24.886 -14.722 628 HB3 ASP 98 HB3 ASP 98 11.022 25.682 -14.144 629 HD2 ASP 98 HD2 ASP 98 12.353 22.289 -13.766 630 H ASP 99 H ASP 99 10.371 23.032 -10.622 631 HA ASP 99 HA ASP 99 12.135 24.379 -9.138 632 HB2 ASP 99 HB2 ASP 99 12.880 22.202 -8.259 633 HB3 ASP 99 HB3 ASP 99 11.150 22.180 -8.536 634 HD2 ASP 99 HD2 ASP 99 13.940 20.807 -10.743 Start of MODEL 5 1 H GLU 14 H GLU 14 0.163 1.599 -2.104 2 HA GLU 14 HA GLU 14 -1.241 -0.654 -0.927 3 HB2 GLU 14 HB2 GLU 14 -2.266 1.742 -2.512 4 HB3 GLU 14 HB3 GLU 14 -3.286 0.447 -1.917 5 HG2 GLU 14 HG2 GLU 14 -2.928 1.028 0.359 6 HG3 GLU 14 HG3 GLU 14 -1.456 1.911 0.006 7 HE2 GLU 14 HE2 GLU 14 -3.074 4.775 -1.043 8 H ASP 15 H ASP 15 0.782 -0.131 -3.458 9 HA ASP 15 HA ASP 15 -0.537 -2.189 -4.990 10 HB2 ASP 15 HB2 ASP 15 0.364 -0.781 -7.085 11 HB3 ASP 15 HB3 ASP 15 -1.237 -0.512 -6.426 12 HD2 ASP 15 HD2 ASP 15 -0.740 2.584 -5.377 13 H GLN 16 H GLN 16 1.103 -3.743 -4.741 14 HA GLN 16 HA GLN 16 3.787 -3.027 -4.442 15 HB2 GLN 16 HB2 GLN 16 2.563 -5.725 -5.171 16 HB3 GLN 16 HB3 GLN 16 4.203 -5.481 -4.604 17 HG2 GLN 16 HG2 GLN 16 3.506 -4.874 -2.421 18 HG3 GLN 16 HG3 GLN 16 1.897 -4.423 -2.949 19 HE21 GLN 16 HE21 GLN 16 0.307 -5.805 -2.696 20 HE22 GLN 16 HE22 GLN 16 0.443 -7.498 -2.357 21 H GLU 17 H GLU 17 1.758 -3.994 -7.228 22 HA GLU 17 HA GLU 17 3.682 -4.644 -9.022 23 HB2 GLU 17 HB2 GLU 17 1.472 -4.963 -9.743 24 HB3 GLU 17 HB3 GLU 17 0.962 -3.361 -9.249 25 HG2 GLU 17 HG2 GLU 17 1.804 -2.336 -11.174 26 HG3 GLU 17 HG3 GLU 17 3.068 -3.530 -11.393 27 HE2 GLU 17 HE2 GLU 17 2.074 -3.230 -13.490 28 H GLN 18 H GLN 18 2.549 -1.381 -8.003 29 HA GLN 18 HA GLN 18 3.863 0.067 -9.933 30 HB2 GLN 18 HB2 GLN 18 2.887 0.634 -7.139 31 HB3 GLN 18 HB3 GLN 18 3.900 1.833 -7.917 32 HG2 GLN 18 HG2 GLN 18 2.352 1.940 -9.849 33 HG3 GLN 18 HG3 GLN 18 1.368 0.661 -9.164 34 HE21 GLN 18 HE21 GLN 18 -0.439 1.985 -9.137 35 HE22 GLN 18 HE22 GLN 18 -0.676 3.240 -7.968 36 H TRP 19 H TRP 19 5.043 -1.507 -6.971 37 HA TRP 19 HA TRP 19 7.460 -0.097 -6.745 38 HB2 TRP 19 HB2 TRP 19 6.368 -1.509 -4.994 39 HB3 TRP 19 HB3 TRP 19 6.862 -2.933 -5.889 40 HD1 TRP 19 HD1 TRP 19 8.551 0.101 -4.106 41 HE1 TRP 19 HE1 TRP 19 10.927 -0.575 -3.178 42 HE3 TRP 19 HE3 TRP 19 8.566 -4.590 -6.071 43 HZ2 TRP 19 HZ2 TRP 19 12.511 -2.942 -3.365 44 HZ3 TRP 19 HZ3 TRP 19 10.566 -6.018 -5.651 45 HH2 TRP 19 HH2 TRP 19 12.492 -5.263 -4.350 46 H ALA 20 H ALA 20 6.355 -2.947 -8.633 47 HA ALA 20 HA ALA 20 8.888 -3.772 -9.498 48 HB1 ALA 20 HB1 ALA 20 6.071 -4.355 -10.005 49 HB2 ALA 20 HB2 ALA 20 7.034 -4.424 -11.501 50 HB3 ALA 20 HB3 ALA 20 7.487 -5.429 -10.103 51 H MET 21 H MET 21 6.485 -1.412 -10.788 52 HA MET 21 HA MET 21 7.596 -0.946 -13.213 53 HB2 MET 21 HB2 MET 21 6.347 1.023 -11.216 54 HB3 MET 21 HB3 MET 21 6.597 1.398 -12.910 55 HG2 MET 21 HG2 MET 21 5.158 -0.577 -13.536 56 HG3 MET 21 HG3 MET 21 4.871 -0.887 -11.835 57 HE1 MET 21 HE1 MET 21 4.234 0.934 -14.892 58 HE2 MET 21 HE2 MET 21 2.974 2.145 -14.552 59 HE3 MET 21 HE3 MET 21 4.684 2.526 -14.234 60 H GLN 22 H GLN 22 8.940 -0.253 -10.067 61 HA GLN 22 HA GLN 22 10.380 1.958 -10.353 62 HB2 GLN 22 HB2 GLN 22 10.448 0.575 -8.337 63 HB3 GLN 22 HB3 GLN 22 11.288 -0.707 -9.186 64 HG2 GLN 22 HG2 GLN 22 13.303 0.562 -9.371 65 HG3 GLN 22 HG3 GLN 22 12.486 2.081 -9.059 66 HE21 GLN 22 HE21 GLN 22 11.157 1.971 -6.895 67 HE22 GLN 22 HE22 GLN 22 12.053 1.450 -5.507 68 H THR 23 H THR 23 12.180 -1.134 -10.861 69 HA THR 23 HA THR 23 14.021 0.109 -12.610 70 HB THR 23 HB THR 23 14.559 -1.821 -11.134 71 HG1 THR 23 HG1 THR 23 15.608 -2.990 -12.908 72 HG21 THR 23 HG21 THR 23 13.655 -3.995 -11.456 73 HG22 THR 23 HG22 THR 23 12.217 -2.960 -11.629 74 HG23 THR 23 HG23 THR 23 13.036 -3.595 -13.076 75 H LEU 24 H LEU 24 11.263 -2.163 -13.182 76 HA LEU 24 HA LEU 24 11.491 -2.631 -15.797 77 HB2 LEU 24 HB2 LEU 24 9.699 -3.455 -14.380 78 HB3 LEU 24 HB3 LEU 24 8.981 -1.859 -14.306 79 HG LEU 24 HG LEU 24 9.370 -3.082 -17.005 80 HD11 LEU 24 HD11 LEU 24 7.582 -4.555 -16.898 81 HD12 LEU 24 HD12 LEU 24 8.409 -4.827 -15.346 82 HD13 LEU 24 HD13 LEU 24 6.936 -3.831 -15.406 83 HD21 LEU 24 HD21 LEU 24 6.815 -1.969 -16.724 84 HD22 LEU 24 HD22 LEU 24 7.902 -0.891 -15.815 85 HD23 LEU 24 HD23 LEU 24 8.231 -1.250 -17.528 86 H MET 25 H MET 25 9.575 0.227 -14.619 87 HA MET 25 HA MET 25 9.745 1.413 -17.173 88 HB2 MET 25 HB2 MET 25 8.021 2.645 -16.281 89 HB3 MET 25 HB3 MET 25 8.200 1.699 -14.816 90 HG2 MET 25 HG2 MET 25 9.963 3.355 -14.029 91 HG3 MET 25 HG3 MET 25 9.623 4.330 -15.445 92 HE1 MET 25 HE1 MET 25 5.940 4.115 -15.367 93 HE2 MET 25 HE2 MET 25 6.415 5.820 -15.176 94 HE3 MET 25 HE3 MET 25 7.375 4.739 -16.214 95 H GLY 26 H GLY 26 11.732 1.435 -14.279 96 HA2 GLY 26 HA2 GLY 26 12.976 3.964 -14.660 97 HA3 GLY 26 HA3 GLY 26 13.536 2.639 -13.660 98 H SER 27 H SER 27 13.070 1.071 -16.497 99 HA SER 27 HA SER 27 15.782 0.904 -17.046 100 HB2 SER 27 HB2 SER 27 14.029 -0.834 -17.567 101 HB3 SER 27 HB3 SER 27 13.447 0.181 -18.871 102 HG SER 27 HG SER 27 16.215 -0.609 -18.737 103 H GLY 28 H GLY 28 13.575 3.402 -17.704 104 HA2 GLY 28 HA2 GLY 28 14.253 5.410 -18.692 105 HA3 GLY 28 HA3 GLY 28 15.394 4.545 -19.703 106 H VAL 29 H VAL 29 12.467 2.786 -19.549 107 HA VAL 29 HA VAL 29 11.889 3.388 -22.270 108 HB VAL 29 HB VAL 29 10.686 1.639 -20.139 109 HG11 VAL 29 HG11 VAL 29 9.659 1.867 -22.986 110 HG12 VAL 29 HG12 VAL 29 9.042 0.809 -21.695 111 HG13 VAL 29 HG13 VAL 29 8.854 2.574 -21.566 112 HG21 VAL 29 HG21 VAL 29 12.253 0.249 -20.918 113 HG22 VAL 29 HG22 VAL 29 11.319 0.163 -22.431 114 HG23 VAL 29 HG23 VAL 29 12.644 1.340 -22.269 115 H LEU 30 H LEU 30 10.338 4.068 -19.075 116 HA LEU 30 HA LEU 30 8.490 5.854 -20.477 117 HB2 LEU 30 HB2 LEU 30 8.404 4.367 -17.879 118 HB3 LEU 30 HB3 LEU 30 7.443 5.819 -18.079 119 HG LEU 30 HG LEU 30 7.285 3.491 -20.002 120 HD11 LEU 30 HD11 LEU 30 6.616 2.418 -18.072 121 HD12 LEU 30 HD12 LEU 30 5.927 3.895 -17.356 122 HD13 LEU 30 HD13 LEU 30 5.075 3.067 -18.681 123 HD21 LEU 30 HD21 LEU 30 6.446 5.589 -20.884 124 HD22 LEU 30 HD22 LEU 30 5.097 4.472 -20.567 125 HD23 LEU 30 HD23 LEU 30 5.422 5.815 -19.445 126 H ALA 31 H ALA 31 7.878 7.806 -18.814 127 HA ALA 31 HA ALA 31 10.454 8.931 -17.954 128 HB1 ALA 31 HB1 ALA 31 9.538 9.846 -20.143 129 HB2 ALA 31 HB2 ALA 31 8.158 10.476 -19.211 130 HB3 ALA 31 HB3 ALA 31 9.806 11.055 -18.865 131 H ARG 32 H ARG 32 10.464 9.968 -15.959 132 HA ARG 32 HA ARG 32 7.871 10.035 -14.637 133 HB2 ARG 32 HB2 ARG 32 10.558 9.397 -13.317 134 HB3 ARG 32 HB3 ARG 32 8.996 9.395 -12.522 135 HG2 ARG 32 HG2 ARG 32 9.111 7.137 -12.993 136 HG3 ARG 32 HG3 ARG 32 8.404 7.661 -14.509 137 HD2 ARG 32 HD2 ARG 32 10.203 6.430 -15.330 138 HD3 ARG 32 HD3 ARG 32 10.961 8.006 -15.225 139 HE ARG 32 HE ARG 32 11.200 6.503 -12.735 140 HH11 ARG 32 HH22 ARG 32 12.600 6.960 -15.932 141 HH12 ARG 32 HH21 ARG 32 14.167 6.387 -15.468 142 HH21 ARG 32 HH12 ARG 32 13.268 5.747 -12.123 143 HH22 ARG 32 HH11 ARG 32 14.550 5.692 -13.286 144 H CYS 33 H CYS 33 7.711 11.712 -12.881 145 HA CYS 33 HA CYS 33 9.151 14.071 -13.686 146 HB2 CYS 33 HB2 CYS 33 6.696 14.120 -13.272 147 HB3 CYS 33 HB3 CYS 33 6.983 13.745 -11.585 148 H ARG 34 H ARG 34 10.760 15.090 -12.447 149 HA ARG 34 HA ARG 34 12.203 13.549 -10.713 150 HB2 ARG 34 HB2 ARG 34 13.087 15.548 -11.919 151 HB3 ARG 34 HB3 ARG 34 12.094 16.601 -10.930 152 HG2 ARG 34 HG2 ARG 34 14.327 16.614 -9.985 153 HG3 ARG 34 HG3 ARG 34 13.295 15.732 -8.876 154 HD2 ARG 34 HD2 ARG 34 14.261 13.659 -9.393 155 HD3 ARG 34 HD3 ARG 34 14.701 14.143 -11.018 156 HE ARG 34 HE ARG 34 16.693 15.120 -10.193 157 HH11 ARG 34 HH22 ARG 34 14.605 14.141 -7.535 158 HH12 ARG 34 HH21 ARG 34 15.830 14.349 -6.328 159 HH21 ARG 34 HH12 ARG 34 18.309 15.394 -8.601 160 HH22 ARG 34 HH11 ARG 34 17.951 15.066 -6.939 161 H ILE 35 H ILE 35 9.273 15.356 -10.200 162 HA ILE 35 HA ILE 35 9.720 15.427 -7.310 163 HB ILE 35 HB ILE 35 7.709 16.783 -9.103 164 HG12 ILE 35 HG12 ILE 35 10.237 17.529 -8.752 165 HG13 ILE 35 HG13 ILE 35 8.930 18.687 -8.897 166 HG21 ILE 35 HG21 ILE 35 6.363 16.536 -7.288 167 HG22 ILE 35 HG22 ILE 35 7.724 16.367 -6.154 168 HG23 ILE 35 HG23 ILE 35 7.266 17.976 -6.762 169 HD11 ILE 35 HD11 ILE 35 9.450 17.660 -6.135 170 HD12 ILE 35 HD12 ILE 35 10.704 18.708 -6.838 171 HD13 ILE 35 HD13 ILE 35 9.034 19.303 -6.678 172 H HIS 36 H HIS 36 8.185 13.648 -9.870 173 HA HIS 36 HA HIS 36 6.564 12.270 -7.853 174 HB2 HIS 36 HB2 HIS 36 5.938 12.228 -10.796 175 HB3 HIS 36 HB3 HIS 36 4.890 11.861 -9.441 176 HD1 HIS 36 HD1 HIS 36 5.331 14.444 -7.736 177 HD2 HIS 36 HD2 HIS 36 4.644 14.401 -11.874 178 HE1 HIS 36 HE1 HIS 36 4.389 16.740 -8.328 179 H ASN 37 H ASN 37 7.755 10.517 -7.234 180 HA ASN 37 HA ASN 37 9.265 9.163 -9.293 181 HB2 ASN 37 HB2 ASN 37 9.265 9.152 -6.258 182 HB3 ASN 37 HB3 ASN 37 9.948 7.777 -7.102 183 HD21 ASN 37 HD21 ASN 37 9.994 11.329 -7.042 184 HD22 ASN 37 HD22 ASN 37 11.672 11.538 -7.414 185 H ASP 38 H ASP 38 6.201 9.116 -7.810 186 HA ASP 38 HA ASP 38 5.997 6.224 -8.009 187 HB2 ASP 38 HB2 ASP 38 3.932 6.456 -6.696 188 HB3 ASP 38 HB3 ASP 38 5.251 7.267 -5.876 189 HD2 ASP 38 HD2 ASP 38 4.550 10.284 -6.400 190 H VAL 39 H VAL 39 5.310 9.226 -9.585 191 HA VAL 39 HA VAL 39 2.925 8.283 -10.923 192 HB VAL 39 HB VAL 39 4.563 10.817 -11.111 193 HG11 VAL 39 HG11 VAL 39 2.437 11.645 -12.329 194 HG12 VAL 39 HG12 VAL 39 3.603 10.657 -13.242 195 HG13 VAL 39 HG13 VAL 39 2.107 9.920 -12.620 196 HG21 VAL 39 HG21 VAL 39 3.275 10.409 -8.991 197 HG22 VAL 39 HG22 VAL 39 2.781 11.865 -9.888 198 HG23 VAL 39 HG23 VAL 39 1.786 10.391 -9.965 199 H ILE 40 H ILE 40 2.800 8.130 -13.297 200 HA ILE 40 HA ILE 40 5.410 7.467 -14.469 201 HB ILE 40 HB ILE 40 4.658 5.365 -14.348 202 HG12 ILE 40 HG12 ILE 40 3.080 6.393 -16.722 203 HG13 ILE 40 HG13 ILE 40 4.728 5.797 -16.731 204 HG21 ILE 40 HG21 ILE 40 2.820 5.586 -12.935 205 HG22 ILE 40 HG22 ILE 40 1.902 6.555 -14.112 206 HG23 ILE 40 HG23 ILE 40 2.138 4.812 -14.385 207 HD11 ILE 40 HD11 ILE 40 3.477 3.928 -17.460 208 HD12 ILE 40 HD12 ILE 40 3.718 3.595 -15.728 209 HD13 ILE 40 HD13 ILE 40 2.162 4.240 -16.302 210 H LEU 41 H LEU 41 5.781 8.186 -16.573 211 HA LEU 41 HA LEU 41 3.558 9.621 -17.827 212 HB2 LEU 41 HB2 LEU 41 6.347 10.740 -17.780 213 HB3 LEU 41 HB3 LEU 41 4.857 11.525 -18.263 214 HG LEU 41 HG LEU 41 5.082 10.607 -15.428 215 HD11 LEU 41 HD11 LEU 41 7.268 11.617 -15.820 216 HD12 LEU 41 HD12 LEU 41 6.491 13.075 -16.481 217 HD13 LEU 41 HD13 LEU 41 6.267 12.646 -14.768 218 HD21 LEU 41 HD21 LEU 41 3.014 11.562 -15.880 219 HD22 LEU 41 HD22 LEU 41 3.932 12.910 -15.167 220 HD23 LEU 41 HD23 LEU 41 3.707 12.821 -16.930 221 H ASP 42 H ASP 42 3.601 9.632 -20.129 222 HA ASP 42 HA ASP 42 4.856 7.348 -21.180 223 HB2 ASP 42 HB2 ASP 42 2.879 7.785 -22.309 224 HB3 ASP 42 HB3 ASP 42 3.045 9.521 -22.146 225 HD2 ASP 42 HD2 ASP 42 4.278 6.838 -23.920 226 H SER 43 H SER 43 6.892 7.233 -22.166 227 HA SER 43 HA SER 43 8.222 9.778 -22.607 228 HB2 SER 43 HB2 SER 43 9.130 7.772 -21.115 229 HB3 SER 43 HB3 SER 43 9.638 7.108 -22.655 230 HG SER 43 HG SER 43 11.136 8.673 -22.904 231 H GLY 44 H GLY 44 7.789 6.474 -24.064 232 HA2 GLY 44 HA2 GLY 44 7.191 6.138 -26.299 233 HA3 GLY 44 HA3 GLY 44 7.826 7.716 -26.723 234 H ASN 45 H ASN 45 9.478 5.270 -24.657 235 HA ASN 45 HA ASN 45 11.587 5.255 -26.653 236 HB2 ASN 45 HB2 ASN 45 11.476 4.932 -23.660 237 HB3 ASN 45 HB3 ASN 45 12.708 4.006 -24.494 238 HD21 ASN 45 HD21 ASN 45 14.445 4.983 -25.385 239 HD22 ASN 45 HD22 ASN 45 14.815 6.670 -25.244 240 H ASP 46 H ASP 46 12.851 2.985 -26.612 241 HA ASP 46 HA ASP 46 11.200 1.078 -27.594 242 HB2 ASP 46 HB2 ASP 46 13.801 1.282 -27.612 243 HB3 ASP 46 HB3 ASP 46 13.762 0.426 -26.084 244 HD2 ASP 46 HD2 ASP 46 14.970 -0.455 -28.356 245 H ALA 47 H ALA 47 9.423 0.339 -26.363 246 HA ALA 47 HA ALA 47 9.629 -0.056 -23.551 247 HB1 ALA 47 HB1 ALA 47 7.501 -0.895 -25.562 248 HB2 ALA 47 HB2 ALA 47 7.312 -0.865 -23.793 249 HB3 ALA 47 HB3 ALA 47 7.551 0.655 -24.688 250 H SER 48 H SER 48 10.679 -1.826 -26.281 251 HA SER 48 HA SER 48 10.058 -4.404 -25.567 252 HB2 SER 48 HB2 SER 48 11.060 -3.657 -27.748 253 HB3 SER 48 HB3 SER 48 12.594 -3.404 -26.939 254 HG SER 48 HG SER 48 12.873 -5.449 -27.627 255 H SER 49 H SER 49 12.752 -2.233 -24.559 256 HA SER 49 HA SER 49 14.078 -4.262 -23.120 257 HB2 SER 49 HB2 SER 49 14.295 -1.224 -23.098 258 HB3 SER 49 HB3 SER 49 15.331 -2.252 -22.128 259 HG SER 49 HG SER 49 15.550 -3.351 -24.484 260 H ALA 50 H ALA 50 11.400 -2.062 -22.508 261 HA ALA 50 HA ALA 50 11.615 -2.062 -19.675 262 HB1 ALA 50 HB1 ALA 50 8.973 -1.508 -20.306 263 HB2 ALA 50 HB2 ALA 50 10.287 -0.311 -20.207 264 HB3 ALA 50 HB3 ALA 50 9.842 -1.015 -21.780 265 H TYR 51 H TYR 51 9.589 -3.863 -22.088 266 HA TYR 51 HA TYR 51 8.253 -5.408 -20.162 267 HB2 TYR 51 HB2 TYR 51 9.047 -6.012 -23.078 268 HB3 TYR 51 HB3 TYR 51 7.690 -6.730 -22.233 269 HD1 TYR 51 HD1 TYR 51 6.329 -4.499 -20.972 270 HD2 TYR 51 HD2 TYR 51 8.236 -4.679 -24.798 271 HE1 TYR 51 HE1 TYR 51 4.821 -2.635 -21.819 272 HE2 TYR 51 HE2 TYR 51 6.722 -2.814 -25.632 273 HH TYR 51 HH TYR 51 4.703 -1.798 -25.174 274 H LYS 52 H LYS 52 11.271 -5.927 -22.072 275 HA LYS 52 HA LYS 52 11.625 -8.594 -21.281 276 HB2 LYS 52 HB2 LYS 52 13.535 -8.502 -22.515 277 HB3 LYS 52 HB3 LYS 52 12.728 -7.091 -23.168 278 HG2 LYS 52 HG2 LYS 52 13.973 -5.616 -21.612 279 HG3 LYS 52 HG3 LYS 52 14.724 -7.008 -20.856 280 HD2 LYS 52 HD2 LYS 52 15.032 -6.294 -23.811 281 HD3 LYS 52 HD3 LYS 52 16.188 -5.851 -22.570 282 HE2 LYS 52 HE2 LYS 52 16.131 -8.464 -22.010 283 HE3 LYS 52 HE3 LYS 52 15.527 -8.600 -23.649 284 HZ1 LYS 52 HZ1 LYS 52 17.833 -8.720 -23.782 285 HZ2 LYS 52 HZ2 LYS 52 17.487 -7.206 -24.285 286 HZ3 LYS 52 HZ3 LYS 52 18.079 -7.451 -22.783 287 H LEU 53 H LEU 53 12.916 -5.469 -19.980 288 HA LEU 53 HA LEU 53 14.332 -6.734 -17.888 289 HB2 LEU 53 HB2 LEU 53 14.951 -4.567 -18.774 290 HB3 LEU 53 HB3 LEU 53 13.414 -3.884 -18.283 291 HG LEU 53 HG LEU 53 15.547 -3.456 -16.858 292 HD11 LEU 53 HD11 LEU 53 13.484 -2.579 -16.133 293 HD12 LEU 53 HD12 LEU 53 12.834 -4.192 -15.753 294 HD13 LEU 53 HD13 LEU 53 14.126 -3.494 -14.748 295 HD21 LEU 53 HD21 LEU 53 14.764 -5.922 -15.362 296 HD22 LEU 53 HD22 LEU 53 15.849 -6.080 -16.764 297 HD23 LEU 53 HD23 LEU 53 16.309 -5.039 -15.396 298 H GLY 54 H GLY 54 10.983 -5.691 -18.372 299 HA2 GLY 54 HA2 GLY 54 10.229 -5.583 -15.644 300 HA3 GLY 54 HA3 GLY 54 9.174 -5.748 -17.033 301 H THR 55 H THR 55 10.034 -8.162 -18.195 302 HA THR 55 HA THR 55 8.763 -10.038 -16.514 303 HB THR 55 HB THR 55 9.538 -11.606 -18.389 304 HG1 THR 55 HG1 THR 55 10.356 -9.355 -19.878 305 HG21 THR 55 HG21 THR 55 7.457 -10.574 -18.943 306 HG22 THR 55 HG22 THR 55 8.180 -8.948 -18.991 307 HG23 THR 55 HG23 THR 55 8.513 -10.109 -20.299 308 H TYR 56 H TYR 56 12.219 -9.377 -17.277 309 HA TYR 56 HA TYR 56 13.241 -11.604 -15.937 310 HB2 TYR 56 HB2 TYR 56 14.187 -8.741 -16.542 311 HB3 TYR 56 HB3 TYR 56 15.269 -9.917 -15.823 312 HD1 TYR 56 HD1 TYR 56 13.147 -11.726 -17.932 313 HD2 TYR 56 HD2 TYR 56 16.457 -9.020 -18.073 314 HE1 TYR 56 HE1 TYR 56 13.756 -12.581 -20.248 315 HE2 TYR 56 HE2 TYR 56 17.055 -9.883 -20.388 316 HH TYR 56 HH TYR 56 16.127 -12.647 -21.574 317 H LEU 57 H LEU 57 12.434 -8.269 -14.813 318 HA LEU 57 HA LEU 57 13.468 -8.776 -12.198 319 HB2 LEU 57 HB2 LEU 57 13.617 -6.576 -12.503 320 HB3 LEU 57 HB3 LEU 57 12.350 -6.544 -13.713 321 HG LEU 57 HG LEU 57 11.813 -5.167 -11.754 322 HD11 LEU 57 HD11 LEU 57 9.761 -7.209 -11.370 323 HD12 LEU 57 HD12 LEU 57 9.639 -5.566 -12.044 324 HD13 LEU 57 HD13 LEU 57 10.141 -6.920 -13.085 325 HD21 LEU 57 HD21 LEU 57 12.610 -7.577 -10.312 326 HD22 LEU 57 HD22 LEU 57 12.497 -5.889 -9.760 327 HD23 LEU 57 HD23 LEU 57 11.049 -6.925 -9.759 328 H TYR 58 H TYR 58 10.386 -9.153 -13.909 329 HA TYR 58 HA TYR 58 8.832 -9.398 -11.525 330 HB2 TYR 58 HB2 TYR 58 8.621 -9.843 -14.533 331 HB3 TYR 58 HB3 TYR 58 7.377 -10.559 -13.528 332 HD1 TYR 58 HD2 TYR 58 7.050 -8.454 -11.434 333 HD2 TYR 58 HD1 TYR 58 7.514 -8.118 -15.673 334 HE1 TYR 58 HE2 TYR 58 5.806 -6.237 -11.401 335 HE2 TYR 58 HE1 TYR 58 6.269 -5.902 -15.627 336 HH TYR 58 HH TYR 58 5.080 -4.534 -14.422 337 H GLN 59 H GLN 59 10.768 -11.556 -13.574 338 HA GLN 59 HA GLN 59 9.595 -13.844 -12.243 339 HB2 GLN 59 HB2 GLN 59 11.499 -13.579 -14.605 340 HB3 GLN 59 HB3 GLN 59 11.085 -15.126 -13.894 341 HG2 GLN 59 HG2 GLN 59 8.824 -14.993 -14.569 342 HG3 GLN 59 HG3 GLN 59 8.853 -13.244 -14.689 343 HE21 GLN 59 HE21 GLN 59 7.906 -13.501 -16.761 344 HE22 GLN 59 HE22 GLN 59 8.864 -13.873 -18.156 345 H LYS 60 H LYS 60 11.789 -11.604 -11.399 346 HA LYS 60 HA LYS 60 13.860 -13.466 -10.540 347 HB2 LYS 60 HB2 LYS 60 14.734 -11.519 -11.576 348 HB3 LYS 60 HB3 LYS 60 13.675 -10.453 -10.673 349 HG2 LYS 60 HG2 LYS 60 16.072 -10.540 -9.821 350 HG3 LYS 60 HG3 LYS 60 14.853 -10.861 -8.605 351 HD2 LYS 60 HD2 LYS 60 16.635 -12.516 -8.373 352 HD3 LYS 60 HD3 LYS 60 15.190 -13.329 -8.939 353 HE2 LYS 60 HE2 LYS 60 17.095 -14.130 -10.246 354 HE3 LYS 60 HE3 LYS 60 16.054 -13.190 -11.298 355 HZ1 LYS 60 HZ1 LYS 60 18.697 -12.761 -10.837 356 HZ2 LYS 60 HZ2 LYS 60 17.678 -11.756 -11.623 357 HZ3 LYS 60 HZ3 LYS 60 17.960 -11.548 -10.028 358 H ASP 61 H ASP 61 11.824 -10.810 -9.109 359 HA ASP 61 HA ASP 61 12.378 -11.370 -6.516 360 HB2 ASP 61 HB2 ASP 61 11.121 -9.391 -7.141 361 HB3 ASP 61 HB3 ASP 61 9.839 -10.350 -7.854 362 HD2 ASP 61 HD2 ASP 61 10.656 -10.915 -4.182 363 H ASN 62 H ASN 62 9.276 -12.270 -8.223 364 HA ASN 62 HA ASN 62 9.452 -14.945 -7.356 365 HB2 ASN 62 HB2 ASN 62 8.573 -13.432 -5.317 366 HB3 ASN 62 HB3 ASN 62 7.057 -13.491 -6.195 367 HD21 ASN 62 HD21 ASN 62 5.746 -15.007 -5.562 368 HD22 ASN 62 HD22 ASN 62 6.156 -16.577 -4.955 369 H SER 63 H SER 63 7.056 -15.988 -7.815 370 HA SER 63 HA SER 63 6.239 -14.784 -10.326 371 HB2 SER 63 HB2 SER 63 5.292 -17.004 -10.858 372 HB3 SER 63 HB3 SER 63 6.986 -17.132 -10.429 373 HG SER 63 HG SER 63 5.693 -18.771 -9.380 374 H CYS 64 H CYS 64 4.098 -14.107 -10.679 375 HA CYS 64 HA CYS 64 2.583 -13.476 -8.425 376 HB2 CYS 64 HB2 CYS 64 2.124 -12.022 -10.127 377 HB3 CYS 64 HB3 CYS 64 2.244 -13.248 -11.374 378 HG CYS 64 HG CYS 64 -0.074 -13.605 -11.641 379 H ASN 65 H ASN 65 2.835 -16.316 -10.502 380 HA ASN 65 HA ASN 65 0.923 -17.631 -8.810 381 HB2 ASN 65 HB2 ASN 65 0.598 -17.306 -11.823 382 HB3 ASN 65 HB3 ASN 65 -0.078 -18.702 -11.007 383 HD21 ASN 65 HD21 ASN 65 -0.797 -15.768 -12.150 384 HD22 ASN 65 HD22 ASN 65 -2.100 -15.283 -11.117 385 H LEU 66 H LEU 66 0.872 -20.138 -9.677 386 HA LEU 66 HA LEU 66 3.428 -21.127 -9.424 387 HB2 LEU 66 HB2 LEU 66 0.789 -22.208 -10.274 388 HB3 LEU 66 HB3 LEU 66 2.207 -23.181 -10.608 389 HG LEU 66 HG LEU 66 2.737 -22.722 -8.053 390 HD11 LEU 66 HD11 LEU 66 -0.258 -22.312 -8.220 391 HD12 LEU 66 HD12 LEU 66 0.616 -22.724 -6.725 392 HD13 LEU 66 HD13 LEU 66 0.964 -21.195 -7.566 393 HD21 LEU 66 HD21 LEU 66 0.558 -24.713 -8.396 394 HD22 LEU 66 HD22 LEU 66 1.976 -24.874 -9.459 395 HD23 LEU 66 HD23 LEU 66 2.183 -24.888 -7.691 396 H PHE 67 H PHE 67 1.590 -20.148 -12.331 397 HA PHE 67 HA PHE 67 3.976 -20.812 -13.908 398 HB2 PHE 67 HB2 PHE 67 1.874 -22.052 -14.504 399 HB3 PHE 67 HB3 PHE 67 0.987 -20.543 -14.587 400 HD1 PHE 67 HD2 PHE 67 4.373 -20.660 -15.926 401 HD2 PHE 67 HD1 PHE 67 0.256 -21.098 -16.858 402 HE1 PHE 67 HE2 PHE 67 4.908 -20.480 -18.372 403 HE2 PHE 67 HE1 PHE 67 0.791 -20.918 -19.304 404 HZ PHE 67 HZ PHE 67 3.110 -20.611 -20.032 405 H ASN 68 H ASN 68 5.166 -19.039 -14.417 406 HA ASN 68 HA ASN 68 4.144 -16.468 -14.075 407 HB2 ASN 68 HB2 ASN 68 6.641 -17.573 -15.443 408 HB3 ASN 68 HB3 ASN 68 6.326 -15.850 -15.380 409 HD21 ASN 68 HD21 ASN 68 7.940 -18.274 -13.946 410 HD22 ASN 68 HD22 ASN 68 8.102 -17.686 -12.325 411 H THR 69 H THR 69 2.713 -15.453 -15.488 412 HA THR 69 HA THR 69 2.696 -16.344 -18.281 413 HB THR 69 HB THR 69 0.447 -15.030 -18.168 414 HG1 THR 69 HG1 THR 69 0.633 -15.493 -15.355 415 HG21 THR 69 HG21 THR 69 0.953 -17.427 -16.333 416 HG22 THR 69 HG22 THR 69 -0.670 -16.791 -16.692 417 HG23 THR 69 HG23 THR 69 0.329 -17.472 -17.999 418 H LEU 70 H LEU 70 3.690 -15.194 -19.801 419 HA LEU 70 HA LEU 70 4.893 -12.727 -19.181 420 HB2 LEU 70 HB2 LEU 70 5.485 -14.579 -20.912 421 HB3 LEU 70 HB3 LEU 70 4.397 -13.705 -21.972 422 HG LEU 70 HG LEU 70 6.393 -12.763 -22.561 423 HD11 LEU 70 HD11 LEU 70 4.935 -10.946 -21.895 424 HD12 LEU 70 HD12 LEU 70 5.529 -11.044 -20.219 425 HD13 LEU 70 HD13 LEU 70 6.627 -10.536 -21.525 426 HD21 LEU 70 HD21 LEU 70 7.272 -13.130 -19.693 427 HD22 LEU 70 HD22 LEU 70 7.885 -13.939 -21.156 428 HD23 LEU 70 HD23 LEU 70 8.216 -12.210 -20.889 429 H THR 71 H THR 71 1.832 -13.684 -20.786 430 HA THR 71 HA THR 71 1.163 -11.188 -21.830 431 HB THR 71 HB THR 71 0.130 -13.587 -22.137 432 HG1 THR 71 HG1 THR 71 -1.526 -12.366 -23.042 433 HG21 THR 71 HG21 THR 71 -1.585 -14.257 -20.699 434 HG22 THR 71 HG22 THR 71 -0.538 -13.447 -19.509 435 HG23 THR 71 HG23 THR 71 -1.942 -12.590 -20.190 436 H GLU 72 H GLU 72 0.947 -12.480 -18.517 437 HA GLU 72 HA GLU 72 -0.754 -10.437 -17.616 438 HB2 GLU 72 HB2 GLU 72 -0.385 -12.686 -16.508 439 HB3 GLU 72 HB3 GLU 72 1.194 -12.129 -15.990 440 HG2 GLU 72 HG2 GLU 72 -0.162 -10.067 -15.001 441 HG3 GLU 72 HG3 GLU 72 -1.537 -11.147 -15.120 442 HE2 GLU 72 HE2 GLU 72 0.851 -13.454 -13.492 443 H ALA 73 H ALA 73 2.793 -10.843 -17.893 444 HA ALA 73 HA ALA 73 3.440 -8.584 -16.314 445 HB1 ALA 73 HB1 ALA 73 4.769 -10.685 -17.788 446 HB2 ALA 73 HB2 ALA 73 5.499 -9.115 -18.199 447 HB3 ALA 73 HB3 ALA 73 5.414 -9.639 -16.501 448 H ARG 74 H ARG 74 3.223 -9.181 -19.889 449 HA ARG 74 HA ARG 74 3.862 -6.578 -20.567 450 HB2 ARG 74 HB2 ARG 74 3.448 -7.263 -22.762 451 HB3 ARG 74 HB3 ARG 74 3.616 -8.829 -21.993 452 HG2 ARG 74 HG2 ARG 74 1.099 -8.877 -21.662 453 HG3 ARG 74 HG3 ARG 74 0.989 -7.382 -22.570 454 HD2 ARG 74 HD2 ARG 74 0.557 -9.327 -24.044 455 HD3 ARG 74 HD3 ARG 74 2.002 -8.478 -24.557 456 HE ARG 74 HE ARG 74 2.840 -10.471 -22.723 457 HH11 ARG 74 HH22 ARG 74 1.320 -10.301 -25.892 458 HH12 ARG 74 HH21 ARG 74 1.958 -11.822 -26.421 459 HH21 ARG 74 HH12 ARG 74 3.683 -12.478 -23.420 460 HH22 ARG 74 HH11 ARG 74 3.311 -13.069 -25.005 461 H ASP 75 H ASP 75 0.864 -8.125 -19.489 462 HA ASP 75 HA ASP 75 -0.843 -6.120 -20.494 463 HB2 ASP 75 HB2 ASP 75 -1.860 -8.226 -20.061 464 HB3 ASP 75 HB3 ASP 75 -1.089 -8.384 -18.496 465 HD2 ASP 75 HD2 ASP 75 -3.941 -7.910 -17.167 466 H ALA 76 H ALA 76 0.970 -6.787 -17.472 467 HA ALA 76 HA ALA 76 -0.344 -4.873 -15.868 468 HB1 ALA 76 HB1 ALA 76 0.968 -5.791 -14.280 469 HB2 ALA 76 HB2 ALA 76 1.539 -6.908 -15.543 470 HB3 ALA 76 HB3 ALA 76 2.454 -5.423 -15.188 471 H ILE 77 H ILE 77 2.612 -4.831 -17.944 472 HA ILE 77 HA ILE 77 3.196 -2.121 -17.258 473 HB ILE 77 HB ILE 77 4.268 -3.743 -19.563 474 HG12 ILE 77 HG12 ILE 77 5.730 -3.651 -16.971 475 HG13 ILE 77 HG13 ILE 77 4.323 -4.692 -17.044 476 HG21 ILE 77 HG21 ILE 77 5.308 -1.356 -18.021 477 HG22 ILE 77 HG22 ILE 77 6.295 -2.325 -19.140 478 HG23 ILE 77 HG23 ILE 77 4.872 -1.443 -19.745 479 HD11 ILE 77 HD11 ILE 77 5.234 -5.812 -19.071 480 HD12 ILE 77 HD12 ILE 77 6.658 -4.746 -19.012 481 HD13 ILE 77 HD13 ILE 77 6.371 -5.920 -17.705 482 H LYS 78 H LYS 78 1.445 -3.862 -19.849 483 HA LYS 78 HA LYS 78 1.170 -1.569 -21.496 484 HB2 LYS 78 HB2 LYS 78 1.090 -3.794 -22.441 485 HB3 LYS 78 HB3 LYS 78 -0.271 -4.234 -21.429 486 HG2 LYS 78 HG2 LYS 78 -1.446 -3.639 -23.332 487 HG3 LYS 78 HG3 LYS 78 -1.375 -2.060 -22.574 488 HD2 LYS 78 HD2 LYS 78 0.903 -1.796 -23.881 489 HD3 LYS 78 HD3 LYS 78 0.319 -3.132 -24.854 490 HE2 LYS 78 HE2 LYS 78 -1.661 -1.888 -25.532 491 HE3 LYS 78 HE3 LYS 78 -1.351 -0.628 -24.354 492 HZ1 LYS 78 HZ1 LYS 78 0.922 -0.728 -25.800 493 HZ2 LYS 78 HZ2 LYS 78 -0.228 -0.976 -26.932 494 HZ3 LYS 78 HZ3 LYS 78 -0.279 0.361 -25.995 495 H ASP 79 H ASP 79 -0.516 -2.888 -18.680 496 HA ASP 79 HA ASP 79 -2.888 -1.444 -19.125 497 HB2 ASP 79 HB2 ASP 79 -3.173 -3.257 -17.666 498 HB3 ASP 79 HB3 ASP 79 -1.643 -2.984 -16.857 499 HD2 ASP 79 HD2 ASP 79 -1.557 -1.415 -15.390 500 H ALA 80 H ALA 80 0.065 -1.048 -17.044 501 HA ALA 80 HA ALA 80 -0.769 1.362 -15.851 502 HB1 ALA 80 HB1 ALA 80 1.337 -0.486 -15.613 503 HB2 ALA 80 HB2 ALA 80 2.121 1.045 -16.074 504 HB3 ALA 80 HB3 ALA 80 1.082 0.976 -14.630 505 H TYR 81 H TYR 81 1.146 0.545 -18.791 506 HA TYR 81 HA TYR 81 1.979 3.144 -19.374 507 HB2 TYR 81 HB2 TYR 81 1.378 0.539 -20.861 508 HB3 TYR 81 HB3 TYR 81 1.840 1.948 -21.794 509 HD1 TYR 81 HD2 TYR 81 3.202 1.192 -18.430 510 HD2 TYR 81 HD1 TYR 81 3.902 1.066 -22.649 511 HE1 TYR 81 HE2 TYR 81 5.655 0.668 -18.015 512 HE2 TYR 81 HE1 TYR 81 6.352 0.543 -22.220 513 HH TYR 81 HH TYR 81 7.485 -0.479 -19.263 514 H GLU 82 H GLU 82 -0.868 1.249 -20.610 515 HA GLU 82 HA GLU 82 -1.818 3.467 -22.063 516 HB2 GLU 82 HB2 GLU 82 -2.303 1.122 -22.705 517 HB3 GLU 82 HB3 GLU 82 -3.211 0.885 -21.225 518 HG2 GLU 82 HG2 GLU 82 -3.954 3.123 -23.141 519 HG3 GLU 82 HG3 GLU 82 -4.509 1.487 -23.433 520 HE2 GLU 82 HE2 GLU 82 -6.204 1.539 -20.211 521 H SER 83 H SER 83 -2.116 2.336 -18.745 522 HA SER 83 HA SER 83 -4.548 3.573 -18.162 523 HB2 SER 83 HB2 SER 83 -3.824 1.918 -16.632 524 HB3 SER 83 HB3 SER 83 -2.206 2.582 -16.521 525 HG SER 83 HG SER 83 -4.404 4.199 -15.659 526 H TYR 84 H TYR 84 -1.115 4.639 -18.109 527 HA TYR 84 HA TYR 84 -1.985 7.282 -17.188 528 HB2 TYR 84 HB2 TYR 84 0.567 5.612 -17.326 529 HB3 TYR 84 HB3 TYR 84 0.733 7.355 -17.255 530 HD1 TYR 84 HD1 TYR 84 -0.086 8.610 -15.251 531 HD2 TYR 84 HD2 TYR 84 -0.056 4.334 -15.386 532 HE1 TYR 84 HE1 TYR 84 -0.314 8.521 -12.721 533 HE2 TYR 84 HE2 TYR 84 -0.284 4.260 -12.855 534 HH TYR 84 HH TYR 84 -1.171 6.945 -11.047 535 H CYS 85 H CYS 85 -1.296 5.519 -20.041 536 HA CYS 85 HA CYS 85 0.224 7.087 -21.593 537 HB2 CYS 85 HB2 CYS 85 -0.543 5.149 -22.618 538 HB3 CYS 85 HB3 CYS 85 -2.215 5.436 -22.180 539 HG CYS 85 HG CYS 85 -2.620 5.985 -24.486 540 H GLY 86 H GLY 86 -0.020 9.050 -22.764 541 HA2 GLY 86 HA2 GLY 86 -1.383 10.771 -23.662 542 HA3 GLY 86 HA3 GLY 86 -2.561 10.497 -22.394 543 H ILE 87 H ILE 87 -0.460 10.206 -20.252 544 HA ILE 87 HA ILE 87 0.052 13.068 -19.949 545 HB ILE 87 HB ILE 87 -0.030 10.827 -17.927 546 HG12 ILE 87 HG12 ILE 87 -2.033 12.491 -17.226 547 HG13 ILE 87 HG13 ILE 87 -2.056 12.746 -18.960 548 HG21 ILE 87 HG21 ILE 87 0.953 13.595 -17.780 549 HG22 ILE 87 HG22 ILE 87 -0.220 13.159 -16.515 550 HG23 ILE 87 HG23 ILE 87 1.265 12.200 -16.720 551 HD11 ILE 87 HD11 ILE 87 -2.232 10.048 -17.542 552 HD12 ILE 87 HD12 ILE 87 -3.555 10.890 -18.385 553 HD13 ILE 87 HD13 ILE 87 -2.169 10.261 -19.308 554 H ASP 88 H ASP 88 1.974 13.556 -20.932 555 HA ASP 88 HA ASP 88 4.197 11.811 -20.214 556 HB2 ASP 88 HB2 ASP 88 5.310 12.703 -22.280 557 HB3 ASP 88 HB3 ASP 88 3.837 11.818 -22.624 558 HD2 ASP 88 HD2 ASP 88 4.303 14.855 -24.492 559 H ASP 89 H ASP 89 2.672 14.696 -19.491 560 HA ASP 89 HA ASP 89 5.064 15.771 -18.375 561 HB2 ASP 89 HB2 ASP 89 4.974 16.748 -20.708 562 HB3 ASP 89 HB3 ASP 89 3.408 17.436 -20.329 563 HD2 ASP 89 HD2 ASP 89 6.527 19.468 -19.846 564 H CYS 90 H CYS 90 4.491 16.789 -16.411 565 HA CYS 90 HA CYS 90 1.621 17.185 -16.003 566 HB2 CYS 90 HB2 CYS 90 2.501 17.148 -13.491 567 HB3 CYS 90 HB3 CYS 90 2.109 15.678 -14.362 568 HA PRO 91 HA PRO 91 3.135 21.376 -15.988 569 HB2 PRO 91 HB2 PRO 91 0.773 22.566 -16.679 570 HB3 PRO 91 HB3 PRO 91 1.944 22.005 -17.856 571 HG2 PRO 91 HG2 PRO 91 -0.637 20.788 -17.085 572 HG3 PRO 91 HG3 PRO 91 0.328 20.500 -18.520 573 HD2 PRO 91 HD2 PRO 91 0.118 18.796 -16.222 574 HD3 PRO 91 HD3 PRO 91 1.170 18.567 -17.604 575 H GLN 92 H GLN 92 0.857 19.773 -14.113 576 HA GLN 92 HA GLN 92 -0.108 21.832 -12.588 577 HB2 GLN 92 HB2 GLN 92 0.396 18.896 -12.085 578 HB3 GLN 92 HB3 GLN 92 -0.130 19.907 -10.754 579 HG2 GLN 92 HG2 GLN 92 -2.016 20.730 -12.363 580 HG3 GLN 92 HG3 GLN 92 -1.583 19.364 -13.371 581 HE21 GLN 92 HE21 GLN 92 -0.970 17.404 -11.636 582 HE22 GLN 92 HE22 GLN 92 -2.333 16.951 -10.667 583 H CYS 93 H CYS 93 2.871 19.816 -12.119 584 HA CYS 93 HA CYS 93 3.637 21.297 -9.816 585 HB2 CYS 93 HB2 CYS 93 5.688 19.958 -9.899 586 HB3 CYS 93 HB3 CYS 93 4.264 18.948 -10.049 587 H SER 94 H SER 94 4.198 21.364 -13.340 588 HA SER 94 HA SER 94 6.456 22.959 -13.329 589 HB2 SER 94 HB2 SER 94 5.450 21.672 -15.285 590 HB3 SER 94 HB3 SER 94 4.249 22.939 -15.432 591 HG SER 94 HG SER 94 7.018 22.982 -16.057 592 H LYS 95 H LYS 95 2.994 23.670 -12.924 593 HA LYS 95 HA LYS 95 3.459 26.520 -13.201 594 HB2 LYS 95 HB2 LYS 95 1.093 24.715 -13.126 595 HB3 LYS 95 HB3 LYS 95 0.869 26.326 -12.475 596 HG2 LYS 95 HG2 LYS 95 0.441 26.816 -14.691 597 HG3 LYS 95 HG3 LYS 95 2.180 27.024 -14.729 598 HD2 LYS 95 HD2 LYS 95 2.541 24.871 -15.710 599 HD3 LYS 95 HD3 LYS 95 0.944 24.301 -15.268 600 HE2 LYS 95 HE2 LYS 95 1.161 26.696 -17.102 601 HE3 LYS 95 HE3 LYS 95 1.478 25.106 -17.765 602 HZ1 LYS 95 HZ1 LYS 95 -0.658 24.397 -17.130 603 HZ2 LYS 95 HZ2 LYS 95 -0.946 25.733 -16.236 604 HZ3 LYS 95 HZ3 LYS 95 -0.863 25.842 -17.863 605 H TYR 96 H TYR 96 2.972 23.997 -10.734 606 HA TYR 96 HA TYR 96 2.273 25.492 -8.561 607 HB2 TYR 96 HB2 TYR 96 2.591 22.990 -8.718 608 HB3 TYR 96 HB3 TYR 96 4.316 23.213 -8.928 609 HD1 TYR 96 HD2 TYR 96 5.676 24.161 -6.998 610 HD2 TYR 96 HD1 TYR 96 1.620 22.877 -6.551 611 HE1 TYR 96 HE2 TYR 96 5.995 24.007 -4.480 612 HE2 TYR 96 HE1 TYR 96 1.952 22.728 -4.034 613 HH TYR 96 HH TYR 96 3.929 22.362 -2.500 614 H ILE 97 H ILE 97 3.122 27.423 -7.927 615 HA ILE 97 HA ILE 97 5.633 28.345 -8.547 616 HB ILE 97 HB ILE 97 3.780 29.727 -7.800 617 HG12 ILE 97 HG12 ILE 97 6.157 30.502 -7.647 618 HG13 ILE 97 HG13 ILE 97 5.043 31.326 -6.575 619 HG21 ILE 97 HG21 ILE 97 3.802 27.938 -5.532 620 HG22 ILE 97 HG22 ILE 97 3.921 29.632 -4.999 621 HG23 ILE 97 HG23 ILE 97 2.572 29.120 -6.040 622 HD11 ILE 97 HD11 ILE 97 6.462 30.811 -4.882 623 HD12 ILE 97 HD12 ILE 97 5.924 29.123 -5.057 624 HD13 ILE 97 HD13 ILE 97 7.379 29.687 -5.913 625 H ASP 98 H ASP 98 7.667 27.883 -7.885 626 HA ASP 98 HA ASP 98 7.883 25.992 -5.715 627 HB2 ASP 98 HB2 ASP 98 9.644 26.910 -7.987 628 HB3 ASP 98 HB3 ASP 98 10.431 26.248 -6.568 629 HD2 ASP 98 HD2 ASP 98 9.082 23.394 -6.457 630 H ASP 99 H ASP 99 7.921 27.107 -3.727 631 HA ASP 99 HA ASP 99 8.727 29.693 -3.397 632 HB2 ASP 99 HB2 ASP 99 7.433 28.328 -1.743 633 HB3 ASP 99 HB3 ASP 99 8.871 27.388 -1.395 634 HD2 ASP 99 HD2 ASP 99 10.338 30.588 -0.567 Start of MODEL 6 1 H GLU 14 H GLU 14 -2.066 -4.393 -2.750 2 HA GLU 14 HA GLU 14 -0.614 -2.458 -1.178 3 HB2 GLU 14 HB2 GLU 14 0.234 -5.198 -2.220 4 HB3 GLU 14 HB3 GLU 14 1.155 -4.207 -1.106 5 HG2 GLU 14 HG2 GLU 14 -0.788 -4.280 0.510 6 HG3 GLU 14 HG3 GLU 14 -1.630 -5.352 -0.592 7 HE2 GLU 14 HE2 GLU 14 1.201 -6.789 1.773 8 H ASP 15 H ASP 15 -0.782 -3.841 -4.473 9 HA ASP 15 HA ASP 15 0.129 -3.273 -6.355 10 HB2 ASP 15 HB2 ASP 15 1.092 -0.616 -5.286 11 HB3 ASP 15 HB3 ASP 15 0.406 -0.982 -6.857 12 HD2 ASP 15 HD2 ASP 15 -0.162 0.523 -4.166 13 H GLN 16 H GLN 16 1.794 -4.780 -4.671 14 HA GLN 16 HA GLN 16 4.279 -3.545 -4.243 15 HB2 GLN 16 HB2 GLN 16 3.215 -6.366 -4.130 16 HB3 GLN 16 HB3 GLN 16 4.951 -6.128 -4.104 17 HG2 GLN 16 HG2 GLN 16 4.452 -4.352 -2.223 18 HG3 GLN 16 HG3 GLN 16 2.888 -5.133 -2.110 19 HE21 GLN 16 HE21 GLN 16 5.074 -4.986 -0.190 20 HE22 GLN 16 HE22 GLN 16 5.518 -6.609 0.219 21 H GLU 17 H GLU 17 2.843 -5.517 -6.873 22 HA GLU 17 HA GLU 17 5.111 -6.152 -8.236 23 HB2 GLU 17 HB2 GLU 17 3.675 -6.422 -10.190 24 HB3 GLU 17 HB3 GLU 17 2.806 -6.957 -8.766 25 HG2 GLU 17 HG2 GLU 17 1.164 -5.615 -9.707 26 HG3 GLU 17 HG3 GLU 17 1.967 -4.411 -8.719 27 HE2 GLU 17 HE2 GLU 17 2.105 -5.822 -11.835 28 H GLN 18 H GLN 18 3.341 -3.055 -8.058 29 HA GLN 18 HA GLN 18 4.436 -1.828 -10.252 30 HB2 GLN 18 HB2 GLN 18 2.573 -1.054 -8.590 31 HB3 GLN 18 HB3 GLN 18 3.882 -0.364 -7.651 32 HG2 GLN 18 HG2 GLN 18 4.630 0.923 -9.684 33 HG3 GLN 18 HG3 GLN 18 3.272 0.269 -10.578 34 HE21 GLN 18 HE21 GLN 18 4.368 2.577 -8.302 35 HE22 GLN 18 HE22 GLN 18 2.875 3.404 -8.002 36 H TRP 19 H TRP 19 5.806 -2.531 -7.052 37 HA TRP 19 HA TRP 19 7.867 -0.696 -6.981 38 HB2 TRP 19 HB2 TRP 19 7.068 -2.351 -5.210 39 HB3 TRP 19 HB3 TRP 19 8.079 -3.541 -6.007 40 HD1 TRP 19 HD1 TRP 19 8.502 -0.077 -4.262 41 HE1 TRP 19 HE1 TRP 19 10.895 0.126 -3.170 42 HE3 TRP 19 HE3 TRP 19 10.259 -4.510 -6.027 43 HZ2 TRP 19 HZ2 TRP 19 13.203 -1.552 -3.166 44 HZ3 TRP 19 HZ3 TRP 19 12.593 -5.153 -5.433 45 HH2 TRP 19 HH2 TRP 19 14.050 -3.756 -4.054 46 H ALA 20 H ALA 20 7.627 -3.958 -8.536 47 HA ALA 20 HA ALA 20 10.263 -4.041 -9.459 48 HB1 ALA 20 HB1 ALA 20 9.008 -5.602 -11.227 49 HB2 ALA 20 HB2 ALA 20 9.210 -6.096 -9.529 50 HB3 ALA 20 HB3 ALA 20 7.663 -5.407 -10.078 51 H MET 21 H MET 21 7.293 -2.484 -10.686 52 HA MET 21 HA MET 21 8.147 -2.050 -13.271 53 HB2 MET 21 HB2 MET 21 5.974 -1.299 -11.543 54 HB3 MET 21 HB3 MET 21 6.582 0.195 -12.227 55 HG2 MET 21 HG2 MET 21 6.380 -1.947 -14.250 56 HG3 MET 21 HG3 MET 21 4.838 -1.614 -13.489 57 HE1 MET 21 HE1 MET 21 4.569 2.115 -13.594 58 HE2 MET 21 HE2 MET 21 3.419 1.052 -14.440 59 HE3 MET 21 HE3 MET 21 4.112 0.551 -12.879 60 H GLN 22 H GLN 22 9.173 -0.609 -10.250 61 HA GLN 22 HA GLN 22 9.891 1.894 -11.036 62 HB2 GLN 22 HB2 GLN 22 11.104 1.987 -9.051 63 HB3 GLN 22 HB3 GLN 22 10.052 0.625 -8.721 64 HG2 GLN 22 HG2 GLN 22 11.858 -0.943 -9.483 65 HG3 GLN 22 HG3 GLN 22 12.910 0.426 -9.782 66 HE21 GLN 22 HE21 GLN 22 11.917 -1.870 -7.579 67 HE22 GLN 22 HE22 GLN 22 12.575 -1.214 -6.117 68 H THR 23 H THR 23 11.682 -1.219 -11.412 69 HA THR 23 HA THR 23 13.937 0.071 -12.633 70 HB THR 23 HB THR 23 13.270 -2.894 -12.733 71 HG1 THR 23 HG1 THR 23 13.983 -1.082 -10.555 72 HG21 THR 23 HG21 THR 23 15.628 -3.183 -12.511 73 HG22 THR 23 HG22 THR 23 15.497 -1.784 -13.605 74 HG23 THR 23 HG23 THR 23 15.856 -1.535 -11.879 75 H LEU 24 H LEU 24 11.537 -2.342 -13.901 76 HA LEU 24 HA LEU 24 12.157 -2.309 -16.486 77 HB2 LEU 24 HB2 LEU 24 10.425 -3.684 -16.076 78 HB3 LEU 24 HB3 LEU 24 9.647 -2.576 -14.963 79 HG LEU 24 HG LEU 24 9.625 -1.769 -17.822 80 HD11 LEU 24 HD11 LEU 24 7.885 -3.271 -18.487 81 HD12 LEU 24 HD12 LEU 24 9.257 -4.241 -17.899 82 HD13 LEU 24 HD13 LEU 24 7.824 -4.008 -16.868 83 HD21 LEU 24 HD21 LEU 24 8.493 -0.713 -15.670 84 HD22 LEU 24 HD22 LEU 24 7.708 -0.664 -17.267 85 HD23 LEU 24 HD23 LEU 24 7.211 -1.882 -16.068 86 H MET 25 H MET 25 10.038 0.180 -14.904 87 HA MET 25 HA MET 25 9.941 1.710 -17.273 88 HB2 MET 25 HB2 MET 25 8.323 2.847 -16.076 89 HB3 MET 25 HB3 MET 25 8.513 1.574 -14.886 90 HG2 MET 25 HG2 MET 25 10.292 2.944 -13.739 91 HG3 MET 25 HG3 MET 25 10.038 4.225 -14.906 92 HE1 MET 25 HE1 MET 25 6.357 3.621 -14.889 93 HE2 MET 25 HE2 MET 25 6.477 5.336 -14.425 94 HE3 MET 25 HE3 MET 25 7.597 4.660 -15.631 95 H GLY 26 H GLY 26 11.982 1.656 -14.342 96 HA2 GLY 26 HA2 GLY 26 13.159 4.204 -14.649 97 HA3 GLY 26 HA3 GLY 26 13.792 2.848 -13.738 98 H SER 27 H SER 27 13.327 1.411 -16.636 99 HA SER 27 HA SER 27 16.029 1.395 -17.256 100 HB2 SER 27 HB2 SER 27 13.638 0.626 -18.989 101 HB3 SER 27 HB3 SER 27 15.300 0.180 -19.321 102 HG SER 27 HG SER 27 15.135 -1.434 -17.930 103 H GLY 28 H GLY 28 13.711 3.826 -17.722 104 HA2 GLY 28 HA2 GLY 28 14.290 5.906 -18.628 105 HA3 GLY 28 HA3 GLY 28 15.411 5.131 -19.730 106 H VAL 29 H VAL 29 12.620 3.211 -19.610 107 HA VAL 29 HA VAL 29 11.869 4.010 -22.238 108 HB VAL 29 HB VAL 29 10.818 2.012 -20.238 109 HG11 VAL 29 HG11 VAL 29 9.867 2.383 -23.098 110 HG12 VAL 29 HG12 VAL 29 9.320 1.149 -21.938 111 HG13 VAL 29 HG13 VAL 29 8.954 2.866 -21.648 112 HG21 VAL 29 HG21 VAL 29 12.839 2.002 -22.349 113 HG22 VAL 29 HG22 VAL 29 12.552 0.839 -21.033 114 HG23 VAL 29 HG23 VAL 29 11.636 0.707 -22.553 115 H LEU 30 H LEU 30 10.421 4.259 -18.932 116 HA LEU 30 HA LEU 30 8.370 6.003 -20.075 117 HB2 LEU 30 HB2 LEU 30 8.537 4.620 -17.394 118 HB3 LEU 30 HB3 LEU 30 7.232 5.671 -17.908 119 HG LEU 30 HG LEU 30 7.996 3.067 -19.260 120 HD11 LEU 30 HD11 LEU 30 6.437 3.591 -16.883 121 HD12 LEU 30 HD12 LEU 30 5.429 2.858 -18.153 122 HD13 LEU 30 HD13 LEU 30 6.916 2.041 -17.615 123 HD21 LEU 30 HD21 LEU 30 5.386 3.730 -19.952 124 HD22 LEU 30 HD22 LEU 30 6.270 5.272 -20.052 125 HD23 LEU 30 HD23 LEU 30 6.832 3.862 -20.982 126 H ALA 31 H ALA 31 7.707 7.764 -18.231 127 HA ALA 31 HA ALA 31 10.232 9.024 -17.406 128 HB1 ALA 31 HB1 ALA 31 9.752 10.555 -19.005 129 HB2 ALA 31 HB2 ALA 31 8.078 9.978 -19.184 130 HB3 ALA 31 HB3 ALA 31 8.492 11.117 -17.880 131 H ARG 32 H ARG 32 10.304 9.668 -15.289 132 HA ARG 32 HA ARG 32 7.743 9.662 -13.905 133 HB2 ARG 32 HB2 ARG 32 9.280 8.945 -11.860 134 HB3 ARG 32 HB3 ARG 32 8.727 7.732 -12.997 135 HG2 ARG 32 HG2 ARG 32 10.870 7.924 -14.262 136 HG3 ARG 32 HG3 ARG 32 11.423 9.163 -13.154 137 HD2 ARG 32 HD2 ARG 32 10.563 6.444 -12.102 138 HD3 ARG 32 HD3 ARG 32 12.174 6.670 -12.754 139 HE ARG 32 HE ARG 32 11.598 8.777 -10.877 140 HH11 ARG 32 HH22 ARG 32 12.354 5.342 -10.997 141 HH12 ARG 32 HH21 ARG 32 13.071 5.314 -9.421 142 HH21 ARG 32 HH12 ARG 32 12.544 8.741 -8.797 143 HH22 ARG 32 HH11 ARG 32 13.179 7.261 -8.161 144 H CYS 33 H CYS 33 7.640 11.139 -12.003 145 HA CYS 33 HA CYS 33 9.286 13.467 -12.477 146 HB2 CYS 33 HB2 CYS 33 6.706 13.439 -12.127 147 HB3 CYS 33 HB3 CYS 33 7.084 13.287 -10.422 148 H ARG 34 H ARG 34 10.837 14.234 -10.996 149 HA ARG 34 HA ARG 34 11.925 12.355 -9.273 150 HB2 ARG 34 HB2 ARG 34 12.342 15.340 -9.689 151 HB3 ARG 34 HB3 ARG 34 13.206 14.503 -8.415 152 HG2 ARG 34 HG2 ARG 34 13.290 13.848 -11.396 153 HG3 ARG 34 HG3 ARG 34 14.586 14.550 -10.448 154 HD2 ARG 34 HD2 ARG 34 14.357 12.377 -8.961 155 HD3 ARG 34 HD3 ARG 34 13.497 11.717 -10.338 156 HE ARG 34 HE ARG 34 15.519 11.583 -11.512 157 HH11 ARG 34 HH22 ARG 34 15.921 13.747 -8.766 158 HH12 ARG 34 HH21 ARG 34 17.632 13.906 -8.978 159 HH21 ARG 34 HH12 ARG 34 17.777 11.793 -11.792 160 HH22 ARG 34 HH11 ARG 34 18.695 12.787 -10.712 161 H ILE 35 H ILE 35 9.168 14.338 -8.942 162 HA ILE 35 HA ILE 35 9.429 14.391 -6.020 163 HB ILE 35 HB ILE 35 7.654 16.001 -7.859 164 HG12 ILE 35 HG12 ILE 35 10.061 16.862 -6.228 165 HG13 ILE 35 HG13 ILE 35 10.069 16.586 -7.958 166 HG21 ILE 35 HG21 ILE 35 6.366 15.959 -5.978 167 HG22 ILE 35 HG22 ILE 35 7.749 15.679 -4.894 168 HG23 ILE 35 HG23 ILE 35 7.453 17.304 -5.557 169 HD11 ILE 35 HD11 ILE 35 7.840 18.291 -7.464 170 HD12 ILE 35 HD12 ILE 35 9.189 18.934 -6.497 171 HD13 ILE 35 HD13 ILE 35 9.377 18.720 -8.254 172 H HIS 36 H HIS 36 8.257 12.511 -8.519 173 HA HIS 36 HA HIS 36 6.337 11.309 -6.712 174 HB2 HIS 36 HB2 HIS 36 5.450 11.627 -9.547 175 HB3 HIS 36 HB3 HIS 36 4.498 11.422 -8.090 176 HD1 HIS 36 HD1 HIS 36 4.796 13.688 -6.365 177 HD2 HIS 36 HD2 HIS 36 5.293 14.171 -10.502 178 HE1 HIS 36 HE1 HIS 36 4.471 16.174 -6.838 179 H ASN 37 H ASN 37 6.996 9.234 -6.515 180 HA ASN 37 HA ASN 37 8.495 8.124 -8.721 181 HB2 ASN 37 HB2 ASN 37 9.143 8.038 -6.153 182 HB3 ASN 37 HB3 ASN 37 7.968 6.741 -6.058 183 HD21 ASN 37 HD21 ASN 37 10.688 6.443 -5.528 184 HD22 ASN 37 HD22 ASN 37 11.402 5.381 -6.695 185 H ASP 38 H ASP 38 5.309 8.294 -7.534 186 HA ASP 38 HA ASP 38 4.659 5.580 -8.280 187 HB2 ASP 38 HB2 ASP 38 2.434 6.085 -7.357 188 HB3 ASP 38 HB3 ASP 38 3.676 6.529 -6.204 189 HD2 ASP 38 HD2 ASP 38 4.062 8.910 -6.049 190 H VAL 39 H VAL 39 5.002 8.671 -9.663 191 HA VAL 39 HA VAL 39 2.722 8.506 -11.429 192 HB VAL 39 HB VAL 39 3.947 10.581 -10.345 193 HG11 VAL 39 HG11 VAL 39 5.354 10.444 -13.026 194 HG12 VAL 39 HG12 VAL 39 5.573 11.641 -11.727 195 HG13 VAL 39 HG13 VAL 39 6.122 9.964 -11.494 196 HG21 VAL 39 HG21 VAL 39 2.198 10.162 -12.574 197 HG22 VAL 39 HG22 VAL 39 2.302 11.564 -11.482 198 HG23 VAL 39 HG23 VAL 39 3.294 11.511 -12.959 199 H ILE 40 H ILE 40 2.726 7.740 -13.513 200 HA ILE 40 HA ILE 40 5.345 6.967 -14.590 201 HB ILE 40 HB ILE 40 4.578 4.909 -13.989 202 HG12 ILE 40 HG12 ILE 40 3.257 5.276 -16.694 203 HG13 ILE 40 HG13 ILE 40 4.972 5.022 -16.442 204 HG21 ILE 40 HG21 ILE 40 1.854 6.098 -14.278 205 HG22 ILE 40 HG22 ILE 40 2.031 4.334 -14.436 206 HG23 ILE 40 HG23 ILE 40 2.562 5.152 -12.947 207 HD11 ILE 40 HD11 ILE 40 4.681 2.786 -16.219 208 HD12 ILE 40 HD12 ILE 40 3.430 3.020 -14.975 209 HD13 ILE 40 HD13 ILE 40 2.984 3.030 -16.698 210 H LEU 41 H LEU 41 5.773 8.022 -16.446 211 HA LEU 41 HA LEU 41 3.451 8.950 -17.988 212 HB2 LEU 41 HB2 LEU 41 6.179 10.175 -18.169 213 HB3 LEU 41 HB3 LEU 41 4.623 10.859 -18.595 214 HG LEU 41 HG LEU 41 5.251 10.206 -15.724 215 HD11 LEU 41 HD11 LEU 41 6.032 12.581 -15.478 216 HD12 LEU 41 HD12 LEU 41 7.151 11.502 -16.346 217 HD13 LEU 41 HD13 LEU 41 6.148 12.659 -17.252 218 HD21 LEU 41 HD21 LEU 41 3.621 11.893 -15.229 219 HD22 LEU 41 HD22 LEU 41 3.527 12.380 -16.938 220 HD23 LEU 41 HD23 LEU 41 2.929 10.781 -16.434 221 H ASP 42 H ASP 42 3.661 8.904 -20.349 222 HA ASP 42 HA ASP 42 5.196 6.578 -21.105 223 HB2 ASP 42 HB2 ASP 42 2.677 7.019 -21.659 224 HB3 ASP 42 HB3 ASP 42 3.269 8.152 -22.858 225 HD2 ASP 42 HD2 ASP 42 5.061 4.841 -23.519 226 H SER 43 H SER 43 6.890 6.703 -22.671 227 HA SER 43 HA SER 43 7.576 9.423 -23.449 228 HB2 SER 43 HB2 SER 43 9.370 6.959 -23.330 229 HB3 SER 43 HB3 SER 43 9.894 8.595 -23.676 230 HG SER 43 HG SER 43 8.581 8.815 -21.381 231 H GLY 44 H GLY 44 7.164 6.030 -24.568 232 HA2 GLY 44 HA2 GLY 44 6.207 5.574 -26.676 233 HA3 GLY 44 HA3 GLY 44 6.903 7.049 -27.318 234 H ASN 45 H ASN 45 9.401 6.055 -25.484 235 HA ASN 45 HA ASN 45 10.900 5.205 -27.636 236 HB2 ASN 45 HB2 ASN 45 11.264 5.122 -24.620 237 HB3 ASN 45 HB3 ASN 45 12.450 4.336 -25.641 238 HD21 ASN 45 HD21 ASN 45 14.020 5.488 -26.498 239 HD22 ASN 45 HD22 ASN 45 14.121 7.216 -26.564 240 H ASP 46 H ASP 46 12.186 2.971 -27.540 241 HA ASP 46 HA ASP 46 10.498 0.943 -28.020 242 HB2 ASP 46 HB2 ASP 46 12.974 1.002 -28.485 243 HB3 ASP 46 HB3 ASP 46 13.283 0.709 -26.786 244 HD2 ASP 46 HD2 ASP 46 14.360 -1.010 -28.342 245 H ALA 47 H ALA 47 8.877 0.317 -26.548 246 HA ALA 47 HA ALA 47 9.384 0.306 -23.733 247 HB1 ALA 47 HB1 ALA 47 7.068 -0.302 -23.563 248 HB2 ALA 47 HB2 ALA 47 7.193 0.869 -24.898 249 HB3 ALA 47 HB3 ALA 47 7.026 -0.868 -25.250 250 H SER 48 H SER 48 10.124 -1.794 -26.324 251 HA SER 48 HA SER 48 9.588 -4.251 -25.163 252 HB2 SER 48 HB2 SER 48 10.342 -3.586 -27.596 253 HB3 SER 48 HB3 SER 48 11.970 -3.762 -26.973 254 HG SER 48 HG SER 48 10.045 -5.853 -26.548 255 H SER 49 H SER 49 12.367 -1.984 -24.930 256 HA SER 49 HA SER 49 14.117 -3.711 -23.678 257 HB2 SER 49 HB2 SER 49 13.800 -0.693 -23.675 258 HB3 SER 49 HB3 SER 49 15.061 -1.458 -22.728 259 HG SER 49 HG SER 49 15.688 -0.794 -24.948 260 H ALA 50 H ALA 50 11.861 -1.223 -22.272 261 HA ALA 50 HA ALA 50 12.411 -1.789 -19.609 262 HB1 ALA 50 HB1 ALA 50 11.199 0.124 -19.688 263 HB2 ALA 50 HB2 ALA 50 10.387 -0.344 -21.201 264 HB3 ALA 50 HB3 ALA 50 9.780 -0.949 -19.641 265 H TYR 51 H TYR 51 9.813 -3.059 -21.804 266 HA TYR 51 HA TYR 51 8.538 -4.681 -19.994 267 HB2 TYR 51 HB2 TYR 51 9.266 -4.991 -22.972 268 HB3 TYR 51 HB3 TYR 51 8.071 -6.007 -22.189 269 HD1 TYR 51 HD2 TYR 51 7.673 -2.966 -20.604 270 HD2 TYR 51 HD1 TYR 51 6.999 -4.789 -24.416 271 HE1 TYR 51 HE2 TYR 51 5.874 -1.245 -21.118 272 HE2 TYR 51 HE1 TYR 51 5.202 -3.061 -24.916 273 HH TYR 51 HH TYR 51 3.786 -1.582 -23.857 274 H LYS 52 H LYS 52 11.610 -5.204 -21.757 275 HA LYS 52 HA LYS 52 11.776 -7.961 -21.184 276 HB2 LYS 52 HB2 LYS 52 13.015 -6.457 -22.944 277 HB3 LYS 52 HB3 LYS 52 14.176 -6.214 -21.655 278 HG2 LYS 52 HG2 LYS 52 13.255 -9.023 -22.329 279 HG3 LYS 52 HG3 LYS 52 14.469 -8.248 -23.326 280 HD2 LYS 52 HD2 LYS 52 14.726 -8.419 -20.293 281 HD3 LYS 52 HD3 LYS 52 15.329 -9.677 -21.353 282 HE2 LYS 52 HE2 LYS 52 17.011 -8.311 -22.263 283 HE3 LYS 52 HE3 LYS 52 16.128 -6.829 -21.954 284 HZ1 LYS 52 HZ1 LYS 52 17.368 -6.660 -20.156 285 HZ2 LYS 52 HZ2 LYS 52 16.548 -7.910 -19.499 286 HZ3 LYS 52 HZ3 LYS 52 17.954 -8.179 -20.285 287 H LEU 53 H LEU 53 13.134 -4.997 -19.609 288 HA LEU 53 HA LEU 53 14.529 -6.342 -17.618 289 HB2 LEU 53 HB2 LEU 53 14.801 -3.977 -18.268 290 HB3 LEU 53 HB3 LEU 53 13.254 -3.604 -17.535 291 HG LEU 53 HG LEU 53 15.415 -3.102 -16.222 292 HD11 LEU 53 HD11 LEU 53 13.937 -4.486 -14.220 293 HD12 LEU 53 HD12 LEU 53 13.924 -2.752 -14.620 294 HD13 LEU 53 HD13 LEU 53 12.785 -3.859 -15.423 295 HD21 LEU 53 HD21 LEU 53 16.325 -5.444 -16.672 296 HD22 LEU 53 HD22 LEU 53 16.470 -4.817 -15.012 297 HD23 LEU 53 HD23 LEU 53 15.201 -6.001 -15.409 298 H GLY 54 H GLY 54 11.147 -5.046 -17.681 299 HA2 GLY 54 HA2 GLY 54 10.501 -5.834 -15.052 300 HA3 GLY 54 HA3 GLY 54 9.383 -5.453 -16.347 301 H THR 55 H THR 55 10.384 -7.492 -18.243 302 HA THR 55 HA THR 55 8.748 -9.623 -17.504 303 HB THR 55 HB THR 55 10.853 -9.051 -19.604 304 HG1 THR 55 HG1 THR 55 8.912 -8.964 -20.751 305 HG21 THR 55 HG21 THR 55 9.868 -11.753 -18.758 306 HG22 THR 55 HG22 THR 55 9.705 -11.383 -20.492 307 HG23 THR 55 HG23 THR 55 11.306 -11.324 -19.716 308 H TYR 56 H TYR 56 12.355 -9.329 -17.374 309 HA TYR 56 HA TYR 56 12.629 -11.902 -16.194 310 HB2 TYR 56 HB2 TYR 56 14.454 -10.890 -17.474 311 HB3 TYR 56 HB3 TYR 56 14.295 -9.364 -16.627 312 HD1 TYR 56 HD1 TYR 56 14.763 -12.919 -15.490 313 HD2 TYR 56 HD2 TYR 56 16.196 -8.889 -15.396 314 HE1 TYR 56 HE1 TYR 56 16.614 -13.607 -13.890 315 HE2 TYR 56 HE2 TYR 56 18.043 -9.591 -13.795 316 HH TYR 56 HH TYR 56 18.581 -12.971 -13.036 317 H LEU 57 H LEU 57 12.188 -8.573 -14.992 318 HA LEU 57 HA LEU 57 13.006 -9.194 -12.338 319 HB2 LEU 57 HB2 LEU 57 12.990 -6.939 -13.551 320 HB3 LEU 57 HB3 LEU 57 11.274 -6.889 -13.202 321 HG LEU 57 HG LEU 57 13.399 -7.191 -11.067 322 HD11 LEU 57 HD11 LEU 57 12.198 -4.623 -10.953 323 HD12 LEU 57 HD12 LEU 57 13.899 -5.042 -11.268 324 HD13 LEU 57 HD13 LEU 57 12.757 -4.878 -12.623 325 HD21 LEU 57 HD21 LEU 57 11.599 -7.788 -9.873 326 HD22 LEU 57 HD22 LEU 57 11.211 -6.050 -9.892 327 HD23 LEU 57 HD23 LEU 57 10.457 -7.144 -11.077 328 H TYR 58 H TYR 58 10.077 -9.571 -14.250 329 HA TYR 58 HA TYR 58 8.429 -9.896 -11.888 330 HB2 TYR 58 HB2 TYR 58 8.192 -9.896 -14.932 331 HB3 TYR 58 HB3 TYR 58 6.886 -10.611 -14.008 332 HD1 TYR 58 HD1 TYR 58 6.602 -8.837 -11.701 333 HD2 TYR 58 HD2 TYR 58 7.425 -7.872 -15.787 334 HE1 TYR 58 HE1 TYR 58 5.582 -6.532 -11.369 335 HE2 TYR 58 HE2 TYR 58 6.403 -5.570 -15.441 336 HH TYR 58 HH TYR 58 4.828 -4.735 -12.399 337 H GLN 59 H GLN 59 10.148 -11.841 -14.333 338 HA GLN 59 HA GLN 59 8.771 -14.218 -13.606 339 HB2 GLN 59 HB2 GLN 59 9.966 -15.236 -15.334 340 HB3 GLN 59 HB3 GLN 59 9.946 -13.569 -15.873 341 HG2 GLN 59 HG2 GLN 59 12.209 -13.298 -14.631 342 HG3 GLN 59 HG3 GLN 59 12.229 -15.045 -14.498 343 HE21 GLN 59 HE21 GLN 59 14.111 -15.085 -15.757 344 HE22 GLN 59 HE22 GLN 59 14.077 -14.923 -17.482 345 H LYS 60 H LYS 60 11.064 -12.324 -12.045 346 HA LYS 60 HA LYS 60 12.556 -14.571 -10.958 347 HB2 LYS 60 HB2 LYS 60 13.482 -12.224 -11.711 348 HB3 LYS 60 HB3 LYS 60 12.939 -11.710 -10.126 349 HG2 LYS 60 HG2 LYS 60 15.058 -12.430 -9.538 350 HG3 LYS 60 HG3 LYS 60 14.210 -13.952 -9.348 351 HD2 LYS 60 HD2 LYS 60 15.515 -13.139 -11.980 352 HD3 LYS 60 HD3 LYS 60 16.391 -14.003 -10.733 353 HE2 LYS 60 HE2 LYS 60 15.610 -15.826 -11.934 354 HE3 LYS 60 HE3 LYS 60 14.254 -15.634 -10.841 355 HZ1 LYS 60 HZ1 LYS 60 13.059 -15.421 -12.669 356 HZ2 LYS 60 HZ2 LYS 60 13.706 -13.934 -12.866 357 HZ3 LYS 60 HZ3 LYS 60 14.359 -15.217 -13.638 358 H ASP 61 H ASP 61 12.010 -15.570 -9.093 359 HA ASP 61 HA ASP 61 10.577 -14.041 -7.125 360 HB2 ASP 61 HB2 ASP 61 9.482 -16.776 -7.782 361 HB3 ASP 61 HB3 ASP 61 8.677 -15.430 -7.000 362 HD2 ASP 61 HD2 ASP 61 7.485 -14.041 -8.461 363 H ASN 62 H ASN 62 10.959 -14.912 -4.982 364 HA ASN 62 HA ASN 62 13.139 -16.750 -4.895 365 HB2 ASN 62 HB2 ASN 62 12.943 -14.710 -3.391 366 HB3 ASN 62 HB3 ASN 62 11.562 -15.452 -2.610 367 HD21 ASN 62 HD21 ASN 62 12.501 -15.570 -0.620 368 HD22 ASN 62 HD22 ASN 62 13.788 -16.655 -0.212 369 H SER 63 H SER 63 9.652 -16.552 -3.995 370 HA SER 63 HA SER 63 9.580 -18.967 -2.603 371 HB2 SER 63 HB2 SER 63 7.435 -17.308 -3.983 372 HB3 SER 63 HB3 SER 63 7.052 -18.771 -3.098 373 HG SER 63 HG SER 63 7.088 -17.596 -1.320 374 H CYS 64 H CYS 64 8.226 -18.136 -5.886 375 HA CYS 64 HA CYS 64 7.986 -19.320 -7.718 376 HB2 CYS 64 HB2 CYS 64 10.467 -19.683 -7.438 377 HB3 CYS 64 HB3 CYS 64 10.109 -21.223 -6.682 378 HG CYS 64 HG CYS 64 9.902 -20.179 -9.740 379 H ASN 65 H ASN 65 6.248 -19.759 -5.465 380 HA ASN 65 HA ASN 65 5.917 -22.598 -5.268 381 HB2 ASN 65 HB2 ASN 65 4.371 -22.121 -3.528 382 HB3 ASN 65 HB3 ASN 65 5.502 -20.788 -3.402 383 HD21 ASN 65 HD21 ASN 65 2.295 -21.737 -3.870 384 HD22 ASN 65 HD22 ASN 65 1.581 -20.203 -4.241 385 H LEU 66 H LEU 66 4.707 -19.809 -7.064 386 HA LEU 66 HA LEU 66 2.836 -21.569 -8.454 387 HB2 LEU 66 HB2 LEU 66 1.457 -20.422 -6.881 388 HB3 LEU 66 HB3 LEU 66 2.191 -18.876 -7.260 389 HG LEU 66 HG LEU 66 0.751 -20.407 -9.410 390 HD11 LEU 66 HD11 LEU 66 -1.362 -19.695 -8.781 391 HD12 LEU 66 HD12 LEU 66 -0.637 -20.178 -7.229 392 HD13 LEU 66 HD13 LEU 66 -0.733 -18.456 -7.670 393 HD21 LEU 66 HD21 LEU 66 1.638 -17.594 -8.934 394 HD22 LEU 66 HD22 LEU 66 1.733 -18.597 -10.401 395 HD23 LEU 66 HD23 LEU 66 0.180 -17.874 -9.916 396 H PHE 67 H PHE 67 3.158 -21.503 -10.618 397 HA PHE 67 HA PHE 67 5.169 -19.807 -11.649 398 HB2 PHE 67 HB2 PHE 67 3.058 -21.746 -12.728 399 HB3 PHE 67 HB3 PHE 67 4.080 -20.864 -13.845 400 HD1 PHE 67 HD2 PHE 67 6.633 -21.112 -13.538 401 HD2 PHE 67 HD1 PHE 67 3.802 -23.752 -11.800 402 HE1 PHE 67 HE2 PHE 67 8.417 -22.859 -13.287 403 HE2 PHE 67 HE1 PHE 67 5.586 -25.499 -11.548 404 HZ PHE 67 HZ PHE 67 7.873 -25.032 -12.295 405 H ASN 68 H ASN 68 4.861 -17.635 -11.901 406 HA ASN 68 HA ASN 68 2.234 -16.669 -12.448 407 HB2 ASN 68 HB2 ASN 68 3.330 -14.422 -12.336 408 HB3 ASN 68 HB3 ASN 68 3.755 -15.403 -10.948 409 HD21 ASN 68 HD21 ASN 68 5.806 -15.719 -10.477 410 HD22 ASN 68 HD22 ASN 68 7.168 -15.360 -11.485 411 H THR 69 H THR 69 1.523 -15.835 -14.480 412 HA THR 69 HA THR 69 3.125 -16.579 -16.762 413 HB THR 69 HB THR 69 0.482 -15.090 -16.847 414 HG1 THR 69 HG1 THR 69 -0.343 -17.404 -16.495 415 HG21 THR 69 HG21 THR 69 1.989 -16.356 -18.798 416 HG22 THR 69 HG22 THR 69 0.928 -17.679 -18.258 417 HG23 THR 69 HG23 THR 69 0.221 -16.166 -18.873 418 H LEU 70 H LEU 70 3.992 -15.232 -18.345 419 HA LEU 70 HA LEU 70 4.889 -12.729 -17.336 420 HB2 LEU 70 HB2 LEU 70 6.034 -14.467 -18.903 421 HB3 LEU 70 HB3 LEU 70 5.171 -13.635 -20.181 422 HG LEU 70 HG LEU 70 7.580 -12.930 -19.718 423 HD11 LEU 70 HD11 LEU 70 7.159 -10.960 -20.729 424 HD12 LEU 70 HD12 LEU 70 5.501 -11.602 -20.818 425 HD13 LEU 70 HD13 LEU 70 5.948 -10.468 -19.521 426 HD21 LEU 70 HD21 LEU 70 6.362 -11.348 -17.448 427 HD22 LEU 70 HD22 LEU 70 7.236 -12.881 -17.210 428 HD23 LEU 70 HD23 LEU 70 8.074 -11.478 -17.916 429 H THR 71 H THR 71 2.220 -13.865 -19.357 430 HA THR 71 HA THR 71 1.638 -11.553 -20.762 431 HB THR 71 HB THR 71 -0.035 -13.835 -19.615 432 HG1 THR 71 HG1 THR 71 1.716 -13.659 -21.532 433 HG21 THR 71 HG21 THR 71 -0.874 -11.697 -21.644 434 HG22 THR 71 HG22 THR 71 -1.820 -13.134 -21.188 435 HG23 THR 71 HG23 THR 71 -1.533 -11.842 -19.997 436 H GLU 72 H GLU 72 0.827 -12.443 -17.373 437 HA GLU 72 HA GLU 72 -0.904 -10.379 -16.896 438 HB2 GLU 72 HB2 GLU 72 -0.414 -12.339 -15.384 439 HB3 GLU 72 HB3 GLU 72 1.098 -11.577 -14.931 440 HG2 GLU 72 HG2 GLU 72 -1.584 -10.162 -14.623 441 HG3 GLU 72 HG3 GLU 72 -0.921 -11.184 -13.363 442 HE2 GLU 72 HE2 GLU 72 -0.544 -7.669 -13.880 443 H ALA 73 H ALA 73 2.697 -10.502 -16.464 444 HA ALA 73 HA ALA 73 2.989 -7.929 -15.465 445 HB1 ALA 73 HB1 ALA 73 4.646 -10.089 -16.539 446 HB2 ALA 73 HB2 ALA 73 5.288 -8.483 -16.962 447 HB3 ALA 73 HB3 ALA 73 5.008 -8.909 -15.256 448 H ARG 74 H ARG 74 3.189 -9.161 -18.876 449 HA ARG 74 HA ARG 74 3.770 -6.798 -20.059 450 HB2 ARG 74 HB2 ARG 74 2.048 -9.128 -21.028 451 HB3 ARG 74 HB3 ARG 74 2.509 -7.807 -22.084 452 HG2 ARG 74 HG2 ARG 74 4.962 -8.308 -21.355 453 HG3 ARG 74 HG3 ARG 74 4.337 -9.809 -20.699 454 HD2 ARG 74 HD2 ARG 74 4.995 -10.421 -22.892 455 HD3 ARG 74 HD3 ARG 74 3.267 -10.181 -23.057 456 HE ARG 74 HE ARG 74 4.226 -7.678 -23.630 457 HH11 ARG 74 HH22 ARG 74 5.127 -10.870 -24.804 458 HH12 ARG 74 HH21 ARG 74 5.641 -10.295 -26.355 459 HH21 ARG 74 HH12 ARG 74 4.903 -6.919 -25.676 460 HH22 ARG 74 HH11 ARG 74 5.512 -8.032 -26.855 461 H ASP 75 H ASP 75 0.671 -8.006 -18.774 462 HA ASP 75 HA ASP 75 -0.897 -6.070 -20.093 463 HB2 ASP 75 HB2 ASP 75 -2.184 -7.892 -19.433 464 HB3 ASP 75 HB3 ASP 75 -1.272 -8.139 -17.957 465 HD2 ASP 75 HD2 ASP 75 -2.562 -7.038 -15.948 466 H ALA 76 H ALA 76 0.898 -6.366 -17.019 467 HA ALA 76 HA ALA 76 -0.347 -4.246 -15.652 468 HB1 ALA 76 HB1 ALA 76 1.413 -6.231 -15.023 469 HB2 ALA 76 HB2 ALA 76 2.515 -4.837 -15.109 470 HB3 ALA 76 HB3 ALA 76 1.123 -4.803 -14.001 471 H ILE 77 H ILE 77 2.693 -4.462 -17.624 472 HA ILE 77 HA ILE 77 3.191 -1.677 -17.390 473 HB ILE 77 HB ILE 77 4.741 -2.342 -19.418 474 HG12 ILE 77 HG12 ILE 77 4.455 -5.062 -18.161 475 HG13 ILE 77 HG13 ILE 77 3.441 -4.606 -19.515 476 HG21 ILE 77 HG21 ILE 77 5.776 -3.682 -17.051 477 HG22 ILE 77 HG22 ILE 77 6.329 -2.199 -17.865 478 HG23 ILE 77 HG23 ILE 77 5.020 -2.118 -16.662 479 HD11 ILE 77 HD11 ILE 77 5.294 -4.326 -20.980 480 HD12 ILE 77 HD12 ILE 77 6.451 -4.214 -19.632 481 HD13 ILE 77 HD13 ILE 77 5.705 -5.778 -20.036 482 H LYS 78 H LYS 78 1.696 -3.825 -19.874 483 HA LYS 78 HA LYS 78 1.354 -1.816 -21.791 484 HB2 LYS 78 HB2 LYS 78 1.282 -4.208 -22.302 485 HB3 LYS 78 HB3 LYS 78 -0.168 -4.399 -21.337 486 HG2 LYS 78 HG2 LYS 78 -1.428 -2.904 -22.832 487 HG3 LYS 78 HG3 LYS 78 0.023 -2.518 -23.736 488 HD2 LYS 78 HD2 LYS 78 0.078 -4.585 -24.820 489 HD3 LYS 78 HD3 LYS 78 -0.692 -5.430 -23.491 490 HE2 LYS 78 HE2 LYS 78 -2.373 -5.375 -25.172 491 HE3 LYS 78 HE3 LYS 78 -2.836 -4.084 -24.081 492 HZ1 LYS 78 HZ1 LYS 78 -2.752 -2.784 -25.842 493 HZ2 LYS 78 HZ2 LYS 78 -1.126 -2.929 -25.850 494 HZ3 LYS 78 HZ3 LYS 78 -2.038 -3.917 -26.777 495 H ASP 79 H ASP 79 -0.461 -2.747 -18.877 496 HA ASP 79 HA ASP 79 -2.760 -1.288 -19.601 497 HB2 ASP 79 HB2 ASP 79 -3.003 -3.059 -17.989 498 HB3 ASP 79 HB3 ASP 79 -1.690 -2.449 -17.002 499 HD2 ASP 79 HD2 ASP 79 -5.333 -0.838 -16.593 500 H ALA 80 H ALA 80 0.245 -0.726 -17.694 501 HA ALA 80 HA ALA 80 -0.529 1.712 -16.538 502 HB1 ALA 80 HB1 ALA 80 1.497 0.001 -16.154 503 HB2 ALA 80 HB2 ALA 80 2.335 1.154 -17.220 504 HB3 ALA 80 HB3 ALA 80 1.614 1.716 -15.693 505 H TYR 81 H TYR 81 1.355 0.905 -19.532 506 HA TYR 81 HA TYR 81 1.797 3.549 -20.303 507 HB2 TYR 81 HB2 TYR 81 1.555 0.793 -21.613 508 HB3 TYR 81 HB3 TYR 81 1.824 2.192 -22.634 509 HD1 TYR 81 HD2 TYR 81 3.244 1.152 -19.312 510 HD2 TYR 81 HD1 TYR 81 4.017 2.223 -23.382 511 HE1 TYR 81 HE2 TYR 81 5.746 0.989 -18.888 512 HE2 TYR 81 HE1 TYR 81 6.516 2.057 -22.944 513 HH TYR 81 HH TYR 81 7.782 0.529 -20.295 514 H GLU 82 H GLU 82 -0.860 1.227 -21.111 515 HA GLU 82 HA GLU 82 -2.098 3.087 -22.838 516 HB2 GLU 82 HB2 GLU 82 -3.223 0.564 -21.541 517 HB3 GLU 82 HB3 GLU 82 -3.952 1.427 -22.881 518 HG2 GLU 82 HG2 GLU 82 -1.076 0.528 -23.135 519 HG3 GLU 82 HG3 GLU 82 -2.345 -0.669 -23.305 520 HE2 GLU 82 HE2 GLU 82 -2.075 0.256 -26.591 521 H SER 83 H SER 83 -2.085 2.491 -19.381 522 HA SER 83 HA SER 83 -4.621 3.612 -18.882 523 HB2 SER 83 HB2 SER 83 -3.838 2.188 -17.177 524 HB3 SER 83 HB3 SER 83 -2.220 2.859 -17.212 525 HG SER 83 HG SER 83 -2.798 4.465 -15.873 526 H TYR 84 H TYR 84 -1.201 4.801 -18.714 527 HA TYR 84 HA TYR 84 -2.217 7.505 -18.255 528 HB2 TYR 84 HB2 TYR 84 0.543 6.133 -18.234 529 HB3 TYR 84 HB3 TYR 84 0.327 7.837 -17.886 530 HD1 TYR 84 HD1 TYR 84 -1.274 8.431 -15.903 531 HD2 TYR 84 HD2 TYR 84 0.460 4.566 -16.495 532 HE1 TYR 84 HE1 TYR 84 -1.659 7.875 -13.452 533 HE2 TYR 84 HE2 TYR 84 0.070 4.023 -14.042 534 HH TYR 84 HH TYR 84 -0.146 5.420 -11.903 535 H CYS 85 H CYS 85 -1.745 5.562 -20.873 536 HA CYS 85 HA CYS 85 0.008 6.833 -22.527 537 HB2 CYS 85 HB2 CYS 85 -0.741 5.001 -23.608 538 HB3 CYS 85 HB3 CYS 85 -2.325 5.070 -22.860 539 HG CYS 85 HG CYS 85 -3.434 6.730 -24.367 540 H GLY 86 H GLY 86 -0.059 8.715 -23.817 541 HA2 GLY 86 HA2 GLY 86 -1.233 10.436 -24.924 542 HA3 GLY 86 HA3 GLY 86 -2.546 10.289 -23.773 543 H ILE 87 H ILE 87 0.229 9.949 -21.934 544 HA ILE 87 HA ILE 87 0.460 12.849 -21.537 545 HB ILE 87 HB ILE 87 0.298 12.663 -19.254 546 HG12 ILE 87 HG12 ILE 87 1.039 9.766 -19.620 547 HG13 ILE 87 HG13 ILE 87 1.858 11.006 -18.690 548 HG21 ILE 87 HG21 ILE 87 -1.828 11.905 -18.894 549 HG22 ILE 87 HG22 ILE 87 -1.811 11.942 -20.674 550 HG23 ILE 87 HG23 ILE 87 -1.575 10.402 -19.813 551 HD11 ILE 87 HD11 ILE 87 0.751 9.710 -17.042 552 HD12 ILE 87 HD12 ILE 87 -0.326 11.110 -17.259 553 HD13 ILE 87 HD13 ILE 87 -0.723 9.554 -18.027 554 H ASP 88 H ASP 88 2.475 13.530 -22.001 555 HA ASP 88 HA ASP 88 4.590 11.552 -21.680 556 HB2 ASP 88 HB2 ASP 88 4.520 12.202 -23.973 557 HB3 ASP 88 HB3 ASP 88 4.186 13.877 -23.584 558 HD2 ASP 88 HD2 ASP 88 5.989 15.061 -22.718 559 H ASP 89 H ASP 89 3.136 14.158 -20.190 560 HA ASP 89 HA ASP 89 5.678 15.011 -19.057 561 HB2 ASP 89 HB2 ASP 89 4.511 17.295 -18.731 562 HB3 ASP 89 HB3 ASP 89 5.048 16.901 -20.352 563 HD2 ASP 89 HD2 ASP 89 1.565 16.322 -18.925 564 H CYS 90 H CYS 90 5.500 15.614 -16.741 565 HA CYS 90 HA CYS 90 3.776 14.018 -15.295 566 HB2 CYS 90 HB2 CYS 90 5.895 14.852 -14.399 567 HB3 CYS 90 HB3 CYS 90 5.291 16.497 -14.411 568 HA PRO 91 HA PRO 91 0.225 16.606 -15.756 569 HB2 PRO 91 HB2 PRO 91 -1.609 14.834 -14.773 570 HB3 PRO 91 HB3 PRO 91 -1.106 14.860 -16.451 571 HG2 PRO 91 HG2 PRO 91 -0.363 12.949 -14.321 572 HG3 PRO 91 HG3 PRO 91 -0.227 12.764 -16.058 573 HD2 PRO 91 HD2 PRO 91 1.900 13.342 -14.222 574 HD3 PRO 91 HD3 PRO 91 2.014 13.271 -15.970 575 H GLN 92 H GLN 92 1.059 14.899 -12.826 576 HA GLN 92 HA GLN 92 -0.614 16.309 -11.157 577 HB2 GLN 92 HB2 GLN 92 0.683 14.234 -10.576 578 HB3 GLN 92 HB3 GLN 92 2.150 15.190 -10.513 579 HG2 GLN 92 HG2 GLN 92 1.425 15.077 -8.246 580 HG3 GLN 92 HG3 GLN 92 0.946 16.678 -8.774 581 HE21 GLN 92 HE21 GLN 92 -0.160 13.360 -8.312 582 HE22 GLN 92 HE22 GLN 92 -1.836 13.707 -8.043 583 H CYS 93 H CYS 93 2.572 17.118 -12.555 584 HA CYS 93 HA CYS 93 3.040 19.318 -10.845 585 HB2 CYS 93 HB2 CYS 93 4.297 18.182 -13.296 586 HB3 CYS 93 HB3 CYS 93 4.587 19.882 -12.985 587 H SER 94 H SER 94 1.388 18.737 -13.969 588 HA SER 94 HA SER 94 1.119 21.484 -14.563 589 HB2 SER 94 HB2 SER 94 0.052 18.898 -15.678 590 HB3 SER 94 HB3 SER 94 -0.770 20.380 -16.126 591 HG SER 94 HG SER 94 2.094 20.178 -16.335 592 H LYS 95 H LYS 95 -0.517 19.200 -12.491 593 HA LYS 95 HA LYS 95 -2.984 20.720 -12.473 594 HB2 LYS 95 HB2 LYS 95 -3.222 18.341 -12.422 595 HB3 LYS 95 HB3 LYS 95 -2.080 18.178 -11.104 596 HG2 LYS 95 HG2 LYS 95 -4.459 18.011 -10.333 597 HG3 LYS 95 HG3 LYS 95 -3.595 19.323 -9.556 598 HD2 LYS 95 HD2 LYS 95 -4.597 20.963 -11.107 599 HD3 LYS 95 HD3 LYS 95 -5.371 19.680 -12.016 600 HE2 LYS 95 HE2 LYS 95 -7.086 20.506 -10.576 601 HE3 LYS 95 HE3 LYS 95 -6.560 19.017 -9.817 602 HZ1 LYS 95 HZ1 LYS 95 -5.741 21.736 -9.072 603 HZ2 LYS 95 HZ2 LYS 95 -6.660 20.710 -8.194 604 HZ3 LYS 95 HZ3 LYS 95 -5.077 20.386 -8.436 605 H TYR 96 H TYR 96 0.039 20.348 -10.664 606 HA TYR 96 HA TYR 96 -1.048 22.062 -8.548 607 HB2 TYR 96 HB2 TYR 96 0.050 19.946 -7.856 608 HB3 TYR 96 HB3 TYR 96 1.396 20.236 -8.940 609 HD1 TYR 96 HD1 TYR 96 -0.177 21.275 -5.756 610 HD2 TYR 96 HD2 TYR 96 3.247 21.639 -8.295 611 HE1 TYR 96 HE1 TYR 96 1.114 22.384 -3.868 612 HE2 TYR 96 HE2 TYR 96 4.527 22.747 -6.398 613 HH TYR 96 HH TYR 96 3.058 24.003 -3.727 614 H ILE 97 H ILE 97 -0.675 24.210 -8.738 615 HA ILE 97 HA ILE 97 1.548 25.053 -10.419 616 HB ILE 97 HB ILE 97 -1.003 26.260 -9.469 617 HG12 ILE 97 HG12 ILE 97 -0.752 25.130 -11.685 618 HG13 ILE 97 HG13 ILE 97 -1.304 26.791 -11.771 619 HG21 ILE 97 HG21 ILE 97 1.472 27.845 -10.188 620 HG22 ILE 97 HG22 ILE 97 -0.180 28.504 -10.246 621 HG23 ILE 97 HG23 ILE 97 0.499 27.940 -8.700 622 HD11 ILE 97 HD11 ILE 97 0.520 27.435 -12.961 623 HD12 ILE 97 HD12 ILE 97 1.630 26.632 -11.825 624 HD13 ILE 97 HD13 ILE 97 0.884 25.702 -13.146 625 H ASP 98 H ASP 98 3.062 26.711 -9.665 626 HA ASP 98 HA ASP 98 3.649 26.244 -6.878 627 HB2 ASP 98 HB2 ASP 98 5.854 27.206 -7.407 628 HB3 ASP 98 HB3 ASP 98 5.450 25.952 -8.563 629 HD2 ASP 98 HD2 ASP 98 5.764 27.993 -11.238 630 H ASP 99 H ASP 99 2.479 27.717 -5.591 631 HA ASP 99 HA ASP 99 1.795 30.265 -6.537 632 HB2 ASP 99 HB2 ASP 99 0.340 29.402 -4.894 633 HB3 ASP 99 HB3 ASP 99 1.652 28.803 -3.899 634 HD2 ASP 99 HD2 ASP 99 2.484 31.701 -2.489 Start of MODEL 7 1 H GLU 14 H GLU 14 6.308 1.050 -1.984 2 HA GLU 14 HA GLU 14 5.348 -0.261 0.274 3 HB2 GLU 14 HB2 GLU 14 4.655 2.022 -0.717 4 HB3 GLU 14 HB3 GLU 14 3.637 1.125 -1.826 5 HG2 GLU 14 HG2 GLU 14 2.230 1.711 0.034 6 HG3 GLU 14 HG3 GLU 14 2.563 -0.002 0.204 7 HE2 GLU 14 HE2 GLU 14 2.118 0.342 2.354 8 H ASP 15 H ASP 15 4.151 -0.453 -3.164 9 HA ASP 15 HA ASP 15 2.946 -2.982 -2.482 10 HB2 ASP 15 HB2 ASP 15 2.874 -1.677 -5.220 11 HB3 ASP 15 HB3 ASP 15 1.690 -2.749 -4.500 12 HD2 ASP 15 HD2 ASP 15 1.457 -0.303 -5.679 13 H GLN 16 H GLN 16 3.309 -4.882 -4.005 14 HA GLN 16 HA GLN 16 6.040 -5.232 -4.473 15 HB2 GLN 16 HB2 GLN 16 3.646 -6.876 -5.408 16 HB3 GLN 16 HB3 GLN 16 5.312 -7.412 -5.493 17 HG2 GLN 16 HG2 GLN 16 3.912 -6.592 -2.905 18 HG3 GLN 16 HG3 GLN 16 4.065 -8.249 -3.454 19 HE21 GLN 16 HE21 GLN 16 5.179 -6.462 -1.196 20 HE22 GLN 16 HE22 GLN 16 6.865 -6.854 -1.126 21 H GLU 17 H GLU 17 3.201 -4.838 -6.703 22 HA GLU 17 HA GLU 17 4.624 -5.026 -9.039 23 HB2 GLU 17 HB2 GLU 17 2.237 -5.122 -9.128 24 HB3 GLU 17 HB3 GLU 17 2.055 -3.588 -8.300 25 HG2 GLU 17 HG2 GLU 17 3.029 -2.390 -10.245 26 HG3 GLU 17 HG3 GLU 17 3.308 -3.911 -11.068 27 HE2 GLU 17 HE2 GLU 17 -0.453 -2.688 -10.410 28 H GLN 18 H GLN 18 3.858 -2.139 -6.998 29 HA GLN 18 HA GLN 18 4.941 -0.271 -8.714 30 HB2 GLN 18 HB2 GLN 18 3.508 -0.004 -6.535 31 HB3 GLN 18 HB3 GLN 18 5.046 0.001 -5.695 32 HG2 GLN 18 HG2 GLN 18 4.662 1.822 -8.085 33 HG3 GLN 18 HG3 GLN 18 3.973 2.282 -6.540 34 HE21 GLN 18 HE21 GLN 18 5.495 2.020 -4.632 35 HE22 GLN 18 HE22 GLN 18 7.117 2.596 -4.827 36 H TRP 19 H TRP 19 6.427 -2.380 -6.226 37 HA TRP 19 HA TRP 19 8.911 -1.097 -6.116 38 HB2 TRP 19 HB2 TRP 19 8.440 -2.563 -4.380 39 HB3 TRP 19 HB3 TRP 19 7.905 -3.842 -5.453 40 HD1 TRP 19 HD1 TRP 19 11.150 -2.311 -4.046 41 HE1 TRP 19 HE1 TRP 19 13.204 -3.928 -4.402 42 HE3 TRP 19 HE3 TRP 19 8.681 -5.655 -6.975 43 HZ2 TRP 19 HZ2 TRP 19 13.558 -6.370 -5.837 44 HZ3 TRP 19 HZ3 TRP 19 9.954 -7.628 -7.812 45 HH2 TRP 19 HH2 TRP 19 12.310 -8.013 -7.287 46 H ALA 20 H ALA 20 7.391 -3.404 -8.376 47 HA ALA 20 HA ALA 20 9.832 -4.048 -9.706 48 HB1 ALA 20 HB1 ALA 20 8.455 -5.724 -10.302 49 HB2 ALA 20 HB2 ALA 20 7.025 -4.820 -9.750 50 HB3 ALA 20 HB3 ALA 20 7.645 -4.582 -11.401 51 H MET 21 H MET 21 7.077 -1.775 -10.223 52 HA MET 21 HA MET 21 7.746 -0.913 -12.717 53 HB2 MET 21 HB2 MET 21 6.545 0.535 -10.299 54 HB3 MET 21 HB3 MET 21 6.622 1.289 -11.879 55 HG2 MET 21 HG2 MET 21 5.479 -1.035 -12.645 56 HG3 MET 21 HG3 MET 21 4.955 -1.055 -10.973 57 HE1 MET 21 HE1 MET 21 5.156 1.950 -13.896 58 HE2 MET 21 HE2 MET 21 4.842 0.254 -14.333 59 HE3 MET 21 HE3 MET 21 3.525 1.449 -14.402 60 H GLN 22 H GLN 22 9.496 -0.492 -9.744 61 HA GLN 22 HA GLN 22 10.641 1.949 -10.049 62 HB2 GLN 22 HB2 GLN 22 11.852 -0.638 -8.983 63 HB3 GLN 22 HB3 GLN 22 12.599 0.934 -8.779 64 HG2 GLN 22 HG2 GLN 22 10.421 1.728 -7.689 65 HG3 GLN 22 HG3 GLN 22 9.865 0.066 -7.735 66 HE21 GLN 22 HE21 GLN 22 11.856 -1.477 -7.059 67 HE22 GLN 22 HE22 GLN 22 12.512 -1.119 -5.496 68 H THR 23 H THR 23 12.631 -0.993 -10.728 69 HA THR 23 HA THR 23 14.356 0.316 -12.467 70 HB THR 23 HB THR 23 13.668 -2.659 -12.517 71 HG1 THR 23 HG1 THR 23 15.498 -2.295 -10.695 72 HG21 THR 23 HG21 THR 23 16.004 -2.962 -12.945 73 HG22 THR 23 HG22 THR 23 15.564 -1.581 -13.977 74 HG23 THR 23 HG23 THR 23 16.396 -1.305 -12.428 75 H LEU 24 H LEU 24 11.509 -1.789 -13.246 76 HA LEU 24 HA LEU 24 11.641 -1.828 -15.919 77 HB2 LEU 24 HB2 LEU 24 9.849 -2.635 -14.179 78 HB3 LEU 24 HB3 LEU 24 9.023 -1.158 -14.634 79 HG LEU 24 HG LEU 24 9.571 -2.183 -17.096 80 HD11 LEU 24 HD11 LEU 24 9.592 -4.452 -15.165 81 HD12 LEU 24 HD12 LEU 24 8.701 -4.668 -16.691 82 HD13 LEU 24 HD13 LEU 24 10.432 -4.254 -16.721 83 HD21 LEU 24 HD21 LEU 24 7.414 -1.566 -16.956 84 HD22 LEU 24 HD22 LEU 24 7.137 -3.295 -16.635 85 HD23 LEU 24 HD23 LEU 24 7.243 -2.144 -15.281 86 H MET 25 H MET 25 10.321 0.910 -13.943 87 HA MET 25 HA MET 25 9.827 2.479 -16.220 88 HB2 MET 25 HB2 MET 25 8.615 2.879 -14.126 89 HB3 MET 25 HB3 MET 25 10.107 3.074 -13.228 90 HG2 MET 25 HG2 MET 25 10.477 5.238 -14.025 91 HG3 MET 25 HG3 MET 25 9.681 4.932 -15.556 92 HE1 MET 25 HE1 MET 25 6.635 5.803 -15.686 93 HE2 MET 25 HE2 MET 25 7.434 4.213 -15.745 94 HE3 MET 25 HE3 MET 25 6.085 4.490 -14.617 95 H GLY 26 H GLY 26 12.599 2.055 -14.004 96 HA2 GLY 26 HA2 GLY 26 14.021 4.378 -14.838 97 HA3 GLY 26 HA3 GLY 26 14.645 3.007 -13.943 98 H SER 27 H SER 27 13.240 1.444 -16.443 99 HA SER 27 HA SER 27 15.655 0.885 -17.680 100 HB2 SER 27 HB2 SER 27 13.794 -0.704 -17.672 101 HB3 SER 27 HB3 SER 27 12.779 0.406 -18.571 102 HG SER 27 HG SER 27 14.871 -1.268 -19.473 103 H GLY 28 H GLY 28 13.420 3.519 -18.042 104 HA2 GLY 28 HA2 GLY 28 13.936 5.438 -19.257 105 HA3 GLY 28 HA3 GLY 28 14.945 4.502 -20.343 106 H VAL 29 H VAL 29 12.100 2.734 -19.741 107 HA VAL 29 HA VAL 29 11.169 3.196 -22.390 108 HB VAL 29 HB VAL 29 9.928 1.657 -20.101 109 HG11 VAL 29 HG11 VAL 29 8.732 0.420 -21.823 110 HG12 VAL 29 HG12 VAL 29 8.380 2.158 -21.969 111 HG13 VAL 29 HG13 VAL 29 9.517 1.383 -23.098 112 HG21 VAL 29 HG21 VAL 29 11.675 0.274 -20.275 113 HG22 VAL 29 HG22 VAL 29 11.095 -0.136 -21.907 114 HG23 VAL 29 HG23 VAL 29 12.309 1.148 -21.690 115 H LEU 30 H LEU 30 10.009 3.995 -19.058 116 HA LEU 30 HA LEU 30 7.946 5.665 -20.286 117 HB2 LEU 30 HB2 LEU 30 8.285 4.359 -17.612 118 HB3 LEU 30 HB3 LEU 30 7.260 5.773 -17.763 119 HG LEU 30 HG LEU 30 6.907 3.282 -19.448 120 HD11 LEU 30 HD11 LEU 30 5.010 2.748 -17.917 121 HD12 LEU 30 HD12 LEU 30 6.618 2.599 -17.168 122 HD13 LEU 30 HD13 LEU 30 5.601 4.016 -16.816 123 HD21 LEU 30 HD21 LEU 30 5.973 5.432 -20.319 124 HD22 LEU 30 HD22 LEU 30 4.757 4.168 -20.011 125 HD23 LEU 30 HD23 LEU 30 4.950 5.517 -18.865 126 H ALA 31 H ALA 31 7.521 7.718 -18.696 127 HA ALA 31 HA ALA 31 10.160 8.950 -18.289 128 HB1 ALA 31 HB1 ALA 31 9.109 9.778 -20.359 129 HB2 ALA 31 HB2 ALA 31 7.638 10.202 -19.451 130 HB3 ALA 31 HB3 ALA 31 9.164 11.057 -19.122 131 H ARG 32 H ARG 32 10.440 10.038 -16.358 132 HA ARG 32 HA ARG 32 8.051 10.186 -14.701 133 HB2 ARG 32 HB2 ARG 32 9.672 8.404 -13.954 134 HB3 ARG 32 HB3 ARG 32 10.918 9.625 -13.785 135 HG2 ARG 32 HG2 ARG 32 9.960 10.555 -11.876 136 HG3 ARG 32 HG3 ARG 32 8.325 10.150 -12.361 137 HD2 ARG 32 HD2 ARG 32 8.692 8.629 -10.602 138 HD3 ARG 32 HD3 ARG 32 9.080 7.649 -12.002 139 HE ARG 32 HE ARG 32 11.396 9.096 -10.946 140 HH11 ARG 32 HH22 ARG 32 9.456 6.174 -10.658 141 HH12 ARG 32 HH21 ARG 32 10.729 5.246 -9.938 142 HH21 ARG 32 HH12 ARG 32 13.076 7.872 -9.996 143 HH22 ARG 32 HH11 ARG 32 12.802 6.219 -9.559 144 H CYS 33 H CYS 33 7.988 12.018 -13.167 145 HA CYS 33 HA CYS 33 9.321 14.310 -14.266 146 HB2 CYS 33 HB2 CYS 33 7.132 13.878 -12.250 147 HB3 CYS 33 HB3 CYS 33 7.971 15.416 -12.289 148 H ARG 34 H ARG 34 11.109 15.332 -13.356 149 HA ARG 34 HA ARG 34 12.630 13.939 -11.536 150 HB2 ARG 34 HB2 ARG 34 14.162 15.780 -11.670 151 HB3 ARG 34 HB3 ARG 34 13.352 15.759 -13.225 152 HG2 ARG 34 HG2 ARG 34 13.003 17.986 -12.788 153 HG3 ARG 34 HG3 ARG 34 11.641 17.392 -11.860 154 HD2 ARG 34 HD2 ARG 34 13.053 18.999 -10.551 155 HD3 ARG 34 HD3 ARG 34 12.957 17.426 -9.785 156 HE ARG 34 HE ARG 34 15.240 17.045 -10.272 157 HH11 ARG 34 HH22 ARG 34 14.105 19.950 -11.901 158 HH12 ARG 34 HH21 ARG 34 15.695 20.478 -12.341 159 HH21 ARG 34 HH12 ARG 34 17.338 17.741 -10.852 160 HH22 ARG 34 HH11 ARG 34 17.546 19.213 -11.740 161 H ILE 35 H ILE 35 9.846 15.910 -11.065 162 HA ILE 35 HA ILE 35 10.617 16.537 -8.311 163 HB ILE 35 HB ILE 35 8.437 17.595 -10.109 164 HG12 ILE 35 HG12 ILE 35 11.002 18.296 -10.192 165 HG13 ILE 35 HG13 ILE 35 9.705 19.451 -10.424 166 HG21 ILE 35 HG21 ILE 35 8.205 19.233 -8.071 167 HG22 ILE 35 HG22 ILE 35 7.340 17.678 -8.092 168 HG23 ILE 35 HG23 ILE 35 8.841 17.848 -7.151 169 HD11 ILE 35 HD11 ILE 35 9.892 20.300 -8.201 170 HD12 ILE 35 HD12 ILE 35 10.829 18.888 -7.656 171 HD13 ILE 35 HD13 ILE 35 11.574 20.085 -8.743 172 H HIS 36 H HIS 36 9.005 14.206 -10.211 173 HA HIS 36 HA HIS 36 7.648 13.262 -7.805 174 HB2 HIS 36 HB2 HIS 36 6.255 12.690 -10.344 175 HB3 HIS 36 HB3 HIS 36 5.609 13.074 -8.760 176 HD1 HIS 36 HD1 HIS 36 6.613 15.879 -8.227 177 HD2 HIS 36 HD2 HIS 36 5.300 14.624 -12.009 178 HE1 HIS 36 HE1 HIS 36 5.948 17.994 -9.491 179 H ASN 37 H ASN 37 8.779 11.458 -7.269 180 HA ASN 37 HA ASN 37 9.878 9.894 -9.431 181 HB2 ASN 37 HB2 ASN 37 10.270 9.955 -6.411 182 HB3 ASN 37 HB3 ASN 37 10.845 8.586 -7.343 183 HD21 ASN 37 HD21 ASN 37 10.711 12.103 -7.910 184 HD22 ASN 37 HD22 ASN 37 12.390 12.332 -8.266 185 H ASP 38 H ASP 38 7.055 10.114 -7.541 186 HA ASP 38 HA ASP 38 6.659 7.233 -7.580 187 HB2 ASP 38 HB2 ASP 38 5.147 9.446 -6.113 188 HB3 ASP 38 HB3 ASP 38 4.720 7.748 -6.039 189 HD2 ASP 38 HD2 ASP 38 6.752 9.938 -4.161 190 H VAL 39 H VAL 39 6.477 9.216 -9.897 191 HA VAL 39 HA VAL 39 3.630 8.825 -10.514 192 HB VAL 39 HB VAL 39 4.749 11.219 -10.149 193 HG11 VAL 39 HG11 VAL 39 6.484 10.989 -11.823 194 HG12 VAL 39 HG12 VAL 39 5.281 10.581 -13.069 195 HG13 VAL 39 HG13 VAL 39 5.311 12.215 -12.362 196 HG21 VAL 39 HG21 VAL 39 2.981 11.282 -12.498 197 HG22 VAL 39 HG22 VAL 39 2.380 10.258 -11.171 198 HG23 VAL 39 HG23 VAL 39 2.758 11.972 -10.872 199 H ILE 40 H ILE 40 3.140 8.292 -12.751 200 HA ILE 40 HA ILE 40 5.485 7.260 -14.188 201 HB ILE 40 HB ILE 40 4.617 5.285 -13.517 202 HG12 ILE 40 HG12 ILE 40 2.776 5.820 -15.864 203 HG13 ILE 40 HG13 ILE 40 4.487 5.476 -16.021 204 HG21 ILE 40 HG21 ILE 40 1.844 6.509 -13.544 205 HG22 ILE 40 HG22 ILE 40 2.228 4.830 -13.093 206 HG23 ILE 40 HG23 ILE 40 2.855 6.179 -12.116 207 HD11 ILE 40 HD11 ILE 40 3.581 3.447 -14.308 208 HD12 ILE 40 HD12 ILE 40 2.260 3.636 -15.486 209 HD13 ILE 40 HD13 ILE 40 3.911 3.280 -16.049 210 H LEU 41 H LEU 41 5.757 8.230 -16.120 211 HA LEU 41 HA LEU 41 3.340 9.305 -17.398 212 HB2 LEU 41 HB2 LEU 41 5.979 10.565 -17.911 213 HB3 LEU 41 HB3 LEU 41 4.372 11.263 -17.916 214 HG LEU 41 HG LEU 41 5.664 10.388 -15.337 215 HD11 LEU 41 HD11 LEU 41 5.880 13.250 -16.014 216 HD12 LEU 41 HD12 LEU 41 7.022 12.169 -15.179 217 HD13 LEU 41 HD13 LEU 41 6.933 12.167 -16.957 218 HD21 LEU 41 HD21 LEU 41 3.146 11.105 -15.741 219 HD22 LEU 41 HD22 LEU 41 4.035 11.581 -14.274 220 HD23 LEU 41 HD23 LEU 41 3.843 12.737 -15.613 221 H ASP 42 H ASP 42 3.363 9.295 -19.764 222 HA ASP 42 HA ASP 42 4.648 6.915 -20.678 223 HB2 ASP 42 HB2 ASP 42 2.248 7.769 -21.237 224 HB3 ASP 42 HB3 ASP 42 3.027 8.884 -22.342 225 HD2 ASP 42 HD2 ASP 42 1.898 5.411 -23.076 226 H SER 43 H SER 43 6.501 6.878 -22.005 227 HA SER 43 HA SER 43 7.525 9.494 -22.762 228 HB2 SER 43 HB2 SER 43 8.855 7.890 -21.221 229 HB3 SER 43 HB3 SER 43 9.107 6.899 -22.644 230 HG SER 43 HG SER 43 10.870 8.383 -22.323 231 H GLY 44 H GLY 44 7.303 6.044 -23.894 232 HA2 GLY 44 HA2 GLY 44 6.447 5.485 -26.014 233 HA3 GLY 44 HA3 GLY 44 6.931 7.051 -26.632 234 H ASN 45 H ASN 45 8.946 4.897 -24.566 235 HA ASN 45 HA ASN 45 10.863 4.870 -26.739 236 HB2 ASN 45 HB2 ASN 45 10.998 4.707 -23.746 237 HB3 ASN 45 HB3 ASN 45 12.166 3.716 -24.597 238 HD21 ASN 45 HD21 ASN 45 12.071 6.395 -23.031 239 HD22 ASN 45 HD22 ASN 45 13.064 7.466 -23.961 240 H ASP 46 H ASP 46 12.313 2.626 -26.482 241 HA ASP 46 HA ASP 46 10.838 0.625 -27.488 242 HB2 ASP 46 HB2 ASP 46 13.358 0.510 -25.774 243 HB3 ASP 46 HB3 ASP 46 12.722 -0.902 -26.594 244 HD2 ASP 46 HD2 ASP 46 15.436 0.764 -27.851 245 H ALA 47 H ALA 47 8.976 -0.206 -26.489 246 HA ALA 47 HA ALA 47 8.807 -0.406 -23.643 247 HB1 ALA 47 HB1 ALA 47 6.559 -0.991 -24.038 248 HB2 ALA 47 HB2 ALA 47 6.952 0.094 -25.394 249 HB3 ALA 47 HB3 ALA 47 6.920 -1.668 -25.644 250 H SER 48 H SER 48 9.960 -2.396 -26.276 251 HA SER 48 HA SER 48 9.423 -4.893 -25.256 252 HB2 SER 48 HB2 SER 48 11.703 -3.846 -26.979 253 HB3 SER 48 HB3 SER 48 11.527 -5.549 -26.605 254 HG SER 48 HG SER 48 10.452 -4.465 -28.649 255 H SER 49 H SER 49 12.047 -2.539 -24.566 256 HA SER 49 HA SER 49 13.648 -4.289 -23.121 257 HB2 SER 49 HB2 SER 49 14.283 -2.004 -24.043 258 HB3 SER 49 HB3 SER 49 13.381 -1.277 -22.728 259 HG SER 49 HG SER 49 15.838 -2.728 -22.660 260 H ALA 50 H ALA 50 10.954 -2.071 -22.196 261 HA ALA 50 HA ALA 50 11.201 -2.377 -19.432 262 HB1 ALA 50 HB1 ALA 50 8.590 -1.844 -19.713 263 HB2 ALA 50 HB2 ALA 50 9.839 -0.612 -20.013 264 HB3 ALA 50 HB3 ALA 50 9.103 -1.485 -21.379 265 H TYR 51 H TYR 51 9.184 -4.143 -21.879 266 HA TYR 51 HA TYR 51 7.883 -5.835 -20.146 267 HB2 TYR 51 HB2 TYR 51 9.112 -6.464 -22.899 268 HB3 TYR 51 HB3 TYR 51 7.678 -7.214 -22.229 269 HD1 TYR 51 HD2 TYR 51 7.003 -4.143 -21.138 270 HD2 TYR 51 HD1 TYR 51 7.560 -6.094 -24.904 271 HE1 TYR 51 HE2 TYR 51 5.557 -2.385 -22.270 272 HE2 TYR 51 HE1 TYR 51 6.112 -4.330 -26.024 273 HH TYR 51 HH TYR 51 4.743 -2.661 -25.703 274 H LYS 52 H LYS 52 11.103 -6.262 -21.754 275 HA LYS 52 HA LYS 52 11.558 -8.831 -20.770 276 HB2 LYS 52 HB2 LYS 52 13.477 -6.648 -21.632 277 HB3 LYS 52 HB3 LYS 52 13.955 -8.299 -21.291 278 HG2 LYS 52 HG2 LYS 52 12.665 -9.177 -23.112 279 HG3 LYS 52 HG3 LYS 52 11.720 -7.709 -23.266 280 HD2 LYS 52 HD2 LYS 52 13.954 -6.519 -23.854 281 HD3 LYS 52 HD3 LYS 52 14.644 -8.121 -24.014 282 HE2 LYS 52 HE2 LYS 52 12.065 -7.503 -25.471 283 HE3 LYS 52 HE3 LYS 52 13.568 -6.879 -26.122 284 HZ1 LYS 52 HZ1 LYS 52 14.387 -9.240 -25.867 285 HZ2 LYS 52 HZ2 LYS 52 12.823 -9.672 -25.687 286 HZ3 LYS 52 HZ3 LYS 52 13.318 -8.954 -27.068 287 H LEU 53 H LEU 53 12.480 -5.574 -19.480 288 HA LEU 53 HA LEU 53 13.843 -6.533 -17.253 289 HB2 LEU 53 HB2 LEU 53 13.786 -4.203 -18.280 290 HB3 LEU 53 HB3 LEU 53 12.295 -3.952 -17.395 291 HG LEU 53 HG LEU 53 14.575 -3.149 -16.409 292 HD11 LEU 53 HD11 LEU 53 13.195 -4.521 -14.231 293 HD12 LEU 53 HD12 LEU 53 13.397 -2.782 -14.552 294 HD13 LEU 53 HD13 LEU 53 12.082 -3.685 -15.341 295 HD21 LEU 53 HD21 LEU 53 15.842 -4.664 -15.144 296 HD22 LEU 53 HD22 LEU 53 14.605 -5.939 -15.260 297 HD23 LEU 53 HD23 LEU 53 15.560 -5.493 -16.694 298 H GLY 54 H GLY 54 10.400 -6.278 -17.998 299 HA2 GLY 54 HA2 GLY 54 9.478 -6.418 -15.299 300 HA3 GLY 54 HA3 GLY 54 8.549 -6.674 -16.763 301 H THR 55 H THR 55 9.990 -8.803 -17.983 302 HA THR 55 HA THR 55 8.942 -10.997 -16.553 303 HB THR 55 HB THR 55 10.628 -12.077 -18.432 304 HG1 THR 55 HG1 THR 55 10.160 -10.085 -20.084 305 HG21 THR 55 HG21 THR 55 8.799 -11.994 -20.007 306 HG22 THR 55 HG22 THR 55 8.030 -12.041 -18.402 307 HG23 THR 55 HG23 THR 55 8.155 -10.500 -19.284 308 H TYR 56 H TYR 56 12.147 -9.449 -16.646 309 HA TYR 56 HA TYR 56 13.481 -11.608 -15.376 310 HB2 TYR 56 HB2 TYR 56 14.192 -9.392 -16.773 311 HB3 TYR 56 HB3 TYR 56 14.207 -8.647 -15.187 312 HD1 TYR 56 HD2 TYR 56 15.414 -11.928 -16.579 313 HD2 TYR 56 HD1 TYR 56 16.343 -8.404 -14.337 314 HE1 TYR 56 HE2 TYR 56 17.775 -12.788 -16.191 315 HE2 TYR 56 HE1 TYR 56 18.701 -9.277 -13.957 316 HH TYR 56 HH TYR 56 19.601 -12.134 -14.060 317 H LEU 57 H LEU 57 12.241 -8.396 -14.210 318 HA LEU 57 HA LEU 57 12.975 -8.816 -11.549 319 HB2 LEU 57 HB2 LEU 57 12.323 -6.674 -12.797 320 HB3 LEU 57 HB3 LEU 57 10.661 -7.128 -12.473 321 HG LEU 57 HG LEU 57 10.904 -6.864 -10.147 322 HD11 LEU 57 HD11 LEU 57 13.856 -7.081 -10.667 323 HD12 LEU 57 HD12 LEU 57 13.250 -6.291 -9.192 324 HD13 LEU 57 HD13 LEU 57 12.831 -7.988 -9.528 325 HD21 LEU 57 HD21 LEU 57 11.762 -4.579 -9.872 326 HD22 LEU 57 HD22 LEU 57 12.537 -4.681 -11.471 327 HD23 LEU 57 HD23 LEU 57 10.763 -4.746 -11.336 328 H TYR 58 H TYR 58 9.861 -9.392 -13.309 329 HA TYR 58 HA TYR 58 8.443 -10.313 -11.095 330 HB2 TYR 58 HB2 TYR 58 8.435 -10.778 -14.129 331 HB3 TYR 58 HB3 TYR 58 7.223 -11.544 -13.123 332 HD1 TYR 58 HD1 TYR 58 6.695 -9.336 -11.152 333 HD2 TYR 58 HD2 TYR 58 7.181 -9.249 -15.402 334 HE1 TYR 58 HE1 TYR 58 5.268 -7.235 -11.280 335 HE2 TYR 58 HE2 TYR 58 5.753 -7.148 -15.515 336 HH TYR 58 HH TYR 58 5.185 -5.223 -13.055 337 H GLN 59 H GLN 59 10.342 -12.116 -13.609 338 HA GLN 59 HA GLN 59 10.432 -14.304 -11.689 339 HB2 GLN 59 HB2 GLN 59 9.777 -14.393 -14.643 340 HB3 GLN 59 HB3 GLN 59 10.521 -15.781 -13.875 341 HG2 GLN 59 HG2 GLN 59 7.884 -14.460 -13.085 342 HG3 GLN 59 HG3 GLN 59 8.083 -16.040 -13.817 343 HE21 GLN 59 HE21 GLN 59 6.895 -15.146 -11.256 344 HE22 GLN 59 HE22 GLN 59 7.662 -16.067 -10.006 345 H LYS 60 H LYS 60 12.477 -15.122 -11.301 346 HA LYS 60 HA LYS 60 14.675 -13.703 -12.386 347 HB2 LYS 60 HB2 LYS 60 14.389 -16.074 -10.537 348 HB3 LYS 60 HB3 LYS 60 15.959 -15.514 -11.077 349 HG2 LYS 60 HG2 LYS 60 14.156 -13.352 -10.103 350 HG3 LYS 60 HG3 LYS 60 14.606 -14.522 -8.878 351 HD2 LYS 60 HD2 LYS 60 16.219 -12.621 -8.979 352 HD3 LYS 60 HD3 LYS 60 16.997 -14.153 -9.321 353 HE2 LYS 60 HE2 LYS 60 17.794 -12.574 -10.974 354 HE3 LYS 60 HE3 LYS 60 16.714 -13.677 -11.803 355 HZ1 LYS 60 HZ1 LYS 60 15.109 -11.685 -10.886 356 HZ2 LYS 60 HZ2 LYS 60 16.443 -10.900 -11.408 357 HZ3 LYS 60 HZ3 LYS 60 15.623 -11.881 -12.424 358 H ASP 61 H ASP 61 16.667 -15.490 -12.946 359 HA ASP 61 HA ASP 61 16.275 -16.034 -15.563 360 HB2 ASP 61 HB2 ASP 61 18.190 -17.773 -15.182 361 HB3 ASP 61 HB3 ASP 61 18.511 -16.087 -14.825 362 HD2 ASP 61 HD2 ASP 61 19.910 -17.680 -12.075 363 H ASN 62 H ASN 62 15.813 -18.142 -12.658 364 HA ASN 62 HA ASN 62 14.441 -20.025 -14.411 365 HB2 ASN 62 HB2 ASN 62 15.097 -21.735 -12.526 366 HB3 ASN 62 HB3 ASN 62 16.336 -21.258 -13.670 367 HD21 ASN 62 HD21 ASN 62 18.204 -20.903 -12.773 368 HD22 ASN 62 HD22 ASN 62 18.516 -20.190 -11.226 369 H SER 63 H SER 63 12.785 -21.403 -13.033 370 HA SER 63 HA SER 63 11.952 -20.252 -10.587 371 HB2 SER 63 HB2 SER 63 9.634 -19.647 -11.422 372 HB3 SER 63 HB3 SER 63 10.909 -18.569 -11.955 373 HG SER 63 HG SER 63 9.476 -19.154 -13.704 374 H CYS 64 H CYS 64 9.731 -21.378 -9.913 375 HA CYS 64 HA CYS 64 10.150 -24.155 -10.306 376 HB2 CYS 64 HB2 CYS 64 9.345 -23.043 -8.169 377 HB3 CYS 64 HB3 CYS 64 7.787 -22.833 -8.942 378 HG CYS 64 HG CYS 64 7.178 -25.244 -9.311 379 H ASN 65 H ASN 65 7.629 -21.715 -11.231 380 HA ASN 65 HA ASN 65 5.906 -23.430 -12.468 381 HB2 ASN 65 HB2 ASN 65 6.597 -20.582 -13.363 382 HB3 ASN 65 HB3 ASN 65 5.097 -21.424 -13.698 383 HD21 ASN 65 HD21 ASN 65 4.897 -19.056 -12.543 384 HD22 ASN 65 HD22 ASN 65 4.453 -19.158 -10.871 385 H LEU 66 H LEU 66 5.837 -24.366 -14.574 386 HA LEU 66 HA LEU 66 8.068 -25.029 -15.898 387 HB2 LEU 66 HB2 LEU 66 6.618 -25.367 -17.886 388 HB3 LEU 66 HB3 LEU 66 6.031 -26.089 -16.401 389 HG LEU 66 HG LEU 66 4.652 -23.824 -16.235 390 HD11 LEU 66 HD11 LEU 66 5.807 -23.681 -18.874 391 HD12 LEU 66 HD12 LEU 66 4.031 -23.762 -18.976 392 HD13 LEU 66 HD13 LEU 66 4.810 -22.492 -18.002 393 HD21 LEU 66 HD21 LEU 66 4.123 -26.477 -17.030 394 HD22 LEU 66 HD22 LEU 66 2.975 -25.262 -16.419 395 HD23 LEU 66 HD23 LEU 66 3.249 -25.425 -18.170 396 H PHE 67 H PHE 67 6.096 -22.050 -16.441 397 HA PHE 67 HA PHE 67 8.411 -20.625 -17.235 398 HB2 PHE 67 HB2 PHE 67 6.416 -21.768 -19.226 399 HB3 PHE 67 HB3 PHE 67 7.039 -20.162 -19.549 400 HD1 PHE 67 HD1 PHE 67 9.694 -19.980 -19.363 401 HD2 PHE 67 HD2 PHE 67 7.551 -23.563 -20.122 402 HE1 PHE 67 HE1 PHE 67 11.744 -20.984 -20.407 403 HE2 PHE 67 HE2 PHE 67 9.601 -24.567 -21.166 404 HZ PHE 67 HZ PHE 67 11.672 -23.266 -21.296 405 H ASN 68 H ASN 68 8.027 -18.350 -17.306 406 HA ASN 68 HA ASN 68 5.554 -17.651 -16.042 407 HB2 ASN 68 HB2 ASN 68 6.692 -15.768 -15.296 408 HB3 ASN 68 HB3 ASN 68 8.096 -16.741 -15.688 409 HD21 ASN 68 HD21 ASN 68 9.403 -16.212 -17.345 410 HD22 ASN 68 HD22 ASN 68 9.240 -14.797 -18.331 411 H THR 69 H THR 69 3.915 -16.359 -17.037 412 HA THR 69 HA THR 69 4.017 -16.222 -19.913 413 HB THR 69 HB THR 69 1.820 -15.021 -18.220 414 HG1 THR 69 HG1 THR 69 2.468 -17.857 -18.625 415 HG21 THR 69 HG21 THR 69 0.523 -15.561 -20.035 416 HG22 THR 69 HG22 THR 69 2.055 -15.813 -20.906 417 HG23 THR 69 HG23 THR 69 1.230 -17.191 -20.139 418 H LEU 70 H LEU 70 4.834 -14.615 -21.084 419 HA LEU 70 HA LEU 70 5.673 -12.223 -19.789 420 HB2 LEU 70 HB2 LEU 70 7.103 -12.913 -21.448 421 HB3 LEU 70 HB3 LEU 70 5.811 -13.378 -22.537 422 HG LEU 70 HG LEU 70 5.337 -11.045 -23.051 423 HD11 LEU 70 HD11 LEU 70 7.715 -9.996 -21.621 424 HD12 LEU 70 HD12 LEU 70 6.140 -9.238 -21.958 425 HD13 LEU 70 HD13 LEU 70 6.299 -10.404 -20.623 426 HD21 LEU 70 HD21 LEU 70 7.107 -12.327 -24.290 427 HD22 LEU 70 HD22 LEU 70 7.268 -10.555 -24.358 428 HD23 LEU 70 HD23 LEU 70 8.319 -11.504 -23.280 429 H THR 71 H THR 71 2.736 -13.348 -21.281 430 HA THR 71 HA THR 71 1.752 -10.892 -22.236 431 HB THR 71 HB THR 71 0.496 -13.520 -21.311 432 HG1 THR 71 HG1 THR 71 1.777 -12.442 -23.505 433 HG21 THR 71 HG21 THR 71 -0.787 -10.937 -22.056 434 HG22 THR 71 HG22 THR 71 -1.294 -12.316 -23.062 435 HG23 THR 71 HG23 THR 71 -1.507 -12.377 -21.296 436 H GLU 72 H GLU 72 1.903 -12.338 -18.989 437 HA GLU 72 HA GLU 72 -0.003 -10.656 -17.855 438 HB2 GLU 72 HB2 GLU 72 2.363 -12.155 -16.659 439 HB3 GLU 72 HB3 GLU 72 1.193 -11.292 -15.681 440 HG2 GLU 72 HG2 GLU 72 -0.624 -12.710 -16.429 441 HG3 GLU 72 HG3 GLU 72 0.350 -13.404 -17.710 442 HE2 GLU 72 HE2 GLU 72 -0.396 -14.874 -14.542 443 H ALA 73 H ALA 73 3.619 -10.465 -18.014 444 HA ALA 73 HA ALA 73 3.805 -8.035 -16.633 445 HB1 ALA 73 HB1 ALA 73 6.089 -8.064 -17.354 446 HB2 ALA 73 HB2 ALA 73 5.619 -9.763 -17.109 447 HB3 ALA 73 HB3 ALA 73 5.705 -9.091 -18.755 448 H ARG 74 H ARG 74 3.815 -8.803 -20.185 449 HA ARG 74 HA ARG 74 4.052 -6.240 -21.055 450 HB2 ARG 74 HB2 ARG 74 3.713 -7.178 -23.133 451 HB3 ARG 74 HB3 ARG 74 3.764 -8.691 -22.251 452 HG2 ARG 74 HG2 ARG 74 1.239 -8.520 -21.948 453 HG3 ARG 74 HG3 ARG 74 1.257 -7.114 -22.993 454 HD2 ARG 74 HD2 ARG 74 2.077 -8.416 -24.881 455 HD3 ARG 74 HD3 ARG 74 2.411 -9.802 -23.862 456 HE ARG 74 HE ARG 74 -0.341 -9.219 -23.542 457 HH11 ARG 74 HH22 ARG 74 1.830 -10.236 -26.118 458 HH12 ARG 74 HH21 ARG 74 0.602 -11.092 -26.989 459 HH21 ARG 74 HH12 ARG 74 -1.962 -10.348 -24.691 460 HH22 ARG 74 HH11 ARG 74 -1.570 -11.156 -26.172 461 H ASP 75 H ASP 75 1.224 -7.990 -19.778 462 HA ASP 75 HA ASP 75 -0.658 -6.122 -20.738 463 HB2 ASP 75 HB2 ASP 75 -0.665 -8.391 -18.735 464 HB3 ASP 75 HB3 ASP 75 -2.031 -7.294 -18.768 465 HD2 ASP 75 HD2 ASP 75 -1.871 -10.306 -19.932 466 H ALA 76 H ALA 76 1.419 -6.533 -17.876 467 HA ALA 76 HA ALA 76 0.017 -4.818 -16.137 468 HB1 ALA 76 HB1 ALA 76 3.005 -5.267 -16.070 469 HB2 ALA 76 HB2 ALA 76 1.859 -5.120 -14.716 470 HB3 ALA 76 HB3 ALA 76 1.882 -6.598 -15.706 471 H ILE 77 H ILE 77 2.926 -4.320 -18.259 472 HA ILE 77 HA ILE 77 3.001 -1.539 -17.705 473 HB ILE 77 HB ILE 77 4.552 -1.641 -19.781 474 HG12 ILE 77 HG12 ILE 77 3.469 -4.174 -20.020 475 HG13 ILE 77 HG13 ILE 77 4.910 -3.579 -20.822 476 HG21 ILE 77 HG21 ILE 77 5.131 -3.029 -17.155 477 HG22 ILE 77 HG22 ILE 77 6.373 -2.597 -18.354 478 HG23 ILE 77 HG23 ILE 77 5.407 -1.321 -17.573 479 HD11 ILE 77 HD11 ILE 77 4.975 -4.817 -18.037 480 HD12 ILE 77 HD12 ILE 77 5.205 -5.761 -19.529 481 HD13 ILE 77 HD13 ILE 77 6.358 -4.473 -19.104 482 H LYS 78 H LYS 78 1.375 -3.627 -20.074 483 HA LYS 78 HA LYS 78 0.765 -1.574 -21.909 484 HB2 LYS 78 HB2 LYS 78 0.740 -3.852 -22.633 485 HB3 LYS 78 HB3 LYS 78 -0.402 -4.317 -21.389 486 HG2 LYS 78 HG2 LYS 78 -1.584 -4.074 -23.527 487 HG3 LYS 78 HG3 LYS 78 -2.134 -2.835 -22.417 488 HD2 LYS 78 HD2 LYS 78 -1.583 -2.082 -24.831 489 HD3 LYS 78 HD3 LYS 78 -0.922 -1.113 -23.529 490 HE2 LYS 78 HE2 LYS 78 1.273 -2.040 -23.790 491 HE3 LYS 78 HE3 LYS 78 0.684 -3.404 -24.719 492 HZ1 LYS 78 HZ1 LYS 78 0.351 -0.672 -25.704 493 HZ2 LYS 78 HZ2 LYS 78 1.740 -1.492 -25.957 494 HZ3 LYS 78 HZ3 LYS 78 0.332 -2.067 -26.552 495 H ASP 79 H ASP 79 -0.708 -2.759 -18.884 496 HA ASP 79 HA ASP 79 -3.124 -1.369 -19.300 497 HB2 ASP 79 HB2 ASP 79 -3.270 -3.177 -17.782 498 HB3 ASP 79 HB3 ASP 79 -1.770 -2.756 -16.979 499 HD2 ASP 79 HD2 ASP 79 -2.576 -1.796 -14.651 500 H ALA 80 H ALA 80 -0.139 -0.885 -17.273 501 HA ALA 80 HA ALA 80 -0.909 1.507 -16.088 502 HB1 ALA 80 HB1 ALA 80 1.196 1.441 -15.193 503 HB2 ALA 80 HB2 ALA 80 1.175 -0.213 -15.850 504 HB3 ALA 80 HB3 ALA 80 1.967 1.097 -16.760 505 H TYR 81 H TYR 81 0.954 0.850 -19.128 506 HA TYR 81 HA TYR 81 1.451 3.494 -19.792 507 HB2 TYR 81 HB2 TYR 81 0.990 0.838 -21.243 508 HB3 TYR 81 HB3 TYR 81 1.286 2.280 -22.195 509 HD1 TYR 81 HD1 TYR 81 2.837 1.261 -18.943 510 HD2 TYR 81 HD2 TYR 81 3.409 1.944 -23.128 511 HE1 TYR 81 HE1 TYR 81 5.343 0.939 -18.660 512 HE2 TYR 81 HE2 TYR 81 5.913 1.620 -22.831 513 HH TYR 81 HH TYR 81 7.260 0.133 -20.397 514 H GLU 82 H GLU 82 -1.323 1.346 -20.726 515 HA GLU 82 HA GLU 82 -2.550 3.377 -22.226 516 HB2 GLU 82 HB2 GLU 82 -2.912 0.907 -22.543 517 HB3 GLU 82 HB3 GLU 82 -3.786 0.859 -21.025 518 HG2 GLU 82 HG2 GLU 82 -5.226 2.813 -22.117 519 HG3 GLU 82 HG3 GLU 82 -4.579 2.197 -23.624 520 HE2 GLU 82 HE2 GLU 82 -6.360 1.085 -24.372 521 H SER 83 H SER 83 -2.420 2.576 -18.815 522 HA SER 83 HA SER 83 -4.872 3.772 -18.126 523 HB2 SER 83 HB2 SER 83 -3.780 2.107 -16.679 524 HB3 SER 83 HB3 SER 83 -2.385 3.148 -16.474 525 HG SER 83 HG SER 83 -5.035 4.014 -15.728 526 H TYR 84 H TYR 84 -1.404 4.828 -18.085 527 HA TYR 84 HA TYR 84 -2.262 7.526 -17.380 528 HB2 TYR 84 HB2 TYR 84 0.388 5.997 -17.711 529 HB3 TYR 84 HB3 TYR 84 0.362 7.716 -17.374 530 HD1 TYR 84 HD1 TYR 84 -0.960 8.460 -15.232 531 HD2 TYR 84 HD2 TYR 84 0.403 4.467 -15.941 532 HE1 TYR 84 HE1 TYR 84 -1.097 7.963 -12.742 533 HE2 TYR 84 HE2 TYR 84 0.262 3.984 -13.449 534 HH TYR 84 HH TYR 84 -1.383 5.287 -11.454 535 H CYS 85 H CYS 85 -1.999 5.702 -20.170 536 HA CYS 85 HA CYS 85 -0.451 7.023 -21.921 537 HB2 CYS 85 HB2 CYS 85 -1.494 5.241 -22.905 538 HB3 CYS 85 HB3 CYS 85 -3.041 5.568 -22.149 539 HG CYS 85 HG CYS 85 -3.520 5.906 -24.606 540 H GLY 86 H GLY 86 -0.311 9.132 -22.622 541 HA2 GLY 86 HA2 GLY 86 -1.374 11.043 -23.555 542 HA3 GLY 86 HA3 GLY 86 -2.747 10.791 -22.496 543 H ILE 87 H ILE 87 -0.338 10.017 -20.440 544 HA ILE 87 HA ILE 87 0.080 12.817 -19.651 545 HB ILE 87 HB ILE 87 -0.215 10.381 -17.889 546 HG12 ILE 87 HG12 ILE 87 -2.257 12.017 -17.196 547 HG13 ILE 87 HG13 ILE 87 -2.151 12.392 -18.905 548 HG21 ILE 87 HG21 ILE 87 0.521 11.578 -16.161 549 HG22 ILE 87 HG22 ILE 87 1.162 12.727 -17.360 550 HG23 ILE 87 HG23 ILE 87 -0.438 13.002 -16.631 551 HD11 ILE 87 HD11 ILE 87 -2.527 10.121 -19.554 552 HD12 ILE 87 HD12 ILE 87 -2.180 9.515 -17.916 553 HD13 ILE 87 HD13 ILE 87 -3.681 10.419 -18.231 554 H ASP 88 H ASP 88 2.083 13.259 -20.508 555 HA ASP 88 HA ASP 88 4.145 11.293 -19.911 556 HB2 ASP 88 HB2 ASP 88 4.544 13.621 -21.799 557 HB3 ASP 88 HB3 ASP 88 5.332 12.056 -21.811 558 HD2 ASP 88 HD2 ASP 88 2.409 13.070 -23.992 559 H ASP 89 H ASP 89 2.964 14.618 -19.521 560 HA ASP 89 HA ASP 89 4.913 15.053 -17.489 561 HB2 ASP 89 HB2 ASP 89 5.885 17.066 -18.403 562 HB3 ASP 89 HB3 ASP 89 6.049 15.819 -19.624 563 HD2 ASP 89 HD2 ASP 89 3.510 18.860 -20.204 564 H CYS 90 H CYS 90 4.238 16.893 -16.099 565 HA CYS 90 HA CYS 90 1.419 17.459 -16.419 566 HB2 CYS 90 HB2 CYS 90 2.921 18.523 -14.079 567 HB3 CYS 90 HB3 CYS 90 1.331 17.792 -14.160 568 HA PRO 91 HA PRO 91 2.297 21.475 -17.881 569 HB2 PRO 91 HB2 PRO 91 -0.138 22.662 -17.521 570 HB3 PRO 91 HB3 PRO 91 0.234 21.635 -18.891 571 HG2 PRO 91 HG2 PRO 91 -1.402 21.023 -16.506 572 HG3 PRO 91 HG3 PRO 91 -1.364 20.199 -18.052 573 HD2 PRO 91 HD2 PRO 91 -0.150 19.318 -15.606 574 HD3 PRO 91 HD3 PRO 91 -0.015 18.554 -17.178 575 H GLN 92 H GLN 92 1.394 20.855 -14.672 576 HA GLN 92 HA GLN 92 1.660 23.545 -13.835 577 HB2 GLN 92 HB2 GLN 92 1.606 20.912 -12.301 578 HB3 GLN 92 HB3 GLN 92 1.657 22.480 -11.521 579 HG2 GLN 92 HG2 GLN 92 -0.437 23.022 -13.055 580 HG3 GLN 92 HG3 GLN 92 -0.562 21.280 -13.203 581 HE21 GLN 92 HE21 GLN 92 -2.157 20.646 -11.963 582 HE22 GLN 92 HE22 GLN 92 -2.413 21.054 -10.299 583 H CYS 93 H CYS 93 3.708 20.558 -13.595 584 HA CYS 93 HA CYS 93 5.858 22.015 -12.428 585 HB2 CYS 93 HB2 CYS 93 7.067 19.935 -12.481 586 HB3 CYS 93 HB3 CYS 93 5.428 19.610 -11.954 587 H SER 94 H SER 94 4.764 20.993 -15.669 588 HA SER 94 HA SER 94 7.216 21.444 -16.944 589 HB2 SER 94 HB2 SER 94 5.500 20.029 -17.956 590 HB3 SER 94 HB3 SER 94 4.354 21.354 -17.988 591 HG SER 94 HG SER 94 5.952 22.482 -19.425 592 H LYS 95 H LYS 95 4.362 23.458 -16.146 593 HA LYS 95 HA LYS 95 5.274 25.663 -17.735 594 HB2 LYS 95 HB2 LYS 95 2.886 25.226 -17.411 595 HB3 LYS 95 HB3 LYS 95 3.057 25.431 -15.679 596 HG2 LYS 95 HG2 LYS 95 2.228 27.525 -16.586 597 HG3 LYS 95 HG3 LYS 95 3.885 27.788 -16.079 598 HD2 LYS 95 HD2 LYS 95 4.683 27.969 -18.264 599 HD3 LYS 95 HD3 LYS 95 3.468 26.890 -18.918 600 HE2 LYS 95 HE2 LYS 95 2.838 29.693 -17.879 601 HE3 LYS 95 HE3 LYS 95 3.185 29.344 -19.561 602 HZ1 LYS 95 HZ1 LYS 95 0.834 29.319 -19.107 603 HZ2 LYS 95 HZ2 LYS 95 1.325 27.835 -19.581 604 HZ3 LYS 95 HZ3 LYS 95 1.009 28.126 -18.005 605 H TYR 96 H TYR 96 5.540 24.514 -14.373 606 HA TYR 96 HA TYR 96 6.486 26.976 -13.332 607 HB2 TYR 96 HB2 TYR 96 5.454 25.059 -12.041 608 HB3 TYR 96 HB3 TYR 96 6.766 24.010 -12.539 609 HD1 TYR 96 HD1 TYR 96 9.084 24.403 -11.646 610 HD2 TYR 96 HD2 TYR 96 5.683 26.539 -10.170 611 HE1 TYR 96 HE1 TYR 96 10.392 25.065 -9.569 612 HE2 TYR 96 HE2 TYR 96 7.003 27.193 -8.098 613 HH TYR 96 HH TYR 96 8.897 26.342 -6.830 614 H ILE 97 H ILE 97 8.336 27.926 -14.057 615 HA ILE 97 HA ILE 97 10.759 26.372 -13.892 616 HB ILE 97 HB ILE 97 9.918 27.651 -16.496 617 HG12 ILE 97 HG12 ILE 97 10.198 24.745 -15.688 618 HG13 ILE 97 HG13 ILE 97 8.732 25.572 -16.173 619 HG21 ILE 97 HG21 ILE 97 12.377 27.795 -15.794 620 HG22 ILE 97 HG22 ILE 97 12.413 26.029 -16.011 621 HG23 ILE 97 HG23 ILE 97 12.009 27.086 -17.385 622 HD11 ILE 97 HD11 ILE 97 11.153 24.913 -17.894 623 HD12 ILE 97 HD12 ILE 97 9.467 24.386 -18.118 624 HD13 ILE 97 HD13 ILE 97 9.915 26.084 -18.410 625 H ASP 98 H ASP 98 12.462 27.631 -13.210 626 HA ASP 98 HA ASP 98 11.763 30.389 -12.728 627 HB2 ASP 98 HB2 ASP 98 12.627 29.200 -10.807 628 HB3 ASP 98 HB3 ASP 98 13.968 28.545 -11.726 629 HD2 ASP 98 HD2 ASP 98 14.012 31.808 -9.709 630 H ASP 99 H ASP 99 12.263 31.639 -14.569 631 HA ASP 99 HA ASP 99 14.782 31.045 -15.884 632 HB2 ASP 99 HB2 ASP 99 12.247 32.496 -16.707 633 HB3 ASP 99 HB3 ASP 99 13.739 32.796 -17.576 634 HD2 ASP 99 HD2 ASP 99 13.946 29.575 -18.845 Start of MODEL 8 1 H GLU 14 H GLU 14 2.130 1.627 -4.186 2 HA GLU 14 HA GLU 14 1.759 0.573 -1.542 3 HB2 GLU 14 HB2 GLU 14 -0.042 1.767 -3.655 4 HB3 GLU 14 HB3 GLU 14 -0.754 0.838 -2.352 5 HG2 GLU 14 HG2 GLU 14 -0.097 2.371 -0.701 6 HG3 GLU 14 HG3 GLU 14 1.278 2.944 -1.624 7 HE2 GLU 14 HE2 GLU 14 -1.191 4.358 -0.518 8 H ASP 15 H ASP 15 2.323 -0.697 -4.617 9 HA ASP 15 HA ASP 15 0.982 -3.156 -3.828 10 HB2 ASP 15 HB2 ASP 15 0.925 -1.684 -6.456 11 HB3 ASP 15 HB3 ASP 15 0.976 -3.435 -6.522 12 HD2 ASP 15 HD2 ASP 15 -2.072 -1.530 -4.809 13 H GLN 16 H GLN 16 2.172 -5.116 -4.508 14 HA GLN 16 HA GLN 16 4.930 -4.782 -4.461 15 HB2 GLN 16 HB2 GLN 16 3.548 -7.292 -5.459 16 HB3 GLN 16 HB3 GLN 16 5.046 -7.165 -4.558 17 HG2 GLN 16 HG2 GLN 16 3.461 -6.011 -2.725 18 HG3 GLN 16 HG3 GLN 16 2.205 -6.897 -3.567 19 HE21 GLN 16 HE21 GLN 16 1.936 -8.061 -1.599 20 HE22 GLN 16 HE22 GLN 16 2.958 -9.400 -1.198 21 H GLU 17 H GLU 17 2.597 -5.494 -7.124 22 HA GLU 17 HA GLU 17 4.382 -6.046 -9.096 23 HB2 GLU 17 HB2 GLU 17 1.744 -5.981 -9.045 24 HB3 GLU 17 HB3 GLU 17 1.936 -4.347 -9.648 25 HG2 GLU 17 HG2 GLU 17 1.853 -5.507 -11.666 26 HG3 GLU 17 HG3 GLU 17 3.585 -5.497 -11.398 27 HE2 GLU 17 HE2 GLU 17 2.761 -7.268 -12.880 28 H GLN 18 H GLN 18 3.336 -2.864 -7.793 29 HA GLN 18 HA GLN 18 4.443 -1.296 -9.766 30 HB2 GLN 18 HB2 GLN 18 2.983 -0.215 -8.258 31 HB3 GLN 18 HB3 GLN 18 3.789 -0.867 -6.845 32 HG2 GLN 18 HG2 GLN 18 4.282 1.567 -7.194 33 HG3 GLN 18 HG3 GLN 18 5.732 0.582 -7.197 34 HE21 GLN 18 HE21 GLN 18 3.216 1.175 -9.645 35 HE22 GLN 18 HE22 GLN 18 4.259 1.765 -10.896 36 H TRP 19 H TRP 19 5.895 -2.955 -6.963 37 HA TRP 19 HA TRP 19 8.308 -1.545 -6.889 38 HB2 TRP 19 HB2 TRP 19 7.265 -3.225 -5.225 39 HB3 TRP 19 HB3 TRP 19 8.032 -4.459 -6.204 40 HD1 TRP 19 HD1 TRP 19 9.083 -1.325 -4.133 41 HE1 TRP 19 HE1 TRP 19 11.529 -1.614 -3.187 42 HE3 TRP 19 HE3 TRP 19 10.032 -5.736 -6.477 43 HZ2 TRP 19 HZ2 TRP 19 13.541 -3.611 -3.517 44 HZ3 TRP 19 HZ3 TRP 19 12.262 -6.789 -6.112 45 HH2 TRP 19 HH2 TRP 19 13.986 -5.798 -4.691 46 H ALA 20 H ALA 20 7.013 -4.154 -8.950 47 HA ALA 20 HA ALA 20 9.515 -4.888 -10.064 48 HB1 ALA 20 HB1 ALA 20 7.446 -5.517 -11.876 49 HB2 ALA 20 HB2 ALA 20 8.156 -6.584 -10.641 50 HB3 ALA 20 HB3 ALA 20 6.708 -5.623 -10.259 51 H MET 21 H MET 21 6.810 -2.700 -11.065 52 HA MET 21 HA MET 21 7.896 -2.023 -13.510 53 HB2 MET 21 HB2 MET 21 5.655 -1.328 -11.885 54 HB3 MET 21 HB3 MET 21 6.466 0.195 -12.195 55 HG2 MET 21 HG2 MET 21 6.334 -1.432 -14.637 56 HG3 MET 21 HG3 MET 21 4.736 -1.195 -13.958 57 HE1 MET 21 HE1 MET 21 3.420 1.442 -14.564 58 HE2 MET 21 HE2 MET 21 3.980 0.847 -12.983 59 HE3 MET 21 HE3 MET 21 4.376 2.503 -13.502 60 H GLN 22 H GLN 22 8.875 -1.169 -10.276 61 HA GLN 22 HA GLN 22 9.820 1.330 -10.491 62 HB2 GLN 22 HB2 GLN 22 9.988 -0.562 -8.600 63 HB3 GLN 22 HB3 GLN 22 11.617 -0.731 -9.224 64 HG2 GLN 22 HG2 GLN 22 11.603 1.951 -9.034 65 HG3 GLN 22 HG3 GLN 22 10.343 1.639 -7.856 66 HE21 GLN 22 HE21 GLN 22 10.786 0.557 -5.962 67 HE22 GLN 22 HE22 GLN 22 12.389 0.292 -5.363 68 H THR 23 H THR 23 12.027 -1.526 -10.953 69 HA THR 23 HA THR 23 13.911 0.040 -12.387 70 HB THR 23 HB THR 23 13.579 -2.993 -12.094 71 HG1 THR 23 HG1 THR 23 13.806 -2.046 -10.030 72 HG21 THR 23 HG21 THR 23 15.811 -3.204 -12.761 73 HG22 THR 23 HG22 THR 23 15.353 -1.810 -13.768 74 HG23 THR 23 HG23 THR 23 16.226 -1.554 -12.238 75 H LEU 24 H LEU 24 11.566 -2.530 -13.407 76 HA LEU 24 HA LEU 24 12.086 -2.744 -16.000 77 HB2 LEU 24 HB2 LEU 24 10.323 -3.988 -15.178 78 HB3 LEU 24 HB3 LEU 24 9.508 -2.596 -14.492 79 HG LEU 24 HG LEU 24 9.772 -3.001 -17.476 80 HD11 LEU 24 HD11 LEU 24 8.108 -4.486 -17.555 81 HD12 LEU 24 HD12 LEU 24 8.424 -4.751 -15.824 82 HD13 LEU 24 HD13 LEU 24 7.151 -3.616 -16.333 83 HD21 LEU 24 HD21 LEU 24 7.505 -1.615 -17.156 84 HD22 LEU 24 HD22 LEU 24 8.369 -1.077 -15.695 85 HD23 LEU 24 HD23 LEU 24 9.103 -0.843 -17.300 86 H MET 25 H MET 25 9.857 -0.154 -14.747 87 HA MET 25 HA MET 25 9.928 1.195 -17.207 88 HB2 MET 25 HB2 MET 25 8.195 2.329 -16.201 89 HB3 MET 25 HB3 MET 25 8.419 1.261 -14.830 90 HG2 MET 25 HG2 MET 25 10.087 2.875 -13.861 91 HG3 MET 25 HG3 MET 25 9.824 3.949 -15.220 92 HE1 MET 25 HE1 MET 25 6.455 5.390 -14.890 93 HE2 MET 25 HE2 MET 25 7.713 4.755 -15.978 94 HE3 MET 25 HE3 MET 25 6.329 3.732 -15.525 95 H GLY 26 H GLY 26 11.896 1.288 -14.259 96 HA2 GLY 26 HA2 GLY 26 13.026 3.849 -14.572 97 HA3 GLY 26 HA3 GLY 26 13.693 2.504 -13.668 98 H SER 27 H SER 27 13.320 0.972 -16.481 99 HA SER 27 HA SER 27 16.009 1.132 -17.144 100 HB2 SER 27 HB2 SER 27 15.396 -0.290 -19.073 101 HB3 SER 27 HB3 SER 27 14.622 -0.852 -17.604 102 HG SER 27 HG SER 27 13.083 -0.828 -19.302 103 H GLY 28 H GLY 28 13.481 3.330 -17.710 104 HA2 GLY 28 HA2 GLY 28 13.860 5.400 -18.730 105 HA3 GLY 28 HA3 GLY 28 15.057 4.678 -19.787 106 H VAL 29 H VAL 29 12.251 2.684 -19.396 107 HA VAL 29 HA VAL 29 11.553 3.055 -22.131 108 HB VAL 29 HB VAL 29 10.757 1.316 -19.857 109 HG11 VAL 29 HG11 VAL 29 8.919 0.379 -21.452 110 HG12 VAL 29 HG12 VAL 29 8.555 1.797 -20.438 111 HG13 VAL 29 HG13 VAL 29 8.946 2.012 -22.161 112 HG21 VAL 29 HG21 VAL 29 12.259 1.099 -22.262 113 HG22 VAL 29 HG22 VAL 29 11.949 -0.153 -21.035 114 HG23 VAL 29 HG23 VAL 29 10.846 0.029 -22.420 115 H LEU 30 H LEU 30 10.065 3.867 -18.937 116 HA LEU 30 HA LEU 30 8.041 5.407 -20.377 117 HB2 LEU 30 HB2 LEU 30 8.193 4.023 -17.769 118 HB3 LEU 30 HB3 LEU 30 7.331 5.549 -17.769 119 HG LEU 30 HG LEU 30 6.701 3.359 -19.753 120 HD11 LEU 30 HD11 LEU 30 6.547 2.711 -17.230 121 HD12 LEU 30 HD12 LEU 30 5.095 3.739 -17.246 122 HD13 LEU 30 HD13 LEU 30 5.200 2.333 -18.331 123 HD21 LEU 30 HD21 LEU 30 5.912 5.665 -20.236 124 HD22 LEU 30 HD22 LEU 30 4.592 4.492 -20.008 125 HD23 LEU 30 HD23 LEU 30 4.999 5.637 -18.707 126 H ALA 31 H ALA 31 7.402 7.485 -18.887 127 HA ALA 31 HA ALA 31 9.949 8.908 -18.523 128 HB1 ALA 31 HB1 ALA 31 7.887 9.429 -20.308 129 HB2 ALA 31 HB2 ALA 31 7.532 10.530 -18.955 130 HB3 ALA 31 HB3 ALA 31 9.114 10.600 -19.768 131 H ARG 32 H ARG 32 10.354 9.821 -16.547 132 HA ARG 32 HA ARG 32 8.093 9.853 -14.714 133 HB2 ARG 32 HB2 ARG 32 10.878 8.757 -14.378 134 HB3 ARG 32 HB3 ARG 32 10.175 9.554 -12.985 135 HG2 ARG 32 HG2 ARG 32 8.049 8.013 -13.696 136 HG3 ARG 32 HG3 ARG 32 9.332 7.014 -14.349 137 HD2 ARG 32 HD2 ARG 32 8.954 7.904 -11.460 138 HD3 ARG 32 HD3 ARG 32 8.982 6.265 -12.082 139 HE ARG 32 HE ARG 32 11.317 7.982 -11.548 140 HH11 ARG 32 HH22 ARG 32 10.123 5.077 -13.134 141 HH12 ARG 32 HH21 ARG 32 11.684 4.334 -13.233 142 HH21 ARG 32 HH12 ARG 32 13.378 7.003 -11.677 143 HH22 ARG 32 HH11 ARG 32 13.548 5.437 -12.398 144 H CYS 33 H CYS 33 8.119 11.605 -13.112 145 HA CYS 33 HA CYS 33 9.571 13.899 -14.103 146 HB2 CYS 33 HB2 CYS 33 7.019 13.690 -13.295 147 HB3 CYS 33 HB3 CYS 33 7.740 14.106 -11.753 148 H ARG 34 H ARG 34 11.215 14.955 -12.922 149 HA ARG 34 HA ARG 34 12.501 13.359 -10.998 150 HB2 ARG 34 HB2 ARG 34 13.027 16.262 -11.818 151 HB3 ARG 34 HB3 ARG 34 14.136 15.261 -10.901 152 HG2 ARG 34 HG2 ARG 34 13.392 15.098 -13.814 153 HG3 ARG 34 HG3 ARG 34 14.971 14.964 -13.066 154 HD2 ARG 34 HD2 ARG 34 12.763 12.851 -12.989 155 HD3 ARG 34 HD3 ARG 34 14.243 12.762 -13.924 156 HE ARG 34 HE ARG 34 14.667 13.144 -11.038 157 HH11 ARG 34 HH22 ARG 34 14.303 10.810 -13.645 158 HH12 ARG 34 HH21 ARG 34 15.098 9.534 -12.786 159 HH21 ARG 34 HH12 ARG 34 15.717 11.461 -9.903 160 HH22 ARG 34 HH11 ARG 34 15.908 9.907 -10.643 161 H ILE 35 H ILE 35 9.790 15.305 -10.775 162 HA ILE 35 HA ILE 35 10.469 16.340 -8.127 163 HB ILE 35 HB ILE 35 7.917 16.913 -9.581 164 HG12 ILE 35 HG12 ILE 35 10.557 18.299 -10.135 165 HG13 ILE 35 HG13 ILE 35 9.733 17.214 -11.237 166 HG21 ILE 35 HG21 ILE 35 9.140 19.158 -8.299 167 HG22 ILE 35 HG22 ILE 35 7.621 18.322 -7.896 168 HG23 ILE 35 HG23 ILE 35 9.155 17.777 -7.176 169 HD11 ILE 35 HD11 ILE 35 7.738 19.057 -10.476 170 HD12 ILE 35 HD12 ILE 35 9.207 20.039 -10.689 171 HD13 ILE 35 HD13 ILE 35 8.616 19.022 -12.024 172 H HIS 36 H HIS 36 8.841 13.755 -9.784 173 HA HIS 36 HA HIS 36 8.053 12.674 -7.254 174 HB2 HIS 36 HB2 HIS 36 5.671 12.248 -8.307 175 HB3 HIS 36 HB3 HIS 36 6.022 13.688 -7.373 176 HD1 HIS 36 HD1 HIS 36 5.929 12.597 -11.045 177 HD2 HIS 36 HD2 HIS 36 5.476 16.034 -8.683 178 HE1 HIS 36 HE1 HIS 36 5.192 14.459 -12.626 179 H ASN 37 H ASN 37 8.776 10.614 -7.354 180 HA ASN 37 HA ASN 37 9.096 9.465 -9.977 181 HB2 ASN 37 HB2 ASN 37 10.908 9.409 -8.138 182 HB3 ASN 37 HB3 ASN 37 9.886 8.282 -7.267 183 HD21 ASN 37 HD21 ASN 37 12.454 8.493 -9.228 184 HD22 ASN 37 HD22 ASN 37 12.415 6.964 -10.041 185 H ASP 38 H ASP 38 6.785 9.619 -7.481 186 HA ASP 38 HA ASP 38 5.969 6.886 -7.615 187 HB2 ASP 38 HB2 ASP 38 3.972 7.859 -6.262 188 HB3 ASP 38 HB3 ASP 38 5.553 7.876 -5.508 189 HD2 ASP 38 HD2 ASP 38 5.805 9.634 -4.477 190 H VAL 39 H VAL 39 5.911 9.204 -9.876 191 HA VAL 39 HA VAL 39 3.143 8.653 -10.699 192 HB VAL 39 HB VAL 39 4.721 11.118 -10.539 193 HG11 VAL 39 HG11 VAL 39 3.448 10.288 -13.134 194 HG12 VAL 39 HG12 VAL 39 3.424 11.997 -12.639 195 HG13 VAL 39 HG13 VAL 39 4.977 11.152 -12.843 196 HG21 VAL 39 HG21 VAL 39 2.606 10.767 -9.340 197 HG22 VAL 39 HG22 VAL 39 2.489 12.137 -10.471 198 HG23 VAL 39 HG23 VAL 39 1.754 10.570 -10.890 199 H ILE 40 H ILE 40 2.793 8.066 -12.890 200 HA ILE 40 HA ILE 40 5.267 7.451 -14.350 201 HB ILE 40 HB ILE 40 4.714 5.333 -13.922 202 HG12 ILE 40 HG12 ILE 40 2.583 5.866 -16.013 203 HG13 ILE 40 HG13 ILE 40 4.289 5.650 -16.352 204 HG21 ILE 40 HG21 ILE 40 2.475 4.534 -13.273 205 HG22 ILE 40 HG22 ILE 40 3.042 5.879 -12.254 206 HG23 ILE 40 HG23 ILE 40 1.830 6.174 -13.524 207 HD11 ILE 40 HD11 ILE 40 4.200 3.379 -15.286 208 HD12 ILE 40 HD12 ILE 40 2.453 3.601 -15.028 209 HD13 ILE 40 HD13 ILE 40 3.105 3.523 -16.682 210 H LEU 41 H LEU 41 5.408 8.347 -16.345 211 HA LEU 41 HA LEU 41 2.892 9.331 -17.501 212 HB2 LEU 41 HB2 LEU 41 5.597 10.625 -17.300 213 HB3 LEU 41 HB3 LEU 41 4.468 11.077 -18.561 214 HG LEU 41 HG LEU 41 2.862 11.281 -16.369 215 HD11 LEU 41 HD11 LEU 41 4.714 10.740 -14.840 216 HD12 LEU 41 HD12 LEU 41 5.611 12.156 -15.440 217 HD13 LEU 41 HD13 LEU 41 4.072 12.379 -14.574 218 HD21 LEU 41 HD21 LEU 41 3.437 13.765 -16.480 219 HD22 LEU 41 HD22 LEU 41 4.625 13.319 -17.728 220 HD23 LEU 41 HD23 LEU 41 2.895 12.986 -17.986 221 H ASP 42 H ASP 42 2.502 8.862 -19.654 222 HA ASP 42 HA ASP 42 3.917 6.697 -20.694 223 HB2 ASP 42 HB2 ASP 42 1.733 6.761 -21.484 224 HB3 ASP 42 HB3 ASP 42 1.703 8.511 -21.577 225 HD2 ASP 42 HD2 ASP 42 2.252 9.257 -24.087 226 H SER 43 H SER 43 5.831 6.740 -21.889 227 HA SER 43 HA SER 43 6.730 9.334 -22.790 228 HB2 SER 43 HB2 SER 43 8.142 7.658 -21.387 229 HB3 SER 43 HB3 SER 43 8.312 6.740 -22.870 230 HG SER 43 HG SER 43 9.530 8.336 -23.792 231 H GLY 44 H GLY 44 6.441 5.913 -23.999 232 HA2 GLY 44 HA2 GLY 44 5.464 5.382 -26.063 233 HA3 GLY 44 HA3 GLY 44 5.837 6.984 -26.667 234 H ASN 45 H ASN 45 8.205 5.077 -24.796 235 HA ASN 45 HA ASN 45 9.842 5.036 -27.184 236 HB2 ASN 45 HB2 ASN 45 10.556 5.916 -24.774 237 HB3 ASN 45 HB3 ASN 45 10.784 4.217 -24.410 238 HD21 ASN 45 HD21 ASN 45 11.589 6.726 -26.785 239 HD22 ASN 45 HD22 ASN 45 13.171 6.152 -27.194 240 H ASP 46 H ASP 46 11.472 2.930 -27.028 241 HA ASP 46 HA ASP 46 9.946 0.752 -27.613 242 HB2 ASP 46 HB2 ASP 46 12.805 0.820 -26.537 243 HB3 ASP 46 HB3 ASP 46 12.084 -0.551 -27.357 244 HD2 ASP 46 HD2 ASP 46 14.123 1.198 -29.686 245 H ALA 47 H ALA 47 8.545 -0.256 -26.151 246 HA ALA 47 HA ALA 47 9.089 -0.213 -23.344 247 HB1 ALA 47 HB1 ALA 47 6.973 -1.795 -24.847 248 HB2 ALA 47 HB2 ALA 47 6.932 -1.245 -23.154 249 HB3 ALA 47 HB3 ALA 47 6.813 -0.061 -24.478 250 H SER 48 H SER 48 10.178 -2.096 -25.977 251 HA SER 48 HA SER 48 10.101 -4.643 -25.045 252 HB2 SER 48 HB2 SER 48 10.911 -4.187 -27.265 253 HB3 SER 48 HB3 SER 48 12.198 -3.157 -26.669 254 HG SER 48 HG SER 48 13.385 -4.909 -26.023 255 H SER 49 H SER 49 12.170 -1.908 -24.059 256 HA SER 49 HA SER 49 14.088 -3.408 -22.720 257 HB2 SER 49 HB2 SER 49 14.854 -1.261 -22.951 258 HB3 SER 49 HB3 SER 49 13.247 -0.567 -22.877 259 HG SER 49 HG SER 49 14.935 -1.383 -20.682 260 H ALA 50 H ALA 50 11.039 -1.779 -21.619 261 HA ALA 50 HA ALA 50 11.336 -2.579 -18.924 262 HB1 ALA 50 HB1 ALA 50 9.968 -0.714 -19.246 263 HB2 ALA 50 HB2 ALA 50 9.144 -1.433 -20.651 264 HB3 ALA 50 HB3 ALA 50 8.770 -2.010 -19.010 265 H TYR 51 H TYR 51 10.073 -4.086 -21.873 266 HA TYR 51 HA TYR 51 8.484 -6.039 -20.606 267 HB2 TYR 51 HB2 TYR 51 9.948 -5.622 -23.263 268 HB3 TYR 51 HB3 TYR 51 9.133 -7.146 -22.973 269 HD1 TYR 51 HD2 TYR 51 7.909 -3.836 -21.806 270 HD2 TYR 51 HD1 TYR 51 7.457 -6.990 -24.661 271 HE1 TYR 51 HE2 TYR 51 5.716 -2.818 -22.594 272 HE2 TYR 51 HE1 TYR 51 5.266 -5.962 -25.440 273 HH TYR 51 HH TYR 51 3.839 -3.254 -23.733 274 H LYS 52 H LYS 52 11.929 -5.946 -21.689 275 HA LYS 52 HA LYS 52 12.360 -8.672 -20.964 276 HB2 LYS 52 HB2 LYS 52 13.562 -7.165 -22.739 277 HB3 LYS 52 HB3 LYS 52 14.549 -6.654 -21.385 278 HG2 LYS 52 HG2 LYS 52 14.903 -9.171 -20.877 279 HG3 LYS 52 HG3 LYS 52 14.189 -9.488 -22.446 280 HD2 LYS 52 HD2 LYS 52 15.973 -7.711 -23.305 281 HD3 LYS 52 HD3 LYS 52 16.793 -8.081 -21.801 282 HE2 LYS 52 HE2 LYS 52 17.248 -10.294 -22.421 283 HE3 LYS 52 HE3 LYS 52 15.847 -10.407 -23.469 284 HZ1 LYS 52 HZ1 LYS 52 17.243 -8.528 -24.693 285 HZ2 LYS 52 HZ2 LYS 52 18.468 -9.395 -24.049 286 HZ3 LYS 52 HZ3 LYS 52 17.387 -10.118 -25.036 287 H LEU 53 H LEU 53 13.211 -5.445 -19.552 288 HA LEU 53 HA LEU 53 14.453 -6.569 -17.283 289 HB2 LEU 53 HB2 LEU 53 14.737 -4.258 -18.309 290 HB3 LEU 53 HB3 LEU 53 13.240 -3.820 -17.509 291 HG LEU 53 HG LEU 53 15.353 -3.161 -16.316 292 HD11 LEU 53 HD11 LEU 53 14.336 -4.620 -14.151 293 HD12 LEU 53 HD12 LEU 53 13.883 -2.976 -14.663 294 HD13 LEU 53 HD13 LEU 53 12.956 -4.378 -15.250 295 HD21 LEU 53 HD21 LEU 53 16.420 -5.470 -16.888 296 HD22 LEU 53 HD22 LEU 53 16.794 -4.678 -15.339 297 HD23 LEU 53 HD23 LEU 53 15.612 -6.007 -15.396 298 H GLY 54 H GLY 54 11.110 -5.911 -18.209 299 HA2 GLY 54 HA2 GLY 54 10.025 -5.893 -15.575 300 HA3 GLY 54 HA3 GLY 54 9.161 -6.097 -17.086 301 H THR 55 H THR 55 10.064 -8.381 -18.237 302 HA THR 55 HA THR 55 8.863 -10.394 -16.723 303 HB THR 55 HB THR 55 9.094 -10.311 -19.229 304 HG1 THR 55 HG1 THR 55 9.570 -12.347 -17.415 305 HG21 THR 55 HG21 THR 55 11.466 -9.587 -19.430 306 HG22 THR 55 HG22 THR 55 11.995 -11.056 -18.577 307 HG23 THR 55 HG23 THR 55 11.250 -11.182 -20.188 308 H TYR 56 H TYR 56 12.288 -9.386 -17.023 309 HA TYR 56 HA TYR 56 13.323 -11.634 -15.671 310 HB2 TYR 56 HB2 TYR 56 14.093 -8.802 -16.459 311 HB3 TYR 56 HB3 TYR 56 15.109 -9.577 -15.259 312 HD1 TYR 56 HD1 TYR 56 15.087 -12.402 -16.256 313 HD2 TYR 56 HD2 TYR 56 15.463 -8.698 -18.363 314 HE1 TYR 56 HE1 TYR 56 16.370 -13.578 -18.109 315 HE2 TYR 56 HE2 TYR 56 16.744 -9.886 -20.209 316 HH TYR 56 HH TYR 56 16.871 -13.295 -20.408 317 H LEU 57 H LEU 57 12.280 -8.342 -14.604 318 HA LEU 57 HA LEU 57 13.090 -8.808 -11.914 319 HB2 LEU 57 HB2 LEU 57 12.868 -6.597 -13.194 320 HB3 LEU 57 HB3 LEU 57 11.150 -6.718 -12.873 321 HG LEU 57 HG LEU 57 13.340 -6.599 -10.781 322 HD11 LEU 57 HD11 LEU 57 11.343 -4.463 -10.813 323 HD12 LEU 57 HD12 LEU 57 13.118 -4.381 -10.712 324 HD13 LEU 57 HD13 LEU 57 12.323 -4.531 -12.297 325 HD21 LEU 57 HD21 LEU 57 11.773 -7.759 -9.613 326 HD22 LEU 57 HD22 LEU 57 11.135 -6.116 -9.365 327 HD23 LEU 57 HD23 LEU 57 10.422 -7.170 -10.610 328 H TYR 58 H TYR 58 10.287 -9.566 -13.890 329 HA TYR 58 HA TYR 58 8.571 -9.944 -11.595 330 HB2 TYR 58 HB2 TYR 58 8.529 -10.180 -14.634 331 HB3 TYR 58 HB3 TYR 58 7.285 -11.036 -13.745 332 HD1 TYR 58 HD1 TYR 58 6.588 -9.201 -11.574 333 HD2 TYR 58 HD2 TYR 58 7.520 -8.352 -15.662 334 HE1 TYR 58 HE1 TYR 58 5.214 -7.066 -11.451 335 HE2 TYR 58 HE2 TYR 58 6.142 -6.219 -15.526 336 HH TYR 58 HH TYR 58 5.346 -4.760 -12.820 337 H GLN 59 H GLN 59 10.760 -11.817 -13.658 338 HA GLN 59 HA GLN 59 10.220 -14.086 -11.962 339 HB2 GLN 59 HB2 GLN 59 10.013 -14.160 -15.000 340 HB3 GLN 59 HB3 GLN 59 10.210 -15.603 -14.025 341 HG2 GLN 59 HG2 GLN 59 7.952 -13.596 -13.586 342 HG3 GLN 59 HG3 GLN 59 7.794 -14.998 -14.626 343 HE21 GLN 59 HE21 GLN 59 6.184 -14.565 -12.425 344 HE22 GLN 59 HE22 GLN 59 6.477 -15.770 -11.216 345 H LYS 60 H LYS 60 12.246 -14.181 -11.034 346 HA LYS 60 HA LYS 60 14.515 -14.171 -12.901 347 HB2 LYS 60 HB2 LYS 60 14.412 -12.262 -11.285 348 HB3 LYS 60 HB3 LYS 60 14.519 -13.410 -9.966 349 HG2 LYS 60 HG2 LYS 60 16.759 -12.547 -10.466 350 HG3 LYS 60 HG3 LYS 60 16.695 -14.251 -10.872 351 HD2 LYS 60 HD2 LYS 60 16.590 -13.818 -13.219 352 HD3 LYS 60 HD3 LYS 60 16.099 -12.152 -12.985 353 HE2 LYS 60 HE2 LYS 60 18.463 -12.222 -13.662 354 HE3 LYS 60 HE3 LYS 60 18.344 -11.619 -12.021 355 HZ1 LYS 60 HZ1 LYS 60 20.006 -13.454 -12.545 356 HZ2 LYS 60 HZ2 LYS 60 19.123 -13.589 -11.178 357 HZ3 LYS 60 HZ3 LYS 60 18.729 -14.471 -12.495 358 H ASP 61 H ASP 61 12.910 -15.733 -10.101 359 HA ASP 61 HA ASP 61 14.443 -18.101 -10.764 360 HB2 ASP 61 HB2 ASP 61 14.386 -18.498 -8.136 361 HB3 ASP 61 HB3 ASP 61 15.673 -17.558 -8.863 362 HD2 ASP 61 HD2 ASP 61 12.382 -16.518 -7.832 363 H ASN 62 H ASN 62 13.376 -20.022 -9.260 364 HA ASN 62 HA ASN 62 11.635 -21.205 -8.733 365 HB2 ASN 62 HB2 ASN 62 9.943 -18.658 -8.641 366 HB3 ASN 62 HB3 ASN 62 9.605 -20.171 -7.824 367 HD21 ASN 62 HD21 ASN 62 9.490 -18.317 -6.144 368 HD22 ASN 62 HD22 ASN 62 10.907 -18.079 -5.177 369 H SER 63 H SER 63 12.241 -20.998 -11.443 370 HA SER 63 HA SER 63 9.602 -21.195 -12.601 371 HB2 SER 63 HB2 SER 63 11.834 -19.418 -13.659 372 HB3 SER 63 HB3 SER 63 10.533 -19.982 -14.688 373 HG SER 63 HG SER 63 10.335 -17.804 -13.487 374 H CYS 64 H CYS 64 9.654 -23.371 -13.109 375 HA CYS 64 HA CYS 64 12.135 -24.516 -14.033 376 HB2 CYS 64 HB2 CYS 64 10.703 -25.705 -12.380 377 HB3 CYS 64 HB3 CYS 64 9.437 -25.836 -13.584 378 HG CYS 64 HG CYS 64 10.393 -27.513 -15.053 379 H ASN 65 H ASN 65 8.692 -24.123 -15.146 380 HA ASN 65 HA ASN 65 9.665 -24.584 -17.848 381 HB2 ASN 65 HB2 ASN 65 6.935 -24.857 -16.523 382 HB3 ASN 65 HB3 ASN 65 7.055 -24.725 -18.266 383 HD21 ASN 65 HD21 ASN 65 6.824 -26.625 -19.151 384 HD22 ASN 65 HD22 ASN 65 7.556 -28.114 -18.654 385 H LEU 66 H LEU 66 7.944 -23.279 -19.465 386 HA LEU 66 HA LEU 66 8.347 -20.509 -18.761 387 HB2 LEU 66 HB2 LEU 66 7.695 -20.069 -21.055 388 HB3 LEU 66 HB3 LEU 66 8.978 -21.259 -20.957 389 HG LEU 66 HG LEU 66 6.890 -22.942 -21.074 390 HD11 LEU 66 HD11 LEU 66 5.932 -20.402 -22.403 391 HD12 LEU 66 HD12 LEU 66 5.299 -22.014 -22.815 392 HD13 LEU 66 HD13 LEU 66 5.116 -21.382 -21.161 393 HD21 LEU 66 HD21 LEU 66 8.134 -21.596 -23.488 394 HD22 LEU 66 HD22 LEU 66 8.852 -22.927 -22.550 395 HD23 LEU 66 HD23 LEU 66 7.341 -23.190 -23.454 396 H PHE 67 H PHE 67 6.170 -22.657 -17.714 397 HA PHE 67 HA PHE 67 3.673 -22.021 -18.337 398 HB2 PHE 67 HB2 PHE 67 5.136 -22.379 -15.677 399 HB3 PHE 67 HB3 PHE 67 3.403 -22.115 -15.661 400 HD1 PHE 67 HD1 PHE 67 2.548 -23.668 -18.026 401 HD2 PHE 67 HD2 PHE 67 5.399 -24.594 -15.023 402 HE1 PHE 67 HE1 PHE 67 2.170 -26.118 -18.422 403 HE2 PHE 67 HE2 PHE 67 5.021 -27.043 -15.419 404 HZ PHE 67 HZ PHE 67 3.411 -27.776 -17.114 405 H ASN 68 H ASN 68 5.908 -19.954 -16.413 406 HA ASN 68 HA ASN 68 4.081 -18.136 -15.521 407 HB2 ASN 68 HB2 ASN 68 6.040 -16.536 -15.456 408 HB3 ASN 68 HB3 ASN 68 6.423 -18.106 -14.777 409 HD21 ASN 68 HD21 ASN 68 7.523 -15.728 -16.709 410 HD22 ASN 68 HD22 ASN 68 8.627 -16.586 -17.732 411 H THR 69 H THR 69 2.746 -16.720 -16.657 412 HA THR 69 HA THR 69 3.261 -16.320 -19.487 413 HB THR 69 HB THR 69 0.940 -15.130 -17.951 414 HG1 THR 69 HG1 THR 69 0.124 -17.500 -18.389 415 HG21 THR 69 HG21 THR 69 1.157 -15.024 -20.508 416 HG22 THR 69 HG22 THR 69 1.052 -16.801 -20.511 417 HG23 THR 69 HG23 THR 69 -0.318 -15.830 -19.920 418 H LEU 70 H LEU 70 4.385 -14.670 -20.288 419 HA LEU 70 HA LEU 70 5.224 -12.574 -18.556 420 HB2 LEU 70 HB2 LEU 70 6.851 -13.086 -20.047 421 HB3 LEU 70 HB3 LEU 70 5.727 -13.455 -21.341 422 HG LEU 70 HG LEU 70 5.326 -11.023 -21.661 423 HD11 LEU 70 HD11 LEU 70 5.849 -9.606 -20.034 424 HD12 LEU 70 HD12 LEU 70 6.788 -10.850 -19.175 425 HD13 LEU 70 HD13 LEU 70 7.565 -9.860 -20.434 426 HD21 LEU 70 HD21 LEU 70 7.171 -12.468 -22.801 427 HD22 LEU 70 HD22 LEU 70 7.175 -10.700 -23.006 428 HD23 LEU 70 HD23 LEU 70 8.290 -11.464 -21.847 429 H THR 71 H THR 71 2.458 -13.168 -20.584 430 HA THR 71 HA THR 71 1.803 -10.633 -21.451 431 HB THR 71 HB THR 71 0.087 -12.981 -20.490 432 HG1 THR 71 HG1 THR 71 1.810 -12.770 -22.429 433 HG21 THR 71 HG21 THR 71 -1.777 -12.013 -21.562 434 HG22 THR 71 HG22 THR 71 -1.030 -10.571 -20.832 435 HG23 THR 71 HG23 THR 71 -0.767 -10.935 -22.555 436 H GLU 72 H GLU 72 1.666 -12.009 -18.180 437 HA GLU 72 HA GLU 72 -0.079 -10.157 -17.107 438 HB2 GLU 72 HB2 GLU 72 1.046 -12.370 -16.143 439 HB3 GLU 72 HB3 GLU 72 2.228 -11.251 -15.494 440 HG2 GLU 72 HG2 GLU 72 0.650 -11.348 -13.753 441 HG3 GLU 72 HG3 GLU 72 0.150 -9.904 -14.611 442 HE2 GLU 72 HE2 GLU 72 -2.606 -11.659 -16.109 443 H ALA 73 H ALA 73 3.544 -10.158 -17.308 444 HA ALA 73 HA ALA 73 3.860 -7.683 -16.022 445 HB1 ALA 73 HB1 ALA 73 5.661 -9.319 -16.223 446 HB2 ALA 73 HB2 ALA 73 5.615 -9.196 -17.998 447 HB3 ALA 73 HB3 ALA 73 6.145 -7.805 -17.023 448 H ARG 74 H ARG 74 3.777 -8.622 -19.529 449 HA ARG 74 HA ARG 74 4.128 -6.070 -20.479 450 HB2 ARG 74 HB2 ARG 74 2.876 -8.597 -21.589 451 HB3 ARG 74 HB3 ARG 74 2.744 -7.117 -22.517 452 HG2 ARG 74 HG2 ARG 74 5.290 -6.865 -22.284 453 HG3 ARG 74 HG3 ARG 74 5.316 -8.477 -21.598 454 HD2 ARG 74 HD2 ARG 74 4.487 -7.660 -24.411 455 HD3 ARG 74 HD3 ARG 74 5.769 -8.760 -23.944 456 HE ARG 74 HE ARG 74 3.583 -10.020 -22.895 457 HH11 ARG 74 HH22 ARG 74 4.173 -8.631 -26.074 458 HH12 ARG 74 HH21 ARG 74 3.117 -9.734 -26.893 459 HH21 ARG 74 HH12 ARG 74 2.190 -11.476 -23.975 460 HH22 ARG 74 HH11 ARG 74 1.982 -11.363 -25.691 461 H ASP 75 H ASP 75 1.289 -7.733 -19.160 462 HA ASP 75 HA ASP 75 -0.594 -5.969 -20.295 463 HB2 ASP 75 HB2 ASP 75 -1.242 -8.222 -19.570 464 HB3 ASP 75 HB3 ASP 75 -0.708 -7.897 -17.933 465 HD2 ASP 75 HD2 ASP 75 -2.448 -7.817 -16.755 466 H ALA 76 H ALA 76 1.379 -6.176 -17.319 467 HA ALA 76 HA ALA 76 -0.050 -4.284 -15.801 468 HB1 ALA 76 HB1 ALA 76 2.700 -5.523 -15.743 469 HB2 ALA 76 HB2 ALA 76 2.319 -4.165 -14.658 470 HB3 ALA 76 HB3 ALA 76 1.370 -5.668 -14.569 471 H ILE 77 H ILE 77 2.902 -4.048 -17.901 472 HA ILE 77 HA ILE 77 3.087 -1.238 -17.546 473 HB ILE 77 HB ILE 77 4.794 -1.379 -19.282 474 HG12 ILE 77 HG12 ILE 77 3.634 -4.118 -19.694 475 HG13 ILE 77 HG13 ILE 77 4.060 -2.899 -20.879 476 HG21 ILE 77 HG21 ILE 77 4.958 -3.563 -17.188 477 HG22 ILE 77 HG22 ILE 77 6.335 -2.899 -18.099 478 HG23 ILE 77 HG23 ILE 77 5.416 -1.855 -16.988 479 HD11 ILE 77 HD11 ILE 77 6.017 -4.533 -19.200 480 HD12 ILE 77 HD12 ILE 77 5.713 -4.709 -20.945 481 HD13 ILE 77 HD13 ILE 77 6.489 -3.234 -20.321 482 H LYS 78 H LYS 78 1.634 -3.436 -19.993 483 HA LYS 78 HA LYS 78 1.050 -1.519 -21.904 484 HB2 LYS 78 HB2 LYS 78 0.898 -3.837 -22.439 485 HB3 LYS 78 HB3 LYS 78 -0.265 -4.140 -21.164 486 HG2 LYS 78 HG2 LYS 78 -1.927 -2.676 -22.318 487 HG3 LYS 78 HG3 LYS 78 -0.763 -2.341 -23.584 488 HD2 LYS 78 HD2 LYS 78 -0.858 -4.543 -24.448 489 HD3 LYS 78 HD3 LYS 78 -1.445 -5.220 -22.942 490 HE2 LYS 78 HE2 LYS 78 -3.659 -4.390 -23.284 491 HE3 LYS 78 HE3 LYS 78 -3.136 -3.213 -24.472 492 HZ1 LYS 78 HZ1 LYS 78 -2.425 -5.268 -25.781 493 HZ2 LYS 78 HZ2 LYS 78 -3.424 -6.097 -24.790 494 HZ3 LYS 78 HZ3 LYS 78 -4.014 -4.897 -25.727 495 H ASP 79 H ASP 79 -0.882 -2.655 -19.058 496 HA ASP 79 HA ASP 79 -3.022 -0.961 -19.609 497 HB2 ASP 79 HB2 ASP 79 -2.037 -2.311 -17.061 498 HB3 ASP 79 HB3 ASP 79 -3.509 -1.361 -17.092 499 HD2 ASP 79 HD2 ASP 79 -3.654 -4.008 -16.454 500 H ALA 80 H ALA 80 0.063 -0.663 -17.820 501 HA ALA 80 HA ALA 80 -0.531 1.615 -16.323 502 HB1 ALA 80 HB1 ALA 80 2.134 0.718 -17.492 503 HB2 ALA 80 HB2 ALA 80 1.895 1.793 -16.093 504 HB3 ALA 80 HB3 ALA 80 1.411 0.082 -15.994 505 H TYR 81 H TYR 81 0.842 1.184 -19.643 506 HA TYR 81 HA TYR 81 1.169 3.963 -20.078 507 HB2 TYR 81 HB2 TYR 81 1.257 1.313 -21.504 508 HB3 TYR 81 HB3 TYR 81 0.893 2.668 -22.555 509 HD1 TYR 81 HD2 TYR 81 2.545 4.523 -22.825 510 HD2 TYR 81 HD1 TYR 81 3.463 0.989 -20.595 511 HE1 TYR 81 HE2 TYR 81 5.024 5.070 -22.965 512 HE2 TYR 81 HE1 TYR 81 5.939 1.548 -20.742 513 HH TYR 81 HH TYR 81 7.096 4.071 -22.808 514 H GLU 82 H GLU 82 -1.442 1.580 -20.756 515 HA GLU 82 HA GLU 82 -2.912 3.309 -22.381 516 HB2 GLU 82 HB2 GLU 82 -3.364 0.705 -20.988 517 HB3 GLU 82 HB3 GLU 82 -4.811 1.609 -21.385 518 HG2 GLU 82 HG2 GLU 82 -4.050 1.784 -23.764 519 HG3 GLU 82 HG3 GLU 82 -2.601 0.880 -23.367 520 HE2 GLU 82 HE2 GLU 82 -5.895 -1.289 -22.730 521 H SER 83 H SER 83 -2.605 2.898 -18.871 522 HA SER 83 HA SER 83 -4.981 4.374 -18.336 523 HB2 SER 83 HB2 SER 83 -2.764 3.156 -16.687 524 HB3 SER 83 HB3 SER 83 -3.805 4.351 -15.939 525 HG SER 83 HG SER 83 -4.488 2.030 -15.757 526 H TYR 84 H TYR 84 -1.400 4.909 -18.158 527 HA TYR 84 HA TYR 84 -1.861 7.720 -17.551 528 HB2 TYR 84 HB2 TYR 84 0.628 5.937 -17.926 529 HB3 TYR 84 HB3 TYR 84 0.689 7.590 -17.347 530 HD1 TYR 84 HD1 TYR 84 -1.221 7.899 -15.300 531 HD2 TYR 84 HD2 TYR 84 1.020 4.383 -16.260 532 HE1 TYR 84 HE1 TYR 84 -1.490 7.067 -12.913 533 HE2 TYR 84 HE2 TYR 84 0.743 3.563 -13.870 534 HH TYR 84 HH TYR 84 0.106 5.324 -11.425 535 H CYS 85 H CYS 85 -2.360 6.214 -20.272 536 HA CYS 85 HA CYS 85 -0.426 7.213 -22.042 537 HB2 CYS 85 HB2 CYS 85 -1.518 5.588 -23.157 538 HB3 CYS 85 HB3 CYS 85 -2.988 5.784 -22.224 539 HG CYS 85 HG CYS 85 -3.983 6.414 -24.352 540 H GLY 86 H GLY 86 -0.247 9.241 -22.997 541 HA2 GLY 86 HA2 GLY 86 -1.293 11.172 -23.928 542 HA3 GLY 86 HA3 GLY 86 -2.524 11.094 -22.684 543 H ILE 87 H ILE 87 -0.577 10.433 -20.497 544 HA ILE 87 HA ILE 87 0.395 13.158 -20.127 545 HB ILE 87 HB ILE 87 0.659 12.364 -17.745 546 HG12 ILE 87 HG12 ILE 87 -1.052 10.039 -18.665 547 HG13 ILE 87 HG13 ILE 87 0.670 9.916 -18.361 548 HG21 ILE 87 HG21 ILE 87 -2.215 12.062 -18.441 549 HG22 ILE 87 HG22 ILE 87 -1.417 13.131 -17.262 550 HG23 ILE 87 HG23 ILE 87 -1.397 13.544 -18.993 551 HD11 ILE 87 HD11 ILE 87 -0.848 11.237 -16.173 552 HD12 ILE 87 HD12 ILE 87 -1.279 9.532 -16.452 553 HD13 ILE 87 HD13 ILE 87 0.406 9.977 -16.088 554 H ASP 88 H ASP 88 2.365 13.386 -21.111 555 HA ASP 88 HA ASP 88 4.286 11.269 -20.559 556 HB2 ASP 88 HB2 ASP 88 5.565 12.242 -22.490 557 HB3 ASP 88 HB3 ASP 88 3.977 11.656 -22.945 558 HD2 ASP 88 HD2 ASP 88 3.920 14.698 -24.633 559 H ASP 89 H ASP 89 3.346 14.607 -20.039 560 HA ASP 89 HA ASP 89 5.589 14.967 -18.320 561 HB2 ASP 89 HB2 ASP 89 6.306 15.744 -20.682 562 HB3 ASP 89 HB3 ASP 89 5.113 17.018 -20.525 563 HD2 ASP 89 HD2 ASP 89 5.383 18.427 -18.917 564 H CYS 90 H CYS 90 5.166 16.777 -16.807 565 HA CYS 90 HA CYS 90 2.366 17.320 -16.565 566 HB2 CYS 90 HB2 CYS 90 4.445 18.564 -14.786 567 HB3 CYS 90 HB3 CYS 90 2.823 18.028 -14.397 568 HA PRO 91 HA PRO 91 2.623 21.209 -18.526 569 HB2 PRO 91 HB2 PRO 91 0.276 22.329 -17.686 570 HB3 PRO 91 HB3 PRO 91 0.373 21.191 -19.014 571 HG2 PRO 91 HG2 PRO 91 -0.607 20.747 -16.261 572 HG3 PRO 91 HG3 PRO 91 -0.887 19.780 -17.696 573 HD2 PRO 91 HD2 PRO 91 0.925 19.186 -15.554 574 HD3 PRO 91 HD3 PRO 91 0.729 18.281 -17.042 575 H GLN 92 H GLN 92 2.145 21.035 -15.099 576 HA GLN 92 HA GLN 92 2.789 23.782 -14.761 577 HB2 GLN 92 HB2 GLN 92 2.700 21.542 -12.692 578 HB3 GLN 92 HB3 GLN 92 2.700 23.260 -12.349 579 HG2 GLN 92 HG2 GLN 92 0.544 21.817 -13.964 580 HG3 GLN 92 HG3 GLN 92 0.401 22.235 -12.268 581 HE21 GLN 92 HE21 GLN 92 -0.172 23.196 -15.401 582 HE22 GLN 92 HE22 GLN 92 -0.488 24.883 -15.167 583 H CYS 93 H CYS 93 4.453 20.609 -14.200 584 HA CYS 93 HA CYS 93 6.792 21.630 -13.163 585 HB2 CYS 93 HB2 CYS 93 6.373 19.135 -14.840 586 HB3 CYS 93 HB3 CYS 93 7.825 19.491 -13.927 587 H SER 94 H SER 94 5.534 21.397 -16.496 588 HA SER 94 HA SER 94 8.067 22.099 -17.619 589 HB2 SER 94 HB2 SER 94 6.940 20.771 -19.136 590 HB3 SER 94 HB3 SER 94 5.361 21.338 -18.633 591 HG SER 94 HG SER 94 6.358 22.019 -20.844 592 H LYS 95 H LYS 95 4.943 23.630 -16.767 593 HA LYS 95 HA LYS 95 5.468 26.061 -18.121 594 HB2 LYS 95 HB2 LYS 95 3.211 25.607 -17.750 595 HB3 LYS 95 HB3 LYS 95 3.465 25.117 -16.087 596 HG2 LYS 95 HG2 LYS 95 2.404 27.363 -16.216 597 HG3 LYS 95 HG3 LYS 95 3.966 27.441 -15.426 598 HD2 LYS 95 HD2 LYS 95 4.138 29.235 -16.919 599 HD3 LYS 95 HD3 LYS 95 4.887 27.955 -17.854 600 HE2 LYS 95 HE2 LYS 95 2.838 27.573 -19.124 601 HE3 LYS 95 HE3 LYS 95 1.917 28.623 -18.066 602 HZ1 LYS 95 HZ1 LYS 95 3.232 30.468 -18.809 603 HZ2 LYS 95 HZ2 LYS 95 4.162 29.506 -19.744 604 HZ3 LYS 95 HZ3 LYS 95 2.583 29.715 -20.105 605 H TYR 96 H TYR 96 6.761 24.585 -15.293 606 HA TYR 96 HA TYR 96 7.250 27.013 -13.855 607 HB2 TYR 96 HB2 TYR 96 7.080 24.905 -12.642 608 HB3 TYR 96 HB3 TYR 96 8.079 24.066 -13.812 609 HD1 TYR 96 HD2 TYR 96 8.300 26.845 -11.302 610 HD2 TYR 96 HD1 TYR 96 10.308 23.633 -13.291 611 HE1 TYR 96 HE2 TYR 96 10.338 27.194 -9.823 612 HE2 TYR 96 HE1 TYR 96 12.340 23.993 -11.805 613 HH TYR 96 HH TYR 96 12.844 26.729 -10.075 614 H ILE 97 H ILE 97 8.620 28.532 -14.669 615 HA ILE 97 HA ILE 97 10.727 27.792 -16.442 616 HB ILE 97 HB ILE 97 9.333 29.910 -16.463 617 HG12 ILE 97 HG12 ILE 97 11.615 29.368 -17.639 618 HG13 ILE 97 HG13 ILE 97 10.944 30.986 -17.687 619 HG21 ILE 97 HG21 ILE 97 11.138 30.519 -14.121 620 HG22 ILE 97 HG22 ILE 97 10.402 31.795 -15.120 621 HG23 ILE 97 HG23 ILE 97 9.366 30.652 -14.233 622 HD11 ILE 97 HD11 ILE 97 12.758 30.273 -15.385 623 HD12 ILE 97 HD12 ILE 97 13.483 30.583 -16.981 624 HD13 ILE 97 HD13 ILE 97 12.512 31.844 -16.184 625 H ASP 98 H ASP 98 12.945 27.672 -16.058 626 HA ASP 98 HA ASP 98 13.580 27.340 -13.262 627 HB2 ASP 98 HB2 ASP 98 14.177 25.671 -15.168 628 HB3 ASP 98 HB3 ASP 98 15.397 26.831 -15.654 629 HD2 ASP 98 HD2 ASP 98 16.052 24.036 -13.332 630 H ASP 99 H ASP 99 14.123 29.360 -12.355 631 HA ASP 99 HA ASP 99 14.978 31.548 -13.634 632 HB2 ASP 99 HB2 ASP 99 16.310 31.922 -11.330 633 HB3 ASP 99 HB3 ASP 99 14.560 31.980 -11.401 634 HD2 ASP 99 HD2 ASP 99 15.902 28.455 -10.105 Start of MODEL 9 1 H GLU 14 H GLU 14 -2.260 -4.449 -4.641 2 HA GLU 14 HA GLU 14 -0.812 -4.554 -6.816 3 HB2 GLU 14 HB2 GLU 14 -2.387 -2.139 -5.827 4 HB3 GLU 14 HB3 GLU 14 -1.827 -2.309 -7.479 5 HG2 GLU 14 HG2 GLU 14 -3.133 -4.375 -7.768 6 HG3 GLU 14 HG3 GLU 14 -3.584 -4.376 -6.075 7 HE2 GLU 14 HE2 GLU 14 -5.801 -4.116 -6.591 8 H ASP 15 H ASP 15 0.458 -3.363 -3.978 9 HA ASP 15 HA ASP 15 1.938 -1.191 -5.012 10 HB2 ASP 15 HB2 ASP 15 2.539 -2.878 -2.541 11 HB3 ASP 15 HB3 ASP 15 3.094 -1.244 -2.847 12 HD2 ASP 15 HD2 ASP 15 -0.725 -2.035 -2.156 13 H GLN 16 H GLN 16 2.190 -4.689 -4.972 14 HA GLN 16 HA GLN 16 5.002 -4.828 -5.104 15 HB2 GLN 16 HB2 GLN 16 3.523 -6.696 -4.325 16 HB3 GLN 16 HB3 GLN 16 2.905 -6.875 -5.955 17 HG2 GLN 16 HG2 GLN 16 4.974 -7.673 -6.799 18 HG3 GLN 16 HG3 GLN 16 5.897 -6.976 -5.483 19 HE21 GLN 16 HE21 GLN 16 6.767 -9.218 -5.576 20 HE22 GLN 16 HE22 GLN 16 6.027 -10.432 -4.587 21 H GLU 17 H GLU 17 2.343 -4.467 -7.447 22 HA GLU 17 HA GLU 17 3.894 -5.145 -9.689 23 HB2 GLU 17 HB2 GLU 17 1.325 -3.518 -9.450 24 HB3 GLU 17 HB3 GLU 17 1.999 -4.082 -10.966 25 HG2 GLU 17 HG2 GLU 17 1.174 -5.889 -8.644 26 HG3 GLU 17 HG3 GLU 17 0.210 -5.602 -10.079 27 HE2 GLU 17 HE2 GLU 17 1.153 -7.953 -9.231 28 H GLN 18 H GLN 18 2.870 -2.003 -8.194 29 HA GLN 18 HA GLN 18 4.114 -0.405 -10.077 30 HB2 GLN 18 HB2 GLN 18 3.515 1.371 -8.697 31 HB3 GLN 18 HB3 GLN 18 2.415 0.134 -8.122 32 HG2 GLN 18 HG2 GLN 18 4.036 -0.443 -6.293 33 HG3 GLN 18 HG3 GLN 18 5.113 0.818 -6.860 34 HE21 GLN 18 HE21 GLN 18 4.176 0.795 -4.297 35 HE22 GLN 18 HE22 GLN 18 3.087 2.113 -4.021 36 H TRP 19 H TRP 19 5.340 -2.144 -7.228 37 HA TRP 19 HA TRP 19 7.752 -0.706 -6.973 38 HB2 TRP 19 HB2 TRP 19 7.005 -1.947 -5.119 39 HB3 TRP 19 HB3 TRP 19 6.808 -3.414 -6.058 40 HD1 TRP 19 HD1 TRP 19 9.471 -1.442 -4.162 41 HE1 TRP 19 HE1 TRP 19 11.736 -2.784 -3.975 42 HE3 TRP 19 HE3 TRP 19 8.159 -5.138 -7.400 43 HZ2 TRP 19 HZ2 TRP 19 12.703 -5.186 -5.176 44 HZ3 TRP 19 HZ3 TRP 19 9.822 -6.943 -7.837 45 HH2 TRP 19 HH2 TRP 19 12.027 -7.006 -6.785 46 H ALA 20 H ALA 20 6.573 -3.384 -9.018 47 HA ALA 20 HA ALA 20 9.082 -4.295 -9.885 48 HB1 ALA 20 HB1 ALA 20 7.122 -4.644 -11.929 49 HB2 ALA 20 HB2 ALA 20 7.684 -5.834 -10.731 50 HB3 ALA 20 HB3 ALA 20 6.287 -4.795 -10.365 51 H MET 21 H MET 21 6.802 -1.773 -11.102 52 HA MET 21 HA MET 21 8.041 -1.219 -13.456 53 HB2 MET 21 HB2 MET 21 6.628 0.580 -11.420 54 HB3 MET 21 HB3 MET 21 7.097 1.169 -13.002 55 HG2 MET 21 HG2 MET 21 5.595 -0.295 -14.138 56 HG3 MET 21 HG3 MET 21 5.456 -1.375 -12.765 57 HE1 MET 21 HE1 MET 21 4.952 2.524 -13.572 58 HE2 MET 21 HE2 MET 21 4.075 1.456 -14.695 59 HE3 MET 21 HE3 MET 21 3.172 2.484 -13.556 60 H GLN 22 H GLN 22 9.244 -0.745 -10.228 61 HA GLN 22 HA GLN 22 10.693 1.457 -10.241 62 HB2 GLN 22 HB2 GLN 22 10.695 -0.232 -8.426 63 HB3 GLN 22 HB3 GLN 22 11.691 -1.299 -9.396 64 HG2 GLN 22 HG2 GLN 22 13.530 0.353 -9.404 65 HG3 GLN 22 HG3 GLN 22 12.531 1.515 -8.555 66 HE21 GLN 22 HE21 GLN 22 13.475 -1.912 -8.274 67 HE22 GLN 22 HE22 GLN 22 13.826 -1.904 -6.578 68 H THR 23 H THR 23 12.402 -1.602 -11.182 69 HA THR 23 HA THR 23 14.285 -0.114 -12.737 70 HB THR 23 HB THR 23 13.768 -3.006 -11.979 71 HG1 THR 23 HG1 THR 23 16.195 -1.401 -12.002 72 HG21 THR 23 HG21 THR 23 15.766 -1.967 -14.055 73 HG22 THR 23 HG22 THR 23 15.917 -3.539 -13.235 74 HG23 THR 23 HG23 THR 23 14.531 -3.224 -14.307 75 H LEU 24 H LEU 24 11.710 -2.537 -13.544 76 HA LEU 24 HA LEU 24 11.961 -2.701 -16.189 77 HB2 LEU 24 HB2 LEU 24 10.264 -3.885 -15.044 78 HB3 LEU 24 HB3 LEU 24 9.477 -2.413 -14.512 79 HG LEU 24 HG LEU 24 9.667 -3.237 -17.419 80 HD11 LEU 24 HD11 LEU 24 8.341 -4.735 -15.643 81 HD12 LEU 24 HD12 LEU 24 7.096 -3.499 -15.948 82 HD13 LEU 24 HD13 LEU 24 7.756 -4.451 -17.300 83 HD21 LEU 24 HD21 LEU 24 9.164 -1.023 -17.553 84 HD22 LEU 24 HD22 LEU 24 7.520 -1.665 -17.326 85 HD23 LEU 24 HD23 LEU 24 8.404 -0.977 -15.944 86 H MET 25 H MET 25 9.957 -0.091 -14.634 87 HA MET 25 HA MET 25 9.866 1.335 -17.067 88 HB2 MET 25 HB2 MET 25 8.199 2.444 -15.929 89 HB3 MET 25 HB3 MET 25 8.477 1.313 -14.620 90 HG2 MET 25 HG2 MET 25 10.274 2.893 -13.731 91 HG3 MET 25 HG3 MET 25 9.800 4.046 -14.962 92 HE1 MET 25 HE1 MET 25 6.302 5.081 -14.171 93 HE2 MET 25 HE2 MET 25 7.436 4.577 -15.447 94 HE3 MET 25 HE3 MET 25 6.274 3.407 -14.776 95 H GLY 26 H GLY 26 11.991 1.293 -14.232 96 HA2 GLY 26 HA2 GLY 26 13.123 3.865 -14.526 97 HA3 GLY 26 HA3 GLY 26 13.807 2.497 -13.671 98 H SER 27 H SER 27 13.226 1.130 -16.590 99 HA SER 27 HA SER 27 15.898 1.136 -17.318 100 HB2 SER 27 HB2 SER 27 14.730 -0.740 -18.066 101 HB3 SER 27 HB3 SER 27 13.325 0.188 -18.551 102 HG SER 27 HG SER 27 15.780 0.637 -19.945 103 H GLY 28 H GLY 28 13.552 3.572 -17.632 104 HA2 GLY 28 HA2 GLY 28 14.089 5.682 -18.492 105 HA3 GLY 28 HA3 GLY 28 15.184 4.949 -19.647 106 H VAL 29 H VAL 29 12.351 3.054 -19.445 107 HA VAL 29 HA VAL 29 11.551 3.856 -22.056 108 HB VAL 29 HB VAL 29 10.207 2.007 -20.075 109 HG11 VAL 29 HG11 VAL 29 10.041 2.044 -23.106 110 HG12 VAL 29 HG12 VAL 29 9.127 1.008 -21.984 111 HG13 VAL 29 HG13 VAL 29 8.825 2.761 -22.023 112 HG21 VAL 29 HG21 VAL 29 11.519 0.430 -21.935 113 HG22 VAL 29 HG22 VAL 29 12.688 1.733 -21.613 114 HG23 VAL 29 HG23 VAL 29 12.056 0.752 -20.269 115 H LEU 30 H LEU 30 10.212 4.186 -18.713 116 HA LEU 30 HA LEU 30 8.222 6.029 -19.825 117 HB2 LEU 30 HB2 LEU 30 8.294 4.461 -17.246 118 HB3 LEU 30 HB3 LEU 30 7.096 5.687 -17.612 119 HG LEU 30 HG LEU 30 7.540 3.214 -19.305 120 HD11 LEU 30 HD11 LEU 30 6.605 2.063 -17.640 121 HD12 LEU 30 HD12 LEU 30 6.151 3.540 -16.756 122 HD13 LEU 30 HD13 LEU 30 5.096 2.915 -18.046 123 HD21 LEU 30 HD21 LEU 30 5.402 5.354 -19.291 124 HD22 LEU 30 HD22 LEU 30 6.517 4.916 -20.608 125 HD23 LEU 30 HD23 LEU 30 5.227 3.790 -20.124 126 H ALA 31 H ALA 31 7.623 7.745 -17.911 127 HA ALA 31 HA ALA 31 10.202 8.864 -17.049 128 HB1 ALA 31 HB1 ALA 31 9.777 10.613 -18.393 129 HB2 ALA 31 HB2 ALA 31 8.201 9.926 -18.854 130 HB3 ALA 31 HB3 ALA 31 8.333 10.963 -17.414 131 H ARG 32 H ARG 32 10.341 9.378 -14.902 132 HA ARG 32 HA ARG 32 7.809 9.399 -13.467 133 HB2 ARG 32 HB2 ARG 32 9.319 8.488 -11.497 134 HB3 ARG 32 HB3 ARG 32 8.743 7.369 -12.716 135 HG2 ARG 32 HG2 ARG 32 10.868 7.412 -13.892 136 HG3 ARG 32 HG3 ARG 32 11.437 8.777 -12.951 137 HD2 ARG 32 HD2 ARG 32 11.368 7.356 -10.875 138 HD3 ARG 32 HD3 ARG 32 10.840 5.991 -11.839 139 HE ARG 32 HE ARG 32 13.317 7.239 -12.809 140 HH11 ARG 32 HH22 ARG 32 11.933 4.804 -10.679 141 HH12 ARG 32 HH21 ARG 32 13.382 3.857 -10.611 142 HH21 ARG 32 HH12 ARG 32 15.228 5.990 -12.720 143 HH22 ARG 32 HH11 ARG 32 15.268 4.536 -11.780 144 H CYS 33 H CYS 33 7.515 11.170 -12.095 145 HA CYS 33 HA CYS 33 9.650 13.118 -12.097 146 HB2 CYS 33 HB2 CYS 33 7.126 13.569 -12.576 147 HB3 CYS 33 HB3 CYS 33 6.942 13.526 -10.834 148 H ARG 34 H ARG 34 10.832 13.681 -10.245 149 HA ARG 34 HA ARG 34 11.028 11.834 -8.237 150 HB2 ARG 34 HB2 ARG 34 12.576 13.365 -7.207 151 HB3 ARG 34 HB3 ARG 34 12.709 13.656 -8.930 152 HG2 ARG 34 HG2 ARG 34 11.059 15.565 -8.687 153 HG3 ARG 34 HG3 ARG 34 11.066 15.307 -6.953 154 HD2 ARG 34 HD2 ARG 34 12.671 17.036 -7.278 155 HD3 ARG 34 HD3 ARG 34 13.647 15.594 -7.076 156 HE ARG 34 HE ARG 34 13.203 15.724 -9.824 157 HH11 ARG 34 HH22 ARG 34 14.560 17.906 -7.420 158 HH12 ARG 34 HH21 ARG 34 15.626 18.685 -8.542 159 HH21 ARG 34 HH12 ARG 34 14.608 16.751 -11.305 160 HH22 ARG 34 HH11 ARG 34 15.653 18.023 -10.767 161 H ILE 35 H ILE 35 8.834 14.561 -8.670 162 HA ILE 35 HA ILE 35 8.095 14.596 -5.868 163 HB ILE 35 HB ILE 35 8.259 16.712 -6.896 164 HG12 ILE 35 HG12 ILE 35 5.368 15.878 -6.552 165 HG13 ILE 35 HG13 ILE 35 6.434 16.554 -5.337 166 HG21 ILE 35 HG21 ILE 35 8.078 16.858 -9.108 167 HG22 ILE 35 HG22 ILE 35 7.138 15.350 -9.206 168 HG23 ILE 35 HG23 ILE 35 6.313 16.893 -8.880 169 HD11 ILE 35 HD11 ILE 35 4.778 17.946 -7.253 170 HD12 ILE 35 HD12 ILE 35 5.768 18.629 -5.940 171 HD13 ILE 35 HD13 ILE 35 6.482 18.368 -7.550 172 H HIS 36 H HIS 36 7.261 12.976 -8.829 173 HA HIS 36 HA HIS 36 4.823 12.016 -7.519 174 HB2 HIS 36 HB2 HIS 36 5.051 12.014 -10.502 175 HB3 HIS 36 HB3 HIS 36 3.622 12.069 -9.488 176 HD1 HIS 36 HD1 HIS 36 3.726 14.524 -7.899 177 HD2 HIS 36 HD2 HIS 36 5.370 14.403 -11.757 178 HE1 HIS 36 HE1 HIS 36 3.842 16.942 -8.703 179 H ASN 37 H ASN 37 5.416 10.056 -6.690 180 HA ASN 37 HA ASN 37 7.203 8.438 -8.275 181 HB2 ASN 37 HB2 ASN 37 6.070 8.121 -5.448 182 HB3 ASN 37 HB3 ASN 37 7.122 6.934 -6.193 183 HD21 ASN 37 HD21 ASN 37 6.860 10.366 -5.358 184 HD22 ASN 37 HD22 ASN 37 8.540 10.657 -5.054 185 H ASP 38 H ASP 38 3.832 8.788 -7.255 186 HA ASP 38 HA ASP 38 3.205 6.089 -8.039 187 HB2 ASP 38 HB2 ASP 38 2.186 7.570 -6.060 188 HB3 ASP 38 HB3 ASP 38 1.145 8.189 -7.327 189 HD2 ASP 38 HD2 ASP 38 1.784 4.926 -5.772 190 H VAL 39 H VAL 39 4.128 8.472 -9.859 191 HA VAL 39 HA VAL 39 1.826 8.374 -11.686 192 HB VAL 39 HB VAL 39 3.809 10.595 -11.164 193 HG11 VAL 39 HG11 VAL 39 3.563 10.933 -13.403 194 HG12 VAL 39 HG12 VAL 39 2.018 10.054 -13.482 195 HG13 VAL 39 HG13 VAL 39 2.061 11.724 -12.867 196 HG21 VAL 39 HG21 VAL 39 1.960 10.403 -9.532 197 HG22 VAL 39 HG22 VAL 39 1.856 11.893 -10.500 198 HG23 VAL 39 HG23 VAL 39 0.787 10.517 -10.866 199 H ILE 40 H ILE 40 2.222 7.704 -13.779 200 HA ILE 40 HA ILE 40 5.040 7.217 -14.441 201 HB ILE 40 HB ILE 40 4.325 5.090 -13.919 202 HG12 ILE 40 HG12 ILE 40 5.264 5.354 -16.255 203 HG13 ILE 40 HG13 ILE 40 4.375 3.877 -15.938 204 HG21 ILE 40 HG21 ILE 40 1.986 4.391 -15.136 205 HG22 ILE 40 HG22 ILE 40 2.139 4.926 -13.446 206 HG23 ILE 40 HG23 ILE 40 1.669 6.089 -14.708 207 HD11 ILE 40 HD11 ILE 40 3.805 5.983 -17.874 208 HD12 ILE 40 HD12 ILE 40 3.085 4.361 -17.735 209 HD13 ILE 40 HD13 ILE 40 2.408 5.719 -16.804 210 H LEU 41 H LEU 41 5.673 8.176 -16.301 211 HA LEU 41 HA LEU 41 3.521 9.113 -18.064 212 HB2 LEU 41 HB2 LEU 41 6.278 10.248 -18.139 213 HB3 LEU 41 HB3 LEU 41 4.744 10.994 -18.541 214 HG LEU 41 HG LEU 41 5.467 10.279 -15.696 215 HD11 LEU 41 HD11 LEU 41 5.805 13.033 -15.960 216 HD12 LEU 41 HD12 LEU 41 7.078 11.811 -15.722 217 HD13 LEU 41 HD13 LEU 41 6.648 12.339 -17.367 218 HD21 LEU 41 HD21 LEU 41 3.856 12.197 -15.259 219 HD22 LEU 41 HD22 LEU 41 3.412 12.083 -16.979 220 HD23 LEU 41 HD23 LEU 41 3.155 10.691 -15.899 221 H ASP 42 H ASP 42 3.657 8.735 -20.306 222 HA ASP 42 HA ASP 42 5.575 6.646 -20.946 223 HB2 ASP 42 HB2 ASP 42 3.288 5.930 -21.287 224 HB3 ASP 42 HB3 ASP 42 2.869 7.423 -22.104 225 HD2 ASP 42 HD2 ASP 42 3.266 4.424 -22.610 226 H SER 43 H SER 43 7.224 7.202 -22.386 227 HA SER 43 HA SER 43 6.971 9.770 -23.693 228 HB2 SER 43 HB2 SER 43 9.008 9.155 -22.296 229 HB3 SER 43 HB3 SER 43 9.411 7.951 -23.505 230 HG SER 43 HG SER 43 10.414 9.536 -24.528 231 H GLY 44 H GLY 44 7.259 6.267 -24.309 232 HA2 GLY 44 HA2 GLY 44 6.329 5.325 -26.262 233 HA3 GLY 44 HA3 GLY 44 6.709 6.785 -27.154 234 H ASN 45 H ASN 45 9.012 5.314 -24.854 235 HA ASN 45 HA ASN 45 10.896 5.095 -26.976 236 HB2 ASN 45 HB2 ASN 45 10.910 4.820 -23.977 237 HB3 ASN 45 HB3 ASN 45 12.169 3.958 -24.838 238 HD21 ASN 45 HD21 ASN 45 13.835 5.208 -24.154 239 HD22 ASN 45 HD22 ASN 45 14.092 6.853 -24.630 240 H ASP 46 H ASP 46 12.365 2.879 -26.734 241 HA ASP 46 HA ASP 46 10.929 0.866 -27.795 242 HB2 ASP 46 HB2 ASP 46 13.342 0.450 -25.975 243 HB3 ASP 46 HB3 ASP 46 12.845 -0.579 -27.303 244 HD2 ASP 46 HD2 ASP 46 13.180 2.883 -28.566 245 H ALA 47 H ALA 47 9.071 0.021 -26.788 246 HA ALA 47 HA ALA 47 8.952 -0.270 -23.946 247 HB1 ALA 47 HB1 ALA 47 7.083 0.246 -25.737 248 HB2 ALA 47 HB2 ALA 47 7.009 -1.526 -25.878 249 HB3 ALA 47 HB3 ALA 47 6.701 -0.745 -24.309 250 H SER 48 H SER 48 9.829 -2.255 -26.746 251 HA SER 48 HA SER 48 9.390 -4.743 -25.722 252 HB2 SER 48 HB2 SER 48 10.747 -5.525 -27.463 253 HB3 SER 48 HB3 SER 48 10.277 -3.945 -28.057 254 HG SER 48 HG SER 48 12.781 -4.696 -26.823 255 H SER 49 H SER 49 12.194 -2.509 -25.279 256 HA SER 49 HA SER 49 13.790 -4.307 -23.910 257 HB2 SER 49 HB2 SER 49 14.261 -1.901 -24.905 258 HB3 SER 49 HB3 SER 49 13.809 -1.340 -23.308 259 HG SER 49 HG SER 49 16.166 -2.484 -24.139 260 H ALA 50 H ALA 50 11.463 -1.777 -22.738 261 HA ALA 50 HA ALA 50 11.851 -2.144 -20.030 262 HB1 ALA 50 HB1 ALA 50 10.422 -0.415 -20.149 263 HB2 ALA 50 HB2 ALA 50 9.983 -0.840 -21.820 264 HB3 ALA 50 HB3 ALA 50 9.109 -1.576 -20.456 265 H TYR 51 H TYR 51 9.705 -3.886 -22.354 266 HA TYR 51 HA TYR 51 8.344 -5.432 -20.497 267 HB2 TYR 51 HB2 TYR 51 9.393 -6.060 -23.329 268 HB3 TYR 51 HB3 TYR 51 8.065 -6.907 -22.561 269 HD1 TYR 51 HD1 TYR 51 7.575 -3.701 -21.452 270 HD2 TYR 51 HD2 TYR 51 7.391 -5.949 -25.088 271 HE1 TYR 51 HE1 TYR 51 5.939 -2.013 -22.422 272 HE2 TYR 51 HE2 TYR 51 5.756 -4.254 -26.045 273 HH TYR 51 HH TYR 51 4.590 -1.556 -24.062 274 H LYS 52 H LYS 52 11.450 -6.075 -22.252 275 HA LYS 52 HA LYS 52 11.812 -8.646 -21.248 276 HB2 LYS 52 HB2 LYS 52 13.005 -7.308 -23.160 277 HB3 LYS 52 HB3 LYS 52 14.109 -6.815 -21.892 278 HG2 LYS 52 HG2 LYS 52 15.141 -8.779 -22.640 279 HG3 LYS 52 HG3 LYS 52 14.191 -9.392 -21.302 280 HD2 LYS 52 HD2 LYS 52 12.412 -10.136 -22.828 281 HD3 LYS 52 HD3 LYS 52 13.205 -9.372 -24.192 282 HE2 LYS 52 HE2 LYS 52 14.414 -11.640 -22.536 283 HE3 LYS 52 HE3 LYS 52 13.611 -11.856 -24.079 284 HZ1 LYS 52 HZ1 LYS 52 16.216 -10.839 -23.533 285 HZ2 LYS 52 HZ2 LYS 52 15.631 -11.525 -24.895 286 HZ3 LYS 52 HZ3 LYS 52 15.390 -9.934 -24.613 287 H LEU 53 H LEU 53 12.966 -5.431 -20.039 288 HA LEU 53 HA LEU 53 14.329 -6.482 -17.835 289 HB2 LEU 53 HB2 LEU 53 13.060 -3.755 -18.024 290 HB3 LEU 53 HB3 LEU 53 14.442 -4.236 -17.060 291 HG LEU 53 HG LEU 53 14.743 -4.640 -19.979 292 HD11 LEU 53 HD11 LEU 53 15.392 -1.909 -19.546 293 HD12 LEU 53 HD12 LEU 53 14.204 -2.607 -20.673 294 HD13 LEU 53 HD13 LEU 53 13.708 -2.153 -19.024 295 HD21 LEU 53 HD21 LEU 53 16.901 -4.626 -19.445 296 HD22 LEU 53 HD22 LEU 53 16.761 -3.059 -18.613 297 HD23 LEU 53 HD23 LEU 53 16.398 -4.567 -17.739 298 H GLY 54 H GLY 54 10.908 -5.718 -18.450 299 HA2 GLY 54 HA2 GLY 54 10.057 -5.731 -15.748 300 HA3 GLY 54 HA3 GLY 54 9.064 -5.943 -17.177 301 H THR 55 H THR 55 10.182 -8.260 -18.350 302 HA THR 55 HA THR 55 8.973 -10.267 -16.785 303 HB THR 55 HB THR 55 10.386 -11.630 -18.668 304 HG1 THR 55 HG1 THR 55 11.608 -9.886 -19.459 305 HG21 THR 55 HG21 THR 55 8.153 -9.680 -19.436 306 HG22 THR 55 HG22 THR 55 8.591 -11.185 -20.281 307 HG23 THR 55 HG23 THR 55 7.861 -11.254 -18.658 308 H TYR 56 H TYR 56 12.325 -9.099 -17.080 309 HA TYR 56 HA TYR 56 13.511 -11.327 -15.828 310 HB2 TYR 56 HB2 TYR 56 14.091 -8.395 -16.422 311 HB3 TYR 56 HB3 TYR 56 15.180 -9.221 -15.326 312 HD1 TYR 56 HD2 TYR 56 13.661 -11.240 -17.947 313 HD2 TYR 56 HD1 TYR 56 17.001 -8.749 -16.974 314 HE1 TYR 56 HE2 TYR 56 14.948 -12.178 -19.929 315 HE2 TYR 56 HE1 TYR 56 18.276 -9.695 -18.959 316 HH TYR 56 HH TYR 56 18.314 -11.552 -20.351 317 H LEU 57 H LEU 57 12.505 -8.065 -14.583 318 HA LEU 57 HA LEU 57 13.271 -8.616 -11.939 319 HB2 LEU 57 HB2 LEU 57 13.000 -6.374 -12.890 320 HB3 LEU 57 HB3 LEU 57 11.273 -6.632 -13.036 321 HG LEU 57 HG LEU 57 12.506 -6.939 -10.329 322 HD11 LEU 57 HD11 LEU 57 12.281 -4.497 -9.931 323 HD12 LEU 57 HD12 LEU 57 13.579 -4.917 -11.074 324 HD13 LEU 57 HD13 LEU 57 12.037 -4.268 -11.679 325 HD21 LEU 57 HD21 LEU 57 10.337 -5.881 -9.664 326 HD22 LEU 57 HD22 LEU 57 9.858 -5.912 -11.378 327 HD23 LEU 57 HD23 LEU 57 10.176 -7.436 -10.515 328 H TYR 58 H TYR 58 10.089 -8.811 -13.662 329 HA TYR 58 HA TYR 58 8.637 -9.663 -11.428 330 HB2 TYR 58 HB2 TYR 58 8.479 -9.875 -14.479 331 HB3 TYR 58 HB3 TYR 58 7.246 -10.654 -13.508 332 HD1 TYR 58 HD2 TYR 58 6.764 -8.724 -11.347 333 HD2 TYR 58 HD1 TYR 58 7.473 -8.044 -15.511 334 HE1 TYR 58 HE2 TYR 58 5.490 -6.528 -11.213 335 HE2 TYR 58 HE1 TYR 58 6.197 -5.850 -15.363 336 HH TYR 58 HH TYR 58 5.379 -4.338 -13.964 337 H GLN 59 H GLN 59 10.774 -11.366 -13.700 338 HA GLN 59 HA GLN 59 10.152 -13.800 -12.221 339 HB2 GLN 59 HB2 GLN 59 10.941 -13.762 -15.160 340 HB3 GLN 59 HB3 GLN 59 10.352 -15.126 -14.232 341 HG2 GLN 59 HG2 GLN 59 8.747 -12.608 -14.884 342 HG3 GLN 59 HG3 GLN 59 8.570 -14.158 -15.683 343 HE21 GLN 59 HE21 GLN 59 6.577 -12.678 -14.271 344 HE22 GLN 59 HE22 GLN 59 6.011 -13.640 -12.946 345 H LYS 60 H LYS 60 11.916 -13.871 -10.842 346 HA LYS 60 HA LYS 60 14.542 -13.369 -12.019 347 HB2 LYS 60 HB2 LYS 60 15.214 -13.463 -9.533 348 HB3 LYS 60 HB3 LYS 60 14.324 -12.067 -10.107 349 HG2 LYS 60 HG2 LYS 60 12.740 -14.410 -9.057 350 HG3 LYS 60 HG3 LYS 60 13.582 -13.406 -7.893 351 HD2 LYS 60 HD2 LYS 60 12.291 -11.509 -8.372 352 HD3 LYS 60 HD3 LYS 60 11.955 -12.015 -10.016 353 HE2 LYS 60 HE2 LYS 60 9.883 -12.326 -8.885 354 HE3 LYS 60 HE3 LYS 60 10.557 -13.941 -8.982 355 HZ1 LYS 60 HZ1 LYS 60 11.374 -13.686 -6.749 356 HZ2 LYS 60 HZ2 LYS 60 10.798 -12.160 -6.656 357 HZ3 LYS 60 HZ3 LYS 60 9.763 -13.418 -6.779 358 H ASP 61 H ASP 61 12.475 -15.864 -10.527 359 HA ASP 61 HA ASP 61 14.560 -17.719 -10.231 360 HB2 ASP 61 HB2 ASP 61 11.662 -18.500 -10.651 361 HB3 ASP 61 HB3 ASP 61 12.852 -19.256 -9.609 362 HD2 ASP 61 HD2 ASP 61 12.156 -17.152 -6.935 363 H ASN 62 H ASN 62 15.120 -19.498 -11.650 364 HA ASN 62 HA ASN 62 13.988 -19.218 -14.322 365 HB2 ASN 62 HB2 ASN 62 16.108 -19.875 -15.226 366 HB3 ASN 62 HB3 ASN 62 16.525 -18.787 -13.917 367 HD21 ASN 62 HD21 ASN 62 16.928 -21.839 -15.259 368 HD22 ASN 62 HD22 ASN 62 17.766 -22.634 -13.968 369 H SER 63 H SER 63 14.012 -21.085 -11.498 370 HA SER 63 HA SER 63 14.310 -23.660 -12.474 371 HB2 SER 63 HB2 SER 63 14.304 -22.917 -10.045 372 HB3 SER 63 HB3 SER 63 12.562 -22.759 -10.144 373 HG SER 63 HG SER 63 13.866 -24.944 -9.496 374 H CYS 64 H CYS 64 11.724 -21.305 -12.744 375 HA CYS 64 HA CYS 64 9.724 -21.350 -13.645 376 HB2 CYS 64 HB2 CYS 64 11.120 -22.300 -15.561 377 HB3 CYS 64 HB3 CYS 64 10.510 -23.880 -15.112 378 HG CYS 64 HG CYS 64 9.024 -21.209 -16.287 379 H ASN 65 H ASN 65 10.181 -22.678 -11.058 380 HA ASN 65 HA ASN 65 9.138 -25.127 -10.756 381 HB2 ASN 65 HB2 ASN 65 8.839 -22.614 -9.049 382 HB3 ASN 65 HB3 ASN 65 8.196 -24.151 -8.507 383 HD21 ASN 65 HD21 ASN 65 9.941 -26.002 -9.196 384 HD22 ASN 65 HD22 ASN 65 11.504 -25.756 -8.491 385 H LEU 66 H LEU 66 7.348 -21.952 -10.787 386 HA LEU 66 HA LEU 66 4.895 -23.471 -11.348 387 HB2 LEU 66 HB2 LEU 66 3.681 -22.092 -10.023 388 HB3 LEU 66 HB3 LEU 66 5.198 -22.118 -9.145 389 HG LEU 66 HG LEU 66 5.703 -19.955 -10.596 390 HD11 LEU 66 HD11 LEU 66 2.736 -19.593 -10.320 391 HD12 LEU 66 HD12 LEU 66 3.904 -18.711 -11.334 392 HD13 LEU 66 HD13 LEU 66 3.413 -20.365 -11.774 393 HD21 LEU 66 HD21 LEU 66 4.810 -20.479 -7.967 394 HD22 LEU 66 HD22 LEU 66 5.691 -19.055 -8.571 395 HD23 LEU 66 HD23 LEU 66 3.911 -19.055 -8.542 396 H PHE 67 H PHE 67 3.585 -22.804 -13.075 397 HA PHE 67 HA PHE 67 4.944 -21.581 -15.196 398 HB2 PHE 67 HB2 PHE 67 1.975 -22.106 -14.577 399 HB3 PHE 67 HB3 PHE 67 2.553 -21.653 -16.168 400 HD1 PHE 67 HD2 PHE 67 5.052 -23.305 -16.279 401 HD2 PHE 67 HD1 PHE 67 1.138 -24.259 -14.947 402 HE1 PHE 67 HE2 PHE 67 5.457 -25.722 -16.821 403 HE2 PHE 67 HE1 PHE 67 1.543 -26.676 -15.489 404 HZ PHE 67 HZ PHE 67 3.697 -27.379 -16.419 405 H ASN 68 H ASN 68 5.599 -19.460 -15.046 406 HA ASN 68 HA ASN 68 3.855 -17.578 -13.783 407 HB2 ASN 68 HB2 ASN 68 5.703 -16.078 -13.874 408 HB3 ASN 68 HB3 ASN 68 6.478 -17.642 -13.706 409 HD21 ASN 68 HD21 ASN 68 5.491 -15.148 -15.989 410 HD22 ASN 68 HD22 ASN 68 6.655 -15.485 -17.227 411 H THR 69 H THR 69 2.817 -15.799 -14.913 412 HA THR 69 HA THR 69 2.626 -16.211 -17.816 413 HB THR 69 HB THR 69 0.723 -14.481 -16.237 414 HG1 THR 69 HG1 THR 69 -0.036 -17.124 -16.223 415 HG21 THR 69 HG21 THR 69 0.278 -14.918 -18.646 416 HG22 THR 69 HG22 THR 69 0.402 -16.670 -18.358 417 HG23 THR 69 HG23 THR 69 -0.938 -15.743 -17.642 418 H LEU 70 H LEU 70 3.673 -14.879 -19.140 419 HA LEU 70 HA LEU 70 4.970 -12.580 -18.079 420 HB2 LEU 70 HB2 LEU 70 6.253 -13.483 -19.693 421 HB3 LEU 70 HB3 LEU 70 4.890 -14.083 -20.616 422 HG LEU 70 HG LEU 70 4.502 -11.913 -21.599 423 HD11 LEU 70 HD11 LEU 70 6.711 -10.344 -20.832 424 HD12 LEU 70 HD12 LEU 70 4.989 -10.060 -20.482 425 HD13 LEU 70 HD13 LEU 70 5.995 -10.965 -19.325 426 HD21 LEU 70 HD21 LEU 70 6.505 -11.670 -22.927 427 HD22 LEU 70 HD22 LEU 70 7.466 -12.536 -21.704 428 HD23 LEU 70 HD23 LEU 70 6.203 -13.397 -22.616 429 H THR 71 H THR 71 1.981 -13.260 -19.910 430 HA THR 71 HA THR 71 1.412 -10.726 -20.840 431 HB THR 71 HB THR 71 -0.217 -13.130 -19.939 432 HG1 THR 71 HG1 THR 71 -0.277 -13.295 -22.215 433 HG21 THR 71 HG21 THR 71 -2.249 -12.106 -20.727 434 HG22 THR 71 HG22 THR 71 -1.545 -10.910 -19.613 435 HG23 THR 71 HG23 THR 71 -1.375 -10.697 -21.372 436 H GLU 72 H GLU 72 1.255 -12.010 -17.532 437 HA GLU 72 HA GLU 72 -0.408 -10.070 -16.490 438 HB2 GLU 72 HB2 GLU 72 0.597 -12.284 -15.463 439 HB3 GLU 72 HB3 GLU 72 1.893 -11.243 -14.910 440 HG2 GLU 72 HG2 GLU 72 0.306 -11.280 -13.117 441 HG3 GLU 72 HG3 GLU 72 0.096 -9.720 -13.887 442 HE2 GLU 72 HE2 GLU 72 -1.762 -12.963 -14.036 443 H ALA 73 H ALA 73 3.211 -10.199 -16.732 444 HA ALA 73 HA ALA 73 3.587 -7.668 -15.544 445 HB1 ALA 73 HB1 ALA 73 5.264 -9.559 -17.210 446 HB2 ALA 73 HB2 ALA 73 5.883 -7.963 -16.725 447 HB3 ALA 73 HB3 ALA 73 5.418 -9.151 -15.485 448 H ARG 74 H ARG 74 3.567 -8.821 -18.987 449 HA ARG 74 HA ARG 74 4.060 -6.373 -20.101 450 HB2 ARG 74 HB2 ARG 74 4.129 -8.494 -21.375 451 HB3 ARG 74 HB3 ARG 74 2.402 -8.712 -21.169 452 HG2 ARG 74 HG2 ARG 74 2.175 -6.378 -22.348 453 HG3 ARG 74 HG3 ARG 74 3.840 -6.617 -22.838 454 HD2 ARG 74 HD2 ARG 74 1.451 -8.394 -23.503 455 HD3 ARG 74 HD3 ARG 74 2.423 -7.462 -24.625 456 HE ARG 74 HE ARG 74 4.150 -9.257 -23.215 457 HH11 ARG 74 HH22 ARG 74 1.582 -9.320 -25.620 458 HH12 ARG 74 HH21 ARG 74 2.147 -10.776 -26.370 459 HH21 ARG 74 HH12 ARG 74 4.895 -11.177 -24.204 460 HH22 ARG 74 HH11 ARG 74 4.044 -11.839 -25.559 461 H ASP 75 H ASP 75 1.106 -7.759 -18.715 462 HA ASP 75 HA ASP 75 -0.647 -5.955 -19.987 463 HB2 ASP 75 HB2 ASP 75 -0.799 -7.946 -17.729 464 HB3 ASP 75 HB3 ASP 75 -2.070 -6.744 -17.826 465 HD2 ASP 75 HD2 ASP 75 -1.635 -8.651 -21.213 466 H ALA 76 H ALA 76 1.146 -6.164 -16.870 467 HA ALA 76 HA ALA 76 -0.123 -4.079 -15.531 468 HB1 ALA 76 HB1 ALA 76 1.433 -4.529 -13.930 469 HB2 ALA 76 HB2 ALA 76 1.804 -5.931 -14.962 470 HB3 ALA 76 HB3 ALA 76 2.788 -4.453 -15.082 471 H ILE 77 H ILE 77 2.861 -4.109 -17.601 472 HA ILE 77 HA ILE 77 3.181 -1.299 -17.414 473 HB ILE 77 HB ILE 77 4.882 -1.626 -19.133 474 HG12 ILE 77 HG12 ILE 77 3.623 -4.351 -19.362 475 HG13 ILE 77 HG13 ILE 77 4.020 -3.206 -20.629 476 HG21 ILE 77 HG21 ILE 77 4.923 -3.680 -16.905 477 HG22 ILE 77 HG22 ILE 77 6.336 -3.165 -17.858 478 HG23 ILE 77 HG23 ILE 77 5.487 -1.994 -16.820 479 HD11 ILE 77 HD11 ILE 77 6.511 -3.542 -19.793 480 HD12 ILE 77 HD12 ILE 77 5.861 -5.041 -19.085 481 HD13 ILE 77 HD13 ILE 77 5.757 -4.768 -20.841 482 H LYS 78 H LYS 78 1.961 -3.520 -20.014 483 HA LYS 78 HA LYS 78 1.354 -1.610 -21.877 484 HB2 LYS 78 HB2 LYS 78 1.297 -4.014 -22.300 485 HB3 LYS 78 HB3 LYS 78 -0.092 -4.201 -21.249 486 HG2 LYS 78 HG2 LYS 78 -1.185 -4.032 -23.293 487 HG3 LYS 78 HG3 LYS 78 -1.162 -2.339 -22.842 488 HD2 LYS 78 HD2 LYS 78 1.100 -3.565 -24.468 489 HD3 LYS 78 HD3 LYS 78 -0.359 -2.980 -25.243 490 HE2 LYS 78 HE2 LYS 78 0.166 -0.807 -23.708 491 HE3 LYS 78 HE3 LYS 78 1.800 -1.427 -23.834 492 HZ1 LYS 78 HZ1 LYS 78 1.796 -0.380 -25.771 493 HZ2 LYS 78 HZ2 LYS 78 0.894 -1.612 -26.349 494 HZ3 LYS 78 HZ3 LYS 78 0.171 -0.239 -25.841 495 H ASP 79 H ASP 79 -0.362 -2.495 -18.877 496 HA ASP 79 HA ASP 79 -2.676 -1.034 -19.567 497 HB2 ASP 79 HB2 ASP 79 -2.841 -2.840 -17.951 498 HB3 ASP 79 HB3 ASP 79 -1.578 -2.148 -16.952 499 HD2 ASP 79 HD2 ASP 79 -2.598 -1.035 -15.094 500 H ALA 80 H ALA 80 0.399 -0.472 -17.803 501 HA ALA 80 HA ALA 80 -0.337 1.947 -16.572 502 HB1 ALA 80 HB1 ALA 80 2.399 0.901 -17.409 503 HB2 ALA 80 HB2 ALA 80 2.085 2.185 -16.217 504 HB3 ALA 80 HB3 ALA 80 1.566 0.515 -15.884 505 H TYR 81 H TYR 81 1.134 1.102 -19.752 506 HA TYR 81 HA TYR 81 1.587 3.807 -20.485 507 HB2 TYR 81 HB2 TYR 81 1.373 1.060 -21.838 508 HB3 TYR 81 HB3 TYR 81 1.657 2.492 -22.807 509 HD1 TYR 81 HD1 TYR 81 3.045 1.338 -19.510 510 HD2 TYR 81 HD2 TYR 81 3.856 2.528 -23.538 511 HE1 TYR 81 HE1 TYR 81 5.542 1.148 -19.071 512 HE2 TYR 81 HE2 TYR 81 6.351 2.334 -23.085 513 HH TYR 81 HH TYR 81 7.537 0.975 -20.087 514 H GLU 82 H GLU 82 -1.016 1.385 -21.127 515 HA GLU 82 HA GLU 82 -2.384 3.147 -22.859 516 HB2 GLU 82 HB2 GLU 82 -2.666 0.761 -23.150 517 HB3 GLU 82 HB3 GLU 82 -3.166 0.547 -21.484 518 HG2 GLU 82 HG2 GLU 82 -5.183 2.011 -21.953 519 HG3 GLU 82 HG3 GLU 82 -4.701 2.078 -23.637 520 HE2 GLU 82 HE2 GLU 82 -6.443 -1.092 -22.041 521 H SER 83 H SER 83 -2.199 2.674 -19.389 522 HA SER 83 HA SER 83 -4.746 3.773 -18.839 523 HB2 SER 83 HB2 SER 83 -3.804 2.301 -17.196 524 HB3 SER 83 HB3 SER 83 -2.286 3.175 -17.161 525 HG SER 83 HG SER 83 -4.702 4.547 -16.448 526 H TYR 84 H TYR 84 -1.322 4.959 -18.771 527 HA TYR 84 HA TYR 84 -2.330 7.672 -18.336 528 HB2 TYR 84 HB2 TYR 84 0.378 6.216 -18.233 529 HB3 TYR 84 HB3 TYR 84 0.280 7.959 -18.088 530 HD1 TYR 84 HD2 TYR 84 -0.941 8.974 -16.125 531 HD2 TYR 84 HD1 TYR 84 -0.102 4.787 -16.379 532 HE1 TYR 84 HE2 TYR 84 -1.333 8.736 -13.624 533 HE2 TYR 84 HE1 TYR 84 -0.497 4.563 -13.878 534 HH TYR 84 HH TYR 84 -0.833 5.619 -12.010 535 H CYS 85 H CYS 85 -2.022 5.747 -20.935 536 HA CYS 85 HA CYS 85 -0.233 6.885 -22.645 537 HB2 CYS 85 HB2 CYS 85 -1.142 5.132 -23.724 538 HB3 CYS 85 HB3 CYS 85 -2.677 5.278 -22.892 539 HG CYS 85 HG CYS 85 -3.228 5.528 -25.376 540 H GLY 86 H GLY 86 -0.173 8.788 -23.885 541 HA2 GLY 86 HA2 GLY 86 -1.233 10.596 -24.970 542 HA3 GLY 86 HA3 GLY 86 -2.545 10.529 -23.810 543 H ILE 87 H ILE 87 0.239 9.981 -22.019 544 HA ILE 87 HA ILE 87 0.679 12.852 -21.600 545 HB ILE 87 HB ILE 87 0.460 12.695 -19.331 546 HG12 ILE 87 HG12 ILE 87 1.037 9.748 -19.634 547 HG13 ILE 87 HG13 ILE 87 1.965 10.963 -18.778 548 HG21 ILE 87 HG21 ILE 87 -1.708 12.318 -20.511 549 HG22 ILE 87 HG22 ILE 87 -1.505 10.573 -20.228 550 HG23 ILE 87 HG23 ILE 87 -1.658 11.687 -18.848 551 HD11 ILE 87 HD11 ILE 87 -0.066 11.267 -17.232 552 HD12 ILE 87 HD12 ILE 87 -0.742 9.808 -17.996 553 HD13 ILE 87 HD13 ILE 87 0.790 9.713 -17.095 554 H ASP 88 H ASP 88 2.739 13.360 -22.086 555 HA ASP 88 HA ASP 88 4.684 11.214 -21.793 556 HB2 ASP 88 HB2 ASP 88 4.811 13.777 -23.451 557 HB3 ASP 88 HB3 ASP 88 6.070 12.560 -23.394 558 HD2 ASP 88 HD2 ASP 88 2.632 11.282 -24.926 559 H ASP 89 H ASP 89 3.446 13.873 -20.204 560 HA ASP 89 HA ASP 89 5.845 14.194 -18.701 561 HB2 ASP 89 HB2 ASP 89 4.623 16.476 -20.305 562 HB3 ASP 89 HB3 ASP 89 5.594 16.781 -18.879 563 HD2 ASP 89 HD2 ASP 89 8.164 14.859 -20.300 564 H CYS 90 H CYS 90 5.300 14.854 -16.538 565 HA CYS 90 HA CYS 90 2.623 14.551 -15.797 566 HB2 CYS 90 HB2 CYS 90 3.421 15.266 -13.537 567 HB3 CYS 90 HB3 CYS 90 4.343 13.953 -14.240 568 HA PRO 91 HA PRO 91 1.464 18.704 -16.674 569 HB2 PRO 91 HB2 PRO 91 -1.198 18.460 -16.107 570 HB3 PRO 91 HB3 PRO 91 -0.508 18.046 -17.663 571 HG2 PRO 91 HG2 PRO 91 -1.430 16.247 -15.506 572 HG3 PRO 91 HG3 PRO 91 -1.144 15.879 -17.196 573 HD2 PRO 91 HD2 PRO 91 0.559 15.220 -14.983 574 HD3 PRO 91 HD3 PRO 91 0.898 14.956 -16.682 575 H GLN 92 H GLN 92 1.234 17.081 -13.699 576 HA GLN 92 HA GLN 92 0.115 19.072 -12.175 577 HB2 GLN 92 HB2 GLN 92 0.792 16.618 -11.582 578 HB3 GLN 92 HB3 GLN 92 2.359 17.288 -11.176 579 HG2 GLN 92 HG2 GLN 92 1.508 18.566 -9.382 580 HG3 GLN 92 HG3 GLN 92 -0.117 18.598 -10.036 581 HE21 GLN 92 HE21 GLN 92 -1.188 16.425 -10.264 582 HE22 GLN 92 HE22 GLN 92 -1.016 15.299 -8.959 583 H CYS 93 H CYS 93 3.566 18.486 -13.096 584 HA CYS 93 HA CYS 93 4.691 20.478 -11.568 585 HB2 CYS 93 HB2 CYS 93 5.476 18.963 -14.002 586 HB3 CYS 93 HB3 CYS 93 6.330 20.468 -13.730 587 H SER 94 H SER 94 2.893 20.542 -14.652 588 HA SER 94 HA SER 94 3.643 23.182 -15.295 589 HB2 SER 94 HB2 SER 94 2.945 22.031 -17.184 590 HB3 SER 94 HB3 SER 94 1.702 21.143 -16.325 591 HG SER 94 HG SER 94 1.072 22.963 -17.903 592 H LYS 95 H LYS 95 0.981 21.611 -13.486 593 HA LYS 95 HA LYS 95 -0.562 24.006 -13.291 594 HB2 LYS 95 HB2 LYS 95 -0.746 21.198 -12.313 595 HB3 LYS 95 HB3 LYS 95 -1.596 22.415 -11.382 596 HG2 LYS 95 HG2 LYS 95 -3.240 21.923 -12.949 597 HG3 LYS 95 HG3 LYS 95 -2.430 23.232 -13.787 598 HD2 LYS 95 HD2 LYS 95 -1.371 20.443 -14.217 599 HD3 LYS 95 HD3 LYS 95 -2.901 20.851 -14.968 600 HE2 LYS 95 HE2 LYS 95 -1.510 23.068 -15.683 601 HE3 LYS 95 HE3 LYS 95 -0.159 21.965 -15.511 602 HZ1 LYS 95 HZ1 LYS 95 -2.532 21.229 -17.059 603 HZ2 LYS 95 HZ2 LYS 95 -1.297 22.059 -17.731 604 HZ3 LYS 95 HZ3 LYS 95 -1.040 20.567 -17.120 605 H TYR 96 H TYR 96 2.279 22.753 -11.768 606 HA TYR 96 HA TYR 96 1.895 24.652 -9.552 607 HB2 TYR 96 HB2 TYR 96 3.166 21.900 -9.916 608 HB3 TYR 96 HB3 TYR 96 3.837 22.956 -8.688 609 HD1 TYR 96 HD1 TYR 96 0.322 22.162 -9.765 610 HD2 TYR 96 HD2 TYR 96 3.169 22.290 -6.574 611 HE1 TYR 96 HE1 TYR 96 -1.469 21.405 -8.127 612 HE2 TYR 96 HE2 TYR 96 1.368 21.532 -4.947 613 HH TYR 96 HH TYR 96 -1.628 20.311 -6.017 614 H ILE 97 H ILE 97 4.335 25.062 -8.586 615 HA ILE 97 HA ILE 97 5.749 26.185 -10.882 616 HB ILE 97 HB ILE 97 6.735 27.713 -9.348 617 HG12 ILE 97 HG12 ILE 97 5.394 26.166 -7.109 618 HG13 ILE 97 HG13 ILE 97 7.106 26.134 -7.483 619 HG21 ILE 97 HG21 ILE 97 4.535 28.592 -8.207 620 HG22 ILE 97 HG22 ILE 97 4.722 28.616 -9.977 621 HG23 ILE 97 HG23 ILE 97 3.769 27.329 -9.200 622 HD11 ILE 97 HD11 ILE 97 6.992 28.746 -7.252 623 HD12 ILE 97 HD12 ILE 97 5.451 28.439 -6.415 624 HD13 ILE 97 HD13 ILE 97 6.965 27.758 -5.772 625 H ASP 98 H ASP 98 8.020 25.872 -11.167 626 HA ASP 98 HA ASP 98 8.854 23.342 -10.058 627 HB2 ASP 98 HB2 ASP 98 8.980 23.923 -12.555 628 HB3 ASP 98 HB3 ASP 98 10.239 25.074 -12.155 629 HD2 ASP 98 HD2 ASP 98 12.320 22.858 -13.123 630 H ASP 99 H ASP 99 9.817 23.677 -8.020 631 HA ASP 99 HA ASP 99 11.276 24.310 -6.545 632 HB2 ASP 99 HB2 ASP 99 12.826 25.882 -8.635 633 HB3 ASP 99 HB3 ASP 99 13.450 25.117 -7.187 634 HD2 ASP 99 HD2 ASP 99 14.386 22.389 -8.674 Start of MODEL 10 1 H GLU 14 H GLU 14 -1.894 -3.826 -5.542 2 HA GLU 14 HA GLU 14 -1.171 -2.472 -3.137 3 HB2 GLU 14 HB2 GLU 14 -1.232 -5.051 -3.631 4 HB3 GLU 14 HB3 GLU 14 0.345 -4.799 -4.354 5 HG2 GLU 14 HG2 GLU 14 1.353 -4.230 -2.315 6 HG3 GLU 14 HG3 GLU 14 -0.138 -3.631 -1.617 7 HE2 GLU 14 HE2 GLU 14 -1.577 -6.025 -0.653 8 H ASP 15 H ASP 15 1.374 -2.276 -2.725 9 HA ASP 15 HA ASP 15 2.274 -0.541 -4.828 10 HB2 ASP 15 HB2 ASP 15 3.139 -1.137 -1.984 11 HB3 ASP 15 HB3 ASP 15 4.238 -0.289 -3.054 12 HD2 ASP 15 HD2 ASP 15 2.221 0.355 -0.721 13 H GLN 16 H GLN 16 2.257 -3.731 -4.677 14 HA GLN 16 HA GLN 16 4.967 -4.454 -4.628 15 HB2 GLN 16 HB2 GLN 16 2.726 -5.870 -4.365 16 HB3 GLN 16 HB3 GLN 16 2.884 -6.073 -6.099 17 HG2 GLN 16 HG2 GLN 16 4.887 -7.286 -5.924 18 HG3 GLN 16 HG3 GLN 16 5.329 -6.551 -4.396 19 HE21 GLN 16 HE21 GLN 16 4.618 -9.362 -5.664 20 HE22 GLN 16 HE22 GLN 16 3.750 -10.160 -4.395 21 H GLU 17 H GLU 17 2.596 -3.726 -7.258 22 HA GLU 17 HA GLU 17 4.431 -4.320 -9.302 23 HB2 GLU 17 HB2 GLU 17 2.718 -3.690 -10.780 24 HB3 GLU 17 HB3 GLU 17 1.821 -4.200 -9.364 25 HG2 GLU 17 HG2 GLU 17 1.725 -1.793 -8.600 26 HG3 GLU 17 HG3 GLU 17 2.539 -1.317 -10.077 27 HE2 GLU 17 HE2 GLU 17 -1.088 -1.107 -10.096 28 H GLN 18 H GLN 18 3.568 -1.403 -7.430 29 HA GLN 18 HA GLN 18 4.690 0.476 -9.098 30 HB2 GLN 18 HB2 GLN 18 4.251 0.359 -6.097 31 HB3 GLN 18 HB3 GLN 18 4.997 1.761 -6.838 32 HG2 GLN 18 HG2 GLN 18 2.872 1.515 -8.507 33 HG3 GLN 18 HG3 GLN 18 2.176 0.750 -7.093 34 HE21 GLN 18 HE21 GLN 18 0.927 2.892 -7.808 35 HE22 GLN 18 HE22 GLN 18 1.273 4.278 -6.828 36 H TRP 19 H TRP 19 6.150 -1.316 -6.295 37 HA TRP 19 HA TRP 19 8.655 -0.162 -6.407 38 HB2 TRP 19 HB2 TRP 19 8.037 -1.462 -4.531 39 HB3 TRP 19 HB3 TRP 19 7.701 -2.875 -5.511 40 HD1 TRP 19 HD1 TRP 19 10.928 -0.685 -5.067 41 HE1 TRP 19 HE1 TRP 19 13.040 -2.229 -4.721 42 HE3 TRP 19 HE3 TRP 19 8.403 -5.090 -5.337 43 HZ2 TRP 19 HZ2 TRP 19 13.409 -5.057 -4.601 44 HZ3 TRP 19 HZ3 TRP 19 9.714 -7.197 -5.095 45 HH2 TRP 19 HH2 TRP 19 12.132 -7.227 -4.739 46 H ALA 20 H ALA 20 7.087 -2.681 -8.392 47 HA ALA 20 HA ALA 20 9.449 -3.620 -9.618 48 HB1 ALA 20 HB1 ALA 20 6.903 -3.731 -11.138 49 HB2 ALA 20 HB2 ALA 20 8.013 -5.040 -10.665 50 HB3 ALA 20 HB3 ALA 20 6.831 -4.409 -9.494 51 H MET 21 H MET 21 7.028 -1.064 -10.416 52 HA MET 21 HA MET 21 7.852 -0.463 -12.923 53 HB2 MET 21 HB2 MET 21 6.159 0.635 -10.961 54 HB3 MET 21 HB3 MET 21 7.319 1.922 -11.222 55 HG2 MET 21 HG2 MET 21 6.696 2.227 -13.467 56 HG3 MET 21 HG3 MET 21 6.153 0.571 -13.657 57 HE1 MET 21 HE1 MET 21 2.634 1.621 -14.078 58 HE2 MET 21 HE2 MET 21 4.189 1.423 -14.921 59 HE3 MET 21 HE3 MET 21 3.574 0.123 -13.873 60 H GLN 22 H GLN 22 9.457 0.236 -9.832 61 HA GLN 22 HA GLN 22 11.010 2.317 -10.326 62 HB2 GLN 22 HB2 GLN 22 10.988 0.632 -8.335 63 HB3 GLN 22 HB3 GLN 22 12.237 -0.228 -9.213 64 HG2 GLN 22 HG2 GLN 22 12.463 2.754 -8.643 65 HG3 GLN 22 HG3 GLN 22 12.993 1.558 -7.477 66 HE21 GLN 22 HE21 GLN 22 14.447 -0.175 -8.336 67 HE22 GLN 22 HE22 GLN 22 15.698 0.283 -9.443 68 H THR 23 H THR 23 12.338 -1.010 -10.958 69 HA THR 23 HA THR 23 14.258 0.041 -12.789 70 HB THR 23 HB THR 23 14.705 -1.908 -11.318 71 HG1 THR 23 HG1 THR 23 15.887 -2.194 -13.195 72 HG21 THR 23 HG21 THR 23 12.227 -2.799 -11.591 73 HG22 THR 23 HG22 THR 23 12.848 -3.544 -13.083 74 HG23 THR 23 HG23 THR 23 13.555 -3.981 -11.509 75 H LEU 24 H LEU 24 11.359 -2.105 -13.188 76 HA LEU 24 HA LEU 24 11.384 -2.524 -15.814 77 HB2 LEU 24 HB2 LEU 24 9.662 -3.253 -14.200 78 HB3 LEU 24 HB3 LEU 24 8.966 -1.645 -14.229 79 HG LEU 24 HG LEU 24 9.263 -2.997 -16.862 80 HD11 LEU 24 HD11 LEU 24 7.638 -4.599 -16.622 81 HD12 LEU 24 HD12 LEU 24 8.431 -4.692 -15.031 82 HD13 LEU 24 HD13 LEU 24 6.899 -3.804 -15.211 83 HD21 LEU 24 HD21 LEU 24 7.381 -1.085 -15.531 84 HD22 LEU 24 HD22 LEU 24 8.225 -0.962 -17.093 85 HD23 LEU 24 HD23 LEU 24 6.817 -2.038 -16.925 86 H MET 25 H MET 25 9.708 0.399 -14.439 87 HA MET 25 HA MET 25 9.693 1.615 -16.985 88 HB2 MET 25 HB2 MET 25 8.172 2.987 -15.927 89 HB3 MET 25 HB3 MET 25 8.345 1.923 -14.545 90 HG2 MET 25 HG2 MET 25 10.257 3.353 -13.719 91 HG3 MET 25 HG3 MET 25 10.002 4.439 -15.071 92 HE1 MET 25 HE1 MET 25 7.391 4.918 -15.690 93 HE2 MET 25 HE2 MET 25 6.453 3.691 -14.805 94 HE3 MET 25 HE3 MET 25 6.215 5.420 -14.452 95 H GLY 26 H GLY 26 11.951 1.488 -14.302 96 HA2 GLY 26 HA2 GLY 26 13.275 3.953 -14.709 97 HA3 GLY 26 HA3 GLY 26 13.895 2.539 -13.879 98 H SER 27 H SER 27 13.011 1.185 -16.720 99 HA SER 27 HA SER 27 15.604 0.923 -17.623 100 HB2 SER 27 HB2 SER 27 14.703 -0.468 -19.263 101 HB3 SER 27 HB3 SER 27 13.420 -0.489 -18.069 102 HG SER 27 HG SER 27 12.934 -0.011 -20.486 103 H GLY 28 H GLY 28 13.433 3.565 -17.879 104 HA2 GLY 28 HA2 GLY 28 14.097 5.628 -18.750 105 HA3 GLY 28 HA3 GLY 28 15.159 4.824 -19.889 106 H VAL 29 H VAL 29 12.296 3.032 -19.808 107 HA VAL 29 HA VAL 29 11.541 3.970 -22.388 108 HB VAL 29 HB VAL 29 10.619 1.871 -20.460 109 HG11 VAL 29 HG11 VAL 29 8.546 2.858 -21.341 110 HG12 VAL 29 HG12 VAL 29 9.144 2.639 -23.003 111 HG13 VAL 29 HG13 VAL 29 8.809 1.219 -21.983 112 HG21 VAL 29 HG21 VAL 29 11.580 1.808 -23.341 113 HG22 VAL 29 HG22 VAL 29 12.522 1.368 -21.897 114 HG23 VAL 29 HG23 VAL 29 11.117 0.386 -22.376 115 H LEU 30 H LEU 30 10.160 4.157 -19.051 116 HA LEU 30 HA LEU 30 8.107 5.954 -20.080 117 HB2 LEU 30 HB2 LEU 30 8.453 4.636 -17.383 118 HB3 LEU 30 HB3 LEU 30 7.128 5.694 -17.826 119 HG LEU 30 HG LEU 30 7.756 3.032 -19.133 120 HD11 LEU 30 HD11 LEU 30 6.860 2.231 -17.233 121 HD12 LEU 30 HD12 LEU 30 6.117 3.788 -16.795 122 HD13 LEU 30 HD13 LEU 30 5.320 2.722 -17.977 123 HD21 LEU 30 HD21 LEU 30 5.221 3.556 -19.862 124 HD22 LEU 30 HD22 LEU 30 5.860 5.216 -19.793 125 HD23 LEU 30 HD23 LEU 30 6.639 4.005 -20.839 126 H ALA 31 H ALA 31 7.600 7.778 -18.255 127 HA ALA 31 HA ALA 31 10.179 8.984 -17.544 128 HB1 ALA 31 HB1 ALA 31 9.776 10.851 -18.769 129 HB2 ALA 31 HB2 ALA 31 8.661 9.810 -19.686 130 HB3 ALA 31 HB3 ALA 31 8.039 10.848 -18.381 131 H ARG 32 H ARG 32 10.226 9.963 -15.526 132 HA ARG 32 HA ARG 32 7.663 9.995 -14.147 133 HB2 ARG 32 HB2 ARG 32 9.042 9.479 -12.032 134 HB3 ARG 32 HB3 ARG 32 8.878 8.160 -13.174 135 HG2 ARG 32 HG2 ARG 32 11.236 10.007 -13.510 136 HG3 ARG 32 HG3 ARG 32 11.272 8.886 -12.164 137 HD2 ARG 32 HD2 ARG 32 11.051 6.965 -13.637 138 HD3 ARG 32 HD3 ARG 32 10.658 7.979 -15.011 139 HE ARG 32 HE ARG 32 13.236 8.712 -13.913 140 HH11 ARG 32 HH22 ARG 32 11.641 6.285 -15.901 141 HH12 ARG 32 HH21 ARG 32 13.080 5.868 -16.771 142 HH21 ARG 32 HH12 ARG 32 15.134 8.162 -15.061 143 HH22 ARG 32 HH11 ARG 32 15.080 6.943 -16.290 144 H CYS 33 H CYS 33 7.394 11.729 -12.557 145 HA CYS 33 HA CYS 33 8.752 14.094 -13.309 146 HB2 CYS 33 HB2 CYS 33 6.314 13.527 -12.152 147 HB3 CYS 33 HB3 CYS 33 7.211 14.183 -10.798 148 H ARG 34 H ARG 34 10.405 15.207 -12.188 149 HA ARG 34 HA ARG 34 12.009 13.609 -10.545 150 HB2 ARG 34 HB2 ARG 34 13.496 15.555 -10.463 151 HB3 ARG 34 HB3 ARG 34 12.855 15.419 -12.088 152 HG2 ARG 34 HG2 ARG 34 11.175 17.162 -11.629 153 HG3 ARG 34 HG3 ARG 34 11.650 17.228 -9.943 154 HD2 ARG 34 HD2 ARG 34 12.819 19.059 -10.875 155 HD3 ARG 34 HD3 ARG 34 14.044 17.806 -10.845 156 HE ARG 34 HE ARG 34 12.718 18.911 -13.235 157 HH11 ARG 34 HH22 ARG 34 14.697 16.315 -11.919 158 HH12 ARG 34 HH21 ARG 34 15.340 15.853 -13.459 159 HH21 ARG 34 HH12 ARG 34 13.566 18.301 -15.267 160 HH22 ARG 34 HH11 ARG 34 14.692 16.990 -15.376 161 H ILE 35 H ILE 35 9.149 15.266 -9.894 162 HA ILE 35 HA ILE 35 9.961 15.998 -7.181 163 HB ILE 35 HB ILE 35 7.414 16.635 -8.672 164 HG12 ILE 35 HG12 ILE 35 9.628 18.605 -8.149 165 HG13 ILE 35 HG13 ILE 35 9.690 17.567 -9.559 166 HG21 ILE 35 HG21 ILE 35 8.121 18.438 -6.533 167 HG22 ILE 35 HG22 ILE 35 6.634 17.493 -6.780 168 HG23 ILE 35 HG23 ILE 35 8.020 16.766 -5.932 169 HD11 ILE 35 HD11 ILE 35 7.130 19.061 -8.961 170 HD12 ILE 35 HD12 ILE 35 8.496 19.925 -9.707 171 HD13 ILE 35 HD13 ILE 35 7.777 18.519 -10.529 172 H HIS 36 H HIS 36 8.466 13.507 -9.045 173 HA HIS 36 HA HIS 36 7.879 12.080 -6.643 174 HB2 HIS 36 HB2 HIS 36 5.474 11.607 -7.642 175 HB3 HIS 36 HB3 HIS 36 5.776 12.923 -6.524 176 HD1 HIS 36 HD1 HIS 36 5.508 12.344 -10.300 177 HD2 HIS 36 HD2 HIS 36 5.044 15.398 -7.462 178 HE1 HIS 36 HE1 HIS 36 4.570 14.354 -11.561 179 H ASN 37 H ASN 37 8.354 9.950 -6.981 180 HA ASN 37 HA ASN 37 8.874 9.228 -9.730 181 HB2 ASN 37 HB2 ASN 37 9.450 7.429 -7.354 182 HB3 ASN 37 HB3 ASN 37 10.329 7.554 -8.865 183 HD21 ASN 37 HD21 ASN 37 11.717 9.297 -9.244 184 HD22 ASN 37 HD22 ASN 37 12.380 10.255 -7.962 185 H ASP 38 H ASP 38 6.410 9.046 -7.391 186 HA ASP 38 HA ASP 38 5.592 6.376 -7.874 187 HB2 ASP 38 HB2 ASP 38 4.208 8.777 -6.596 188 HB3 ASP 38 HB3 ASP 38 3.477 7.187 -6.670 189 HD2 ASP 38 HD2 ASP 38 5.374 9.144 -4.867 190 H VAL 39 H VAL 39 5.695 9.039 -9.842 191 HA VAL 39 HA VAL 39 3.036 8.631 -10.995 192 HB VAL 39 HB VAL 39 5.108 10.795 -11.413 193 HG11 VAL 39 HG11 VAL 39 2.394 10.313 -12.646 194 HG12 VAL 39 HG12 VAL 39 3.079 11.951 -12.517 195 HG13 VAL 39 HG13 VAL 39 3.938 10.697 -13.444 196 HG21 VAL 39 HG21 VAL 39 2.596 10.631 -9.745 197 HG22 VAL 39 HG22 VAL 39 4.230 11.149 -9.266 198 HG23 VAL 39 HG23 VAL 39 3.237 12.192 -10.312 199 H ILE 40 H ILE 40 2.806 8.182 -13.268 200 HA ILE 40 HA ILE 40 5.273 7.177 -14.500 201 HB ILE 40 HB ILE 40 4.304 5.196 -13.917 202 HG12 ILE 40 HG12 ILE 40 3.155 5.927 -16.620 203 HG13 ILE 40 HG13 ILE 40 4.672 5.117 -16.284 204 HG21 ILE 40 HG21 ILE 40 1.604 6.491 -14.349 205 HG22 ILE 40 HG22 ILE 40 1.834 4.757 -14.019 206 HG23 ILE 40 HG23 ILE 40 2.337 5.966 -12.814 207 HD11 ILE 40 HD11 ILE 40 1.878 4.032 -16.209 208 HD12 ILE 40 HD12 ILE 40 3.387 3.251 -16.740 209 HD13 ILE 40 HD13 ILE 40 3.023 3.394 -15.004 210 H LEU 41 H LEU 41 5.674 7.965 -16.512 211 HA LEU 41 HA LEU 41 3.403 9.169 -17.922 212 HB2 LEU 41 HB2 LEU 41 6.145 10.407 -17.880 213 HB3 LEU 41 HB3 LEU 41 4.649 11.087 -18.489 214 HG LEU 41 HG LEU 41 4.896 10.424 -15.568 215 HD11 LEU 41 HD11 LEU 41 6.059 12.850 -16.950 216 HD12 LEU 41 HD12 LEU 41 5.687 12.787 -15.210 217 HD13 LEU 41 HD13 LEU 41 6.890 11.674 -15.904 218 HD21 LEU 41 HD21 LEU 41 3.277 12.199 -15.300 219 HD22 LEU 41 HD22 LEU 41 3.387 12.608 -17.029 220 HD23 LEU 41 HD23 LEU 41 2.702 11.044 -16.526 221 H ASP 42 H ASP 42 3.876 9.431 -20.316 222 HA ASP 42 HA ASP 42 5.258 7.033 -21.144 223 HB2 ASP 42 HB2 ASP 42 3.147 8.839 -22.307 224 HB3 ASP 42 HB3 ASP 42 4.171 7.982 -23.442 225 HD2 ASP 42 HD2 ASP 42 3.576 5.169 -23.121 226 H SER 43 H SER 43 7.108 7.127 -22.519 227 HA SER 43 HA SER 43 8.095 9.825 -22.990 228 HB2 SER 43 HB2 SER 43 9.409 8.076 -21.573 229 HB3 SER 43 HB3 SER 43 9.753 7.280 -23.096 230 HG SER 43 HG SER 43 10.478 9.595 -23.765 231 H GLY 44 H GLY 44 7.706 6.533 -24.441 232 HA2 GLY 44 HA2 GLY 44 6.926 6.251 -26.643 233 HA3 GLY 44 HA3 GLY 44 7.612 7.799 -27.094 234 H ASN 45 H ASN 45 9.256 5.269 -25.128 235 HA ASN 45 HA ASN 45 11.183 5.080 -27.304 236 HB2 ASN 45 HB2 ASN 45 11.413 4.976 -24.287 237 HB3 ASN 45 HB3 ASN 45 12.570 4.052 -25.223 238 HD21 ASN 45 HD21 ASN 45 10.969 7.233 -25.440 239 HD22 ASN 45 HD22 ASN 45 12.392 8.173 -25.745 240 H ASP 46 H ASP 46 12.337 2.808 -27.323 241 HA ASP 46 HA ASP 46 10.556 0.866 -27.850 242 HB2 ASP 46 HB2 ASP 46 13.220 1.062 -28.080 243 HB3 ASP 46 HB3 ASP 46 13.208 0.104 -26.614 244 HD2 ASP 46 HD2 ASP 46 13.899 -1.674 -27.358 245 H ALA 47 H ALA 47 8.938 0.344 -26.313 246 HA ALA 47 HA ALA 47 9.507 0.187 -23.537 247 HB1 ALA 47 HB1 ALA 47 7.286 0.677 -24.898 248 HB2 ALA 47 HB2 ALA 47 7.103 -1.092 -24.818 249 HB3 ALA 47 HB3 ALA 47 7.219 -0.140 -23.318 250 H SER 48 H SER 48 10.178 -1.862 -26.190 251 HA SER 48 HA SER 48 9.625 -4.346 -25.178 252 HB2 SER 48 HB2 SER 48 12.144 -3.777 -26.767 253 HB3 SER 48 HB3 SER 48 11.104 -5.185 -26.846 254 HG SER 48 HG SER 48 9.471 -3.920 -27.866 255 H SER 49 H SER 49 12.459 -2.171 -24.678 256 HA SER 49 HA SER 49 14.025 -4.003 -23.327 257 HB2 SER 49 HB2 SER 49 14.788 -1.795 -24.247 258 HB3 SER 49 HB3 SER 49 13.918 -0.975 -22.966 259 HG SER 49 HG SER 49 15.292 -2.452 -21.490 260 H ALA 50 H ALA 50 11.802 -1.408 -22.071 261 HA ALA 50 HA ALA 50 12.126 -1.917 -19.386 262 HB1 ALA 50 HB1 ALA 50 10.010 -0.717 -21.137 263 HB2 ALA 50 HB2 ALA 50 9.585 -1.074 -19.445 264 HB3 ALA 50 HB3 ALA 50 10.944 0.015 -19.810 265 H TYR 51 H TYR 51 9.931 -3.462 -21.800 266 HA TYR 51 HA TYR 51 8.605 -5.080 -19.904 267 HB2 TYR 51 HB2 TYR 51 9.198 -5.419 -22.911 268 HB3 TYR 51 HB3 TYR 51 7.908 -6.240 -22.055 269 HD1 TYR 51 HD1 TYR 51 7.804 -3.217 -20.507 270 HD2 TYR 51 HD2 TYR 51 7.082 -4.878 -24.383 271 HE1 TYR 51 HE1 TYR 51 6.227 -1.297 -21.044 272 HE2 TYR 51 HE2 TYR 51 5.507 -2.952 -24.907 273 HH TYR 51 HH TYR 51 5.074 -0.299 -22.601 274 H LYS 52 H LYS 52 11.684 -5.333 -21.643 275 HA LYS 52 HA LYS 52 11.940 -8.140 -21.332 276 HB2 LYS 52 HB2 LYS 52 13.149 -7.141 -23.096 277 HB3 LYS 52 HB3 LYS 52 13.826 -5.900 -22.061 278 HG2 LYS 52 HG2 LYS 52 15.132 -7.626 -20.822 279 HG3 LYS 52 HG3 LYS 52 14.431 -8.886 -21.818 280 HD2 LYS 52 HD2 LYS 52 15.874 -6.565 -23.133 281 HD3 LYS 52 HD3 LYS 52 16.802 -7.880 -22.439 282 HE2 LYS 52 HE2 LYS 52 15.693 -9.520 -23.877 283 HE3 LYS 52 HE3 LYS 52 14.542 -8.326 -24.443 284 HZ1 LYS 52 HZ1 LYS 52 15.979 -7.747 -25.983 285 HZ2 LYS 52 HZ2 LYS 52 17.113 -7.359 -24.874 286 HZ3 LYS 52 HZ3 LYS 52 17.041 -8.877 -25.471 287 H LEU 53 H LEU 53 13.245 -5.262 -19.555 288 HA LEU 53 HA LEU 53 14.484 -6.911 -17.591 289 HB2 LEU 53 HB2 LEU 53 15.393 -5.003 -16.810 290 HB3 LEU 53 HB3 LEU 53 15.006 -4.481 -18.438 291 HG LEU 53 HG LEU 53 12.870 -3.489 -17.527 292 HD11 LEU 53 HD11 LEU 53 12.285 -4.268 -15.503 293 HD12 LEU 53 HD12 LEU 53 13.962 -4.656 -15.046 294 HD13 LEU 53 HD13 LEU 53 13.364 -2.985 -14.902 295 HD21 LEU 53 HD21 LEU 53 15.548 -2.453 -16.572 296 HD22 LEU 53 HD22 LEU 53 14.679 -2.034 -18.068 297 HD23 LEU 53 HD23 LEU 53 14.034 -1.521 -16.490 298 H GLY 54 H GLY 54 11.294 -5.481 -18.102 299 HA2 GLY 54 HA2 GLY 54 10.423 -5.567 -15.399 300 HA3 GLY 54 HA3 GLY 54 9.428 -5.449 -16.837 301 H THR 55 H THR 55 9.893 -7.757 -18.260 302 HA THR 55 HA THR 55 8.430 -9.662 -16.787 303 HB THR 55 HB THR 55 8.864 -11.038 -18.865 304 HG1 THR 55 HG1 THR 55 10.467 -10.234 -20.257 305 HG21 THR 55 HG21 THR 55 7.068 -9.595 -19.365 306 HG22 THR 55 HG22 THR 55 8.032 -8.131 -19.053 307 HG23 THR 55 HG23 THR 55 8.271 -9.050 -20.558 308 H TYR 56 H TYR 56 11.926 -9.365 -17.599 309 HA TYR 56 HA TYR 56 12.697 -11.851 -16.632 310 HB2 TYR 56 HB2 TYR 56 14.233 -10.468 -17.906 311 HB3 TYR 56 HB3 TYR 56 13.884 -9.050 -16.937 312 HD1 TYR 56 HD2 TYR 56 15.673 -12.305 -16.944 313 HD2 TYR 56 HD1 TYR 56 15.163 -8.536 -14.985 314 HE1 TYR 56 HE2 TYR 56 17.746 -12.746 -15.540 315 HE2 TYR 56 HE1 TYR 56 17.238 -8.989 -13.588 316 HH TYR 56 HH TYR 56 19.133 -11.953 -14.085 317 H LEU 57 H LEU 57 12.540 -8.636 -14.952 318 HA LEU 57 HA LEU 57 13.423 -9.702 -12.488 319 HB2 LEU 57 HB2 LEU 57 13.429 -7.279 -13.435 320 HB3 LEU 57 HB3 LEU 57 11.807 -7.192 -12.777 321 HG LEU 57 HG LEU 57 13.144 -8.149 -10.612 322 HD11 LEU 57 HD11 LEU 57 15.129 -6.577 -12.248 323 HD12 LEU 57 HD12 LEU 57 15.218 -6.645 -10.472 324 HD13 LEU 57 HD13 LEU 57 15.337 -8.142 -11.427 325 HD21 LEU 57 HD21 LEU 57 12.229 -5.500 -11.538 326 HD22 LEU 57 HD22 LEU 57 11.872 -6.388 -10.037 327 HD23 LEU 57 HD23 LEU 57 13.394 -5.477 -10.192 328 H TYR 58 H TYR 58 10.253 -9.285 -14.076 329 HA TYR 58 HA TYR 58 8.671 -9.686 -11.801 330 HB2 TYR 58 HB2 TYR 58 8.541 -9.826 -14.814 331 HB3 TYR 58 HB3 TYR 58 7.282 -10.724 -13.991 332 HD1 TYR 58 HD1 TYR 58 6.645 -9.031 -11.677 333 HD2 TYR 58 HD2 TYR 58 7.540 -7.922 -15.710 334 HE1 TYR 58 HE1 TYR 58 5.309 -6.886 -11.391 335 HE2 TYR 58 HE2 TYR 58 6.202 -5.781 -15.411 336 HH TYR 58 HH TYR 58 4.567 -5.093 -12.329 337 H GLN 59 H GLN 59 10.127 -11.964 -14.192 338 HA GLN 59 HA GLN 59 9.752 -14.048 -12.245 339 HB2 GLN 59 HB2 GLN 59 8.367 -13.967 -14.917 340 HB3 GLN 59 HB3 GLN 59 8.959 -15.516 -14.349 341 HG2 GLN 59 HG2 GLN 59 7.043 -13.661 -12.860 342 HG3 GLN 59 HG3 GLN 59 6.629 -15.187 -13.616 343 HE21 GLN 59 HE21 GLN 59 7.980 -17.092 -12.893 344 HE22 GLN 59 HE22 GLN 59 8.288 -17.255 -11.197 345 H LYS 60 H LYS 60 11.472 -15.498 -12.256 346 HA LYS 60 HA LYS 60 13.698 -14.810 -13.877 347 HB2 LYS 60 HB2 LYS 60 13.118 -16.811 -11.720 348 HB3 LYS 60 HB3 LYS 60 14.541 -17.035 -12.718 349 HG2 LYS 60 HG2 LYS 60 13.968 -14.320 -11.488 350 HG3 LYS 60 HG3 LYS 60 14.709 -15.579 -10.520 351 HD2 LYS 60 HD2 LYS 60 16.502 -15.824 -12.295 352 HD3 LYS 60 HD3 LYS 60 15.789 -14.474 -13.156 353 HE2 LYS 60 HE2 LYS 60 16.833 -14.343 -10.285 354 HE3 LYS 60 HE3 LYS 60 17.722 -13.795 -11.693 355 HZ1 LYS 60 HZ1 LYS 60 16.663 -11.928 -10.879 356 HZ2 LYS 60 HZ2 LYS 60 15.703 -12.367 -12.125 357 HZ3 LYS 60 HZ3 LYS 60 15.249 -12.692 -10.591 358 H ASP 61 H ASP 61 14.599 -15.879 -15.647 359 HA ASP 61 HA ASP 61 12.816 -17.136 -17.326 360 HB2 ASP 61 HB2 ASP 61 14.965 -15.970 -17.974 361 HB3 ASP 61 HB3 ASP 61 15.866 -17.328 -17.329 362 HD2 ASP 61 HD2 ASP 61 15.753 -17.340 -20.774 363 H ASN 62 H ASN 62 14.705 -18.289 -14.624 364 HA ASN 62 HA ASN 62 15.255 -20.865 -15.398 365 HB2 ASN 62 HB2 ASN 62 16.206 -19.984 -13.342 366 HB3 ASN 62 HB3 ASN 62 14.625 -19.618 -12.682 367 HD21 ASN 62 HD21 ASN 62 17.137 -21.634 -12.431 368 HD22 ASN 62 HD22 ASN 62 16.388 -23.079 -11.840 369 H SER 63 H SER 63 12.344 -19.345 -13.878 370 HA SER 63 HA SER 63 10.973 -21.700 -13.391 371 HB2 SER 63 HB2 SER 63 9.135 -20.322 -12.870 372 HB3 SER 63 HB3 SER 63 10.507 -19.271 -12.580 373 HG SER 63 HG SER 63 9.551 -17.930 -13.944 374 H CYS 64 H CYS 64 9.391 -22.859 -14.612 375 HA CYS 64 HA CYS 64 9.786 -22.731 -17.419 376 HB2 CYS 64 HB2 CYS 64 7.982 -24.414 -15.662 377 HB3 CYS 64 HB3 CYS 64 7.991 -24.547 -17.409 378 HG CYS 64 HG CYS 64 10.529 -25.045 -17.684 379 H ASN 65 H ASN 65 7.881 -21.004 -15.162 380 HA ASN 65 HA ASN 65 6.326 -19.506 -15.380 381 HB2 ASN 65 HB2 ASN 65 7.534 -18.934 -17.573 382 HB3 ASN 65 HB3 ASN 65 6.388 -19.964 -18.408 383 HD21 ASN 65 HD21 ASN 65 6.557 -17.260 -16.108 384 HD22 ASN 65 HD22 ASN 65 5.172 -16.392 -16.681 385 H LEU 66 H LEU 66 5.546 -22.144 -14.802 386 HA LEU 66 HA LEU 66 3.313 -22.774 -16.553 387 HB2 LEU 66 HB2 LEU 66 3.271 -24.871 -15.541 388 HB3 LEU 66 HB3 LEU 66 4.967 -24.486 -15.753 389 HG LEU 66 HG LEU 66 3.663 -23.880 -13.120 390 HD11 LEU 66 HD11 LEU 66 4.883 -26.570 -13.390 391 HD12 LEU 66 HD12 LEU 66 3.524 -26.011 -12.385 392 HD13 LEU 66 HD13 LEU 66 3.271 -26.351 -14.113 393 HD21 LEU 66 HD21 LEU 66 5.749 -23.359 -12.584 394 HD22 LEU 66 HD22 LEU 66 6.244 -25.041 -12.891 395 HD23 LEU 66 HD23 LEU 66 6.309 -23.840 -14.204 396 H PHE 67 H PHE 67 4.082 -21.526 -13.296 397 HA PHE 67 HA PHE 67 1.272 -21.523 -12.595 398 HB2 PHE 67 HB2 PHE 67 3.397 -22.034 -11.105 399 HB3 PHE 67 HB3 PHE 67 3.682 -20.305 -11.137 400 HD1 PHE 67 HD1 PHE 67 1.822 -18.780 -10.250 401 HD2 PHE 67 HD2 PHE 67 1.921 -22.964 -9.544 402 HE1 PHE 67 HE1 PHE 67 0.268 -18.488 -8.301 403 HE2 PHE 67 HE2 PHE 67 0.366 -22.671 -7.596 404 HZ PHE 67 HZ PHE 67 -0.442 -20.437 -6.997 405 H ASN 68 H ASN 68 3.984 -19.164 -13.100 406 HA ASN 68 HA ASN 68 2.067 -17.025 -12.968 407 HB2 ASN 68 HB2 ASN 68 4.959 -16.599 -13.745 408 HB3 ASN 68 HB3 ASN 68 3.929 -15.587 -12.752 409 HD21 ASN 68 HD21 ASN 68 5.975 -18.392 -12.888 410 HD22 ASN 68 HD22 ASN 68 6.143 -18.670 -11.187 411 H THR 69 H THR 69 1.591 -15.648 -14.809 412 HA THR 69 HA THR 69 2.427 -16.794 -17.388 413 HB THR 69 HB THR 69 0.255 -15.391 -18.050 414 HG1 THR 69 HG1 THR 69 -0.996 -15.870 -15.767 415 HG21 THR 69 HG21 THR 69 -1.118 -17.311 -17.727 416 HG22 THR 69 HG22 THR 69 0.518 -18.008 -17.809 417 HG23 THR 69 HG23 THR 69 -0.271 -17.772 -16.231 418 H LEU 70 H LEU 70 3.622 -15.637 -18.783 419 HA LEU 70 HA LEU 70 4.732 -13.200 -17.886 420 HB2 LEU 70 HB2 LEU 70 5.662 -15.079 -19.433 421 HB3 LEU 70 HB3 LEU 70 4.872 -14.183 -20.715 422 HG LEU 70 HG LEU 70 7.273 -13.652 -20.476 423 HD11 LEU 70 HD11 LEU 70 5.778 -11.154 -19.741 424 HD12 LEU 70 HD12 LEU 70 7.049 -11.405 -20.962 425 HD13 LEU 70 HD13 LEU 70 5.402 -12.012 -21.254 426 HD21 LEU 70 HD21 LEU 70 6.923 -11.984 -18.077 427 HD22 LEU 70 HD22 LEU 70 6.850 -13.737 -17.780 428 HD23 LEU 70 HD23 LEU 70 8.277 -13.027 -18.572 429 H THR 71 H THR 71 1.987 -14.103 -19.960 430 HA THR 71 HA THR 71 1.644 -11.672 -21.281 431 HB THR 71 HB THR 71 -0.254 -13.898 -20.388 432 HG1 THR 71 HG1 THR 71 0.312 -14.603 -22.469 433 HG21 THR 71 HG21 THR 71 -0.908 -12.127 -22.717 434 HG22 THR 71 HG22 THR 71 -2.004 -12.930 -21.566 435 HG23 THR 71 HG23 THR 71 -1.185 -11.417 -21.109 436 H GLU 72 H GLU 72 0.844 -12.670 -17.957 437 HA GLU 72 HA GLU 72 -0.942 -10.643 -17.414 438 HB2 GLU 72 HB2 GLU 72 0.880 -12.391 -15.775 439 HB3 GLU 72 HB3 GLU 72 0.127 -11.025 -14.977 440 HG2 GLU 72 HG2 GLU 72 -2.099 -11.909 -16.097 441 HG3 GLU 72 HG3 GLU 72 -1.211 -13.406 -16.298 442 HE2 GLU 72 HE2 GLU 72 -2.825 -12.699 -12.856 443 H ALA 73 H ALA 73 2.657 -10.789 -16.968 444 HA ALA 73 HA ALA 73 2.900 -8.218 -15.896 445 HB1 ALA 73 HB1 ALA 73 4.878 -9.253 -15.554 446 HB2 ALA 73 HB2 ALA 73 4.615 -10.380 -16.906 447 HB3 ALA 73 HB3 ALA 73 5.288 -8.762 -17.215 448 H ARG 74 H ARG 74 3.062 -9.485 -19.279 449 HA ARG 74 HA ARG 74 3.854 -7.195 -20.495 450 HB2 ARG 74 HB2 ARG 74 3.509 -9.486 -21.554 451 HB3 ARG 74 HB3 ARG 74 1.785 -9.172 -21.579 452 HG2 ARG 74 HG2 ARG 74 2.316 -7.031 -22.914 453 HG3 ARG 74 HG3 ARG 74 3.958 -7.626 -23.059 454 HD2 ARG 74 HD2 ARG 74 3.015 -9.769 -24.077 455 HD3 ARG 74 HD3 ARG 74 1.431 -9.020 -24.065 456 HE ARG 74 HE ARG 74 2.920 -7.128 -25.374 457 HH11 ARG 74 HH22 ARG 74 2.621 -10.607 -25.814 458 HH12 ARG 74 HH21 ARG 74 2.948 -10.548 -27.514 459 HH21 ARG 74 HH12 ARG 74 3.350 -7.051 -27.617 460 HH22 ARG 74 HH11 ARG 74 3.365 -8.512 -28.546 461 H ASP 75 H ASP 75 0.539 -8.261 -19.531 462 HA ASP 75 HA ASP 75 -0.701 -6.022 -20.714 463 HB2 ASP 75 HB2 ASP 75 -1.762 -8.293 -20.159 464 HB3 ASP 75 HB3 ASP 75 -1.760 -7.806 -18.475 465 HD2 ASP 75 HD2 ASP 75 -4.142 -6.177 -21.202 466 H ALA 76 H ALA 76 0.721 -6.886 -17.557 467 HA ALA 76 HA ALA 76 -0.498 -4.960 -15.961 468 HB1 ALA 76 HB1 ALA 76 1.313 -7.013 -15.639 469 HB2 ALA 76 HB2 ALA 76 2.331 -5.578 -15.370 470 HB3 ALA 76 HB3 ALA 76 0.874 -5.833 -14.381 471 H ILE 77 H ILE 77 2.608 -4.870 -17.839 472 HA ILE 77 HA ILE 77 3.070 -2.148 -17.164 473 HB ILE 77 HB ILE 77 4.299 -3.761 -19.396 474 HG12 ILE 77 HG12 ILE 77 5.615 -3.596 -16.728 475 HG13 ILE 77 HG13 ILE 77 4.245 -4.680 -16.869 476 HG21 ILE 77 HG21 ILE 77 5.196 -1.325 -17.842 477 HG22 ILE 77 HG22 ILE 77 6.269 -2.289 -18.885 478 HG23 ILE 77 HG23 ILE 77 4.861 -1.454 -19.585 479 HD11 ILE 77 HD11 ILE 77 6.717 -4.687 -18.663 480 HD12 ILE 77 HD12 ILE 77 6.328 -5.881 -17.401 481 HD13 ILE 77 HD13 ILE 77 5.312 -5.763 -18.859 482 H LYS 78 H LYS 78 1.971 -3.867 -20.166 483 HA LYS 78 HA LYS 78 1.616 -1.621 -21.719 484 HB2 LYS 78 HB2 LYS 78 1.580 -3.934 -22.549 485 HB3 LYS 78 HB3 LYS 78 0.055 -4.221 -21.737 486 HG2 LYS 78 HG2 LYS 78 -0.780 -3.630 -23.812 487 HG3 LYS 78 HG3 LYS 78 -0.686 -2.026 -23.113 488 HD2 LYS 78 HD2 LYS 78 0.394 -1.763 -25.202 489 HD3 LYS 78 HD3 LYS 78 1.733 -1.934 -24.083 490 HE2 LYS 78 HE2 LYS 78 2.232 -4.127 -24.790 491 HE3 LYS 78 HE3 LYS 78 0.603 -4.431 -25.360 492 HZ1 LYS 78 HZ1 LYS 78 2.619 -2.720 -26.630 493 HZ2 LYS 78 HZ2 LYS 78 1.969 -4.096 -27.222 494 HZ3 LYS 78 HZ3 LYS 78 1.055 -2.749 -27.100 495 H ASP 79 H ASP 79 -0.287 -2.873 -19.013 496 HA ASP 79 HA ASP 79 -2.609 -1.427 -19.654 497 HB2 ASP 79 HB2 ASP 79 -2.899 -3.266 -18.176 498 HB3 ASP 79 HB3 ASP 79 -1.526 -2.811 -17.187 499 HD2 ASP 79 HD2 ASP 79 -1.928 -1.658 -15.479 500 H ALA 80 H ALA 80 0.176 -0.990 -17.356 501 HA ALA 80 HA ALA 80 -0.682 1.394 -16.213 502 HB1 ALA 80 HB1 ALA 80 1.098 0.741 -14.997 503 HB2 ALA 80 HB2 ALA 80 1.718 -0.271 -16.324 504 HB3 ALA 80 HB3 ALA 80 2.120 1.462 -16.263 505 H TYR 81 H TYR 81 1.321 0.725 -19.148 506 HA TYR 81 HA TYR 81 1.938 3.383 -19.719 507 HB2 TYR 81 HB2 TYR 81 1.582 0.738 -21.212 508 HB3 TYR 81 HB3 TYR 81 1.930 2.181 -22.144 509 HD1 TYR 81 HD2 TYR 81 3.246 0.800 -18.901 510 HD2 TYR 81 HD1 TYR 81 4.138 2.233 -22.833 511 HE1 TYR 81 HE2 TYR 81 5.730 0.496 -18.456 512 HE2 TYR 81 HE1 TYR 81 6.620 1.924 -22.374 513 HH TYR 81 HH TYR 81 7.752 0.160 -19.701 514 H GLU 82 H GLU 82 -0.797 1.279 -20.837 515 HA GLU 82 HA GLU 82 -1.878 3.319 -22.438 516 HB2 GLU 82 HB2 GLU 82 -2.254 0.841 -22.747 517 HB3 GLU 82 HB3 GLU 82 -3.258 0.844 -21.310 518 HG2 GLU 82 HG2 GLU 82 -4.671 1.029 -23.319 519 HG3 GLU 82 HG3 GLU 82 -4.795 2.495 -22.367 520 HE2 GLU 82 HE2 GLU 82 -2.094 2.938 -25.206 521 H SER 83 H SER 83 -2.009 2.532 -19.021 522 HA SER 83 HA SER 83 -4.481 3.714 -18.476 523 HB2 SER 83 HB2 SER 83 -3.464 2.168 -16.896 524 HB3 SER 83 HB3 SER 83 -2.035 3.171 -16.744 525 HG SER 83 HG SER 83 -4.207 3.263 -15.217 526 H TYR 84 H TYR 84 -1.057 4.898 -18.344 527 HA TYR 84 HA TYR 84 -2.054 7.594 -17.819 528 HB2 TYR 84 HB2 TYR 84 0.651 6.130 -17.843 529 HB3 TYR 84 HB3 TYR 84 0.567 7.869 -17.646 530 HD1 TYR 84 HD2 TYR 84 -0.218 4.620 -16.076 531 HD2 TYR 84 HD1 TYR 84 -0.154 8.867 -15.560 532 HE1 TYR 84 HE2 TYR 84 -0.539 4.328 -13.571 533 HE2 TYR 84 HE1 TYR 84 -0.475 8.560 -13.057 534 HH TYR 84 HH TYR 84 0.045 5.707 -11.510 535 H CYS 85 H CYS 85 -1.439 5.615 -20.469 536 HA CYS 85 HA CYS 85 0.167 7.015 -22.140 537 HB2 CYS 85 HB2 CYS 85 -0.560 4.987 -22.991 538 HB3 CYS 85 HB3 CYS 85 -2.239 5.278 -22.582 539 HG CYS 85 HG CYS 85 -2.952 6.245 -24.626 540 H GLY 86 H GLY 86 -0.100 8.822 -23.554 541 HA2 GLY 86 HA2 GLY 86 -1.413 10.459 -24.615 542 HA3 GLY 86 HA3 GLY 86 -2.656 10.267 -23.395 543 H ILE 87 H ILE 87 0.320 10.144 -21.793 544 HA ILE 87 HA ILE 87 0.347 13.054 -21.417 545 HB ILE 87 HB ILE 87 0.479 12.853 -19.100 546 HG12 ILE 87 HG12 ILE 87 1.123 9.959 -19.605 547 HG13 ILE 87 HG13 ILE 87 2.020 11.150 -18.683 548 HG21 ILE 87 HG21 ILE 87 -1.493 10.668 -19.374 549 HG22 ILE 87 HG22 ILE 87 -1.656 12.290 -18.661 550 HG23 ILE 87 HG23 ILE 87 -1.753 12.080 -20.426 551 HD11 ILE 87 HD11 ILE 87 -0.498 9.660 -17.906 552 HD12 ILE 87 HD12 ILE 87 1.016 9.857 -16.991 553 HD13 ILE 87 HD13 ILE 87 -0.117 11.221 -17.141 554 H ASP 88 H ASP 88 2.247 13.830 -22.144 555 HA ASP 88 HA ASP 88 4.484 12.001 -22.168 556 HB2 ASP 88 HB2 ASP 88 5.500 14.146 -23.396 557 HB3 ASP 88 HB3 ASP 88 4.448 13.032 -24.245 558 HD2 ASP 88 HD2 ASP 88 4.290 16.638 -23.879 559 H ASP 89 H ASP 89 3.080 14.556 -20.321 560 HA ASP 89 HA ASP 89 5.487 14.746 -18.767 561 HB2 ASP 89 HB2 ASP 89 4.197 17.061 -20.229 562 HB3 ASP 89 HB3 ASP 89 4.933 17.359 -18.667 563 HD2 ASP 89 HD2 ASP 89 6.454 18.687 -20.578 564 H CYS 90 H CYS 90 4.888 14.791 -16.570 565 HA CYS 90 HA CYS 90 2.320 14.332 -15.791 566 HB2 CYS 90 HB2 CYS 90 3.624 13.808 -14.036 567 HB3 CYS 90 HB3 CYS 90 4.855 14.978 -14.467 568 HA PRO 91 HA PRO 91 0.829 18.459 -16.441 569 HB2 PRO 91 HB2 PRO 91 -1.832 17.836 -16.474 570 HB3 PRO 91 HB3 PRO 91 -0.819 17.790 -17.904 571 HG2 PRO 91 HG2 PRO 91 -1.859 15.538 -16.296 572 HG3 PRO 91 HG3 PRO 91 -1.222 15.520 -17.928 573 HD2 PRO 91 HD2 PRO 91 0.125 14.648 -15.551 574 HD3 PRO 91 HD3 PRO 91 0.801 14.738 -17.165 575 H GLN 92 H GLN 92 0.337 16.314 -13.867 576 HA GLN 92 HA GLN 92 -1.331 17.824 -12.299 577 HB2 GLN 92 HB2 GLN 92 -0.350 15.418 -11.976 578 HB3 GLN 92 HB3 GLN 92 0.979 16.219 -11.161 579 HG2 GLN 92 HG2 GLN 92 -0.655 15.595 -9.473 580 HG3 GLN 92 HG3 GLN 92 -0.686 17.341 -9.625 581 HE21 GLN 92 HE21 GLN 92 -2.395 14.392 -9.982 582 HE22 GLN 92 HE22 GLN 92 -3.930 15.020 -10.482 583 H CYS 93 H CYS 93 2.075 18.256 -13.134 584 HA CYS 93 HA CYS 93 2.644 19.987 -10.951 585 HB2 CYS 93 HB2 CYS 93 4.086 19.013 -13.369 586 HB3 CYS 93 HB3 CYS 93 4.606 20.555 -12.718 587 H SER 94 H SER 94 1.402 20.222 -14.290 588 HA SER 94 HA SER 94 1.612 23.090 -14.225 589 HB2 SER 94 HB2 SER 94 2.046 22.409 -16.392 590 HB3 SER 94 HB3 SER 94 1.007 21.002 -16.280 591 HG SER 94 HG SER 94 0.258 22.827 -17.700 592 H LYS 95 H LYS 95 -0.506 20.696 -13.083 593 HA LYS 95 HA LYS 95 -2.899 22.291 -13.553 594 HB2 LYS 95 HB2 LYS 95 -2.307 19.460 -13.012 595 HB3 LYS 95 HB3 LYS 95 -3.661 20.082 -12.091 596 HG2 LYS 95 HG2 LYS 95 -3.346 20.390 -15.115 597 HG3 LYS 95 HG3 LYS 95 -4.321 19.155 -14.344 598 HD2 LYS 95 HD2 LYS 95 -4.900 21.902 -13.373 599 HD3 LYS 95 HD3 LYS 95 -5.221 21.681 -15.081 600 HE2 LYS 95 HE2 LYS 95 -7.263 21.075 -13.995 601 HE3 LYS 95 HE3 LYS 95 -6.523 19.548 -14.437 602 HZ1 LYS 95 HZ1 LYS 95 -5.879 19.174 -12.269 603 HZ2 LYS 95 HZ2 LYS 95 -6.023 20.736 -11.814 604 HZ3 LYS 95 HZ3 LYS 95 -7.360 19.837 -12.083 605 H TYR 96 H TYR 96 -0.572 21.322 -11.039 606 HA TYR 96 HA TYR 96 -2.082 23.006 -9.154 607 HB2 TYR 96 HB2 TYR 96 -1.702 20.365 -8.887 608 HB3 TYR 96 HB3 TYR 96 -0.047 20.804 -8.513 609 HD1 TYR 96 HD2 TYR 96 -3.471 22.000 -7.508 610 HD2 TYR 96 HD1 TYR 96 0.454 20.845 -6.257 611 HE1 TYR 96 HE2 TYR 96 -4.119 22.398 -5.082 612 HE2 TYR 96 HE1 TYR 96 -0.207 21.247 -3.835 613 HH TYR 96 HH TYR 96 -1.838 22.602 -2.618 614 H ILE 97 H ILE 97 -0.349 23.555 -7.216 615 HA ILE 97 HA ILE 97 1.419 25.377 -8.418 616 HB ILE 97 HB ILE 97 1.143 24.386 -5.581 617 HG12 ILE 97 HG12 ILE 97 0.226 27.021 -6.745 618 HG13 ILE 97 HG13 ILE 97 -0.798 25.598 -6.734 619 HG21 ILE 97 HG21 ILE 97 2.353 26.567 -5.050 620 HG22 ILE 97 HG22 ILE 97 3.337 25.225 -5.680 621 HG23 ILE 97 HG23 ILE 97 2.871 26.567 -6.753 622 HD11 ILE 97 HD11 ILE 97 -0.074 27.391 -4.519 623 HD12 ILE 97 HD12 ILE 97 -1.414 26.226 -4.640 624 HD13 ILE 97 HD13 ILE 97 0.196 25.679 -4.115 625 H ASP 98 H ASP 98 3.766 25.429 -8.337 626 HA ASP 98 HA ASP 98 4.804 22.760 -8.690 627 HB2 ASP 98 HB2 ASP 98 5.399 24.203 -10.487 628 HB3 ASP 98 HB3 ASP 98 5.729 25.552 -9.419 629 HD2 ASP 98 HD2 ASP 98 7.930 22.710 -8.485 630 H ASP 99 H ASP 99 5.435 21.910 -6.671 631 HA ASP 99 HA ASP 99 6.340 21.751 -4.700 632 HB2 ASP 99 HB2 ASP 99 8.656 22.286 -4.548 633 HB3 ASP 99 HB3 ASP 99 8.369 22.046 -6.260 634 HD2 ASP 99 HD2 ASP 99 9.023 25.345 -7.083 Start of MODEL 11 1 H GLU 14 H GLU 14 1.627 2.686 -4.749 2 HA GLU 14 HA GLU 14 -1.033 2.735 -3.649 3 HB2 GLU 14 HB2 GLU 14 0.157 3.180 -6.396 4 HB3 GLU 14 HB3 GLU 14 -1.561 2.876 -6.236 5 HG2 GLU 14 HG2 GLU 14 -1.332 5.259 -6.151 6 HG3 GLU 14 HG3 GLU 14 -1.629 4.765 -4.496 7 HE2 GLU 14 HE2 GLU 14 -0.416 6.431 -3.560 8 H ASP 15 H ASP 15 1.027 0.708 -5.828 9 HA ASP 15 HA ASP 15 -0.626 -1.534 -5.069 10 HB2 ASP 15 HB2 ASP 15 0.073 -0.823 -7.957 11 HB3 ASP 15 HB3 ASP 15 -0.658 -2.336 -7.461 12 HD2 ASP 15 HD2 ASP 15 -2.510 -1.773 -5.959 13 H GLN 16 H GLN 16 0.537 -3.660 -5.711 14 HA GLN 16 HA GLN 16 3.242 -3.438 -5.031 15 HB2 GLN 16 HB2 GLN 16 1.473 -5.722 -5.956 16 HB3 GLN 16 HB3 GLN 16 3.188 -5.970 -5.698 17 HG2 GLN 16 HG2 GLN 16 1.758 -6.501 -3.677 18 HG3 GLN 16 HG3 GLN 16 3.026 -5.333 -3.363 19 HE21 GLN 16 HE21 GLN 16 2.370 -3.832 -2.040 20 HE22 GLN 16 HE22 GLN 16 0.837 -3.027 -2.033 21 H GLU 17 H GLU 17 1.473 -4.031 -8.116 22 HA GLU 17 HA GLU 17 3.654 -4.670 -9.654 23 HB2 GLU 17 HB2 GLU 17 1.051 -4.632 -10.149 24 HB3 GLU 17 HB3 GLU 17 1.374 -3.025 -10.770 25 HG2 GLU 17 HG2 GLU 17 3.187 -5.261 -11.667 26 HG3 GLU 17 HG3 GLU 17 1.564 -5.217 -12.327 27 HE2 GLU 17 HE2 GLU 17 4.442 -2.709 -13.198 28 H GLN 18 H GLN 18 2.162 -1.443 -8.950 29 HA GLN 18 HA GLN 18 3.778 0.034 -10.594 30 HB2 GLN 18 HB2 GLN 18 1.695 0.730 -9.220 31 HB3 GLN 18 HB3 GLN 18 2.794 0.993 -7.881 32 HG2 GLN 18 HG2 GLN 18 4.069 2.649 -9.167 33 HG3 GLN 18 HG3 GLN 18 3.160 2.288 -10.621 34 HE21 GLN 18 HE21 GLN 18 0.635 2.259 -10.051 35 HE22 GLN 18 HE22 GLN 18 0.056 3.725 -9.332 36 H TRP 19 H TRP 19 4.415 -1.425 -7.418 37 HA TRP 19 HA TRP 19 6.708 0.132 -6.830 38 HB2 TRP 19 HB2 TRP 19 5.799 -0.802 -4.955 39 HB3 TRP 19 HB3 TRP 19 5.405 -2.316 -5.745 40 HD1 TRP 19 HD1 TRP 19 8.502 -0.503 -4.249 41 HE1 TRP 19 HE1 TRP 19 10.341 -2.245 -3.509 42 HE3 TRP 19 HE3 TRP 19 6.127 -4.593 -6.116 43 HZ2 TRP 19 HZ2 TRP 19 10.590 -5.075 -3.782 44 HZ3 TRP 19 HZ3 TRP 19 7.237 -6.808 -5.837 45 HH2 TRP 19 HH2 TRP 19 9.391 -7.087 -4.717 46 H ALA 20 H ALA 20 6.092 -3.124 -8.301 47 HA ALA 20 HA ALA 20 8.741 -3.854 -8.651 48 HB1 ALA 20 HB1 ALA 20 6.156 -4.817 -9.300 49 HB2 ALA 20 HB2 ALA 20 7.062 -4.763 -10.831 50 HB3 ALA 20 HB3 ALA 20 7.705 -5.681 -9.448 51 H MET 21 H MET 21 6.677 -1.556 -10.397 52 HA MET 21 HA MET 21 8.009 -1.463 -12.782 53 HB2 MET 21 HB2 MET 21 5.925 -0.098 -11.544 54 HB3 MET 21 HB3 MET 21 7.140 1.161 -11.624 55 HG2 MET 21 HG2 MET 21 7.414 0.380 -14.144 56 HG3 MET 21 HG3 MET 21 5.840 -0.353 -13.909 57 HE1 MET 21 HE1 MET 21 3.752 0.705 -13.626 58 HE2 MET 21 HE2 MET 21 3.404 2.352 -14.204 59 HE3 MET 21 HE3 MET 21 4.121 1.155 -15.308 60 H GLN 22 H GLN 22 9.122 -0.559 -9.619 61 HA GLN 22 HA GLN 22 10.668 1.552 -9.875 62 HB2 GLN 22 HB2 GLN 22 12.384 0.260 -8.416 63 HB3 GLN 22 HB3 GLN 22 10.750 0.424 -7.804 64 HG2 GLN 22 HG2 GLN 22 10.479 -1.899 -9.234 65 HG3 GLN 22 HG3 GLN 22 12.172 -2.016 -8.799 66 HE21 GLN 22 HE21 GLN 22 11.964 -0.501 -6.364 67 HE22 GLN 22 HE22 GLN 22 11.168 -1.485 -5.181 68 H THR 23 H THR 23 11.915 -1.771 -10.705 69 HA THR 23 HA THR 23 14.114 -0.617 -12.157 70 HB THR 23 HB THR 23 13.287 -3.538 -12.196 71 HG1 THR 23 HG1 THR 23 13.844 -3.615 -9.997 72 HG21 THR 23 HG21 THR 23 15.498 -2.518 -13.216 73 HG22 THR 23 HG22 THR 23 15.993 -2.321 -11.518 74 HG23 THR 23 HG23 THR 23 15.637 -3.943 -12.158 75 H LEU 24 H LEU 24 11.322 -2.749 -13.081 76 HA LEU 24 HA LEU 24 11.621 -2.918 -15.700 77 HB2 LEU 24 HB2 LEU 24 9.742 -3.845 -14.539 78 HB3 LEU 24 HB3 LEU 24 9.101 -2.254 -14.180 79 HG LEU 24 HG LEU 24 9.466 -3.001 -17.054 80 HD11 LEU 24 HD11 LEU 24 6.919 -3.832 -15.727 81 HD12 LEU 24 HD12 LEU 24 7.690 -4.433 -17.215 82 HD13 LEU 24 HD13 LEU 24 8.332 -4.909 -15.625 83 HD21 LEU 24 HD21 LEU 24 7.411 -1.656 -17.301 84 HD22 LEU 24 HD22 LEU 24 7.388 -1.396 -15.540 85 HD23 LEU 24 HD23 LEU 24 8.732 -0.756 -16.517 86 H MET 25 H MET 25 9.837 -0.089 -14.266 87 HA MET 25 HA MET 25 10.084 1.329 -16.692 88 HB2 MET 25 HB2 MET 25 8.210 2.064 -15.510 89 HB3 MET 25 HB3 MET 25 8.938 1.728 -13.951 90 HG2 MET 25 HG2 MET 25 10.302 3.777 -14.085 91 HG3 MET 25 HG3 MET 25 9.755 4.082 -15.722 92 HE1 MET 25 HE1 MET 25 7.307 5.512 -16.170 93 HE2 MET 25 HE2 MET 25 7.214 3.735 -16.213 94 HE3 MET 25 HE3 MET 25 5.986 4.670 -15.327 95 H GLY 26 H GLY 26 11.918 1.147 -13.645 96 HA2 GLY 26 HA2 GLY 26 13.332 3.527 -13.730 97 HA3 GLY 26 HA3 GLY 26 13.896 2.020 -13.036 98 H SER 27 H SER 27 13.397 0.833 -15.950 99 HA SER 27 HA SER 27 16.064 0.927 -16.687 100 HB2 SER 27 HB2 SER 27 14.474 -0.894 -17.295 101 HB3 SER 27 HB3 SER 27 13.620 0.200 -18.363 102 HG SER 27 HG SER 27 16.356 0.152 -18.887 103 H GLY 28 H GLY 28 13.586 3.269 -17.005 104 HA2 GLY 28 HA2 GLY 28 13.883 5.399 -17.830 105 HA3 GLY 28 HA3 GLY 28 15.253 4.863 -18.782 106 H VAL 29 H VAL 29 12.350 2.869 -18.863 107 HA VAL 29 HA VAL 29 12.094 3.306 -21.664 108 HB VAL 29 HB VAL 29 10.658 1.682 -19.581 109 HG11 VAL 29 HG11 VAL 29 8.866 2.331 -21.020 110 HG12 VAL 29 HG12 VAL 29 9.854 2.073 -22.478 111 HG13 VAL 29 HG13 VAL 29 9.340 0.682 -21.493 112 HG21 VAL 29 HG21 VAL 29 12.952 1.222 -21.010 113 HG22 VAL 29 HG22 VAL 29 11.911 -0.042 -20.312 114 HG23 VAL 29 HG23 VAL 29 11.728 0.419 -22.022 115 H LEU 30 H LEU 30 10.190 4.179 -18.716 116 HA LEU 30 HA LEU 30 8.493 5.841 -20.419 117 HB2 LEU 30 HB2 LEU 30 8.199 4.584 -17.721 118 HB3 LEU 30 HB3 LEU 30 7.278 6.028 -18.096 119 HG LEU 30 HG LEU 30 7.214 3.570 -19.855 120 HD11 LEU 30 HD11 LEU 30 5.543 4.210 -17.420 121 HD12 LEU 30 HD12 LEU 30 5.008 3.092 -18.698 122 HD13 LEU 30 HD13 LEU 30 6.484 2.739 -17.768 123 HD21 LEU 30 HD21 LEU 30 5.995 4.853 -21.188 124 HD22 LEU 30 HD22 LEU 30 4.783 5.011 -19.894 125 HD23 LEU 30 HD23 LEU 30 6.095 6.206 -20.037 126 H ALA 31 H ALA 31 7.750 7.938 -19.004 127 HA ALA 31 HA ALA 31 10.290 9.219 -18.260 128 HB1 ALA 31 HB1 ALA 31 9.698 10.560 -19.993 129 HB2 ALA 31 HB2 ALA 31 8.009 9.996 -19.977 130 HB3 ALA 31 HB3 ALA 31 8.537 11.258 -18.839 131 H ARG 32 H ARG 32 10.425 10.299 -16.295 132 HA ARG 32 HA ARG 32 7.981 10.222 -14.717 133 HB2 ARG 32 HB2 ARG 32 9.383 9.742 -12.710 134 HB3 ARG 32 HB3 ARG 32 9.556 8.484 -13.917 135 HG2 ARG 32 HG2 ARG 32 11.801 8.841 -13.508 136 HG3 ARG 32 HG3 ARG 32 11.584 10.065 -14.743 137 HD2 ARG 32 HD2 ARG 32 12.523 11.426 -13.129 138 HD3 ARG 32 HD3 ARG 32 10.861 11.550 -12.590 139 HE ARG 32 HE ARG 32 11.407 10.297 -10.689 140 HH11 ARG 32 HH22 ARG 32 13.925 9.873 -13.111 141 HH12 ARG 32 HH21 ARG 32 14.976 8.996 -12.049 142 HH21 ARG 32 HH12 ARG 32 12.793 9.140 -9.288 143 HH22 ARG 32 HH11 ARG 32 14.328 8.576 -9.860 144 H CYS 33 H CYS 33 7.445 12.166 -13.699 145 HA CYS 33 HA CYS 33 8.844 14.473 -14.443 146 HB2 CYS 33 HB2 CYS 33 6.324 14.024 -13.629 147 HB3 CYS 33 HB3 CYS 33 6.993 14.560 -12.101 148 H ARG 34 H ARG 34 10.588 15.474 -13.464 149 HA ARG 34 HA ARG 34 11.969 14.164 -11.478 150 HB2 ARG 34 HB2 ARG 34 13.460 16.090 -11.497 151 HB3 ARG 34 HB3 ARG 34 12.901 15.845 -13.139 152 HG2 ARG 34 HG2 ARG 34 11.477 17.758 -11.245 153 HG3 ARG 34 HG3 ARG 34 12.856 18.272 -12.198 154 HD2 ARG 34 HD2 ARG 34 10.142 17.321 -13.186 155 HD3 ARG 34 HD3 ARG 34 10.947 18.840 -13.527 156 HE ARG 34 HE ARG 34 11.300 16.363 -14.969 157 HH11 ARG 34 HH22 ARG 34 13.062 19.210 -13.888 158 HH12 ARG 34 HH21 ARG 34 14.238 19.122 -15.157 159 HH21 ARG 34 HH12 ARG 34 12.851 16.245 -16.643 160 HH22 ARG 34 HH11 ARG 34 14.117 17.423 -16.734 161 H ILE 35 H ILE 35 9.171 16.182 -11.311 162 HA ILE 35 HA ILE 35 9.726 17.144 -8.640 163 HB ILE 35 HB ILE 35 7.410 17.464 -10.542 164 HG12 ILE 35 HG12 ILE 35 8.473 19.946 -9.831 165 HG13 ILE 35 HG13 ILE 35 9.882 18.922 -10.020 166 HG21 ILE 35 HG21 ILE 35 7.707 18.661 -7.774 167 HG22 ILE 35 HG22 ILE 35 6.408 18.996 -8.944 168 HG23 ILE 35 HG23 ILE 35 6.569 17.372 -8.232 169 HD11 ILE 35 HD11 ILE 35 9.592 19.563 -12.230 170 HD12 ILE 35 HD12 ILE 35 8.557 18.114 -12.221 171 HD13 ILE 35 HD13 ILE 35 7.828 19.730 -12.059 172 H HIS 36 H HIS 36 8.379 14.357 -10.219 173 HA HIS 36 HA HIS 36 7.822 13.201 -7.676 174 HB2 HIS 36 HB2 HIS 36 5.423 12.564 -8.564 175 HB3 HIS 36 HB3 HIS 36 5.703 14.028 -7.643 176 HD1 HIS 36 HD1 HIS 36 5.327 12.901 -11.275 177 HD2 HIS 36 HD2 HIS 36 4.976 16.357 -8.925 178 HE1 HIS 36 HE1 HIS 36 4.344 14.701 -12.793 179 H ASN 37 H ASN 37 8.736 11.224 -7.865 180 HA ASN 37 HA ASN 37 8.985 10.140 -10.520 181 HB2 ASN 37 HB2 ASN 37 10.676 8.710 -9.596 182 HB3 ASN 37 HB3 ASN 37 10.887 10.230 -8.749 183 HD21 ASN 37 HD21 ASN 37 9.783 6.939 -8.568 184 HD22 ASN 37 HD22 ASN 37 9.630 6.814 -6.848 185 H ASP 38 H ASP 38 6.824 10.051 -7.892 186 HA ASP 38 HA ASP 38 6.266 7.266 -7.949 187 HB2 ASP 38 HB2 ASP 38 4.678 9.613 -6.806 188 HB3 ASP 38 HB3 ASP 38 4.321 7.926 -6.498 189 HD2 ASP 38 HD2 ASP 38 7.123 7.582 -4.351 190 H VAL 39 H VAL 39 5.857 9.616 -10.222 191 HA VAL 39 HA VAL 39 3.162 8.730 -10.982 192 HB VAL 39 HB VAL 39 4.674 11.183 -11.892 193 HG11 VAL 39 HG11 VAL 39 2.986 10.514 -13.480 194 HG12 VAL 39 HG12 VAL 39 1.780 10.319 -12.185 195 HG13 VAL 39 HG13 VAL 39 2.395 11.939 -12.591 196 HG21 VAL 39 HG21 VAL 39 4.215 11.210 -9.437 197 HG22 VAL 39 HG22 VAL 39 3.362 12.486 -10.338 198 HG23 VAL 39 HG23 VAL 39 2.481 11.036 -9.798 199 H ILE 40 H ILE 40 2.797 8.296 -13.298 200 HA ILE 40 HA ILE 40 5.285 7.525 -14.655 201 HB ILE 40 HB ILE 40 4.598 5.448 -14.142 202 HG12 ILE 40 HG12 ILE 40 2.676 5.912 -16.436 203 HG13 ILE 40 HG13 ILE 40 4.412 5.791 -16.641 204 HG21 ILE 40 HG21 ILE 40 2.826 5.917 -12.664 205 HG22 ILE 40 HG22 ILE 40 1.794 6.556 -13.966 206 HG23 ILE 40 HG23 ILE 40 2.147 4.813 -13.884 207 HD11 ILE 40 HD11 ILE 40 3.419 3.593 -17.030 208 HD12 ILE 40 HD12 ILE 40 4.353 3.532 -15.516 209 HD13 ILE 40 HD13 ILE 40 2.578 3.655 -15.463 210 H LEU 41 H LEU 41 5.551 8.741 -16.441 211 HA LEU 41 HA LEU 41 3.101 9.624 -17.802 212 HB2 LEU 41 HB2 LEU 41 5.801 10.971 -17.642 213 HB3 LEU 41 HB3 LEU 41 4.445 11.530 -18.602 214 HG LEU 41 HG LEU 41 4.114 11.158 -15.638 215 HD11 LEU 41 HD11 LEU 41 4.682 13.854 -15.957 216 HD12 LEU 41 HD12 LEU 41 5.727 12.628 -15.199 217 HD13 LEU 41 HD13 LEU 41 5.937 13.036 -16.919 218 HD21 LEU 41 HD21 LEU 41 2.819 13.469 -16.581 219 HD22 LEU 41 HD22 LEU 41 2.553 12.218 -17.818 220 HD23 LEU 41 HD23 LEU 41 2.086 11.912 -16.128 221 H ASP 42 H ASP 42 2.919 9.299 -20.025 222 HA ASP 42 HA ASP 42 4.235 7.124 -21.046 223 HB2 ASP 42 HB2 ASP 42 2.924 7.467 -22.929 224 HB3 ASP 42 HB3 ASP 42 2.060 8.484 -21.792 225 HD2 ASP 42 HD2 ASP 42 4.596 8.877 -24.296 226 H SER 43 H SER 43 6.251 6.909 -22.065 227 HA SER 43 HA SER 43 7.767 9.339 -22.389 228 HB2 SER 43 HB2 SER 43 8.956 7.635 -21.215 229 HB3 SER 43 HB3 SER 43 8.463 6.386 -22.342 230 HG SER 43 HG SER 43 9.946 8.550 -23.431 231 H GLY 44 H GLY 44 6.883 6.358 -24.277 232 HA2 GLY 44 HA2 GLY 44 6.086 6.491 -26.490 233 HA3 GLY 44 HA3 GLY 44 6.967 7.987 -26.726 234 H ASN 45 H ASN 45 9.097 6.156 -24.964 235 HA ASN 45 HA ASN 45 10.595 5.558 -27.304 236 HB2 ASN 45 HB2 ASN 45 11.047 5.466 -24.318 237 HB3 ASN 45 HB3 ASN 45 12.100 4.482 -25.314 238 HD21 ASN 45 HD21 ASN 45 13.170 5.536 -27.148 239 HD22 ASN 45 HD22 ASN 45 13.709 7.174 -26.991 240 H ASP 46 H ASP 46 11.738 3.261 -27.369 241 HA ASP 46 HA ASP 46 9.883 1.348 -27.788 242 HB2 ASP 46 HB2 ASP 46 12.840 1.298 -27.174 243 HB3 ASP 46 HB3 ASP 46 11.991 -0.233 -27.242 244 HD2 ASP 46 HD2 ASP 46 13.722 1.033 -30.086 245 H ALA 47 H ALA 47 8.436 0.540 -26.252 246 HA ALA 47 HA ALA 47 9.120 0.510 -23.478 247 HB1 ALA 47 HB1 ALA 47 6.848 1.017 -24.281 248 HB2 ALA 47 HB2 ALA 47 6.735 -0.602 -25.012 249 HB3 ALA 47 HB3 ALA 47 6.841 -0.430 -23.244 250 H SER 48 H SER 48 9.765 -1.531 -26.153 251 HA SER 48 HA SER 48 9.405 -4.032 -25.151 252 HB2 SER 48 HB2 SER 48 10.950 -4.769 -26.814 253 HB3 SER 48 HB3 SER 48 10.210 -3.325 -27.475 254 HG SER 48 HG SER 48 12.188 -2.212 -26.382 255 H SER 49 H SER 49 11.857 -1.578 -24.361 256 HA SER 49 HA SER 49 13.689 -3.297 -23.169 257 HB2 SER 49 HB2 SER 49 13.176 -0.374 -23.276 258 HB3 SER 49 HB3 SER 49 13.998 -0.896 -21.819 259 HG SER 49 HG SER 49 15.019 -2.066 -24.155 260 H ALA 50 H ALA 50 10.896 -1.386 -21.883 261 HA ALA 50 HA ALA 50 11.308 -2.079 -19.192 262 HB1 ALA 50 HB1 ALA 50 9.972 -0.168 -19.749 263 HB2 ALA 50 HB2 ALA 50 8.898 -1.137 -20.786 264 HB3 ALA 50 HB3 ALA 50 8.869 -1.359 -19.021 265 H TYR 51 H TYR 51 9.715 -3.679 -21.953 266 HA TYR 51 HA TYR 51 8.311 -5.578 -20.380 267 HB2 TYR 51 HB2 TYR 51 9.383 -5.665 -23.268 268 HB3 TYR 51 HB3 TYR 51 8.039 -6.610 -22.660 269 HD1 TYR 51 HD2 TYR 51 7.378 -3.751 -21.015 270 HD2 TYR 51 HD1 TYR 51 7.585 -5.124 -25.062 271 HE1 TYR 51 HE2 TYR 51 5.769 -1.916 -21.727 272 HE2 TYR 51 HE1 TYR 51 5.974 -3.284 -25.760 273 HH TYR 51 HH TYR 51 4.272 -1.399 -23.429 274 H LYS 52 H LYS 52 11.470 -5.570 -22.143 275 HA LYS 52 HA LYS 52 12.029 -8.274 -21.621 276 HB2 LYS 52 HB2 LYS 52 13.569 -5.889 -22.576 277 HB3 LYS 52 HB3 LYS 52 14.462 -7.303 -22.054 278 HG2 LYS 52 HG2 LYS 52 12.791 -8.645 -23.587 279 HG3 LYS 52 HG3 LYS 52 12.434 -7.086 -24.303 280 HD2 LYS 52 HD2 LYS 52 15.211 -8.344 -24.099 281 HD3 LYS 52 HD3 LYS 52 14.232 -8.278 -25.551 282 HE2 LYS 52 HE2 LYS 52 14.959 -5.731 -24.057 283 HE3 LYS 52 HE3 LYS 52 16.080 -6.447 -25.198 284 HZ1 LYS 52 HZ1 LYS 52 14.925 -5.331 -26.699 285 HZ2 LYS 52 HZ2 LYS 52 13.747 -6.449 -26.533 286 HZ3 LYS 52 HZ3 LYS 52 13.663 -5.046 -25.702 287 H LEU 53 H LEU 53 13.038 -5.200 -19.983 288 HA LEU 53 HA LEU 53 14.422 -6.610 -17.940 289 HB2 LEU 53 HB2 LEU 53 15.008 -4.351 -18.709 290 HB3 LEU 53 HB3 LEU 53 13.487 -3.740 -18.090 291 HG LEU 53 HG LEU 53 15.662 -3.435 -16.707 292 HD11 LEU 53 HD11 LEU 53 13.613 -2.688 -15.811 293 HD12 LEU 53 HD12 LEU 53 13.012 -4.347 -15.581 294 HD13 LEU 53 HD13 LEU 53 14.334 -3.730 -14.560 295 HD21 LEU 53 HD21 LEU 53 16.491 -5.154 -15.434 296 HD22 LEU 53 HD22 LEU 53 14.974 -6.083 -15.492 297 HD23 LEU 53 HD23 LEU 53 16.040 -6.029 -16.917 298 H GLY 54 H GLY 54 11.097 -5.519 -18.498 299 HA2 GLY 54 HA2 GLY 54 10.199 -5.567 -15.827 300 HA3 GLY 54 HA3 GLY 54 9.221 -5.713 -17.273 301 H THR 55 H THR 55 10.147 -8.057 -18.475 302 HA THR 55 HA THR 55 8.919 -10.018 -16.828 303 HB THR 55 HB THR 55 10.206 -9.847 -19.562 304 HG1 THR 55 HG1 THR 55 7.994 -9.524 -19.619 305 HG21 THR 55 HG21 THR 55 10.953 -12.044 -19.199 306 HG22 THR 55 HG22 THR 55 9.749 -12.345 -17.922 307 HG23 THR 55 HG23 THR 55 9.257 -12.365 -19.632 308 H TYR 56 H TYR 56 12.302 -9.136 -17.590 309 HA TYR 56 HA TYR 56 13.515 -11.423 -16.589 310 HB2 TYR 56 HB2 TYR 56 14.539 -9.496 -17.896 311 HB3 TYR 56 HB3 TYR 56 14.282 -8.437 -16.524 312 HD1 TYR 56 HD1 TYR 56 16.146 -11.477 -17.617 313 HD2 TYR 56 HD2 TYR 56 15.900 -8.260 -14.807 314 HE1 TYR 56 HE1 TYR 56 18.442 -12.084 -16.709 315 HE2 TYR 56 HE2 TYR 56 18.197 -8.878 -13.909 316 HH TYR 56 HH TYR 56 19.608 -10.861 -13.795 317 H LEU 57 H LEU 57 12.549 -8.351 -14.931 318 HA LEU 57 HA LEU 57 13.554 -9.279 -12.422 319 HB2 LEU 57 HB2 LEU 57 13.644 -6.961 -12.846 320 HB3 LEU 57 HB3 LEU 57 11.959 -6.892 -13.322 321 HG LEU 57 HG LEU 57 12.802 -7.607 -10.509 322 HD11 LEU 57 HD11 LEU 57 13.667 -5.329 -11.381 323 HD12 LEU 57 HD12 LEU 57 11.960 -4.829 -11.301 324 HD13 LEU 57 HD13 LEU 57 12.794 -5.386 -9.831 325 HD21 LEU 57 HD21 LEU 57 10.631 -7.978 -10.247 326 HD22 LEU 57 HD22 LEU 57 10.339 -6.251 -10.564 327 HD23 LEU 57 HD23 LEU 57 10.284 -7.423 -11.903 328 H TYR 58 H TYR 58 10.288 -8.839 -13.927 329 HA TYR 58 HA TYR 58 8.746 -9.614 -11.805 330 HB2 TYR 58 HB2 TYR 58 8.696 -9.878 -14.844 331 HB3 TYR 58 HB3 TYR 58 7.406 -10.646 -13.941 332 HD1 TYR 58 HD2 TYR 58 7.022 -8.627 -11.745 333 HD2 TYR 58 HD1 TYR 58 7.591 -8.123 -15.955 334 HE1 TYR 58 HE2 TYR 58 5.773 -6.414 -11.656 335 HE2 TYR 58 HE1 TYR 58 6.340 -5.912 -15.853 336 HH TYR 58 HH TYR 58 5.324 -4.558 -12.760 337 H GLN 59 H GLN 59 10.569 -11.657 -14.140 338 HA GLN 59 HA GLN 59 9.595 -13.983 -12.696 339 HB2 GLN 59 HB2 GLN 59 9.381 -13.894 -15.215 340 HB3 GLN 59 HB3 GLN 59 11.130 -13.871 -15.329 341 HG2 GLN 59 HG2 GLN 59 11.217 -16.054 -14.072 342 HG3 GLN 59 HG3 GLN 59 9.465 -16.082 -14.035 343 HE21 GLN 59 HE21 GLN 59 12.095 -15.514 -16.374 344 HE22 GLN 59 HE22 GLN 59 11.453 -16.476 -17.664 345 H LYS 60 H LYS 60 10.904 -14.971 -11.217 346 HA LYS 60 HA LYS 60 13.698 -15.193 -11.641 347 HB2 LYS 60 HB2 LYS 60 14.395 -13.901 -9.622 348 HB3 LYS 60 HB3 LYS 60 13.830 -12.911 -10.953 349 HG2 LYS 60 HG2 LYS 60 11.779 -12.396 -9.880 350 HG3 LYS 60 HG3 LYS 60 11.861 -13.793 -8.826 351 HD2 LYS 60 HD2 LYS 60 12.359 -11.552 -7.702 352 HD3 LYS 60 HD3 LYS 60 13.566 -12.797 -7.450 353 HE2 LYS 60 HE2 LYS 60 14.602 -10.596 -8.026 354 HE3 LYS 60 HE3 LYS 60 15.009 -11.836 -9.195 355 HZ1 LYS 60 HZ1 LYS 60 14.325 -9.820 -10.270 356 HZ2 LYS 60 HZ2 LYS 60 13.245 -10.999 -10.602 357 HZ3 LYS 60 HZ3 LYS 60 12.877 -9.837 -9.514 358 H ASP 61 H ASP 61 14.704 -16.130 -9.440 359 HA ASP 61 HA ASP 61 14.728 -17.916 -8.196 360 HB2 ASP 61 HB2 ASP 61 13.220 -17.938 -6.321 361 HB3 ASP 61 HB3 ASP 61 13.446 -16.255 -6.753 362 HD2 ASP 61 HD2 ASP 61 10.723 -15.404 -6.591 363 H ASN 62 H ASN 62 13.491 -18.205 -10.903 364 HA ASN 62 HA ASN 62 11.162 -19.555 -10.982 365 HB2 ASN 62 HB2 ASN 62 12.237 -20.776 -13.011 366 HB3 ASN 62 HB3 ASN 62 12.231 -19.024 -13.064 367 HD21 ASN 62 HD21 ASN 62 13.959 -19.959 -14.669 368 HD22 ASN 62 HD22 ASN 62 15.593 -19.931 -14.094 369 H SER 63 H SER 63 10.554 -21.367 -9.787 370 HA SER 63 HA SER 63 12.649 -23.329 -9.273 371 HB2 SER 63 HB2 SER 63 11.536 -22.114 -7.293 372 HB3 SER 63 HB3 SER 63 10.068 -22.984 -7.694 373 HG SER 63 HG SER 63 11.591 -23.960 -6.033 374 H CYS 64 H CYS 64 10.037 -22.665 -11.249 375 HA CYS 64 HA CYS 64 8.785 -23.874 -12.585 376 HB2 CYS 64 HB2 CYS 64 10.216 -26.406 -11.766 377 HB3 CYS 64 HB3 CYS 64 9.454 -26.029 -13.299 378 HG CYS 64 HG CYS 64 11.097 -24.364 -14.190 379 H ASN 65 H ASN 65 8.037 -23.334 -9.797 380 HA ASN 65 HA ASN 65 6.744 -25.746 -8.931 381 HB2 ASN 65 HB2 ASN 65 7.757 -24.260 -7.230 382 HB3 ASN 65 HB3 ASN 65 6.809 -22.901 -7.799 383 HD21 ASN 65 HD21 ASN 65 5.647 -22.471 -6.029 384 HD22 ASN 65 HD22 ASN 65 4.494 -23.534 -5.294 385 H LEU 66 H LEU 66 5.899 -22.321 -9.849 386 HA LEU 66 HA LEU 66 3.327 -23.322 -10.820 387 HB2 LEU 66 HB2 LEU 66 3.821 -21.229 -8.756 388 HB3 LEU 66 HB3 LEU 66 2.525 -20.963 -9.905 389 HG LEU 66 HG LEU 66 2.802 -23.291 -7.987 390 HD11 LEU 66 HD11 LEU 66 1.248 -20.753 -7.996 391 HD12 LEU 66 HD12 LEU 66 0.434 -22.214 -7.386 392 HD13 LEU 66 HD13 LEU 66 1.957 -21.669 -6.644 393 HD21 LEU 66 HD21 LEU 66 1.015 -22.891 -10.353 394 HD22 LEU 66 HD22 LEU 66 1.787 -24.371 -9.733 395 HD23 LEU 66 HD23 LEU 66 0.364 -23.695 -8.904 396 H PHE 67 H PHE 67 3.287 -22.944 -12.964 397 HA PHE 67 HA PHE 67 5.103 -21.254 -14.228 398 HB2 PHE 67 HB2 PHE 67 3.698 -23.250 -15.111 399 HB3 PHE 67 HB3 PHE 67 2.311 -22.179 -15.130 400 HD1 PHE 67 HD2 PHE 67 5.808 -21.413 -16.138 401 HD2 PHE 67 HD1 PHE 67 1.800 -22.005 -17.399 402 HE1 PHE 67 HE2 PHE 67 6.425 -20.658 -18.451 403 HE2 PHE 67 HE1 PHE 67 2.416 -21.249 -19.712 404 HZ PHE 67 HZ PHE 67 4.721 -20.585 -20.211 405 H ASN 68 H ASN 68 5.188 -19.062 -14.237 406 HA ASN 68 HA ASN 68 2.803 -17.629 -13.538 407 HB2 ASN 68 HB2 ASN 68 5.158 -17.086 -12.648 408 HB3 ASN 68 HB3 ASN 68 5.565 -16.520 -14.256 409 HD21 ASN 68 HD21 ASN 68 5.947 -14.454 -13.447 410 HD22 ASN 68 HD22 ASN 68 4.670 -13.354 -13.045 411 H THR 69 H THR 69 1.605 -16.356 -15.026 412 HA THR 69 HA THR 69 2.164 -16.783 -17.816 413 HB THR 69 HB THR 69 0.027 -14.942 -16.696 414 HG1 THR 69 HG1 THR 69 -1.112 -17.005 -16.226 415 HG21 THR 69 HG21 THR 69 -0.286 -17.249 -18.652 416 HG22 THR 69 HG22 THR 69 -1.286 -15.785 -18.491 417 HG23 THR 69 HG23 THR 69 0.335 -15.680 -19.219 418 H LEU 70 H LEU 70 3.406 -15.579 -19.095 419 HA LEU 70 HA LEU 70 4.583 -13.207 -18.076 420 HB2 LEU 70 HB2 LEU 70 5.417 -15.038 -19.779 421 HB3 LEU 70 HB3 LEU 70 4.679 -13.975 -20.961 422 HG LEU 70 HG LEU 70 7.044 -13.512 -20.780 423 HD11 LEU 70 HD11 LEU 70 6.858 -11.261 -20.921 424 HD12 LEU 70 HD12 LEU 70 5.121 -11.642 -20.860 425 HD13 LEU 70 HD13 LEU 70 5.970 -11.120 -19.385 426 HD21 LEU 70 HD21 LEU 70 8.031 -13.922 -18.822 427 HD22 LEU 70 HD22 LEU 70 7.498 -12.292 -18.345 428 HD23 LEU 70 HD23 LEU 70 6.516 -13.712 -17.912 429 H THR 71 H THR 71 1.836 -13.997 -20.214 430 HA THR 71 HA THR 71 1.450 -11.544 -21.414 431 HB THR 71 HB THR 71 -0.414 -13.774 -20.479 432 HG1 THR 71 HG1 THR 71 1.136 -14.115 -22.245 433 HG21 THR 71 HG21 THR 71 -1.813 -12.599 -22.470 434 HG22 THR 71 HG22 THR 71 -2.067 -12.137 -20.770 435 HG23 THR 71 HG23 THR 71 -1.032 -11.139 -21.818 436 H GLU 72 H GLU 72 0.734 -12.576 -18.074 437 HA GLU 72 HA GLU 72 -0.941 -10.479 -17.440 438 HB2 GLU 72 HB2 GLU 72 -0.390 -12.615 -16.100 439 HB3 GLU 72 HB3 GLU 72 1.032 -11.772 -15.518 440 HG2 GLU 72 HG2 GLU 72 -1.776 -10.606 -15.275 441 HG3 GLU 72 HG3 GLU 72 -1.069 -11.622 -14.035 442 HE2 GLU 72 HE2 GLU 72 -0.698 -8.714 -12.780 443 H ALA 73 H ALA 73 2.658 -10.804 -17.150 444 HA ALA 73 HA ALA 73 3.093 -8.310 -15.983 445 HB1 ALA 73 HB1 ALA 73 5.296 -9.014 -17.659 446 HB2 ALA 73 HB2 ALA 73 5.129 -9.251 -15.902 447 HB3 ALA 73 HB3 ALA 73 4.602 -10.526 -17.027 448 H ARG 74 H ARG 74 3.158 -9.368 -19.455 449 HA ARG 74 HA ARG 74 3.855 -6.968 -20.516 450 HB2 ARG 74 HB2 ARG 74 3.726 -9.021 -21.859 451 HB3 ARG 74 HB3 ARG 74 1.995 -9.134 -21.611 452 HG2 ARG 74 HG2 ARG 74 3.072 -6.601 -22.844 453 HG3 ARG 74 HG3 ARG 74 3.040 -8.042 -23.840 454 HD2 ARG 74 HD2 ARG 74 0.535 -8.250 -22.916 455 HD3 ARG 74 HD3 ARG 74 0.721 -6.533 -22.617 456 HE ARG 74 HE ARG 74 0.759 -6.132 -24.941 457 HH11 ARG 74 HH22 ARG 74 1.023 -9.583 -24.307 458 HH12 ARG 74 HH21 ARG 74 0.783 -10.035 -25.962 459 HH21 ARG 74 HH12 ARG 74 0.442 -6.727 -27.124 460 HH22 ARG 74 HH11 ARG 74 0.450 -8.399 -27.575 461 H ASP 75 H ASP 75 0.672 -8.157 -19.377 462 HA ASP 75 HA ASP 75 -0.781 -6.041 -20.527 463 HB2 ASP 75 HB2 ASP 75 -1.939 -8.090 -19.979 464 HB3 ASP 75 HB3 ASP 75 -1.353 -8.065 -18.327 465 HD2 ASP 75 HD2 ASP 75 -3.591 -6.482 -16.928 466 H ALA 76 H ALA 76 0.988 -6.653 -17.494 467 HA ALA 76 HA ALA 76 -0.199 -4.604 -15.961 468 HB1 ALA 76 HB1 ALA 76 1.624 -6.702 -15.593 469 HB2 ALA 76 HB2 ALA 76 2.575 -5.228 -15.286 470 HB3 ALA 76 HB3 ALA 76 1.085 -5.535 -14.361 471 H ILE 77 H ILE 77 2.594 -4.786 -18.217 472 HA ILE 77 HA ILE 77 3.386 -2.093 -17.633 473 HB ILE 77 HB ILE 77 4.252 -3.851 -19.924 474 HG12 ILE 77 HG12 ILE 77 5.683 -3.730 -17.278 475 HG13 ILE 77 HG13 ILE 77 4.372 -4.867 -17.524 476 HG21 ILE 77 HG21 ILE 77 6.265 -2.529 -19.902 477 HG22 ILE 77 HG22 ILE 77 4.858 -1.445 -20.025 478 HG23 ILE 77 HG23 ILE 77 5.709 -1.627 -18.472 479 HD11 ILE 77 HD11 ILE 77 6.523 -5.929 -18.078 480 HD12 ILE 77 HD12 ILE 77 5.536 -5.765 -19.551 481 HD13 ILE 77 HD13 ILE 77 6.881 -4.638 -19.250 482 H LYS 78 H LYS 78 1.557 -3.843 -20.195 483 HA LYS 78 HA LYS 78 1.265 -1.562 -21.836 484 HB2 LYS 78 HB2 LYS 78 0.116 -4.321 -21.718 485 HB3 LYS 78 HB3 LYS 78 -0.732 -3.120 -22.671 486 HG2 LYS 78 HG2 LYS 78 2.258 -3.303 -23.008 487 HG3 LYS 78 HG3 LYS 78 1.287 -4.592 -23.692 488 HD2 LYS 78 HD2 LYS 78 1.414 -3.031 -25.464 489 HD3 LYS 78 HD3 LYS 78 -0.155 -2.695 -24.760 490 HE2 LYS 78 HE2 LYS 78 0.640 -0.734 -23.626 491 HE3 LYS 78 HE3 LYS 78 2.320 -1.191 -23.830 492 HZ1 LYS 78 HZ1 LYS 78 0.505 -0.029 -25.755 493 HZ2 LYS 78 HZ2 LYS 78 2.094 0.261 -25.516 494 HZ3 LYS 78 HZ3 LYS 78 1.622 -1.073 -26.332 495 H ASP 79 H ASP 79 -0.370 -2.792 -18.956 496 HA ASP 79 HA ASP 79 -2.717 -1.286 -19.371 497 HB2 ASP 79 HB2 ASP 79 -2.905 -3.179 -17.928 498 HB3 ASP 79 HB3 ASP 79 -1.469 -2.746 -17.022 499 HD2 ASP 79 HD2 ASP 79 -5.049 -1.984 -16.810 500 H ALA 80 H ALA 80 0.233 -1.010 -17.255 501 HA ALA 80 HA ALA 80 -0.481 1.421 -16.068 502 HB1 ALA 80 HB1 ALA 80 1.624 1.302 -15.090 503 HB2 ALA 80 HB2 ALA 80 1.359 -0.402 -15.529 504 HB3 ALA 80 HB3 ALA 80 2.384 0.631 -16.553 505 H TYR 81 H TYR 81 1.286 0.579 -19.086 506 HA TYR 81 HA TYR 81 2.073 3.245 -19.636 507 HB2 TYR 81 HB2 TYR 81 1.736 0.578 -21.106 508 HB3 TYR 81 HB3 TYR 81 2.188 2.004 -22.019 509 HD1 TYR 81 HD1 TYR 81 3.279 0.889 -18.610 510 HD2 TYR 81 HD2 TYR 81 4.411 1.691 -22.657 511 HE1 TYR 81 HE1 TYR 81 5.720 0.506 -18.010 512 HE2 TYR 81 HE2 TYR 81 6.848 1.305 -22.044 513 HH TYR 81 HH TYR 81 7.972 1.363 -19.007 514 H GLU 82 H GLU 82 -0.560 1.103 -20.939 515 HA GLU 82 HA GLU 82 -1.588 3.112 -22.581 516 HB2 GLU 82 HB2 GLU 82 -2.861 0.573 -21.471 517 HB3 GLU 82 HB3 GLU 82 -3.602 1.574 -22.704 518 HG2 GLU 82 HG2 GLU 82 -0.761 0.631 -23.128 519 HG3 GLU 82 HG3 GLU 82 -2.066 -0.515 -23.364 520 HE2 GLU 82 HE2 GLU 82 -3.189 0.223 -25.971 521 H SER 83 H SER 83 -1.863 2.427 -19.155 522 HA SER 83 HA SER 83 -4.342 3.770 -18.841 523 HB2 SER 83 HB2 SER 83 -3.823 2.080 -17.225 524 HB3 SER 83 HB3 SER 83 -2.224 2.733 -16.927 525 HG SER 83 HG SER 83 -4.521 3.297 -15.621 526 H TYR 84 H TYR 84 -0.846 4.505 -18.228 527 HA TYR 84 HA TYR 84 -1.553 7.256 -17.580 528 HB2 TYR 84 HB2 TYR 84 0.862 5.384 -17.473 529 HB3 TYR 84 HB3 TYR 84 1.141 7.112 -17.373 530 HD1 TYR 84 HD2 TYR 84 -0.097 8.414 -15.507 531 HD2 TYR 84 HD1 TYR 84 0.291 4.154 -15.550 532 HE1 TYR 84 HE2 TYR 84 -0.570 8.339 -13.010 533 HE2 TYR 84 HE1 TYR 84 -0.183 4.092 -13.053 534 HH TYR 84 HH TYR 84 -1.614 5.978 -11.446 535 H CYS 85 H CYS 85 -1.298 5.599 -20.388 536 HA CYS 85 HA CYS 85 0.646 7.090 -21.781 537 HB2 CYS 85 HB2 CYS 85 0.243 5.134 -22.889 538 HB3 CYS 85 HB3 CYS 85 -1.460 5.104 -22.474 539 HG CYS 85 HG CYS 85 -1.322 5.316 -25.041 540 H GLY 86 H GLY 86 0.361 8.941 -23.133 541 HA2 GLY 86 HA2 GLY 86 -1.088 10.451 -24.282 542 HA3 GLY 86 HA3 GLY 86 -2.308 10.200 -23.049 543 H ILE 87 H ILE 87 0.268 10.188 -21.105 544 HA ILE 87 HA ILE 87 0.514 13.112 -21.020 545 HB ILE 87 HB ILE 87 0.529 12.855 -18.515 546 HG12 ILE 87 HG12 ILE 87 0.745 10.235 -18.845 547 HG13 ILE 87 HG13 ILE 87 -0.047 10.930 -17.445 548 HG21 ILE 87 HG21 ILE 87 -1.988 12.330 -20.110 549 HG22 ILE 87 HG22 ILE 87 -1.976 12.750 -18.380 550 HG23 ILE 87 HG23 ILE 87 -1.331 13.896 -19.579 551 HD11 ILE 87 HD11 ILE 87 -2.262 10.710 -18.595 552 HD12 ILE 87 HD12 ILE 87 -1.440 9.952 -19.980 553 HD13 ILE 87 HD13 ILE 87 -1.444 9.141 -18.395 554 H ASP 88 H ASP 88 2.571 13.397 -21.770 555 HA ASP 88 HA ASP 88 4.573 11.540 -20.818 556 HB2 ASP 88 HB2 ASP 88 6.039 12.871 -22.478 557 HB3 ASP 88 HB3 ASP 88 4.757 11.891 -23.163 558 HD2 ASP 88 HD2 ASP 88 4.101 13.956 -25.154 559 H ASP 89 H ASP 89 3.268 14.758 -20.362 560 HA ASP 89 HA ASP 89 5.192 15.247 -18.319 561 HB2 ASP 89 HB2 ASP 89 5.758 17.547 -19.203 562 HB3 ASP 89 HB3 ASP 89 6.429 16.235 -20.152 563 HD2 ASP 89 HD2 ASP 89 6.515 18.090 -21.595 564 H CYS 90 H CYS 90 4.391 16.967 -16.849 565 HA CYS 90 HA CYS 90 1.553 17.217 -16.964 566 HB2 CYS 90 HB2 CYS 90 3.276 18.676 -14.974 567 HB3 CYS 90 HB3 CYS 90 1.669 18.009 -14.770 568 HA PRO 91 HA PRO 91 1.585 21.109 -18.935 569 HB2 PRO 91 HB2 PRO 91 -0.955 21.953 -18.383 570 HB3 PRO 91 HB3 PRO 91 -0.578 20.832 -19.676 571 HG2 PRO 91 HG2 PRO 91 -1.809 20.281 -17.046 572 HG3 PRO 91 HG3 PRO 91 -1.811 19.287 -18.489 573 HD2 PRO 91 HD2 PRO 91 -0.200 18.907 -16.146 574 HD3 PRO 91 HD3 PRO 91 -0.121 17.984 -17.634 575 H GLN 92 H GLN 92 0.779 20.871 -15.580 576 HA GLN 92 HA GLN 92 1.034 23.676 -15.203 577 HB2 GLN 92 HB2 GLN 92 -0.451 22.352 -13.763 578 HB3 GLN 92 HB3 GLN 92 0.887 21.352 -13.234 579 HG2 GLN 92 HG2 GLN 92 0.360 23.083 -11.540 580 HG3 GLN 92 HG3 GLN 92 1.978 23.307 -12.175 581 HE21 GLN 92 HE21 GLN 92 -1.290 24.115 -13.345 582 HE22 GLN 92 HE22 GLN 92 -1.018 25.806 -13.606 583 H CYS 93 H CYS 93 3.080 20.752 -14.806 584 HA CYS 93 HA CYS 93 5.138 21.973 -13.387 585 HB2 CYS 93 HB2 CYS 93 5.066 19.549 -15.198 586 HB3 CYS 93 HB3 CYS 93 6.530 20.060 -14.381 587 H SER 94 H SER 94 4.334 21.704 -16.882 588 HA SER 94 HA SER 94 6.794 22.884 -17.671 589 HB2 SER 94 HB2 SER 94 5.270 21.244 -19.005 590 HB3 SER 94 HB3 SER 94 4.293 22.649 -19.382 591 HG SER 94 HG SER 94 6.189 21.946 -20.874 592 H LYS 95 H LYS 95 3.460 23.929 -16.949 593 HA LYS 95 HA LYS 95 3.684 26.480 -18.146 594 HB2 LYS 95 HB2 LYS 95 1.519 25.521 -17.801 595 HB3 LYS 95 HB3 LYS 95 1.805 25.304 -16.086 596 HG2 LYS 95 HG2 LYS 95 2.053 28.092 -17.213 597 HG3 LYS 95 HG3 LYS 95 0.443 27.422 -17.034 598 HD2 LYS 95 HD2 LYS 95 0.653 27.203 -14.673 599 HD3 LYS 95 HD3 LYS 95 2.403 27.265 -14.724 600 HE2 LYS 95 HE2 LYS 95 1.761 29.414 -13.914 601 HE3 LYS 95 HE3 LYS 95 2.158 29.688 -15.599 602 HZ1 LYS 95 HZ1 LYS 95 -0.583 29.079 -14.780 603 HZ2 LYS 95 HZ2 LYS 95 -0.008 30.607 -14.743 604 HZ3 LYS 95 HZ3 LYS 95 -0.071 29.793 -16.157 605 H TYR 96 H TYR 96 4.808 25.042 -15.140 606 HA TYR 96 HA TYR 96 5.419 27.718 -14.101 607 HB2 TYR 96 HB2 TYR 96 4.143 25.701 -12.882 608 HB3 TYR 96 HB3 TYR 96 5.735 24.981 -12.754 609 HD1 TYR 96 HD2 TYR 96 7.559 26.972 -11.945 610 HD2 TYR 96 HD1 TYR 96 3.422 26.648 -10.900 611 HE1 TYR 96 HE2 TYR 96 7.983 28.303 -9.821 612 HE2 TYR 96 HE1 TYR 96 3.861 27.980 -8.780 613 HH TYR 96 HH TYR 96 5.878 29.851 -8.215 614 H ILE 97 H ILE 97 7.402 28.441 -14.717 615 HA ILE 97 HA ILE 97 9.573 26.461 -14.670 616 HB ILE 97 HB ILE 97 8.832 28.529 -16.671 617 HG12 ILE 97 HG12 ILE 97 10.176 25.817 -16.861 618 HG13 ILE 97 HG13 ILE 97 8.464 26.124 -17.074 619 HG21 ILE 97 HG21 ILE 97 11.213 28.556 -17.488 620 HG22 ILE 97 HG22 ILE 97 10.906 29.471 -15.992 621 HG23 ILE 97 HG23 ILE 97 11.686 27.873 -15.913 622 HD11 ILE 97 HD11 ILE 97 9.598 27.982 -18.806 623 HD12 ILE 97 HD12 ILE 97 10.702 26.593 -18.945 624 HD13 ILE 97 HD13 ILE 97 8.966 26.387 -19.280 625 H ASP 98 H ASP 98 11.432 27.005 -13.541 626 HA ASP 98 HA ASP 98 11.121 29.350 -11.889 627 HB2 ASP 98 HB2 ASP 98 13.077 28.347 -10.634 628 HB3 ASP 98 HB3 ASP 98 11.659 27.318 -10.693 629 HD2 ASP 98 HD2 ASP 98 15.036 26.839 -12.575 630 H ASP 99 H ASP 99 11.931 31.176 -12.988 631 HA ASP 99 HA ASP 99 14.388 30.810 -14.481 632 HB2 ASP 99 HB2 ASP 99 12.509 31.921 -15.646 633 HB3 ASP 99 HB3 ASP 99 12.380 33.108 -14.364 634 HD2 ASP 99 HD2 ASP 99 13.284 33.080 -17.358 Start of MODEL 12 1 H GLU 14 H GLU 14 -2.650 -2.585 -1.098 2 HA GLU 14 HA GLU 14 -0.067 -2.568 -0.367 3 HB2 GLU 14 HB2 GLU 14 0.112 -4.766 -1.613 4 HB3 GLU 14 HB3 GLU 14 -1.279 -4.643 -0.553 5 HG2 GLU 14 HG2 GLU 14 -2.533 -3.757 -2.705 6 HG3 GLU 14 HG3 GLU 14 -1.197 -4.476 -3.581 7 HE2 GLU 14 HE2 GLU 14 -4.171 -6.397 -2.037 8 H ASP 15 H ASP 15 -1.381 -2.232 -3.722 9 HA ASP 15 HA ASP 15 -0.419 -1.740 -5.618 10 HB2 ASP 15 HB2 ASP 15 1.360 0.235 -5.324 11 HB3 ASP 15 HB3 ASP 15 -0.350 0.510 -5.061 12 HD2 ASP 15 HD2 ASP 15 2.510 -0.331 -3.082 13 H GLN 16 H GLN 16 0.804 -4.018 -4.329 14 HA GLN 16 HA GLN 16 3.572 -3.775 -4.162 15 HB2 GLN 16 HB2 GLN 16 2.005 -5.630 -3.248 16 HB3 GLN 16 HB3 GLN 16 2.081 -6.334 -4.851 17 HG2 GLN 16 HG2 GLN 16 4.540 -6.512 -4.707 18 HG3 GLN 16 HG3 GLN 16 4.543 -5.678 -3.166 19 HE21 GLN 16 HE21 GLN 16 2.968 -6.664 -1.514 20 HE22 GLN 16 HE22 GLN 16 3.032 -8.383 -1.318 21 H GLU 17 H GLU 17 1.358 -4.845 -6.816 22 HA GLU 17 HA GLU 17 3.224 -5.701 -8.587 23 HB2 GLU 17 HB2 GLU 17 0.534 -4.353 -8.920 24 HB3 GLU 17 HB3 GLU 17 1.480 -4.767 -10.336 25 HG2 GLU 17 HG2 GLU 17 1.481 -7.118 -9.777 26 HG3 GLU 17 HG3 GLU 17 0.896 -6.810 -8.154 27 HE2 GLU 17 HE2 GLU 17 -0.302 -7.513 -11.305 28 H GLN 18 H GLN 18 2.319 -2.365 -7.693 29 HA GLN 18 HA GLN 18 3.530 -1.113 -9.857 30 HB2 GLN 18 HB2 GLN 18 2.732 -0.255 -7.069 31 HB3 GLN 18 HB3 GLN 18 3.652 0.846 -8.075 32 HG2 GLN 18 HG2 GLN 18 1.184 1.188 -8.311 33 HG3 GLN 18 HG3 GLN 18 1.943 0.771 -9.834 34 HE21 GLN 18 HE21 GLN 18 -0.428 0.003 -7.559 35 HE22 GLN 18 HE22 GLN 18 -0.979 -1.510 -8.199 36 H TRP 19 H TRP 19 4.783 -2.468 -6.822 37 HA TRP 19 HA TRP 19 7.171 -1.117 -6.601 38 HB2 TRP 19 HB2 TRP 19 6.166 -2.743 -4.987 39 HB3 TRP 19 HB3 TRP 19 6.702 -4.047 -6.028 40 HD1 TRP 19 HD1 TRP 19 8.456 -0.999 -4.289 41 HE1 TRP 19 HE1 TRP 19 10.814 -1.715 -3.348 42 HE3 TRP 19 HE3 TRP 19 8.250 -5.798 -5.959 43 HZ2 TRP 19 HZ2 TRP 19 12.297 -4.153 -3.406 44 HZ3 TRP 19 HZ3 TRP 19 10.195 -7.280 -5.474 45 HH2 TRP 19 HH2 TRP 19 12.169 -6.528 -4.245 46 H ALA 20 H ALA 20 6.084 -3.667 -8.851 47 HA ALA 20 HA ALA 20 8.589 -4.457 -9.791 48 HB1 ALA 20 HB1 ALA 20 7.305 -5.816 -11.051 49 HB2 ALA 20 HB2 ALA 20 5.903 -5.080 -10.238 50 HB3 ALA 20 HB3 ALA 20 6.460 -4.442 -11.804 51 H MET 21 H MET 21 6.284 -1.902 -10.936 52 HA MET 21 HA MET 21 7.652 -1.093 -13.125 53 HB2 MET 21 HB2 MET 21 6.022 0.435 -11.037 54 HB3 MET 21 HB3 MET 21 6.620 1.238 -12.475 55 HG2 MET 21 HG2 MET 21 5.491 -0.830 -13.736 56 HG3 MET 21 HG3 MET 21 4.562 -0.971 -12.257 57 HE1 MET 21 HE1 MET 21 6.104 1.593 -14.550 58 HE2 MET 21 HE2 MET 21 4.809 1.104 -15.669 59 HE3 MET 21 HE3 MET 21 4.797 2.732 -14.950 60 H GLN 22 H GLN 22 8.534 -0.712 -9.743 61 HA GLN 22 HA GLN 22 9.964 1.500 -9.596 62 HB2 GLN 22 HB2 GLN 22 9.775 -0.202 -7.797 63 HB3 GLN 22 HB3 GLN 22 10.888 -1.251 -8.653 64 HG2 GLN 22 HG2 GLN 22 12.283 -0.155 -7.086 65 HG3 GLN 22 HG3 GLN 22 12.564 0.745 -8.563 66 HE21 GLN 22 HE21 GLN 22 10.540 0.655 -5.653 67 HE22 GLN 22 HE22 GLN 22 10.357 2.365 -5.450 68 H THR 23 H THR 23 11.765 -1.556 -10.366 69 HA THR 23 HA THR 23 13.910 -0.181 -11.545 70 HB THR 23 HB THR 23 12.969 -2.982 -11.116 71 HG1 THR 23 HG1 THR 23 15.641 -1.839 -11.296 72 HG21 THR 23 HG21 THR 23 13.533 -3.554 -13.320 73 HG22 THR 23 HG22 THR 23 14.603 -2.145 -13.515 74 HG23 THR 23 HG23 THR 23 15.155 -3.559 -12.587 75 H LEU 24 H LEU 24 11.019 -1.801 -12.972 76 HA LEU 24 HA LEU 24 11.617 -1.745 -15.584 77 HB2 LEU 24 HB2 LEU 24 9.442 -2.320 -14.231 78 HB3 LEU 24 HB3 LEU 24 8.952 -0.706 -14.706 79 HG LEU 24 HG LEU 24 9.860 -1.854 -17.084 80 HD11 LEU 24 HD11 LEU 24 8.841 -3.992 -17.305 81 HD12 LEU 24 HD12 LEU 24 9.866 -4.047 -15.850 82 HD13 LEU 24 HD13 LEU 24 8.101 -3.883 -15.690 83 HD21 LEU 24 HD21 LEU 24 7.108 -2.158 -17.134 84 HD22 LEU 24 HD22 LEU 24 7.368 -0.888 -15.914 85 HD23 LEU 24 HD23 LEU 24 8.020 -0.689 -17.558 86 H MET 25 H MET 25 9.750 1.019 -14.151 87 HA MET 25 HA MET 25 10.286 2.714 -16.233 88 HB2 MET 25 HB2 MET 25 9.907 3.521 -13.299 89 HB3 MET 25 HB3 MET 25 9.462 4.468 -14.705 90 HG2 MET 25 HG2 MET 25 8.010 2.253 -15.269 91 HG3 MET 25 HG3 MET 25 8.097 2.051 -13.531 92 HE1 MET 25 HE1 MET 25 6.445 5.758 -15.696 93 HE2 MET 25 HE2 MET 25 7.963 4.902 -16.061 94 HE3 MET 25 HE3 MET 25 6.399 4.147 -16.452 95 H GLY 26 H GLY 26 12.210 1.933 -13.333 96 HA2 GLY 26 HA2 GLY 26 13.972 4.136 -13.428 97 HA3 GLY 26 HA3 GLY 26 14.248 2.593 -12.645 98 H SER 27 H SER 27 13.578 1.341 -15.490 99 HA SER 27 HA SER 27 16.246 0.974 -16.187 100 HB2 SER 27 HB2 SER 27 15.426 -0.603 -17.648 101 HB3 SER 27 HB3 SER 27 13.977 -0.390 -16.686 102 HG SER 27 HG SER 27 13.081 0.958 -18.268 103 H GLY 28 H GLY 28 13.907 3.458 -16.941 104 HA2 GLY 28 HA2 GLY 28 14.529 5.495 -17.895 105 HA3 GLY 28 HA3 GLY 28 15.840 4.712 -18.755 106 H VAL 29 H VAL 29 12.851 2.920 -18.772 107 HA VAL 29 HA VAL 29 12.631 3.245 -21.593 108 HB VAL 29 HB VAL 29 11.088 1.771 -19.469 109 HG11 VAL 29 HG11 VAL 29 10.077 2.616 -22.018 110 HG12 VAL 29 HG12 VAL 29 10.303 0.850 -22.044 111 HG13 VAL 29 HG13 VAL 29 9.295 1.600 -20.782 112 HG21 VAL 29 HG21 VAL 29 12.386 0.017 -19.984 113 HG22 VAL 29 HG22 VAL 29 12.194 0.280 -21.734 114 HG23 VAL 29 HG23 VAL 29 13.432 1.184 -20.828 115 H LEU 30 H LEU 30 10.702 4.264 -18.705 116 HA LEU 30 HA LEU 30 9.194 6.024 -20.504 117 HB2 LEU 30 HB2 LEU 30 8.533 4.559 -17.996 118 HB3 LEU 30 HB3 LEU 30 7.757 6.106 -18.270 119 HG LEU 30 HG LEU 30 7.694 3.872 -20.308 120 HD11 LEU 30 HD11 LEU 30 5.570 4.463 -18.230 121 HD12 LEU 30 HD12 LEU 30 5.554 3.181 -19.465 122 HD13 LEU 30 HD13 LEU 30 6.735 3.120 -18.134 123 HD21 LEU 30 HD21 LEU 30 7.136 6.450 -20.723 124 HD22 LEU 30 HD22 LEU 30 6.238 5.131 -21.512 125 HD23 LEU 30 HD23 LEU 30 5.560 5.934 -20.075 126 H ALA 31 H ALA 31 8.368 8.062 -19.058 127 HA ALA 31 HA ALA 31 10.823 9.151 -17.857 128 HB1 ALA 31 HB1 ALA 31 9.499 11.361 -18.646 129 HB2 ALA 31 HB2 ALA 31 10.619 10.483 -19.716 130 HB3 ALA 31 HB3 ALA 31 8.865 10.215 -19.851 131 H ARG 32 H ARG 32 10.642 10.221 -15.877 132 HA ARG 32 HA ARG 32 7.947 10.215 -14.774 133 HB2 ARG 32 HB2 ARG 32 10.505 9.730 -13.173 134 HB3 ARG 32 HB3 ARG 32 8.858 9.559 -12.598 135 HG2 ARG 32 HG2 ARG 32 8.483 7.575 -13.834 136 HG3 ARG 32 HG3 ARG 32 9.757 7.928 -14.985 137 HD2 ARG 32 HD2 ARG 32 10.941 6.397 -13.736 138 HD3 ARG 32 HD3 ARG 32 11.260 7.781 -12.710 139 HE ARG 32 HE ARG 32 8.886 6.886 -11.684 140 HH11 ARG 32 HH22 ARG 32 11.874 5.209 -12.486 141 HH12 ARG 32 HH21 ARG 32 11.666 3.991 -11.273 142 HH21 ARG 32 HH12 ARG 32 8.611 5.279 -10.083 143 HH22 ARG 32 HH11 ARG 32 9.797 4.031 -9.896 144 H CYS 33 H CYS 33 7.589 11.895 -13.051 145 HA CYS 33 HA CYS 33 8.664 14.358 -13.834 146 HB2 CYS 33 HB2 CYS 33 6.733 13.388 -11.814 147 HB3 CYS 33 HB3 CYS 33 7.563 14.868 -11.376 148 H ARG 34 H ARG 34 10.329 15.621 -12.905 149 HA ARG 34 HA ARG 34 12.278 14.170 -11.512 150 HB2 ARG 34 HB2 ARG 34 13.592 16.216 -11.625 151 HB3 ARG 34 HB3 ARG 34 12.706 16.083 -13.131 152 HG2 ARG 34 HG2 ARG 34 10.920 17.600 -12.153 153 HG3 ARG 34 HG3 ARG 34 11.925 17.805 -10.732 154 HD2 ARG 34 HD2 ARG 34 12.152 19.641 -12.503 155 HD3 ARG 34 HD3 ARG 34 13.661 18.918 -11.982 156 HE ARG 34 HE ARG 34 12.441 17.619 -14.327 157 HH11 ARG 34 HH22 ARG 34 14.671 20.092 -13.189 158 HH12 ARG 34 HH21 ARG 34 15.552 20.164 -14.679 159 HH21 ARG 34 HH12 ARG 34 13.604 17.713 -16.292 160 HH22 ARG 34 HH11 ARG 34 14.941 18.802 -16.456 161 H ILE 35 H ILE 35 9.382 15.524 -10.470 162 HA ILE 35 HA ILE 35 10.478 16.248 -7.849 163 HB ILE 35 HB ILE 35 7.775 16.882 -9.035 164 HG12 ILE 35 HG12 ILE 35 9.943 18.919 -8.635 165 HG13 ILE 35 HG13 ILE 35 9.973 17.910 -10.068 166 HG21 ILE 35 HG21 ILE 35 7.475 18.361 -7.174 167 HG22 ILE 35 HG22 ILE 35 7.895 16.750 -6.545 168 HG23 ILE 35 HG23 ILE 35 9.122 18.038 -6.582 169 HD11 ILE 35 HD11 ILE 35 7.262 18.801 -9.714 170 HD12 ILE 35 HD12 ILE 35 8.331 20.214 -9.550 171 HD13 ILE 35 HD13 ILE 35 8.395 19.217 -11.022 172 H HIS 36 H HIS 36 8.763 13.832 -9.656 173 HA HIS 36 HA HIS 36 8.452 12.313 -7.235 174 HB2 HIS 36 HB2 HIS 36 5.999 11.788 -8.195 175 HB3 HIS 36 HB3 HIS 36 6.322 12.980 -6.952 176 HD1 HIS 36 HD1 HIS 36 5.140 12.620 -10.467 177 HD2 HIS 36 HD2 HIS 36 6.241 15.717 -7.861 178 HE1 HIS 36 HE1 HIS 36 4.300 14.782 -11.531 179 H ASN 37 H ASN 37 9.064 10.240 -7.649 180 HA ASN 37 HA ASN 37 9.367 9.562 -10.442 181 HB2 ASN 37 HB2 ASN 37 11.115 8.177 -9.767 182 HB3 ASN 37 HB3 ASN 37 11.124 9.273 -8.399 183 HD21 ASN 37 HD21 ASN 37 9.533 8.694 -6.622 184 HD22 ASN 37 HD22 ASN 37 9.458 7.034 -6.135 185 H ASP 38 H ASP 38 7.151 9.218 -7.888 186 HA ASP 38 HA ASP 38 6.471 6.499 -8.300 187 HB2 ASP 38 HB2 ASP 38 6.028 7.510 -6.136 188 HB3 ASP 38 HB3 ASP 38 5.130 8.828 -6.863 189 HD2 ASP 38 HD2 ASP 38 3.119 8.154 -5.576 190 H VAL 39 H VAL 39 6.219 9.154 -10.266 191 HA VAL 39 HA VAL 39 3.519 8.507 -11.207 192 HB VAL 39 HB VAL 39 4.286 10.875 -10.515 193 HG11 VAL 39 HG11 VAL 39 6.391 11.003 -11.667 194 HG12 VAL 39 HG12 VAL 39 5.626 10.610 -13.225 195 HG13 VAL 39 HG13 VAL 39 5.278 12.164 -12.430 196 HG21 VAL 39 HG21 VAL 39 2.363 11.387 -11.516 197 HG22 VAL 39 HG22 VAL 39 3.174 11.397 -13.100 198 HG23 VAL 39 HG23 VAL 39 2.464 9.890 -12.474 199 H ILE 40 H ILE 40 3.193 8.297 -13.559 200 HA ILE 40 HA ILE 40 5.650 7.415 -14.905 201 HB ILE 40 HB ILE 40 4.769 5.377 -14.682 202 HG12 ILE 40 HG12 ILE 40 2.817 6.261 -16.819 203 HG13 ILE 40 HG13 ILE 40 4.531 6.059 -17.122 204 HG21 ILE 40 HG21 ILE 40 2.475 4.840 -14.150 205 HG22 ILE 40 HG22 ILE 40 3.030 6.176 -13.112 206 HG23 ILE 40 HG23 ILE 40 1.964 6.509 -14.499 207 HD11 ILE 40 HD11 ILE 40 4.468 3.727 -16.743 208 HD12 ILE 40 HD12 ILE 40 2.960 3.827 -15.802 209 HD13 ILE 40 HD13 ILE 40 2.922 4.036 -17.569 210 H LEU 41 H LEU 41 6.030 8.321 -16.877 211 HA LEU 41 HA LEU 41 3.767 9.590 -18.218 212 HB2 LEU 41 HB2 LEU 41 6.341 11.079 -18.141 213 HB3 LEU 41 HB3 LEU 41 4.704 11.665 -18.357 214 HG LEU 41 HG LEU 41 5.590 10.560 -15.699 215 HD11 LEU 41 HD11 LEU 41 6.529 12.558 -14.990 216 HD12 LEU 41 HD12 LEU 41 7.166 12.389 -16.644 217 HD13 LEU 41 HD13 LEU 41 5.808 13.494 -16.322 218 HD21 LEU 41 HD21 LEU 41 3.210 11.805 -16.765 219 HD22 LEU 41 HD22 LEU 41 3.480 11.024 -15.188 220 HD23 LEU 41 HD23 LEU 41 3.861 12.749 -15.403 221 H ASP 42 H ASP 42 3.882 9.527 -20.478 222 HA ASP 42 HA ASP 42 5.332 7.458 -21.540 223 HB2 ASP 42 HB2 ASP 42 3.896 9.857 -22.703 224 HB3 ASP 42 HB3 ASP 42 4.814 8.820 -23.776 225 HD2 ASP 42 HD2 ASP 42 2.376 7.928 -21.186 226 H SER 43 H SER 43 7.428 7.341 -22.435 227 HA SER 43 HA SER 43 8.968 9.784 -22.273 228 HB2 SER 43 HB2 SER 43 9.868 7.808 -21.116 229 HB3 SER 43 HB3 SER 43 9.800 6.868 -22.593 230 HG SER 43 HG SER 43 11.926 7.577 -22.399 231 H GLY 44 H GLY 44 7.580 7.466 -24.546 232 HA2 GLY 44 HA2 GLY 44 7.242 7.843 -26.789 233 HA3 GLY 44 HA3 GLY 44 8.422 9.139 -26.771 234 H ASN 45 H ASN 45 9.313 6.121 -25.188 235 HA ASN 45 HA ASN 45 11.041 5.576 -27.470 236 HB2 ASN 45 HB2 ASN 45 12.088 6.199 -25.183 237 HB3 ASN 45 HB3 ASN 45 11.468 4.675 -24.578 238 HD21 ASN 45 HD21 ASN 45 13.763 6.259 -26.630 239 HD22 ASN 45 HD22 ASN 45 14.755 4.892 -27.018 240 H ASP 46 H ASP 46 11.611 3.117 -27.647 241 HA ASP 46 HA ASP 46 9.339 1.664 -27.977 242 HB2 ASP 46 HB2 ASP 46 12.145 0.616 -27.376 243 HB3 ASP 46 HB3 ASP 46 10.863 -0.319 -28.119 244 HD2 ASP 46 HD2 ASP 46 12.510 -0.549 -29.646 245 H ALA 47 H ALA 47 7.929 0.860 -26.415 246 HA ALA 47 HA ALA 47 8.701 0.754 -23.683 247 HB1 ALA 47 HB1 ALA 47 6.230 -0.349 -25.081 248 HB2 ALA 47 HB2 ALA 47 6.405 -0.000 -23.344 249 HB3 ALA 47 HB3 ALA 47 6.419 1.332 -24.524 250 H SER 48 H SER 48 9.018 -1.377 -26.400 251 HA SER 48 HA SER 48 8.663 -3.827 -25.282 252 HB2 SER 48 HB2 SER 48 10.648 -2.835 -27.361 253 HB3 SER 48 HB3 SER 48 10.527 -4.532 -26.944 254 HG SER 48 HG SER 48 9.135 -3.472 -28.794 255 H SER 49 H SER 49 11.310 -1.480 -24.862 256 HA SER 49 HA SER 49 13.196 -3.222 -23.834 257 HB2 SER 49 HB2 SER 49 12.706 -0.266 -23.763 258 HB3 SER 49 HB3 SER 49 13.815 -0.898 -22.561 259 HG SER 49 HG SER 49 14.052 -0.860 -25.409 260 H ALA 50 H ALA 50 10.815 -1.043 -22.148 261 HA ALA 50 HA ALA 50 11.444 -1.854 -19.567 262 HB1 ALA 50 HB1 ALA 50 9.238 -0.437 -20.971 263 HB2 ALA 50 HB2 ALA 50 8.815 -1.155 -19.399 264 HB3 ALA 50 HB3 ALA 50 10.146 0.021 -19.510 265 H TYR 51 H TYR 51 9.163 -3.185 -22.017 266 HA TYR 51 HA TYR 51 7.827 -4.982 -20.410 267 HB2 TYR 51 HB2 TYR 51 8.891 -5.203 -23.296 268 HB3 TYR 51 HB3 TYR 51 7.579 -6.177 -22.661 269 HD1 TYR 51 HD2 TYR 51 7.052 -3.151 -21.119 270 HD2 TYR 51 HD1 TYR 51 6.863 -4.901 -25.018 271 HE1 TYR 51 HE2 TYR 51 5.383 -1.375 -21.843 272 HE2 TYR 51 HE1 TYR 51 5.195 -3.119 -25.729 273 HH TYR 51 HH TYR 51 4.003 -1.427 -25.118 274 H LYS 52 H LYS 52 10.994 -5.320 -22.118 275 HA LYS 52 HA LYS 52 11.315 -8.036 -21.432 276 HB2 LYS 52 HB2 LYS 52 13.099 -7.890 -22.771 277 HB3 LYS 52 HB3 LYS 52 12.539 -6.271 -23.139 278 HG2 LYS 52 HG2 LYS 52 13.948 -5.342 -21.313 279 HG3 LYS 52 HG3 LYS 52 14.470 -6.955 -20.872 280 HD2 LYS 52 HD2 LYS 52 14.891 -5.848 -23.679 281 HD3 LYS 52 HD3 LYS 52 16.050 -5.566 -22.395 282 HE2 LYS 52 HE2 LYS 52 16.711 -7.806 -22.296 283 HE3 LYS 52 HE3 LYS 52 15.149 -8.407 -22.816 284 HZ1 LYS 52 HZ1 LYS 52 17.247 -7.214 -24.470 285 HZ2 LYS 52 HZ2 LYS 52 16.561 -8.689 -24.613 286 HZ3 LYS 52 HZ3 LYS 52 15.713 -7.352 -25.013 287 H LEU 53 H LEU 53 12.367 -4.926 -19.936 288 HA LEU 53 HA LEU 53 13.903 -6.113 -17.918 289 HB2 LEU 53 HB2 LEU 53 12.454 -3.472 -17.779 290 HB3 LEU 53 HB3 LEU 53 13.886 -3.957 -16.893 291 HG LEU 53 HG LEU 53 14.109 -4.011 -19.856 292 HD11 LEU 53 HD11 LEU 53 14.727 -1.370 -19.288 293 HD12 LEU 53 HD12 LEU 53 13.303 -1.960 -20.178 294 HD13 LEU 53 HD13 LEU 53 13.190 -1.638 -18.431 295 HD21 LEU 53 HD21 LEU 53 16.275 -4.048 -19.373 296 HD22 LEU 53 HD22 LEU 53 16.145 -2.551 -18.419 297 HD23 LEU 53 HD23 LEU 53 15.839 -4.126 -17.649 298 H GLY 54 H GLY 54 10.416 -5.536 -18.321 299 HA2 GLY 54 HA2 GLY 54 9.759 -6.004 -15.571 300 HA3 GLY 54 HA3 GLY 54 8.664 -5.911 -16.935 301 H THR 55 H THR 55 9.805 -7.944 -18.626 302 HA THR 55 HA THR 55 8.576 -10.221 -17.537 303 HB THR 55 HB THR 55 9.580 -11.287 -19.602 304 HG1 THR 55 HG1 THR 55 11.453 -10.264 -20.186 305 HG21 THR 55 HG21 THR 55 8.935 -8.999 -21.085 306 HG22 THR 55 HG22 THR 55 7.777 -10.253 -20.580 307 HG23 THR 55 HG23 THR 55 7.990 -8.788 -19.591 308 H TYR 56 H TYR 56 11.961 -9.075 -17.535 309 HA TYR 56 HA TYR 56 12.995 -11.548 -16.580 310 HB2 TYR 56 HB2 TYR 56 14.526 -10.065 -17.688 311 HB3 TYR 56 HB3 TYR 56 13.809 -8.641 -16.961 312 HD1 TYR 56 HD2 TYR 56 14.409 -7.970 -14.649 313 HD2 TYR 56 HD1 TYR 56 16.300 -11.286 -16.580 314 HE1 TYR 56 HE2 TYR 56 16.272 -7.923 -12.920 315 HE2 TYR 56 HE1 TYR 56 18.157 -11.228 -14.845 316 HH TYR 56 HH TYR 56 19.098 -9.983 -13.260 317 H LEU 57 H LEU 57 12.314 -8.327 -15.040 318 HA LEU 57 HA LEU 57 13.087 -9.077 -12.482 319 HB2 LEU 57 HB2 LEU 57 12.891 -6.850 -12.592 320 HB3 LEU 57 HB3 LEU 57 11.582 -6.900 -13.756 321 HG LEU 57 HG LEU 57 11.117 -5.908 -11.437 322 HD11 LEU 57 HD11 LEU 57 9.497 -7.450 -13.231 323 HD12 LEU 57 HD12 LEU 57 8.930 -7.701 -11.562 324 HD13 LEU 57 HD13 LEU 57 9.050 -6.053 -12.223 325 HD21 LEU 57 HD21 LEU 57 10.265 -8.361 -10.236 326 HD22 LEU 57 HD22 LEU 57 11.997 -8.482 -10.630 327 HD23 LEU 57 HD23 LEU 57 11.405 -7.142 -9.619 328 H TYR 58 H TYR 58 9.841 -9.178 -14.088 329 HA TYR 58 HA TYR 58 8.462 -10.172 -11.879 330 HB2 TYR 58 HB2 TYR 58 8.232 -10.327 -14.937 331 HB3 TYR 58 HB3 TYR 58 7.005 -11.066 -13.927 332 HD1 TYR 58 HD1 TYR 58 6.784 -9.045 -11.734 333 HD2 TYR 58 HD2 TYR 58 7.117 -8.540 -15.969 334 HE1 TYR 58 HE1 TYR 58 5.582 -6.811 -11.569 335 HE2 TYR 58 HE2 TYR 58 5.914 -6.307 -15.790 336 HH TYR 58 HH TYR 58 4.194 -5.324 -14.075 337 H GLN 59 H GLN 59 9.925 -11.911 -14.716 338 HA GLN 59 HA GLN 59 9.425 -14.391 -13.332 339 HB2 GLN 59 HB2 GLN 59 9.092 -13.858 -15.907 340 HB3 GLN 59 HB3 GLN 59 10.811 -14.183 -16.012 341 HG2 GLN 59 HG2 GLN 59 10.407 -16.408 -14.859 342 HG3 GLN 59 HG3 GLN 59 8.686 -16.083 -14.913 343 HE21 GLN 59 HE21 GLN 59 11.472 -17.102 -16.619 344 HE22 GLN 59 HE22 GLN 59 10.751 -17.436 -18.158 345 H LYS 60 H LYS 60 10.912 -14.815 -11.733 346 HA LYS 60 HA LYS 60 13.684 -14.972 -12.569 347 HB2 LYS 60 HB2 LYS 60 13.615 -12.722 -11.726 348 HB3 LYS 60 HB3 LYS 60 12.737 -13.215 -10.292 349 HG2 LYS 60 HG2 LYS 60 14.897 -13.155 -9.427 350 HG3 LYS 60 HG3 LYS 60 14.826 -14.833 -9.927 351 HD2 LYS 60 HD2 LYS 60 15.738 -12.832 -11.981 352 HD3 LYS 60 HD3 LYS 60 16.841 -13.182 -10.666 353 HE2 LYS 60 HE2 LYS 60 17.128 -15.418 -11.303 354 HE3 LYS 60 HE3 LYS 60 15.541 -15.528 -12.039 355 HZ1 LYS 60 HZ1 LYS 60 17.283 -13.638 -13.291 356 HZ2 LYS 60 HZ2 LYS 60 17.804 -15.182 -13.387 357 HZ3 LYS 60 HZ3 LYS 60 16.330 -14.781 -13.963 358 H ASP 61 H ASP 61 13.946 -17.136 -12.291 359 HA ASP 61 HA ASP 61 13.863 -18.114 -9.654 360 HB2 ASP 61 HB2 ASP 61 11.794 -19.090 -11.669 361 HB3 ASP 61 HB3 ASP 61 12.274 -20.057 -10.288 362 HD2 ASP 61 HD2 ASP 61 9.868 -16.929 -9.975 363 H ASN 62 H ASN 62 14.455 -20.623 -9.754 364 HA ASN 62 HA ASN 62 16.258 -20.919 -12.009 365 HB2 ASN 62 HB2 ASN 62 16.170 -22.286 -9.269 366 HB3 ASN 62 HB3 ASN 62 17.326 -22.705 -10.518 367 HD21 ASN 62 HD21 ASN 62 16.354 -20.411 -8.131 368 HD22 ASN 62 HD22 ASN 62 17.725 -19.355 -8.201 369 H SER 63 H SER 63 13.214 -21.891 -10.810 370 HA SER 63 HA SER 63 13.369 -24.356 -12.362 371 HB2 SER 63 HB2 SER 63 13.177 -24.904 -9.971 372 HB3 SER 63 HB3 SER 63 11.798 -23.837 -9.800 373 HG SER 63 HG SER 63 11.270 -26.159 -10.054 374 H CYS 64 H CYS 64 10.934 -25.069 -12.945 375 HA CYS 64 HA CYS 64 9.762 -22.699 -14.142 376 HB2 CYS 64 HB2 CYS 64 9.384 -25.658 -14.682 377 HB3 CYS 64 HB3 CYS 64 8.413 -24.412 -15.441 378 HG CYS 64 HG CYS 64 10.642 -25.522 -16.784 379 H ASN 65 H ASN 65 9.624 -23.742 -11.181 380 HA ASN 65 HA ASN 65 6.947 -24.552 -10.860 381 HB2 ASN 65 HB2 ASN 65 9.193 -23.666 -9.024 382 HB3 ASN 65 HB3 ASN 65 7.571 -23.762 -8.369 383 HD21 ASN 65 HD21 ASN 65 9.230 -25.713 -10.835 384 HD22 ASN 65 HD22 ASN 65 9.088 -27.245 -10.041 385 H LEU 66 H LEU 66 8.456 -21.584 -11.622 386 HA LEU 66 HA LEU 66 7.188 -19.716 -10.049 387 HB2 LEU 66 HB2 LEU 66 7.827 -18.141 -11.643 388 HB3 LEU 66 HB3 LEU 66 9.051 -19.394 -11.698 389 HG LEU 66 HG LEU 66 7.655 -20.344 -13.689 390 HD11 LEU 66 HD11 LEU 66 5.877 -19.211 -14.372 391 HD12 LEU 66 HD12 LEU 66 6.111 -18.046 -13.047 392 HD13 LEU 66 HD13 LEU 66 6.876 -17.760 -14.628 393 HD21 LEU 66 HD21 LEU 66 9.688 -18.224 -13.540 394 HD22 LEU 66 HD22 LEU 66 9.656 -19.730 -14.487 395 HD23 LEU 66 HD23 LEU 66 8.799 -18.287 -15.080 396 H PHE 67 H PHE 67 5.147 -18.888 -9.895 397 HA PHE 67 HA PHE 67 3.163 -20.140 -11.626 398 HB2 PHE 67 HB2 PHE 67 3.016 -18.451 -9.056 399 HB3 PHE 67 HB3 PHE 67 1.627 -19.206 -9.812 400 HD1 PHE 67 HD1 PHE 67 1.713 -21.789 -10.070 401 HD2 PHE 67 HD2 PHE 67 4.215 -19.604 -7.429 402 HE1 PHE 67 HE1 PHE 67 2.114 -23.871 -8.728 403 HE2 PHE 67 HE2 PHE 67 4.616 -21.687 -6.086 404 HZ PHE 67 HZ PHE 67 3.561 -23.795 -6.752 405 H ASN 68 H ASN 68 4.867 -17.149 -11.121 406 HA ASN 68 HA ASN 68 2.924 -15.335 -11.809 407 HB2 ASN 68 HB2 ASN 68 4.977 -14.429 -11.010 408 HB3 ASN 68 HB3 ASN 68 5.947 -15.421 -12.081 409 HD21 ASN 68 HD21 ASN 68 3.546 -12.815 -12.037 410 HD22 ASN 68 HD22 ASN 68 4.115 -11.957 -13.431 411 H THR 69 H THR 69 1.980 -14.792 -13.810 412 HA THR 69 HA THR 69 2.827 -16.371 -16.112 413 HB THR 69 HB THR 69 0.589 -15.186 -16.953 414 HG1 THR 69 HG1 THR 69 -0.656 -14.694 -14.925 415 HG21 THR 69 HG21 THR 69 1.089 -17.614 -15.569 416 HG22 THR 69 HG22 THR 69 -0.254 -16.849 -14.685 417 HG23 THR 69 HG23 THR 69 -0.408 -17.177 -16.428 418 H LEU 70 H LEU 70 3.640 -15.561 -18.006 419 HA LEU 70 HA LEU 70 4.980 -13.085 -17.806 420 HB2 LEU 70 HB2 LEU 70 5.521 -15.262 -19.129 421 HB3 LEU 70 HB3 LEU 70 4.513 -14.556 -20.377 422 HG LEU 70 HG LEU 70 6.749 -14.016 -20.923 423 HD11 LEU 70 HD11 LEU 70 4.910 -12.144 -20.870 424 HD12 LEU 70 HD12 LEU 70 5.959 -11.438 -19.617 425 HD13 LEU 70 HD13 LEU 70 6.603 -11.746 -21.248 426 HD21 LEU 70 HD21 LEU 70 7.179 -14.061 -18.129 427 HD22 LEU 70 HD22 LEU 70 8.382 -13.894 -19.430 428 HD23 LEU 70 HD23 LEU 70 7.654 -12.443 -18.699 429 H THR 71 H THR 71 1.992 -14.207 -19.485 430 HA THR 71 HA THR 71 1.473 -11.923 -20.949 431 HB THR 71 HB THR 71 -0.583 -13.698 -19.543 432 HG1 THR 71 HG1 THR 71 0.105 -15.259 -21.014 433 HG21 THR 71 HG21 THR 71 -0.462 -12.266 -22.248 434 HG22 THR 71 HG22 THR 71 -1.695 -13.477 -21.823 435 HG23 THR 71 HG23 THR 71 -1.609 -11.942 -20.926 436 H GLU 72 H GLU 72 1.091 -12.528 -17.464 437 HA GLU 72 HA GLU 72 -0.525 -10.251 -17.072 438 HB2 GLU 72 HB2 GLU 72 0.889 -12.253 -15.345 439 HB3 GLU 72 HB3 GLU 72 0.487 -10.720 -14.598 440 HG2 GLU 72 HG2 GLU 72 -1.473 -12.583 -16.020 441 HG3 GLU 72 HG3 GLU 72 -1.346 -12.360 -14.287 442 HE2 GLU 72 HE2 GLU 72 -4.022 -10.777 -14.890 443 H ALA 73 H ALA 73 2.961 -10.911 -17.222 444 HA ALA 73 HA ALA 73 3.783 -8.537 -15.921 445 HB1 ALA 73 HB1 ALA 73 5.867 -9.255 -17.555 446 HB2 ALA 73 HB2 ALA 73 5.545 -9.971 -15.958 447 HB3 ALA 73 HB3 ALA 73 4.975 -10.790 -17.432 448 H ARG 74 H ARG 74 3.457 -9.509 -19.405 449 HA ARG 74 HA ARG 74 4.224 -7.012 -20.349 450 HB2 ARG 74 HB2 ARG 74 3.348 -7.813 -22.526 451 HB3 ARG 74 HB3 ARG 74 4.247 -9.089 -21.729 452 HG2 ARG 74 HG2 ARG 74 2.067 -10.015 -20.838 453 HG3 ARG 74 HG3 ARG 74 1.207 -8.784 -21.741 454 HD2 ARG 74 HD2 ARG 74 1.241 -10.880 -23.034 455 HD3 ARG 74 HD3 ARG 74 2.177 -9.660 -23.874 456 HE ARG 74 HE ARG 74 3.227 -12.076 -22.547 457 HH11 ARG 74 HH22 ARG 74 3.980 -8.948 -23.974 458 HH12 ARG 74 HH21 ARG 74 5.646 -9.333 -24.251 459 HH21 ARG 74 HH12 ARG 74 5.425 -12.584 -22.913 460 HH22 ARG 74 HH11 ARG 74 6.473 -11.415 -23.643 461 H ASP 75 H ASP 75 1.122 -8.411 -19.286 462 HA ASP 75 HA ASP 75 -0.458 -6.394 -20.463 463 HB2 ASP 75 HB2 ASP 75 -1.439 -8.562 -19.935 464 HB3 ASP 75 HB3 ASP 75 -0.955 -8.437 -18.255 465 HD2 ASP 75 HD2 ASP 75 -4.272 -7.259 -19.758 466 H ALA 76 H ALA 76 1.273 -6.930 -17.389 467 HA ALA 76 HA ALA 76 -0.076 -4.962 -15.878 468 HB1 ALA 76 HB1 ALA 76 2.421 -6.609 -15.664 469 HB2 ALA 76 HB2 ALA 76 2.274 -5.179 -14.615 470 HB3 ALA 76 HB3 ALA 76 1.048 -6.467 -14.540 471 H ILE 77 H ILE 77 2.931 -4.992 -17.885 472 HA ILE 77 HA ILE 77 3.492 -2.257 -17.309 473 HB ILE 77 HB ILE 77 4.586 -3.996 -19.519 474 HG12 ILE 77 HG12 ILE 77 5.859 -3.679 -16.806 475 HG13 ILE 77 HG13 ILE 77 4.667 -4.930 -17.094 476 HG21 ILE 77 HG21 ILE 77 5.180 -1.733 -19.896 477 HG22 ILE 77 HG22 ILE 77 5.557 -1.467 -18.177 478 HG23 ILE 77 HG23 ILE 77 6.602 -2.516 -19.165 479 HD11 ILE 77 HD11 ILE 77 6.079 -5.609 -19.152 480 HD12 ILE 77 HD12 ILE 77 7.346 -4.553 -18.483 481 HD13 ILE 77 HD13 ILE 77 6.776 -5.959 -17.552 482 H LYS 78 H LYS 78 1.843 -4.099 -19.913 483 HA LYS 78 HA LYS 78 1.547 -1.836 -21.597 484 HB2 LYS 78 HB2 LYS 78 1.553 -4.229 -22.339 485 HB3 LYS 78 HB3 LYS 78 -0.016 -4.435 -21.587 486 HG2 LYS 78 HG2 LYS 78 -0.624 -3.910 -23.792 487 HG3 LYS 78 HG3 LYS 78 -0.721 -2.338 -23.023 488 HD2 LYS 78 HD2 LYS 78 1.594 -1.808 -23.808 489 HD3 LYS 78 HD3 LYS 78 1.699 -3.383 -24.569 490 HE2 LYS 78 HE2 LYS 78 -0.606 -1.544 -25.275 491 HE3 LYS 78 HE3 LYS 78 0.968 -1.264 -25.994 492 HZ1 LYS 78 HZ1 LYS 78 -0.766 -2.912 -27.023 493 HZ2 LYS 78 HZ2 LYS 78 0.841 -3.162 -27.167 494 HZ3 LYS 78 HZ3 LYS 78 -0.015 -3.979 -26.041 495 H ASP 79 H ASP 79 -0.183 -3.165 -18.812 496 HA ASP 79 HA ASP 79 -2.600 -1.857 -19.332 497 HB2 ASP 79 HB2 ASP 79 -1.285 -3.189 -16.976 498 HB3 ASP 79 HB3 ASP 79 -2.632 -2.124 -16.628 499 HD2 ASP 79 HD2 ASP 79 -4.134 -3.516 -16.149 500 H ALA 80 H ALA 80 0.256 -1.181 -17.176 501 HA ALA 80 HA ALA 80 -0.719 1.257 -16.185 502 HB1 ALA 80 HB1 ALA 80 2.088 1.338 -16.119 503 HB2 ALA 80 HB2 ALA 80 1.008 0.731 -14.841 504 HB3 ALA 80 HB3 ALA 80 1.684 -0.393 -16.044 505 H TYR 81 H TYR 81 1.566 0.442 -18.883 506 HA TYR 81 HA TYR 81 2.088 3.069 -19.635 507 HB2 TYR 81 HB2 TYR 81 1.990 0.300 -20.937 508 HB3 TYR 81 HB3 TYR 81 2.386 1.687 -21.932 509 HD1 TYR 81 HD1 TYR 81 3.394 0.743 -18.438 510 HD2 TYR 81 HD2 TYR 81 4.653 1.633 -22.429 511 HE1 TYR 81 HE1 TYR 81 5.826 0.574 -17.716 512 HE2 TYR 81 HE2 TYR 81 7.081 1.461 -21.694 513 HH TYR 81 HH TYR 81 7.948 1.291 -18.367 514 H GLU 82 H GLU 82 -0.459 0.744 -20.739 515 HA GLU 82 HA GLU 82 -1.480 2.606 -22.604 516 HB2 GLU 82 HB2 GLU 82 -1.666 0.111 -22.835 517 HB3 GLU 82 HB3 GLU 82 -2.765 0.082 -21.470 518 HG2 GLU 82 HG2 GLU 82 -4.229 0.132 -23.326 519 HG3 GLU 82 HG3 GLU 82 -4.194 1.806 -22.810 520 HE2 GLU 82 HE2 GLU 82 -2.383 0.751 -26.233 521 H SER 83 H SER 83 -1.885 1.993 -19.176 522 HA SER 83 HA SER 83 -4.460 3.178 -19.031 523 HB2 SER 83 HB2 SER 83 -3.964 1.582 -17.334 524 HB3 SER 83 HB3 SER 83 -2.394 2.284 -17.000 525 HG SER 83 HG SER 83 -3.286 3.841 -15.756 526 H TYR 84 H TYR 84 -1.113 4.255 -19.055 527 HA TYR 84 HA TYR 84 -1.979 6.928 -18.183 528 HB2 TYR 84 HB2 TYR 84 0.692 5.396 -18.253 529 HB3 TYR 84 HB3 TYR 84 0.613 7.104 -17.870 530 HD1 TYR 84 HD1 TYR 84 -1.483 7.500 -16.016 531 HD2 TYR 84 HD2 TYR 84 1.070 4.087 -16.385 532 HE1 TYR 84 HE1 TYR 84 -1.883 6.928 -13.572 533 HE2 TYR 84 HE2 TYR 84 0.662 3.526 -13.940 534 HH TYR 84 HH TYR 84 -1.694 5.323 -12.048 535 H CYS 85 H CYS 85 -1.285 5.045 -20.911 536 HA CYS 85 HA CYS 85 0.397 6.501 -22.447 537 HB2 CYS 85 HB2 CYS 85 -0.689 5.545 -24.376 538 HB3 CYS 85 HB3 CYS 85 -0.653 4.347 -23.097 539 HG CYS 85 HG CYS 85 -3.131 5.564 -22.217 540 H GLY 86 H GLY 86 0.236 8.400 -23.734 541 HA2 GLY 86 HA2 GLY 86 -1.001 10.109 -24.777 542 HA3 GLY 86 HA3 GLY 86 -2.315 9.863 -23.644 543 H ILE 87 H ILE 87 -0.236 9.596 -21.359 544 HA ILE 87 HA ILE 87 -0.087 12.453 -20.875 545 HB ILE 87 HB ILE 87 0.264 10.015 -19.137 546 HG12 ILE 87 HG12 ILE 87 -1.700 11.492 -18.008 547 HG13 ILE 87 HG13 ILE 87 -1.925 11.951 -19.685 548 HG21 ILE 87 HG21 ILE 87 0.117 12.449 -17.623 549 HG22 ILE 87 HG22 ILE 87 1.369 11.183 -17.612 550 HG23 ILE 87 HG23 ILE 87 1.483 12.538 -18.761 551 HD11 ILE 87 HD11 ILE 87 -2.081 9.574 -20.353 552 HD12 ILE 87 HD12 ILE 87 -1.777 9.073 -18.672 553 HD13 ILE 87 HD13 ILE 87 -3.274 9.943 -19.084 554 H ASP 88 H ASP 88 1.785 13.640 -20.824 555 HA ASP 88 HA ASP 88 4.198 12.103 -21.381 556 HB2 ASP 88 HB2 ASP 88 4.940 13.814 -22.804 557 HB3 ASP 88 HB3 ASP 88 3.214 13.826 -23.106 558 HD2 ASP 88 HD2 ASP 88 5.602 15.950 -21.266 559 H ASP 89 H ASP 89 2.653 14.858 -19.648 560 HA ASP 89 HA ASP 89 4.700 14.637 -17.638 561 HB2 ASP 89 HB2 ASP 89 5.350 16.916 -17.659 562 HB3 ASP 89 HB3 ASP 89 5.322 16.479 -19.356 563 HD2 ASP 89 HD2 ASP 89 2.397 17.350 -20.002 564 H CYS 90 H CYS 90 3.824 15.155 -15.549 565 HA CYS 90 HA CYS 90 1.028 15.168 -15.357 566 HB2 CYS 90 HB2 CYS 90 1.373 14.734 -13.169 567 HB3 CYS 90 HB3 CYS 90 3.033 14.477 -13.670 568 HA PRO 91 HA PRO 91 0.416 19.483 -15.642 569 HB2 PRO 91 HB2 PRO 91 -2.180 19.630 -14.803 570 HB3 PRO 91 HB3 PRO 91 -1.725 19.198 -16.439 571 HG2 PRO 91 HG2 PRO 91 -2.707 17.452 -14.265 572 HG3 PRO 91 HG3 PRO 91 -2.654 17.135 -15.988 573 HD2 PRO 91 HD2 PRO 91 -0.868 16.098 -13.997 574 HD3 PRO 91 HD3 PRO 91 -0.747 15.877 -15.731 575 H GLN 92 H GLN 92 0.092 17.763 -12.703 576 HA GLN 92 HA GLN 92 -0.459 19.868 -11.030 577 HB2 GLN 92 HB2 GLN 92 0.761 17.160 -10.771 578 HB3 GLN 92 HB3 GLN 92 1.144 18.272 -9.473 579 HG2 GLN 92 HG2 GLN 92 -1.092 18.473 -8.786 580 HG3 GLN 92 HG3 GLN 92 -1.730 18.101 -10.375 581 HE21 GLN 92 HE21 GLN 92 -3.133 16.675 -9.164 582 HE22 GLN 92 HE22 GLN 92 -2.616 15.070 -8.768 583 H CYS 93 H CYS 93 2.423 19.119 -12.865 584 HA CYS 93 HA CYS 93 4.221 20.524 -11.170 585 HB2 CYS 93 HB2 CYS 93 4.357 19.105 -13.766 586 HB3 CYS 93 HB3 CYS 93 5.480 20.439 -13.595 587 H SER 94 H SER 94 2.133 21.207 -14.004 588 HA SER 94 HA SER 94 3.248 23.817 -14.322 589 HB2 SER 94 HB2 SER 94 1.766 24.029 -16.196 590 HB3 SER 94 HB3 SER 94 2.347 22.375 -16.216 591 HG SER 94 HG SER 94 0.196 22.182 -14.739 592 H LYS 95 H LYS 95 0.867 22.281 -12.341 593 HA LYS 95 HA LYS 95 -0.725 24.687 -12.043 594 HB2 LYS 95 HB2 LYS 95 -2.145 22.887 -12.024 595 HB3 LYS 95 HB3 LYS 95 -0.981 21.817 -11.270 596 HG2 LYS 95 HG2 LYS 95 -2.035 24.174 -9.691 597 HG3 LYS 95 HG3 LYS 95 -3.054 22.762 -9.885 598 HD2 LYS 95 HD2 LYS 95 -0.856 21.444 -9.137 599 HD3 LYS 95 HD3 LYS 95 -0.390 22.996 -8.471 600 HE2 LYS 95 HE2 LYS 95 -1.601 21.564 -6.805 601 HE3 LYS 95 HE3 LYS 95 -2.415 23.089 -7.091 602 HZ1 LYS 95 HZ1 LYS 95 -3.164 20.821 -8.736 603 HZ2 LYS 95 HZ2 LYS 95 -3.692 20.855 -7.191 604 HZ3 LYS 95 HZ3 LYS 95 -4.078 22.069 -8.213 605 H TYR 96 H TYR 96 1.861 22.845 -10.443 606 HA TYR 96 HA TYR 96 1.947 24.971 -8.414 607 HB2 TYR 96 HB2 TYR 96 1.185 23.010 -7.240 608 HB3 TYR 96 HB3 TYR 96 2.044 21.926 -8.317 609 HD1 TYR 96 HD2 TYR 96 2.771 24.596 -5.778 610 HD2 TYR 96 HD1 TYR 96 3.962 20.878 -7.527 611 HE1 TYR 96 HE2 TYR 96 4.655 24.395 -4.083 612 HE2 TYR 96 HE1 TYR 96 5.842 20.689 -5.827 613 HH TYR 96 HH TYR 96 6.258 23.170 -3.316 614 H ILE 97 H ILE 97 3.936 25.905 -8.092 615 HA ILE 97 HA ILE 97 5.967 25.341 -9.969 616 HB ILE 97 HB ILE 97 7.170 27.100 -8.915 617 HG12 ILE 97 HG12 ILE 97 5.974 28.119 -6.770 618 HG13 ILE 97 HG13 ILE 97 5.454 26.461 -6.548 619 HG21 ILE 97 HG21 ILE 97 4.190 27.631 -8.964 620 HG22 ILE 97 HG22 ILE 97 5.437 28.896 -8.856 621 HG23 ILE 97 HG23 ILE 97 5.357 27.846 -10.290 622 HD11 ILE 97 HD11 ILE 97 8.156 26.176 -7.213 623 HD12 ILE 97 HD12 ILE 97 8.129 27.641 -6.203 624 HD13 ILE 97 HD13 ILE 97 7.476 26.111 -5.569 625 H ASP 98 H ASP 98 8.267 24.800 -9.362 626 HA ASP 98 HA ASP 98 8.150 22.544 -7.567 627 HB2 ASP 98 HB2 ASP 98 9.134 22.066 -9.717 628 HB3 ASP 98 HB3 ASP 98 10.135 23.504 -9.663 629 HD2 ASP 98 HD2 ASP 98 11.168 20.688 -9.924 630 H ASP 99 H ASP 99 8.516 23.245 -5.429 631 HA ASP 99 HA ASP 99 9.799 25.490 -4.669 632 HB2 ASP 99 HB2 ASP 99 9.942 24.504 -2.463 633 HB3 ASP 99 HB3 ASP 99 8.479 23.896 -3.212 634 HD2 ASP 99 HD2 ASP 99 10.235 21.151 -1.603 Start of MODEL 13 1 H GLU 14 H GLU 14 1.298 -0.645 0.290 2 HA GLU 14 HA GLU 14 0.483 0.772 -2.066 3 HB2 GLU 14 HB2 GLU 14 2.637 1.056 -3.037 4 HB3 GLU 14 HB3 GLU 14 2.802 1.654 -1.399 5 HG2 GLU 14 HG2 GLU 14 3.604 -1.136 -2.353 6 HG3 GLU 14 HG3 GLU 14 4.711 0.184 -2.035 7 HE2 GLU 14 HE2 GLU 14 5.237 -0.589 0.968 8 H ASP 15 H ASP 15 1.251 -0.628 -4.104 9 HA ASP 15 HA ASP 15 0.689 -3.370 -3.331 10 HB2 ASP 15 HB2 ASP 15 0.377 -3.443 -6.000 11 HB3 ASP 15 HB3 ASP 15 -0.906 -2.900 -4.937 12 HD2 ASP 15 HD2 ASP 15 1.919 -1.169 -5.954 13 H GLN 16 H GLN 16 1.925 -5.113 -4.509 14 HA GLN 16 HA GLN 16 4.646 -4.512 -4.611 15 HB2 GLN 16 HB2 GLN 16 3.214 -6.968 -5.714 16 HB3 GLN 16 HB3 GLN 16 4.915 -6.862 -5.308 17 HG2 GLN 16 HG2 GLN 16 2.620 -6.497 -3.323 18 HG3 GLN 16 HG3 GLN 16 3.564 -7.962 -3.504 19 HE21 GLN 16 HE21 GLN 16 6.027 -7.525 -3.504 20 HE22 GLN 16 HE22 GLN 16 6.625 -6.533 -2.216 21 H GLU 17 H GLU 17 2.072 -4.770 -7.077 22 HA GLU 17 HA GLU 17 3.574 -5.039 -9.319 23 HB2 GLU 17 HB2 GLU 17 0.967 -3.618 -8.736 24 HB3 GLU 17 HB3 GLU 17 1.652 -3.536 -10.347 25 HG2 GLU 17 HG2 GLU 17 0.072 -5.435 -10.163 26 HG3 GLU 17 HG3 GLU 17 1.695 -6.010 -10.492 27 HE2 GLU 17 HE2 GLU 17 -0.712 -5.738 -8.141 28 H GLN 18 H GLN 18 2.622 -1.959 -7.645 29 HA GLN 18 HA GLN 18 3.849 -0.259 -9.405 30 HB2 GLN 18 HB2 GLN 18 2.281 0.446 -7.618 31 HB3 GLN 18 HB3 GLN 18 3.472 0.052 -6.394 32 HG2 GLN 18 HG2 GLN 18 5.034 1.749 -7.360 33 HG3 GLN 18 HG3 GLN 18 3.853 2.137 -8.595 34 HE21 GLN 18 HE21 GLN 18 4.810 4.083 -6.981 35 HE22 GLN 18 HE22 GLN 18 3.600 4.651 -5.881 36 H TRP 19 H TRP 19 5.179 -2.151 -6.671 37 HA TRP 19 HA TRP 19 7.648 -0.850 -6.500 38 HB2 TRP 19 HB2 TRP 19 6.604 -2.443 -4.850 39 HB3 TRP 19 HB3 TRP 19 7.078 -3.756 -5.910 40 HD1 TRP 19 HD1 TRP 19 9.044 -0.712 -4.399 41 HE1 TRP 19 HE1 TRP 19 11.377 -1.508 -3.457 42 HE3 TRP 19 HE3 TRP 19 8.460 -5.611 -5.629 43 HZ2 TRP 19 HZ2 TRP 19 12.687 -4.041 -3.336 44 HZ3 TRP 19 HZ3 TRP 19 10.313 -7.179 -5.064 45 HH2 TRP 19 HH2 TRP 19 12.371 -6.465 -3.957 46 H ALA 20 H ALA 20 6.290 -3.353 -8.662 47 HA ALA 20 HA ALA 20 8.761 -4.158 -9.767 48 HB1 ALA 20 HB1 ALA 20 6.255 -4.315 -11.381 49 HB2 ALA 20 HB2 ALA 20 7.457 -5.574 -11.008 50 HB3 ALA 20 HB3 ALA 20 6.234 -5.124 -9.795 51 H MET 21 H MET 21 6.204 -1.795 -10.774 52 HA MET 21 HA MET 21 7.265 -1.067 -13.158 53 HB2 MET 21 HB2 MET 21 5.840 0.573 -10.997 54 HB3 MET 21 HB3 MET 21 6.146 1.213 -12.599 55 HG2 MET 21 HG2 MET 21 4.941 -0.909 -13.504 56 HG3 MET 21 HG3 MET 21 4.410 -1.179 -11.856 57 HE1 MET 21 HE1 MET 21 3.319 2.415 -14.517 58 HE2 MET 21 HE2 MET 21 4.964 2.236 -13.860 59 HE3 MET 21 HE3 MET 21 4.315 1.014 -14.980 60 H GLN 22 H GLN 22 8.303 -0.142 -9.868 61 HA GLN 22 HA GLN 22 9.696 2.069 -10.197 62 HB2 GLN 22 HB2 GLN 22 10.589 -0.461 -8.754 63 HB3 GLN 22 HB3 GLN 22 11.394 1.083 -8.561 64 HG2 GLN 22 HG2 GLN 22 8.400 0.738 -8.096 65 HG3 GLN 22 HG3 GLN 22 9.578 0.503 -6.820 66 HE21 GLN 22 HE21 GLN 22 10.924 2.240 -6.178 67 HE22 GLN 22 HE22 GLN 22 10.443 3.890 -6.393 68 H THR 23 H THR 23 11.679 -0.948 -10.302 69 HA THR 23 HA THR 23 13.643 0.232 -11.925 70 HB THR 23 HB THR 23 12.991 -2.704 -11.336 71 HG1 THR 23 HG1 THR 23 13.839 -2.110 -9.376 72 HG21 THR 23 HG21 THR 23 15.050 -3.252 -12.204 73 HG22 THR 23 HG22 THR 23 14.926 -1.713 -13.090 74 HG23 THR 23 HG23 THR 23 15.805 -1.782 -11.543 75 H LEU 24 H LEU 24 11.097 -2.222 -12.738 76 HA LEU 24 HA LEU 24 11.567 -2.704 -15.289 77 HB2 LEU 24 HB2 LEU 24 9.654 -3.547 -14.078 78 HB3 LEU 24 HB3 LEU 24 8.906 -1.962 -14.067 79 HG LEU 24 HG LEU 24 9.563 -3.188 -16.717 80 HD11 LEU 24 HD11 LEU 24 7.015 -3.940 -15.291 81 HD12 LEU 24 HD12 LEU 24 7.714 -4.621 -16.779 82 HD13 LEU 24 HD13 LEU 24 8.477 -4.952 -15.206 83 HD21 LEU 24 HD21 LEU 24 8.601 -1.208 -17.190 84 HD22 LEU 24 HD22 LEU 24 7.089 -2.110 -16.927 85 HD23 LEU 24 HD23 LEU 24 7.768 -1.109 -15.620 86 H MET 25 H MET 25 9.404 0.101 -14.475 87 HA MET 25 HA MET 25 9.895 1.230 -17.011 88 HB2 MET 25 HB2 MET 25 8.301 2.880 -16.305 89 HB3 MET 25 HB3 MET 25 7.812 1.440 -15.434 90 HG2 MET 25 HG2 MET 25 7.979 2.661 -13.521 91 HG3 MET 25 HG3 MET 25 9.719 2.607 -13.727 92 HE1 MET 25 HE1 MET 25 6.550 5.421 -14.593 93 HE2 MET 25 HE2 MET 25 7.338 5.461 -16.188 94 HE3 MET 25 HE3 MET 25 6.798 3.911 -15.501 95 H GLY 26 H GLY 26 11.542 1.319 -13.948 96 HA2 GLY 26 HA2 GLY 26 12.673 3.925 -14.140 97 HA3 GLY 26 HA3 GLY 26 13.197 2.605 -13.112 98 H SER 27 H SER 27 13.117 1.082 -16.007 99 HA SER 27 HA SER 27 15.874 1.066 -16.271 100 HB2 SER 27 HB2 SER 27 14.730 -0.846 -17.066 101 HB3 SER 27 HB3 SER 27 13.568 0.100 -17.975 102 HG SER 27 HG SER 27 15.394 -1.045 -19.181 103 H GLY 28 H GLY 28 13.627 3.472 -17.103 104 HA2 GLY 28 HA2 GLY 28 14.311 5.536 -17.969 105 HA3 GLY 28 HA3 GLY 28 15.583 4.749 -18.882 106 H VAL 29 H VAL 29 12.657 2.933 -19.001 107 HA VAL 29 HA VAL 29 12.356 3.503 -21.773 108 HB VAL 29 HB VAL 29 10.812 1.829 -19.790 109 HG11 VAL 29 HG11 VAL 29 9.831 2.803 -22.223 110 HG12 VAL 29 HG12 VAL 29 10.371 1.145 -22.582 111 HG13 VAL 29 HG13 VAL 29 9.193 1.435 -21.279 112 HG21 VAL 29 HG21 VAL 29 12.159 0.484 -22.010 113 HG22 VAL 29 HG22 VAL 29 13.283 1.412 -20.989 114 HG23 VAL 29 HG23 VAL 29 12.239 0.167 -20.261 115 H LEU 30 H LEU 30 10.494 4.217 -18.757 116 HA LEU 30 HA LEU 30 8.751 5.939 -20.348 117 HB2 LEU 30 HB2 LEU 30 8.531 4.717 -17.606 118 HB3 LEU 30 HB3 LEU 30 7.477 6.015 -18.131 119 HG LEU 30 HG LEU 30 7.748 3.377 -19.594 120 HD11 LEU 30 HD11 LEU 30 6.816 2.658 -17.614 121 HD12 LEU 30 HD12 LEU 30 5.975 4.198 -17.319 122 HD13 LEU 30 HD13 LEU 30 5.365 3.074 -18.557 123 HD21 LEU 30 HD21 LEU 30 5.280 4.923 -19.901 124 HD22 LEU 30 HD22 LEU 30 6.728 5.772 -20.492 125 HD23 LEU 30 HD23 LEU 30 6.322 4.158 -21.124 126 H ALA 31 H ALA 31 8.025 7.972 -18.842 127 HA ALA 31 HA ALA 31 10.537 9.176 -17.900 128 HB1 ALA 31 HB1 ALA 31 9.734 11.303 -18.872 129 HB2 ALA 31 HB2 ALA 31 9.906 10.046 -20.120 130 HB3 ALA 31 HB3 ALA 31 8.292 10.471 -19.501 131 H ARG 32 H ARG 32 10.457 10.054 -15.872 132 HA ARG 32 HA ARG 32 7.785 10.400 -14.772 133 HB2 ARG 32 HB2 ARG 32 8.514 9.490 -12.645 134 HB3 ARG 32 HB3 ARG 32 9.012 8.348 -13.878 135 HG2 ARG 32 HG2 ARG 32 11.307 9.308 -13.872 136 HG3 ARG 32 HG3 ARG 32 10.820 10.505 -12.688 137 HD2 ARG 32 HD2 ARG 32 10.590 8.895 -10.955 138 HD3 ARG 32 HD3 ARG 32 10.417 7.561 -12.078 139 HE ARG 32 HE ARG 32 12.931 8.752 -11.150 140 HH11 ARG 32 HH22 ARG 32 11.405 6.826 -13.669 141 HH12 ARG 32 HH21 ARG 32 12.883 6.070 -14.163 142 HH21 ARG 32 HH12 ARG 32 14.881 7.754 -11.802 143 HH22 ARG 32 HH11 ARG 32 14.873 6.602 -13.095 144 H CYS 33 H CYS 33 7.660 12.068 -13.016 145 HA CYS 33 HA CYS 33 9.527 14.201 -13.582 146 HB2 CYS 33 HB2 CYS 33 7.012 14.531 -13.539 147 HB3 CYS 33 HB3 CYS 33 7.073 14.297 -11.803 148 H ARG 34 H ARG 34 10.984 15.044 -12.033 149 HA ARG 34 HA ARG 34 11.918 13.308 -10.138 150 HB2 ARG 34 HB2 ARG 34 12.211 16.346 -10.348 151 HB3 ARG 34 HB3 ARG 34 13.161 15.364 -9.250 152 HG2 ARG 34 HG2 ARG 34 13.173 15.317 -12.291 153 HG3 ARG 34 HG3 ARG 34 14.517 15.633 -11.212 154 HD2 ARG 34 HD2 ARG 34 13.139 12.968 -11.738 155 HD3 ARG 34 HD3 ARG 34 14.820 13.380 -12.016 156 HE ARG 34 HE ARG 34 13.610 12.612 -9.461 157 HH11 ARG 34 HH22 ARG 34 16.311 14.276 -10.984 158 HH12 ARG 34 HH21 ARG 34 17.360 14.093 -9.619 159 HH21 ARG 34 HH12 ARG 34 14.994 12.370 -7.659 160 HH22 ARG 34 HH11 ARG 34 16.606 13.001 -7.714 161 H ILE 35 H ILE 35 9.279 15.639 -10.035 162 HA ILE 35 HA ILE 35 9.194 15.557 -7.125 163 HB ILE 35 HB ILE 35 8.965 17.686 -8.434 164 HG12 ILE 35 HG12 ILE 35 8.080 17.122 -6.041 165 HG13 ILE 35 HG13 ILE 35 7.632 18.628 -6.816 166 HG21 ILE 35 HG21 ILE 35 6.744 16.170 -9.608 167 HG22 ILE 35 HG22 ILE 35 6.294 17.802 -9.057 168 HG23 ILE 35 HG23 ILE 35 7.624 17.591 -10.221 169 HD11 ILE 35 HD11 ILE 35 5.811 16.395 -7.496 170 HD12 ILE 35 HD12 ILE 35 5.848 16.786 -5.760 171 HD13 ILE 35 HD13 ILE 35 5.431 18.045 -6.947 172 H HIS 36 H HIS 36 7.971 13.922 -9.910 173 HA HIS 36 HA HIS 36 5.853 12.776 -8.238 174 HB2 HIS 36 HB2 HIS 36 5.747 12.793 -11.246 175 HB3 HIS 36 HB3 HIS 36 4.444 12.559 -10.098 176 HD1 HIS 36 HD1 HIS 36 4.505 14.991 -8.343 177 HD2 HIS 36 HD2 HIS 36 5.298 15.187 -12.458 178 HE1 HIS 36 HE1 HIS 36 4.057 17.404 -9.044 179 H ASN 37 H ASN 37 6.704 10.898 -7.449 180 HA ASN 37 HA ASN 37 8.384 9.367 -9.235 181 HB2 ASN 37 HB2 ASN 37 8.946 8.049 -7.198 182 HB3 ASN 37 HB3 ASN 37 9.179 9.761 -6.902 183 HD21 ASN 37 HD21 ASN 37 6.860 7.107 -6.576 184 HD22 ASN 37 HD22 ASN 37 6.068 7.669 -5.141 185 H ASP 38 H ASP 38 5.132 9.636 -8.097 186 HA ASP 38 HA ASP 38 4.627 6.807 -8.426 187 HB2 ASP 38 HB2 ASP 38 3.553 7.740 -6.491 188 HB3 ASP 38 HB3 ASP 38 3.015 9.157 -7.371 189 HD2 ASP 38 HD2 ASP 38 2.546 5.748 -7.217 190 H VAL 39 H VAL 39 4.588 9.825 -10.118 191 HA VAL 39 HA VAL 39 2.373 9.167 -11.844 192 HB VAL 39 HB VAL 39 4.388 11.412 -11.732 193 HG11 VAL 39 HG11 VAL 39 3.268 12.496 -13.555 194 HG12 VAL 39 HG12 VAL 39 3.710 10.858 -14.094 195 HG13 VAL 39 HG13 VAL 39 2.030 11.220 -13.631 196 HG21 VAL 39 HG21 VAL 39 2.737 11.524 -9.976 197 HG22 VAL 39 HG22 VAL 39 2.351 12.761 -11.196 198 HG23 VAL 39 HG23 VAL 39 1.416 11.248 -11.137 199 H ILE 40 H ILE 40 2.502 8.441 -13.981 200 HA ILE 40 HA ILE 40 5.206 7.744 -14.886 201 HB ILE 40 HB ILE 40 4.584 5.651 -14.388 202 HG12 ILE 40 HG12 ILE 40 2.955 5.922 -16.929 203 HG13 ILE 40 HG13 ILE 40 4.705 5.842 -16.893 204 HG21 ILE 40 HG21 ILE 40 2.658 5.891 -13.152 205 HG22 ILE 40 HG22 ILE 40 1.777 6.701 -14.469 206 HG23 ILE 40 HG23 ILE 40 2.066 4.946 -14.539 207 HD11 ILE 40 HD11 ILE 40 4.481 3.645 -15.592 208 HD12 ILE 40 HD12 ILE 40 2.740 3.710 -15.957 209 HD13 ILE 40 HD13 ILE 40 3.923 3.596 -17.282 210 H LEU 41 H LEU 41 5.704 8.633 -16.816 211 HA LEU 41 HA LEU 41 3.436 9.425 -18.509 212 HB2 LEU 41 HB2 LEU 41 6.057 10.828 -17.993 213 HB3 LEU 41 HB3 LEU 41 4.988 11.236 -19.321 214 HG LEU 41 HG LEU 41 3.222 11.406 -17.287 215 HD11 LEU 41 HD11 LEU 41 4.987 10.805 -15.627 216 HD12 LEU 41 HD12 LEU 41 5.823 12.322 -16.036 217 HD13 LEU 41 HD13 LEU 41 4.195 12.369 -15.320 218 HD21 LEU 41 HD21 LEU 41 3.109 13.535 -17.944 219 HD22 LEU 41 HD22 LEU 41 4.794 13.865 -17.476 220 HD23 LEU 41 HD23 LEU 41 4.437 13.136 -19.060 221 H ASP 42 H ASP 42 3.859 9.364 -20.857 222 HA ASP 42 HA ASP 42 5.415 7.033 -21.438 223 HB2 ASP 42 HB2 ASP 42 3.203 7.267 -22.465 224 HB3 ASP 42 HB3 ASP 42 3.621 8.838 -23.121 225 HD2 ASP 42 HD2 ASP 42 2.840 7.641 -24.999 226 H SER 43 H SER 43 7.544 7.186 -22.165 227 HA SER 43 HA SER 43 8.456 9.807 -22.968 228 HB2 SER 43 HB2 SER 43 9.631 8.285 -21.222 229 HB3 SER 43 HB3 SER 43 10.165 7.321 -22.585 230 HG SER 43 HG SER 43 10.789 10.074 -21.990 231 H GLY 44 H GLY 44 7.678 6.611 -24.226 232 HA2 GLY 44 HA2 GLY 44 7.335 6.107 -26.444 233 HA3 GLY 44 HA3 GLY 44 8.223 7.536 -26.930 234 H ASN 45 H ASN 45 10.184 6.307 -24.582 235 HA ASN 45 HA ASN 45 12.157 5.540 -26.279 236 HB2 ASN 45 HB2 ASN 45 12.243 6.037 -23.728 237 HB3 ASN 45 HB3 ASN 45 11.778 4.366 -23.481 238 HD21 ASN 45 HD21 ASN 45 13.965 6.072 -25.722 239 HD22 ASN 45 HD22 ASN 45 15.380 5.123 -25.412 240 H ASP 46 H ASP 46 13.220 3.151 -26.110 241 HA ASP 46 HA ASP 46 11.604 1.443 -27.465 242 HB2 ASP 46 HB2 ASP 46 14.143 1.175 -25.878 243 HB3 ASP 46 HB3 ASP 46 13.332 -0.316 -26.313 244 HD2 ASP 46 HD2 ASP 46 14.095 0.001 -29.700 245 H ALA 47 H ALA 47 9.688 0.526 -26.699 246 HA ALA 47 HA ALA 47 9.209 0.220 -23.916 247 HB1 ALA 47 HB1 ALA 47 7.652 -0.961 -26.245 248 HB2 ALA 47 HB2 ALA 47 7.049 -0.557 -24.619 249 HB3 ALA 47 HB3 ALA 47 7.518 0.742 -25.743 250 H SER 48 H SER 48 10.560 -1.772 -26.501 251 HA SER 48 HA SER 48 10.024 -4.258 -25.456 252 HB2 SER 48 HB2 SER 48 10.932 -3.903 -27.716 253 HB3 SER 48 HB3 SER 48 12.428 -3.274 -27.055 254 HG SER 48 HG SER 48 11.651 -5.853 -26.158 255 H SER 49 H SER 49 12.512 -1.815 -24.651 256 HA SER 49 HA SER 49 14.124 -3.526 -23.149 257 HB2 SER 49 HB2 SER 49 14.793 -1.273 -24.057 258 HB3 SER 49 HB3 SER 49 13.760 -0.510 -22.864 259 HG SER 49 HG SER 49 15.124 -1.909 -21.276 260 H ALA 50 H ALA 50 11.406 -1.285 -22.315 261 HA ALA 50 HA ALA 50 11.531 -1.561 -19.561 262 HB1 ALA 50 HB1 ALA 50 9.718 -0.527 -21.595 263 HB2 ALA 50 HB2 ALA 50 8.819 -1.285 -20.258 264 HB3 ALA 50 HB3 ALA 50 9.977 0.025 -19.923 265 H TYR 51 H TYR 51 9.836 -3.533 -22.072 266 HA TYR 51 HA TYR 51 8.688 -5.280 -20.132 267 HB2 TYR 51 HB2 TYR 51 9.278 -5.700 -23.122 268 HB3 TYR 51 HB3 TYR 51 7.980 -6.443 -22.210 269 HD1 TYR 51 HD1 TYR 51 6.903 -4.056 -20.746 270 HD2 TYR 51 HD2 TYR 51 8.149 -4.520 -24.813 271 HE1 TYR 51 HE1 TYR 51 5.341 -2.177 -21.448 272 HE2 TYR 51 HE2 TYR 51 6.582 -2.640 -25.500 273 HH TYR 51 HH TYR 51 5.157 -1.160 -24.851 274 H LYS 52 H LYS 52 11.759 -5.068 -21.867 275 HA LYS 52 HA LYS 52 12.437 -7.793 -21.721 276 HB2 LYS 52 HB2 LYS 52 13.501 -6.208 -23.260 277 HB3 LYS 52 HB3 LYS 52 14.184 -5.320 -21.912 278 HG2 LYS 52 HG2 LYS 52 15.577 -7.193 -21.258 279 HG3 LYS 52 HG3 LYS 52 14.721 -8.292 -22.321 280 HD2 LYS 52 HD2 LYS 52 16.254 -5.866 -23.355 281 HD3 LYS 52 HD3 LYS 52 16.996 -7.442 -23.168 282 HE2 LYS 52 HE2 LYS 52 15.202 -8.415 -24.673 283 HE3 LYS 52 HE3 LYS 52 14.579 -6.796 -24.923 284 HZ1 LYS 52 HZ1 LYS 52 16.122 -6.491 -26.440 285 HZ2 LYS 52 HZ2 LYS 52 17.325 -6.777 -25.373 286 HZ3 LYS 52 HZ3 LYS 52 16.681 -8.010 -26.229 287 H LEU 53 H LEU 53 13.199 -4.957 -19.592 288 HA LEU 53 HA LEU 53 14.540 -6.601 -17.700 289 HB2 LEU 53 HB2 LEU 53 15.126 -4.675 -16.715 290 HB3 LEU 53 HB3 LEU 53 14.679 -4.022 -18.279 291 HG LEU 53 HG LEU 53 12.577 -4.165 -16.151 292 HD11 LEU 53 HD11 LEU 53 13.936 -3.095 -14.708 293 HD12 LEU 53 HD12 LEU 53 15.058 -2.562 -15.983 294 HD13 LEU 53 HD13 LEU 53 13.539 -1.676 -15.706 295 HD21 LEU 53 HD21 LEU 53 11.479 -2.639 -17.403 296 HD22 LEU 53 HD22 LEU 53 12.967 -1.784 -17.875 297 HD23 LEU 53 HD23 LEU 53 12.510 -3.294 -18.698 298 H GLY 54 H GLY 54 11.228 -5.274 -18.098 299 HA2 GLY 54 HA2 GLY 54 10.212 -5.861 -15.578 300 HA3 GLY 54 HA3 GLY 54 9.296 -5.782 -17.070 301 H THR 55 H THR 55 10.199 -7.882 -18.607 302 HA THR 55 HA THR 55 8.996 -10.099 -17.307 303 HB THR 55 HB THR 55 9.531 -11.204 -19.487 304 HG1 THR 55 HG1 THR 55 11.330 -10.374 -20.470 305 HG21 THR 55 HG21 THR 55 8.835 -9.070 -21.011 306 HG22 THR 55 HG22 THR 55 7.648 -9.915 -19.989 307 HG23 THR 55 HG23 THR 55 8.404 -8.409 -19.415 308 H TYR 56 H TYR 56 12.349 -9.008 -17.788 309 HA TYR 56 HA TYR 56 13.612 -11.430 -17.245 310 HB2 TYR 56 HB2 TYR 56 14.132 -8.440 -17.037 311 HB3 TYR 56 HB3 TYR 56 15.297 -9.495 -16.261 312 HD1 TYR 56 HD1 TYR 56 13.613 -10.705 -19.273 313 HD2 TYR 56 HD2 TYR 56 17.048 -8.635 -17.785 314 HE1 TYR 56 HE1 TYR 56 14.792 -11.046 -21.500 315 HE2 TYR 56 HE2 TYR 56 18.216 -8.983 -20.016 316 HH TYR 56 HH TYR 56 18.144 -9.989 -21.944 317 H LEU 57 H LEU 57 12.576 -8.743 -15.042 318 HA LEU 57 HA LEU 57 13.534 -10.153 -12.744 319 HB2 LEU 57 HB2 LEU 57 13.506 -7.679 -12.999 320 HB3 LEU 57 HB3 LEU 57 11.755 -7.719 -12.938 321 HG LEU 57 HG LEU 57 13.192 -9.015 -10.675 322 HD11 LEU 57 HD11 LEU 57 13.895 -6.378 -11.502 323 HD12 LEU 57 HD12 LEU 57 12.944 -6.260 -10.002 324 HD13 LEU 57 HD13 LEU 57 14.408 -7.272 -10.051 325 HD21 LEU 57 HD21 LEU 57 10.775 -9.006 -10.704 326 HD22 LEU 57 HD22 LEU 57 11.360 -7.960 -9.388 327 HD23 LEU 57 HD23 LEU 57 10.748 -7.237 -10.895 328 H TYR 58 H TYR 58 10.297 -9.369 -14.174 329 HA TYR 58 HA TYR 58 8.700 -10.517 -12.287 330 HB2 TYR 58 HB2 TYR 58 8.727 -10.254 -15.331 331 HB3 TYR 58 HB3 TYR 58 7.395 -11.119 -14.590 332 HD1 TYR 58 HD1 TYR 58 7.026 -9.471 -12.096 333 HD2 TYR 58 HD2 TYR 58 7.686 -8.312 -16.162 334 HE1 TYR 58 HE1 TYR 58 5.837 -7.266 -11.668 335 HE2 TYR 58 HE2 TYR 58 6.495 -6.110 -15.720 336 HH TYR 58 HH TYR 58 5.404 -4.911 -14.297 337 H GLN 59 H GLN 59 10.097 -12.165 -15.215 338 HA GLN 59 HA GLN 59 9.053 -14.640 -14.601 339 HB2 GLN 59 HB2 GLN 59 10.448 -15.476 -16.333 340 HB3 GLN 59 HB3 GLN 59 10.129 -13.814 -16.789 341 HG2 GLN 59 HG2 GLN 59 12.317 -13.135 -15.731 342 HG3 GLN 59 HG3 GLN 59 12.639 -14.818 -15.364 343 HE21 GLN 59 HE21 GLN 59 11.321 -13.057 -18.172 344 HE22 GLN 59 HE22 GLN 59 12.398 -13.707 -19.363 345 H LYS 60 H LYS 60 12.245 -13.143 -13.782 346 HA LYS 60 HA LYS 60 12.486 -15.146 -11.662 347 HB2 LYS 60 HB2 LYS 60 14.563 -15.855 -12.272 348 HB3 LYS 60 HB3 LYS 60 13.902 -15.538 -13.864 349 HG2 LYS 60 HG2 LYS 60 14.954 -13.293 -13.891 350 HG3 LYS 60 HG3 LYS 60 15.547 -13.525 -12.258 351 HD2 LYS 60 HD2 LYS 60 16.271 -15.604 -14.320 352 HD3 LYS 60 HD3 LYS 60 17.076 -14.050 -14.413 353 HE2 LYS 60 HE2 LYS 60 18.526 -15.152 -12.961 354 HE3 LYS 60 HE3 LYS 60 17.443 -14.423 -11.792 355 HZ1 LYS 60 HZ1 LYS 60 17.966 -16.995 -11.866 356 HZ2 LYS 60 HZ2 LYS 60 16.560 -16.400 -11.288 357 HZ3 LYS 60 HZ3 LYS 60 16.633 -16.989 -12.809 358 H ASP 61 H ASP 61 12.699 -14.178 -9.719 359 HA ASP 61 HA ASP 61 13.533 -11.393 -9.783 360 HB2 ASP 61 HB2 ASP 61 11.824 -13.035 -7.883 361 HB3 ASP 61 HB3 ASP 61 12.538 -11.529 -7.342 362 HD2 ASP 61 HD2 ASP 61 10.275 -12.084 -10.363 363 H ASN 62 H ASN 62 14.498 -10.870 -7.320 364 HA ASN 62 HA ASN 62 16.782 -12.600 -7.162 365 HB2 ASN 62 HB2 ASN 62 16.717 -9.957 -7.041 366 HB3 ASN 62 HB3 ASN 62 16.243 -10.195 -5.370 367 HD21 ASN 62 HD21 ASN 62 17.642 -11.195 -3.912 368 HD22 ASN 62 HD22 ASN 62 19.349 -11.310 -4.183 369 H SER 63 H SER 63 16.363 -14.469 -5.934 370 HA SER 63 HA SER 63 15.886 -15.730 -4.235 371 HB2 SER 63 HB2 SER 63 17.235 -14.118 -2.912 372 HB3 SER 63 HB3 SER 63 15.808 -13.143 -2.619 373 HG SER 63 HG SER 63 15.254 -14.443 -1.015 374 H CYS 64 H CYS 64 13.765 -15.229 -5.899 375 HA CYS 64 HA CYS 64 11.560 -15.400 -4.048 376 HB2 CYS 64 HB2 CYS 64 11.945 -13.088 -5.881 377 HB3 CYS 64 HB3 CYS 64 10.340 -13.791 -5.853 378 HG CYS 64 HG CYS 64 9.661 -12.568 -3.947 379 H ASN 65 H ASN 65 9.490 -16.009 -5.445 380 HA ASN 65 HA ASN 65 10.459 -17.817 -7.509 381 HB2 ASN 65 HB2 ASN 65 8.481 -19.187 -7.034 382 HB3 ASN 65 HB3 ASN 65 9.267 -18.823 -5.510 383 HD21 ASN 65 HD21 ASN 65 6.388 -18.965 -7.065 384 HD22 ASN 65 HD22 ASN 65 5.425 -17.892 -6.106 385 H LEU 66 H LEU 66 8.282 -18.342 -9.040 386 HA LEU 66 HA LEU 66 7.009 -15.784 -9.661 387 HB2 LEU 66 HB2 LEU 66 8.926 -15.908 -11.110 388 HB3 LEU 66 HB3 LEU 66 8.518 -17.540 -11.598 389 HG LEU 66 HG LEU 66 8.000 -15.603 -13.208 390 HD11 LEU 66 HD11 LEU 66 6.858 -17.188 -14.252 391 HD12 LEU 66 HD12 LEU 66 6.746 -18.097 -12.725 392 HD13 LEU 66 HD13 LEU 66 5.467 -16.941 -13.169 393 HD21 LEU 66 HD21 LEU 66 5.678 -15.268 -11.289 394 HD22 LEU 66 HD22 LEU 66 6.959 -14.081 -11.631 395 HD23 LEU 66 HD23 LEU 66 5.801 -14.533 -12.905 396 H PHE 67 H PHE 67 4.872 -16.129 -9.410 397 HA PHE 67 HA PHE 67 3.873 -18.773 -10.205 398 HB2 PHE 67 HB2 PHE 67 3.762 -17.956 -7.737 399 HB3 PHE 67 HB3 PHE 67 2.697 -16.677 -8.286 400 HD1 PHE 67 HD1 PHE 67 3.008 -20.312 -7.814 401 HD2 PHE 67 HD2 PHE 67 0.399 -17.115 -8.801 402 HE1 PHE 67 HE1 PHE 67 1.034 -21.839 -7.543 403 HE2 PHE 67 HE2 PHE 67 -1.575 -18.642 -8.530 404 HZ PHE 67 HZ PHE 67 -1.234 -20.986 -7.905 405 H ASN 68 H ASN 68 3.801 -15.326 -10.757 406 HA ASN 68 HA ASN 68 1.212 -15.396 -11.963 407 HB2 ASN 68 HB2 ASN 68 3.378 -13.295 -11.585 408 HB3 ASN 68 HB3 ASN 68 2.073 -12.988 -12.714 409 HD21 ASN 68 HD21 ASN 68 2.307 -14.585 -9.535 410 HD22 ASN 68 HD22 ASN 68 1.074 -13.668 -8.737 411 H THR 69 H THR 69 0.835 -15.237 -14.275 412 HA THR 69 HA THR 69 2.915 -16.364 -15.891 413 HB THR 69 HB THR 69 0.555 -17.019 -16.175 414 HG1 THR 69 HG1 THR 69 0.680 -16.735 -18.446 415 HG21 THR 69 HG21 THR 69 0.162 -14.076 -16.174 416 HG22 THR 69 HG22 THR 69 -0.637 -14.893 -17.538 417 HG23 THR 69 HG23 THR 69 -1.020 -15.370 -15.867 418 H LEU 70 H LEU 70 3.328 -15.368 -18.150 419 HA LEU 70 HA LEU 70 4.545 -12.845 -17.649 420 HB2 LEU 70 HB2 LEU 70 5.819 -14.156 -19.011 421 HB3 LEU 70 HB3 LEU 70 4.443 -14.825 -19.865 422 HG LEU 70 HG LEU 70 4.157 -12.611 -21.019 423 HD11 LEU 70 HD11 LEU 70 6.357 -11.224 -21.014 424 HD12 LEU 70 HD12 LEU 70 5.172 -11.001 -19.705 425 HD13 LEU 70 HD13 LEU 70 6.628 -11.986 -19.429 426 HD21 LEU 70 HD21 LEU 70 5.859 -13.012 -22.653 427 HD22 LEU 70 HD22 LEU 70 6.868 -13.881 -21.472 428 HD23 LEU 70 HD23 LEU 70 5.325 -14.585 -22.013 429 H THR 71 H THR 71 1.543 -14.014 -19.161 430 HA THR 71 HA THR 71 0.871 -11.811 -20.679 431 HB THR 71 HB THR 71 -1.064 -13.467 -18.993 432 HG1 THR 71 HG1 THR 71 0.770 -14.020 -21.161 433 HG21 THR 71 HG21 THR 71 -1.376 -12.994 -21.937 434 HG22 THR 71 HG22 THR 71 -2.615 -13.017 -20.660 435 HG23 THR 71 HG23 THR 71 -1.609 -11.568 -20.898 436 H GLU 72 H GLU 72 0.763 -12.248 -17.141 437 HA GLU 72 HA GLU 72 -0.766 -9.900 -16.762 438 HB2 GLU 72 HB2 GLU 72 -0.579 -11.922 -15.184 439 HB3 GLU 72 HB3 GLU 72 0.990 -11.302 -14.707 440 HG2 GLU 72 HG2 GLU 72 -0.479 -10.379 -13.092 441 HG3 GLU 72 HG3 GLU 72 -0.227 -9.056 -14.214 442 HE2 GLU 72 HE2 GLU 72 -2.256 -9.164 -12.674 443 H ALA 73 H ALA 73 2.665 -10.700 -17.110 444 HA ALA 73 HA ALA 73 3.668 -8.338 -15.917 445 HB1 ALA 73 HB1 ALA 73 4.787 -10.410 -17.835 446 HB2 ALA 73 HB2 ALA 73 5.747 -9.036 -17.236 447 HB3 ALA 73 HB3 ALA 73 5.104 -10.239 -16.092 448 H ARG 74 H ARG 74 3.072 -9.364 -19.349 449 HA ARG 74 HA ARG 74 3.875 -6.924 -20.400 450 HB2 ARG 74 HB2 ARG 74 1.940 -8.996 -21.555 451 HB3 ARG 74 HB3 ARG 74 2.712 -7.725 -22.482 452 HG2 ARG 74 HG2 ARG 74 4.952 -8.766 -21.453 453 HG3 ARG 74 HG3 ARG 74 3.950 -10.188 -21.242 454 HD2 ARG 74 HD2 ARG 74 4.822 -8.841 -23.799 455 HD3 ARG 74 HD3 ARG 74 4.814 -10.547 -23.398 456 HE ARG 74 HE ARG 74 2.575 -8.996 -24.483 457 HH11 ARG 74 HH22 ARG 74 3.487 -11.903 -22.722 458 HH12 ARG 74 HH21 ARG 74 2.040 -12.761 -23.136 459 HH21 ARG 74 HH12 ARG 74 0.666 -10.127 -25.029 460 HH22 ARG 74 HH11 ARG 74 0.425 -11.744 -24.457 461 H ASP 75 H ASP 75 0.737 -8.214 -19.234 462 HA ASP 75 HA ASP 75 -0.774 -6.084 -20.282 463 HB2 ASP 75 HB2 ASP 75 -1.253 -8.244 -18.202 464 HB3 ASP 75 HB3 ASP 75 -2.446 -6.984 -18.446 465 HD2 ASP 75 HD2 ASP 75 -2.093 -8.593 -21.953 466 H ALA 76 H ALA 76 1.059 -6.777 -17.306 467 HA ALA 76 HA ALA 76 -0.140 -4.827 -15.663 468 HB1 ALA 76 HB1 ALA 76 2.224 -5.122 -14.507 469 HB2 ALA 76 HB2 ALA 76 1.041 -6.452 -14.494 470 HB3 ALA 76 HB3 ALA 76 2.385 -6.467 -15.661 471 H ILE 77 H ILE 77 2.754 -4.842 -17.835 472 HA ILE 77 HA ILE 77 3.348 -2.113 -17.222 473 HB ILE 77 HB ILE 77 4.401 -3.777 -19.502 474 HG12 ILE 77 HG12 ILE 77 5.855 -3.668 -16.900 475 HG13 ILE 77 HG13 ILE 77 4.460 -4.724 -16.993 476 HG21 ILE 77 HG21 ILE 77 4.968 -1.432 -19.644 477 HG22 ILE 77 HG22 ILE 77 5.536 -1.431 -17.957 478 HG23 ILE 77 HG23 ILE 77 6.411 -2.370 -19.189 479 HD11 ILE 77 HD11 ILE 77 5.512 -5.582 -19.234 480 HD12 ILE 77 HD12 ILE 77 7.003 -4.812 -18.643 481 HD13 ILE 77 HD13 ILE 77 6.240 -6.113 -17.699 482 H LYS 78 H LYS 78 1.549 -3.929 -19.721 483 HA LYS 78 HA LYS 78 1.263 -1.695 -21.447 484 HB2 LYS 78 HB2 LYS 78 -0.112 -4.383 -21.252 485 HB3 LYS 78 HB3 LYS 78 -0.541 -3.190 -22.461 486 HG2 LYS 78 HG2 LYS 78 2.380 -3.861 -22.133 487 HG3 LYS 78 HG3 LYS 78 1.355 -5.049 -22.912 488 HD2 LYS 78 HD2 LYS 78 1.474 -2.121 -23.767 489 HD3 LYS 78 HD3 LYS 78 2.463 -3.374 -24.489 490 HE2 LYS 78 HE2 LYS 78 0.092 -4.610 -24.774 491 HE3 LYS 78 HE3 LYS 78 -0.524 -2.972 -24.672 492 HZ1 LYS 78 HZ1 LYS 78 -0.057 -3.500 -26.920 493 HZ2 LYS 78 HZ2 LYS 78 1.041 -2.387 -26.446 494 HZ3 LYS 78 HZ3 LYS 78 1.475 -3.955 -26.585 495 H ASP 79 H ASP 79 -0.380 -2.895 -18.554 496 HA ASP 79 HA ASP 79 -2.751 -1.454 -19.012 497 HB2 ASP 79 HB2 ASP 79 -1.471 -2.891 -16.690 498 HB3 ASP 79 HB3 ASP 79 -2.786 -1.789 -16.334 499 HD2 ASP 79 HD2 ASP 79 -3.321 -4.212 -19.204 500 H ALA 80 H ALA 80 0.211 -1.012 -16.946 501 HA ALA 80 HA ALA 80 -0.573 1.439 -15.836 502 HB1 ALA 80 HB1 ALA 80 1.270 -0.260 -15.142 503 HB2 ALA 80 HB2 ALA 80 2.293 0.595 -16.321 504 HB3 ALA 80 HB3 ALA 80 1.604 1.476 -14.936 505 H TYR 81 H TYR 81 1.502 0.596 -18.688 506 HA TYR 81 HA TYR 81 2.173 3.193 -19.386 507 HB2 TYR 81 HB2 TYR 81 1.723 0.509 -20.788 508 HB3 TYR 81 HB3 TYR 81 2.163 1.903 -21.755 509 HD1 TYR 81 HD2 TYR 81 3.382 0.943 -18.349 510 HD2 TYR 81 HD1 TYR 81 4.340 1.440 -22.489 511 HE1 TYR 81 HE2 TYR 81 5.838 0.528 -17.838 512 HE2 TYR 81 HE1 TYR 81 6.793 1.024 -21.964 513 HH TYR 81 HH TYR 81 7.929 0.853 -18.680 514 H GLU 82 H GLU 82 -0.534 1.110 -20.638 515 HA GLU 82 HA GLU 82 -1.555 3.190 -22.214 516 HB2 GLU 82 HB2 GLU 82 -3.291 1.672 -22.780 517 HB3 GLU 82 HB3 GLU 82 -1.898 0.651 -22.484 518 HG2 GLU 82 HG2 GLU 82 -3.579 -0.447 -21.255 519 HG3 GLU 82 HG3 GLU 82 -2.787 0.509 -20.017 520 HE2 GLU 82 HE2 GLU 82 -6.383 1.667 -21.395 521 H SER 83 H SER 83 -1.846 2.308 -18.826 522 HA SER 83 HA SER 83 -4.332 3.423 -18.320 523 HB2 SER 83 HB2 SER 83 -3.484 2.051 -16.610 524 HB3 SER 83 HB3 SER 83 -1.892 2.782 -16.664 525 HG SER 83 HG SER 83 -2.591 3.880 -14.956 526 H TYR 84 H TYR 84 -0.976 4.784 -18.174 527 HA TYR 84 HA TYR 84 -2.117 7.431 -17.694 528 HB2 TYR 84 HB2 TYR 84 0.659 6.107 -17.662 529 HB3 TYR 84 HB3 TYR 84 0.485 7.843 -17.494 530 HD1 TYR 84 HD1 TYR 84 -0.579 8.812 -15.472 531 HD2 TYR 84 HD2 TYR 84 0.110 4.605 -15.843 532 HE1 TYR 84 HE1 TYR 84 -0.916 8.529 -12.968 533 HE2 TYR 84 HE2 TYR 84 -0.230 4.336 -13.338 534 HH TYR 84 HH TYR 84 -1.280 7.053 -11.360 535 H CYS 85 H CYS 85 -1.159 5.415 -20.280 536 HA CYS 85 HA CYS 85 0.325 6.890 -21.948 537 HB2 CYS 85 HB2 CYS 85 -0.339 4.748 -22.675 538 HB3 CYS 85 HB3 CYS 85 -2.046 5.104 -22.502 539 HG CYS 85 HG CYS 85 -1.789 5.042 -24.995 540 H GLY 86 H GLY 86 -0.003 8.659 -23.395 541 HA2 GLY 86 HA2 GLY 86 -1.398 10.192 -24.521 542 HA3 GLY 86 HA3 GLY 86 -2.636 9.972 -23.300 543 H ILE 87 H ILE 87 0.361 10.039 -21.713 544 HA ILE 87 HA ILE 87 0.217 12.953 -21.386 545 HB ILE 87 HB ILE 87 0.520 10.861 -19.230 546 HG12 ILE 87 HG12 ILE 87 -1.618 12.967 -19.311 547 HG13 ILE 87 HG13 ILE 87 -1.798 11.529 -20.296 548 HG21 ILE 87 HG21 ILE 87 1.615 13.460 -19.319 549 HG22 ILE 87 HG22 ILE 87 0.202 13.541 -18.239 550 HG23 ILE 87 HG23 ILE 87 1.497 12.362 -17.924 551 HD11 ILE 87 HD11 ILE 87 -2.694 11.569 -17.793 552 HD12 ILE 87 HD12 ILE 87 -1.937 10.098 -18.450 553 HD13 ILE 87 HD13 ILE 87 -0.999 11.191 -17.404 554 H ASP 88 H ASP 88 2.022 13.724 -22.355 555 HA ASP 88 HA ASP 88 4.413 12.101 -22.121 556 HB2 ASP 88 HB2 ASP 88 3.906 12.751 -24.395 557 HB3 ASP 88 HB3 ASP 88 3.600 14.412 -23.928 558 HD2 ASP 88 HD2 ASP 88 7.136 12.881 -23.472 559 H ASP 89 H ASP 89 2.807 14.584 -20.531 560 HA ASP 89 HA ASP 89 5.215 15.426 -19.265 561 HB2 ASP 89 HB2 ASP 89 5.162 17.055 -21.086 562 HB3 ASP 89 HB3 ASP 89 3.459 17.372 -20.824 563 HD2 ASP 89 HD2 ASP 89 5.940 19.764 -19.413 564 H CYS 90 H CYS 90 4.703 15.765 -17.072 565 HA CYS 90 HA CYS 90 2.127 15.232 -16.175 566 HB2 CYS 90 HB2 CYS 90 3.032 16.059 -13.950 567 HB3 CYS 90 HB3 CYS 90 3.908 14.741 -14.702 568 HA PRO 91 HA PRO 91 0.483 19.257 -16.785 569 HB2 PRO 91 HB2 PRO 91 -2.046 18.774 -15.867 570 HB3 PRO 91 HB3 PRO 91 -1.536 18.415 -17.505 571 HG2 PRO 91 HG2 PRO 91 -1.992 16.552 -15.255 572 HG3 PRO 91 HG3 PRO 91 -1.903 16.202 -16.969 573 HD2 PRO 91 HD2 PRO 91 0.135 15.715 -15.010 574 HD3 PRO 91 HD3 PRO 91 0.266 15.473 -16.741 575 H GLN 92 H GLN 92 0.940 17.676 -13.847 576 HA GLN 92 HA GLN 92 -0.179 19.579 -12.168 577 HB2 GLN 92 HB2 GLN 92 1.845 17.379 -11.907 578 HB3 GLN 92 HB3 GLN 92 1.806 18.571 -10.623 579 HG2 GLN 92 HG2 GLN 92 0.217 17.062 -9.827 580 HG3 GLN 92 HG3 GLN 92 -0.822 18.166 -10.706 581 HE21 GLN 92 HE21 GLN 92 -0.337 15.053 -10.112 582 HE22 GLN 92 HE22 GLN 92 -0.874 14.302 -11.578 583 H CYS 93 H CYS 93 3.145 19.218 -13.548 584 HA CYS 93 HA CYS 93 4.261 21.363 -12.171 585 HB2 CYS 93 HB2 CYS 93 4.985 19.794 -14.616 586 HB3 CYS 93 HB3 CYS 93 5.814 21.313 -14.340 587 H SER 94 H SER 94 2.331 21.059 -15.175 588 HA SER 94 HA SER 94 2.787 23.785 -15.880 589 HB2 SER 94 HB2 SER 94 1.411 23.327 -17.801 590 HB3 SER 94 HB3 SER 94 2.407 21.909 -17.544 591 HG SER 94 HG SER 94 -0.360 22.241 -16.753 592 H LYS 95 H LYS 95 0.717 22.030 -13.742 593 HA LYS 95 HA LYS 95 -1.501 23.849 -13.935 594 HB2 LYS 95 HB2 LYS 95 -1.964 21.540 -13.451 595 HB3 LYS 95 HB3 LYS 95 -0.857 21.532 -12.093 596 HG2 LYS 95 HG2 LYS 95 -2.365 23.493 -11.164 597 HG3 LYS 95 HG3 LYS 95 -3.547 22.919 -12.323 598 HD2 LYS 95 HD2 LYS 95 -2.931 20.532 -11.230 599 HD3 LYS 95 HD3 LYS 95 -2.459 21.537 -9.874 600 HE2 LYS 95 HE2 LYS 95 -4.750 21.051 -9.454 601 HE3 LYS 95 HE3 LYS 95 -4.778 22.679 -10.101 602 HZ1 LYS 95 HZ1 LYS 95 -6.311 21.694 -11.403 603 HZ2 LYS 95 HZ2 LYS 95 -5.005 21.363 -12.326 604 HZ3 LYS 95 HZ3 LYS 95 -5.627 20.212 -11.349 605 H TYR 96 H TYR 96 1.453 23.404 -11.994 606 HA TYR 96 HA TYR 96 0.837 24.964 -9.812 607 HB2 TYR 96 HB2 TYR 96 2.920 23.536 -10.408 608 HB3 TYR 96 HB3 TYR 96 3.434 24.833 -11.468 609 HD1 TYR 96 HD2 TYR 96 2.377 24.348 -7.894 610 HD2 TYR 96 HD1 TYR 96 4.972 26.358 -10.639 611 HE1 TYR 96 HE2 TYR 96 3.574 25.471 -5.952 612 HE2 TYR 96 HE1 TYR 96 6.160 27.474 -8.687 613 HH TYR 96 HH TYR 96 5.277 26.680 -5.348 614 H ILE 97 H ILE 97 -0.077 26.967 -9.843 615 HA ILE 97 HA ILE 97 1.305 28.987 -11.435 616 HB ILE 97 HB ILE 97 -0.557 28.279 -12.800 617 HG12 ILE 97 HG12 ILE 97 -1.795 30.497 -12.898 618 HG13 ILE 97 HG13 ILE 97 -0.867 30.993 -11.496 619 HG21 ILE 97 HG21 ILE 97 -1.980 27.327 -11.048 620 HG22 ILE 97 HG22 ILE 97 -2.330 28.962 -10.439 621 HG23 ILE 97 HG23 ILE 97 -2.875 28.482 -12.064 622 HD11 ILE 97 HD11 ILE 97 -0.029 31.369 -14.067 623 HD12 ILE 97 HD12 ILE 97 1.087 31.211 -12.689 624 HD13 ILE 97 HD13 ILE 97 0.735 29.800 -13.716 625 H ASP 98 H ASP 98 1.061 31.163 -10.575 626 HA ASP 98 HA ASP 98 0.611 31.025 -7.727 627 HB2 ASP 98 HB2 ASP 98 1.747 33.225 -7.678 628 HB3 ASP 98 HB3 ASP 98 2.712 32.041 -8.536 629 HD2 ASP 98 HD2 ASP 98 1.755 33.672 -11.665 630 H ASP 99 H ASP 99 -1.603 31.341 -7.285 631 HA ASP 99 HA ASP 99 -3.212 32.926 -8.949 632 HB2 ASP 99 HB2 ASP 99 -4.296 31.172 -7.744 633 HB3 ASP 99 HB3 ASP 99 -3.544 31.626 -6.228 634 HD2 ASP 99 HD2 ASP 99 -6.527 32.981 -5.383 Start of MODEL 14 1 H GLU 14 H GLU 14 1.009 2.812 -5.745 2 HA GLU 14 HA GLU 14 2.448 2.290 -3.281 3 HB2 GLU 14 HB2 GLU 14 -0.355 3.325 -3.858 4 HB3 GLU 14 HB3 GLU 14 0.156 2.862 -2.247 5 HG2 GLU 14 HG2 GLU 14 1.897 4.548 -2.208 6 HG3 GLU 14 HG3 GLU 14 1.732 4.859 -3.925 7 HE2 GLU 14 HE2 GLU 14 -0.018 7.163 -3.872 8 H ASP 15 H ASP 15 0.749 0.678 -5.753 9 HA ASP 15 HA ASP 15 -0.327 -1.298 -3.939 10 HB2 ASP 15 HB2 ASP 15 -1.059 -2.309 -6.269 11 HB3 ASP 15 HB3 ASP 15 -1.904 -0.917 -5.620 12 HD2 ASP 15 HD2 ASP 15 -1.323 0.807 -8.504 13 H GLN 16 H GLN 16 -0.036 -3.702 -5.109 14 HA GLN 16 HA GLN 16 2.658 -4.283 -4.825 15 HB2 GLN 16 HB2 GLN 16 0.400 -5.908 -6.074 16 HB3 GLN 16 HB3 GLN 16 1.980 -6.563 -5.691 17 HG2 GLN 16 HG2 GLN 16 0.279 -5.160 -3.589 18 HG3 GLN 16 HG3 GLN 16 0.100 -6.871 -3.925 19 HE21 GLN 16 HE21 GLN 16 0.992 -7.941 -2.331 20 HE22 GLN 16 HE22 GLN 16 2.569 -7.694 -1.659 21 H GLU 17 H GLU 17 0.547 -4.114 -7.774 22 HA GLU 17 HA GLU 17 2.400 -4.851 -9.610 23 HB2 GLU 17 HB2 GLU 17 1.023 -3.641 -11.253 24 HB3 GLU 17 HB3 GLU 17 0.001 -4.471 -10.096 25 HG2 GLU 17 HG2 GLU 17 -0.285 -2.352 -8.810 26 HG3 GLU 17 HG3 GLU 17 0.764 -1.516 -9.938 27 HE2 GLU 17 HE2 GLU 17 -1.727 -2.935 -12.327 28 H GLN 18 H GLN 18 2.008 -1.728 -7.922 29 HA GLN 18 HA GLN 18 3.664 -0.264 -9.618 30 HB2 GLN 18 HB2 GLN 18 2.530 0.068 -6.863 31 HB3 GLN 18 HB3 GLN 18 3.904 1.077 -7.270 32 HG2 GLN 18 HG2 GLN 18 1.788 0.913 -9.374 33 HG3 GLN 18 HG3 GLN 18 1.296 1.699 -7.888 34 HE21 GLN 18 HE21 GLN 18 4.570 1.583 -9.186 35 HE22 GLN 18 HE22 GLN 18 4.748 3.272 -9.529 36 H TRP 19 H TRP 19 4.270 -2.479 -6.904 37 HA TRP 19 HA TRP 19 6.818 -1.701 -6.189 38 HB2 TRP 19 HB2 TRP 19 5.310 -3.402 -5.094 39 HB3 TRP 19 HB3 TRP 19 5.817 -4.545 -6.322 40 HD1 TRP 19 HD1 TRP 19 7.318 -2.550 -3.352 41 HE1 TRP 19 HE1 TRP 19 9.516 -3.705 -2.458 42 HE3 TRP 19 HE3 TRP 19 7.581 -6.074 -7.008 43 HZ2 TRP 19 HZ2 TRP 19 11.083 -5.914 -3.360 44 HZ3 TRP 19 HZ3 TRP 19 9.476 -7.692 -6.928 45 HH2 TRP 19 HH2 TRP 19 11.189 -7.651 -5.185 46 H ALA 20 H ALA 20 5.599 -3.697 -8.927 47 HA ALA 20 HA ALA 20 8.201 -4.425 -9.816 48 HB1 ALA 20 HB1 ALA 20 6.003 -4.439 -11.785 49 HB2 ALA 20 HB2 ALA 20 7.031 -5.773 -11.210 50 HB3 ALA 20 HB3 ALA 20 5.609 -5.275 -10.263 51 H MET 21 H MET 21 5.836 -1.817 -10.540 52 HA MET 21 HA MET 21 7.020 -0.847 -12.808 53 HB2 MET 21 HB2 MET 21 5.420 0.390 -10.528 54 HB3 MET 21 HB3 MET 21 6.013 1.421 -11.815 55 HG2 MET 21 HG2 MET 21 4.909 -0.658 -13.273 56 HG3 MET 21 HG3 MET 21 3.849 -0.628 -11.878 57 HE1 MET 21 HE1 MET 21 4.647 1.015 -15.276 58 HE2 MET 21 HE2 MET 21 4.544 2.753 -14.905 59 HE3 MET 21 HE3 MET 21 5.830 1.761 -14.176 60 H GLN 22 H GLN 22 8.255 -0.916 -9.578 61 HA GLN 22 HA GLN 22 9.611 1.396 -9.318 62 HB2 GLN 22 HB2 GLN 22 10.250 -1.449 -8.512 63 HB3 GLN 22 HB3 GLN 22 11.402 -0.175 -8.165 64 HG2 GLN 22 HG2 GLN 22 9.213 1.075 -7.224 65 HG3 GLN 22 HG3 GLN 22 8.615 -0.565 -7.075 66 HE21 GLN 22 HE21 GLN 22 8.606 -0.598 -4.877 67 HE22 GLN 22 HE22 GLN 22 10.031 -0.622 -3.892 68 H THR 23 H THR 23 11.718 -1.405 -10.019 69 HA THR 23 HA THR 23 13.631 0.027 -11.363 70 HB THR 23 HB THR 23 12.823 -2.908 -11.717 71 HG1 THR 23 HG1 THR 23 14.340 -1.283 -9.821 72 HG21 THR 23 HG21 THR 23 14.707 -1.821 -13.224 73 HG22 THR 23 HG22 THR 23 15.634 -1.750 -11.707 74 HG23 THR 23 HG23 THR 23 15.082 -3.319 -12.339 75 H LEU 24 H LEU 24 10.748 -1.653 -12.730 76 HA LEU 24 HA LEU 24 11.238 -1.492 -15.361 77 HB2 LEU 24 HB2 LEU 24 9.120 -2.130 -13.883 78 HB3 LEU 24 HB3 LEU 24 8.567 -0.560 -14.432 79 HG LEU 24 HG LEU 24 9.399 -1.661 -16.791 80 HD11 LEU 24 HD11 LEU 24 9.843 -3.812 -15.510 81 HD12 LEU 24 HD12 LEU 24 8.076 -3.957 -15.342 82 HD13 LEU 24 HD13 LEU 24 8.818 -3.939 -16.960 83 HD21 LEU 24 HD21 LEU 24 6.695 -2.448 -16.455 84 HD22 LEU 24 HD22 LEU 24 6.939 -0.958 -15.511 85 HD23 LEU 24 HD23 LEU 24 7.338 -0.988 -17.246 86 H MET 25 H MET 25 9.492 1.178 -13.615 87 HA MET 25 HA MET 25 9.757 2.966 -15.686 88 HB2 MET 25 HB2 MET 25 9.591 3.482 -12.663 89 HB3 MET 25 HB3 MET 25 9.228 4.675 -13.894 90 HG2 MET 25 HG2 MET 25 7.710 2.285 -14.492 91 HG3 MET 25 HG3 MET 25 7.477 2.666 -12.798 92 HE1 MET 25 HE1 MET 25 8.382 5.362 -15.564 93 HE2 MET 25 HE2 MET 25 7.518 4.051 -16.403 94 HE3 MET 25 HE3 MET 25 6.761 5.653 -16.240 95 H GLY 26 H GLY 26 12.023 2.023 -13.120 96 HA2 GLY 26 HA2 GLY 26 13.749 4.298 -13.429 97 HA3 GLY 26 HA3 GLY 26 14.056 2.831 -12.521 98 H SER 27 H SER 27 13.073 1.535 -15.354 99 HA SER 27 HA SER 27 15.643 0.818 -16.114 100 HB2 SER 27 HB2 SER 27 13.076 0.671 -17.756 101 HB3 SER 27 HB3 SER 27 14.535 -0.253 -18.054 102 HG SER 27 HG SER 27 14.253 -1.311 -16.003 103 H GLY 28 H GLY 28 13.569 3.549 -16.929 104 HA2 GLY 28 HA2 GLY 28 14.394 5.507 -17.881 105 HA3 GLY 28 HA3 GLY 28 15.684 4.609 -18.656 106 H VAL 29 H VAL 29 12.747 2.871 -18.926 107 HA VAL 29 HA VAL 29 12.644 3.361 -21.728 108 HB VAL 29 HB VAL 29 11.173 1.673 -19.740 109 HG11 VAL 29 HG11 VAL 29 10.089 0.891 -22.149 110 HG12 VAL 29 HG12 VAL 29 9.266 1.875 -20.915 111 HG13 VAL 29 HG13 VAL 29 10.082 2.665 -22.285 112 HG21 VAL 29 HG21 VAL 29 11.988 0.283 -22.092 113 HG22 VAL 29 HG22 VAL 29 13.333 1.335 -21.589 114 HG23 VAL 29 HG23 VAL 29 12.648 0.158 -20.443 115 H LEU 30 H LEU 30 10.583 4.186 -18.873 116 HA LEU 30 HA LEU 30 8.933 5.832 -20.621 117 HB2 LEU 30 HB2 LEU 30 8.637 4.589 -17.936 118 HB3 LEU 30 HB3 LEU 30 7.794 6.099 -18.218 119 HG LEU 30 HG LEU 30 7.516 3.681 -20.018 120 HD11 LEU 30 HD11 LEU 30 5.298 3.376 -18.863 121 HD12 LEU 30 HD12 LEU 30 6.732 2.961 -17.893 122 HD13 LEU 30 HD13 LEU 30 5.879 4.498 -17.609 123 HD21 LEU 30 HD21 LEU 30 6.960 6.090 -20.805 124 HD22 LEU 30 HD22 LEU 30 5.783 4.785 -21.089 125 HD23 LEU 30 HD23 LEU 30 5.538 5.929 -19.746 126 H ALA 31 H ALA 31 8.194 7.985 -19.300 127 HA ALA 31 HA ALA 31 10.737 9.318 -18.687 128 HB1 ALA 31 HB1 ALA 31 8.819 11.277 -19.158 129 HB2 ALA 31 HB2 ALA 31 10.010 10.678 -20.338 130 HB3 ALA 31 HB3 ALA 31 8.371 9.985 -20.298 131 H ARG 32 H ARG 32 11.052 10.191 -16.678 132 HA ARG 32 HA ARG 32 8.687 10.288 -14.984 133 HB2 ARG 32 HB2 ARG 32 10.050 9.542 -13.079 134 HB3 ARG 32 HB3 ARG 32 10.205 8.376 -14.378 135 HG2 ARG 32 HG2 ARG 32 12.196 10.652 -13.996 136 HG3 ARG 32 HG3 ARG 32 12.389 9.103 -13.201 137 HD2 ARG 32 HD2 ARG 32 13.517 8.495 -15.099 138 HD3 ARG 32 HD3 ARG 32 11.924 8.285 -15.797 139 HE ARG 32 HE ARG 32 12.629 11.040 -16.045 140 HH11 ARG 32 HH22 ARG 32 13.612 7.906 -17.307 141 HH12 ARG 32 HH21 ARG 32 14.190 8.548 -18.808 142 HH21 ARG 32 HH12 ARG 32 13.391 11.888 -18.025 143 HH22 ARG 32 HH11 ARG 32 14.063 10.829 -19.219 144 H CYS 33 H CYS 33 8.763 11.975 -13.269 145 HA CYS 33 HA CYS 33 10.271 14.260 -14.195 146 HB2 CYS 33 HB2 CYS 33 7.805 13.830 -12.627 147 HB3 CYS 33 HB3 CYS 33 8.807 15.144 -12.044 148 H ARG 34 H ARG 34 11.961 15.215 -13.005 149 HA ARG 34 HA ARG 34 13.166 13.539 -11.088 150 HB2 ARG 34 HB2 ARG 34 14.503 14.905 -12.672 151 HB3 ARG 34 HB3 ARG 34 13.835 16.381 -12.004 152 HG2 ARG 34 HG2 ARG 34 16.165 15.712 -11.150 153 HG3 ARG 34 HG3 ARG 34 14.980 16.104 -9.920 154 HD2 ARG 34 HD2 ARG 34 14.697 13.850 -9.271 155 HD3 ARG 34 HD3 ARG 34 15.229 13.225 -10.819 156 HE ARG 34 HE ARG 34 16.911 13.770 -8.558 157 HH11 ARG 34 HH22 ARG 34 16.886 14.075 -12.064 158 HH12 ARG 34 HH21 ARG 34 18.609 13.976 -12.212 159 HH21 ARG 34 HH12 ARG 34 19.184 13.641 -8.754 160 HH22 ARG 34 HH11 ARG 34 19.925 13.728 -10.317 161 H ILE 35 H ILE 35 10.541 15.561 -10.846 162 HA ILE 35 HA ILE 35 11.282 16.563 -8.195 163 HB ILE 35 HB ILE 35 10.487 18.146 -9.965 164 HG12 ILE 35 HG12 ILE 35 10.279 18.338 -7.355 165 HG13 ILE 35 HG13 ILE 35 9.533 19.526 -8.406 166 HG21 ILE 35 HG21 ILE 35 8.770 17.411 -11.204 167 HG22 ILE 35 HG22 ILE 35 8.211 16.282 -9.946 168 HG23 ILE 35 HG23 ILE 35 7.759 18.002 -9.863 169 HD11 ILE 35 HD11 ILE 35 7.367 18.727 -8.023 170 HD12 ILE 35 HD12 ILE 35 7.932 17.083 -7.639 171 HD13 ILE 35 HD13 ILE 35 8.134 18.393 -6.451 172 H HIS 36 H HIS 36 9.402 14.186 -9.939 173 HA HIS 36 HA HIS 36 8.628 12.996 -7.482 174 HB2 HIS 36 HB2 HIS 36 6.124 13.012 -8.272 175 HB3 HIS 36 HB3 HIS 36 6.773 14.309 -7.289 176 HD1 HIS 36 HD1 HIS 36 6.134 16.570 -8.112 177 HD2 HIS 36 HD2 HIS 36 6.433 13.792 -11.241 178 HE1 HIS 36 HE1 HIS 36 5.504 17.824 -10.243 179 H ASN 37 H ASN 37 9.193 10.928 -7.923 180 HA ASN 37 HA ASN 37 9.242 10.035 -10.606 181 HB2 ASN 37 HB2 ASN 37 10.337 8.114 -9.740 182 HB3 ASN 37 HB3 ASN 37 10.776 9.349 -8.577 183 HD21 ASN 37 HD21 ASN 37 8.676 6.629 -9.257 184 HD22 ASN 37 HD22 ASN 37 8.233 6.248 -7.626 185 H ASP 38 H ASP 38 6.778 10.448 -8.337 186 HA ASP 38 HA ASP 38 5.427 7.989 -8.681 187 HB2 ASP 38 HB2 ASP 38 4.235 10.657 -7.809 188 HB3 ASP 38 HB3 ASP 38 3.619 9.058 -7.440 189 HD2 ASP 38 HD2 ASP 38 4.240 9.862 -4.743 190 H VAL 39 H VAL 39 6.148 10.391 -10.840 191 HA VAL 39 HA VAL 39 3.509 10.333 -12.125 192 HB VAL 39 HB VAL 39 4.938 12.489 -11.416 193 HG11 VAL 39 HG11 VAL 39 6.878 12.001 -12.775 194 HG12 VAL 39 HG12 VAL 39 5.866 11.820 -14.228 195 HG13 VAL 39 HG13 VAL 39 6.038 13.414 -13.456 196 HG21 VAL 39 HG21 VAL 39 3.718 13.124 -13.942 197 HG22 VAL 39 HG22 VAL 39 2.725 11.914 -13.094 198 HG23 VAL 39 HG23 VAL 39 3.130 13.452 -12.294 199 H ILE 40 H ILE 40 3.271 9.166 -13.969 200 HA ILE 40 HA ILE 40 5.756 8.256 -15.246 201 HB ILE 40 HB ILE 40 4.928 6.294 -14.514 202 HG12 ILE 40 HG12 ILE 40 3.316 6.730 -17.045 203 HG13 ILE 40 HG13 ILE 40 4.965 6.144 -16.947 204 HG21 ILE 40 HG21 ILE 40 2.098 7.350 -14.772 205 HG22 ILE 40 HG22 ILE 40 2.578 5.773 -14.101 206 HG23 ILE 40 HG23 ILE 40 3.058 7.275 -13.275 207 HD11 ILE 40 HD11 ILE 40 4.097 4.050 -16.849 208 HD12 ILE 40 HD12 ILE 40 3.551 4.446 -15.202 209 HD13 ILE 40 HD13 ILE 40 2.453 4.678 -16.584 210 H LEU 41 H LEU 41 6.089 8.828 -17.340 211 HA LEU 41 HA LEU 41 3.753 9.857 -18.791 212 HB2 LEU 41 HB2 LEU 41 6.498 10.993 -19.176 213 HB3 LEU 41 HB3 LEU 41 4.942 11.677 -19.602 214 HG LEU 41 HG LEU 41 5.800 11.285 -16.730 215 HD11 LEU 41 HD11 LEU 41 7.495 12.687 -17.534 216 HD12 LEU 41 HD12 LEU 41 6.383 13.578 -18.600 217 HD13 LEU 41 HD13 LEU 41 6.290 13.797 -16.836 218 HD21 LEU 41 HD21 LEU 41 3.886 13.374 -17.709 219 HD22 LEU 41 HD22 LEU 41 3.337 11.690 -17.528 220 HD23 LEU 41 HD23 LEU 41 3.990 12.569 -16.124 221 H ASP 42 H ASP 42 3.672 9.385 -21.034 222 HA ASP 42 HA ASP 42 5.188 7.041 -21.672 223 HB2 ASP 42 HB2 ASP 42 2.686 7.406 -22.157 224 HB3 ASP 42 HB3 ASP 42 3.170 8.538 -23.403 225 HD2 ASP 42 HD2 ASP 42 2.255 7.388 -24.838 226 H SER 43 H SER 43 7.162 7.238 -22.737 227 HA SER 43 HA SER 43 7.802 9.747 -23.947 228 HB2 SER 43 HB2 SER 43 9.432 8.450 -22.543 229 HB3 SER 43 HB3 SER 43 9.439 7.180 -23.751 230 HG SER 43 HG SER 43 10.531 9.820 -23.888 231 H GLY 44 H GLY 44 6.796 6.483 -24.886 232 HA2 GLY 44 HA2 GLY 44 5.833 5.992 -26.942 233 HA3 GLY 44 HA3 GLY 44 6.651 7.359 -27.674 234 H ASN 45 H ASN 45 9.038 6.057 -25.798 235 HA ASN 45 HA ASN 45 10.389 5.014 -27.989 236 HB2 ASN 45 HB2 ASN 45 10.831 5.058 -24.991 237 HB3 ASN 45 HB3 ASN 45 11.858 4.020 -25.960 238 HD21 ASN 45 HD21 ASN 45 13.656 5.265 -25.431 239 HD22 ASN 45 HD22 ASN 45 13.984 6.800 -26.162 240 H ASP 46 H ASP 46 11.361 2.663 -27.944 241 HA ASP 46 HA ASP 46 9.381 0.842 -28.176 242 HB2 ASP 46 HB2 ASP 46 12.332 0.508 -27.499 243 HB3 ASP 46 HB3 ASP 46 11.301 -0.876 -27.800 244 HD2 ASP 46 HD2 ASP 46 13.504 -0.032 -29.955 245 H ALA 47 H ALA 47 7.926 0.414 -26.477 246 HA ALA 47 HA ALA 47 8.746 0.444 -23.762 247 HB1 ALA 47 HB1 ALA 47 6.471 1.048 -24.601 248 HB2 ALA 47 HB2 ALA 47 6.213 -0.657 -25.044 249 HB3 ALA 47 HB3 ALA 47 6.433 -0.204 -23.336 250 H SER 48 H SER 48 8.985 -1.854 -26.333 251 HA SER 48 HA SER 48 8.544 -4.222 -25.077 252 HB2 SER 48 HB2 SER 48 10.201 -5.169 -26.715 253 HB3 SER 48 HB3 SER 48 9.010 -4.117 -27.454 254 HG SER 48 HG SER 48 11.715 -3.888 -27.496 255 H SER 49 H SER 49 11.252 -1.935 -24.760 256 HA SER 49 HA SER 49 13.080 -3.678 -23.625 257 HB2 SER 49 HB2 SER 49 12.703 -0.728 -23.813 258 HB3 SER 49 HB3 SER 49 13.696 -1.257 -22.469 259 HG SER 49 HG SER 49 14.758 -0.834 -24.659 260 H ALA 50 H ALA 50 10.745 -1.342 -22.094 261 HA ALA 50 HA ALA 50 11.332 -1.976 -19.463 262 HB1 ALA 50 HB1 ALA 50 9.302 -0.532 -20.988 263 HB2 ALA 50 HB2 ALA 50 8.602 -1.336 -19.563 264 HB3 ALA 50 HB3 ALA 50 9.955 -0.196 -19.366 265 H TYR 51 H TYR 51 9.176 -3.545 -21.868 266 HA TYR 51 HA TYR 51 7.878 -5.251 -20.058 267 HB2 TYR 51 HB2 TYR 51 8.690 -5.640 -23.006 268 HB3 TYR 51 HB3 TYR 51 7.345 -6.439 -22.216 269 HD1 TYR 51 HD1 TYR 51 7.049 -3.400 -20.775 270 HD2 TYR 51 HD2 TYR 51 6.748 -5.133 -24.675 271 HE1 TYR 51 HE1 TYR 51 5.505 -1.515 -21.502 272 HE2 TYR 51 HE2 TYR 51 5.205 -3.243 -25.388 273 HH TYR 51 HH TYR 51 3.724 -1.204 -23.202 274 H LYS 52 H LYS 52 10.827 -5.677 -22.122 275 HA LYS 52 HA LYS 52 11.257 -8.345 -21.464 276 HB2 LYS 52 HB2 LYS 52 12.857 -6.115 -22.625 277 HB3 LYS 52 HB3 LYS 52 13.749 -7.488 -22.001 278 HG2 LYS 52 HG2 LYS 52 11.449 -7.667 -24.005 279 HG3 LYS 52 HG3 LYS 52 13.149 -7.747 -24.424 280 HD2 LYS 52 HD2 LYS 52 13.093 -9.689 -22.514 281 HD3 LYS 52 HD3 LYS 52 11.428 -9.790 -23.052 282 HE2 LYS 52 HE2 LYS 52 12.286 -9.964 -25.448 283 HE3 LYS 52 HE3 LYS 52 13.915 -10.042 -24.808 284 HZ1 LYS 52 HZ1 LYS 52 11.908 -12.049 -24.843 285 HZ2 LYS 52 HZ2 LYS 52 13.525 -12.201 -24.673 286 HZ3 LYS 52 HZ3 LYS 52 12.593 -11.889 -23.369 287 H LEU 53 H LEU 53 12.573 -5.305 -19.984 288 HA LEU 53 HA LEU 53 14.011 -6.677 -17.992 289 HB2 LEU 53 HB2 LEU 53 14.129 -4.439 -16.930 290 HB3 LEU 53 HB3 LEU 53 14.683 -4.501 -18.591 291 HG LEU 53 HG LEU 53 12.120 -3.755 -19.015 292 HD11 LEU 53 HD11 LEU 53 12.805 -2.894 -16.218 293 HD12 LEU 53 HD12 LEU 53 11.770 -1.878 -17.251 294 HD13 LEU 53 HD13 LEU 53 11.281 -3.546 -16.867 295 HD21 LEU 53 HD21 LEU 53 14.635 -2.184 -18.565 296 HD22 LEU 53 HD22 LEU 53 13.745 -2.509 -20.071 297 HD23 LEU 53 HD23 LEU 53 13.106 -1.335 -18.895 298 H GLY 54 H GLY 54 10.631 -5.697 -18.364 299 HA2 GLY 54 HA2 GLY 54 9.891 -5.774 -15.640 300 HA3 GLY 54 HA3 GLY 54 8.835 -5.930 -17.029 301 H THR 55 H THR 55 9.694 -8.237 -18.311 302 HA THR 55 HA THR 55 8.607 -10.241 -16.640 303 HB THR 55 HB THR 55 8.315 -10.236 -19.085 304 HG1 THR 55 HG1 THR 55 8.713 -12.274 -17.728 305 HG21 THR 55 HG21 THR 55 10.425 -9.230 -19.857 306 HG22 THR 55 HG22 THR 55 11.361 -10.551 -19.118 307 HG23 THR 55 HG23 THR 55 10.314 -10.878 -20.519 308 H TYR 56 H TYR 56 11.930 -9.204 -17.400 309 HA TYR 56 HA TYR 56 13.230 -11.494 -16.470 310 HB2 TYR 56 HB2 TYR 56 14.419 -9.790 -17.736 311 HB3 TYR 56 HB3 TYR 56 13.778 -8.496 -16.743 312 HD1 TYR 56 HD1 TYR 56 16.229 -11.284 -16.815 313 HD2 TYR 56 HD2 TYR 56 14.917 -7.761 -14.772 314 HE1 TYR 56 HE1 TYR 56 18.353 -11.294 -15.419 315 HE2 TYR 56 HE2 TYR 56 17.046 -7.783 -13.383 316 HH TYR 56 HH TYR 56 19.635 -9.040 -14.076 317 H LEU 57 H LEU 57 12.427 -8.375 -14.785 318 HA LEU 57 HA LEU 57 13.459 -9.286 -12.312 319 HB2 LEU 57 HB2 LEU 57 13.159 -6.901 -13.177 320 HB3 LEU 57 HB3 LEU 57 11.472 -7.061 -12.728 321 HG LEU 57 HG LEU 57 12.690 -7.840 -10.410 322 HD11 LEU 57 HD11 LEU 57 14.326 -5.463 -10.802 323 HD12 LEU 57 HD12 LEU 57 14.750 -7.051 -10.117 324 HD13 LEU 57 HD13 LEU 57 14.805 -6.798 -11.878 325 HD21 LEU 57 HD21 LEU 57 12.232 -5.467 -9.647 326 HD22 LEU 57 HD22 LEU 57 11.781 -5.109 -11.331 327 HD23 LEU 57 HD23 LEU 57 10.872 -6.329 -10.407 328 H TYR 58 H TYR 58 10.126 -8.987 -13.700 329 HA TYR 58 HA TYR 58 8.623 -9.727 -11.588 330 HB2 TYR 58 HB2 TYR 58 8.668 -10.293 -14.581 331 HB3 TYR 58 HB3 TYR 58 7.433 -11.098 -13.634 332 HD1 TYR 58 HD2 TYR 58 6.786 -8.946 -11.645 333 HD2 TYR 58 HD1 TYR 58 7.446 -8.751 -15.867 334 HE1 TYR 58 HE2 TYR 58 5.330 -6.867 -11.783 335 HE2 TYR 58 HE1 TYR 58 5.988 -6.672 -15.992 336 HH TYR 58 HH TYR 58 4.318 -5.467 -13.109 337 H GLN 59 H GLN 59 10.284 -12.003 -13.883 338 HA GLN 59 HA GLN 59 10.491 -13.873 -11.717 339 HB2 GLN 59 HB2 GLN 59 8.237 -14.255 -12.946 340 HB3 GLN 59 HB3 GLN 59 9.196 -14.815 -14.301 341 HG2 GLN 59 HG2 GLN 59 9.385 -15.958 -11.474 342 HG3 GLN 59 HG3 GLN 59 8.436 -16.671 -12.763 343 HE21 GLN 59 HE21 GLN 59 10.640 -17.807 -11.302 344 HE22 GLN 59 HE22 GLN 59 11.886 -18.213 -12.435 345 H LYS 60 H LYS 60 12.429 -14.972 -11.844 346 HA LYS 60 HA LYS 60 14.020 -14.452 -14.221 347 HB2 LYS 60 HB2 LYS 60 14.888 -15.697 -11.600 348 HB3 LYS 60 HB3 LYS 60 15.914 -15.050 -12.865 349 HG2 LYS 60 HG2 LYS 60 14.926 -12.775 -12.495 350 HG3 LYS 60 HG3 LYS 60 13.912 -13.426 -11.223 351 HD2 LYS 60 HD2 LYS 60 15.941 -14.099 -9.935 352 HD3 LYS 60 HD3 LYS 60 16.967 -13.484 -11.215 353 HE2 LYS 60 HE2 LYS 60 14.911 -11.625 -10.010 354 HE3 LYS 60 HE3 LYS 60 16.356 -11.977 -9.084 355 HZ1 LYS 60 HZ1 LYS 60 16.889 -11.377 -11.817 356 HZ2 LYS 60 HZ2 LYS 60 16.178 -10.141 -11.021 357 HZ3 LYS 60 HZ3 LYS 60 17.578 -10.772 -10.466 358 H ASP 61 H ASP 61 14.017 -15.892 -15.853 359 HA ASP 61 HA ASP 61 12.845 -18.398 -15.553 360 HB2 ASP 61 HB2 ASP 61 12.894 -17.290 -17.721 361 HB3 ASP 61 HB3 ASP 61 14.643 -17.185 -17.694 362 HD2 ASP 61 HD2 ASP 61 13.003 -20.744 -17.793 363 H ASN 62 H ASN 62 13.850 -19.922 -14.196 364 HA ASN 62 HA ASN 62 16.739 -20.139 -14.422 365 HB2 ASN 62 HB2 ASN 62 15.562 -19.800 -12.135 366 HB3 ASN 62 HB3 ASN 62 14.931 -21.425 -12.316 367 HD21 ASN 62 HD21 ASN 62 16.166 -21.589 -10.256 368 HD22 ASN 62 HD22 ASN 62 17.824 -22.086 -10.327 369 H SER 63 H SER 63 13.588 -21.831 -14.670 370 HA SER 63 HA SER 63 14.891 -23.907 -16.166 371 HB2 SER 63 HB2 SER 63 13.042 -24.682 -13.878 372 HB3 SER 63 HB3 SER 63 14.007 -25.750 -14.878 373 HG SER 63 HG SER 63 14.871 -23.952 -12.807 374 H CYS 64 H CYS 64 13.264 -25.242 -17.399 375 HA CYS 64 HA CYS 64 11.115 -23.552 -18.227 376 HB2 CYS 64 HB2 CYS 64 10.697 -25.331 -19.908 377 HB3 CYS 64 HB3 CYS 64 12.347 -24.741 -19.926 378 HG CYS 64 HG CYS 64 11.880 -27.045 -17.750 379 H ASN 65 H ASN 65 8.895 -24.902 -18.660 380 HA ASN 65 HA ASN 65 7.155 -25.911 -17.842 381 HB2 ASN 65 HB2 ASN 65 8.886 -27.820 -17.387 382 HB3 ASN 65 HB3 ASN 65 8.872 -27.282 -15.720 383 HD21 ASN 65 HD21 ASN 65 6.985 -27.422 -14.485 384 HD22 ASN 65 HD22 ASN 65 5.684 -28.491 -14.890 385 H LEU 66 H LEU 66 7.883 -23.317 -16.888 386 HA LEU 66 HA LEU 66 7.301 -23.437 -14.020 387 HB2 LEU 66 HB2 LEU 66 9.339 -22.215 -15.091 388 HB3 LEU 66 HB3 LEU 66 8.167 -20.979 -15.503 389 HG LEU 66 HG LEU 66 9.387 -20.485 -13.424 390 HD11 LEU 66 HD11 LEU 66 7.612 -19.479 -12.443 391 HD12 LEU 66 HD12 LEU 66 6.797 -20.016 -13.931 392 HD13 LEU 66 HD13 LEU 66 6.627 -20.962 -12.433 393 HD21 LEU 66 HD21 LEU 66 9.738 -21.960 -11.798 394 HD22 LEU 66 HD22 LEU 66 8.005 -22.351 -11.684 395 HD23 LEU 66 HD23 LEU 66 9.032 -23.196 -12.867 396 H PHE 67 H PHE 67 5.817 -23.093 -17.052 397 HA PHE 67 HA PHE 67 3.858 -22.341 -17.730 398 HB2 PHE 67 HB2 PHE 67 3.280 -22.452 -14.707 399 HB3 PHE 67 HB3 PHE 67 2.043 -22.416 -15.947 400 HD1 PHE 67 HD2 PHE 67 3.324 -24.332 -17.904 401 HD2 PHE 67 HD1 PHE 67 2.828 -24.523 -13.694 402 HE1 PHE 67 HE2 PHE 67 3.361 -26.839 -18.013 403 HE2 PHE 67 HE1 PHE 67 2.865 -27.030 -13.803 404 HZ PHE 67 HZ PHE 67 3.131 -28.158 -15.961 405 H ASN 68 H ASN 68 5.852 -20.314 -17.199 406 HA ASN 68 HA ASN 68 4.405 -18.200 -15.902 407 HB2 ASN 68 HB2 ASN 68 7.003 -18.671 -15.829 408 HB3 ASN 68 HB3 ASN 68 7.040 -17.905 -17.405 409 HD21 ASN 68 HD21 ASN 68 6.835 -15.749 -17.611 410 HD22 ASN 68 HD22 ASN 68 6.701 -14.629 -16.297 411 H THR 69 H THR 69 3.091 -16.794 -17.080 412 HA THR 69 HA THR 69 3.271 -16.909 -19.995 413 HB THR 69 HB THR 69 1.139 -15.434 -18.432 414 HG1 THR 69 HG1 THR 69 1.807 -18.261 -18.594 415 HG21 THR 69 HG21 THR 69 0.215 -17.399 -20.346 416 HG22 THR 69 HG22 THR 69 0.051 -15.629 -20.429 417 HG23 THR 69 HG23 THR 69 1.488 -16.424 -21.118 418 H LEU 70 H LEU 70 4.353 -15.431 -21.122 419 HA LEU 70 HA LEU 70 5.434 -13.164 -19.802 420 HB2 LEU 70 HB2 LEU 70 6.331 -14.605 -21.775 421 HB3 LEU 70 HB3 LEU 70 5.361 -13.542 -22.776 422 HG LEU 70 HG LEU 70 7.694 -12.823 -22.678 423 HD11 LEU 70 HD11 LEU 70 5.542 -11.229 -22.608 424 HD12 LEU 70 HD12 LEU 70 6.357 -10.669 -21.127 425 HD13 LEU 70 HD13 LEU 70 7.209 -10.610 -22.689 426 HD21 LEU 70 HD21 LEU 70 7.396 -12.078 -19.783 427 HD22 LEU 70 HD22 LEU 70 7.934 -13.711 -20.246 428 HD23 LEU 70 HD23 LEU 70 8.870 -12.287 -20.759 429 H THR 71 H THR 71 2.421 -13.887 -21.387 430 HA THR 71 HA THR 71 1.818 -11.287 -22.320 431 HB THR 71 HB THR 71 0.109 -13.705 -21.533 432 HG1 THR 71 HG1 THR 71 0.893 -12.525 -24.095 433 HG21 THR 71 HG21 THR 71 -0.550 -11.056 -22.875 434 HG22 THR 71 HG22 THR 71 -1.406 -12.539 -23.362 435 HG23 THR 71 HG23 THR 71 -1.508 -11.965 -21.681 436 H GLU 72 H GLU 72 1.412 -12.938 -19.166 437 HA GLU 72 HA GLU 72 -0.291 -11.095 -18.048 438 HB2 GLU 72 HB2 GLU 72 1.736 -13.048 -16.969 439 HB3 GLU 72 HB3 GLU 72 1.021 -11.897 -15.858 440 HG2 GLU 72 HG2 GLU 72 -1.270 -12.676 -16.955 441 HG3 GLU 72 HG3 GLU 72 -0.344 -14.074 -17.464 442 HE2 GLU 72 HE2 GLU 72 -0.325 -13.224 -13.576 443 H ALA 73 H ALA 73 3.336 -11.220 -18.029 444 HA ALA 73 HA ALA 73 3.699 -8.910 -16.512 445 HB1 ALA 73 HB1 ALA 73 5.363 -10.445 -18.522 446 HB2 ALA 73 HB2 ALA 73 5.976 -8.956 -17.764 447 HB3 ALA 73 HB3 ALA 73 5.545 -10.355 -16.753 448 H ARG 74 H ARG 74 3.635 -9.415 -20.108 449 HA ARG 74 HA ARG 74 4.113 -6.835 -20.804 450 HB2 ARG 74 HB2 ARG 74 4.057 -8.650 -22.453 451 HB3 ARG 74 HB3 ARG 74 2.358 -8.947 -22.147 452 HG2 ARG 74 HG2 ARG 74 1.680 -6.919 -23.207 453 HG3 ARG 74 HG3 ARG 74 3.278 -6.211 -23.087 454 HD2 ARG 74 HD2 ARG 74 3.244 -6.837 -25.346 455 HD3 ARG 74 HD3 ARG 74 4.011 -8.240 -24.631 456 HE ARG 74 HE ARG 74 2.140 -9.512 -25.208 457 HH11 ARG 74 HH22 ARG 74 1.233 -6.113 -25.181 458 HH12 ARG 74 HH21 ARG 74 -0.359 -6.401 -25.800 459 HH21 ARG 74 HH12 ARG 74 0.041 -9.893 -26.025 460 HH22 ARG 74 HH11 ARG 74 -1.041 -8.565 -26.284 461 H ASP 75 H ASP 75 1.134 -8.386 -19.612 462 HA ASP 75 HA ASP 75 -0.562 -6.280 -20.409 463 HB2 ASP 75 HB2 ASP 75 -1.778 -8.225 -20.054 464 HB3 ASP 75 HB3 ASP 75 -0.745 -8.760 -18.744 465 HD2 ASP 75 HD2 ASP 75 -1.823 -6.539 -16.564 466 H ALA 76 H ALA 76 1.461 -7.112 -17.591 467 HA ALA 76 HA ALA 76 0.257 -5.361 -15.742 468 HB1 ALA 76 HB1 ALA 76 2.829 -5.631 -14.874 469 HB2 ALA 76 HB2 ALA 76 1.564 -6.858 -14.625 470 HB3 ALA 76 HB3 ALA 76 2.711 -7.023 -15.977 471 H ILE 77 H ILE 77 3.149 -5.072 -17.915 472 HA ILE 77 HA ILE 77 3.601 -2.372 -17.148 473 HB ILE 77 HB ILE 77 4.652 -3.612 -19.662 474 HG12 ILE 77 HG12 ILE 77 4.986 -5.458 -18.287 475 HG13 ILE 77 HG13 ILE 77 6.496 -4.579 -18.153 476 HG21 ILE 77 HG21 ILE 77 5.438 -1.466 -17.759 477 HG22 ILE 77 HG22 ILE 77 6.746 -2.429 -18.488 478 HG23 ILE 77 HG23 ILE 77 5.598 -1.556 -19.530 479 HD11 ILE 77 HD11 ILE 77 4.479 -5.154 -16.086 480 HD12 ILE 77 HD12 ILE 77 6.187 -4.689 -15.903 481 HD13 ILE 77 HD13 ILE 77 4.942 -3.436 -16.129 482 H LYS 78 H LYS 78 1.820 -4.061 -19.753 483 HA LYS 78 HA LYS 78 1.356 -1.701 -21.256 484 HB2 LYS 78 HB2 LYS 78 1.347 -3.903 -22.290 485 HB3 LYS 78 HB3 LYS 78 0.014 -4.419 -21.277 486 HG2 LYS 78 HG2 LYS 78 -1.090 -3.793 -23.260 487 HG3 LYS 78 HG3 LYS 78 -1.270 -2.357 -22.272 488 HD2 LYS 78 HD2 LYS 78 -0.467 -1.351 -24.198 489 HD3 LYS 78 HD3 LYS 78 1.068 -1.689 -23.422 490 HE2 LYS 78 HE2 LYS 78 1.410 -3.689 -24.751 491 HE3 LYS 78 HE3 LYS 78 -0.244 -3.671 -25.332 492 HZ1 LYS 78 HZ1 LYS 78 0.195 -1.937 -26.721 493 HZ2 LYS 78 HZ2 LYS 78 1.454 -1.366 -25.851 494 HZ3 LYS 78 HZ3 LYS 78 1.635 -2.706 -26.767 495 H ASP 79 H ASP 79 -0.126 -3.246 -18.442 496 HA ASP 79 HA ASP 79 -2.598 -1.949 -18.695 497 HB2 ASP 79 HB2 ASP 79 -2.581 -3.850 -17.282 498 HB3 ASP 79 HB3 ASP 79 -1.100 -3.365 -16.480 499 HD2 ASP 79 HD2 ASP 79 -4.691 -2.366 -16.168 500 H ALA 80 H ALA 80 0.429 -1.383 -16.760 501 HA ALA 80 HA ALA 80 -0.499 0.938 -15.475 502 HB1 ALA 80 HB1 ALA 80 1.943 1.249 -14.984 503 HB2 ALA 80 HB2 ALA 80 1.344 -0.382 -14.597 504 HB3 ALA 80 HB3 ALA 80 2.295 -0.111 -16.077 505 H TYR 81 H TYR 81 1.599 0.416 -18.392 506 HA TYR 81 HA TYR 81 1.982 3.108 -18.968 507 HB2 TYR 81 HB2 TYR 81 1.861 0.450 -20.484 508 HB3 TYR 81 HB3 TYR 81 2.148 1.926 -21.384 509 HD1 TYR 81 HD1 TYR 81 3.433 0.945 -18.006 510 HD2 TYR 81 HD2 TYR 81 4.372 1.769 -22.098 511 HE1 TYR 81 HE1 TYR 81 5.914 0.793 -17.475 512 HE2 TYR 81 HE2 TYR 81 6.851 1.614 -21.553 513 HH TYR 81 HH TYR 81 8.151 2.018 -18.958 514 H GLU 82 H GLU 82 -0.695 0.856 -19.778 515 HA GLU 82 HA GLU 82 -1.863 2.646 -21.618 516 HB2 GLU 82 HB2 GLU 82 -2.310 0.275 -21.827 517 HB3 GLU 82 HB3 GLU 82 -2.894 0.170 -20.178 518 HG2 GLU 82 HG2 GLU 82 -4.799 1.692 -20.760 519 HG3 GLU 82 HG3 GLU 82 -4.219 1.782 -22.411 520 HE2 GLU 82 HE2 GLU 82 -5.258 0.293 -23.688 521 H SER 83 H SER 83 -2.229 1.945 -18.117 522 HA SER 83 HA SER 83 -4.573 3.347 -17.731 523 HB2 SER 83 HB2 SER 83 -3.590 1.810 -16.063 524 HB3 SER 83 HB3 SER 83 -2.230 2.890 -15.831 525 HG SER 83 HG SER 83 -4.629 4.235 -15.497 526 H TYR 84 H TYR 84 -1.118 4.371 -17.755 527 HA TYR 84 HA TYR 84 -1.916 7.116 -17.184 528 HB2 TYR 84 HB2 TYR 84 0.685 5.511 -17.522 529 HB3 TYR 84 HB3 TYR 84 0.721 7.254 -17.349 530 HD1 TYR 84 HD1 TYR 84 -0.517 8.221 -15.227 531 HD2 TYR 84 HD2 TYR 84 0.800 4.169 -15.615 532 HE1 TYR 84 HE1 TYR 84 -0.537 7.965 -12.698 533 HE2 TYR 84 HE2 TYR 84 0.775 3.927 -13.084 534 HH TYR 84 HH TYR 84 -0.763 5.408 -11.149 535 H CYS 85 H CYS 85 -1.471 5.034 -19.873 536 HA CYS 85 HA CYS 85 -0.116 6.513 -21.697 537 HB2 CYS 85 HB2 CYS 85 -0.735 4.405 -22.438 538 HB3 CYS 85 HB3 CYS 85 -2.398 4.576 -21.911 539 HG CYS 85 HG CYS 85 -3.325 5.378 -23.936 540 H GLY 86 H GLY 86 -0.649 8.248 -23.129 541 HA2 GLY 86 HA2 GLY 86 -2.283 9.675 -24.121 542 HA3 GLY 86 HA3 GLY 86 -3.268 9.532 -22.679 543 H ILE 87 H ILE 87 -0.025 9.680 -21.694 544 HA ILE 87 HA ILE 87 -0.188 12.601 -21.425 545 HB ILE 87 HB ILE 87 1.035 10.728 -19.408 546 HG12 ILE 87 HG12 ILE 87 -1.757 11.908 -19.341 547 HG13 ILE 87 HG13 ILE 87 -1.386 10.231 -19.691 548 HG21 ILE 87 HG21 ILE 87 1.593 12.550 -18.250 549 HG22 ILE 87 HG22 ILE 87 1.291 13.456 -19.752 550 HG23 ILE 87 HG23 ILE 87 0.011 13.318 -18.523 551 HD11 ILE 87 HD11 ILE 87 -1.892 11.194 -17.173 552 HD12 ILE 87 HD12 ILE 87 -0.930 9.732 -17.499 553 HD13 ILE 87 HD13 ILE 87 -0.115 11.288 -17.212 554 H ASP 88 H ASP 88 1.289 13.505 -22.752 555 HA ASP 88 HA ASP 88 3.580 11.961 -23.488 556 HB2 ASP 88 HB2 ASP 88 2.368 14.606 -24.300 557 HB3 ASP 88 HB3 ASP 88 4.053 14.320 -24.684 558 HD2 ASP 88 HD2 ASP 88 4.433 12.806 -26.404 559 H ASP 89 H ASP 89 2.867 15.229 -22.029 560 HA ASP 89 HA ASP 89 5.459 15.029 -20.707 561 HB2 ASP 89 HB2 ASP 89 5.267 17.636 -20.689 562 HB3 ASP 89 HB3 ASP 89 5.747 16.847 -22.179 563 HD2 ASP 89 HD2 ASP 89 3.859 19.108 -21.002 564 H CYS 90 H CYS 90 5.337 15.210 -18.443 565 HA CYS 90 HA CYS 90 2.962 15.028 -17.122 566 HB2 CYS 90 HB2 CYS 90 4.680 14.403 -15.762 567 HB3 CYS 90 HB3 CYS 90 5.762 15.651 -16.347 568 HA PRO 91 HA PRO 91 1.728 19.252 -17.700 569 HB2 PRO 91 HB2 PRO 91 -0.926 18.885 -17.165 570 HB3 PRO 91 HB3 PRO 91 -0.235 18.689 -18.763 571 HG2 PRO 91 HG2 PRO 91 -1.114 16.609 -16.855 572 HG3 PRO 91 HG3 PRO 91 -0.828 16.468 -18.578 573 HD2 PRO 91 HD2 PRO 91 0.897 15.562 -16.473 574 HD3 PRO 91 HD3 PRO 91 1.233 15.526 -18.193 575 H GLN 92 H GLN 92 1.451 17.240 -14.957 576 HA GLN 92 HA GLN 92 0.342 19.027 -13.199 577 HB2 GLN 92 HB2 GLN 92 2.217 16.680 -12.935 578 HB3 GLN 92 HB3 GLN 92 1.920 17.670 -11.521 579 HG2 GLN 92 HG2 GLN 92 -0.546 17.338 -11.809 580 HG3 GLN 92 HG3 GLN 92 -0.246 16.345 -13.221 581 HE21 GLN 92 HE21 GLN 92 -0.022 14.251 -12.968 582 HE22 GLN 92 HE22 GLN 92 0.287 13.406 -11.488 583 H CYS 93 H CYS 93 3.577 18.891 -14.628 584 HA CYS 93 HA CYS 93 4.763 20.593 -12.680 585 HB2 CYS 93 HB2 CYS 93 5.614 19.298 -15.223 586 HB3 CYS 93 HB3 CYS 93 6.460 20.766 -14.776 587 H SER 94 H SER 94 3.222 20.883 -15.922 588 HA SER 94 HA SER 94 3.899 23.572 -16.276 589 HB2 SER 94 HB2 SER 94 3.249 22.098 -18.144 590 HB3 SER 94 HB3 SER 94 1.645 21.898 -17.468 591 HG SER 94 HG SER 94 2.157 23.631 -19.250 592 H LYS 95 H LYS 95 1.493 21.899 -14.355 593 HA LYS 95 HA LYS 95 -0.191 24.252 -14.148 594 HB2 LYS 95 HB2 LYS 95 -1.334 22.153 -14.351 595 HB3 LYS 95 HB3 LYS 95 -0.399 21.436 -13.055 596 HG2 LYS 95 HG2 LYS 95 -1.391 23.549 -11.684 597 HG3 LYS 95 HG3 LYS 95 -2.649 23.431 -12.899 598 HD2 LYS 95 HD2 LYS 95 -2.891 20.967 -12.333 599 HD3 LYS 95 HD3 LYS 95 -1.730 21.189 -11.038 600 HE2 LYS 95 HE2 LYS 95 -3.196 22.525 -9.759 601 HE3 LYS 95 HE3 LYS 95 -4.126 23.032 -11.156 602 HZ1 LYS 95 HZ1 LYS 95 -4.251 20.510 -9.711 603 HZ2 LYS 95 HZ2 LYS 95 -5.470 21.484 -10.194 604 HZ3 LYS 95 HZ3 LYS 95 -4.696 20.544 -11.282 605 H TYR 96 H TYR 96 2.319 22.450 -12.374 606 HA TYR 96 HA TYR 96 2.145 24.509 -10.277 607 HB2 TYR 96 HB2 TYR 96 2.786 21.508 -10.340 608 HB3 TYR 96 HB3 TYR 96 3.333 22.491 -8.996 609 HD1 TYR 96 HD1 TYR 96 1.011 24.300 -8.583 610 HD2 TYR 96 HD2 TYR 96 1.142 20.109 -9.436 611 HE1 TYR 96 HE1 TYR 96 -1.241 23.991 -7.446 612 HE2 TYR 96 HE2 TYR 96 -1.112 19.814 -8.295 613 HH TYR 96 HH TYR 96 -2.886 20.875 -7.520 614 H ILE 97 H ILE 97 3.865 25.861 -10.248 615 HA ILE 97 HA ILE 97 6.163 25.239 -11.827 616 HB ILE 97 HB ILE 97 5.445 27.554 -10.031 617 HG12 ILE 97 HG12 ILE 97 5.711 27.670 -13.019 618 HG13 ILE 97 HG13 ILE 97 4.251 27.003 -12.316 619 HG21 ILE 97 HG21 ILE 97 7.651 27.952 -9.969 620 HG22 ILE 97 HG22 ILE 97 7.999 26.835 -11.310 621 HG23 ILE 97 HG23 ILE 97 7.431 28.486 -11.652 622 HD11 ILE 97 HD11 ILE 97 3.548 29.172 -12.216 623 HD12 ILE 97 HD12 ILE 97 4.599 29.285 -10.784 624 HD13 ILE 97 HD13 ILE 97 5.204 29.807 -12.375 625 H ASP 98 H ASP 98 8.279 24.782 -11.127 626 HA ASP 98 HA ASP 98 8.320 23.637 -8.478 627 HB2 ASP 98 HB2 ASP 98 10.705 22.918 -9.397 628 HB3 ASP 98 HB3 ASP 98 9.261 22.090 -9.944 629 HD2 ASP 98 HD2 ASP 98 11.708 24.316 -10.948 630 H ASP 99 H ASP 99 8.823 25.254 -6.951 631 HA ASP 99 HA ASP 99 10.767 27.243 -7.707 632 HB2 ASP 99 HB2 ASP 99 8.727 28.005 -6.568 633 HB3 ASP 99 HB3 ASP 99 8.995 26.884 -5.249 634 HD2 ASP 99 HD2 ASP 99 11.004 27.432 -3.934 Start of MODEL 15 1 H GLU 14 H GLU 14 -1.546 -1.440 -1.458 2 HA GLU 14 HA GLU 14 0.874 -0.147 -2.404 3 HB2 GLU 14 HB2 GLU 14 1.427 -0.884 -0.146 4 HB3 GLU 14 HB3 GLU 14 0.753 -2.475 -0.442 5 HG2 GLU 14 HG2 GLU 14 3.354 -2.144 -0.626 6 HG3 GLU 14 HG3 GLU 14 2.541 -3.137 -1.819 7 HE2 GLU 14 HE2 GLU 14 3.971 -0.012 -1.351 8 H ASP 15 H ASP 15 1.201 -0.759 -4.495 9 HA ASP 15 HA ASP 15 -0.001 -3.279 -5.295 10 HB2 ASP 15 HB2 ASP 15 0.786 -0.744 -6.766 11 HB3 ASP 15 HB3 ASP 15 0.579 -2.237 -7.659 12 HD2 ASP 15 HD2 ASP 15 -1.689 -0.388 -8.338 13 H GLN 16 H GLN 16 1.558 -4.919 -5.145 14 HA GLN 16 HA GLN 16 4.257 -4.500 -5.089 15 HB2 GLN 16 HB2 GLN 16 2.995 -6.583 -4.391 16 HB3 GLN 16 HB3 GLN 16 2.846 -7.014 -6.083 17 HG2 GLN 16 HG2 GLN 16 5.540 -6.478 -4.756 18 HG3 GLN 16 HG3 GLN 16 4.817 -8.074 -4.815 19 HE21 GLN 16 HE21 GLN 16 7.223 -6.693 -6.072 20 HE22 GLN 16 HE22 GLN 16 7.158 -7.110 -7.752 21 H GLU 17 H GLU 17 2.182 -5.552 -7.880 22 HA GLU 17 HA GLU 17 4.153 -5.823 -9.724 23 HB2 GLU 17 HB2 GLU 17 2.349 -5.302 -11.418 24 HB3 GLU 17 HB3 GLU 17 1.893 -6.502 -10.225 25 HG2 GLU 17 HG2 GLU 17 1.283 -3.636 -9.554 26 HG3 GLU 17 HG3 GLU 17 0.331 -4.363 -10.833 27 HE2 GLU 17 HE2 GLU 17 -0.295 -5.337 -7.063 28 H GLN 18 H GLN 18 2.677 -2.857 -8.414 29 HA GLN 18 HA GLN 18 3.635 -1.161 -10.424 30 HB2 GLN 18 HB2 GLN 18 1.779 -0.757 -8.649 31 HB3 GLN 18 HB3 GLN 18 3.080 -0.336 -7.553 32 HG2 GLN 18 HG2 GLN 18 3.790 1.512 -8.931 33 HG3 GLN 18 HG3 GLN 18 2.836 0.963 -10.295 34 HE21 GLN 18 HE21 GLN 18 1.006 1.951 -10.634 35 HE22 GLN 18 HE22 GLN 18 0.032 2.793 -9.475 36 H TRP 19 H TRP 19 5.025 -2.549 -7.463 37 HA TRP 19 HA TRP 19 7.158 -0.727 -7.200 38 HB2 TRP 19 HB2 TRP 19 6.329 -2.212 -5.411 39 HB3 TRP 19 HB3 TRP 19 6.943 -3.601 -6.286 40 HD1 TRP 19 HD1 TRP 19 8.362 -0.372 -4.616 41 HE1 TRP 19 HE1 TRP 19 10.812 -0.788 -3.726 42 HE3 TRP 19 HE3 TRP 19 8.796 -5.089 -6.465 43 HZ2 TRP 19 HZ2 TRP 19 12.615 -2.994 -3.892 44 HZ3 TRP 19 HZ3 TRP 19 10.934 -6.304 -6.057 45 HH2 TRP 19 HH2 TRP 19 12.804 -5.331 -4.820 46 H ALA 20 H ALA 20 6.512 -3.636 -9.166 47 HA ALA 20 HA ALA 20 9.127 -4.223 -9.910 48 HB1 ALA 20 HB1 ALA 20 7.336 -4.743 -12.080 49 HB2 ALA 20 HB2 ALA 20 7.967 -5.887 -10.871 50 HB3 ALA 20 HB3 ALA 20 6.445 -5.017 -10.564 51 H MET 21 H MET 21 6.789 -1.765 -11.046 52 HA MET 21 HA MET 21 7.908 -1.099 -13.421 53 HB2 MET 21 HB2 MET 21 6.751 0.744 -11.255 54 HB3 MET 21 HB3 MET 21 6.944 1.204 -12.935 55 HG2 MET 21 HG2 MET 21 5.439 -1.346 -12.391 56 HG3 MET 21 HG3 MET 21 4.636 0.152 -11.968 57 HE1 MET 21 HE1 MET 21 3.498 1.418 -13.159 58 HE2 MET 21 HE2 MET 21 4.464 2.311 -14.357 59 HE3 MET 21 HE3 MET 21 3.102 1.297 -14.890 60 H GLN 22 H GLN 22 9.200 -0.624 -10.183 61 HA GLN 22 HA GLN 22 10.722 1.528 -10.305 62 HB2 GLN 22 HB2 GLN 22 11.236 -1.227 -9.195 63 HB3 GLN 22 HB3 GLN 22 12.534 -0.051 -9.127 64 HG2 GLN 22 HG2 GLN 22 10.784 1.574 -8.091 65 HG3 GLN 22 HG3 GLN 22 9.760 0.167 -7.890 66 HE21 GLN 22 HE21 GLN 22 11.747 2.104 -6.297 67 HE22 GLN 22 HE22 GLN 22 12.447 1.043 -5.120 68 H THR 23 H THR 23 12.318 -1.625 -11.123 69 HA THR 23 HA THR 23 14.270 -0.302 -12.716 70 HB THR 23 HB THR 23 13.514 -3.186 -12.076 71 HG1 THR 23 HG1 THR 23 14.773 -2.301 -10.449 72 HG21 THR 23 HG21 THR 23 15.750 -2.126 -13.879 73 HG22 THR 23 HG22 THR 23 15.776 -3.739 -13.126 74 HG23 THR 23 HG23 THR 23 14.512 -3.330 -14.311 75 H LEU 24 H LEU 24 11.628 -2.643 -13.574 76 HA LEU 24 HA LEU 24 11.873 -2.720 -16.221 77 HB2 LEU 24 HB2 LEU 24 10.172 -3.929 -15.097 78 HB3 LEU 24 HB3 LEU 24 9.384 -2.465 -14.543 79 HG LEU 24 HG LEU 24 9.600 -3.206 -17.469 80 HD11 LEU 24 HD11 LEU 24 7.017 -3.572 -16.053 81 HD12 LEU 24 HD12 LEU 24 7.735 -4.485 -17.402 82 HD13 LEU 24 HD13 LEU 24 8.284 -4.781 -15.735 83 HD21 LEU 24 HD21 LEU 24 7.435 -1.685 -17.366 84 HD22 LEU 24 HD22 LEU 24 8.245 -1.043 -15.917 85 HD23 LEU 24 HD23 LEU 24 9.067 -0.986 -17.496 86 H MET 25 H MET 25 9.812 -0.181 -14.622 87 HA MET 25 HA MET 25 9.773 1.332 -16.999 88 HB2 MET 25 HB2 MET 25 8.054 2.349 -15.860 89 HB3 MET 25 HB3 MET 25 8.360 1.225 -14.551 90 HG2 MET 25 HG2 MET 25 10.043 2.830 -13.587 91 HG3 MET 25 HG3 MET 25 9.689 3.960 -14.879 92 HE1 MET 25 HE1 MET 25 6.079 3.376 -14.855 93 HE2 MET 25 HE2 MET 25 6.198 5.097 -14.418 94 HE3 MET 25 HE3 MET 25 7.345 4.394 -15.583 95 H GLY 26 H GLY 26 11.966 1.068 -14.286 96 HA2 GLY 26 HA2 GLY 26 13.050 3.707 -14.406 97 HA3 GLY 26 HA3 GLY 26 13.724 2.308 -13.595 98 H SER 27 H SER 27 13.171 1.051 -16.569 99 HA SER 27 HA SER 27 15.848 1.067 -17.267 100 HB2 SER 27 HB2 SER 27 15.214 -0.380 -18.959 101 HB3 SER 27 HB3 SER 27 13.794 -0.496 -17.939 102 HG SER 27 HG SER 27 12.594 0.603 -19.385 103 H GLY 28 H GLY 28 13.487 3.516 -17.546 104 HA2 GLY 28 HA2 GLY 28 14.026 5.663 -18.298 105 HA3 GLY 28 HA3 GLY 28 15.190 4.994 -19.424 106 H VAL 29 H VAL 29 12.383 3.052 -19.448 107 HA VAL 29 HA VAL 29 11.702 3.954 -22.061 108 HB VAL 29 HB VAL 29 10.641 1.881 -20.153 109 HG11 VAL 29 HG11 VAL 29 9.527 2.651 -22.867 110 HG12 VAL 29 HG12 VAL 29 9.192 1.101 -22.059 111 HG13 VAL 29 HG13 VAL 29 8.676 2.628 -21.304 112 HG21 VAL 29 HG21 VAL 29 11.900 0.397 -21.301 113 HG22 VAL 29 HG22 VAL 29 11.556 1.162 -22.872 114 HG23 VAL 29 HG23 VAL 29 12.810 1.841 -21.806 115 H LEU 30 H LEU 30 10.184 4.114 -18.781 116 HA LEU 30 HA LEU 30 8.175 5.915 -19.910 117 HB2 LEU 30 HB2 LEU 30 8.301 4.361 -17.326 118 HB3 LEU 30 HB3 LEU 30 7.066 5.552 -17.683 119 HG LEU 30 HG LEU 30 7.576 3.074 -19.351 120 HD11 LEU 30 HD11 LEU 30 6.089 3.453 -16.852 121 HD12 LEU 30 HD12 LEU 30 5.124 2.730 -18.161 122 HD13 LEU 30 HD13 LEU 30 6.646 1.962 -17.650 123 HD21 LEU 30 HD21 LEU 30 6.252 5.404 -20.042 124 HD22 LEU 30 HD22 LEU 30 6.057 3.808 -20.806 125 HD23 LEU 30 HD23 LEU 30 4.942 4.320 -19.515 126 H ALA 31 H ALA 31 7.499 7.632 -18.029 127 HA ALA 31 HA ALA 31 10.015 8.826 -17.094 128 HB1 ALA 31 HB1 ALA 31 7.818 9.957 -18.796 129 HB2 ALA 31 HB2 ALA 31 8.586 11.027 -17.600 130 HB3 ALA 31 HB3 ALA 31 9.572 10.247 -18.859 131 H ARG 32 H ARG 32 10.004 9.436 -14.966 132 HA ARG 32 HA ARG 32 7.382 9.469 -13.703 133 HB2 ARG 32 HB2 ARG 32 8.466 8.507 -11.655 134 HB3 ARG 32 HB3 ARG 32 8.572 7.421 -13.026 135 HG2 ARG 32 HG2 ARG 32 10.882 7.876 -13.379 136 HG3 ARG 32 HG3 ARG 32 10.822 9.382 -12.485 137 HD2 ARG 32 HD2 ARG 32 11.890 7.913 -10.966 138 HD3 ARG 32 HD3 ARG 32 10.230 7.908 -10.404 139 HE ARG 32 HE ARG 32 9.969 5.686 -11.177 140 HH11 ARG 32 HH22 ARG 32 13.043 7.015 -12.257 141 HH12 ARG 32 HH21 ARG 32 13.668 5.486 -12.777 142 HH21 ARG 32 HH12 ARG 32 10.793 3.668 -11.862 143 HH22 ARG 32 HH11 ARG 32 12.379 3.569 -12.551 144 H CYS 33 H CYS 33 7.225 10.919 -11.781 145 HA CYS 33 HA CYS 33 8.833 13.262 -12.184 146 HB2 CYS 33 HB2 CYS 33 6.258 13.076 -11.644 147 HB3 CYS 33 HB3 CYS 33 6.804 13.001 -9.981 148 H ARG 34 H ARG 34 10.434 14.028 -10.753 149 HA ARG 34 HA ARG 34 11.697 12.128 -9.191 150 HB2 ARG 34 HB2 ARG 34 11.934 15.163 -9.374 151 HB3 ARG 34 HB3 ARG 34 12.960 14.236 -8.297 152 HG2 ARG 34 HG2 ARG 34 12.753 13.898 -11.326 153 HG3 ARG 34 HG3 ARG 34 14.105 14.590 -10.452 154 HD2 ARG 34 HD2 ARG 34 14.026 12.216 -9.169 155 HD3 ARG 34 HD3 ARG 34 13.252 11.704 -10.656 156 HE ARG 34 HE ARG 34 15.283 11.998 -11.811 157 HH11 ARG 34 HH22 ARG 34 15.503 13.455 -8.615 158 HH12 ARG 34 HH21 ARG 34 17.212 13.720 -8.714 159 HH21 ARG 34 HH12 ARG 34 17.538 12.347 -11.941 160 HH22 ARG 34 HH11 ARG 34 18.377 13.086 -10.618 161 H ILE 35 H ILE 35 8.878 13.972 -8.598 162 HA ILE 35 HA ILE 35 9.292 13.866 -5.697 163 HB ILE 35 HB ILE 35 8.759 16.031 -6.080 164 HG12 ILE 35 HG12 ILE 35 6.126 14.579 -5.794 165 HG13 ILE 35 HG13 ILE 35 7.101 15.322 -4.542 166 HG21 ILE 35 HG21 ILE 35 6.987 15.176 -8.385 167 HG22 ILE 35 HG22 ILE 35 7.256 16.853 -7.854 168 HG23 ILE 35 HG23 ILE 35 8.612 15.895 -8.496 169 HD11 ILE 35 HD11 ILE 35 5.234 16.805 -5.023 170 HD12 ILE 35 HD12 ILE 35 6.713 17.572 -5.649 171 HD13 ILE 35 HD13 ILE 35 5.589 16.762 -6.766 172 H HIS 36 H HIS 36 7.742 12.363 -8.397 173 HA HIS 36 HA HIS 36 6.025 10.920 -6.512 174 HB2 HIS 36 HB2 HIS 36 5.210 11.248 -9.376 175 HB3 HIS 36 HB3 HIS 36 4.223 10.935 -7.962 176 HD1 HIS 36 HD1 HIS 36 4.426 13.166 -6.132 177 HD2 HIS 36 HD2 HIS 36 4.849 13.794 -10.258 178 HE1 HIS 36 HE1 HIS 36 3.953 15.641 -6.530 179 H ASN 37 H ASN 37 6.755 8.871 -6.291 180 HA ASN 37 HA ASN 37 8.319 7.798 -8.472 181 HB2 ASN 37 HB2 ASN 37 7.863 6.899 -5.582 182 HB3 ASN 37 HB3 ASN 37 8.779 5.942 -6.730 183 HD21 ASN 37 HD21 ASN 37 10.769 6.084 -5.923 184 HD22 ASN 37 HD22 ASN 37 11.680 7.542 -5.715 185 H ASP 38 H ASP 38 5.118 7.866 -7.314 186 HA ASP 38 HA ASP 38 4.583 5.131 -8.102 187 HB2 ASP 38 HB2 ASP 38 2.807 7.262 -6.821 188 HB3 ASP 38 HB3 ASP 38 2.273 5.635 -7.198 189 HD2 ASP 38 HD2 ASP 38 1.836 5.769 -4.931 190 H VAL 39 H VAL 39 4.851 8.196 -9.456 191 HA VAL 39 HA VAL 39 2.508 7.987 -11.165 192 HB VAL 39 HB VAL 39 3.549 10.102 -9.986 193 HG11 VAL 39 HG11 VAL 39 4.980 11.398 -11.539 194 HG12 VAL 39 HG12 VAL 39 5.776 9.919 -10.949 195 HG13 VAL 39 HG13 VAL 39 5.098 9.969 -12.594 196 HG21 VAL 39 HG21 VAL 39 1.517 10.096 -11.353 197 HG22 VAL 39 HG22 VAL 39 2.523 11.518 -11.721 198 HG23 VAL 39 HG23 VAL 39 2.500 10.131 -12.837 199 H ILE 40 H ILE 40 2.583 7.520 -13.366 200 HA ILE 40 HA ILE 40 5.246 6.852 -14.405 201 HB ILE 40 HB ILE 40 4.304 4.773 -13.900 202 HG12 ILE 40 HG12 ILE 40 5.214 5.152 -16.263 203 HG13 ILE 40 HG13 ILE 40 4.279 3.698 -15.972 204 HG21 ILE 40 HG21 ILE 40 1.776 6.108 -14.438 205 HG22 ILE 40 HG22 ILE 40 1.865 4.505 -15.207 206 HG23 ILE 40 HG23 ILE 40 2.127 4.667 -13.454 207 HD11 ILE 40 HD11 ILE 40 2.471 5.846 -16.708 208 HD12 ILE 40 HD12 ILE 40 3.777 5.724 -17.911 209 HD13 ILE 40 HD13 ILE 40 2.770 4.303 -17.544 210 H LEU 41 H LEU 41 5.737 7.747 -16.360 211 HA LEU 41 HA LEU 41 3.490 8.929 -17.836 212 HB2 LEU 41 HB2 LEU 41 6.218 10.184 -17.619 213 HB3 LEU 41 HB3 LEU 41 4.757 10.872 -18.300 214 HG LEU 41 HG LEU 41 4.829 10.126 -15.390 215 HD11 LEU 41 HD11 LEU 41 5.791 12.803 -16.415 216 HD12 LEU 41 HD12 LEU 41 5.790 12.195 -14.742 217 HD13 LEU 41 HD13 LEU 41 6.885 11.478 -15.948 218 HD21 LEU 41 HD21 LEU 41 2.744 10.873 -16.729 219 HD22 LEU 41 HD22 LEU 41 3.066 11.617 -15.145 220 HD23 LEU 41 HD23 LEU 41 3.465 12.498 -16.639 221 H ASP 42 H ASP 42 4.053 9.303 -20.200 222 HA ASP 42 HA ASP 42 5.440 6.934 -21.085 223 HB2 ASP 42 HB2 ASP 42 3.169 7.480 -21.977 224 HB3 ASP 42 HB3 ASP 42 3.776 8.999 -22.603 225 HD2 ASP 42 HD2 ASP 42 5.263 5.853 -22.831 226 H SER 43 H SER 43 7.464 7.060 -22.119 227 HA SER 43 HA SER 43 8.578 9.710 -22.353 228 HB2 SER 43 HB2 SER 43 9.685 7.559 -21.269 229 HB3 SER 43 HB3 SER 43 10.094 7.154 -22.924 230 HG SER 43 HG SER 43 11.832 8.345 -22.202 231 H GLY 44 H GLY 44 8.140 6.685 -24.317 232 HA2 GLY 44 HA2 GLY 44 7.358 6.773 -26.541 233 HA3 GLY 44 HA3 GLY 44 8.062 8.367 -26.732 234 H ASN 45 H ASN 45 9.663 5.534 -25.187 235 HA ASN 45 HA ASN 45 11.522 5.572 -27.434 236 HB2 ASN 45 HB2 ASN 45 11.957 5.348 -24.443 237 HB3 ASN 45 HB3 ASN 45 13.085 4.529 -25.505 238 HD21 ASN 45 HD21 ASN 45 13.894 5.869 -27.378 239 HD22 ASN 45 HD22 ASN 45 14.358 7.506 -27.052 240 H ASP 46 H ASP 46 12.815 3.309 -27.438 241 HA ASP 46 HA ASP 46 11.108 1.337 -28.057 242 HB2 ASP 46 HB2 ASP 46 13.019 -0.206 -27.845 243 HB3 ASP 46 HB3 ASP 46 13.543 1.315 -28.540 244 HD2 ASP 46 HD2 ASP 46 15.046 2.626 -26.972 245 H ALA 47 H ALA 47 9.438 0.724 -26.621 246 HA ALA 47 HA ALA 47 9.933 0.501 -23.813 247 HB1 ALA 47 HB1 ALA 47 7.548 -0.298 -23.818 248 HB2 ALA 47 HB2 ALA 47 7.779 1.275 -24.619 249 HB3 ALA 47 HB3 ALA 47 7.566 -0.198 -25.595 250 H SER 48 H SER 48 10.428 -1.495 -26.589 251 HA SER 48 HA SER 48 9.799 -3.976 -25.692 252 HB2 SER 48 HB2 SER 48 10.618 -3.477 -27.970 253 HB3 SER 48 HB3 SER 48 12.213 -3.111 -27.345 254 HG SER 48 HG SER 48 11.723 -5.526 -26.393 255 H SER 49 H SER 49 12.629 -1.908 -24.913 256 HA SER 49 HA SER 49 14.071 -3.920 -23.618 257 HB2 SER 49 HB2 SER 49 15.343 -1.969 -22.625 258 HB3 SER 49 HB3 SER 49 15.227 -1.945 -24.373 259 HG SER 49 HG SER 49 14.648 0.110 -23.853 260 H ALA 50 H ALA 50 11.418 -1.759 -22.680 261 HA ALA 50 HA ALA 50 11.788 -2.045 -19.877 262 HB1 ALA 50 HB1 ALA 50 10.451 -0.244 -20.098 263 HB2 ALA 50 HB2 ALA 50 9.992 -0.702 -21.756 264 HB3 ALA 50 HB3 ALA 50 9.112 -1.386 -20.367 265 H TYR 51 H TYR 51 9.795 -3.668 -22.410 266 HA TYR 51 HA TYR 51 8.321 -5.274 -20.661 267 HB2 TYR 51 HB2 TYR 51 9.284 -5.298 -23.560 268 HB3 TYR 51 HB3 TYR 51 8.446 -6.715 -22.959 269 HD1 TYR 51 HD2 TYR 51 6.075 -6.448 -22.060 270 HD2 TYR 51 HD1 TYR 51 8.090 -3.357 -24.228 271 HE1 TYR 51 HE2 TYR 51 3.847 -5.325 -22.546 272 HE2 TYR 51 HE1 TYR 51 5.854 -2.246 -24.706 273 HH TYR 51 HH TYR 51 3.005 -3.156 -23.081 274 H LYS 52 H LYS 52 11.430 -5.871 -22.429 275 HA LYS 52 HA LYS 52 11.702 -8.509 -21.510 276 HB2 LYS 52 HB2 LYS 52 12.834 -7.358 -23.494 277 HB3 LYS 52 HB3 LYS 52 13.951 -6.663 -22.336 278 HG2 LYS 52 HG2 LYS 52 13.450 -9.639 -22.220 279 HG3 LYS 52 HG3 LYS 52 14.450 -9.020 -23.519 280 HD2 LYS 52 HD2 LYS 52 15.003 -8.122 -20.680 281 HD3 LYS 52 HD3 LYS 52 15.541 -9.710 -21.192 282 HE2 LYS 52 HE2 LYS 52 17.411 -8.475 -21.805 283 HE3 LYS 52 HE3 LYS 52 16.500 -8.352 -23.296 284 HZ1 LYS 52 HZ1 LYS 52 15.833 -6.224 -22.777 285 HZ2 LYS 52 HZ2 LYS 52 16.144 -6.370 -21.180 286 HZ3 LYS 52 HZ3 LYS 52 17.376 -6.240 -22.243 287 H LEU 53 H LEU 53 13.057 -5.358 -20.340 288 HA LEU 53 HA LEU 53 14.513 -6.437 -18.236 289 HB2 LEU 53 HB2 LEU 53 14.555 -4.104 -19.276 290 HB3 LEU 53 HB3 LEU 53 13.196 -3.729 -18.234 291 HG LEU 53 HG LEU 53 16.066 -4.116 -17.568 292 HD11 LEU 53 HD11 LEU 53 15.408 -2.379 -15.829 293 HD12 LEU 53 HD12 LEU 53 15.291 -1.892 -17.537 294 HD13 LEU 53 HD13 LEU 53 13.821 -2.326 -16.633 295 HD21 LEU 53 HD21 LEU 53 15.648 -4.751 -15.266 296 HD22 LEU 53 HD22 LEU 53 13.899 -4.848 -15.580 297 HD23 LEU 53 HD23 LEU 53 15.009 -5.994 -16.369 298 H GLY 54 H GLY 54 11.058 -5.524 -18.540 299 HA2 GLY 54 HA2 GLY 54 10.440 -5.783 -15.783 300 HA3 GLY 54 HA3 GLY 54 9.319 -5.774 -17.130 301 H THR 55 H THR 55 10.349 -8.022 -18.624 302 HA THR 55 HA THR 55 8.996 -10.112 -17.379 303 HB THR 55 HB THR 55 11.004 -9.884 -19.663 304 HG1 THR 55 HG1 THR 55 8.604 -9.135 -19.517 305 HG21 THR 55 HG21 THR 55 11.240 -12.163 -19.631 306 HG22 THR 55 HG22 THR 55 10.074 -12.323 -18.296 307 HG23 THR 55 HG23 THR 55 9.497 -12.251 -19.979 308 H TYR 56 H TYR 56 12.539 -9.411 -17.538 309 HA TYR 56 HA TYR 56 13.195 -11.717 -16.015 310 HB2 TYR 56 HB2 TYR 56 14.470 -9.103 -16.959 311 HB3 TYR 56 HB3 TYR 56 15.356 -10.101 -15.823 312 HD1 TYR 56 HD1 TYR 56 13.191 -11.294 -18.617 313 HD2 TYR 56 HD2 TYR 56 17.179 -10.820 -17.142 314 HE1 TYR 56 HE1 TYR 56 14.078 -12.704 -20.539 315 HE2 TYR 56 HE2 TYR 56 18.052 -12.231 -19.068 316 HH TYR 56 HH TYR 56 17.080 -14.054 -20.547 317 H LEU 57 H LEU 57 12.349 -8.333 -15.277 318 HA LEU 57 HA LEU 57 13.318 -8.485 -12.593 319 HB2 LEU 57 HB2 LEU 57 13.370 -6.364 -13.537 320 HB3 LEU 57 HB3 LEU 57 11.763 -6.508 -14.221 321 HG LEU 57 HG LEU 57 12.014 -4.920 -12.276 322 HD11 LEU 57 HD11 LEU 57 9.976 -6.599 -11.163 323 HD12 LEU 57 HD12 LEU 57 9.812 -5.124 -12.146 324 HD13 LEU 57 HD13 LEU 57 9.925 -6.713 -12.939 325 HD21 LEU 57 HD21 LEU 57 13.262 -5.744 -10.593 326 HD22 LEU 57 HD22 LEU 57 11.710 -6.420 -10.041 327 HD23 LEU 57 HD23 LEU 57 12.845 -7.435 -10.963 328 H TYR 58 H TYR 58 10.416 -9.413 -14.335 329 HA TYR 58 HA TYR 58 8.856 -9.539 -11.887 330 HB2 TYR 58 HB2 TYR 58 8.533 -9.894 -14.897 331 HB3 TYR 58 HB3 TYR 58 7.335 -10.650 -13.866 332 HD1 TYR 58 HD1 TYR 58 6.878 -8.718 -11.737 333 HD2 TYR 58 HD2 TYR 58 7.564 -8.038 -15.905 334 HE1 TYR 58 HE1 TYR 58 5.621 -6.513 -11.592 335 HE2 TYR 58 HE2 TYR 58 6.304 -5.836 -15.746 336 HH TYR 58 HH TYR 58 5.883 -4.151 -13.659 337 H GLN 59 H GLN 59 10.614 -11.639 -14.183 338 HA GLN 59 HA GLN 59 9.496 -13.994 -13.021 339 HB2 GLN 59 HB2 GLN 59 11.375 -13.342 -15.259 340 HB3 GLN 59 HB3 GLN 59 11.569 -14.920 -14.523 341 HG2 GLN 59 HG2 GLN 59 9.988 -15.138 -16.361 342 HG3 GLN 59 HG3 GLN 59 9.107 -15.351 -14.861 343 HE21 GLN 59 HE21 GLN 59 8.801 -14.109 -17.767 344 HE22 GLN 59 HE22 GLN 59 7.816 -12.711 -17.492 345 H LYS 60 H LYS 60 12.526 -12.081 -12.841 346 HA LYS 60 HA LYS 60 14.400 -12.400 -11.662 347 HB2 LYS 60 HB2 LYS 60 13.680 -12.839 -9.120 348 HB3 LYS 60 HB3 LYS 60 13.471 -11.295 -9.920 349 HG2 LYS 60 HG2 LYS 60 11.127 -12.004 -10.575 350 HG3 LYS 60 HG3 LYS 60 11.350 -13.477 -9.651 351 HD2 LYS 60 HD2 LYS 60 11.030 -10.648 -8.673 352 HD3 LYS 60 HD3 LYS 60 10.309 -12.121 -8.056 353 HE2 LYS 60 HE2 LYS 60 12.568 -12.827 -7.180 354 HE3 LYS 60 HE3 LYS 60 13.240 -11.310 -7.744 355 HZ1 LYS 60 HZ1 LYS 60 11.657 -11.818 -5.447 356 HZ2 LYS 60 HZ2 LYS 60 12.628 -10.547 -5.777 357 HZ3 LYS 60 HZ3 LYS 60 11.086 -10.557 -6.313 358 H ASP 61 H ASP 61 13.656 -14.749 -13.156 359 HA ASP 61 HA ASP 61 14.038 -16.883 -13.304 360 HB2 ASP 61 HB2 ASP 61 16.357 -16.012 -12.750 361 HB3 ASP 61 HB3 ASP 61 16.066 -16.409 -11.068 362 HD2 ASP 61 HD2 ASP 61 15.992 -17.823 -14.155 363 H ASN 62 H ASN 62 11.786 -16.502 -11.791 364 HA ASN 62 HA ASN 62 11.756 -18.785 -10.168 365 HB2 ASN 62 HB2 ASN 62 11.892 -16.063 -8.849 366 HB3 ASN 62 HB3 ASN 62 10.834 -17.264 -8.135 367 HD21 ASN 62 HD21 ASN 62 13.928 -16.050 -8.273 368 HD22 ASN 62 HD22 ASN 62 14.811 -17.336 -7.520 369 H SER 63 H SER 63 9.413 -18.766 -8.942 370 HA SER 63 HA SER 63 7.259 -18.790 -9.216 371 HB2 SER 63 HB2 SER 63 7.244 -16.052 -10.484 372 HB3 SER 63 HB3 SER 63 6.152 -16.719 -9.287 373 HG SER 63 HG SER 63 7.378 -15.882 -7.755 374 H CYS 64 H CYS 64 8.556 -20.115 -11.265 375 HA CYS 64 HA CYS 64 7.258 -19.184 -13.709 376 HB2 CYS 64 HB2 CYS 64 9.656 -19.527 -13.922 377 HB3 CYS 64 HB3 CYS 64 9.526 -21.158 -13.292 378 HG CYS 64 HG CYS 64 9.087 -22.252 -15.339 379 H ASN 65 H ASN 65 7.184 -21.528 -11.116 380 HA ASN 65 HA ASN 65 5.479 -23.260 -12.709 381 HB2 ASN 65 HB2 ASN 65 7.075 -23.640 -10.146 382 HB3 ASN 65 HB3 ASN 65 5.746 -24.724 -10.506 383 HD21 ASN 65 HD21 ASN 65 7.179 -26.453 -10.669 384 HD22 ASN 65 HD22 ASN 65 8.178 -26.715 -12.060 385 H LEU 66 H LEU 66 5.400 -20.634 -10.575 386 HA LEU 66 HA LEU 66 3.161 -21.513 -8.987 387 HB2 LEU 66 HB2 LEU 66 4.910 -19.101 -9.131 388 HB3 LEU 66 HB3 LEU 66 3.323 -18.935 -8.408 389 HG LEU 66 HG LEU 66 5.423 -19.483 -6.941 390 HD11 LEU 66 HD11 LEU 66 3.631 -21.185 -5.698 391 HD12 LEU 66 HD12 LEU 66 3.695 -19.413 -5.534 392 HD13 LEU 66 HD13 LEU 66 2.591 -20.159 -6.715 393 HD21 LEU 66 HD21 LEU 66 4.616 -22.269 -7.822 394 HD22 LEU 66 HD22 LEU 66 6.135 -21.441 -8.241 395 HD23 LEU 66 HD23 LEU 66 5.786 -21.858 -6.546 396 H PHE 67 H PHE 67 1.291 -19.682 -8.879 397 HA PHE 67 HA PHE 67 -0.009 -19.911 -11.372 398 HB2 PHE 67 HB2 PHE 67 -0.427 -18.519 -8.687 399 HB3 PHE 67 HB3 PHE 67 -1.533 -18.161 -9.997 400 HD1 PHE 67 HD1 PHE 67 -2.891 -20.027 -10.993 401 HD2 PHE 67 HD2 PHE 67 -0.609 -20.531 -7.451 402 HE1 PHE 67 HE1 PHE 67 -4.229 -22.073 -10.422 403 HE2 PHE 67 HE2 PHE 67 -1.948 -22.577 -6.880 404 HZ PHE 67 HZ PHE 67 -3.742 -23.323 -8.372 405 H ASN 68 H ASN 68 2.392 -17.750 -10.256 406 HA ASN 68 HA ASN 68 1.469 -15.353 -11.270 407 HB2 ASN 68 HB2 ASN 68 4.205 -16.533 -10.699 408 HB3 ASN 68 HB3 ASN 68 4.118 -15.001 -11.545 409 HD21 ASN 68 HD21 ASN 68 2.567 -13.378 -10.564 410 HD22 ASN 68 HD22 ASN 68 2.603 -13.182 -8.843 411 H THR 69 H THR 69 1.411 -14.541 -13.401 412 HA THR 69 HA THR 69 2.742 -16.172 -15.463 413 HB THR 69 HB THR 69 0.658 -15.367 -16.856 414 HG1 THR 69 HG1 THR 69 0.007 -13.882 -15.091 415 HG21 THR 69 HG21 THR 69 -0.144 -17.183 -14.559 416 HG22 THR 69 HG22 THR 69 -0.574 -17.308 -16.281 417 HG23 THR 69 HG23 THR 69 1.063 -17.747 -15.739 418 H LEU 70 H LEU 70 3.596 -15.070 -17.275 419 HA LEU 70 HA LEU 70 4.610 -12.510 -16.598 420 HB2 LEU 70 HB2 LEU 70 6.133 -13.651 -17.807 421 HB3 LEU 70 HB3 LEU 70 4.930 -14.499 -18.758 422 HG LEU 70 HG LEU 70 4.591 -12.537 -20.166 423 HD11 LEU 70 HD11 LEU 70 5.201 -10.461 -19.641 424 HD12 LEU 70 HD12 LEU 70 5.569 -11.087 -18.016 425 HD13 LEU 70 HD13 LEU 70 6.860 -10.961 -19.235 426 HD21 LEU 70 HD21 LEU 70 7.539 -12.643 -20.219 427 HD22 LEU 70 HD22 LEU 70 6.721 -14.224 -20.239 428 HD23 LEU 70 HD23 LEU 70 6.345 -13.012 -21.487 429 H THR 71 H THR 71 1.852 -13.744 -18.456 430 HA THR 71 HA THR 71 1.310 -11.568 -20.062 431 HB THR 71 HB THR 71 0.209 -13.936 -19.852 432 HG1 THR 71 HG1 THR 71 -1.923 -12.666 -20.443 433 HG21 THR 71 HG21 THR 71 -1.689 -14.163 -18.460 434 HG22 THR 71 HG22 THR 71 -0.570 -13.293 -17.383 435 HG23 THR 71 HG23 THR 71 -1.854 -12.404 -18.239 436 H GLU 72 H GLU 72 0.854 -11.967 -16.554 437 HA GLU 72 HA GLU 72 -0.863 -9.786 -16.275 438 HB2 GLU 72 HB2 GLU 72 -0.738 -11.423 -14.511 439 HB3 GLU 72 HB3 GLU 72 0.996 -11.230 -14.349 440 HG2 GLU 72 HG2 GLU 72 -0.197 -10.049 -12.525 441 HG3 GLU 72 HG3 GLU 72 0.700 -8.917 -13.517 442 HE2 GLU 72 HE2 GLU 72 -1.214 -7.235 -14.779 443 H ALA 73 H ALA 73 2.725 -10.158 -16.080 444 HA ALA 73 HA ALA 73 3.231 -7.514 -15.280 445 HB1 ALA 73 HB1 ALA 73 5.071 -8.821 -14.918 446 HB2 ALA 73 HB2 ALA 73 4.747 -9.855 -16.331 447 HB3 ALA 73 HB3 ALA 73 5.509 -8.262 -16.550 448 H ARG 74 H ARG 74 3.273 -9.139 -18.527 449 HA ARG 74 HA ARG 74 4.006 -6.951 -19.964 450 HB2 ARG 74 HB2 ARG 74 3.558 -9.465 -20.656 451 HB3 ARG 74 HB3 ARG 74 1.934 -8.914 -21.015 452 HG2 ARG 74 HG2 ARG 74 4.276 -7.347 -22.116 453 HG3 ARG 74 HG3 ARG 74 3.840 -8.861 -22.885 454 HD2 ARG 74 HD2 ARG 74 1.652 -6.852 -22.308 455 HD3 ARG 74 HD3 ARG 74 2.723 -6.559 -23.664 456 HE ARG 74 HE ARG 74 0.701 -8.671 -23.457 457 HH11 ARG 74 HH22 ARG 74 3.654 -7.653 -25.077 458 HH12 ARG 74 HH21 ARG 74 3.385 -8.648 -26.469 459 HH21 ARG 74 HH12 ARG 74 0.345 -9.984 -25.294 460 HH22 ARG 74 HH11 ARG 74 1.491 -9.982 -26.594 461 H ASP 75 H ASP 75 0.790 -7.940 -18.713 462 HA ASP 75 HA ASP 75 -0.599 -5.976 -20.189 463 HB2 ASP 75 HB2 ASP 75 -1.484 -8.185 -19.126 464 HB3 ASP 75 HB3 ASP 75 -1.527 -7.305 -17.611 465 HD2 ASP 75 HD2 ASP 75 -2.463 -6.679 -20.849 466 H ALA 76 H ALA 76 1.047 -6.240 -17.042 467 HA ALA 76 HA ALA 76 -0.169 -4.125 -15.701 468 HB1 ALA 76 HB1 ALA 76 1.259 -4.808 -14.103 469 HB2 ALA 76 HB2 ALA 76 1.886 -5.998 -15.269 470 HB3 ALA 76 HB3 ALA 76 2.671 -4.408 -15.111 471 H ILE 77 H ILE 77 2.838 -4.223 -17.739 472 HA ILE 77 HA ILE 77 3.245 -1.435 -17.553 473 HB ILE 77 HB ILE 77 4.858 -1.835 -19.391 474 HG12 ILE 77 HG12 ILE 77 3.446 -4.457 -19.473 475 HG13 ILE 77 HG13 ILE 77 4.117 -3.497 -20.776 476 HG21 ILE 77 HG21 ILE 77 5.026 -3.773 -17.067 477 HG22 ILE 77 HG22 ILE 77 6.384 -3.211 -18.072 478 HG23 ILE 77 HG23 ILE 77 5.502 -2.058 -17.041 479 HD11 ILE 77 HD11 ILE 77 6.414 -4.124 -20.108 480 HD12 ILE 77 HD12 ILE 77 5.770 -5.043 -18.726 481 HD13 ILE 77 HD13 ILE 77 5.430 -5.580 -20.388 482 H LYS 78 H LYS 78 1.891 -3.572 -20.157 483 HA LYS 78 HA LYS 78 1.302 -1.550 -21.942 484 HB2 LYS 78 HB2 LYS 78 0.308 -3.185 -23.164 485 HB3 LYS 78 HB3 LYS 78 1.182 -4.207 -22.041 486 HG2 LYS 78 HG2 LYS 78 -0.990 -5.110 -21.941 487 HG3 LYS 78 HG3 LYS 78 -0.970 -4.050 -20.546 488 HD2 LYS 78 HD2 LYS 78 -2.478 -2.571 -21.470 489 HD3 LYS 78 HD3 LYS 78 -1.812 -2.731 -23.083 490 HE2 LYS 78 HE2 LYS 78 -2.853 -5.178 -22.967 491 HE3 LYS 78 HE3 LYS 78 -3.843 -4.496 -21.692 492 HZ1 LYS 78 HZ1 LYS 78 -3.720 -2.783 -23.933 493 HZ2 LYS 78 HZ2 LYS 78 -4.273 -4.260 -24.356 494 HZ3 LYS 78 HZ3 LYS 78 -5.028 -3.411 -23.184 495 H ASP 79 H ASP 79 -0.254 -2.493 -18.914 496 HA ASP 79 HA ASP 79 -2.702 -1.238 -19.490 497 HB2 ASP 79 HB2 ASP 79 -1.314 -2.347 -17.060 498 HB3 ASP 79 HB3 ASP 79 -2.641 -1.238 -16.775 499 HD2 ASP 79 HD2 ASP 79 -3.982 -4.272 -18.932 500 H ALA 80 H ALA 80 0.337 -0.370 -17.716 501 HA ALA 80 HA ALA 80 -0.568 2.137 -16.809 502 HB1 ALA 80 HB1 ALA 80 2.205 0.972 -17.267 503 HB2 ALA 80 HB2 ALA 80 1.891 2.513 -16.434 504 HB3 ALA 80 HB3 ALA 80 1.283 0.989 -15.745 505 H TYR 81 H TYR 81 1.112 0.992 -19.776 506 HA TYR 81 HA TYR 81 1.690 3.552 -20.783 507 HB2 TYR 81 HB2 TYR 81 1.254 0.713 -21.858 508 HB3 TYR 81 HB3 TYR 81 1.613 2.015 -22.975 509 HD1 TYR 81 HD2 TYR 81 3.013 1.352 -19.563 510 HD2 TYR 81 HD1 TYR 81 3.770 1.585 -23.767 511 HE1 TYR 81 HE2 TYR 81 5.500 1.035 -19.140 512 HE2 TYR 81 HE1 TYR 81 6.254 1.268 -23.330 513 HH TYR 81 HH TYR 81 7.448 0.131 -20.467 514 H GLU 82 H GLU 82 -1.057 1.254 -21.358 515 HA GLU 82 HA GLU 82 -2.298 3.070 -23.138 516 HB2 GLU 82 HB2 GLU 82 -3.094 0.448 -21.847 517 HB3 GLU 82 HB3 GLU 82 -4.283 1.385 -22.729 518 HG2 GLU 82 HG2 GLU 82 -1.584 0.577 -23.906 519 HG3 GLU 82 HG3 GLU 82 -3.042 -0.376 -24.106 520 HE2 GLU 82 HE2 GLU 82 -1.716 0.635 -26.070 521 H SER 83 H SER 83 -2.219 2.586 -19.666 522 HA SER 83 HA SER 83 -4.732 3.712 -19.123 523 HB2 SER 83 HB2 SER 83 -2.238 3.136 -17.510 524 HB3 SER 83 HB3 SER 83 -3.520 4.091 -16.793 525 HG SER 83 HG SER 83 -4.952 2.196 -17.616 526 H TYR 84 H TYR 84 -1.336 4.980 -19.168 527 HA TYR 84 HA TYR 84 -2.427 7.689 -18.894 528 HB2 TYR 84 HB2 TYR 84 0.377 6.422 -18.692 529 HB3 TYR 84 HB3 TYR 84 0.073 8.129 -18.440 530 HD1 TYR 84 HD2 TYR 84 -1.693 8.710 -16.562 531 HD2 TYR 84 HD1 TYR 84 0.377 4.977 -16.860 532 HE1 TYR 84 HE2 TYR 84 -2.135 8.260 -14.099 533 HE2 TYR 84 HE1 TYR 84 -0.073 4.540 -14.396 534 HH TYR 84 HH TYR 84 -2.125 5.512 -12.741 535 H CYS 85 H CYS 85 -1.863 5.571 -21.334 536 HA CYS 85 HA CYS 85 -0.069 6.596 -23.049 537 HB2 CYS 85 HB2 CYS 85 -1.012 4.811 -24.051 538 HB3 CYS 85 HB3 CYS 85 -2.576 5.081 -23.308 539 HG CYS 85 HG CYS 85 -2.743 5.147 -25.953 540 H GLY 86 H GLY 86 0.251 8.600 -23.962 541 HA2 GLY 86 HA2 GLY 86 -0.557 10.419 -25.235 542 HA3 GLY 86 HA3 GLY 86 -2.104 10.307 -24.420 543 H ILE 87 H ILE 87 0.277 9.754 -22.082 544 HA ILE 87 HA ILE 87 0.251 12.598 -21.348 545 HB ILE 87 HB ILE 87 0.378 10.172 -19.553 546 HG12 ILE 87 HG12 ILE 87 -1.931 12.071 -20.061 547 HG13 ILE 87 HG13 ILE 87 -1.810 10.442 -20.694 548 HG21 ILE 87 HG21 ILE 87 0.504 11.562 -17.734 549 HG22 ILE 87 HG22 ILE 87 1.479 12.474 -18.911 550 HG23 ILE 87 HG23 ILE 87 -0.208 12.947 -18.596 551 HD11 ILE 87 HD11 ILE 87 -2.585 11.338 -18.010 552 HD12 ILE 87 HD12 ILE 87 -2.821 9.752 -18.783 553 HD13 ILE 87 HD13 ILE 87 -1.291 10.117 -17.951 554 H ASP 88 H ASP 88 2.166 13.566 -21.717 555 HA ASP 88 HA ASP 88 4.523 11.879 -21.403 556 HB2 ASP 88 HB2 ASP 88 3.944 12.945 -23.707 557 HB3 ASP 88 HB3 ASP 88 4.367 14.481 -22.978 558 HD2 ASP 88 HD2 ASP 88 6.605 11.793 -22.137 559 H ASP 89 H ASP 89 2.642 14.367 -20.057 560 HA ASP 89 HA ASP 89 4.993 15.526 -18.778 561 HB2 ASP 89 HB2 ASP 89 3.125 17.408 -18.285 562 HB3 ASP 89 HB3 ASP 89 4.105 17.427 -19.738 563 HD2 ASP 89 HD2 ASP 89 0.920 17.322 -18.652 564 H CYS 90 H CYS 90 4.831 15.808 -16.441 565 HA CYS 90 HA CYS 90 3.321 13.890 -15.122 566 HB2 CYS 90 HB2 CYS 90 5.403 14.764 -14.205 567 HB3 CYS 90 HB3 CYS 90 4.709 16.365 -14.043 568 HA PRO 91 HA PRO 91 -0.422 16.246 -15.179 569 HB2 PRO 91 HB2 PRO 91 -2.096 14.224 -14.421 570 HB3 PRO 91 HB3 PRO 91 -1.645 14.520 -16.088 571 HG2 PRO 91 HG2 PRO 91 -0.705 12.392 -14.264 572 HG3 PRO 91 HG3 PRO 91 -0.608 12.461 -16.013 573 HD2 PRO 91 HD2 PRO 91 1.526 12.934 -14.155 574 HD3 PRO 91 HD3 PRO 91 1.593 13.117 -15.897 575 H GLN 92 H GLN 92 0.819 14.369 -12.551 576 HA GLN 92 HA GLN 92 -0.966 15.348 -10.650 577 HB2 GLN 92 HB2 GLN 92 1.850 14.210 -10.426 578 HB3 GLN 92 HB3 GLN 92 0.885 14.622 -9.022 579 HG2 GLN 92 HG2 GLN 92 -0.069 12.720 -11.212 580 HG3 GLN 92 HG3 GLN 92 0.740 12.181 -9.754 581 HE21 GLN 92 HE21 GLN 92 -2.104 12.152 -11.029 582 HE22 GLN 92 HE22 GLN 92 -3.162 12.482 -9.698 583 H CYS 93 H CYS 93 2.006 16.636 -12.110 584 HA CYS 93 HA CYS 93 2.477 18.579 -10.118 585 HB2 CYS 93 HB2 CYS 93 3.562 17.930 -12.806 586 HB3 CYS 93 HB3 CYS 93 3.711 19.605 -12.312 587 H SER 94 H SER 94 0.486 18.307 -13.068 588 HA SER 94 HA SER 94 -0.055 21.094 -13.159 589 HB2 SER 94 HB2 SER 94 -0.059 19.595 -15.177 590 HB3 SER 94 HB3 SER 94 -1.473 18.775 -14.546 591 HG SER 94 HG SER 94 -2.715 20.355 -15.279 592 H LYS 95 H LYS 95 -1.455 18.177 -11.691 593 HA LYS 95 HA LYS 95 -3.986 19.390 -11.150 594 HB2 LYS 95 HB2 LYS 95 -3.860 17.006 -11.480 595 HB3 LYS 95 HB3 LYS 95 -2.667 16.831 -10.209 596 HG2 LYS 95 HG2 LYS 95 -4.772 16.207 -9.228 597 HG3 LYS 95 HG3 LYS 95 -4.388 17.787 -8.576 598 HD2 LYS 95 HD2 LYS 95 -6.566 18.221 -9.216 599 HD3 LYS 95 HD3 LYS 95 -5.781 18.617 -10.731 600 HE2 LYS 95 HE2 LYS 95 -6.576 15.742 -10.264 601 HE3 LYS 95 HE3 LYS 95 -7.845 16.896 -10.624 602 HZ1 LYS 95 HZ1 LYS 95 -5.824 15.863 -12.334 603 HZ2 LYS 95 HZ2 LYS 95 -7.259 16.542 -12.715 604 HZ3 LYS 95 HZ3 LYS 95 -5.957 17.487 -12.435 605 H TYR 96 H TYR 96 -0.826 19.066 -9.538 606 HA TYR 96 HA TYR 96 -1.950 20.305 -7.137 607 HB2 TYR 96 HB2 TYR 96 0.792 19.106 -7.884 608 HB3 TYR 96 HB3 TYR 96 0.360 19.639 -6.271 609 HD1 TYR 96 HD1 TYR 96 -2.630 18.388 -7.085 610 HD2 TYR 96 HD2 TYR 96 1.370 16.954 -6.590 611 HE1 TYR 96 HE1 TYR 96 -3.520 16.065 -6.557 612 HE2 TYR 96 HE2 TYR 96 0.467 14.637 -6.063 613 HH TYR 96 HH TYR 96 -1.283 13.377 -5.933 614 H ILE 97 H ILE 97 -1.867 22.485 -6.974 615 HA ILE 97 HA ILE 97 -0.097 23.944 -8.715 616 HB ILE 97 HB ILE 97 -2.438 24.512 -7.001 617 HG12 ILE 97 HG12 ILE 97 -2.341 24.195 -9.555 618 HG13 ILE 97 HG13 ILE 97 -3.286 25.524 -8.913 619 HG21 ILE 97 HG21 ILE 97 -2.017 26.910 -6.913 620 HG22 ILE 97 HG22 ILE 97 -0.768 26.015 -6.015 621 HG23 ILE 97 HG23 ILE 97 -0.405 26.670 -7.629 622 HD11 ILE 97 HD11 ILE 97 -1.558 25.919 -10.902 623 HD12 ILE 97 HD12 ILE 97 -1.770 27.148 -9.632 624 HD13 ILE 97 HD13 ILE 97 -0.385 26.032 -9.567 625 H ASP 98 H ASP 98 1.326 25.708 -7.832 626 HA ASP 98 HA ASP 98 2.764 24.592 -5.592 627 HB2 ASP 98 HB2 ASP 98 3.431 26.833 -7.557 628 HB3 ASP 98 HB3 ASP 98 4.501 26.326 -6.266 629 HD2 ASP 98 HD2 ASP 98 3.175 23.857 -8.902 630 H ASP 99 H ASP 99 1.852 25.346 -3.643 631 HA ASP 99 HA ASP 99 0.393 27.586 -3.310 632 HB2 ASP 99 HB2 ASP 99 1.044 25.612 -1.678 633 HB3 ASP 99 HB3 ASP 99 2.343 26.673 -1.170 634 HD2 ASP 99 HD2 ASP 99 0.435 26.195 0.869 Start of MODEL 16 1 H GLU 14 H GLU 14 1.471 1.313 -1.935 2 HA GLU 14 HA GLU 14 3.243 -0.384 -0.811 3 HB2 GLU 14 HB2 GLU 14 1.438 -1.037 0.711 4 HB3 GLU 14 HB3 GLU 14 1.314 0.674 0.353 5 HG2 GLU 14 HG2 GLU 14 -0.211 -1.293 -1.369 6 HG3 GLU 14 HG3 GLU 14 -0.834 -0.900 0.221 7 HE2 GLU 14 HE2 GLU 14 -2.068 -0.049 -2.253 8 H ASP 15 H ASP 15 2.126 -0.974 -3.758 9 HA ASP 15 HA ASP 15 1.461 -3.754 -3.318 10 HB2 ASP 15 HB2 ASP 15 0.102 -2.325 -4.897 11 HB3 ASP 15 HB3 ASP 15 1.528 -2.110 -5.893 12 HD2 ASP 15 HD2 ASP 15 -0.193 -5.653 -5.459 13 H GLN 16 H GLN 16 2.694 -5.448 -4.519 14 HA GLN 16 HA GLN 16 5.453 -4.863 -4.555 15 HB2 GLN 16 HB2 GLN 16 4.251 -7.085 -3.937 16 HB3 GLN 16 HB3 GLN 16 4.160 -7.379 -5.662 17 HG2 GLN 16 HG2 GLN 16 6.768 -6.787 -5.586 18 HG3 GLN 16 HG3 GLN 16 6.606 -7.213 -3.894 19 HE21 GLN 16 HE21 GLN 16 6.506 -9.275 -3.288 20 HE22 GLN 16 HE22 GLN 16 6.474 -10.646 -4.347 21 H GLU 17 H GLU 17 2.855 -5.143 -6.976 22 HA GLU 17 HA GLU 17 4.338 -5.546 -9.223 23 HB2 GLU 17 HB2 GLU 17 1.725 -5.249 -8.776 24 HB3 GLU 17 HB3 GLU 17 2.031 -3.600 -9.285 25 HG2 GLU 17 HG2 GLU 17 1.445 -4.781 -11.286 26 HG3 GLU 17 HG3 GLU 17 3.182 -4.563 -11.369 27 HE2 GLU 17 HE2 GLU 17 2.339 -7.813 -12.341 28 H GLN 18 H GLN 18 3.597 -2.457 -7.500 29 HA GLN 18 HA GLN 18 4.766 -0.804 -9.389 30 HB2 GLN 18 HB2 GLN 18 4.364 0.907 -7.868 31 HB3 GLN 18 HB3 GLN 18 3.262 -0.313 -7.263 32 HG2 GLN 18 HG2 GLN 18 5.323 -1.083 -5.790 33 HG3 GLN 18 HG3 GLN 18 5.961 0.509 -6.151 34 HE21 GLN 18 HE21 GLN 18 5.657 0.238 -3.653 35 HE22 GLN 18 HE22 GLN 18 4.225 0.959 -2.997 36 H TRP 19 H TRP 19 6.109 -2.747 -6.722 37 HA TRP 19 HA TRP 19 8.606 -1.466 -6.577 38 HB2 TRP 19 HB2 TRP 19 7.740 -2.898 -4.815 39 HB3 TRP 19 HB3 TRP 19 7.773 -4.288 -5.881 40 HD1 TRP 19 HD1 TRP 19 10.269 -1.878 -4.125 41 HE1 TRP 19 HE1 TRP 19 12.608 -3.048 -3.772 42 HE3 TRP 19 HE3 TRP 19 9.126 -6.116 -6.691 43 HZ2 TRP 19 HZ2 TRP 19 13.693 -5.558 -4.588 44 HZ3 TRP 19 HZ3 TRP 19 10.882 -7.877 -6.866 45 HH2 TRP 19 HH2 TRP 19 13.101 -7.649 -5.866 46 H ALA 20 H ALA 20 7.143 -3.920 -8.715 47 HA ALA 20 HA ALA 20 9.590 -4.781 -9.858 48 HB1 ALA 20 HB1 ALA 20 8.037 -6.364 -10.327 49 HB2 ALA 20 HB2 ALA 20 6.687 -5.210 -10.203 50 HB3 ALA 20 HB3 ALA 20 7.623 -5.325 -11.713 51 H MET 21 H MET 21 7.006 -2.435 -10.842 52 HA MET 21 HA MET 21 8.013 -1.741 -13.258 53 HB2 MET 21 HB2 MET 21 6.581 -0.142 -11.081 54 HB3 MET 21 HB3 MET 21 6.938 0.581 -12.637 55 HG2 MET 21 HG2 MET 21 5.602 -2.115 -12.674 56 HG3 MET 21 HG3 MET 21 4.627 -0.759 -12.144 57 HE1 MET 21 HE1 MET 21 4.682 1.368 -13.110 58 HE2 MET 21 HE2 MET 21 5.501 1.844 -14.617 59 HE3 MET 21 HE3 MET 21 3.800 1.319 -14.656 60 H GLN 22 H GLN 22 9.394 -1.156 -10.108 61 HA GLN 22 HA GLN 22 10.675 1.176 -10.326 62 HB2 GLN 22 HB2 GLN 22 11.636 -1.477 -9.195 63 HB3 GLN 22 HB3 GLN 22 12.576 -0.009 -9.016 64 HG2 GLN 22 HG2 GLN 22 10.403 1.067 -8.066 65 HG3 GLN 22 HG3 GLN 22 9.776 -0.566 -7.958 66 HE21 GLN 22 HE21 GLN 22 11.763 -2.105 -7.169 67 HE22 GLN 22 HE22 GLN 22 12.415 -1.638 -5.634 68 H THR 23 H THR 23 12.495 -1.878 -11.067 69 HA THR 23 HA THR 23 14.367 -0.499 -12.680 70 HB THR 23 HB THR 23 13.804 -3.496 -12.685 71 HG1 THR 23 HG1 THR 23 14.486 -1.618 -10.650 72 HG21 THR 23 HG21 THR 23 16.455 -2.018 -12.405 73 HG22 THR 23 HG22 THR 23 16.180 -3.701 -12.914 74 HG23 THR 23 HG23 THR 23 15.765 -2.361 -14.009 75 H LEU 24 H LEU 24 11.742 -2.852 -13.551 76 HA LEU 24 HA LEU 24 11.971 -2.929 -16.194 77 HB2 LEU 24 HB2 LEU 24 10.254 -4.123 -15.120 78 HB3 LEU 24 HB3 LEU 24 9.516 -2.669 -14.477 79 HG LEU 24 HG LEU 24 9.642 -3.201 -17.447 80 HD11 LEU 24 HD11 LEU 24 7.835 -4.558 -17.447 81 HD12 LEU 24 HD12 LEU 24 8.438 -4.978 -15.826 82 HD13 LEU 24 HD13 LEU 24 7.119 -3.798 -16.006 83 HD21 LEU 24 HD21 LEU 24 7.430 -1.782 -17.149 84 HD22 LEU 24 HD22 LEU 24 8.252 -1.250 -15.662 85 HD23 LEU 24 HD23 LEU 24 9.031 -1.009 -17.244 86 H MET 25 H MET 25 9.887 -0.382 -14.644 87 HA MET 25 HA MET 25 9.939 1.137 -17.020 88 HB2 MET 25 HB2 MET 25 8.170 2.148 -15.952 89 HB3 MET 25 HB3 MET 25 8.420 1.015 -14.638 90 HG2 MET 25 HG2 MET 25 10.184 2.678 -13.723 91 HG3 MET 25 HG3 MET 25 9.577 3.826 -14.899 92 HE1 MET 25 HE1 MET 25 5.777 3.963 -13.961 93 HE2 MET 25 HE2 MET 25 7.032 5.030 -14.636 94 HE3 MET 25 HE3 MET 25 6.808 3.392 -15.295 95 H GLY 26 H GLY 26 12.003 0.882 -14.201 96 HA2 GLY 26 HA2 GLY 26 13.078 3.515 -14.237 97 HA3 GLY 26 HA3 GLY 26 13.749 2.098 -13.453 98 H SER 27 H SER 27 13.294 0.920 -16.471 99 HA SER 27 HA SER 27 15.991 1.019 -17.101 100 HB2 SER 27 HB2 SER 27 15.433 -0.485 -18.738 101 HB3 SER 27 HB3 SER 27 13.910 -0.537 -17.872 102 HG SER 27 HG SER 27 13.941 -0.121 -20.329 103 H GLY 28 H GLY 28 13.621 3.433 -17.332 104 HA2 GLY 28 HA2 GLY 28 14.148 5.598 -18.047 105 HA3 GLY 28 HA3 GLY 28 15.281 4.952 -19.218 106 H VAL 29 H VAL 29 12.447 3.032 -19.177 107 HA VAL 29 HA VAL 29 11.708 3.960 -21.765 108 HB VAL 29 HB VAL 29 10.750 1.862 -19.845 109 HG11 VAL 29 HG11 VAL 29 9.127 1.161 -21.674 110 HG12 VAL 29 HG12 VAL 29 8.676 2.606 -20.737 111 HG13 VAL 29 HG13 VAL 29 9.356 2.782 -22.372 112 HG21 VAL 29 HG21 VAL 29 12.186 0.611 -21.003 113 HG22 VAL 29 HG22 VAL 29 11.225 0.890 -22.475 114 HG23 VAL 29 HG23 VAL 29 12.565 1.988 -22.065 115 H LEU 30 H LEU 30 10.264 4.099 -18.449 116 HA LEU 30 HA LEU 30 8.290 5.982 -19.513 117 HB2 LEU 30 HB2 LEU 30 8.354 4.076 -17.217 118 HB3 LEU 30 HB3 LEU 30 7.384 5.528 -17.070 119 HG LEU 30 HG LEU 30 7.113 3.498 -19.304 120 HD11 LEU 30 HD11 LEU 30 5.520 3.849 -16.753 121 HD12 LEU 30 HD12 LEU 30 4.987 2.875 -18.144 122 HD13 LEU 30 HD13 LEU 30 6.467 2.431 -17.262 123 HD21 LEU 30 HD21 LEU 30 4.758 4.909 -19.159 124 HD22 LEU 30 HD22 LEU 30 5.982 6.164 -18.851 125 HD23 LEU 30 HD23 LEU 30 6.067 5.182 -20.334 126 H ALA 31 H ALA 31 7.656 7.638 -17.567 127 HA ALA 31 HA ALA 31 10.208 8.733 -16.602 128 HB1 ALA 31 HB1 ALA 31 8.429 9.820 -18.547 129 HB2 ALA 31 HB2 ALA 31 8.253 10.797 -17.071 130 HB3 ALA 31 HB3 ALA 31 9.857 10.590 -17.814 131 H ARG 32 H ARG 32 10.254 9.211 -14.443 132 HA ARG 32 HA ARG 32 7.762 8.763 -13.047 133 HB2 ARG 32 HB2 ARG 32 10.681 8.814 -12.157 134 HB3 ARG 32 HB3 ARG 32 9.368 8.765 -10.997 135 HG2 ARG 32 HG2 ARG 32 9.344 6.753 -13.247 136 HG3 ARG 32 HG3 ARG 32 10.492 6.515 -11.944 137 HD2 ARG 32 HD2 ARG 32 8.329 5.332 -11.514 138 HD3 ARG 32 HD3 ARG 32 8.684 6.517 -10.273 139 HE ARG 32 HE ARG 32 6.610 6.766 -12.392 140 HH11 ARG 32 HH22 ARG 32 8.228 8.154 -9.593 141 HH12 ARG 32 HH21 ARG 32 6.994 9.336 -9.306 142 HH21 ARG 32 HH12 ARG 32 4.982 8.324 -12.015 143 HH22 ARG 32 HH11 ARG 32 5.136 9.433 -10.693 144 H CYS 33 H CYS 33 6.697 10.423 -11.951 145 HA CYS 33 HA CYS 33 7.842 13.061 -12.251 146 HB2 CYS 33 HB2 CYS 33 5.102 11.982 -11.683 147 HB3 CYS 33 HB3 CYS 33 5.482 13.612 -11.163 148 H ARG 34 H ARG 34 8.906 14.072 -10.575 149 HA ARG 34 HA ARG 34 9.178 12.684 -8.143 150 HB2 ARG 34 HB2 ARG 34 10.658 14.557 -7.506 151 HB3 ARG 34 HB3 ARG 34 11.002 14.069 -9.154 152 HG2 ARG 34 HG2 ARG 34 9.804 15.952 -10.075 153 HG3 ARG 34 HG3 ARG 34 9.047 16.321 -8.538 154 HD2 ARG 34 HD2 ARG 34 10.915 17.894 -9.017 155 HD3 ARG 34 HD3 ARG 34 11.233 16.962 -7.568 156 HE ARG 34 HE ARG 34 12.971 15.808 -8.686 157 HH11 ARG 34 HH22 ARG 34 11.151 17.792 -10.952 158 HH12 ARG 34 HH21 ARG 34 12.306 17.617 -12.231 159 HH21 ARG 34 HH12 ARG 34 14.495 15.577 -10.373 160 HH22 ARG 34 HH11 ARG 34 14.221 16.349 -11.899 161 H ILE 35 H ILE 35 6.642 14.479 -9.333 162 HA ILE 35 HA ILE 35 6.036 15.703 -6.738 163 HB ILE 35 HB ILE 35 5.073 16.279 -9.535 164 HG12 ILE 35 HG12 ILE 35 5.911 18.630 -8.370 165 HG13 ILE 35 HG13 ILE 35 7.035 17.469 -7.691 166 HG21 ILE 35 HG21 ILE 35 4.087 17.603 -6.998 167 HG22 ILE 35 HG22 ILE 35 3.537 17.887 -8.667 168 HG23 ILE 35 HG23 ILE 35 3.199 16.331 -7.872 169 HD11 ILE 35 HD11 ILE 35 7.023 16.624 -10.293 170 HD12 ILE 35 HD12 ILE 35 6.703 18.361 -10.519 171 HD13 ILE 35 HD13 ILE 35 8.167 17.830 -9.656 172 H HIS 36 H HIS 36 5.317 13.080 -8.900 173 HA HIS 36 HA HIS 36 3.383 12.106 -7.039 174 HB2 HIS 36 HB2 HIS 36 1.917 11.771 -9.361 175 HB3 HIS 36 HB3 HIS 36 1.559 12.877 -8.049 176 HD1 HIS 36 HD1 HIS 36 1.631 15.357 -8.561 177 HD2 HIS 36 HD2 HIS 36 3.399 13.024 -11.567 178 HE1 HIS 36 HE1 HIS 36 2.125 16.942 -10.499 179 H ASN 37 H ASN 37 3.315 9.853 -7.069 180 HA ASN 37 HA ASN 37 5.214 8.681 -8.905 181 HB2 ASN 37 HB2 ASN 37 5.731 7.882 -6.761 182 HB3 ASN 37 HB3 ASN 37 4.067 7.960 -6.215 183 HD21 ASN 37 HD21 ASN 37 6.436 6.152 -8.040 184 HD22 ASN 37 HD22 ASN 37 5.610 4.630 -8.081 185 H ASP 38 H ASP 38 1.847 9.197 -8.486 186 HA ASP 38 HA ASP 38 1.089 6.691 -9.684 187 HB2 ASP 38 HB2 ASP 38 -1.220 7.487 -9.342 188 HB3 ASP 38 HB3 ASP 38 -0.296 7.644 -7.861 189 HD2 ASP 38 HD2 ASP 38 -0.184 9.899 -7.044 190 H VAL 39 H VAL 39 2.592 9.262 -10.888 191 HA VAL 39 HA VAL 39 0.887 9.414 -13.276 192 HB VAL 39 HB VAL 39 2.077 11.529 -11.592 193 HG11 VAL 39 HG11 VAL 39 2.181 11.674 -14.622 194 HG12 VAL 39 HG12 VAL 39 2.342 13.075 -13.537 195 HG13 VAL 39 HG13 VAL 39 3.551 11.770 -13.490 196 HG21 VAL 39 HG21 VAL 39 -0.355 11.096 -13.288 197 HG22 VAL 39 HG22 VAL 39 -0.219 11.652 -11.603 198 HG23 VAL 39 HG23 VAL 39 0.159 12.764 -12.940 199 H ILE 40 H ILE 40 1.859 8.416 -14.955 200 HA ILE 40 HA ILE 40 4.797 8.418 -14.961 201 HB ILE 40 HB ILE 40 2.828 6.371 -15.978 202 HG12 ILE 40 HG12 ILE 40 5.042 5.812 -14.039 203 HG13 ILE 40 HG13 ILE 40 3.603 6.624 -13.455 204 HG21 ILE 40 HG21 ILE 40 5.689 5.711 -16.096 205 HG22 ILE 40 HG22 ILE 40 4.383 5.404 -17.265 206 HG23 ILE 40 HG23 ILE 40 5.186 6.992 -17.225 207 HD11 ILE 40 HD11 ILE 40 3.818 3.918 -13.606 208 HD12 ILE 40 HD12 ILE 40 2.262 4.771 -13.746 209 HD13 ILE 40 HD13 ILE 40 3.126 4.249 -15.213 210 H LEU 41 H LEU 41 5.882 9.007 -16.859 211 HA LEU 41 HA LEU 41 4.120 10.142 -18.919 212 HB2 LEU 41 HB2 LEU 41 6.909 11.115 -18.505 213 HB3 LEU 41 HB3 LEU 41 5.515 11.946 -19.166 214 HG LEU 41 HG LEU 41 5.709 11.210 -16.241 215 HD11 LEU 41 HD11 LEU 41 6.899 13.545 -17.704 216 HD12 LEU 41 HD12 LEU 41 6.297 13.744 -16.041 217 HD13 LEU 41 HD13 LEU 41 7.577 12.557 -16.388 218 HD21 LEU 41 HD21 LEU 41 4.047 12.986 -15.959 219 HD22 LEU 41 HD22 LEU 41 4.047 13.272 -17.716 220 HD23 LEU 41 HD23 LEU 41 3.468 11.719 -17.067 221 H ASP 42 H ASP 42 4.634 9.760 -21.109 222 HA ASP 42 HA ASP 42 6.156 7.367 -21.456 223 HB2 ASP 42 HB2 ASP 42 3.922 7.990 -22.613 224 HB3 ASP 42 HB3 ASP 42 4.856 9.085 -23.611 225 HD2 ASP 42 HD2 ASP 42 4.250 8.025 -25.274 226 H SER 43 H SER 43 8.369 7.487 -21.861 227 HA SER 43 HA SER 43 9.618 9.917 -22.371 228 HB2 SER 43 HB2 SER 43 10.550 7.028 -22.578 229 HB3 SER 43 HB3 SER 43 11.629 8.373 -22.892 230 HG SER 43 HG SER 43 11.827 7.755 -20.695 231 H GLY 44 H GLY 44 8.710 7.116 -24.467 232 HA2 GLY 44 HA2 GLY 44 7.991 7.449 -26.688 233 HA3 GLY 44 HA3 GLY 44 9.000 8.877 -26.808 234 H ASN 45 H ASN 45 10.340 6.050 -25.177 235 HA ASN 45 HA ASN 45 12.031 5.665 -27.515 236 HB2 ASN 45 HB2 ASN 45 12.480 5.486 -24.536 237 HB3 ASN 45 HB3 ASN 45 13.392 4.375 -25.537 238 HD21 ASN 45 HD21 ASN 45 12.580 7.772 -25.033 239 HD22 ASN 45 HD22 ASN 45 14.029 8.459 -25.687 240 H ASP 46 H ASP 46 12.955 3.225 -27.507 241 HA ASP 46 HA ASP 46 10.920 1.545 -28.050 242 HB2 ASP 46 HB2 ASP 46 13.663 0.789 -26.938 243 HB3 ASP 46 HB3 ASP 46 12.604 -0.296 -27.815 244 HD2 ASP 46 HD2 ASP 46 14.701 0.269 -30.225 245 H ALA 47 H ALA 47 9.303 0.832 -26.649 246 HA ALA 47 HA ALA 47 9.748 0.794 -23.825 247 HB1 ALA 47 HB1 ALA 47 7.480 0.321 -25.732 248 HB2 ALA 47 HB2 ALA 47 7.345 -0.345 -24.087 249 HB3 ALA 47 HB3 ALA 47 7.577 1.404 -24.322 250 H SER 48 H SER 48 10.132 -1.426 -26.500 251 HA SER 48 HA SER 48 9.606 -3.818 -25.327 252 HB2 SER 48 HB2 SER 48 10.149 -3.777 -27.649 253 HB3 SER 48 HB3 SER 48 11.670 -2.952 -27.374 254 HG SER 48 HG SER 48 12.493 -4.933 -27.480 255 H SER 49 H SER 49 12.410 -1.632 -24.929 256 HA SER 49 HA SER 49 14.145 -3.405 -23.753 257 HB2 SER 49 HB2 SER 49 14.560 -0.989 -24.517 258 HB3 SER 49 HB3 SER 49 13.855 -0.467 -23.001 259 HG SER 49 HG SER 49 15.511 -1.705 -21.873 260 H ALA 50 H ALA 50 11.612 -1.262 -22.290 261 HA ALA 50 HA ALA 50 12.151 -1.996 -19.634 262 HB1 ALA 50 HB1 ALA 50 9.501 -1.248 -19.677 263 HB2 ALA 50 HB2 ALA 50 10.876 -0.120 -19.601 264 HB3 ALA 50 HB3 ALA 50 10.117 -0.494 -21.167 265 H TYR 51 H TYR 51 10.012 -3.325 -22.202 266 HA TYR 51 HA TYR 51 8.569 -5.083 -20.603 267 HB2 TYR 51 HB2 TYR 51 9.494 -4.796 -23.486 268 HB3 TYR 51 HB3 TYR 51 8.780 -6.333 -23.042 269 HD1 TYR 51 HD1 TYR 51 6.437 -6.202 -21.834 270 HD2 TYR 51 HD2 TYR 51 8.113 -3.051 -24.193 271 HE1 TYR 51 HE1 TYR 51 4.119 -5.216 -22.178 272 HE2 TYR 51 HE2 TYR 51 5.790 -2.075 -24.528 273 HH TYR 51 HH TYR 51 3.521 -2.263 -22.989 274 H LYS 52 H LYS 52 11.683 -5.537 -22.402 275 HA LYS 52 HA LYS 52 11.968 -8.238 -21.775 276 HB2 LYS 52 HB2 LYS 52 13.236 -7.317 -23.559 277 HB3 LYS 52 HB3 LYS 52 13.923 -6.065 -22.543 278 HG2 LYS 52 HG2 LYS 52 15.132 -7.791 -21.209 279 HG3 LYS 52 HG3 LYS 52 14.421 -9.060 -22.187 280 HD2 LYS 52 HD2 LYS 52 15.481 -7.862 -24.234 281 HD3 LYS 52 HD3 LYS 52 16.396 -6.917 -23.076 282 HE2 LYS 52 HE2 LYS 52 17.273 -9.065 -22.069 283 HE3 LYS 52 HE3 LYS 52 16.418 -9.965 -23.306 284 HZ1 LYS 52 HZ1 LYS 52 18.870 -9.197 -23.626 285 HZ2 LYS 52 HZ2 LYS 52 17.841 -9.266 -24.893 286 HZ3 LYS 52 HZ3 LYS 52 18.168 -7.832 -24.183 287 H LEU 53 H LEU 53 13.204 -5.257 -20.127 288 HA LEU 53 HA LEU 53 14.485 -6.684 -18.071 289 HB2 LEU 53 HB2 LEU 53 14.914 -4.327 -18.835 290 HB3 LEU 53 HB3 LEU 53 13.448 -3.851 -18.002 291 HG LEU 53 HG LEU 53 15.813 -3.616 -16.870 292 HD11 LEU 53 HD11 LEU 53 14.671 -4.016 -14.615 293 HD12 LEU 53 HD12 LEU 53 13.925 -2.839 -15.722 294 HD13 LEU 53 HD13 LEU 53 13.234 -4.471 -15.562 295 HD21 LEU 53 HD21 LEU 53 15.082 -6.441 -16.056 296 HD22 LEU 53 HD22 LEU 53 16.399 -6.007 -17.172 297 HD23 LEU 53 HD23 LEU 53 16.458 -5.474 -15.475 298 H GLY 54 H GLY 54 11.140 -5.723 -18.681 299 HA2 GLY 54 HA2 GLY 54 10.209 -5.892 -16.008 300 HA3 GLY 54 HA3 GLY 54 9.252 -5.960 -17.474 301 H THR 55 H THR 55 10.150 -8.209 -18.814 302 HA THR 55 HA THR 55 8.917 -10.278 -17.353 303 HB THR 55 HB THR 55 9.594 -11.616 -19.354 304 HG1 THR 55 HG1 THR 55 11.623 -10.883 -19.949 305 HG21 THR 55 HG21 THR 55 9.161 -9.129 -20.838 306 HG22 THR 55 HG22 THR 55 8.071 -10.526 -20.666 307 HG23 THR 55 HG23 THR 55 8.051 -9.226 -19.450 308 H TYR 56 H TYR 56 12.308 -9.253 -17.731 309 HA TYR 56 HA TYR 56 13.458 -11.623 -16.761 310 HB2 TYR 56 HB2 TYR 56 14.617 -9.747 -17.984 311 HB3 TYR 56 HB3 TYR 56 14.225 -8.639 -16.685 312 HD1 TYR 56 HD1 TYR 56 16.050 -11.866 -17.263 313 HD2 TYR 56 HD2 TYR 56 15.825 -8.213 -15.047 314 HE1 TYR 56 HE1 TYR 56 18.254 -12.415 -16.121 315 HE2 TYR 56 HE2 TYR 56 18.030 -8.774 -13.913 316 HH TYR 56 HH TYR 56 20.131 -10.336 -14.737 317 H LEU 57 H LEU 57 12.632 -8.491 -15.113 318 HA LEU 57 HA LEU 57 13.458 -9.396 -12.581 319 HB2 LEU 57 HB2 LEU 57 12.993 -7.007 -13.595 320 HB3 LEU 57 HB3 LEU 57 11.390 -7.269 -12.937 321 HG LEU 57 HG LEU 57 12.735 -7.870 -10.735 322 HD11 LEU 57 HD11 LEU 57 14.685 -6.105 -10.686 323 HD12 LEU 57 HD12 LEU 57 14.959 -7.759 -11.285 324 HD13 LEU 57 HD13 LEU 57 14.727 -6.421 -12.437 325 HD21 LEU 57 HD21 LEU 57 12.287 -5.031 -11.699 326 HD22 LEU 57 HD22 LEU 57 11.078 -6.092 -10.938 327 HD23 LEU 57 HD23 LEU 57 12.492 -5.542 -10.006 328 H TYR 58 H TYR 58 10.221 -9.186 -14.195 329 HA TYR 58 HA TYR 58 8.784 -10.210 -12.023 330 HB2 TYR 58 HB2 TYR 58 8.516 -10.050 -15.071 331 HB3 TYR 58 HB3 TYR 58 7.262 -10.848 -14.144 332 HD1 TYR 58 HD2 TYR 58 6.998 -9.148 -11.761 333 HD2 TYR 58 HD1 TYR 58 7.609 -8.050 -15.851 334 HE1 TYR 58 HE2 TYR 58 5.894 -6.899 -11.330 335 HE2 TYR 58 HE1 TYR 58 6.503 -5.805 -15.406 336 HH TYR 58 HH TYR 58 6.127 -4.332 -13.498 337 H GLN 59 H GLN 59 10.763 -11.751 -14.531 338 HA GLN 59 HA GLN 59 10.346 -14.249 -13.173 339 HB2 GLN 59 HB2 GLN 59 8.682 -13.927 -15.210 340 HB3 GLN 59 HB3 GLN 59 10.092 -14.286 -16.186 341 HG2 GLN 59 HG2 GLN 59 9.174 -16.427 -15.848 342 HG3 GLN 59 HG3 GLN 59 10.402 -16.357 -14.600 343 HE21 GLN 59 HE21 GLN 59 7.512 -17.494 -15.093 344 HE22 GLN 59 HE22 GLN 59 6.720 -17.260 -13.570 345 H LYS 60 H LYS 60 12.334 -15.153 -12.852 346 HA LYS 60 HA LYS 60 14.586 -14.020 -14.204 347 HB2 LYS 60 HB2 LYS 60 14.174 -16.032 -12.007 348 HB3 LYS 60 HB3 LYS 60 15.740 -15.895 -12.780 349 HG2 LYS 60 HG2 LYS 60 14.322 -13.395 -11.812 350 HG3 LYS 60 HG3 LYS 60 15.181 -14.403 -10.664 351 HD2 LYS 60 HD2 LYS 60 16.589 -13.603 -13.218 352 HD3 LYS 60 HD3 LYS 60 16.420 -12.408 -11.947 353 HE2 LYS 60 HE2 LYS 60 18.543 -13.550 -11.613 354 HE3 LYS 60 HE3 LYS 60 17.465 -14.042 -10.322 355 HZ1 LYS 60 HZ1 LYS 60 18.712 -15.837 -11.524 356 HZ2 LYS 60 HZ2 LYS 60 17.107 -16.082 -11.343 357 HZ3 LYS 60 HZ3 LYS 60 17.703 -15.604 -12.787 358 H ASP 61 H ASP 61 12.423 -16.744 -14.645 359 HA ASP 61 HA ASP 61 13.888 -17.404 -17.015 360 HB2 ASP 61 HB2 ASP 61 13.138 -19.683 -15.159 361 HB3 ASP 61 HB3 ASP 61 14.234 -19.715 -16.525 362 HD2 ASP 61 HD2 ASP 61 16.677 -19.839 -15.173 363 H ASN 62 H ASN 62 12.362 -17.922 -18.625 364 HA ASN 62 HA ASN 62 9.677 -17.640 -18.071 365 HB2 ASN 62 HB2 ASN 62 9.332 -18.353 -20.416 366 HB3 ASN 62 HB3 ASN 62 10.730 -17.299 -20.326 367 HD21 ASN 62 HD21 ASN 62 9.832 -19.571 -22.120 368 HD22 ASN 62 HD22 ASN 62 11.200 -20.625 -22.248 369 H SER 63 H SER 63 8.240 -19.128 -17.174 370 HA SER 63 HA SER 63 8.308 -21.829 -17.928 371 HB2 SER 63 HB2 SER 63 9.426 -21.069 -15.215 372 HB3 SER 63 HB3 SER 63 8.604 -22.602 -15.426 373 HG SER 63 HG SER 63 10.195 -23.345 -16.753 374 H CYS 64 H CYS 64 6.575 -23.099 -16.559 375 HA CYS 64 HA CYS 64 4.502 -21.169 -15.810 376 HB2 CYS 64 HB2 CYS 64 2.874 -22.969 -16.465 377 HB3 CYS 64 HB3 CYS 64 3.791 -22.286 -17.793 378 HG CYS 64 HG CYS 64 3.864 -25.197 -16.340 379 H ASN 65 H ASN 65 6.833 -22.756 -14.362 380 HA ASN 65 HA ASN 65 5.319 -24.453 -12.631 381 HB2 ASN 65 HB2 ASN 65 7.493 -24.925 -11.572 382 HB3 ASN 65 HB3 ASN 65 7.690 -24.980 -13.312 383 HD21 ASN 65 HD21 ASN 65 9.205 -24.092 -10.668 384 HD22 ASN 65 HD22 ASN 65 10.090 -22.692 -11.176 385 H LEU 66 H LEU 66 5.380 -21.214 -12.947 386 HA LEU 66 HA LEU 66 5.391 -20.752 -10.048 387 HB2 LEU 66 HB2 LEU 66 7.319 -19.790 -11.592 388 HB3 LEU 66 HB3 LEU 66 6.117 -18.562 -11.936 389 HG LEU 66 HG LEU 66 7.443 -17.706 -10.188 390 HD11 LEU 66 HD11 LEU 66 5.222 -17.125 -9.737 391 HD12 LEU 66 HD12 LEU 66 4.804 -18.765 -9.186 392 HD13 LEU 66 HD13 LEU 66 5.846 -17.727 -8.183 393 HD21 LEU 66 HD21 LEU 66 7.986 -20.332 -9.550 394 HD22 LEU 66 HD22 LEU 66 8.526 -18.898 -8.643 395 HD23 LEU 66 HD23 LEU 66 7.052 -19.764 -8.145 396 H PHE 67 H PHE 67 3.364 -20.358 -9.359 397 HA PHE 67 HA PHE 67 1.146 -20.167 -10.813 398 HB2 PHE 67 HB2 PHE 67 2.112 -18.874 -8.227 399 HB3 PHE 67 HB3 PHE 67 0.501 -18.477 -8.790 400 HD1 PHE 67 HD2 PHE 67 -1.195 -20.304 -9.036 401 HD2 PHE 67 HD1 PHE 67 2.568 -20.959 -7.188 402 HE1 PHE 67 HE2 PHE 67 -2.083 -22.396 -7.970 403 HE2 PHE 67 HE1 PHE 67 1.681 -23.051 -6.123 404 HZ PHE 67 HZ PHE 67 -0.634 -23.745 -6.526 405 H ASN 68 H ASN 68 3.301 -17.388 -9.960 406 HA ASN 68 HA ASN 68 1.716 -15.399 -10.945 407 HB2 ASN 68 HB2 ASN 68 3.614 -14.039 -10.708 408 HB3 ASN 68 HB3 ASN 68 4.108 -15.413 -9.738 409 HD21 ASN 68 HD21 ASN 68 5.106 -13.320 -12.002 410 HD22 ASN 68 HD22 ASN 68 6.324 -14.236 -12.827 411 H THR 69 H THR 69 1.229 -14.688 -13.057 412 HA THR 69 HA THR 69 2.494 -16.194 -15.241 413 HB THR 69 HB THR 69 0.131 -16.539 -15.272 414 HG1 THR 69 HG1 THR 69 0.204 -14.081 -16.767 415 HG21 THR 69 HG21 THR 69 -0.754 -14.950 -13.690 416 HG22 THR 69 HG22 THR 69 -0.027 -13.575 -14.557 417 HG23 THR 69 HG23 THR 69 -1.412 -14.441 -15.264 418 H LEU 70 H LEU 70 3.245 -15.137 -17.127 419 HA LEU 70 HA LEU 70 4.502 -12.664 -16.542 420 HB2 LEU 70 HB2 LEU 70 5.174 -14.692 -18.076 421 HB3 LEU 70 HB3 LEU 70 4.294 -13.799 -19.300 422 HG LEU 70 HG LEU 70 6.614 -13.264 -19.497 423 HD11 LEU 70 HD11 LEU 70 5.313 -10.899 -18.126 424 HD12 LEU 70 HD12 LEU 70 6.580 -10.877 -19.377 425 HD13 LEU 70 HD13 LEU 70 4.937 -11.427 -19.784 426 HD21 LEU 70 HD21 LEU 70 6.662 -12.277 -16.640 427 HD22 LEU 70 HD22 LEU 70 7.168 -13.917 -17.115 428 HD23 LEU 70 HD23 LEU 70 8.027 -12.498 -17.761 429 H THR 71 H THR 71 1.507 -13.680 -18.163 430 HA THR 71 HA THR 71 0.977 -11.430 -19.672 431 HB THR 71 HB THR 71 -0.252 -13.804 -19.181 432 HG1 THR 71 HG1 THR 71 -1.124 -11.173 -20.063 433 HG21 THR 71 HG21 THR 71 -1.102 -12.569 -16.926 434 HG22 THR 71 HG22 THR 71 -2.282 -11.873 -18.063 435 HG23 THR 71 HG23 THR 71 -2.176 -13.639 -17.860 436 H GLU 72 H GLU 72 0.844 -11.880 -16.152 437 HA GLU 72 HA GLU 72 -0.721 -9.611 -15.676 438 HB2 GLU 72 HB2 GLU 72 -0.378 -11.478 -14.048 439 HB3 GLU 72 HB3 GLU 72 1.295 -10.997 -13.853 440 HG2 GLU 72 HG2 GLU 72 0.751 -9.035 -12.686 441 HG3 GLU 72 HG3 GLU 72 -0.825 -8.892 -13.440 442 HE2 GLU 72 HE2 GLU 72 -1.973 -10.106 -10.380 443 H ALA 73 H ALA 73 2.798 -10.196 -16.044 444 HA ALA 73 HA ALA 73 3.541 -7.590 -15.175 445 HB1 ALA 73 HB1 ALA 73 5.272 -9.096 -14.926 446 HB2 ALA 73 HB2 ALA 73 4.854 -9.989 -16.408 447 HB3 ALA 73 HB3 ALA 73 5.696 -8.424 -16.519 448 H ARG 74 H ARG 74 3.253 -9.231 -18.402 449 HA ARG 74 HA ARG 74 3.968 -7.024 -19.869 450 HB2 ARG 74 HB2 ARG 74 3.390 -8.321 -21.720 451 HB3 ARG 74 HB3 ARG 74 3.462 -9.582 -20.505 452 HG2 ARG 74 HG2 ARG 74 0.971 -9.278 -20.119 453 HG3 ARG 74 HG3 ARG 74 0.943 -8.129 -21.442 454 HD2 ARG 74 HD2 ARG 74 0.299 -10.543 -22.046 455 HD3 ARG 74 HD3 ARG 74 1.519 -9.805 -23.065 456 HE ARG 74 HE ARG 74 2.588 -11.303 -20.762 457 HH11 ARG 74 HH22 ARG 74 1.674 -11.413 -24.159 458 HH12 ARG 74 HH21 ARG 74 2.651 -12.800 -24.509 459 HH21 ARG 74 HH12 ARG 74 3.877 -13.133 -21.224 460 HH22 ARG 74 HH11 ARG 74 3.912 -13.785 -22.828 461 H ASP 75 H ASP 75 0.813 -8.083 -18.518 462 HA ASP 75 HA ASP 75 -0.664 -6.141 -19.932 463 HB2 ASP 75 HB2 ASP 75 -1.245 -7.870 -17.491 464 HB3 ASP 75 HB3 ASP 75 -2.429 -6.746 -18.127 465 HD2 ASP 75 HD2 ASP 75 -3.447 -9.610 -18.874 466 H ALA 76 H ALA 76 1.125 -6.364 -16.866 467 HA ALA 76 HA ALA 76 -0.091 -4.264 -15.482 468 HB1 ALA 76 HB1 ALA 76 2.448 -5.826 -15.366 469 HB2 ALA 76 HB2 ALA 76 2.446 -4.253 -14.534 470 HB3 ALA 76 HB3 ALA 76 1.249 -5.494 -14.093 471 H ILE 77 H ILE 77 2.839 -4.348 -17.626 472 HA ILE 77 HA ILE 77 3.193 -1.537 -17.461 473 HB ILE 77 HB ILE 77 4.845 -1.917 -19.251 474 HG12 ILE 77 HG12 ILE 77 3.420 -4.499 -19.450 475 HG13 ILE 77 HG13 ILE 77 4.274 -3.580 -20.673 476 HG21 ILE 77 HG21 ILE 77 5.463 -2.144 -16.896 477 HG22 ILE 77 HG22 ILE 77 5.009 -3.865 -16.934 478 HG23 ILE 77 HG23 ILE 77 6.373 -3.282 -17.918 479 HD11 ILE 77 HD11 ILE 77 6.455 -4.316 -19.740 480 HD12 ILE 77 HD12 ILE 77 5.602 -5.228 -18.471 481 HD13 ILE 77 HD13 ILE 77 5.441 -5.713 -20.176 482 H LYS 78 H LYS 78 1.439 -3.786 -19.610 483 HA LYS 78 HA LYS 78 0.962 -1.870 -21.634 484 HB2 LYS 78 HB2 LYS 78 0.896 -4.413 -21.812 485 HB3 LYS 78 HB3 LYS 78 -0.676 -4.344 -21.042 486 HG2 LYS 78 HG2 LYS 78 0.041 -2.793 -23.574 487 HG3 LYS 78 HG3 LYS 78 -0.752 -4.355 -23.581 488 HD2 LYS 78 HD2 LYS 78 -2.288 -2.855 -21.765 489 HD3 LYS 78 HD3 LYS 78 -1.878 -1.690 -23.009 490 HE2 LYS 78 HE2 LYS 78 -2.552 -3.899 -24.542 491 HE3 LYS 78 HE3 LYS 78 -3.628 -4.094 -23.172 492 HZ1 LYS 78 HZ1 LYS 78 -3.428 -1.435 -24.274 493 HZ2 LYS 78 HZ2 LYS 78 -4.189 -2.546 -25.199 494 HZ3 LYS 78 HZ3 LYS 78 -4.732 -2.227 -23.692 495 H ASP 79 H ASP 79 -0.488 -2.622 -18.500 496 HA ASP 79 HA ASP 79 -2.935 -1.349 -19.061 497 HB2 ASP 79 HB2 ASP 79 -2.924 -2.930 -17.268 498 HB3 ASP 79 HB3 ASP 79 -1.488 -2.233 -16.544 499 HD2 ASP 79 HD2 ASP 79 -4.360 -0.499 -17.499 500 H ALA 80 H ALA 80 0.073 -0.496 -17.193 501 HA ALA 80 HA ALA 80 -0.740 2.077 -16.470 502 HB1 ALA 80 HB1 ALA 80 1.058 1.435 -15.219 503 HB2 ALA 80 HB2 ALA 80 1.766 0.472 -16.538 504 HB3 ALA 80 HB3 ALA 80 1.975 2.240 -16.515 505 H TYR 81 H TYR 81 1.144 0.820 -19.292 506 HA TYR 81 HA TYR 81 1.696 3.316 -20.414 507 HB2 TYR 81 HB2 TYR 81 1.334 0.422 -21.346 508 HB3 TYR 81 HB3 TYR 81 1.679 1.661 -22.536 509 HD1 TYR 81 HD1 TYR 81 3.038 1.228 -19.070 510 HD2 TYR 81 HD2 TYR 81 3.860 1.256 -23.268 511 HE1 TYR 81 HE1 TYR 81 5.525 1.002 -18.592 512 HE2 TYR 81 HE2 TYR 81 6.343 1.029 -22.776 513 HH TYR 81 HH TYR 81 7.555 -0.037 -20.078 514 H GLU 82 H GLU 82 -1.100 1.067 -20.783 515 HA GLU 82 HA GLU 82 -2.253 2.597 -22.844 516 HB2 GLU 82 HB2 GLU 82 -2.862 0.294 -22.747 517 HB3 GLU 82 HB3 GLU 82 -3.243 0.370 -21.038 518 HG2 GLU 82 HG2 GLU 82 -5.208 1.797 -21.495 519 HG3 GLU 82 HG3 GLU 82 -4.797 1.874 -23.197 520 HE2 GLU 82 HE2 GLU 82 -7.220 0.213 -23.373 521 H SER 83 H SER 83 -2.170 2.809 -19.343 522 HA SER 83 HA SER 83 -4.575 4.299 -19.140 523 HB2 SER 83 HB2 SER 83 -3.837 2.996 -17.230 524 HB3 SER 83 HB3 SER 83 -2.270 3.781 -17.220 525 HG SER 83 HG SER 83 -3.764 4.620 -15.589 526 H TYR 84 H TYR 84 -1.022 5.009 -19.086 527 HA TYR 84 HA TYR 84 -1.618 7.864 -19.117 528 HB2 TYR 84 HB2 TYR 84 1.060 6.358 -19.164 529 HB3 TYR 84 HB3 TYR 84 0.794 7.993 -18.594 530 HD1 TYR 84 HD2 TYR 84 -1.103 8.078 -16.612 531 HD2 TYR 84 HD1 TYR 84 1.442 4.765 -17.532 532 HE1 TYR 84 HE2 TYR 84 -1.379 7.200 -14.242 533 HE2 TYR 84 HE1 TYR 84 1.158 3.897 -15.159 534 HH TYR 84 HH TYR 84 -0.142 4.059 -13.330 535 H CYS 85 H CYS 85 -1.628 5.511 -21.393 536 HA CYS 85 HA CYS 85 0.215 6.182 -23.289 537 HB2 CYS 85 HB2 CYS 85 -0.930 4.324 -23.932 538 HB3 CYS 85 HB3 CYS 85 -2.462 4.899 -23.305 539 HG CYS 85 HG CYS 85 -1.515 4.708 -26.190 540 H GLY 86 H GLY 86 0.308 7.761 -24.968 541 HA2 GLY 86 HA2 GLY 86 -0.443 9.538 -26.225 542 HA3 GLY 86 HA3 GLY 86 -1.869 9.678 -25.217 543 H ILE 87 H ILE 87 0.369 9.331 -22.883 544 HA ILE 87 HA ILE 87 0.868 12.220 -22.775 545 HB ILE 87 HB ILE 87 0.894 10.309 -20.451 546 HG12 ILE 87 HG12 ILE 87 -1.494 11.874 -21.474 547 HG13 ILE 87 HG13 ILE 87 -1.289 10.140 -21.623 548 HG21 ILE 87 HG21 ILE 87 1.285 12.101 -19.189 549 HG22 ILE 87 HG22 ILE 87 1.664 12.962 -20.700 550 HG23 ILE 87 HG23 ILE 87 0.026 13.056 -20.009 551 HD11 ILE 87 HD11 ILE 87 -2.416 11.526 -19.437 552 HD12 ILE 87 HD12 ILE 87 -1.988 9.799 -19.494 553 HD13 ILE 87 HD13 ILE 87 -0.821 10.985 -18.863 554 H ASP 88 H ASP 88 2.886 12.781 -23.373 555 HA ASP 88 HA ASP 88 4.990 10.895 -22.650 556 HB2 ASP 88 HB2 ASP 88 5.219 12.921 -24.899 557 HB3 ASP 88 HB3 ASP 88 6.180 11.478 -24.644 558 HD2 ASP 88 HD2 ASP 88 3.042 11.761 -26.813 559 H ASP 89 H ASP 89 3.529 13.795 -21.891 560 HA ASP 89 HA ASP 89 5.989 14.806 -20.777 561 HB2 ASP 89 HB2 ASP 89 4.057 16.512 -22.419 562 HB3 ASP 89 HB3 ASP 89 5.402 17.145 -21.492 563 HD2 ASP 89 HD2 ASP 89 4.688 16.735 -24.508 564 H CYS 90 H CYS 90 5.546 16.206 -18.877 565 HA CYS 90 HA CYS 90 2.816 15.838 -17.902 566 HB2 CYS 90 HB2 CYS 90 4.729 14.835 -16.591 567 HB3 CYS 90 HB3 CYS 90 5.295 16.462 -16.268 568 HA PRO 91 HA PRO 91 2.759 20.214 -18.650 569 HB2 PRO 91 HB2 PRO 91 0.041 20.498 -18.670 570 HB3 PRO 91 HB3 PRO 91 0.973 20.098 -20.099 571 HG2 PRO 91 HG2 PRO 91 -0.737 18.339 -18.449 572 HG3 PRO 91 HG3 PRO 91 -0.152 18.085 -20.082 573 HD2 PRO 91 HD2 PRO 91 0.850 16.860 -17.689 574 HD3 PRO 91 HD3 PRO 91 1.508 16.696 -19.305 575 H GLN 92 H GLN 92 1.346 18.422 -16.082 576 HA GLN 92 HA GLN 92 0.651 20.701 -14.581 577 HB2 GLN 92 HB2 GLN 92 -0.350 18.400 -14.306 578 HB3 GLN 92 HB3 GLN 92 1.165 17.854 -13.617 579 HG2 GLN 92 HG2 GLN 92 0.836 19.940 -11.987 580 HG3 GLN 92 HG3 GLN 92 -0.843 19.806 -12.470 581 HE21 GLN 92 HE21 GLN 92 -0.911 17.003 -12.885 582 HE22 GLN 92 HE22 GLN 92 -0.827 16.204 -11.350 583 H CYS 93 H CYS 93 3.510 18.524 -14.766 584 HA CYS 93 HA CYS 93 4.817 19.489 -12.516 585 HB2 CYS 93 HB2 CYS 93 5.550 17.912 -14.916 586 HB3 CYS 93 HB3 CYS 93 6.878 18.762 -14.153 587 H SER 94 H SER 94 4.502 20.659 -15.883 588 HA SER 94 HA SER 94 6.506 22.659 -15.475 589 HB2 SER 94 HB2 SER 94 6.452 21.860 -17.695 590 HB3 SER 94 HB3 SER 94 4.701 21.840 -17.757 591 HG SER 94 HG SER 94 6.493 23.939 -18.276 592 H LYS 95 H LYS 95 3.009 22.263 -15.197 593 HA LYS 95 HA LYS 95 2.376 25.027 -15.372 594 HB2 LYS 95 HB2 LYS 95 0.775 23.221 -15.890 595 HB3 LYS 95 HB3 LYS 95 0.805 22.705 -14.216 596 HG2 LYS 95 HG2 LYS 95 -1.149 24.152 -14.613 597 HG3 LYS 95 HG3 LYS 95 -0.047 24.931 -13.494 598 HD2 LYS 95 HD2 LYS 95 0.734 26.474 -15.132 599 HD3 LYS 95 HD3 LYS 95 0.179 25.486 -16.469 600 HE2 LYS 95 HE2 LYS 95 -2.192 25.943 -15.840 601 HE3 LYS 95 HE3 LYS 95 -1.655 26.902 -14.475 602 HZ1 LYS 95 HZ1 LYS 95 -1.852 27.649 -17.172 603 HZ2 LYS 95 HZ2 LYS 95 -1.583 28.590 -15.864 604 HZ3 LYS 95 HZ3 LYS 95 -0.326 27.897 -16.643 605 H TYR 96 H TYR 96 3.507 22.816 -12.845 606 HA TYR 96 HA TYR 96 2.817 24.635 -10.723 607 HB2 TYR 96 HB2 TYR 96 4.274 21.988 -11.168 608 HB3 TYR 96 HB3 TYR 96 4.500 22.804 -9.634 609 HD1 TYR 96 HD2 TYR 96 1.254 23.285 -11.170 610 HD2 TYR 96 HD1 TYR 96 3.524 20.707 -8.619 611 HE1 TYR 96 HE2 TYR 96 -0.895 22.244 -10.298 612 HE2 TYR 96 HE1 TYR 96 1.367 19.675 -7.755 613 HH TYR 96 HH TYR 96 -1.303 20.856 -7.715 614 H ILE 97 H ILE 97 3.929 26.525 -10.527 615 HA ILE 97 HA ILE 97 6.668 26.645 -11.415 616 HB ILE 97 HB ILE 97 4.614 28.599 -10.461 617 HG12 ILE 97 HG12 ILE 97 6.354 28.449 -12.940 618 HG13 ILE 97 HG13 ILE 97 4.684 27.932 -12.833 619 HG21 ILE 97 HG21 ILE 97 7.587 29.139 -10.671 620 HG22 ILE 97 HG22 ILE 97 6.328 30.394 -10.585 621 HG23 ILE 97 HG23 ILE 97 6.563 29.274 -9.221 622 HD11 ILE 97 HD11 ILE 97 5.819 30.709 -12.861 623 HD12 ILE 97 HD12 ILE 97 4.332 30.082 -13.612 624 HD13 ILE 97 HD13 ILE 97 4.367 30.437 -11.868 625 H ASP 98 H ASP 98 8.456 27.325 -10.029 626 HA ASP 98 HA ASP 98 8.136 26.134 -7.420 627 HB2 ASP 98 HB2 ASP 98 10.051 25.513 -8.955 628 HB3 ASP 98 HB3 ASP 98 10.641 27.158 -8.839 629 HD2 ASP 98 HD2 ASP 98 10.214 24.621 -5.987 630 H ASP 99 H ASP 99 7.325 27.688 -5.962 631 HA ASP 99 HA ASP 99 8.003 30.418 -6.269 632 HB2 ASP 99 HB2 ASP 99 6.610 30.761 -4.297 633 HB3 ASP 99 HB3 ASP 99 5.817 29.601 -5.344 634 HD2 ASP 99 HD2 ASP 99 6.208 26.929 -3.293 Start of MODEL 17 1 H GLU 14 H GLU 14 -2.752 -2.654 -3.070 2 HA GLU 14 HA GLU 14 -0.505 -2.494 -1.267 3 HB2 GLU 14 HB2 GLU 14 -0.810 -4.494 -3.526 4 HB3 GLU 14 HB3 GLU 14 0.083 -4.672 -2.029 5 HG2 GLU 14 HG2 GLU 14 -1.810 -5.890 -1.466 6 HG3 GLU 14 HG3 GLU 14 -2.333 -4.308 -0.923 7 HE2 GLU 14 HE2 GLU 14 -4.803 -3.904 -2.751 8 H ASP 15 H ASP 15 -1.139 -2.571 -4.848 9 HA ASP 15 HA ASP 15 -0.053 -1.754 -6.536 10 HB2 ASP 15 HB2 ASP 15 0.842 0.190 -4.381 11 HB3 ASP 15 HB3 ASP 15 1.465 0.343 -6.012 12 HD2 ASP 15 HD2 ASP 15 -0.789 2.058 -4.438 13 H GLN 16 H GLN 16 1.143 -4.006 -5.260 14 HA GLN 16 HA GLN 16 3.822 -3.602 -4.624 15 HB2 GLN 16 HB2 GLN 16 3.928 -5.922 -4.388 16 HB3 GLN 16 HB3 GLN 16 2.209 -5.640 -4.197 17 HG2 GLN 16 HG2 GLN 16 2.244 -7.400 -5.759 18 HG3 GLN 16 HG3 GLN 16 2.076 -5.997 -6.796 19 HE21 GLN 16 HE21 GLN 16 2.932 -7.768 -8.257 20 HE22 GLN 16 HE22 GLN 16 4.647 -7.844 -8.494 21 H GLU 17 H GLU 17 2.081 -4.123 -7.690 22 HA GLU 17 HA GLU 17 4.284 -4.857 -9.210 23 HB2 GLU 17 HB2 GLU 17 2.867 -4.218 -11.152 24 HB3 GLU 17 HB3 GLU 17 1.983 -5.184 -9.988 25 HG2 GLU 17 HG2 GLU 17 0.946 -3.149 -9.030 26 HG3 GLU 17 HG3 GLU 17 1.897 -2.132 -10.094 27 HE2 GLU 17 HE2 GLU 17 -0.467 -1.727 -10.308 28 H GLN 18 H GLN 18 3.049 -1.712 -8.087 29 HA GLN 18 HA GLN 18 4.316 -0.078 -9.884 30 HB2 GLN 18 HB2 GLN 18 3.629 0.311 -6.944 31 HB3 GLN 18 HB3 GLN 18 4.268 1.607 -7.936 32 HG2 GLN 18 HG2 GLN 18 1.821 0.011 -8.794 33 HG3 GLN 18 HG3 GLN 18 1.680 1.401 -7.736 34 HE21 GLN 18 HE21 GLN 18 2.700 3.428 -8.468 35 HE22 GLN 18 HE22 GLN 18 2.637 3.841 -10.149 36 H TRP 19 H TRP 19 5.553 -1.754 -6.967 37 HA TRP 19 HA TRP 19 8.005 -0.365 -6.849 38 HB2 TRP 19 HB2 TRP 19 6.971 -1.630 -4.985 39 HB3 TRP 19 HB3 TRP 19 7.310 -3.126 -5.832 40 HD1 TRP 19 HD1 TRP 19 9.571 -0.063 -4.876 41 HE1 TRP 19 HE1 TRP 19 11.848 -0.898 -3.834 42 HE3 TRP 19 HE3 TRP 19 8.519 -5.025 -5.230 43 HZ2 TRP 19 HZ2 TRP 19 12.928 -3.483 -3.288 44 HZ3 TRP 19 HZ3 TRP 19 10.238 -6.638 -4.420 45 HH2 TRP 19 HH2 TRP 19 12.381 -5.937 -3.475 46 H ALA 20 H ALA 20 6.907 -3.481 -8.343 47 HA ALA 20 HA ALA 20 9.410 -4.210 -9.350 48 HB1 ALA 20 HB1 ALA 20 6.583 -5.009 -9.615 49 HB2 ALA 20 HB2 ALA 20 7.553 -5.311 -11.076 50 HB3 ALA 20 HB3 ALA 20 8.050 -6.012 -9.518 51 H MET 21 H MET 21 6.905 -1.942 -10.457 52 HA MET 21 HA MET 21 7.855 -1.781 -13.094 53 HB2 MET 21 HB2 MET 21 6.100 -0.056 -11.289 54 HB3 MET 21 HB3 MET 21 6.520 0.508 -12.894 55 HG2 MET 21 HG2 MET 21 5.488 -1.455 -13.934 56 HG3 MET 21 HG3 MET 21 5.250 -2.221 -12.376 57 HE1 MET 21 HE1 MET 21 3.022 1.474 -13.971 58 HE2 MET 21 HE2 MET 21 4.680 1.647 -13.346 59 HE3 MET 21 HE3 MET 21 4.364 0.608 -14.757 60 H GLN 22 H GLN 22 9.172 -0.727 -10.117 61 HA GLN 22 HA GLN 22 10.151 1.746 -10.647 62 HB2 GLN 22 HB2 GLN 22 10.348 0.548 -8.474 63 HB3 GLN 22 HB3 GLN 22 11.546 -0.528 -9.166 64 HG2 GLN 22 HG2 GLN 22 11.988 2.466 -9.306 65 HG3 GLN 22 HG3 GLN 22 12.310 1.621 -7.805 66 HE21 GLN 22 HE21 GLN 22 13.966 0.150 -7.652 67 HE22 GLN 22 HE22 GLN 22 15.220 -0.014 -8.835 68 H THR 23 H THR 23 12.232 -1.226 -10.902 69 HA THR 23 HA THR 23 14.148 0.006 -12.515 70 HB THR 23 HB THR 23 14.612 -2.007 -11.195 71 HG1 THR 23 HG1 THR 23 15.628 -1.690 -13.363 72 HG21 THR 23 HG21 THR 23 12.143 -2.940 -11.759 73 HG22 THR 23 HG22 THR 23 13.012 -3.713 -13.108 74 HG23 THR 23 HG23 THR 23 13.491 -4.054 -11.428 75 H LEU 24 H LEU 24 11.491 -2.276 -13.468 76 HA LEU 24 HA LEU 24 11.881 -2.447 -16.093 77 HB2 LEU 24 HB2 LEU 24 10.069 -3.588 -15.253 78 HB3 LEU 24 HB3 LEU 24 9.408 -2.183 -14.440 79 HG LEU 24 HG LEU 24 9.490 -2.131 -17.424 80 HD11 LEU 24 HD11 LEU 24 8.153 -4.227 -15.900 81 HD12 LEU 24 HD12 LEU 24 7.023 -3.274 -16.891 82 HD13 LEU 24 HD13 LEU 24 8.420 -4.071 -17.653 83 HD21 LEU 24 HD21 LEU 24 7.002 -1.366 -16.189 84 HD22 LEU 24 HD22 LEU 24 8.366 -0.566 -15.373 85 HD23 LEU 24 HD23 LEU 24 8.152 -0.387 -17.131 86 H MET 25 H MET 25 9.950 0.268 -14.626 87 HA MET 25 HA MET 25 10.019 1.693 -17.056 88 HB2 MET 25 HB2 MET 25 8.438 2.974 -15.959 89 HB3 MET 25 HB3 MET 25 8.526 1.753 -14.704 90 HG2 MET 25 HG2 MET 25 10.364 3.078 -13.585 91 HG3 MET 25 HG3 MET 25 10.188 4.317 -14.811 92 HE1 MET 25 HE1 MET 25 6.502 3.757 -14.813 93 HE2 MET 25 HE2 MET 25 6.577 5.493 -14.427 94 HE3 MET 25 HE3 MET 25 7.724 4.789 -15.592 95 H GLY 26 H GLY 26 12.164 1.402 -14.295 96 HA2 GLY 26 HA2 GLY 26 13.435 3.942 -14.513 97 HA3 GLY 26 HA3 GLY 26 14.014 2.527 -13.656 98 H SER 27 H SER 27 13.400 1.179 -16.560 99 HA SER 27 HA SER 27 16.075 1.040 -17.262 100 HB2 SER 27 HB2 SER 27 14.542 -0.735 -17.871 101 HB3 SER 27 HB3 SER 27 13.522 0.365 -18.777 102 HG SER 27 HG SER 27 16.288 -0.028 -19.490 103 H GLY 28 H GLY 28 13.832 3.575 -17.653 104 HA2 GLY 28 HA2 GLY 28 14.460 5.650 -18.525 105 HA3 GLY 28 HA3 GLY 28 15.575 4.868 -19.627 106 H VAL 29 H VAL 29 12.718 3.030 -19.553 107 HA VAL 29 HA VAL 29 12.025 3.872 -22.184 108 HB VAL 29 HB VAL 29 10.618 1.995 -20.275 109 HG11 VAL 29 HG11 VAL 29 9.304 2.833 -22.264 110 HG12 VAL 29 HG12 VAL 29 10.512 2.041 -23.305 111 HG13 VAL 29 HG13 VAL 29 9.525 1.069 -22.188 112 HG21 VAL 29 HG21 VAL 29 12.833 1.169 -20.506 113 HG22 VAL 29 HG22 VAL 29 11.836 0.223 -21.637 114 HG23 VAL 29 HG23 VAL 29 12.871 1.536 -22.247 115 H LEU 30 H LEU 30 10.553 4.153 -18.892 116 HA LEU 30 HA LEU 30 8.550 5.943 -20.040 117 HB2 LEU 30 HB2 LEU 30 8.718 4.636 -17.321 118 HB3 LEU 30 HB3 LEU 30 7.420 5.677 -17.871 119 HG LEU 30 HG LEU 30 8.161 3.010 -19.107 120 HD11 LEU 30 HD11 LEU 30 6.530 3.696 -16.801 121 HD12 LEU 30 HD12 LEU 30 5.590 2.845 -18.051 122 HD13 LEU 30 HD13 LEU 30 7.069 2.106 -17.393 123 HD21 LEU 30 HD21 LEU 30 7.089 3.836 -20.888 124 HD22 LEU 30 HD22 LEU 30 5.612 3.594 -19.925 125 HD23 LEU 30 HD23 LEU 30 6.394 5.192 -19.968 126 H ALA 31 H ALA 31 7.953 7.761 -18.233 127 HA ALA 31 HA ALA 31 10.513 8.971 -17.446 128 HB1 ALA 31 HB1 ALA 31 8.132 10.543 -18.467 129 HB2 ALA 31 HB2 ALA 31 9.826 11.066 -18.303 130 HB3 ALA 31 HB3 ALA 31 9.372 9.903 -19.572 131 H ARG 32 H ARG 32 10.584 9.775 -15.371 132 HA ARG 32 HA ARG 32 8.031 9.735 -13.969 133 HB2 ARG 32 HB2 ARG 32 9.123 7.985 -12.882 134 HB3 ARG 32 HB3 ARG 32 10.719 8.608 -13.247 135 HG2 ARG 32 HG2 ARG 32 8.995 10.219 -11.373 136 HG3 ARG 32 HG3 ARG 32 9.671 8.722 -10.762 137 HD2 ARG 32 HD2 ARG 32 11.565 10.513 -12.251 138 HD3 ARG 32 HD3 ARG 32 11.011 11.100 -10.696 139 HE ARG 32 HE ARG 32 11.751 8.383 -10.334 140 HH11 ARG 32 HH22 ARG 32 13.286 11.439 -11.164 141 HH12 ARG 32 HH21 ARG 32 14.823 10.994 -10.499 142 HH21 ARG 32 HH12 ARG 32 13.778 7.796 -9.457 143 HH22 ARG 32 HH11 ARG 32 15.104 8.907 -9.523 144 H CYS 33 H CYS 33 7.582 11.526 -12.605 145 HA CYS 33 HA CYS 33 9.210 13.827 -13.096 146 HB2 CYS 33 HB2 CYS 33 6.576 13.600 -12.856 147 HB3 CYS 33 HB3 CYS 33 6.922 13.852 -11.156 148 H ARG 34 H ARG 34 10.566 14.869 -11.580 149 HA ARG 34 HA ARG 34 11.614 13.247 -9.585 150 HB2 ARG 34 HB2 ARG 34 13.041 15.161 -9.056 151 HB3 ARG 34 HB3 ARG 34 12.842 15.097 -10.796 152 HG2 ARG 34 HG2 ARG 34 10.806 16.727 -10.384 153 HG3 ARG 34 HG3 ARG 34 11.550 17.006 -8.822 154 HD2 ARG 34 HD2 ARG 34 12.385 18.703 -10.357 155 HD3 ARG 34 HD3 ARG 34 13.708 17.611 -9.999 156 HE ARG 34 HE ARG 34 12.262 16.706 -12.336 157 HH11 ARG 34 HH22 ARG 34 14.595 19.115 -11.271 158 HH12 ARG 34 HH21 ARG 34 15.315 19.295 -12.836 159 HH21 ARG 34 HH12 ARG 34 13.211 16.944 -14.401 160 HH22 ARG 34 HH11 ARG 34 14.522 18.052 -14.628 161 H ILE 35 H ILE 35 8.734 15.061 -9.691 162 HA ILE 35 HA ILE 35 8.771 15.584 -6.813 163 HB ILE 35 HB ILE 35 6.847 16.522 -8.944 164 HG12 ILE 35 HG12 ILE 35 9.087 18.050 -7.587 165 HG13 ILE 35 HG13 ILE 35 9.167 17.398 -9.211 166 HG21 ILE 35 HG21 ILE 35 7.083 17.094 -5.989 167 HG22 ILE 35 HG22 ILE 35 6.239 18.186 -7.113 168 HG23 ILE 35 HG23 ILE 35 5.672 16.511 -6.905 169 HD11 ILE 35 HD11 ILE 35 7.626 19.741 -8.178 170 HD12 ILE 35 HD12 ILE 35 8.386 19.491 -9.768 171 HD13 ILE 35 HD13 ILE 35 6.809 18.748 -9.408 172 H HIS 36 H HIS 36 7.935 13.192 -9.053 173 HA HIS 36 HA HIS 36 6.261 11.940 -7.063 174 HB2 HIS 36 HB2 HIS 36 5.087 11.656 -9.735 175 HB3 HIS 36 HB3 HIS 36 4.316 11.903 -8.181 176 HD1 HIS 36 HD1 HIS 36 4.722 14.580 -7.261 177 HD2 HIS 36 HD2 HIS 36 4.755 13.798 -11.382 178 HE1 HIS 36 HE1 HIS 36 4.269 16.810 -8.416 179 H ASN 37 H ASN 37 7.278 10.032 -6.729 180 HA ASN 37 HA ASN 37 8.736 8.915 -8.960 181 HB2 ASN 37 HB2 ASN 37 9.679 9.208 -6.536 182 HB3 ASN 37 HB3 ASN 37 8.656 7.855 -6.096 183 HD21 ASN 37 HD21 ASN 37 9.097 5.808 -6.812 184 HD22 ASN 37 HD22 ASN 37 10.583 5.347 -7.572 185 H ASP 38 H ASP 38 5.680 8.750 -7.466 186 HA ASP 38 HA ASP 38 5.401 5.906 -7.919 187 HB2 ASP 38 HB2 ASP 38 3.272 7.811 -6.871 188 HB3 ASP 38 HB3 ASP 38 3.338 6.071 -6.672 189 HD2 ASP 38 HD2 ASP 38 6.231 6.735 -4.444 190 H VAL 39 H VAL 39 5.204 8.788 -9.623 191 HA VAL 39 HA VAL 39 2.777 8.086 -11.080 192 HB VAL 39 HB VAL 39 3.571 10.445 -10.169 193 HG11 VAL 39 HG11 VAL 39 4.616 11.790 -11.954 194 HG12 VAL 39 HG12 VAL 39 5.691 10.491 -11.384 195 HG13 VAL 39 HG13 VAL 39 4.828 10.318 -12.931 196 HG21 VAL 39 HG21 VAL 39 1.720 9.511 -12.106 197 HG22 VAL 39 HG22 VAL 39 1.663 11.022 -11.167 198 HG23 VAL 39 HG23 VAL 39 2.455 10.994 -12.761 199 H ILE 40 H ILE 40 2.781 7.607 -13.318 200 HA ILE 40 HA ILE 40 5.452 7.134 -14.439 201 HB ILE 40 HB ILE 40 4.755 5.000 -13.829 202 HG12 ILE 40 HG12 ILE 40 5.390 5.445 -16.316 203 HG13 ILE 40 HG13 ILE 40 4.794 3.869 -15.834 204 HG21 ILE 40 HG21 ILE 40 2.616 4.850 -13.166 205 HG22 ILE 40 HG22 ILE 40 2.049 6.037 -14.365 206 HG23 ILE 40 HG23 ILE 40 2.313 4.344 -14.846 207 HD11 ILE 40 HD11 ILE 40 2.916 4.067 -17.106 208 HD12 ILE 40 HD12 ILE 40 2.610 5.726 -16.538 209 HD13 ILE 40 HD13 ILE 40 3.743 5.439 -17.881 210 H LEU 41 H LEU 41 5.786 8.199 -16.315 211 HA LEU 41 HA LEU 41 3.380 9.093 -17.746 212 HB2 LEU 41 HB2 LEU 41 6.093 10.417 -17.624 213 HB3 LEU 41 HB3 LEU 41 4.690 11.000 -18.498 214 HG LEU 41 HG LEU 41 3.760 10.719 -15.886 215 HD11 LEU 41 HD11 LEU 41 5.992 10.376 -15.019 216 HD12 LEU 41 HD12 LEU 41 6.573 11.844 -15.841 217 HD13 LEU 41 HD13 LEU 41 5.390 11.974 -14.518 218 HD21 LEU 41 HD21 LEU 41 4.649 13.053 -17.564 219 HD22 LEU 41 HD22 LEU 41 3.003 12.518 -17.148 220 HD23 LEU 41 HD23 LEU 41 4.027 13.290 -15.913 221 H ASP 42 H ASP 42 3.197 8.637 -19.924 222 HA ASP 42 HA ASP 42 4.952 6.614 -20.860 223 HB2 ASP 42 HB2 ASP 42 2.618 6.421 -21.434 224 HB3 ASP 42 HB3 ASP 42 2.547 8.072 -22.019 225 HD2 ASP 42 HD2 ASP 42 2.808 8.188 -24.355 226 H SER 43 H SER 43 6.942 7.193 -21.752 227 HA SER 43 HA SER 43 7.267 9.830 -22.798 228 HB2 SER 43 HB2 SER 43 8.965 8.367 -21.419 229 HB3 SER 43 HB3 SER 43 9.337 7.621 -22.960 230 HG SER 43 HG SER 43 9.370 10.241 -23.454 231 H GLY 44 H GLY 44 7.099 6.437 -23.980 232 HA2 GLY 44 HA2 GLY 44 6.173 5.951 -26.094 233 HA3 GLY 44 HA3 GLY 44 6.757 7.484 -26.710 234 H ASN 45 H ASN 45 8.902 5.638 -24.605 235 HA ASN 45 HA ASN 45 10.706 5.359 -26.802 236 HB2 ASN 45 HB2 ASN 45 10.821 5.024 -23.804 237 HB3 ASN 45 HB3 ASN 45 12.010 4.143 -24.743 238 HD21 ASN 45 HD21 ASN 45 13.842 5.143 -24.996 239 HD22 ASN 45 HD22 ASN 45 14.108 6.850 -25.124 240 H ASP 46 H ASP 46 12.056 3.040 -26.556 241 HA ASP 46 HA ASP 46 10.487 1.132 -27.618 242 HB2 ASP 46 HB2 ASP 46 13.057 0.998 -26.010 243 HB3 ASP 46 HB3 ASP 46 12.324 -0.481 -26.599 244 HD2 ASP 46 HD2 ASP 46 11.719 1.227 -29.326 245 H ALA 47 H ALA 47 8.504 0.699 -26.497 246 HA ALA 47 HA ALA 47 8.355 0.360 -23.713 247 HB1 ALA 47 HB1 ALA 47 6.107 0.081 -24.112 248 HB2 ALA 47 HB2 ALA 47 6.569 0.811 -25.668 249 HB3 ALA 47 HB3 ALA 47 6.376 -0.953 -25.536 250 H SER 48 H SER 48 9.400 -1.708 -26.344 251 HA SER 48 HA SER 48 8.804 -4.152 -25.143 252 HB2 SER 48 HB2 SER 48 9.303 -4.000 -27.525 253 HB3 SER 48 HB3 SER 48 10.898 -3.347 -27.205 254 HG SER 48 HG SER 48 10.104 -5.969 -27.337 255 H SER 49 H SER 49 11.455 -1.800 -24.806 256 HA SER 49 HA SER 49 13.281 -3.525 -23.609 257 HB2 SER 49 HB2 SER 49 13.139 -0.585 -22.917 258 HB3 SER 49 HB3 SER 49 14.556 -1.587 -23.161 259 HG SER 49 HG SER 49 14.287 -0.236 -24.987 260 H ALA 50 H ALA 50 10.714 -1.338 -22.309 261 HA ALA 50 HA ALA 50 11.339 -1.782 -19.599 262 HB1 ALA 50 HB1 ALA 50 8.770 -1.031 -19.499 263 HB2 ALA 50 HB2 ALA 50 10.069 0.118 -19.903 264 HB3 ALA 50 HB3 ALA 50 9.090 -0.611 -21.199 265 H TYR 51 H TYR 51 8.883 -3.225 -21.848 266 HA TYR 51 HA TYR 51 7.658 -4.913 -20.068 267 HB2 TYR 51 HB2 TYR 51 8.532 -5.344 -22.994 268 HB3 TYR 51 HB3 TYR 51 7.239 -6.235 -22.216 269 HD1 TYR 51 HD1 TYR 51 6.538 -3.372 -20.719 270 HD2 TYR 51 HD2 TYR 51 6.755 -4.826 -24.737 271 HE1 TYR 51 HE1 TYR 51 4.873 -1.598 -21.459 272 HE2 TYR 51 HE2 TYR 51 5.090 -3.047 -25.463 273 HH TYR 51 HH TYR 51 3.293 -1.729 -24.407 274 H LYS 52 H LYS 52 10.647 -5.494 -22.034 275 HA LYS 52 HA LYS 52 10.991 -8.140 -21.219 276 HB2 LYS 52 HB2 LYS 52 12.735 -8.060 -22.617 277 HB3 LYS 52 HB3 LYS 52 12.181 -6.446 -23.016 278 HG2 LYS 52 HG2 LYS 52 13.659 -5.481 -21.260 279 HG3 LYS 52 HG3 LYS 52 14.184 -7.088 -20.799 280 HD2 LYS 52 HD2 LYS 52 14.468 -6.402 -23.704 281 HD3 LYS 52 HD3 LYS 52 15.517 -5.528 -22.605 282 HE2 LYS 52 HE2 LYS 52 16.136 -7.825 -21.584 283 HE3 LYS 52 HE3 LYS 52 15.312 -8.551 -22.950 284 HZ1 LYS 52 HZ1 LYS 52 17.059 -8.135 -24.197 285 HZ2 LYS 52 HZ2 LYS 52 17.051 -6.542 -23.838 286 HZ3 LYS 52 HZ3 LYS 52 17.872 -7.588 -22.891 287 H LEU 53 H LEU 53 12.254 -5.023 -19.885 288 HA LEU 53 HA LEU 53 13.761 -6.231 -17.854 289 HB2 LEU 53 HB2 LEU 53 13.868 -3.866 -18.818 290 HB3 LEU 53 HB3 LEU 53 12.531 -3.484 -17.751 291 HG LEU 53 HG LEU 53 14.791 -2.853 -16.888 292 HD11 LEU 53 HD11 LEU 53 14.191 -4.531 -14.705 293 HD12 LEU 53 HD12 LEU 53 13.679 -2.847 -14.970 294 HD13 LEU 53 HD13 LEU 53 12.643 -4.188 -15.513 295 HD21 LEU 53 HD21 LEU 53 15.353 -5.665 -16.101 296 HD22 LEU 53 HD22 LEU 53 15.683 -5.210 -17.790 297 HD23 LEU 53 HD23 LEU 53 16.464 -4.322 -16.460 298 H GLY 54 H GLY 54 10.318 -5.534 -18.241 299 HA2 GLY 54 HA2 GLY 54 9.583 -5.570 -15.517 300 HA3 GLY 54 HA3 GLY 54 8.547 -5.874 -16.897 301 H THR 55 H THR 55 9.416 -8.147 -18.087 302 HA THR 55 HA THR 55 8.541 -10.164 -16.370 303 HB THR 55 HB THR 55 8.333 -10.340 -18.795 304 HG1 THR 55 HG1 THR 55 9.752 -12.390 -18.976 305 HG21 THR 55 HG21 THR 55 10.433 -10.743 -20.174 306 HG22 THR 55 HG22 THR 55 10.290 -9.072 -19.577 307 HG23 THR 55 HG23 THR 55 11.393 -10.213 -18.771 308 H TYR 56 H TYR 56 11.861 -9.090 -17.249 309 HA TYR 56 HA TYR 56 13.185 -11.193 -15.967 310 HB2 TYR 56 HB2 TYR 56 14.160 -9.545 -17.601 311 HB3 TYR 56 HB3 TYR 56 13.822 -8.225 -16.500 312 HD1 TYR 56 HD1 TYR 56 15.828 -11.367 -16.796 313 HD2 TYR 56 HD2 TYR 56 15.444 -7.527 -14.948 314 HE1 TYR 56 HE1 TYR 56 18.140 -11.621 -15.770 315 HE2 TYR 56 HE2 TYR 56 17.757 -7.795 -13.928 316 HH TYR 56 HH TYR 56 19.287 -10.653 -13.660 317 H LEU 57 H LEU 57 12.054 -7.968 -14.801 318 HA LEU 57 HA LEU 57 13.237 -8.357 -12.228 319 HB2 LEU 57 HB2 LEU 57 13.147 -6.149 -12.698 320 HB3 LEU 57 HB3 LEU 57 11.670 -6.278 -13.632 321 HG LEU 57 HG LEU 57 11.495 -4.942 -11.518 322 HD11 LEU 57 HD11 LEU 57 9.455 -6.685 -10.769 323 HD12 LEU 57 HD12 LEU 57 9.353 -5.356 -11.949 324 HD13 LEU 57 HD13 LEU 57 9.708 -7.011 -12.500 325 HD21 LEU 57 HD21 LEU 57 12.618 -7.347 -10.390 326 HD22 LEU 57 HD22 LEU 57 12.363 -5.751 -9.644 327 HD23 LEU 57 HD23 LEU 57 11.061 -6.966 -9.616 328 H TYR 58 H TYR 58 10.245 -9.233 -13.846 329 HA TYR 58 HA TYR 58 8.778 -9.589 -11.401 330 HB2 TYR 58 HB2 TYR 58 8.503 -10.233 -14.388 331 HB3 TYR 58 HB3 TYR 58 7.311 -10.839 -13.255 332 HD1 TYR 58 HD2 TYR 58 7.104 -8.492 -11.391 333 HD2 TYR 58 HD1 TYR 58 7.287 -8.674 -15.661 334 HE1 TYR 58 HE2 TYR 58 5.843 -6.289 -11.547 335 HE2 TYR 58 HE1 TYR 58 6.026 -6.471 -15.803 336 HH TYR 58 HH TYR 58 4.491 -5.095 -13.069 337 H GLN 59 H GLN 59 10.876 -11.513 -13.528 338 HA GLN 59 HA GLN 59 10.917 -13.559 -11.566 339 HB2 GLN 59 HB2 GLN 59 8.846 -14.013 -13.092 340 HB3 GLN 59 HB3 GLN 59 10.014 -14.447 -14.325 341 HG2 GLN 59 HG2 GLN 59 9.314 -16.462 -13.097 342 HG3 GLN 59 HG3 GLN 59 11.012 -16.149 -12.799 343 HE21 GLN 59 HE21 GLN 59 7.750 -15.694 -11.524 344 HE22 GLN 59 HE22 GLN 59 8.161 -15.655 -9.841 345 H LYS 60 H LYS 60 12.675 -15.129 -11.978 346 HA LYS 60 HA LYS 60 14.563 -14.072 -13.964 347 HB2 LYS 60 HB2 LYS 60 15.604 -13.652 -11.949 348 HB3 LYS 60 HB3 LYS 60 14.904 -15.047 -11.155 349 HG2 LYS 60 HG2 LYS 60 16.338 -16.549 -12.586 350 HG3 LYS 60 HG3 LYS 60 17.071 -15.130 -13.308 351 HD2 LYS 60 HD2 LYS 60 18.144 -14.490 -11.282 352 HD3 LYS 60 HD3 LYS 60 17.063 -15.449 -10.291 353 HE2 LYS 60 HE2 LYS 60 18.097 -17.486 -11.690 354 HE3 LYS 60 HE3 LYS 60 19.411 -16.360 -11.964 355 HZ1 LYS 60 HZ1 LYS 60 20.098 -17.085 -9.998 356 HZ2 LYS 60 HZ2 LYS 60 18.974 -16.096 -9.346 357 HZ3 LYS 60 HZ3 LYS 60 18.644 -17.681 -9.556 358 H ASP 61 H ASP 61 13.000 -16.947 -12.520 359 HA ASP 61 HA ASP 61 14.497 -18.773 -14.036 360 HB2 ASP 61 HB2 ASP 61 12.928 -19.039 -11.883 361 HB3 ASP 61 HB3 ASP 61 11.685 -19.348 -13.079 362 HD2 ASP 61 HD2 ASP 61 13.978 -21.841 -11.567 363 H ASN 62 H ASN 62 12.944 -20.447 -15.453 364 HA ASN 62 HA ASN 62 12.234 -18.974 -17.699 365 HB2 ASN 62 HB2 ASN 62 11.307 -21.817 -17.062 366 HB3 ASN 62 HB3 ASN 62 11.574 -21.125 -18.650 367 HD21 ASN 62 HD21 ASN 62 12.734 -23.408 -16.967 368 HD22 ASN 62 HD22 ASN 62 14.451 -23.260 -17.141 369 H SER 63 H SER 63 9.920 -19.338 -18.777 370 HA SER 63 HA SER 63 8.011 -18.502 -16.801 371 HB2 SER 63 HB2 SER 63 6.732 -17.667 -18.603 372 HB3 SER 63 HB3 SER 63 8.386 -17.423 -19.128 373 HG SER 63 HG SER 63 8.180 -19.534 -20.279 374 H CYS 64 H CYS 64 5.583 -19.386 -17.473 375 HA CYS 64 HA CYS 64 4.185 -21.077 -17.441 376 HB2 CYS 64 HB2 CYS 64 6.173 -22.975 -18.666 377 HB3 CYS 64 HB3 CYS 64 4.437 -22.888 -18.892 378 HG CYS 64 HG CYS 64 4.720 -20.262 -19.836 379 H ASN 65 H ASN 65 5.900 -20.496 -15.179 380 HA ASN 65 HA ASN 65 6.674 -23.087 -14.188 381 HB2 ASN 65 HB2 ASN 65 7.386 -21.637 -12.146 382 HB3 ASN 65 HB3 ASN 65 8.264 -21.380 -13.640 383 HD21 ASN 65 HD21 ASN 65 7.601 -19.628 -15.037 384 HD22 ASN 65 HD22 ASN 65 6.935 -18.177 -14.365 385 H LEU 66 H LEU 66 4.448 -20.311 -13.487 386 HA LEU 66 HA LEU 66 2.903 -22.124 -11.767 387 HB2 LEU 66 HB2 LEU 66 3.826 -19.331 -11.345 388 HB3 LEU 66 HB3 LEU 66 2.204 -19.725 -10.810 389 HG LEU 66 HG LEU 66 3.046 -21.473 -9.350 390 HD11 LEU 66 HD11 LEU 66 5.654 -20.909 -10.727 391 HD12 LEU 66 HD12 LEU 66 5.636 -21.537 -9.061 392 HD13 LEU 66 HD13 LEU 66 4.865 -22.465 -10.371 393 HD21 LEU 66 HD21 LEU 66 3.145 -18.880 -8.820 394 HD22 LEU 66 HD22 LEU 66 3.756 -20.096 -7.674 395 HD23 LEU 66 HD23 LEU 66 4.891 -19.211 -8.721 396 H PHE 67 H PHE 67 0.536 -21.008 -11.518 397 HA PHE 67 HA PHE 67 -0.629 -21.299 -14.026 398 HB2 PHE 67 HB2 PHE 67 -1.387 -20.214 -11.280 399 HB3 PHE 67 HB3 PHE 67 -2.536 -20.018 -12.589 400 HD1 PHE 67 HD2 PHE 67 -0.297 -22.929 -12.123 401 HD2 PHE 67 HD1 PHE 67 -4.256 -21.434 -11.812 402 HE1 PHE 67 HE2 PHE 67 -1.145 -25.258 -11.726 403 HE2 PHE 67 HE1 PHE 67 -5.104 -23.763 -11.416 404 HZ PHE 67 HZ PHE 67 -3.538 -25.647 -11.377 405 H ASN 68 H ASN 68 1.040 -18.608 -12.633 406 HA ASN 68 HA ASN 68 -0.477 -16.637 -14.017 407 HB2 ASN 68 HB2 ASN 68 2.302 -16.382 -12.756 408 HB3 ASN 68 HB3 ASN 68 1.213 -15.063 -13.137 409 HD21 ASN 68 HD21 ASN 68 2.286 -17.161 -10.788 410 HD22 ASN 68 HD22 ASN 68 1.037 -16.980 -9.601 411 H THR 69 H THR 69 0.005 -15.816 -16.091 412 HA THR 69 HA THR 69 2.329 -17.008 -17.432 413 HB THR 69 HB THR 69 0.008 -15.572 -18.772 414 HG1 THR 69 HG1 THR 69 0.230 -18.087 -17.355 415 HG21 THR 69 HG21 THR 69 1.465 -18.143 -19.540 416 HG22 THR 69 HG22 THR 69 0.450 -17.112 -20.576 417 HG23 THR 69 HG23 THR 69 2.052 -16.542 -20.052 418 H LEU 70 H LEU 70 3.754 -15.741 -18.703 419 HA LEU 70 HA LEU 70 4.511 -13.364 -17.501 420 HB2 LEU 70 HB2 LEU 70 5.690 -15.079 -19.139 421 HB3 LEU 70 HB3 LEU 70 5.194 -13.916 -20.352 422 HG LEU 70 HG LEU 70 7.539 -13.672 -19.421 423 HD11 LEU 70 HD11 LEU 70 6.462 -11.042 -18.852 424 HD12 LEU 70 HD12 LEU 70 7.453 -11.601 -20.220 425 HD13 LEU 70 HD13 LEU 70 5.682 -11.768 -20.277 426 HD21 LEU 70 HD21 LEU 70 6.556 -12.130 -17.108 427 HD22 LEU 70 HD22 LEU 70 6.367 -13.895 -16.975 428 HD23 LEU 70 HD23 LEU 70 7.975 -13.192 -17.272 429 H THR 71 H THR 71 2.103 -14.062 -19.989 430 HA THR 71 HA THR 71 1.921 -11.611 -21.243 431 HB THR 71 HB THR 71 -0.060 -13.816 -20.532 432 HG1 THR 71 HG1 THR 71 0.218 -13.733 -23.052 433 HG21 THR 71 HG21 THR 71 -1.298 -11.597 -20.844 434 HG22 THR 71 HG22 THR 71 -0.535 -11.477 -22.448 435 HG23 THR 71 HG23 THR 71 -1.655 -12.814 -22.093 436 H GLU 72 H GLU 72 0.871 -12.574 -17.983 437 HA GLU 72 HA GLU 72 -0.847 -10.454 -17.554 438 HB2 GLU 72 HB2 GLU 72 0.738 -12.323 -15.808 439 HB3 GLU 72 HB3 GLU 72 0.018 -10.917 -15.049 440 HG2 GLU 72 HG2 GLU 72 -2.217 -11.553 -15.902 441 HG3 GLU 72 HG3 GLU 72 -1.528 -12.902 -16.784 442 HE2 GLU 72 HE2 GLU 72 -2.303 -12.738 -12.972 443 H ALA 73 H ALA 73 2.692 -10.817 -16.841 444 HA ALA 73 HA ALA 73 3.028 -8.299 -15.702 445 HB1 ALA 73 HB1 ALA 73 4.905 -9.506 -15.307 446 HB2 ALA 73 HB2 ALA 73 4.687 -10.497 -16.769 447 HB3 ALA 73 HB3 ALA 73 5.450 -8.893 -16.886 448 H ARG 74 H ARG 74 3.523 -9.445 -19.114 449 HA ARG 74 HA ARG 74 4.363 -7.089 -20.147 450 HB2 ARG 74 HB2 ARG 74 2.887 -9.479 -21.230 451 HB3 ARG 74 HB3 ARG 74 2.936 -8.060 -22.257 452 HG2 ARG 74 HG2 ARG 74 5.411 -8.009 -22.127 453 HG3 ARG 74 HG3 ARG 74 5.404 -9.360 -21.010 454 HD2 ARG 74 HD2 ARG 74 5.854 -10.367 -23.121 455 HD3 ARG 74 HD3 ARG 74 4.151 -10.687 -22.859 456 HE ARG 74 HE ARG 74 4.431 -8.182 -24.238 457 HH11 ARG 74 HH22 ARG 74 4.771 -11.643 -24.776 458 HH12 ARG 74 HH21 ARG 74 4.438 -11.541 -26.473 459 HH21 ARG 74 HH12 ARG 74 3.992 -8.047 -26.477 460 HH22 ARG 74 HH11 ARG 74 3.993 -9.482 -27.447 461 H ASP 75 H ASP 75 1.062 -8.168 -19.297 462 HA ASP 75 HA ASP 75 -0.220 -6.075 -20.682 463 HB2 ASP 75 HB2 ASP 75 -1.405 -8.154 -20.140 464 HB3 ASP 75 HB3 ASP 75 -1.108 -7.929 -18.427 465 HD2 ASP 75 HD2 ASP 75 -4.488 -7.014 -18.949 466 H ALA 76 H ALA 76 1.226 -6.599 -17.471 467 HA ALA 76 HA ALA 76 -0.081 -4.522 -16.101 468 HB1 ALA 76 HB1 ALA 76 0.991 -5.632 -14.469 469 HB2 ALA 76 HB2 ALA 76 2.005 -6.481 -15.659 470 HB3 ALA 76 HB3 ALA 76 2.514 -4.898 -15.024 471 H ILE 77 H ILE 77 2.914 -4.703 -18.095 472 HA ILE 77 HA ILE 77 3.587 -1.978 -17.548 473 HB ILE 77 HB ILE 77 4.714 -3.497 -19.851 474 HG12 ILE 77 HG12 ILE 77 4.697 -5.313 -18.396 475 HG13 ILE 77 HG13 ILE 77 6.282 -4.609 -18.147 476 HG21 ILE 77 HG21 ILE 77 6.832 -2.517 -18.733 477 HG22 ILE 77 HG22 ILE 77 5.722 -1.421 -19.590 478 HG23 ILE 77 HG23 ILE 77 5.688 -1.510 -17.813 479 HD11 ILE 77 HD11 ILE 77 4.605 -3.233 -16.330 480 HD12 ILE 77 HD12 ILE 77 4.095 -4.936 -16.241 481 HD13 ILE 77 HD13 ILE 77 5.794 -4.499 -15.938 482 H LYS 78 H LYS 78 2.147 -3.828 -20.304 483 HA LYS 78 HA LYS 78 1.882 -1.593 -21.974 484 HB2 LYS 78 HB2 LYS 78 1.782 -3.604 -23.098 485 HB3 LYS 78 HB3 LYS 78 0.778 -4.373 -21.886 486 HG2 LYS 78 HG2 LYS 78 -1.155 -2.940 -22.577 487 HG3 LYS 78 HG3 LYS 78 -0.151 -2.170 -23.789 488 HD2 LYS 78 HD2 LYS 78 -1.215 -4.999 -23.728 489 HD3 LYS 78 HD3 LYS 78 -1.269 -3.833 -25.035 490 HE2 LYS 78 HE2 LYS 78 1.217 -5.303 -24.038 491 HE3 LYS 78 HE3 LYS 78 0.376 -5.602 -25.546 492 HZ1 LYS 78 HZ1 LYS 78 2.416 -4.003 -25.397 493 HZ2 LYS 78 HZ2 LYS 78 1.202 -3.730 -26.455 494 HZ3 LYS 78 HZ3 LYS 78 1.266 -2.896 -25.052 495 H ASP 79 H ASP 79 0.033 -2.798 -19.215 496 HA ASP 79 HA ASP 79 -2.314 -1.391 -19.859 497 HB2 ASP 79 HB2 ASP 79 -2.542 -3.217 -18.339 498 HB3 ASP 79 HB3 ASP 79 -1.188 -2.690 -17.360 499 HD2 ASP 79 HD2 ASP 79 -2.335 -2.490 -15.416 500 H ALA 80 H ALA 80 0.499 -0.880 -17.612 501 HA ALA 80 HA ALA 80 -0.377 1.534 -16.527 502 HB1 ALA 80 HB1 ALA 80 2.025 1.786 -15.899 503 HB2 ALA 80 HB2 ALA 80 1.386 0.166 -15.532 504 HB3 ALA 80 HB3 ALA 80 2.421 0.412 -16.959 505 H TYR 81 H TYR 81 1.625 0.764 -19.434 506 HA TYR 81 HA TYR 81 2.249 3.415 -20.072 507 HB2 TYR 81 HB2 TYR 81 1.973 0.706 -21.453 508 HB3 TYR 81 HB3 TYR 81 2.271 2.110 -22.458 509 HD1 TYR 81 HD1 TYR 81 3.637 1.066 -19.117 510 HD2 TYR 81 HD2 TYR 81 4.473 2.081 -23.188 511 HE1 TYR 81 HE1 TYR 81 6.131 0.871 -18.661 512 HE2 TYR 81 HE2 TYR 81 6.963 1.883 -22.718 513 HH TYR 81 HH TYR 81 8.122 1.013 -19.470 514 H GLU 82 H GLU 82 -0.489 1.266 -21.058 515 HA GLU 82 HA GLU 82 -1.550 3.240 -22.779 516 HB2 GLU 82 HB2 GLU 82 -1.856 0.682 -22.914 517 HB3 GLU 82 HB3 GLU 82 -3.030 0.845 -21.624 518 HG2 GLU 82 HG2 GLU 82 -3.221 2.494 -24.178 519 HG3 GLU 82 HG3 GLU 82 -3.924 0.894 -24.061 520 HE2 GLU 82 HE2 GLU 82 -4.896 4.220 -23.073 521 H SER 83 H SER 83 -1.710 2.545 -19.348 522 HA SER 83 HA SER 83 -4.192 3.887 -18.978 523 HB2 SER 83 HB2 SER 83 -3.872 3.438 -16.633 524 HB3 SER 83 HB3 SER 83 -3.324 2.019 -17.503 525 HG SER 83 HG SER 83 -1.203 3.699 -17.263 526 H TYR 84 H TYR 84 -0.708 4.640 -18.895 527 HA TYR 84 HA TYR 84 -1.361 7.369 -18.018 528 HB2 TYR 84 HB2 TYR 84 1.045 5.478 -17.941 529 HB3 TYR 84 HB3 TYR 84 1.324 7.204 -17.819 530 HD1 TYR 84 HD1 TYR 84 0.279 8.488 -15.894 531 HD2 TYR 84 HD2 TYR 84 0.302 4.213 -16.066 532 HE1 TYR 84 HE1 TYR 84 -0.179 8.378 -13.395 533 HE2 TYR 84 HE2 TYR 84 -0.156 4.117 -13.567 534 HH TYR 84 HH TYR 84 -0.163 7.050 -11.622 535 H CYS 85 H CYS 85 -1.152 5.692 -20.819 536 HA CYS 85 HA CYS 85 0.808 7.078 -22.258 537 HB2 CYS 85 HB2 CYS 85 0.240 5.220 -23.429 538 HB3 CYS 85 HB3 CYS 85 -1.422 5.230 -22.875 539 HG CYS 85 HG CYS 85 -2.382 6.156 -24.823 540 H GLY 86 H GLY 86 0.642 8.975 -23.556 541 HA2 GLY 86 HA2 GLY 86 -0.699 10.618 -24.647 542 HA3 GLY 86 HA3 GLY 86 -1.920 10.433 -23.404 543 H ILE 87 H ILE 87 0.504 10.199 -21.383 544 HA ILE 87 HA ILE 87 1.115 13.069 -21.321 545 HB ILE 87 HB ILE 87 0.666 13.210 -19.034 546 HG12 ILE 87 HG12 ILE 87 0.902 10.249 -19.084 547 HG13 ILE 87 HG13 ILE 87 1.478 11.409 -17.903 548 HG21 ILE 87 HG21 ILE 87 -1.677 12.715 -18.862 549 HG22 ILE 87 HG22 ILE 87 -1.321 13.209 -20.535 550 HG23 ILE 87 HG23 ILE 87 -1.563 11.488 -20.147 551 HD11 ILE 87 HD11 ILE 87 -0.305 10.169 -16.850 552 HD12 ILE 87 HD12 ILE 87 -0.958 11.783 -17.216 553 HD13 ILE 87 HD13 ILE 87 -1.376 10.398 -18.253 554 H ASP 88 H ASP 88 3.262 13.427 -21.410 555 HA ASP 88 HA ASP 88 4.950 11.221 -20.532 556 HB2 ASP 88 HB2 ASP 88 5.526 11.522 -22.775 557 HB3 ASP 88 HB3 ASP 88 5.129 13.228 -22.760 558 HD2 ASP 88 HD2 ASP 88 8.733 12.375 -22.943 559 H ASP 89 H ASP 89 3.845 14.435 -19.931 560 HA ASP 89 HA ASP 89 5.736 14.718 -17.823 561 HB2 ASP 89 HB2 ASP 89 6.404 17.052 -18.544 562 HB3 ASP 89 HB3 ASP 89 7.066 15.774 -19.544 563 HD2 ASP 89 HD2 ASP 89 7.178 17.900 -20.796 564 H CYS 90 H CYS 90 4.975 16.392 -16.272 565 HA CYS 90 HA CYS 90 2.164 16.692 -16.332 566 HB2 CYS 90 HB2 CYS 90 3.960 18.199 -14.440 567 HB3 CYS 90 HB3 CYS 90 2.353 17.558 -14.164 568 HA PRO 91 HA PRO 91 2.075 20.544 -18.377 569 HB2 PRO 91 HB2 PRO 91 -0.435 21.396 -17.712 570 HB3 PRO 91 HB3 PRO 91 -0.122 20.246 -18.996 571 HG2 PRO 91 HG2 PRO 91 -1.213 19.754 -16.293 572 HG3 PRO 91 HG3 PRO 91 -1.288 18.727 -17.711 573 HD2 PRO 91 HD2 PRO 91 0.445 18.405 -15.448 574 HD3 PRO 91 HD3 PRO 91 0.449 17.448 -16.915 575 H GLN 92 H GLN 92 1.414 20.395 -14.980 576 HA GLN 92 HA GLN 92 1.715 23.209 -14.695 577 HB2 GLN 92 HB2 GLN 92 0.368 21.497 -13.214 578 HB3 GLN 92 HB3 GLN 92 1.905 21.216 -12.421 579 HG2 GLN 92 HG2 GLN 92 2.089 23.745 -12.073 580 HG3 GLN 92 HG3 GLN 92 0.451 23.888 -12.680 581 HE21 GLN 92 HE21 GLN 92 -0.856 24.266 -11.065 582 HE22 GLN 92 HE22 GLN 92 -0.908 23.445 -9.541 583 H CYS 93 H CYS 93 3.681 20.258 -13.944 584 HA CYS 93 HA CYS 93 5.814 21.551 -12.777 585 HB2 CYS 93 HB2 CYS 93 5.784 19.002 -14.426 586 HB3 CYS 93 HB3 CYS 93 7.133 19.533 -13.441 587 H SER 94 H SER 94 4.826 21.130 -16.183 588 HA SER 94 HA SER 94 7.334 22.141 -17.129 589 HB2 SER 94 HB2 SER 94 4.811 21.071 -18.375 590 HB3 SER 94 HB3 SER 94 5.827 22.105 -19.359 591 HG SER 94 HG SER 94 6.160 19.526 -19.006 592 H LYS 95 H LYS 95 3.960 23.219 -16.589 593 HA LYS 95 HA LYS 95 4.266 25.678 -17.972 594 HB2 LYS 95 HB2 LYS 95 2.081 24.731 -17.753 595 HB3 LYS 95 HB3 LYS 95 2.219 24.625 -16.009 596 HG2 LYS 95 HG2 LYS 95 2.599 27.349 -17.215 597 HG3 LYS 95 HG3 LYS 95 0.976 26.690 -17.273 598 HD2 LYS 95 HD2 LYS 95 1.059 26.283 -14.800 599 HD3 LYS 95 HD3 LYS 95 2.676 26.956 -14.747 600 HE2 LYS 95 HE2 LYS 95 0.067 28.387 -15.363 601 HE3 LYS 95 HE3 LYS 95 1.239 28.762 -14.116 602 HZ1 LYS 95 HZ1 LYS 95 1.405 29.277 -16.974 603 HZ2 LYS 95 HZ2 LYS 95 1.714 30.283 -15.725 604 HZ3 LYS 95 HZ3 LYS 95 2.786 29.115 -16.118 605 H TYR 96 H TYR 96 5.550 24.457 -15.055 606 HA TYR 96 HA TYR 96 5.819 27.181 -13.979 607 HB2 TYR 96 HB2 TYR 96 4.717 25.125 -12.717 608 HB3 TYR 96 HB3 TYR 96 6.336 24.459 -12.649 609 HD1 TYR 96 HD1 TYR 96 5.162 27.987 -12.165 610 HD2 TYR 96 HD2 TYR 96 6.983 24.537 -10.409 611 HE1 TYR 96 HE1 TYR 96 5.620 29.302 -10.038 612 HE2 TYR 96 HE2 TYR 96 7.434 25.863 -8.287 613 HH TYR 96 HH TYR 96 7.233 27.752 -7.272 614 H ILE 97 H ILE 97 7.975 27.110 -12.429 615 HA ILE 97 HA ILE 97 10.101 27.189 -14.209 616 HB ILE 97 HB ILE 97 11.485 27.446 -12.197 617 HG12 ILE 97 HG12 ILE 97 8.949 26.958 -10.611 618 HG13 ILE 97 HG13 ILE 97 10.222 25.770 -10.812 619 HG21 ILE 97 HG21 ILE 97 9.165 29.047 -12.925 620 HG22 ILE 97 HG22 ILE 97 9.637 29.276 -11.224 621 HG23 ILE 97 HG23 ILE 97 10.825 29.546 -12.522 622 HD11 ILE 97 HD11 ILE 97 10.406 27.123 -8.683 623 HD12 ILE 97 HD12 ILE 97 11.853 27.212 -9.716 624 HD13 ILE 97 HD13 ILE 97 10.697 28.565 -9.685 625 H ASP 98 H ASP 98 11.410 25.663 -15.071 626 HA ASP 98 HA ASP 98 11.019 22.975 -14.096 627 HB2 ASP 98 HB2 ASP 98 10.973 23.739 -16.595 628 HB3 ASP 98 HB3 ASP 98 12.718 23.839 -16.470 629 HD2 ASP 98 HD2 ASP 98 11.303 22.178 -18.137 630 H ASP 99 H ASP 99 12.407 22.591 -12.329 631 HA ASP 99 HA ASP 99 14.765 23.906 -11.887 632 HB2 ASP 99 HB2 ASP 99 13.326 22.322 -10.365 633 HB3 ASP 99 HB3 ASP 99 14.290 21.024 -11.041 634 HD2 ASP 99 HD2 ASP 99 14.822 23.926 -8.893 Start of MODEL 18 1 H GLU 14 H GLU 14 -1.469 0.645 -1.815 2 HA GLU 14 HA GLU 14 0.334 1.399 -3.972 3 HB2 GLU 14 HB2 GLU 14 1.265 1.813 -1.590 4 HB3 GLU 14 HB3 GLU 14 1.304 0.070 -1.415 5 HG2 GLU 14 HG2 GLU 14 3.487 0.668 -2.195 6 HG3 GLU 14 HG3 GLU 14 2.672 -0.008 -3.592 7 HE2 GLU 14 HE2 GLU 14 4.734 2.282 -3.224 8 H ASP 15 H ASP 15 1.157 -0.364 -5.224 9 HA ASP 15 HA ASP 15 -0.153 -2.890 -4.584 10 HB2 ASP 15 HB2 ASP 15 -0.806 -1.537 -6.733 11 HB3 ASP 15 HB3 ASP 15 0.754 -2.034 -7.358 12 HD2 ASP 15 HD2 ASP 15 -2.432 -3.955 -7.701 13 H GLN 16 H GLN 16 1.150 -4.844 -4.984 14 HA GLN 16 HA GLN 16 3.906 -4.395 -4.567 15 HB2 GLN 16 HB2 GLN 16 2.126 -6.820 -4.832 16 HB3 GLN 16 HB3 GLN 16 3.864 -7.034 -4.907 17 HG2 GLN 16 HG2 GLN 16 3.916 -5.572 -2.718 18 HG3 GLN 16 HG3 GLN 16 2.204 -5.934 -2.613 19 HE21 GLN 16 HE21 GLN 16 1.598 -8.258 -2.850 20 HE22 GLN 16 HE22 GLN 16 2.587 -9.448 -2.073 21 H GLU 17 H GLU 17 1.819 -5.207 -7.337 22 HA GLU 17 HA GLU 17 3.927 -6.061 -8.988 23 HB2 GLU 17 HB2 GLU 17 1.112 -5.076 -9.617 24 HB3 GLU 17 HB3 GLU 17 2.197 -5.730 -10.827 25 HG2 GLU 17 HG2 GLU 17 1.059 -7.168 -8.394 26 HG3 GLU 17 HG3 GLU 17 0.773 -7.544 -10.081 27 HE2 GLU 17 HE2 GLU 17 3.165 -9.636 -10.409 28 H GLN 18 H GLN 18 2.120 -2.947 -8.595 29 HA GLN 18 HA GLN 18 3.432 -1.622 -10.639 30 HB2 GLN 18 HB2 GLN 18 2.257 0.245 -9.925 31 HB3 GLN 18 HB3 GLN 18 1.314 -1.012 -9.149 32 HG2 GLN 18 HG2 GLN 18 2.666 -0.710 -7.051 33 HG3 GLN 18 HG3 GLN 18 3.569 0.573 -7.830 34 HE21 GLN 18 HE21 GLN 18 2.779 1.808 -5.995 35 HE22 GLN 18 HE22 GLN 18 1.233 2.584 -6.075 36 H TRP 19 H TRP 19 4.344 -2.357 -7.288 37 HA TRP 19 HA TRP 19 6.365 -0.413 -7.038 38 HB2 TRP 19 HB2 TRP 19 5.282 -1.616 -5.165 39 HB3 TRP 19 HB3 TRP 19 6.093 -3.089 -5.658 40 HD1 TRP 19 HD1 TRP 19 7.495 0.523 -5.040 41 HE1 TRP 19 HE1 TRP 19 9.614 0.425 -3.471 42 HE3 TRP 19 HE3 TRP 19 7.423 -4.518 -4.378 43 HZ2 TRP 19 HZ2 TRP 19 10.992 -1.702 -2.158 44 HZ3 TRP 19 HZ3 TRP 19 9.190 -5.525 -2.938 45 HH2 TRP 19 HH2 TRP 19 10.933 -4.204 -1.847 46 H ALA 20 H ALA 20 6.175 -3.750 -8.361 47 HA ALA 20 HA ALA 20 8.931 -4.143 -8.660 48 HB1 ALA 20 HB1 ALA 20 6.409 -5.306 -9.830 49 HB2 ALA 20 HB2 ALA 20 7.985 -5.756 -10.525 50 HB3 ALA 20 HB3 ALA 20 7.645 -6.078 -8.808 51 H MET 21 H MET 21 6.530 -2.276 -10.469 52 HA MET 21 HA MET 21 7.806 -2.179 -12.903 53 HB2 MET 21 HB2 MET 21 5.544 -1.047 -11.682 54 HB3 MET 21 HB3 MET 21 6.536 0.363 -11.999 55 HG2 MET 21 HG2 MET 21 6.311 0.180 -14.290 56 HG3 MET 21 HG3 MET 21 6.386 -1.571 -14.266 57 HE1 MET 21 HE1 MET 21 3.822 1.389 -14.821 58 HE2 MET 21 HE2 MET 21 2.760 1.082 -13.426 59 HE3 MET 21 HE3 MET 21 4.480 1.459 -13.168 60 H GLN 22 H GLN 22 8.865 -0.991 -9.857 61 HA GLN 22 HA GLN 22 9.993 1.363 -10.225 62 HB2 GLN 22 HB2 GLN 22 10.258 0.128 -8.151 63 HB3 GLN 22 HB3 GLN 22 11.224 -1.106 -8.936 64 HG2 GLN 22 HG2 GLN 22 13.100 0.341 -9.194 65 HG3 GLN 22 HG3 GLN 22 12.133 1.789 -8.993 66 HE21 GLN 22 HE21 GLN 22 11.223 2.256 -6.912 67 HE22 GLN 22 HE22 GLN 22 12.013 1.737 -5.461 68 H THR 23 H THR 23 12.244 -1.437 -10.599 69 HA THR 23 HA THR 23 13.959 -0.037 -12.313 70 HB THR 23 HB THR 23 13.596 -3.053 -11.910 71 HG1 THR 23 HG1 THR 23 14.756 -0.803 -10.485 72 HG21 THR 23 HG21 THR 23 16.157 -1.463 -12.391 73 HG22 THR 23 HG22 THR 23 15.936 -3.228 -12.459 74 HG23 THR 23 HG23 THR 23 15.246 -2.195 -13.734 75 H LEU 24 H LEU 24 11.574 -2.664 -13.080 76 HA LEU 24 HA LEU 24 11.856 -2.977 -15.672 77 HB2 LEU 24 HB2 LEU 24 10.113 -4.093 -14.600 78 HB3 LEU 24 HB3 LEU 24 9.362 -2.610 -14.046 79 HG LEU 24 HG LEU 24 9.524 -3.251 -16.987 80 HD11 LEU 24 HD11 LEU 24 8.441 -5.097 -15.434 81 HD12 LEU 24 HD12 LEU 24 7.064 -3.969 -15.451 82 HD13 LEU 24 HD13 LEU 24 7.697 -4.624 -16.980 83 HD21 LEU 24 HD21 LEU 24 7.207 -1.948 -16.662 84 HD22 LEU 24 HD22 LEU 24 8.094 -1.295 -15.264 85 HD23 LEU 24 HD23 LEU 24 8.763 -1.117 -16.904 86 H MET 25 H MET 25 9.620 -0.345 -14.535 87 HA MET 25 HA MET 25 9.824 0.924 -17.048 88 HB2 MET 25 HB2 MET 25 8.155 2.369 -16.169 89 HB3 MET 25 HB3 MET 25 7.901 0.920 -15.218 90 HG2 MET 25 HG2 MET 25 8.000 2.488 -13.499 91 HG3 MET 25 HG3 MET 25 9.696 2.056 -13.585 92 HE1 MET 25 HE1 MET 25 7.159 3.976 -15.587 93 HE2 MET 25 HE2 MET 25 7.118 5.131 -14.233 94 HE3 MET 25 HE3 MET 25 7.828 5.612 -15.792 95 H GLY 26 H GLY 26 11.638 1.040 -14.053 96 HA2 GLY 26 HA2 GLY 26 12.611 3.689 -14.204 97 HA3 GLY 26 HA3 GLY 26 13.315 2.350 -13.320 98 H SER 27 H SER 27 13.079 1.004 -16.290 99 HA SER 27 HA SER 27 15.793 1.214 -16.795 100 HB2 SER 27 HB2 SER 27 15.283 -0.001 -18.887 101 HB3 SER 27 HB3 SER 27 14.420 -0.697 -17.530 102 HG SER 27 HG SER 27 12.497 0.391 -18.204 103 H GLY 28 H GLY 28 13.296 3.474 -17.289 104 HA2 GLY 28 HA2 GLY 28 13.735 5.635 -18.067 105 HA3 GLY 28 HA3 GLY 28 14.998 5.019 -19.114 106 H VAL 29 H VAL 29 12.143 3.037 -19.077 107 HA VAL 29 HA VAL 29 11.634 3.651 -21.810 108 HB VAL 29 HB VAL 29 10.578 1.776 -19.739 109 HG11 VAL 29 HG11 VAL 29 8.482 2.247 -20.581 110 HG12 VAL 29 HG12 VAL 29 9.104 2.684 -22.190 111 HG13 VAL 29 HG13 VAL 29 9.013 0.974 -21.706 112 HG21 VAL 29 HG21 VAL 29 11.020 0.603 -22.307 113 HG22 VAL 29 HG22 VAL 29 12.394 1.673 -21.940 114 HG23 VAL 29 HG23 VAL 29 11.947 0.378 -20.804 115 H LEU 30 H LEU 30 9.944 4.217 -18.662 116 HA LEU 30 HA LEU 30 8.018 5.883 -20.084 117 HB2 LEU 30 HB2 LEU 30 8.099 4.507 -17.432 118 HB3 LEU 30 HB3 LEU 30 7.085 5.924 -17.620 119 HG LEU 30 HG LEU 30 6.911 3.480 -19.401 120 HD11 LEU 30 HD11 LEU 30 6.338 2.754 -17.201 121 HD12 LEU 30 HD12 LEU 30 5.334 4.196 -16.919 122 HD13 LEU 30 HD13 LEU 30 4.824 2.974 -18.109 123 HD21 LEU 30 HD21 LEU 30 4.488 4.719 -19.520 124 HD22 LEU 30 HD22 LEU 30 5.586 6.112 -19.368 125 HD23 LEU 30 HD23 LEU 30 5.808 4.946 -20.694 126 H ALA 31 H ALA 31 7.346 7.892 -18.522 127 HA ALA 31 HA ALA 31 9.883 9.217 -17.845 128 HB1 ALA 31 HB1 ALA 31 8.202 11.265 -18.537 129 HB2 ALA 31 HB2 ALA 31 9.362 10.500 -19.650 130 HB3 ALA 31 HB3 ALA 31 7.658 9.986 -19.650 131 H ARG 32 H ARG 32 9.991 10.103 -15.820 132 HA ARG 32 HA ARG 32 7.451 10.280 -14.408 133 HB2 ARG 32 HB2 ARG 32 10.112 9.563 -13.092 134 HB3 ARG 32 HB3 ARG 32 8.516 9.463 -12.375 135 HG2 ARG 32 HG2 ARG 32 8.796 7.234 -12.963 136 HG3 ARG 32 HG3 ARG 32 8.040 7.817 -14.433 137 HD2 ARG 32 HD2 ARG 32 9.918 6.648 -15.261 138 HD3 ARG 32 HD3 ARG 32 10.486 8.306 -15.255 139 HE ARG 32 HE ARG 32 11.271 6.173 -13.335 140 HH11 ARG 32 HH22 ARG 32 11.553 9.521 -14.383 141 HH12 ARG 32 HH21 ARG 32 12.994 9.819 -13.470 142 HH21 ARG 32 HH12 ARG 32 13.172 6.566 -12.130 143 HH22 ARG 32 HH11 ARG 32 13.922 8.127 -12.180 144 H CYS 33 H CYS 33 7.212 12.108 -12.993 145 HA CYS 33 HA CYS 33 8.772 14.342 -13.714 146 HB2 CYS 33 HB2 CYS 33 6.345 14.410 -13.079 147 HB3 CYS 33 HB3 CYS 33 6.804 14.098 -11.417 148 H ARG 34 H ARG 34 10.451 15.374 -12.553 149 HA ARG 34 HA ARG 34 12.039 13.789 -10.994 150 HB2 ARG 34 HB2 ARG 34 13.355 15.808 -10.583 151 HB3 ARG 34 HB3 ARG 34 12.735 15.890 -12.220 152 HG2 ARG 34 HG2 ARG 34 10.914 17.392 -11.511 153 HG3 ARG 34 HG3 ARG 34 11.376 17.219 -9.830 154 HD2 ARG 34 HD2 ARG 34 13.742 18.097 -10.677 155 HD3 ARG 34 HD3 ARG 34 12.825 18.693 -12.047 156 HE ARG 34 HE ARG 34 11.900 20.344 -10.673 157 HH11 ARG 34 HH22 ARG 34 13.213 17.781 -8.651 158 HH12 ARG 34 HH21 ARG 34 12.944 18.637 -7.170 159 HH21 ARG 34 HH12 ARG 34 11.546 21.474 -8.719 160 HH22 ARG 34 HH11 ARG 34 11.990 20.752 -7.209 161 H ILE 35 H ILE 35 9.114 15.450 -10.189 162 HA ILE 35 HA ILE 35 9.798 15.459 -7.341 163 HB ILE 35 HB ILE 35 7.534 16.794 -8.829 164 HG12 ILE 35 HG12 ILE 35 9.019 18.804 -7.766 165 HG13 ILE 35 HG13 ILE 35 10.285 17.644 -8.116 166 HG21 ILE 35 HG21 ILE 35 7.214 18.005 -6.654 167 HG22 ILE 35 HG22 ILE 35 6.778 16.279 -6.627 168 HG23 ILE 35 HG23 ILE 35 8.312 16.821 -5.905 169 HD11 ILE 35 HD11 ILE 35 8.296 18.888 -10.047 170 HD12 ILE 35 HD12 ILE 35 10.074 18.911 -10.120 171 HD13 ILE 35 HD13 ILE 35 9.190 17.405 -10.463 172 H HIS 36 H HIS 36 8.123 13.730 -9.834 173 HA HIS 36 HA HIS 36 6.822 12.151 -7.743 174 HB2 HIS 36 HB2 HIS 36 5.511 12.354 -10.415 175 HB3 HIS 36 HB3 HIS 36 4.808 12.064 -8.836 176 HD1 HIS 36 HD1 HIS 36 5.081 14.370 -7.167 177 HD2 HIS 36 HD2 HIS 36 4.945 14.853 -11.332 178 HE1 HIS 36 HE1 HIS 36 4.417 16.798 -7.584 179 H ASN 37 H ASN 37 7.805 10.198 -7.681 180 HA ASN 37 HA ASN 37 9.077 9.288 -10.107 181 HB2 ASN 37 HB2 ASN 37 9.940 7.449 -8.472 182 HB3 ASN 37 HB3 ASN 37 10.527 9.080 -8.214 183 HD21 ASN 37 HD21 ASN 37 9.435 10.420 -6.636 184 HD22 ASN 37 HD22 ASN 37 8.730 9.706 -5.224 185 H ASP 38 H ASP 38 6.110 9.038 -8.455 186 HA ASP 38 HA ASP 38 5.715 6.267 -9.187 187 HB2 ASP 38 HB2 ASP 38 4.015 8.256 -7.614 188 HB3 ASP 38 HB3 ASP 38 3.483 6.629 -7.986 189 HD2 ASP 38 HD2 ASP 38 6.737 5.997 -6.121 190 H VAL 39 H VAL 39 5.761 9.030 -10.847 191 HA VAL 39 HA VAL 39 3.108 8.799 -12.050 192 HB VAL 39 HB VAL 39 5.239 10.897 -11.934 193 HG11 VAL 39 HG11 VAL 39 4.971 11.054 -14.220 194 HG12 VAL 39 HG12 VAL 39 3.294 10.458 -14.177 195 HG13 VAL 39 HG13 VAL 39 3.661 12.121 -13.659 196 HG21 VAL 39 HG21 VAL 39 3.365 10.832 -10.290 197 HG22 VAL 39 HG22 VAL 39 3.408 12.326 -11.257 198 HG23 VAL 39 HG23 VAL 39 2.222 11.054 -11.636 199 H ILE 40 H ILE 40 2.871 8.526 -14.357 200 HA ILE 40 HA ILE 40 5.286 7.455 -15.637 201 HB ILE 40 HB ILE 40 2.547 6.262 -15.409 202 HG12 ILE 40 HG12 ILE 40 5.345 5.120 -15.156 203 HG13 ILE 40 HG13 ILE 40 4.297 5.568 -13.825 204 HG21 ILE 40 HG21 ILE 40 4.462 5.998 -17.712 205 HG22 ILE 40 HG22 ILE 40 3.412 4.641 -17.237 206 HG23 ILE 40 HG23 ILE 40 2.693 6.195 -17.723 207 HD11 ILE 40 HD11 ILE 40 3.709 3.345 -13.934 208 HD12 ILE 40 HD12 ILE 40 2.589 3.938 -15.184 209 HD13 ILE 40 HD13 ILE 40 4.143 3.209 -15.655 210 H LEU 41 H LEU 41 5.763 8.377 -17.570 211 HA LEU 41 HA LEU 41 3.583 9.832 -18.893 212 HB2 LEU 41 HB2 LEU 41 6.310 10.759 -18.105 213 HB3 LEU 41 HB3 LEU 41 5.623 11.353 -19.603 214 HG LEU 41 HG LEU 41 3.695 12.262 -18.403 215 HD11 LEU 41 HD11 LEU 41 3.133 11.129 -16.542 216 HD12 LEU 41 HD12 LEU 41 4.814 10.675 -16.175 217 HD13 LEU 41 HD13 LEU 41 4.216 12.295 -15.744 218 HD21 LEU 41 HD21 LEU 41 5.037 13.903 -16.898 219 HD22 LEU 41 HD22 LEU 41 6.463 13.058 -17.546 220 HD23 LEU 41 HD23 LEU 41 5.334 13.876 -18.652 221 H ASP 42 H ASP 42 3.415 9.534 -21.099 222 HA ASP 42 HA ASP 42 4.885 7.341 -22.118 223 HB2 ASP 42 HB2 ASP 42 3.583 8.049 -24.281 224 HB3 ASP 42 HB3 ASP 42 2.676 7.422 -22.919 225 HD2 ASP 42 HD2 ASP 42 3.358 9.980 -24.818 226 H SER 43 H SER 43 6.931 7.581 -23.027 227 HA SER 43 HA SER 43 7.647 10.223 -23.968 228 HB2 SER 43 HB2 SER 43 9.107 8.957 -22.323 229 HB3 SER 43 HB3 SER 43 9.422 7.774 -23.577 230 HG SER 43 HG SER 43 10.556 9.280 -24.783 231 H GLY 44 H GLY 44 7.319 6.796 -24.996 232 HA2 GLY 44 HA2 GLY 44 6.683 6.171 -27.146 233 HA3 GLY 44 HA3 GLY 44 7.281 7.689 -27.785 234 H ASN 45 H ASN 45 9.179 5.778 -25.448 235 HA ASN 45 HA ASN 45 11.145 5.428 -27.541 236 HB2 ASN 45 HB2 ASN 45 12.614 4.750 -25.512 237 HB3 ASN 45 HB3 ASN 45 12.100 6.424 -25.573 238 HD21 ASN 45 HD21 ASN 45 11.984 6.952 -23.497 239 HD22 ASN 45 HD22 ASN 45 10.978 6.197 -22.305 240 H ASP 46 H ASP 46 12.490 3.225 -27.205 241 HA ASP 46 HA ASP 46 10.869 1.146 -27.811 242 HB2 ASP 46 HB2 ASP 46 13.194 0.942 -28.293 243 HB3 ASP 46 HB3 ASP 46 13.663 1.319 -26.647 244 HD2 ASP 46 HD2 ASP 46 12.733 -1.001 -28.773 245 H ALA 47 H ALA 47 9.183 0.479 -26.437 246 HA ALA 47 HA ALA 47 9.495 0.552 -23.596 247 HB1 ALA 47 HB1 ALA 47 7.327 1.037 -24.365 248 HB2 ALA 47 HB2 ALA 47 7.346 -0.292 -25.549 249 HB3 ALA 47 HB3 ALA 47 7.190 -0.650 -23.813 250 H SER 48 H SER 48 10.253 -1.671 -26.158 251 HA SER 48 HA SER 48 9.815 -4.076 -24.932 252 HB2 SER 48 HB2 SER 48 10.615 -3.544 -27.335 253 HB3 SER 48 HB3 SER 48 12.236 -3.471 -26.672 254 HG SER 48 HG SER 48 10.566 -5.759 -26.169 255 H SER 49 H SER 49 12.347 -1.626 -24.432 256 HA SER 49 HA SER 49 14.210 -3.224 -23.175 257 HB2 SER 49 HB2 SER 49 13.529 -0.271 -22.953 258 HB3 SER 49 HB3 SER 49 14.846 -0.970 -22.032 259 HG SER 49 HG SER 49 16.064 -0.920 -23.785 260 H ALA 50 H ALA 50 11.498 -1.220 -21.822 261 HA ALA 50 HA ALA 50 11.982 -1.931 -19.148 262 HB1 ALA 50 HB1 ALA 50 9.960 -0.493 -20.745 263 HB2 ALA 50 HB2 ALA 50 9.298 -1.295 -19.301 264 HB3 ALA 50 HB3 ALA 50 10.624 -0.119 -19.136 265 H TYR 51 H TYR 51 10.038 -3.369 -21.801 266 HA TYR 51 HA TYR 51 8.660 -5.213 -20.180 267 HB2 TYR 51 HB2 TYR 51 9.487 -4.871 -23.106 268 HB3 TYR 51 HB3 TYR 51 8.683 -6.353 -22.629 269 HD1 TYR 51 HD1 TYR 51 6.509 -5.769 -20.986 270 HD2 TYR 51 HD2 TYR 51 8.100 -3.320 -24.113 271 HE1 TYR 51 HE1 TYR 51 4.255 -4.622 -21.246 272 HE2 TYR 51 HE2 TYR 51 5.841 -2.182 -24.362 273 HH TYR 51 HH TYR 51 3.024 -3.391 -22.728 274 H LYS 52 H LYS 52 11.866 -5.220 -21.767 275 HA LYS 52 HA LYS 52 12.283 -8.001 -21.486 276 HB2 LYS 52 HB2 LYS 52 13.473 -6.049 -22.915 277 HB3 LYS 52 HB3 LYS 52 14.600 -6.134 -21.576 278 HG2 LYS 52 HG2 LYS 52 13.711 -8.760 -22.723 279 HG3 LYS 52 HG3 LYS 52 14.735 -7.777 -23.750 280 HD2 LYS 52 HD2 LYS 52 16.486 -8.670 -22.598 281 HD3 LYS 52 HD3 LYS 52 16.039 -7.576 -21.305 282 HE2 LYS 52 HE2 LYS 52 14.272 -9.646 -20.848 283 HE3 LYS 52 HE3 LYS 52 15.632 -10.525 -21.517 284 HZ1 LYS 52 HZ1 LYS 52 15.540 -8.888 -19.112 285 HZ2 LYS 52 HZ2 LYS 52 16.139 -10.395 -19.311 286 HZ3 LYS 52 HZ3 LYS 52 16.968 -9.106 -19.875 287 H LEU 53 H LEU 53 13.296 -5.108 -19.552 288 HA LEU 53 HA LEU 53 14.552 -6.710 -17.574 289 HB2 LEU 53 HB2 LEU 53 15.193 -4.399 -18.109 290 HB3 LEU 53 HB3 LEU 53 13.647 -3.828 -17.511 291 HG LEU 53 HG LEU 53 15.781 -3.698 -16.012 292 HD11 LEU 53 HD11 LEU 53 13.012 -4.516 -15.151 293 HD12 LEU 53 HD12 LEU 53 14.292 -4.166 -13.965 294 HD13 LEU 53 HD13 LEU 53 13.777 -2.909 -15.115 295 HD21 LEU 53 HD21 LEU 53 15.978 -5.672 -14.490 296 HD22 LEU 53 HD22 LEU 53 14.947 -6.582 -15.620 297 HD23 LEU 53 HD23 LEU 53 16.528 -5.967 -16.157 298 H GLY 54 H GLY 54 11.263 -5.602 -18.224 299 HA2 GLY 54 HA2 GLY 54 10.253 -5.896 -15.585 300 HA3 GLY 54 HA3 GLY 54 9.335 -5.820 -17.076 301 H THR 55 H THR 55 10.184 -8.012 -18.545 302 HA THR 55 HA THR 55 8.813 -10.117 -17.277 303 HB THR 55 HB THR 55 9.572 -11.358 -19.335 304 HG1 THR 55 HG1 THR 55 11.221 -10.358 -20.547 305 HG21 THR 55 HG21 THR 55 7.814 -10.148 -20.214 306 HG22 THR 55 HG22 THR 55 8.334 -8.647 -19.411 307 HG23 THR 55 HG23 THR 55 9.094 -9.147 -20.942 308 H TYR 56 H TYR 56 12.317 -9.410 -17.708 309 HA TYR 56 HA TYR 56 13.222 -11.851 -16.689 310 HB2 TYR 56 HB2 TYR 56 14.567 -10.144 -17.951 311 HB3 TYR 56 HB3 TYR 56 14.286 -8.959 -16.690 312 HD1 TYR 56 HD2 TYR 56 15.395 -9.224 -14.458 313 HD2 TYR 56 HD1 TYR 56 16.317 -11.779 -17.763 314 HE1 TYR 56 HE2 TYR 56 17.538 -9.955 -13.303 315 HE2 TYR 56 HE1 TYR 56 18.457 -12.502 -16.597 316 HH TYR 56 HH TYR 56 19.451 -10.999 -13.559 317 H LEU 57 H LEU 57 12.405 -8.713 -15.102 318 HA LEU 57 HA LEU 57 13.271 -9.652 -12.544 319 HB2 LEU 57 HB2 LEU 57 13.167 -7.244 -13.522 320 HB3 LEU 57 HB3 LEU 57 11.490 -7.284 -13.012 321 HG LEU 57 HG LEU 57 12.628 -8.083 -10.711 322 HD11 LEU 57 HD11 LEU 57 14.786 -7.591 -10.412 323 HD12 LEU 57 HD12 LEU 57 14.885 -7.536 -12.188 324 HD13 LEU 57 HD13 LEU 57 14.648 -6.034 -11.263 325 HD21 LEU 57 HD21 LEU 57 11.179 -5.982 -11.464 326 HD22 LEU 57 HD22 LEU 57 11.974 -6.071 -9.874 327 HD23 LEU 57 HD23 LEU 57 12.726 -5.143 -11.194 328 H TYR 58 H TYR 58 10.321 -9.732 -14.485 329 HA TYR 58 HA TYR 58 8.619 -10.295 -12.245 330 HB2 TYR 58 HB2 TYR 58 8.549 -10.217 -15.294 331 HB3 TYR 58 HB3 TYR 58 7.228 -11.022 -14.472 332 HD1 TYR 58 HD1 TYR 58 6.939 -9.246 -12.064 333 HD2 TYR 58 HD2 TYR 58 7.525 -8.300 -16.195 334 HE1 TYR 58 HE1 TYR 58 5.791 -7.003 -11.721 335 HE2 TYR 58 HE2 TYR 58 6.376 -6.061 -15.838 336 HH TYR 58 HH TYR 58 6.052 -4.508 -13.814 337 H GLN 59 H GLN 59 10.638 -12.115 -14.516 338 HA GLN 59 HA GLN 59 9.475 -14.553 -13.414 339 HB2 GLN 59 HB2 GLN 59 9.401 -14.017 -15.997 340 HB3 GLN 59 HB3 GLN 59 11.090 -14.483 -15.975 341 HG2 GLN 59 HG2 GLN 59 10.385 -16.659 -14.826 342 HG3 GLN 59 HG3 GLN 59 8.718 -16.195 -15.102 343 HE21 GLN 59 HE21 GLN 59 8.612 -15.139 -17.521 344 HE22 GLN 59 HE22 GLN 59 9.109 -16.243 -18.760 345 H LYS 60 H LYS 60 10.759 -15.515 -11.905 346 HA LYS 60 HA LYS 60 13.381 -14.680 -11.431 347 HB2 LYS 60 HB2 LYS 60 13.414 -16.336 -9.732 348 HB3 LYS 60 HB3 LYS 60 11.781 -15.703 -9.785 349 HG2 LYS 60 HG2 LYS 60 11.375 -17.713 -11.493 350 HG3 LYS 60 HG3 LYS 60 12.803 -18.388 -10.733 351 HD2 LYS 60 HD2 LYS 60 11.769 -18.558 -8.614 352 HD3 LYS 60 HD3 LYS 60 10.584 -17.319 -8.976 353 HE2 LYS 60 HE2 LYS 60 10.642 -20.011 -10.413 354 HE3 LYS 60 HE3 LYS 60 9.709 -19.736 -8.955 355 HZ1 LYS 60 HZ1 LYS 60 9.299 -17.727 -10.923 356 HZ2 LYS 60 HZ2 LYS 60 8.880 -19.214 -11.452 357 HZ3 LYS 60 HZ3 LYS 60 8.203 -18.609 -10.095 358 H ASP 61 H ASP 61 11.982 -17.329 -13.393 359 HA ASP 61 HA ASP 61 14.712 -18.003 -14.156 360 HB2 ASP 61 HB2 ASP 61 12.126 -19.620 -14.253 361 HB3 ASP 61 HB3 ASP 61 13.606 -20.154 -15.024 362 HD2 ASP 61 HD2 ASP 61 15.059 -21.373 -13.402 363 H ASN 62 H ASN 62 14.702 -18.930 -16.587 364 HA ASN 62 HA ASN 62 12.940 -17.194 -18.133 365 HB2 ASN 62 HB2 ASN 62 15.882 -17.826 -18.364 366 HB3 ASN 62 HB3 ASN 62 15.001 -17.622 -19.865 367 HD21 ASN 62 HD21 ASN 62 14.281 -15.657 -20.494 368 HD22 ASN 62 HD22 ASN 62 14.624 -14.169 -19.678 369 H SER 63 H SER 63 11.438 -18.497 -19.195 370 HA SER 63 HA SER 63 12.441 -20.798 -20.590 371 HB2 SER 63 HB2 SER 63 10.809 -22.356 -19.656 372 HB3 SER 63 HB3 SER 63 11.777 -21.690 -18.356 373 HG SER 63 HG SER 63 10.040 -20.192 -17.887 374 H CYS 64 H CYS 64 10.411 -21.826 -21.868 375 HA CYS 64 HA CYS 64 9.336 -19.673 -23.354 376 HB2 CYS 64 HB2 CYS 64 8.922 -22.671 -23.475 377 HB3 CYS 64 HB3 CYS 64 8.098 -21.560 -24.550 378 HG CYS 64 HG CYS 64 10.147 -20.478 -25.622 379 H ASN 65 H ASN 65 7.893 -22.315 -21.298 380 HA ASN 65 HA ASN 65 5.663 -20.492 -20.844 381 HB2 ASN 65 HB2 ASN 65 5.751 -23.469 -21.388 382 HB3 ASN 65 HB3 ASN 65 4.495 -22.872 -20.321 383 HD21 ASN 65 HD21 ASN 65 5.122 -23.691 -23.382 384 HD22 ASN 65 HD22 ASN 65 4.017 -22.687 -24.262 385 H LEU 66 H LEU 66 4.623 -20.803 -18.633 386 HA LEU 66 HA LEU 66 5.932 -22.434 -16.712 387 HB2 LEU 66 HB2 LEU 66 7.506 -20.443 -17.112 388 HB3 LEU 66 HB3 LEU 66 6.296 -19.478 -16.291 389 HG LEU 66 HG LEU 66 6.532 -21.310 -14.408 390 HD11 LEU 66 HD11 LEU 66 8.703 -21.977 -16.244 391 HD12 LEU 66 HD12 LEU 66 9.270 -21.663 -14.586 392 HD13 LEU 66 HD13 LEU 66 8.023 -22.898 -14.881 393 HD21 LEU 66 HD21 LEU 66 8.648 -19.184 -14.846 394 HD22 LEU 66 HD22 LEU 66 7.021 -18.909 -14.177 395 HD23 LEU 66 HD23 LEU 66 8.187 -19.924 -13.294 396 H PHE 67 H PHE 67 4.837 -22.298 -14.592 397 HA PHE 67 HA PHE 67 2.138 -22.268 -14.787 398 HB2 PHE 67 HB2 PHE 67 4.207 -21.827 -12.608 399 HB3 PHE 67 HB3 PHE 67 2.531 -21.563 -12.171 400 HD1 PHE 67 HD1 PHE 67 3.888 -24.127 -14.495 401 HD2 PHE 67 HD2 PHE 67 2.089 -23.349 -10.731 402 HE1 PHE 67 HE1 PHE 67 3.596 -26.592 -14.125 403 HE2 PHE 67 HE2 PHE 67 1.797 -25.814 -10.361 404 HZ PHE 67 HZ PHE 67 2.554 -27.406 -12.063 405 H ASN 68 H ASN 68 4.328 -19.505 -14.103 406 HA ASN 68 HA ASN 68 2.068 -17.806 -13.622 407 HB2 ASN 68 HB2 ASN 68 5.090 -17.446 -13.605 408 HB3 ASN 68 HB3 ASN 68 4.050 -16.036 -13.600 409 HD21 ASN 68 HD21 ASN 68 5.196 -18.796 -11.855 410 HD22 ASN 68 HD22 ASN 68 4.529 -18.421 -10.301 411 H THR 69 H THR 69 1.066 -16.671 -15.296 412 HA THR 69 HA THR 69 2.146 -16.854 -17.947 413 HB THR 69 HB THR 69 -0.217 -15.145 -17.100 414 HG1 THR 69 HG1 THR 69 -1.084 -16.999 -16.261 415 HG21 THR 69 HG21 THR 69 -1.058 -15.671 -19.210 416 HG22 THR 69 HG22 THR 69 0.675 -15.829 -19.583 417 HG23 THR 69 HG23 THR 69 -0.293 -17.278 -19.220 418 H LEU 70 H LEU 70 3.506 -15.513 -18.946 419 HA LEU 70 HA LEU 70 4.494 -13.251 -17.569 420 HB2 LEU 70 HB2 LEU 70 6.042 -14.332 -18.889 421 HB3 LEU 70 HB3 LEU 70 4.934 -14.532 -20.232 422 HG LEU 70 HG LEU 70 5.158 -12.233 -20.879 423 HD11 LEU 70 HD11 LEU 70 7.187 -11.484 -18.866 424 HD12 LEU 70 HD12 LEU 70 5.873 -10.530 -19.595 425 HD13 LEU 70 HD13 LEU 70 5.523 -11.648 -18.256 426 HD21 LEU 70 HD21 LEU 70 7.186 -14.077 -21.030 427 HD22 LEU 70 HD22 LEU 70 7.122 -12.528 -21.905 428 HD23 LEU 70 HD23 LEU 70 8.018 -12.648 -20.372 429 H THR 71 H THR 71 1.867 -13.833 -19.848 430 HA THR 71 HA THR 71 1.590 -11.334 -20.987 431 HB THR 71 HB THR 71 -0.431 -13.462 -20.119 432 HG1 THR 71 HG1 THR 71 0.821 -14.243 -21.813 433 HG21 THR 71 HG21 THR 71 -1.188 -11.889 -22.447 434 HG22 THR 71 HG22 THR 71 -2.120 -12.174 -20.957 435 HG23 THR 71 HG23 THR 71 -0.985 -10.806 -21.049 436 H GLU 72 H GLU 72 0.863 -12.411 -17.678 437 HA GLU 72 HA GLU 72 -0.802 -10.315 -17.002 438 HB2 GLU 72 HB2 GLU 72 -0.754 -12.099 -15.472 439 HB3 GLU 72 HB3 GLU 72 0.996 -12.191 -15.465 440 HG2 GLU 72 HG2 GLU 72 -0.011 -11.202 -13.353 441 HG3 GLU 72 HG3 GLU 72 1.197 -10.190 -14.120 442 HE2 GLU 72 HE2 GLU 72 -2.635 -9.164 -14.760 443 H ALA 73 H ALA 73 2.793 -10.654 -16.870 444 HA ALA 73 HA ALA 73 3.231 -8.161 -15.634 445 HB1 ALA 73 HB1 ALA 73 5.146 -9.351 -15.431 446 HB2 ALA 73 HB2 ALA 73 4.781 -10.351 -16.857 447 HB3 ALA 73 HB3 ALA 73 5.528 -8.748 -17.061 448 H ARG 74 H ARG 74 3.371 -9.274 -19.087 449 HA ARG 74 HA ARG 74 4.104 -6.881 -20.155 450 HB2 ARG 74 HB2 ARG 74 3.902 -9.135 -21.337 451 HB3 ARG 74 HB3 ARG 74 2.169 -8.888 -21.415 452 HG2 ARG 74 HG2 ARG 74 2.471 -6.840 -22.759 453 HG3 ARG 74 HG3 ARG 74 4.212 -6.943 -22.586 454 HD2 ARG 74 HD2 ARG 74 3.916 -7.931 -24.693 455 HD3 ARG 74 HD3 ARG 74 3.923 -9.348 -23.662 456 HE ARG 74 HE ARG 74 1.605 -9.636 -24.035 457 HH11 ARG 74 HH22 ARG 74 2.686 -6.553 -25.343 458 HH12 ARG 74 HH21 ARG 74 1.220 -6.266 -26.219 459 HH21 ARG 74 HH12 ARG 74 -0.329 -9.258 -25.191 460 HH22 ARG 74 HH11 ARG 74 -0.507 -7.815 -26.132 461 H ASP 75 H ASP 75 0.889 -8.088 -19.127 462 HA ASP 75 HA ASP 75 -0.523 -5.975 -20.347 463 HB2 ASP 75 HB2 ASP 75 -1.666 -8.065 -19.866 464 HB3 ASP 75 HB3 ASP 75 -1.210 -7.998 -18.176 465 HD2 ASP 75 HD2 ASP 75 -3.089 -6.625 -20.561 466 H ALA 76 H ALA 76 1.091 -6.610 -17.234 467 HA ALA 76 HA ALA 76 -0.185 -4.622 -15.714 468 HB1 ALA 76 HB1 ALA 76 2.664 -5.364 -15.183 469 HB2 ALA 76 HB2 ALA 76 1.277 -5.287 -14.071 470 HB3 ALA 76 HB3 ALA 76 1.463 -6.678 -15.166 471 H ILE 77 H ILE 77 2.760 -4.659 -17.800 472 HA ILE 77 HA ILE 77 3.425 -1.966 -17.173 473 HB ILE 77 HB ILE 77 4.335 -3.603 -19.535 474 HG12 ILE 77 HG12 ILE 77 5.930 -3.587 -17.023 475 HG13 ILE 77 HG13 ILE 77 4.479 -4.569 -17.020 476 HG21 ILE 77 HG21 ILE 77 6.475 -2.228 -18.946 477 HG22 ILE 77 HG22 ILE 77 5.153 -1.471 -19.868 478 HG23 ILE 77 HG23 ILE 77 5.325 -1.145 -18.126 479 HD11 ILE 77 HD11 ILE 77 6.853 -4.758 -18.912 480 HD12 ILE 77 HD12 ILE 77 6.210 -6.010 -17.823 481 HD13 ILE 77 HD13 ILE 77 5.295 -5.538 -19.275 482 H LYS 78 H LYS 78 1.833 -3.635 -19.966 483 HA LYS 78 HA LYS 78 1.428 -1.294 -21.443 484 HB2 LYS 78 HB2 LYS 78 0.433 -2.662 -22.953 485 HB3 LYS 78 HB3 LYS 78 1.230 -3.896 -21.999 486 HG2 LYS 78 HG2 LYS 78 -0.933 -3.983 -20.571 487 HG3 LYS 78 HG3 LYS 78 -1.681 -3.015 -21.826 488 HD2 LYS 78 HD2 LYS 78 -0.198 -5.554 -22.571 489 HD3 LYS 78 HD3 LYS 78 -1.830 -5.656 -21.940 490 HE2 LYS 78 HE2 LYS 78 -2.282 -5.482 -24.224 491 HE3 LYS 78 HE3 LYS 78 -2.351 -3.791 -23.768 492 HZ1 LYS 78 HZ1 LYS 78 0.292 -4.551 -24.346 493 HZ2 LYS 78 HZ2 LYS 78 -0.682 -4.920 -25.604 494 HZ3 LYS 78 HZ3 LYS 78 -0.618 -3.388 -25.042 495 H ASP 79 H ASP 79 -0.234 -2.724 -18.668 496 HA ASP 79 HA ASP 79 -2.648 -1.375 -19.033 497 HB2 ASP 79 HB2 ASP 79 -1.237 -2.777 -16.778 498 HB3 ASP 79 HB3 ASP 79 -2.552 -1.708 -16.335 499 HD2 ASP 79 HD2 ASP 79 -4.194 -3.388 -15.872 500 H ALA 80 H ALA 80 0.299 -0.768 -16.981 501 HA ALA 80 HA ALA 80 -0.629 1.667 -15.920 502 HB1 ALA 80 HB1 ALA 80 2.277 1.422 -16.115 503 HB2 ALA 80 HB2 ALA 80 1.232 1.429 -14.674 504 HB3 ALA 80 HB3 ALA 80 1.524 -0.091 -15.554 505 H TYR 81 H TYR 81 1.088 0.734 -18.906 506 HA TYR 81 HA TYR 81 1.979 3.305 -19.600 507 HB2 TYR 81 HB2 TYR 81 1.283 0.656 -20.960 508 HB3 TYR 81 HB3 TYR 81 1.715 2.023 -21.966 509 HD1 TYR 81 HD1 TYR 81 3.214 1.335 -18.640 510 HD2 TYR 81 HD2 TYR 81 3.736 1.129 -22.882 511 HE1 TYR 81 HE1 TYR 81 5.679 0.798 -18.319 512 HE2 TYR 81 HE2 TYR 81 6.198 0.593 -22.546 513 HH TYR 81 HH TYR 81 7.448 -0.355 -19.585 514 H GLU 82 H GLU 82 -0.940 1.406 -20.648 515 HA GLU 82 HA GLU 82 -1.928 3.541 -22.169 516 HB2 GLU 82 HB2 GLU 82 -2.467 1.042 -22.401 517 HB3 GLU 82 HB3 GLU 82 -3.536 1.222 -21.025 518 HG2 GLU 82 HG2 GLU 82 -4.788 3.024 -22.256 519 HG3 GLU 82 HG3 GLU 82 -3.738 2.791 -23.640 520 HE2 GLU 82 HE2 GLU 82 -4.778 1.010 -25.127 521 H SER 83 H SER 83 -2.245 2.528 -18.772 522 HA SER 83 HA SER 83 -4.528 3.940 -18.150 523 HB2 SER 83 HB2 SER 83 -3.814 2.423 -16.507 524 HB3 SER 83 HB3 SER 83 -2.143 2.944 -16.595 525 HG SER 83 HG SER 83 -2.622 4.806 -15.405 526 H TYR 84 H TYR 84 -1.031 4.889 -18.057 527 HA TYR 84 HA TYR 84 -1.792 7.611 -17.368 528 HB2 TYR 84 HB2 TYR 84 0.723 5.891 -17.639 529 HB3 TYR 84 HB3 TYR 84 0.900 7.634 -17.595 530 HD1 TYR 84 HD1 TYR 84 0.008 8.899 -15.557 531 HD2 TYR 84 HD2 TYR 84 0.442 4.644 -15.645 532 HE1 TYR 84 HE1 TYR 84 -0.049 8.833 -13.016 533 HE2 TYR 84 HE2 TYR 84 0.384 4.592 -13.104 534 HH TYR 84 HH TYR 84 0.298 5.748 -11.285 535 H CYS 85 H CYS 85 -1.318 5.684 -20.168 536 HA CYS 85 HA CYS 85 0.103 7.217 -21.878 537 HB2 CYS 85 HB2 CYS 85 -0.655 5.123 -22.653 538 HB3 CYS 85 HB3 CYS 85 -2.334 5.490 -22.314 539 HG CYS 85 HG CYS 85 -1.404 5.426 -24.975 540 H GLY 86 H GLY 86 -0.326 9.062 -23.200 541 HA2 GLY 86 HA2 GLY 86 -1.822 10.650 -24.120 542 HA3 GLY 86 HA3 GLY 86 -2.911 10.409 -22.769 543 H ILE 87 H ILE 87 0.140 10.328 -21.403 544 HA ILE 87 HA ILE 87 0.217 13.245 -21.081 545 HB ILE 87 HB ILE 87 0.539 13.059 -18.762 546 HG12 ILE 87 HG12 ILE 87 0.996 10.143 -19.310 547 HG13 ILE 87 HG13 ILE 87 1.975 11.272 -18.395 548 HG21 ILE 87 HG21 ILE 87 -1.610 11.004 -19.074 549 HG22 ILE 87 HG22 ILE 87 -1.574 12.489 -18.094 550 HG23 ILE 87 HG23 ILE 87 -1.819 12.590 -19.854 551 HD11 ILE 87 HD11 ILE 87 1.006 10.306 -16.567 552 HD12 ILE 87 HD12 ILE 87 -0.389 11.338 -16.962 553 HD13 ILE 87 HD13 ILE 87 -0.347 9.649 -17.520 554 H ASP 88 H ASP 88 1.985 13.758 -22.303 555 HA ASP 88 HA ASP 88 4.282 12.017 -22.057 556 HB2 ASP 88 HB2 ASP 88 5.178 13.548 -23.922 557 HB3 ASP 88 HB3 ASP 88 3.805 12.541 -24.335 558 HD2 ASP 88 HD2 ASP 88 3.356 15.753 -25.703 559 H ASP 89 H ASP 89 2.909 14.844 -20.710 560 HA ASP 89 HA ASP 89 5.500 15.602 -19.672 561 HB2 ASP 89 HB2 ASP 89 5.056 17.189 -21.507 562 HB3 ASP 89 HB3 ASP 89 3.450 17.512 -20.884 563 HD2 ASP 89 HD2 ASP 89 3.696 19.735 -20.113 564 H CYS 90 H CYS 90 5.345 16.254 -17.453 565 HA CYS 90 HA CYS 90 3.215 15.406 -15.981 566 HB2 CYS 90 HB2 CYS 90 5.578 16.035 -15.211 567 HB3 CYS 90 HB3 CYS 90 5.006 17.689 -15.119 568 HA PRO 91 HA PRO 91 0.454 18.685 -17.118 569 HB2 PRO 91 HB2 PRO 91 -1.854 17.448 -16.337 570 HB3 PRO 91 HB3 PRO 91 -1.151 17.249 -17.930 571 HG2 PRO 91 HG2 PRO 91 -1.152 15.360 -15.656 572 HG3 PRO 91 HG3 PRO 91 -0.846 15.037 -17.351 573 HD2 PRO 91 HD2 PRO 91 1.109 15.231 -15.261 574 HD3 PRO 91 HD3 PRO 91 1.422 15.023 -16.973 575 H GLN 92 H GLN 92 0.344 16.989 -14.050 576 HA GLN 92 HA GLN 92 -1.084 18.902 -12.697 577 HB2 GLN 92 HB2 GLN 92 -0.014 17.918 -10.644 578 HB3 GLN 92 HB3 GLN 92 -0.681 16.715 -11.731 579 HG2 GLN 92 HG2 GLN 92 1.487 16.101 -12.568 580 HG3 GLN 92 HG3 GLN 92 2.240 17.543 -11.916 581 HE21 GLN 92 HE21 GLN 92 2.006 14.346 -11.535 582 HE22 GLN 92 HE22 GLN 92 2.274 14.159 -9.834 583 H CYS 93 H CYS 93 2.371 18.742 -13.587 584 HA CYS 93 HA CYS 93 3.116 20.889 -11.881 585 HB2 CYS 93 HB2 CYS 93 4.458 19.201 -13.940 586 HB3 CYS 93 HB3 CYS 93 5.151 20.784 -13.647 587 H SER 94 H SER 94 1.980 20.421 -15.240 588 HA SER 94 HA SER 94 2.589 23.105 -15.967 589 HB2 SER 94 HB2 SER 94 0.936 20.949 -17.354 590 HB3 SER 94 HB3 SER 94 1.329 22.499 -18.071 591 HG SER 94 HG SER 94 3.555 21.119 -17.049 592 H LYS 95 H LYS 95 0.171 21.576 -14.110 593 HA LYS 95 HA LYS 95 -1.848 23.562 -14.843 594 HB2 LYS 95 HB2 LYS 95 -2.689 21.327 -14.911 595 HB3 LYS 95 HB3 LYS 95 -1.991 20.933 -13.352 596 HG2 LYS 95 HG2 LYS 95 -4.448 21.398 -13.207 597 HG3 LYS 95 HG3 LYS 95 -3.505 22.484 -12.206 598 HD2 LYS 95 HD2 LYS 95 -3.899 24.335 -13.582 599 HD3 LYS 95 HD3 LYS 95 -4.079 23.363 -15.029 600 HE2 LYS 95 HE2 LYS 95 -6.310 22.696 -14.450 601 HE3 LYS 95 HE3 LYS 95 -6.117 23.184 -12.778 602 HZ1 LYS 95 HZ1 LYS 95 -5.668 25.324 -14.585 603 HZ2 LYS 95 HZ2 LYS 95 -7.166 24.693 -14.745 604 HZ3 LYS 95 HZ3 LYS 95 -6.665 25.248 -13.293 605 H TYR 96 H TYR 96 0.467 22.586 -12.365 606 HA TYR 96 HA TYR 96 -0.250 24.990 -10.880 607 HB2 TYR 96 HB2 TYR 96 -1.343 22.709 -10.047 608 HB3 TYR 96 HB3 TYR 96 0.287 22.255 -9.591 609 HD1 TYR 96 HD2 TYR 96 -2.231 24.979 -9.070 610 HD2 TYR 96 HD1 TYR 96 1.098 22.819 -7.471 611 HE1 TYR 96 HE2 TYR 96 -2.511 26.179 -6.846 612 HE2 TYR 96 HE1 TYR 96 0.807 24.026 -5.253 613 HH TYR 96 HH TYR 96 -0.158 26.232 -4.519 614 H ILE 97 H ILE 97 1.490 25.804 -9.545 615 HA ILE 97 HA ILE 97 4.058 24.481 -10.052 616 HB ILE 97 HB ILE 97 3.787 26.337 -11.609 617 HG12 ILE 97 HG12 ILE 97 5.815 26.946 -9.438 618 HG13 ILE 97 HG13 ILE 97 6.014 25.727 -10.682 619 HG21 ILE 97 HG21 ILE 97 2.611 27.643 -9.363 620 HG22 ILE 97 HG22 ILE 97 4.028 28.586 -9.882 621 HG23 ILE 97 HG23 ILE 97 2.737 28.205 -11.047 622 HD11 ILE 97 HD11 ILE 97 6.907 28.267 -10.973 623 HD12 ILE 97 HD12 ILE 97 6.375 27.279 -12.355 624 HD13 ILE 97 HD13 ILE 97 5.266 28.470 -11.632 625 H ASP 98 H ASP 98 5.350 24.247 -8.269 626 HA ASP 98 HA ASP 98 4.180 25.205 -5.811 627 HB2 ASP 98 HB2 ASP 98 4.914 22.795 -6.119 628 HB3 ASP 98 HB3 ASP 98 6.568 23.355 -6.269 629 HD2 ASP 98 HD2 ASP 98 7.198 24.098 -3.210 630 H ASP 99 H ASP 99 4.873 27.340 -5.413 631 HA ASP 99 HA ASP 99 7.478 28.142 -6.224 632 HB2 ASP 99 HB2 ASP 99 5.132 29.445 -4.820 633 HB3 ASP 99 HB3 ASP 99 6.690 30.246 -4.786 634 HD2 ASP 99 HD2 ASP 99 4.685 31.691 -6.834 Start of MODEL 19 1 H GLU 14 H GLU 14 -3.334 -5.800 -7.608 2 HA GLU 14 HA GLU 14 -1.766 -6.352 -5.209 3 HB2 GLU 14 HB2 GLU 14 -1.336 -7.157 -8.090 4 HB3 GLU 14 HB3 GLU 14 0.057 -6.935 -7.050 5 HG2 GLU 14 HG2 GLU 14 -0.817 -9.311 -7.099 6 HG3 GLU 14 HG3 GLU 14 -0.721 -8.624 -5.490 7 HE2 GLU 14 HE2 GLU 14 -2.650 -8.283 -4.438 8 H ASP 15 H ASP 15 -0.480 -4.690 -4.505 9 HA ASP 15 HA ASP 15 -0.291 -2.416 -6.293 10 HB2 ASP 15 HB2 ASP 15 0.118 -1.086 -4.320 11 HB3 ASP 15 HB3 ASP 15 -1.222 -2.153 -3.949 12 HD2 ASP 15 HD2 ASP 15 0.721 -1.604 -1.325 13 H GLN 16 H GLN 16 1.509 -4.980 -4.661 14 HA GLN 16 HA GLN 16 4.009 -3.773 -4.600 15 HB2 GLN 16 HB2 GLN 16 3.140 -6.688 -4.714 16 HB3 GLN 16 HB3 GLN 16 4.819 -6.217 -4.543 17 HG2 GLN 16 HG2 GLN 16 4.494 -5.297 -2.398 18 HG3 GLN 16 HG3 GLN 16 2.789 -4.993 -2.668 19 HE21 GLN 16 HE21 GLN 16 5.058 -6.997 -1.266 20 HE22 GLN 16 HE22 GLN 16 4.076 -8.374 -0.890 21 H GLU 17 H GLU 17 2.159 -5.405 -7.166 22 HA GLU 17 HA GLU 17 4.207 -6.019 -8.872 23 HB2 GLU 17 HB2 GLU 17 1.340 -5.153 -9.426 24 HB3 GLU 17 HB3 GLU 17 2.410 -5.741 -10.683 25 HG2 GLU 17 HG2 GLU 17 1.696 -7.294 -8.150 26 HG3 GLU 17 HG3 GLU 17 0.942 -7.542 -9.713 27 HE2 GLU 17 HE2 GLU 17 4.857 -8.132 -9.321 28 H GLN 18 H GLN 18 2.479 -2.912 -8.327 29 HA GLN 18 HA GLN 18 3.460 -1.558 -10.503 30 HB2 GLN 18 HB2 GLN 18 1.654 -0.711 -9.051 31 HB3 GLN 18 HB3 GLN 18 2.775 -0.520 -7.718 32 HG2 GLN 18 HG2 GLN 18 2.705 1.659 -8.595 33 HG3 GLN 18 HG3 GLN 18 4.136 1.011 -9.371 34 HE21 GLN 18 HE21 GLN 18 2.135 3.101 -10.120 35 HE22 GLN 18 HE22 GLN 18 1.600 2.705 -11.719 36 H TRP 19 H TRP 19 4.872 -2.069 -7.222 37 HA TRP 19 HA TRP 19 7.008 -0.341 -7.406 38 HB2 TRP 19 HB2 TRP 19 6.659 -1.243 -5.320 39 HB3 TRP 19 HB3 TRP 19 6.466 -2.877 -5.923 40 HD1 TRP 19 HD1 TRP 19 9.486 -0.370 -6.018 41 HE1 TRP 19 HE1 TRP 19 11.711 -1.593 -5.301 42 HE3 TRP 19 HE3 TRP 19 7.350 -4.914 -5.217 43 HZ2 TRP 19 HZ2 TRP 19 12.315 -4.264 -4.498 44 HZ3 TRP 19 HZ3 TRP 19 8.828 -6.777 -4.468 45 HH2 TRP 19 HH2 TRP 19 11.230 -6.508 -4.108 46 H ALA 20 H ALA 20 6.391 -3.523 -8.895 47 HA ALA 20 HA ALA 20 8.987 -4.183 -9.613 48 HB1 ALA 20 HB1 ALA 20 6.761 -4.796 -11.505 49 HB2 ALA 20 HB2 ALA 20 7.968 -5.878 -10.770 50 HB3 ALA 20 HB3 ALA 20 6.556 -5.348 -9.825 51 H MET 21 H MET 21 6.605 -1.930 -11.055 52 HA MET 21 HA MET 21 7.892 -1.588 -13.476 53 HB2 MET 21 HB2 MET 21 5.596 -0.638 -12.219 54 HB3 MET 21 HB3 MET 21 6.580 0.812 -12.253 55 HG2 MET 21 HG2 MET 21 6.361 1.050 -14.521 56 HG3 MET 21 HG3 MET 21 6.654 -0.651 -14.821 57 HE1 MET 21 HE1 MET 21 3.626 1.975 -15.088 58 HE2 MET 21 HE2 MET 21 2.761 1.381 -13.650 59 HE3 MET 21 HE3 MET 21 4.436 1.966 -13.503 60 H GLN 22 H GLN 22 8.950 -0.785 -10.321 61 HA GLN 22 HA GLN 22 10.085 1.635 -10.498 62 HB2 GLN 22 HB2 GLN 22 10.158 0.211 -8.486 63 HB3 GLN 22 HB3 GLN 22 11.279 -0.887 -9.266 64 HG2 GLN 22 HG2 GLN 22 13.067 0.656 -9.186 65 HG3 GLN 22 HG3 GLN 22 12.004 2.045 -9.080 66 HE21 GLN 22 HE21 GLN 22 14.100 0.173 -7.418 67 HE22 GLN 22 HE22 GLN 22 13.582 0.432 -5.786 68 H THR 23 H THR 23 12.056 -1.365 -11.092 69 HA THR 23 HA THR 23 13.985 0.115 -12.581 70 HB THR 23 HB THR 23 13.538 -2.900 -12.258 71 HG1 THR 23 HG1 THR 23 13.855 -1.115 -10.401 72 HG21 THR 23 HG21 THR 23 15.483 -1.431 -13.763 73 HG22 THR 23 HG22 THR 23 16.293 -1.950 -12.266 74 HG23 THR 23 HG23 THR 23 15.537 -3.157 -13.333 75 H LEU 24 H LEU 24 11.500 -2.363 -13.489 76 HA LEU 24 HA LEU 24 11.927 -2.619 -16.099 77 HB2 LEU 24 HB2 LEU 24 10.156 -3.787 -15.141 78 HB3 LEU 24 HB3 LEU 24 9.381 -2.335 -14.540 79 HG LEU 24 HG LEU 24 9.626 -2.907 -17.497 80 HD11 LEU 24 HD11 LEU 24 7.891 -4.327 -17.523 81 HD12 LEU 24 HD12 LEU 24 8.306 -4.602 -15.814 82 HD13 LEU 24 HD13 LEU 24 7.018 -3.451 -16.242 83 HD21 LEU 24 HD21 LEU 24 7.327 -1.492 -17.118 84 HD22 LEU 24 HD22 LEU 24 8.362 -0.833 -15.829 85 HD23 LEU 24 HD23 LEU 24 8.908 -0.781 -17.522 86 H MET 25 H MET 25 9.919 0.089 -14.731 87 HA MET 25 HA MET 25 9.900 1.409 -17.219 88 HB2 MET 25 HB2 MET 25 8.339 2.743 -16.143 89 HB3 MET 25 HB3 MET 25 8.420 1.524 -14.887 90 HG2 MET 25 HG2 MET 25 10.328 2.873 -13.828 91 HG3 MET 25 HG3 MET 25 9.996 4.138 -14.995 92 HE1 MET 25 HE1 MET 25 7.569 4.529 -15.621 93 HE2 MET 25 HE2 MET 25 6.277 3.652 -14.766 94 HE3 MET 25 HE3 MET 25 6.595 5.362 -14.385 95 H GLY 26 H GLY 26 11.977 1.473 -14.336 96 HA2 GLY 26 HA2 GLY 26 13.212 3.974 -14.786 97 HA3 GLY 26 HA3 GLY 26 13.828 2.646 -13.822 98 H SER 27 H SER 27 13.266 1.080 -16.634 99 HA SER 27 HA SER 27 15.968 1.019 -17.315 100 HB2 SER 27 HB2 SER 27 13.815 -0.604 -17.768 101 HB3 SER 27 HB3 SER 27 13.957 0.142 -19.347 102 HG SER 27 HG SER 27 16.351 -0.457 -19.135 103 H GLY 28 H GLY 28 13.650 3.406 -17.857 104 HA2 GLY 28 HA2 GLY 28 14.179 5.398 -18.965 105 HA3 GLY 28 HA3 GLY 28 15.228 4.526 -20.065 106 H VAL 29 H VAL 29 12.395 2.694 -19.575 107 HA VAL 29 HA VAL 29 11.512 3.226 -22.228 108 HB VAL 29 HB VAL 29 10.444 1.531 -19.967 109 HG11 VAL 29 HG11 VAL 29 8.621 2.231 -21.498 110 HG12 VAL 29 HG12 VAL 29 9.537 1.554 -22.866 111 HG13 VAL 29 HG13 VAL 29 8.948 0.483 -21.572 112 HG21 VAL 29 HG21 VAL 29 11.882 -0.039 -20.638 113 HG22 VAL 29 HG22 VAL 29 11.363 0.128 -22.333 114 HG23 VAL 29 HG23 VAL 29 12.640 1.185 -21.684 115 H LEU 30 H LEU 30 10.276 3.900 -18.897 116 HA LEU 30 HA LEU 30 8.252 5.625 -20.127 117 HB2 LEU 30 HB2 LEU 30 8.434 4.304 -17.422 118 HB3 LEU 30 HB3 LEU 30 7.256 5.544 -17.802 119 HG LEU 30 HG LEU 30 7.503 2.934 -19.320 120 HD11 LEU 30 HD11 LEU 30 6.667 1.978 -17.481 121 HD12 LEU 30 HD12 LEU 30 6.244 3.540 -16.740 122 HD13 LEU 30 HD13 LEU 30 5.145 2.789 -17.921 123 HD21 LEU 30 HD21 LEU 30 5.417 5.129 -19.336 124 HD22 LEU 30 HD22 LEU 30 6.470 4.611 -20.675 125 HD23 LEU 30 HD23 LEU 30 5.191 3.526 -20.077 126 H ALA 31 H ALA 31 7.728 7.545 -18.389 127 HA ALA 31 HA ALA 31 10.321 8.707 -17.653 128 HB1 ALA 31 HB1 ALA 31 9.877 9.867 -19.633 129 HB2 ALA 31 HB2 ALA 31 8.115 9.826 -19.383 130 HB3 ALA 31 HB3 ALA 31 9.126 10.922 -18.412 131 H ARG 32 H ARG 32 10.347 9.777 -15.679 132 HA ARG 32 HA ARG 32 7.756 9.917 -14.358 133 HB2 ARG 32 HB2 ARG 32 9.170 9.514 -12.194 134 HB3 ARG 32 HB3 ARG 32 8.835 8.133 -13.219 135 HG2 ARG 32 HG2 ARG 32 11.033 8.021 -14.039 136 HG3 ARG 32 HG3 ARG 32 11.336 9.727 -13.775 137 HD2 ARG 32 HD2 ARG 32 10.817 7.992 -11.357 138 HD3 ARG 32 HD3 ARG 32 12.373 7.853 -12.150 139 HE ARG 32 HE ARG 32 11.696 10.637 -11.748 140 HH11 ARG 32 HH22 ARG 32 12.843 7.781 -10.040 141 HH12 ARG 32 HH21 ARG 32 13.669 8.688 -8.817 142 HH21 ARG 32 HH12 ARG 32 12.786 11.833 -10.135 143 HH22 ARG 32 HH11 ARG 32 13.636 11.008 -8.871 144 H CYS 33 H CYS 33 7.400 11.788 -13.030 145 HA CYS 33 HA CYS 33 8.911 14.047 -13.775 146 HB2 CYS 33 HB2 CYS 33 6.426 13.949 -13.168 147 HB3 CYS 33 HB3 CYS 33 6.930 13.912 -11.490 148 H ARG 34 H ARG 34 10.507 15.179 -12.591 149 HA ARG 34 HA ARG 34 12.102 13.724 -10.933 150 HB2 ARG 34 HB2 ARG 34 13.142 15.962 -10.342 151 HB3 ARG 34 HB3 ARG 34 12.937 15.715 -12.065 152 HG2 ARG 34 HG2 ARG 34 11.063 17.187 -12.184 153 HG3 ARG 34 HG3 ARG 34 10.768 17.105 -10.459 154 HD2 ARG 34 HD2 ARG 34 13.122 18.210 -10.187 155 HD3 ARG 34 HD3 ARG 34 13.015 18.571 -11.898 156 HE ARG 34 HE ARG 34 11.551 19.889 -9.766 157 HH11 ARG 34 HH22 ARG 34 11.352 18.967 -13.156 158 HH12 ARG 34 HH21 ARG 34 10.231 20.223 -13.564 159 HH21 ARG 34 HH12 ARG 34 10.071 21.546 -10.303 160 HH22 ARG 34 HH11 ARG 34 9.498 21.700 -11.930 161 H ILE 35 H ILE 35 9.077 15.290 -10.264 162 HA ILE 35 HA ILE 35 9.646 15.324 -7.390 163 HB ILE 35 HB ILE 35 8.843 17.403 -8.478 164 HG12 ILE 35 HG12 ILE 35 8.358 16.528 -6.026 165 HG13 ILE 35 HG13 ILE 35 7.699 18.041 -6.615 166 HG21 ILE 35 HG21 ILE 35 7.338 17.044 -10.119 167 HG22 ILE 35 HG22 ILE 35 6.673 15.585 -9.348 168 HG23 ILE 35 HG23 ILE 35 6.170 17.197 -8.784 169 HD11 ILE 35 HD11 ILE 35 5.536 17.162 -6.889 170 HD12 ILE 35 HD12 ILE 35 6.127 15.490 -7.036 171 HD13 ILE 35 HD13 ILE 35 6.105 16.289 -5.446 172 H HIS 36 H HIS 36 8.078 13.578 -9.954 173 HA HIS 36 HA HIS 36 6.606 12.058 -7.925 174 HB2 HIS 36 HB2 HIS 36 5.801 12.068 -10.816 175 HB3 HIS 36 HB3 HIS 36 4.841 11.707 -9.395 176 HD1 HIS 36 HD1 HIS 36 4.904 14.118 -7.683 177 HD2 HIS 36 HD2 HIS 36 4.922 14.415 -11.867 178 HE1 HIS 36 HE1 HIS 36 4.056 16.460 -8.237 179 H ASN 37 H ASN 37 7.885 10.321 -7.457 180 HA ASN 37 HA ASN 37 9.333 9.127 -9.654 181 HB2 ASN 37 HB2 ASN 37 9.406 8.596 -6.637 182 HB3 ASN 37 HB3 ASN 37 10.431 7.780 -7.801 183 HD21 ASN 37 HD21 ASN 37 12.130 8.683 -6.451 184 HD22 ASN 37 HD22 ASN 37 12.722 10.282 -6.760 185 H ASP 38 H ASP 38 6.506 8.761 -7.611 186 HA ASP 38 HA ASP 38 6.347 5.928 -8.039 187 HB2 ASP 38 HB2 ASP 38 5.461 6.437 -5.944 188 HB3 ASP 38 HB3 ASP 38 4.860 8.001 -6.459 189 HD2 ASP 38 HD2 ASP 38 3.546 4.513 -6.565 190 H VAL 39 H VAL 39 5.524 8.873 -9.629 191 HA VAL 39 HA VAL 39 3.128 7.851 -10.887 192 HB VAL 39 HB VAL 39 4.669 10.428 -10.920 193 HG11 VAL 39 HG11 VAL 39 2.527 9.556 -12.876 194 HG12 VAL 39 HG12 VAL 39 2.897 11.265 -12.543 195 HG13 VAL 39 HG13 VAL 39 4.149 10.199 -13.227 196 HG21 VAL 39 HG21 VAL 39 3.082 10.070 -9.096 197 HG22 VAL 39 HG22 VAL 39 2.506 11.356 -10.183 198 HG23 VAL 39 HG23 VAL 39 1.786 9.730 -10.267 199 H ILE 40 H ILE 40 2.944 7.656 -13.255 200 HA ILE 40 HA ILE 40 5.537 7.051 -14.493 201 HB ILE 40 HB ILE 40 4.655 4.950 -13.990 202 HG12 ILE 40 HG12 ILE 40 5.406 5.339 -16.372 203 HG13 ILE 40 HG13 ILE 40 4.393 3.934 -16.104 204 HG21 ILE 40 HG21 ILE 40 2.211 4.452 -14.891 205 HG22 ILE 40 HG22 ILE 40 2.498 5.131 -13.271 206 HG23 ILE 40 HG23 ILE 40 2.016 6.199 -14.611 207 HD11 ILE 40 HD11 ILE 40 2.629 6.136 -16.621 208 HD12 ILE 40 HD12 ILE 40 3.915 6.180 -17.850 209 HD13 ILE 40 HD13 ILE 40 2.932 4.711 -17.644 210 H LEU 41 H LEU 41 5.825 7.776 -16.598 211 HA LEU 41 HA LEU 41 3.502 9.097 -17.804 212 HB2 LEU 41 HB2 LEU 41 6.256 10.280 -17.952 213 HB3 LEU 41 HB3 LEU 41 4.713 11.023 -18.323 214 HG LEU 41 HG LEU 41 5.249 10.147 -15.506 215 HD11 LEU 41 HD11 LEU 41 7.035 11.836 -16.866 216 HD12 LEU 41 HD12 LEU 41 6.015 12.904 -15.873 217 HD13 LEU 41 HD13 LEU 41 6.908 11.566 -15.112 218 HD21 LEU 41 HD21 LEU 41 3.762 12.529 -16.643 219 HD22 LEU 41 HD22 LEU 41 3.020 10.977 -16.187 220 HD23 LEU 41 HD23 LEU 41 3.793 11.993 -14.946 221 H ASP 42 H ASP 42 3.254 8.760 -19.998 222 HA ASP 42 HA ASP 42 4.798 6.645 -21.057 223 HB2 ASP 42 HB2 ASP 42 2.283 7.294 -21.465 224 HB3 ASP 42 HB3 ASP 42 2.914 8.427 -22.644 225 HD2 ASP 42 HD2 ASP 42 3.705 4.586 -23.432 226 H SER 43 H SER 43 6.642 6.854 -22.357 227 HA SER 43 HA SER 43 7.312 9.561 -23.164 228 HB2 SER 43 HB2 SER 43 8.852 7.949 -21.744 229 HB3 SER 43 HB3 SER 43 9.213 7.208 -23.290 230 HG SER 43 HG SER 43 10.657 9.026 -22.536 231 H GLY 44 H GLY 44 6.785 6.214 -24.325 232 HA2 GLY 44 HA2 GLY 44 5.976 5.689 -26.430 233 HA3 GLY 44 HA3 GLY 44 6.509 7.240 -27.047 234 H ASN 45 H ASN 45 8.593 5.150 -25.025 235 HA ASN 45 HA ASN 45 10.363 4.954 -27.307 236 HB2 ASN 45 HB2 ASN 45 10.786 4.446 -24.317 237 HB3 ASN 45 HB3 ASN 45 12.033 4.183 -25.520 238 HD21 ASN 45 HD21 ASN 45 11.868 6.202 -27.225 239 HD22 ASN 45 HD22 ASN 45 12.127 7.739 -26.470 240 H ASP 46 H ASP 46 11.739 2.718 -27.177 241 HA ASP 46 HA ASP 46 10.026 0.693 -27.793 242 HB2 ASP 46 HB2 ASP 46 12.123 -0.790 -27.292 243 HB3 ASP 46 HB3 ASP 46 12.238 0.422 -28.553 244 HD2 ASP 46 HD2 ASP 46 14.036 1.547 -28.414 245 H ALA 47 H ALA 47 8.564 -0.282 -26.377 246 HA ALA 47 HA ALA 47 8.999 -0.242 -23.563 247 HB1 ALA 47 HB1 ALA 47 6.841 -1.400 -23.496 248 HB2 ALA 47 HB2 ALA 47 6.769 -0.048 -24.651 249 HB3 ALA 47 HB3 ALA 47 6.933 -1.718 -25.245 250 H SER 48 H SER 48 10.177 -2.178 -26.122 251 HA SER 48 HA SER 48 10.039 -4.707 -25.136 252 HB2 SER 48 HB2 SER 48 12.567 -3.665 -26.444 253 HB3 SER 48 HB3 SER 48 11.812 -5.235 -26.632 254 HG SER 48 HG SER 48 9.917 -3.797 -27.524 255 H SER 49 H SER 49 12.057 -1.957 -24.122 256 HA SER 49 HA SER 49 13.936 -3.455 -22.701 257 HB2 SER 49 HB2 SER 49 13.134 -0.596 -22.935 258 HB3 SER 49 HB3 SER 49 13.897 -1.017 -21.415 259 HG SER 49 HG SER 49 15.530 -2.167 -22.981 260 H ALA 50 H ALA 50 10.854 -1.788 -21.781 261 HA ALA 50 HA ALA 50 11.061 -2.468 -19.040 262 HB1 ALA 50 HB1 ALA 50 9.734 -0.589 -19.567 263 HB2 ALA 50 HB2 ALA 50 8.877 -1.444 -20.871 264 HB3 ALA 50 HB3 ALA 50 8.543 -1.851 -19.171 265 H TYR 51 H TYR 51 9.893 -4.086 -21.970 266 HA TYR 51 HA TYR 51 8.294 -6.004 -20.622 267 HB2 TYR 51 HB2 TYR 51 9.736 -5.774 -23.331 268 HB3 TYR 51 HB3 TYR 51 8.693 -7.133 -22.962 269 HD1 TYR 51 HD2 TYR 51 7.448 -4.198 -21.392 270 HD2 TYR 51 HD1 TYR 51 7.622 -6.202 -25.168 271 HE1 TYR 51 HE2 TYR 51 5.434 -2.872 -22.197 272 HE2 TYR 51 HE1 TYR 51 5.607 -4.869 -25.960 273 HH TYR 51 HH TYR 51 3.776 -2.893 -23.760 274 H LYS 52 H LYS 52 11.664 -5.999 -21.957 275 HA LYS 52 HA LYS 52 12.142 -8.682 -21.189 276 HB2 LYS 52 HB2 LYS 52 13.297 -7.447 -23.040 277 HB3 LYS 52 HB3 LYS 52 14.140 -6.495 -21.835 278 HG2 LYS 52 HG2 LYS 52 15.294 -8.415 -20.958 279 HG3 LYS 52 HG3 LYS 52 14.215 -9.536 -21.764 280 HD2 LYS 52 HD2 LYS 52 15.099 -8.361 -23.980 281 HD3 LYS 52 HD3 LYS 52 16.431 -7.853 -22.960 282 HE2 LYS 52 HE2 LYS 52 15.537 -10.764 -23.139 283 HE3 LYS 52 HE3 LYS 52 16.734 -10.085 -24.224 284 HZ1 LYS 52 HZ1 LYS 52 17.690 -11.127 -22.257 285 HZ2 LYS 52 HZ2 LYS 52 18.094 -9.548 -22.359 286 HZ3 LYS 52 HZ3 LYS 52 16.954 -10.032 -21.294 287 H LEU 53 H LEU 53 13.024 -5.459 -19.786 288 HA LEU 53 HA LEU 53 14.336 -6.590 -17.560 289 HB2 LEU 53 HB2 LEU 53 14.571 -4.268 -18.588 290 HB3 LEU 53 HB3 LEU 53 13.106 -3.845 -17.724 291 HG LEU 53 HG LEU 53 15.859 -4.298 -16.709 292 HD11 LEU 53 HD11 LEU 53 15.548 -2.155 -16.228 293 HD12 LEU 53 HD12 LEU 53 13.823 -2.257 -16.657 294 HD13 LEU 53 HD13 LEU 53 14.353 -2.646 -15.003 295 HD21 LEU 53 HD21 LEU 53 15.154 -4.922 -14.476 296 HD22 LEU 53 HD22 LEU 53 13.453 -4.976 -14.996 297 HD23 LEU 53 HD23 LEU 53 14.620 -6.150 -15.649 298 H GLY 54 H GLY 54 10.967 -5.567 -18.251 299 HA2 GLY 54 HA2 GLY 54 9.966 -5.674 -15.644 300 HA3 GLY 54 HA3 GLY 54 9.052 -5.897 -17.123 301 H THR 55 H THR 55 10.038 -8.215 -18.250 302 HA THR 55 HA THR 55 8.867 -10.195 -16.607 303 HB THR 55 HB THR 55 9.153 -9.911 -19.249 304 HG1 THR 55 HG1 THR 55 9.490 -12.564 -18.812 305 HG21 THR 55 HG21 THR 55 10.889 -11.565 -20.050 306 HG22 THR 55 HG22 THR 55 11.619 -10.103 -19.346 307 HG23 THR 55 HG23 THR 55 11.558 -11.610 -18.401 308 H TYR 56 H TYR 56 12.214 -9.101 -17.140 309 HA TYR 56 HA TYR 56 13.518 -11.324 -16.099 310 HB2 TYR 56 HB2 TYR 56 14.414 -9.224 -17.308 311 HB3 TYR 56 HB3 TYR 56 14.118 -8.310 -15.842 312 HD1 TYR 56 HD1 TYR 56 15.542 -11.753 -16.117 313 HD2 TYR 56 HD2 TYR 56 16.285 -7.639 -15.209 314 HE1 TYR 56 HE1 TYR 56 17.863 -12.352 -15.269 315 HE2 TYR 56 HE2 TYR 56 18.604 -8.252 -14.364 316 HH TYR 56 HH TYR 56 19.903 -9.924 -13.735 317 H LEU 57 H LEU 57 12.425 -8.279 -14.442 318 HA LEU 57 HA LEU 57 13.251 -9.235 -11.899 319 HB2 LEU 57 HB2 LEU 57 12.920 -6.817 -12.832 320 HB3 LEU 57 HB3 LEU 57 11.259 -7.037 -12.318 321 HG LEU 57 HG LEU 57 11.930 -7.350 -10.021 322 HD11 LEU 57 HD11 LEU 57 14.710 -7.454 -11.163 323 HD12 LEU 57 HD12 LEU 57 14.434 -6.956 -9.476 324 HD13 LEU 57 HD13 LEU 57 13.906 -8.564 -10.027 325 HD21 LEU 57 HD21 LEU 57 11.683 -5.120 -10.106 326 HD22 LEU 57 HD22 LEU 57 13.453 -5.095 -9.919 327 HD23 LEU 57 HD23 LEU 57 12.727 -4.951 -11.538 328 H TYR 58 H TYR 58 10.067 -8.909 -13.596 329 HA TYR 58 HA TYR 58 8.437 -9.792 -11.580 330 HB2 TYR 58 HB2 TYR 58 8.572 -9.990 -14.623 331 HB3 TYR 58 HB3 TYR 58 7.261 -10.821 -13.809 332 HD1 TYR 58 HD1 TYR 58 6.643 -8.884 -11.614 333 HD2 TYR 58 HD2 TYR 58 7.508 -8.230 -15.753 334 HE1 TYR 58 HE1 TYR 58 5.312 -6.718 -11.558 335 HE2 TYR 58 HE2 TYR 58 6.174 -6.067 -15.682 336 HH TYR 58 HH TYR 58 5.258 -4.609 -12.793 337 H GLN 59 H GLN 59 10.638 -11.654 -13.685 338 HA GLN 59 HA GLN 59 9.937 -13.980 -12.087 339 HB2 GLN 59 HB2 GLN 59 8.896 -13.984 -14.460 340 HB3 GLN 59 HB3 GLN 59 10.529 -14.183 -15.062 341 HG2 GLN 59 HG2 GLN 59 9.578 -16.029 -12.868 342 HG3 GLN 59 HG3 GLN 59 8.988 -16.302 -14.495 343 HE21 GLN 59 HE21 GLN 59 10.324 -18.300 -13.619 344 HE22 GLN 59 HE22 GLN 59 11.946 -18.407 -14.218 345 H LYS 60 H LYS 60 11.753 -14.466 -10.935 346 HA LYS 60 HA LYS 60 14.331 -13.899 -12.198 347 HB2 LYS 60 HB2 LYS 60 13.855 -14.541 -9.284 348 HB3 LYS 60 HB3 LYS 60 15.250 -13.775 -10.016 349 HG2 LYS 60 HG2 LYS 60 14.175 -11.870 -9.255 350 HG3 LYS 60 HG3 LYS 60 13.411 -11.986 -10.828 351 HD2 LYS 60 HD2 LYS 60 11.385 -12.773 -9.952 352 HD3 LYS 60 HD3 LYS 60 12.145 -13.506 -8.554 353 HE2 LYS 60 HE2 LYS 60 12.417 -11.384 -7.448 354 HE3 LYS 60 HE3 LYS 60 12.107 -10.484 -8.920 355 HZ1 LYS 60 HZ1 LYS 60 10.266 -11.448 -7.050 356 HZ2 LYS 60 HZ2 LYS 60 10.003 -10.463 -8.326 357 HZ3 LYS 60 HZ3 LYS 60 9.915 -12.083 -8.513 358 H ASP 61 H ASP 61 16.101 -15.579 -11.269 359 HA ASP 61 HA ASP 61 15.345 -18.013 -12.457 360 HB2 ASP 61 HB2 ASP 61 17.803 -17.042 -10.951 361 HB3 ASP 61 HB3 ASP 61 17.679 -18.709 -11.476 362 HD2 ASP 61 HD2 ASP 61 17.164 -16.366 -14.539 363 H ASN 62 H ASN 62 13.783 -19.176 -11.239 364 HA ASN 62 HA ASN 62 14.419 -19.563 -8.426 365 HB2 ASN 62 HB2 ASN 62 11.845 -19.532 -10.021 366 HB3 ASN 62 HB3 ASN 62 11.901 -20.522 -8.576 367 HD21 ASN 62 HD21 ASN 62 11.206 -19.585 -6.826 368 HD22 ASN 62 HD22 ASN 62 11.290 -17.903 -6.423 369 H SER 63 H SER 63 13.448 -21.122 -11.536 370 HA SER 63 HA SER 63 13.704 -23.131 -12.318 371 HB2 SER 63 HB2 SER 63 16.028 -22.820 -11.101 372 HB3 SER 63 HB3 SER 63 15.403 -24.002 -9.968 373 HG SER 63 HG SER 63 16.649 -24.918 -11.785 374 H CYS 64 H CYS 64 11.615 -22.411 -10.267 375 HA CYS 64 HA CYS 64 11.163 -25.044 -9.083 376 HB2 CYS 64 HB2 CYS 64 11.141 -23.225 -7.469 377 HB3 CYS 64 HB3 CYS 64 9.960 -22.339 -8.413 378 HG CYS 64 HG CYS 64 8.365 -23.183 -6.781 379 H ASN 65 H ASN 65 9.807 -22.432 -11.164 380 HA ASN 65 HA ASN 65 7.563 -24.153 -11.775 381 HB2 ASN 65 HB2 ASN 65 7.462 -21.553 -11.264 382 HB3 ASN 65 HB3 ASN 65 8.017 -21.367 -12.916 383 HD21 ASN 65 HD21 ASN 65 6.276 -20.597 -13.907 384 HD22 ASN 65 HD22 ASN 65 4.734 -21.379 -14.018 385 H LEU 66 H LEU 66 6.924 -23.722 -14.356 386 HA LEU 66 HA LEU 66 9.267 -24.660 -15.794 387 HB2 LEU 66 HB2 LEU 66 6.539 -24.461 -16.991 388 HB3 LEU 66 HB3 LEU 66 7.820 -25.614 -17.305 389 HG LEU 66 HG LEU 66 6.305 -25.554 -14.689 390 HD11 LEU 66 HD11 LEU 66 4.490 -26.338 -15.691 391 HD12 LEU 66 HD12 LEU 66 5.302 -26.303 -17.274 392 HD13 LEU 66 HD13 LEU 66 5.429 -27.746 -16.240 393 HD21 LEU 66 HD21 LEU 66 8.303 -27.376 -15.965 394 HD22 LEU 66 HD22 LEU 66 8.155 -26.836 -14.276 395 HD23 LEU 66 HD23 LEU 66 7.050 -28.078 -14.913 396 H PHE 67 H PHE 67 6.554 -22.318 -16.423 397 HA PHE 67 HA PHE 67 8.462 -20.328 -17.207 398 HB2 PHE 67 HB2 PHE 67 7.849 -20.298 -19.539 399 HB3 PHE 67 HB3 PHE 67 8.012 -22.007 -19.189 400 HD1 PHE 67 HD1 PHE 67 5.876 -23.308 -18.618 401 HD2 PHE 67 HD2 PHE 67 5.838 -19.450 -20.384 402 HE1 PHE 67 HE1 PHE 67 3.528 -23.696 -19.416 403 HE2 PHE 67 HE2 PHE 67 3.490 -19.838 -21.182 404 HZ PHE 67 HZ PHE 67 2.363 -21.956 -20.688 405 H ASN 68 H ASN 68 7.655 -18.371 -16.600 406 HA ASN 68 HA ASN 68 4.909 -18.307 -15.794 407 HB2 ASN 68 HB2 ASN 68 5.511 -16.418 -14.538 408 HB3 ASN 68 HB3 ASN 68 7.071 -17.208 -14.656 409 HD21 ASN 68 HD21 ASN 68 8.490 -16.588 -16.433 410 HD22 ASN 68 HD22 ASN 68 8.504 -14.948 -16.990 411 H THR 69 H THR 69 3.323 -16.818 -16.712 412 HA THR 69 HA THR 69 3.737 -16.252 -19.488 413 HB THR 69 HB THR 69 1.396 -15.249 -17.849 414 HG1 THR 69 HG1 THR 69 1.651 -17.984 -18.767 415 HG21 THR 69 HG21 THR 69 0.437 -16.811 -19.902 416 HG22 THR 69 HG22 THR 69 0.733 -15.063 -20.062 417 HG23 THR 69 HG23 THR 69 1.956 -16.227 -20.623 418 H LEU 70 H LEU 70 4.685 -14.526 -20.353 419 HA LEU 70 HA LEU 70 5.409 -12.338 -18.682 420 HB2 LEU 70 HB2 LEU 70 7.014 -12.756 -20.234 421 HB3 LEU 70 HB3 LEU 70 5.869 -13.205 -21.483 422 HG LEU 70 HG LEU 70 5.293 -10.825 -21.816 423 HD11 LEU 70 HD11 LEU 70 6.715 -10.510 -19.332 424 HD12 LEU 70 HD12 LEU 70 7.448 -9.487 -20.591 425 HD13 LEU 70 HD13 LEU 70 5.713 -9.340 -20.224 426 HD21 LEU 70 HD21 LEU 70 7.934 -12.016 -22.311 427 HD22 LEU 70 HD22 LEU 70 6.802 -11.210 -23.424 428 HD23 LEU 70 HD23 LEU 70 7.900 -10.239 -22.414 429 H THR 71 H THR 71 2.630 -13.199 -20.593 430 HA THR 71 HA THR 71 1.728 -10.744 -21.467 431 HB THR 71 HB THR 71 0.843 -13.236 -21.717 432 HG1 THR 71 HG1 THR 71 -1.226 -12.155 -22.255 433 HG21 THR 71 HG21 THR 71 -0.914 -13.885 -20.283 434 HG22 THR 71 HG22 THR 71 0.208 -13.142 -19.119 435 HG23 THR 71 HG23 THR 71 -1.193 -12.221 -19.716 436 H GLU 72 H GLU 72 1.719 -12.126 -18.176 437 HA GLU 72 HA GLU 72 -0.079 -10.310 -17.106 438 HB2 GLU 72 HB2 GLU 72 1.054 -12.519 -16.148 439 HB3 GLU 72 HB3 GLU 72 2.224 -11.397 -15.482 440 HG2 GLU 72 HG2 GLU 72 0.570 -10.255 -14.178 441 HG3 GLU 72 HG3 GLU 72 -0.755 -10.929 -15.106 442 HE2 GLU 72 HE2 GLU 72 -0.403 -11.000 -12.466 443 H ALA 73 H ALA 73 3.547 -10.276 -17.270 444 HA ALA 73 HA ALA 73 3.852 -7.830 -15.950 445 HB1 ALA 73 HB1 ALA 73 5.712 -9.323 -16.156 446 HB2 ALA 73 HB2 ALA 73 5.556 -9.383 -17.928 447 HB3 ALA 73 HB3 ALA 73 6.112 -7.890 -17.135 448 H ARG 74 H ARG 74 3.724 -8.667 -19.482 449 HA ARG 74 HA ARG 74 4.015 -6.073 -20.349 450 HB2 ARG 74 HB2 ARG 74 4.208 -8.144 -21.774 451 HB3 ARG 74 HB3 ARG 74 2.471 -8.354 -21.685 452 HG2 ARG 74 HG2 ARG 74 2.227 -6.014 -22.697 453 HG3 ARG 74 HG3 ARG 74 3.961 -6.010 -22.950 454 HD2 ARG 74 HD2 ARG 74 2.280 -8.317 -23.989 455 HD3 ARG 74 HD3 ARG 74 2.379 -6.823 -24.900 456 HE ARG 74 HE ARG 74 5.013 -7.779 -24.104 457 HH11 ARG 74 HH22 ARG 74 2.454 -8.177 -26.487 458 HH12 ARG 74 HH21 ARG 74 3.515 -8.788 -27.712 459 HH21 ARG 74 HH12 ARG 74 6.413 -8.585 -25.720 460 HH22 ARG 74 HH11 ARG 74 5.782 -9.022 -27.273 461 H ASP 75 H ASP 75 1.213 -7.881 -19.122 462 HA ASP 75 HA ASP 75 -0.739 -6.184 -20.187 463 HB2 ASP 75 HB2 ASP 75 -0.602 -8.265 -18.008 464 HB3 ASP 75 HB3 ASP 75 -1.997 -7.206 -18.027 465 HD2 ASP 75 HD2 ASP 75 -1.460 -7.837 -21.398 466 H ALA 76 H ALA 76 1.257 -6.280 -17.207 467 HA ALA 76 HA ALA 76 -0.206 -4.363 -15.752 468 HB1 ALA 76 HB1 ALA 76 1.851 -6.116 -15.255 469 HB2 ALA 76 HB2 ALA 76 2.709 -4.557 -15.273 470 HB3 ALA 76 HB3 ALA 76 1.346 -4.810 -14.156 471 H ILE 77 H ILE 77 2.781 -4.160 -17.807 472 HA ILE 77 HA ILE 77 2.939 -1.342 -17.531 473 HB ILE 77 HB ILE 77 4.648 -1.535 -19.291 474 HG12 ILE 77 HG12 ILE 77 3.461 -4.254 -19.573 475 HG13 ILE 77 HG13 ILE 77 4.093 -3.167 -20.794 476 HG21 ILE 77 HG21 ILE 77 4.880 -3.574 -17.059 477 HG22 ILE 77 HG22 ILE 77 6.230 -2.882 -17.991 478 HG23 ILE 77 HG23 ILE 77 5.243 -1.835 -16.944 479 HD11 ILE 77 HD11 ILE 77 5.683 -4.901 -18.859 480 HD12 ILE 77 HD12 ILE 77 5.659 -4.987 -20.637 481 HD13 ILE 77 HD13 ILE 77 6.430 -3.604 -19.823 482 H LYS 78 H LYS 78 1.263 -3.597 -19.698 483 HA LYS 78 HA LYS 78 0.768 -1.735 -21.754 484 HB2 LYS 78 HB2 LYS 78 0.623 -4.040 -22.275 485 HB3 LYS 78 HB3 LYS 78 -0.474 -4.367 -20.949 486 HG2 LYS 78 HG2 LYS 78 -1.853 -4.311 -22.907 487 HG3 LYS 78 HG3 LYS 78 -2.155 -2.792 -22.087 488 HD2 LYS 78 HD2 LYS 78 -1.830 -2.124 -24.331 489 HD3 LYS 78 HD3 LYS 78 -0.269 -1.807 -23.601 490 HE2 LYS 78 HE2 LYS 78 0.543 -4.049 -24.418 491 HE3 LYS 78 HE3 LYS 78 -1.007 -4.309 -25.194 492 HZ1 LYS 78 HZ1 LYS 78 -0.209 -1.854 -26.038 493 HZ2 LYS 78 HZ2 LYS 78 1.164 -2.738 -26.066 494 HZ3 LYS 78 HZ3 LYS 78 -0.147 -3.239 -26.901 495 H ASP 79 H ASP 79 -0.921 -2.633 -18.714 496 HA ASP 79 HA ASP 79 -3.185 -1.078 -19.324 497 HB2 ASP 79 HB2 ASP 79 -3.640 -2.711 -17.717 498 HB3 ASP 79 HB3 ASP 79 -2.082 -2.529 -16.935 499 HD2 ASP 79 HD2 ASP 79 -4.745 0.332 -16.318 500 H ALA 80 H ALA 80 -0.211 -0.696 -17.277 501 HA ALA 80 HA ALA 80 -0.841 1.772 -16.166 502 HB1 ALA 80 HB1 ALA 80 1.226 1.564 -15.242 503 HB2 ALA 80 HB2 ALA 80 1.183 -0.067 -15.955 504 HB3 ALA 80 HB3 ALA 80 2.007 1.258 -16.812 505 H TYR 81 H TYR 81 1.023 0.937 -19.167 506 HA TYR 81 HA TYR 81 1.593 3.549 -19.913 507 HB2 TYR 81 HB2 TYR 81 1.125 0.849 -21.278 508 HB3 TYR 81 HB3 TYR 81 1.483 2.249 -22.269 509 HD1 TYR 81 HD2 TYR 81 2.900 1.268 -18.942 510 HD2 TYR 81 HD1 TYR 81 3.633 1.883 -23.112 511 HE1 TYR 81 HE2 TYR 81 5.388 0.905 -18.565 512 HE2 TYR 81 HE1 TYR 81 6.118 1.517 -22.721 513 HH TYR 81 HH TYR 81 7.334 0.075 -20.086 514 H GLU 82 H GLU 82 -1.233 1.432 -20.712 515 HA GLU 82 HA GLU 82 -2.377 3.384 -22.387 516 HB2 GLU 82 HB2 GLU 82 -2.983 1.122 -22.820 517 HB3 GLU 82 HB3 GLU 82 -3.365 0.803 -21.140 518 HG2 GLU 82 HG2 GLU 82 -4.930 2.939 -22.602 519 HG3 GLU 82 HG3 GLU 82 -5.303 1.256 -22.922 520 HE2 GLU 82 HE2 GLU 82 -6.080 0.185 -20.145 521 H SER 83 H SER 83 -2.294 2.824 -18.931 522 HA SER 83 HA SER 83 -4.711 4.232 -18.420 523 HB2 SER 83 HB2 SER 83 -4.160 3.924 -16.075 524 HB3 SER 83 HB3 SER 83 -3.800 2.432 -16.922 525 HG SER 83 HG SER 83 -2.094 4.140 -15.547 526 H TYR 84 H TYR 84 -1.207 4.921 -18.597 527 HA TYR 84 HA TYR 84 -1.729 7.683 -17.762 528 HB2 TYR 84 HB2 TYR 84 0.641 5.760 -17.980 529 HB3 TYR 84 HB3 TYR 84 0.959 7.483 -17.940 530 HD1 TYR 84 HD1 TYR 84 0.558 8.795 -15.907 531 HD2 TYR 84 HD2 TYR 84 -0.197 4.584 -16.003 532 HE1 TYR 84 HE1 TYR 84 0.449 8.748 -13.367 533 HE2 TYR 84 HE2 TYR 84 -0.303 4.552 -13.463 534 HH TYR 84 HH TYR 84 0.892 6.908 -11.581 535 H CYS 85 H CYS 85 -1.762 5.870 -20.549 536 HA CYS 85 HA CYS 85 -0.070 7.017 -22.316 537 HB2 CYS 85 HB2 CYS 85 -1.647 6.420 -24.061 538 HB3 CYS 85 HB3 CYS 85 -1.603 5.159 -22.845 539 HG CYS 85 HG CYS 85 -3.921 7.118 -23.848 540 H GLY 86 H GLY 86 0.089 9.016 -23.373 541 HA2 GLY 86 HA2 GLY 86 -0.650 11.055 -24.147 542 HA3 GLY 86 HA3 GLY 86 -2.132 10.893 -23.227 543 H ILE 87 H ILE 87 0.273 9.961 -21.099 544 HA ILE 87 HA ILE 87 0.640 12.723 -20.165 545 HB ILE 87 HB ILE 87 0.261 10.241 -18.487 546 HG12 ILE 87 HG12 ILE 87 -1.683 12.535 -18.693 547 HG13 ILE 87 HG13 ILE 87 -1.757 11.191 -19.815 548 HG21 ILE 87 HG21 ILE 87 0.637 11.479 -16.619 549 HG22 ILE 87 HG22 ILE 87 1.695 12.365 -17.744 550 HG23 ILE 87 HG23 ILE 87 0.073 12.993 -17.366 551 HD11 ILE 87 HD11 ILE 87 -1.469 10.306 -17.011 552 HD12 ILE 87 HD12 ILE 87 -2.944 11.259 -17.299 553 HD13 ILE 87 HD13 ILE 87 -2.636 9.788 -18.251 554 H ASP 88 H ASP 88 2.671 13.082 -21.067 555 HA ASP 88 HA ASP 88 4.685 11.113 -20.333 556 HB2 ASP 88 HB2 ASP 88 5.253 13.365 -22.251 557 HB3 ASP 88 HB3 ASP 88 5.901 11.736 -22.240 558 HD2 ASP 88 HD2 ASP 88 2.143 11.879 -23.536 559 H ASP 89 H ASP 89 3.423 14.330 -19.826 560 HA ASP 89 HA ASP 89 5.481 14.842 -17.925 561 HB2 ASP 89 HB2 ASP 89 5.130 16.526 -20.430 562 HB3 ASP 89 HB3 ASP 89 5.742 17.249 -18.956 563 HD2 ASP 89 HD2 ASP 89 8.332 16.659 -18.713 564 H CYS 90 H CYS 90 4.782 16.583 -16.422 565 HA CYS 90 HA CYS 90 1.946 16.801 -16.311 566 HB2 CYS 90 HB2 CYS 90 3.791 18.360 -14.519 567 HB3 CYS 90 HB3 CYS 90 2.232 17.646 -14.158 568 HA PRO 91 HA PRO 91 1.736 20.631 -18.390 569 HB2 PRO 91 HB2 PRO 91 -0.760 21.455 -17.640 570 HB3 PRO 91 HB3 PRO 91 -0.479 20.300 -18.927 571 HG2 PRO 91 HG2 PRO 91 -1.463 19.814 -16.182 572 HG3 PRO 91 HG3 PRO 91 -1.576 18.775 -17.589 573 HD2 PRO 91 HD2 PRO 91 0.243 18.493 -15.389 574 HD3 PRO 91 HD3 PRO 91 0.206 17.524 -16.849 575 H GLN 92 H GLN 92 1.189 20.503 -14.971 576 HA GLN 92 HA GLN 92 1.465 23.320 -14.716 577 HB2 GLN 92 HB2 GLN 92 1.632 21.187 -12.544 578 HB3 GLN 92 HB3 GLN 92 1.321 22.895 -12.306 579 HG2 GLN 92 HG2 GLN 92 -0.481 20.895 -13.743 580 HG3 GLN 92 HG3 GLN 92 -0.803 21.684 -12.212 581 HE21 GLN 92 HE21 GLN 92 -1.247 23.907 -12.140 582 HE22 GLN 92 HE22 GLN 92 -1.831 24.779 -13.518 583 H CYS 93 H CYS 93 3.498 20.408 -13.976 584 HA CYS 93 HA CYS 93 5.653 21.748 -12.918 585 HB2 CYS 93 HB2 CYS 93 5.610 19.175 -14.528 586 HB3 CYS 93 HB3 CYS 93 6.975 19.740 -13.586 587 H SER 94 H SER 94 4.543 21.268 -16.276 588 HA SER 94 HA SER 94 7.003 22.298 -17.328 589 HB2 SER 94 HB2 SER 94 6.082 20.647 -18.727 590 HB3 SER 94 HB3 SER 94 4.439 21.207 -18.489 591 HG SER 94 HG SER 94 6.286 22.978 -19.761 592 H LYS 95 H LYS 95 3.751 23.386 -16.444 593 HA LYS 95 HA LYS 95 3.993 25.846 -17.929 594 HB2 LYS 95 HB2 LYS 95 1.817 24.818 -17.779 595 HB3 LYS 95 HB3 LYS 95 1.895 24.764 -16.030 596 HG2 LYS 95 HG2 LYS 95 0.512 26.680 -16.894 597 HG3 LYS 95 HG3 LYS 95 1.837 27.198 -15.871 598 HD2 LYS 95 HD2 LYS 95 3.180 27.850 -17.795 599 HD3 LYS 95 HD3 LYS 95 2.066 27.085 -18.911 600 HE2 LYS 95 HE2 LYS 95 1.568 29.436 -18.999 601 HE3 LYS 95 HE3 LYS 95 0.264 28.708 -18.082 602 HZ1 LYS 95 HZ1 LYS 95 2.611 30.059 -16.942 603 HZ2 LYS 95 HZ2 LYS 95 1.086 30.642 -16.979 604 HZ3 LYS 95 HZ3 LYS 95 1.439 29.336 -16.065 605 H TYR 96 H TYR 96 5.374 24.606 -15.131 606 HA TYR 96 HA TYR 96 5.135 26.959 -13.504 607 HB2 TYR 96 HB2 TYR 96 5.500 24.397 -12.920 608 HB3 TYR 96 HB3 TYR 96 7.165 24.655 -13.401 609 HD1 TYR 96 HD1 TYR 96 4.560 25.871 -11.016 610 HD2 TYR 96 HD2 TYR 96 8.737 25.510 -11.868 611 HE1 TYR 96 HE1 TYR 96 5.116 26.693 -8.676 612 HE2 TYR 96 HE2 TYR 96 9.279 26.334 -9.525 613 HH TYR 96 HH TYR 96 6.861 27.693 -7.489 614 H ILE 97 H ILE 97 7.517 27.619 -12.516 615 HA ILE 97 HA ILE 97 8.747 28.964 -14.715 616 HB ILE 97 HB ILE 97 8.306 29.752 -12.283 617 HG12 ILE 97 HG12 ILE 97 11.042 30.481 -13.262 618 HG13 ILE 97 HG13 ILE 97 9.668 30.797 -14.303 619 HG21 ILE 97 HG21 ILE 97 9.832 27.698 -11.533 620 HG22 ILE 97 HG22 ILE 97 11.111 28.921 -11.727 621 HG23 ILE 97 HG23 ILE 97 9.754 29.221 -10.614 622 HD11 ILE 97 HD11 ILE 97 10.538 32.270 -11.972 623 HD12 ILE 97 HD12 ILE 97 9.220 32.660 -13.103 624 HD13 ILE 97 HD13 ILE 97 8.899 31.641 -11.680 625 H ASP 98 H ASP 98 10.629 28.483 -15.782 626 HA ASP 98 HA ASP 98 11.746 25.904 -15.124 627 HB2 ASP 98 HB2 ASP 98 11.696 27.712 -17.524 628 HB3 ASP 98 HB3 ASP 98 13.106 26.686 -17.354 629 HD2 ASP 98 HD2 ASP 98 10.563 26.792 -18.997 630 H ASP 99 H ASP 99 13.325 26.144 -13.498 631 HA ASP 99 HA ASP 99 14.848 28.502 -13.297 632 HB2 ASP 99 HB2 ASP 99 15.749 25.920 -12.031 633 HB3 ASP 99 HB3 ASP 99 15.738 27.535 -11.350 634 HD2 ASP 99 HD2 ASP 99 14.552 24.786 -10.866 Start of MODEL 20 1 H GLU 14 H GLU 14 2.435 3.000 -4.615 2 HA GLU 14 HA GLU 14 3.243 1.786 -2.324 3 HB2 GLU 14 HB2 GLU 14 0.924 2.272 -1.487 4 HB3 GLU 14 HB3 GLU 14 1.668 3.633 -2.303 5 HG2 GLU 14 HG2 GLU 14 0.306 3.410 -4.221 6 HG3 GLU 14 HG3 GLU 14 -0.027 1.717 -3.919 7 HE2 GLU 14 HE2 GLU 14 -2.071 1.620 -3.547 8 H ASP 15 H ASP 15 2.556 0.083 -4.988 9 HA ASP 15 HA ASP 15 1.217 -2.026 -3.482 10 HB2 ASP 15 HB2 ASP 15 0.143 -0.958 -5.645 11 HB3 ASP 15 HB3 ASP 15 1.346 -1.890 -6.513 12 HD2 ASP 15 HD2 ASP 15 -1.067 -2.161 -4.186 13 H GLN 16 H GLN 16 1.884 -4.317 -4.422 14 HA GLN 16 HA GLN 16 4.681 -4.464 -4.293 15 HB2 GLN 16 HB2 GLN 16 2.419 -6.415 -4.669 16 HB3 GLN 16 HB3 GLN 16 4.039 -6.960 -5.054 17 HG2 GLN 16 HG2 GLN 16 4.832 -6.531 -2.817 18 HG3 GLN 16 HG3 GLN 16 3.420 -5.576 -2.414 19 HE21 GLN 16 HE21 GLN 16 3.546 -7.139 -0.576 20 HE22 GLN 16 HE22 GLN 16 2.657 -8.620 -0.699 21 H GLU 17 H GLU 17 2.266 -4.559 -6.938 22 HA GLU 17 HA GLU 17 4.071 -5.449 -8.885 23 HB2 GLU 17 HB2 GLU 17 1.699 -5.712 -9.257 24 HB3 GLU 17 HB3 GLU 17 1.399 -4.000 -9.031 25 HG2 GLU 17 HG2 GLU 17 2.366 -3.415 -11.120 26 HG3 GLU 17 HG3 GLU 17 3.283 -4.905 -11.227 27 HE2 GLU 17 HE2 GLU 17 0.386 -3.423 -11.756 28 H GLN 18 H GLN 18 2.882 -2.180 -7.884 29 HA GLN 18 HA GLN 18 4.144 -0.744 -9.845 30 HB2 GLN 18 HB2 GLN 18 2.450 0.137 -8.224 31 HB3 GLN 18 HB3 GLN 18 3.652 0.084 -6.950 32 HG2 GLN 18 HG2 GLN 18 5.116 1.605 -8.430 33 HG3 GLN 18 HG3 GLN 18 3.719 1.800 -9.471 34 HE21 GLN 18 HE21 GLN 18 1.626 2.289 -8.213 35 HE22 GLN 18 HE22 GLN 18 1.721 3.541 -7.020 36 H TRP 19 H TRP 19 5.415 -2.233 -6.876 37 HA TRP 19 HA TRP 19 7.786 -0.783 -6.662 38 HB2 TRP 19 HB2 TRP 19 7.274 -2.034 -4.807 39 HB3 TRP 19 HB3 TRP 19 6.814 -3.448 -5.734 40 HD1 TRP 19 HD1 TRP 19 10.213 -1.523 -5.347 41 HE1 TRP 19 HE1 TRP 19 12.190 -3.227 -4.961 42 HE3 TRP 19 HE3 TRP 19 7.334 -5.710 -5.523 43 HZ2 TRP 19 HZ2 TRP 19 12.325 -6.072 -4.776 44 HZ3 TRP 19 HZ3 TRP 19 8.467 -7.911 -5.231 45 HH2 TRP 19 HH2 TRP 19 10.874 -8.133 -4.868 46 H ALA 20 H ALA 20 6.709 -3.454 -8.771 47 HA ALA 20 HA ALA 20 9.327 -4.083 -9.703 48 HB1 ALA 20 HB1 ALA 20 6.586 -5.021 -10.013 49 HB2 ALA 20 HB2 ALA 20 7.419 -4.944 -11.584 50 HB3 ALA 20 HB3 ALA 20 8.116 -5.898 -10.253 51 H MET 21 H MET 21 6.536 -2.115 -10.893 52 HA MET 21 HA MET 21 7.537 -1.484 -13.343 53 HB2 MET 21 HB2 MET 21 5.769 -0.050 -11.324 54 HB3 MET 21 HB3 MET 21 6.194 0.776 -12.810 55 HG2 MET 21 HG2 MET 21 5.202 -2.052 -13.076 56 HG3 MET 21 HG3 MET 21 4.022 -0.846 -12.604 57 HE1 MET 21 HE1 MET 21 4.145 1.412 -13.465 58 HE2 MET 21 HE2 MET 21 5.001 1.950 -14.930 59 HE3 MET 21 HE3 MET 21 3.325 1.363 -15.044 60 H GLN 22 H GLN 22 8.335 -0.106 -10.135 61 HA GLN 22 HA GLN 22 9.467 2.206 -10.659 62 HB2 GLN 22 HB2 GLN 22 10.334 -0.059 -8.864 63 HB3 GLN 22 HB3 GLN 22 11.354 1.361 -8.971 64 HG2 GLN 22 HG2 GLN 22 9.616 2.814 -8.171 65 HG3 GLN 22 HG3 GLN 22 8.368 1.618 -8.456 66 HE21 GLN 22 HE21 GLN 22 11.553 1.025 -7.064 67 HE22 GLN 22 HE22 GLN 22 11.034 0.568 -5.476 68 H THR 23 H THR 23 11.642 -0.705 -10.586 69 HA THR 23 HA THR 23 13.673 0.517 -12.052 70 HB THR 23 HB THR 23 14.114 -1.416 -10.652 71 HG1 THR 23 HG1 THR 23 15.468 -2.024 -12.291 72 HG21 THR 23 HG21 THR 23 11.970 -2.608 -10.698 73 HG22 THR 23 HG22 THR 23 12.088 -2.833 -12.460 74 HG23 THR 23 HG23 THR 23 13.209 -3.691 -11.376 75 H LEU 24 H LEU 24 10.877 -1.479 -13.119 76 HA LEU 24 HA LEU 24 11.488 -2.028 -15.656 77 HB2 LEU 24 HB2 LEU 24 9.343 -2.422 -14.379 78 HB3 LEU 24 HB3 LEU 24 8.849 -0.809 -14.854 79 HG LEU 24 HG LEU 24 9.560 -1.926 -17.273 80 HD11 LEU 24 HD11 LEU 24 8.698 -4.125 -17.448 81 HD12 LEU 24 HD12 LEU 24 9.807 -4.128 -16.055 82 HD13 LEU 24 HD13 LEU 24 8.047 -4.084 -15.792 83 HD21 LEU 24 HD21 LEU 24 7.596 -0.956 -17.628 84 HD22 LEU 24 HD22 LEU 24 6.814 -2.421 -16.988 85 HD23 LEU 24 HD23 LEU 24 7.169 -1.056 -15.903 86 H MET 25 H MET 25 9.556 0.975 -15.063 87 HA MET 25 HA MET 25 10.342 2.102 -17.460 88 HB2 MET 25 HB2 MET 25 9.510 4.274 -16.195 89 HB3 MET 25 HB3 MET 25 8.361 2.981 -16.473 90 HG2 MET 25 HG2 MET 25 8.416 2.258 -14.219 91 HG3 MET 25 HG3 MET 25 9.996 2.956 -13.923 92 HE1 MET 25 HE1 MET 25 6.409 4.127 -15.213 93 HE2 MET 25 HE2 MET 25 6.608 5.876 -14.946 94 HE3 MET 25 HE3 MET 25 7.680 5.021 -16.081 95 H GLY 26 H GLY 26 11.902 2.001 -14.299 96 HA2 GLY 26 HA2 GLY 26 13.492 4.283 -14.397 97 HA3 GLY 26 HA3 GLY 26 13.871 2.791 -13.560 98 H SER 27 H SER 27 13.622 1.286 -16.269 99 HA SER 27 HA SER 27 16.337 1.310 -16.831 100 HB2 SER 27 HB2 SER 27 14.510 -0.511 -17.262 101 HB3 SER 27 HB3 SER 27 14.213 0.334 -18.769 102 HG SER 27 HG SER 27 16.370 -1.295 -18.019 103 H GLY 28 H GLY 28 13.936 3.582 -17.598 104 HA2 GLY 28 HA2 GLY 28 14.454 5.579 -18.704 105 HA3 GLY 28 HA3 GLY 28 15.634 4.742 -19.694 106 H VAL 29 H VAL 29 12.726 2.911 -19.279 107 HA VAL 29 HA VAL 29 12.103 3.198 -22.045 108 HB VAL 29 HB VAL 29 10.795 1.733 -19.749 109 HG11 VAL 29 HG11 VAL 29 9.071 1.127 -21.043 110 HG12 VAL 29 HG12 VAL 29 9.561 2.438 -22.142 111 HG13 VAL 29 HG13 VAL 29 10.133 0.776 -22.428 112 HG21 VAL 29 HG21 VAL 29 12.087 -0.058 -20.256 113 HG22 VAL 29 HG22 VAL 29 12.063 0.281 -22.003 114 HG23 VAL 29 HG23 VAL 29 13.170 1.179 -20.937 115 H LEU 30 H LEU 30 10.563 4.167 -18.916 116 HA LEU 30 HA LEU 30 8.743 5.848 -20.487 117 HB2 LEU 30 HB2 LEU 30 8.515 4.402 -17.889 118 HB3 LEU 30 HB3 LEU 30 7.633 5.904 -18.081 119 HG LEU 30 HG LEU 30 7.397 3.642 -20.072 120 HD11 LEU 30 HD11 LEU 30 5.906 4.044 -17.477 121 HD12 LEU 30 HD12 LEU 30 5.234 3.113 -18.836 122 HD13 LEU 30 HD13 LEU 30 6.752 2.593 -18.066 123 HD21 LEU 30 HD21 LEU 30 5.937 4.934 -21.143 124 HD22 LEU 30 HD22 LEU 30 5.067 5.325 -19.640 125 HD23 LEU 30 HD23 LEU 30 6.494 6.276 -20.115 126 H ALA 31 H ALA 31 8.049 7.859 -18.917 127 HA ALA 31 HA ALA 31 10.612 9.070 -18.131 128 HB1 ALA 31 HB1 ALA 31 9.063 11.208 -18.675 129 HB2 ALA 31 HB2 ALA 31 10.035 10.387 -19.920 130 HB3 ALA 31 HB3 ALA 31 8.298 10.027 -19.765 131 H ARG 32 H ARG 32 10.773 9.850 -16.064 132 HA ARG 32 HA ARG 32 8.266 9.965 -14.588 133 HB2 ARG 32 HB2 ARG 32 9.499 9.149 -12.580 134 HB3 ARG 32 HB3 ARG 32 9.573 7.979 -13.883 135 HG2 ARG 32 HG2 ARG 32 11.824 8.005 -13.425 136 HG3 ARG 32 HG3 ARG 32 11.817 9.413 -14.468 137 HD2 ARG 32 HD2 ARG 32 12.857 10.367 -12.631 138 HD3 ARG 32 HD3 ARG 32 11.197 10.672 -12.162 139 HE ARG 32 HE ARG 32 11.646 8.159 -11.125 140 HH11 ARG 32 HH22 ARG 32 13.404 11.198 -10.891 141 HH12 ARG 32 HH21 ARG 32 14.047 10.853 -9.320 142 HH21 ARG 32 HH12 ARG 32 12.494 7.703 -9.053 143 HH22 ARG 32 HH11 ARG 32 13.525 8.851 -8.267 144 H CYS 33 H CYS 33 8.152 11.640 -12.922 145 HA CYS 33 HA CYS 33 9.914 13.850 -13.528 146 HB2 CYS 33 HB2 CYS 33 7.252 13.556 -12.180 147 HB3 CYS 33 HB3 CYS 33 8.243 14.941 -11.769 148 H ARG 34 H ARG 34 11.524 14.569 -12.125 149 HA ARG 34 HA ARG 34 12.486 12.879 -10.220 150 HB2 ARG 34 HB2 ARG 34 13.957 14.552 -11.109 151 HB3 ARG 34 HB3 ARG 34 12.856 15.858 -10.719 152 HG2 ARG 34 HG2 ARG 34 14.759 15.822 -9.136 153 HG3 ARG 34 HG3 ARG 34 13.252 15.512 -8.296 154 HD2 ARG 34 HD2 ARG 34 14.649 13.828 -7.421 155 HD3 ARG 34 HD3 ARG 34 13.807 12.968 -8.695 156 HE ARG 34 HE ARG 34 15.848 12.705 -9.788 157 HH11 ARG 34 HH22 ARG 34 16.078 15.491 -7.650 158 HH12 ARG 34 HH21 ARG 34 17.756 15.767 -7.980 159 HH21 ARG 34 HH12 ARG 34 18.062 13.068 -10.224 160 HH22 ARG 34 HH11 ARG 34 18.892 14.379 -9.454 161 H ILE 35 H ILE 35 9.953 15.340 -10.035 162 HA ILE 35 HA ILE 35 9.994 15.312 -7.129 163 HB ILE 35 HB ILE 35 9.720 17.456 -7.985 164 HG12 ILE 35 HG12 ILE 35 6.980 16.376 -7.269 165 HG13 ILE 35 HG13 ILE 35 8.185 17.006 -6.164 166 HG21 ILE 35 HG21 ILE 35 7.578 17.726 -9.619 167 HG22 ILE 35 HG22 ILE 35 9.251 17.509 -10.186 168 HG23 ILE 35 HG23 ILE 35 8.153 16.111 -10.101 169 HD11 ILE 35 HD11 ILE 35 7.837 19.027 -8.138 170 HD12 ILE 35 HD12 ILE 35 6.204 18.456 -7.717 171 HD13 ILE 35 HD13 ILE 35 7.289 19.065 -6.444 172 H HIS 36 H HIS 36 8.531 13.685 -9.831 173 HA HIS 36 HA HIS 36 6.506 12.608 -8.005 174 HB2 HIS 36 HB2 HIS 36 6.169 12.402 -10.965 175 HB3 HIS 36 HB3 HIS 36 4.959 12.501 -9.701 176 HD1 HIS 36 HD1 HIS 36 5.817 15.147 -8.316 177 HD2 HIS 36 HD2 HIS 36 5.586 14.619 -12.471 178 HE1 HIS 36 HE1 HIS 36 5.524 17.476 -9.318 179 H ASN 37 H ASN 37 7.363 10.738 -7.201 180 HA ASN 37 HA ASN 37 8.921 9.118 -9.016 181 HB2 ASN 37 HB2 ASN 37 8.520 9.224 -6.011 182 HB3 ASN 37 HB3 ASN 37 9.090 7.727 -6.722 183 HD21 ASN 37 HD21 ASN 37 9.692 11.034 -7.825 184 HD22 ASN 37 HD22 ASN 37 11.409 11.046 -7.593 185 H ASP 38 H ASP 38 5.792 9.377 -7.403 186 HA ASP 38 HA ASP 38 5.207 6.594 -7.920 187 HB2 ASP 38 HB2 ASP 38 3.929 8.819 -6.328 188 HB3 ASP 38 HB3 ASP 38 2.900 7.512 -6.878 189 HD2 ASP 38 HD2 ASP 38 2.973 7.827 -4.503 190 H VAL 39 H VAL 39 5.573 8.835 -10.010 191 HA VAL 39 HA VAL 39 2.905 8.613 -11.224 192 HB VAL 39 HB VAL 39 4.848 10.918 -11.160 193 HG11 VAL 39 HG11 VAL 39 2.693 11.782 -12.664 194 HG12 VAL 39 HG12 VAL 39 4.298 11.342 -13.294 195 HG13 VAL 39 HG13 VAL 39 2.985 10.141 -13.288 196 HG21 VAL 39 HG21 VAL 39 2.830 12.165 -10.400 197 HG22 VAL 39 HG22 VAL 39 1.923 10.634 -10.396 198 HG23 VAL 39 HG23 VAL 39 3.304 10.853 -9.295 199 H ILE 40 H ILE 40 2.838 8.121 -13.456 200 HA ILE 40 HA ILE 40 5.452 7.469 -14.622 201 HB ILE 40 HB ILE 40 4.828 5.349 -14.256 202 HG12 ILE 40 HG12 ILE 40 3.170 6.025 -16.702 203 HG13 ILE 40 HG13 ILE 40 4.854 5.543 -16.674 204 HG21 ILE 40 HG21 ILE 40 2.376 4.623 -14.166 205 HG22 ILE 40 HG22 ILE 40 2.979 5.657 -12.848 206 HG23 ILE 40 HG23 ILE 40 1.988 6.360 -14.149 207 HD11 ILE 40 HD11 ILE 40 3.690 3.476 -15.254 208 HD12 ILE 40 HD12 ILE 40 2.410 3.881 -16.423 209 HD13 ILE 40 HD13 ILE 40 4.034 3.435 -17.000 210 H LEU 41 H LEU 41 5.818 8.657 -16.409 211 HA LEU 41 HA LEU 41 3.448 9.626 -17.846 212 HB2 LEU 41 HB2 LEU 41 6.151 10.819 -17.321 213 HB3 LEU 41 HB3 LEU 41 5.215 11.322 -18.714 214 HG LEU 41 HG LEU 41 3.894 11.358 -16.026 215 HD11 LEU 41 HD11 LEU 41 5.032 13.089 -15.158 216 HD12 LEU 41 HD12 LEU 41 6.345 12.518 -16.215 217 HD13 LEU 41 HD13 LEU 41 5.294 13.854 -16.744 218 HD21 LEU 41 HD21 LEU 41 3.673 13.475 -18.137 219 HD22 LEU 41 HD22 LEU 41 2.865 11.907 -18.373 220 HD23 LEU 41 HD23 LEU 41 2.469 12.907 -16.955 221 H ASP 42 H ASP 42 3.226 9.197 -20.026 222 HA ASP 42 HA ASP 42 4.632 7.013 -21.001 223 HB2 ASP 42 HB2 ASP 42 2.290 8.137 -21.646 224 HB3 ASP 42 HB3 ASP 42 3.256 8.984 -22.838 225 HD2 ASP 42 HD2 ASP 42 2.812 5.320 -22.159 226 H SER 43 H SER 43 6.666 6.975 -21.976 227 HA SER 43 HA SER 43 7.762 9.541 -22.761 228 HB2 SER 43 HB2 SER 43 8.979 7.983 -21.141 229 HB3 SER 43 HB3 SER 43 9.210 6.874 -22.478 230 HG SER 43 HG SER 43 11.026 8.379 -22.076 231 H GLY 44 H GLY 44 6.635 6.428 -23.986 232 HA2 GLY 44 HA2 GLY 44 6.199 5.786 -26.110 233 HA3 GLY 44 HA3 GLY 44 6.739 7.350 -26.689 234 H ASN 45 H ASN 45 8.949 5.658 -24.555 235 HA ASN 45 HA ASN 45 10.810 5.468 -26.693 236 HB2 ASN 45 HB2 ASN 45 11.184 5.992 -24.106 237 HB3 ASN 45 HB3 ASN 45 11.226 4.248 -23.939 238 HD21 ASN 45 HD21 ASN 45 13.073 3.251 -24.223 239 HD22 ASN 45 HD22 ASN 45 14.484 3.869 -25.014 240 H ASP 46 H ASP 46 12.242 3.194 -26.478 241 HA ASP 46 HA ASP 46 10.699 1.260 -27.615 242 HB2 ASP 46 HB2 ASP 46 13.340 1.111 -26.102 243 HB3 ASP 46 HB3 ASP 46 12.660 -0.292 -26.903 244 HD2 ASP 46 HD2 ASP 46 14.546 0.210 -29.308 245 H ALA 47 H ALA 47 8.926 0.318 -26.558 246 HA ALA 47 HA ALA 47 8.831 0.030 -23.745 247 HB1 ALA 47 HB1 ALA 47 6.781 0.348 -24.907 248 HB2 ALA 47 HB2 ALA 47 7.145 -0.949 -26.070 249 HB3 ALA 47 HB3 ALA 47 6.756 -1.352 -24.380 250 H SER 48 H SER 48 10.476 -1.689 -26.201 251 HA SER 48 HA SER 48 10.131 -4.291 -25.284 252 HB2 SER 48 HB2 SER 48 12.004 -4.845 -26.699 253 HB3 SER 48 HB3 SER 48 11.097 -3.586 -27.512 254 HG SER 48 HG SER 48 13.604 -3.366 -26.108 255 H SER 49 H SER 49 12.718 -1.812 -24.669 256 HA SER 49 HA SER 49 14.307 -3.313 -23.063 257 HB2 SER 49 HB2 SER 49 13.900 -0.480 -22.209 258 HB3 SER 49 HB3 SER 49 15.385 -1.328 -22.591 259 HG SER 49 HG SER 49 13.805 0.260 -24.214 260 H ALA 50 H ALA 50 11.307 -1.486 -22.258 261 HA ALA 50 HA ALA 50 11.504 -1.874 -19.468 262 HB1 ALA 50 HB1 ALA 50 8.845 -1.486 -19.940 263 HB2 ALA 50 HB2 ALA 50 10.046 -0.173 -19.887 264 HB3 ALA 50 HB3 ALA 50 9.540 -0.854 -21.452 265 H TYR 51 H TYR 51 9.681 -3.565 -22.110 266 HA TYR 51 HA TYR 51 8.410 -5.428 -20.511 267 HB2 TYR 51 HB2 TYR 51 9.521 -5.266 -23.357 268 HB3 TYR 51 HB3 TYR 51 8.772 -6.761 -22.832 269 HD1 TYR 51 HD2 TYR 51 6.513 -5.752 -21.181 270 HD2 TYR 51 HD1 TYR 51 8.039 -4.371 -24.932 271 HE1 TYR 51 HE2 TYR 51 4.227 -4.807 -21.771 272 HE2 TYR 51 HE1 TYR 51 5.748 -3.431 -25.509 273 HH TYR 51 HH TYR 51 3.754 -2.969 -24.761 274 H LYS 52 H LYS 52 11.766 -5.307 -21.731 275 HA LYS 52 HA LYS 52 12.325 -8.025 -21.144 276 HB2 LYS 52 HB2 LYS 52 13.844 -5.617 -22.019 277 HB3 LYS 52 HB3 LYS 52 14.762 -6.880 -21.226 278 HG2 LYS 52 HG2 LYS 52 14.805 -7.461 -23.543 279 HG3 LYS 52 HG3 LYS 52 13.628 -8.548 -22.833 280 HD2 LYS 52 HD2 LYS 52 11.828 -6.810 -23.497 281 HD3 LYS 52 HD3 LYS 52 13.073 -6.020 -24.442 282 HE2 LYS 52 HE2 LYS 52 11.832 -8.751 -24.850 283 HE3 LYS 52 HE3 LYS 52 12.056 -7.463 -26.017 284 HZ1 LYS 52 HZ1 LYS 52 14.460 -7.862 -25.818 285 HZ2 LYS 52 HZ2 LYS 52 14.161 -9.157 -24.868 286 HZ3 LYS 52 HZ3 LYS 52 13.646 -9.144 -26.418 287 H LEU 53 H LEU 53 12.939 -4.880 -19.453 288 HA LEU 53 HA LEU 53 14.196 -6.076 -17.243 289 HB2 LEU 53 HB2 LEU 53 14.424 -3.721 -17.937 290 HB3 LEU 53 HB3 LEU 53 12.762 -3.426 -17.465 291 HG LEU 53 HG LEU 53 14.477 -2.656 -15.820 292 HD11 LEU 53 HD11 LEU 53 12.015 -3.931 -15.375 293 HD12 LEU 53 HD12 LEU 53 13.113 -4.546 -14.117 294 HD13 LEU 53 HD13 LEU 53 12.865 -2.794 -14.302 295 HD21 LEU 53 HD21 LEU 53 15.992 -3.993 -14.824 296 HD22 LEU 53 HD22 LEU 53 14.891 -5.391 -14.768 297 HD23 LEU 53 HD23 LEU 53 15.753 -4.996 -16.275 298 H GLY 54 H GLY 54 10.824 -5.651 -18.211 299 HA2 GLY 54 HA2 GLY 54 9.728 -6.055 -15.592 300 HA3 GLY 54 HA3 GLY 54 8.877 -6.057 -17.124 301 H THR 55 H THR 55 10.285 -8.084 -18.546 302 HA THR 55 HA THR 55 9.035 -10.383 -17.508 303 HB THR 55 HB THR 55 10.547 -11.420 -19.400 304 HG1 THR 55 HG1 THR 55 12.010 -9.917 -20.101 305 HG21 THR 55 HG21 THR 55 8.649 -11.016 -20.607 306 HG22 THR 55 HG22 THR 55 8.226 -9.648 -19.549 307 HG23 THR 55 HG23 THR 55 9.285 -9.391 -20.957 308 H TYR 56 H TYR 56 12.328 -9.051 -17.184 309 HA TYR 56 HA TYR 56 13.406 -11.442 -16.084 310 HB2 TYR 56 HB2 TYR 56 14.466 -9.288 -17.232 311 HB3 TYR 56 HB3 TYR 56 14.281 -8.528 -15.664 312 HD1 TYR 56 HD2 TYR 56 16.003 -11.257 -17.491 313 HD2 TYR 56 HD1 TYR 56 15.793 -9.000 -13.863 314 HE1 TYR 56 HE2 TYR 56 18.233 -12.227 -16.751 315 HE2 TYR 56 HE1 TYR 56 18.024 -9.977 -13.135 316 HH TYR 56 HH TYR 56 19.945 -10.958 -14.059 317 H LEU 57 H LEU 57 12.347 -8.264 -14.673 318 HA LEU 57 HA LEU 57 12.878 -8.969 -12.033 319 HB2 LEU 57 HB2 LEU 57 12.334 -6.697 -13.190 320 HB3 LEU 57 HB3 LEU 57 10.670 -7.100 -12.819 321 HG LEU 57 HG LEU 57 11.730 -7.501 -10.382 322 HD11 LEU 57 HD11 LEU 57 13.976 -6.996 -10.725 323 HD12 LEU 57 HD12 LEU 57 13.610 -5.614 -11.786 324 HD13 LEU 57 HD13 LEU 57 13.315 -5.494 -10.034 325 HD21 LEU 57 HD21 LEU 57 10.526 -5.688 -9.755 326 HD22 LEU 57 HD22 LEU 57 11.229 -4.640 -11.011 327 HD23 LEU 57 HD23 LEU 57 9.945 -5.799 -11.434 328 H TYR 58 H TYR 58 9.844 -9.209 -13.999 329 HA TYR 58 HA TYR 58 8.270 -10.263 -11.949 330 HB2 TYR 58 HB2 TYR 58 8.373 -10.428 -15.015 331 HB3 TYR 58 HB3 TYR 58 7.063 -11.184 -14.130 332 HD1 TYR 58 HD2 TYR 58 6.622 -9.122 -11.983 333 HD2 TYR 58 HD1 TYR 58 7.286 -8.702 -16.188 334 HE1 TYR 58 HE2 TYR 58 5.363 -6.913 -11.968 335 HE2 TYR 58 HE1 TYR 58 6.025 -6.494 -16.159 336 HH TYR 58 HH TYR 58 4.109 -5.548 -13.563 337 H GLN 59 H GLN 59 10.429 -11.820 -14.378 338 HA GLN 59 HA GLN 59 9.594 -14.417 -13.654 339 HB2 GLN 59 HB2 GLN 59 11.905 -13.317 -15.290 340 HB3 GLN 59 HB3 GLN 59 11.750 -15.034 -14.978 341 HG2 GLN 59 HG2 GLN 59 9.340 -13.539 -16.023 342 HG3 GLN 59 HG3 GLN 59 10.636 -13.916 -17.140 343 HE21 GLN 59 HE21 GLN 59 7.869 -14.899 -16.934 344 HE22 GLN 59 HE22 GLN 59 7.952 -16.627 -16.850 345 H LYS 60 H LYS 60 11.578 -16.059 -13.079 346 HA LYS 60 HA LYS 60 12.770 -16.822 -11.376 347 HB2 LYS 60 HB2 LYS 60 14.101 -14.267 -12.153 348 HB3 LYS 60 HB3 LYS 60 14.643 -15.034 -10.674 349 HG2 LYS 60 HG2 LYS 60 14.351 -16.589 -13.278 350 HG3 LYS 60 HG3 LYS 60 15.826 -15.736 -12.871 351 HD2 LYS 60 HD2 LYS 60 15.472 -17.092 -10.538 352 HD3 LYS 60 HD3 LYS 60 14.643 -18.195 -11.617 353 HE2 LYS 60 HE2 LYS 60 17.027 -18.815 -11.438 354 HE3 LYS 60 HE3 LYS 60 16.657 -18.315 -13.077 355 HZ1 LYS 60 HZ1 LYS 60 17.455 -16.153 -11.408 356 HZ2 LYS 60 HZ2 LYS 60 18.611 -17.298 -11.550 357 HZ3 LYS 60 HZ3 LYS 60 18.002 -16.583 -12.886 358 H ASP 61 H ASP 61 10.266 -15.940 -10.578 359 HA ASP 61 HA ASP 61 10.598 -14.181 -8.362 360 HB2 ASP 61 HB2 ASP 61 8.505 -14.219 -9.697 361 HB3 ASP 61 HB3 ASP 61 8.249 -15.903 -9.284 362 HD2 ASP 61 HD2 ASP 61 8.925 -13.091 -7.166 363 H ASN 62 H ASN 62 10.428 -14.829 -6.105 364 HA ASN 62 HA ASN 62 11.671 -17.065 -5.350 365 HB2 ASN 62 HB2 ASN 62 9.421 -15.561 -3.920 366 HB3 ASN 62 HB3 ASN 62 10.390 -16.786 -3.126 367 HD21 ASN 62 HD21 ASN 62 10.098 -13.895 -2.654 368 HD22 ASN 62 HD22 ASN 62 11.689 -13.213 -2.704 369 H SER 63 H SER 63 8.201 -16.585 -6.137 370 HA SER 63 HA SER 63 7.523 -19.219 -5.245 371 HB2 SER 63 HB2 SER 63 5.977 -16.962 -6.569 372 HB3 SER 63 HB3 SER 63 5.256 -18.542 -6.333 373 HG SER 63 HG SER 63 6.513 -17.538 -4.035 374 H CYS 64 H CYS 64 5.935 -20.415 -7.026 375 HA CYS 64 HA CYS 64 7.615 -21.462 -8.914 376 HB2 CYS 64 HB2 CYS 64 5.261 -22.233 -8.002 377 HB3 CYS 64 HB3 CYS 64 4.653 -21.403 -9.420 378 HG CYS 64 HG CYS 64 5.025 -23.189 -10.917 379 H ASN 65 H ASN 65 7.320 -21.321 -11.386 380 HA ASN 65 HA ASN 65 7.072 -18.510 -12.049 381 HB2 ASN 65 HB2 ASN 65 9.201 -19.742 -12.640 382 HB3 ASN 65 HB3 ASN 65 8.273 -20.827 -13.656 383 HD21 ASN 65 HD21 ASN 65 9.299 -20.272 -15.527 384 HD22 ASN 65 HD22 ASN 65 9.105 -18.750 -16.330 385 H LEU 66 H LEU 66 5.580 -21.656 -12.361 386 HA LEU 66 HA LEU 66 4.325 -21.358 -14.848 387 HB2 LEU 66 HB2 LEU 66 4.596 -23.497 -13.785 388 HB3 LEU 66 HB3 LEU 66 3.639 -22.993 -12.406 389 HG LEU 66 HG LEU 66 2.454 -23.061 -15.179 390 HD11 LEU 66 HD11 LEU 66 1.797 -25.312 -14.956 391 HD12 LEU 66 HD12 LEU 66 3.531 -25.279 -14.551 392 HD13 LEU 66 HD13 LEU 66 2.316 -25.385 -13.255 393 HD21 LEU 66 HD21 LEU 66 0.429 -23.670 -13.572 394 HD22 LEU 66 HD22 LEU 66 1.434 -22.801 -12.388 395 HD23 LEU 66 HD23 LEU 66 0.918 -21.987 -13.884 396 H PHE 67 H PHE 67 3.226 -20.641 -11.469 397 HA PHE 67 HA PHE 67 0.692 -19.813 -12.031 398 HB2 PHE 67 HB2 PHE 67 1.738 -20.042 -9.766 399 HB3 PHE 67 HB3 PHE 67 2.838 -18.724 -10.115 400 HD1 PHE 67 HD1 PHE 67 -0.714 -18.611 -11.058 401 HD2 PHE 67 HD2 PHE 67 2.196 -17.410 -8.213 402 HE1 PHE 67 HE1 PHE 67 -2.350 -16.983 -10.072 403 HE2 PHE 67 HE2 PHE 67 0.560 -15.782 -7.226 404 HZ PHE 67 HZ PHE 67 -1.694 -15.588 -8.168 405 H ASN 68 H ASN 68 3.725 -17.817 -12.060 406 HA ASN 68 HA ASN 68 2.311 -15.519 -12.878 407 HB2 ASN 68 HB2 ASN 68 4.640 -15.743 -11.654 408 HB3 ASN 68 HB3 ASN 68 5.302 -15.968 -13.261 409 HD21 ASN 68 HD21 ASN 68 6.246 -14.182 -13.876 410 HD22 ASN 68 HD22 ASN 68 5.621 -12.571 -13.765 411 H THR 69 H THR 69 1.975 -14.770 -15.018 412 HA THR 69 HA THR 69 3.148 -16.425 -17.157 413 HB THR 69 HB THR 69 0.454 -14.982 -17.207 414 HG1 THR 69 HG1 THR 69 0.645 -16.649 -15.494 415 HG21 THR 69 HG21 THR 69 1.097 -15.663 -19.435 416 HG22 THR 69 HG22 THR 69 1.789 -17.191 -18.840 417 HG23 THR 69 HG23 THR 69 0.025 -16.953 -18.840 418 H LEU 70 H LEU 70 3.801 -15.386 -19.089 419 HA LEU 70 HA LEU 70 4.963 -12.864 -18.626 420 HB2 LEU 70 HB2 LEU 70 5.598 -14.861 -20.200 421 HB3 LEU 70 HB3 LEU 70 4.580 -14.027 -21.357 422 HG LEU 70 HG LEU 70 6.738 -13.284 -21.840 423 HD11 LEU 70 HD11 LEU 70 5.574 -11.172 -20.004 424 HD12 LEU 70 HD12 LEU 70 6.775 -10.907 -21.290 425 HD13 LEU 70 HD13 LEU 70 5.129 -11.442 -21.706 426 HD21 LEU 70 HD21 LEU 70 7.513 -12.345 -19.140 427 HD22 LEU 70 HD22 LEU 70 7.453 -14.109 -19.372 428 HD23 LEU 70 HD23 LEU 70 8.484 -13.108 -20.422 429 H THR 71 H THR 71 1.992 -13.984 -20.311 430 HA THR 71 HA THR 71 1.338 -11.568 -21.535 431 HB THR 71 HB THR 71 -0.342 -13.892 -20.461 432 HG1 THR 71 HG1 THR 71 1.406 -14.063 -22.210 433 HG21 THR 71 HG21 THR 71 -1.028 -11.587 -22.354 434 HG22 THR 71 HG22 THR 71 -1.944 -13.112 -22.305 435 HG23 THR 71 HG23 THR 71 -1.899 -12.056 -20.874 436 H GLU 72 H GLU 72 0.636 -12.783 -18.216 437 HA GLU 72 HA GLU 72 -1.047 -10.726 -17.511 438 HB2 GLU 72 HB2 GLU 72 0.766 -12.591 -15.969 439 HB3 GLU 72 HB3 GLU 72 -0.071 -11.310 -15.115 440 HG2 GLU 72 HG2 GLU 72 -1.370 -13.480 -16.827 441 HG3 GLU 72 HG3 GLU 72 -1.420 -13.375 -15.078 442 HE2 GLU 72 HE2 GLU 72 -2.548 -11.828 -14.200 443 H ALA 73 H ALA 73 2.547 -11.039 -17.139 444 HA ALA 73 HA ALA 73 2.945 -8.611 -15.847 445 HB1 ALA 73 HB1 ALA 73 5.280 -8.921 -17.070 446 HB2 ALA 73 HB2 ALA 73 4.771 -10.041 -15.784 447 HB3 ALA 73 HB3 ALA 73 4.599 -10.510 -17.492 448 H ARG 74 H ARG 74 3.063 -9.458 -19.375 449 HA ARG 74 HA ARG 74 3.731 -6.979 -20.271 450 HB2 ARG 74 HB2 ARG 74 3.347 -9.304 -21.506 451 HB3 ARG 74 HB3 ARG 74 1.730 -8.689 -21.786 452 HG2 ARG 74 HG2 ARG 74 4.042 -6.862 -22.418 453 HG3 ARG 74 HG3 ARG 74 3.757 -8.210 -23.501 454 HD2 ARG 74 HD2 ARG 74 1.599 -6.202 -22.689 455 HD3 ARG 74 HD3 ARG 74 2.550 -6.070 -24.156 456 HE ARG 74 HE ARG 74 1.431 -8.694 -24.075 457 HH11 ARG 74 HH22 ARG 74 0.386 -5.353 -24.433 458 HH12 ARG 74 HH21 ARG 74 -1.012 -5.757 -25.372 459 HH21 ARG 74 HH12 ARG 74 -0.414 -9.228 -25.314 460 HH22 ARG 74 HH11 ARG 74 -1.471 -7.976 -25.876 461 H ASP 75 H ASP 75 0.589 -8.286 -19.192 462 HA ASP 75 HA ASP 75 -0.925 -6.175 -20.281 463 HB2 ASP 75 HB2 ASP 75 -2.055 -8.247 -19.825 464 HB3 ASP 75 HB3 ASP 75 -1.431 -8.321 -18.189 465 HD2 ASP 75 HD2 ASP 75 -3.640 -6.495 -20.164 466 H ALA 76 H ALA 76 0.858 -6.846 -17.271 467 HA ALA 76 HA ALA 76 -0.388 -4.912 -15.649 468 HB1 ALA 76 HB1 ALA 76 1.323 -6.965 -15.233 469 HB2 ALA 76 HB2 ALA 76 2.482 -5.614 -15.222 470 HB3 ALA 76 HB3 ALA 76 1.118 -5.626 -14.078 471 H ILE 77 H ILE 77 2.567 -4.885 -17.741 472 HA ILE 77 HA ILE 77 3.057 -2.127 -17.144 473 HB ILE 77 HB ILE 77 4.282 -3.818 -19.318 474 HG12 ILE 77 HG12 ILE 77 5.315 -3.578 -16.485 475 HG13 ILE 77 HG13 ILE 77 4.295 -4.903 -17.008 476 HG21 ILE 77 HG21 ILE 77 4.770 -1.457 -19.514 477 HG22 ILE 77 HG22 ILE 77 5.257 -1.381 -17.803 478 HG23 ILE 77 HG23 ILE 77 6.221 -2.328 -18.962 479 HD11 ILE 77 HD11 ILE 77 6.684 -4.245 -18.716 480 HD12 ILE 77 HD12 ILE 77 6.970 -5.051 -17.155 481 HD13 ILE 77 HD13 ILE 77 5.933 -5.823 -18.378 482 H LYS 78 H LYS 78 1.416 -4.050 -19.662 483 HA LYS 78 HA LYS 78 1.184 -1.907 -21.496 484 HB2 LYS 78 HB2 LYS 78 1.083 -4.219 -22.223 485 HB3 LYS 78 HB3 LYS 78 -0.320 -4.524 -21.218 486 HG2 LYS 78 HG2 LYS 78 -1.402 -4.092 -23.224 487 HG3 LYS 78 HG3 LYS 78 -1.346 -2.460 -22.588 488 HD2 LYS 78 HD2 LYS 78 1.067 -3.325 -24.135 489 HD3 LYS 78 HD3 LYS 78 -0.408 -3.160 -25.067 490 HE2 LYS 78 HE2 LYS 78 0.411 -0.957 -23.148 491 HE3 LYS 78 HE3 LYS 78 1.168 -1.060 -24.725 492 HZ1 LYS 78 HZ1 LYS 78 -1.730 -1.200 -24.569 493 HZ2 LYS 78 HZ2 LYS 78 -1.009 0.256 -24.399 494 HZ3 LYS 78 HZ3 LYS 78 -0.785 -0.611 -25.765 495 H ASP 79 H ASP 79 -0.615 -2.991 -18.635 496 HA ASP 79 HA ASP 79 -2.918 -1.494 -19.252 497 HB2 ASP 79 HB2 ASP 79 -3.267 -3.262 -17.722 498 HB3 ASP 79 HB3 ASP 79 -1.813 -2.899 -16.815 499 HD2 ASP 79 HD2 ASP 79 -5.010 -0.588 -16.510 500 H ALA 80 H ALA 80 -0.077 -1.111 -17.010 501 HA ALA 80 HA ALA 80 -0.826 1.348 -15.941 502 HB1 ALA 80 HB1 ALA 80 1.334 1.358 -15.008 503 HB2 ALA 80 HB2 ALA 80 1.001 -0.375 -15.247 504 HB3 ALA 80 HB3 ALA 80 2.041 0.499 -16.397 505 H TYR 81 H TYR 81 1.289 0.514 -18.766 506 HA TYR 81 HA TYR 81 1.935 3.140 -19.434 507 HB2 TYR 81 HB2 TYR 81 1.640 0.434 -20.833 508 HB3 TYR 81 HB3 TYR 81 2.070 1.836 -21.792 509 HD1 TYR 81 HD2 TYR 81 3.175 0.898 -18.337 510 HD2 TYR 81 HD1 TYR 81 4.296 1.493 -22.423 511 HE1 TYR 81 HE2 TYR 81 5.620 0.575 -17.721 512 HE2 TYR 81 HE1 TYR 81 6.737 1.169 -21.793 513 HH TYR 81 HH TYR 81 7.706 0.872 -18.427 514 H GLU 82 H GLU 82 -0.816 1.023 -20.434 515 HA GLU 82 HA GLU 82 -1.785 2.911 -22.281 516 HB2 GLU 82 HB2 GLU 82 -2.297 0.521 -22.499 517 HB3 GLU 82 HB3 GLU 82 -3.107 0.510 -20.945 518 HG2 GLU 82 HG2 GLU 82 -4.697 2.306 -21.913 519 HG3 GLU 82 HG3 GLU 82 -3.991 1.956 -23.478 520 HE2 GLU 82 HE2 GLU 82 -6.958 0.798 -22.640 521 H SER 83 H SER 83 -2.021 2.496 -18.805 522 HA SER 83 HA SER 83 -4.429 3.996 -18.582 523 HB2 SER 83 HB2 SER 83 -2.384 3.018 -16.547 524 HB3 SER 83 HB3 SER 83 -3.803 3.940 -16.091 525 HG SER 83 HG SER 83 -4.479 1.838 -17.767 526 H TYR 84 H TYR 84 -0.896 4.547 -18.375 527 HA TYR 84 HA TYR 84 -1.391 7.354 -17.698 528 HB2 TYR 84 HB2 TYR 84 0.957 5.379 -17.682 529 HB3 TYR 84 HB3 TYR 84 1.263 7.098 -17.540 530 HD1 TYR 84 HD2 TYR 84 0.031 8.355 -15.609 531 HD2 TYR 84 HD1 TYR 84 0.501 4.105 -15.767 532 HE1 TYR 84 HE2 TYR 84 -0.364 8.211 -13.102 533 HE2 TYR 84 HE1 TYR 84 0.105 3.976 -13.259 534 HH TYR 84 HH TYR 84 -0.475 6.933 -11.371 535 H CYS 85 H CYS 85 -1.314 5.516 -20.430 536 HA CYS 85 HA CYS 85 0.618 6.886 -21.966 537 HB2 CYS 85 HB2 CYS 85 0.157 4.865 -22.931 538 HB3 CYS 85 HB3 CYS 85 -1.536 4.894 -22.482 539 HG CYS 85 HG CYS 85 -0.368 5.291 -25.208 540 H GLY 86 H GLY 86 0.309 8.653 -23.424 541 HA2 GLY 86 HA2 GLY 86 -1.155 10.109 -24.619 542 HA3 GLY 86 HA3 GLY 86 -2.343 9.947 -23.340 543 H ILE 87 H ILE 87 0.488 10.022 -21.639 544 HA ILE 87 HA ILE 87 0.590 12.955 -21.613 545 HB ILE 87 HB ILE 87 1.017 12.621 -19.094 546 HG12 ILE 87 HG12 ILE 87 -0.576 10.095 -19.608 547 HG13 ILE 87 HG13 ILE 87 1.148 10.113 -19.291 548 HG21 ILE 87 HG21 ILE 87 -1.020 13.497 -18.817 549 HG22 ILE 87 HG22 ILE 87 -1.179 13.342 -20.583 550 HG23 ILE 87 HG23 ILE 87 -1.833 12.076 -19.515 551 HD11 ILE 87 HD11 ILE 87 -0.685 11.579 -17.387 552 HD12 ILE 87 HD12 ILE 87 -0.575 9.804 -17.296 553 HD13 ILE 87 HD13 ILE 87 0.883 10.799 -17.066 554 H ASP 88 H ASP 88 2.528 13.389 -22.557 555 HA ASP 88 HA ASP 88 4.773 11.825 -21.546 556 HB2 ASP 88 HB2 ASP 88 5.846 12.020 -23.691 557 HB3 ASP 88 HB3 ASP 88 4.202 11.504 -24.007 558 HD2 ASP 88 HD2 ASP 88 3.332 14.534 -25.537 559 H ASP 89 H ASP 89 3.171 14.747 -21.398 560 HA ASP 89 HA ASP 89 5.677 16.190 -21.034 561 HB2 ASP 89 HB2 ASP 89 3.022 17.193 -22.156 562 HB3 ASP 89 HB3 ASP 89 4.301 18.274 -21.641 563 HD2 ASP 89 HD2 ASP 89 5.882 18.684 -23.292 564 H CYS 90 H CYS 90 5.758 17.460 -19.090 565 HA CYS 90 HA CYS 90 3.459 17.068 -17.329 566 HB2 CYS 90 HB2 CYS 90 5.668 16.120 -16.607 567 HB3 CYS 90 HB3 CYS 90 6.313 17.749 -16.554 568 HA PRO 91 HA PRO 91 3.050 21.416 -18.086 569 HB2 PRO 91 HB2 PRO 91 0.485 21.662 -17.176 570 HB3 PRO 91 HB3 PRO 91 0.879 21.226 -18.827 571 HG2 PRO 91 HG2 PRO 91 -0.117 19.502 -16.642 572 HG3 PRO 91 HG3 PRO 91 -0.122 19.199 -18.368 573 HD2 PRO 91 HD2 PRO 91 1.671 18.072 -16.434 574 HD3 PRO 91 HD3 PRO 91 1.737 17.861 -18.172 575 H GLN 92 H GLN 92 2.361 19.759 -15.107 576 HA GLN 92 HA GLN 92 2.252 22.047 -13.540 577 HB2 GLN 92 HB2 GLN 92 1.449 19.823 -12.802 578 HB3 GLN 92 HB3 GLN 92 3.090 19.206 -12.807 579 HG2 GLN 92 HG2 GLN 92 2.415 19.829 -10.513 580 HG3 GLN 92 HG3 GLN 92 3.739 20.842 -11.053 581 HE21 GLN 92 HE21 GLN 92 3.546 22.940 -10.850 582 HE22 GLN 92 HE22 GLN 92 2.083 23.839 -10.623 583 H CYS 93 H CYS 93 4.974 19.915 -14.560 584 HA CYS 93 HA CYS 93 6.895 21.120 -12.924 585 HB2 CYS 93 HB2 CYS 93 6.910 19.273 -15.260 586 HB3 CYS 93 HB3 CYS 93 8.392 20.160 -14.963 587 H SER 94 H SER 94 5.455 21.874 -16.102 588 HA SER 94 HA SER 94 7.435 23.881 -16.621 589 HB2 SER 94 HB2 SER 94 4.940 22.955 -18.096 590 HB3 SER 94 HB3 SER 94 5.883 24.329 -18.639 591 HG SER 94 HG SER 94 7.579 22.240 -18.133 592 H LYS 95 H LYS 95 4.529 23.576 -14.823 593 HA LYS 95 HA LYS 95 3.771 26.358 -15.206 594 HB2 LYS 95 HB2 LYS 95 1.796 25.275 -15.108 595 HB3 LYS 95 HB3 LYS 95 2.459 23.896 -14.255 596 HG2 LYS 95 HG2 LYS 95 2.539 25.287 -12.144 597 HG3 LYS 95 HG3 LYS 95 1.780 26.605 -13.015 598 HD2 LYS 95 HD2 LYS 95 0.487 23.857 -12.962 599 HD3 LYS 95 HD3 LYS 95 0.271 24.962 -11.619 600 HE2 LYS 95 HE2 LYS 95 -0.358 26.704 -13.543 601 HE3 LYS 95 HE3 LYS 95 -0.661 25.257 -14.483 602 HZ1 LYS 95 HZ1 LYS 95 -2.125 24.513 -12.700 603 HZ2 LYS 95 HZ2 LYS 95 -1.886 25.913 -11.894 604 HZ3 LYS 95 HZ3 LYS 95 -2.629 25.924 -13.349 605 H TYR 96 H TYR 96 5.675 24.300 -13.130 606 HA TYR 96 HA TYR 96 5.450 25.749 -10.740 607 HB2 TYR 96 HB2 TYR 96 7.095 24.169 -10.134 608 HB3 TYR 96 HB3 TYR 96 6.607 23.426 -11.644 609 HD1 TYR 96 HD1 TYR 96 7.884 25.290 -13.614 610 HD2 TYR 96 HD2 TYR 96 9.374 23.626 -9.965 611 HE1 TYR 96 HE1 TYR 96 10.265 25.501 -14.481 612 HE2 TYR 96 HE2 TYR 96 11.750 23.843 -10.845 613 HH TYR 96 HH TYR 96 13.012 24.776 -12.400 614 H ILE 97 H ILE 97 7.788 26.632 -9.821 615 HA ILE 97 HA ILE 97 8.341 28.890 -11.584 616 HB ILE 97 HB ILE 97 8.432 28.399 -8.649 617 HG12 ILE 97 HG12 ILE 97 6.477 29.462 -9.640 618 HG13 ILE 97 HG13 ILE 97 7.324 30.575 -8.584 619 HG21 ILE 97 HG21 ILE 97 9.842 30.336 -8.253 620 HG22 ILE 97 HG22 ILE 97 10.728 29.106 -9.186 621 HG23 ILE 97 HG23 ILE 97 10.083 30.550 -10.004 622 HD11 ILE 97 HD11 ILE 97 6.718 30.872 -11.392 623 HD12 ILE 97 HD12 ILE 97 7.484 32.045 -10.294 624 HD13 ILE 97 HD13 ILE 97 8.486 30.875 -11.185 625 H ASP 98 H ASP 98 10.650 29.666 -11.701 626 HA ASP 98 HA ASP 98 12.294 27.337 -12.141 627 HB2 ASP 98 HB2 ASP 98 13.754 28.897 -13.397 628 HB3 ASP 98 HB3 ASP 98 12.098 28.992 -13.962 629 HD2 ASP 98 HD2 ASP 98 11.650 32.202 -12.520 630 H ASP 99 H ASP 99 13.348 26.762 -10.203 631 HA ASP 99 HA ASP 99 14.278 28.899 -8.507 632 HB2 ASP 99 HB2 ASP 99 13.112 26.939 -7.509 633 HB3 ASP 99 HB3 ASP 99 14.320 25.862 -8.180 634 HD2 ASP 99 HD2 ASP 99 15.321 28.419 -5.301
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